#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 2.83 0.13 1.61 0.52 -1.26 -4.96 118.95 117.82 2f1d s ARG 11 Ca 0.00 1.17 0.10 0.00 -0.52 0.00 0.00 55.73 56.48 2f1d s ARG 11 Cb 0.00 -4.35 -0.04 0.00 0.52 0.00 0.00 34.95 31.08 2f1d s ARG 11 CO 0.00 -2.46 -0.24 0.42 0.02 0.00 0.00 175.30 173.04 2f1d s ILE 12 N 8.79 2.05 -0.07 1.52 1.01 -1.26 -1.90 121.20 131.35 2f1d s ILE 12 Ca 0.80 -1.75 -0.01 0.00 0.00 0.00 0.00 60.65 59.69 2f1d s ILE 12 Cb -0.19 -1.86 0.03 0.00 0.01 0.00 0.00 42.46 40.45 2f1d s ILE 12 CO 0.28 -0.03 0.00 -0.83 0.00 0.00 0.00 174.94 174.35 2f1d s GLY 13 N -2.17 0.46 -0.19 6.18 0.00 -0.85 -3.76 107.32 106.99 2f1d s GLY 13 Ca 0.13 -0.11 -0.05 0.00 0.00 0.00 0.00 44.72 44.69 2f1d s GLY 13 CO 0.06 1.10 0.00 1.85 0.00 0.00 0.00 173.10 176.11 2f1d s GLU 14 N 1.90 3.67 -0.05 2.90 2.12 -1.26 -1.98 118.70 126.00 2f1d s GLU 14 Ca 0.04 -0.50 0.03 0.00 0.36 0.00 0.00 54.97 54.90 2f1d s GLU 14 Cb -0.12 -3.08 0.01 0.00 0.26 0.00 0.00 34.13 31.19 2f1d s GLU 14 CO -0.05 0.07 -0.13 0.08 -0.54 0.00 0.00 175.26 174.70 2f1d s VAL 15 N 0.84 1.15 -0.06 3.70 1.01 -0.48 -4.90 120.40 121.67 2f1d s VAL 15 Ca 0.01 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.49 2f1d s VAL 15 Cb -0.14 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 2f1d s VAL 15 CO 0.02 0.35 -0.14 -1.59 0.00 0.00 0.00 175.10 173.73 2f1d s LYS 16 N 0.34 2.57 -0.09 2.72 -2.85 -1.26 -1.72 119.74 119.44 2f1d s LYS 16 Ca -0.08 -0.70 -0.03 0.00 -1.00 0.00 0.00 55.97 54.17 2f1d s LYS 16 Cb -0.13 -2.39 0.04 0.00 -2.06 0.00 0.00 37.83 33.29 2f1d s LYS 16 CO 0.02 0.59 0.05 0.50 0.10 0.00 0.00 175.35 176.61 2f1d s ARG 17 N -0.65 0.22 -0.11 1.78 3.52 -0.92 -5.03 118.95 117.77 2f1d s ARG 17 Ca 0.10 0.12 0.03 0.00 -0.13 0.00 0.00 55.73 55.85 2f1d s ARG 17 Cb -0.11 -1.08 0.00 0.00 -1.56 0.00 0.00 34.95 32.20 2f1d s ARG 17 CO 0.01 -0.43 -0.23 0.08 -0.81 0.00 0.00 175.30 173.93 2f1d s VAL 18 N 2.07 1.98 0.20 7.11 1.01 -1.26 -1.73 120.40 129.78 2f1d s VAL 18 Ca 0.04 -0.96 0.01 0.00 0.00 0.00 0.00 61.98 61.07 2f1d s VAL 18 Cb -0.13 -1.73 -0.05 0.00 0.00 0.00 0.00 36.38 34.47 2f1d s VAL 18 CO -0.05 0.54 0.03 0.42 0.00 0.00 0.00 175.10 176.04 2f1d s THR 19 N 0.49 0.61 0.65 3.92 -4.23 -1.15 -5.04 115.64 110.88 2f1d s THR 19 Ca -0.16 -1.98 0.32 0.00 -1.18 0.00 0.00 61.69 58.69 2f1d s THR 19 Cb -0.17 -2.27 0.34 0.00 1.34 0.00 0.00 72.50 71.74 2f1d s THR 19 CO 0.06 -0.33 2.00 0.07 -0.54 0.00 0.00 174.62 175.88 2f1d h LYS 20 N 2.61 0.00 0.00 3.99 -0.00 -2.04 -3.10 116.57 118.04 2f1d h LYS 20 Ca -0.37 0.00 -0.36 0.00 -0.00 0.00 0.00 60.65 59.92 2f1d h LYS 20 Cb 1.22 0.00 -0.06 0.00 -0.00 0.00 0.00 32.23 33.38 2f1d h LYS 20 CO 0.62 0.00 -2.36 0.39 -0.00 0.00 0.00 179.45 178.10 2f1d n GLU 21 N -3.09 0.59 -4.41 0.07 1.02 -1.26 -5.05 120.64 108.51 2f1d n GLU 21 Ca -0.01 0.14 -0.20 0.00 -0.02 0.00 0.00 57.16 57.07 2f1d n GLU 21 Cb 0.36 -1.47 -0.10 0.00 -0.02 0.00 0.00 31.44 30.20 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 -2.48 0.88 -0.23 2.62 -4.23 -1.17 -3.30 115.64 107.73 2f1d s THR 22 Ca -0.32 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 58.16 2f1d s THR 22 Cb 0.09 -2.67 0.11 0.00 1.34 0.00 0.00 72.50 71.36 2f1d s THR 22 CO 0.54 0.00 0.25 0.21 -0.54 0.00 0.00 174.62 175.08 2f1d s ASN 23 N -3.45 1.45 0.09 3.99 3.84 -0.57 -2.96 114.94 117.35 2f1d s ASN 23 Ca 0.35 -0.35 0.09 0.00 0.21 0.00 0.00 52.86 53.16 2f1d s ASN 23 Cb 0.07 0.43 -0.04 0.00 -0.55 0.00 0.00 41.25 41.17 2f1d s ASN 23 CO 0.15 -0.34 -0.21 -0.69 -2.79 0.00 0.00 177.10 173.22 2f1d s VAL 24 N 2.34 2.62 -0.21 -5.21 1.01 -0.71 -2.23 120.40 118.01 2f1d s VAL 24 Ca 0.08 -1.48 -0.04 0.00 0.00 0.00 0.00 61.98 60.54 2f1d s VAL 24 Cb -0.15 -2.15 0.11 0.00 0.00 0.00 0.00 36.38 34.18 2f1d s VAL 24 CO -0.18 0.18 0.35 -0.55 0.00 0.00 0.00 175.10 174.90 2f1d s SER 25 N -1.86 0.29 -0.08 3.32 0.15 -0.12 -2.16 113.70 113.24 2f1d s SER 25 Ca 0.16 0.38 0.03 0.00 0.70 0.00 0.00 55.95 57.22 2f1d s SER 25 Cb -0.10 1.02 0.01 0.00 -1.71 0.00 0.00 66.02 65.24 2f1d s SER 25 CO 0.07 -0.28 -0.16 -0.69 1.20 0.00 0.00 173.24 173.38 2f1d s VAL 26 N 2.52 1.48 -0.07 4.45 1.01 -0.70 -1.38 120.40 127.70 2f1d s VAL 26 Ca 0.07 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.41 2f1d s VAL 26 Cb -0.14 -1.32 0.01 0.00 0.00 0.00 0.00 36.38 34.93 2f1d s VAL 26 CO -0.14 0.43 -0.17 -0.54 0.00 0.00 0.00 175.10 174.69 2f1d s LYS 27 N 0.58 2.13 -0.04 2.72 1.02 -0.81 -1.38 119.74 123.96 2f1d s LYS 27 Ca -0.16 -0.59 0.01 0.00 0.02 0.00 0.00 55.97 55.26 2f1d s LYS 27 Cb -0.17 -1.71 0.02 0.00 -0.52 0.00 0.00 37.83 35.45 2f1d s LYS 27 CO 0.05 0.11 -0.06 0.42 -0.92 0.00 0.00 175.35 174.95 2f1d s ILE 28 N 0.46 0.62 -0.37 2.17 1.01 -0.84 -1.71 121.20 122.54 2f1d s ILE 28 Ca -0.14 -0.19 -0.07 0.00 0.00 0.00 0.00 60.65 60.25 2f1d s ILE 28 Cb -0.16 -0.61 0.06 0.00 0.01 0.00 0.00 42.46 41.76 2f1d s ILE 28 CO 0.05 0.23 0.16 0.21 0.00 0.00 0.00 174.94 175.59 2f1d s ASN 29 N 0.72 5.40 0.32 3.58 3.84 -0.81 -2.01 114.94 125.99 2f1d s ASN 29 Ca -0.10 -1.33 0.04 0.00 0.21 0.00 0.00 52.86 51.67 2f1d s ASN 29 Cb -0.13 -1.90 0.64 0.00 -0.55 0.00 0.00 41.25 39.31 2f1d s ASN 29 CO 0.01 -0.41 1.89 -0.07 -2.79 0.00 0.00 177.10 175.73 2f1d h LEU 30 N 8.26 0.81 -5.08 3.21 3.38 -1.71 -2.62 115.31 121.56 2f1d h LEU 30 Ca -0.22 0.02 -0.74 0.00 0.09 0.00 0.00 57.88 57.03 2f1d h LEU 30 Cb 1.08 -0.15 -0.30 0.00 0.09 0.00 0.00 40.66 41.38 2f1d h LEU 30 CO 0.66 0.48 0.72 0.47 0.09 0.00 0.00 178.44 180.86 2f1d n ASP 31 N -4.53 6.96 -0.65 -0.43 8.00 -1.26 -4.68 116.55 119.96 2f1d n ASP 31 Ca 0.15 -3.80 0.00 0.00 0.71 0.00 0.00 54.79 51.85 2f1d n ASP 31 Cb 0.30 -0.97 0.00 0.00 -0.02 0.00 0.00 41.12 40.43 2f1d n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2f1d n GLY 32 N -0.46 1.72 0.00 0.44 0.00 -1.13 -4.60 105.19 101.16 2f1d n GLY 32 Ca 0.50 -2.03 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 -1.30 0.00 0.00 0.00 173.32 172.02 2f1d n THR 33 N -0.27 0.02 0.00 2.61 -2.24 -1.26 -4.73 114.28 108.42 2f1d n THR 33 Ca 0.00 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 2f1d n THR 33 Cb 0.00 1.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.27 2f1d n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2f1d n GLY 34 N -0.01 1.81 3.61 3.38 0.00 -1.16 -4.92 105.19 107.89 2f1d n GLY 34 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.00 4.14 -0.29 1.61 1.01 -1.19 -4.26 120.40 119.42 2f1d s VAL 35 Ca 0.00 1.21 -0.25 0.00 0.00 0.00 0.00 61.98 62.94 2f1d s VAL 35 Cb 0.00 -4.39 0.00 0.00 0.00 0.00 0.00 36.38 31.99 2f1d s VAL 35 CO 0.00 -0.79 0.85 0.00 0.00 0.00 0.00 175.10 175.16 2f1d s ALA 36 N 4.63 3.56 -0.38 5.51 0.00 -1.26 -1.18 121.76 132.64 2f1d s ALA 36 Ca 0.53 -0.28 0.11 0.00 0.00 0.00 0.00 51.96 52.32 2f1d s ALA 36 Cb -0.11 -3.35 0.34 0.00 0.00 0.00 0.00 23.12 20.00 2f1d s ALA 36 CO 0.29 -1.16 0.79 -3.47 0.00 0.00 0.00 175.76 172.21 2f1d n ASP 37 N 6.24 0.32 -4.23 0.00 4.64 -0.02 -5.01 116.55 118.50 2f1d n ASP 37 Ca 0.06 -3.12 -0.31 0.00 -1.38 0.00 0.00 54.79 50.03 2f1d n ASP 37 Cb 0.48 -0.21 -0.17 0.00 -1.04 0.00 0.00 41.12 40.18 2f1d n ASP 37 CO 0.00 0.00 0.00 -0.44 -0.82 0.00 0.00 177.20 175.94 2f1d s SER 38 N -2.24 2.98 -0.20 1.67 0.01 -1.26 -1.43 113.70 113.24 2f1d s SER 38 Ca 0.37 -0.52 -0.05 0.00 1.31 0.00 0.00 55.95 57.06 2f1d s SER 38 Cb 0.34 -1.12 0.07 0.00 0.21 0.00 0.00 66.02 65.52 2f1d s SER 38 CO -0.08 0.19 0.10 -0.55 0.41 0.00 0.00 173.24 173.32 2f1d s SER 39 N 0.14 2.57 -0.03 2.44 0.15 -0.94 -4.90 113.70 113.13 2f1d s SER 39 Ca -0.12 -0.75 0.12 0.00 0.70 0.00 0.00 55.95 55.90 2f1d s SER 39 Cb -0.16 -0.24 -0.18 0.00 -1.71 0.00 0.00 66.02 63.73 2f1d s SER 39 CO 0.06 -0.37 0.23 -1.54 1.20 0.00 0.00 173.24 172.83 2f1d n SER 40 N 5.27 2.32 0.00 5.45 3.41 -1.26 -2.19 113.62 126.63 2f1d n SER 40 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 2f1d n SER 40 Cb 0.47 1.45 0.00 0.00 -0.26 0.00 0.00 64.21 65.88 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 1.89 0.84 3.07 5.00 0.00 -1.26 -4.42 105.19 110.30 2f1d n GLY 41 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.41 3.44 0.25 -0.61 1.01 -1.26 -5.00 121.20 116.61 2f1d s ILE 42 Ca 0.00 -2.98 -0.06 0.00 0.00 0.00 0.00 60.65 57.61 2f1d s ILE 42 Cb 0.00 -3.28 0.28 0.00 0.01 0.00 0.00 42.46 39.48 2f1d s ILE 42 CO 0.00 -0.85 1.63 -0.65 0.00 0.00 0.00 174.94 175.08 2f1d h PRO 43 N 6.98 0.10 -0.03 2.79 0.11 -1.99 -2.12 132.00 137.84 2f1d h PRO 43 Ca -0.03 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.97 2f1d h PRO 43 Cb 0.95 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.02 2f1d h PRO 43 CO 0.70 0.07 -0.46 0.35 -0.21 0.00 0.00 178.00 178.45 2f1d h PHE 44 N 0.11 0.09 -0.49 0.65 3.57 -1.94 -2.45 116.94 116.47 2f1d h PHE 44 Ca 0.42 -0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.78 2f1d h PHE 44 Cb 0.75 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.46 2f1d h PHE 44 CO -0.42 0.52 -0.14 1.25 -2.23 0.00 0.00 178.31 177.30 2f1d h LEU 45 N 0.06 0.97 -1.14 0.59 5.85 -1.84 -2.72 115.31 117.08 2f1d h LEU 45 Ca 0.00 -0.37 -0.00 0.00 0.84 0.00 0.00 57.88 58.35 2f1d h LEU 45 Cb 0.84 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 2f1d h LEU 45 CO 0.06 1.12 0.47 0.44 -0.34 0.00 0.00 178.44 180.19 2f1d h ASP 46 N 0.82 0.93 -0.62 1.25 3.32 -1.06 0.12 116.42 121.18 2f1d h ASP 46 Ca 0.12 -0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.08 2f1d h ASP 46 Cb 0.70 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.98 2f1d h ASP 46 CO 0.05 0.72 0.25 -0.74 -1.72 0.00 0.00 179.24 177.80 2f1d h HIS 47 N 1.08 0.98 -0.03 4.55 2.76 -1.30 0.11 115.15 123.30 2f1d h HIS 47 Ca 0.28 -0.06 -0.19 0.00 -2.20 0.00 0.00 60.37 58.19 2f1d h HIS 47 Cb -0.05 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 28.61 2f1d h HIS 47 CO 0.00 0.75 -0.82 0.52 -1.30 0.00 0.00 177.93 177.09 2f1d h MET 48 N 0.95 0.30 0.00 5.26 2.86 -1.05 -2.87 114.93 120.37 2f1d h MET 48 Ca 0.22 -0.29 -0.03 0.00 -2.06 0.00 0.00 59.70 57.54 2f1d h MET 48 Cb 0.20 0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 2f1d h MET 48 CO -0.02 0.97 -0.15 -0.07 1.06 0.00 0.00 176.91 178.70 2f1d h LEU 49 N 0.18 0.00 -0.55 1.22 3.38 -0.42 -1.85 115.31 117.28 2f1d h LEU 49 Ca -0.04 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 2f1d h LEU 49 Cb 1.42 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.17 2f1d h LEU 49 CO 0.13 0.15 -0.43 0.44 0.09 0.00 0.00 178.44 178.82 2f1d h ASP 50 N 0.00 0.74 1.59 -0.43 5.19 -0.74 -3.04 116.42 119.73 2f1d h ASP 50 Ca -0.00 -0.35 -0.06 0.00 -0.62 0.00 0.00 57.03 56.00 2f1d h ASP 50 Cb 1.00 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 40.30 2f1d h ASP 50 CO 0.02 1.07 -0.30 1.56 -3.12 0.00 0.00 179.24 178.47 2f1d h GLN 51 N 0.56 0.00 0.12 3.56 1.08 -1.27 -0.70 115.11 118.46 2f1d h GLN 51 Ca 0.04 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.23 2f1d h GLN 51 Cb 0.97 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.40 2f1d h GLN 51 CO 0.09 0.30 -0.06 1.25 -0.95 0.00 0.00 178.83 179.46 2f1d h LEU 52 N 0.00 -0.14 0.07 1.46 5.85 -1.34 -2.27 115.31 118.94 2f1d h LEU 52 Ca -0.00 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2f1d h LEU 52 Cb 1.18 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 2f1d h LEU 52 CO 0.04 -0.01 -0.07 0.00 -0.34 0.00 0.00 178.44 178.06 2f1d h ALA 53 N 0.62 -0.13 0.02 1.25 0.00 -1.40 -2.08 119.26 117.54 2f1d h ALA 53 Ca -0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2f1d h ALA 53 Cb 0.20 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2f1d h ALA 53 CO 0.03 -0.58 -0.01 1.03 0.00 0.00 0.00 179.25 179.71 2f1d h SER 54 N -0.15 -0.02 0.21 0.00 0.87 -1.15 -0.98 113.55 112.33 2f1d h SER 54 Ca 0.00 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 2f1d h SER 54 Cb 0.15 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 2f1d h SER 54 CO -0.02 0.06 -0.25 1.41 -0.53 0.00 0.00 176.83 177.51 2f1d n HIS 55 N -5.06 0.00 -0.05 2.24 8.25 -0.86 -3.75 115.22 115.99 2f1d n HIS 55 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 2f1d n HIS 55 Cb 0.08 -0.11 0.00 0.00 1.12 0.00 0.00 29.99 31.08 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 1.33 -0.51 4.16 -1.41 0.00 -0.78 -4.03 105.19 103.95 2f1d n GLY 56 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.10 -1.51 -4.95 0.99 4.77 -0.39 -4.74 117.00 111.07 2f1d n LEU 57 Ca 0.00 -1.16 -0.25 0.00 -0.03 0.00 0.00 56.01 54.57 2f1d n LEU 57 Cb 0.07 -1.87 -0.03 0.00 -2.33 0.00 0.00 43.42 39.26 2f1d n LEU 57 CO 0.00 0.46 -0.08 -0.36 -1.33 0.00 0.00 177.39 176.08 2f1d s PHE 58 N -4.19 3.48 -0.25 -1.77 2.99 -1.12 -2.84 117.98 114.27 2f1d s PHE 58 Ca 0.01 0.09 -0.16 0.00 0.00 0.00 0.00 56.93 56.87 2f1d s PHE 58 Cb -0.00 -1.65 -0.04 0.00 0.00 0.00 0.00 43.02 41.33 2f1d s PHE 58 CO 0.95 0.49 0.41 -0.51 -0.00 0.00 0.00 175.22 176.56 2f1d s ASP 59 N -3.41 6.34 -0.18 1.36 1.11 -0.99 -3.00 116.67 117.90 2f1d s ASP 59 Ca 0.34 0.40 -0.01 0.00 0.18 0.00 0.00 52.55 53.47 2f1d s ASP 59 Cb -0.11 -2.23 0.00 0.00 1.07 0.00 0.00 42.92 41.66 2f1d s ASP 59 CO 0.29 -0.17 -0.14 -0.69 1.18 0.00 0.00 175.17 175.63 2f1d s VAL 60 N 1.90 2.67 -0.27 -1.27 1.01 -0.33 -1.92 120.40 122.19 2f1d s VAL 60 Ca 0.17 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.43 2f1d s VAL 60 Cb -0.15 -2.15 0.07 0.00 0.00 0.00 0.00 36.38 34.14 2f1d s VAL 60 CO 0.09 0.50 -0.06 -2.28 0.00 0.00 0.00 175.10 173.35 2f1d s HIS 61 N 1.12 3.16 0.10 5.22 5.04 -0.69 -0.84 115.29 128.40 2f1d s HIS 61 Ca 0.01 -2.35 0.10 0.00 -1.54 0.00 0.00 55.06 51.27 2f1d s HIS 61 Cb -0.14 -2.07 -0.04 0.00 0.04 0.00 0.00 32.58 30.37 2f1d s HIS 61 CO -0.05 -0.87 -0.23 0.08 -2.34 0.00 0.00 174.74 171.33 2f1d s VAL 62 N 1.13 2.48 -0.23 0.89 1.01 -0.51 -1.92 120.40 123.25 2f1d s VAL 62 Ca -0.03 -1.56 -0.05 0.00 0.00 0.00 0.00 61.98 60.34 2f1d s VAL 62 Cb -0.19 -2.09 0.12 0.00 0.00 0.00 0.00 36.38 34.22 2f1d s VAL 62 CO -0.06 0.17 0.44 -0.60 0.00 0.00 0.00 175.10 175.04 2f1d s ARG 63 N -1.88 0.38 0.04 2.72 6.06 -0.48 -2.20 118.95 123.58 2f1d s ARG 63 Ca 0.15 0.88 0.02 0.00 -2.50 0.00 0.00 55.73 54.28 2f1d s ARG 63 Cb -0.10 0.10 -0.02 0.00 0.06 0.00 0.00 34.95 34.99 2f1d s ARG 63 CO 0.07 -0.43 -0.06 0.00 -2.50 0.00 0.00 175.30 172.37 2f1d s ALA 64 N 2.64 0.48 -0.02 6.12 0.00 -0.93 -0.94 121.76 129.12 2f1d s ALA 64 Ca 0.06 -0.76 0.01 0.00 0.00 0.00 0.00 51.96 51.26 2f1d s ALA 64 Cb -0.14 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.08 2f1d s ALA 64 CO -0.15 -0.07 -0.02 0.99 0.00 0.00 0.00 175.76 176.50 2f1d s THR 65 N -1.57 0.26 0.00 0.00 2.01 -0.95 -4.42 115.64 110.97 2f1d s THR 65 Ca -0.10 -0.05 0.00 0.00 0.31 0.00 0.00 61.69 61.85 2f1d s THR 65 Cb -0.09 -0.28 0.00 0.00 0.01 0.00 0.00 72.50 72.14 2f1d s THR 65 CO -0.00 0.12 0.00 0.61 -0.69 0.00 0.00 174.62 174.65 2f1d n GLY 66 N 3.56 2.05 0.43 4.40 0.00 -1.26 -1.51 105.19 112.85 2f1d n GLY 66 Ca -0.20 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 44.85 2f1d n GLY 66 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2f1d n ASP 67 N -0.84 0.13 -0.54 1.61 8.00 -1.21 -4.60 116.55 119.10 2f1d n ASP 67 Ca 0.00 -0.31 0.42 0.00 0.71 0.00 0.00 54.79 55.60 2f1d n ASP 67 Cb 0.00 -0.07 0.66 0.00 -0.02 0.00 0.00 41.12 41.69 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 0.28 -0.06 0.13 2.53 0.31 -1.24 0.28 118.33 120.55 2f1d n VAL 68 Ca 0.00 1.33 0.04 0.00 -0.01 0.00 0.00 64.34 65.70 2f1d n VAL 68 Cb 0.03 -2.21 0.44 0.00 -0.91 0.00 0.00 33.84 31.19 2f1d n VAL 68 CO 0.00 0.00 0.00 1.12 -1.32 0.00 0.00 176.83 176.63 2f1d h HIS 69 N 0.00 0.24 0.00 3.52 2.07 -2.01 -3.31 115.15 115.66 2f1d h HIS 69 Ca 0.78 -0.02 -0.00 0.00 -2.85 0.00 0.00 60.37 58.28 2f1d h HIS 69 Cb 2.95 -0.07 -0.00 0.00 2.57 0.00 0.00 27.41 32.86 2f1d h HIS 69 CO -0.00 0.29 -0.02 0.82 -3.07 0.00 0.00 177.93 175.95 2f1d h ILE 70 N 0.23 0.37 -2.92 6.12 2.04 -0.57 -3.50 117.51 119.27 2f1d h ILE 70 Ca 0.05 -1.28 0.06 0.00 1.00 0.00 0.00 64.86 64.69 2f1d h ILE 70 Cb 0.25 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 2f1d h ILE 70 CO 0.01 0.12 0.28 -0.62 0.00 0.00 0.00 178.15 177.94 2f1d s ASP 71 N -5.70 -0.18 0.00 1.72 -1.08 -1.22 -5.03 116.67 105.18 2f1d s ASP 71 Ca -0.04 -0.72 0.23 0.00 -0.52 0.00 0.00 52.55 51.49 2f1d s ASP 71 Cb -0.01 0.73 0.06 0.00 -1.46 0.00 0.00 42.92 42.25 2f1d s ASP 71 CO 0.15 -1.38 1.13 0.47 0.52 0.00 0.00 175.17 176.06 2f1d n ASP 72 N -0.72 1.87 -0.21 -0.34 8.00 -1.26 -3.72 116.55 120.18 2f1d n ASP 72 Ca -0.05 -1.42 0.12 0.00 0.71 0.00 0.00 54.79 54.15 2f1d n ASP 72 Cb 0.59 0.47 0.43 0.00 -0.02 0.00 0.00 41.12 42.59 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 2.18 0.66 0.18 1.24 2.76 -1.96 -1.23 115.15 118.99 2f1d h HIS 73 Ca 0.00 0.02 -0.30 0.00 -2.20 0.00 0.00 60.37 57.89 2f1d h HIS 73 Cb 0.72 -0.21 0.02 0.00 1.55 0.00 0.00 27.41 29.49 2f1d h HIS 73 CO 0.00 0.27 -1.34 0.45 -1.30 0.00 0.00 177.93 176.01 2f1d h HIS 74 N 0.58 0.70 0.02 5.26 3.86 -1.97 -2.46 115.15 121.15 2f1d h HIS 74 Ca 0.39 -0.51 -0.10 0.00 -1.16 0.00 0.00 60.37 58.99 2f1d h HIS 74 Cb 0.70 -0.03 0.01 0.00 1.06 0.00 0.00 27.41 29.15 2f1d h HIS 74 CO -0.00 1.40 -0.39 1.15 0.86 0.00 0.00 177.93 180.94 2f1d h THR 75 N 0.11 1.54 -0.66 2.45 2.02 -1.78 -1.42 112.91 115.16 2f1d h THR 75 Ca -0.18 -2.11 0.13 0.00 0.77 0.00 0.00 66.41 65.02 2f1d h THR 75 Cb 2.05 2.86 -0.12 0.00 -1.74 0.00 0.00 68.15 71.20 2f1d h THR 75 CO 0.23 0.59 -0.17 -1.13 0.37 0.00 0.00 175.52 175.41 2f1d h ASN 76 N -0.44 -0.63 -0.29 4.18 -0.73 -1.37 -1.30 115.58 115.01 2f1d h ASN 76 Ca -0.06 0.20 -0.09 0.00 1.87 0.00 0.00 56.30 58.22 2f1d h ASN 76 Cb 1.18 0.41 -0.01 0.00 0.27 0.00 0.00 38.32 40.17 2f1d h ASN 76 CO 0.08 -0.22 -0.18 -0.08 -0.37 0.00 0.00 177.43 176.66 2f1d h GLU 77 N -0.01 0.63 0.00 6.67 4.81 -1.38 -2.77 114.58 122.53 2f1d h GLU 77 Ca 0.31 -0.29 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 2f1d h GLU 77 Cb 0.48 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.85 2f1d h GLU 77 CO -0.68 0.88 -0.06 -0.44 -0.73 0.00 0.00 179.01 177.98 2f1d h ASP 78 N 0.37 0.00 0.37 1.04 3.32 -1.15 -2.13 116.42 118.24 2f1d h ASP 78 Ca 0.06 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.92 2f1d h ASP 78 Cb 0.71 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 2f1d h ASP 78 CO 0.05 0.06 -0.80 0.40 -1.72 0.00 0.00 179.24 177.23 2f1d h ILE 79 N 0.00 1.42 0.16 0.35 2.04 -1.22 -2.53 117.51 117.73 2f1d h ILE 79 Ca -0.00 -2.31 -0.31 0.00 1.00 0.00 0.00 64.86 63.23 2f1d h ILE 79 Cb 1.00 2.25 0.01 0.00 -0.74 0.00 0.00 36.82 39.34 2f1d h ILE 79 CO 0.01 0.69 -1.52 0.00 0.00 0.00 0.00 178.15 177.33 2f1d h ALA 80 N 0.94 0.14 -0.41 1.87 0.00 -1.31 -1.63 119.26 118.86 2f1d h ALA 80 Ca -0.04 -1.03 -0.06 0.00 0.00 0.00 0.00 54.91 53.77 2f1d h ALA 80 Cb 1.39 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 2f1d h ALA 80 CO 0.13 1.01 -0.01 -0.07 0.00 0.00 0.00 179.25 180.31 2f1d h LEU 81 N 0.09 0.63 -0.40 0.00 3.38 -1.51 -2.14 115.31 115.36 2f1d h LEU 81 Ca -0.25 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.49 2f1d h LEU 81 Cb 2.05 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.62 2f1d h LEU 81 CO 0.19 0.71 -0.10 0.00 0.09 0.00 0.00 178.44 179.34 2f1d h ALA 82 N 1.36 0.55 -0.32 1.53 0.00 -1.40 -2.97 119.26 118.01 2f1d h ALA 82 Ca 0.13 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 2f1d h ALA 82 Cb 0.41 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2f1d h ALA 82 CO 0.02 0.42 -0.33 0.82 0.00 0.00 0.00 179.25 180.19 2f1d h ILE 83 N 0.59 1.28 0.00 0.00 2.04 -1.17 -1.61 117.51 118.64 2f1d h ILE 83 Ca 0.10 -1.47 -0.01 0.00 1.00 0.00 0.00 64.86 64.49 2f1d h ILE 83 Cb 0.62 1.38 -0.00 0.00 -0.74 0.00 0.00 36.82 38.08 2f1d h ILE 83 CO 0.04 0.48 -0.04 1.23 0.00 0.00 0.00 178.15 179.86 2f1d h GLY 84 N 0.97 0.00 1.19 5.37 0.00 -1.41 -0.61 103.07 108.58 2f1d h GLY 84 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.07 2f1d h GLY 84 CO 0.07 0.00 -1.56 -0.84 0.00 0.00 0.00 176.54 174.21 2f1d h THR 85 N 0.00 1.14 0.00 4.70 2.02 -1.32 -2.96 112.91 116.49 2f1d h THR 85 Ca -0.00 -2.73 -0.02 0.00 0.77 0.00 0.00 66.41 64.43 2f1d h THR 85 Cb 0.55 2.82 -0.00 0.00 -1.74 0.00 0.00 68.15 69.78 2f1d h THR 85 CO 0.00 0.83 -0.08 0.00 0.37 0.00 0.00 175.52 176.65 2f1d h ALA 86 N 0.34 1.17 0.24 6.16 0.00 -0.91 -2.25 119.26 124.01 2f1d h ALA 86 Ca -0.26 -0.08 -0.34 0.00 0.00 0.00 0.00 54.91 54.24 2f1d h ALA 86 Cb 2.06 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 19.87 2f1d h ALA 86 CO 0.19 0.10 -1.50 1.25 0.00 0.00 0.00 179.25 179.29 2f1d h LEU 87 N 0.00 0.79 -0.09 0.00 5.85 -1.18 -2.88 115.31 117.80 2f1d h LEU 87 Ca -0.00 -0.88 -0.04 0.00 0.84 0.00 0.00 57.88 57.81 2f1d h LEU 87 Cb 0.33 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 2f1d h LEU 87 CO 0.01 1.70 -0.09 0.25 -0.34 0.00 0.00 178.44 179.97 2f1d h LEU 88 N 0.14 0.23 0.45 2.25 5.85 -1.31 -2.39 115.31 120.53 2f1d h LEU 88 Ca -0.26 -0.48 -0.02 0.00 0.84 0.00 0.00 57.88 57.96 2f1d h LEU 88 Cb 2.15 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 43.10 2f1d h LEU 88 CO 0.26 0.66 -0.39 0.11 -0.34 0.00 0.00 178.44 178.74 2f1d h LYS 89 N -0.21 -0.79 -0.64 1.25 1.57 -1.57 -2.70 116.57 113.48 2f1d h LYS 89 Ca 0.01 0.05 0.21 0.00 -1.87 0.00 0.00 60.65 59.06 2f1d h LYS 89 Cb 0.60 0.18 -0.12 0.00 0.08 0.00 0.00 32.23 32.97 2f1d h LYS 89 CO 0.02 -0.53 0.13 0.00 -0.57 0.00 0.00 179.45 178.51 2f1d n ALA 90 N -2.66 0.45 -0.00 3.86 0.00 -1.09 -1.03 120.51 120.04 2f1d n ALA 90 Ca -0.10 0.67 -0.13 0.00 0.00 0.00 0.00 53.44 53.88 2f1d n ALA 90 Cb 0.36 -0.56 -0.02 0.00 0.00 0.00 0.00 19.45 19.24 2f1d n ALA 90 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2f1d h LEU 91 N 0.00 0.75 0.00 0.00 3.38 -1.09 -3.41 115.31 114.94 2f1d h LEU 91 Ca 0.45 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2f1d h LEU 91 Cb 1.03 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2f1d h LEU 91 CO -0.56 1.24 0.00 0.61 0.09 0.00 0.00 178.44 179.81 2f1d n GLY 92 N 0.55 3.66 0.50 0.83 0.00 -0.20 -2.94 105.19 107.59 2f1d n GLY 92 Ca -0.05 -0.06 0.03 0.00 0.00 0.00 0.00 46.02 45.93 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 13.82 1.60 -4.33 1.61 -0.00 -1.26 -4.91 120.64 127.17 2f1d n GLU 93 Ca 0.00 -0.70 -0.32 0.00 -0.00 0.00 0.00 57.16 56.15 2f1d n GLU 93 Cb 0.00 -1.32 -0.10 0.00 -0.00 0.00 0.00 31.44 30.02 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 0.07 -1.00 -3.27 3.44 1.74 -1.15 -4.86 116.66 111.63 2f1d n ARG 94 Ca 0.06 0.11 -0.41 0.00 -0.77 0.00 0.00 57.85 56.84 2f1d n ARG 94 Cb 0.26 -3.71 -0.08 0.00 -1.02 0.00 0.00 32.46 27.91 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 -7.35 3.66 0.00 5.56 -0.14 -1.26 -4.26 119.74 115.94 2f1d s LYS 95 Ca 0.07 -0.16 0.00 0.00 -1.36 0.00 0.00 55.97 54.53 2f1d s LYS 95 Cb -0.04 -3.79 0.00 0.00 -1.68 0.00 0.00 37.83 32.32 2f1d s LYS 95 CO 1.00 -0.59 0.00 0.41 -0.76 0.00 0.00 175.35 175.41 2f1d n GLY 96 N 4.79 0.59 3.85 -3.33 0.00 -1.26 -5.01 105.19 104.81 2f1d n GLY 96 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.39 4.63 0.24 -0.61 -4.36 -1.26 -1.45 121.20 115.99 2f1d s ILE 97 Ca 0.00 0.99 -0.06 0.00 -0.26 0.00 0.00 60.65 61.32 2f1d s ILE 97 Cb 0.00 -3.71 0.20 0.00 1.25 0.00 0.00 42.46 40.20 2f1d s ILE 97 CO 0.00 -0.56 1.81 0.78 0.24 0.00 0.00 174.94 177.22 2f1d h ASN 98 N 1.23 0.66 0.00 4.36 2.35 -1.48 -3.44 115.58 119.26 2f1d h ASN 98 Ca -0.47 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 2f1d h ASN 98 Cb 1.18 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.46 2f1d h ASN 98 CO 0.63 0.40 0.00 -1.14 -1.65 0.00 0.00 177.43 175.66 2f1d n ARG 99 N -4.74 0.00 -4.16 0.81 0.63 -0.89 -4.94 116.66 103.38 2f1d n ARG 99 Ca 0.12 0.00 -0.35 0.00 -0.92 0.00 0.00 57.85 56.70 2f1d n ARG 99 Cb 0.24 0.00 -0.09 0.00 0.45 0.00 0.00 32.46 33.05 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 -0.33 3.24 -0.03 -0.14 0.40 -1.26 -1.78 117.98 118.08 2f1d s PHE 100 Ca 0.00 0.13 0.07 0.00 -0.60 0.00 0.00 56.93 56.53 2f1d s PHE 100 Cb 0.00 -1.95 -0.02 0.00 0.51 0.00 0.00 43.02 41.57 2f1d s PHE 100 CO 0.00 0.32 -0.24 0.20 0.70 0.00 0.00 175.22 176.20 2f1d s GLY 101 N -0.26 1.20 -0.21 4.36 0.00 -0.49 -3.99 107.32 107.93 2f1d s GLY 101 Ca 0.07 -1.02 -0.05 0.00 0.00 0.00 0.00 44.72 43.73 2f1d s GLY 101 CO 0.02 -0.76 0.36 -0.35 0.00 0.00 0.00 173.10 172.36 2f1d s ASP 102 N -0.40 0.17 -0.23 1.64 2.15 -1.26 -1.01 116.67 117.72 2f1d s ASP 102 Ca 0.05 0.52 -0.12 0.00 0.43 0.00 0.00 52.55 53.42 2f1d s ASP 102 Cb -0.11 1.07 0.08 0.00 -0.30 0.00 0.00 42.92 43.66 2f1d s ASP 102 CO 0.01 -0.27 0.56 0.12 -0.17 0.00 0.00 175.17 175.42 2f1d s PHE 103 N 2.53 -0.89 -0.27 -5.34 5.36 -0.91 -4.90 117.98 113.56 2f1d s PHE 103 Ca 0.05 1.78 -0.11 0.00 -0.96 0.00 0.00 56.93 57.69 2f1d s PHE 103 Cb -0.14 0.48 -0.05 0.00 -0.34 0.00 0.00 43.02 42.98 2f1d s PHE 103 CO -0.13 -0.46 0.18 0.99 -1.46 0.00 0.00 175.22 174.33 2f1d s THR 104 N 1.71 5.27 -0.09 0.12 2.01 -1.26 -1.92 115.64 121.48 2f1d s THR 104 Ca -0.09 0.16 0.04 0.00 0.31 0.00 0.00 61.69 62.11 2f1d s THR 104 Cb -0.07 -3.50 -0.00 0.00 0.01 0.00 0.00 72.50 68.93 2f1d s THR 104 CO -0.17 0.27 -0.24 0.00 -0.69 0.00 0.00 174.62 173.79 2f1d s ALA 105 N 1.65 2.19 0.23 7.40 0.00 -0.66 -4.97 121.76 127.60 2f1d s ALA 105 Ca 0.07 -0.99 -0.07 0.00 0.00 0.00 0.00 51.96 50.97 2f1d s ALA 105 Cb -0.16 -0.79 -0.06 0.00 0.00 0.00 0.00 23.12 22.11 2f1d s ALA 105 CO 0.10 0.33 0.51 -1.25 0.00 0.00 0.00 175.76 175.45 2f1d s PRO 106 N 0.17 3.72 -0.31 0.00 0.04 -1.26 -2.38 135.00 134.98 2f1d s PRO 106 Ca -0.14 0.13 -0.03 0.00 0.04 0.00 0.00 61.00 61.01 2f1d s PRO 106 Cb -0.17 -2.69 0.11 0.00 0.04 0.00 0.00 34.50 31.79 2f1d s PRO 106 CO 0.07 0.32 0.14 -1.17 0.04 0.00 0.00 177.00 176.40 2f1d s LEU 107 N -2.96 1.05 0.00 -3.56 1.98 -1.12 -4.97 118.68 109.10 2f1d s LEU 107 Ca 0.45 -1.54 0.00 0.00 -2.89 0.00 0.00 54.13 50.16 2f1d s LEU 107 Cb -0.11 -0.49 0.00 0.00 0.66 0.00 0.00 46.19 46.24 2f1d s LEU 107 CO 0.24 -0.41 0.00 0.47 -1.89 0.00 0.00 176.35 174.76 2f1d n ASP 108 N 4.94 0.00 0.18 3.68 8.00 -1.26 -2.09 116.55 130.00 2f1d n ASP 108 Ca -0.02 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.60 2f1d n ASP 108 Cb 0.41 0.00 0.26 0.00 -0.02 0.00 0.00 41.12 41.77 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 -7.33 -1.24 9.09 -1.96 -3.46 114.58 109.68 2f1d h GLU 109 Ca 0.00 0.00 -0.51 0.00 0.05 0.00 0.00 59.36 58.90 2f1d h GLU 109 Cb 0.00 0.00 0.07 0.00 -1.65 0.00 0.00 28.75 27.17 2f1d h GLU 109 CO 0.00 0.00 0.40 0.00 0.05 0.00 0.00 179.01 179.46 2f1d s ALA 110 N -3.17 2.92 -0.30 1.06 0.00 -0.89 -3.76 121.76 117.62 2f1d s ALA 110 Ca 0.08 0.02 0.05 0.00 0.00 0.00 0.00 51.96 52.11 2f1d s ALA 110 Cb 0.08 -3.13 0.19 0.00 0.00 0.00 0.00 23.12 20.26 2f1d s ALA 110 CO 0.64 -0.87 0.56 -1.17 0.00 0.00 0.00 175.76 174.92 2f1d s LEU 111 N -5.22 -1.45 -0.14 0.00 2.96 -0.74 -2.77 118.68 111.30 2f1d s LEU 111 Ca 0.57 0.01 -0.02 0.00 -0.22 0.00 0.00 54.13 54.46 2f1d s LEU 111 Cb -0.12 1.84 -0.02 0.00 0.50 0.00 0.00 46.19 48.39 2f1d s LEU 111 CO 0.52 -0.30 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.54 2f1d s ILE 112 N 2.71 3.54 -0.19 6.68 -1.09 -1.00 -1.33 121.20 130.52 2f1d s ILE 112 Ca 0.10 -0.49 -0.07 0.00 -2.23 0.00 0.00 60.65 57.96 2f1d s ILE 112 Cb -0.10 -2.53 -0.04 0.00 -1.58 0.00 0.00 42.46 38.21 2f1d s ILE 112 CO -0.26 0.51 0.06 -2.28 -1.23 0.00 0.00 174.94 171.74 2f1d s HIS 113 N 0.35 3.24 -0.04 3.97 5.65 -0.59 -1.65 115.29 126.22 2f1d s HIS 113 Ca -0.07 0.05 0.07 0.00 0.25 0.00 0.00 55.06 55.36 2f1d s HIS 113 Cb -0.15 -2.09 -0.02 0.00 -1.18 0.00 0.00 32.58 29.15 2f1d s HIS 113 CO 0.04 0.13 -0.25 0.08 -0.65 0.00 0.00 174.74 174.09 2f1d s VAL 114 N 0.44 2.02 -0.04 0.89 1.01 -0.81 -1.17 120.40 122.74 2f1d s VAL 114 Ca 0.03 -1.07 -0.02 0.00 0.00 0.00 0.00 61.98 60.92 2f1d s VAL 114 Cb -0.13 -1.69 0.02 0.00 0.00 0.00 0.00 36.38 34.59 2f1d s VAL 114 CO 0.00 0.57 0.08 -0.55 0.00 0.00 0.00 175.10 175.20 2f1d s SER 115 N -0.38 -0.04 0.15 3.32 0.15 -0.72 -2.13 113.70 114.05 2f1d s SER 115 Ca 0.03 0.16 -0.08 0.00 0.70 0.00 0.00 55.95 56.76 2f1d s SER 115 Cb -0.12 0.09 -0.01 0.00 -1.71 0.00 0.00 66.02 64.27 2f1d s SER 115 CO 0.01 -0.09 0.24 -1.48 1.20 0.00 0.00 173.24 173.12 2f1d s LEU 116 N 0.71 1.12 -0.15 3.45 0.05 -0.18 -1.20 118.68 122.48 2f1d s LEU 116 Ca -0.06 -0.90 -0.06 0.00 0.05 0.00 0.00 54.13 53.17 2f1d s LEU 116 Cb -0.08 1.05 0.07 0.00 -2.05 0.00 0.00 46.19 45.19 2f1d s LEU 116 CO -0.03 -0.86 0.32 -0.62 -0.55 0.00 0.00 176.35 174.62 2f1d s ASP 117 N -2.97 0.10 -0.86 1.48 2.15 -0.65 -1.40 116.67 114.51 2f1d s ASP 117 Ca 0.17 0.75 -0.24 0.00 0.43 0.00 0.00 52.55 53.66 2f1d s ASP 117 Cb 0.04 0.93 0.05 0.00 -0.30 0.00 0.00 42.92 43.65 2f1d s ASP 117 CO -0.01 -0.23 1.30 -0.76 -0.17 0.00 0.00 175.17 175.30 2f1d s LEU 118 N 2.44 3.62 -0.02 -1.34 1.43 -0.74 -0.56 118.68 123.52 2f1d s LEU 118 Ca -0.00 -1.07 0.08 0.00 -1.03 0.00 0.00 54.13 52.10 2f1d s LEU 118 Cb -0.12 -2.53 -0.12 0.00 0.03 0.00 0.00 46.19 43.45 2f1d s LEU 118 CO -0.10 -1.59 0.15 -1.54 0.23 0.00 0.00 176.35 173.51 2f1d n SER 119 N 8.72 3.21 0.00 2.29 3.41 -1.05 -4.99 113.62 125.21 2f1d n SER 119 Ca 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 2f1d n SER 119 Cb 0.49 1.27 0.00 0.00 -0.26 0.00 0.00 64.21 65.72 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 2.12 0.78 2.73 5.00 0.00 -0.52 -5.02 105.19 110.28 2f1d n GLY 120 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.22 0.90 0.26 1.61 0.52 -1.24 -4.87 118.95 115.90 2f1d s ARG 121 Ca 0.00 -1.37 -0.31 0.00 -0.52 0.00 0.00 55.73 53.53 2f1d s ARG 121 Cb 0.00 -2.12 -0.12 0.00 0.52 0.00 0.00 34.95 33.23 2f1d s ARG 121 CO 0.00 -1.04 1.66 -0.35 0.02 0.00 0.00 175.30 175.59 2f1d n PRO 122 N 4.45 2.76 -3.64 3.54 -0.04 -1.24 -4.13 135.00 136.70 2f1d n PRO 122 Ca 0.02 0.99 -0.11 0.00 -0.04 0.00 0.00 63.50 64.36 2f1d n PRO 122 Cb 0.40 -2.81 -0.07 0.00 -0.04 0.00 0.00 33.50 30.98 2f1d n PRO 122 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2f1d s TYR 123 N 0.51 -0.88 -0.18 0.54 5.04 -0.77 -4.96 117.35 116.65 2f1d s TYR 123 Ca 0.69 1.95 0.01 0.00 -2.44 0.00 0.00 57.07 57.28 2f1d s TYR 123 Cb -0.49 0.41 0.03 0.00 0.35 0.00 0.00 41.96 42.25 2f1d s TYR 123 CO 0.41 -0.43 -0.17 -1.17 -1.34 0.00 0.00 175.55 172.86 2f1d s LEU 124 N 0.91 2.13 -0.49 6.97 2.96 -1.26 -1.01 118.68 128.89 2f1d s LEU 124 Ca -0.04 -0.69 -0.16 0.00 -0.22 0.00 0.00 54.13 53.01 2f1d s LEU 124 Cb -0.05 -1.38 0.08 0.00 0.50 0.00 0.00 46.19 45.34 2f1d s LEU 124 CO -0.08 -0.05 0.47 -0.83 -1.32 0.00 0.00 176.35 174.54 2f1d s GLY 125 N 1.34 1.99 -0.31 7.98 0.00 -0.44 -5.02 107.32 112.85 2f1d s GLY 125 Ca 0.03 -2.09 -0.05 0.00 0.00 0.00 0.00 44.72 42.61 2f1d s GLY 125 CO -0.11 1.18 0.06 -0.47 0.00 0.00 0.00 173.10 173.76 2f1d s TYR 126 N 1.88 3.20 -0.57 1.90 5.04 -1.26 -1.46 117.35 126.09 2f1d s TYR 126 Ca 0.06 -1.36 0.05 0.00 -2.44 0.00 0.00 57.07 53.38 2f1d s TYR 126 Cb -0.24 -2.22 0.18 0.00 0.35 0.00 0.00 41.96 40.03 2f1d s TYR 126 CO 0.07 -0.69 0.45 0.09 -1.34 0.00 0.00 175.55 174.13 2f1d n ASN 127 N 4.79 1.53 -3.44 4.32 4.13 -0.86 -5.03 115.26 120.70 2f1d n ASN 127 Ca -0.14 -2.87 -0.20 0.00 1.68 0.00 0.00 54.58 53.05 2f1d n ASN 127 Cb 0.46 -0.66 -0.11 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 -0.92 -0.04 -0.45 3.41 2.96 -1.26 -0.97 118.68 121.41 2f1d s LEU 128 Ca 0.30 -0.86 -0.17 0.00 -0.22 0.00 0.00 54.13 53.17 2f1d s LEU 128 Cb 0.01 0.29 0.04 0.00 0.50 0.00 0.00 46.19 47.03 2f1d s LEU 128 CO -0.17 -0.40 0.48 -1.83 -1.32 0.00 0.00 176.35 173.11 2f1d s GLU 129 N 2.29 3.08 -0.37 1.98 -1.05 -1.26 -5.04 118.70 118.34 2f1d s GLU 129 Ca 0.09 -0.89 -0.15 0.00 -0.15 0.00 0.00 54.97 53.87 2f1d s GLU 129 Cb -0.15 -4.03 -0.00 0.00 -0.44 0.00 0.00 34.13 29.52 2f1d s GLU 129 CO -0.33 -0.97 0.35 0.42 0.95 0.00 0.00 175.26 175.68 2f1d s ILE 130 N 2.17 5.19 -0.60 1.83 1.01 -1.26 -5.00 121.20 124.54 2f1d s ILE 130 Ca 0.11 -0.18 0.22 0.00 0.00 0.00 0.00 60.65 60.81 2f1d s ILE 130 Cb -0.19 -3.86 0.23 0.00 0.01 0.00 0.00 42.46 38.65 2f1d s ILE 130 CO 0.12 -0.18 1.68 -0.81 0.00 0.00 0.00 174.94 175.76 2f1d n PRO 131 N 5.34 0.16 -4.55 2.79 -0.04 -1.26 -4.68 135.00 132.76 2f1d n PRO 131 Ca -0.10 0.36 -0.31 0.00 -0.04 0.00 0.00 63.50 63.42 2f1d n PRO 131 Cb 0.49 -1.80 -0.12 0.00 -0.04 0.00 0.00 33.50 32.03 2f1d n PRO 131 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2f1d s THR 132 N -3.24 3.06 -0.29 0.52 -4.23 -1.26 -5.02 115.64 105.18 2f1d s THR 132 Ca 0.06 -1.11 0.28 0.00 -1.18 0.00 0.00 61.69 59.74 2f1d s THR 132 Cb 0.10 -2.32 0.32 0.00 1.34 0.00 0.00 72.50 71.94 2f1d s THR 132 CO 0.39 0.32 1.81 1.56 -0.54 0.00 0.00 174.62 178.16 2f1d h GLN 133 N 4.41 0.00 -2.79 3.99 4.20 -1.96 -3.44 115.11 119.52 2f1d h GLN 133 Ca -0.48 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.07 2f1d h GLN 133 Cb 1.16 0.00 -0.29 0.00 0.30 0.00 0.00 27.48 28.65 2f1d h GLN 133 CO 0.49 0.00 -0.41 0.50 -0.67 0.00 0.00 178.83 178.74 2f1d s ARG 134 N -3.40 0.28 -0.31 1.46 3.52 -1.26 -2.05 118.95 117.19 2f1d s ARG 134 Ca 0.04 0.73 -0.05 0.00 -0.13 0.00 0.00 55.73 56.33 2f1d s ARG 134 Cb 0.09 -0.01 0.03 0.00 -1.56 0.00 0.00 34.95 33.51 2f1d s ARG 134 CO 0.52 -0.20 0.05 0.14 -0.81 0.00 0.00 175.30 175.01 2f1d s VAL 135 N 1.71 3.49 0.00 7.11 -7.23 -0.99 -4.94 120.40 119.55 2f1d s VAL 135 Ca -0.06 -1.10 0.00 0.00 -1.81 0.00 0.00 61.98 59.00 2f1d s VAL 135 Cb -0.10 -2.93 0.00 0.00 0.56 0.00 0.00 36.38 33.91 2f1d s VAL 135 CO -0.11 -0.06 0.00 0.61 -0.31 0.00 0.00 175.10 175.23 2f1d n GLY 136 N 4.75 2.90 0.90 2.32 0.00 -1.26 -1.62 105.19 113.19 2f1d n GLY 136 Ca -0.14 -0.24 0.02 0.00 0.00 0.00 0.00 46.02 45.66 2f1d n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2f1d n THR 137 N 0.00 2.37 -3.47 2.61 -2.24 -1.26 -5.00 114.28 107.28 2f1d n THR 137 Ca 0.00 -2.46 -0.41 0.00 -2.27 0.00 0.00 64.05 58.91 2f1d n THR 137 Cb 0.00 -0.29 -0.10 0.00 -2.10 0.00 0.00 70.33 67.84 2f1d n THR 137 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2f1d s TYR 138 N -3.08 3.22 0.16 4.78 5.04 -0.64 -4.99 117.35 121.85 2f1d s TYR 138 Ca 0.42 -0.23 -0.33 0.00 -2.44 0.00 0.00 57.07 54.48 2f1d s TYR 138 Cb 0.37 -2.57 -0.13 0.00 0.35 0.00 0.00 41.96 39.98 2f1d s TYR 138 CO 0.02 -0.44 1.66 -3.47 -1.34 0.00 0.00 175.55 171.99 2f1d n ASP 139 N 5.22 3.45 0.10 4.32 -0.08 -1.26 -2.34 116.55 125.95 2f1d n ASP 139 Ca -0.11 1.06 0.12 0.00 -1.51 0.00 0.00 54.79 54.36 2f1d n ASP 139 Cb 0.49 -1.48 0.28 0.00 2.34 0.00 0.00 41.12 42.75 2f1d n ASP 139 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 2f1d h THR 140 N 3.86 0.00 0.00 5.18 2.02 -1.71 -2.81 112.91 119.46 2f1d h THR 140 Ca -0.45 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 66.19 2f1d h THR 140 Cb 1.24 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 2f1d h THR 140 CO 0.92 0.00 0.00 1.56 0.37 0.00 0.00 175.52 178.37 2f1d h GLN 141 N 0.00 0.00 -0.00 6.66 4.20 -1.90 -3.18 115.11 120.88 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 0.77 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.55 2f1d h GLN 141 CO 0.00 0.00 -0.06 1.28 -0.67 0.00 0.00 178.83 179.38 2f1d n LEU 142 N -2.72 0.10 -0.04 1.46 4.32 -1.06 -3.21 117.00 115.85 2f1d n LEU 142 Ca 0.01 0.35 -0.13 0.00 -0.02 0.00 0.00 56.01 56.22 2f1d n LEU 142 Cb 0.25 -0.39 -0.08 0.00 -1.62 0.00 0.00 43.42 41.58 2f1d n LEU 142 CO 0.23 0.02 0.60 0.58 -1.22 0.00 0.00 177.39 177.61 2f1d h VAL 143 N 0.05 1.36 -0.86 4.08 2.07 -1.75 -1.25 116.25 119.95 2f1d h VAL 143 Ca 0.00 -1.28 0.13 0.00 0.82 0.00 0.00 66.70 66.37 2f1d h VAL 143 Cb 0.44 1.98 -0.09 0.00 -1.52 0.00 0.00 31.29 32.10 2f1d h VAL 143 CO 0.00 0.37 0.47 -0.08 0.02 0.00 0.00 177.57 178.34 2f1d h GLU 144 N -0.16 0.68 0.00 1.57 4.81 -1.77 -2.85 114.58 116.86 2f1d h GLU 144 Ca 0.01 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.10 2f1d h GLU 144 Cb 0.64 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 2f1d h GLU 144 CO 0.03 0.45 -0.51 1.25 -0.73 0.00 0.00 179.01 179.50 2f1d h HIS 145 N 0.70 0.00 -0.09 0.92 2.76 -1.52 -1.66 115.15 116.26 2f1d h HIS 145 Ca 0.45 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.61 2f1d h HIS 145 Cb 0.58 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.54 2f1d h HIS 145 CO -0.07 0.51 -0.00 0.35 -1.30 0.00 0.00 177.93 177.41 2f1d h PHE 146 N 0.00 0.17 0.00 5.26 3.57 -1.00 -2.64 116.94 122.30 2f1d h PHE 146 Ca -0.01 -0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.37 2f1d h PHE 146 Cb 1.27 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.95 2f1d h PHE 146 CO 0.00 0.42 -0.45 0.74 -2.23 0.00 0.00 178.31 176.79 2f1d h PHE 147 N -0.14 0.00 0.07 0.41 -1.00 -1.45 -1.82 116.94 113.01 2f1d h PHE 147 Ca 0.02 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.80 2f1d h PHE 147 Cb 0.36 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.92 2f1d h PHE 147 CO 0.04 0.45 -0.03 0.37 -1.61 0.00 0.00 178.31 177.52 2f1d h GLN 148 N 0.00 -0.09 -0.77 1.51 5.75 -1.25 -2.17 115.11 118.09 2f1d h GLN 148 Ca -0.00 0.01 -0.03 0.00 -0.15 0.00 0.00 58.65 58.47 2f1d h GLN 148 Cb 0.90 0.02 -0.04 0.00 1.07 0.00 0.00 27.48 29.43 2f1d h GLN 148 CO 0.06 0.33 0.37 0.77 -2.65 0.00 0.00 178.83 177.71 2f1d h SER 149 N -0.54 1.00 0.08 -0.69 0.02 -1.47 -2.39 113.55 109.56 2f1d h SER 149 Ca -0.01 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 60.78 2f1d h SER 149 Cb 0.46 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 2f1d h SER 149 CO 0.02 0.85 -0.12 0.25 -1.14 0.00 0.00 176.83 176.69 2f1d h LEU 150 N 1.08 0.09 -0.04 5.07 6.46 -1.30 -2.11 115.31 124.55 2f1d h LEU 150 Ca 0.26 -0.01 -0.25 0.00 -0.12 0.00 0.00 57.88 57.76 2f1d h LEU 150 Cb 0.11 -0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.02 2f1d h LEU 150 CO -0.03 0.22 -1.08 0.58 -0.62 0.00 0.00 178.44 177.51 2f1d h VAL 151 N 0.09 1.44 -0.10 1.05 2.07 -1.02 -2.92 116.25 116.87 2f1d h VAL 151 Ca 0.02 -2.71 -0.07 0.00 0.82 0.00 0.00 66.70 64.76 2f1d h VAL 151 Cb 0.27 2.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.69 2f1d h VAL 151 CO 0.02 0.80 -0.25 0.78 0.02 0.00 0.00 177.57 178.93 2f1d h ASN 152 N 0.16 0.17 0.08 0.57 2.35 -0.89 -0.90 115.58 117.12 2f1d h ASN 152 Ca -0.11 -0.05 -0.05 0.00 -0.55 0.00 0.00 56.30 55.54 2f1d h ASN 152 Cb 1.75 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 40.07 2f1d h ASN 152 CO 0.18 0.43 -1.97 0.35 -1.65 0.00 0.00 177.43 174.77 2f1d n THR 153 N -4.18 0.25 0.11 2.81 -2.24 -1.16 -4.42 114.28 105.45 2f1d n THR 153 Ca -0.01 -0.56 0.01 0.00 -2.27 0.00 0.00 64.05 61.22 2f1d n THR 153 Cb 0.35 -0.10 -0.01 0.00 -2.10 0.00 0.00 70.33 68.46 2f1d n THR 153 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2f1d h SER 154 N 0.00 0.00 -5.77 3.42 0.87 -1.31 -3.39 113.55 107.37 2f1d h SER 154 Ca -0.08 0.00 -0.35 0.00 -1.23 0.00 0.00 61.79 60.13 2f1d h SER 154 Cb 1.18 0.00 0.14 0.00 -0.44 0.00 0.00 62.40 63.28 2f1d h SER 154 CO 0.01 0.56 -0.81 0.61 -0.53 0.00 0.00 176.83 176.67 2f1d n GLY 155 N 1.28 -0.49 3.82 5.77 0.00 -0.36 -4.78 105.19 110.42 2f1d n GLY 155 Ca -0.01 0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 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 -5.41 2.84 -0.15 1.61 -2.45 -1.22 -1.44 119.30 113.09 2f1d s MET 156 Ca 0.09 -1.13 -0.02 0.00 -1.25 0.00 0.00 55.69 53.39 2f1d s MET 156 Cb -0.02 -2.52 -0.02 0.00 1.25 0.00 0.00 34.83 33.53 2f1d s MET 156 CO 0.76 0.34 -0.08 0.99 1.05 0.00 0.00 175.02 178.08 2f1d s THR 157 N -2.18 3.49 -0.13 10.11 2.01 0.28 -1.84 115.64 127.38 2f1d s THR 157 Ca 0.34 -0.50 -0.04 0.00 0.31 0.00 0.00 61.69 61.80 2f1d s THR 157 Cb -0.07 -2.51 0.06 0.00 0.01 0.00 0.00 72.50 69.99 2f1d s THR 157 CO 0.25 0.50 0.14 -0.22 -0.69 0.00 0.00 174.62 174.60 2f1d s LEU 158 N 0.41 0.08 -0.19 4.42 2.96 -0.18 -1.64 118.68 124.54 2f1d s LEU 158 Ca -0.07 -0.14 -0.04 0.00 -0.22 0.00 0.00 54.13 53.67 2f1d s LEU 158 Cb -0.15 0.07 -0.02 0.00 0.50 0.00 0.00 46.19 46.59 2f1d s LEU 158 CO 0.04 -0.30 -0.03 -1.00 -1.32 0.00 0.00 176.35 173.74 2f1d s HIS 159 N 2.23 2.99 -0.23 5.38 3.76 -0.34 -1.33 115.29 127.75 2f1d s HIS 159 Ca 0.04 -0.57 0.00 0.00 -0.15 0.00 0.00 55.06 54.38 2f1d s HIS 159 Cb -0.14 -2.04 0.03 0.00 1.11 0.00 0.00 32.58 31.54 2f1d s HIS 159 CO -0.08 -0.28 -0.11 0.42 -0.85 0.00 0.00 174.74 173.84 2f1d s ILE 160 N 0.95 2.51 -0.15 0.60 1.01 -0.53 -1.75 121.20 123.83 2f1d s ILE 160 Ca 0.00 -1.12 0.01 0.00 0.00 0.00 0.00 60.65 59.54 2f1d s ILE 160 Cb -0.15 -2.26 0.01 0.00 0.01 0.00 0.00 42.46 40.07 2f1d s ILE 160 CO 0.01 0.25 -0.18 -0.13 0.00 0.00 0.00 174.94 174.89 2f1d s ARG 161 N 1.27 3.11 -0.05 2.79 0.52 -0.32 -2.04 118.95 124.23 2f1d s ARG 161 Ca -0.00 -0.80 -0.27 0.00 -0.52 0.00 0.00 55.73 54.13 2f1d s ARG 161 Cb -0.16 -2.55 -0.03 0.00 0.52 0.00 0.00 34.95 32.72 2f1d s ARG 161 CO -0.07 -0.04 0.88 -1.14 0.02 0.00 0.00 175.30 174.95 2f1d s GLN 162 N 0.91 4.48 -0.01 3.54 0.74 -0.14 -1.55 119.66 127.63 2f1d s GLN 162 Ca -0.04 1.20 0.08 0.00 0.05 0.00 0.00 55.36 56.65 2f1d s GLN 162 Cb -0.15 -3.48 -0.12 0.00 1.10 0.00 0.00 33.01 30.36 2f1d s GLN 162 CO -0.03 -0.07 0.17 1.28 -0.55 0.00 0.00 175.29 176.09 2f1d n LEU 163 N 4.13 0.00 -3.51 3.68 4.77 -0.44 -4.98 117.00 120.64 2f1d n LEU 163 Ca 0.04 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.89 2f1d n LEU 163 Cb 0.51 0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.56 2f1d n LEU 163 CO 0.50 0.01 0.57 0.00 -1.33 0.00 0.00 177.39 177.14 2f1d s ALA 164 N -2.53 -1.79 0.00 -1.18 0.00 -1.15 -4.88 121.76 110.22 2f1d s ALA 164 Ca -0.03 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.08 2f1d s ALA 164 Cb 0.05 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.26 2f1d s ALA 164 CO 0.33 -0.51 0.00 0.41 0.00 0.00 0.00 175.76 175.99 2f1d n GLY 165 N 0.34 3.88 1.10 0.00 0.00 -1.25 -1.80 105.19 107.48 2f1d n GLY 165 Ca -0.14 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2f1d n GLY 165 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2f1d n GLU 166 N -0.91 0.00 -2.15 1.61 1.02 -1.26 -4.99 120.64 113.96 2f1d n GLU 166 Ca 0.00 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.73 2f1d n GLU 166 Cb 0.00 -0.47 -0.02 0.00 -0.02 0.00 0.00 31.44 30.93 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 -5.69 6.83 0.07 1.62 3.84 -1.26 -4.67 114.94 115.68 2f1d s ASN 167 Ca 0.00 2.59 0.04 0.00 0.21 0.00 0.00 52.86 55.71 2f1d s ASN 167 Cb 0.00 -2.64 -0.24 0.00 -0.55 0.00 0.00 41.25 37.83 2f1d s ASN 167 CO 0.00 -0.52 1.10 0.28 -2.79 0.00 0.00 177.10 175.17 2f1d h SER 168 N 4.01 0.14 -0.41 -4.21 0.02 -1.98 -2.63 113.55 108.49 2f1d h SER 168 Ca -0.48 -0.16 -0.11 0.00 -0.84 0.00 0.00 61.79 60.20 2f1d h SER 168 Cb 1.22 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.70 2f1d h SER 168 CO 0.69 1.13 -0.16 -0.74 -1.14 0.00 0.00 176.83 176.61 2f1d h HIS 169 N 0.02 1.00 0.00 3.45 -0.00 -1.97 -2.69 115.15 114.96 2f1d h HIS 169 Ca -0.11 -0.22 -0.12 0.00 -0.00 0.00 0.00 60.37 59.92 2f1d h HIS 169 Cb 1.88 -0.25 -0.02 0.00 -0.00 0.00 0.00 27.41 29.03 2f1d h HIS 169 CO 0.02 0.98 -0.58 0.45 -0.00 0.00 0.00 177.93 178.80 2f1d h HIS 170 N 0.79 0.00 0.01 5.26 3.86 -1.91 -2.44 115.15 120.71 2f1d h HIS 170 Ca 0.12 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.10 2f1d h HIS 170 Cb 0.70 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.19 2f1d h HIS 170 CO 0.04 0.58 -0.89 0.82 0.86 0.00 0.00 177.93 179.34 2f1d h ILE 171 N 0.00 1.33 -0.03 2.45 2.04 -1.44 -2.95 117.51 118.91 2f1d h ILE 171 Ca -0.01 -2.20 -0.07 0.00 1.00 0.00 0.00 64.86 63.59 2f1d h ILE 171 Cb 1.08 2.48 0.00 0.00 -0.74 0.00 0.00 36.82 39.64 2f1d h ILE 171 CO 0.08 0.66 -0.25 0.40 0.00 0.00 0.00 178.15 179.04 2f1d h ILE 172 N 0.20 1.48 -0.70 -0.67 2.04 -1.52 -2.95 117.51 115.39 2f1d h ILE 172 Ca -0.11 -1.77 0.07 0.00 1.00 0.00 0.00 64.86 64.05 2f1d h ILE 172 Cb 1.57 2.51 -0.06 0.00 -0.74 0.00 0.00 36.82 40.10 2f1d h ILE 172 CO 0.18 0.49 0.37 -0.08 0.00 0.00 0.00 178.15 179.11 2f1d h GLU 173 N -0.34 0.65 0.00 2.37 4.81 -1.57 -1.28 114.58 119.22 2f1d h GLU 173 Ca -0.02 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.13 2f1d h GLU 173 Cb 0.94 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 2f1d h GLU 173 CO 0.05 0.43 -0.20 0.00 -0.73 0.00 0.00 179.01 178.56 2f1d h ALA 174 N 1.38 0.96 -0.20 2.92 0.00 -1.60 -0.83 119.26 121.90 2f1d h ALA 174 Ca 0.32 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.90 2f1d h ALA 174 Cb 0.26 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2f1d h ALA 174 CO -0.22 0.25 -0.53 1.15 0.00 0.00 0.00 179.25 179.90 2f1d h THR 175 N 0.00 1.32 0.00 0.00 2.02 -1.09 -2.47 112.91 112.69 2f1d h THR 175 Ca -0.00 -1.76 -0.03 0.00 0.77 0.00 0.00 66.41 65.38 2f1d h THR 175 Cb 0.84 1.74 -0.00 0.00 -1.74 0.00 0.00 68.15 68.98 2f1d h THR 175 CO 0.03 0.55 -0.18 -0.26 0.37 0.00 0.00 175.52 176.02 2f1d h PHE 176 N 0.44 0.00 -0.04 3.16 -1.00 -0.77 -1.17 116.94 117.56 2f1d h PHE 176 Ca 0.01 0.00 -0.24 0.00 2.81 0.00 0.00 57.97 60.56 2f1d h PHE 176 Cb 1.07 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.64 2f1d h PHE 176 CO 0.04 0.14 -0.93 0.87 -1.61 0.00 0.00 178.31 176.83 2f1d h LYS 177 N 0.00 0.59 0.02 1.51 1.57 -1.15 -2.52 116.57 116.59 2f1d h LYS 177 Ca -0.00 -0.59 -0.27 0.00 -1.87 0.00 0.00 60.65 57.92 2f1d h LYS 177 Cb 1.11 0.16 -0.04 0.00 0.08 0.00 0.00 32.23 33.54 2f1d h LYS 177 CO 0.02 1.20 -1.45 0.00 -0.57 0.00 0.00 179.45 178.65 2f1d h ALA 178 N 0.60 0.57 -0.05 3.86 0.00 -1.45 -2.86 119.26 119.93 2f1d h ALA 178 Ca -0.09 -1.24 -0.01 0.00 0.00 0.00 0.00 54.91 53.58 2f1d h ALA 178 Cb 1.56 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.60 2f1d h ALA 178 CO 0.17 1.42 0.00 0.35 0.00 0.00 0.00 179.25 181.19 2f1d h PHE 179 N 0.01 0.08 -0.37 0.00 3.57 -1.31 -2.41 116.94 116.51 2f1d h PHE 179 Ca -0.19 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.37 2f1d h PHE 179 Cb 1.93 -0.02 -0.07 0.00 2.79 0.00 0.00 35.95 40.58 2f1d h PHE 179 CO 0.01 0.34 -0.08 0.00 -2.23 0.00 0.00 178.31 176.35 2f1d h ALA 180 N 0.74 0.26 0.00 2.41 0.00 -1.54 0.06 119.26 121.19 2f1d h ALA 180 Ca 0.01 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2f1d h ALA 180 Cb 0.30 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 2f1d h ALA 180 CO 0.00 -0.45 -0.13 0.00 0.00 0.00 0.00 179.25 178.67 2f1d h ARG 181 N 0.01 0.00 0.14 0.00 3.08 -1.41 -1.38 114.38 114.83 2f1d h ARG 181 Ca 0.18 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.91 2f1d h ARG 181 Cb 0.27 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.32 2f1d h ARG 181 CO -0.37 0.13 -1.61 0.00 -1.07 0.00 0.00 179.97 177.04 2f1d h ALA 182 N 1.87 0.24 -0.26 0.04 0.00 -1.12 -3.12 119.26 116.91 2f1d h ALA 182 Ca -0.00 -1.13 -0.04 0.00 0.00 0.00 0.00 54.91 53.74 2f1d h ALA 182 Cb 0.82 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2f1d h ALA 182 CO 0.02 1.10 -0.02 1.25 0.00 0.00 0.00 179.25 181.60 2f1d h LEU 183 N 0.08 0.36 -0.33 0.00 6.46 -0.42 -1.96 115.31 119.52 2f1d h LEU 183 Ca -0.28 -0.06 -0.18 0.00 -0.12 0.00 0.00 57.88 57.24 2f1d h LEU 183 Cb 2.05 -0.09 -0.00 0.00 -0.73 0.00 0.00 40.66 41.88 2f1d h LEU 183 CO 0.17 0.44 -0.52 -0.09 -0.62 0.00 0.00 178.44 177.82 2f1d h ARG 184 N 0.38 0.88 -0.94 1.25 2.43 -1.37 -2.37 114.38 114.63 2f1d h ARG 184 Ca 0.08 -0.54 0.04 0.00 -0.81 0.00 0.00 59.98 58.76 2f1d h ARG 184 Cb 0.29 0.06 -0.06 0.00 -0.42 0.00 0.00 29.97 29.84 2f1d h ARG 184 CO 0.01 1.18 0.62 0.37 -1.51 0.00 0.00 179.97 180.63 2f1d h GLN 185 N 0.68 1.14 0.15 0.20 4.15 -1.30 -1.51 115.11 118.62 2f1d h GLN 185 Ca 0.02 -0.07 -0.29 0.00 0.77 0.00 0.00 58.65 59.09 2f1d h GLN 185 Cb 1.12 -0.26 0.02 0.00 0.21 0.00 0.00 27.48 28.57 2f1d h GLN 185 CO 0.12 0.76 -1.27 0.00 -1.93 0.00 0.00 178.83 176.50 2f1d h ALA 186 N 1.45 0.05 0.00 3.38 0.00 -1.32 -3.27 119.26 119.55 2f1d h ALA 186 Ca 0.38 -0.84 -0.17 0.00 0.00 0.00 0.00 54.91 54.28 2f1d h ALA 186 Cb 0.03 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2f1d h ALA 186 CO -0.12 0.85 -0.79 1.79 0.00 0.00 0.00 179.25 180.98 2f1d h THR 187 N 0.14 1.52 -3.94 0.00 1.35 -1.32 -2.34 112.91 108.31 2f1d h THR 187 Ca -0.17 -2.74 -0.49 0.00 -0.55 0.00 0.00 66.41 62.46 2f1d h THR 187 Cb 1.97 2.50 0.20 0.00 -1.73 0.00 0.00 68.15 71.09 2f1d h THR 187 CO 0.22 0.77 0.15 -1.61 -0.25 0.00 0.00 175.52 174.81 2f1d s GLU 188 N -3.13 0.36 -0.06 4.72 2.02 -0.58 -4.77 118.70 117.27 2f1d s GLU 188 Ca 0.00 1.34 -0.13 0.00 0.02 0.00 0.00 54.97 56.20 2f1d s GLU 188 Cb 0.11 -1.67 -0.05 0.00 0.10 0.00 0.00 34.13 32.62 2f1d s GLU 188 CO 0.79 -3.01 0.33 0.95 0.02 0.00 0.00 175.26 174.34 2f1d s THR 189 N -2.58 5.19 -0.25 3.63 -4.23 -1.26 -2.66 115.64 113.47 2f1d s THR 189 Ca 0.67 0.66 -0.13 0.00 -1.18 0.00 0.00 61.69 61.71 2f1d s THR 189 Cb -0.24 -3.64 -0.04 0.00 1.34 0.00 0.00 72.50 69.92 2f1d s THR 189 CO 0.60 0.54 0.30 -0.62 -0.54 0.00 0.00 174.62 174.91 2f1d s ASP 190 N -0.72 6.21 -0.83 3.99 2.15 -0.53 -4.86 116.67 122.09 2f1d s ASP 190 Ca 0.21 0.23 -0.21 0.00 0.43 0.00 0.00 52.55 53.21 2f1d s ASP 190 Cb -0.15 -2.18 -0.19 0.00 -0.30 0.00 0.00 42.92 40.11 2f1d s ASP 190 CO 0.10 -0.09 2.18 -2.65 -0.17 0.00 0.00 175.17 174.53 2f1d n PRO 191 N 4.94 0.30 0.00 4.34 -0.02 -1.26 -4.82 135.00 138.49 2f1d n PRO 191 Ca -0.11 -0.83 0.14 0.00 -2.02 0.00 0.00 63.50 60.68 2f1d n PRO 191 Cb 0.51 -3.06 0.58 0.00 -0.02 0.00 0.00 33.50 31.52 2f1d n PRO 191 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02