#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1frq s SER 20 N 0.00 3.44 0.00 0.41 0.15 -1.26 -4.96 113.70 111.49 1frq s SER 20 Ca 0.00 -0.66 0.23 0.00 0.70 0.00 0.00 55.95 56.22 1frq s SER 20 Cb 0.00 -0.32 0.21 0.00 -1.71 0.00 0.00 66.02 64.20 1frq s SER 20 CO 0.00 0.20 1.21 0.29 1.20 0.00 0.00 173.24 176.14 1frq n LYS 21 N 1.07 0.00 -3.92 5.44 5.02 -1.26 -4.93 118.16 119.58 1frq n LYS 21 Ca -0.17 -0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 55.91 1frq n LYS 21 Cb 0.53 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.00 1frq n LYS 21 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1frq s LYS 22 N -3.00 3.01 -1.28 1.97 1.02 -1.26 0.13 119.74 120.33 1frq s LYS 22 Ca 0.10 -1.05 -0.14 0.00 0.02 0.00 0.00 55.97 54.90 1frq s LYS 22 Cb 0.17 -2.65 -0.04 0.00 -0.52 0.00 0.00 37.83 34.79 1frq s LYS 22 CO 0.77 0.28 2.28 -1.33 -0.92 0.00 0.00 175.35 176.44 1frq n MET 23 N -1.34 2.62 0.08 1.68 2.81 0.15 -4.58 117.12 118.54 1frq n MET 23 Ca -0.06 -2.24 0.07 0.00 -1.81 0.00 0.00 57.70 53.66 1frq n MET 23 Cb 0.58 -3.03 -0.03 0.00 -0.71 0.00 0.00 33.22 30.03 1frq n MET 23 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1frq h GLU 24 N 6.29 0.00 -6.39 0.03 5.08 -1.94 -3.46 114.58 114.18 1frq h GLU 24 Ca 0.59 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 58.41 1frq h GLU 24 Cb 0.53 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.79 1frq h GLU 24 CO 1.85 0.12 0.99 -1.21 -1.00 0.00 0.00 179.01 179.76 1frq s GLU 25 N -3.18 4.21 -0.61 2.33 8.01 -1.26 -2.98 118.70 125.21 1frq s GLU 25 Ca -0.01 2.24 0.00 0.00 0.01 0.00 0.00 54.97 57.21 1frq s GLU 25 Cb 0.09 -3.69 0.00 0.00 -4.31 0.00 0.00 34.13 26.22 1frq s GLU 25 CO 0.79 -0.74 0.00 0.41 0.01 0.00 0.00 175.26 175.74 1frq n GLY 26 N 3.97 0.55 3.86 -1.39 0.00 -1.26 -5.04 105.19 105.88 1frq n GLY 26 Ca 0.16 -0.71 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 1frq n GLY 26 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1frq s ILE 27 N -2.27 4.10 -0.09 -0.61 -4.36 -1.16 -5.06 121.20 111.75 1frq s ILE 27 Ca 0.00 0.68 0.03 0.00 -0.26 0.00 0.00 60.65 61.10 1frq s ILE 27 Cb 0.00 -3.61 -0.01 0.00 1.25 0.00 0.00 42.46 40.09 1frq s ILE 27 CO 0.00 -0.89 -0.20 -0.89 0.24 0.00 0.00 174.94 173.20 1frq s THR 28 N -3.21 2.48 -0.06 8.37 2.01 -1.26 -5.10 115.64 118.87 1frq s THR 28 Ca 0.57 -0.88 0.00 0.00 0.31 0.00 0.00 61.69 61.69 1frq s THR 28 Cb -0.12 -1.97 0.02 0.00 0.01 0.00 0.00 72.50 70.44 1frq s THR 28 CO 0.54 0.55 -0.04 -0.69 -0.69 0.00 0.00 174.62 174.29 1frq s VAL 29 N 0.12 0.56 -1.41 3.82 1.01 -1.26 -4.34 120.40 118.90 1frq s VAL 29 Ca -0.10 -0.09 -0.07 0.00 0.00 0.00 0.00 61.98 61.72 1frq s VAL 29 Cb -0.16 -0.61 0.04 0.00 0.00 0.00 0.00 36.38 35.65 1frq s VAL 29 CO 0.06 0.25 0.92 0.59 0.00 0.00 0.00 175.10 176.92 1frq n ASN 30 N 4.37 -3.62 -0.15 3.32 5.03 0.18 -4.85 115.26 119.56 1frq n ASN 30 Ca -0.19 -0.74 -0.09 0.00 0.87 0.00 0.00 54.58 54.42 1frq n ASN 30 Cb 0.51 -4.21 -0.00 0.00 -1.02 0.00 0.00 39.78 35.05 1frq n ASN 30 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 1frq h LYS 31 N -2.10 0.64 -5.96 3.52 3.64 -1.65 -3.42 116.57 111.24 1frq h LYS 31 Ca -0.59 -0.11 -0.68 0.00 -1.27 0.00 0.00 60.65 58.00 1frq h LYS 31 Cb 1.37 -0.10 -0.17 0.00 -0.41 0.00 0.00 32.23 32.92 1frq h LYS 31 CO 0.61 0.58 -0.64 -0.06 -2.27 0.00 0.00 179.45 177.67 1frq s PHE 32 N -5.57 3.09 0.35 1.91 0.08 -0.90 -5.00 117.98 111.94 1frq s PHE 32 Ca -0.13 0.11 0.07 0.00 0.12 0.00 0.00 56.93 57.09 1frq s PHE 32 Cb 0.11 -1.78 -0.07 0.00 -0.57 0.00 0.00 43.02 40.70 1frq s PHE 32 CO 0.76 0.39 -0.01 0.15 -0.10 0.00 0.00 175.22 176.40 1frq s LYS 33 N -0.75 1.77 0.35 0.44 1.02 -1.12 -1.60 119.74 119.85 1frq s LYS 33 Ca 0.11 -1.96 0.10 0.00 0.02 0.00 0.00 55.97 54.25 1frq s LYS 33 Cb -0.11 -1.36 0.85 0.00 -0.52 0.00 0.00 37.83 36.68 1frq s LYS 33 CO 0.02 -0.03 1.84 -1.35 -0.92 0.00 0.00 175.35 174.91 1frq h PRO 34 N 2.01 0.64 0.00 -1.68 0.11 -1.98 -0.18 132.00 130.92 1frq h PRO 34 Ca -0.42 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1frq h PRO 34 Cb 1.24 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1frq h PRO 34 CO 0.73 0.42 0.00 0.87 -0.21 0.00 0.00 178.00 179.82 1frq h LYS 35 N 0.66 0.00 -1.18 1.05 1.57 -2.01 -3.35 116.57 113.31 1frq h LYS 35 Ca 0.50 0.00 -0.42 0.00 -1.87 0.00 0.00 60.65 58.86 1frq h LYS 35 Cb 0.88 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 32.90 1frq h LYS 35 CO -0.25 0.00 -0.86 0.25 -0.57 0.00 0.00 179.45 178.02 1frq n THR 36 N -2.82 -0.40 -1.63 -0.16 -2.24 -0.23 -5.14 114.28 101.67 1frq n THR 36 Ca 0.03 -2.99 -0.30 0.00 -2.27 0.00 0.00 64.05 58.52 1frq n THR 36 Cb 0.38 -0.50 0.09 0.00 -2.10 0.00 0.00 70.33 68.21 1frq n THR 36 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1frq s PRO 37 N -0.44 2.01 -0.06 -0.78 0.04 -0.35 -2.79 135.00 132.63 1frq s PRO 37 Ca 0.34 0.49 -0.14 0.00 0.04 0.00 0.00 61.00 61.73 1frq s PRO 37 Cb 0.20 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.77 1frq s PRO 37 CO -0.16 -1.64 0.37 -0.47 0.04 0.00 0.00 177.00 175.13 1frq s TYR 38 N -3.25 3.64 -0.31 0.56 5.04 0.57 -4.86 117.35 118.73 1frq s TYR 38 Ca 0.61 0.86 -0.09 0.00 -2.44 0.00 0.00 57.07 56.01 1frq s TYR 38 Cb -0.14 -2.29 -0.00 0.00 0.35 0.00 0.00 41.96 39.88 1frq s TYR 38 CO 0.53 0.52 0.14 0.08 -1.34 0.00 0.00 175.55 175.48 1frq s VAL 39 N -0.57 4.45 0.54 3.14 1.01 -1.26 0.14 120.40 127.85 1frq s VAL 39 Ca 0.22 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 61.74 1frq s VAL 39 Cb -0.15 -3.29 0.03 0.00 0.00 0.00 0.00 36.38 32.97 1frq s VAL 39 CO 0.10 0.06 0.30 -0.83 0.00 0.00 0.00 175.10 174.73 1frq s GLY 40 N 1.58 2.56 0.08 4.51 0.00 0.36 -4.87 107.32 111.54 1frq s GLY 40 Ca 0.04 -0.98 0.08 0.00 0.00 0.00 0.00 44.72 43.85 1frq s GLY 40 CO 0.05 -2.01 -0.20 0.50 0.00 0.00 0.00 173.10 171.44 1frq s ARG 41 N -4.18 1.18 -0.00 2.90 0.52 -1.21 0.18 118.95 118.35 1frq s ARG 41 Ca 0.26 -1.06 -0.30 0.00 -0.52 0.00 0.00 55.73 54.10 1frq s ARG 41 Cb -0.01 -1.38 -0.03 0.00 0.52 0.00 0.00 34.95 34.05 1frq s ARG 41 CO 0.16 0.33 1.00 0.00 0.02 0.00 0.00 175.30 176.81 1frq n LEU 43 N 3.98 1.90 -3.96 0.00 4.77 0.39 0.82 117.00 124.90 1frq n LEU 43 Ca 0.06 0.39 -0.09 0.00 -0.03 0.00 0.00 56.01 56.34 1frq n LEU 43 Cb 0.50 -0.90 -0.11 0.00 -2.33 0.00 0.00 43.42 40.59 1frq n LEU 43 CO 0.52 0.36 -0.32 -0.76 -1.33 0.00 0.00 177.39 175.86 1frq s LEU 44 N -7.74 2.10 -0.21 2.23 1.02 -1.19 -4.68 118.68 110.21 1frq s LEU 44 Ca -0.33 -0.45 -0.04 0.00 0.02 0.00 0.00 54.13 53.34 1frq s LEU 44 Cb 0.09 0.23 0.10 0.00 0.02 0.00 0.00 46.19 46.63 1frq s LEU 44 CO 0.53 -0.32 0.29 0.21 0.02 0.00 0.00 176.35 177.08 1frq s ASN 45 N -1.47 0.77 -0.03 2.29 2.47 -1.26 -0.89 114.94 116.82 1frq s ASN 45 Ca -0.15 0.10 0.05 0.00 0.42 0.00 0.00 52.86 53.28 1frq s ASN 45 Cb -0.09 0.72 -0.01 0.00 -1.45 0.00 0.00 41.25 40.42 1frq s ASN 45 CO -0.01 -0.30 -0.19 -0.89 -3.72 0.00 0.00 177.10 171.99 1frq s THR 46 N 2.43 1.53 -0.13 -5.21 2.01 -0.76 -5.00 115.64 110.51 1frq s THR 46 Ca 0.08 -0.80 -0.29 0.00 0.31 0.00 0.00 61.69 60.98 1frq s THR 46 Cb -0.15 -1.29 -0.01 0.00 0.01 0.00 0.00 72.50 71.07 1frq s THR 46 CO -0.13 0.43 1.02 -0.75 -0.69 0.00 0.00 174.62 174.50 1frq s LYS 47 N -0.25 4.39 0.00 4.92 2.20 -1.26 -1.02 119.74 128.71 1frq s LYS 47 Ca 0.03 1.39 0.14 0.00 -0.36 0.00 0.00 55.97 57.16 1frq s LYS 47 Cb -0.09 -3.56 0.26 0.00 -1.51 0.00 0.00 37.83 32.92 1frq s LYS 47 CO 0.01 -0.39 1.14 0.44 -0.36 0.00 0.00 175.35 176.19 1frq n ILE 48 N 4.72 0.50 -4.08 5.43 -5.35 0.15 -4.94 119.36 115.79 1frq n ILE 48 Ca 0.09 -0.75 -0.28 0.00 -0.27 0.00 0.00 62.75 61.54 1frq n ILE 48 Cb 0.48 0.90 -0.06 0.00 -1.74 0.00 0.00 39.64 39.22 1frq n ILE 48 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1frq s THR 49 N -1.10 4.41 0.87 7.28 -4.23 -1.23 -4.88 115.64 116.77 1frq s THR 49 Ca 0.23 -0.95 -0.14 0.00 -1.18 0.00 0.00 61.69 59.65 1frq s THR 49 Cb 0.14 -3.18 0.13 0.00 1.34 0.00 0.00 72.50 70.93 1frq s THR 49 CO 0.19 0.02 1.24 -0.83 -0.54 0.00 0.00 174.62 174.70 1frq s GLY 50 N -2.70 1.68 0.47 3.99 0.00 -0.20 -4.92 107.32 105.64 1frq s GLY 50 Ca 0.29 -0.90 0.16 0.00 0.00 0.00 0.00 44.72 44.27 1frq s GLY 50 CO 0.22 -0.29 2.04 -0.55 0.00 0.00 0.00 173.10 174.52 1frq h ASP 51 N -1.30 0.00 0.24 1.64 3.32 -1.98 -2.84 116.42 115.49 1frq h ASP 51 Ca -0.45 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.59 1frq h ASP 51 Cb 1.29 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.83 1frq h ASP 51 CO 0.54 0.13 -0.25 -0.78 -1.72 0.00 0.00 179.24 177.16 1frq h ASP 52 N 0.00 -0.68 0.00 6.45 1.82 -1.93 -3.46 116.42 118.62 1frq h ASP 52 Ca -0.00 0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.69 1frq h ASP 52 Cb 0.24 0.23 0.00 0.00 0.68 0.00 0.00 39.33 40.47 1frq h ASP 52 CO 0.02 -0.33 0.00 0.00 -1.61 0.00 0.00 179.24 177.32 1frq n ALA 53 N -2.53 -0.33 -2.39 -0.78 0.00 -1.08 -4.77 120.51 108.63 1frq n ALA 53 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 52.99 1frq n ALA 53 Cb 0.23 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.64 1frq n ALA 53 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1frq s PRO 54 N 0.00 3.06 0.00 0.00 0.04 -1.26 -4.73 135.00 132.11 1frq s PRO 54 Ca 0.00 -0.14 0.00 0.00 0.04 0.00 0.00 61.00 60.90 1frq s PRO 54 Cb 0.00 -4.44 0.00 0.00 0.04 0.00 0.00 34.50 30.10 1frq s PRO 54 CO 0.00 -2.38 0.00 0.41 0.04 0.00 0.00 177.00 175.07 1frq n GLY 55 N 5.75 1.17 3.92 0.56 0.00 -1.26 -5.04 105.19 110.30 1frq n GLY 55 Ca 0.14 -1.57 -0.30 0.00 0.00 0.00 0.00 46.02 44.29 1frq n GLY 55 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1frq s GLU 56 N -4.62 3.47 -0.03 1.61 2.02 -1.26 -4.96 118.70 114.92 1frq s GLU 56 Ca 0.00 -0.42 0.02 0.00 0.02 0.00 0.00 54.97 54.59 1frq s GLU 56 Cb 0.00 -2.98 0.01 0.00 0.10 0.00 0.00 34.13 31.26 1frq s GLU 56 CO 0.00 0.56 -0.07 0.99 0.02 0.00 0.00 175.26 176.76 1frq s THR 57 N -1.61 0.65 0.05 3.63 2.01 -1.26 -1.06 115.64 118.05 1frq s THR 57 Ca 0.36 -0.26 0.08 0.00 0.31 0.00 0.00 61.69 62.18 1frq s THR 57 Cb -0.12 -0.60 -0.03 0.00 0.01 0.00 0.00 72.50 71.76 1frq s THR 57 CO 0.28 0.22 -0.23 0.26 -0.69 0.00 0.00 174.62 174.45 1frq s TRP 58 N 0.40 2.04 -0.21 4.92 0.52 0.58 -0.67 118.94 126.52 1frq s TRP 58 Ca -0.06 -0.39 -0.05 0.00 0.02 0.00 0.00 56.10 55.62 1frq s TRP 58 Cb -0.10 -1.21 -0.02 0.00 -1.15 0.00 0.00 33.47 30.99 1frq s TRP 58 CO 0.00 0.12 -0.01 -1.58 0.02 0.00 0.00 176.95 175.50 1frq s HIS 59 N -0.82 3.01 0.03 -1.98 2.46 -0.19 -0.56 115.29 117.24 1frq s HIS 59 Ca 0.09 -0.61 0.04 0.00 0.47 0.00 0.00 55.06 55.05 1frq s HIS 59 Cb -0.09 -2.09 -0.02 0.00 -0.13 0.00 0.00 32.58 30.25 1frq s HIS 59 CO 0.02 -0.34 -0.11 0.00 -2.47 0.00 0.00 174.74 171.84 1frq s MET 60 N 1.17 0.74 -0.10 2.88 0.23 -0.04 -1.83 119.30 122.35 1frq s MET 60 Ca 0.03 -0.63 0.03 0.00 -1.03 0.00 0.00 55.69 54.08 1frq s MET 60 Cb -0.14 -0.69 -0.01 0.00 -1.53 0.00 0.00 34.83 32.46 1frq s MET 60 CO 0.01 0.17 -0.19 0.08 -2.03 0.00 0.00 175.02 173.06 1frq s VAL 61 N -0.81 2.57 0.13 5.16 1.01 -0.07 -0.96 120.40 127.43 1frq s VAL 61 Ca -0.01 -0.85 0.10 0.00 0.00 0.00 0.00 61.98 61.22 1frq s VAL 61 Cb -0.07 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 1frq s VAL 61 CO 0.01 0.55 -0.21 -0.36 0.00 0.00 0.00 175.10 175.09 1frq s PHE 62 N 0.14 2.45 0.14 5.22 0.08 0.13 -0.46 117.98 125.69 1frq s PHE 62 Ca -0.10 -0.30 -0.23 0.00 0.12 0.00 0.00 56.93 56.42 1frq s PHE 62 Cb -0.16 -1.30 -0.08 0.00 -0.57 0.00 0.00 43.02 40.92 1frq s PHE 62 CO 0.06 0.38 0.71 0.45 -0.10 0.00 0.00 175.22 176.72 1frq s SER 63 N -2.18 7.27 0.00 1.36 0.15 0.33 -1.21 113.70 119.42 1frq s SER 63 Ca 0.17 1.51 0.00 0.00 0.70 0.00 0.00 55.95 58.33 1frq s SER 63 Cb -0.10 -2.45 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 1frq s SER 63 CO 0.09 0.22 0.12 0.00 1.20 0.00 0.00 173.24 174.87 1frq n HIS 64 N 1.59 0.00 -2.77 3.44 1.44 -0.27 -3.33 115.22 115.33 1frq n HIS 64 Ca -0.07 -0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.50 1frq n HIS 64 Cb 0.49 -0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.60 1frq n HIS 64 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1frq n GLU 65 N -0.00 -2.69 -1.14 -1.40 -0.58 -0.95 -0.41 120.64 113.47 1frq n GLU 65 Ca 0.00 0.43 -0.05 0.00 -0.42 0.00 0.00 57.16 57.12 1frq n GLU 65 Cb 0.28 -5.03 -0.02 0.00 -0.57 0.00 0.00 31.44 26.10 1frq n GLU 65 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1frq n GLY 66 N -0.85 0.74 0.12 0.62 0.00 -1.25 -4.89 105.19 99.69 1frq n GLY 66 Ca -0.07 -0.59 0.03 0.00 0.00 0.00 0.00 46.02 45.39 1frq n GLY 66 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1frq h GLU 67 N 0.17 0.00 -4.12 1.61 4.39 -1.05 -3.40 114.58 112.17 1frq h GLU 67 Ca -0.10 0.00 -0.74 0.00 0.34 0.00 0.00 59.36 58.86 1frq h GLU 67 Cb 0.38 0.00 -0.29 0.00 -0.10 0.00 0.00 28.75 28.75 1frq h GLU 67 CO 0.14 0.35 -0.29 0.42 -1.16 0.00 0.00 179.01 178.47 1frq s ILE 68 N -2.99 4.54 -1.44 3.13 1.01 -1.26 -4.99 121.20 119.20 1frq s ILE 68 Ca 0.01 -1.95 -0.13 0.00 0.00 0.00 0.00 60.65 58.58 1frq s ILE 68 Cb 0.08 -3.94 0.06 0.00 0.01 0.00 0.00 42.46 38.66 1frq s ILE 68 CO 0.77 -0.84 2.20 -0.81 0.00 0.00 0.00 174.94 176.26 1frq n PRO 69 N 4.70 3.01 -1.92 2.79 -0.04 -1.26 -4.97 135.00 137.32 1frq n PRO 69 Ca -0.05 -2.74 -0.30 0.00 -0.04 0.00 0.00 63.50 60.38 1frq n PRO 69 Cb 0.41 -3.21 0.05 0.00 -0.04 0.00 0.00 33.50 30.71 1frq n PRO 69 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1frq s TYR 70 N 2.68 3.29 0.16 0.54 -0.85 -1.26 -4.44 117.35 117.47 1frq s TYR 70 Ca 0.47 1.00 0.08 0.00 -0.52 0.00 0.00 57.07 58.10 1frq s TYR 70 Cb 0.13 -3.08 -0.04 0.00 0.38 0.00 0.00 41.96 39.35 1frq s TYR 70 CO -0.07 -1.20 -0.18 0.50 -1.52 0.00 0.00 175.55 173.07 1frq s ARG 71 N -5.35 1.26 0.26 -3.49 3.52 -1.26 -4.68 118.95 109.21 1frq s ARG 71 Ca 0.58 -1.39 -0.30 0.00 -0.13 0.00 0.00 55.73 54.49 1frq s ARG 71 Cb -0.11 -1.34 -0.13 0.00 -1.56 0.00 0.00 34.95 31.81 1frq s ARG 71 CO 0.51 0.27 1.31 0.39 -0.81 0.00 0.00 175.30 176.97 1frq n GLU 72 N 0.36 1.89 0.00 5.12 4.71 -1.26 -1.98 120.64 129.48 1frq n GLU 72 Ca -0.14 0.67 0.00 0.00 -0.01 0.00 0.00 57.16 57.68 1frq n GLU 72 Cb 0.57 -2.26 0.00 0.00 -1.01 0.00 0.00 31.44 28.74 1frq n GLU 72 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1frq n GLY 73 N 1.68 2.00 3.94 0.62 0.00 -1.26 -4.27 105.19 107.91 1frq n GLY 73 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 1frq n GLY 73 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1frq s GLN 74 N -0.87 1.65 0.28 1.61 -0.21 -0.84 -4.36 119.66 116.92 1frq s GLN 74 Ca 0.00 -0.49 0.07 0.00 0.02 0.00 0.00 55.36 54.96 1frq s GLN 74 Cb 0.00 -2.11 -0.06 0.00 1.00 0.00 0.00 33.01 31.84 1frq s GLN 74 CO 0.00 -1.61 -0.05 -1.12 -2.12 0.00 0.00 175.29 170.38 1frq s SER 75 N -4.67 2.78 0.13 5.90 0.01 -0.49 -1.31 113.70 116.04 1frq s SER 75 Ca 0.65 -1.20 0.08 0.00 1.31 0.00 0.00 55.95 56.79 1frq s SER 75 Cb -0.08 -0.17 -0.04 0.00 0.21 0.00 0.00 66.02 65.95 1frq s SER 75 CO 0.47 -0.35 -0.19 0.68 0.41 0.00 0.00 173.24 174.26 1frq s VAL 76 N -3.01 1.67 -0.07 3.43 -7.23 -0.67 -0.51 120.40 114.01 1frq s VAL 76 Ca 0.30 -1.70 -0.05 0.00 -1.81 0.00 0.00 61.98 58.72 1frq s VAL 76 Cb 0.04 -1.64 -0.04 0.00 0.56 0.00 0.00 36.38 35.30 1frq s VAL 76 CO 0.12 -0.22 0.15 -0.83 -0.31 0.00 0.00 175.10 174.02 1frq s GLY 77 N -2.27 2.16 -0.13 2.32 0.00 -0.19 -1.44 107.32 107.76 1frq s GLY 77 Ca 0.10 -0.70 0.02 0.00 0.00 0.00 0.00 44.72 44.13 1frq s GLY 77 CO 0.05 -0.51 -0.19 0.14 0.00 0.00 0.00 173.10 172.59 1frq s VAL 78 N -1.15 2.42 -0.49 1.40 1.01 0.92 -0.78 120.40 123.72 1frq s VAL 78 Ca 0.20 -0.87 -0.13 0.00 0.00 0.00 0.00 61.98 61.18 1frq s VAL 78 Cb -0.12 -1.98 0.11 0.00 0.00 0.00 0.00 36.38 34.38 1frq s VAL 78 CO 0.10 0.54 0.41 -0.63 0.00 0.00 0.00 175.10 175.52 1frq s ILE 79 N 0.63 4.79 0.53 2.22 1.01 -1.00 -1.18 121.20 128.21 1frq s ILE 79 Ca -0.10 -1.49 -0.21 0.00 0.00 0.00 0.00 60.65 58.85 1frq s ILE 79 Cb -0.16 -4.04 -0.06 0.00 0.01 0.00 0.00 42.46 38.21 1frq s ILE 79 CO 0.03 -0.74 1.20 -2.16 0.00 0.00 0.00 174.94 173.26 1frq s PRO 80 N 1.51 3.34 0.60 2.79 0.04 -1.26 -4.38 135.00 137.64 1frq s PRO 80 Ca 0.04 1.81 -0.19 0.00 0.04 0.00 0.00 61.00 62.70 1frq s PRO 80 Cb -0.27 -2.15 -0.03 0.00 0.04 0.00 0.00 34.50 32.10 1frq s PRO 80 CO 0.02 -0.91 1.29 -0.51 0.04 0.00 0.00 177.00 176.94 1frq s ASP 81 N -1.47 4.99 0.00 6.66 1.01 -1.26 -4.48 116.67 122.11 1frq s ASP 81 Ca 0.71 2.61 0.00 0.00 0.71 0.00 0.00 52.55 56.58 1frq s ASP 81 Cb -0.30 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.01 1frq s ASP 81 CO 0.34 -1.75 0.00 0.61 0.21 0.00 0.00 175.17 174.58 1frq n GLY 82 N 0.75 -1.20 3.32 0.21 0.00 -1.26 -4.97 105.19 102.04 1frq n GLY 82 Ca 0.13 -2.22 -0.19 0.00 0.00 0.00 0.00 46.02 43.74 1frq n GLY 82 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1frq s GLU 83 N -0.64 1.24 1.03 1.61 2.02 -1.26 -3.75 118.70 118.95 1frq s GLU 83 Ca 0.00 -1.46 -0.17 0.00 0.02 0.00 0.00 54.97 53.36 1frq s GLU 83 Cb 0.00 -1.11 0.22 0.00 0.10 0.00 0.00 34.13 33.35 1frq s GLU 83 CO 0.00 0.20 1.26 0.16 0.02 0.00 0.00 175.26 176.90 1frq s ASP 84 N -2.96 2.50 0.12 -0.19 1.47 0.25 -4.81 116.67 113.06 1frq s ASP 84 Ca 0.18 0.37 0.07 0.00 1.18 0.00 0.00 52.55 54.34 1frq s ASP 84 Cb -0.03 -0.47 0.36 0.00 -0.34 0.00 0.00 42.92 42.44 1frq s ASP 84 CO 0.06 -3.13 1.11 2.29 0.68 0.00 0.00 175.17 176.18 1frq n LYS 85 N -4.05 0.04 -0.72 2.11 2.85 -1.26 -0.39 118.16 116.75 1frq n LYS 85 Ca 0.15 0.47 0.03 0.00 -1.05 0.00 0.00 58.31 57.90 1frq n LYS 85 Cb 0.59 -1.77 0.28 0.00 -0.65 0.00 0.00 35.03 33.49 1frq n LYS 85 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1frq n ASN 86 N -1.68 4.19 0.00 -5.58 3.02 -1.26 -4.95 115.26 109.00 1frq n ASN 86 Ca -0.00 -3.18 0.00 0.00 -0.03 0.00 0.00 54.58 51.37 1frq n ASN 86 Cb 0.14 -0.63 0.00 0.00 -0.61 0.00 0.00 39.78 38.68 1frq n ASN 86 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1frq n GLY 87 N -0.36 0.48 3.91 7.41 0.00 0.48 -4.99 105.19 112.13 1frq n GLY 87 Ca 0.29 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.04 1frq n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1frq s LYS 88 N -0.52 3.61 0.44 1.61 1.02 -1.26 -4.75 119.74 119.89 1frq s LYS 88 Ca 0.00 0.04 -0.25 0.00 0.02 0.00 0.00 55.97 55.78 1frq s LYS 88 Cb 0.00 -2.57 -0.08 0.00 -0.52 0.00 0.00 37.83 34.66 1frq s LYS 88 CO 0.00 0.10 1.35 -2.14 -0.92 0.00 0.00 175.35 173.74 1frq s PRO 89 N -3.91 3.76 0.71 -1.68 0.02 -1.26 0.87 135.00 133.51 1frq s PRO 89 Ca 0.45 2.25 -0.16 0.00 0.02 0.00 0.00 61.00 63.55 1frq s PRO 89 Cb -0.10 -2.65 0.01 0.00 0.02 0.00 0.00 34.50 31.78 1frq s PRO 89 CO 0.34 -0.69 1.11 0.72 -0.33 0.00 0.00 177.00 178.15 1frq n HIS 90 N -0.15 1.18 -2.09 6.54 8.25 -1.25 -4.62 115.22 123.08 1frq n HIS 90 Ca 0.05 0.41 -0.35 0.00 -0.26 0.00 0.00 57.72 57.57 1frq n HIS 90 Cb 0.43 -2.15 0.02 0.00 1.12 0.00 0.00 29.99 29.42 1frq n HIS 90 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1frq s LYS 91 N -3.47 3.14 0.51 -0.41 -0.14 -1.26 -4.78 119.74 113.33 1frq s LYS 91 Ca 0.76 1.63 -0.18 0.00 -1.36 0.00 0.00 55.97 56.82 1frq s LYS 91 Cb -0.35 -1.97 -0.08 0.00 -1.68 0.00 0.00 37.83 33.75 1frq s LYS 91 CO 0.47 -1.03 1.01 -0.48 -0.76 0.00 0.00 175.35 174.56 1frq s LEU 92 N -4.08 3.71 0.05 3.17 0.05 -1.26 -4.61 118.68 115.70 1frq s LEU 92 Ca 0.73 1.74 0.09 0.00 0.05 0.00 0.00 54.13 56.74 1frq s LEU 92 Cb -0.25 -4.53 -0.03 0.00 -2.05 0.00 0.00 46.19 39.33 1frq s LEU 92 CO 0.31 -0.73 -0.24 -0.13 -0.55 0.00 0.00 176.35 175.01 1frq s ARG 93 N -3.70 1.85 -0.06 1.48 3.00 -0.33 -4.93 118.95 116.27 1frq s ARG 93 Ca 0.63 -1.09 -0.07 0.00 0.00 0.00 0.00 55.73 55.20 1frq s ARG 93 Cb -0.13 -2.03 -0.04 0.00 0.00 0.00 0.00 34.95 32.75 1frq s ARG 93 CO 0.26 0.52 0.21 -0.51 0.00 0.00 0.00 175.30 175.78 1frq s LEU 94 N -1.32 4.39 -0.05 2.53 1.43 -1.26 -0.06 118.68 124.34 1frq s LEU 94 Ca 0.13 0.53 0.01 0.00 -1.03 0.00 0.00 54.13 53.77 1frq s LEU 94 Cb -0.10 -2.37 0.02 0.00 0.03 0.00 0.00 46.19 43.77 1frq s LEU 94 CO 0.03 0.34 -0.05 -0.31 0.23 0.00 0.00 176.35 176.59 1frq s TYR 95 N -1.15 0.83 0.44 0.29 2.02 -0.52 -4.99 117.35 114.26 1frq s TYR 95 Ca 0.21 -0.25 -0.25 0.00 -0.37 0.00 0.00 57.07 56.41 1frq s TYR 95 Cb -0.13 -0.74 -0.08 0.00 -0.40 0.00 0.00 41.96 40.61 1frq s TYR 95 CO 0.10 -0.22 1.28 -1.12 -1.57 0.00 0.00 175.55 174.02 1frq s SER 96 N 1.03 6.14 0.10 2.29 0.01 -1.26 -1.66 113.70 120.34 1frq s SER 96 Ca -0.09 2.59 -0.30 0.00 1.31 0.00 0.00 55.95 59.46 1frq s SER 96 Cb -0.14 -2.63 -0.06 0.00 0.21 0.00 0.00 66.02 63.40 1frq s SER 96 CO -0.00 -0.96 1.15 -0.63 0.41 0.00 0.00 173.24 173.20 1frq s ILE 97 N -1.33 4.05 -2.78 1.44 1.01 -0.43 -4.60 121.20 118.56 1frq s ILE 97 Ca 0.60 1.56 0.24 0.00 0.00 0.00 0.00 60.65 63.05 1frq s ILE 97 Cb -0.36 -4.00 0.16 0.00 0.01 0.00 0.00 42.46 38.26 1frq s ILE 97 CO 0.46 0.17 1.24 0.00 0.00 0.00 0.00 174.94 176.81 1frq n ALA 98 N 3.37 2.70 -2.52 9.38 0.00 -0.46 -3.88 120.51 129.10 1frq n ALA 98 Ca 0.06 -0.67 -0.27 0.00 0.00 0.00 0.00 53.44 52.56 1frq n ALA 98 Cb 0.47 -0.82 -0.10 0.00 0.00 0.00 0.00 19.45 19.00 1frq n ALA 98 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1frq s SER 99 N -2.10 3.99 1.02 0.00 1.04 -1.25 -3.70 113.70 112.69 1frq s SER 99 Ca 0.26 -0.65 -0.14 0.00 0.48 0.00 0.00 55.95 55.90 1frq s SER 99 Cb 0.20 -0.57 0.20 0.00 0.10 0.00 0.00 66.02 65.94 1frq s SER 99 CO 0.36 0.12 1.13 -0.94 0.98 0.00 0.00 173.24 174.89 1frq s SER 100 N -2.66 2.53 0.37 7.02 1.04 -1.26 -4.64 113.70 116.09 1frq s SER 100 Ca 0.23 0.90 0.09 0.00 0.48 0.00 0.00 55.95 57.65 1frq s SER 100 Cb -0.09 -1.40 0.84 0.00 0.10 0.00 0.00 66.02 65.47 1frq s SER 100 CO 0.13 -3.16 1.90 0.00 0.98 0.00 0.00 173.24 173.09 1frq h ALA 101 N -1.91 1.85 0.00 5.32 0.00 -1.87 -0.34 119.26 122.30 1frq h ALA 101 Ca -0.50 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.24 1frq h ALA 101 Cb 1.32 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1frq h ALA 101 CO 0.52 -0.06 -0.80 -0.07 0.00 0.00 0.00 179.25 178.84 1frq h LEU 102 N 0.66 0.00 0.00 0.00 3.38 -1.92 -3.40 115.31 114.04 1frq h LEU 102 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 1frq h LEU 102 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1frq h LEU 102 CO -0.17 0.80 0.00 0.61 0.09 0.00 0.00 178.44 179.77 1frq n GLY 103 N 1.17 0.62 0.30 0.83 0.00 -0.14 0.13 105.19 108.10 1frq n GLY 103 Ca 0.00 -1.95 0.18 0.00 0.00 0.00 0.00 46.02 44.25 1frq n GLY 103 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1frq h ASP 104 N 0.00 0.00 -0.28 1.61 3.32 -1.86 -2.17 116.42 117.04 1frq h ASP 104 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1frq h ASP 104 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1frq h ASP 104 CO 0.00 0.04 0.00 0.49 -1.72 0.00 0.00 179.24 178.05 1frq n PHE 105 N -3.32 0.37 -0.95 4.55 3.72 -1.26 -4.99 117.46 115.57 1frq n PHE 105 Ca -0.02 -0.32 0.00 0.00 -0.05 0.00 0.00 57.45 57.06 1frq n PHE 105 Cb 0.18 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 1frq n PHE 105 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1frq n GLY 106 N 0.76 0.31 0.58 1.37 0.00 -0.82 -4.87 105.19 102.52 1frq n GLY 106 Ca 0.12 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.20 1frq n GLY 106 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1frq n ASP 107 N -0.38 2.40 -1.76 1.61 5.68 -0.98 -4.86 116.55 118.27 1frq n ASP 107 Ca 0.00 -1.70 -0.18 0.00 -0.50 0.00 0.00 54.79 52.42 1frq n ASP 107 Cb 0.19 -0.10 -0.04 0.00 -1.14 0.00 0.00 41.12 40.04 1frq n ASP 107 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1frq n ALA 108 N 0.68 -0.42 0.15 2.12 0.00 0.12 -4.89 120.51 118.26 1frq n ALA 108 Ca 0.09 0.20 0.02 0.00 0.00 0.00 0.00 53.44 53.75 1frq n ALA 108 Cb 0.36 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 17.91 1frq n ALA 108 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1frq n LYS 109 N -2.62 2.27 -4.42 0.00 5.02 -1.26 -3.75 118.16 113.40 1frq n LYS 109 Ca -0.20 -0.40 -0.21 0.00 -2.02 0.00 0.00 58.31 55.48 1frq n LYS 109 Cb 0.63 -0.89 -0.10 0.00 -0.02 0.00 0.00 35.03 34.65 1frq n LYS 109 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1frq s SER 110 N -0.72 2.88 -0.01 4.39 1.04 -1.26 -1.11 113.70 118.91 1frq s SER 110 Ca 0.03 -1.12 0.01 0.00 0.48 0.00 0.00 55.95 55.34 1frq s SER 110 Cb 0.03 -0.19 0.00 0.00 0.10 0.00 0.00 66.02 65.96 1frq s SER 110 CO 0.08 -0.24 -0.02 0.54 0.98 0.00 0.00 173.24 174.58 1frq s VAL 111 N -2.91 0.21 0.05 5.02 0.11 -0.35 -4.66 120.40 117.87 1frq s VAL 111 Ca 0.28 -0.08 0.09 0.00 -2.93 0.00 0.00 61.98 59.34 1frq s VAL 111 Cb 0.01 -0.20 -0.03 0.00 -1.53 0.00 0.00 36.38 34.63 1frq s VAL 111 CO 0.11 0.08 -0.23 -0.44 -3.33 0.00 0.00 175.10 171.28 1frq s SER 112 N 0.15 3.42 0.15 3.54 0.01 -1.26 -0.69 113.70 119.02 1frq s SER 112 Ca -0.01 -0.55 0.09 0.00 1.31 0.00 0.00 55.95 56.79 1frq s SER 112 Cb -0.04 -0.40 -0.04 0.00 0.21 0.00 0.00 66.02 65.75 1frq s SER 112 CO -0.00 0.25 -0.19 -0.76 0.41 0.00 0.00 173.24 172.94 1frq s LEU 113 N -1.41 2.40 -0.25 2.44 1.43 -0.14 -1.36 118.68 121.80 1frq s LEU 113 Ca 0.13 -0.82 0.01 0.00 -1.03 0.00 0.00 54.13 52.42 1frq s LEU 113 Cb -0.10 -0.86 0.04 0.00 0.03 0.00 0.00 46.19 45.30 1frq s LEU 113 CO 0.04 -0.01 -0.09 0.00 0.23 0.00 0.00 176.35 176.52 1frq s VAL 115 N 1.22 1.10 -0.07 0.00 1.01 0.28 -4.95 120.40 119.00 1frq s VAL 115 Ca -0.04 -0.44 -0.18 0.00 0.00 0.00 0.00 61.98 61.33 1frq s VAL 115 Cb -0.18 -1.03 -0.05 0.00 0.00 0.00 0.00 36.38 35.12 1frq s VAL 115 CO -0.05 0.35 0.48 -0.75 0.00 0.00 0.00 175.10 175.13 1frq s LYS 116 N 0.87 4.24 -0.16 2.72 2.20 -1.26 -0.31 119.74 128.03 1frq s LYS 116 Ca -0.11 0.49 -0.29 0.00 -0.36 0.00 0.00 55.97 55.70 1frq s LYS 116 Cb -0.15 -3.37 -0.01 0.00 -1.51 0.00 0.00 37.83 32.79 1frq s LYS 116 CO 0.01 0.33 1.27 0.50 -0.36 0.00 0.00 175.35 177.10 1frq s ARG 117 N 0.04 4.23 -0.23 4.03 3.52 -0.22 -4.82 118.95 125.50 1frq s ARG 117 Ca 0.26 1.67 -0.18 0.00 -0.13 0.00 0.00 55.73 57.35 1frq s ARG 117 Cb -0.16 -3.77 -0.03 0.00 -1.56 0.00 0.00 34.95 29.43 1frq s ARG 117 CO 0.12 -0.71 0.53 -1.17 -0.81 0.00 0.00 175.30 173.26 1frq s LEU 118 N 3.50 4.10 -0.04 -0.88 2.96 -1.26 -4.64 118.68 122.42 1frq s LEU 118 Ca 0.55 0.62 -0.01 0.00 -0.22 0.00 0.00 54.13 55.07 1frq s LEU 118 Cb -0.22 -2.70 0.03 0.00 0.50 0.00 0.00 46.19 43.80 1frq s LEU 118 CO 0.15 -0.24 0.01 -0.63 -1.32 0.00 0.00 176.35 174.32 1frq s ILE 119 N 1.98 0.17 0.32 6.68 -1.09 -1.26 -0.07 121.20 127.93 1frq s ILE 119 Ca 0.23 0.18 0.06 0.00 -2.23 0.00 0.00 60.65 58.89 1frq s ILE 119 Cb -0.15 -0.32 -0.02 0.00 -1.58 0.00 0.00 42.46 40.38 1frq s ILE 119 CO 0.09 0.19 0.30 0.00 -1.23 0.00 0.00 174.94 174.30 1frq n TYR 120 N 4.72 -0.88 -5.19 3.97 4.11 0.95 -4.98 117.16 119.86 1frq n TYR 120 Ca -0.15 -2.59 -0.30 0.00 -0.00 0.00 0.00 57.90 54.86 1frq n TYR 120 Cb 0.50 0.32 -0.16 0.00 -0.00 0.00 0.00 39.34 40.00 1frq n TYR 120 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.86 177.81 1frq s THR 121 N -3.19 1.92 0.30 -3.48 -4.23 -1.26 0.17 115.64 105.87 1frq s THR 121 Ca 0.36 -1.01 -0.05 0.00 -1.18 0.00 0.00 61.69 59.82 1frq s THR 121 Cb 0.01 -1.62 0.07 0.00 1.34 0.00 0.00 72.50 72.30 1frq s THR 121 CO 0.26 0.54 0.41 -0.46 -0.54 0.00 0.00 174.62 174.83 1frq n ASN 122 N 2.84 0.08 -0.29 3.99 6.94 0.32 -4.90 115.26 124.24 1frq n ASN 122 Ca -0.17 -1.18 0.01 0.00 -0.02 0.00 0.00 54.58 53.22 1frq n ASN 122 Cb 0.52 -0.31 0.15 0.00 -2.36 0.00 0.00 39.78 37.77 1frq n ASN 122 CO 0.00 0.00 0.00 -2.24 -1.03 0.00 0.00 177.26 173.99 1frq h ASP 123 N -0.51 0.72 0.00 0.53 2.03 -2.01 -2.23 116.42 114.95 1frq h ASP 123 Ca -0.13 0.03 0.00 0.00 -0.73 0.00 0.00 57.03 56.20 1frq h ASP 123 Cb 0.38 -0.11 0.00 0.00 -0.83 0.00 0.00 39.33 38.77 1frq h ASP 123 CO 0.10 0.44 0.00 0.00 -1.03 0.00 0.00 179.24 178.75 1frq n ALA 124 N -2.36 2.32 -0.98 4.15 0.00 -1.26 -4.82 120.51 117.56 1frq n ALA 124 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1frq n ALA 124 Cb 0.22 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1frq n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1frq n GLY 125 N 0.32 0.52 3.77 0.00 0.00 -0.84 -5.02 105.19 103.94 1frq n GLY 125 Ca 0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 1frq n GLY 125 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1frq s GLU 126 N -0.29 4.63 -0.22 1.61 2.02 -1.26 -4.79 118.70 120.39 1frq s GLU 126 Ca 0.00 1.22 -0.29 0.00 0.02 0.00 0.00 54.97 55.92 1frq s GLU 126 Cb 0.00 -3.27 -0.00 0.00 0.10 0.00 0.00 34.13 30.96 1frq s GLU 126 CO 0.00 0.55 1.21 0.99 0.02 0.00 0.00 175.26 178.03 1frq s THR 127 N -1.10 4.34 -0.10 3.63 2.01 -1.26 -0.52 115.64 122.64 1frq s THR 127 Ca 0.37 1.59 -0.01 0.00 0.31 0.00 0.00 61.69 63.95 1frq s THR 127 Cb -0.24 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.11 1frq s THR 127 CO 0.27 -0.26 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.27 1frq s ILE 128 N 3.67 3.86 -0.12 1.82 -1.09 0.45 -4.96 121.20 124.84 1frq s ILE 128 Ca 0.52 -0.40 -0.03 0.00 -2.23 0.00 0.00 60.65 58.51 1frq s ILE 128 Cb -0.18 -2.62 -0.03 0.00 -1.58 0.00 0.00 42.46 38.05 1frq s ILE 128 CO 0.15 0.57 -0.03 -0.54 -1.23 0.00 0.00 174.94 173.87 1frq s LYS 129 N -0.50 3.33 0.40 2.79 1.02 -1.26 -0.04 119.74 125.48 1frq s LYS 129 Ca 0.08 -0.48 -0.27 0.00 0.02 0.00 0.00 55.97 55.32 1frq s LYS 129 Cb -0.12 -2.84 -0.09 0.00 -0.52 0.00 0.00 37.83 34.26 1frq s LYS 129 CO 0.02 0.45 1.40 0.20 -0.92 0.00 0.00 175.35 176.50 1frq s GLY 130 N -0.21 2.94 0.05 -3.33 0.00 0.90 -4.96 107.32 102.71 1frq s GLY 130 Ca 0.04 1.42 -0.32 0.00 0.00 0.00 0.00 44.72 45.86 1frq s GLY 130 CO 0.02 2.05 1.44 -2.08 0.00 0.00 0.00 173.10 174.53 1frq h VAL 131 N 2.63 0.00 -0.27 1.40 2.07 -1.98 -2.72 116.25 117.38 1frq h VAL 131 Ca -0.50 -0.04 -0.16 0.00 0.82 0.00 0.00 66.70 66.82 1frq h VAL 131 Cb 1.25 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1frq h VAL 131 CO 0.63 0.00 -0.44 0.00 0.02 0.00 0.00 177.57 177.77 1frq h SER 133 N 0.53 0.94 0.35 0.00 4.64 -1.88 -0.92 113.55 117.21 1frq h SER 133 Ca 0.02 -0.29 -0.11 0.00 -0.47 0.00 0.00 61.79 60.94 1frq h SER 133 Cb 1.04 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.87 1frq h SER 133 CO 0.10 1.00 -0.46 0.78 -0.87 0.00 0.00 176.83 177.38 1frq h ASN 134 N 0.85 0.15 -0.14 4.97 2.35 -1.54 -0.21 115.58 122.01 1frq h ASN 134 Ca 0.16 -0.07 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 1frq h ASN 134 Cb 0.50 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.82 1frq h ASN 134 CO 0.02 0.60 -0.01 0.15 -1.65 0.00 0.00 177.43 176.54 1frq h PHE 135 N 0.12 0.29 -0.24 1.19 3.57 -1.22 -1.98 116.94 118.66 1frq h PHE 135 Ca 0.01 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.43 1frq h PHE 135 Cb 0.87 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 1frq h PHE 135 CO 0.01 0.50 0.05 -0.07 -2.23 0.00 0.00 178.31 176.57 1frq h LEU 136 N -0.01 0.38 -0.71 0.59 3.38 -1.06 -2.66 115.31 115.22 1frq h LEU 136 Ca 0.04 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1frq h LEU 136 Cb 0.40 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1frq h LEU 136 CO 0.01 0.53 0.00 0.00 0.09 0.00 0.00 178.44 179.07 1frq n ASP 138 N -2.19 0.70 -4.68 0.00 8.00 -0.75 -4.97 116.55 112.65 1frq n ASP 138 Ca 0.02 -0.50 -0.42 0.00 0.71 0.00 0.00 54.79 54.60 1frq n ASP 138 Cb 0.21 0.68 -0.00 0.00 -0.02 0.00 0.00 41.12 41.98 1frq n ASP 138 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1frq n LEU 139 N -1.63 3.44 -4.65 0.64 4.77 -0.80 -5.02 117.00 113.74 1frq n LEU 139 Ca 0.04 1.18 -0.29 0.00 -0.03 0.00 0.00 56.01 56.90 1frq n LEU 139 Cb 0.36 -1.46 -0.08 0.00 -2.33 0.00 0.00 43.42 39.91 1frq n LEU 139 CO 0.39 -0.65 -0.36 -0.54 -1.33 0.00 0.00 177.39 174.90 1frq s LYS 140 N -1.92 2.41 0.18 3.23 -0.14 -1.26 -4.83 119.74 117.40 1frq s LYS 140 Ca 0.57 -0.93 -0.33 0.00 -1.36 0.00 0.00 55.97 53.92 1frq s LYS 140 Cb -0.57 -2.45 -0.14 0.00 -1.68 0.00 0.00 37.83 32.99 1frq s LYS 140 CO 0.61 0.52 1.41 -2.30 -0.76 0.00 0.00 175.35 174.82 1frq n PRO 141 N 0.48 1.79 0.00 -1.68 -0.02 -1.26 -1.41 135.00 132.89 1frq n PRO 141 Ca -0.11 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1frq n PRO 141 Cb 0.53 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1frq n PRO 141 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1frq n GLY 142 N 2.56 3.23 3.77 -1.23 0.00 0.24 -4.96 105.19 108.80 1frq n GLY 142 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 1frq n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1frq s ALA 143 N -2.87 3.06 0.46 4.61 0.00 -0.50 -4.67 121.76 121.84 1frq s ALA 143 Ca 0.00 0.96 -0.09 0.00 0.00 0.00 0.00 51.96 52.83 1frq s ALA 143 Cb 0.00 -3.39 -0.05 0.00 0.00 0.00 0.00 23.12 19.68 1frq s ALA 143 CO 0.00 -0.61 0.82 -1.21 0.00 0.00 0.00 175.76 174.75 1frq s GLU 144 N -2.52 3.67 -0.15 0.00 2.02 -1.26 -0.41 118.70 120.06 1frq s GLU 144 Ca 0.61 0.42 -0.10 0.00 0.02 0.00 0.00 54.97 55.91 1frq s GLU 144 Cb -0.30 -2.34 0.05 0.00 0.10 0.00 0.00 34.13 31.64 1frq s GLU 144 CO 0.37 -0.17 0.37 0.54 0.02 0.00 0.00 175.26 176.38 1frq s VAL 145 N -2.62 -0.02 -0.28 2.63 0.11 0.13 -4.90 120.40 115.45 1frq s VAL 145 Ca 0.51 0.06 -0.22 0.00 -2.93 0.00 0.00 61.98 59.39 1frq s VAL 145 Cb -0.10 -0.53 -0.01 0.00 -1.53 0.00 0.00 36.38 34.21 1frq s VAL 145 CO 0.39 0.02 0.70 -0.54 -3.33 0.00 0.00 175.10 172.35 1frq s LYS 146 N 0.80 4.01 0.04 1.54 1.02 -1.26 -0.48 119.74 125.41 1frq s LYS 146 Ca -0.05 0.54 0.08 0.00 0.02 0.00 0.00 55.97 56.56 1frq s LYS 146 Cb -0.06 -3.70 -0.03 0.00 -0.52 0.00 0.00 37.83 33.53 1frq s LYS 146 CO -0.06 -0.55 -0.22 -0.51 -0.92 0.00 0.00 175.35 173.09 1frq s LEU 147 N 2.72 2.39 0.34 3.17 1.43 0.12 -2.37 118.68 126.48 1frq s LEU 147 Ca 0.29 -0.50 0.05 0.00 -1.03 0.00 0.00 54.13 52.94 1frq s LEU 147 Cb -0.15 -1.40 -0.07 0.00 0.03 0.00 0.00 46.19 44.60 1frq s LEU 147 CO 0.10 0.26 0.03 0.42 0.23 0.00 0.00 176.35 177.39 1frq s THR 148 N -0.86 1.47 0.00 5.49 -4.23 0.04 -0.32 115.64 117.24 1frq s THR 148 Ca 0.13 -2.02 0.00 0.00 -1.18 0.00 0.00 61.69 58.62 1frq s THR 148 Cb -0.10 -2.80 0.00 0.00 1.34 0.00 0.00 72.50 70.93 1frq s THR 148 CO 0.03 -0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.68 1frq n GLY 149 N -0.75 -0.85 3.74 3.99 0.00 -0.63 -1.02 105.19 109.66 1frq n GLY 149 Ca -0.03 -2.10 -0.33 0.00 0.00 0.00 0.00 46.02 43.55 1frq n GLY 149 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1frq s PRO 150 N 0.00 2.30 -0.04 1.61 0.02 -1.26 -1.88 135.00 135.74 1frq s PRO 150 Ca 0.00 1.57 0.05 0.00 0.02 0.00 0.00 61.00 62.64 1frq s PRO 150 Cb 0.00 -1.87 -0.01 0.00 0.02 0.00 0.00 34.50 32.64 1frq s PRO 150 CO 0.00 -1.67 -0.19 0.08 -0.33 0.00 0.00 177.00 174.88 1frq s VAL 151 N -2.23 1.59 0.00 3.83 1.01 0.33 -0.64 120.40 124.29 1frq s VAL 151 Ca 0.70 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.87 1frq s VAL 151 Cb -0.25 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 34.78 1frq s VAL 151 CO 0.45 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.62 1frq n GLY 152 N 3.01 3.04 0.00 4.51 0.00 -1.26 -1.39 105.19 113.10 1frq n GLY 152 Ca -0.17 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1frq n GLY 152 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1frq n LYS 153 N 0.59 3.34 -0.30 1.61 5.02 -1.26 -4.80 118.16 122.36 1frq n LYS 153 Ca 0.00 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.32 1frq n LYS 153 Cb 0.00 -0.68 0.23 0.00 -0.02 0.00 0.00 35.03 34.56 1frq n LYS 153 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1frq h GLU 154 N 0.00 1.03 -0.61 1.97 4.57 -1.95 -2.91 114.58 116.68 1frq h GLU 154 Ca 0.00 -0.06 -0.16 0.00 -1.18 0.00 0.00 59.36 57.96 1frq h GLU 154 Cb 0.07 -0.23 -0.09 0.00 -0.16 0.00 0.00 28.75 28.34 1frq h GLU 154 CO 0.00 0.68 0.17 -1.33 -1.18 0.00 0.00 179.01 177.35 1frq n MET 155 N -4.47 3.53 -1.25 1.92 2.81 -1.26 -4.81 117.12 113.59 1frq n MET 155 Ca 0.13 -3.07 -0.31 0.00 -1.81 0.00 0.00 57.70 52.64 1frq n MET 155 Cb 0.16 -2.12 0.10 0.00 -0.71 0.00 0.00 33.22 30.64 1frq n MET 155 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1frq s LEU 156 N -2.98 2.98 0.59 4.03 1.43 -1.10 -4.19 118.68 119.44 1frq s LEU 156 Ca 0.52 1.80 -0.13 0.00 -1.03 0.00 0.00 54.13 55.29 1frq s LEU 156 Cb 0.42 -4.48 -0.05 0.00 0.03 0.00 0.00 46.19 42.11 1frq s LEU 156 CO 0.12 -2.09 1.02 -0.04 0.23 0.00 0.00 176.35 175.59 1frq s MET 157 N -4.90 3.58 0.60 1.70 -1.94 -1.26 -4.79 119.30 112.29 1frq s MET 157 Ca 0.61 0.90 -0.17 0.00 -1.71 0.00 0.00 55.69 55.32 1frq s MET 157 Cb -0.17 -2.08 -0.03 0.00 2.01 0.00 0.00 34.83 34.56 1frq s MET 157 CO 0.56 -0.58 1.11 -2.14 -0.01 0.00 0.00 175.02 173.96 1frq s PRO 158 N -4.68 3.12 0.12 2.03 0.02 -1.26 -0.67 135.00 133.67 1frq s PRO 158 Ca 0.58 1.45 -0.14 0.00 0.02 0.00 0.00 61.00 62.91 1frq s PRO 158 Cb -0.12 -1.99 -0.06 0.00 0.02 0.00 0.00 34.50 32.36 1frq s PRO 158 CO 0.45 -1.01 1.46 0.87 -0.33 0.00 0.00 177.00 178.44 1frq h LYS 159 N 0.59 0.77 -6.09 5.54 1.57 -0.56 -3.42 116.57 114.96 1frq h LYS 159 Ca -0.48 -0.37 -0.66 0.00 -1.87 0.00 0.00 60.65 57.26 1frq h LYS 159 Cb 1.25 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.55 1frq h LYS 159 CO 0.56 1.00 1.25 -3.47 -0.57 0.00 0.00 179.45 178.21 1frq n ASP 160 N -4.25 2.63 0.11 0.86 -0.08 -1.26 -4.88 116.55 109.69 1frq n ASP 160 Ca -0.03 0.67 0.12 0.00 -1.51 0.00 0.00 54.79 54.05 1frq n ASP 160 Cb 0.45 -1.29 0.45 0.00 2.34 0.00 0.00 41.12 43.07 1frq n ASP 160 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1frq n PRO 161 N 7.32 0.22 -0.47 -0.67 -0.04 -1.26 -2.14 135.00 137.96 1frq n PRO 161 Ca 0.33 0.30 0.08 0.00 -0.04 0.00 0.00 63.50 64.17 1frq n PRO 161 Cb 0.24 -1.83 0.29 0.00 -0.04 0.00 0.00 33.50 32.17 1frq n PRO 161 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1frq n ASN 162 N -2.23 4.13 -4.74 3.54 5.03 -1.26 -0.86 115.26 118.87 1frq n ASN 162 Ca 0.04 -2.46 -0.34 0.00 0.87 0.00 0.00 54.58 52.68 1frq n ASN 162 Cb 0.34 -0.49 0.07 0.00 -1.02 0.00 0.00 39.78 38.68 1frq n ASN 162 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1frq s ALA 163 N -1.86 2.28 -0.24 5.41 0.00 -0.91 -4.21 121.76 122.23 1frq s ALA 163 Ca 0.42 0.80 -0.16 0.00 0.00 0.00 0.00 51.96 53.02 1frq s ALA 163 Cb 0.28 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.94 1frq s ALA 163 CO 0.19 -1.59 0.41 0.99 0.00 0.00 0.00 175.76 175.76 1frq s THR 164 N -2.04 5.16 -0.22 0.00 2.01 -0.45 -2.65 115.64 117.45 1frq s THR 164 Ca 0.72 0.69 0.01 0.00 0.31 0.00 0.00 61.69 63.43 1frq s THR 164 Cb -0.27 -3.74 0.04 0.00 0.01 0.00 0.00 72.50 68.54 1frq s THR 164 CO 0.42 0.18 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.76 1frq s ILE 165 N 1.81 2.26 -0.20 1.82 1.01 0.62 -0.88 121.20 127.64 1frq s ILE 165 Ca 0.18 -1.21 -0.07 0.00 0.00 0.00 0.00 60.65 59.54 1frq s ILE 165 Cb -0.15 -2.13 -0.04 0.00 0.01 0.00 0.00 42.46 40.15 1frq s ILE 165 CO 0.09 0.26 0.06 -0.63 0.00 0.00 0.00 174.94 174.73 1frq s ILE 166 N 1.23 4.66 -0.12 2.92 1.01 -0.52 -0.69 121.20 129.69 1frq s ILE 166 Ca -0.01 -0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.59 1frq s ILE 166 Cb -0.16 -3.12 0.01 0.00 0.01 0.00 0.00 42.46 39.20 1frq s ILE 166 CO -0.08 0.43 -0.18 -0.04 0.00 0.00 0.00 174.94 175.06 1frq s MET 167 N 0.69 2.60 -0.27 2.79 -1.94 0.34 -1.62 119.30 121.88 1frq s MET 167 Ca 0.03 -0.70 0.02 0.00 -1.71 0.00 0.00 55.69 53.33 1frq s MET 167 Cb -0.13 -2.15 0.07 0.00 2.01 0.00 0.00 34.83 34.63 1frq s MET 167 CO 0.02 -0.04 -0.03 -0.51 -0.01 0.00 0.00 175.02 174.44 1frq s LEU 168 N 0.91 3.32 0.14 -0.03 1.43 -0.73 -1.10 118.68 122.62 1frq s LEU 168 Ca -0.07 -1.52 0.10 0.00 -1.03 0.00 0.00 54.13 51.62 1frq s LEU 168 Cb -0.15 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.66 1frq s LEU 168 CO -0.02 -0.27 -0.23 -0.83 0.23 0.00 0.00 176.35 175.23 1frq s GLY 169 N 1.21 1.48 -0.05 -3.19 0.00 -0.84 -1.42 107.32 104.51 1frq s GLY 169 Ca -0.01 -1.45 0.06 0.00 0.00 0.00 0.00 44.72 43.31 1frq s GLY 169 CO -0.08 -1.47 -0.24 -0.51 0.00 0.00 0.00 173.10 170.81 1frq s THR 170 N -1.43 1.94 0.00 0.90 -4.23 -0.96 -1.61 115.64 110.25 1frq s THR 170 Ca 0.14 -1.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.64 1frq s THR 170 Cb -0.09 -1.64 0.00 0.00 1.34 0.00 0.00 72.50 72.11 1frq s THR 170 CO 0.07 0.54 0.00 0.61 -0.54 0.00 0.00 174.62 175.30 1frq n GLY 171 N 2.97 3.63 0.00 3.99 0.00 -1.07 -0.67 105.19 114.05 1frq n GLY 171 Ca -0.17 0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.02 1frq n GLY 171 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1frq n THR 172 N 0.00 0.73 0.26 2.61 -2.24 -1.26 -2.19 114.28 112.19 1frq n THR 172 Ca 0.00 0.18 0.06 0.00 -2.27 0.00 0.00 64.05 62.02 1frq n THR 172 Cb 0.00 -0.89 0.28 0.00 -2.10 0.00 0.00 70.33 67.62 1frq n THR 172 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1frq n GLY 173 N 0.26 -0.85 0.28 3.38 0.00 0.16 -0.94 105.19 107.48 1frq n GLY 173 Ca 0.05 0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.24 1frq n GLY 173 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1frq h ILE 174 N 0.00 0.53 -0.52 -0.61 6.09 -1.61 -3.35 117.51 118.03 1frq h ILE 174 Ca 0.00 -0.28 0.10 0.00 -1.37 0.00 0.00 64.86 63.31 1frq h ILE 174 Cb 0.14 1.18 -0.11 0.00 0.47 0.00 0.00 36.82 38.51 1frq h ILE 174 CO 0.00 0.06 -0.25 0.00 -3.07 0.00 0.00 178.15 174.89 1frq h ALA 175 N 1.94 0.09 0.00 0.18 0.00 -1.31 -1.65 119.26 118.52 1frq h ALA 175 Ca -0.00 0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1frq h ALA 175 Cb 0.18 0.61 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1frq h ALA 175 CO 0.01 -0.59 -0.10 -1.00 0.00 0.00 0.00 179.25 177.57 1frq h PRO 176 N -0.13 0.00 0.02 0.00 0.13 -1.70 -2.76 132.00 127.57 1frq h PRO 176 Ca 0.23 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 65.15 1frq h PRO 176 Cb 0.50 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 1frq h PRO 176 CO -0.60 0.10 -0.95 0.74 -0.23 0.00 0.00 178.00 177.06 1frq h PHE 177 N 0.00 0.35 -0.82 1.56 0.04 -1.56 -1.57 116.94 114.94 1frq h PHE 177 Ca -0.00 -0.21 -0.04 0.00 2.80 0.00 0.00 57.97 60.52 1frq h PHE 177 Cb 0.63 -0.03 -0.04 0.00 2.20 0.00 0.00 35.95 38.71 1frq h PHE 177 CO 0.00 1.05 0.35 -0.09 -0.60 0.00 0.00 178.31 179.02 1frq h ARG 178 N 0.12 1.21 0.31 1.51 2.43 -1.16 -0.88 114.38 117.91 1frq h ARG 178 Ca -0.06 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 58.90 1frq h ARG 178 Cb 1.60 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 30.94 1frq h ARG 178 CO 0.15 0.96 -0.19 1.03 -1.51 0.00 0.00 179.97 180.41 1frq h SER 179 N 1.18 -0.47 -0.20 -3.80 0.87 -1.26 -0.51 113.55 109.36 1frq h SER 179 Ca 0.28 0.03 0.06 0.00 -1.23 0.00 0.00 61.79 60.92 1frq h SER 179 Cb 0.18 0.14 -0.07 0.00 -0.44 0.00 0.00 62.40 62.22 1frq h SER 179 CO -0.03 -0.30 -0.24 -0.26 -0.53 0.00 0.00 176.83 175.47 1frq h PHE 180 N -0.48 -0.64 -0.32 2.24 -1.00 -1.13 -2.94 116.94 112.67 1frq h PHE 180 Ca -0.03 0.04 -0.08 0.00 2.81 0.00 0.00 57.97 60.70 1frq h PHE 180 Cb 0.40 0.31 -0.02 0.00 3.61 0.00 0.00 35.95 40.25 1frq h PHE 180 CO -0.09 -0.32 -0.14 -0.07 -1.61 0.00 0.00 178.31 176.08 1frq h LEU 181 N -0.27 0.55 -0.42 1.54 3.38 -0.98 -1.35 115.31 117.76 1frq h LEU 181 Ca 0.12 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 1frq h LEU 181 Cb 0.46 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1frq h LEU 181 CO -0.36 0.72 0.22 -0.50 0.09 0.00 0.00 178.44 178.62 1frq h TRP 182 N 0.52 0.58 -0.07 1.13 4.06 -1.04 -0.27 115.95 120.85 1frq h TRP 182 Ca 0.09 -0.02 0.00 0.00 2.06 0.00 0.00 58.89 61.03 1frq h TRP 182 Cb 0.55 -0.18 -0.01 0.00 -1.00 0.00 0.00 29.16 28.52 1frq h TRP 182 CO 0.02 0.45 0.03 -0.22 -3.56 0.00 0.00 178.44 175.16 1frq h LYS 183 N 0.54 0.08 -0.07 0.49 3.64 -1.29 0.64 116.57 120.59 1frq h LYS 183 Ca 0.15 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1frq h LYS 183 Cb 0.06 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1frq h LYS 183 CO -0.02 0.05 0.04 0.52 -2.27 0.00 0.00 179.45 177.77 1frq h MET 184 N 0.08 0.10 0.00 1.90 2.86 -1.10 -3.33 114.93 115.44 1frq h MET 184 Ca 0.03 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1frq h MET 184 Cb 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.64 1frq h MET 184 CO -0.02 0.15 -0.92 1.19 1.06 0.00 0.00 176.91 178.36 1frq n PHE 185 N -4.99 0.00 0.24 -0.22 3.72 -0.12 -4.55 117.46 111.53 1frq n PHE 185 Ca -0.06 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.39 1frq n PHE 185 Cb 0.07 -0.11 0.06 0.00 -0.94 0.00 0.00 39.48 38.56 1frq n PHE 185 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1frq n PHE 186 N -1.52 0.10 -4.27 1.38 3.72 0.19 -5.02 117.46 112.04 1frq n PHE 186 Ca -0.00 -0.13 -0.18 0.00 -0.05 0.00 0.00 57.45 57.08 1frq n PHE 186 Cb 0.19 -0.01 -0.11 0.00 -0.94 0.00 0.00 39.48 38.61 1frq n PHE 186 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1frq s GLU 187 N -0.81 1.12 -0.26 -1.08 2.02 -1.08 -4.98 118.70 113.63 1frq s GLU 187 Ca 0.13 -1.34 -0.08 0.00 0.02 0.00 0.00 54.97 53.70 1frq s GLU 187 Cb 0.08 -0.98 -0.03 0.00 0.10 0.00 0.00 34.13 33.30 1frq s GLU 187 CO 0.12 0.18 0.08 0.15 0.02 0.00 0.00 175.26 175.81 1frq s LYS 188 N -2.96 3.63 -0.01 1.61 -0.14 -1.26 -4.84 119.74 115.78 1frq s LYS 188 Ca 0.13 -0.50 0.07 0.00 -1.36 0.00 0.00 55.97 54.32 1frq s LYS 188 Cb -0.04 -3.35 -0.02 0.00 -1.68 0.00 0.00 37.83 32.74 1frq s LYS 188 CO 0.04 -0.21 -0.23 -1.01 -0.76 0.00 0.00 175.35 173.18 1frq s HIS 189 N 1.62 2.04 0.38 3.18 3.76 -1.26 -5.02 115.29 119.99 1frq s HIS 189 Ca 0.06 -0.39 0.15 0.00 -0.15 0.00 0.00 55.06 54.74 1frq s HIS 189 Cb -0.15 -1.30 0.85 0.00 1.11 0.00 0.00 32.58 33.09 1frq s HIS 189 CO 0.04 -0.01 1.88 -0.44 -0.85 0.00 0.00 174.74 175.36 1frq h ASP 190 N 5.43 0.00 0.00 1.40 3.32 -2.04 -3.25 116.42 121.28 1frq h ASP 190 Ca -0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1frq h ASP 190 Cb 1.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.69 1frq h ASP 190 CO 0.47 0.31 -0.01 0.47 -1.72 0.00 0.00 179.24 178.76 1frq n ASP 191 N -4.05 2.02 -3.63 6.45 8.00 -1.26 -4.99 116.55 119.08 1frq n ASP 191 Ca -0.02 -2.30 -0.13 0.00 0.71 0.00 0.00 54.79 53.05 1frq n ASP 191 Cb 0.36 -0.13 -0.13 0.00 -0.02 0.00 0.00 41.12 41.21 1frq n ASP 191 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1frq s TYR 192 N -1.52 -0.47 -0.15 1.24 5.04 -1.23 -5.10 117.35 115.16 1frq s TYR 192 Ca 0.10 0.96 -0.02 0.00 -2.44 0.00 0.00 57.07 55.67 1frq s TYR 192 Cb 0.08 -0.03 0.04 0.00 0.35 0.00 0.00 41.96 42.41 1frq s TYR 192 CO 0.01 -0.41 0.00 0.21 -1.34 0.00 0.00 175.55 174.02 1frq s LYS 193 N 2.44 0.85 0.05 4.97 2.47 -1.26 -4.05 119.74 125.21 1frq s LYS 193 Ca 0.02 -0.27 -0.31 0.00 -1.56 0.00 0.00 55.97 53.86 1frq s LYS 193 Cb -0.12 -1.71 -0.06 0.00 -1.46 0.00 0.00 37.83 34.48 1frq s LYS 193 CO -0.10 -0.47 1.23 0.12 0.16 0.00 0.00 175.35 176.29 1frq s PHE 194 N 1.84 3.35 -0.01 4.03 5.36 -1.26 -4.77 117.98 126.52 1frq s PHE 194 Ca 0.02 1.23 0.01 0.00 -0.96 0.00 0.00 56.93 57.22 1frq s PHE 194 Cb -0.15 -3.46 0.01 0.00 -0.34 0.00 0.00 43.02 39.08 1frq s PHE 194 CO -0.07 -1.45 0.70 -1.71 -1.46 0.00 0.00 175.22 171.23 1frq n ASN 195 N 4.18 0.61 -0.26 6.13 4.05 -0.04 -5.03 115.26 124.90 1frq n ASN 195 Ca 0.10 -1.44 0.00 0.00 0.45 0.00 0.00 54.58 53.69 1frq n ASN 195 Cb 0.46 -0.04 0.00 0.00 1.23 0.00 0.00 39.78 41.43 1frq n ASN 195 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1frq n GLY 196 N -0.19 1.62 3.05 8.20 0.00 -1.11 -4.81 105.19 111.96 1frq n GLY 196 Ca 0.01 -1.68 -0.28 0.00 0.00 0.00 0.00 46.02 44.07 1frq n GLY 196 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1frq s LEU 197 N 0.00 1.69 -0.10 0.99 2.96 -1.09 -4.59 118.68 118.55 1frq s LEU 197 Ca 0.00 -0.41 -0.01 0.00 -0.22 0.00 0.00 54.13 53.50 1frq s LEU 197 Cb 0.00 -1.05 -0.03 0.00 0.50 0.00 0.00 46.19 45.61 1frq s LEU 197 CO 0.00 0.02 -0.06 0.00 -1.32 0.00 0.00 176.35 174.99 1frq s ALA 198 N 0.96 2.98 -0.12 5.97 0.00 -0.07 -0.27 121.76 131.21 1frq s ALA 198 Ca -0.08 -0.86 -0.02 0.00 0.00 0.00 0.00 51.96 51.01 1frq s ALA 198 Cb -0.15 -1.34 0.04 0.00 0.00 0.00 0.00 23.12 21.66 1frq s ALA 198 CO -0.01 0.44 0.00 -0.46 0.00 0.00 0.00 175.76 175.74 1frq s TRP 199 N -0.38 0.91 -0.14 0.00 -0.11 0.14 -1.15 118.94 118.22 1frq s TRP 199 Ca 0.06 -0.49 -0.03 0.00 1.22 0.00 0.00 56.10 56.86 1frq s TRP 199 Cb -0.12 -0.94 -0.03 0.00 -1.50 0.00 0.00 33.47 30.88 1frq s TRP 199 CO 0.02 -0.45 -0.05 -1.17 -4.62 0.00 0.00 176.95 170.68 1frq s LEU 200 N 1.89 3.20 -0.12 5.86 2.96 -0.07 -0.50 118.68 131.90 1frq s LEU 200 Ca 0.03 -0.13 0.01 0.00 -0.22 0.00 0.00 54.13 53.82 1frq s LEU 200 Cb -0.14 -1.76 -0.01 0.00 0.50 0.00 0.00 46.19 44.78 1frq s LEU 200 CO -0.07 0.19 -0.17 -0.36 -1.32 0.00 0.00 176.35 174.63 1frq s PHE 201 N 0.21 2.72 -0.12 5.38 0.40 -0.26 -0.78 117.98 125.52 1frq s PHE 201 Ca -0.03 -0.76 -0.00 0.00 -0.60 0.00 0.00 56.93 55.54 1frq s PHE 201 Cb -0.14 -1.79 0.03 0.00 0.51 0.00 0.00 43.02 41.63 1frq s PHE 201 CO 0.03 -0.26 -0.07 -1.17 0.70 0.00 0.00 175.22 174.44 1frq s LEU 202 N 0.30 1.28 -0.25 -0.37 2.96 -0.31 -1.98 118.68 120.32 1frq s LEU 202 Ca -0.13 -0.38 -0.08 0.00 -0.22 0.00 0.00 54.13 53.33 1frq s LEU 202 Cb -0.16 -0.87 -0.03 0.00 0.50 0.00 0.00 46.19 45.63 1frq s LEU 202 CO 0.07 -0.13 0.08 -0.83 -1.32 0.00 0.00 176.35 174.21 1frq s GLY 203 N 1.69 1.78 0.27 7.98 0.00 -0.63 -0.45 107.32 117.95 1frq s GLY 203 Ca 0.04 -1.12 0.02 0.00 0.00 0.00 0.00 44.72 43.67 1frq s GLY 203 CO -0.08 0.53 0.06 -1.34 0.00 0.00 0.00 173.10 172.27 1frq s VAL 204 N 1.59 0.83 0.01 1.40 -7.23 0.54 -2.58 120.40 114.96 1frq s VAL 204 Ca 0.06 -2.01 -0.15 0.00 -1.81 0.00 0.00 61.98 58.08 1frq s VAL 204 Cb -0.15 -2.59 -0.35 0.00 0.56 0.00 0.00 36.38 33.85 1frq s VAL 204 CO 0.04 -0.09 0.92 1.55 -0.31 0.00 0.00 175.10 177.21 1frq h PRO 205 N 2.35 0.51 -4.95 4.82 0.13 -1.89 -1.28 132.00 131.69 1frq h PRO 205 Ca -0.39 -0.87 -0.31 0.00 -0.87 0.00 0.00 66.00 63.56 1frq h PRO 205 Cb 1.24 0.32 -0.15 0.00 0.13 0.00 0.00 31.00 32.55 1frq h PRO 205 CO 0.64 1.42 -0.69 0.95 -0.23 0.00 0.00 178.00 180.08 1frq s THR 206 N -2.60 0.97 0.45 1.56 -4.23 -1.26 -1.96 115.64 108.58 1frq s THR 206 Ca -0.11 -2.02 0.23 0.00 -1.18 0.00 0.00 61.69 58.62 1frq s THR 206 Cb 0.04 -1.95 0.26 0.00 1.34 0.00 0.00 72.50 72.20 1frq s THR 206 CO 0.93 -0.65 2.07 0.28 -0.54 0.00 0.00 174.62 176.71 1frq h SER 207 N 2.75 0.00 0.78 3.99 0.02 -1.94 0.01 113.55 119.15 1frq h SER 207 Ca -0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 1frq h SER 207 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1frq h SER 207 CO 0.64 0.12 0.00 -1.54 -1.14 0.00 0.00 176.83 174.91 1frq n SER 208 N -3.91 0.00 -1.14 3.07 3.41 -1.26 -2.68 113.62 111.12 1frq n SER 208 Ca -0.02 0.50 0.10 0.00 -0.26 0.00 0.00 58.87 59.18 1frq n SER 208 Cb 0.22 -0.50 0.27 0.00 -0.26 0.00 0.00 64.21 63.94 1frq n SER 208 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1frq n SER 209 N -1.50 3.65 -4.64 4.04 7.64 -0.01 -1.03 113.62 121.77 1frq n SER 209 Ca 0.05 -2.01 -0.43 0.00 1.01 0.00 0.00 58.87 57.50 1frq n SER 209 Cb 0.26 -0.41 -0.02 0.00 -1.01 0.00 0.00 64.21 63.03 1frq n SER 209 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1frq s LEU 210 N -1.01 3.98 -0.08 -3.43 1.43 -1.09 -4.87 118.68 113.62 1frq s LEU 210 Ca 0.41 1.28 -0.20 0.00 -1.03 0.00 0.00 54.13 54.60 1frq s LEU 210 Cb 0.21 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.85 1frq s LEU 210 CO 0.28 -0.92 0.56 -0.76 0.23 0.00 0.00 176.35 175.73 1frq s LEU 211 N 3.89 4.32 -1.35 1.79 1.43 -1.26 -4.29 118.68 123.21 1frq s LEU 211 Ca 0.52 0.99 0.00 0.00 -1.03 0.00 0.00 54.13 54.61 1frq s LEU 211 Cb -0.16 -2.84 0.00 0.00 0.03 0.00 0.00 46.19 43.22 1frq s LEU 211 CO 0.18 0.01 0.00 -1.22 0.23 0.00 0.00 176.35 175.54 1frq n TYR 212 N 3.42 0.00 -0.26 0.29 4.01 -1.26 -4.87 117.16 118.50 1frq n TYR 212 Ca -0.06 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.75 1frq n TYR 212 Cb 0.51 -2.74 0.20 0.00 -0.31 0.00 0.00 39.34 37.00 1frq n TYR 212 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1frq h LYS 213 N 0.03 0.23 -0.91 -0.72 3.64 -2.00 0.83 116.57 117.68 1frq h LYS 213 Ca -0.26 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.16 1frq h LYS 213 Cb 1.12 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.83 1frq h LYS 213 CO 0.38 0.15 0.59 1.49 -2.27 0.00 0.00 179.45 179.80 1frq h GLU 214 N 0.24 1.04 -0.15 1.90 4.57 -1.93 0.14 114.58 120.39 1frq h GLU 214 Ca 0.44 -0.06 -0.08 0.00 -1.18 0.00 0.00 59.36 58.47 1frq h GLU 214 Cb 0.79 -0.23 -0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1frq h GLU 214 CO -0.56 0.69 -0.24 0.93 -1.18 0.00 0.00 179.01 178.66 1frq h GLU 215 N 1.07 0.43 -0.21 1.92 5.08 -1.27 -2.78 114.58 118.82 1frq h GLU 215 Ca 0.38 -0.26 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 1frq h GLU 215 Cb 0.14 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1frq h GLU 215 CO -0.13 0.85 -0.21 0.74 -1.00 0.00 0.00 179.01 179.25 1frq h PHE 216 N 0.04 0.41 -0.39 4.33 0.04 -0.53 -2.16 116.94 118.68 1frq h PHE 216 Ca 0.01 -0.07 -0.05 0.00 2.80 0.00 0.00 57.97 60.66 1frq h PHE 216 Cb 0.81 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.83 1frq h PHE 216 CO 0.09 0.57 0.02 0.93 -0.60 0.00 0.00 178.31 179.32 1frq h GLU 217 N 0.34 0.61 -0.05 1.51 4.39 -0.70 -1.21 114.58 119.46 1frq h GLU 217 Ca 0.06 -0.14 -0.16 0.00 0.34 0.00 0.00 59.36 59.46 1frq h GLU 217 Cb 0.56 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 1frq h GLU 217 CO 0.04 0.62 -0.69 0.87 -1.16 0.00 0.00 179.01 178.69 1frq h LYS 218 N 0.59 0.25 -0.29 2.33 1.57 -1.13 -2.95 116.57 116.95 1frq h LYS 218 Ca 0.12 -0.20 -0.14 0.00 -1.87 0.00 0.00 60.65 58.56 1frq h LYS 218 Cb 0.34 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1frq h LYS 218 CO 0.01 0.85 -0.39 0.52 -0.57 0.00 0.00 179.45 179.86 1frq h MET 219 N 0.18 0.68 -0.72 3.15 2.86 -0.90 -2.55 114.93 117.62 1frq h MET 219 Ca -0.02 -0.35 -0.03 0.00 -2.06 0.00 0.00 59.70 57.25 1frq h MET 219 Cb 1.24 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.87 1frq h MET 219 CO 0.11 0.95 0.35 -0.22 1.06 0.00 0.00 176.91 179.16 1frq h LYS 220 N 0.56 1.04 -0.29 1.72 1.63 -1.20 -1.22 116.57 118.81 1frq h LYS 220 Ca 0.05 -0.15 -0.08 0.00 -0.85 0.00 0.00 60.65 59.62 1frq h LYS 220 Cb 0.92 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 32.35 1frq h LYS 220 CO 0.08 0.81 -0.17 1.49 -3.45 0.00 0.00 179.45 178.22 1frq h GLU 221 N 1.01 0.52 -0.35 1.90 4.81 -1.42 -2.42 114.58 118.62 1frq h GLU 221 Ca 0.25 -0.17 -0.14 0.00 -0.13 0.00 0.00 59.36 59.17 1frq h GLU 221 Cb 0.12 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1frq h GLU 221 CO -0.03 0.67 -0.33 -0.22 -0.73 0.00 0.00 179.01 178.37 1frq h LYS 222 N 0.47 0.85 -2.05 1.92 3.64 -1.00 -3.36 116.57 117.03 1frq h LYS 222 Ca 0.08 -0.44 -0.55 0.00 -1.27 0.00 0.00 60.65 58.47 1frq h LYS 222 Cb 0.56 0.01 -0.40 0.00 -0.41 0.00 0.00 32.23 31.99 1frq h LYS 222 CO 0.04 1.08 -1.00 0.00 -2.27 0.00 0.00 179.45 177.29 1frq n ALA 223 N -2.52 2.80 0.30 5.00 0.00 -0.51 -4.97 120.51 120.61 1frq n ALA 223 Ca -0.03 -3.74 0.15 0.00 0.00 0.00 0.00 53.44 49.82 1frq n ALA 223 Cb 0.51 -0.85 0.93 0.00 0.00 0.00 0.00 19.45 20.04 1frq n ALA 223 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1frq h PRO 224 N 3.75 0.00 -0.00 0.00 0.13 -1.60 -0.37 132.00 133.92 1frq h PRO 224 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1frq h PRO 224 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1frq h PRO 224 CO 0.56 0.00 -0.81 -0.25 -0.23 0.00 0.00 178.00 177.28 1frq n ASP 225 N -3.82 0.84 -0.36 1.44 8.00 -1.26 -4.20 116.55 117.19 1frq n ASP 225 Ca -0.03 -0.74 0.06 0.00 0.71 0.00 0.00 54.79 54.78 1frq n ASP 225 Cb 0.08 0.72 0.02 0.00 -0.02 0.00 0.00 41.12 41.92 1frq n ASP 225 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1frq n ASN 226 N -1.47 1.63 -3.72 -2.24 4.13 -0.28 -4.88 115.26 108.43 1frq n ASN 226 Ca 0.05 -1.31 -0.20 0.00 1.68 0.00 0.00 54.58 54.79 1frq n ASN 226 Cb 0.33 0.24 -0.18 0.00 -1.54 0.00 0.00 39.78 38.64 1frq n ASN 226 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1frq s PHE 227 N -1.22 0.27 -0.00 3.10 5.36 -0.41 -0.89 117.98 124.19 1frq s PHE 227 Ca 0.11 0.10 0.02 0.00 -0.96 0.00 0.00 56.93 56.20 1frq s PHE 227 Cb 0.09 -0.56 -0.04 0.00 -0.34 0.00 0.00 43.02 42.18 1frq s PHE 227 CO 0.21 -0.22 -0.01 1.03 -1.46 0.00 0.00 175.22 174.77 1frq s ARG 228 N 1.94 2.74 -0.03 10.12 0.52 -0.30 -4.77 118.95 129.18 1frq s ARG 228 Ca 0.03 -0.63 0.01 0.00 -0.52 0.00 0.00 55.73 54.62 1frq s ARG 228 Cb -0.12 -2.64 0.02 0.00 0.52 0.00 0.00 34.95 32.73 1frq s ARG 228 CO -0.04 0.62 -0.01 -1.17 0.02 0.00 0.00 175.30 174.73 1frq s LEU 229 N -1.51 1.35 -0.04 2.53 2.96 -1.26 -0.89 118.68 121.82 1frq s LEU 229 Ca 0.19 -0.04 -0.01 0.00 -0.22 0.00 0.00 54.13 54.04 1frq s LEU 229 Cb -0.11 -0.23 0.03 0.00 0.50 0.00 0.00 46.19 46.38 1frq s LEU 229 CO 0.09 -0.07 0.07 -1.81 -1.32 0.00 0.00 176.35 173.32 1frq s ASP 230 N 0.79 -0.00 0.07 3.68 1.01 0.04 -4.99 116.67 117.26 1frq s ASP 230 Ca -0.08 0.14 0.05 0.00 0.71 0.00 0.00 52.55 53.36 1frq s ASP 230 Cb -0.11 0.03 -0.04 0.00 1.01 0.00 0.00 42.92 43.81 1frq s ASP 230 CO -0.01 -0.13 -0.03 -0.36 0.21 0.00 0.00 175.17 174.85 1frq s PHE 231 N 1.07 2.94 -0.31 4.23 0.08 -1.26 -1.16 117.98 123.56 1frq s PHE 231 Ca -0.09 -0.04 -0.02 0.00 0.12 0.00 0.00 56.93 56.90 1frq s PHE 231 Cb -0.12 -1.54 0.11 0.00 -0.57 0.00 0.00 43.02 40.90 1frq s PHE 231 CO -0.04 0.46 0.13 0.00 -0.10 0.00 0.00 175.22 175.67 1frq s ALA 232 N -1.24 1.16 -0.94 5.36 0.00 0.40 -4.89 121.76 121.60 1frq s ALA 232 Ca 0.23 -1.52 -0.14 0.00 0.00 0.00 0.00 51.96 50.54 1frq s ALA 232 Cb -0.11 -1.55 0.22 0.00 0.00 0.00 0.00 23.12 21.67 1frq s ALA 232 CO 0.15 -1.73 0.96 0.08 0.00 0.00 0.00 175.76 175.23 1frq s VAL 233 N 1.67 5.52 0.28 0.00 1.01 -1.25 -0.34 120.40 127.29 1frq s VAL 233 Ca 0.11 -2.57 -0.04 0.00 0.00 0.00 0.00 61.98 59.47 1frq s VAL 233 Cb -0.18 -4.59 0.37 0.00 0.00 0.00 0.00 36.38 31.98 1frq s VAL 233 CO -0.26 -1.19 1.59 0.77 0.00 0.00 0.00 175.10 176.01 1frq h SER 234 N 7.63 -0.55 -0.02 3.32 4.64 -0.91 -0.50 113.55 127.15 1frq h SER 234 Ca 0.15 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 1frq h SER 234 Cb 0.98 0.47 0.00 0.00 -0.31 0.00 0.00 62.40 63.54 1frq h SER 234 CO 0.91 -0.28 0.00 0.54 -0.87 0.00 0.00 176.83 177.13 1frq n ARG 235 N -5.47 1.18 0.00 4.77 1.74 -0.83 -3.49 116.66 114.56 1frq n ARG 235 Ca 0.17 -0.26 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 1frq n ARG 235 Cb 0.58 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.62 1frq n ARG 235 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1frq n GLU 236 N -0.60 0.19 -3.88 5.56 1.02 -0.30 -5.04 120.64 117.59 1frq n GLU 236 Ca 0.18 -0.44 -0.11 0.00 -0.02 0.00 0.00 57.16 56.77 1frq n GLU 236 Cb 0.15 -0.68 -0.13 0.00 -0.02 0.00 0.00 31.44 30.76 1frq n GLU 236 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1frq s GLN 237 N -0.14 0.13 0.08 3.49 -0.21 -0.62 -5.02 119.66 117.37 1frq s GLN 237 Ca 0.00 -0.11 0.04 0.00 0.02 0.00 0.00 55.36 55.31 1frq s GLN 237 Cb 0.00 0.05 -0.03 0.00 1.00 0.00 0.00 33.01 34.03 1frq s GLN 237 CO 0.00 -0.02 -0.10 0.95 -2.12 0.00 0.00 175.29 173.99 1frq s THR 238 N -0.38 0.86 0.79 -0.19 -4.23 -1.26 0.49 115.64 111.74 1frq s THR 238 Ca -0.04 -1.43 -0.04 0.00 -1.18 0.00 0.00 61.69 58.99 1frq s THR 238 Cb -0.03 -1.12 0.15 0.00 1.34 0.00 0.00 72.50 72.85 1frq s THR 238 CO -0.00 -0.45 1.08 0.54 -0.54 0.00 0.00 174.62 175.25 1frq s ASN 239 N -2.09 3.97 0.19 3.99 4.22 0.24 -4.87 114.94 120.59 1frq s ASN 239 Ca 0.00 -0.30 -0.19 0.00 -2.14 0.00 0.00 52.86 50.23 1frq s ASN 239 Cb -0.06 0.05 0.14 0.00 1.28 0.00 0.00 41.25 42.66 1frq s ASN 239 CO 0.00 -2.13 1.60 -0.33 -2.04 0.00 0.00 177.10 174.20 1frq h GLU 240 N -0.82 -0.14 -0.26 3.55 3.07 -2.01 0.16 114.58 118.13 1frq h GLU 240 Ca -0.37 0.01 0.08 0.00 -0.50 0.00 0.00 59.36 58.57 1frq h GLU 240 Cb 1.25 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 29.19 1frq h GLU 240 CO 0.38 -0.09 0.46 -0.22 -1.40 0.00 0.00 179.01 178.13 1frq h LYS 241 N -0.14 0.00 0.00 2.33 3.64 -2.05 -3.43 116.57 116.92 1frq h LYS 241 Ca 0.24 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.62 1frq h LYS 241 Cb 0.53 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1frq h LYS 241 CO -0.64 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 176.95 1frq n GLY 242 N -1.39 1.17 3.77 5.01 0.00 0.54 -5.09 105.19 109.19 1frq n GLY 242 Ca 0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 1frq n GLY 242 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1frq s GLU 243 N -0.56 4.28 0.35 1.61 2.02 -1.22 -4.68 118.70 120.50 1frq s GLU 243 Ca 0.00 1.68 -0.28 0.00 0.02 0.00 0.00 54.97 56.39 1frq s GLU 243 Cb 0.00 -2.76 -0.12 0.00 0.10 0.00 0.00 34.13 31.34 1frq s GLU 243 CO 0.00 -0.08 1.34 1.63 0.02 0.00 0.00 175.26 178.17 1frq n LYS 244 N 0.33 2.25 -2.02 1.61 5.02 -1.26 -0.59 118.16 123.50 1frq n LYS 244 Ca 0.03 0.79 -0.42 0.00 -2.02 0.00 0.00 58.31 56.69 1frq n LYS 244 Cb 0.47 -2.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.08 1frq n LYS 244 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 1frq n MET 245 N 0.58 2.98 -1.96 1.97 0.00 0.18 -4.76 117.12 116.11 1frq n MET 245 Ca 0.04 -2.85 -0.29 0.00 -0.00 0.00 0.00 57.70 54.61 1frq n MET 245 Cb 0.37 -3.34 0.11 0.00 0.00 0.00 0.00 33.22 30.35 1frq n MET 245 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 175.97 176.68 1frq s TYR 246 N 3.42 2.62 0.21 1.12 2.02 -1.26 -2.49 117.35 122.99 1frq s TYR 246 Ca 0.49 0.59 -0.10 0.00 -0.37 0.00 0.00 57.07 57.68 1frq s TYR 246 Cb 0.11 -3.58 0.15 0.00 -0.40 0.00 0.00 41.96 38.24 1frq s TYR 246 CO -0.03 -1.92 1.87 0.97 -1.57 0.00 0.00 175.55 174.87 1frq h ILE 247 N -1.11 1.20 -0.01 2.71 2.10 -1.92 -0.15 117.51 120.33 1frq h ILE 247 Ca -0.45 -0.39 -0.10 0.00 1.08 0.00 0.00 64.86 65.00 1frq h ILE 247 Cb 1.31 0.11 -0.01 0.00 -1.09 0.00 0.00 36.82 37.13 1frq h ILE 247 CO 0.59 0.20 -0.46 0.06 -1.08 0.00 0.00 178.15 177.46 1frq h GLN 248 N 1.02 0.02 -0.26 2.19 -0.00 -1.94 -0.91 115.11 115.24 1frq h GLN 248 Ca 0.27 -0.01 -0.09 0.00 -0.00 0.00 0.00 58.65 58.83 1frq h GLN 248 Cb -0.09 -0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.37 1frq h GLN 248 CO -0.06 0.48 -0.20 1.15 -0.00 0.00 0.00 178.83 180.19 1frq h THR 249 N 0.02 1.25 0.11 1.86 2.02 -1.46 -0.36 112.91 116.35 1frq h THR 249 Ca -0.00 -1.17 -0.27 0.00 0.77 0.00 0.00 66.41 65.74 1frq h THR 249 Cb 0.82 1.28 0.01 0.00 -1.74 0.00 0.00 68.15 68.51 1frq h THR 249 CO 0.06 0.37 -1.20 -0.09 0.37 0.00 0.00 175.52 175.04 1frq h ARG 250 N 0.43 0.32 -0.44 6.66 9.65 -0.69 -3.35 114.38 126.95 1frq h ARG 250 Ca 0.07 -0.49 -0.08 0.00 -1.10 0.00 0.00 59.98 58.38 1frq h ARG 250 Cb 0.60 0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 29.34 1frq h ARG 250 CO 0.04 1.21 -0.02 0.52 2.80 0.00 0.00 179.97 184.52 1frq h MET 251 N 0.11 0.79 -1.00 0.20 2.86 -0.68 -3.17 114.93 114.05 1frq h MET 251 Ca -0.13 -0.26 0.23 0.00 -2.06 0.00 0.00 59.70 57.48 1frq h MET 251 Cb 1.90 -0.07 -0.09 0.00 0.06 0.00 0.00 31.60 33.40 1frq h MET 251 CO 0.20 0.87 0.63 0.00 1.06 0.00 0.00 176.91 179.67 1frq h ALA 252 N 0.90 2.07 0.00 6.32 0.00 -1.21 0.48 119.26 127.81 1frq h ALA 252 Ca 0.12 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1frq h ALA 252 Cb 0.53 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1frq h ALA 252 CO 0.03 -0.44 -0.00 0.37 0.00 0.00 0.00 179.25 179.21 1frq h GLN 253 N 0.50 0.00 -0.05 0.00 4.15 -1.69 -0.76 115.11 117.25 1frq h GLN 253 Ca 0.56 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.98 1frq h GLN 253 Cb 1.26 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.95 1frq h GLN 253 CO -0.30 0.00 -0.02 0.66 -1.93 0.00 0.00 178.83 177.25 1frq n TYR 254 N -3.26 0.19 -0.06 3.99 4.01 0.16 -4.88 117.16 117.32 1frq n TYR 254 Ca -0.03 -1.00 -0.12 0.00 -0.16 0.00 0.00 57.90 56.59 1frq n TYR 254 Cb 0.08 -0.19 -0.07 0.00 -0.31 0.00 0.00 39.34 38.86 1frq n TYR 254 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1frq h ALA 255 N 0.38 -0.62 -0.97 -0.72 0.00 -0.45 -1.00 119.26 115.89 1frq h ALA 255 Ca 0.00 0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.07 1frq h ALA 255 Cb 1.09 0.91 -0.09 0.00 0.00 0.00 0.00 17.79 19.70 1frq h ALA 255 CO 0.05 -0.95 0.61 0.28 0.00 0.00 0.00 179.25 179.24 1frq h VAL 256 N -0.44 0.83 -0.34 0.00 2.07 -1.90 -0.38 116.25 116.09 1frq h VAL 256 Ca 0.09 -0.29 -0.13 0.00 0.82 0.00 0.00 66.70 67.19 1frq h VAL 256 Cb 0.62 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1frq h VAL 256 CO -0.49 0.15 -0.30 -0.08 0.02 0.00 0.00 177.57 176.87 1frq h GLU 257 N 0.84 0.81 -0.18 1.57 4.81 -1.71 -2.40 114.58 118.31 1frq h GLU 257 Ca 0.51 -0.41 -0.22 0.00 -0.13 0.00 0.00 59.36 59.11 1frq h GLU 257 Cb 0.68 0.01 0.01 0.00 0.63 0.00 0.00 28.75 30.08 1frq h GLU 257 CO -0.28 1.04 -0.73 -0.07 -0.73 0.00 0.00 179.01 178.24 1frq h LEU 258 N 0.59 0.94 -0.73 1.64 3.38 -0.79 -1.45 115.31 118.89 1frq h LEU 258 Ca 0.06 -0.60 -0.08 0.00 0.09 0.00 0.00 57.88 57.35 1frq h LEU 258 Cb 0.87 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1frq h LEU 258 CO 0.08 1.40 0.06 -0.25 0.09 0.00 0.00 178.44 179.81 1frq h TRP 259 N 0.56 1.10 -0.17 1.13 2.91 -1.13 0.08 115.95 120.44 1frq h TRP 259 Ca -0.04 -0.16 -0.10 0.00 1.13 0.00 0.00 58.89 59.71 1frq h TRP 259 Cb 1.36 -0.30 -0.01 0.00 -0.51 0.00 0.00 29.16 29.70 1frq h TRP 259 CO 0.08 0.95 -0.35 1.49 -1.03 0.00 0.00 178.44 179.58 1frq h GLU 260 N 0.96 0.35 -0.43 2.65 4.57 -1.32 -2.71 114.58 118.65 1frq h GLU 260 Ca 0.18 -0.15 -0.12 0.00 -1.18 0.00 0.00 59.36 58.09 1frq h GLU 260 Cb 0.48 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.04 1frq h GLU 260 CO 0.02 0.66 -0.22 0.52 -1.18 0.00 0.00 179.01 178.81 1frq h MET 261 N 0.30 0.86 0.00 1.92 2.86 -0.56 -2.92 114.93 117.40 1frq h MET 261 Ca 0.03 -0.36 -0.01 0.00 -2.06 0.00 0.00 59.70 57.31 1frq h MET 261 Cb 0.77 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.39 1frq h MET 261 CO 0.06 1.00 -0.05 -0.07 1.06 0.00 0.00 176.91 178.90 1frq h LEU 262 N 0.75 0.00 -0.00 1.22 3.38 -0.68 -2.31 115.31 117.66 1frq h LEU 262 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1frq h LEU 262 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1frq h LEU 262 CO 0.06 0.05 0.00 0.29 0.09 0.00 0.00 178.44 178.93 1frq n LYS 263 N -3.66 0.00 -3.58 1.13 5.02 -1.10 -4.82 118.16 111.15 1frq n LYS 263 Ca -0.02 0.08 -0.37 0.00 -2.02 0.00 0.00 58.31 55.98 1frq n LYS 263 Cb 0.16 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.60 1frq n LYS 263 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1frq s LYS 264 N -3.00 3.97 0.54 1.97 1.02 -0.87 -5.00 119.74 118.37 1frq s LYS 264 Ca 0.12 0.18 0.23 0.00 0.02 0.00 0.00 55.97 56.51 1frq s LYS 264 Cb 0.16 -3.30 1.41 0.00 -0.52 0.00 0.00 37.83 35.58 1frq s LYS 264 CO 0.45 0.51 2.08 0.22 -0.92 0.00 0.00 175.35 177.68 1frq h ASP 265 N 5.62 0.00 -0.43 2.83 3.58 -1.88 -1.91 116.42 124.24 1frq h ASP 265 Ca -0.48 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 56.96 1frq h ASP 265 Cb 1.20 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.24 1frq h ASP 265 CO 0.67 0.00 0.02 -0.46 -2.88 0.00 0.00 179.24 176.59 1frq n ASN 266 N -4.31 4.36 -4.83 2.28 6.94 -1.26 -4.88 115.26 113.56 1frq n ASN 266 Ca 0.03 -2.69 -0.36 0.00 -0.02 0.00 0.00 54.58 51.54 1frq n ASN 266 Cb 0.35 -0.64 -0.07 0.00 -2.36 0.00 0.00 39.78 37.06 1frq n ASN 266 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1frq s THR 267 N -2.27 5.28 -0.11 5.53 2.01 -0.72 -1.34 115.64 124.02 1frq s THR 267 Ca 0.39 0.12 -0.00 0.00 0.31 0.00 0.00 61.69 62.51 1frq s THR 267 Cb 0.30 -3.30 0.02 0.00 0.01 0.00 0.00 72.50 69.54 1frq s THR 267 CO 0.11 0.60 -0.07 -0.31 -0.69 0.00 0.00 174.62 174.27 1frq s TYR 268 N -0.86 1.36 -0.21 4.92 1.51 -0.06 -4.79 117.35 119.22 1frq s TYR 268 Ca 0.14 -0.65 -0.12 0.00 -1.01 0.00 0.00 57.07 55.43 1frq s TYR 268 Cb -0.12 -1.16 -0.05 0.00 -0.11 0.00 0.00 41.96 40.52 1frq s TYR 268 CO 0.03 -0.48 0.24 -0.06 -1.11 0.00 0.00 175.55 174.17 1frq s PHE 269 N 1.71 3.38 -0.05 2.71 0.40 0.14 -1.44 117.98 124.83 1frq s PHE 269 Ca 0.04 0.42 0.06 0.00 -0.60 0.00 0.00 56.93 56.85 1frq s PHE 269 Cb -0.13 -2.32 -0.01 0.00 0.51 0.00 0.00 43.02 41.07 1frq s PHE 269 CO -0.07 0.13 -0.24 0.71 0.70 0.00 0.00 175.22 176.45 1frq s TYR 270 N 0.84 2.31 -0.02 0.36 1.51 -0.64 0.18 117.35 121.88 1frq s TYR 270 Ca 0.12 -0.63 0.02 0.00 -1.01 0.00 0.00 57.07 55.58 1frq s TYR 270 Cb -0.13 -1.51 0.00 0.00 -0.11 0.00 0.00 41.96 40.21 1frq s TYR 270 CO 0.04 -0.17 -0.09 1.41 -1.11 0.00 0.00 175.55 175.63 1frq s MET 271 N -0.24 0.91 -0.20 -0.62 1.75 0.16 -1.77 119.30 119.29 1frq s MET 271 Ca -0.00 -0.30 -0.13 0.00 -1.25 0.00 0.00 55.69 54.00 1frq s MET 271 Cb -0.13 -0.86 0.06 0.00 2.84 0.00 0.00 34.83 36.75 1frq s MET 271 CO 0.02 0.13 0.50 0.00 -0.65 0.00 0.00 175.02 175.02 1frq n GLY 273 N 3.85 0.12 3.69 0.00 0.00 -1.11 -2.27 105.19 109.46 1frq n GLY 273 Ca -0.20 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 1frq n GLY 273 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1frq s LEU 274 N 0.00 4.32 0.27 0.99 2.01 -1.26 -0.50 118.68 124.52 1frq s LEU 274 Ca 0.00 2.15 0.17 0.00 0.01 0.00 0.00 54.13 56.46 1frq s LEU 274 Cb 0.00 -3.56 0.98 0.00 0.01 0.00 0.00 46.19 43.62 1frq s LEU 274 CO 0.00 -0.75 1.11 0.29 1.01 0.00 0.00 176.35 178.02 1frq n LYS 275 N 5.47 -0.04 -0.23 1.70 4.76 0.54 -0.93 118.16 129.42 1frq n LYS 275 Ca 0.14 0.95 0.04 0.00 -2.87 0.00 0.00 58.31 56.57 1frq n LYS 275 Cb 0.43 -1.75 0.16 0.00 -1.84 0.00 0.00 35.03 32.03 1frq n LYS 275 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1frq h GLY 276 N 0.00 0.95 0.32 0.72 0.00 -1.90 -2.51 103.07 100.64 1frq h GLY 276 Ca 0.61 -0.04 0.24 0.00 0.00 0.00 0.00 47.33 48.14 1frq h GLY 276 CO -0.49 -0.17 0.60 0.00 0.00 0.00 0.00 176.54 176.48 1frq h MET 277 N 0.28 0.06 -0.29 4.80 -0.00 -1.42 -2.67 114.93 115.69 1frq h MET 277 Ca 0.38 -0.00 0.06 0.00 -0.00 0.00 0.00 59.70 60.15 1frq h MET 277 Cb 0.63 -0.01 -0.06 0.00 -0.00 0.00 0.00 31.60 32.15 1frq h MET 277 CO -0.47 0.04 -0.14 1.49 -0.00 0.00 0.00 176.91 177.82 1frq h GLU 278 N 0.06 -0.10 -0.34 -0.10 4.81 -1.64 -3.07 114.58 114.20 1frq h GLU 278 Ca 0.41 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.67 1frq h GLU 278 Cb 1.54 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.91 1frq h GLU 278 CO -0.03 -0.06 0.17 -0.22 -0.73 0.00 0.00 179.01 178.13 1frq h LYS 279 N -0.10 0.33 0.00 1.92 3.64 -1.68 -2.21 116.57 118.48 1frq h LYS 279 Ca 0.15 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1frq h LYS 279 Cb 0.33 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1frq h LYS 279 CO -0.35 0.22 0.00 0.78 -2.27 0.00 0.00 179.45 177.83 1frq h GLY 280 N 0.34 0.00 0.66 5.01 0.00 -1.66 -1.82 103.07 105.59 1frq h GLY 280 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.15 1frq h GLY 280 CO -0.10 0.00 -1.94 1.39 0.00 0.00 0.00 176.54 175.88 1frq n ILE 281 N -2.42 1.59 -0.23 2.60 5.41 -1.03 -3.44 119.36 121.84 1frq n ILE 281 Ca 0.01 -0.77 -0.08 0.00 1.00 0.00 0.00 62.75 62.91 1frq n ILE 281 Cb 0.20 -1.06 0.03 0.00 -0.71 0.00 0.00 39.64 38.10 1frq n ILE 281 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 1frq h ASP 282 N 0.01 0.97 -0.57 4.38 3.32 -1.07 -0.85 116.42 122.61 1frq h ASP 282 Ca -0.38 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 56.43 1frq h ASP 282 Cb 2.06 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 41.33 1frq h ASP 282 CO 0.06 0.96 0.34 0.44 -1.72 0.00 0.00 179.24 179.32 1frq h ASP 283 N 0.94 0.68 -0.44 6.45 3.32 -1.48 0.14 116.42 126.02 1frq h ASP 283 Ca 0.20 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1frq h ASP 283 Cb 0.37 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 1frq h ASP 283 CO 0.00 0.54 0.23 0.40 -1.72 0.00 0.00 179.24 178.69 1frq h ILE 284 N 0.77 1.17 -0.34 0.35 1.08 -1.51 -3.23 117.51 115.80 1frq h ILE 284 Ca 0.20 -0.45 -0.17 0.00 -0.39 0.00 0.00 64.86 64.05 1frq h ILE 284 Cb -0.02 0.66 -0.00 0.00 -3.07 0.00 0.00 36.82 34.39 1frq h ILE 284 CO -0.04 0.18 -0.47 0.24 -0.69 0.00 0.00 178.15 177.37 1frq h MET 285 N 0.57 0.90 -0.89 2.37 2.86 -0.82 -2.99 114.93 116.94 1frq h MET 285 Ca 0.15 -0.52 0.10 0.00 -2.06 0.00 0.00 59.70 57.37 1frq h MET 285 Cb 0.08 0.04 -0.07 0.00 0.06 0.00 0.00 31.60 31.72 1frq h MET 285 CO -0.02 1.17 0.58 0.28 1.06 0.00 0.00 176.91 179.97 1frq h VAL 286 N 0.71 0.96 -0.15 -2.22 2.07 -0.75 -1.18 116.25 115.68 1frq h VAL 286 Ca 0.04 -0.30 -0.16 0.00 0.82 0.00 0.00 66.70 67.10 1frq h VAL 286 Cb 1.07 0.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.85 1frq h VAL 286 CO 0.11 0.16 -0.53 0.28 0.02 0.00 0.00 177.57 177.61 1frq h SER 287 N 0.87 0.73 -0.71 0.57 0.02 -1.56 -1.60 113.55 111.87 1frq h SER 287 Ca 0.42 -0.61 -0.06 0.00 -0.84 0.00 0.00 61.79 60.70 1frq h SER 287 Cb 0.43 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.73 1frq h SER 287 CO -0.18 1.21 0.21 -0.07 -1.14 0.00 0.00 176.83 176.86 1frq h LEU 288 N 0.29 1.04 -0.20 5.07 3.38 -1.31 -2.26 115.31 121.32 1frq h LEU 288 Ca -0.02 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 57.62 1frq h LEU 288 Cb 1.16 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 1frq h LEU 288 CO 0.11 0.99 -0.32 0.00 0.09 0.00 0.00 178.44 179.31 1frq h ALA 289 N 1.10 0.31 -0.83 1.53 0.00 -1.24 -3.11 119.26 117.01 1frq h ALA 289 Ca 0.23 -0.42 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1frq h ALA 289 Cb 0.33 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1frq h ALA 289 CO -0.00 0.34 0.55 0.00 0.00 0.00 0.00 179.25 180.14 1frq h ALA 290 N 0.61 1.41 0.00 0.00 0.00 -1.15 0.86 119.26 120.99 1frq h ALA 290 Ca 0.02 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1frq h ALA 290 Cb 0.91 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1frq h ALA 290 CO 0.07 0.55 0.11 0.00 0.00 0.00 0.00 179.25 179.99 1frq h ALA 291 N 1.48 1.10 -0.19 0.00 0.00 -1.34 0.38 119.26 120.70 1frq h ALA 291 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1frq h ALA 291 Cb -0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1frq h ALA 291 CO -0.07 -0.10 0.00 0.39 0.00 0.00 0.00 179.25 179.48 1frq n GLU 292 N -2.59 2.67 -1.12 0.00 1.02 0.14 -4.97 120.64 115.79 1frq n GLU 292 Ca -0.02 -1.74 0.00 0.00 -0.02 0.00 0.00 57.16 55.38 1frq n GLU 292 Cb 0.16 -1.15 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1frq n GLU 292 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1frq n GLY 293 N 0.11 0.40 3.57 0.62 0.00 0.13 -5.05 105.19 104.97 1frq n GLY 293 Ca 0.06 -1.04 -0.34 0.00 0.00 0.00 0.00 46.02 44.71 1frq n GLY 293 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1frq s ILE 294 N -2.00 3.83 -0.59 -0.61 1.01 -0.27 -4.98 121.20 117.59 1frq s ILE 294 Ca 0.00 -0.42 -0.21 0.00 0.00 0.00 0.00 60.65 60.02 1frq s ILE 294 Cb 0.00 -2.60 0.07 0.00 0.01 0.00 0.00 42.46 39.94 1frq s ILE 294 CO 0.00 0.57 0.82 -0.62 0.00 0.00 0.00 174.94 175.71 1frq s ASP 295 N -0.49 6.21 0.37 3.58 2.15 -1.26 -2.89 116.67 124.35 1frq s ASP 295 Ca 0.08 -1.00 0.17 0.00 0.43 0.00 0.00 52.55 52.23 1frq s ASP 295 Cb -0.12 -2.36 1.09 0.00 -0.30 0.00 0.00 42.92 41.23 1frq s ASP 295 CO 0.02 -1.20 1.73 -0.25 -0.17 0.00 0.00 175.17 175.30 1frq h TRP 296 N 9.30 0.77 -0.73 -5.34 -0.00 -1.90 -0.02 115.95 118.03 1frq h TRP 296 Ca -0.28 0.03 -0.03 0.00 -0.00 0.00 0.00 58.89 58.61 1frq h TRP 296 Cb 1.08 -0.22 -0.03 0.00 -0.00 0.00 0.00 29.16 29.99 1frq h TRP 296 CO 0.88 -0.01 0.35 0.82 -0.00 0.00 0.00 178.44 180.48 1frq h ILE 297 N 0.39 1.24 0.06 2.65 2.04 -1.98 0.21 117.51 122.12 1frq h ILE 297 Ca 0.66 -0.66 -0.24 0.00 1.00 0.00 0.00 64.86 65.62 1frq h ILE 297 Cb 1.59 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.99 1frq h ILE 297 CO -0.40 0.28 -1.09 -0.33 0.00 0.00 0.00 178.15 176.60 1frq h GLU 298 N 1.02 0.13 0.06 2.37 4.39 -1.60 -2.61 114.58 118.33 1frq h GLU 298 Ca 0.25 -0.22 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 1frq h GLU 298 Cb 0.11 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1frq h GLU 298 CO -0.03 1.09 -0.03 -0.92 -1.16 0.00 0.00 179.01 177.96 1frq h TYR 299 N 0.04 -0.07 -0.93 4.33 3.20 -0.76 -2.15 116.97 120.63 1frq h TYR 299 Ca -0.07 -0.00 0.16 0.00 3.14 0.00 0.00 58.73 61.96 1frq h TYR 299 Cb 1.83 0.02 -0.10 0.00 1.54 0.00 0.00 36.73 40.03 1frq h TYR 299 CO 0.03 0.28 0.53 -0.22 -1.64 0.00 0.00 178.16 177.13 1frq h LYS 300 N -0.44 0.70 -0.63 1.82 3.64 -0.66 0.88 116.57 121.89 1frq h LYS 300 Ca -0.01 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1frq h LYS 300 Cb 0.39 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 1frq h LYS 300 CO 0.01 0.46 0.41 -0.09 -2.27 0.00 0.00 179.45 177.98 1frq h ARG 301 N 0.72 0.82 -0.56 1.90 2.43 -1.32 0.23 114.38 118.61 1frq h ARG 301 Ca 0.51 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.54 1frq h ARG 301 Cb 0.73 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 1frq h ARG 301 CO -0.36 0.54 -0.03 1.96 -1.51 0.00 0.00 179.97 180.58 1frq h GLN 302 N 0.85 1.00 -0.21 0.20 4.20 -0.40 -1.75 115.11 119.00 1frq h GLN 302 Ca 0.23 -0.33 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 1frq h GLN 302 Cb -0.10 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.59 1frq h GLN 302 CO -0.05 1.01 0.13 -0.07 -0.67 0.00 0.00 178.83 179.18 1frq h LEU 303 N 0.89 0.25 -0.71 1.46 3.38 -0.09 -1.72 115.31 118.77 1frq h LEU 303 Ca 0.16 -0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.17 1frq h LEU 303 Cb 0.58 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.19 1frq h LEU 303 CO 0.03 0.22 0.37 0.11 0.09 0.00 0.00 178.44 179.26 1frq h LYS 304 N 0.27 0.62 0.00 1.13 1.57 -0.38 -1.30 116.57 118.48 1frq h LYS 304 Ca 0.08 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1frq h LYS 304 Cb 0.01 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1frq h LYS 304 CO -0.01 0.41 -0.22 -0.22 -0.57 0.00 0.00 179.45 178.84 1frq h LYS 305 N 0.64 0.00 -0.13 3.15 3.64 -1.07 -2.58 116.57 120.22 1frq h LYS 305 Ca 0.34 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 1frq h LYS 305 Cb 0.32 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1frq h LYS 305 CO -0.25 0.22 0.00 0.00 -2.27 0.00 0.00 179.45 177.16 1frq n ALA 306 N -2.29 2.51 -2.06 5.00 0.00 -0.66 -4.91 120.51 118.10 1frq n ALA 306 Ca -0.01 -0.60 -0.08 0.00 0.00 0.00 0.00 53.44 52.75 1frq n ALA 306 Cb 0.35 -1.03 -0.01 0.00 0.00 0.00 0.00 19.45 18.76 1frq n ALA 306 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1frq n GLU 307 N 0.63 -0.64 0.00 0.00 1.02 -0.88 -4.92 120.64 115.86 1frq n GLU 307 Ca 0.17 0.43 0.07 0.00 -0.02 0.00 0.00 57.16 57.81 1frq n GLU 307 Cb 0.43 -4.37 0.02 0.00 -0.02 0.00 0.00 31.44 27.49 1frq n GLU 307 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1frq n GLN 308 N -1.88 1.59 -3.74 3.49 6.02 -0.58 -4.80 117.38 117.48 1frq n GLN 308 Ca -0.09 -0.89 -0.29 0.00 -0.01 0.00 0.00 57.00 55.71 1frq n GLN 308 Cb 0.54 -1.21 -0.15 0.00 1.02 0.00 0.00 30.24 30.44 1frq n GLN 308 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 1frq s TRP 309 N -1.50 1.60 -0.15 1.08 -0.11 -1.23 0.26 118.94 118.90 1frq s TRP 309 Ca 0.12 -1.57 0.00 0.00 1.22 0.00 0.00 56.10 55.88 1frq s TRP 309 Cb 0.11 -1.57 -0.00 0.00 -1.50 0.00 0.00 33.47 30.50 1frq s TRP 309 CO 0.28 -0.82 -0.15 -0.80 -4.62 0.00 0.00 176.95 170.84 1frq s ASN 310 N 1.65 3.69 -0.02 5.86 0.01 0.13 -4.48 114.94 121.78 1frq s ASN 310 Ca 0.07 -0.45 0.02 0.00 -0.71 0.00 0.00 52.86 51.79 1frq s ASN 310 Cb -0.17 -1.56 0.00 0.00 0.41 0.00 0.00 41.25 39.93 1frq s ASN 310 CO -0.21 0.10 -0.07 -0.69 -1.51 0.00 0.00 177.10 174.72 1frq s VAL 311 N 0.70 0.60 -0.36 1.60 1.01 -1.26 0.39 120.40 123.08 1frq s VAL 311 Ca -0.07 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.64 1frq s VAL 311 Cb -0.16 -0.53 0.15 0.00 0.00 0.00 0.00 36.38 35.84 1frq s VAL 311 CO 0.02 0.19 0.35 0.00 0.00 0.00 0.00 175.10 175.65 1frq s ALA 312 N 0.07 -0.24 0.17 5.51 0.00 -0.55 -4.96 121.76 121.76 1frq s ALA 312 Ca -0.01 -1.05 0.09 0.00 0.00 0.00 0.00 51.96 50.99 1frq s ALA 312 Cb -0.06 -1.96 -0.04 0.00 0.00 0.00 0.00 23.12 21.06 1frq s ALA 312 CO -0.00 -2.10 -0.11 0.14 0.00 0.00 0.00 175.76 173.70 1frq s VAL 313 N 1.46 3.16 0.00 0.00 -7.23 -1.26 -2.74 120.40 113.79 1frq s VAL 313 Ca 0.16 -1.62 0.00 0.00 -1.81 0.00 0.00 61.98 58.72 1frq s VAL 313 Cb -0.16 -2.54 0.00 0.00 0.56 0.00 0.00 36.38 34.23 1frq s VAL 313 CO -0.05 -0.07 0.00 0.00 -0.31 0.00 0.00 175.10 174.66