#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fnd s SER 20 N 0.00 6.65 0.00 0.41 0.15 -1.26 -4.92 113.70 114.73 1fnd s SER 20 Ca 0.00 1.85 0.26 0.00 0.70 0.00 0.00 55.95 58.76 1fnd s SER 20 Cb 0.00 -2.56 0.78 0.00 -1.71 0.00 0.00 66.02 62.53 1fnd s SER 20 CO 0.00 -0.56 1.58 0.29 1.20 0.00 0.00 173.24 175.75 1fnd n LYS 21 N -0.69 0.58 -3.97 5.44 5.02 -1.26 -4.91 118.16 118.37 1fnd n LYS 21 Ca 0.08 -0.31 -0.22 0.00 -2.02 0.00 0.00 58.31 55.84 1fnd n LYS 21 Cb 0.53 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 34.00 1fnd n LYS 21 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1fnd s LYS 22 N -2.64 2.70 -1.47 1.97 1.02 -1.26 -0.31 119.74 119.74 1fnd s LYS 22 Ca 0.21 -1.28 -0.14 0.00 0.02 0.00 0.00 55.97 54.79 1fnd s LYS 22 Cb 0.19 -2.43 0.03 0.00 -0.52 0.00 0.00 37.83 35.09 1fnd s LYS 22 CO 0.56 0.19 2.30 -1.33 -0.92 0.00 0.00 175.35 176.15 1fnd n MET 23 N -1.26 2.95 0.02 1.68 2.81 -0.15 -4.60 117.12 118.57 1fnd n MET 23 Ca -0.04 -2.57 0.11 0.00 -1.81 0.00 0.00 57.70 53.39 1fnd n MET 23 Cb 0.59 -3.24 -0.03 0.00 -0.71 0.00 0.00 33.22 29.83 1fnd n MET 23 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1fnd n GLU 24 N 5.81 0.29 -2.40 0.03 1.02 -1.26 -4.84 120.64 119.29 1fnd n GLU 24 Ca 0.55 -0.03 -0.42 0.00 -0.02 0.00 0.00 57.16 57.23 1fnd n GLU 24 Cb 0.37 -1.56 -0.03 0.00 -0.02 0.00 0.00 31.44 30.20 1fnd n GLU 24 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1fnd s GLU 25 N -3.21 4.36 -0.96 3.49 8.01 -1.26 -3.41 118.70 125.71 1fnd s GLU 25 Ca 0.03 1.75 0.00 0.00 0.01 0.00 0.00 54.97 56.76 1fnd s GLU 25 Cb 0.15 -3.51 0.00 0.00 -4.31 0.00 0.00 34.13 26.46 1fnd s GLU 25 CO 0.83 -0.42 0.00 0.41 0.01 0.00 0.00 175.26 176.09 1fnd n GLY 26 N 3.38 0.27 3.82 -1.39 0.00 -1.26 -5.02 105.19 104.98 1fnd n GLY 26 Ca 0.11 -0.47 -0.31 0.00 0.00 0.00 0.00 46.02 45.35 1fnd n GLY 26 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1fnd s ILE 27 N -2.49 4.04 -0.01 -0.61 -4.36 -1.22 -5.06 121.20 111.49 1fnd s ILE 27 Ca 0.00 0.72 0.02 0.00 -0.26 0.00 0.00 60.65 61.13 1fnd s ILE 27 Cb 0.00 -3.43 -0.03 0.00 1.25 0.00 0.00 42.46 40.25 1fnd s ILE 27 CO 0.00 -0.81 -0.05 -0.89 0.24 0.00 0.00 174.94 173.42 1fnd s THR 28 N -2.95 3.77 -0.03 8.37 2.01 -1.26 -5.11 115.64 120.44 1fnd s THR 28 Ca 0.59 -0.68 -0.01 0.00 0.31 0.00 0.00 61.69 61.90 1fnd s THR 28 Cb -0.14 -2.63 0.03 0.00 0.01 0.00 0.00 72.50 69.77 1fnd s THR 28 CO 0.51 0.43 0.03 -0.69 -0.69 0.00 0.00 174.62 174.22 1fnd s VAL 29 N -0.98 -0.03 -1.43 3.82 1.01 -1.26 -4.42 120.40 117.12 1fnd s VAL 29 Ca 0.17 0.27 -0.10 0.00 0.00 0.00 0.00 61.98 62.31 1fnd s VAL 29 Cb -0.11 -0.15 0.05 0.00 0.00 0.00 0.00 36.38 36.17 1fnd s VAL 29 CO 0.07 0.13 1.04 0.59 0.00 0.00 0.00 175.10 176.93 1fnd n ASN 30 N 4.58 -4.91 -0.26 3.32 5.03 0.89 -4.82 115.26 119.10 1fnd n ASN 30 Ca -0.19 -0.69 -0.02 0.00 0.87 0.00 0.00 54.58 54.55 1fnd n ASN 30 Cb 0.50 -4.39 0.10 0.00 -1.02 0.00 0.00 39.78 34.96 1fnd n ASN 30 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 1fnd h LYS 31 N -2.29 0.81 -6.07 3.52 3.64 -1.49 -3.41 116.57 111.27 1fnd h LYS 31 Ca -0.58 -0.05 -0.68 0.00 -1.27 0.00 0.00 60.65 58.07 1fnd h LYS 31 Cb 1.37 -0.18 -0.21 0.00 -0.41 0.00 0.00 32.23 32.80 1fnd h LYS 31 CO 0.61 0.54 -0.72 -0.06 -2.27 0.00 0.00 179.45 177.55 1fnd s PHE 32 N -6.10 2.87 0.31 1.91 0.08 -0.72 -4.97 117.98 111.36 1fnd s PHE 32 Ca -0.13 -0.09 0.06 0.00 0.12 0.00 0.00 56.93 56.89 1fnd s PHE 32 Cb 0.16 -1.72 -0.06 0.00 -0.57 0.00 0.00 43.02 40.83 1fnd s PHE 32 CO 0.77 0.23 -0.02 0.15 -0.10 0.00 0.00 175.22 176.25 1fnd s LYS 33 N -0.62 1.65 0.35 0.44 1.02 -1.21 -0.17 119.74 121.20 1fnd s LYS 33 Ca 0.09 -1.87 0.08 0.00 0.02 0.00 0.00 55.97 54.29 1fnd s LYS 33 Cb -0.11 -1.19 0.80 0.00 -0.52 0.00 0.00 37.83 36.81 1fnd s LYS 33 CO 0.02 -0.02 1.88 -1.35 -0.92 0.00 0.00 175.35 174.95 1fnd h PRO 34 N 2.15 0.69 0.00 -1.68 0.11 -1.98 0.18 132.00 131.47 1fnd h PRO 34 Ca -0.41 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1fnd h PRO 34 Cb 1.24 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1fnd h PRO 34 CO 0.70 0.45 0.00 0.87 -0.21 0.00 0.00 178.00 179.81 1fnd h LYS 35 N 0.71 0.00 -1.76 1.05 1.57 -2.01 -3.36 116.57 112.77 1fnd h LYS 35 Ca 0.44 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.70 1fnd h LYS 35 Cb 0.67 0.00 -0.35 0.00 0.08 0.00 0.00 32.23 32.63 1fnd h LYS 35 CO -0.20 0.00 -1.01 0.25 -0.57 0.00 0.00 179.45 177.92 1fnd n THR 36 N -2.83 -0.64 -1.00 -0.16 -2.24 0.44 -5.13 114.28 102.71 1fnd n THR 36 Ca 0.02 -3.61 -0.29 0.00 -2.27 0.00 0.00 64.05 57.91 1fnd n THR 36 Cb 0.37 -1.46 0.18 0.00 -2.10 0.00 0.00 70.33 67.33 1fnd n THR 36 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1fnd s PRO 37 N -0.82 0.39 -0.07 -0.78 0.04 -0.02 -3.29 135.00 130.45 1fnd s PRO 37 Ca 0.34 0.75 -0.14 0.00 0.04 0.00 0.00 61.00 61.99 1fnd s PRO 37 Cb 0.17 -1.71 -0.05 0.00 0.04 0.00 0.00 34.50 32.94 1fnd s PRO 37 CO -0.13 -2.82 0.36 -0.47 0.04 0.00 0.00 177.00 173.98 1fnd s TYR 38 N -2.82 3.62 -0.42 0.56 5.04 0.10 -4.87 117.35 118.56 1fnd s TYR 38 Ca 0.66 0.84 -0.13 0.00 -2.44 0.00 0.00 57.07 55.99 1fnd s TYR 38 Cb -0.20 -2.31 0.05 0.00 0.35 0.00 0.00 41.96 39.85 1fnd s TYR 38 CO 0.59 0.49 0.30 0.08 -1.34 0.00 0.00 175.55 175.67 1fnd s VAL 39 N -0.45 4.87 0.57 3.14 1.01 -1.26 -1.03 120.40 127.26 1fnd s VAL 39 Ca 0.21 -0.99 0.07 0.00 0.00 0.00 0.00 61.98 61.27 1fnd s VAL 39 Cb -0.15 -3.83 0.07 0.00 0.00 0.00 0.00 36.38 32.46 1fnd s VAL 39 CO 0.10 -0.42 0.55 0.61 0.00 0.00 0.00 175.10 175.94 1fnd n GLY 40 N 5.09 2.47 3.26 4.51 0.00 -0.04 -4.88 105.19 115.60 1fnd n GLY 40 Ca -0.11 -2.28 -0.25 0.00 0.00 0.00 0.00 46.02 43.38 1fnd n GLY 40 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fnd s ARG 41 N -4.42 1.31 -0.00 1.61 0.52 -1.22 -0.60 118.95 116.15 1fnd s ARG 41 Ca 0.42 -1.00 -0.30 0.00 -0.52 0.00 0.00 55.73 54.33 1fnd s ARG 41 Cb -0.03 -1.46 -0.05 0.00 0.52 0.00 0.00 34.95 33.92 1fnd s ARG 41 CO 0.27 0.36 1.35 0.00 0.02 0.00 0.00 175.30 177.30 1fnd n LEU 43 N 5.16 1.97 -3.88 0.00 4.77 0.08 0.65 117.00 125.77 1fnd n LEU 43 Ca 0.12 0.37 -0.10 0.00 -0.03 0.00 0.00 56.01 56.37 1fnd n LEU 43 Cb 0.44 -0.93 -0.09 0.00 -2.33 0.00 0.00 43.42 40.51 1fnd n LEU 43 CO 0.58 0.43 -0.15 -0.76 -1.33 0.00 0.00 177.39 176.15 1fnd s LEU 44 N -7.66 1.56 -0.27 2.23 1.43 -1.16 -4.65 118.68 110.15 1fnd s LEU 44 Ca -0.32 -0.40 -0.01 0.00 -1.03 0.00 0.00 54.13 52.37 1fnd s LEU 44 Cb 0.09 0.78 0.16 0.00 0.03 0.00 0.00 46.19 47.25 1fnd s LEU 44 CO 0.57 -0.51 0.47 0.21 0.23 0.00 0.00 176.35 177.32 1fnd s ASN 45 N -1.98 -0.41 -0.01 2.29 2.47 -1.26 -0.88 114.94 115.17 1fnd s ASN 45 Ca -0.07 0.38 0.05 0.00 0.42 0.00 0.00 52.86 53.64 1fnd s ASN 45 Cb -0.02 1.53 -0.01 0.00 -1.45 0.00 0.00 41.25 41.29 1fnd s ASN 45 CO -0.03 -0.29 -0.17 -0.89 -3.72 0.00 0.00 177.10 172.00 1fnd s THR 46 N 2.67 1.32 -0.16 -5.21 2.01 -0.67 -4.98 115.64 110.62 1fnd s THR 46 Ca 0.15 -0.74 -0.29 0.00 0.31 0.00 0.00 61.69 61.12 1fnd s THR 46 Cb -0.15 -1.10 -0.01 0.00 0.01 0.00 0.00 72.50 71.25 1fnd s THR 46 CO -0.20 0.36 1.13 -0.75 -0.69 0.00 0.00 174.62 174.47 1fnd s LYS 47 N -0.44 4.29 0.00 4.92 2.20 -1.26 -0.84 119.74 128.61 1fnd s LYS 47 Ca 0.06 1.51 0.15 0.00 -0.36 0.00 0.00 55.97 57.34 1fnd s LYS 47 Cb -0.07 -3.65 0.32 0.00 -1.51 0.00 0.00 37.83 32.92 1fnd s LYS 47 CO -0.01 -0.57 1.23 0.44 -0.36 0.00 0.00 175.35 176.08 1fnd n ILE 48 N 5.10 0.62 -4.13 5.43 -5.35 -0.25 -4.94 119.36 115.84 1fnd n ILE 48 Ca 0.12 -0.81 -0.26 0.00 -0.27 0.00 0.00 62.75 61.53 1fnd n ILE 48 Cb 0.46 0.82 -0.06 0.00 -1.74 0.00 0.00 39.64 39.12 1fnd n ILE 48 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1fnd s THR 49 N -1.12 4.20 0.74 7.28 -4.23 -1.23 -4.83 115.64 116.44 1fnd s THR 49 Ca 0.28 -1.26 -0.11 0.00 -1.18 0.00 0.00 61.69 59.42 1fnd s THR 49 Cb 0.16 -3.15 0.04 0.00 1.34 0.00 0.00 72.50 70.89 1fnd s THR 49 CO 0.22 -0.15 1.11 -0.83 -0.54 0.00 0.00 174.62 174.43 1fnd s GLY 50 N -3.16 1.62 0.43 3.99 0.00 0.59 -4.93 107.32 105.86 1fnd s GLY 50 Ca 0.30 -0.53 0.11 0.00 0.00 0.00 0.00 44.72 44.60 1fnd s GLY 50 CO 0.22 -0.12 2.00 -0.55 0.00 0.00 0.00 173.10 174.64 1fnd h ASP 51 N -0.77 0.18 -0.26 1.64 3.32 -1.96 -1.40 116.42 117.16 1fnd h ASP 51 Ca -0.45 -0.02 0.06 0.00 0.02 0.00 0.00 57.03 56.63 1fnd h ASP 51 Cb 1.29 -0.05 -0.06 0.00 0.22 0.00 0.00 39.33 40.73 1fnd h ASP 51 CO 0.64 0.26 -0.14 -0.78 -1.72 0.00 0.00 179.24 177.50 1fnd h ASP 52 N 0.19 -0.46 -1.49 6.45 3.58 -1.93 -3.45 116.42 119.30 1fnd h ASP 52 Ca 0.04 0.11 -0.51 0.00 0.42 0.00 0.00 57.03 57.09 1fnd h ASP 52 Cb 0.22 0.25 0.14 0.00 1.72 0.00 0.00 39.33 41.66 1fnd h ASP 52 CO 0.01 -0.18 -0.85 0.00 -2.88 0.00 0.00 179.24 175.34 1fnd n ALA 53 N -2.65 -2.75 -2.94 -0.78 0.00 -0.53 -4.84 120.51 106.01 1fnd n ALA 53 Ca -0.00 0.05 -0.44 0.00 0.00 0.00 0.00 53.44 53.05 1fnd n ALA 53 Cb 0.22 -1.21 -0.00 0.00 0.00 0.00 0.00 19.45 18.46 1fnd n ALA 53 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1fnd s PRO 54 N -0.83 4.05 0.00 0.00 0.04 -1.26 -4.83 135.00 132.16 1fnd s PRO 54 Ca 0.49 -2.51 0.00 0.00 0.04 0.00 0.00 61.00 59.02 1fnd s PRO 54 Cb -0.49 -5.05 0.00 0.00 0.04 0.00 0.00 34.50 29.00 1fnd s PRO 54 CO 0.53 -1.77 0.00 0.41 0.04 0.00 0.00 177.00 176.21 1fnd n GLY 55 N 4.24 2.83 3.49 0.56 0.00 -1.26 -5.05 105.19 109.99 1fnd n GLY 55 Ca 0.36 -1.97 -0.32 0.00 0.00 0.00 0.00 46.02 44.08 1fnd n GLY 55 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fnd s GLU 56 N -2.87 2.37 -0.04 1.61 2.02 -1.26 -4.93 118.70 115.60 1fnd s GLU 56 Ca 0.00 -0.79 0.02 0.00 0.02 0.00 0.00 54.97 54.22 1fnd s GLU 56 Cb 0.00 -2.33 0.01 0.00 0.10 0.00 0.00 34.13 31.91 1fnd s GLU 56 CO 0.00 0.59 -0.10 0.99 0.02 0.00 0.00 175.26 176.76 1fnd s THR 57 N -0.83 0.89 0.09 3.63 2.01 -1.26 -1.02 115.64 119.16 1fnd s THR 57 Ca 0.13 -0.40 0.09 0.00 0.31 0.00 0.00 61.69 61.83 1fnd s THR 57 Cb -0.11 -0.81 -0.03 0.00 0.01 0.00 0.00 72.50 71.56 1fnd s THR 57 CO 0.03 0.28 -0.23 0.26 -0.69 0.00 0.00 174.62 174.27 1fnd s TRP 58 N 0.35 1.99 -0.21 4.92 0.52 -0.29 -1.09 118.94 125.13 1fnd s TRP 58 Ca -0.06 -0.40 -0.04 0.00 0.02 0.00 0.00 56.10 55.62 1fnd s TRP 58 Cb -0.11 -1.11 -0.01 0.00 -1.15 0.00 0.00 33.47 31.08 1fnd s TRP 58 CO 0.01 0.22 -0.04 -1.58 0.02 0.00 0.00 176.95 175.58 1fnd s HIS 59 N -1.03 2.96 0.05 -1.98 2.46 -0.02 -1.06 115.29 116.67 1fnd s HIS 59 Ca 0.09 -0.81 0.05 0.00 0.47 0.00 0.00 55.06 54.87 1fnd s HIS 59 Cb -0.10 -2.07 -0.02 0.00 -0.13 0.00 0.00 32.58 30.25 1fnd s HIS 59 CO 0.04 -0.45 -0.15 0.00 -2.47 0.00 0.00 174.74 171.71 1fnd s MET 60 N 1.27 0.93 -0.06 2.88 0.23 -0.24 -1.67 119.30 122.63 1fnd s MET 60 Ca 0.03 -0.85 0.03 0.00 -1.03 0.00 0.00 55.69 53.87 1fnd s MET 60 Cb -0.14 -0.96 0.01 0.00 -1.53 0.00 0.00 34.83 32.20 1fnd s MET 60 CO -0.01 0.23 -0.15 0.08 -2.03 0.00 0.00 175.02 173.14 1fnd s VAL 61 N -0.99 1.32 0.09 5.16 1.01 -0.06 -1.12 120.40 125.82 1fnd s VAL 61 Ca 0.01 -0.61 0.09 0.00 0.00 0.00 0.00 61.98 61.48 1fnd s VAL 61 Cb -0.09 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1fnd s VAL 61 CO 0.02 0.39 -0.23 -0.36 0.00 0.00 0.00 175.10 174.92 1fnd s PHE 62 N 0.44 2.41 0.07 5.22 0.08 0.24 -0.74 117.98 125.71 1fnd s PHE 62 Ca -0.12 -0.34 -0.27 0.00 0.12 0.00 0.00 56.93 56.33 1fnd s PHE 62 Cb -0.15 -1.34 -0.06 0.00 -0.57 0.00 0.00 43.02 40.91 1fnd s PHE 62 CO 0.04 0.29 0.84 0.45 -0.10 0.00 0.00 175.22 176.74 1fnd s SER 63 N -1.81 7.32 0.00 1.36 0.15 0.09 -1.04 113.70 119.77 1fnd s SER 63 Ca 0.15 1.58 0.00 0.00 0.70 0.00 0.00 55.95 58.38 1fnd s SER 63 Cb -0.10 -2.51 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 1fnd s SER 63 CO 0.06 -0.01 0.33 0.00 1.20 0.00 0.00 173.24 174.82 1fnd n HIS 64 N 2.78 0.00 -3.25 3.44 1.44 -0.30 -3.41 115.22 115.91 1fnd n HIS 64 Ca -0.01 -0.05 -0.21 0.00 -2.01 0.00 0.00 57.72 55.44 1fnd n HIS 64 Cb 0.50 -0.01 -0.01 0.00 0.12 0.00 0.00 29.99 30.59 1fnd n HIS 64 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1fnd n GLU 65 N -0.05 -2.96 -0.88 -1.40 -0.58 -0.94 -0.09 120.64 113.75 1fnd n GLU 65 Ca 0.00 0.40 0.00 0.00 -0.42 0.00 0.00 57.16 57.14 1fnd n GLU 65 Cb 0.24 -5.05 0.00 0.00 -0.57 0.00 0.00 31.44 26.06 1fnd n GLU 65 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1fnd n GLY 66 N -1.03 0.84 0.15 0.62 0.00 -1.25 -4.88 105.19 99.63 1fnd n GLY 66 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.13 1fnd n GLY 66 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1fnd h GLU 67 N 2.75 0.00 -4.22 1.61 4.39 -0.82 -3.39 114.58 114.90 1fnd h GLU 67 Ca 0.00 0.00 -0.71 0.00 0.34 0.00 0.00 59.36 58.99 1fnd h GLU 67 Cb 0.00 0.00 -0.33 0.00 -0.10 0.00 0.00 28.75 28.32 1fnd h GLU 67 CO 0.00 0.00 -0.44 0.42 -1.16 0.00 0.00 179.01 177.83 1fnd s ILE 68 N -3.18 3.73 -1.39 3.13 1.01 -1.26 -5.01 121.20 118.23 1fnd s ILE 68 Ca 0.07 -2.18 -0.12 0.00 0.00 0.00 0.00 60.65 58.43 1fnd s ILE 68 Cb 0.09 -3.49 0.09 0.00 0.01 0.00 0.00 42.46 39.16 1fnd s ILE 68 CO 0.66 -0.77 2.11 -0.81 0.00 0.00 0.00 174.94 176.14 1fnd n PRO 69 N 4.44 3.26 -2.07 2.79 -0.04 -1.26 -4.98 135.00 137.14 1fnd n PRO 69 Ca -0.01 -3.00 -0.29 0.00 -0.04 0.00 0.00 63.50 60.15 1fnd n PRO 69 Cb 0.41 -3.10 0.03 0.00 -0.04 0.00 0.00 33.50 30.80 1fnd n PRO 69 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1fnd s TYR 70 N 1.83 3.37 0.27 0.54 -0.85 -1.26 -4.42 117.35 116.84 1fnd s TYR 70 Ca 0.45 0.96 0.11 0.00 -0.52 0.00 0.00 57.07 58.07 1fnd s TYR 70 Cb 0.12 -2.87 -0.05 0.00 0.38 0.00 0.00 41.96 39.54 1fnd s TYR 70 CO -0.05 -0.95 -0.11 0.50 -1.52 0.00 0.00 175.55 173.42 1fnd s ARG 71 N -5.19 1.95 0.15 -3.49 3.52 -1.26 -4.67 118.95 109.96 1fnd s ARG 71 Ca 0.56 -1.61 -0.34 0.00 -0.13 0.00 0.00 55.73 54.21 1fnd s ARG 71 Cb -0.11 -1.95 -0.15 0.00 -1.56 0.00 0.00 34.95 31.19 1fnd s ARG 71 CO 0.50 0.35 1.47 0.39 -0.81 0.00 0.00 175.30 177.20 1fnd n GLU 72 N -0.73 1.80 0.00 5.12 4.71 -1.26 -2.29 120.64 127.98 1fnd n GLU 72 Ca -0.06 0.65 0.00 0.00 -0.01 0.00 0.00 57.16 57.74 1fnd n GLU 72 Cb 0.59 -2.36 0.00 0.00 -1.01 0.00 0.00 31.44 28.67 1fnd n GLU 72 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1fnd n GLY 73 N 2.97 3.08 3.93 0.62 0.00 -1.26 -4.27 105.19 110.25 1fnd n GLY 73 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 1fnd n GLY 73 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fnd s GLN 74 N -0.81 1.86 0.31 1.61 -0.21 -0.97 -4.34 119.66 117.12 1fnd s GLN 74 Ca 0.00 -0.26 0.09 0.00 0.02 0.00 0.00 55.36 55.20 1fnd s GLN 74 Cb 0.00 -2.08 -0.06 0.00 1.00 0.00 0.00 33.01 31.87 1fnd s GLN 74 CO 0.00 -1.52 -0.09 -1.12 -2.12 0.00 0.00 175.29 170.44 1fnd s SER 75 N -4.61 3.34 0.26 5.90 0.01 0.28 -1.79 113.70 117.10 1fnd s SER 75 Ca 0.63 -1.17 0.12 0.00 1.31 0.00 0.00 55.95 56.84 1fnd s SER 75 Cb -0.09 -0.27 -0.05 0.00 0.21 0.00 0.00 66.02 65.81 1fnd s SER 75 CO 0.47 -0.23 -0.21 0.68 0.41 0.00 0.00 173.24 174.37 1fnd s VAL 76 N -2.75 2.47 -0.09 3.43 -7.23 -0.69 -1.02 120.40 114.51 1fnd s VAL 76 Ca 0.31 -2.33 -0.05 0.00 -1.81 0.00 0.00 61.98 58.10 1fnd s VAL 76 Cb 0.02 -2.27 -0.04 0.00 0.56 0.00 0.00 36.38 34.65 1fnd s VAL 76 CO 0.14 -0.34 0.13 -0.83 -0.31 0.00 0.00 175.10 173.89 1fnd s GLY 77 N -3.34 2.12 -0.10 2.32 0.00 -0.35 -1.30 107.32 106.66 1fnd s GLY 77 Ca 0.28 -0.70 0.01 0.00 0.00 0.00 0.00 44.72 44.31 1fnd s GLY 77 CO 0.14 -0.48 -0.13 0.14 0.00 0.00 0.00 173.10 172.77 1fnd s VAL 78 N -1.09 3.13 -0.43 1.40 1.01 0.04 -0.95 120.40 123.51 1fnd s VAL 78 Ca 0.18 -0.66 -0.08 0.00 0.00 0.00 0.00 61.98 61.41 1fnd s VAL 78 Cb -0.12 -2.28 0.09 0.00 0.00 0.00 0.00 36.38 34.06 1fnd s VAL 78 CO 0.08 0.55 0.27 -0.63 0.00 0.00 0.00 175.10 175.36 1fnd s ILE 79 N -0.06 4.12 0.44 2.22 1.01 -0.58 -1.89 121.20 126.46 1fnd s ILE 79 Ca -0.02 -1.53 -0.25 0.00 0.00 0.00 0.00 60.65 58.84 1fnd s ILE 79 Cb -0.14 -3.58 -0.08 0.00 0.01 0.00 0.00 42.46 38.67 1fnd s ILE 79 CO 0.04 -0.57 1.36 -2.16 0.00 0.00 0.00 174.94 173.61 1fnd s PRO 80 N 1.38 3.78 0.53 2.79 0.04 -1.26 -4.28 135.00 137.99 1fnd s PRO 80 Ca 0.04 2.28 -0.21 0.00 0.04 0.00 0.00 61.00 63.14 1fnd s PRO 80 Cb -0.24 -2.67 -0.05 0.00 0.04 0.00 0.00 34.50 31.58 1fnd s PRO 80 CO 0.01 -0.69 1.26 -0.51 0.04 0.00 0.00 177.00 177.11 1fnd s ASP 81 N -0.65 5.53 0.00 6.66 1.01 -1.26 -4.38 116.67 123.58 1fnd s ASP 81 Ca 0.60 2.52 0.00 0.00 0.71 0.00 0.00 52.55 56.37 1fnd s ASP 81 Cb -0.41 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 40.91 1fnd s ASP 81 CO 0.52 -1.37 0.00 0.61 0.21 0.00 0.00 175.17 175.14 1fnd n GLY 82 N 0.58 -0.47 3.27 0.21 0.00 -1.26 -4.96 105.19 102.56 1fnd n GLY 82 Ca 0.10 -2.21 -0.17 0.00 0.00 0.00 0.00 46.02 43.75 1fnd n GLY 82 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fnd s GLU 83 N 0.00 1.10 0.13 1.61 2.02 -1.26 -3.92 118.70 118.39 1fnd s GLU 83 Ca 0.00 -1.40 -0.02 0.00 0.02 0.00 0.00 54.97 53.57 1fnd s GLU 83 Cb 0.00 -0.84 0.03 0.00 0.10 0.00 0.00 34.13 33.42 1fnd s GLU 83 CO 0.00 0.14 0.17 -0.40 0.02 0.00 0.00 175.26 175.19 1fnd n ASP 84 N 0.05 -0.13 0.04 -0.19 5.68 1.38 -4.79 116.55 118.60 1fnd n ASP 84 Ca -0.12 -1.01 0.09 0.00 -0.50 0.00 0.00 54.79 53.26 1fnd n ASP 84 Cb 0.59 -0.13 0.39 0.00 -1.14 0.00 0.00 41.12 40.83 1fnd n ASP 84 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 1fnd n LYS 85 N -1.43 0.07 -0.71 0.11 2.85 -1.26 -0.88 118.16 116.90 1fnd n LYS 85 Ca 0.02 0.28 0.08 0.00 -1.05 0.00 0.00 58.31 57.64 1fnd n LYS 85 Cb 0.08 -1.62 0.36 0.00 -0.65 0.00 0.00 35.03 33.19 1fnd n LYS 85 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1fnd n ASN 86 N -1.75 5.03 -1.01 -5.58 3.02 -1.26 -4.93 115.26 108.77 1fnd n ASN 86 Ca 0.03 -2.82 -0.12 0.00 -0.03 0.00 0.00 54.58 51.64 1fnd n ASN 86 Cb 0.21 -0.62 -0.05 0.00 -0.61 0.00 0.00 39.78 38.72 1fnd n ASN 86 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fnd n GLY 87 N 0.47 1.16 3.91 7.41 0.00 -0.06 -5.00 105.19 113.08 1fnd n GLY 87 Ca 0.25 -0.44 -0.20 0.00 0.00 0.00 0.00 46.02 45.64 1fnd n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fnd s LYS 88 N -3.25 2.91 0.50 1.61 1.02 -1.26 -4.76 119.74 116.51 1fnd s LYS 88 Ca 0.00 -1.15 -0.22 0.00 0.02 0.00 0.00 55.97 54.62 1fnd s LYS 88 Cb 0.00 -2.62 -0.07 0.00 -0.52 0.00 0.00 37.83 34.62 1fnd s LYS 88 CO 0.00 0.12 1.17 -2.14 -0.92 0.00 0.00 175.35 173.58 1fnd s PRO 89 N -4.05 3.55 0.77 -1.68 0.02 -1.26 0.41 135.00 132.76 1fnd s PRO 89 Ca 0.41 1.77 -0.14 0.00 0.02 0.00 0.00 61.00 63.06 1fnd s PRO 89 Cb -0.07 -2.26 0.06 0.00 0.02 0.00 0.00 34.50 32.25 1fnd s PRO 89 CO 0.28 -0.73 1.22 0.72 -0.33 0.00 0.00 177.00 178.16 1fnd n HIS 90 N -0.82 1.41 -2.53 6.54 8.25 -1.25 -4.52 115.22 122.29 1fnd n HIS 90 Ca 0.09 0.41 -0.34 0.00 -0.26 0.00 0.00 57.72 57.62 1fnd n HIS 90 Cb 0.49 -2.14 -0.03 0.00 1.12 0.00 0.00 29.99 29.42 1fnd n HIS 90 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1fnd s LYS 91 N -3.92 3.82 0.56 -0.41 1.02 -1.26 -4.79 119.74 114.76 1fnd s LYS 91 Ca 0.76 1.39 -0.20 0.00 0.02 0.00 0.00 55.97 57.94 1fnd s LYS 91 Cb -0.31 -2.14 -0.05 0.00 -0.52 0.00 0.00 37.83 34.81 1fnd s LYS 91 CO 0.48 -0.42 1.19 -0.48 -0.92 0.00 0.00 175.35 175.20 1fnd s LEU 92 N -3.41 3.75 -0.04 3.17 0.05 -1.26 -4.66 118.68 116.27 1fnd s LEU 92 Ca 0.67 2.34 0.01 0.00 0.05 0.00 0.00 54.13 57.19 1fnd s LEU 92 Cb -0.17 -4.53 -0.03 0.00 -2.05 0.00 0.00 46.19 39.41 1fnd s LEU 92 CO 0.21 -1.39 -0.06 -0.13 -0.55 0.00 0.00 176.35 174.44 1fnd s ARG 93 N -3.21 2.72 0.10 1.48 3.00 -0.79 -4.94 118.95 117.31 1fnd s ARG 93 Ca 0.74 -0.59 -0.12 0.00 0.00 0.00 0.00 55.73 55.76 1fnd s ARG 93 Cb -0.29 -2.59 -0.06 0.00 0.00 0.00 0.00 34.95 32.01 1fnd s ARG 93 CO 0.32 0.65 0.45 -0.51 0.00 0.00 0.00 175.30 176.21 1fnd s LEU 94 N -1.04 4.36 -0.03 2.53 1.43 -1.26 -0.78 118.68 123.88 1fnd s LEU 94 Ca 0.14 0.91 0.00 0.00 -1.03 0.00 0.00 54.13 54.15 1fnd s LEU 94 Cb -0.11 -3.05 0.03 0.00 0.03 0.00 0.00 46.19 43.09 1fnd s LEU 94 CO 0.04 0.16 0.01 -0.31 0.23 0.00 0.00 176.35 176.48 1fnd s TYR 95 N -1.39 0.27 0.46 0.29 1.51 -0.42 -4.98 117.35 113.07 1fnd s TYR 95 Ca 0.34 0.03 -0.24 0.00 -1.01 0.00 0.00 57.07 56.19 1fnd s TYR 95 Cb -0.15 -0.40 -0.07 0.00 -0.11 0.00 0.00 41.96 41.23 1fnd s TYR 95 CO 0.18 -0.13 1.24 -1.12 -1.11 0.00 0.00 175.55 174.61 1fnd s SER 96 N 1.11 6.06 0.12 2.29 0.01 -1.26 -1.71 113.70 120.32 1fnd s SER 96 Ca -0.09 2.50 -0.30 0.00 1.31 0.00 0.00 55.95 59.38 1fnd s SER 96 Cb -0.13 -2.62 -0.06 0.00 0.21 0.00 0.00 66.02 63.41 1fnd s SER 96 CO -0.02 -1.01 1.07 -0.63 0.41 0.00 0.00 173.24 173.07 1fnd s ILE 97 N -1.40 4.16 -2.25 1.44 1.01 -0.74 -4.63 121.20 118.79 1fnd s ILE 97 Ca 0.63 1.74 0.23 0.00 0.00 0.00 0.00 60.65 63.25 1fnd s ILE 97 Cb -0.34 -4.11 0.04 0.00 0.01 0.00 0.00 42.46 38.06 1fnd s ILE 97 CO 0.42 0.24 1.14 0.00 0.00 0.00 0.00 174.94 176.74 1fnd n ALA 98 N 2.94 3.31 -2.66 9.38 0.00 -0.29 -3.88 120.51 129.31 1fnd n ALA 98 Ca 0.04 -0.65 -0.27 0.00 0.00 0.00 0.00 53.44 52.56 1fnd n ALA 98 Cb 0.47 -0.80 -0.08 0.00 0.00 0.00 0.00 19.45 19.04 1fnd n ALA 98 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1fnd s SER 99 N -2.37 4.76 1.03 0.00 1.04 -1.24 -3.67 113.70 113.24 1fnd s SER 99 Ca 0.21 -0.36 -0.15 0.00 0.48 0.00 0.00 55.95 56.13 1fnd s SER 99 Cb 0.19 -1.02 0.20 0.00 0.10 0.00 0.00 66.02 65.49 1fnd s SER 99 CO 0.51 0.11 1.15 -0.94 0.98 0.00 0.00 173.24 175.05 1fnd s SER 100 N -2.76 2.47 0.44 7.02 1.04 -1.26 -4.62 113.70 116.03 1fnd s SER 100 Ca 0.26 0.80 0.16 0.00 0.48 0.00 0.00 55.95 57.65 1fnd s SER 100 Cb -0.10 -1.22 1.08 0.00 0.10 0.00 0.00 66.02 65.89 1fnd s SER 100 CO 0.18 -3.18 1.96 0.00 0.98 0.00 0.00 173.24 173.18 1fnd h ALA 101 N -1.94 2.10 0.00 5.32 0.00 -1.88 0.12 119.26 122.99 1fnd h ALA 101 Ca -0.49 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.29 1fnd h ALA 101 Cb 1.31 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 1fnd h ALA 101 CO 0.49 -0.26 -0.57 -0.07 0.00 0.00 0.00 179.25 178.84 1fnd h LEU 102 N 0.36 0.00 0.00 0.00 3.38 -1.92 -3.40 115.31 113.73 1fnd h LEU 102 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1fnd h LEU 102 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1fnd h LEU 102 CO -0.08 0.57 0.00 0.61 0.09 0.00 0.00 178.44 179.63 1fnd n GLY 103 N 1.17 -0.06 0.24 0.83 0.00 0.42 0.02 105.19 107.81 1fnd n GLY 103 Ca 0.02 -1.79 0.16 0.00 0.00 0.00 0.00 46.02 44.40 1fnd n GLY 103 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1fnd h ASP 104 N 0.00 0.00 -0.02 1.61 3.32 -1.87 -2.51 116.42 116.95 1fnd h ASP 104 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1fnd h ASP 104 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1fnd h ASP 104 CO 0.00 0.00 -0.11 0.49 -1.72 0.00 0.00 179.24 177.90 1fnd n PHE 105 N -2.78 0.00 -1.06 4.55 3.72 -1.26 -5.01 117.46 115.62 1fnd n PHE 105 Ca 0.00 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.38 1fnd n PHE 105 Cb 0.22 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.75 1fnd n PHE 105 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1fnd n GLY 106 N 1.11 0.51 0.26 1.37 0.00 -0.95 -4.88 105.19 102.61 1fnd n GLY 106 Ca 0.10 -0.21 0.03 0.00 0.00 0.00 0.00 46.02 45.93 1fnd n GLY 106 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1fnd n ASP 107 N -0.01 2.05 -1.83 1.61 5.68 -1.04 -4.90 116.55 118.11 1fnd n ASP 107 Ca -0.02 -1.70 -0.19 0.00 -0.50 0.00 0.00 54.79 52.38 1fnd n ASP 107 Cb 0.19 -0.07 -0.04 0.00 -1.14 0.00 0.00 41.12 40.07 1fnd n ASP 107 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1fnd n ALA 108 N 0.09 -0.44 0.02 2.12 0.00 0.10 -4.86 120.51 117.54 1fnd n ALA 108 Ca 0.04 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1fnd n ALA 108 Cb 0.25 -1.96 0.01 0.00 0.00 0.00 0.00 19.45 17.74 1fnd n ALA 108 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1fnd n LYS 109 N -2.65 0.10 -4.42 0.00 5.02 -1.26 -3.81 118.16 111.14 1fnd n LYS 109 Ca -0.21 -0.80 -0.21 0.00 -2.02 0.00 0.00 58.31 55.08 1fnd n LYS 109 Cb 0.64 -1.02 -0.10 0.00 -0.02 0.00 0.00 35.03 34.53 1fnd n LYS 109 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1fnd s SER 110 N -0.30 2.54 -0.00 4.39 1.04 -1.26 -1.15 113.70 118.95 1fnd s SER 110 Ca 0.01 -1.23 -0.00 0.00 0.48 0.00 0.00 55.95 55.20 1fnd s SER 110 Cb 0.01 -0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.00 1fnd s SER 110 CO 0.01 -0.43 0.01 0.54 0.98 0.00 0.00 173.24 174.35 1fnd s VAL 111 N -3.13 0.00 0.09 5.02 0.11 -0.21 -4.65 120.40 117.63 1fnd s VAL 111 Ca 0.31 -0.03 0.10 0.00 -2.93 0.00 0.00 61.98 59.42 1fnd s VAL 111 Cb 0.05 -0.03 -0.04 0.00 -1.53 0.00 0.00 36.38 34.83 1fnd s VAL 111 CO 0.12 -0.02 -0.26 -0.44 -3.33 0.00 0.00 175.10 171.17 1fnd s SER 112 N -0.05 3.32 0.10 3.54 0.01 -1.26 -0.59 113.70 118.77 1fnd s SER 112 Ca -0.01 -0.66 0.07 0.00 1.31 0.00 0.00 55.95 56.67 1fnd s SER 112 Cb -0.00 -0.28 -0.03 0.00 0.21 0.00 0.00 66.02 65.91 1fnd s SER 112 CO -0.00 0.21 -0.19 -0.76 0.41 0.00 0.00 173.24 172.92 1fnd s LEU 113 N -1.72 2.32 -0.26 2.44 1.43 -0.28 -1.14 118.68 121.47 1fnd s LEU 113 Ca 0.13 -0.70 0.01 0.00 -1.03 0.00 0.00 54.13 52.55 1fnd s LEU 113 Cb -0.10 -0.77 0.05 0.00 0.03 0.00 0.00 46.19 45.40 1fnd s LEU 113 CO 0.05 0.00 -0.09 0.00 0.23 0.00 0.00 176.35 176.54 1fnd s VAL 115 N 1.18 0.96 -0.00 0.00 1.01 -0.23 -4.93 120.40 118.39 1fnd s VAL 115 Ca -0.06 -0.36 -0.23 0.00 0.00 0.00 0.00 61.98 61.33 1fnd s VAL 115 Cb -0.19 -0.91 -0.05 0.00 0.00 0.00 0.00 36.38 35.24 1fnd s VAL 115 CO -0.05 0.32 0.70 -0.75 0.00 0.00 0.00 175.10 175.32 1fnd s LYS 116 N 0.86 4.43 -0.18 2.72 2.20 -1.26 -1.14 119.74 127.37 1fnd s LYS 116 Ca -0.11 0.92 -0.29 0.00 -0.36 0.00 0.00 55.97 56.12 1fnd s LYS 116 Cb -0.15 -3.38 -0.01 0.00 -1.51 0.00 0.00 37.83 32.78 1fnd s LYS 116 CO 0.01 0.24 1.21 0.50 -0.36 0.00 0.00 175.35 176.95 1fnd s ARG 117 N 0.17 4.24 -0.31 4.03 3.52 -0.19 -4.83 118.95 125.59 1fnd s ARG 117 Ca 0.36 1.59 -0.18 0.00 -0.13 0.00 0.00 55.73 57.38 1fnd s ARG 117 Cb -0.19 -3.73 -0.02 0.00 -1.56 0.00 0.00 34.95 29.45 1fnd s ARG 117 CO 0.20 -0.68 0.51 -1.17 -0.81 0.00 0.00 175.30 173.35 1fnd s LEU 118 N 3.39 4.19 -0.07 -0.88 2.96 -1.26 -4.63 118.68 122.38 1fnd s LEU 118 Ca 0.52 0.24 0.02 0.00 -0.22 0.00 0.00 54.13 54.69 1fnd s LEU 118 Cb -0.20 -2.62 0.01 0.00 0.50 0.00 0.00 46.19 43.88 1fnd s LEU 118 CO 0.13 -0.38 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.02 1fnd s ILE 119 N 2.36 1.15 0.22 6.68 1.01 -1.26 0.91 121.20 132.27 1fnd s ILE 119 Ca 0.20 -0.48 -0.06 0.00 0.00 0.00 0.00 60.65 60.31 1fnd s ILE 119 Cb -0.15 -1.06 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 1fnd s ILE 119 CO 0.11 0.36 0.26 -0.72 0.00 0.00 0.00 174.94 174.96 1fnd s TYR 120 N 0.75 0.85 -0.12 3.97 1.13 0.99 -4.98 117.35 119.94 1fnd s TYR 120 Ca -0.13 -1.13 -0.01 0.00 -1.41 0.00 0.00 57.07 54.40 1fnd s TYR 120 Cb -0.16 -0.27 -0.02 0.00 -1.10 0.00 0.00 41.96 40.41 1fnd s TYR 120 CO 0.03 -0.78 -0.10 0.95 -2.51 0.00 0.00 175.55 173.14 1fnd s THR 121 N -4.10 3.38 0.00 -3.49 -4.23 -1.25 0.45 115.64 106.39 1fnd s THR 121 Ca 0.33 -0.56 0.00 0.00 -1.18 0.00 0.00 61.69 60.28 1fnd s THR 121 Cb 0.04 -2.43 0.00 0.00 1.34 0.00 0.00 72.50 71.45 1fnd s THR 121 CO 0.11 0.53 0.00 -0.46 -0.54 0.00 0.00 174.62 174.26 1fnd n ASN 122 N 3.29 0.00 0.00 3.99 0.23 0.26 -4.84 115.26 118.20 1fnd n ASN 122 Ca -0.18 -0.34 0.11 0.00 -0.53 0.00 0.00 54.58 53.64 1fnd n ASN 122 Cb 0.53 0.00 0.54 0.00 -2.08 0.00 0.00 39.78 38.76 1fnd n ASN 122 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 1fnd h ASP 123 N 0.00 0.27 -0.59 0.53 2.03 -2.00 -1.93 116.42 114.72 1fnd h ASP 123 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1fnd h ASP 123 Cb 0.00 -0.06 0.00 0.00 -0.83 0.00 0.00 39.33 38.44 1fnd h ASP 123 CO 0.00 0.18 0.00 0.00 -1.03 0.00 0.00 179.24 178.39 1fnd n ALA 124 N -2.53 3.06 -0.96 4.15 0.00 -1.26 -4.89 120.51 118.08 1fnd n ALA 124 Ca 0.06 -1.43 0.00 0.00 0.00 0.00 0.00 53.44 52.07 1fnd n ALA 124 Cb 0.30 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.72 1fnd n ALA 124 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fnd n GLY 125 N 1.07 0.65 3.79 0.00 0.00 -0.73 -5.01 105.19 104.96 1fnd n GLY 125 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.88 1fnd n GLY 125 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fnd s GLU 126 N -0.22 4.45 -0.10 1.61 2.02 -1.26 -4.75 118.70 120.45 1fnd s GLU 126 Ca 0.00 1.07 -0.30 0.00 0.02 0.00 0.00 54.97 55.77 1fnd s GLU 126 Cb 0.00 -3.06 -0.01 0.00 0.10 0.00 0.00 34.13 31.15 1fnd s GLU 126 CO 0.00 0.47 1.04 0.99 0.02 0.00 0.00 175.26 177.78 1fnd s THR 127 N -1.35 4.71 -0.07 3.63 2.01 -1.26 0.91 115.64 124.23 1fnd s THR 127 Ca 0.40 1.98 0.05 0.00 0.31 0.00 0.00 61.69 64.43 1fnd s THR 127 Cb -0.20 -4.27 -0.01 0.00 0.01 0.00 0.00 72.50 68.02 1fnd s THR 127 CO 0.24 -0.00 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.32 1fnd s ILE 128 N 2.07 2.33 -0.14 1.82 -1.09 1.57 -4.92 121.20 122.84 1fnd s ILE 128 Ca 0.49 -0.97 -0.14 0.00 -2.23 0.00 0.00 60.65 57.81 1fnd s ILE 128 Cb -0.19 -1.87 -0.05 0.00 -1.58 0.00 0.00 42.46 38.77 1fnd s ILE 128 CO 0.18 0.57 0.30 -0.54 -1.23 0.00 0.00 174.94 174.22 1fnd s LYS 129 N -0.17 4.16 0.37 2.79 1.02 -1.26 -0.00 119.74 126.64 1fnd s LYS 129 Ca -0.03 0.13 -0.27 0.00 0.02 0.00 0.00 55.97 55.82 1fnd s LYS 129 Cb -0.14 -3.39 -0.09 0.00 -0.52 0.00 0.00 37.83 33.69 1fnd s LYS 129 CO 0.04 0.32 1.27 0.20 -0.92 0.00 0.00 175.35 176.25 1fnd s GLY 130 N 0.20 2.95 0.04 -3.33 0.00 0.26 -4.94 107.32 102.50 1fnd s GLY 130 Ca 0.17 1.17 -0.26 0.00 0.00 0.00 0.00 44.72 45.81 1fnd s GLY 130 CO 0.05 1.77 1.36 -2.08 0.00 0.00 0.00 173.10 174.20 1fnd h VAL 131 N 2.71 0.00 -0.24 1.40 2.07 -1.98 -2.33 116.25 117.88 1fnd h VAL 131 Ca -0.49 -0.02 -0.13 0.00 0.82 0.00 0.00 66.70 66.89 1fnd h VAL 131 Cb 1.23 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1fnd h VAL 131 CO 0.64 0.00 -0.34 0.00 0.02 0.00 0.00 177.57 177.89 1fnd h SER 133 N 0.36 1.04 0.85 0.00 4.64 -1.88 0.15 113.55 118.70 1fnd h SER 133 Ca 0.03 -0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.19 1fnd h SER 133 Cb 0.92 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.75 1fnd h SER 133 CO 0.08 0.72 -0.69 0.78 -0.87 0.00 0.00 176.83 176.85 1fnd h ASN 134 N 1.21 0.00 -0.06 4.97 2.35 -1.45 0.43 115.58 123.03 1fnd h ASN 134 Ca 0.37 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.11 1fnd h ASN 134 Cb -0.04 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.33 1fnd h ASN 134 CO -0.11 0.69 0.03 0.15 -1.65 0.00 0.00 177.43 176.54 1fnd h PHE 135 N 0.00 0.09 -0.17 1.19 3.57 -0.92 -1.94 116.94 118.76 1fnd h PHE 135 Ca -0.01 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 1fnd h PHE 135 Cb 1.31 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 40.01 1fnd h PHE 135 CO 0.00 0.20 0.01 -0.07 -2.23 0.00 0.00 178.31 176.22 1fnd h LEU 136 N -0.04 0.29 -1.43 0.59 3.38 -0.62 -2.95 115.31 114.52 1fnd h LEU 136 Ca 0.02 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1fnd h LEU 136 Cb 0.15 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1fnd h LEU 136 CO -0.00 0.51 0.00 0.00 0.09 0.00 0.00 178.44 179.04 1fnd n ASP 138 N -2.67 1.24 -4.69 0.00 8.00 -0.74 -4.96 116.55 112.74 1fnd n ASP 138 Ca 0.00 -1.02 -0.43 0.00 0.71 0.00 0.00 54.79 54.05 1fnd n ASP 138 Cb 0.20 0.22 -0.01 0.00 -0.02 0.00 0.00 41.12 41.51 1fnd n ASP 138 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1fnd n LEU 139 N -0.53 3.42 -4.63 0.64 4.77 -0.83 -5.02 117.00 114.82 1fnd n LEU 139 Ca 0.11 1.19 -0.31 0.00 -0.03 0.00 0.00 56.01 56.97 1fnd n LEU 139 Cb 0.37 -1.47 -0.09 0.00 -2.33 0.00 0.00 43.42 39.90 1fnd n LEU 139 CO 0.27 -0.48 -0.37 -0.54 -1.33 0.00 0.00 177.39 174.94 1fnd s LYS 140 N -1.42 2.48 0.13 3.23 -0.14 -1.26 -4.83 119.74 117.93 1fnd s LYS 140 Ca 0.59 -0.81 -0.35 0.00 -1.36 0.00 0.00 55.97 54.04 1fnd s LYS 140 Cb -0.59 -2.49 -0.15 0.00 -1.68 0.00 0.00 37.83 32.92 1fnd s LYS 140 CO 0.58 0.56 1.50 -2.30 -0.76 0.00 0.00 175.35 174.93 1fnd n PRO 141 N 1.04 1.79 0.00 -1.68 -0.02 -1.26 -0.78 135.00 134.10 1fnd n PRO 141 Ca -0.13 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1fnd n PRO 141 Cb 0.52 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1fnd n PRO 141 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fnd n GLY 142 N 3.11 2.76 3.77 -1.23 0.00 0.21 -4.96 105.19 108.85 1fnd n GLY 142 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1fnd n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fnd s ALA 143 N -2.57 2.62 0.24 4.61 0.00 0.04 -4.64 121.76 122.06 1fnd s ALA 143 Ca 0.00 0.71 -0.07 0.00 0.00 0.00 0.00 51.96 52.59 1fnd s ALA 143 Cb 0.00 -3.34 -0.06 0.00 0.00 0.00 0.00 23.12 19.72 1fnd s ALA 143 CO 0.00 -0.93 0.52 -1.21 0.00 0.00 0.00 175.76 174.14 1fnd s GLU 144 N -3.59 3.72 -0.08 0.00 2.02 -1.26 0.43 118.70 119.94 1fnd s GLU 144 Ca 0.70 0.13 -0.05 0.00 0.02 0.00 0.00 54.97 55.77 1fnd s GLU 144 Cb -0.22 -2.68 0.03 0.00 0.10 0.00 0.00 34.13 31.36 1fnd s GLU 144 CO 0.32 0.30 0.20 0.54 0.02 0.00 0.00 175.26 176.64 1fnd s VAL 145 N -1.88 -0.03 -0.19 2.63 0.11 0.23 -4.92 120.40 116.36 1fnd s VAL 145 Ca 0.45 0.09 -0.17 0.00 -2.93 0.00 0.00 61.98 59.43 1fnd s VAL 145 Cb -0.11 -0.30 -0.04 0.00 -1.53 0.00 0.00 36.38 34.40 1fnd s VAL 145 CO 0.25 0.04 0.44 -0.54 -3.33 0.00 0.00 175.10 171.96 1fnd s LYS 146 N 0.76 4.20 0.12 1.54 1.02 -1.26 -0.86 119.74 125.26 1fnd s LYS 146 Ca -0.05 0.29 0.07 0.00 0.02 0.00 0.00 55.97 56.30 1fnd s LYS 146 Cb -0.07 -3.53 -0.04 0.00 -0.52 0.00 0.00 37.83 33.67 1fnd s LYS 146 CO -0.04 -0.05 -0.17 -0.51 -0.92 0.00 0.00 175.35 173.66 1fnd s LEU 147 N 1.32 2.36 0.26 3.17 1.43 -0.19 -1.53 118.68 125.50 1fnd s LEU 147 Ca 0.21 -0.75 0.03 0.00 -1.03 0.00 0.00 54.13 52.58 1fnd s LEU 147 Cb -0.15 -0.72 -0.05 0.00 0.03 0.00 0.00 46.19 45.30 1fnd s LEU 147 CO 0.09 -0.04 0.05 0.42 0.23 0.00 0.00 176.35 177.09 1fnd s THR 148 N -1.68 0.88 0.00 5.49 -4.23 -0.12 0.02 115.64 116.00 1fnd s THR 148 Ca 0.08 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1fnd s THR 148 Cb -0.07 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.20 1fnd s THR 148 CO 0.04 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.61 1fnd n GLY 149 N -0.50 -0.19 3.78 3.99 0.00 0.76 -1.22 105.19 111.82 1fnd n GLY 149 Ca -0.02 -2.19 -0.30 0.00 0.00 0.00 0.00 46.02 43.50 1fnd n GLY 149 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fnd s PRO 150 N 0.00 2.13 0.04 1.61 0.05 -1.26 -1.38 135.00 136.18 1fnd s PRO 150 Ca 0.00 0.86 0.06 0.00 0.05 0.00 0.00 61.00 61.97 1fnd s PRO 150 Cb 0.00 -1.91 -0.02 0.00 0.05 0.00 0.00 34.50 32.62 1fnd s PRO 150 CO 0.00 -1.65 -0.19 0.08 0.05 0.00 0.00 177.00 175.30 1fnd s VAL 151 N -3.03 1.49 0.00 -0.36 1.01 -0.19 -0.07 120.40 119.25 1fnd s VAL 151 Ca 0.61 -1.10 0.00 0.00 0.00 0.00 0.00 61.98 61.49 1fnd s VAL 151 Cb -0.16 -1.31 0.00 0.00 0.00 0.00 0.00 36.38 34.92 1fnd s VAL 151 CO 0.55 0.17 0.00 0.61 0.00 0.00 0.00 175.10 176.44 1fnd n GLY 152 N 1.94 2.95 0.00 4.51 0.00 -1.26 -0.55 105.19 112.78 1fnd n GLY 152 Ca -0.17 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.25 1fnd n GLY 152 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1fnd n LYS 153 N 0.66 4.41 -0.31 1.61 5.02 -1.26 -4.82 118.16 123.47 1fnd n LYS 153 Ca 0.00 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.28 1fnd n LYS 153 Cb 0.00 -0.42 0.12 0.00 -0.02 0.00 0.00 35.03 34.71 1fnd n LYS 153 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1fnd h GLU 154 N 0.00 0.99 -0.60 1.97 4.57 -1.95 -3.08 114.58 116.48 1fnd h GLU 154 Ca 0.00 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1fnd h GLU 154 Cb 0.00 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.37 1fnd h GLU 154 CO 0.00 0.65 0.00 -1.33 -1.18 0.00 0.00 179.01 177.15 1fnd n MET 155 N -4.59 4.74 -2.03 1.92 2.81 -1.26 -4.77 117.12 113.93 1fnd n MET 155 Ca 0.11 -3.01 -0.35 0.00 -1.81 0.00 0.00 57.70 52.64 1fnd n MET 155 Cb 0.12 -2.24 0.03 0.00 -0.71 0.00 0.00 33.22 30.42 1fnd n MET 155 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1fnd s LEU 156 N -2.63 3.64 0.67 4.03 1.43 -1.17 -4.25 118.68 120.40 1fnd s LEU 156 Ca 0.52 2.25 -0.12 0.00 -1.03 0.00 0.00 54.13 55.75 1fnd s LEU 156 Cb 0.40 -4.58 -0.00 0.00 0.03 0.00 0.00 46.19 42.03 1fnd s LEU 156 CO 0.15 -1.50 1.06 -0.04 0.23 0.00 0.00 176.35 176.26 1fnd s MET 157 N -3.46 2.98 0.42 1.70 -1.94 -1.26 -4.75 119.30 112.99 1fnd s MET 157 Ca 0.74 1.05 -0.25 0.00 -1.71 0.00 0.00 55.69 55.52 1fnd s MET 157 Cb -0.26 -1.99 -0.08 0.00 2.01 0.00 0.00 34.83 34.50 1fnd s MET 157 CO 0.33 -1.07 1.22 -2.14 -0.01 0.00 0.00 175.02 173.34 1fnd s PRO 158 N -4.74 3.94 0.33 2.03 0.02 -1.26 -0.98 135.00 134.34 1fnd s PRO 158 Ca 0.60 1.95 0.03 0.00 0.02 0.00 0.00 61.00 63.61 1fnd s PRO 158 Cb -0.15 -2.65 0.57 0.00 0.02 0.00 0.00 34.50 32.30 1fnd s PRO 158 CO 0.50 -0.45 1.87 0.87 -0.33 0.00 0.00 177.00 179.46 1fnd h LYS 159 N 2.51 0.57 -6.03 5.54 1.57 -0.92 -3.44 116.57 116.39 1fnd h LYS 159 Ca -0.49 -0.12 -0.56 0.00 -1.87 0.00 0.00 60.65 57.61 1fnd h LYS 159 Cb 1.24 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 1fnd h LYS 159 CO 0.62 0.58 1.43 0.34 -0.57 0.00 0.00 179.45 181.85 1fnd s ASP 160 N -6.71 5.44 0.03 0.86 -1.08 -1.26 -4.87 116.67 109.08 1fnd s ASP 160 Ca -0.08 1.48 0.15 0.00 -0.52 0.00 0.00 52.55 53.58 1fnd s ASP 160 Cb 0.15 -2.52 0.65 0.00 -1.46 0.00 0.00 42.92 39.75 1fnd s ASP 160 CO 0.77 -2.04 1.48 -0.81 0.52 0.00 0.00 175.17 175.09 1fnd n PRO 161 N 8.72 0.03 -0.40 4.34 -0.04 -1.26 -2.00 135.00 144.38 1fnd n PRO 161 Ca 0.28 0.28 0.09 0.00 -0.04 0.00 0.00 63.50 64.11 1fnd n PRO 161 Cb 0.47 -1.55 0.27 0.00 -0.04 0.00 0.00 33.50 32.66 1fnd n PRO 161 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1fnd n ASN 162 N -1.60 3.88 -4.71 3.54 4.13 -1.26 -1.22 115.26 118.03 1fnd n ASN 162 Ca 0.03 -2.29 -0.33 0.00 1.68 0.00 0.00 54.58 53.67 1fnd n ASN 162 Cb 0.17 -0.44 0.12 0.00 -1.54 0.00 0.00 39.78 38.09 1fnd n ASN 162 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1fnd s ALA 163 N -1.54 1.91 -0.28 5.41 0.00 -0.85 -4.29 121.76 122.12 1fnd s ALA 163 Ca 0.40 0.79 -0.13 0.00 0.00 0.00 0.00 51.96 53.03 1fnd s ALA 163 Cb 0.25 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 1fnd s ALA 163 CO 0.21 -2.18 0.26 0.99 0.00 0.00 0.00 175.76 175.04 1fnd s THR 164 N -2.19 5.26 -0.25 0.00 2.01 0.04 -2.12 115.64 118.38 1fnd s THR 164 Ca 0.72 0.27 -0.01 0.00 0.31 0.00 0.00 61.69 62.99 1fnd s THR 164 Cb -0.27 -3.61 0.03 0.00 0.01 0.00 0.00 72.50 68.66 1fnd s THR 164 CO 0.50 0.19 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.91 1fnd s ILE 165 N 1.88 2.73 -0.21 1.82 1.01 0.69 -0.45 121.20 128.67 1fnd s ILE 165 Ca 0.10 -1.17 -0.08 0.00 0.00 0.00 0.00 60.65 59.50 1fnd s ILE 165 Cb -0.16 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.84 1fnd s ILE 165 CO 0.11 0.14 0.09 -0.63 0.00 0.00 0.00 174.94 174.65 1fnd s ILE 166 N 1.28 4.86 -0.20 2.92 1.01 -0.36 -1.01 121.20 129.70 1fnd s ILE 166 Ca -0.02 -0.00 -0.00 0.00 0.00 0.00 0.00 60.65 60.63 1fnd s ILE 166 Cb -0.17 -3.22 0.02 0.00 0.01 0.00 0.00 42.46 39.09 1fnd s ILE 166 CO -0.05 0.41 -0.14 -0.04 0.00 0.00 0.00 174.94 175.13 1fnd s MET 167 N 0.72 2.98 -0.31 2.79 -1.94 0.04 -1.23 119.30 122.35 1fnd s MET 167 Ca 0.05 -0.85 -0.01 0.00 -1.71 0.00 0.00 55.69 53.17 1fnd s MET 167 Cb -0.13 -2.74 0.06 0.00 2.01 0.00 0.00 34.83 34.03 1fnd s MET 167 CO 0.02 -0.26 0.02 -0.51 -0.01 0.00 0.00 175.02 174.27 1fnd s LEU 168 N 1.32 4.11 0.16 -0.03 1.43 -0.62 -0.21 118.68 124.84 1fnd s LEU 168 Ca 0.03 -1.48 0.07 0.00 -1.03 0.00 0.00 54.13 51.72 1fnd s LEU 168 Cb -0.14 -1.70 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 1fnd s LEU 168 CO -0.09 -0.30 -0.14 -0.83 0.23 0.00 0.00 176.35 175.22 1fnd s GLY 169 N 1.29 1.25 -0.05 -3.19 0.00 -0.60 -0.72 107.32 105.29 1fnd s GLY 169 Ca -0.02 -1.50 0.04 0.00 0.00 0.00 0.00 44.72 43.23 1fnd s GLY 169 CO -0.03 -1.58 -0.17 -0.51 0.00 0.00 0.00 173.10 170.81 1fnd s THR 170 N -2.71 1.43 0.00 0.90 -4.23 -1.05 -1.20 115.64 108.79 1fnd s THR 170 Ca 0.17 -0.70 0.00 0.00 -1.18 0.00 0.00 61.69 59.98 1fnd s THR 170 Cb -0.02 -1.25 0.00 0.00 1.34 0.00 0.00 72.50 72.58 1fnd s THR 170 CO 0.04 0.42 0.00 0.61 -0.54 0.00 0.00 174.62 175.15 1fnd n GLY 171 N 3.31 3.37 0.00 3.99 0.00 -0.50 -0.90 105.19 114.47 1fnd n GLY 171 Ca -0.19 -0.06 0.02 0.00 0.00 0.00 0.00 46.02 45.79 1fnd n GLY 171 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fnd n THR 172 N 0.00 1.17 0.94 2.61 -2.24 -1.26 -1.56 114.28 113.93 1fnd n THR 172 Ca 0.00 0.29 0.10 0.00 -2.27 0.00 0.00 64.05 62.17 1fnd n THR 172 Cb 0.00 -1.21 0.50 0.00 -2.10 0.00 0.00 70.33 67.52 1fnd n THR 172 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fnd n GLY 173 N -0.92 -0.97 0.28 3.38 0.00 -0.08 -1.31 105.19 105.57 1fnd n GLY 173 Ca 0.02 -0.09 0.15 0.00 0.00 0.00 0.00 46.02 46.09 1fnd n GLY 173 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1fnd h ILE 174 N 0.00 0.45 -0.65 -0.61 6.09 -1.47 -3.37 117.51 117.94 1fnd h ILE 174 Ca 0.00 -0.37 0.10 0.00 -1.37 0.00 0.00 64.86 63.22 1fnd h ILE 174 Cb 0.20 1.25 -0.11 0.00 0.47 0.00 0.00 36.82 38.63 1fnd h ILE 174 CO 0.00 0.07 -0.42 0.00 -3.07 0.00 0.00 178.15 174.73 1fnd h ALA 175 N 1.92 -0.24 0.00 0.18 0.00 -1.47 -0.70 119.26 118.96 1fnd h ALA 175 Ca -0.00 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1fnd h ALA 175 Cb 0.25 0.96 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1fnd h ALA 175 CO 0.01 -0.79 -0.16 -1.00 0.00 0.00 0.00 179.25 177.32 1fnd h PRO 176 N -0.18 0.00 0.00 0.00 0.13 -1.73 -2.14 132.00 128.08 1fnd h PRO 176 Ca 0.21 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 65.14 1fnd h PRO 176 Cb 0.56 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.66 1fnd h PRO 176 CO -0.74 0.16 -0.94 0.74 -0.23 0.00 0.00 178.00 176.99 1fnd h PHE 177 N 0.00 0.00 -0.64 1.56 0.04 -1.41 -0.80 116.94 115.70 1fnd h PHE 177 Ca -0.00 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.70 1fnd h PHE 177 Cb 0.56 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.68 1fnd h PHE 177 CO 0.00 0.94 0.14 -0.09 -0.60 0.00 0.00 178.31 178.70 1fnd h ARG 178 N 0.00 1.01 0.48 1.51 2.43 -0.66 0.89 114.38 120.04 1fnd h ARG 178 Ca -0.01 -0.24 -0.02 0.00 -0.81 0.00 0.00 59.98 58.90 1fnd h ARG 178 Cb 1.69 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 31.11 1fnd h ARG 178 CO 0.12 0.91 -0.25 1.03 -1.51 0.00 0.00 179.97 180.27 1fnd h SER 179 N 0.96 -0.61 -0.03 -3.80 0.87 -1.21 0.18 113.55 109.91 1fnd h SER 179 Ca 0.20 0.03 0.02 0.00 -1.23 0.00 0.00 61.79 60.81 1fnd h SER 179 Cb 0.36 0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 1fnd h SER 179 CO 0.00 -0.42 -0.08 -0.26 -0.53 0.00 0.00 176.83 175.55 1fnd h PHE 180 N -0.68 -0.20 -0.45 2.24 -1.00 -0.87 -3.02 116.94 112.97 1fnd h PHE 180 Ca -0.06 0.01 -0.07 0.00 2.81 0.00 0.00 57.97 60.66 1fnd h PHE 180 Cb 0.53 0.09 -0.02 0.00 3.61 0.00 0.00 35.95 40.16 1fnd h PHE 180 CO -0.06 -0.12 0.01 -0.07 -1.61 0.00 0.00 178.31 176.45 1fnd h LEU 181 N -0.12 0.69 -0.73 1.54 3.38 -0.63 -1.26 115.31 118.18 1fnd h LEU 181 Ca 0.04 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1fnd h LEU 181 Cb 0.18 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1fnd h LEU 181 CO -0.10 0.76 0.46 -0.50 0.09 0.00 0.00 178.44 179.15 1fnd h TRP 182 N 0.69 0.93 -0.50 1.13 4.06 -0.86 -0.30 115.95 121.09 1fnd h TRP 182 Ca 0.14 0.01 -0.02 0.00 2.06 0.00 0.00 58.89 61.08 1fnd h TRP 182 Cb 0.41 -0.31 -0.02 0.00 -1.00 0.00 0.00 29.16 28.24 1fnd h TRP 182 CO 0.02 0.60 0.23 -0.22 -3.56 0.00 0.00 178.44 175.51 1fnd h LYS 183 N 0.99 0.74 -0.35 0.49 3.64 -1.29 -0.08 116.57 120.70 1fnd h LYS 183 Ca 0.26 -0.12 -0.07 0.00 -1.27 0.00 0.00 60.65 59.46 1fnd h LYS 183 Cb -0.08 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 1fnd h LYS 183 CO -0.05 0.63 -0.05 0.52 -2.27 0.00 0.00 179.45 178.23 1fnd h MET 184 N 0.67 0.65 0.00 1.90 2.86 -0.97 -3.36 114.93 116.67 1fnd h MET 184 Ca 0.17 -0.23 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1fnd h MET 184 Cb 0.15 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.76 1fnd h MET 184 CO -0.02 0.79 -0.86 1.19 1.06 0.00 0.00 176.91 179.08 1fnd n PHE 185 N -4.45 0.00 0.33 -0.22 3.72 -0.15 -4.58 117.46 112.11 1fnd n PHE 185 Ca -0.02 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.43 1fnd n PHE 185 Cb 0.31 -0.04 0.05 0.00 -0.94 0.00 0.00 39.48 38.85 1fnd n PHE 185 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1fnd n PHE 186 N -1.45 0.03 -4.25 1.38 3.72 -0.07 -5.02 117.46 111.80 1fnd n PHE 186 Ca -0.00 -0.04 -0.22 0.00 -0.05 0.00 0.00 57.45 57.13 1fnd n PHE 186 Cb 0.06 -0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.47 1fnd n PHE 186 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1fnd s GLU 187 N -0.77 1.04 -0.26 -1.08 2.02 -1.03 -5.00 118.70 113.62 1fnd s GLU 187 Ca 0.11 -1.11 -0.10 0.00 0.02 0.00 0.00 54.97 53.89 1fnd s GLU 187 Cb 0.08 -1.23 -0.05 0.00 0.10 0.00 0.00 34.13 33.03 1fnd s GLU 187 CO 0.11 0.28 0.16 0.15 0.02 0.00 0.00 175.26 175.99 1fnd s LYS 188 N -1.90 3.96 0.04 1.61 -0.14 -1.26 -4.83 119.74 117.22 1fnd s LYS 188 Ca 0.04 -0.32 0.07 0.00 -1.36 0.00 0.00 55.97 54.40 1fnd s LYS 188 Cb -0.10 -3.57 -0.02 0.00 -1.68 0.00 0.00 37.83 32.46 1fnd s LYS 188 CO 0.04 -0.09 -0.21 -1.01 -0.76 0.00 0.00 175.35 173.32 1fnd s HIS 189 N 1.47 1.83 0.24 3.18 3.76 -1.26 -5.03 115.29 119.49 1fnd s HIS 189 Ca 0.07 -0.37 -0.05 0.00 -0.15 0.00 0.00 55.06 54.56 1fnd s HIS 189 Cb -0.15 -1.10 0.27 0.00 1.11 0.00 0.00 32.58 32.70 1fnd s HIS 189 CO 0.08 0.08 1.78 -0.44 -0.85 0.00 0.00 174.74 175.39 1fnd h ASP 190 N 4.95 0.93 -0.05 1.40 3.32 -2.04 -3.24 116.42 121.69 1fnd h ASP 190 Ca -0.42 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.45 1fnd h ASP 190 Cb 1.16 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.46 1fnd h ASP 190 CO 0.44 0.89 0.00 0.47 -1.72 0.00 0.00 179.24 179.32 1fnd n ASP 191 N -4.26 2.60 -3.68 6.45 8.00 -1.26 -4.98 116.55 119.43 1fnd n ASP 191 Ca 0.05 -3.02 -0.10 0.00 0.71 0.00 0.00 54.79 52.43 1fnd n ASP 191 Cb 0.24 -0.43 -0.11 0.00 -0.02 0.00 0.00 41.12 40.80 1fnd n ASP 191 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1fnd s TYR 192 N -2.77 -0.66 -0.17 1.24 5.04 -1.23 -5.11 117.35 113.69 1fnd s TYR 192 Ca 0.32 1.35 -0.04 0.00 -2.44 0.00 0.00 57.07 56.26 1fnd s TYR 192 Cb 0.28 0.26 0.06 0.00 0.35 0.00 0.00 41.96 42.90 1fnd s TYR 192 CO 0.04 -0.40 0.07 0.21 -1.34 0.00 0.00 175.55 174.13 1fnd s LYS 193 N 1.94 0.26 0.06 4.97 2.47 -1.26 -4.10 119.74 124.08 1fnd s LYS 193 Ca -0.06 -0.16 -0.30 0.00 -1.56 0.00 0.00 55.97 53.89 1fnd s LYS 193 Cb -0.10 -1.82 -0.05 0.00 -1.46 0.00 0.00 37.83 34.40 1fnd s LYS 193 CO -0.12 -0.63 1.09 0.12 0.16 0.00 0.00 175.35 175.97 1fnd s PHE 194 N 2.04 3.57 -0.01 4.03 5.36 -1.26 -4.80 117.98 126.91 1fnd s PHE 194 Ca 0.01 1.52 0.01 0.00 -0.96 0.00 0.00 56.93 57.52 1fnd s PHE 194 Cb -0.16 -3.27 0.02 0.00 -0.34 0.00 0.00 43.02 39.27 1fnd s PHE 194 CO -0.08 -0.62 0.74 -1.71 -1.46 0.00 0.00 175.22 172.08 1fnd n ASN 195 N 3.61 0.62 -0.49 6.13 4.05 -0.36 -5.05 115.26 123.77 1fnd n ASN 195 Ca 0.06 -1.52 0.00 0.00 0.45 0.00 0.00 54.58 53.57 1fnd n ASN 195 Cb 0.48 -0.06 0.00 0.00 1.23 0.00 0.00 39.78 41.43 1fnd n ASN 195 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1fnd n GLY 196 N -0.21 1.48 3.04 8.20 0.00 -1.13 -4.82 105.19 111.75 1fnd n GLY 196 Ca 0.01 -1.64 -0.28 0.00 0.00 0.00 0.00 46.02 44.11 1fnd n GLY 196 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fnd s LEU 197 N 0.00 1.67 -0.14 0.99 2.96 -0.90 -4.58 118.68 118.68 1fnd s LEU 197 Ca 0.00 -0.41 -0.03 0.00 -0.22 0.00 0.00 54.13 53.47 1fnd s LEU 197 Cb 0.00 -1.05 -0.03 0.00 0.50 0.00 0.00 46.19 45.61 1fnd s LEU 197 CO 0.00 -0.00 -0.05 0.00 -1.32 0.00 0.00 176.35 174.98 1fnd s ALA 198 N 1.07 2.96 -0.14 5.97 0.00 -0.45 -0.22 121.76 130.95 1fnd s ALA 198 Ca -0.05 -0.83 -0.02 0.00 0.00 0.00 0.00 51.96 51.05 1fnd s ALA 198 Cb -0.15 -1.47 0.04 0.00 0.00 0.00 0.00 23.12 21.54 1fnd s ALA 198 CO -0.03 0.28 0.01 -0.46 0.00 0.00 0.00 175.76 175.56 1fnd s TRP 199 N 0.17 0.93 -0.16 0.00 -0.11 -0.18 -0.64 118.94 118.95 1fnd s TRP 199 Ca -0.02 -0.58 -0.07 0.00 1.22 0.00 0.00 56.10 56.64 1fnd s TRP 199 Cb -0.14 -0.96 -0.04 0.00 -1.50 0.00 0.00 33.47 30.83 1fnd s TRP 199 CO 0.03 -0.49 0.10 -1.17 -4.62 0.00 0.00 176.95 170.79 1fnd s LEU 200 N 1.89 4.06 -0.13 5.86 2.96 -0.54 -0.78 118.68 132.01 1fnd s LEU 200 Ca 0.02 0.24 0.01 0.00 -0.22 0.00 0.00 54.13 54.17 1fnd s LEU 200 Cb -0.15 -2.01 -0.01 0.00 0.50 0.00 0.00 46.19 44.52 1fnd s LEU 200 CO -0.07 0.26 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.72 1fnd s PHE 201 N -0.16 2.77 -0.13 5.38 0.40 0.70 -1.35 117.98 125.60 1fnd s PHE 201 Ca 0.09 -0.74 -0.01 0.00 -0.60 0.00 0.00 56.93 55.67 1fnd s PHE 201 Cb -0.12 -1.83 0.03 0.00 0.51 0.00 0.00 43.02 41.62 1fnd s PHE 201 CO 0.01 -0.27 -0.05 -1.17 0.70 0.00 0.00 175.22 174.44 1fnd s LEU 202 N 0.39 1.23 -0.33 -0.37 2.96 -0.42 -1.56 118.68 120.58 1fnd s LEU 202 Ca -0.12 -0.42 -0.18 0.00 -0.22 0.00 0.00 54.13 53.20 1fnd s LEU 202 Cb -0.16 -0.78 -0.01 0.00 0.50 0.00 0.00 46.19 45.73 1fnd s LEU 202 CO 0.06 -0.16 0.49 -0.83 -1.32 0.00 0.00 176.35 174.58 1fnd s GLY 203 N 1.74 1.83 0.20 7.98 0.00 -0.34 -0.99 107.32 117.74 1fnd s GLY 203 Ca 0.03 -0.97 0.03 0.00 0.00 0.00 0.00 44.72 43.81 1fnd s GLY 203 CO -0.08 1.22 0.00 -1.34 0.00 0.00 0.00 173.10 172.90 1fnd s VAL 204 N 2.32 0.84 0.03 1.40 -7.23 -0.77 -1.40 120.40 115.59 1fnd s VAL 204 Ca 0.18 -2.01 -0.06 0.00 -1.81 0.00 0.00 61.98 58.28 1fnd s VAL 204 Cb -0.16 -2.24 -0.30 0.00 0.56 0.00 0.00 36.38 34.25 1fnd s VAL 204 CO 0.12 -0.39 0.97 1.55 -0.31 0.00 0.00 175.10 177.04 1fnd h PRO 205 N 2.58 0.32 -4.41 4.82 0.13 -1.87 -1.78 132.00 131.80 1fnd h PRO 205 Ca -0.37 -0.55 -0.19 0.00 -0.87 0.00 0.00 66.00 64.02 1fnd h PRO 205 Cb 1.21 0.21 -0.15 0.00 0.13 0.00 0.00 31.00 32.40 1fnd h PRO 205 CO 0.63 1.23 -0.62 0.95 -0.23 0.00 0.00 178.00 179.97 1fnd s THR 206 N -2.63 0.08 0.35 1.56 -4.23 -1.26 -1.15 115.64 108.37 1fnd s THR 206 Ca -0.08 -1.88 0.29 0.00 -1.18 0.00 0.00 61.69 58.84 1fnd s THR 206 Cb 0.06 -2.10 0.31 0.00 1.34 0.00 0.00 72.50 72.11 1fnd s THR 206 CO 0.88 -0.38 2.05 0.28 -0.54 0.00 0.00 174.62 176.91 1fnd h SER 207 N 2.80 0.00 0.15 3.99 0.02 -1.95 0.30 113.55 118.86 1fnd h SER 207 Ca -0.35 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 1fnd h SER 207 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1fnd h SER 207 CO 0.57 0.11 -0.01 -1.54 -1.14 0.00 0.00 176.83 174.82 1fnd n SER 208 N -3.47 0.24 -0.64 3.07 3.41 -1.26 -3.16 113.62 111.80 1fnd n SER 208 Ca -0.01 -0.85 0.06 0.00 -0.26 0.00 0.00 58.87 57.81 1fnd n SER 208 Cb 0.26 -0.06 0.17 0.00 -0.26 0.00 0.00 64.21 64.32 1fnd n SER 208 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1fnd n SER 209 N -0.91 3.09 -4.57 4.04 7.64 0.10 -0.30 113.62 122.72 1fnd n SER 209 Ca 0.20 -2.29 -0.38 0.00 1.01 0.00 0.00 58.87 57.41 1fnd n SER 209 Cb 0.18 -0.30 -0.02 0.00 -1.01 0.00 0.00 64.21 63.06 1fnd n SER 209 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1fnd s LEU 210 N -1.52 3.53 0.20 -3.43 1.43 -1.19 -4.81 118.68 112.89 1fnd s LEU 210 Ca 0.27 -1.81 -0.32 0.00 -1.03 0.00 0.00 54.13 51.23 1fnd s LEU 210 Cb 0.17 -2.58 -0.12 0.00 0.03 0.00 0.00 46.19 43.69 1fnd s LEU 210 CO 0.12 -1.75 1.71 0.18 0.23 0.00 0.00 176.35 176.84 1fnd n LEU 211 N 10.11 3.87 -1.25 1.79 4.77 -1.26 -2.75 117.00 132.29 1fnd n LEU 211 Ca 0.42 1.06 -0.16 0.00 -0.03 0.00 0.00 56.01 57.30 1fnd n LEU 211 Cb 0.48 -1.55 -0.07 0.00 -2.33 0.00 0.00 43.42 39.95 1fnd n LEU 211 CO 0.70 0.11 -0.15 -1.22 -1.33 0.00 0.00 177.39 175.50 1fnd n TYR 212 N 3.94 -0.03 -0.29 -1.77 4.01 -1.26 -4.90 117.16 116.86 1fnd n TYR 212 Ca 0.16 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.99 1fnd n TYR 212 Cb 0.34 -3.10 0.24 0.00 -0.31 0.00 0.00 39.34 36.51 1fnd n TYR 212 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 1fnd h LYS 213 N 0.00 0.52 -0.35 -0.72 3.64 -1.93 -0.88 116.57 116.85 1fnd h LYS 213 Ca -0.33 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.02 1fnd h LYS 213 Cb 1.25 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 1fnd h LYS 213 CO 0.48 0.35 0.19 1.49 -2.27 0.00 0.00 179.45 179.68 1fnd h GLU 214 N 0.54 0.47 -0.11 1.90 4.81 -1.90 0.45 114.58 120.73 1fnd h GLU 214 Ca 0.48 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.60 1fnd h GLU 214 Cb 0.76 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.04 1fnd h GLU 214 CO -0.41 0.35 -0.20 0.93 -0.73 0.00 0.00 179.01 178.95 1fnd h GLU 215 N 0.48 0.33 -0.10 1.92 5.08 -1.60 -2.76 114.58 117.92 1fnd h GLU 215 Ca 0.12 -0.21 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 1fnd h GLU 215 Cb 0.02 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1fnd h GLU 215 CO -0.02 0.80 -0.22 0.74 -1.00 0.00 0.00 179.01 179.30 1fnd h PHE 216 N -0.11 0.19 -0.15 4.33 0.04 -0.71 -1.83 116.94 118.70 1fnd h PHE 216 Ca 0.01 -0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.66 1fnd h PHE 216 Cb 0.78 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.87 1fnd h PHE 216 CO 0.10 0.39 -0.31 0.93 -0.60 0.00 0.00 178.31 178.83 1fnd h GLU 217 N 0.16 0.29 -0.30 1.51 4.39 -0.87 -1.39 114.58 118.38 1fnd h GLU 217 Ca 0.03 -0.11 -0.15 0.00 0.34 0.00 0.00 59.36 59.46 1fnd h GLU 217 Cb 0.49 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 1fnd h GLU 217 CO 0.03 0.58 -0.44 0.87 -1.16 0.00 0.00 179.01 178.90 1fnd h LYS 218 N 0.26 0.75 -0.63 2.33 1.57 -1.11 -2.65 116.57 117.09 1fnd h LYS 218 Ca 0.03 -0.41 -0.05 0.00 -1.87 0.00 0.00 60.65 58.35 1fnd h LYS 218 Cb 0.68 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.99 1fnd h LYS 218 CO 0.05 1.04 0.19 0.52 -0.57 0.00 0.00 179.45 180.67 1fnd h MET 219 N 0.61 0.98 -0.69 3.15 2.86 -0.95 -2.32 114.93 118.57 1fnd h MET 219 Ca 0.04 -0.22 -0.06 0.00 -2.06 0.00 0.00 59.70 57.40 1fnd h MET 219 Cb 0.99 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.49 1fnd h MET 219 CO 0.09 0.87 0.18 -0.22 1.06 0.00 0.00 176.91 178.90 1fnd h LYS 220 N 0.90 1.10 -0.86 1.72 1.63 -1.23 -1.67 116.57 118.16 1fnd h LYS 220 Ca 0.20 -0.26 -0.01 0.00 -0.85 0.00 0.00 60.65 59.74 1fnd h LYS 220 Cb 0.31 -0.15 -0.04 0.00 -0.60 0.00 0.00 32.23 31.75 1fnd h LYS 220 CO -0.00 0.97 0.51 1.49 -3.45 0.00 0.00 179.45 178.96 1fnd h GLU 221 N 1.03 1.17 -0.36 1.90 4.81 -1.21 -2.38 114.58 119.55 1fnd h GLU 221 Ca 0.22 -0.11 -0.11 0.00 -0.13 0.00 0.00 59.36 59.22 1fnd h GLU 221 Cb 0.35 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1fnd h GLU 221 CO -0.00 0.83 -0.22 0.87 -0.73 0.00 0.00 179.01 179.76 1fnd h LYS 222 N 1.19 0.78 -2.10 1.92 1.57 -0.86 -3.38 116.57 115.69 1fnd h LYS 222 Ca 0.31 -0.36 -0.56 0.00 -1.87 0.00 0.00 60.65 58.17 1fnd h LYS 222 Cb -0.03 -0.01 -0.41 0.00 0.08 0.00 0.00 32.23 31.86 1fnd h LYS 222 CO -0.06 0.98 -0.91 0.00 -0.57 0.00 0.00 179.45 178.90 1fnd n ALA 223 N -2.48 3.18 0.26 3.86 0.00 -0.68 -4.96 120.51 119.68 1fnd n ALA 223 Ca -0.02 -4.00 0.15 0.00 0.00 0.00 0.00 53.44 49.56 1fnd n ALA 223 Cb 0.44 -0.85 0.85 0.00 0.00 0.00 0.00 19.45 19.89 1fnd n ALA 223 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1fnd h PRO 224 N 3.66 0.00 -0.01 0.00 0.13 -1.61 -1.13 132.00 133.04 1fnd h PRO 224 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1fnd h PRO 224 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1fnd h PRO 224 CO 0.63 0.00 -0.36 -0.25 -0.23 0.00 0.00 178.00 177.80 1fnd n ASP 225 N -3.95 1.30 -0.24 1.44 8.00 -1.26 -4.03 116.55 117.81 1fnd n ASP 225 Ca -0.01 -1.05 0.03 0.00 0.71 0.00 0.00 54.79 54.46 1fnd n ASP 225 Cb 0.16 0.27 0.03 0.00 -0.02 0.00 0.00 41.12 41.56 1fnd n ASP 225 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1fnd n ASN 226 N -0.53 1.52 -3.73 -2.24 4.13 -0.46 -4.87 115.26 109.08 1fnd n ASN 226 Ca 0.11 -1.27 -0.14 0.00 1.68 0.00 0.00 54.58 54.96 1fnd n ASN 226 Cb 0.38 -0.00 -0.15 0.00 -1.54 0.00 0.00 39.78 38.47 1fnd n ASN 226 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1fnd s PHE 227 N -0.50 -0.16 0.07 3.10 5.36 -0.99 -1.34 117.98 123.52 1fnd s PHE 227 Ca 0.07 0.50 0.08 0.00 -0.96 0.00 0.00 56.93 56.62 1fnd s PHE 227 Cb 0.05 -0.14 -0.03 0.00 -0.34 0.00 0.00 43.02 42.56 1fnd s PHE 227 CO 0.07 -0.19 -0.21 1.03 -1.46 0.00 0.00 175.22 174.46 1fnd s ARG 228 N 1.44 1.86 -0.02 10.12 0.52 0.19 -4.82 118.95 128.24 1fnd s ARG 228 Ca -0.06 -1.10 0.00 0.00 -0.52 0.00 0.00 55.73 54.05 1fnd s ARG 228 Cb -0.12 -2.09 0.03 0.00 0.52 0.00 0.00 34.95 33.29 1fnd s ARG 228 CO -0.06 0.51 0.01 -1.17 0.02 0.00 0.00 175.30 174.61 1fnd s LEU 229 N -1.62 1.20 -0.03 2.53 2.96 -1.26 -1.46 118.68 121.00 1fnd s LEU 229 Ca 0.15 0.00 -0.01 0.00 -0.22 0.00 0.00 54.13 54.05 1fnd s LEU 229 Cb -0.10 -0.14 0.03 0.00 0.50 0.00 0.00 46.19 46.48 1fnd s LEU 229 CO 0.06 -0.10 0.05 -1.81 -1.32 0.00 0.00 176.35 173.22 1fnd s ASP 230 N 0.94 0.02 0.03 3.68 1.01 -0.45 -4.99 116.67 116.91 1fnd s ASP 230 Ca -0.09 0.09 0.02 0.00 0.71 0.00 0.00 52.55 53.28 1fnd s ASP 230 Cb -0.12 -0.00 -0.04 0.00 1.01 0.00 0.00 42.92 43.77 1fnd s ASP 230 CO -0.02 -0.11 0.03 -0.36 0.21 0.00 0.00 175.17 174.92 1fnd s PHE 231 N 0.89 3.12 -0.44 4.23 0.08 -1.26 -1.29 117.98 123.32 1fnd s PHE 231 Ca -0.07 0.09 0.03 0.00 0.12 0.00 0.00 56.93 57.09 1fnd s PHE 231 Cb -0.10 -1.65 0.12 0.00 -0.57 0.00 0.00 43.02 40.82 1fnd s PHE 231 CO -0.03 0.49 0.19 0.00 -0.10 0.00 0.00 175.22 175.78 1fnd s ALA 232 N -1.21 2.71 -1.09 5.36 0.00 -0.16 -4.90 121.76 122.47 1fnd s ALA 232 Ca 0.23 -2.76 -0.15 0.00 0.00 0.00 0.00 51.96 49.28 1fnd s ALA 232 Cb -0.12 -1.99 0.17 0.00 0.00 0.00 0.00 23.12 21.18 1fnd s ALA 232 CO 0.15 -1.92 1.28 0.08 0.00 0.00 0.00 175.76 175.34 1fnd s VAL 233 N 0.35 5.03 0.33 0.00 1.01 -1.25 -1.84 120.40 124.02 1fnd s VAL 233 Ca 0.15 -2.34 0.11 0.00 0.00 0.00 0.00 61.98 59.90 1fnd s VAL 233 Cb -0.23 -4.83 0.38 0.00 0.00 0.00 0.00 36.38 31.70 1fnd s VAL 233 CO -0.04 -1.53 1.53 -1.54 0.00 0.00 0.00 175.10 173.52 1fnd n SER 234 N 5.66 0.10 -1.04 3.32 3.41 -0.67 -1.21 113.62 123.19 1fnd n SER 234 Ca 0.31 1.63 0.10 0.00 -0.26 0.00 0.00 58.87 60.65 1fnd n SER 234 Cb 0.45 -0.69 0.26 0.00 -0.26 0.00 0.00 64.21 63.97 1fnd n SER 234 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1fnd n ARG 235 N -5.33 2.32 0.00 4.33 1.74 -0.30 -3.97 116.66 115.45 1fnd n ARG 235 Ca 0.30 -2.03 0.00 0.00 -0.77 0.00 0.00 57.85 55.34 1fnd n ARG 235 Cb 0.99 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.97 1fnd n ARG 235 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1fnd n GLU 236 N 1.17 3.21 -4.99 5.56 1.02 -0.35 -5.02 120.64 121.24 1fnd n GLU 236 Ca 0.19 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 57.03 1fnd n GLU 236 Cb 0.49 -0.46 -0.15 0.00 -0.02 0.00 0.00 31.44 31.30 1fnd n GLU 236 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1fnd s GLN 237 N -0.63 1.84 0.07 3.49 -0.21 -0.48 -5.07 119.66 118.66 1fnd s GLN 237 Ca 0.00 -1.05 0.03 0.00 0.02 0.00 0.00 55.36 54.36 1fnd s GLN 237 Cb 0.00 -1.95 -0.03 0.00 1.00 0.00 0.00 33.01 32.03 1fnd s GLN 237 CO 0.00 0.51 -0.09 0.95 -2.12 0.00 0.00 175.29 174.54 1fnd s THR 238 N -0.75 0.75 0.86 -0.19 -4.23 -1.25 -1.45 115.64 109.38 1fnd s THR 238 Ca 0.11 -1.35 -0.10 0.00 -1.18 0.00 0.00 61.69 59.17 1fnd s THR 238 Cb -0.10 -0.99 0.17 0.00 1.34 0.00 0.00 72.50 72.92 1fnd s THR 238 CO 0.01 -0.46 1.19 0.54 -0.54 0.00 0.00 174.62 175.37 1fnd s ASN 239 N -1.99 3.60 0.29 3.99 2.20 0.19 -4.79 114.94 118.44 1fnd s ASN 239 Ca -0.02 -0.02 -0.02 0.00 -0.94 0.00 0.00 52.86 51.85 1fnd s ASN 239 Cb -0.06 -0.14 0.61 0.00 -2.00 0.00 0.00 41.25 39.65 1fnd s ASN 239 CO 0.00 -2.39 1.53 -0.62 -2.94 0.00 0.00 177.10 172.68 1fnd n GLU 240 N -3.38 -0.08 0.00 3.55 4.71 -1.26 0.42 120.64 124.59 1fnd n GLU 240 Ca 0.15 1.49 0.07 0.00 -0.01 0.00 0.00 57.16 58.87 1fnd n GLU 240 Cb 0.60 -2.31 0.43 0.00 -1.01 0.00 0.00 31.44 29.16 1fnd n GLU 240 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 1fnd n LYS 241 N -5.52 0.59 -2.07 3.49 4.81 -1.26 -4.80 118.16 113.38 1fnd n LYS 241 Ca 0.20 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.54 1fnd n LYS 241 Cb 0.63 -1.39 -0.01 0.00 0.02 0.00 0.00 35.03 34.29 1fnd n LYS 241 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1fnd n GLY 242 N 0.15 0.11 3.86 3.14 0.00 1.39 -5.02 105.19 108.83 1fnd n GLY 242 Ca 0.11 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 45.31 1fnd n GLY 242 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fnd s GLU 243 N -4.28 3.91 0.17 1.61 2.02 -1.18 -4.70 118.70 116.26 1fnd s GLU 243 Ca 0.00 0.59 -0.32 0.00 0.02 0.00 0.00 54.97 55.26 1fnd s GLU 243 Cb 0.00 -2.42 -0.11 0.00 0.10 0.00 0.00 34.13 31.71 1fnd s GLU 243 CO 0.00 0.09 1.61 0.21 0.02 0.00 0.00 175.26 177.19 1fnd s LYS 244 N -3.30 4.19 -1.23 1.61 2.20 -1.26 0.53 119.74 122.48 1fnd s LYS 244 Ca 0.53 2.42 -0.21 0.00 -0.36 0.00 0.00 55.97 58.35 1fnd s LYS 244 Cb -0.10 -3.14 -0.04 0.00 -1.51 0.00 0.00 37.83 33.04 1fnd s LYS 244 CO 0.23 -0.65 1.87 1.41 -0.36 0.00 0.00 175.35 177.85 1fnd s MET 245 N 1.17 2.95 0.62 4.03 -2.45 -0.53 -4.81 119.30 120.29 1fnd s MET 245 Ca 0.71 -1.44 -0.07 0.00 -1.25 0.00 0.00 55.69 53.64 1fnd s MET 245 Cb -0.45 -5.34 0.01 0.00 1.25 0.00 0.00 34.83 30.30 1fnd s MET 245 CO 0.31 -3.46 0.94 0.71 1.05 0.00 0.00 175.02 174.57 1fnd s TYR 246 N 8.95 3.26 0.24 4.11 2.02 -1.26 -3.06 117.35 131.61 1fnd s TYR 246 Ca 0.64 0.73 -0.04 0.00 -0.37 0.00 0.00 57.07 58.02 1fnd s TYR 246 Cb 0.01 -2.82 0.43 0.00 -0.40 0.00 0.00 41.96 39.18 1fnd s TYR 246 CO 0.12 -0.91 1.76 0.97 -1.57 0.00 0.00 175.55 175.92 1fnd h ILE 247 N -0.29 0.76 0.00 2.71 2.10 -1.93 0.34 117.51 121.20 1fnd h ILE 247 Ca -0.45 -0.19 -0.05 0.00 1.08 0.00 0.00 64.86 65.24 1fnd h ILE 247 Cb 1.26 0.15 -0.01 0.00 -1.09 0.00 0.00 36.82 37.13 1fnd h ILE 247 CO 0.61 0.10 -0.25 0.06 -1.08 0.00 0.00 178.15 177.60 1fnd h GLN 248 N 0.56 0.00 -0.42 2.19 -0.00 -1.93 0.66 115.11 116.18 1fnd h GLN 248 Ca 0.40 0.00 -0.13 0.00 -0.00 0.00 0.00 58.65 58.92 1fnd h GLN 248 Cb 0.52 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 28.00 1fnd h GLN 248 CO -0.34 0.25 -0.26 1.15 -0.00 0.00 0.00 178.83 179.64 1fnd h THR 249 N 0.00 1.28 -0.10 1.86 2.02 -0.77 -2.09 112.91 115.11 1fnd h THR 249 Ca -0.00 -1.42 -0.17 0.00 0.77 0.00 0.00 66.41 65.58 1fnd h THR 249 Cb 0.45 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 1fnd h THR 249 CO 0.03 0.48 -0.68 -0.09 0.37 0.00 0.00 175.52 175.64 1fnd h ARG 250 N 0.74 0.42 -0.87 6.66 9.65 0.09 -3.24 114.38 127.84 1fnd h ARG 250 Ca 0.09 -0.32 0.05 0.00 -1.10 0.00 0.00 59.98 58.70 1fnd h ARG 250 Cb 0.84 0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 29.42 1fnd h ARG 250 CO 0.07 0.95 0.57 0.52 2.80 0.00 0.00 179.97 184.88 1fnd h MET 251 N 0.30 1.00 -0.26 0.20 2.86 -0.57 -2.50 114.93 115.96 1fnd h MET 251 Ca -0.02 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1fnd h MET 251 Cb 1.24 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.66 1fnd h MET 251 CO 0.12 0.66 0.16 0.00 1.06 0.00 0.00 176.91 178.91 1fnd h ALA 252 N 1.51 1.79 0.00 6.32 0.00 -1.41 0.19 119.26 127.67 1fnd h ALA 252 Ca 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1fnd h ALA 252 Cb 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1fnd h ALA 252 CO -0.12 0.19 0.00 0.37 0.00 0.00 0.00 179.25 179.69 1fnd h GLN 253 N 0.35 0.00 0.00 0.00 4.15 -1.56 -2.56 115.11 115.49 1fnd h GLN 253 Ca 0.09 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.51 1fnd h GLN 253 Cb -0.02 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 1fnd h GLN 253 CO -0.02 0.00 -0.23 0.66 -1.93 0.00 0.00 178.83 177.31 1fnd n TYR 254 N -2.54 0.00 -0.27 3.99 4.01 0.65 -4.88 117.16 118.13 1fnd n TYR 254 Ca -0.01 -1.10 0.05 0.00 -0.16 0.00 0.00 57.90 56.68 1fnd n TYR 254 Cb 0.10 -0.18 0.19 0.00 -0.31 0.00 0.00 39.34 39.14 1fnd n TYR 254 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1fnd h ALA 255 N 0.37 1.12 -0.26 -0.72 0.00 -1.23 -0.39 119.26 118.15 1fnd h ALA 255 Ca -0.01 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1fnd h ALA 255 Cb 1.05 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1fnd h ALA 255 CO 0.00 -0.12 -0.05 0.28 0.00 0.00 0.00 179.25 179.36 1fnd h VAL 256 N 0.55 1.28 -0.16 0.00 2.07 -1.89 -1.15 116.25 116.94 1fnd h VAL 256 Ca 0.41 -1.04 0.01 0.00 0.82 0.00 0.00 66.70 66.91 1fnd h VAL 256 Cb 0.56 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 1fnd h VAL 256 CO -0.35 0.33 0.06 -0.08 0.02 0.00 0.00 177.57 177.54 1fnd h GLU 257 N 0.24 0.14 -0.49 1.57 4.81 -1.73 -1.66 114.58 117.45 1fnd h GLU 257 Ca 0.07 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.21 1fnd h GLU 257 Cb 0.51 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1fnd h GLU 257 CO 0.02 0.09 0.02 -0.07 -0.73 0.00 0.00 179.01 178.34 1fnd h LEU 258 N 0.14 0.83 -0.86 1.64 3.38 -1.11 -1.89 115.31 117.45 1fnd h LEU 258 Ca 0.07 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.75 1fnd h LEU 258 Cb 0.04 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 1fnd h LEU 258 CO -0.07 0.92 0.57 -0.25 0.09 0.00 0.00 178.44 179.71 1fnd h TRP 259 N 0.71 1.08 -0.75 1.13 2.91 -1.08 0.02 115.95 119.98 1fnd h TRP 259 Ca 0.14 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.17 1fnd h TRP 259 Cb 0.49 -0.37 -0.03 0.00 -0.51 0.00 0.00 29.16 28.74 1fnd h TRP 259 CO 0.04 0.67 0.39 1.49 -1.03 0.00 0.00 178.44 180.00 1fnd h GLU 260 N 1.16 1.05 -0.77 2.65 4.57 -1.09 -2.60 114.58 119.56 1fnd h GLU 260 Ca 0.32 -0.14 -0.01 0.00 -1.18 0.00 0.00 59.36 58.35 1fnd h GLU 260 Cb -0.12 -0.20 -0.04 0.00 -0.16 0.00 0.00 28.75 28.23 1fnd h GLU 260 CO -0.07 0.80 0.45 0.52 -1.18 0.00 0.00 179.01 179.52 1fnd h MET 261 N 1.04 1.06 0.00 1.92 2.86 -0.48 -2.66 114.93 118.66 1fnd h MET 261 Ca 0.26 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1fnd h MET 261 Cb 0.07 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.51 1fnd h MET 261 CO -0.04 0.76 0.00 -0.07 1.06 0.00 0.00 176.91 178.62 1fnd h LEU 262 N 1.06 0.00 -0.20 1.22 3.38 -0.63 -2.19 115.31 117.96 1fnd h LEU 262 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1fnd h LEU 262 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1fnd h LEU 262 CO -0.05 0.00 -0.09 0.29 0.09 0.00 0.00 178.44 178.68 1fnd n LYS 263 N -3.03 0.66 -3.84 1.13 5.02 -1.00 -4.84 118.16 112.26 1fnd n LYS 263 Ca -0.03 -0.20 -0.35 0.00 -2.02 0.00 0.00 58.31 55.71 1fnd n LYS 263 Cb 0.09 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.55 1fnd n LYS 263 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1fnd s LYS 264 N -2.47 3.49 0.59 1.97 1.02 -0.83 -4.99 119.74 118.52 1fnd s LYS 264 Ca 0.29 -0.15 0.36 0.00 0.02 0.00 0.00 55.97 56.50 1fnd s LYS 264 Cb 0.20 -3.14 1.78 0.00 -0.52 0.00 0.00 37.83 36.15 1fnd s LYS 264 CO 0.47 0.72 2.15 0.22 -0.92 0.00 0.00 175.35 177.99 1fnd h ASP 265 N 4.41 0.00 -0.53 2.83 3.58 -1.88 -2.86 116.42 121.98 1fnd h ASP 265 Ca -0.52 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.93 1fnd h ASP 265 Cb 1.21 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.26 1fnd h ASP 265 CO 0.63 0.03 0.00 -0.46 -2.88 0.00 0.00 179.24 176.57 1fnd n ASN 266 N -3.24 4.63 -4.69 2.28 6.94 -1.26 -4.89 115.26 115.03 1fnd n ASN 266 Ca -0.01 -2.60 -0.35 0.00 -0.02 0.00 0.00 54.58 51.60 1fnd n ASN 266 Cb 0.20 -0.60 -0.09 0.00 -2.36 0.00 0.00 39.78 36.93 1fnd n ASN 266 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1fnd s THR 267 N -2.17 5.07 -0.08 5.53 2.01 -1.08 -0.78 115.64 124.14 1fnd s THR 267 Ca 0.45 0.06 0.02 0.00 0.31 0.00 0.00 61.69 62.54 1fnd s THR 267 Cb 0.32 -3.29 0.01 0.00 0.01 0.00 0.00 72.50 69.56 1fnd s THR 267 CO 0.17 0.47 -0.14 -0.31 -0.69 0.00 0.00 174.62 174.12 1fnd s TYR 268 N 0.24 1.69 -0.12 4.92 1.51 0.41 -4.77 117.35 121.23 1fnd s TYR 268 Ca 0.06 -0.67 -0.03 0.00 -1.01 0.00 0.00 57.07 55.42 1fnd s TYR 268 Cb -0.12 -1.22 -0.03 0.00 -0.11 0.00 0.00 41.96 40.48 1fnd s TYR 268 CO -0.00 -0.34 -0.02 0.08 -1.11 0.00 0.00 175.55 174.16 1fnd s VAL 269 N 0.71 4.14 -0.05 0.71 1.01 0.12 -1.22 120.40 125.81 1fnd s VAL 269 Ca -0.13 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 61.60 1fnd s VAL 269 Cb -0.16 -2.77 -0.00 0.00 0.00 0.00 0.00 36.38 33.45 1fnd s VAL 269 CO 0.03 0.55 -0.18 -0.31 0.00 0.00 0.00 175.10 175.20 1fnd s TYR 270 N -0.32 1.81 -0.04 5.22 1.51 -0.37 0.25 117.35 125.42 1fnd s TYR 270 Ca 0.06 -0.56 0.03 0.00 -1.01 0.00 0.00 57.07 55.59 1fnd s TYR 270 Cb -0.12 -1.22 0.00 0.00 -0.11 0.00 0.00 41.96 40.51 1fnd s TYR 270 CO 0.02 -0.20 -0.12 1.41 -1.11 0.00 0.00 175.55 175.55 1fnd s MET 271 N 0.11 1.40 -0.08 -0.62 1.75 0.17 -1.59 119.30 120.43 1fnd s MET 271 Ca -0.06 -0.42 -0.08 0.00 -1.25 0.00 0.00 55.69 53.88 1fnd s MET 271 Cb -0.13 -1.23 0.02 0.00 2.84 0.00 0.00 34.83 36.34 1fnd s MET 271 CO 0.03 0.13 0.22 0.00 -0.65 0.00 0.00 175.02 174.75 1fnd n GLY 273 N 3.06 0.53 3.74 0.00 0.00 -0.93 -2.53 105.19 109.07 1fnd n GLY 273 Ca -0.14 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 1fnd n GLY 273 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fnd s LEU 274 N 0.00 4.35 0.40 0.99 1.02 -1.26 -0.56 118.68 123.62 1fnd s LEU 274 Ca 0.00 2.91 0.18 0.00 0.02 0.00 0.00 54.13 57.25 1fnd s LEU 274 Cb 0.00 -3.63 1.10 0.00 0.02 0.00 0.00 46.19 43.69 1fnd s LEU 274 CO 0.00 -0.92 1.78 0.11 0.02 0.00 0.00 176.35 177.34 1fnd h LYS 275 N 5.35 0.38 -0.80 1.70 1.57 -1.53 0.14 116.57 123.38 1fnd h LYS 275 Ca -0.46 -0.02 0.10 0.00 -1.87 0.00 0.00 60.65 58.39 1fnd h LYS 275 Cb 1.22 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 33.38 1fnd h LYS 275 CO 0.83 0.25 0.52 0.78 -0.57 0.00 0.00 179.45 181.27 1fnd h GLY 276 N 0.40 1.05 2.00 3.86 0.00 -1.89 -2.21 103.07 106.28 1fnd h GLY 276 Ca 0.58 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.59 1fnd h GLY 276 CO -0.28 0.18 -0.09 0.00 0.00 0.00 0.00 176.54 176.34 1fnd h MET 277 N 0.74 0.00 -0.84 4.80 -0.00 -1.09 -2.86 114.93 115.68 1fnd h MET 277 Ca 0.37 0.00 0.04 0.00 -0.00 0.00 0.00 59.70 60.10 1fnd h MET 277 Cb 0.45 0.00 -0.05 0.00 -0.00 0.00 0.00 31.60 31.99 1fnd h MET 277 CO -0.14 0.09 0.54 1.49 -0.00 0.00 0.00 176.91 178.89 1fnd h GLU 278 N 0.00 1.01 -0.37 -0.10 4.81 -1.53 -2.25 114.58 116.15 1fnd h GLU 278 Ca -0.00 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.07 1fnd h GLU 278 Cb 0.19 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 1fnd h GLU 278 CO 0.01 0.67 -0.17 -0.22 -0.73 0.00 0.00 179.01 178.57 1fnd h LYS 279 N 1.04 0.76 -0.49 1.92 3.64 -1.67 -1.74 116.57 120.04 1fnd h LYS 279 Ca 0.34 -0.33 0.03 0.00 -1.27 0.00 0.00 60.65 59.42 1fnd h LYS 279 Cb 0.03 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.80 1fnd h LYS 279 CO -0.12 0.95 0.32 0.78 -2.27 0.00 0.00 179.45 179.11 1fnd h GLY 280 N 0.55 0.63 1.54 5.01 0.00 -1.53 -0.14 103.07 109.14 1fnd h GLY 280 Ca 0.08 -0.22 -0.27 0.00 0.00 0.00 0.00 47.33 46.93 1fnd h GLY 280 CO 0.05 0.19 -1.17 -2.22 0.00 0.00 0.00 176.54 173.40 1fnd h ILE 281 N 0.56 1.43 -0.66 2.60 2.04 -1.02 -2.76 117.51 119.70 1fnd h ILE 281 Ca 0.20 -2.79 -0.04 0.00 1.00 0.00 0.00 64.86 63.23 1fnd h ILE 281 Cb 0.09 2.77 -0.03 0.00 -0.74 0.00 0.00 36.82 38.91 1fnd h ILE 281 CO -0.05 0.82 0.26 0.44 0.00 0.00 0.00 178.15 179.63 1fnd h ASP 282 N 0.14 0.89 -0.31 1.72 3.32 -0.59 -1.42 116.42 120.18 1fnd h ASP 282 Ca -0.13 -0.12 0.06 0.00 0.02 0.00 0.00 57.03 56.86 1fnd h ASP 282 Cb 1.86 -0.23 -0.06 0.00 0.22 0.00 0.00 39.33 41.12 1fnd h ASP 282 CO 0.20 0.80 -0.11 0.44 -1.72 0.00 0.00 179.24 178.85 1fnd h ASP 283 N 0.96 -0.37 -0.74 6.45 3.32 -0.90 0.14 116.42 125.27 1fnd h ASP 283 Ca 0.22 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.36 1fnd h ASP 283 Cb 0.18 0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 1fnd h ASP 283 CO -0.02 -0.14 0.39 0.40 -1.72 0.00 0.00 179.24 178.15 1fnd h ILE 284 N -0.04 1.23 -0.09 0.35 1.08 -1.19 -3.26 117.51 115.58 1fnd h ILE 284 Ca 0.15 -0.60 -0.19 0.00 -0.39 0.00 0.00 64.86 63.83 1fnd h ILE 284 Cb 0.28 0.27 -0.00 0.00 -3.07 0.00 0.00 36.82 34.30 1fnd h ILE 284 CO -0.34 0.26 -0.75 0.24 -0.69 0.00 0.00 178.15 176.87 1fnd h MET 285 N 1.02 0.49 -0.69 2.37 2.86 -0.54 -2.46 114.93 117.98 1fnd h MET 285 Ca 0.26 -0.41 0.15 0.00 -2.06 0.00 0.00 59.70 57.64 1fnd h MET 285 Cb 0.06 0.09 -0.11 0.00 0.06 0.00 0.00 31.60 31.70 1fnd h MET 285 CO -0.04 1.04 0.09 0.28 1.06 0.00 0.00 176.91 179.34 1fnd h VAL 286 N 0.34 0.48 -0.26 -2.22 2.07 -0.79 0.16 116.25 116.03 1fnd h VAL 286 Ca -0.04 -0.07 -0.18 0.00 0.82 0.00 0.00 66.70 67.24 1fnd h VAL 286 Cb 1.34 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1fnd h VAL 286 CO 0.13 0.03 -0.55 0.28 0.02 0.00 0.00 177.57 177.49 1fnd h SER 287 N 0.19 0.87 -0.49 0.57 0.02 -1.63 -0.95 113.55 112.12 1fnd h SER 287 Ca 0.38 -0.47 -0.06 0.00 -0.84 0.00 0.00 61.79 60.81 1fnd h SER 287 Cb 0.64 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.92 1fnd h SER 287 CO -0.54 1.24 0.09 -0.07 -1.14 0.00 0.00 176.83 176.41 1fnd h LEU 288 N 0.60 0.77 -0.31 5.07 3.38 -0.87 -2.81 115.31 121.14 1fnd h LEU 288 Ca 0.01 -0.26 -0.20 0.00 0.09 0.00 0.00 57.88 57.53 1fnd h LEU 288 Cb 1.14 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1fnd h LEU 288 CO 0.12 0.83 -0.71 0.00 0.09 0.00 0.00 178.44 178.77 1fnd h ALA 289 N 0.97 0.48 0.00 1.53 0.00 -0.65 -2.90 119.26 118.69 1fnd h ALA 289 Ca 0.15 -0.58 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 1fnd h ALA 289 Cb 0.38 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1fnd h ALA 289 CO 0.01 0.71 -0.07 0.00 0.00 0.00 0.00 179.25 179.90 1fnd h ALA 290 N 0.76 1.64 0.00 0.00 0.00 -1.03 0.15 119.26 120.77 1fnd h ALA 290 Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1fnd h ALA 290 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1fnd h ALA 290 CO 0.14 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.48 1fnd h ALA 291 N 1.93 1.00 -0.45 0.00 0.00 -1.28 0.34 119.26 120.79 1fnd h ALA 291 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fnd h ALA 291 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1fnd h ALA 291 CO 0.01 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.65 1fnd n GLU 292 N -2.85 2.59 -1.10 0.00 -0.58 0.28 -4.92 120.64 114.05 1fnd n GLU 292 Ca -0.00 -2.20 0.00 0.00 -0.42 0.00 0.00 57.16 54.54 1fnd n GLU 292 Cb 0.21 -1.39 0.00 0.00 -0.57 0.00 0.00 31.44 29.69 1fnd n GLU 292 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1fnd n GLY 293 N 1.01 0.48 3.47 0.62 0.00 0.12 -5.04 105.19 105.84 1fnd n GLY 293 Ca 0.16 -0.92 -0.33 0.00 0.00 0.00 0.00 46.02 44.93 1fnd n GLY 293 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fnd s ILE 294 N -2.00 3.01 -0.52 -0.61 1.01 0.08 -4.98 121.20 117.19 1fnd s ILE 294 Ca 0.00 -0.74 -0.24 0.00 0.00 0.00 0.00 60.65 59.67 1fnd s ILE 294 Cb 0.00 -2.18 0.04 0.00 0.01 0.00 0.00 42.46 40.33 1fnd s ILE 294 CO 0.00 0.59 0.89 -0.62 0.00 0.00 0.00 174.94 175.80 1fnd s ASP 295 N -0.71 6.37 0.30 3.58 2.15 -1.26 -3.11 116.67 123.98 1fnd s ASP 295 Ca 0.11 -0.28 0.05 0.00 0.43 0.00 0.00 52.55 52.86 1fnd s ASP 295 Cb -0.11 -2.42 0.71 0.00 -0.30 0.00 0.00 42.92 40.81 1fnd s ASP 295 CO 0.00 -1.13 1.78 -0.25 -0.17 0.00 0.00 175.17 175.40 1fnd h TRP 296 N 9.21 1.05 -0.92 -5.34 2.91 -1.87 -1.12 115.95 119.86 1fnd h TRP 296 Ca -0.26 0.03 0.02 0.00 1.13 0.00 0.00 58.89 59.82 1fnd h TRP 296 Cb 1.08 -0.32 -0.05 0.00 -0.51 0.00 0.00 29.16 29.36 1fnd h TRP 296 CO 0.88 0.24 0.60 0.82 -1.03 0.00 0.00 178.44 179.95 1fnd h ILE 297 N 0.77 1.19 0.08 2.65 2.04 -1.97 0.24 117.51 122.50 1fnd h ILE 297 Ca 0.57 -0.41 -0.27 0.00 1.00 0.00 0.00 64.86 65.74 1fnd h ILE 297 Cb 0.86 -0.12 0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1fnd h ILE 297 CO -0.38 0.22 -1.15 -0.33 0.00 0.00 0.00 178.15 176.51 1fnd h GLU 298 N 1.20 0.53 0.00 2.37 4.39 -1.70 -2.77 114.58 118.60 1fnd h GLU 298 Ca 0.36 -0.68 -0.00 0.00 0.34 0.00 0.00 59.36 59.38 1fnd h GLU 298 Cb -0.06 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1fnd h GLU 298 CO -0.10 1.29 -0.00 -0.92 -1.16 0.00 0.00 179.01 178.11 1fnd h TYR 299 N 0.25 -0.00 -0.93 4.33 3.20 -1.04 -1.09 116.97 121.69 1fnd h TYR 299 Ca -0.15 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 61.84 1fnd h TYR 299 Cb 1.82 0.00 -0.07 0.00 1.54 0.00 0.00 36.73 40.02 1fnd h TYR 299 CO 0.09 0.12 0.59 -0.22 -1.64 0.00 0.00 178.16 177.11 1fnd h LYS 300 N -0.12 0.84 -0.43 1.82 3.64 -0.62 0.11 116.57 121.81 1fnd h LYS 300 Ca -0.00 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.26 1fnd h LYS 300 Cb 0.12 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1fnd h LYS 300 CO 0.00 0.55 -0.03 -0.09 -2.27 0.00 0.00 179.45 177.61 1fnd h ARG 301 N 0.86 0.72 -0.40 1.90 2.43 -1.15 0.46 114.38 119.20 1fnd h ARG 301 Ca 0.45 -0.20 -0.10 0.00 -0.81 0.00 0.00 59.98 59.33 1fnd h ARG 301 Cb 0.53 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1fnd h ARG 301 CO -0.22 0.75 -0.13 1.96 -1.51 0.00 0.00 179.97 180.83 1fnd h GLN 302 N 0.67 0.80 -0.68 0.20 4.20 0.08 -1.94 115.11 118.44 1fnd h GLN 302 Ca 0.13 -0.32 -0.00 0.00 0.06 0.00 0.00 58.65 58.52 1fnd h GLN 302 Cb 0.46 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.17 1fnd h GLN 302 CO 0.02 0.94 0.42 -0.07 -0.67 0.00 0.00 178.83 179.48 1fnd h LEU 303 N 0.61 0.80 -0.97 1.46 3.38 -0.12 -1.94 115.31 118.54 1fnd h LEU 303 Ca 0.10 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.04 1fnd h LEU 303 Cb 0.67 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.16 1fnd h LEU 303 CO 0.05 0.61 0.64 0.11 0.09 0.00 0.00 178.44 179.94 1fnd h LYS 304 N 0.92 1.24 0.00 1.13 1.57 -0.82 0.18 116.57 120.79 1fnd h LYS 304 Ca 0.24 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.89 1fnd h LYS 304 Cb -0.05 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 31.97 1fnd h LYS 304 CO -0.05 0.82 -0.29 -0.22 -0.57 0.00 0.00 179.45 179.15 1fnd h LYS 305 N 1.28 0.00 -0.42 3.15 3.64 -1.02 -2.62 116.57 120.58 1fnd h LYS 305 Ca 0.37 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 1fnd h LYS 305 Cb -0.08 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1fnd h LYS 305 CO -0.10 0.29 0.00 0.00 -2.27 0.00 0.00 179.45 177.37 1fnd n ALA 306 N -2.32 2.44 -2.00 5.00 0.00 -0.63 -4.88 120.51 118.11 1fnd n ALA 306 Ca -0.01 -0.81 -0.15 0.00 0.00 0.00 0.00 53.44 52.47 1fnd n ALA 306 Cb 0.40 -0.97 -0.02 0.00 0.00 0.00 0.00 19.45 18.85 1fnd n ALA 306 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1fnd n GLU 307 N 0.89 -1.12 0.00 0.00 1.02 -0.94 -4.93 120.64 115.56 1fnd n GLU 307 Ca 0.17 0.81 0.11 0.00 -0.02 0.00 0.00 57.16 58.22 1fnd n GLU 307 Cb 0.42 -5.06 -0.02 0.00 -0.02 0.00 0.00 31.44 26.76 1fnd n GLU 307 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1fnd n GLN 308 N -2.46 0.88 -3.77 3.49 6.02 -0.04 -4.78 117.38 116.72 1fnd n GLN 308 Ca -0.17 -0.73 -0.29 0.00 -0.01 0.00 0.00 57.00 55.81 1fnd n GLN 308 Cb 0.58 -1.48 -0.16 0.00 1.02 0.00 0.00 30.24 30.20 1fnd n GLN 308 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 1fnd s TRP 309 N -2.62 1.59 -0.15 1.08 -0.11 -1.23 0.11 118.94 117.62 1fnd s TRP 309 Ca 0.16 -1.44 0.02 0.00 1.22 0.00 0.00 56.10 56.06 1fnd s TRP 309 Cb 0.18 -1.46 0.01 0.00 -1.50 0.00 0.00 33.47 30.70 1fnd s TRP 309 CO 0.65 -0.77 -0.21 -0.80 -4.62 0.00 0.00 176.95 171.20 1fnd s ASN 310 N 1.66 3.06 -0.04 5.86 0.01 0.14 -4.52 114.94 121.10 1fnd s ASN 310 Ca 0.04 -0.60 0.03 0.00 -0.71 0.00 0.00 52.86 51.61 1fnd s ASN 310 Cb -0.17 -1.42 0.01 0.00 0.41 0.00 0.00 41.25 40.07 1fnd s ASN 310 CO -0.16 0.05 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.67 1fnd s VAL 311 N 0.98 1.04 -0.36 1.60 1.01 -1.26 0.42 120.40 123.82 1fnd s VAL 311 Ca -0.03 -0.47 0.01 0.00 0.00 0.00 0.00 61.98 61.48 1fnd s VAL 311 Cb -0.15 -0.93 0.14 0.00 0.00 0.00 0.00 36.38 35.45 1fnd s VAL 311 CO -0.05 0.32 0.23 -0.70 0.00 0.00 0.00 175.10 174.90 1fnd s GLU 312 N 0.36 0.63 0.26 2.72 2.12 -0.40 -4.96 118.70 119.43 1fnd s GLU 312 Ca -0.08 -1.47 0.11 0.00 0.36 0.00 0.00 54.97 53.89 1fnd s GLU 312 Cb -0.12 -1.37 -0.05 0.00 0.26 0.00 0.00 34.13 32.86 1fnd s GLU 312 CO 0.02 -1.23 -0.10 0.14 -0.54 0.00 0.00 175.26 173.55 1fnd s VAL 313 N 0.89 3.00 0.00 3.70 -7.23 -1.26 -2.20 120.40 117.30 1fnd s VAL 313 Ca 0.20 -2.10 0.00 0.00 -1.81 0.00 0.00 61.98 58.28 1fnd s VAL 313 Cb -0.19 -2.58 0.00 0.00 0.56 0.00 0.00 36.38 34.17 1fnd s VAL 313 CO -0.02 -0.35 0.00 0.00 -0.31 0.00 0.00 175.10 174.42