#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k7d s ASN 2 N 0.00 4.25 -0.29 6.43 2.20 -0.55 -3.54 114.94 123.44 1k7d s ASN 2 Ca 0.00 -1.20 -0.20 0.00 -0.94 0.00 0.00 52.86 50.52 1k7d s ASN 2 Cb 0.00 -0.37 0.14 0.00 -2.00 0.00 0.00 41.25 39.02 1k7d s ASN 2 CO 0.00 -0.55 1.01 -0.32 -2.94 0.00 0.00 177.10 174.29 1k7d s MET 3 N -3.86 0.42 -0.07 3.55 1.75 -0.82 -1.31 119.30 118.97 1k7d s MET 3 Ca 0.37 0.63 0.01 0.00 -1.25 0.00 0.00 55.69 55.45 1k7d s MET 3 Cb 0.05 0.14 0.02 0.00 2.84 0.00 0.00 34.83 37.88 1k7d s MET 3 CO 0.20 -0.07 -0.07 1.67 -0.65 0.00 0.00 175.02 176.09 1k7d s TRP 4 N 0.88 1.18 -0.19 4.11 -2.14 -0.59 -1.68 118.94 120.51 1k7d s TRP 4 Ca -0.04 -0.46 -0.04 0.00 2.66 0.00 0.00 56.10 58.22 1k7d s TRP 4 Cb -0.04 -0.97 -0.02 0.00 -3.10 0.00 0.00 33.47 29.34 1k7d s TRP 4 CO -0.12 -0.32 -0.02 0.08 -2.66 0.00 0.00 176.95 173.92 1k7d s VAL 5 N 1.15 3.84 -0.20 -0.66 1.01 0.60 -1.92 120.40 124.23 1k7d s VAL 5 Ca -0.06 -0.35 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 1k7d s VAL 5 Cb -0.14 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.50 1k7d s VAL 5 CO -0.01 0.44 -0.04 -0.63 0.00 0.00 0.00 175.10 174.86 1k7d s ILE 6 N 0.93 3.61 0.60 2.22 1.01 0.14 -1.14 121.20 128.56 1k7d s ILE 6 Ca 0.01 -0.43 -0.03 0.00 0.00 0.00 0.00 60.65 60.19 1k7d s ILE 6 Cb -0.14 -2.62 0.12 0.00 0.01 0.00 0.00 42.46 39.83 1k7d s ILE 6 CO 0.02 0.44 0.82 0.61 0.00 0.00 0.00 174.94 176.83 1k7d n GLY 7 N 4.31 0.20 0.37 6.18 0.00 -0.67 -1.02 105.19 114.56 1k7d n GLY 7 Ca -0.18 -1.94 0.14 0.00 0.00 0.00 0.00 46.02 44.04 1k7d n GLY 7 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1k7d h LYS 8 N 0.00 0.39 0.00 1.61 3.64 -0.98 0.26 116.57 121.49 1k7d h LYS 8 Ca -0.27 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 1k7d h LYS 8 Cb 0.93 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 1k7d h LYS 8 CO 0.26 0.26 0.00 -1.13 -2.27 0.00 0.00 179.45 176.57 1k7d n SER 9 N -4.47 0.56 0.00 4.20 3.41 -1.26 -3.90 113.62 112.16 1k7d n SER 9 Ca 0.12 0.59 0.00 0.00 -0.26 0.00 0.00 58.87 59.32 1k7d n SER 9 Cb 0.45 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 1k7d n SER 9 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1k7d n LYS 10 N -2.07 5.64 -2.87 4.33 5.02 -0.34 -4.84 118.16 123.04 1k7d n LYS 10 Ca 0.04 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.92 1k7d n LYS 10 Cb 0.31 -0.50 -0.04 0.00 -0.02 0.00 0.00 35.03 34.78 1k7d n LYS 10 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1k7d s ALA 11 N -0.99 3.32 -0.13 7.82 0.00 -0.07 0.00 121.76 131.72 1k7d s ALA 11 Ca 0.00 0.27 -0.06 0.00 0.00 0.00 0.00 51.96 52.17 1k7d s ALA 11 Cb 0.00 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 1k7d s ALA 11 CO 0.00 -0.31 0.10 -1.14 0.00 0.00 0.00 175.76 174.41 1k7d s GLN 12 N 1.27 3.46 -1.83 0.00 0.74 0.80 -4.42 119.66 119.68 1k7d s GLN 12 Ca 0.44 -0.23 0.00 0.00 0.05 0.00 0.00 55.36 55.62 1k7d s GLN 12 Cb -0.19 -3.12 0.00 0.00 1.10 0.00 0.00 33.01 30.81 1k7d s GLN 12 CO 0.20 0.66 0.00 -0.25 -0.55 0.00 0.00 175.29 175.35 1k7d n ASP 13 N 2.34 -5.92 -3.61 6.67 8.00 -1.26 -4.14 116.55 118.63 1k7d n ASP 13 Ca -0.19 0.02 -0.01 0.00 0.71 0.00 0.00 54.79 55.32 1k7d n ASP 13 Cb 0.54 -4.95 -0.01 0.00 -0.02 0.00 0.00 41.12 36.68 1k7d n ASP 13 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1k7d s ALA 14 N -3.03 -2.16 -0.16 2.24 0.00 -1.26 -1.43 121.76 115.96 1k7d s ALA 14 Ca 0.00 1.10 0.17 0.00 0.00 0.00 0.00 51.96 53.24 1k7d s ALA 14 Cb 0.00 0.14 -0.25 0.00 0.00 0.00 0.00 23.12 23.02 1k7d s ALA 14 CO 0.00 -0.85 0.24 1.63 0.00 0.00 0.00 175.76 176.79 1k7d n LYS 15 N -0.31 0.67 -3.58 0.00 5.02 -0.86 -4.62 118.16 114.49 1k7d n LYS 15 Ca -0.04 0.04 -0.11 0.00 -2.02 0.00 0.00 58.31 56.17 1k7d n LYS 15 Cb 0.61 -1.58 -0.04 0.00 -0.02 0.00 0.00 35.03 33.99 1k7d n LYS 15 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1k7d s ALA 16 N -2.61 -1.14 -0.13 7.82 0.00 -1.23 -0.98 121.76 123.50 1k7d s ALA 16 Ca -0.09 0.17 -0.10 0.00 0.00 0.00 0.00 51.96 51.94 1k7d s ALA 16 Cb 0.07 0.69 0.04 0.00 0.00 0.00 0.00 23.12 23.92 1k7d s ALA 16 CO 0.83 -0.65 0.33 0.42 0.00 0.00 0.00 175.76 176.69 1k7d s ILE 17 N -3.58 -0.01 -0.07 0.00 1.01 -0.19 -1.27 121.20 117.11 1k7d s ILE 17 Ca 0.01 0.03 -0.00 0.00 0.00 0.00 0.00 60.65 60.69 1k7d s ILE 17 Cb 0.01 -0.47 0.02 0.00 0.01 0.00 0.00 42.46 42.04 1k7d s ILE 17 CO -0.11 0.01 -0.03 -0.32 0.00 0.00 0.00 174.94 174.49 1k7d s MET 18 N 0.48 0.87 -0.15 2.79 1.75 -0.04 0.28 119.30 125.28 1k7d s MET 18 Ca -0.03 -0.05 -0.01 0.00 -1.25 0.00 0.00 55.69 54.36 1k7d s MET 18 Cb -0.04 -1.02 0.04 0.00 2.84 0.00 0.00 34.83 36.65 1k7d s MET 18 CO -0.03 -0.19 -0.05 0.08 -0.65 0.00 0.00 175.02 174.18 1k7d s VAL 19 N 1.45 0.99 -0.05 10.11 1.01 -0.81 -0.89 120.40 132.22 1k7d s VAL 19 Ca -0.02 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 61.55 1k7d s VAL 19 Cb -0.13 -1.14 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 1k7d s VAL 19 CO -0.03 0.18 -0.23 0.21 0.00 0.00 0.00 175.10 175.23 1k7d s ASN 20 N 1.70 2.85 -0.43 3.32 3.04 -0.31 -1.54 114.94 123.57 1k7d s ASN 20 Ca 0.02 -0.47 0.03 0.00 0.04 0.00 0.00 52.86 52.48 1k7d s ASN 20 Cb -0.14 -0.68 0.16 0.00 -1.54 0.00 0.00 41.25 39.04 1k7d s ASN 20 CO -0.08 0.24 0.30 -0.83 -3.04 0.00 0.00 177.10 173.70 1k7d s GLY 21 N -0.22 1.37 0.20 1.21 0.00 -0.43 -2.28 107.32 107.17 1k7d s GLY 21 Ca -0.01 -2.46 -0.30 0.00 0.00 0.00 0.00 44.72 41.95 1k7d s GLY 21 CO 0.02 1.90 1.06 2.56 0.00 0.00 0.00 173.10 178.65 1k7d s PRO 22 N 0.23 4.65 -0.68 2.90 0.04 -1.25 -1.48 135.00 139.42 1k7d s PRO 22 Ca 0.25 1.68 -0.04 0.00 0.04 0.00 0.00 61.00 62.93 1k7d s PRO 22 Cb -0.10 -3.27 0.17 0.00 0.04 0.00 0.00 34.50 31.35 1k7d s PRO 22 CO -0.10 0.17 0.51 -0.65 0.04 0.00 0.00 177.00 176.97 1k7d s GLN 23 N -0.63 2.76 0.00 4.56 -0.21 -1.26 0.16 119.66 125.03 1k7d s GLN 23 Ca 0.47 -2.60 0.25 0.00 0.02 0.00 0.00 55.36 53.50 1k7d s GLN 23 Cb -0.29 -3.83 0.36 0.00 1.00 0.00 0.00 33.01 30.25 1k7d s GLN 23 CO 0.35 -1.20 1.35 1.19 -2.12 0.00 0.00 175.29 174.87 1k7d n PHE 24 N 3.42 0.00 0.00 0.91 3.72 -1.26 -4.63 117.46 119.62 1k7d n PHE 24 Ca 0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.50 1k7d n PHE 24 Cb 0.39 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.93 1k7d n PHE 24 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1k7d n GLY 25 N 1.32 0.24 3.29 1.37 0.00 -1.26 -4.96 105.19 105.19 1k7d n GLY 25 Ca 0.15 -1.99 -0.32 0.00 0.00 0.00 0.00 46.02 43.86 1k7d n GLY 25 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1k7d s TRP 26 N -1.24 2.69 0.05 1.61 0.51 -1.26 -4.68 118.94 116.62 1k7d s TRP 26 Ca 0.00 -0.86 -0.04 0.00 -2.12 0.00 0.00 56.10 53.08 1k7d s TRP 26 Cb 0.00 -1.78 -0.02 0.00 -0.81 0.00 0.00 33.47 30.86 1k7d s TRP 26 CO 0.00 -0.32 0.07 0.71 -0.51 0.00 0.00 176.95 176.89 1k7d s TYR 27 N 0.36 0.29 -0.09 -1.98 2.02 -1.26 -1.43 117.35 115.26 1k7d s TYR 27 Ca -0.15 -0.69 0.01 0.00 -0.37 0.00 0.00 57.07 55.88 1k7d s TYR 27 Cb -0.17 -0.20 0.02 0.00 -0.40 0.00 0.00 41.96 41.20 1k7d s TYR 27 CO 0.07 -0.39 -0.12 0.00 -1.57 0.00 0.00 175.55 173.53 1k7d s ALA 28 N -3.17 1.44 1.10 3.71 0.00 0.43 -3.58 121.76 121.69 1k7d s ALA 28 Ca -0.00 -0.56 -0.15 0.00 0.00 0.00 0.00 51.96 51.25 1k7d s ALA 28 Cb 0.02 -0.74 0.24 0.00 0.00 0.00 0.00 23.12 22.65 1k7d s ALA 28 CO -0.07 -0.07 1.08 -1.25 0.00 0.00 0.00 175.76 175.45 1k7d s PRO 29 N 1.00 -0.41 0.37 0.00 0.04 -1.26 -4.37 135.00 130.37 1k7d s PRO 29 Ca -0.08 0.35 -0.25 0.00 0.04 0.00 0.00 61.00 61.06 1k7d s PRO 29 Cb -0.15 -1.65 -0.12 0.00 0.04 0.00 0.00 34.50 32.62 1k7d s PRO 29 CO -0.01 -3.26 0.89 0.00 0.04 0.00 0.00 177.00 174.67 1k7d n ALA 30 N -4.52 -0.42 -0.05 8.56 0.00 -1.24 -4.91 120.51 117.93 1k7d n ALA 30 Ca 0.07 0.28 -0.03 0.00 0.00 0.00 0.00 53.44 53.75 1k7d n ALA 30 Cb 0.58 -1.98 0.19 0.00 0.00 0.00 0.00 19.45 18.24 1k7d n ALA 30 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1k7d h TYR 31 N 1.51 0.71 -2.01 0.00 3.20 -1.81 -3.44 116.97 115.12 1k7d h TYR 31 Ca -0.41 -0.11 -0.52 0.00 3.14 0.00 0.00 58.73 60.83 1k7d h TYR 31 Cb 1.36 -0.19 -0.06 0.00 1.54 0.00 0.00 36.73 39.38 1k7d h TYR 31 CO 0.43 0.72 -0.52 0.95 -1.64 0.00 0.00 178.16 178.10 1k7d s THR 32 N -4.84 3.69 -0.08 1.81 -4.23 -1.26 -2.45 115.64 108.28 1k7d s THR 32 Ca -0.08 -1.53 0.02 0.00 -1.18 0.00 0.00 61.69 58.93 1k7d s THR 32 Cb 0.14 -3.16 0.01 0.00 1.34 0.00 0.00 72.50 70.84 1k7d s THR 32 CO 0.80 -0.26 -0.14 -0.47 -0.54 0.00 0.00 174.62 174.01 1k7d s TYR 33 N -2.28 1.70 0.03 3.99 5.04 0.90 -4.86 117.35 121.88 1k7d s TYR 33 Ca 0.36 -0.67 -0.22 0.00 -2.44 0.00 0.00 57.07 54.10 1k7d s TYR 33 Cb -0.06 -1.22 -0.06 0.00 0.35 0.00 0.00 41.96 40.97 1k7d s TYR 33 CO 0.24 -0.33 0.66 0.20 -1.34 0.00 0.00 175.55 174.98 1k7d s GLY 34 N 0.66 2.70 -0.15 8.97 0.00 -1.26 -0.44 107.32 117.80 1k7d s GLY 34 Ca -0.14 0.13 -0.29 0.00 0.00 0.00 0.00 44.72 44.42 1k7d s GLY 34 CO 0.04 0.82 0.78 -1.50 0.00 0.00 0.00 173.10 173.24 1k7d s ILE 35 N -0.35 0.00 0.01 0.90 1.10 -0.75 -4.99 121.20 117.12 1k7d s ILE 35 Ca 0.33 0.00 0.04 0.00 -0.51 0.00 0.00 60.65 60.51 1k7d s ILE 35 Cb -0.19 -1.00 -0.01 0.00 0.15 0.00 0.00 42.46 41.40 1k7d s ILE 35 CO 0.20 0.00 -0.11 -0.83 -2.11 0.00 0.00 174.94 172.08 1k7d s GLY 36 N -0.62 0.59 -0.03 1.50 0.00 -1.26 -2.53 107.32 104.96 1k7d s GLY 36 Ca -0.05 -0.57 0.03 0.00 0.00 0.00 0.00 44.72 44.13 1k7d s GLY 36 CO 0.05 -0.52 -0.11 1.08 0.00 0.00 0.00 173.10 173.60 1k7d s LEU 37 N -0.56 1.81 -0.30 0.66 1.43 -0.44 -4.97 118.68 116.31 1k7d s LEU 37 Ca 0.03 -0.23 -0.02 0.00 -1.03 0.00 0.00 54.13 52.88 1k7d s LEU 37 Cb -0.05 -0.67 0.12 0.00 0.03 0.00 0.00 46.19 45.62 1k7d s LEU 37 CO 0.00 0.09 0.22 -1.00 0.23 0.00 0.00 176.35 175.89 1k7d s HIS 38 N 0.17 -0.01 0.00 0.29 3.76 -1.26 -0.50 115.29 117.75 1k7d s HIS 38 Ca -0.04 -0.66 0.00 0.00 -0.15 0.00 0.00 55.06 54.21 1k7d s HIS 38 Cb -0.10 -0.69 0.00 0.00 1.11 0.00 0.00 32.58 32.91 1k7d s HIS 38 CO 0.01 -0.88 0.00 0.41 -0.85 0.00 0.00 174.74 173.43 1k7d n GLY 39 N 5.09 2.37 3.51 -2.22 0.00 -0.62 -4.99 105.19 108.32 1k7d n GLY 39 Ca -0.01 -1.57 -0.25 0.00 0.00 0.00 0.00 46.02 44.18 1k7d n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k7d n ALA 40 N -1.54 -1.10 -0.65 4.61 0.00 -1.26 -1.19 120.51 119.38 1k7d n ALA 40 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1k7d n ALA 40 Cb 0.00 -3.08 0.00 0.00 0.00 0.00 0.00 19.45 16.37 1k7d n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k7d n GLY 41 N -1.26 0.81 3.65 0.00 0.00 -1.26 -5.05 105.19 102.08 1k7d n GLY 41 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1k7d n GLY 41 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1k7d s TYR 42 N -3.14 2.90 -0.46 1.61 2.02 -0.33 -4.78 117.35 115.17 1k7d s TYR 42 Ca 0.00 -0.08 0.06 0.00 -0.37 0.00 0.00 57.07 56.68 1k7d s TYR 42 Cb 0.00 -1.48 0.18 0.00 -0.40 0.00 0.00 41.96 40.26 1k7d s TYR 42 CO 0.00 0.47 0.57 0.34 -1.57 0.00 0.00 175.55 175.36 1k7d s ASP 43 N -2.41 -0.36 0.15 2.29 2.15 -1.19 -1.59 116.67 115.71 1k7d s ASP 43 Ca 0.25 -1.91 0.02 0.00 0.43 0.00 0.00 52.55 51.34 1k7d s ASP 43 Cb -0.11 1.14 -0.05 0.00 -0.30 0.00 0.00 42.92 43.60 1k7d s ASP 43 CO 0.17 -0.13 -0.03 0.68 -0.17 0.00 0.00 175.17 175.69 1k7d s VAL 44 N 0.89 0.77 -0.14 1.11 -7.23 0.35 -4.17 120.40 111.97 1k7d s VAL 44 Ca 0.27 -1.98 -0.13 0.00 -1.81 0.00 0.00 61.98 58.33 1k7d s VAL 44 Cb -0.02 -1.98 0.04 0.00 0.56 0.00 0.00 36.38 34.97 1k7d s VAL 44 CO -0.08 -0.61 0.37 0.28 -0.31 0.00 0.00 175.10 174.75 1k7d s THR 45 N -3.59 -0.00 -4.83 5.32 -1.32 -1.05 -1.33 115.64 108.85 1k7d s THR 45 Ca 0.20 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.69 1k7d s THR 45 Cb 0.05 -0.52 0.00 0.00 -1.51 0.00 0.00 72.50 70.52 1k7d s THR 45 CO 0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.04 1k7d n GLY 46 N 2.94 -0.49 3.05 6.08 0.00 -1.05 -1.92 105.19 113.79 1k7d n GLY 46 Ca -0.13 -1.07 -0.09 0.00 0.00 0.00 0.00 46.02 44.72 1k7d n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k7d s ASN 47 N -4.00 0.25 -0.01 1.61 2.20 -0.67 -1.80 114.94 112.52 1k7d s ASN 47 Ca 0.00 -0.58 -0.07 0.00 -0.94 0.00 0.00 52.86 51.28 1k7d s ASN 47 Cb 0.00 0.16 0.00 0.00 -2.00 0.00 0.00 41.25 39.41 1k7d s ASN 47 CO 0.00 -0.41 0.14 0.28 -2.94 0.00 0.00 177.10 174.16 1k7d s THR 48 N -2.20 0.07 0.32 0.54 -1.32 0.42 -3.08 115.64 110.38 1k7d s THR 48 Ca -0.09 -0.55 -0.29 0.00 -1.21 0.00 0.00 61.69 59.55 1k7d s THR 48 Cb -0.04 -0.38 -0.11 0.00 -1.51 0.00 0.00 72.50 70.46 1k7d s THR 48 CO -0.03 -0.30 1.52 -2.84 -2.21 0.00 0.00 174.62 170.75 1k7d s PRO 49 N -1.08 4.16 -0.83 7.08 0.02 -1.26 -0.07 135.00 143.02 1k7d s PRO 49 Ca -0.12 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.41 1k7d s PRO 49 Cb -0.06 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.44 1k7d s PRO 49 CO 0.01 -0.54 0.00 1.19 -0.33 0.00 0.00 177.00 177.34 1k7d n PHE 50 N 1.54 -1.34 -4.04 6.54 3.72 -1.02 -1.45 117.46 121.40 1k7d n PHE 50 Ca 0.05 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.17 1k7d n PHE 50 Cb 0.39 -2.27 -0.03 0.00 -0.94 0.00 0.00 39.48 36.62 1k7d n PHE 50 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1k7d n ALA 51 N -1.78 -1.92 -1.68 4.37 0.00 -1.17 -4.92 120.51 113.40 1k7d n ALA 51 Ca -0.11 -0.26 -0.38 0.00 0.00 0.00 0.00 53.44 52.70 1k7d n ALA 51 Cb 0.52 -1.61 0.06 0.00 0.00 0.00 0.00 19.45 18.42 1k7d n ALA 51 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1k7d n TYR 52 N -4.43 1.54 -0.34 0.00 4.01 -0.53 -4.87 117.16 112.55 1k7d n TYR 52 Ca -0.27 0.43 0.19 0.00 -0.16 0.00 0.00 57.90 58.09 1k7d n TYR 52 Cb 0.67 -2.23 0.42 0.00 -0.31 0.00 0.00 39.34 37.88 1k7d n TYR 52 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1k7d h PRO 53 N 0.65 0.53 -5.66 -0.72 0.11 -1.92 -3.39 132.00 121.60 1k7d h PRO 53 Ca -0.50 -0.03 -0.61 0.00 0.11 0.00 0.00 66.00 64.97 1k7d h PRO 53 Cb 1.34 -0.12 -0.08 0.00 0.11 0.00 0.00 31.00 32.25 1k7d h PRO 53 CO 0.53 0.35 -0.33 0.20 -0.21 0.00 0.00 178.00 178.54 1k7d s GLY 54 N -3.90 2.27 -0.28 -0.55 0.00 -1.26 -4.94 107.32 98.67 1k7d s GLY 54 Ca -0.10 -0.44 -0.28 0.00 0.00 0.00 0.00 44.72 43.91 1k7d s GLY 54 CO 0.80 0.17 1.00 1.08 0.00 0.00 0.00 173.10 176.14 1k7d s LEU 55 N -0.29 4.03 0.44 0.66 1.02 -1.26 -4.87 118.68 118.41 1k7d s LEU 55 Ca 0.18 1.11 0.26 0.00 0.02 0.00 0.00 54.13 55.70 1k7d s LEU 55 Cb -0.14 -3.44 0.68 0.00 0.02 0.00 0.00 46.19 43.31 1k7d s LEU 55 CO 0.06 -0.73 1.73 0.58 0.02 0.00 0.00 176.35 178.01 1k7d h VAL 56 N 5.58 0.00 -3.29 -1.59 2.07 -1.90 -3.42 116.25 113.70 1k7d h VAL 56 Ca -0.21 -0.79 -0.51 0.00 0.82 0.00 0.00 66.70 66.01 1k7d h VAL 56 Cb 1.07 1.78 -0.39 0.00 -1.52 0.00 0.00 31.29 32.23 1k7d h VAL 56 CO 0.98 0.00 -0.77 -0.36 0.02 0.00 0.00 177.57 177.44 1k7d s PHE 57 N -3.33 1.10 -1.61 1.57 0.08 -1.18 -4.02 117.98 110.59 1k7d s PHE 57 Ca 0.06 -0.79 0.00 0.00 0.12 0.00 0.00 56.93 56.31 1k7d s PHE 57 Cb 0.07 -1.04 0.00 0.00 -0.57 0.00 0.00 43.02 41.48 1k7d s PHE 57 CO 0.62 -0.57 0.00 0.41 -0.10 0.00 0.00 175.22 175.58 1k7d n GLY 58 N 5.03 -1.62 3.30 4.36 0.00 -1.17 -1.67 105.19 113.43 1k7d n GLY 58 Ca -0.09 -1.08 -0.09 0.00 0.00 0.00 0.00 46.02 44.75 1k7d n GLY 58 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1k7d s HIS 59 N -2.17 0.20 -0.15 1.61 -3.43 -0.81 -1.41 115.29 109.13 1k7d s HIS 59 Ca 0.00 -0.58 0.18 0.00 -0.80 0.00 0.00 55.06 53.85 1k7d s HIS 59 Cb 0.00 0.01 0.35 0.00 -1.43 0.00 0.00 32.58 31.51 1k7d s HIS 59 CO 0.00 -0.67 1.22 0.27 -2.00 0.00 0.00 174.74 173.56 1k7d n ASN 60 N -0.17 2.78 0.00 7.38 0.23 -0.80 -2.53 115.26 122.14 1k7d n ASN 60 Ca -0.11 -3.02 0.00 0.00 -0.53 0.00 0.00 54.58 50.92 1k7d n ASN 60 Cb 0.63 -0.45 0.00 0.00 -2.08 0.00 0.00 39.78 37.88 1k7d n ASN 60 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1k7d n GLY 61 N -1.12 2.16 0.85 4.83 0.00 -1.26 -4.70 105.19 105.95 1k7d n GLY 61 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 1k7d n GLY 61 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1k7d n VAL 62 N -2.00 0.03 -4.35 1.61 0.31 -1.26 -4.79 118.33 107.88 1k7d n VAL 62 Ca 0.00 -0.01 -0.18 0.00 -0.01 0.00 0.00 64.34 64.14 1k7d n VAL 62 Cb 0.00 -1.38 -0.10 0.00 -0.91 0.00 0.00 33.84 31.45 1k7d n VAL 62 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1k7d s ILE 63 N -2.01 1.30 0.10 2.52 -4.36 -1.26 -1.76 121.20 115.73 1k7d s ILE 63 Ca -0.01 -2.08 0.07 0.00 -0.26 0.00 0.00 60.65 58.37 1k7d s ILE 63 Cb 0.00 -2.28 -0.03 0.00 1.25 0.00 0.00 42.46 41.40 1k7d s ILE 63 CO 0.01 -0.40 -0.17 -0.94 0.24 0.00 0.00 174.94 173.68 1k7d s SER 64 N -3.33 2.09 0.12 4.36 1.04 0.48 -1.91 113.70 116.55 1k7d s SER 64 Ca 0.26 -0.70 0.04 0.00 0.48 0.00 0.00 55.95 56.03 1k7d s SER 64 Cb 0.04 -0.09 -0.04 0.00 0.10 0.00 0.00 66.02 66.03 1k7d s SER 64 CO 0.08 -0.04 -0.10 -1.66 0.98 0.00 0.00 173.24 172.50 1k7d s TRP 65 N -1.47 1.12 0.34 5.02 -2.14 -0.50 -2.40 118.94 118.91 1k7d s TRP 65 Ca 0.04 -0.74 -0.13 0.00 2.66 0.00 0.00 56.10 57.93 1k7d s TRP 65 Cb -0.09 -0.60 0.03 0.00 -3.10 0.00 0.00 33.47 29.72 1k7d s TRP 65 CO 0.03 0.01 0.66 0.20 -2.66 0.00 0.00 176.95 175.19 1k7d s GLY 66 N -2.84 0.61 0.05 3.67 0.00 -1.03 -3.05 107.32 104.72 1k7d s GLY 66 Ca 0.11 -0.90 -0.09 0.00 0.00 0.00 0.00 44.72 43.85 1k7d s GLY 66 CO -0.01 -0.49 0.18 -0.56 0.00 0.00 0.00 173.10 172.22 1k7d s SER 67 N -3.08 0.07 -0.02 1.64 0.01 -1.26 -1.66 113.70 109.40 1k7d s SER 67 Ca 0.19 -0.45 -0.07 0.00 1.31 0.00 0.00 55.95 56.94 1k7d s SER 67 Cb -0.03 0.29 0.01 0.00 0.21 0.00 0.00 66.02 66.49 1k7d s SER 67 CO 0.13 -0.59 0.15 0.42 0.41 0.00 0.00 173.24 173.76 1k7d s THR 68 N -2.86 0.06 0.38 1.44 -4.23 -0.32 -4.76 115.64 105.35 1k7d s THR 68 Ca -0.03 -0.48 -0.27 0.00 -1.18 0.00 0.00 61.69 59.74 1k7d s THR 68 Cb 0.00 -0.37 -0.10 0.00 1.34 0.00 0.00 72.50 73.37 1k7d s THR 68 CO -0.06 -0.26 1.34 0.00 -0.54 0.00 0.00 174.62 175.10 1k7d s ALA 69 N -0.93 3.39 -0.07 3.99 0.00 -1.26 -0.02 121.76 126.85 1k7d s ALA 69 Ca -0.10 1.31 0.14 0.00 0.00 0.00 0.00 51.96 53.31 1k7d s ALA 69 Cb -0.06 -3.51 -0.12 0.00 0.00 0.00 0.00 23.12 19.43 1k7d s ALA 69 CO 0.01 -0.83 1.01 0.78 0.00 0.00 0.00 175.76 176.74 1k7d h GLY 70 N 2.93 0.00 -6.65 0.00 0.00 -1.56 -3.42 103.07 94.38 1k7d h GLY 70 Ca -0.50 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.30 1k7d h GLY 70 CO 0.64 0.00 -0.85 0.69 0.00 0.00 0.00 176.54 177.02 1k7d n PHE 71 N -3.08 -1.74 -2.18 5.60 3.72 -1.26 -4.93 117.46 113.60 1k7d n PHE 71 Ca -0.07 0.78 -0.27 0.00 -0.05 0.00 0.00 57.45 57.84 1k7d n PHE 71 Cb 0.87 -3.27 0.05 0.00 -0.94 0.00 0.00 39.48 36.20 1k7d n PHE 71 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1k7d s GLY 72 N -3.67 1.63 -0.68 1.37 0.00 -1.26 -0.92 107.32 103.78 1k7d s GLY 72 Ca 0.48 -0.67 -0.19 0.00 0.00 0.00 0.00 44.72 44.34 1k7d s GLY 72 CO 0.91 -0.32 0.83 -0.35 0.00 0.00 0.00 173.10 174.18 1k7d s ASP 73 N -4.40 6.30 -0.18 1.64 -1.08 -1.26 -4.06 116.67 113.63 1k7d s ASP 73 Ca 0.57 -1.54 0.16 0.00 -0.52 0.00 0.00 52.55 51.22 1k7d s ASP 73 Cb -0.11 -2.33 0.43 0.00 -1.46 0.00 0.00 42.92 39.45 1k7d s ASP 73 CO 0.47 -1.13 1.31 -0.90 0.52 0.00 0.00 175.17 175.44 1k7d n ASP 74 N 6.47 2.86 -3.70 -0.34 5.75 -1.26 -4.77 116.55 121.56 1k7d n ASP 74 Ca -0.01 -3.27 -0.15 0.00 -0.01 0.00 0.00 54.79 51.36 1k7d n ASP 74 Cb 0.44 -0.52 -0.14 0.00 -1.03 0.00 0.00 41.12 39.87 1k7d n ASP 74 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1k7d s VAL 75 N -2.96 -0.21 0.28 2.12 1.01 -1.26 -1.53 120.40 117.84 1k7d s VAL 75 Ca 0.39 0.26 0.06 0.00 0.00 0.00 0.00 61.98 62.69 1k7d s VAL 75 Cb 0.33 -0.33 -0.06 0.00 0.00 0.00 0.00 36.38 36.32 1k7d s VAL 75 CO 0.04 0.11 -0.04 -1.81 0.00 0.00 0.00 175.10 173.39 1k7d s ASP 76 N 1.89 2.61 -0.13 3.32 1.01 -0.06 -4.93 116.67 120.37 1k7d s ASP 76 Ca -0.02 -1.21 0.03 0.00 0.71 0.00 0.00 52.55 52.06 1k7d s ASP 76 Cb -0.12 -0.14 0.01 0.00 1.01 0.00 0.00 42.92 43.68 1k7d s ASP 76 CO -0.07 -0.39 -0.22 -0.63 0.21 0.00 0.00 175.17 174.07 1k7d s ILE 77 N -3.09 2.06 -0.20 0.77 1.01 -1.26 -0.07 121.20 120.41 1k7d s ILE 77 Ca 0.30 -0.99 -0.07 0.00 0.00 0.00 0.00 60.65 59.89 1k7d s ILE 77 Cb 0.04 -1.81 -0.04 0.00 0.01 0.00 0.00 42.46 40.67 1k7d s ILE 77 CO 0.12 0.55 0.06 -0.36 0.00 0.00 0.00 174.94 175.31 1k7d s PHE 78 N 0.71 3.18 -0.59 3.97 0.40 -0.75 -1.30 117.98 123.62 1k7d s PHE 78 Ca -0.10 -0.08 -0.25 0.00 -0.60 0.00 0.00 56.93 55.91 1k7d s PHE 78 Cb -0.16 -2.13 0.04 0.00 0.51 0.00 0.00 43.02 41.29 1k7d s PHE 78 CO 0.00 -0.01 1.00 0.00 0.70 0.00 0.00 175.22 176.92 1k7d s ALA 79 N 0.76 3.10 0.37 5.36 0.00 -0.15 -1.57 121.76 129.64 1k7d s ALA 79 Ca 0.03 -1.29 -0.20 0.00 0.00 0.00 0.00 51.96 50.50 1k7d s ALA 79 Cb -0.13 -3.83 -0.10 0.00 0.00 0.00 0.00 23.12 19.05 1k7d s ALA 79 CO 0.02 -2.55 0.88 -1.21 0.00 0.00 0.00 175.76 172.90 1k7d s GLU 80 N 4.23 4.23 -0.27 0.00 0.41 0.08 -1.00 118.70 126.38 1k7d s GLU 80 Ca 0.31 1.03 -0.10 0.00 -0.41 0.00 0.00 54.97 55.80 1k7d s GLU 80 Cb -0.12 -2.39 -0.04 0.00 -1.78 0.00 0.00 34.13 29.80 1k7d s GLU 80 CO 0.18 0.09 0.15 0.50 -0.49 0.00 0.00 175.26 175.70 1k7d s ARG 81 N -2.87 3.84 0.41 1.61 6.06 -1.26 -2.66 118.95 124.09 1k7d s ARG 81 Ca 0.57 -0.38 0.08 0.00 -2.50 0.00 0.00 55.73 53.50 1k7d s ARG 81 Cb -0.11 -3.55 -0.04 0.00 0.06 0.00 0.00 34.95 31.31 1k7d s ARG 81 CO 0.16 -0.19 0.26 -0.51 -2.50 0.00 0.00 175.30 172.53 1k7d s LEU 82 N 1.71 3.25 -0.09 -0.88 1.43 0.87 -1.72 118.68 123.25 1k7d s LEU 82 Ca 0.07 -0.91 -0.11 0.00 -1.03 0.00 0.00 54.13 52.15 1k7d s LEU 82 Cb -0.16 -1.73 0.03 0.00 0.03 0.00 0.00 46.19 44.36 1k7d s LEU 82 CO 0.09 -0.57 0.29 -0.94 0.23 0.00 0.00 176.35 175.44 1k7d s SER 83 N -4.00 -0.28 0.63 2.29 1.04 -1.26 -4.64 113.70 107.49 1k7d s SER 83 Ca 0.44 0.49 0.36 0.00 0.48 0.00 0.00 55.95 57.72 1k7d s SER 83 Cb 0.00 0.55 2.05 0.00 0.10 0.00 0.00 66.02 68.72 1k7d s SER 83 CO 0.25 -0.16 2.24 0.00 0.98 0.00 0.00 173.24 176.55 1k7d h ALA 84 N 5.37 1.32 0.00 5.32 0.00 -1.99 -1.73 119.26 127.56 1k7d h ALA 84 Ca -0.27 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1k7d h ALA 84 Cb 1.19 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1k7d h ALA 84 CO 0.34 -0.09 -0.71 0.93 0.00 0.00 0.00 179.25 179.72 1k7d h GLU 85 N 0.00 0.00 -2.23 0.00 3.07 -1.97 -3.37 114.58 110.08 1k7d h GLU 85 Ca 0.02 0.00 -0.59 0.00 -0.50 0.00 0.00 59.36 58.28 1k7d h GLU 85 Cb 0.17 0.00 -0.41 0.00 -0.84 0.00 0.00 28.75 27.67 1k7d h GLU 85 CO -0.00 0.06 -0.72 1.63 -1.40 0.00 0.00 179.01 178.58 1k7d n LYS 86 N -2.86 1.98 -1.70 2.33 5.02 -0.65 -5.08 118.16 117.20 1k7d n LYS 86 Ca 0.00 -4.28 -0.44 0.00 -2.02 0.00 0.00 58.31 51.57 1k7d n LYS 86 Cb 0.58 -2.00 -0.03 0.00 -0.02 0.00 0.00 35.03 33.56 1k7d n LYS 86 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1k7d n PRO 87 N 1.13 2.38 -0.98 1.97 -0.02 -1.24 -1.54 135.00 136.70 1k7d n PRO 87 Ca 0.27 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.60 1k7d n PRO 87 Cb 0.43 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.30 1k7d n PRO 87 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1k7d n GLY 88 N 3.00 0.44 3.39 -1.23 0.00 -1.26 -5.03 105.19 104.49 1k7d n GLY 88 Ca 0.14 -0.64 -0.20 0.00 0.00 0.00 0.00 46.02 45.32 1k7d n GLY 88 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1k7d s TYR 89 N -2.00 1.86 -0.04 1.61 1.51 -0.59 -1.20 117.35 118.50 1k7d s TYR 89 Ca 0.00 -0.59 -0.14 0.00 -1.01 0.00 0.00 57.07 55.33 1k7d s TYR 89 Cb 0.00 -0.93 0.02 0.00 -0.11 0.00 0.00 41.96 40.94 1k7d s TYR 89 CO 0.00 0.37 0.31 1.52 -1.11 0.00 0.00 175.55 176.63 1k7d s TYR 90 N -2.94 -0.22 -0.21 2.71 1.13 -0.51 -4.49 117.35 112.82 1k7d s TYR 90 Ca 0.26 0.40 -0.29 0.00 -1.41 0.00 0.00 57.07 56.03 1k7d s TYR 90 Cb 0.00 0.10 0.01 0.00 -1.10 0.00 0.00 41.96 40.97 1k7d s TYR 90 CO 0.09 -0.33 1.03 -1.17 -2.51 0.00 0.00 175.55 172.66 1k7d s LEU 91 N -0.94 4.12 -0.15 -3.49 2.96 -0.70 -0.67 118.68 119.82 1k7d s LEU 91 Ca -0.10 1.39 -0.04 0.00 -0.22 0.00 0.00 54.13 55.16 1k7d s LEU 91 Cb -0.05 -3.53 0.06 0.00 0.50 0.00 0.00 46.19 43.18 1k7d s LEU 91 CO 0.03 -0.63 0.13 -2.28 -1.32 0.00 0.00 176.35 172.29 1k7d s HIS 92 N 2.99 -0.01 -1.15 5.38 5.65 0.03 -4.28 115.29 123.90 1k7d s HIS 92 Ca 0.44 0.06 -0.03 0.00 0.25 0.00 0.00 55.06 55.78 1k7d s HIS 92 Cb -0.16 -0.51 0.00 0.00 -1.18 0.00 0.00 32.58 30.74 1k7d s HIS 92 CO 0.08 -0.45 0.98 0.09 -0.65 0.00 0.00 174.74 174.79 1k7d n ASN 93 N 5.30 -3.66 -0.07 9.88 5.03 0.19 -3.00 115.26 128.93 1k7d n ASN 93 Ca -0.06 -0.53 -0.01 0.00 0.87 0.00 0.00 54.58 54.85 1k7d n ASN 93 Cb 0.49 -4.66 -0.00 0.00 -1.02 0.00 0.00 39.78 34.59 1k7d n ASN 93 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1k7d n GLY 94 N -1.43 0.48 3.01 7.41 0.00 -1.26 -5.02 105.19 108.38 1k7d n GLY 94 Ca -0.15 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.54 1k7d n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k7d s LYS 95 N -0.86 0.40 -0.39 1.61 1.02 -1.16 -5.11 119.74 115.25 1k7d s LYS 95 Ca 0.00 -0.73 -0.20 0.00 0.02 0.00 0.00 55.97 55.06 1k7d s LYS 95 Cb 0.00 0.04 0.01 0.00 -0.52 0.00 0.00 37.83 37.36 1k7d s LYS 95 CO 0.00 -0.04 0.62 -1.58 -0.92 0.00 0.00 175.35 173.44 1k7d s TRP 96 N -1.81 3.12 -0.14 3.18 0.52 -1.26 -0.79 118.94 121.76 1k7d s TRP 96 Ca -0.11 0.16 -0.05 0.00 0.02 0.00 0.00 56.10 56.11 1k7d s TRP 96 Cb -0.07 -3.20 -0.04 0.00 -1.15 0.00 0.00 33.47 29.01 1k7d s TRP 96 CO -0.02 -0.72 0.04 0.08 0.02 0.00 0.00 176.95 176.35 1k7d s VAL 97 N 2.72 4.60 0.17 4.03 1.01 0.16 -4.86 120.40 128.23 1k7d s VAL 97 Ca 0.23 -0.12 -0.30 0.00 0.00 0.00 0.00 61.98 61.79 1k7d s VAL 97 Cb -0.14 -3.01 -0.08 0.00 0.00 0.00 0.00 36.38 33.14 1k7d s VAL 97 CO 0.16 0.53 1.23 -0.75 0.00 0.00 0.00 175.10 176.27 1k7d s LYS 98 N -0.18 4.45 0.62 2.72 2.47 -1.26 -1.43 119.74 127.13 1k7d s LYS 98 Ca 0.06 1.91 -0.16 0.00 -1.56 0.00 0.00 55.97 56.23 1k7d s LYS 98 Cb -0.12 -3.24 -0.02 0.00 -1.46 0.00 0.00 37.83 32.98 1k7d s LYS 98 CO 0.02 -0.16 1.09 -1.64 0.16 0.00 0.00 175.35 174.82 1k7d s MET 99 N -0.00 3.08 0.34 4.03 -1.94 -0.34 -4.94 119.30 119.53 1k7d s MET 99 Ca 0.55 1.36 -0.26 0.00 -1.71 0.00 0.00 55.69 55.63 1k7d s MET 99 Cb -0.33 -1.99 -0.09 0.00 2.01 0.00 0.00 34.83 34.42 1k7d s MET 99 CO 0.36 -1.03 1.01 -0.51 -0.01 0.00 0.00 175.02 174.84 1k7d s LEU 100 N -4.55 4.33 0.03 -0.03 1.43 0.15 -4.93 118.68 115.12 1k7d s LEU 100 Ca 0.67 1.99 -0.16 0.00 -1.03 0.00 0.00 54.13 55.60 1k7d s LEU 100 Cb -0.19 -3.98 0.03 0.00 0.03 0.00 0.00 46.19 42.07 1k7d s LEU 100 CO 0.37 -0.21 0.35 -0.94 0.23 0.00 0.00 176.35 176.15 1k7d s SER 101 N -1.44 -0.20 0.03 2.29 1.04 -1.26 -1.15 113.70 113.01 1k7d s SER 101 Ca 0.51 -0.04 -0.07 0.00 0.48 0.00 0.00 55.95 56.83 1k7d s SER 101 Cb -0.23 0.37 -0.00 0.00 0.10 0.00 0.00 66.02 66.26 1k7d s SER 101 CO 0.29 -0.59 0.14 0.00 0.98 0.00 0.00 173.24 174.06 1k7d s ARG 102 N -2.19 0.62 -0.11 4.02 1.70 -0.67 -4.99 118.95 117.33 1k7d s ARG 102 Ca -0.07 -0.66 -0.13 0.00 -0.47 0.00 0.00 55.73 54.40 1k7d s ARG 102 Cb -0.02 0.25 -0.05 0.00 -0.57 0.00 0.00 34.95 34.56 1k7d s ARG 102 CO -0.01 -0.17 0.31 -1.21 -1.08 0.00 0.00 175.30 173.14 1k7d s GLU 103 N -2.44 4.06 0.07 3.89 0.41 -1.26 -1.56 118.70 121.86 1k7d s GLU 103 Ca -0.06 0.15 0.07 0.00 -0.41 0.00 0.00 54.97 54.72 1k7d s GLU 103 Cb -0.02 -3.34 -0.03 0.00 -1.78 0.00 0.00 34.13 28.96 1k7d s GLU 103 CO -0.04 0.42 -0.20 -1.21 -0.49 0.00 0.00 175.26 173.75 1k7d s GLU 104 N -0.11 1.19 -0.13 1.61 0.41 -0.20 -5.00 118.70 116.45 1k7d s GLU 104 Ca 0.18 -1.02 -0.00 0.00 -0.41 0.00 0.00 54.97 53.72 1k7d s GLU 104 Cb -0.14 -1.35 0.03 0.00 -1.78 0.00 0.00 34.13 30.89 1k7d s GLU 104 CO 0.06 0.33 -0.09 0.99 -0.49 0.00 0.00 175.26 176.06 1k7d s THR 105 N -1.00 1.20 -0.48 3.63 2.01 -1.26 -1.02 115.64 118.73 1k7d s THR 105 Ca 0.06 -0.43 -0.24 0.00 0.31 0.00 0.00 61.69 61.39 1k7d s THR 105 Cb -0.09 -1.20 0.03 0.00 0.01 0.00 0.00 72.50 71.24 1k7d s THR 105 CO 0.03 0.36 0.84 -0.63 -0.69 0.00 0.00 174.62 174.53 1k7d s ILE 106 N 1.63 4.56 0.36 1.82 1.01 0.79 -4.93 121.20 126.45 1k7d s ILE 106 Ca 0.04 0.42 -0.25 0.00 0.00 0.00 0.00 60.65 60.86 1k7d s ILE 106 Cb -0.13 -4.39 -0.09 0.00 0.01 0.00 0.00 42.46 37.85 1k7d s ILE 106 CO -0.09 -0.83 1.02 -0.89 0.00 0.00 0.00 174.94 174.15 1k7d s THR 107 N 3.50 3.84 -0.06 2.92 2.01 -1.26 -2.07 115.64 124.53 1k7d s THR 107 Ca 0.31 1.50 0.02 0.00 0.31 0.00 0.00 61.69 63.83 1k7d s THR 107 Cb -0.12 -3.82 0.02 0.00 0.01 0.00 0.00 72.50 68.58 1k7d s THR 107 CO 0.22 0.10 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.47 1k7d s VAL 108 N -1.57 0.89 0.12 3.82 1.01 -1.26 -4.99 120.40 118.42 1k7d s VAL 108 Ca 0.53 -0.32 -0.31 0.00 0.00 0.00 0.00 61.98 61.88 1k7d s VAL 108 Cb -0.22 -0.85 -0.10 0.00 0.00 0.00 0.00 36.38 35.21 1k7d s VAL 108 CO 0.28 0.30 1.67 -0.75 0.00 0.00 0.00 175.10 176.60 1k7d s LYS 109 N 0.84 4.18 -1.35 2.72 2.47 -1.26 -2.31 119.74 125.03 1k7d s LYS 109 Ca -0.12 2.42 -0.08 0.00 -1.56 0.00 0.00 55.97 56.63 1k7d s LYS 109 Cb -0.15 -3.41 0.05 0.00 -1.46 0.00 0.00 37.83 32.87 1k7d s LYS 109 CO 0.02 -0.72 0.52 0.09 0.16 0.00 0.00 175.35 175.41 1k7d n ASN 110 N 4.94 -4.32 -3.27 1.43 3.02 -1.26 -4.92 115.26 110.87 1k7d n ASN 110 Ca 0.16 -0.36 -0.12 0.00 -0.03 0.00 0.00 54.58 54.23 1k7d n ASN 110 Cb 0.39 -3.55 -0.02 0.00 -0.61 0.00 0.00 39.78 35.99 1k7d n ASN 110 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1k7d s GLY 111 N -2.71 1.03 0.20 7.41 0.00 -0.98 -5.16 107.32 107.11 1k7d s GLY 111 Ca 0.37 -1.20 -0.14 0.00 0.00 0.00 0.00 44.72 43.75 1k7d s GLY 111 CO 0.46 -0.75 0.60 1.62 0.00 0.00 0.00 173.10 175.02 1k7d s GLN 112 N -3.00 3.97 0.24 2.90 0.74 -1.26 -4.51 119.66 118.75 1k7d s GLN 112 Ca 0.25 0.51 -0.29 0.00 0.05 0.00 0.00 55.36 55.88 1k7d s GLN 112 Cb -0.02 -2.79 -0.09 0.00 1.10 0.00 0.00 33.01 31.21 1k7d s GLN 112 CO 0.16 0.39 0.92 0.00 -0.55 0.00 0.00 175.29 176.21 1k7d s ALA 113 N -1.63 3.34 -0.09 1.58 0.00 -1.26 -4.54 121.76 119.16 1k7d s ALA 113 Ca 0.43 0.57 0.04 0.00 0.00 0.00 0.00 51.96 53.00 1k7d s ALA 113 Cb -0.14 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1k7d s ALA 113 CO 0.20 0.22 -0.22 -1.21 0.00 0.00 0.00 175.76 174.74 1k7d s GLU 114 N -1.31 2.70 -0.09 0.00 2.02 -0.88 -4.97 118.70 116.17 1k7d s GLU 114 Ca 0.42 -0.80 -0.03 0.00 0.02 0.00 0.00 54.97 54.58 1k7d s GLU 114 Cb -0.24 -2.10 -0.03 0.00 0.10 0.00 0.00 34.13 31.85 1k7d s GLU 114 CO 0.30 0.19 0.03 0.99 0.02 0.00 0.00 175.26 176.79 1k7d s THR 115 N 0.30 4.57 0.06 3.63 2.01 -1.26 -0.15 115.64 124.81 1k7d s THR 115 Ca -0.15 -0.15 -0.15 0.00 0.31 0.00 0.00 61.69 61.55 1k7d s THR 115 Cb -0.17 -2.94 0.03 0.00 0.01 0.00 0.00 72.50 69.43 1k7d s THR 115 CO 0.07 0.61 0.35 0.72 -0.69 0.00 0.00 174.62 175.68 1k7d s PHE 116 N -0.89 -0.16 -0.02 4.92 -0.71 -0.19 -5.01 117.98 115.93 1k7d s PHE 116 Ca 0.13 -0.00 -0.00 0.00 -1.04 0.00 0.00 56.93 56.02 1k7d s PHE 116 Cb -0.11 0.16 -0.04 0.00 -1.21 0.00 0.00 43.02 41.82 1k7d s PHE 116 CO 0.03 -0.57 0.04 0.99 -1.34 0.00 0.00 175.22 174.37 1k7d s THR 117 N -2.90 4.49 -0.10 -4.49 2.01 -1.26 -1.04 115.64 112.35 1k7d s THR 117 Ca -0.03 -0.44 0.02 0.00 0.31 0.00 0.00 61.69 61.55 1k7d s THR 117 Cb 0.00 -3.01 -0.02 0.00 0.01 0.00 0.00 72.50 69.48 1k7d s THR 117 CO -0.05 0.40 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.43 1k7d s VAL 118 N -1.11 2.86 0.07 3.82 1.01 -0.60 -4.98 120.40 121.47 1k7d s VAL 118 Ca 0.20 -0.75 0.07 0.00 0.00 0.00 0.00 61.98 61.50 1k7d s VAL 118 Cb -0.12 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 1k7d s VAL 118 CO 0.11 0.55 -0.15 0.26 0.00 0.00 0.00 175.10 175.87 1k7d s TRP 119 N 0.03 2.64 -0.06 5.22 0.52 -1.26 -1.67 118.94 124.36 1k7d s TRP 119 Ca -0.06 -0.21 -0.08 0.00 0.02 0.00 0.00 56.10 55.78 1k7d s TRP 119 Cb -0.15 -1.44 0.02 0.00 -1.15 0.00 0.00 33.47 30.75 1k7d s TRP 119 CO 0.05 0.34 0.21 0.50 0.02 0.00 0.00 176.95 178.07 1k7d s ARG 120 N -1.81 0.35 0.44 4.98 3.52 -0.30 -0.14 118.95 125.99 1k7d s ARG 120 Ca 0.17 0.09 0.01 0.00 -0.13 0.00 0.00 55.73 55.88 1k7d s ARG 120 Cb -0.11 0.16 0.01 0.00 -1.56 0.00 0.00 34.95 33.45 1k7d s ARG 120 CO 0.09 -0.06 0.06 0.25 -0.81 0.00 0.00 175.30 174.82 1k7d n THR 121 N 2.45 0.00 0.30 4.11 -2.24 -0.42 -0.67 114.28 117.81 1k7d n THR 121 Ca -0.16 -2.03 0.19 0.00 -2.27 0.00 0.00 64.05 59.79 1k7d n THR 121 Cb 0.58 0.33 0.98 0.00 -2.10 0.00 0.00 70.33 70.11 1k7d n THR 121 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1k7d h VAL 122 N 1.13 0.00 0.00 2.28 3.04 -2.00 -2.28 116.25 118.42 1k7d h VAL 122 Ca -0.35 -0.10 0.00 0.00 -1.01 0.00 0.00 66.70 65.24 1k7d h VAL 122 Cb 1.09 0.98 0.00 0.00 -2.01 0.00 0.00 31.29 31.35 1k7d h VAL 122 CO 0.58 0.00 -0.89 1.41 -1.01 0.00 0.00 177.57 177.66 1k7d n HIS 123 N -2.87 0.61 0.00 3.17 8.25 -1.26 -5.08 115.22 118.03 1k7d n HIS 123 Ca -0.02 0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 1k7d n HIS 123 Cb 0.11 -0.70 0.00 0.00 1.12 0.00 0.00 29.99 30.52 1k7d n HIS 123 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1k7d n GLY 124 N 1.29 1.20 3.77 -1.41 0.00 -0.86 -3.30 105.19 105.89 1k7d n GLY 124 Ca 0.02 -1.93 -0.37 0.00 0.00 0.00 0.00 46.02 43.74 1k7d n GLY 124 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1k7d s ASN 125 N 0.00 6.11 0.21 1.61 0.02 -1.26 -1.30 114.94 120.33 1k7d s ASN 125 Ca 0.00 2.26 -0.30 0.00 -1.02 0.00 0.00 52.86 53.80 1k7d s ASN 125 Cb 0.00 -2.60 -0.08 0.00 0.02 0.00 0.00 41.25 38.59 1k7d s ASN 125 CO 0.00 -0.96 1.01 -0.63 0.02 0.00 0.00 177.10 176.54 1k7d s ILE 126 N -1.61 3.99 0.09 0.60 -1.09 0.80 -2.58 121.20 121.40 1k7d s ILE 126 Ca 0.65 1.88 -0.30 0.00 -2.23 0.00 0.00 60.65 60.65 1k7d s ILE 126 Cb -0.27 -4.20 -0.05 0.00 -1.58 0.00 0.00 42.46 36.36 1k7d s ILE 126 CO 0.32 0.40 0.97 -0.76 -1.23 0.00 0.00 174.94 174.64 1k7d s LEU 127 N -0.87 4.47 0.00 2.97 1.43 0.49 -4.82 118.68 122.35 1k7d s LEU 127 Ca 0.44 1.77 0.00 0.00 -1.03 0.00 0.00 54.13 55.31 1k7d s LEU 127 Cb -0.27 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.36 1k7d s LEU 127 CO 0.34 -0.11 0.79 0.00 0.23 0.00 0.00 176.35 177.60 1k7d n GLN 128 N 3.02 0.84 -4.47 1.70 1.13 -1.26 -4.61 117.38 113.73 1k7d n GLN 128 Ca 0.03 0.00 -0.27 0.00 -1.94 0.00 0.00 57.00 54.82 1k7d n GLN 128 Cb 0.49 -1.05 -0.10 0.00 0.11 0.00 0.00 30.24 29.70 1k7d n GLN 128 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1k7d s THR 129 N -1.88 2.07 -1.43 5.09 2.01 -1.26 -4.84 115.64 115.39 1k7d s THR 129 Ca 0.00 -1.91 -0.08 0.00 0.31 0.00 0.00 61.69 60.01 1k7d s THR 129 Cb 0.00 -2.97 0.05 0.00 0.01 0.00 0.00 72.50 69.59 1k7d s THR 129 CO 0.00 0.00 0.89 0.47 -0.69 0.00 0.00 174.62 175.29 1k7d n ASP 130 N -1.06 -3.51 -4.68 3.53 8.00 -1.26 -4.71 116.55 112.85 1k7d n ASP 130 Ca -0.04 -0.78 -0.35 0.00 0.71 0.00 0.00 54.79 54.33 1k7d n ASP 130 Cb 0.66 -4.04 -0.09 0.00 -0.02 0.00 0.00 41.12 37.63 1k7d n ASP 130 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1k7d s GLN 131 N -6.35 3.64 0.23 -1.24 2.00 -1.26 -4.72 119.66 111.97 1k7d s GLN 131 Ca 0.40 -0.33 0.00 0.00 -2.00 0.00 0.00 55.36 53.44 1k7d s GLN 131 Cb -0.20 -3.10 -0.05 0.00 0.80 0.00 0.00 33.01 30.47 1k7d s GLN 131 CO 0.82 0.46 0.10 0.99 -0.50 0.00 0.00 175.29 177.16 1k7d s THR 132 N -0.17 0.36 0.39 -0.34 2.01 -0.82 -5.02 115.64 112.06 1k7d s THR 132 Ca 0.07 -2.00 0.15 0.00 0.31 0.00 0.00 61.69 60.22 1k7d s THR 132 Cb -0.12 -2.57 0.14 0.00 0.01 0.00 0.00 72.50 69.96 1k7d s THR 132 CO 0.01 -0.02 1.90 0.74 -0.69 0.00 0.00 174.62 176.56 1k7d h THR 133 N 2.48 1.14 0.02 -0.82 2.02 -1.98 -3.17 112.91 112.61 1k7d h THR 133 Ca -0.37 -1.00 -0.30 0.00 0.77 0.00 0.00 66.41 65.51 1k7d h THR 133 Cb 1.25 1.55 -0.04 0.00 -1.74 0.00 0.00 68.15 69.16 1k7d h THR 133 CO 0.58 0.28 -1.73 0.06 0.37 0.00 0.00 175.52 175.08 1k7d h GLN 134 N 0.00 0.05 -5.06 6.66 -0.00 -1.97 -3.39 115.11 111.41 1k7d h GLN 134 Ca -0.00 -0.08 -0.37 0.00 -0.00 0.00 0.00 58.65 58.20 1k7d h GLN 134 Cb 0.52 0.03 -0.22 0.00 -0.00 0.00 0.00 27.48 27.82 1k7d h GLN 134 CO 0.04 0.64 -0.76 0.99 -0.00 0.00 0.00 178.83 179.73 1k7d s THR 135 N -2.59 0.90 -0.02 1.86 2.01 -1.20 -0.09 115.64 116.51 1k7d s THR 135 Ca -0.07 -1.18 -0.11 0.00 0.31 0.00 0.00 61.69 60.64 1k7d s THR 135 Cb 0.08 -0.89 0.01 0.00 0.01 0.00 0.00 72.50 71.71 1k7d s THR 135 CO 0.82 -0.25 0.23 0.00 -0.69 0.00 0.00 174.62 174.72 1k7d s ALA 136 N -1.25 -0.56 -0.09 7.40 0.00 -1.09 -1.94 121.76 124.22 1k7d s ALA 136 Ca -0.04 0.17 -0.01 0.00 0.00 0.00 0.00 51.96 52.08 1k7d s ALA 136 Cb -0.10 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.03 1k7d s ALA 136 CO 0.01 -0.22 -0.06 0.71 0.00 0.00 0.00 175.76 176.21 1k7d s TYR 137 N -1.19 2.98 -0.08 0.00 2.02 -1.26 -0.74 117.35 119.08 1k7d s TYR 137 Ca -0.13 -0.07 0.03 0.00 -0.37 0.00 0.00 57.07 56.53 1k7d s TYR 137 Cb -0.06 -1.79 -0.02 0.00 -0.40 0.00 0.00 41.96 39.70 1k7d s TYR 137 CO 0.03 0.23 -0.17 0.00 -1.57 0.00 0.00 175.55 174.06 1k7d s ALA 138 N -0.47 2.48 -0.36 3.71 0.00 -0.61 -0.38 121.76 126.14 1k7d s ALA 138 Ca 0.07 -0.97 -0.15 0.00 0.00 0.00 0.00 51.96 50.91 1k7d s ALA 138 Cb -0.12 -0.96 -0.00 0.00 0.00 0.00 0.00 23.12 22.04 1k7d s ALA 138 CO 0.02 0.40 0.34 0.21 0.00 0.00 0.00 175.76 176.73 1k7d s LYS 139 N -0.16 3.42 -0.27 0.00 2.20 -1.06 -1.80 119.74 122.06 1k7d s LYS 139 Ca -0.02 -0.59 -0.09 0.00 -0.36 0.00 0.00 55.97 54.91 1k7d s LYS 139 Cb -0.14 -3.85 -0.04 0.00 -1.51 0.00 0.00 37.83 32.30 1k7d s LYS 139 CO 0.03 -0.58 0.14 0.45 -0.36 0.00 0.00 175.35 175.04 1k7d s SER 140 N 1.74 5.64 -0.15 1.43 0.15 0.90 -4.12 113.70 119.29 1k7d s SER 140 Ca 0.10 -0.10 -0.04 0.00 0.70 0.00 0.00 55.95 56.61 1k7d s SER 140 Cb -0.17 -2.04 -0.03 0.00 -1.71 0.00 0.00 66.02 62.07 1k7d s SER 140 CO 0.11 -0.04 -0.01 -0.13 1.20 0.00 0.00 173.24 174.37 1k7d s ARG 141 N 1.70 3.59 0.55 5.44 0.52 -1.26 -0.88 118.95 128.61 1k7d s ARG 141 Ca 0.07 -0.45 0.36 0.00 -0.52 0.00 0.00 55.73 55.19 1k7d s ARG 141 Cb -0.16 -2.95 1.79 0.00 0.52 0.00 0.00 34.95 34.15 1k7d s ARG 141 CO 0.08 0.35 2.10 0.00 0.02 0.00 0.00 175.30 177.85 1k7d h ALA 142 N 6.35 1.00 -0.08 2.13 0.00 -1.56 -1.57 119.26 125.53 1k7d h ALA 142 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1k7d h ALA 142 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1k7d h ALA 142 CO 0.63 0.00 0.00 -2.67 0.00 0.00 0.00 179.25 177.21 1k7d n TRP 143 N -2.92 0.09 -1.70 0.00 4.27 -1.26 -4.80 117.44 111.12 1k7d n TRP 143 Ca -0.01 -0.04 -0.44 0.00 -3.89 0.00 0.00 57.50 53.12 1k7d n TRP 143 Cb 0.17 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.08 1k7d n TRP 143 CO 0.00 0.00 0.00 -3.47 -2.29 0.00 0.00 177.69 171.93 1k7d n ASP 144 N 0.38 3.66 0.00 -0.67 2.03 -0.59 -0.24 116.55 121.12 1k7d n ASP 144 Ca 0.18 1.07 0.00 0.00 0.52 0.00 0.00 54.79 56.55 1k7d n ASP 144 Cb 0.38 -1.52 0.00 0.00 -0.72 0.00 0.00 41.12 39.26 1k7d n ASP 144 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1k7d n GLY 145 N 3.77 1.33 0.08 0.27 0.00 -1.26 -4.89 105.19 104.49 1k7d n GLY 145 Ca 0.16 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.28 1k7d n GLY 145 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1k7d n LYS 146 N -2.00 1.31 -0.02 1.61 5.02 0.66 -4.76 118.16 119.98 1k7d n LYS 146 Ca 0.00 -2.48 -0.09 0.00 -2.02 0.00 0.00 58.31 53.71 1k7d n LYS 146 Cb 0.00 -1.45 -0.04 0.00 -0.02 0.00 0.00 35.03 33.53 1k7d n LYS 146 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1k7d h GLU 147 N 0.00 0.04 -0.11 1.97 3.07 -1.90 -1.42 114.58 116.24 1k7d h GLU 147 Ca 0.00 -0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.70 1k7d h GLU 147 Cb 0.99 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.88 1k7d h GLU 147 CO 0.00 0.03 -0.62 0.28 -1.40 0.00 0.00 179.01 177.30 1k7d h VAL 148 N 0.05 1.36 -0.25 3.13 2.07 -1.94 -2.00 116.25 118.67 1k7d h VAL 148 Ca 0.07 -1.96 -0.02 0.00 0.82 0.00 0.00 66.70 65.61 1k7d h VAL 148 Cb 0.09 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1k7d h VAL 148 CO -0.12 0.59 0.07 0.00 0.02 0.00 0.00 177.57 178.13 1k7d h ALA 149 N 1.05 1.66 -0.12 1.67 0.00 -1.84 -1.93 119.26 119.75 1k7d h ALA 149 Ca -0.01 -0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.64 1k7d h ALA 149 Cb 1.16 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1k7d h ALA 149 CO 0.11 0.26 -0.65 0.77 0.00 0.00 0.00 179.25 179.74 1k7d h SER 150 N 0.35 0.52 -0.09 0.00 0.02 -0.51 0.72 113.55 114.55 1k7d h SER 150 Ca 0.09 -0.31 -0.00 0.00 -0.84 0.00 0.00 61.79 60.72 1k7d h SER 150 Cb 0.12 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.50 1k7d h SER 150 CO -0.01 1.03 0.04 0.25 -1.14 0.00 0.00 176.83 177.00 1k7d h LEU 151 N 0.33 0.12 -0.80 5.07 6.46 -1.13 -2.08 115.31 123.28 1k7d h LEU 151 Ca -0.01 -0.15 -0.04 0.00 -0.12 0.00 0.00 57.88 57.55 1k7d h LEU 151 Cb 1.21 -0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 41.07 1k7d h LEU 151 CO 0.11 0.24 0.33 -0.07 -0.62 0.00 0.00 178.44 178.44 1k7d h LEU 152 N -0.00 1.09 -1.37 2.25 -0.00 -1.28 -2.22 115.31 113.78 1k7d h LEU 152 Ca 0.03 -0.17 0.00 0.00 -0.00 0.00 0.00 57.88 57.75 1k7d h LEU 152 Cb 0.16 -0.28 -0.03 0.00 -0.00 0.00 0.00 40.66 40.50 1k7d h LEU 152 CO -0.00 0.96 0.38 0.00 -0.00 0.00 0.00 178.44 179.78 1k7d h ALA 153 N 1.18 1.54 0.00 1.53 0.00 -0.68 0.22 119.26 123.04 1k7d h ALA 153 Ca 0.27 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1k7d h ALA 153 Cb 0.20 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1k7d h ALA 153 CO -0.02 0.42 0.00 2.35 0.00 0.00 0.00 179.25 181.99 1k7d h TRP 154 N 0.83 0.00 0.07 0.00 2.91 -0.80 -1.82 115.95 117.14 1k7d h TRP 154 Ca 0.22 0.00 -0.32 0.00 1.13 0.00 0.00 58.89 59.92 1k7d h TRP 154 Cb -0.07 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 28.56 1k7d h TRP 154 CO 0.00 0.00 -1.75 2.41 -1.03 0.00 0.00 178.44 178.07 1k7d n THR 155 N -2.53 1.68 0.10 2.65 -1.04 0.12 -4.27 114.28 110.99 1k7d n THR 155 Ca 0.03 -0.41 -0.04 0.00 -2.04 0.00 0.00 64.05 61.59 1k7d n THR 155 Cb 0.35 -1.85 0.14 0.00 -1.82 0.00 0.00 70.33 67.16 1k7d n THR 155 CO 0.00 0.00 0.00 0.45 -0.64 0.00 0.00 175.07 174.88 1k7d h HIS 156 N -0.36 0.21 -0.37 -1.42 3.86 -0.66 -2.79 115.15 113.62 1k7d h HIS 156 Ca -0.41 -0.08 0.11 0.00 -1.16 0.00 0.00 60.37 58.83 1k7d h HIS 156 Cb 1.75 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 30.17 1k7d h HIS 156 CO 0.08 0.72 0.41 -0.56 0.86 0.00 0.00 177.93 179.44 1k7d h GLN 157 N 0.12 0.00 0.00 2.45 -0.00 -1.53 -0.94 115.11 115.21 1k7d h GLN 157 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1k7d h GLN 157 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.57 1k7d h GLN 157 CO 0.09 0.00 0.00 0.52 -0.00 0.00 0.00 178.83 179.44 1k7d h MET 158 N 0.00 0.00 -0.00 0.06 2.86 -1.71 -2.26 114.93 113.88 1k7d h MET 158 Ca 0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 1k7d h MET 158 Cb 0.99 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.65 1k7d h MET 158 CO -0.00 0.00 -0.33 1.63 1.06 0.00 0.00 176.91 179.27 1k7d n LYS 159 N -2.72 0.45 -2.19 1.72 5.02 -0.36 -4.73 118.16 115.36 1k7d n LYS 159 Ca 0.00 -0.25 -0.37 0.00 -2.02 0.00 0.00 58.31 55.68 1k7d n LYS 159 Cb 0.21 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 1k7d n LYS 159 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1k7d s ALA 160 N -2.72 2.86 0.00 7.82 0.00 -0.85 -4.96 121.76 123.91 1k7d s ALA 160 Ca 0.19 0.96 0.00 0.00 0.00 0.00 0.00 51.96 53.11 1k7d s ALA 160 Cb 0.19 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1k7d s ALA 160 CO 0.59 -0.80 0.39 1.63 0.00 0.00 0.00 175.76 177.57 1k7d n LYS 161 N -0.81 0.52 -3.85 0.00 4.76 -1.26 -4.61 118.16 112.91 1k7d n LYS 161 Ca 0.09 -0.39 -0.09 0.00 -2.87 0.00 0.00 58.31 55.05 1k7d n LYS 161 Cb 0.48 -0.89 0.01 0.00 -1.84 0.00 0.00 35.03 32.80 1k7d n LYS 161 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1k7d s ASN 162 N -0.18 0.02 0.15 4.39 2.20 -1.26 -4.86 114.94 115.40 1k7d s ASN 162 Ca 0.00 -1.06 -0.18 0.00 -0.94 0.00 0.00 52.86 50.68 1k7d s ASN 162 Cb 0.00 0.80 0.03 0.00 -2.00 0.00 0.00 41.25 40.09 1k7d s ASN 162 CO 0.00 -1.58 1.72 -0.25 -2.94 0.00 0.00 177.10 174.06 1k7d h TRP 163 N 2.02 0.06 0.13 1.54 2.91 -1.99 -2.23 115.95 118.39 1k7d h TRP 163 Ca -0.29 0.02 0.01 0.00 1.13 0.00 0.00 58.89 59.76 1k7d h TRP 163 Cb 1.25 0.02 -0.05 0.00 -0.51 0.00 0.00 29.16 29.87 1k7d h TRP 163 CO 1.16 -0.01 -0.51 1.96 -1.03 0.00 0.00 178.44 180.02 1k7d h GLN 164 N 0.14 -0.72 -0.31 2.65 4.20 -1.99 0.08 115.11 119.16 1k7d h GLN 164 Ca 0.14 0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.91 1k7d h GLN 164 Cb 0.17 0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 1k7d h GLN 164 CO -0.21 -0.48 0.20 0.93 -0.67 0.00 0.00 178.83 178.61 1k7d h GLU 165 N -0.74 0.37 0.04 1.46 5.08 -1.94 -2.28 114.58 116.58 1k7d h GLU 165 Ca -0.00 -0.02 -0.28 0.00 -1.00 0.00 0.00 59.36 58.06 1k7d h GLU 165 Cb 0.75 -0.08 0.02 0.00 0.50 0.00 0.00 28.75 29.94 1k7d h GLU 165 CO -0.28 0.25 -1.12 2.35 -1.00 0.00 0.00 179.01 179.21 1k7d h TRP 166 N 0.39 1.02 -0.09 4.33 7.01 -0.92 -3.08 115.95 124.60 1k7d h TRP 166 Ca 0.12 -0.59 -0.08 0.00 2.11 0.00 0.00 58.89 60.45 1k7d h TRP 166 Cb -0.00 -0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 26.94 1k7d h TRP 166 CO -0.00 1.42 -0.32 1.79 -2.79 0.00 0.00 178.44 178.54 1k7d h THR 167 N 0.35 1.26 -0.92 2.65 1.35 -0.65 -0.13 112.91 116.82 1k7d h THR 167 Ca -0.15 -1.25 0.09 0.00 -0.55 0.00 0.00 66.41 64.54 1k7d h THR 167 Cb 1.78 1.56 -0.07 0.00 -1.73 0.00 0.00 68.15 69.69 1k7d h THR 167 CO 0.22 0.37 0.59 1.56 -0.25 0.00 0.00 175.52 178.01 1k7d h GLN 168 N 0.15 0.94 0.12 4.72 4.20 -1.37 0.57 115.11 124.46 1k7d h GLN 168 Ca 0.02 -0.06 -0.28 0.00 0.06 0.00 0.00 58.65 58.39 1k7d h GLN 168 Cb 0.65 -0.21 0.02 0.00 0.30 0.00 0.00 27.48 28.24 1k7d h GLN 168 CO 0.05 0.62 -1.23 1.96 -0.67 0.00 0.00 178.83 179.56 1k7d h GLN 169 N 0.97 0.47 -0.16 1.46 1.08 -1.22 -3.25 115.11 114.45 1k7d h GLN 169 Ca 0.42 -0.67 0.03 0.00 -1.45 0.00 0.00 58.65 56.98 1k7d h GLN 169 Cb 0.33 0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.98 1k7d h GLN 169 CO -0.18 1.29 0.11 0.00 -0.95 0.00 0.00 178.83 179.11 1k7d h ALA 170 N 0.44 2.02 0.00 3.87 0.00 -0.22 0.29 119.26 125.66 1k7d h ALA 170 Ca -0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1k7d h ALA 170 Cb 1.91 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.67 1k7d h ALA 170 CO 0.22 -0.05 -0.05 0.00 0.00 0.00 0.00 179.25 179.37 1k7d h ALA 171 N 1.91 1.07 -0.10 0.00 0.00 -0.95 -2.76 119.26 118.43 1k7d h ALA 171 Ca 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1k7d h ALA 171 Cb 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1k7d h ALA 171 CO -0.01 0.07 0.00 1.63 0.00 0.00 0.00 179.25 180.94 1k7d n LYS 172 N -3.25 2.21 -3.18 0.00 5.02 0.08 -4.80 118.16 114.24 1k7d n LYS 172 Ca -0.01 -1.77 -0.42 0.00 -2.02 0.00 0.00 58.31 54.09 1k7d n LYS 172 Cb 0.25 -1.47 -0.07 0.00 -0.02 0.00 0.00 35.03 33.72 1k7d n LYS 172 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1k7d s GLN 173 N -1.90 3.52 0.06 1.97 -0.44 -1.04 -3.98 119.66 117.84 1k7d s GLN 173 Ca 0.32 -0.19 0.24 0.00 -2.50 0.00 0.00 55.36 53.23 1k7d s GLN 173 Cb 0.21 -3.85 0.29 0.00 -1.64 0.00 0.00 33.01 28.02 1k7d s GLN 173 CO 0.31 -0.77 1.25 0.00 0.50 0.00 0.00 175.29 176.58 1k7d n ALA 174 N 5.93 3.31 -1.76 1.58 0.00 -1.26 -2.20 120.51 126.12 1k7d n ALA 174 Ca -0.03 -0.34 -0.31 0.00 0.00 0.00 0.00 53.44 52.76 1k7d n ALA 174 Cb 0.48 -1.09 0.03 0.00 0.00 0.00 0.00 19.45 18.88 1k7d n ALA 174 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1k7d s LEU 175 N -3.72 3.14 -0.89 0.00 1.43 -1.26 -0.85 118.68 116.53 1k7d s LEU 175 Ca 0.07 1.45 -0.24 0.00 -1.03 0.00 0.00 54.13 54.39 1k7d s LEU 175 Cb 0.15 -4.40 0.06 0.00 0.03 0.00 0.00 46.19 42.02 1k7d s LEU 175 CO 0.74 -1.16 1.30 0.28 0.23 0.00 0.00 176.35 177.75 1k7d s THR 176 N -3.15 4.01 -0.01 5.49 -1.32 -1.26 -3.13 115.64 116.27 1k7d s THR 176 Ca 0.57 -0.48 0.01 0.00 -1.21 0.00 0.00 61.69 60.57 1k7d s THR 176 Cb -0.12 -4.94 0.01 0.00 -1.51 0.00 0.00 72.50 65.93 1k7d s THR 176 CO 0.54 -1.81 -0.02 -0.63 -2.21 0.00 0.00 174.62 170.50 1k7d s ILE 177 N 4.80 0.21 -0.16 5.08 -1.09 -1.15 -1.51 121.20 127.38 1k7d s ILE 177 Ca 0.38 -0.06 -0.25 0.00 -2.23 0.00 0.00 60.65 58.49 1k7d s ILE 177 Cb -0.05 -0.21 -0.02 0.00 -1.58 0.00 0.00 42.46 40.60 1k7d s ILE 177 CO -0.00 0.08 0.83 0.20 -1.23 0.00 0.00 174.94 174.82 1k7d s ASN 178 N 0.23 6.97 0.03 3.58 0.01 0.97 -0.72 114.94 126.01 1k7d s ASN 178 Ca -0.02 1.19 0.02 0.00 -0.71 0.00 0.00 52.86 53.35 1k7d s ASN 178 Cb -0.05 -2.46 -0.04 0.00 0.41 0.00 0.00 41.25 39.12 1k7d s ASN 178 CO -0.01 -0.38 0.01 0.26 -1.51 0.00 0.00 177.10 175.48 1k7d s TRP 179 N 2.02 3.08 0.07 2.20 0.52 0.02 -1.17 118.94 125.67 1k7d s TRP 179 Ca 0.39 0.06 0.06 0.00 0.02 0.00 0.00 56.10 56.62 1k7d s TRP 179 Cb -0.17 -1.63 -0.03 0.00 -1.15 0.00 0.00 33.47 30.49 1k7d s TRP 179 CO 0.13 0.48 -0.16 0.71 0.02 0.00 0.00 176.95 178.13 1k7d s TYR 180 N -1.19 1.36 0.06 -1.98 1.51 -0.67 -1.72 117.35 114.71 1k7d s TYR 180 Ca 0.23 -0.43 0.05 0.00 -1.01 0.00 0.00 57.07 55.91 1k7d s TYR 180 Cb -0.12 -0.77 -0.03 0.00 -0.11 0.00 0.00 41.96 40.94 1k7d s TYR 180 CO 0.14 0.09 -0.14 -0.47 -1.11 0.00 0.00 175.55 174.05 1k7d s TYR 181 N -1.17 1.23 0.09 2.71 6.14 0.15 -2.47 117.35 124.04 1k7d s TYR 181 Ca 0.01 -0.40 -0.15 0.00 0.64 0.00 0.00 57.07 57.17 1k7d s TYR 181 Cb -0.10 -0.71 0.03 0.00 0.42 0.00 0.00 41.96 41.60 1k7d s TYR 181 CO 0.03 0.05 0.35 0.00 0.64 0.00 0.00 175.55 176.62 1k7d s ALA 182 N -1.05 -0.78 0.14 3.97 0.00 -1.01 -0.83 121.76 122.20 1k7d s ALA 182 Ca 0.00 -0.08 -0.11 0.00 0.00 0.00 0.00 51.96 51.78 1k7d s ALA 182 Cb -0.09 0.54 0.00 0.00 0.00 0.00 0.00 23.12 23.57 1k7d s ALA 182 CO 0.02 -0.55 0.30 0.16 0.00 0.00 0.00 175.76 175.69 1k7d s ASP 183 N -2.56 -0.00 0.52 0.00 1.47 -0.75 -0.38 116.67 114.96 1k7d s ASP 183 Ca 0.01 -0.71 0.35 0.00 1.18 0.00 0.00 52.55 53.38 1k7d s ASP 183 Cb 0.02 0.43 1.50 0.00 -0.34 0.00 0.00 42.92 44.52 1k7d s ASP 183 CO -0.09 -0.86 1.77 -0.37 0.68 0.00 0.00 175.17 176.29 1k7d h VAL 184 N 2.54 0.37 0.00 2.11 -1.51 -1.65 0.60 116.25 118.71 1k7d h VAL 184 Ca -0.32 -0.02 0.00 0.00 -1.23 0.00 0.00 66.70 65.13 1k7d h VAL 184 Cb 1.23 0.30 0.00 0.00 -2.13 0.00 0.00 31.29 30.69 1k7d h VAL 184 CO 0.49 0.01 -0.06 0.59 -1.23 0.00 0.00 177.57 177.37 1k7d n ASN 185 N -4.25 0.62 0.00 4.19 3.02 -1.26 -4.33 115.26 113.25 1k7d n ASN 185 Ca 0.28 0.50 0.00 0.00 -0.03 0.00 0.00 54.58 55.34 1k7d n ASN 185 Cb 1.28 -0.63 0.00 0.00 -0.61 0.00 0.00 39.78 39.82 1k7d n ASN 185 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k7d n GLY 186 N 1.36 0.67 3.78 7.41 0.00 0.20 -4.95 105.19 113.66 1k7d n GLY 186 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1k7d n GLY 186 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1k7d s ASN 187 N -2.37 6.50 0.08 1.61 0.01 -1.26 -3.08 114.94 116.43 1k7d s ASN 187 Ca 0.00 2.16 0.02 0.00 -0.71 0.00 0.00 52.86 54.34 1k7d s ASN 187 Cb 0.00 -2.59 -0.03 0.00 0.41 0.00 0.00 41.25 39.03 1k7d s ASN 187 CO 0.00 -0.68 -0.08 0.27 -1.51 0.00 0.00 177.10 175.10 1k7d s ILE 188 N -1.61 0.72 0.21 0.60 -4.36 -1.26 -1.81 121.20 113.69 1k7d s ILE 188 Ca 0.60 -1.56 -0.22 0.00 -0.26 0.00 0.00 60.65 59.21 1k7d s ILE 188 Cb -0.25 -1.23 0.05 0.00 1.25 0.00 0.00 42.46 42.28 1k7d s ILE 188 CO 0.31 -0.62 0.66 -0.83 0.24 0.00 0.00 174.94 174.70 1k7d s GLY 189 N -2.38 -0.38 -0.08 6.27 0.00 -0.01 -0.89 107.32 109.85 1k7d s GLY 189 Ca 0.03 0.14 -0.11 0.00 0.00 0.00 0.00 44.72 44.78 1k7d s GLY 189 CO -0.02 0.05 0.28 -0.47 0.00 0.00 0.00 173.10 172.94 1k7d s TYR 190 N -3.81 -0.26 -0.11 1.90 5.04 -0.69 0.34 117.35 119.75 1k7d s TYR 190 Ca 0.06 0.59 -0.05 0.00 -2.44 0.00 0.00 57.07 55.22 1k7d s TYR 190 Cb -0.03 0.09 0.05 0.00 0.35 0.00 0.00 41.96 42.42 1k7d s TYR 190 CO -0.04 -0.21 0.26 0.08 -1.34 0.00 0.00 175.55 174.30 1k7d s VAL 191 N -0.29 -0.10 -1.02 3.14 1.01 -0.70 -1.73 120.40 120.70 1k7d s VAL 191 Ca -0.04 0.16 -0.18 0.00 0.00 0.00 0.00 61.98 61.92 1k7d s VAL 191 Cb -0.03 -0.41 0.13 0.00 0.00 0.00 0.00 36.38 36.06 1k7d s VAL 191 CO 0.01 0.07 1.27 -2.28 0.00 0.00 0.00 175.10 174.17 1k7d s HIS 192 N 1.46 3.11 1.01 5.22 2.46 -0.23 -0.80 115.29 127.52 1k7d s HIS 192 Ca -0.08 -1.49 -0.14 0.00 0.47 0.00 0.00 55.06 53.82 1k7d s HIS 192 Cb -0.10 -4.37 0.19 0.00 -0.13 0.00 0.00 32.58 28.17 1k7d s HIS 192 CO -0.09 -1.55 1.14 0.95 -2.47 0.00 0.00 174.74 172.72 1k7d s THR 193 N 2.83 1.91 0.00 0.89 -4.23 0.10 -4.35 115.64 112.78 1k7d s THR 193 Ca 0.38 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.89 1k7d s THR 193 Cb -0.03 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.16 1k7d s THR 193 CO -0.07 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.62 1k7d n GLY 194 N -1.77 3.43 3.74 3.99 0.00 -0.93 -2.93 105.19 110.72 1k7d n GLY 194 Ca 0.08 -1.77 -0.40 0.00 0.00 0.00 0.00 46.02 43.93 1k7d n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k7d s ALA 195 N -2.19 3.33 -0.02 4.61 0.00 -0.03 -4.93 121.76 122.53 1k7d s ALA 195 Ca 0.00 0.34 0.04 0.00 0.00 0.00 0.00 51.96 52.34 1k7d s ALA 195 Cb 0.00 -3.07 -0.01 0.00 0.00 0.00 0.00 23.12 20.04 1k7d s ALA 195 CO 0.00 0.01 -0.12 0.71 0.00 0.00 0.00 175.76 176.36 1k7d s TYR 196 N 0.12 1.13 0.48 0.00 2.02 -1.26 -4.65 117.35 115.20 1k7d s TYR 196 Ca 0.41 -0.24 -0.23 0.00 -0.37 0.00 0.00 57.07 56.64 1k7d s TYR 196 Cb -0.21 -0.75 -0.07 0.00 -0.40 0.00 0.00 41.96 40.54 1k7d s TYR 196 CO 0.24 -0.05 1.26 -1.25 -1.57 0.00 0.00 175.55 174.19 1k7d s PRO 197 N -0.16 3.56 -0.74 -1.71 0.04 -1.26 -1.04 135.00 133.68 1k7d s PRO 197 Ca 0.02 2.02 -0.15 0.00 0.04 0.00 0.00 61.00 62.93 1k7d s PRO 197 Cb -0.06 -2.41 0.18 0.00 0.04 0.00 0.00 34.50 32.25 1k7d s PRO 197 CO -0.00 -0.79 0.71 0.34 0.04 0.00 0.00 177.00 177.30 1k7d s ASP 198 N -1.10 6.57 0.53 6.66 2.15 -0.20 -4.56 116.67 126.72 1k7d s ASP 198 Ca 0.65 -2.34 -0.11 0.00 0.43 0.00 0.00 52.55 51.18 1k7d s ASP 198 Cb -0.35 -2.23 -0.05 0.00 -0.30 0.00 0.00 42.92 40.00 1k7d s ASP 198 CO 0.42 -0.71 0.93 -0.13 -0.17 0.00 0.00 175.17 175.51 1k7d s ARG 199 N 0.83 3.69 0.79 4.34 0.52 -1.26 -1.49 118.95 126.37 1k7d s ARG 199 Ca 0.14 0.64 -0.13 0.00 -0.52 0.00 0.00 55.73 55.87 1k7d s ARG 199 Cb -0.16 -2.20 0.08 0.00 0.52 0.00 0.00 34.95 33.19 1k7d s ARG 199 CO -0.05 -0.35 1.17 -0.65 0.02 0.00 0.00 175.30 175.44 1k7d s GLN 200 N -4.64 1.81 0.26 3.54 -1.52 -1.26 -4.83 119.66 113.01 1k7d s GLN 200 Ca 0.54 1.59 -0.30 0.00 -1.95 0.00 0.00 55.36 55.24 1k7d s GLN 200 Cb -0.10 -1.81 -0.11 0.00 -0.22 0.00 0.00 33.01 30.77 1k7d s GLN 200 CO 0.44 -2.05 1.51 0.45 -0.25 0.00 0.00 175.29 175.38 1k7d s SER 201 N -2.46 6.55 0.00 5.90 0.15 -1.26 -2.42 113.70 120.16 1k7d s SER 201 Ca 0.70 2.76 0.00 0.00 0.70 0.00 0.00 55.95 60.11 1k7d s SER 201 Cb -0.25 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.44 1k7d s SER 201 CO 0.51 -0.79 0.00 0.61 1.20 0.00 0.00 173.24 174.77 1k7d n GLY 202 N 2.35 0.64 3.60 9.45 0.00 -1.26 -5.03 105.19 114.94 1k7d n GLY 202 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1k7d n GLY 202 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1k7d s HIS 203 N -2.33 2.70 -0.52 1.61 5.04 -1.01 -4.97 115.29 115.80 1k7d s HIS 203 Ca 0.00 0.69 -0.26 0.00 -1.54 0.00 0.00 55.06 53.95 1k7d s HIS 203 Cb 0.00 -4.42 0.03 0.00 0.04 0.00 0.00 32.58 28.24 1k7d s HIS 203 CO 0.00 -1.47 1.02 0.34 -2.34 0.00 0.00 174.74 172.29 1k7d s ASP 204 N 2.88 6.46 0.00 9.88 -1.08 -1.26 -4.93 116.67 128.61 1k7d s ASP 204 Ca 0.51 0.02 0.02 0.00 -0.52 0.00 0.00 52.55 52.59 1k7d s ASP 204 Cb -0.09 -2.48 0.12 0.00 -1.46 0.00 0.00 42.92 39.01 1k7d s ASP 204 CO 0.32 -1.23 1.06 -0.81 0.52 0.00 0.00 175.17 175.03 1k7d n PRO 205 N 7.65 0.98 0.00 4.34 -0.04 -1.26 -2.30 135.00 144.37 1k7d n PRO 205 Ca 0.06 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.64 1k7d n PRO 205 Cb 0.48 -1.03 0.25 0.00 -0.04 0.00 0.00 33.50 33.16 1k7d n PRO 205 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1k7d n ARG 206 N -0.53 0.57 -4.11 0.54 1.74 -1.26 -4.75 116.66 108.86 1k7d n ARG 206 Ca 0.02 -0.37 -0.15 0.00 -0.77 0.00 0.00 57.85 56.57 1k7d n ARG 206 Cb 0.01 -1.49 -0.11 0.00 -1.02 0.00 0.00 32.46 29.84 1k7d n ARG 206 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1k7d s LEU 207 N -2.68 2.28 0.90 0.55 1.43 -0.97 -5.04 118.68 115.15 1k7d s LEU 207 Ca 0.18 -0.61 -0.10 0.00 -1.03 0.00 0.00 54.13 52.58 1k7d s LEU 207 Cb 0.18 -0.30 0.14 0.00 0.03 0.00 0.00 46.19 46.25 1k7d s LEU 207 CO 0.61 -0.17 1.14 -2.84 0.23 0.00 0.00 176.35 175.32 1k7d s PRO 208 N -1.80 1.11 0.08 1.29 0.02 -1.26 -4.81 135.00 129.63 1k7d s PRO 208 Ca -0.05 1.53 0.04 0.00 0.02 0.00 0.00 61.00 62.54 1k7d s PRO 208 Cb -0.09 -1.74 -0.03 0.00 0.02 0.00 0.00 34.50 32.66 1k7d s PRO 208 CO 0.01 -2.56 -0.12 0.14 -0.33 0.00 0.00 177.00 174.14 1k7d s VAL 209 N -2.67 0.99 0.54 3.83 -7.23 -0.42 -4.99 120.40 110.46 1k7d s VAL 209 Ca 0.66 -1.45 -0.22 0.00 -1.81 0.00 0.00 61.98 59.17 1k7d s VAL 209 Cb -0.22 -1.17 -0.06 0.00 0.56 0.00 0.00 36.38 35.49 1k7d s VAL 209 CO 0.58 -0.40 1.25 -2.65 -0.31 0.00 0.00 175.10 173.56 1k7d n PRO 210 N 0.94 1.51 -0.18 4.82 -0.02 -1.26 -0.98 135.00 139.83 1k7d n PRO 210 Ca -0.19 0.56 0.12 0.00 -2.02 0.00 0.00 63.50 61.97 1k7d n PRO 210 Cb 0.56 -2.44 0.24 0.00 -0.02 0.00 0.00 33.50 31.85 1k7d n PRO 210 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1k7d n GLY 211 N 0.90 1.54 0.01 -1.23 0.00 -0.17 -4.42 105.19 101.82 1k7d n GLY 211 Ca 0.11 -0.69 0.10 0.00 0.00 0.00 0.00 46.02 45.54 1k7d n GLY 211 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1k7d n THR 212 N 1.32 0.62 0.00 2.61 -2.24 -1.26 -4.71 114.28 110.62 1k7d n THR 212 Ca 0.19 0.14 0.00 0.00 -2.27 0.00 0.00 64.05 62.11 1k7d n THR 212 Cb 0.56 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.97 1k7d n THR 212 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k7d n GLY 213 N 0.58 4.18 0.29 3.38 0.00 -1.26 0.53 105.19 112.89 1k7d n GLY 213 Ca 0.05 -0.84 0.18 0.00 0.00 0.00 0.00 46.02 45.41 1k7d n GLY 213 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k7d h LYS 214 N 0.00 0.00 -0.50 1.61 1.79 -1.90 -2.27 116.57 115.30 1k7d h LYS 214 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1k7d h LYS 214 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1k7d h LYS 214 CO 0.00 0.03 0.00 0.91 -1.08 0.00 0.00 179.45 179.31 1k7d n TRP 215 N -3.16 0.66 -1.77 -1.35 7.02 -1.26 -4.97 117.44 112.60 1k7d n TRP 215 Ca -0.01 -0.38 -0.40 0.00 -1.02 0.00 0.00 57.50 55.70 1k7d n TRP 215 Cb 0.24 -0.00 0.02 0.00 -2.42 0.00 0.00 31.31 29.14 1k7d n TRP 215 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1k7d s ASP 216 N -1.19 5.91 0.40 -0.99 1.11 -0.86 -4.75 116.67 116.31 1k7d s ASP 216 Ca 0.39 2.97 -0.24 0.00 0.18 0.00 0.00 52.55 55.86 1k7d s ASP 216 Cb 0.21 -2.66 -0.12 0.00 1.07 0.00 0.00 42.92 41.42 1k7d s ASP 216 CO 0.29 -1.16 0.71 0.79 1.18 0.00 0.00 175.17 176.98 1k7d n TRP 217 N -0.11 0.11 0.14 4.23 8.01 -1.26 -4.56 117.44 123.99 1k7d n TRP 217 Ca 0.04 0.62 0.02 0.00 -1.31 0.00 0.00 57.50 56.87 1k7d n TRP 217 Cb 0.41 -2.07 0.10 0.00 -2.01 0.00 0.00 31.31 27.74 1k7d n TRP 217 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.69 177.55 1k7d h LYS 218 N 1.09 0.00 0.00 -0.99 1.57 -1.59 -3.49 116.57 113.16 1k7d h LYS 218 Ca -0.41 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.37 1k7d h LYS 218 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.69 1k7d h LYS 218 CO 0.54 0.53 0.00 0.41 -0.57 0.00 0.00 179.45 180.36 1k7d n GLY 219 N 0.93 -0.50 3.60 3.86 0.00 -1.25 -5.02 105.19 106.81 1k7d n GLY 219 Ca 0.01 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.82 1k7d n GLY 219 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k7d s LEU 220 N 0.00 3.12 0.41 0.99 1.43 -1.26 -1.04 118.68 122.34 1k7d s LEU 220 Ca 0.00 -0.32 -0.24 0.00 -1.03 0.00 0.00 54.13 52.54 1k7d s LEU 220 Cb 0.00 -1.89 -0.08 0.00 0.03 0.00 0.00 46.19 44.25 1k7d s LEU 220 CO 0.00 0.19 1.13 -0.76 0.23 0.00 0.00 176.35 177.14 1k7d s LEU 221 N -2.10 4.13 0.65 1.79 1.43 -0.21 -4.73 118.68 119.65 1k7d s LEU 221 Ca 0.21 2.24 -0.14 0.00 -1.03 0.00 0.00 54.13 55.42 1k7d s LEU 221 Cb -0.11 -4.12 -0.01 0.00 0.03 0.00 0.00 46.19 41.98 1k7d s LEU 221 CO 0.13 -0.68 1.07 -2.16 0.23 0.00 0.00 176.35 174.95 1k7d s PRO 222 N -2.45 2.99 0.60 1.29 0.04 -1.26 -4.72 135.00 131.49 1k7d s PRO 222 Ca 0.59 1.19 0.28 0.00 0.04 0.00 0.00 61.00 63.11 1k7d s PRO 222 Cb -0.28 -1.99 1.42 0.00 0.04 0.00 0.00 34.50 33.70 1k7d s PRO 222 CO 0.34 -1.08 1.83 0.35 0.04 0.00 0.00 177.00 178.48 1k7d h PHE 223 N -0.08 0.00 -0.04 0.56 3.57 -1.95 0.81 116.94 119.81 1k7d h PHE 223 Ca -0.46 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.05 1k7d h PHE 223 Cb 1.23 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.96 1k7d h PHE 223 CO 0.58 0.00 0.03 1.49 -2.23 0.00 0.00 178.31 178.19 1k7d h GLU 224 N 0.00 0.00 0.00 1.11 4.57 -2.03 -1.72 114.58 116.51 1k7d h GLU 224 Ca 0.22 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 58.25 1k7d h GLU 224 Cb 1.32 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.88 1k7d h GLU 224 CO -0.00 0.00 -0.80 0.52 -1.18 0.00 0.00 179.01 177.55 1k7d h MET 225 N 0.00 0.00 -6.43 1.92 2.86 -1.19 -3.45 114.93 108.64 1k7d h MET 225 Ca 0.02 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.13 1k7d h MET 225 Cb 0.09 0.00 0.03 0.00 0.06 0.00 0.00 31.60 31.78 1k7d h MET 225 CO -0.00 0.64 1.18 0.09 1.06 0.00 0.00 176.91 179.88 1k7d n ASN 226 N -3.22 4.11 -4.67 1.22 4.13 -0.65 -4.92 115.26 111.26 1k7d n ASN 226 Ca -0.01 0.94 -0.45 0.00 1.68 0.00 0.00 54.58 56.75 1k7d n ASN 226 Cb 0.82 -1.53 -0.02 0.00 -1.54 0.00 0.00 39.78 37.51 1k7d n ASN 226 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 1k7d n PRO 227 N 6.65 1.97 -3.47 3.52 -0.02 -1.26 -4.81 135.00 137.58 1k7d n PRO 227 Ca 0.19 0.70 -0.13 0.00 -2.02 0.00 0.00 63.50 62.25 1k7d n PRO 227 Cb 0.39 -2.33 -0.03 0.00 -0.02 0.00 0.00 33.50 31.51 1k7d n PRO 227 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1k7d s LYS 228 N -0.68 1.21 -0.17 -0.52 -2.85 -1.26 -1.06 119.74 114.41 1k7d s LYS 228 Ca 0.66 -0.40 -0.18 0.00 -1.00 0.00 0.00 55.97 55.05 1k7d s LYS 228 Cb -0.65 0.56 0.05 0.00 -2.06 0.00 0.00 37.83 35.72 1k7d s LYS 228 CO 0.52 -0.50 0.49 0.54 0.10 0.00 0.00 175.35 176.50 1k7d s VAL 229 N -3.36 0.00 -0.15 1.79 0.11 -0.71 -5.00 120.40 113.09 1k7d s VAL 229 Ca -0.01 -0.03 0.02 0.00 -2.93 0.00 0.00 61.98 59.03 1k7d s VAL 229 Cb -0.01 -0.70 0.02 0.00 -1.53 0.00 0.00 36.38 34.16 1k7d s VAL 229 CO -0.09 -0.02 -0.19 -0.47 -3.33 0.00 0.00 175.10 171.00 1k7d s TYR 230 N 0.09 2.47 -0.89 1.54 5.04 -1.26 -1.71 117.35 122.63 1k7d s TYR 230 Ca -0.01 -1.32 -0.06 0.00 -2.44 0.00 0.00 57.07 53.24 1k7d s TYR 230 Cb -0.03 -1.72 -0.01 0.00 0.35 0.00 0.00 41.96 40.54 1k7d s TYR 230 CO 0.01 -0.65 0.72 0.09 -1.34 0.00 0.00 175.55 174.39 1k7d n ASN 231 N 4.36 -6.34 -4.76 4.32 3.02 -0.06 -4.92 115.26 110.88 1k7d n ASN 231 Ca -0.19 -0.59 -0.37 0.00 -0.03 0.00 0.00 54.58 53.39 1k7d n ASN 231 Cb 0.51 -3.89 0.03 0.00 -0.61 0.00 0.00 39.78 35.82 1k7d n ASN 231 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1k7d s PRO 232 N -4.37 3.19 0.34 3.52 0.04 -1.26 -4.89 135.00 131.58 1k7d s PRO 232 Ca 0.16 1.93 0.12 0.00 0.04 0.00 0.00 61.00 63.25 1k7d s PRO 232 Cb -0.05 -2.13 0.95 0.00 0.04 0.00 0.00 34.50 33.31 1k7d s PRO 232 CO 0.81 -1.05 1.74 1.96 0.04 0.00 0.00 177.00 180.50 1k7d h GLN 233 N 1.31 0.52 0.00 4.56 4.20 -1.95 -1.03 115.11 122.72 1k7d h GLN 233 Ca -0.50 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.16 1k7d h GLN 233 Cb 1.29 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.95 1k7d h GLN 233 CO 0.57 0.34 -0.05 0.66 -0.67 0.00 0.00 178.83 179.68 1k7d h SER 234 N 0.53 0.00 0.00 1.46 4.64 -2.03 -3.46 113.55 114.69 1k7d h SER 234 Ca 0.63 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.95 1k7d h SER 234 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1k7d h SER 234 CO -0.42 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.20 1k7d n GLY 235 N -1.05 0.49 3.43 -0.77 0.00 -0.39 -4.96 105.19 101.92 1k7d n GLY 235 Ca -0.02 -0.35 -0.12 0.00 0.00 0.00 0.00 46.02 45.53 1k7d n GLY 235 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1k7d s TYR 236 N -2.00 -0.47 -0.12 1.61 -0.85 -1.26 -1.66 117.35 112.59 1k7d s TYR 236 Ca 0.00 0.23 -0.02 0.00 -0.52 0.00 0.00 57.07 56.77 1k7d s TYR 236 Cb 0.00 0.52 0.04 0.00 0.38 0.00 0.00 41.96 42.90 1k7d s TYR 236 CO 0.00 -0.85 0.00 0.42 -1.52 0.00 0.00 175.55 173.60 1k7d s ILE 237 N -3.77 0.51 -0.03 -3.49 1.01 -0.30 -4.87 121.20 110.27 1k7d s ILE 237 Ca 0.02 -0.17 0.05 0.00 0.00 0.00 0.00 60.65 60.55 1k7d s ILE 237 Cb -0.01 -0.77 -0.01 0.00 0.01 0.00 0.00 42.46 41.68 1k7d s ILE 237 CO -0.12 0.11 -0.18 0.00 0.00 0.00 0.00 174.94 174.75 1k7d s ALA 238 N 1.90 1.55 -0.05 9.38 0.00 -1.26 -0.29 121.76 132.98 1k7d s ALA 238 Ca 0.03 -0.75 -0.09 0.00 0.00 0.00 0.00 51.96 51.14 1k7d s ALA 238 Cb -0.14 -0.45 0.02 0.00 0.00 0.00 0.00 23.12 22.55 1k7d s ALA 238 CO -0.07 0.33 0.23 1.21 0.00 0.00 0.00 175.76 177.47 1k7d s ASN 239 N -0.21 -0.17 -0.32 0.00 3.84 -0.67 -5.03 114.94 112.37 1k7d s ASN 239 Ca 0.02 0.24 0.17 0.00 0.21 0.00 0.00 52.86 53.50 1k7d s ASN 239 Cb -0.09 0.39 0.45 0.00 -0.55 0.00 0.00 41.25 41.45 1k7d s ASN 239 CO 0.01 -0.23 1.08 1.87 -2.79 0.00 0.00 177.10 177.04 1k7d n TRP 240 N 2.24 0.38 -1.19 0.43 -0.00 -1.26 -1.93 117.44 116.11 1k7d n TRP 240 Ca -0.17 -2.46 -0.07 0.00 -0.00 0.00 0.00 57.50 54.81 1k7d n TRP 240 Cb 0.57 0.09 -0.03 0.00 -0.00 0.00 0.00 31.31 31.95 1k7d n TRP 240 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1k7d n ASN 241 N -0.34 -3.92 -4.42 5.87 5.03 -1.23 -4.74 115.26 111.50 1k7d n ASN 241 Ca 0.05 0.16 -0.27 0.00 0.87 0.00 0.00 54.58 55.39 1k7d n ASN 241 Cb 0.82 -2.00 0.14 0.00 -1.02 0.00 0.00 39.78 37.73 1k7d n ASN 241 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1k7d s ASN 242 N -2.81 3.74 0.29 6.41 4.22 -1.26 -4.94 114.94 120.59 1k7d s ASN 242 Ca 0.00 0.11 -0.29 0.00 -2.14 0.00 0.00 52.86 50.54 1k7d s ASN 242 Cb 0.00 -0.34 -0.10 0.00 1.28 0.00 0.00 41.25 42.08 1k7d s ASN 242 CO 0.00 -2.30 1.45 -0.55 -2.04 0.00 0.00 177.10 173.66 1k7d s SER 243 N -4.79 6.57 0.23 3.54 0.15 -1.26 -4.93 113.70 113.20 1k7d s SER 243 Ca 0.70 2.79 -0.05 0.00 0.70 0.00 0.00 55.95 60.09 1k7d s SER 243 Cb -0.05 -2.64 0.23 0.00 -1.71 0.00 0.00 66.02 61.85 1k7d s SER 243 CO 0.49 -0.74 1.72 -0.65 1.20 0.00 0.00 173.24 175.26 1k7d h PRO 244 N 4.38 0.91 -2.29 5.44 0.11 -1.91 -3.48 132.00 135.16 1k7d h PRO 244 Ca -0.47 -0.26 0.01 0.00 0.11 0.00 0.00 66.00 65.39 1k7d h PRO 244 Cb 1.22 -0.10 -0.17 0.00 0.11 0.00 0.00 31.00 32.07 1k7d h PRO 244 CO 0.74 0.90 0.33 -1.14 -0.21 0.00 0.00 178.00 178.61 1k7d s GLN 245 N -5.02 0.99 0.02 1.05 0.74 -1.26 -5.00 119.66 111.18 1k7d s GLN 245 Ca -0.10 -0.11 -0.33 0.00 0.05 0.00 0.00 55.36 54.86 1k7d s GLN 245 Cb 0.14 0.46 -0.12 0.00 1.10 0.00 0.00 33.01 34.59 1k7d s GLN 245 CO 0.83 -0.38 1.79 1.17 -0.55 0.00 0.00 175.29 178.15 1k7d n LYS 246 N 0.22 2.29 -1.21 1.67 0.00 -1.26 -1.11 118.16 118.76 1k7d n LYS 246 Ca -0.15 0.83 -0.07 0.00 0.00 0.00 0.00 58.31 58.93 1k7d n LYS 246 Cb 0.61 -2.67 -0.03 0.00 0.00 0.00 0.00 35.03 32.94 1k7d n LYS 246 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1k7d n ASP 247 N 5.57 -3.88 -4.72 3.14 8.00 -1.26 -5.01 116.55 118.39 1k7d n ASP 247 Ca 0.20 0.18 -0.38 0.00 0.71 0.00 0.00 54.79 55.50 1k7d n ASP 247 Cb 0.31 -2.02 -0.06 0.00 -0.02 0.00 0.00 41.12 39.33 1k7d n ASP 247 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1k7d s TYR 248 N -2.27 3.52 0.25 1.24 6.14 -0.26 -5.05 117.35 120.92 1k7d s TYR 248 Ca 0.00 0.95 -0.24 0.00 0.64 0.00 0.00 57.07 58.41 1k7d s TYR 248 Cb 0.00 -2.60 -0.09 0.00 0.42 0.00 0.00 41.96 39.70 1k7d s TYR 248 CO 0.00 0.15 0.84 -1.25 0.64 0.00 0.00 175.55 175.93 1k7d s PRO 249 N 0.68 4.52 0.64 4.97 0.04 -1.26 -4.90 135.00 139.68 1k7d s PRO 249 Ca 0.28 1.17 -0.06 0.00 0.04 0.00 0.00 61.00 62.43 1k7d s PRO 249 Cb -0.16 -2.99 0.03 0.00 0.04 0.00 0.00 34.50 31.43 1k7d s PRO 249 CO 0.11 0.41 0.95 0.00 0.04 0.00 0.00 177.00 178.52 1k7d s ALA 250 N -1.42 3.26 0.45 8.56 0.00 -1.26 -4.25 121.76 127.09 1k7d s ALA 250 Ca 0.43 -0.82 -0.16 0.00 0.00 0.00 0.00 51.96 51.42 1k7d s ALA 250 Cb -0.20 -2.59 -0.13 0.00 0.00 0.00 0.00 23.12 20.20 1k7d s ALA 250 CO 0.25 -1.03 -0.13 0.45 0.00 0.00 0.00 175.76 175.30 1k7d n SER 251 N -2.73 -3.26 -0.08 0.00 2.88 -0.10 -4.14 113.62 106.20 1k7d n SER 251 Ca 0.06 0.56 0.15 0.00 -1.33 0.00 0.00 58.87 58.32 1k7d n SER 251 Cb 0.59 -0.74 0.82 0.00 -0.75 0.00 0.00 64.21 64.13 1k7d n SER 251 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1k7d n ASP 252 N 2.21 0.28 -4.66 -3.46 5.68 -1.26 -4.88 116.55 110.45 1k7d n ASP 252 Ca 0.07 -0.91 -0.50 0.00 -0.50 0.00 0.00 54.79 52.95 1k7d n ASP 252 Cb 0.41 -0.05 -0.05 0.00 -1.14 0.00 0.00 41.12 40.29 1k7d n ASP 252 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1k7d n LEU 253 N -0.86 2.78 0.27 -2.12 4.77 -1.26 -4.85 117.00 115.72 1k7d n LEU 253 Ca 0.21 1.06 0.12 0.00 -0.03 0.00 0.00 56.01 57.37 1k7d n LEU 253 Cb 0.18 -1.31 0.75 0.00 -2.33 0.00 0.00 43.42 40.71 1k7d n LEU 253 CO 0.19 -0.40 1.01 2.19 -1.33 0.00 0.00 177.39 179.05 1k7d h PHE 254 N 6.79 0.00 -0.24 -1.77 -5.15 -1.99 0.38 116.94 114.97 1k7d h PHE 254 Ca -0.47 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.30 1k7d h PHE 254 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.46 1k7d h PHE 254 CO 0.72 0.09 0.00 0.00 -2.00 0.00 0.00 178.31 177.12 1k7d n ALA 255 N -2.33 2.47 -3.83 12.09 0.00 -1.26 -4.83 120.51 122.82 1k7d n ALA 255 Ca -0.02 -0.45 -0.29 0.00 0.00 0.00 0.00 53.44 52.68 1k7d n ALA 255 Cb 0.19 -1.01 -0.17 0.00 0.00 0.00 0.00 19.45 18.46 1k7d n ALA 255 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1k7d s PHE 256 N -1.68 1.98 0.04 0.00 2.19 0.13 -4.56 117.98 116.07 1k7d s PHE 256 Ca 0.20 -1.01 0.02 0.00 0.33 0.00 0.00 56.93 56.47 1k7d s PHE 256 Cb 0.10 -1.46 -0.02 0.00 -1.31 0.00 0.00 43.02 40.33 1k7d s PHE 256 CO 0.14 -0.55 -0.08 -0.51 1.83 0.00 0.00 175.22 176.05 1k7d s LEU 257 N 1.27 2.25 -0.34 6.12 1.43 -1.26 -4.74 118.68 123.41 1k7d s LEU 257 Ca -0.01 -0.54 -0.05 0.00 -1.03 0.00 0.00 54.13 52.51 1k7d s LEU 257 Cb -0.14 -0.17 0.06 0.00 0.03 0.00 0.00 46.19 45.97 1k7d s LEU 257 CO -0.06 -0.19 0.09 0.26 0.23 0.00 0.00 176.35 176.68 1k7d s TRP 258 N -1.34 3.31 0.00 0.29 0.51 -1.26 -5.02 118.94 115.43 1k7d s TRP 258 Ca -0.10 -1.72 0.00 0.00 -2.12 0.00 0.00 56.10 52.17 1k7d s TRP 258 Cb -0.10 -2.39 0.00 0.00 -0.81 0.00 0.00 33.47 30.17 1k7d s TRP 258 CO 0.00 -0.80 0.00 0.41 -0.51 0.00 0.00 176.95 176.06 1k7d n GLY 259 N 4.72 4.42 0.39 0.98 0.00 -1.26 -5.02 105.19 109.42 1k7d n GLY 259 Ca -0.11 -1.63 0.17 0.00 0.00 0.00 0.00 46.02 44.44 1k7d n GLY 259 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1k7d h GLY 260 N 0.00 1.17 -7.30 -0.02 0.00 -1.98 -3.37 103.07 91.58 1k7d h GLY 260 Ca 0.00 -0.25 -0.67 0.00 0.00 0.00 0.00 47.33 46.42 1k7d h GLY 260 CO 0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 176.54 176.38 1k7d s ALA 261 N -5.57 3.45 -0.17 3.60 0.00 -1.26 -5.02 121.76 116.79 1k7d s ALA 261 Ca -0.09 -1.24 -0.11 0.00 0.00 0.00 0.00 51.96 50.52 1k7d s ALA 261 Cb 0.23 -3.00 0.05 0.00 0.00 0.00 0.00 23.12 20.41 1k7d s ALA 261 CO 0.79 -1.34 0.41 0.34 0.00 0.00 0.00 175.76 175.96 1k7d s ASP 262 N 1.79 -0.49 0.51 0.00 -1.08 -1.26 -4.94 116.67 111.20 1k7d s ASP 262 Ca 0.15 0.88 0.35 0.00 -0.52 0.00 0.00 52.55 53.40 1k7d s ASP 262 Cb -0.16 0.80 1.86 0.00 -1.46 0.00 0.00 42.92 43.96 1k7d s ASP 262 CO 0.13 -0.18 2.06 0.08 0.52 0.00 0.00 175.17 177.78 1k7d h ARG 263 N 6.64 0.00 0.00 4.34 0.11 -1.93 -2.21 114.38 121.33 1k7d h ARG 263 Ca -0.34 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.71 1k7d h ARG 263 Cb 1.18 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.26 1k7d h ARG 263 CO 0.28 0.00 -0.16 -0.24 0.10 0.00 0.00 179.97 179.95 1k7d h VAL 264 N 0.00 0.71 -0.18 0.08 3.04 -1.96 -2.27 116.25 115.67 1k7d h VAL 264 Ca 0.00 -0.67 0.05 0.00 -1.01 0.00 0.00 66.70 65.08 1k7d h VAL 264 Cb 0.02 1.41 -0.01 0.00 -2.01 0.00 0.00 31.29 30.71 1k7d h VAL 264 CO 0.00 0.16 0.16 0.74 -1.01 0.00 0.00 177.57 177.62 1k7d h THR 265 N 0.00 0.66 -0.33 3.17 2.02 -1.82 -0.58 112.91 116.03 1k7d h THR 265 Ca -0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 1k7d h THR 265 Cb 0.40 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 1k7d h THR 265 CO 0.02 0.00 -0.06 -0.33 0.37 0.00 0.00 175.52 175.52 1k7d h GLU 266 N 0.00 0.54 -0.00 6.66 4.39 -1.63 -1.88 114.58 122.66 1k7d h GLU 266 Ca 0.09 -0.14 -0.05 0.00 0.34 0.00 0.00 59.36 59.60 1k7d h GLU 266 Cb 0.41 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1k7d h GLU 266 CO -0.00 0.61 -0.20 0.82 -1.16 0.00 0.00 179.01 179.07 1k7d h ILE 267 N 0.50 1.55 -0.81 3.13 2.04 -1.29 -3.28 117.51 119.36 1k7d h ILE 267 Ca 0.10 -1.90 0.19 0.00 1.00 0.00 0.00 64.86 64.25 1k7d h ILE 267 Cb 0.42 2.75 -0.14 0.00 -0.74 0.00 0.00 36.82 39.12 1k7d h ILE 267 CO 0.02 0.52 0.08 0.44 0.00 0.00 0.00 178.15 179.21 1k7d h ASP 268 N -0.53 -0.24 -0.32 1.72 3.32 -1.28 -1.64 116.42 117.44 1k7d h ASP 268 Ca -0.02 0.20 -0.12 0.00 0.02 0.00 0.00 57.03 57.11 1k7d h ASP 268 Cb 0.96 0.33 -0.01 0.00 0.22 0.00 0.00 39.33 40.82 1k7d h ASP 268 CO 0.04 -0.18 -0.23 0.03 -1.72 0.00 0.00 179.24 177.18 1k7d h ARG 269 N 0.14 0.82 0.00 3.56 3.08 -1.41 -0.36 114.38 120.20 1k7d h ARG 269 Ca 0.46 -0.34 -0.10 0.00 0.07 0.00 0.00 59.98 60.08 1k7d h ARG 269 Cb 0.86 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 1k7d h ARG 269 CO -0.67 0.96 -0.48 -0.07 -1.07 0.00 0.00 179.97 178.64 1k7d h LEU 270 N 0.71 0.00 0.00 3.04 3.38 -1.44 -0.28 115.31 120.72 1k7d h LEU 270 Ca 0.09 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.85 1k7d h LEU 270 Cb 0.76 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.47 1k7d h LEU 270 CO 0.06 0.48 -1.07 -0.07 0.09 0.00 0.00 178.44 177.93 1k7d h LEU 271 N 0.00 0.00 0.00 1.67 3.38 -0.95 -3.28 115.31 116.13 1k7d h LEU 271 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1k7d h LEU 271 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 1k7d h LEU 271 CO 0.06 0.94 -0.53 -0.62 0.09 0.00 0.00 178.44 178.38 1k7d n GLU 272 N -3.28 0.20 -0.12 1.13 1.02 -0.18 -4.21 120.64 115.21 1k7d n GLU 272 Ca -0.03 0.07 -0.09 0.00 -0.02 0.00 0.00 57.16 57.09 1k7d n GLU 272 Cb 0.93 -1.64 -0.01 0.00 -0.02 0.00 0.00 31.44 30.71 1k7d n GLU 272 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 1k7d h GLN 273 N 0.00 0.52 -6.40 3.49 4.15 -1.11 -3.42 115.11 112.34 1k7d h GLN 273 Ca 0.00 -0.06 -0.68 0.00 0.77 0.00 0.00 58.65 58.68 1k7d h GLN 273 Cb 0.67 -0.10 -0.20 0.00 0.21 0.00 0.00 27.48 28.06 1k7d h GLN 273 CO 0.00 0.42 -0.75 0.15 -1.93 0.00 0.00 178.83 176.72 1k7d s LYS 274 N -5.86 2.36 0.11 1.69 1.02 -1.26 -5.06 119.74 112.74 1k7d s LYS 274 Ca -0.13 -0.81 -0.21 0.00 0.02 0.00 0.00 55.97 54.83 1k7d s LYS 274 Cb 0.10 -2.36 -0.11 0.00 -0.52 0.00 0.00 37.83 34.94 1k7d s LYS 274 CO 0.73 0.58 1.76 -1.35 -0.92 0.00 0.00 175.35 176.15 1k7d h PRO 275 N 4.70 0.12 -6.19 -1.68 0.11 -1.86 -3.44 132.00 123.76 1k7d h PRO 275 Ca -0.48 -0.01 -0.56 0.00 0.11 0.00 0.00 66.00 65.06 1k7d h PRO 275 Cb 1.16 -0.03 -0.22 0.00 0.11 0.00 0.00 31.00 32.03 1k7d h PRO 275 CO 0.51 0.08 -0.83 1.03 -0.21 0.00 0.00 178.00 178.58 1k7d s ARG 276 N -6.18 1.14 -0.03 1.05 0.52 -1.26 -4.62 118.95 109.56 1k7d s ARG 276 Ca -0.13 -1.18 0.06 0.00 -0.52 0.00 0.00 55.73 53.96 1k7d s ARG 276 Cb 0.07 -1.41 -0.01 0.00 0.52 0.00 0.00 34.95 34.12 1k7d s ARG 276 CO 0.67 0.33 -0.21 -0.51 0.02 0.00 0.00 175.30 175.60 1k7d s LEU 277 N -1.93 2.02 0.94 2.53 1.02 0.10 -4.81 118.68 118.55 1k7d s LEU 277 Ca 0.07 -0.40 -0.14 0.00 0.02 0.00 0.00 54.13 53.67 1k7d s LEU 277 Cb -0.10 -1.13 0.19 0.00 0.02 0.00 0.00 46.19 45.17 1k7d s LEU 277 CO 0.04 0.24 1.29 0.42 0.02 0.00 0.00 176.35 178.36 1k7d s THR 278 N -0.34 2.01 0.12 5.49 -4.23 -1.26 -0.14 115.64 117.29 1k7d s THR 278 Ca 0.04 -0.07 -0.14 0.00 -1.18 0.00 0.00 61.69 60.34 1k7d s THR 278 Cb -0.10 -2.94 -0.05 0.00 1.34 0.00 0.00 72.50 70.75 1k7d s THR 278 CO 0.01 0.00 1.48 0.00 -0.54 0.00 0.00 174.62 175.56 1k7d h ALA 279 N -1.52 0.50 -0.60 3.99 0.00 -1.94 -1.83 119.26 117.86 1k7d h ALA 279 Ca -0.43 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.10 1k7d h ALA 279 Cb 1.24 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1k7d h ALA 279 CO 0.38 0.45 0.34 -0.44 0.00 0.00 0.00 179.25 179.98 1k7d h ASP 280 N 0.54 0.72 0.91 0.00 3.32 -1.96 -0.36 116.42 119.59 1k7d h ASP 280 Ca 0.07 -0.05 -0.13 0.00 0.02 0.00 0.00 57.03 56.94 1k7d h ASP 280 Cb 0.76 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.11 1k7d h ASP 280 CO 0.06 0.58 -0.63 1.56 -1.72 0.00 0.00 179.24 179.09 1k7d h GLN 281 N 0.83 0.00 -0.17 3.56 4.20 -1.85 -1.87 115.11 119.81 1k7d h GLN 281 Ca 0.21 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.72 1k7d h GLN 281 Cb 0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.79 1k7d h GLN 281 CO -0.04 0.63 -0.69 0.00 -0.67 0.00 0.00 178.83 178.06 1k7d h ALA 282 N 1.37 0.46 -0.64 3.87 0.00 -0.67 -3.01 119.26 120.64 1k7d h ALA 282 Ca -0.01 -0.57 -0.08 0.00 0.00 0.00 0.00 54.91 54.25 1k7d h ALA 282 Cb 1.25 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1k7d h ALA 282 CO 0.08 0.70 0.09 2.35 0.00 0.00 0.00 179.25 182.48 1k7d h TRP 283 N 0.50 1.14 0.00 0.00 2.91 -0.99 -3.02 115.95 116.49 1k7d h TRP 283 Ca -0.03 -0.16 0.00 0.00 1.13 0.00 0.00 58.89 59.83 1k7d h TRP 283 Cb 1.29 -0.31 0.00 0.00 -0.51 0.00 0.00 29.16 29.63 1k7d h TRP 283 CO 0.07 0.97 0.00 -0.44 -1.03 0.00 0.00 178.44 178.01 1k7d h ASP 284 N 0.99 0.00 0.01 2.65 3.32 -1.21 -1.40 116.42 120.78 1k7d h ASP 284 Ca 0.19 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 1k7d h ASP 284 Cb 0.45 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.00 1k7d h ASP 284 CO 0.01 0.00 -0.00 0.58 -1.72 0.00 0.00 179.24 178.11 1k7d h VAL 285 N 0.00 0.34 0.28 -1.35 2.07 -1.43 -2.01 116.25 114.15 1k7d h VAL 285 Ca 0.00 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1k7d h VAL 285 Cb 0.20 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1k7d h VAL 285 CO 0.00 0.00 -0.13 0.40 0.02 0.00 0.00 177.57 177.86 1k7d h ILE 286 N 0.00 0.71 -0.60 4.57 2.04 -1.44 -0.61 117.51 122.18 1k7d h ILE 286 Ca -0.00 -0.73 0.09 0.00 1.00 0.00 0.00 64.86 65.22 1k7d h ILE 286 Cb 0.01 1.07 -0.07 0.00 -0.74 0.00 0.00 36.82 37.09 1k7d h ILE 286 CO 0.00 0.14 0.24 -0.09 0.00 0.00 0.00 178.15 178.43 1k7d h ARG 287 N -0.80 0.42 0.03 2.37 2.43 -1.65 0.25 114.38 117.43 1k7d h ARG 287 Ca -0.04 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1k7d h ARG 287 Cb 0.51 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1k7d h ARG 287 CO 0.06 0.27 -0.02 1.96 -1.51 0.00 0.00 179.97 180.74 1k7d h GLN 288 N 0.43 -0.04 -0.14 0.20 1.08 -1.33 -2.91 115.11 112.39 1k7d h GLN 288 Ca 0.30 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.47 1k7d h GLN 288 Cb 0.34 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.77 1k7d h GLN 288 CO -0.28 0.32 -0.07 1.79 -0.95 0.00 0.00 178.83 179.63 1k7d h THR 289 N -0.41 1.14 -0.81 -0.54 1.35 -1.00 -2.48 112.91 110.16 1k7d h THR 289 Ca -0.00 -0.57 0.14 0.00 -0.55 0.00 0.00 66.41 65.42 1k7d h THR 289 Cb 0.38 1.11 -0.06 0.00 -1.73 0.00 0.00 68.15 67.86 1k7d h THR 289 CO 0.01 0.18 0.53 0.28 -0.25 0.00 0.00 175.52 176.27 1k7d h SER 290 N 0.20 0.52 -0.01 5.36 0.02 -0.32 -3.02 113.55 116.30 1k7d h SER 290 Ca 0.04 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 1k7d h SER 290 Cb 0.26 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1k7d h SER 290 CO 0.01 0.27 -0.35 0.54 -1.14 0.00 0.00 176.83 176.17 1k7d n ARG 291 N -4.51 1.90 -2.41 3.45 1.74 -1.03 -0.97 116.66 114.84 1k7d n ARG 291 Ca 0.15 -0.64 -0.43 0.00 -0.77 0.00 0.00 57.85 56.17 1k7d n ARG 291 Cb 0.48 -1.21 -0.02 0.00 -1.02 0.00 0.00 32.46 30.69 1k7d n ARG 291 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1k7d s GLN 292 N -1.82 4.23 0.17 5.56 2.00 -0.96 -1.01 119.66 127.82 1k7d s GLN 292 Ca 0.11 1.68 -0.31 0.00 -2.00 0.00 0.00 55.36 54.85 1k7d s GLN 292 Cb 0.11 -3.77 -0.09 0.00 0.80 0.00 0.00 33.01 30.06 1k7d s GLN 292 CO 0.39 -0.71 1.40 0.34 -0.50 0.00 0.00 175.29 176.21 1k7d s ASP 293 N 2.03 6.78 0.02 6.67 -1.08 0.13 -4.91 116.67 126.32 1k7d s ASP 293 Ca 0.55 2.44 0.23 0.00 -0.52 0.00 0.00 52.55 55.26 1k7d s ASP 293 Cb -0.22 -2.60 0.10 0.00 -1.46 0.00 0.00 42.92 38.74 1k7d s ASP 293 CO 0.15 -0.65 1.09 0.18 0.52 0.00 0.00 175.17 176.47 1k7d n LEU 294 N 3.32 0.67 0.03 -1.34 4.77 -1.26 -4.20 117.00 118.99 1k7d n LEU 294 Ca 0.10 -0.13 0.04 0.00 -0.03 0.00 0.00 56.01 55.99 1k7d n LEU 294 Cb 0.42 -0.11 -0.08 0.00 -2.33 0.00 0.00 43.42 41.31 1k7d n LEU 294 CO 0.59 0.12 -0.37 0.59 -1.33 0.00 0.00 177.39 176.99 1k7d n ASN 295 N -1.73 0.62 -0.16 -1.43 3.02 -1.26 -4.49 115.26 109.84 1k7d n ASN 295 Ca 0.03 0.26 -0.03 0.00 -0.03 0.00 0.00 54.58 54.81 1k7d n ASN 295 Cb 0.38 0.66 0.06 0.00 -0.61 0.00 0.00 39.78 40.27 1k7d n ASN 295 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1k7d h LEU 296 N 0.00 0.15 -1.19 3.41 5.85 -1.99 -1.95 115.31 119.61 1k7d h LEU 296 Ca -0.12 0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.58 1k7d h LEU 296 Cb 1.37 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.45 1k7d h LEU 296 CO 0.02 0.11 -0.31 -0.09 -0.34 0.00 0.00 178.44 177.84 1k7d h ARG 297 N 0.33 0.17 0.03 1.25 2.43 -1.83 -1.23 114.38 115.53 1k7d h ARG 297 Ca 0.24 -0.06 -0.26 0.00 -0.81 0.00 0.00 59.98 59.09 1k7d h ARG 297 Cb 0.26 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 29.81 1k7d h ARG 297 CO -0.25 0.46 -1.04 -0.07 -1.51 0.00 0.00 179.97 177.56 1k7d h LEU 298 N 0.15 0.71 -0.77 3.80 3.38 -1.60 -3.38 115.31 117.61 1k7d h LEU 298 Ca 0.02 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 57.39 1k7d h LEU 298 Cb 0.62 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1k7d h LEU 298 CO 0.05 1.40 -0.11 0.49 0.09 0.00 0.00 178.44 180.36 1k7d n PHE 299 N -3.78 0.00 -0.09 1.13 3.72 -0.92 -4.71 117.46 112.81 1k7d n PHE 299 Ca -0.09 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.23 1k7d n PHE 299 Cb 0.89 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.43 1k7d n PHE 299 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1k7d h LEU 300 N 0.80 0.14 -0.68 4.37 5.85 -1.40 -1.45 115.31 122.94 1k7d h LEU 300 Ca 0.00 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.84 1k7d h LEU 300 Cb 0.22 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.20 1k7d h LEU 300 CO 0.00 0.12 0.34 -0.65 -0.34 0.00 0.00 178.44 177.90 1k7d h PRO 301 N 0.26 0.56 -0.73 5.25 0.11 -1.84 0.33 132.00 135.95 1k7d h PRO 301 Ca 0.14 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.20 1k7d h PRO 301 Cb 0.10 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.05 1k7d h PRO 301 CO -0.13 0.37 0.41 1.15 -0.21 0.00 0.00 178.00 179.59 1k7d h THR 302 N 0.58 1.22 -0.35 -1.15 2.02 -1.82 -0.51 112.91 112.90 1k7d h THR 302 Ca 0.33 -0.54 -0.07 0.00 0.77 0.00 0.00 66.41 66.91 1k7d h THR 302 Cb 0.34 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 1k7d h THR 302 CO -0.26 0.24 -0.09 -0.07 0.37 0.00 0.00 175.52 175.71 1k7d h LEU 303 N 1.00 0.56 -0.18 2.58 3.38 -0.41 -1.61 115.31 120.64 1k7d h LEU 303 Ca 0.26 -0.14 -0.23 0.00 0.09 0.00 0.00 57.88 57.86 1k7d h LEU 303 Cb 0.02 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.63 1k7d h LEU 303 CO -0.04 0.69 -0.86 1.56 0.09 0.00 0.00 178.44 179.88 1k7d h GLN 304 N 0.54 0.63 -0.52 1.13 4.20 0.16 -2.91 115.11 118.34 1k7d h GLN 304 Ca 0.10 -0.58 -0.02 0.00 0.06 0.00 0.00 58.65 58.21 1k7d h GLN 304 Cb 0.48 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 1k7d h GLN 304 CO 0.03 1.19 0.23 0.00 -0.67 0.00 0.00 178.83 179.61 1k7d h ALA 305 N 0.63 0.67 -0.33 3.87 0.00 -0.87 -0.03 119.26 123.21 1k7d h ALA 305 Ca -0.07 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 1k7d h ALA 305 Cb 1.48 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 1k7d h ALA 305 CO 0.16 0.26 -0.05 0.00 0.00 0.00 0.00 179.25 179.63 1k7d h ALA 306 N 1.07 1.30 -0.09 0.00 0.00 -1.31 -3.11 119.26 117.12 1k7d h ALA 306 Ca 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1k7d h ALA 306 Cb 0.16 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1k7d h ALA 306 CO -0.02 0.47 0.00 0.25 0.00 0.00 0.00 179.25 179.95 1k7d n THR 307 N -4.24 0.09 -0.04 0.00 -2.24 -1.10 -4.62 114.28 102.13 1k7d n THR 307 Ca 0.01 -0.55 0.12 0.00 -2.27 0.00 0.00 64.05 61.37 1k7d n THR 307 Cb 0.28 1.39 0.53 0.00 -2.10 0.00 0.00 70.33 70.44 1k7d n THR 307 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1k7d h SER 308 N 4.53 0.29 -0.60 3.42 4.64 -0.93 -2.66 113.55 122.24 1k7d h SER 308 Ca 0.00 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1k7d h SER 308 Cb 0.97 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 1k7d h SER 308 CO 0.00 0.18 0.00 0.61 -0.87 0.00 0.00 176.83 176.75 1k7d n GLY 309 N -1.54 2.51 3.86 -0.77 0.00 -1.26 -4.98 105.19 103.02 1k7d n GLY 309 Ca 0.08 -0.67 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 1k7d n GLY 309 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k7d s LEU 310 N -1.02 3.57 0.66 0.99 1.43 -1.00 -5.03 118.68 118.28 1k7d s LEU 310 Ca 0.41 1.38 -0.15 0.00 -1.03 0.00 0.00 54.13 54.73 1k7d s LEU 310 Cb 0.21 -4.33 0.00 0.00 0.03 0.00 0.00 46.19 42.11 1k7d s LEU 310 CO 0.28 -0.61 1.13 0.42 0.23 0.00 0.00 176.35 177.80 1k7d s THR 311 N -2.72 3.04 0.33 5.49 -4.23 -1.26 -4.93 115.64 111.37 1k7d s THR 311 Ca 0.55 0.50 0.10 0.00 -1.18 0.00 0.00 61.69 61.66 1k7d s THR 311 Cb -0.10 -3.04 0.36 0.00 1.34 0.00 0.00 72.50 71.06 1k7d s THR 311 CO 0.38 -0.28 1.60 -0.61 -0.54 0.00 0.00 174.62 175.17 1k7d h GLN 312 N 0.07 0.09 -0.20 3.99 -0.00 -1.98 -2.07 115.11 115.00 1k7d h GLN 312 Ca -0.47 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.17 1k7d h GLN 312 Cb 1.26 -0.02 0.00 0.00 0.00 0.00 0.00 27.48 28.72 1k7d h GLN 312 CO 0.53 0.06 0.00 -1.13 0.00 0.00 0.00 178.83 178.29 1k7d n SER 313 N -5.30 1.14 -4.68 -0.69 3.41 -1.26 -4.71 113.62 101.53 1k7d n SER 313 Ca 0.29 -1.94 -0.42 0.00 -0.26 0.00 0.00 58.87 56.53 1k7d n SER 313 Cb 0.94 -0.13 -0.03 0.00 -0.26 0.00 0.00 64.21 64.73 1k7d n SER 313 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1k7d s ASP 314 N -1.08 7.19 0.38 4.04 -1.08 -0.78 -4.92 116.67 120.41 1k7d s ASP 314 Ca 0.17 1.46 0.08 0.00 -0.52 0.00 0.00 52.55 53.75 1k7d s ASP 314 Cb 0.09 -2.54 0.74 0.00 -1.46 0.00 0.00 42.92 39.75 1k7d s ASP 314 CO 0.12 -0.47 1.90 -0.65 0.52 0.00 0.00 175.17 176.59 1k7d h PRO 315 N 7.17 0.29 -0.59 4.34 0.11 -1.90 -1.12 132.00 140.31 1k7d h PRO 315 Ca -0.29 -0.07 0.03 0.00 0.11 0.00 0.00 66.00 65.78 1k7d h PRO 315 Cb 1.13 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 1k7d h PRO 315 CO 0.87 0.41 0.39 0.00 -0.21 0.00 0.00 178.00 179.46 1k7d h ARG 316 N 0.28 0.68 -0.06 1.05 3.08 -1.91 -1.06 114.38 116.44 1k7d h ARG 316 Ca 0.06 -0.04 -0.22 0.00 0.07 0.00 0.00 59.98 59.84 1k7d h ARG 316 Cb 0.37 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 30.27 1k7d h ARG 316 CO 0.02 0.45 -0.87 -0.09 -1.07 0.00 0.00 179.97 178.41 1k7d h ARG 317 N 0.70 0.55 -0.64 0.04 2.43 -1.58 -2.62 114.38 113.26 1k7d h ARG 317 Ca 0.23 -0.52 -0.09 0.00 -0.81 0.00 0.00 59.98 58.79 1k7d h ARG 317 Cb 0.06 0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 1k7d h ARG 317 CO -0.06 1.15 0.06 1.96 -1.51 0.00 0.00 179.97 181.57 1k7d h GLN 318 N 0.35 1.09 -0.80 0.20 4.20 -0.80 -0.82 115.11 118.53 1k7d h GLN 318 Ca -0.07 -0.32 -0.04 0.00 0.06 0.00 0.00 58.65 58.28 1k7d h GLN 318 Cb 1.49 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 29.12 1k7d h GLN 318 CO 0.16 1.03 0.34 -0.07 -0.67 0.00 0.00 178.83 179.62 1k7d h LEU 319 N 1.01 1.08 -0.42 1.46 3.38 -1.12 -0.94 115.31 119.76 1k7d h LEU 319 Ca 0.19 -0.15 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 1k7d h LEU 319 Cb 0.50 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1k7d h LEU 319 CO 0.02 0.94 -0.26 0.58 0.09 0.00 0.00 178.44 179.81 1k7d h VAL 320 N 1.15 1.27 -0.72 1.22 2.07 -1.07 -2.74 116.25 117.43 1k7d h VAL 320 Ca 0.27 -1.42 -0.01 0.00 0.82 0.00 0.00 66.70 66.36 1k7d h VAL 320 Cb 0.18 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 1k7d h VAL 320 CO -0.03 0.48 0.40 -0.33 0.02 0.00 0.00 177.57 178.12 1k7d h GLU 321 N 0.75 0.99 -0.57 1.57 4.39 -0.90 -0.53 114.58 120.29 1k7d h GLU 321 Ca 0.09 -0.10 0.07 0.00 0.34 0.00 0.00 59.36 59.75 1k7d h GLU 321 Cb 0.84 -0.20 -0.06 0.00 -0.10 0.00 0.00 28.75 29.23 1k7d h GLU 321 CO 0.07 0.72 0.26 1.15 -1.16 0.00 0.00 179.01 180.05 1k7d h THR 322 N 1.00 0.88 -0.20 1.13 2.02 -0.96 -2.44 112.91 114.35 1k7d h THR 322 Ca 0.26 -0.16 -0.12 0.00 0.77 0.00 0.00 66.41 67.15 1k7d h THR 322 Cb 0.01 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 66.77 1k7d h THR 322 CO -0.04 0.09 -0.41 -0.07 0.37 0.00 0.00 175.52 175.46 1k7d h LEU 323 N 0.48 0.48 -1.58 2.58 3.38 -1.07 -3.09 115.31 116.49 1k7d h LEU 323 Ca 0.27 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1k7d h LEU 323 Cb 0.24 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1k7d h LEU 323 CO -0.22 0.84 0.04 0.74 0.09 0.00 0.00 178.44 179.92 1k7d h THR 324 N 0.38 1.12 0.00 0.22 2.02 -0.67 -1.98 112.91 113.99 1k7d h THR 324 Ca 0.03 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 66.79 1k7d h THR 324 Cb 0.88 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 1k7d h THR 324 CO 0.07 0.15 -0.09 0.54 0.37 0.00 0.00 175.52 176.56 1k7d n ARG 325 N -4.40 0.04 -3.62 6.66 1.74 -0.96 -4.88 116.66 111.24 1k7d n ARG 325 Ca 0.00 0.03 -0.38 0.00 -0.77 0.00 0.00 57.85 56.74 1k7d n ARG 325 Cb 0.16 -1.55 -0.06 0.00 -1.02 0.00 0.00 32.46 29.99 1k7d n ARG 325 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 1k7d s TRP 326 N -3.02 3.67 -0.91 -1.55 -0.00 -0.75 -4.96 118.94 111.42 1k7d s TRP 326 Ca 0.13 0.82 0.27 0.00 -0.00 0.00 0.00 56.10 57.32 1k7d s TRP 326 Cb 0.18 -2.18 0.94 0.00 -0.00 0.00 0.00 33.47 32.41 1k7d s TRP 326 CO 0.57 0.65 1.75 -0.40 -0.00 0.00 0.00 176.95 179.52 1k7d n ASP 327 N 2.00 0.32 0.00 5.86 5.68 -1.26 -4.93 116.55 124.21 1k7d n ASP 327 Ca -0.16 0.35 0.00 0.00 -0.50 0.00 0.00 54.79 54.48 1k7d n ASP 327 Cb 0.53 -0.37 0.00 0.00 -1.14 0.00 0.00 41.12 40.14 1k7d n ASP 327 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1k7d n GLY 328 N 1.45 0.75 3.45 6.12 0.00 -1.26 -4.90 105.19 110.81 1k7d n GLY 328 Ca 0.06 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 1k7d n GLY 328 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k7d s ILE 329 N -2.68 4.84 0.24 -0.61 -1.09 -1.26 0.21 121.20 120.85 1k7d s ILE 329 Ca 0.00 -0.41 -0.30 0.00 -2.23 0.00 0.00 60.65 57.71 1k7d s ILE 329 Cb 0.00 -4.31 -0.09 0.00 -1.58 0.00 0.00 42.46 36.48 1k7d s ILE 329 CO 0.00 -0.82 1.14 0.20 -1.23 0.00 0.00 174.94 174.23 1k7d s ASN 330 N 2.67 7.19 0.01 3.58 0.01 -0.18 -4.99 114.94 123.23 1k7d s ASN 330 Ca 0.16 2.26 0.02 0.00 -0.71 0.00 0.00 52.86 54.59 1k7d s ASN 330 Cb -0.18 -2.62 -0.01 0.00 0.41 0.00 0.00 41.25 38.84 1k7d s ASN 330 CO 0.13 -0.24 -0.06 -0.76 -1.51 0.00 0.00 177.10 174.66 1k7d s LEU 331 N -0.99 2.09 0.52 0.60 1.43 -1.26 -4.84 118.68 116.23 1k7d s LEU 331 Ca 0.48 -0.25 -0.20 0.00 -1.03 0.00 0.00 54.13 53.13 1k7d s LEU 331 Cb -0.32 -0.24 -0.07 0.00 0.03 0.00 0.00 46.19 45.58 1k7d s LEU 331 CO 0.40 -0.02 1.07 -0.76 0.23 0.00 0.00 176.35 177.26 1k7d s LEU 332 N -0.63 3.78 0.69 1.79 1.43 -1.26 -1.51 118.68 122.96 1k7d s LEU 332 Ca -0.02 2.01 -0.07 0.00 -1.03 0.00 0.00 54.13 55.02 1k7d s LEU 332 Cb -0.05 -4.57 0.05 0.00 0.03 0.00 0.00 46.19 41.66 1k7d s LEU 332 CO 0.00 -0.97 1.00 0.20 0.23 0.00 0.00 176.35 176.81 1k7d s ASN 333 N -1.98 5.00 0.47 2.29 0.01 0.20 -4.70 114.94 116.24 1k7d s ASN 333 Ca 0.69 0.56 0.30 0.00 -0.71 0.00 0.00 52.86 53.71 1k7d s ASN 333 Cb -0.19 -1.29 1.66 0.00 0.41 0.00 0.00 41.25 41.84 1k7d s ASN 333 CO 0.24 -1.49 1.93 0.44 -1.51 0.00 0.00 177.10 176.71 1k7d h ASP 334 N -0.54 0.00 0.74 -1.22 3.32 -1.97 -1.29 116.42 115.46 1k7d h ASP 334 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1k7d h ASP 334 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 1k7d h ASP 334 CO 0.61 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.23 1k7d n ASP 335 N -2.59 0.12 0.00 6.45 5.68 -1.26 -4.89 116.55 120.05 1k7d n ASP 335 Ca -0.02 0.52 0.00 0.00 -0.50 0.00 0.00 54.79 54.79 1k7d n ASP 335 Cb 0.08 -0.55 0.00 0.00 -1.14 0.00 0.00 41.12 39.51 1k7d n ASP 335 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1k7d n GLY 336 N 0.53 0.30 0.00 6.12 0.00 -0.49 -4.78 105.19 106.87 1k7d n GLY 336 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1k7d n GLY 336 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1k7d n LYS 337 N -1.23 2.78 -4.42 1.61 4.76 -1.26 -4.84 118.16 115.57 1k7d n LYS 337 Ca 0.00 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.20 1k7d n LYS 337 Cb 0.21 -0.89 -0.09 0.00 -1.84 0.00 0.00 35.03 32.42 1k7d n LYS 337 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1k7d s THR 338 N -1.78 2.74 0.15 -0.18 -4.23 -1.26 -0.78 115.64 110.30 1k7d s THR 338 Ca 0.00 -2.23 -0.12 0.00 -1.18 0.00 0.00 61.69 58.17 1k7d s THR 338 Cb 0.00 -2.51 -0.07 0.00 1.34 0.00 0.00 72.50 71.26 1k7d s THR 338 CO 0.00 -0.36 0.51 0.26 -0.54 0.00 0.00 174.62 174.48 1k7d s TRP 339 N -2.47 3.55 0.35 3.99 0.51 0.11 0.61 118.94 125.60 1k7d s TRP 339 Ca 0.31 0.93 0.09 0.00 -2.12 0.00 0.00 56.10 55.32 1k7d s TRP 339 Cb -0.05 -2.28 0.65 0.00 -0.81 0.00 0.00 33.47 30.99 1k7d s TRP 339 CO 0.17 0.41 1.82 1.96 -0.51 0.00 0.00 176.95 180.79 1k7d h GLN 340 N 3.31 0.17 -6.09 4.98 4.20 -1.55 -3.37 115.11 116.76 1k7d h GLN 340 Ca -0.48 -0.06 -0.59 0.00 0.06 0.00 0.00 58.65 57.58 1k7d h GLN 340 Cb 1.19 -0.01 -0.27 0.00 0.30 0.00 0.00 27.48 28.69 1k7d h GLN 340 CO 0.67 0.46 -0.85 -0.65 -0.67 0.00 0.00 178.83 177.79 1k7d s GLN 341 N -4.37 1.47 -0.13 1.46 -1.52 -1.26 -5.01 119.66 110.29 1k7d s GLN 341 Ca -0.04 -0.90 0.10 0.00 -1.95 0.00 0.00 55.36 52.57 1k7d s GLN 341 Cb 0.14 -1.55 0.53 0.00 -0.22 0.00 0.00 33.01 31.91 1k7d s GLN 341 CO 0.74 0.40 1.33 -0.35 -0.25 0.00 0.00 175.29 177.17 1k7d n PRO 342 N 2.02 3.38 -0.13 2.91 -0.04 -1.26 -4.63 135.00 137.25 1k7d n PRO 342 Ca -0.17 -2.04 -0.08 0.00 -0.04 0.00 0.00 63.50 61.18 1k7d n PRO 342 Cb 0.53 -1.92 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 1k7d n PRO 342 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1k7d h GLY 343 N 4.45 0.60 1.00 0.55 0.00 -1.96 -1.20 103.07 106.51 1k7d h GLY 343 Ca 0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.08 1k7d h GLY 343 CO 0.28 0.24 0.39 1.76 0.00 0.00 0.00 176.54 179.20 1k7d h SER 344 N 0.55 0.79 -0.25 0.19 0.02 -1.98 0.12 113.55 112.99 1k7d h SER 344 Ca 0.15 -0.07 -0.08 0.00 -0.84 0.00 0.00 61.79 60.95 1k7d h SER 344 Cb -0.02 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 1k7d h SER 344 CO -0.03 0.63 -0.11 0.00 -1.14 0.00 0.00 176.83 176.18 1k7d h ALA 345 N 1.20 1.11 -0.33 3.77 0.00 -1.82 0.44 119.26 123.63 1k7d h ALA 345 Ca 0.23 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1k7d h ALA 345 Cb -0.01 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1k7d h ALA 345 CO -0.04 0.55 0.11 0.82 0.00 0.00 0.00 179.25 180.70 1k7d h ILE 346 N 0.59 1.20 -0.52 0.00 2.04 -0.77 -1.84 117.51 118.21 1k7d h ILE 346 Ca 0.11 -0.62 -0.07 0.00 1.00 0.00 0.00 64.86 65.28 1k7d h ILE 346 Cb 0.54 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 1k7d h ILE 346 CO 0.03 0.21 0.06 -0.07 0.00 0.00 0.00 178.15 178.39 1k7d h LEU 347 N 0.37 0.84 -0.23 1.44 3.38 -0.26 -0.67 115.31 120.19 1k7d h LEU 347 Ca 0.11 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1k7d h LEU 347 Cb 0.22 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1k7d h LEU 347 CO -0.01 0.91 0.15 -1.13 0.09 0.00 0.00 178.44 178.45 1k7d h ASN 348 N 0.75 0.26 -0.30 -0.43 -0.00 -0.01 0.33 115.58 116.17 1k7d h ASN 348 Ca 0.15 -0.01 -0.18 0.00 -0.00 0.00 0.00 56.30 56.27 1k7d h ASN 348 Cb 0.44 -0.06 -0.00 0.00 -0.00 0.00 0.00 38.32 38.69 1k7d h ASN 348 CO 0.01 0.19 -0.50 0.58 -0.00 0.00 0.00 177.43 177.72 1k7d h VAL 349 N 0.31 1.27 -0.40 2.57 2.07 -1.26 -1.13 116.25 119.68 1k7d h VAL 349 Ca 0.09 -1.68 -0.08 0.00 0.82 0.00 0.00 66.70 65.85 1k7d h VAL 349 Cb -0.03 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 1k7d h VAL 349 CO -0.02 0.55 -0.06 -0.25 0.02 0.00 0.00 177.57 177.82 1k7d h TRP 350 N 0.69 0.83 -0.46 1.57 7.01 -0.89 -2.55 115.95 122.16 1k7d h TRP 350 Ca 0.03 -0.17 -0.11 0.00 2.11 0.00 0.00 58.89 60.75 1k7d h TRP 350 Cb 1.10 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 27.94 1k7d h TRP 350 CO 0.07 0.86 -0.14 1.25 -2.79 0.00 0.00 178.44 177.68 1k7d h LEU 351 N 0.57 0.93 -0.27 0.65 5.85 -0.22 -1.19 115.31 121.64 1k7d h LEU 351 Ca 0.11 -0.37 0.03 0.00 0.84 0.00 0.00 57.88 58.48 1k7d h LEU 351 Cb 0.56 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 1k7d h LEU 351 CO 0.03 1.09 0.09 0.74 -0.34 0.00 0.00 178.44 180.06 1k7d h THR 352 N 0.76 0.93 -0.69 1.05 2.02 -1.13 -0.05 112.91 115.80 1k7d h THR 352 Ca 0.11 -0.07 -0.07 0.00 0.77 0.00 0.00 66.41 67.15 1k7d h THR 352 Cb 0.70 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 1k7d h THR 352 CO 0.05 0.04 0.16 -1.28 0.37 0.00 0.00 175.52 174.87 1k7d h SER 353 N 0.21 1.05 -0.76 4.18 0.87 -1.22 -1.66 113.55 116.23 1k7d h SER 353 Ca 0.12 -0.22 -0.01 0.00 -1.23 0.00 0.00 61.79 60.44 1k7d h SER 353 Cb 0.08 -0.28 -0.04 0.00 -0.44 0.00 0.00 62.40 61.73 1k7d h SER 353 CO -0.12 1.01 0.43 0.24 -0.53 0.00 0.00 176.83 177.86 1k7d h MET 354 N 1.05 1.04 -0.34 2.24 2.07 -0.33 -0.88 114.93 119.78 1k7d h MET 354 Ca 0.22 -0.11 -0.08 0.00 -2.07 0.00 0.00 59.70 57.66 1k7d h MET 354 Cb 0.37 -0.21 -0.01 0.00 -1.87 0.00 0.00 31.60 29.88 1k7d h MET 354 CO 0.00 0.76 -0.09 -0.07 1.07 0.00 0.00 176.91 178.58 1k7d h LEU 355 N 1.04 0.67 -1.03 1.22 3.38 -0.76 -0.60 115.31 119.24 1k7d h LEU 355 Ca 0.27 -0.37 0.12 0.00 0.09 0.00 0.00 57.88 57.99 1k7d h LEU 355 Cb 0.00 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 40.49 1k7d h LEU 355 CO -0.05 0.88 0.63 0.50 0.09 0.00 0.00 178.44 180.50 1k7d h LYS 356 N 0.45 0.96 0.00 1.13 3.64 -0.84 -1.71 116.57 120.20 1k7d h LYS 356 Ca 0.09 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1k7d h LYS 356 Cb 0.59 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1k7d h LYS 356 CO 0.04 0.63 -0.19 0.54 -2.27 0.00 0.00 179.45 178.20 1k7d n ARG 357 N -4.61 0.25 0.00 1.90 1.74 -0.38 -3.52 116.66 112.05 1k7d n ARG 357 Ca 0.19 0.16 0.00 0.00 -0.77 0.00 0.00 57.85 57.43 1k7d n ARG 357 Cb 0.36 -1.75 0.00 0.00 -1.02 0.00 0.00 32.46 30.05 1k7d n ARG 357 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1k7d n THR 358 N -2.16 0.00 -0.09 0.55 -2.24 -0.28 -4.72 114.28 105.33 1k7d n THR 358 Ca 0.05 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.77 1k7d n THR 358 Cb 0.43 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 1k7d n THR 358 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1k7d h VAL 359 N 0.00 0.71 -0.97 2.28 2.07 -1.73 -1.66 116.25 116.94 1k7d h VAL 359 Ca 0.00 -0.02 0.06 0.00 0.82 0.00 0.00 66.70 67.57 1k7d h VAL 359 Cb 0.00 0.66 -0.06 0.00 -1.52 0.00 0.00 31.29 30.37 1k7d h VAL 359 CO 0.00 0.01 0.63 0.58 0.02 0.00 0.00 177.57 178.81 1k7d h VAL 360 N 0.04 1.09 0.00 2.57 2.07 -1.53 -1.68 116.25 118.81 1k7d h VAL 360 Ca 0.16 -0.39 -0.10 0.00 0.82 0.00 0.00 66.70 67.19 1k7d h VAL 360 Cb 0.23 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 29.84 1k7d h VAL 360 CO -0.31 0.21 -0.46 0.00 0.02 0.00 0.00 177.57 177.03 1k7d h ALA 361 N 1.47 0.91 0.00 1.67 0.00 -1.37 -2.90 119.26 119.03 1k7d h ALA 361 Ca 0.42 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1k7d h ALA 361 Cb 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1k7d h ALA 361 CO -0.16 0.58 -0.07 0.00 0.00 0.00 0.00 179.25 179.61 1k7d h ALA 362 N 1.54 0.96 -3.26 0.00 0.00 -0.58 -3.46 119.26 114.46 1k7d h ALA 362 Ca -0.00 0.00 -0.68 0.00 0.00 0.00 0.00 54.91 54.23 1k7d h ALA 362 Cb 1.05 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.69 1k7d h ALA 362 CO 0.06 0.00 -0.61 0.08 0.00 0.00 0.00 179.25 178.78 1k7d s VAL 363 N -3.12 4.42 0.24 0.00 1.01 -1.10 -5.07 120.40 116.79 1k7d s VAL 363 Ca 0.10 -0.20 -0.30 0.00 0.00 0.00 0.00 61.98 61.58 1k7d s VAL 363 Cb 0.12 -2.87 -0.10 0.00 0.00 0.00 0.00 36.38 33.53 1k7d s VAL 363 CO 0.61 0.60 1.42 -2.84 0.00 0.00 0.00 175.10 174.89 1k7d s PRO 364 N -0.81 4.29 0.39 2.72 0.02 -1.26 -4.34 135.00 136.01 1k7d s PRO 364 Ca 0.12 2.26 -0.27 0.00 0.02 0.00 0.00 61.00 63.14 1k7d s PRO 364 Cb -0.11 -3.12 -0.11 0.00 0.02 0.00 0.00 34.50 31.18 1k7d s PRO 364 CO 0.02 -0.39 1.33 -1.33 -0.33 0.00 0.00 177.00 176.31 1k7d n MET 365 N 2.34 2.16 -0.88 5.54 2.81 -1.26 -0.80 117.12 127.02 1k7d n MET 365 Ca 0.06 0.76 0.02 0.00 -1.81 0.00 0.00 57.70 56.74 1k7d n MET 365 Cb 0.41 -2.45 0.34 0.00 -0.71 0.00 0.00 33.22 30.82 1k7d n MET 365 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1k7d n PRO 366 N 0.24 4.12 0.24 0.03 -0.04 -1.26 -4.84 135.00 133.49 1k7d n PRO 366 Ca 0.05 -3.10 0.11 0.00 -0.04 0.00 0.00 63.50 60.51 1k7d n PRO 366 Cb 0.39 -2.18 0.61 0.00 -0.04 0.00 0.00 33.50 32.27 1k7d n PRO 366 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1k7d h PHE 367 N 3.12 0.00 -0.88 0.54 0.04 -1.31 -2.70 116.94 115.75 1k7d h PHE 367 Ca 0.10 0.00 0.16 0.00 2.80 0.00 0.00 57.97 61.04 1k7d h PHE 367 Cb 2.03 0.00 -0.10 0.00 2.20 0.00 0.00 35.95 40.08 1k7d h PHE 367 CO 1.08 0.18 0.47 0.38 -0.60 0.00 0.00 178.31 179.82 1k7d h ASP 368 N 0.00 0.56 -0.66 2.17 2.03 -1.59 0.33 116.42 119.25 1k7d h ASP 368 Ca -0.00 0.10 0.19 0.00 -0.73 0.00 0.00 57.03 56.59 1k7d h ASP 368 Cb 0.49 0.01 -0.03 0.00 -0.83 0.00 0.00 39.33 38.97 1k7d h ASP 368 CO 0.02 0.21 0.63 0.11 -1.03 0.00 0.00 179.24 179.18 1k7d h LYS 369 N 0.63 0.00 0.00 4.15 1.57 -1.80 0.32 116.57 121.44 1k7d h LYS 369 Ca 0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 1k7d h LYS 369 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1k7d h LYS 369 CO -0.38 0.00 0.00 -1.49 -0.57 0.00 0.00 179.45 177.01 1k7d h TRP 370 N 0.00 0.00 -0.26 -1.35 6.55 -0.52 -3.03 115.95 117.34 1k7d h TRP 370 Ca 0.31 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.15 1k7d h TRP 370 Cb 1.57 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.87 1k7d h TRP 370 CO 0.00 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 178.05 1k7d n TYR 371 N -2.81 0.82 -0.01 0.49 4.01 0.10 -4.71 117.16 115.06 1k7d n TYR 371 Ca 0.00 -0.81 0.07 0.00 -0.16 0.00 0.00 57.90 57.00 1k7d n TYR 371 Cb 0.21 -0.26 -0.15 0.00 -0.31 0.00 0.00 39.34 38.84 1k7d n TYR 371 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1k7d n SER 372 N -0.37 0.14 -4.75 7.72 3.41 -1.14 -4.47 113.62 114.15 1k7d n SER 372 Ca 0.19 0.06 -0.41 0.00 -0.26 0.00 0.00 58.87 58.45 1k7d n SER 372 Cb 0.80 1.57 -0.02 0.00 -0.26 0.00 0.00 64.21 66.30 1k7d n SER 372 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k7d s ALA 373 N -3.30 3.54 -0.30 7.33 0.00 -1.26 -4.86 121.76 122.90 1k7d s ALA 373 Ca -0.07 1.22 0.22 0.00 0.00 0.00 0.00 51.96 53.33 1k7d s ALA 373 Cb 0.12 -3.49 0.14 0.00 0.00 0.00 0.00 23.12 19.88 1k7d s ALA 373 CO 0.88 -0.62 1.30 0.66 0.00 0.00 0.00 175.76 177.98 1k7d h SER 374 N 4.35 0.00 0.00 0.00 4.64 -1.92 -3.42 113.55 117.19 1k7d h SER 374 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1k7d h SER 374 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1k7d h SER 374 CO 0.72 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 177.38 1k7d n GLY 375 N 1.17 0.70 0.16 -0.77 0.00 -1.26 -4.37 105.19 100.81 1k7d n GLY 375 Ca 0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.11 1k7d n GLY 375 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1k7d n TYR 376 N -2.07 0.00 -1.72 1.61 4.01 -1.26 -4.63 117.16 113.10 1k7d n TYR 376 Ca 0.00 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.34 1k7d n TYR 376 Cb 0.00 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.05 1k7d n TYR 376 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1k7d n GLU 377 N -0.90 1.95 -3.15 -0.72 4.71 -1.26 -4.98 120.64 116.29 1k7d n GLU 377 Ca 0.05 0.70 -0.04 0.00 -0.01 0.00 0.00 57.16 57.85 1k7d n GLU 377 Cb 0.31 -2.48 0.02 0.00 -1.01 0.00 0.00 31.44 28.28 1k7d n GLU 377 CO 0.00 0.00 0.00 -2.37 0.09 0.00 0.00 177.13 174.85 1k7d n THR 378 N -0.39 0.00 -4.65 2.62 5.66 -1.26 -4.88 114.28 111.38 1k7d n THR 378 Ca 0.07 -0.58 -0.29 0.00 -3.05 0.00 0.00 64.05 60.20 1k7d n THR 378 Cb 0.41 0.65 -0.09 0.00 -1.55 0.00 0.00 70.33 69.75 1k7d n THR 378 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1k7d s THR 379 N -2.26 1.43 0.50 1.09 -4.23 -1.26 -4.97 115.64 105.93 1k7d s THR 379 Ca 0.14 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 58.87 1k7d s THR 379 Cb -0.03 -2.58 0.37 0.00 1.34 0.00 0.00 72.50 71.60 1k7d s THR 379 CO 0.06 0.00 1.99 1.56 -0.54 0.00 0.00 174.62 177.70 1k7d h GLN 380 N 1.65 0.13 0.00 3.99 4.20 -2.02 0.29 115.11 123.35 1k7d h GLN 380 Ca -0.43 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.28 1k7d h GLN 380 Cb 1.27 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 29.03 1k7d h GLN 380 CO 0.75 0.08 0.00 -0.25 -0.67 0.00 0.00 178.83 178.74 1k7d n ASP 381 N -4.42 0.59 0.00 1.46 8.00 -1.26 -4.80 116.55 116.12 1k7d n ASP 381 Ca 0.10 0.56 0.00 0.00 0.71 0.00 0.00 54.79 56.16 1k7d n ASP 381 Cb 0.52 -0.72 0.00 0.00 -0.02 0.00 0.00 41.12 40.90 1k7d n ASP 381 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k7d n GLY 382 N 1.26 0.10 3.59 0.44 0.00 0.10 -3.37 105.19 107.31 1k7d n GLY 382 Ca 0.06 -1.86 -0.40 0.00 0.00 0.00 0.00 46.02 43.81 1k7d n GLY 382 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1k7d n PRO 383 N 0.22 1.15 0.01 1.61 -0.02 -1.26 -4.38 135.00 132.33 1k7d n PRO 383 Ca 0.00 0.42 0.12 0.00 -2.02 0.00 0.00 63.50 62.02 1k7d n PRO 383 Cb 0.00 -2.01 0.31 0.00 -0.02 0.00 0.00 33.50 31.78 1k7d n PRO 383 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1k7d n THR 384 N -0.86 0.04 -1.43 3.45 -2.24 -1.26 -4.79 114.28 107.19 1k7d n THR 384 Ca 0.10 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1k7d n THR 384 Cb 0.42 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1k7d n THR 384 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1k7d n GLY 385 N 1.48 4.27 3.66 3.38 0.00 -1.26 -4.11 105.19 112.61 1k7d n GLY 385 Ca 0.06 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 45.03 1k7d n GLY 385 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1k7d s SER 386 N 1.57 2.27 -0.07 1.61 1.04 -1.26 -4.98 113.70 113.87 1k7d s SER 386 Ca 0.00 1.11 0.01 0.00 0.48 0.00 0.00 55.95 57.56 1k7d s SER 386 Cb 0.00 -1.74 -0.03 0.00 0.10 0.00 0.00 66.02 64.36 1k7d s SER 386 CO 0.00 -3.34 -0.10 -0.76 0.98 0.00 0.00 173.24 170.02 1k7d s LEU 387 N -6.57 2.97 0.24 2.42 1.02 -1.26 -5.07 118.68 112.43 1k7d s LEU 387 Ca 0.66 -0.12 0.00 0.00 0.02 0.00 0.00 54.13 54.69 1k7d s LEU 387 Cb -0.18 -1.64 -0.03 0.00 0.02 0.00 0.00 46.19 44.36 1k7d s LEU 387 CO 0.58 0.32 0.21 0.21 0.02 0.00 0.00 176.35 177.69 1k7d s ASN 388 N -0.59 0.54 0.07 2.29 3.84 -1.26 -5.08 114.94 114.75 1k7d s ASN 388 Ca 0.09 -1.45 -0.29 0.00 0.21 0.00 0.00 52.86 51.42 1k7d s ASN 388 Cb -0.12 0.45 -0.05 0.00 -0.55 0.00 0.00 41.25 40.98 1k7d s ASN 388 CO 0.02 -0.94 0.91 -0.63 -2.79 0.00 0.00 177.10 173.67 1k7d s ILE 389 N -3.92 4.64 0.67 -5.21 1.01 -1.26 -4.79 121.20 112.33 1k7d s ILE 389 Ca 0.38 1.94 -0.11 0.00 0.00 0.00 0.00 60.65 62.86 1k7d s ILE 389 Cb 0.05 -4.26 -0.01 0.00 0.01 0.00 0.00 42.46 38.25 1k7d s ILE 389 CO 0.16 0.30 1.05 -0.94 0.00 0.00 0.00 174.94 175.51 1k7d s SER 390 N 0.19 5.63 0.25 3.58 1.04 -1.26 -4.85 113.70 118.28 1k7d s SER 390 Ca 0.45 1.59 -0.03 0.00 0.48 0.00 0.00 55.95 58.44 1k7d s SER 390 Cb -0.22 -2.49 0.46 0.00 0.10 0.00 0.00 66.02 63.87 1k7d s SER 390 CO 0.27 -1.28 1.76 -0.37 0.98 0.00 0.00 173.24 174.61 1k7d h VAL 391 N -0.51 0.76 -0.39 5.02 -1.51 -1.86 -1.28 116.25 116.47 1k7d h VAL 391 Ca -0.44 -0.21 -0.02 0.00 -1.23 0.00 0.00 66.70 64.81 1k7d h VAL 391 Cb 1.21 0.11 -0.02 0.00 -2.13 0.00 0.00 31.29 30.45 1k7d h VAL 391 CO 0.58 0.11 0.19 1.23 -1.23 0.00 0.00 177.57 178.45 1k7d h GLY 392 N 0.60 0.61 1.04 5.19 0.00 -1.82 -1.55 103.07 107.15 1k7d h GLY 392 Ca 0.42 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.44 1k7d h GLY 392 CO -0.34 0.29 0.56 0.00 0.00 0.00 0.00 176.54 177.05 1k7d h ALA 393 N 1.03 1.22 -0.37 3.60 0.00 -1.63 0.18 119.26 123.30 1k7d h ALA 393 Ca 0.14 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1k7d h ALA 393 Cb 0.13 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1k7d h ALA 393 CO -0.02 0.66 -0.10 0.87 0.00 0.00 0.00 179.25 180.67 1k7d h LYS 394 N 1.29 0.64 -0.12 0.00 1.57 -0.71 0.02 116.57 119.26 1k7d h LYS 394 Ca 0.34 -0.19 -0.23 0.00 -1.87 0.00 0.00 60.65 58.69 1k7d h LYS 394 Cb -0.05 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 32.21 1k7d h LYS 394 CO -0.06 0.73 -0.83 0.82 -0.57 0.00 0.00 179.45 179.53 1k7d h ILE 395 N 0.59 1.28 -0.14 1.86 2.04 -0.65 -2.71 117.51 119.78 1k7d h ILE 395 Ca 0.11 -2.03 -0.02 0.00 1.00 0.00 0.00 64.86 63.91 1k7d h ILE 395 Cb 0.52 2.06 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 1k7d h ILE 395 CO 0.03 0.64 0.00 0.25 0.00 0.00 0.00 178.15 179.07 1k7d h LEU 396 N 0.51 0.17 -0.44 1.44 5.85 -0.08 -2.48 115.31 120.27 1k7d h LEU 396 Ca -0.07 -0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.51 1k7d h LEU 396 Cb 1.46 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.44 1k7d h LEU 396 CO 0.17 0.21 -0.21 0.22 -0.34 0.00 0.00 178.44 178.49 1k7d h TYR 397 N 0.19 1.06 -0.93 1.25 3.20 -0.69 -0.93 116.97 120.11 1k7d h TYR 397 Ca 0.05 -0.26 -0.00 0.00 3.14 0.00 0.00 58.73 61.65 1k7d h TYR 397 Cb 0.13 -0.24 -0.04 0.00 1.54 0.00 0.00 36.73 38.11 1k7d h TYR 397 CO 0.00 1.06 0.56 0.93 -1.64 0.00 0.00 178.16 179.07 1k7d h GLU 398 N 0.75 1.26 -0.31 1.82 4.39 -1.24 -2.16 114.58 119.09 1k7d h GLU 398 Ca 0.10 -0.11 -0.13 0.00 0.34 0.00 0.00 59.36 59.55 1k7d h GLU 398 Cb 0.78 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 1k7d h GLU 398 CO 0.06 0.88 -0.35 0.00 -1.16 0.00 0.00 179.01 178.44 1k7d h ALA 399 N 1.34 0.81 -0.00 3.43 0.00 -1.14 -2.87 119.26 120.83 1k7d h ALA 399 Ca 0.33 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1k7d h ALA 399 Cb -0.06 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1k7d h ALA 399 CO -0.06 0.65 -0.10 1.33 0.00 0.00 0.00 179.25 181.07 1k7d n VAL 400 N -4.06 0.00 0.79 0.00 0.24 -0.43 -2.56 118.33 112.31 1k7d n VAL 400 Ca -0.01 -0.01 0.13 0.00 -2.04 0.00 0.00 64.34 62.41 1k7d n VAL 400 Cb 0.50 -0.31 0.42 0.00 -1.47 0.00 0.00 33.84 32.98 1k7d n VAL 400 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1k7d n GLN 401 N -1.34 0.15 0.00 7.34 1.13 -0.84 -4.98 117.38 118.84 1k7d n GLN 401 Ca 0.10 0.10 0.00 0.00 -1.94 0.00 0.00 57.00 55.26 1k7d n GLN 401 Cb 0.30 -1.65 0.00 0.00 0.11 0.00 0.00 30.24 29.01 1k7d n GLN 401 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1k7d n GLY 402 N 1.40 3.90 0.13 1.08 0.00 -1.06 -1.65 105.19 109.00 1k7d n GLY 402 Ca 0.06 0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.34 1k7d n GLY 402 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1k7d h ASP 403 N 0.00 0.00 0.68 1.61 3.32 -1.91 -2.60 116.42 117.52 1k7d h ASP 403 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1k7d h ASP 403 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1k7d h ASP 403 CO 0.00 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 177.81 1k7d n LYS 404 N -2.30 0.18 -3.25 3.56 5.02 -0.66 -4.72 118.16 115.99 1k7d n LYS 404 Ca 0.03 0.05 -0.39 0.00 -2.02 0.00 0.00 58.31 55.99 1k7d n LYS 404 Cb 0.28 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.73 1k7d n LYS 404 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1k7d s SER 405 N -2.79 6.89 0.00 4.39 0.15 -0.98 -4.94 113.70 116.42 1k7d s SER 405 Ca 0.18 1.06 0.19 0.00 0.70 0.00 0.00 55.95 58.09 1k7d s SER 405 Cb 0.17 -2.34 1.12 0.00 -1.71 0.00 0.00 66.02 63.26 1k7d s SER 405 CO 0.43 0.09 1.73 -0.81 1.20 0.00 0.00 173.24 175.87 1k7d n PRO 406 N 2.92 1.05 -3.31 5.44 -0.04 -1.26 -4.76 135.00 135.04 1k7d n PRO 406 Ca -0.07 -0.08 -0.41 0.00 -0.04 0.00 0.00 63.50 62.90 1k7d n PRO 406 Cb 0.51 -1.31 -0.08 0.00 -0.04 0.00 0.00 33.50 32.58 1k7d n PRO 406 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1k7d s ILE 407 N -1.99 5.08 0.24 0.52 -1.09 -1.26 -5.04 121.20 117.66 1k7d s ILE 407 Ca 0.29 0.16 -0.31 0.00 -2.23 0.00 0.00 60.65 58.56 1k7d s ILE 407 Cb 0.14 -3.92 -0.13 0.00 -1.58 0.00 0.00 42.46 36.97 1k7d s ILE 407 CO 0.23 -0.20 1.57 -2.65 -1.23 0.00 0.00 174.94 172.66 1k7d n PRO 408 N 5.60 2.46 -2.77 2.79 -0.02 -1.26 -4.88 135.00 136.92 1k7d n PRO 408 Ca -0.07 0.88 -0.44 0.00 -2.02 0.00 0.00 63.50 61.86 1k7d n PRO 408 Cb 0.49 -2.64 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1k7d n PRO 408 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1k7d n GLN 409 N 2.69 3.49 -0.29 -0.52 1.13 -1.26 -4.83 117.38 117.78 1k7d n GLN 409 Ca 0.12 -3.79 0.12 0.00 -1.94 0.00 0.00 57.00 51.51 1k7d n GLN 409 Cb 0.34 -2.97 0.27 0.00 0.11 0.00 0.00 30.24 27.99 1k7d n GLN 409 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1k7d h ALA 410 N 6.63 1.21 -4.26 -1.58 0.00 -2.05 -3.37 119.26 115.84 1k7d h ALA 410 Ca 0.33 0.22 -0.60 0.00 0.00 0.00 0.00 54.91 54.86 1k7d h ALA 410 Cb 0.79 0.32 -0.30 0.00 0.00 0.00 0.00 17.79 18.60 1k7d h ALA 410 CO 1.36 -0.45 -0.85 0.14 0.00 0.00 0.00 179.25 179.44 1k7d s VAL 411 N -5.96 1.64 -0.44 0.00 -7.23 -1.26 -5.09 120.40 102.05 1k7d s VAL 411 Ca -0.12 -0.87 -0.28 0.00 -1.81 0.00 0.00 61.98 58.90 1k7d s VAL 411 Cb 0.25 -1.37 -0.00 0.00 0.56 0.00 0.00 36.38 35.82 1k7d s VAL 411 CO 0.77 0.46 1.56 -0.62 -0.31 0.00 0.00 175.10 176.96 1k7d s ASP 412 N -0.33 6.06 0.33 4.85 2.15 -1.26 -4.85 116.67 123.62 1k7d s ASP 412 Ca 0.04 0.79 0.23 0.00 0.43 0.00 0.00 52.55 54.04 1k7d s ASP 412 Cb -0.09 -2.54 1.21 0.00 -0.30 0.00 0.00 42.92 41.19 1k7d s ASP 412 CO 0.00 -1.66 1.70 -0.07 -0.17 0.00 0.00 175.17 174.97 1k7d h LEU 413 N 13.22 0.00 -1.36 -1.34 3.38 -1.93 0.22 115.31 127.50 1k7d h LEU 413 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1k7d h LEU 413 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1k7d h LEU 413 CO 1.10 0.00 -0.18 0.49 0.09 0.00 0.00 178.44 179.95 1k7d n PHE 414 N -2.30 0.00 -4.10 1.13 3.72 -1.26 -4.29 117.46 110.35 1k7d n PHE 414 Ca -0.01 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.09 1k7d n PHE 414 Cb 0.06 -0.01 -0.05 0.00 -0.94 0.00 0.00 39.48 38.55 1k7d n PHE 414 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1k7d n ALA 415 N 0.55 -2.11 0.00 4.37 0.00 0.77 -2.10 120.51 122.00 1k7d n ALA 415 Ca 0.13 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1k7d n ALA 415 Cb 0.50 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.48 1k7d n ALA 415 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k7d n GLY 416 N -2.23 3.18 3.82 0.00 0.00 -1.26 -5.02 105.19 103.68 1k7d n GLY 416 Ca -0.29 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 1k7d n GLY 416 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k7d s LYS 417 N -0.42 4.24 0.61 1.61 1.02 -0.89 -5.02 119.74 120.88 1k7d s LYS 417 Ca 0.00 1.00 -0.19 0.00 0.02 0.00 0.00 55.97 56.80 1k7d s LYS 417 Cb 0.00 -2.47 -0.03 0.00 -0.52 0.00 0.00 37.83 34.81 1k7d s LYS 417 CO 0.00 0.14 1.29 -1.25 -0.92 0.00 0.00 175.35 174.61 1k7d s PRO 418 N -2.74 2.82 0.15 -1.68 0.04 -1.26 -4.86 135.00 127.47 1k7d s PRO 418 Ca 0.55 2.04 -0.13 0.00 0.04 0.00 0.00 61.00 63.50 1k7d s PRO 418 Cb -0.12 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.47 1k7d s PRO 418 CO 0.17 -1.38 1.64 1.96 0.04 0.00 0.00 177.00 179.43 1k7d h GLN 419 N 0.88 0.83 -0.74 4.56 4.20 -1.95 -2.73 115.11 120.16 1k7d h GLN 419 Ca -0.51 -0.22 0.12 0.00 0.06 0.00 0.00 58.65 58.10 1k7d h GLN 419 Cb 1.32 -0.10 -0.08 0.00 0.30 0.00 0.00 27.48 28.92 1k7d h GLN 419 CO 0.55 0.82 0.34 0.37 -0.67 0.00 0.00 178.83 180.23 1k7d h GLN 420 N 0.71 0.52 -0.20 1.46 4.15 -1.96 0.12 115.11 119.91 1k7d h GLN 420 Ca 0.15 -0.03 0.04 0.00 0.77 0.00 0.00 58.65 59.58 1k7d h GLN 420 Cb 0.39 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.93 1k7d h GLN 420 CO 0.01 0.35 -0.02 1.49 -1.93 0.00 0.00 178.83 178.73 1k7d h GLU 421 N 0.54 0.04 -0.65 1.69 4.81 -1.86 0.21 114.58 119.36 1k7d h GLU 421 Ca 0.38 -0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.56 1k7d h GLU 421 Cb 0.49 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.84 1k7d h GLU 421 CO -0.33 0.03 0.20 0.28 -0.73 0.00 0.00 179.01 178.46 1k7d h VAL 422 N 0.04 1.25 -0.78 0.32 2.07 -1.11 -0.33 116.25 117.71 1k7d h VAL 422 Ca 0.10 -0.86 -0.03 0.00 0.82 0.00 0.00 66.70 66.72 1k7d h VAL 422 Cb 0.13 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 1k7d h VAL 422 CO -0.18 0.33 0.35 0.58 0.02 0.00 0.00 177.57 178.67 1k7d h VAL 423 N 0.95 1.25 -0.20 2.57 2.07 -0.50 -1.74 116.25 120.64 1k7d h VAL 423 Ca 0.21 -0.74 -0.04 0.00 0.82 0.00 0.00 66.70 66.95 1k7d h VAL 423 Cb 0.30 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1k7d h VAL 423 CO -0.01 0.31 -0.03 -0.07 0.02 0.00 0.00 177.57 177.80 1k7d h LEU 424 N 1.11 0.38 -1.39 2.57 3.38 -0.60 -1.15 115.31 119.61 1k7d h LEU 424 Ca 0.26 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1k7d h LEU 424 Cb 0.16 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1k7d h LEU 424 CO -0.03 0.63 0.04 0.00 0.09 0.00 0.00 178.44 179.17 1k7d h ALA 425 N 0.76 1.51 -0.09 1.53 0.00 -0.97 0.23 119.26 122.23 1k7d h ALA 425 Ca 0.05 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1k7d h ALA 425 Cb 0.45 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1k7d h ALA 425 CO 0.02 0.36 -0.45 0.00 0.00 0.00 0.00 179.25 179.17 1k7d h ALA 426 N 1.61 1.07 -0.13 0.00 0.00 -0.91 -1.60 119.26 119.30 1k7d h ALA 426 Ca 0.10 -0.44 -0.15 0.00 0.00 0.00 0.00 54.91 54.42 1k7d h ALA 426 Cb 0.23 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1k7d h ALA 426 CO 0.00 0.61 -0.57 -0.07 0.00 0.00 0.00 179.25 179.22 1k7d h LEU 427 N 0.18 0.47 -0.09 0.00 3.38 0.27 -1.91 115.31 117.61 1k7d h LEU 427 Ca 0.01 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.74 1k7d h LEU 427 Cb 0.87 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1k7d h LEU 427 CO 0.07 0.94 -0.03 -0.08 0.09 0.00 0.00 178.44 179.43 1k7d h GLU 428 N 0.32 -0.02 -1.01 1.13 4.81 -0.27 -0.99 114.58 118.55 1k7d h GLU 428 Ca 0.00 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.34 1k7d h GLU 428 Cb 1.10 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.40 1k7d h GLU 428 CO 0.10 -0.01 0.64 -0.44 -0.73 0.00 0.00 179.01 178.57 1k7d h ASP 429 N -0.02 0.96 -0.37 1.04 3.32 -1.14 -2.12 116.42 118.09 1k7d h ASP 429 Ca 0.05 0.04 -0.17 0.00 0.02 0.00 0.00 57.03 56.97 1k7d h ASP 429 Cb 0.09 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.48 1k7d h ASP 429 CO -0.11 0.54 -0.42 0.74 -1.72 0.00 0.00 179.24 178.27 1k7d h THR 430 N 1.04 1.27 -0.28 0.35 2.02 -0.81 -0.93 112.91 115.57 1k7d h THR 430 Ca 0.48 -1.60 -0.06 0.00 0.77 0.00 0.00 66.41 66.00 1k7d h THR 430 Cb 0.41 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.24 1k7d h THR 430 CO -0.24 0.53 -0.06 -0.25 0.37 0.00 0.00 175.52 175.87 1k7d h TRP 431 N 0.75 0.60 0.32 3.16 2.91 -0.92 -0.62 115.95 122.16 1k7d h TRP 431 Ca 0.05 -0.13 -0.00 0.00 1.13 0.00 0.00 58.89 59.94 1k7d h TRP 431 Cb 1.02 -0.15 -0.02 0.00 -0.51 0.00 0.00 29.16 29.51 1k7d h TRP 431 CO 0.07 0.73 -0.27 0.93 -1.03 0.00 0.00 178.44 178.87 1k7d h GLU 432 N 0.30 -0.58 0.25 2.65 4.39 -1.29 0.26 114.58 120.56 1k7d h GLU 432 Ca 0.07 0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.82 1k7d h GLU 432 Cb 0.53 0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 29.28 1k7d h GLU 432 CO 0.03 -0.39 -0.35 1.15 -1.16 0.00 0.00 179.01 178.29 1k7d h THR 433 N -0.60 0.27 -0.28 1.13 2.02 -1.15 -2.65 112.91 111.64 1k7d h THR 433 Ca -0.02 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.04 1k7d h THR 433 Cb 0.53 0.27 -0.00 0.00 -1.74 0.00 0.00 68.15 67.21 1k7d h THR 433 CO -0.03 0.00 -0.27 -0.07 0.37 0.00 0.00 175.52 175.52 1k7d h LEU 434 N -0.66 0.73 -2.14 2.58 3.38 -1.08 -3.07 115.31 115.04 1k7d h LEU 434 Ca 0.00 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.49 1k7d h LEU 434 Cb 0.64 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 1k7d h LEU 434 CO -0.13 1.05 -0.07 0.77 0.09 0.00 0.00 178.44 180.15 1k7d h SER 435 N 0.42 0.00 1.33 -0.43 4.64 -0.48 0.83 113.55 119.86 1k7d h SER 435 Ca 0.05 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.25 1k7d h SER 435 Cb 0.84 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.91 1k7d h SER 435 CO 0.07 0.07 -0.70 0.11 -0.87 0.00 0.00 176.83 175.51 1k7d h LYS 436 N 0.00 0.00 0.08 4.77 1.57 -1.41 0.36 116.57 121.94 1k7d h LYS 436 Ca -0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.45 1k7d h LYS 436 Cb 0.24 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 1k7d h LYS 436 CO 0.01 0.44 -1.84 -0.09 -0.57 0.00 0.00 179.45 177.40 1k7d h ARG 437 N 0.00 0.18 -0.01 3.15 2.43 -1.30 -3.40 114.38 115.43 1k7d h ARG 437 Ca -0.04 -0.31 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 1k7d h ARG 437 Cb 1.41 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 31.08 1k7d h ARG 437 CO 0.06 0.96 -0.14 0.66 -1.51 0.00 0.00 179.97 180.00 1k7d n TYR 438 N -3.34 0.00 -0.52 2.20 4.01 0.23 -5.11 117.16 114.63 1k7d n TYR 438 Ca -0.25 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.49 1k7d n TYR 438 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.08 1k7d n TYR 438 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1k7d n GLY 439 N 0.76 -2.66 0.74 2.72 0.00 0.13 -4.62 105.19 102.25 1k7d n GLY 439 Ca 0.03 -1.67 0.09 0.00 0.00 0.00 0.00 46.02 44.47 1k7d n GLY 439 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1k7d n ASN 440 N -0.49 2.17 -4.06 1.61 5.03 -1.26 -4.28 115.26 113.98 1k7d n ASN 440 Ca 0.00 -1.89 -0.35 0.00 0.87 0.00 0.00 54.58 53.21 1k7d n ASN 440 Cb 0.00 -0.22 -0.10 0.00 -1.02 0.00 0.00 39.78 38.45 1k7d n ASN 440 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1k7d s ASN 441 N -1.25 5.23 0.27 6.41 3.04 -1.26 -4.95 114.94 122.43 1k7d s ASN 441 Ca 0.31 -3.18 0.00 0.00 0.04 0.00 0.00 52.86 50.03 1k7d s ASN 441 Cb 0.17 -1.82 0.60 0.00 -1.54 0.00 0.00 41.25 38.66 1k7d s ASN 441 CO 0.23 -0.28 1.73 0.58 -3.04 0.00 0.00 177.10 176.32 1k7d h VAL 442 N 4.94 0.61 0.00 -5.21 2.07 -1.93 -0.47 116.25 116.26 1k7d h VAL 442 Ca 0.03 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.38 1k7d h VAL 442 Cb 0.89 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1k7d h VAL 442 CO 0.74 0.09 0.04 -1.54 0.02 0.00 0.00 177.57 176.92 1k7d n SER 443 N -4.96 0.27 -0.30 0.57 3.41 -1.26 -0.40 113.62 110.96 1k7d n SER 443 Ca 0.19 0.61 0.03 0.00 -0.26 0.00 0.00 58.87 59.44 1k7d n SER 443 Cb 0.52 -0.63 0.08 0.00 -0.26 0.00 0.00 64.21 63.92 1k7d n SER 443 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1k7d n ASN 444 N -1.86 2.49 -4.70 4.04 2.04 -0.19 -5.00 115.26 112.07 1k7d n ASN 444 Ca -0.01 -2.15 -0.42 0.00 -0.44 0.00 0.00 54.58 51.57 1k7d n ASN 444 Cb 0.05 -0.15 -0.03 0.00 -2.53 0.00 0.00 39.78 37.12 1k7d n ASN 444 CO 0.00 0.00 0.00 0.26 -0.44 0.00 0.00 177.26 177.08 1k7d s TRP 445 N -1.26 2.77 -0.50 -2.53 0.52 0.47 -4.96 118.94 113.45 1k7d s TRP 445 Ca 0.14 0.54 0.04 0.00 0.02 0.00 0.00 56.10 56.84 1k7d s TRP 445 Cb 0.09 -3.89 0.13 0.00 -1.15 0.00 0.00 33.47 28.65 1k7d s TRP 445 CO 0.07 -3.41 0.24 0.15 0.02 0.00 0.00 176.95 174.02 1k7d s LYS 446 N 1.94 1.88 0.31 4.98 1.02 -1.26 -4.72 119.74 123.89 1k7d s LYS 446 Ca 0.71 -2.51 -0.20 0.00 0.02 0.00 0.00 55.97 53.98 1k7d s LYS 446 Cb -0.40 -3.22 -0.09 0.00 -0.52 0.00 0.00 37.83 33.59 1k7d s LYS 446 CO 0.31 -1.10 0.81 0.95 -0.92 0.00 0.00 175.35 175.40 1k7d s THR 447 N -0.15 4.49 0.06 2.17 -4.23 -1.26 -4.87 115.64 111.86 1k7d s THR 447 Ca 0.17 1.34 -0.30 0.00 -1.18 0.00 0.00 61.69 61.71 1k7d s THR 447 Cb -0.25 -3.77 -0.09 0.00 1.34 0.00 0.00 72.50 69.73 1k7d s THR 447 CO -0.01 -0.01 1.84 -2.84 -0.54 0.00 0.00 174.62 173.06 1k7d s PRO 448 N -2.50 4.15 0.57 3.99 0.02 -1.26 -0.71 135.00 139.26 1k7d s PRO 448 Ca 0.51 2.51 -0.15 0.00 0.02 0.00 0.00 61.00 63.89 1k7d s PRO 448 Cb -0.14 -3.88 -0.05 0.00 0.02 0.00 0.00 34.50 30.45 1k7d s PRO 448 CO 0.19 -0.87 1.02 0.00 -0.33 0.00 0.00 177.00 177.01 1k7d s ALA 449 N 3.60 2.91 0.32 -1.55 0.00 0.04 -4.72 121.76 122.35 1k7d s ALA 449 Ca 0.82 0.23 -0.27 0.00 0.00 0.00 0.00 51.96 52.74 1k7d s ALA 449 Cb -0.42 -3.16 -0.10 0.00 0.00 0.00 0.00 23.12 19.44 1k7d s ALA 449 CO 0.37 -0.58 0.98 -1.64 0.00 0.00 0.00 175.76 174.89 1k7d s MET 450 N -4.26 4.55 0.51 0.00 -1.94 -1.26 -4.94 119.30 111.96 1k7d s MET 450 Ca 0.60 1.45 0.07 0.00 -1.71 0.00 0.00 55.69 56.10 1k7d s MET 450 Cb -0.13 -2.87 0.02 0.00 2.01 0.00 0.00 34.83 33.87 1k7d s MET 450 CO 0.38 0.22 0.43 0.00 -0.01 0.00 0.00 175.02 176.04 1k7d s ALA 451 N -1.50 4.33 -0.02 3.03 0.00 -1.25 -0.48 121.76 125.86 1k7d s ALA 451 Ca 0.50 -1.56 0.04 0.00 0.00 0.00 0.00 51.96 50.93 1k7d s ALA 451 Cb -0.22 -0.86 -0.01 0.00 0.00 0.00 0.00 23.12 22.04 1k7d s ALA 451 CO 0.28 -0.42 -0.13 -1.17 0.00 0.00 0.00 175.76 174.32 1k7d s LEU 452 N -4.27 1.94 -0.07 0.00 0.20 -0.18 -4.16 118.68 112.14 1k7d s LEU 452 Ca 0.41 -0.25 0.01 0.00 0.69 0.00 0.00 54.13 55.00 1k7d s LEU 452 Cb -0.02 -0.70 0.02 0.00 -0.43 0.00 0.00 46.19 45.05 1k7d s LEU 452 CO 0.25 0.13 -0.09 -0.89 -0.29 0.00 0.00 176.35 175.47 1k7d s THR 453 N -0.10 0.91 -0.58 3.68 2.01 -1.22 -0.51 115.64 119.83 1k7d s THR 453 Ca 0.01 -0.32 -0.22 0.00 0.31 0.00 0.00 61.69 61.48 1k7d s THR 453 Cb -0.07 -0.88 0.06 0.00 0.01 0.00 0.00 72.50 71.61 1k7d s THR 453 CO 0.00 0.32 0.85 -0.36 -0.69 0.00 0.00 174.62 174.74 1k7d s PHE 454 N 0.99 2.83 0.40 4.92 0.40 0.46 -4.51 117.98 123.47 1k7d s PHE 454 Ca -0.09 -0.40 -0.23 0.00 -0.60 0.00 0.00 56.93 55.61 1k7d s PHE 454 Cb -0.15 -4.01 -0.10 0.00 0.51 0.00 0.00 43.02 39.27 1k7d s PHE 454 CO 0.00 -1.37 0.97 1.03 0.70 0.00 0.00 175.22 176.56 1k7d s ARG 455 N 3.56 4.28 0.18 0.44 0.52 -0.52 -1.65 118.95 125.77 1k7d s ARG 455 Ca 0.22 1.27 0.24 0.00 -0.52 0.00 0.00 55.73 56.95 1k7d s ARG 455 Cb -0.17 -2.42 0.43 0.00 0.52 0.00 0.00 34.95 33.32 1k7d s ARG 455 CO 0.13 0.01 1.44 0.00 0.02 0.00 0.00 175.30 176.90 1k7d h ALA 456 N 2.36 0.73 -2.81 2.13 0.00 -1.88 0.12 119.26 119.91 1k7d h ALA 456 Ca -0.48 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 53.82 1k7d h ALA 456 Cb 1.19 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.91 1k7d h ALA 456 CO 0.62 0.00 -0.25 -0.80 0.00 0.00 0.00 179.25 178.82 1k7d s ASN 457 N -4.61 6.66 1.07 0.00 0.01 -1.26 -0.81 114.94 116.00 1k7d s ASN 457 Ca 0.07 0.79 -0.11 0.00 -0.71 0.00 0.00 52.86 52.89 1k7d s ASN 457 Cb 0.12 -2.22 0.16 0.00 0.41 0.00 0.00 41.25 39.72 1k7d s ASN 457 CO 0.69 0.23 0.73 -0.46 -1.51 0.00 0.00 177.10 176.79 1k7d n ASN 458 N 2.51 -0.79 0.26 -1.22 0.23 0.13 -4.78 115.26 111.61 1k7d n ASN 458 Ca -0.13 -1.10 0.10 0.00 -0.53 0.00 0.00 54.58 52.92 1k7d n ASN 458 Cb 0.52 -0.61 0.69 0.00 -2.08 0.00 0.00 39.78 38.30 1k7d n ASN 458 CO 0.00 0.00 0.00 2.19 -0.93 0.00 0.00 177.26 178.52 1k7d h PHE 459 N -1.85 0.00 0.00 -2.53 -5.15 -1.93 0.88 116.94 106.36 1k7d h PHE 459 Ca -0.25 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.52 1k7d h PHE 459 Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.91 1k7d h PHE 459 CO 0.00 0.04 0.00 1.19 -2.00 0.00 0.00 178.31 177.54 1k7d n PHE 460 N -4.28 0.64 -0.76 6.09 3.01 -1.26 -4.86 117.46 116.04 1k7d n PHE 460 Ca -0.03 0.26 0.00 0.00 1.01 0.00 0.00 57.45 58.69 1k7d n PHE 460 Cb 0.12 -0.91 0.00 0.00 -0.01 0.00 0.00 39.48 38.68 1k7d n PHE 460 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1k7d n GLY 461 N -0.10 0.74 3.47 1.37 0.00 0.30 -5.07 105.19 105.91 1k7d n GLY 461 Ca 0.02 -0.62 -0.33 0.00 0.00 0.00 0.00 46.02 45.09 1k7d n GLY 461 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k7d s VAL 462 N -2.00 3.40 0.12 1.61 1.01 -1.25 -4.83 120.40 118.46 1k7d s VAL 462 Ca 0.00 -0.56 -0.35 0.00 0.00 0.00 0.00 61.98 61.07 1k7d s VAL 462 Cb 0.00 -2.42 -0.14 0.00 0.00 0.00 0.00 36.38 33.82 1k7d s VAL 462 CO 0.00 0.55 1.55 -2.65 0.00 0.00 0.00 175.10 174.55 1k7d n PRO 463 N 2.98 1.93 -0.05 2.72 -0.02 -1.26 0.18 135.00 141.47 1k7d n PRO 463 Ca -0.18 0.70 0.02 0.00 -2.02 0.00 0.00 63.50 62.02 1k7d n PRO 463 Cb 0.53 -2.44 0.03 0.00 -0.02 0.00 0.00 33.50 31.59 1k7d n PRO 463 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k7d n GLN 464 N 3.45 1.78 -3.62 -0.52 10.64 0.01 -4.82 117.38 124.30 1k7d n GLN 464 Ca 0.18 -1.45 0.04 0.00 -1.83 0.00 0.00 57.00 53.94 1k7d n GLN 464 Cb 0.27 -0.95 0.00 0.00 -0.86 0.00 0.00 30.24 28.70 1k7d n GLN 464 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1k7d s ALA 465 N -1.06 -2.53 0.60 2.61 0.00 -1.12 -4.59 121.76 115.67 1k7d s ALA 465 Ca 0.06 0.84 -0.13 0.00 0.00 0.00 0.00 51.96 52.73 1k7d s ALA 465 Cb 0.05 0.33 -0.04 0.00 0.00 0.00 0.00 23.12 23.46 1k7d s ALA 465 CO 0.01 -1.08 1.03 0.00 0.00 0.00 0.00 175.76 175.72 1k7d s ALA 466 N -2.05 2.99 0.36 0.00 0.00 -1.26 -4.76 121.76 117.04 1k7d s ALA 466 Ca 0.17 0.06 0.08 0.00 0.00 0.00 0.00 51.96 52.26 1k7d s ALA 466 Cb 0.07 -3.12 0.79 0.00 0.00 0.00 0.00 23.12 20.85 1k7d s ALA 466 CO -0.06 -0.66 1.91 0.00 0.00 0.00 0.00 175.76 176.95 1k7d h ALA 467 N 0.02 1.78 0.00 0.00 0.00 -2.01 -0.16 119.26 118.89 1k7d h ALA 467 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1k7d h ALA 467 Cb 1.19 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1k7d h ALA 467 CO 0.61 0.04 0.00 -0.85 0.00 0.00 0.00 179.25 179.04 1k7d n GLU 468 N -4.52 0.24 0.00 0.00 0.00 -1.26 -2.60 120.64 112.50 1k7d n GLU 468 Ca 0.14 0.11 0.14 0.00 0.00 0.00 0.00 57.16 57.56 1k7d n GLU 468 Cb 0.36 -1.50 0.65 0.00 0.00 0.00 0.00 31.44 30.95 1k7d n GLU 468 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1k7d n GLU 469 N -1.31 0.34 -1.76 3.44 1.02 -0.07 -4.84 120.64 117.46 1k7d n GLU 469 Ca 0.08 -0.05 -0.42 0.00 -0.02 0.00 0.00 57.16 56.76 1k7d n GLU 469 Cb 0.16 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.07 1k7d n GLU 469 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1k7d s THR 470 N -2.70 2.03 0.19 2.62 2.01 -1.07 -4.86 115.64 113.86 1k7d s THR 470 Ca 0.23 0.02 0.09 0.00 0.31 0.00 0.00 61.69 62.35 1k7d s THR 470 Cb 0.20 -3.01 -0.04 0.00 0.01 0.00 0.00 72.50 69.65 1k7d s THR 470 CO 0.50 0.00 -0.13 -0.13 -0.69 0.00 0.00 174.62 174.18 1k7d s ARG 471 N -0.44 1.94 0.06 4.92 1.81 -0.66 -4.98 118.95 121.60 1k7d s ARG 471 Ca 0.64 -1.33 0.07 0.00 -1.72 0.00 0.00 55.73 53.38 1k7d s ARG 471 Cb -0.48 -2.09 -0.03 0.00 -0.45 0.00 0.00 34.95 31.90 1k7d s ARG 471 CO 0.48 0.42 -0.18 -1.01 -0.68 0.00 0.00 175.30 174.33 1k7d s HIS 472 N -1.72 1.58 -0.06 -0.53 3.76 -1.26 -0.41 115.29 116.65 1k7d s HIS 472 Ca 0.24 -0.38 0.01 0.00 -0.15 0.00 0.00 55.06 54.78 1k7d s HIS 472 Cb -0.08 -0.92 0.02 0.00 1.11 0.00 0.00 32.58 32.71 1k7d s HIS 472 CO 0.14 0.10 -0.07 -1.14 -0.85 0.00 0.00 174.74 172.92 1k7d s GLN 473 N -1.37 1.17 0.15 1.40 0.74 0.33 -4.99 119.66 117.08 1k7d s GLN 473 Ca 0.05 -0.20 -0.20 0.00 0.05 0.00 0.00 55.36 55.05 1k7d s GLN 473 Cb -0.09 -1.12 0.03 0.00 1.10 0.00 0.00 33.01 32.93 1k7d s GLN 473 CO 0.02 -0.09 1.66 0.00 -0.55 0.00 0.00 175.29 176.33 1k7d h ALA 474 N 7.35 0.06 -2.29 1.58 0.00 -1.89 -0.46 119.26 123.60 1k7d h ALA 474 Ca -0.33 0.10 -0.63 0.00 0.00 0.00 0.00 54.91 54.05 1k7d h ALA 474 Cb 1.16 0.33 -0.13 0.00 0.00 0.00 0.00 17.79 19.15 1k7d h ALA 474 CO 0.44 -0.55 0.18 -2.00 0.00 0.00 0.00 179.25 177.33 1k7d s GLU 475 N -6.16 3.68 0.28 0.00 2.12 -1.26 -3.91 118.70 113.44 1k7d s GLU 475 Ca -0.14 0.08 -0.29 0.00 0.36 0.00 0.00 54.97 54.98 1k7d s GLU 475 Cb 0.12 -3.81 -0.10 0.00 0.26 0.00 0.00 34.13 30.60 1k7d s GLU 475 CO 0.69 -0.76 1.36 -0.47 -0.54 0.00 0.00 175.26 175.54 1k7d s TYR 476 N 2.78 3.06 -0.11 5.30 5.04 0.37 -4.52 117.35 129.26 1k7d s TYR 476 Ca 0.25 1.23 0.00 0.00 -2.44 0.00 0.00 57.07 56.11 1k7d s TYR 476 Cb -0.14 -3.73 0.02 0.00 0.35 0.00 0.00 41.96 38.46 1k7d s TYR 476 CO 0.15 -2.21 -0.08 -0.65 -1.34 0.00 0.00 175.55 171.42 1k7d s GLN 477 N -0.99 1.56 -1.21 4.97 -0.21 -1.26 -4.92 119.66 117.60 1k7d s GLN 477 Ca 0.54 -0.28 -0.17 0.00 0.02 0.00 0.00 55.36 55.47 1k7d s GLN 477 Cb -0.40 -1.56 -0.03 0.00 1.00 0.00 0.00 33.01 32.02 1k7d s GLN 477 CO 0.47 -0.22 2.09 -1.71 -2.12 0.00 0.00 175.29 173.81 1k7d n ASN 478 N 4.75 3.44 -3.58 5.90 5.15 -0.14 -4.83 115.26 125.95 1k7d n ASN 478 Ca -0.14 -2.79 -0.16 0.00 -0.60 0.00 0.00 54.58 50.89 1k7d n ASN 478 Cb 0.50 -1.48 -0.08 0.00 -0.53 0.00 0.00 39.78 38.20 1k7d n ASN 478 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1k7d s ARG 479 N 3.96 1.64 0.58 1.20 1.70 -1.26 -3.99 118.95 122.79 1k7d s ARG 479 Ca 0.52 -1.82 -0.20 0.00 -0.47 0.00 0.00 55.73 53.75 1k7d s ARG 479 Cb 0.13 0.35 -0.03 0.00 -0.57 0.00 0.00 34.95 34.82 1k7d s ARG 479 CO -0.00 -0.62 1.33 0.20 -1.08 0.00 0.00 175.30 175.13 1k7d s GLY 480 N -3.27 2.88 0.36 3.88 0.00 -1.25 -4.72 107.32 105.19 1k7d s GLY 480 Ca 0.37 1.29 0.10 0.00 0.00 0.00 0.00 44.72 46.48 1k7d s GLY 480 CO 0.21 1.77 1.84 -0.84 0.00 0.00 0.00 173.10 176.08 1k7d h THR 481 N 1.11 0.76 -3.92 0.90 2.02 -0.56 -3.42 112.91 109.80 1k7d h THR 481 Ca -0.51 -0.22 -0.22 0.00 0.77 0.00 0.00 66.41 66.23 1k7d h THR 481 Cb 1.31 0.06 -0.17 0.00 -1.74 0.00 0.00 68.15 67.61 1k7d h THR 481 CO 0.56 0.12 -0.71 -1.83 0.37 0.00 0.00 175.52 174.03 1k7d s GLU 482 N -5.66 0.68 -0.02 6.66 4.04 -1.25 -4.70 118.70 118.45 1k7d s GLU 482 Ca -0.10 -1.10 0.04 0.00 0.04 0.00 0.00 54.97 53.85 1k7d s GLU 482 Cb 0.23 -0.17 -0.01 0.00 0.02 0.00 0.00 34.13 34.20 1k7d s GLU 482 CO 0.79 -0.01 -0.13 -0.80 -1.84 0.00 0.00 175.26 173.27 1k7d s ASN 483 N -2.48 1.58 0.05 0.83 -0.87 -1.25 -3.78 114.94 109.01 1k7d s ASN 483 Ca 0.03 -0.25 0.02 0.00 -1.57 0.00 0.00 52.86 51.09 1k7d s ASN 483 Cb -0.00 -0.25 -0.03 0.00 -0.02 0.00 0.00 41.25 40.95 1k7d s ASN 483 CO -0.04 0.14 -0.07 1.51 -2.57 0.00 0.00 177.10 176.08 1k7d s ASP 484 N -0.18 0.81 -0.02 -1.22 -4.77 -0.97 -2.33 116.67 108.01 1k7d s ASP 484 Ca 0.03 -0.61 0.00 0.00 -3.30 0.00 0.00 52.55 48.67 1k7d s ASP 484 Cb -0.07 0.05 0.02 0.00 -1.09 0.00 0.00 42.92 41.84 1k7d s ASP 484 CO -0.00 -0.25 0.01 -0.32 0.70 0.00 0.00 175.17 175.30 1k7d s MET 485 N -1.88 0.11 -0.10 2.11 1.75 -0.39 -1.16 119.30 119.74 1k7d s MET 485 Ca -0.08 0.07 0.04 0.00 -1.25 0.00 0.00 55.69 54.47 1k7d s MET 485 Cb -0.08 -0.26 0.00 0.00 2.84 0.00 0.00 34.83 37.33 1k7d s MET 485 CO -0.01 -0.08 -0.23 0.42 -0.65 0.00 0.00 175.02 174.47 1k7d s ILE 486 N 0.64 2.00 -0.21 10.11 1.09 -0.07 -1.30 121.20 133.47 1k7d s ILE 486 Ca -0.06 -0.99 0.01 0.00 -1.10 0.00 0.00 60.65 58.51 1k7d s ILE 486 Cb -0.08 -1.73 0.03 0.00 -1.06 0.00 0.00 42.46 39.61 1k7d s ILE 486 CO -0.02 0.55 -0.16 -0.69 -0.10 0.00 0.00 174.94 174.52 1k7d s VAL 487 N 0.34 2.22 0.07 2.92 1.01 0.69 -0.86 120.40 126.79 1k7d s VAL 487 Ca -0.18 -1.09 -0.11 0.00 0.00 0.00 0.00 61.98 60.60 1k7d s VAL 487 Cb -0.18 -2.04 -0.06 0.00 0.00 0.00 0.00 36.38 34.10 1k7d s VAL 487 CO 0.08 0.37 0.42 -0.36 0.00 0.00 0.00 175.10 175.62 1k7d s PHE 488 N 1.26 3.61 -1.44 5.22 0.08 -0.39 -1.51 117.98 124.81 1k7d s PHE 488 Ca 0.01 0.86 -0.12 0.00 0.12 0.00 0.00 56.93 57.81 1k7d s PHE 488 Cb -0.15 -2.21 0.02 0.00 -0.57 0.00 0.00 43.02 40.10 1k7d s PHE 488 CO -0.10 0.53 0.24 0.43 -0.10 0.00 0.00 175.22 176.22 1k7d n SER 489 N 1.07 -0.75 -4.71 1.36 7.64 0.46 -2.04 113.62 116.66 1k7d n SER 489 Ca -0.09 -1.28 -0.42 0.00 1.01 0.00 0.00 58.87 58.09 1k7d n SER 489 Cb 0.52 -1.66 -0.03 0.00 -1.01 0.00 0.00 64.21 62.04 1k7d n SER 489 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1k7d s PRO 490 N -7.39 4.14 0.55 1.43 0.04 -1.26 -4.00 135.00 128.51 1k7d s PRO 490 Ca 0.16 2.56 0.35 0.00 0.04 0.00 0.00 61.00 64.11 1k7d s PRO 490 Cb -0.09 -3.34 1.55 0.00 0.04 0.00 0.00 34.50 32.66 1k7d s PRO 490 CO 0.99 -0.77 2.03 1.79 0.04 0.00 0.00 177.00 181.08 1k7d h THR 491 N 4.27 0.00 -0.55 1.26 1.35 -1.58 -3.21 112.91 114.45 1k7d h THR 491 Ca -0.44 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.05 1k7d h THR 491 Cb 1.21 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.97 1k7d h THR 491 CO 0.95 0.00 0.00 0.35 -0.25 0.00 0.00 175.52 176.57 1k7d n THR 492 N -3.00 2.38 -4.06 6.82 -2.24 -1.26 -4.96 114.28 107.96 1k7d n THR 492 Ca -0.00 -1.41 -0.10 0.00 -2.27 0.00 0.00 64.05 60.27 1k7d n THR 492 Cb 0.25 -0.13 -0.11 0.00 -2.10 0.00 0.00 70.33 68.24 1k7d n THR 492 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1k7d s SER 493 N -1.00 0.66 0.16 3.42 0.15 -1.22 -5.05 113.70 110.83 1k7d s SER 493 Ca 0.51 -0.71 0.26 0.00 0.70 0.00 0.00 55.95 56.71 1k7d s SER 493 Cb 0.37 0.10 0.76 0.00 -1.71 0.00 0.00 66.02 65.54 1k7d s SER 493 CO 0.18 -0.36 1.69 -0.90 1.20 0.00 0.00 173.24 175.05 1k7d n ASP 494 N 0.94 0.70 -4.91 5.45 5.75 -1.26 -4.82 116.55 118.40 1k7d n ASP 494 Ca -0.19 0.46 -0.29 0.00 -0.01 0.00 0.00 54.79 54.76 1k7d n ASP 494 Cb 0.57 -0.55 -0.03 0.00 -1.03 0.00 0.00 41.12 40.08 1k7d n ASP 494 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1k7d s ARG 495 N -3.10 3.59 0.00 0.11 3.00 -1.26 -4.97 118.95 116.31 1k7d s ARG 495 Ca 0.10 -0.16 0.25 0.00 0.00 0.00 0.00 55.73 55.93 1k7d s ARG 495 Cb 0.13 -2.76 1.50 0.00 0.00 0.00 0.00 34.95 33.82 1k7d s ARG 495 CO 0.62 0.34 1.86 -0.35 0.00 0.00 0.00 175.30 177.76 1k7d n PRO 496 N -0.62 0.78 -3.59 3.54 -0.05 -1.26 -4.54 135.00 129.26 1k7d n PRO 496 Ca -0.03 0.00 -0.16 0.00 -0.05 0.00 0.00 63.50 63.26 1k7d n PRO 496 Cb 0.53 -1.50 -0.07 0.00 -0.05 0.00 0.00 33.50 32.42 1k7d n PRO 496 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 175.50 175.99 1k7d s VAL 497 N -2.00 0.01 0.02 0.52 0.11 -1.26 -0.40 120.40 117.39 1k7d s VAL 497 Ca 0.38 -0.05 0.04 0.00 -2.93 0.00 0.00 61.98 59.41 1k7d s VAL 497 Cb 0.17 -0.93 -0.02 0.00 -1.53 0.00 0.00 36.38 34.08 1k7d s VAL 497 CO 0.29 -0.03 -0.12 -0.76 -3.33 0.00 0.00 175.10 171.15 1k7d s LEU 498 N -0.70 2.11 0.04 2.54 1.43 -0.57 -5.00 118.68 118.53 1k7d s LEU 498 Ca -0.08 -0.35 -0.00 0.00 -1.03 0.00 0.00 54.13 52.67 1k7d s LEU 498 Cb -0.02 -0.56 -0.03 0.00 0.03 0.00 0.00 46.19 45.61 1k7d s LEU 498 CO 0.06 0.06 -0.03 0.00 0.23 0.00 0.00 176.35 176.67 1k7d s ALA 499 N -0.63 0.32 0.00 4.21 0.00 -1.26 -0.22 121.76 124.18 1k7d s ALA 499 Ca 0.02 -0.84 -0.10 0.00 0.00 0.00 0.00 51.96 51.03 1k7d s ALA 499 Cb -0.06 0.18 0.01 0.00 0.00 0.00 0.00 23.12 23.25 1k7d s ALA 499 CO 0.00 -0.22 0.20 -1.58 0.00 0.00 0.00 175.76 174.16 1k7d s TRP 500 N -2.38 -0.03 0.36 0.00 0.51 -0.42 -1.60 118.94 115.38 1k7d s TRP 500 Ca -0.07 -0.02 -0.11 0.00 -2.12 0.00 0.00 56.10 53.78 1k7d s TRP 500 Cb -0.03 0.00 0.03 0.00 -0.81 0.00 0.00 33.47 32.66 1k7d s TRP 500 CO -0.04 -0.34 0.65 0.16 -0.51 0.00 0.00 176.95 176.87 1k7d s ASP 501 N -1.47 0.31 -0.14 2.95 -4.77 -0.46 -1.26 116.67 111.84 1k7d s ASP 501 Ca -0.13 -1.22 -0.06 0.00 -3.30 0.00 0.00 52.55 47.84 1k7d s ASP 501 Cb -0.06 0.76 0.06 0.00 -1.09 0.00 0.00 42.92 42.59 1k7d s ASP 501 CO 0.02 -1.50 0.30 0.54 0.70 0.00 0.00 175.17 175.23 1k7d s VAL 502 N -2.77 -0.29 -0.47 2.11 0.11 -0.98 -1.73 120.40 116.37 1k7d s VAL 502 Ca 0.21 0.20 0.03 0.00 -2.93 0.00 0.00 61.98 59.49 1k7d s VAL 502 Cb -0.03 -0.48 0.13 0.00 -1.53 0.00 0.00 36.38 34.48 1k7d s VAL 502 CO 0.14 0.09 0.25 -0.69 -3.33 0.00 0.00 175.10 171.55 1k7d s VAL 503 N 1.98 1.88 0.13 2.04 1.01 -1.26 -3.89 120.40 122.28 1k7d s VAL 503 Ca -0.04 -2.86 -0.05 0.00 0.00 0.00 0.00 61.98 59.04 1k7d s VAL 503 Cb -0.11 -2.31 -0.05 0.00 0.00 0.00 0.00 36.38 33.90 1k7d s VAL 503 CO -0.10 -0.85 0.36 0.00 0.00 0.00 0.00 175.10 174.51 1k7d s ALA 504 N 0.10 3.81 0.20 5.51 0.00 -1.26 -2.51 121.76 127.60 1k7d s ALA 504 Ca 0.17 -0.57 0.16 0.00 0.00 0.00 0.00 51.96 51.72 1k7d s ALA 504 Cb -0.25 -2.11 0.59 0.00 0.00 0.00 0.00 23.12 21.35 1k7d s ALA 504 CO 0.00 0.68 1.70 -1.35 0.00 0.00 0.00 175.76 176.79 1k7d h PRO 505 N 2.94 0.00 -1.98 0.00 0.11 -1.85 -3.37 132.00 127.85 1k7d h PRO 505 Ca -0.46 0.00 0.26 0.00 0.11 0.00 0.00 66.00 65.91 1k7d h PRO 505 Cb 1.17 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.19 1k7d h PRO 505 CO 0.72 0.44 0.71 0.20 -0.21 0.00 0.00 178.00 179.87 1k7d s GLY 506 N -4.39 -0.22 0.28 -0.55 0.00 -1.04 -0.61 107.32 100.79 1k7d s GLY 506 Ca -0.00 0.25 0.00 0.00 0.00 0.00 0.00 44.72 44.97 1k7d s GLY 506 CO 0.71 1.42 1.79 -1.61 0.00 0.00 0.00 173.10 175.41 1k7d h GLN 507 N 2.00 0.70 -6.05 2.90 5.75 -1.68 -3.40 115.11 115.34 1k7d h GLN 507 Ca -0.27 -0.18 -0.67 0.00 -0.15 0.00 0.00 58.65 57.38 1k7d h GLN 507 Cb 1.21 -0.09 -0.13 0.00 1.07 0.00 0.00 27.48 29.54 1k7d h GLN 507 CO 0.30 0.72 -0.62 0.45 -2.65 0.00 0.00 178.83 177.02 1k7d s SER 508 N -6.67 5.27 0.00 -0.69 0.15 -0.60 -4.91 113.70 106.25 1k7d s SER 508 Ca -0.09 0.09 0.11 0.00 0.70 0.00 0.00 55.95 56.76 1k7d s SER 508 Cb 0.15 -1.45 0.27 0.00 -1.71 0.00 0.00 66.02 63.28 1k7d s SER 508 CO 0.80 0.32 1.19 0.61 1.20 0.00 0.00 173.24 177.35 1k7d n GLY 509 N 1.67 2.22 3.73 9.45 0.00 -1.26 -3.96 105.19 117.05 1k7d n GLY 509 Ca -0.16 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.08 1k7d n GLY 509 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1k7d s PHE 510 N -0.99 3.66 -0.08 1.61 5.36 -1.26 -4.99 117.98 121.29 1k7d s PHE 510 Ca 0.22 1.65 -0.01 0.00 -0.96 0.00 0.00 56.93 57.83 1k7d s PHE 510 Cb 0.12 -3.21 0.03 0.00 -0.34 0.00 0.00 43.02 39.61 1k7d s PHE 510 CO 0.16 -0.37 -0.03 0.42 -1.46 0.00 0.00 175.22 173.94 1k7d s ILE 511 N -0.15 0.59 1.03 3.12 1.01 -1.26 -1.44 121.20 124.10 1k7d s ILE 511 Ca 0.49 -0.02 -0.11 0.00 0.00 0.00 0.00 60.65 61.00 1k7d s ILE 511 Cb -0.28 -0.70 0.21 0.00 0.01 0.00 0.00 42.46 41.70 1k7d s ILE 511 CO 0.33 0.29 1.10 0.00 0.00 0.00 0.00 174.94 176.66 1k7d n ALA 512 N 5.02 -1.68 -0.15 9.38 0.00 -0.48 -4.84 120.51 127.76 1k7d n ALA 512 Ca -0.10 -0.82 0.13 0.00 0.00 0.00 0.00 53.44 52.65 1k7d n ALA 512 Cb 0.50 -2.12 0.47 0.00 0.00 0.00 0.00 19.45 18.30 1k7d n ALA 512 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1k7d h PRO 513 N -2.24 0.47 -0.03 0.00 0.11 -2.01 -0.83 132.00 127.48 1k7d h PRO 513 Ca -0.51 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1k7d h PRO 513 Cb 1.30 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1k7d h PRO 513 CO 0.44 0.31 0.00 -0.40 -0.21 0.00 0.00 178.00 178.15 1k7d n ASP 514 N -4.48 0.20 0.00 -2.05 5.68 -1.26 -4.87 116.55 109.76 1k7d n ASP 514 Ca 0.13 -1.69 0.00 0.00 -0.50 0.00 0.00 54.79 52.73 1k7d n ASP 514 Cb 0.44 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.40 1k7d n ASP 514 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1k7d n GLY 515 N 0.71 0.70 3.65 6.12 0.00 -0.31 -5.02 105.19 111.04 1k7d n GLY 515 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 1k7d n GLY 515 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k7d s THR 516 N -2.73 4.04 0.41 2.61 2.01 -1.26 -4.80 115.64 115.93 1k7d s THR 516 Ca 0.00 1.24 -0.22 0.00 0.31 0.00 0.00 61.69 63.01 1k7d s THR 516 Cb 0.00 -3.87 -0.10 0.00 0.01 0.00 0.00 72.50 68.54 1k7d s THR 516 CO 0.00 -0.19 0.99 -0.69 -0.69 0.00 0.00 174.62 174.03 1k7d s VAL 517 N 3.96 4.11 0.55 3.82 1.01 -1.26 -1.38 120.40 131.20 1k7d s VAL 517 Ca 0.61 1.45 -0.19 0.00 0.00 0.00 0.00 61.98 63.84 1k7d s VAL 517 Cb -0.24 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 1k7d s VAL 517 CO 0.21 -0.15 1.15 -0.62 0.00 0.00 0.00 175.10 175.69 1k7d s ASP 518 N -1.91 5.60 0.36 3.32 2.15 -0.52 -4.92 116.67 120.74 1k7d s ASP 518 Ca 0.60 2.24 0.17 0.00 0.43 0.00 0.00 52.55 55.99 1k7d s ASP 518 Cb -0.15 -2.59 1.18 0.00 -0.30 0.00 0.00 42.92 41.07 1k7d s ASP 518 CO 0.19 -1.30 1.64 0.50 -0.17 0.00 0.00 175.17 176.03 1k7d h LYS 519 N 1.15 0.22 -0.92 4.34 3.64 -1.95 0.10 116.57 123.14 1k7d h LYS 519 Ca -0.50 -0.01 -0.61 0.00 -1.27 0.00 0.00 60.65 58.26 1k7d h LYS 519 Cb 1.27 -0.05 -0.37 0.00 -0.41 0.00 0.00 32.23 32.67 1k7d h LYS 519 CO 0.57 0.14 -0.09 0.72 -2.27 0.00 0.00 179.45 178.52 1k7d n HIS 520 N -5.08 2.98 0.05 1.91 8.25 -1.26 -4.59 115.22 117.48 1k7d n HIS 520 Ca 0.34 -2.58 -0.06 0.00 -0.26 0.00 0.00 57.72 55.16 1k7d n HIS 520 Cb 1.10 -0.79 -0.10 0.00 1.12 0.00 0.00 29.99 31.31 1k7d n HIS 520 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1k7d h TYR 521 N 2.16 0.00 0.00 4.41 3.20 -1.09 -1.55 116.97 124.09 1k7d h TYR 521 Ca 0.47 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.34 1k7d h TYR 521 Cb 1.18 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.45 1k7d h TYR 521 CO 1.09 0.91 -0.17 -0.85 -1.64 0.00 0.00 178.16 177.51 1k7d n GLU 522 N -3.25 0.00 -0.00 1.82 0.28 -1.26 -3.76 120.64 114.47 1k7d n GLU 522 Ca -0.03 -0.62 0.00 0.00 -0.16 0.00 0.00 57.16 56.35 1k7d n GLU 522 Cb 0.93 -0.45 0.00 0.00 1.43 0.00 0.00 31.44 33.35 1k7d n GLU 522 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1k7d n ASP 523 N 0.00 0.21 0.00 -1.84 5.75 -1.18 -2.94 116.55 116.55 1k7d n ASP 523 Ca 0.00 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.78 1k7d n ASP 523 Cb 0.57 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.57 1k7d n ASP 523 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1k7d n GLN 524 N -0.40 0.92 0.01 0.11 6.02 0.22 -4.79 117.38 119.47 1k7d n GLN 524 Ca 0.00 -0.86 -0.12 0.00 -0.01 0.00 0.00 57.00 56.02 1k7d n GLN 524 Cb 0.05 -0.87 0.00 0.00 1.02 0.00 0.00 30.24 30.44 1k7d n GLN 524 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1k7d h LEU 525 N 0.00 0.67 0.01 1.08 5.85 -1.36 -1.88 115.31 119.67 1k7d h LEU 525 Ca 0.00 -0.41 -0.25 0.00 0.84 0.00 0.00 57.88 58.06 1k7d h LEU 525 Cb 0.41 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 1k7d h LEU 525 CO 0.00 1.17 -1.33 0.11 -0.34 0.00 0.00 178.44 178.05 1k7d h LYS 526 N 0.40 0.01 -0.90 1.25 1.79 -1.87 -3.00 116.57 114.26 1k7d h LYS 526 Ca -0.03 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 58.40 1k7d h LYS 526 Cb 1.28 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.90 1k7d h LYS 526 CO 0.13 0.79 0.49 1.98 -1.08 0.00 0.00 179.45 181.76 1k7d h MET 527 N 0.00 1.26 0.45 3.15 4.05 -1.85 -2.22 114.93 119.77 1k7d h MET 527 Ca -0.14 -0.15 -0.02 0.00 -0.28 0.00 0.00 59.70 59.11 1k7d h MET 527 Cb 1.89 -0.25 0.00 0.00 -0.80 0.00 0.00 31.60 32.45 1k7d h MET 527 CO 0.11 0.92 -0.22 -0.92 0.23 0.00 0.00 176.91 177.03 1k7d h TYR 528 N 1.26 -0.56 -0.83 1.39 3.20 -1.32 0.92 116.97 121.03 1k7d h TYR 528 Ca 0.32 -0.01 0.20 0.00 3.14 0.00 0.00 58.73 62.38 1k7d h TYR 528 Cb 0.03 0.19 -0.14 0.00 1.54 0.00 0.00 36.73 38.34 1k7d h TYR 528 CO 0.01 -0.31 0.06 1.49 -1.64 0.00 0.00 178.16 177.77 1k7d h GLU 529 N -0.68 0.11 -0.83 1.82 4.81 -1.35 -2.53 114.58 115.93 1k7d h GLU 529 Ca -0.06 -0.01 -0.25 0.00 -0.13 0.00 0.00 59.36 58.92 1k7d h GLU 529 Cb 0.51 -0.03 -0.15 0.00 0.63 0.00 0.00 28.75 29.71 1k7d h GLU 529 CO 0.10 0.07 0.31 0.27 -0.73 0.00 0.00 179.01 179.04 1k7d n ASN 530 N -5.34 4.33 -3.50 1.04 0.23 -0.86 -4.91 115.26 106.24 1k7d n ASN 530 Ca 0.17 -3.13 -0.26 0.00 -0.53 0.00 0.00 54.58 50.83 1k7d n ASN 530 Cb 0.57 -0.74 0.02 0.00 -2.08 0.00 0.00 39.78 37.56 1k7d n ASN 530 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1k7d n PHE 531 N -0.26 -2.10 -2.48 -2.53 3.72 -0.95 -5.00 117.46 107.86 1k7d n PHE 531 Ca 0.39 0.68 -0.24 0.00 -0.05 0.00 0.00 57.45 58.23 1k7d n PHE 531 Cb 1.32 -3.83 0.10 0.00 -0.94 0.00 0.00 39.48 36.14 1k7d n PHE 531 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1k7d s GLY 532 N -2.97 1.76 0.12 1.37 0.00 0.31 -5.05 107.32 102.86 1k7d s GLY 532 Ca 0.49 -1.55 -0.24 0.00 0.00 0.00 0.00 44.72 43.42 1k7d s GLY 532 CO 0.61 -1.01 0.60 1.09 0.00 0.00 0.00 173.10 174.39 1k7d s ARG 533 N -5.19 1.22 0.14 2.90 1.70 -1.26 -4.65 118.95 113.80 1k7d s ARG 533 Ca 0.66 -0.36 0.10 0.00 -0.47 0.00 0.00 55.73 55.66 1k7d s ARG 533 Cb -0.06 0.56 -0.04 0.00 -0.57 0.00 0.00 34.95 34.84 1k7d s ARG 533 CO 0.45 -0.51 -0.21 -1.59 -1.08 0.00 0.00 175.30 172.36 1k7d s LYS 534 N -3.28 1.66 0.35 3.89 -2.85 -0.71 -4.94 119.74 113.86 1k7d s LYS 534 Ca -0.01 -1.30 -0.27 0.00 -1.00 0.00 0.00 55.97 53.39 1k7d s LYS 534 Cb -0.01 -2.01 -0.09 0.00 -2.06 0.00 0.00 37.83 33.66 1k7d s LYS 534 CO -0.09 0.45 1.12 -1.12 0.10 0.00 0.00 175.35 175.82 1k7d s SER 535 N -2.28 6.88 -0.19 0.03 0.01 -1.26 -1.36 113.70 115.53 1k7d s SER 535 Ca 0.18 2.27 -0.10 0.00 1.31 0.00 0.00 55.95 59.61 1k7d s SER 535 Cb -0.10 -2.62 -0.05 0.00 0.21 0.00 0.00 66.02 63.47 1k7d s SER 535 CO 0.09 -0.42 0.14 -0.76 0.41 0.00 0.00 173.24 172.71 1k7d s LEU 536 N -2.07 4.22 0.01 2.44 1.43 -0.62 -4.86 118.68 119.24 1k7d s LEU 536 Ca 0.52 0.26 -0.02 0.00 -1.03 0.00 0.00 54.13 53.87 1k7d s LEU 536 Cb -0.30 -2.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.77 1k7d s LEU 536 CO 0.38 0.19 0.17 0.26 0.23 0.00 0.00 176.35 177.58 1k7d s TRP 537 N 0.29 3.49 0.09 0.29 0.23 -1.26 -4.39 118.94 117.69 1k7d s TRP 537 Ca 0.09 0.30 -0.00 0.00 -2.03 0.00 0.00 56.10 54.46 1k7d s TRP 537 Cb -0.11 -1.79 -0.00 0.00 0.03 0.00 0.00 33.47 31.60 1k7d s TRP 537 CO -0.01 0.62 -0.00 -0.11 0.96 0.00 0.00 176.95 178.40 1k7d n LEU 538 N 0.80 1.01 -4.76 2.99 7.94 -1.26 -4.70 117.00 119.02 1k7d n LEU 538 Ca -0.10 0.13 -0.38 0.00 -1.11 0.00 0.00 56.01 54.55 1k7d n LEU 538 Cb 0.52 -0.31 0.03 0.00 0.53 0.00 0.00 43.42 44.19 1k7d n LEU 538 CO 0.45 -0.73 0.95 0.42 -1.11 0.00 0.00 177.39 177.37 1k7d s THR 539 N -1.90 2.34 0.37 1.96 -4.23 -1.26 -4.80 115.64 108.12 1k7d s THR 539 Ca -0.00 0.26 0.16 0.00 -1.18 0.00 0.00 61.69 60.92 1k7d s THR 539 Cb 0.00 -3.13 0.37 0.00 1.34 0.00 0.00 72.50 71.08 1k7d s THR 539 CO 0.00 -0.00 1.76 0.11 -0.54 0.00 0.00 174.62 175.95 1k7d h LYS 540 N 1.63 0.45 -0.19 3.99 1.57 -1.98 0.13 116.57 122.15 1k7d h LYS 540 Ca -0.50 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.20 1k7d h LYS 540 Cb 1.29 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 1k7d h LYS 540 CO 0.58 0.29 -0.06 0.37 -0.57 0.00 0.00 179.45 180.06 1k7d h GLN 541 N 0.46 0.39 -0.61 3.15 4.15 -1.99 -1.22 115.11 119.43 1k7d h GLN 541 Ca 0.61 -0.15 -0.08 0.00 0.77 0.00 0.00 58.65 59.79 1k7d h GLN 541 Cb 1.41 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 29.05 1k7d h GLN 541 CO -0.34 0.65 0.05 -0.44 -1.93 0.00 0.00 178.83 176.82 1k7d h ASP 542 N 0.10 1.00 -0.36 -0.69 3.32 -1.36 -2.88 116.42 115.54 1k7d h ASP 542 Ca 0.05 -0.25 -0.10 0.00 0.02 0.00 0.00 57.03 56.75 1k7d h ASP 542 Cb 0.52 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 1k7d h ASP 542 CO 0.02 1.02 -0.13 0.58 -1.72 0.00 0.00 179.24 179.02 1k7d h VAL 543 N 0.96 1.26 -0.07 -1.35 2.07 -0.71 -3.00 116.25 115.42 1k7d h VAL 543 Ca 0.18 -1.21 -0.12 0.00 0.82 0.00 0.00 66.70 66.37 1k7d h VAL 543 Cb 0.48 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1k7d h VAL 543 CO 0.02 0.41 -0.52 -0.33 0.02 0.00 0.00 177.57 177.18 1k7d h GLU 544 N 0.73 0.18 -0.00 1.57 4.39 -1.15 -2.11 114.58 118.18 1k7d h GLU 544 Ca 0.12 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1k7d h GLU 544 Cb 0.62 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 1k7d h GLU 544 CO 0.04 0.65 -0.22 0.00 -1.16 0.00 0.00 179.01 178.33 1k7d n ALA 545 N -2.46 2.91 -0.58 3.43 0.00 -1.09 -3.33 120.51 119.38 1k7d n ALA 545 Ca -0.02 -0.25 0.05 0.00 0.00 0.00 0.00 53.44 53.22 1k7d n ALA 545 Cb 0.55 -1.30 0.07 0.00 0.00 0.00 0.00 19.45 18.77 1k7d n ALA 545 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1k7d n HIS 546 N -1.30 0.00 -1.75 0.00 8.25 -1.12 -5.06 115.22 114.23 1k7d n HIS 546 Ca 0.09 -0.71 -0.40 0.00 -0.26 0.00 0.00 57.72 56.44 1k7d n HIS 546 Cb 0.32 -0.10 0.01 0.00 1.12 0.00 0.00 29.99 31.35 1k7d n HIS 546 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1k7d n LYS 547 N -0.92 2.24 0.00 -0.41 4.81 -0.81 -4.93 118.16 118.15 1k7d n LYS 547 Ca 0.08 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.31 1k7d n LYS 547 Cb 0.45 -2.58 0.00 0.00 0.02 0.00 0.00 35.03 32.92 1k7d n LYS 547 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 1k7d n GLU 548 N -0.06 0.54 -3.51 1.64 0.28 -1.26 -5.09 120.64 113.18 1k7d n GLU 548 Ca 0.05 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 56.96 1k7d n GLU 548 Cb 0.41 -0.96 -0.02 0.00 1.43 0.00 0.00 31.44 32.30 1k7d n GLU 548 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1k7d s SER 549 N -1.92 -0.40 -0.20 -1.84 1.04 -1.26 -5.18 113.70 103.94 1k7d s SER 549 Ca 0.00 -0.04 -0.23 0.00 0.48 0.00 0.00 55.95 56.16 1k7d s SER 549 Cb 0.00 0.45 0.06 0.00 0.10 0.00 0.00 66.02 66.63 1k7d s SER 549 CO 0.00 -0.74 0.63 -1.58 0.98 0.00 0.00 173.24 172.53 1k7d s GLN 550 N -3.30 0.79 -0.07 4.02 0.74 -1.26 -5.17 119.66 115.41 1k7d s GLN 550 Ca 0.05 0.73 -0.07 0.00 0.05 0.00 0.00 55.36 56.12 1k7d s GLN 550 Cb -0.01 0.38 0.02 0.00 1.10 0.00 0.00 33.01 34.50 1k7d s GLN 550 CO -0.09 -0.13 0.19 -2.00 -0.55 0.00 0.00 175.29 172.71 1k7d s GLU 551 N 0.00 0.22 -0.17 1.67 2.12 -1.26 -5.15 118.70 116.14 1k7d s GLU 551 Ca -0.02 0.28 0.01 0.00 0.36 0.00 0.00 54.97 55.59 1k7d s GLU 551 Cb -0.04 0.10 0.02 0.00 0.26 0.00 0.00 34.13 34.47 1k7d s GLU 551 CO 0.03 -0.03 -0.18 0.08 -0.54 0.00 0.00 175.26 174.61 1k7d s VAL 552 N 0.16 1.90 0.00 3.70 1.01 -1.26 -5.13 120.40 120.78 1k7d s VAL 552 Ca -0.00 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 61.11 1k7d s VAL 552 Cb -0.02 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 1k7d s VAL 552 CO -0.00 0.50 0.13 -0.76 0.00 0.00 0.00 175.10 174.97 1k7d s LEU 553 N 1.35 4.12 -0.19 3.92 1.43 -1.26 -5.11 118.68 122.94 1k7d s LEU 553 Ca 0.05 0.23 0.01 0.00 -1.03 0.00 0.00 54.13 53.38 1k7d s LEU 553 Cb -0.13 -2.47 0.04 0.00 0.03 0.00 0.00 46.19 43.65 1k7d s LEU 553 CO -0.12 0.25 -0.12 -1.00 0.23 0.00 0.00 176.35 175.60 1k7d s HIS 554 N -1.28 2.46 -0.03 0.29 3.76 -1.26 -5.12 115.29 114.11 1k7d s HIS 554 Ca 0.26 -1.58 -0.12 0.00 -0.15 0.00 0.00 55.06 53.47 1k7d s HIS 554 Cb -0.12 -1.67 0.02 0.00 1.11 0.00 0.00 32.58 31.91 1k7d s HIS 554 CO 0.17 -0.75 0.26 0.08 -0.85 0.00 0.00 174.74 173.66 1k7d s VAL 555 N 1.38 0.05 0.04 -0.90 1.01 -1.26 -5.15 120.40 115.57 1k7d s VAL 555 Ca -0.00 -0.43 0.08 0.00 0.00 0.00 0.00 61.98 61.62 1k7d s VAL 555 Cb -0.16 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.67 1k7d s VAL 555 CO -0.09 -0.24 -0.22 -1.10 0.00 0.00 0.00 175.10 173.45 1k7d s GLN 556 N -1.05 1.53 0.00 2.72 -1.52 -1.26 -5.36 119.66 114.73 1k7d s GLN 556 Ca -0.11 -0.97 0.29 0.00 -1.95 0.00 0.00 55.36 52.62 1k7d s GLN 556 Cb -0.05 -1.64 1.73 0.00 -0.22 0.00 0.00 33.01 32.82 1k7d s GLN 556 CO 0.03 0.42 2.06 -2.13 -0.25 0.00 0.00 175.29 175.43