#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k1d n THR 2 N 0.00 1.85 -4.12 2.03 -1.04 -1.26 -4.96 114.28 106.78 1k1d n THR 2 Ca 0.00 -0.50 -0.09 0.00 -2.04 0.00 0.00 64.05 61.42 1k1d n THR 2 Cb 0.00 -0.48 -0.10 0.00 -1.82 0.00 0.00 70.33 67.93 1k1d n THR 2 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1k1d s LYS 3 N -1.35 0.70 -0.10 -2.82 1.02 -0.90 -4.07 119.74 112.22 1k1d s LYS 3 Ca 0.62 -1.23 -0.03 0.00 0.02 0.00 0.00 55.97 55.34 1k1d s LYS 3 Cb -0.74 0.00 0.05 0.00 -0.52 0.00 0.00 37.83 36.61 1k1d s LYS 3 CO 0.58 -0.06 0.09 0.42 -0.92 0.00 0.00 175.35 175.46 1k1d s ILE 4 N -3.60 -0.13 -0.46 2.17 1.01 -1.06 -0.56 121.20 118.57 1k1d s ILE 4 Ca 0.08 0.18 -0.17 0.00 0.00 0.00 0.00 60.65 60.74 1k1d s ILE 4 Cb 0.05 -0.35 0.05 0.00 0.01 0.00 0.00 42.46 42.23 1k1d s ILE 4 CO -0.07 -0.01 0.45 -0.63 0.00 0.00 0.00 174.94 174.68 1k1d s ILE 5 N 2.18 5.11 0.33 2.92 1.01 -0.42 0.11 121.20 132.43 1k1d s ILE 5 Ca 0.04 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 60.09 1k1d s ILE 5 Cb -0.14 -4.12 -0.03 0.00 0.01 0.00 0.00 42.46 38.18 1k1d s ILE 5 CO -0.06 -0.56 0.21 -1.59 0.00 0.00 0.00 174.94 172.94 1k1d s LYS 6 N 2.03 2.57 -2.05 2.79 -2.85 0.01 -1.39 119.74 120.84 1k1d s LYS 6 Ca 0.09 -1.39 0.00 0.00 -1.00 0.00 0.00 55.97 53.68 1k1d s LYS 6 Cb -0.20 -2.34 0.00 0.00 -2.06 0.00 0.00 37.83 33.22 1k1d s LYS 6 CO 0.10 0.14 0.00 0.09 0.10 0.00 0.00 175.35 175.78 1k1d n ASN 7 N -1.24 -5.41 -4.98 0.03 3.02 -1.26 0.03 115.26 105.45 1k1d n ASN 7 Ca -0.03 0.43 -0.19 0.00 -0.03 0.00 0.00 54.58 54.76 1k1d n ASN 7 Cb 0.60 -4.63 -0.01 0.00 -0.61 0.00 0.00 39.78 35.14 1k1d n ASN 7 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1k1d s GLY 8 N -2.71 1.57 -0.34 7.41 0.00 -1.25 -2.93 107.32 109.06 1k1d s GLY 8 Ca 0.00 -1.45 -0.11 0.00 0.00 0.00 0.00 44.72 43.16 1k1d s GLY 8 CO 0.00 -1.38 0.19 -1.59 0.00 0.00 0.00 173.10 170.32 1k1d s THR 9 N -2.16 4.66 0.11 0.90 2.01 -0.30 -3.29 115.64 117.56 1k1d s THR 9 Ca 0.43 -0.60 -0.30 0.00 0.31 0.00 0.00 61.69 61.54 1k1d s THR 9 Cb -0.09 -3.48 -0.06 0.00 0.01 0.00 0.00 72.50 68.88 1k1d s THR 9 CO 0.30 -0.08 1.00 -0.63 -0.69 0.00 0.00 174.62 174.53 1k1d s ILE 10 N 1.60 4.40 -0.28 1.82 1.01 0.40 -0.85 121.20 129.30 1k1d s ILE 10 Ca 0.04 1.95 -0.02 0.00 0.00 0.00 0.00 60.65 62.61 1k1d s ILE 10 Cb -0.18 -4.25 0.09 0.00 0.01 0.00 0.00 42.46 38.14 1k1d s ILE 10 CO 0.07 0.28 0.10 -0.69 0.00 0.00 0.00 174.94 174.70 1k1d s VAL 11 N 0.14 0.43 0.03 2.92 1.01 -1.05 -0.75 120.40 123.15 1k1d s VAL 11 Ca 0.49 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.46 1k1d s VAL 11 Cb -0.25 -1.29 0.01 0.00 0.00 0.00 0.00 36.38 34.85 1k1d s VAL 11 CO 0.30 -0.63 0.04 0.35 0.00 0.00 0.00 175.10 175.17 1k1d n THR 12 N 5.04 0.00 0.45 3.92 -2.24 0.59 -4.42 114.28 117.63 1k1d n THR 12 Ca -0.05 -0.08 0.10 0.00 -2.27 0.00 0.00 64.05 61.75 1k1d n THR 12 Cb 0.43 -1.19 0.41 0.00 -2.10 0.00 0.00 70.33 67.89 1k1d n THR 12 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k1d n ALA 13 N -2.98 1.68 0.00 6.98 0.00 -1.26 -4.02 120.51 120.91 1k1d n ALA 13 Ca -0.01 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1k1d n ALA 13 Cb 0.03 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.15 1k1d n ALA 13 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1k1d n THR 14 N -1.91 0.00 -3.77 0.00 -1.04 -1.26 -4.58 114.28 101.72 1k1d n THR 14 Ca 0.03 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.82 1k1d n THR 14 Cb 0.21 -0.62 -0.02 0.00 -1.82 0.00 0.00 70.33 68.08 1k1d n THR 14 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1k1d s ASP 15 N -4.13 6.29 -0.27 8.00 1.01 -1.26 -5.01 116.67 121.30 1k1d s ASP 15 Ca 0.00 0.17 0.00 0.00 0.71 0.00 0.00 52.55 53.43 1k1d s ASP 15 Cb 0.00 -1.88 0.15 0.00 1.01 0.00 0.00 42.92 42.20 1k1d s ASP 15 CO 0.00 -0.15 0.37 -0.89 0.21 0.00 0.00 175.17 174.70 1k1d s THR 16 N -2.09 -0.56 0.26 -1.27 2.01 -1.25 -0.30 115.64 112.45 1k1d s THR 16 Ca 0.36 -0.28 -0.10 0.00 0.31 0.00 0.00 61.69 61.99 1k1d s THR 16 Cb -0.09 -0.93 -0.01 0.00 0.01 0.00 0.00 72.50 71.48 1k1d s THR 16 CO 0.31 -0.28 0.45 -0.72 -0.69 0.00 0.00 174.62 173.69 1k1d s TYR 17 N 2.49 0.57 -0.18 4.92 1.13 0.08 -4.96 117.35 121.40 1k1d s TYR 17 Ca 0.10 -0.90 -0.04 0.00 -1.41 0.00 0.00 57.07 54.82 1k1d s TYR 17 Cb -0.14 0.08 -0.03 0.00 -1.10 0.00 0.00 41.96 40.77 1k1d s TYR 17 CO -0.26 -1.00 -0.02 -1.21 -2.51 0.00 0.00 175.55 170.55 1k1d s GLU 18 N -3.81 3.67 0.13 -3.49 2.02 -1.26 0.15 118.70 116.11 1k1d s GLU 18 Ca 0.26 -0.51 -0.24 0.00 0.02 0.00 0.00 54.97 54.50 1k1d s GLU 18 Cb 0.00 -3.00 0.08 0.00 0.10 0.00 0.00 34.13 31.31 1k1d s GLU 18 CO 0.11 0.15 1.11 0.00 0.02 0.00 0.00 175.26 176.66 1k1d s ALA 19 N 0.61 -1.85 0.14 5.21 0.00 -1.21 -4.83 121.76 119.84 1k1d s ALA 19 Ca -0.01 -0.21 0.08 0.00 0.00 0.00 0.00 51.96 51.81 1k1d s ALA 19 Cb -0.14 0.79 -0.04 0.00 0.00 0.00 0.00 23.12 23.73 1k1d s ALA 19 CO 0.02 -1.09 -0.10 -1.01 0.00 0.00 0.00 175.76 173.58 1k1d s HIS 20 N -2.14 2.68 -0.16 0.00 3.76 0.59 -3.92 115.29 116.10 1k1d s HIS 20 Ca 0.24 -0.19 -0.01 0.00 -0.15 0.00 0.00 55.06 54.94 1k1d s HIS 20 Cb -0.02 -1.37 -0.01 0.00 1.11 0.00 0.00 32.58 32.29 1k1d s HIS 20 CO 0.03 0.46 -0.10 -0.51 -0.85 0.00 0.00 174.74 173.77 1k1d s LEU 21 N -2.46 2.79 -0.42 0.89 1.43 -0.49 -2.04 118.68 118.38 1k1d s LEU 21 Ca 0.22 -0.34 -0.15 0.00 -1.03 0.00 0.00 54.13 52.83 1k1d s LEU 21 Cb -0.10 -1.66 0.03 0.00 0.03 0.00 0.00 46.19 44.49 1k1d s LEU 21 CO 0.14 0.11 0.33 -0.22 0.23 0.00 0.00 176.35 176.94 1k1d s LEU 22 N 0.70 5.16 -0.01 1.79 2.96 0.15 -1.30 118.68 128.13 1k1d s LEU 22 Ca -0.05 -0.94 -0.18 0.00 -0.22 0.00 0.00 54.13 52.74 1k1d s LEU 22 Cb -0.15 -2.19 -0.05 0.00 0.50 0.00 0.00 46.19 44.29 1k1d s LEU 22 CO 0.02 -0.50 0.52 -0.63 -1.32 0.00 0.00 176.35 174.44 1k1d s ILE 23 N 1.73 4.97 0.00 6.68 1.01 0.27 -0.52 121.20 135.34 1k1d s ILE 23 Ca 0.06 1.07 0.00 0.00 0.00 0.00 0.00 60.65 61.78 1k1d s ILE 23 Cb -0.20 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.43 1k1d s ILE 23 CO 0.10 0.46 0.00 1.17 0.00 0.00 0.00 174.94 176.67 1k1d n LYS 24 N 2.52 0.00 -0.55 2.79 3.00 0.06 -2.12 118.16 123.87 1k1d n LYS 24 Ca -0.09 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.18 1k1d n LYS 24 Cb 0.51 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.49 1k1d n LYS 24 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1k1d n ASP 25 N 0.00 4.20 0.00 3.14 9.92 -1.26 -4.39 116.55 128.16 1k1d n ASP 25 Ca 0.00 -2.18 0.00 0.00 -0.53 0.00 0.00 54.79 52.08 1k1d n ASP 25 Cb 0.00 -0.98 0.00 0.00 -0.64 0.00 0.00 41.12 39.50 1k1d n ASP 25 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1k1d n GLY 26 N 1.99 0.67 3.51 0.44 0.00 -1.26 -4.99 105.19 105.56 1k1d n GLY 26 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 1k1d n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k1d s LYS 27 N -0.12 1.75 -0.38 1.61 1.02 -1.26 -0.38 119.74 121.97 1k1d s LYS 27 Ca 0.00 -1.95 -0.28 0.00 0.02 0.00 0.00 55.97 53.76 1k1d s LYS 27 Cb 0.00 -1.29 0.02 0.00 -0.52 0.00 0.00 37.83 36.04 1k1d s LYS 27 CO 0.00 -0.05 1.02 0.42 -0.92 0.00 0.00 175.35 175.82 1k1d s ILE 28 N -2.95 4.47 -0.09 2.17 1.01 -0.41 -0.76 121.20 124.65 1k1d s ILE 28 Ca 0.34 1.36 -0.25 0.00 0.00 0.00 0.00 60.65 62.09 1k1d s ILE 28 Cb 0.07 -4.42 -0.28 0.00 0.01 0.00 0.00 42.46 37.84 1k1d s ILE 28 CO 0.16 -0.64 0.86 0.00 0.00 0.00 0.00 174.94 175.32 1k1d h ALA 29 N 8.54 -0.03 -2.41 9.38 0.00 -1.13 -0.45 119.26 133.16 1k1d h ALA 29 Ca -0.22 -0.58 0.02 0.00 0.00 0.00 0.00 54.91 54.12 1k1d h ALA 29 Cb 1.07 0.04 -0.16 0.00 0.00 0.00 0.00 17.79 18.74 1k1d h ALA 29 CO 1.03 0.17 0.32 0.00 0.00 0.00 0.00 179.25 180.77 1k1d s MET 30 N -2.44 1.03 -0.00 0.00 0.23 -1.09 -4.79 119.30 112.23 1k1d s MET 30 Ca -0.16 -0.18 0.07 0.00 -1.03 0.00 0.00 55.69 54.38 1k1d s MET 30 Cb -0.01 0.48 -0.02 0.00 -1.53 0.00 0.00 34.83 33.75 1k1d s MET 30 CO 0.76 -0.41 -0.20 0.42 -2.03 0.00 0.00 175.02 173.56 1k1d s ILE 31 N -2.67 1.62 -2.21 3.16 1.01 -1.26 -0.67 121.20 120.17 1k1d s ILE 31 Ca -0.01 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 59.69 1k1d s ILE 31 Cb -0.01 -1.36 0.00 0.00 0.01 0.00 0.00 42.46 41.10 1k1d s ILE 31 CO -0.05 0.39 0.00 0.61 0.00 0.00 0.00 174.94 175.89 1k1d n GLY 32 N 2.39 -1.69 3.71 6.18 0.00 -0.86 -4.96 105.19 109.95 1k1d n GLY 32 Ca -0.16 -1.09 -0.29 0.00 0.00 0.00 0.00 46.02 44.48 1k1d n GLY 32 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1k1d s GLN 33 N -1.59 2.61 -1.27 1.61 -2.07 -1.26 0.22 119.66 117.91 1k1d s GLN 33 Ca 0.00 -0.87 -0.02 0.00 -1.82 0.00 0.00 55.36 52.65 1k1d s GLN 33 Cb 0.00 -2.55 -0.01 0.00 -1.09 0.00 0.00 33.01 29.37 1k1d s GLN 33 CO 0.00 0.52 0.73 0.09 -1.32 0.00 0.00 175.29 175.31 1k1d n ASN 34 N 0.31 -1.92 -4.82 12.60 3.02 -1.26 -4.94 115.26 118.24 1k1d n ASN 34 Ca -0.10 -0.83 -0.33 0.00 -0.03 0.00 0.00 54.58 53.29 1k1d n ASN 34 Cb 0.53 -4.10 -0.05 0.00 -0.61 0.00 0.00 39.78 35.54 1k1d n ASN 34 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1k1d s LEU 35 N -6.56 3.83 -0.03 3.41 1.43 -1.26 -5.07 118.68 114.43 1k1d s LEU 35 Ca 0.08 1.73 -0.18 0.00 -1.03 0.00 0.00 54.13 54.72 1k1d s LEU 35 Cb -0.02 -4.54 0.03 0.00 0.03 0.00 0.00 46.19 41.70 1k1d s LEU 35 CO 0.81 -0.55 0.39 -1.61 0.23 0.00 0.00 176.35 175.62 1k1d s GLU 36 N -3.43 0.73 -0.30 1.70 2.02 -1.26 -5.11 118.70 113.05 1k1d s GLU 36 Ca 0.63 -0.04 -0.15 0.00 0.02 0.00 0.00 54.97 55.43 1k1d s GLU 36 Cb -0.11 0.33 0.18 0.00 0.10 0.00 0.00 34.13 34.63 1k1d s GLU 36 CO 0.20 -0.20 1.10 -2.00 0.02 0.00 0.00 175.26 174.37 1k1d s GLU 37 N -1.18 0.15 -0.01 1.61 2.12 -1.26 -5.13 118.70 115.00 1k1d s GLU 37 Ca -0.12 0.28 -0.39 0.00 0.36 0.00 0.00 54.97 55.10 1k1d s GLU 37 Cb -0.04 0.16 -0.18 0.00 0.26 0.00 0.00 34.13 34.32 1k1d s GLU 37 CO 0.05 -0.15 1.28 1.17 -0.54 0.00 0.00 175.26 177.07 1k1d n LYS 38 N 5.41 0.61 -1.92 4.30 4.81 -1.26 -3.66 118.16 126.45 1k1d n LYS 38 Ca -0.08 0.22 -0.01 0.00 -0.87 0.00 0.00 58.31 57.58 1k1d n LYS 38 Cb 0.54 -1.80 -0.01 0.00 0.02 0.00 0.00 35.03 33.78 1k1d n LYS 38 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1k1d n GLY 39 N 2.33 -3.54 0.00 3.14 0.00 -1.26 -5.03 105.19 100.82 1k1d n GLY 39 Ca 0.20 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.40 1k1d n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k1d n ALA 40 N 0.40 0.00 0.00 4.61 0.00 -1.24 -4.70 120.51 119.58 1k1d n ALA 40 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1k1d n ALA 40 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.55 1k1d n ALA 40 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1k1d n GLU 41 N 0.00 0.00 -0.68 0.00 2.13 -1.26 -2.56 120.64 118.27 1k1d n GLU 41 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1k1d n GLU 41 Cb 0.22 -3.10 0.00 0.00 0.27 0.00 0.00 31.44 28.83 1k1d n GLU 41 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1k1d n VAL 42 N -1.42 -0.23 -3.32 6.31 0.31 -1.26 -4.88 118.33 113.83 1k1d n VAL 42 Ca 0.00 0.02 -0.38 0.00 -0.01 0.00 0.00 64.34 63.97 1k1d n VAL 42 Cb 0.00 -0.49 -0.06 0.00 -0.91 0.00 0.00 33.84 32.38 1k1d n VAL 42 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1k1d s ILE 43 N -0.05 4.93 -0.24 2.52 -1.09 0.30 -4.93 121.20 122.64 1k1d s ILE 43 Ca 0.00 1.08 -0.11 0.00 -2.23 0.00 0.00 60.65 59.39 1k1d s ILE 43 Cb 0.00 -3.84 -0.05 0.00 -1.58 0.00 0.00 42.46 36.99 1k1d s ILE 43 CO 0.00 0.49 0.19 -0.62 -1.23 0.00 0.00 174.94 173.77 1k1d s ASP 44 N -0.58 6.15 -0.13 3.58 2.15 -1.26 -0.81 116.67 125.77 1k1d s ASP 44 Ca 0.28 0.16 0.16 0.00 0.43 0.00 0.00 52.55 53.57 1k1d s ASP 44 Cb -0.18 -2.12 0.36 0.00 -0.30 0.00 0.00 42.92 40.68 1k1d s ASP 44 CO 0.16 0.04 1.25 0.00 -0.17 0.00 0.00 175.17 176.45 1k1d n ALA 45 N 4.34 2.52 -1.41 3.66 0.00 0.10 -4.93 120.51 124.79 1k1d n ALA 45 Ca -0.14 -2.26 -0.44 0.00 0.00 0.00 0.00 53.44 50.60 1k1d n ALA 45 Cb 0.52 -0.48 -0.01 0.00 0.00 0.00 0.00 19.45 19.48 1k1d n ALA 45 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1k1d n LYS 46 N -0.86 0.34 -3.55 0.00 5.02 -1.15 -1.56 118.16 116.39 1k1d n LYS 46 Ca 0.16 0.12 -0.26 0.00 -2.02 0.00 0.00 58.31 56.31 1k1d n LYS 46 Cb 0.69 -1.26 0.03 0.00 -0.02 0.00 0.00 35.03 34.47 1k1d n LYS 46 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k1d n GLY 47 N 1.93 -0.51 3.16 0.72 0.00 -1.26 -4.97 105.19 104.26 1k1d n GLY 47 Ca 0.13 0.17 -0.09 0.00 0.00 0.00 0.00 46.02 46.23 1k1d n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k1d s TYR 49 N -3.10 3.48 -0.30 0.00 2.02 0.16 -1.15 117.35 118.47 1k1d s TYR 49 Ca -0.01 0.26 0.01 0.00 -0.37 0.00 0.00 57.07 56.96 1k1d s TYR 49 Cb 0.02 -1.79 0.09 0.00 -0.40 0.00 0.00 41.96 39.88 1k1d s TYR 49 CO -0.07 0.41 0.03 0.08 -1.57 0.00 0.00 175.55 174.43 1k1d s VAL 50 N -1.86 1.59 0.19 0.71 1.01 -0.03 -0.66 120.40 121.34 1k1d s VAL 50 Ca 0.37 -1.68 0.04 0.00 0.00 0.00 0.00 61.98 60.71 1k1d s VAL 50 Cb -0.11 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 1k1d s VAL 50 CO 0.29 -0.46 0.31 -0.36 0.00 0.00 0.00 175.10 174.88 1k1d s PHE 51 N 1.29 3.46 0.15 5.22 0.08 -0.26 -2.52 117.98 125.40 1k1d s PHE 51 Ca 0.05 0.06 -0.30 0.00 0.12 0.00 0.00 56.93 56.86 1k1d s PHE 51 Cb -0.18 -1.62 -0.07 0.00 -0.57 0.00 0.00 43.02 40.57 1k1d s PHE 51 CO -0.13 0.49 1.18 -2.14 -0.10 0.00 0.00 175.22 174.52 1k1d s PRO 52 N -3.54 4.49 0.38 0.24 0.02 -1.26 -1.00 135.00 134.32 1k1d s PRO 52 Ca 0.34 1.82 -0.23 0.00 0.02 0.00 0.00 61.00 62.95 1k1d s PRO 52 Cb -0.10 -3.28 -0.15 0.00 0.02 0.00 0.00 34.50 30.99 1k1d s PRO 52 CO 0.29 -0.11 0.26 0.41 -0.33 0.00 0.00 177.00 177.52 1k1d n GLY 53 N 2.49 -2.29 3.82 0.52 0.00 0.82 -4.78 105.19 105.77 1k1d n GLY 53 Ca 0.05 0.05 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 1k1d n GLY 53 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1k1d s GLY 54 N -0.99 1.97 -0.14 -0.02 0.00 0.16 -4.65 107.32 103.65 1k1d s GLY 54 Ca 0.61 0.25 0.00 0.00 0.00 0.00 0.00 44.72 45.58 1k1d s GLY 54 CO 0.61 0.56 -0.11 -0.42 0.00 0.00 0.00 173.10 173.73 1k1d s ILE 55 N -2.68 1.35 -0.48 0.90 1.01 -0.65 -1.02 121.20 119.63 1k1d s ILE 55 Ca 0.61 -0.52 -0.14 0.00 0.00 0.00 0.00 60.65 60.60 1k1d s ILE 55 Cb -0.14 -1.31 0.09 0.00 0.01 0.00 0.00 42.46 41.10 1k1d s ILE 55 CO 0.42 0.40 0.39 -0.62 0.00 0.00 0.00 174.94 175.52 1k1d s ASP 56 N 1.57 6.01 0.00 3.58 -1.08 -0.23 -4.70 116.67 121.83 1k1d s ASP 56 Ca 0.05 -1.51 0.31 0.00 -0.52 0.00 0.00 52.55 50.88 1k1d s ASP 56 Cb -0.13 -2.13 1.75 0.00 -1.46 0.00 0.00 42.92 40.94 1k1d s ASP 56 CO -0.10 -0.67 2.15 -0.81 0.52 0.00 0.00 175.17 176.26 1k1d n PRO 57 N 5.13 0.88 -3.80 4.34 -0.04 -1.26 -0.97 135.00 139.27 1k1d n PRO 57 Ca -0.12 -0.05 -0.29 0.00 -0.04 0.00 0.00 63.50 63.00 1k1d n PRO 57 Cb 0.42 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.26 1k1d n PRO 57 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1k1d s HIS 58 N -2.16 2.77 0.04 0.54 2.46 -1.25 -4.63 115.29 113.06 1k1d s HIS 58 Ca 0.42 -2.95 0.07 0.00 0.47 0.00 0.00 55.06 53.07 1k1d s HIS 58 Cb 0.21 -2.30 -0.02 0.00 -0.13 0.00 0.00 32.58 30.34 1k1d s HIS 58 CO 0.40 -0.68 -0.21 0.99 -2.47 0.00 0.00 174.74 172.76 1k1d s THR 59 N -0.56 1.67 -0.38 0.89 2.01 -1.17 -1.04 115.64 117.06 1k1d s THR 59 Ca 0.22 -1.18 0.01 0.00 0.31 0.00 0.00 61.69 61.05 1k1d s THR 59 Cb -0.13 -1.45 0.15 0.00 0.01 0.00 0.00 72.50 71.08 1k1d s THR 59 CO -0.09 0.22 0.26 -1.00 -0.69 0.00 0.00 174.62 173.32 1k1d s HIS 60 N -0.78 0.94 0.00 4.92 3.76 -0.67 -1.62 115.29 121.84 1k1d s HIS 60 Ca 0.08 -1.90 0.00 0.00 -0.15 0.00 0.00 55.06 53.08 1k1d s HIS 60 Cb -0.09 -0.99 0.00 0.00 1.11 0.00 0.00 32.58 32.61 1k1d s HIS 60 CO 0.02 -0.82 0.00 1.28 -0.85 0.00 0.00 174.74 174.36 1k1d n LEU 61 N 3.62 1.46 -0.61 0.89 4.77 -1.26 -4.31 117.00 121.57 1k1d n LEU 61 Ca 0.17 0.07 0.01 0.00 -0.03 0.00 0.00 56.01 56.23 1k1d n LEU 61 Cb 0.40 -0.11 0.05 0.00 -2.33 0.00 0.00 43.42 41.44 1k1d n LEU 61 CO 0.13 -0.11 0.37 -0.67 -1.33 0.00 0.00 177.39 175.78 1k1d n ASP 62 N -1.16 1.46 -4.77 -1.43 -0.08 -1.26 -4.40 116.55 104.92 1k1d n ASP 62 Ca 0.00 -2.11 -0.39 0.00 -1.51 0.00 0.00 54.79 50.78 1k1d n ASP 62 Cb 0.00 -0.45 -0.01 0.00 2.34 0.00 0.00 41.12 43.00 1k1d n ASP 62 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1k1d s MET 63 N -1.34 4.04 -0.34 -0.67 0.23 -1.26 -4.74 119.30 115.22 1k1d s MET 63 Ca 0.07 2.09 -0.11 0.00 -1.03 0.00 0.00 55.69 56.71 1k1d s MET 63 Cb 0.05 -2.79 0.00 0.00 -1.53 0.00 0.00 34.83 30.57 1k1d s MET 63 CO 0.03 -0.41 0.20 -2.14 -2.03 0.00 0.00 175.02 170.67 1k1d s PRO 64 N -2.18 3.20 -0.76 3.16 0.02 -1.26 -1.69 135.00 135.49 1k1d s PRO 64 Ca 0.56 -0.83 0.03 0.00 0.02 0.00 0.00 61.00 60.78 1k1d s PRO 64 Cb -0.37 -3.71 0.25 0.00 0.02 0.00 0.00 34.50 30.69 1k1d s PRO 64 CO 0.47 -0.53 0.85 -0.11 -0.33 0.00 0.00 177.00 177.35 1k1d n LEU 65 N 5.04 4.20 0.00 -5.54 7.94 -1.02 -4.97 117.00 122.65 1k1d n LEU 65 Ca -0.13 -5.34 0.00 0.00 -1.11 0.00 0.00 56.01 49.43 1k1d n LEU 65 Cb 0.48 -0.84 0.00 0.00 0.53 0.00 0.00 43.42 43.60 1k1d n LEU 65 CO 0.36 1.90 0.00 0.61 -1.11 0.00 0.00 177.39 179.15 1k1d n GLY 66 N 1.24 0.50 0.01 -3.96 0.00 -1.26 -4.56 105.19 97.15 1k1d n GLY 66 Ca 0.27 -1.94 0.16 0.00 0.00 0.00 0.00 46.02 44.50 1k1d n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k1d n GLY 67 N 0.00 -1.01 3.78 -0.02 0.00 -1.26 -4.80 105.19 101.88 1k1d n GLY 67 Ca 0.00 -0.20 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 1k1d n GLY 67 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1k1d s THR 68 N -2.06 1.77 0.08 2.61 -1.32 -1.26 -5.16 115.64 110.30 1k1d s THR 68 Ca 0.46 -1.75 0.03 0.00 -1.21 0.00 0.00 61.69 59.21 1k1d s THR 68 Cb 0.22 -2.53 -0.03 0.00 -1.51 0.00 0.00 72.50 68.65 1k1d s THR 68 CO 0.38 0.00 -0.09 -0.69 -2.21 0.00 0.00 174.62 172.01 1k1d s VAL 69 N -2.74 0.74 0.17 5.08 1.01 -1.26 -2.43 120.40 120.97 1k1d s VAL 69 Ca 0.28 -1.51 -0.33 0.00 0.00 0.00 0.00 61.98 60.43 1k1d s VAL 69 Cb 0.02 -1.17 -0.16 0.00 0.00 0.00 0.00 36.38 35.07 1k1d s VAL 69 CO 0.16 -0.57 1.10 0.41 0.00 0.00 0.00 175.10 176.20 1k1d n THR 70 N 0.74 0.99 -0.19 3.92 -1.04 -0.68 -4.86 114.28 113.17 1k1d n THR 70 Ca -0.18 -0.25 -0.01 0.00 -2.04 0.00 0.00 64.05 61.58 1k1d n THR 70 Cb 0.57 -0.73 0.21 0.00 -1.82 0.00 0.00 70.33 68.57 1k1d n THR 70 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 1k1d h LYS 71 N 3.06 0.94 -5.61 -2.82 1.63 -1.38 -3.40 116.57 109.00 1k1d h LYS 71 Ca -0.42 -0.11 -0.59 0.00 -0.85 0.00 0.00 60.65 58.68 1k1d h LYS 71 Cb 1.36 -0.19 -0.10 0.00 -0.60 0.00 0.00 32.23 32.70 1k1d h LYS 71 CO 0.68 0.71 -0.05 -0.51 -3.45 0.00 0.00 179.45 176.83 1k1d s ASP 72 N -6.44 6.61 0.29 4.20 1.01 -1.26 -4.83 116.67 116.25 1k1d s ASP 72 Ca -0.11 0.74 0.03 0.00 0.71 0.00 0.00 52.55 53.92 1k1d s ASP 72 Cb 0.17 -2.30 0.04 0.00 1.01 0.00 0.00 42.92 41.84 1k1d s ASP 72 CO 0.79 -0.14 0.34 -0.90 0.21 0.00 0.00 175.17 175.47 1k1d n ASP 73 N 4.50 0.78 0.31 0.27 5.75 -1.26 -4.20 116.55 122.70 1k1d n ASP 73 Ca -0.05 -1.58 0.21 0.00 -0.01 0.00 0.00 54.79 53.36 1k1d n ASP 73 Cb 0.51 -0.19 1.05 0.00 -1.03 0.00 0.00 41.12 41.46 1k1d n ASP 73 CO 0.00 0.00 0.00 -0.26 -0.11 0.00 0.00 177.20 176.83 1k1d h PHE 74 N -0.06 0.00 0.00 2.11 -1.00 -1.85 -1.24 116.94 114.90 1k1d h PHE 74 Ca -0.11 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.66 1k1d h PHE 74 Cb 0.50 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.06 1k1d h PHE 74 CO 0.00 0.00 -0.11 1.49 -1.61 0.00 0.00 178.31 178.08 1k1d h GLU 75 N 0.00 0.00 -0.19 1.51 4.81 -1.88 -3.01 114.58 115.82 1k1d h GLU 75 Ca 0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1k1d h GLU 75 Cb 0.14 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 1k1d h GLU 75 CO 0.00 0.30 0.11 0.66 -0.73 0.00 0.00 179.01 179.34 1k1d h SER 76 N -1.00 0.24 -0.98 1.04 4.64 -1.87 -2.50 113.55 113.13 1k1d h SER 76 Ca -0.02 -0.08 0.09 0.00 -0.47 0.00 0.00 61.79 61.32 1k1d h SER 76 Cb 0.36 -0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 62.32 1k1d h SER 76 CO -0.01 0.25 0.63 1.23 -0.87 0.00 0.00 176.83 178.06 1k1d h GLY 77 N 0.21 1.52 0.90 -0.77 0.00 -1.40 0.58 103.07 104.11 1k1d h GLY 77 Ca 0.07 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 1k1d h GLY 77 CO -0.01 0.25 0.10 -0.84 0.00 0.00 0.00 176.54 176.03 1k1d h THR 78 N 1.05 1.18 -0.15 4.70 2.02 -1.34 -0.99 112.91 119.38 1k1d h THR 78 Ca 0.45 -0.55 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 1k1d h THR 78 Cb 0.34 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 1k1d h THR 78 CO -0.21 0.19 0.07 0.40 0.37 0.00 0.00 175.52 176.34 1k1d h ILE 79 N 0.28 1.11 0.06 3.11 2.04 -0.98 0.03 117.51 123.16 1k1d h ILE 79 Ca 0.09 -0.32 0.02 0.00 1.00 0.00 0.00 64.86 65.65 1k1d h ILE 79 Cb 0.19 1.06 -0.05 0.00 -0.74 0.00 0.00 36.82 37.29 1k1d h ILE 79 CO -0.01 0.10 -0.48 0.00 0.00 0.00 0.00 178.15 177.76 1k1d h ALA 80 N 0.95 -0.85 -0.95 1.87 0.00 -0.75 0.21 119.26 119.74 1k1d h ALA 80 Ca 0.05 -0.08 0.15 0.00 0.00 0.00 0.00 54.91 55.03 1k1d h ALA 80 Cb 0.10 0.84 -0.08 0.00 0.00 0.00 0.00 17.79 18.65 1k1d h ALA 80 CO -0.01 -1.06 0.60 0.00 0.00 0.00 0.00 179.25 178.79 1k1d h ALA 81 N -0.31 1.73 -0.45 0.00 0.00 -1.06 -0.08 119.26 119.09 1k1d h ALA 81 Ca 0.02 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1k1d h ALA 81 Cb 0.71 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1k1d h ALA 81 CO -0.31 0.00 0.27 0.00 0.00 0.00 0.00 179.25 179.21 1k1d h ALA 82 N 1.59 0.58 -0.32 0.00 0.00 0.88 0.90 119.26 122.89 1k1d h ALA 82 Ca 0.49 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.30 1k1d h ALA 82 Cb 0.70 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1k1d h ALA 82 CO -0.25 -0.05 -0.17 0.74 0.00 0.00 0.00 179.25 179.52 1k1d h PHE 83 N 0.54 0.64 0.00 0.00 -1.00 0.34 -2.72 116.94 114.73 1k1d h PHE 83 Ca 0.18 -0.12 0.00 0.00 2.81 0.00 0.00 57.97 60.84 1k1d h PHE 83 Cb 0.02 -0.16 0.00 0.00 3.61 0.00 0.00 35.95 39.41 1k1d h PHE 83 CO -0.07 0.72 0.00 0.41 -1.61 0.00 0.00 178.31 177.76 1k1d n GLY 84 N -0.46 -0.69 0.89 -1.45 0.00 -0.18 -4.63 105.19 98.66 1k1d n GLY 84 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1k1d n GLY 84 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k1d n GLY 85 N 0.25 0.77 3.69 -0.02 0.00 -0.94 -4.33 105.19 104.60 1k1d n GLY 85 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 1k1d n GLY 85 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1k1d s THR 86 N -2.28 5.36 -0.81 2.61 2.01 0.21 -0.67 115.64 122.08 1k1d s THR 86 Ca 0.00 0.24 0.07 0.00 0.31 0.00 0.00 61.69 62.31 1k1d s THR 86 Cb 0.00 -3.51 0.09 0.00 0.01 0.00 0.00 72.50 69.09 1k1d s THR 86 CO 0.00 0.37 0.83 0.35 -0.69 0.00 0.00 174.62 175.49 1k1d n THR 87 N 4.00 0.25 -3.69 -0.82 -2.24 -0.19 -3.05 114.28 108.53 1k1d n THR 87 Ca -0.15 -0.63 -0.10 0.00 -2.27 0.00 0.00 64.05 60.90 1k1d n THR 87 Cb 0.52 0.99 -0.11 0.00 -2.10 0.00 0.00 70.33 69.63 1k1d n THR 87 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1k1d s THR 88 N -0.69 -0.11 0.16 4.28 2.01 -1.09 -2.97 115.64 117.22 1k1d s THR 88 Ca 0.10 0.11 0.08 0.00 0.31 0.00 0.00 61.69 62.29 1k1d s THR 88 Cb 0.06 -0.59 -0.04 0.00 0.01 0.00 0.00 72.50 71.94 1k1d s THR 88 CO 0.09 0.05 -0.18 0.27 -0.69 0.00 0.00 174.62 174.15 1k1d s ILE 89 N 1.55 1.80 -0.31 1.82 -4.36 -0.91 -1.07 121.20 119.73 1k1d s ILE 89 Ca -0.08 -1.88 0.01 0.00 -0.26 0.00 0.00 60.65 58.43 1k1d s ILE 89 Cb -0.09 -1.81 0.09 0.00 1.25 0.00 0.00 42.46 41.90 1k1d s ILE 89 CO -0.12 -0.30 0.06 -0.63 0.24 0.00 0.00 174.94 174.19 1k1d s ILE 90 N -1.97 1.43 0.36 8.37 1.01 -0.15 -0.96 121.20 129.29 1k1d s ILE 90 Ca 0.15 -1.69 -0.12 0.00 0.00 0.00 0.00 60.65 58.99 1k1d s ILE 90 Cb -0.06 -2.02 -0.08 0.00 0.01 0.00 0.00 42.46 40.31 1k1d s ILE 90 CO 0.06 -0.57 0.74 -0.62 0.00 0.00 0.00 174.94 174.55 1k1d s ASP 91 N 1.35 6.64 -0.55 3.58 -1.08 -0.82 -3.07 116.67 122.71 1k1d s ASP 91 Ca 0.08 1.18 -0.22 0.00 -0.52 0.00 0.00 52.55 53.07 1k1d s ASP 91 Cb -0.18 -2.34 0.05 0.00 -1.46 0.00 0.00 42.92 38.99 1k1d s ASP 91 CO -0.17 -0.30 0.86 -0.36 0.52 0.00 0.00 175.17 175.72 1k1d s PHE 92 N -2.17 2.85 -0.50 -5.34 0.40 -0.64 -1.27 117.98 111.31 1k1d s PHE 92 Ca 0.52 -0.25 -0.28 0.00 -0.60 0.00 0.00 56.93 56.32 1k1d s PHE 92 Cb -0.10 -3.96 0.01 0.00 0.51 0.00 0.00 43.02 39.48 1k1d s PHE 92 CO 0.25 -1.31 1.37 0.00 0.70 0.00 0.00 175.22 176.23 1k1d s LEU 94 N 5.60 3.62 0.06 0.00 1.43 -1.26 -1.21 118.68 126.92 1k1d s LEU 94 Ca 0.55 1.97 0.06 0.00 -1.03 0.00 0.00 54.13 55.68 1k1d s LEU 94 Cb -0.11 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 41.53 1k1d s LEU 94 CO 0.29 -1.18 -0.17 -0.89 0.23 0.00 0.00 176.35 174.63 1k1d s THR 95 N -2.15 1.36 0.01 5.49 2.01 -1.26 -4.81 115.64 116.30 1k1d s THR 95 Ca 0.67 -1.24 0.05 0.00 0.31 0.00 0.00 61.69 61.48 1k1d s THR 95 Cb -0.19 -1.24 -0.03 0.00 0.01 0.00 0.00 72.50 71.05 1k1d s THR 95 CO 0.31 -0.02 -0.11 0.20 -0.69 0.00 0.00 174.62 174.31 1k1d s ASN 96 N -1.47 4.29 0.58 3.53 0.01 -1.26 -4.84 114.94 115.78 1k1d s ASN 96 Ca 0.03 -0.25 -0.19 0.00 -0.71 0.00 0.00 52.86 51.74 1k1d s ASN 96 Cb -0.09 -0.90 -0.04 0.00 0.41 0.00 0.00 41.25 40.63 1k1d s ASN 96 CO 0.02 0.28 1.23 -0.54 -1.51 0.00 0.00 177.10 176.58 1k1d s LYS 97 N -1.37 3.01 0.00 -0.60 1.02 -1.26 -2.90 119.74 117.64 1k1d s LYS 97 Ca 0.16 1.90 0.00 0.00 0.02 0.00 0.00 55.97 58.04 1k1d s LYS 97 Cb -0.11 -1.99 0.00 0.00 -0.52 0.00 0.00 37.83 35.21 1k1d s LYS 97 CO 0.06 -1.19 0.00 0.41 -0.92 0.00 0.00 175.35 173.71 1k1d n GLY 98 N 0.57 1.73 3.73 -3.33 0.00 -1.26 -4.93 105.19 101.71 1k1d n GLY 98 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1k1d n GLY 98 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1k1d s GLU 99 N 0.00 4.46 0.20 1.61 2.12 -1.14 -5.01 118.70 120.93 1k1d s GLU 99 Ca 0.00 0.99 -0.33 0.00 0.36 0.00 0.00 54.97 55.99 1k1d s GLU 99 Cb 0.00 -3.40 -0.13 0.00 0.26 0.00 0.00 34.13 30.86 1k1d s GLU 99 CO 0.00 0.20 1.60 -0.35 -0.54 0.00 0.00 175.26 176.16 1k1d n PRO 100 N 3.20 2.36 -0.30 4.30 -0.04 -1.26 -4.72 135.00 138.53 1k1d n PRO 100 Ca -0.02 0.85 0.14 0.00 -0.04 0.00 0.00 63.50 64.43 1k1d n PRO 100 Cb 0.51 -2.63 0.38 0.00 -0.04 0.00 0.00 33.50 31.72 1k1d n PRO 100 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1k1d h LEU 101 N 5.81 0.66 -0.81 1.53 3.38 -1.95 -0.21 115.31 123.72 1k1d h LEU 101 Ca -0.45 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1k1d h LEU 101 Cb 1.24 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1k1d h LEU 101 CO 0.88 0.28 0.00 0.29 0.09 0.00 0.00 178.44 179.98 1k1d n LYS 102 N -4.63 0.18 0.30 1.13 5.02 -1.26 -1.81 118.16 117.09 1k1d n LYS 102 Ca 0.20 0.46 -0.13 0.00 -2.02 0.00 0.00 58.31 56.83 1k1d n LYS 102 Cb 0.57 -1.88 -0.06 0.00 -0.02 0.00 0.00 35.03 33.64 1k1d n LYS 102 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1k1d h LYS 103 N 0.00 -0.78 -0.36 1.97 1.63 -1.40 -2.61 116.57 115.02 1k1d h LYS 103 Ca 0.00 0.05 0.05 0.00 -0.85 0.00 0.00 60.65 59.90 1k1d h LYS 103 Cb 0.29 0.18 -0.04 0.00 -0.60 0.00 0.00 32.23 32.06 1k1d h LYS 103 CO 0.00 -0.51 0.10 0.00 -3.45 0.00 0.00 179.45 175.59 1k1d h ALA 104 N -1.18 0.40 -0.94 5.00 0.00 -1.56 -1.58 119.26 119.41 1k1d h ALA 104 Ca -0.08 0.05 0.17 0.00 0.00 0.00 0.00 54.91 55.05 1k1d h ALA 104 Cb 0.63 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.39 1k1d h ALA 104 CO 0.14 -0.29 0.60 0.82 0.00 0.00 0.00 179.25 180.51 1k1d h ILE 105 N 0.24 0.77 0.04 0.00 2.04 -1.40 0.75 117.51 119.95 1k1d h ILE 105 Ca 0.17 -0.23 -0.23 0.00 1.00 0.00 0.00 64.86 65.56 1k1d h ILE 105 Cb 0.16 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.28 1k1d h ILE 105 CO -0.19 0.12 -1.03 -0.33 0.00 0.00 0.00 178.15 176.73 1k1d h GLU 106 N 0.67 0.31 -0.55 2.37 5.08 -1.00 -1.48 114.58 119.97 1k1d h GLU 106 Ca 0.49 -0.39 0.06 0.00 -1.00 0.00 0.00 59.36 58.52 1k1d h GLU 106 Cb 0.86 0.13 -0.05 0.00 0.50 0.00 0.00 28.75 30.18 1k1d h GLU 106 CO -0.25 1.11 0.26 1.15 -1.00 0.00 0.00 179.01 180.28 1k1d h THR 107 N 0.15 0.90 -0.22 1.13 2.02 0.02 -0.43 112.91 116.47 1k1d h THR 107 Ca -0.09 -0.17 -0.04 0.00 0.77 0.00 0.00 66.41 66.89 1k1d h THR 107 Cb 1.69 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 68.46 1k1d h THR 107 CO 0.17 0.09 -0.01 -0.50 0.37 0.00 0.00 175.52 175.64 1k1d h TRP 108 N 0.49 0.44 -0.73 3.16 6.55 -0.99 -1.90 115.95 122.96 1k1d h TRP 108 Ca 0.26 -0.08 0.18 0.00 0.95 0.00 0.00 58.89 60.19 1k1d h TRP 108 Cb 0.22 -0.11 -0.04 0.00 -0.86 0.00 0.00 29.16 28.36 1k1d h TRP 108 CO -0.12 0.59 0.50 0.45 -1.05 0.00 0.00 178.44 178.81 1k1d h HIS 109 N 0.15 0.27 -0.10 0.49 3.86 -0.56 -0.08 115.15 119.19 1k1d h HIS 109 Ca 0.06 0.01 -0.06 0.00 -1.16 0.00 0.00 60.37 59.22 1k1d h HIS 109 Cb 0.43 -0.09 -0.00 0.00 1.06 0.00 0.00 27.41 28.81 1k1d h HIS 109 CO 0.04 0.09 -0.16 -0.91 0.86 0.00 0.00 177.93 177.85 1k1d h ASN 110 N 0.23 0.32 -0.93 2.45 2.35 -0.62 0.35 115.58 119.73 1k1d h ASN 110 Ca 0.36 -0.54 0.18 0.00 -0.55 0.00 0.00 56.30 55.75 1k1d h ASN 110 Cb 1.08 -0.09 -0.11 0.00 0.05 0.00 0.00 38.32 39.25 1k1d h ASN 110 CO -0.08 0.80 0.52 0.11 -1.65 0.00 0.00 177.43 177.13 1k1d h LYS 111 N -0.15 0.63 0.16 0.81 1.57 -0.26 -2.87 116.57 116.46 1k1d h LYS 111 Ca 0.01 -0.04 -0.33 0.00 -1.87 0.00 0.00 60.65 58.42 1k1d h LYS 111 Cb 0.73 -0.14 0.01 0.00 0.08 0.00 0.00 32.23 32.91 1k1d h LYS 111 CO 0.04 0.42 -1.63 0.00 -0.57 0.00 0.00 179.45 177.71 1k1d h ALA 112 N 1.63 0.15 -0.58 3.86 0.00 -1.27 -3.41 119.26 119.64 1k1d h ALA 112 Ca 0.54 -1.11 -0.59 0.00 0.00 0.00 0.00 54.91 53.74 1k1d h ALA 112 Cb 0.86 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1k1d h ALA 112 CO -0.40 0.94 0.54 0.09 0.00 0.00 0.00 179.25 180.42 1k1d n ASN 113 N -3.71 0.78 0.00 0.00 3.02 0.12 -0.95 115.26 114.53 1k1d n ASN 113 Ca -0.25 0.76 0.00 0.00 -0.03 0.00 0.00 54.58 55.07 1k1d n ASN 113 Cb 1.02 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 39.58 1k1d n ASN 113 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k1d n GLY 114 N 3.10 0.13 0.00 7.41 0.00 -1.26 -4.75 105.19 109.82 1k1d n GLY 114 Ca 0.24 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.29 1k1d n GLY 114 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1k1d n LYS 115 N -0.68 0.92 -2.28 1.61 5.02 -0.12 -2.09 118.16 120.54 1k1d n LYS 115 Ca 0.00 -0.05 -0.41 0.00 -2.02 0.00 0.00 58.31 55.82 1k1d n LYS 115 Cb 0.24 -1.11 -0.03 0.00 -0.02 0.00 0.00 35.03 34.11 1k1d n LYS 115 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1k1d s ALA 116 N -2.34 3.49 -0.13 7.82 0.00 -1.13 -4.03 121.76 125.44 1k1d s ALA 116 Ca -0.02 1.03 0.18 0.00 0.00 0.00 0.00 51.96 53.16 1k1d s ALA 116 Cb 0.04 -3.46 -0.14 0.00 0.00 0.00 0.00 23.12 19.56 1k1d s ALA 116 CO 0.28 -0.48 0.76 0.28 0.00 0.00 0.00 175.76 176.60 1k1d n VAL 117 N 2.89 1.05 -4.48 0.00 0.31 -1.26 0.35 118.33 117.18 1k1d n VAL 117 Ca 0.06 -0.67 -0.23 0.00 -0.01 0.00 0.00 64.34 63.49 1k1d n VAL 117 Cb 0.44 -0.61 -0.10 0.00 -0.91 0.00 0.00 33.84 32.65 1k1d n VAL 117 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1k1d s ILE 118 N -2.99 1.06 0.73 2.52 -4.36 -1.26 -3.67 121.20 113.23 1k1d s ILE 118 Ca -0.04 -2.00 -0.12 0.00 -0.26 0.00 0.00 60.65 58.24 1k1d s ILE 118 Cb 0.09 -2.67 0.03 0.00 1.25 0.00 0.00 42.46 41.16 1k1d s ILE 118 CO 0.82 0.00 1.09 -1.81 0.24 0.00 0.00 174.94 175.27 1k1d s ASP 119 N -3.53 4.85 0.24 4.36 1.01 -1.16 -4.09 116.67 118.35 1k1d s ASP 119 Ca 0.32 1.81 -0.17 0.00 0.71 0.00 0.00 52.55 55.22 1k1d s ASP 119 Cb 0.07 -2.52 0.01 0.00 1.01 0.00 0.00 42.92 41.49 1k1d s ASP 119 CO 0.15 -1.80 0.57 -0.72 0.21 0.00 0.00 175.17 173.58 1k1d s TYR 120 N -2.81 0.03 0.18 4.23 1.13 -0.98 -2.13 117.35 116.99 1k1d s TYR 120 Ca 0.62 -0.41 -0.00 0.00 -1.41 0.00 0.00 57.07 55.86 1k1d s TYR 120 Cb -0.17 0.43 0.00 0.00 -1.10 0.00 0.00 41.96 41.12 1k1d s TYR 120 CO 0.52 -1.05 0.23 0.41 -2.51 0.00 0.00 175.55 173.15 1k1d n GLY 121 N -0.40 2.77 3.21 5.49 0.00 -0.13 0.55 105.19 116.69 1k1d n GLY 121 Ca -0.05 -1.55 -0.12 0.00 0.00 0.00 0.00 46.02 44.29 1k1d n GLY 121 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1k1d s PHE 122 N -3.70 1.08 0.02 1.61 0.08 -1.26 -1.95 117.98 113.86 1k1d s PHE 122 Ca 0.16 -0.99 0.09 0.00 0.12 0.00 0.00 56.93 56.30 1k1d s PHE 122 Cb -0.00 -0.61 -0.03 0.00 -0.57 0.00 0.00 43.02 41.81 1k1d s PHE 122 CO 0.11 -0.21 -0.26 -1.01 -0.10 0.00 0.00 175.22 173.76 1k1d s HIS 123 N -3.67 2.26 -0.21 0.36 3.76 -0.39 -4.68 115.29 112.71 1k1d s HIS 123 Ca 0.20 -0.41 -0.08 0.00 -0.15 0.00 0.00 55.06 54.61 1k1d s HIS 123 Cb 0.06 -1.39 -0.04 0.00 1.11 0.00 0.00 32.58 32.32 1k1d s HIS 123 CO 0.01 0.07 0.08 -1.17 -0.85 0.00 0.00 174.74 172.88 1k1d s LEU 124 N -1.01 3.74 0.39 0.89 2.96 -0.86 -0.20 118.68 124.58 1k1d s LEU 124 Ca 0.11 -0.01 -0.24 0.00 -0.22 0.00 0.00 54.13 53.77 1k1d s LEU 124 Cb -0.10 -1.97 -0.09 0.00 0.50 0.00 0.00 46.19 44.52 1k1d s LEU 124 CO 0.01 0.08 1.02 -0.32 -1.32 0.00 0.00 176.35 175.83 1k1d s MET 125 N 0.91 4.22 -0.11 1.98 -2.45 -0.35 -4.41 119.30 119.09 1k1d s MET 125 Ca 0.04 1.44 -0.01 0.00 -1.25 0.00 0.00 55.69 55.91 1k1d s MET 125 Cb -0.14 -2.52 0.03 0.00 1.25 0.00 0.00 34.83 33.45 1k1d s MET 125 CO 0.03 -0.08 -0.01 0.42 1.05 0.00 0.00 175.02 176.43 1k1d s ILE 126 N -1.72 0.57 -0.62 10.11 1.01 -1.26 -4.46 121.20 124.82 1k1d s ILE 126 Ca 0.57 -0.12 0.09 0.00 0.00 0.00 0.00 60.65 61.19 1k1d s ILE 126 Cb -0.20 -0.77 -0.05 0.00 0.01 0.00 0.00 42.46 41.46 1k1d s ILE 126 CO 0.25 0.19 0.48 -1.54 0.00 0.00 0.00 174.94 174.32 1k1d n SER 127 N 5.08 0.78 -3.57 3.58 3.41 -1.26 -4.61 113.62 117.02 1k1d n SER 127 Ca -0.09 -0.89 -0.11 0.00 -0.26 0.00 0.00 58.87 57.52 1k1d n SER 127 Cb 0.49 0.73 -0.05 0.00 -0.26 0.00 0.00 64.21 65.12 1k1d n SER 127 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1k1d s GLU 128 N -1.54 0.65 -0.43 4.33 -1.05 -1.26 -4.77 118.70 114.64 1k1d s GLU 128 Ca 0.05 0.20 -0.05 0.00 -0.15 0.00 0.00 54.97 55.03 1k1d s GLU 128 Cb 0.07 0.31 0.11 0.00 -0.44 0.00 0.00 34.13 34.18 1k1d s GLU 128 CO 0.29 -0.19 0.25 0.96 0.95 0.00 0.00 175.26 177.51 1k1d s ILE 129 N -1.01 3.55 0.30 1.83 -4.36 -1.26 -4.95 121.20 115.30 1k1d s ILE 129 Ca -0.03 -2.01 0.07 0.00 -0.26 0.00 0.00 60.65 58.43 1k1d s ILE 129 Cb -0.01 -3.40 -0.03 0.00 1.25 0.00 0.00 42.46 40.27 1k1d s ILE 129 CO 0.02 -0.72 0.30 -0.89 0.24 0.00 0.00 174.94 173.89 1k1d s THR 130 N 1.17 4.04 0.39 8.37 2.01 -1.26 -4.96 115.64 125.40 1k1d s THR 130 Ca 0.08 -1.28 0.07 0.00 0.31 0.00 0.00 61.69 60.86 1k1d s THR 130 Cb -0.24 -3.34 0.23 0.00 0.01 0.00 0.00 72.50 69.16 1k1d s THR 130 CO -0.03 -0.23 2.00 0.44 -0.69 0.00 0.00 174.62 176.10 1k1d h ASP 131 N 1.25 0.44 -0.61 3.53 3.32 -1.98 0.21 116.42 122.58 1k1d h ASP 131 Ca -0.47 -0.04 -0.09 0.00 0.02 0.00 0.00 57.03 56.46 1k1d h ASP 131 Cb 1.25 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.66 1k1d h ASP 131 CO 0.58 0.39 0.02 0.44 -1.72 0.00 0.00 179.24 178.96 1k1d h ASP 132 N 0.50 1.03 -0.09 6.45 3.32 -2.00 -1.90 116.42 123.73 1k1d h ASP 132 Ca 0.13 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 56.87 1k1d h ASP 132 Cb 0.08 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 1k1d h ASP 132 CO -0.02 1.07 0.02 0.58 -1.72 0.00 0.00 179.24 179.18 1k1d h VAL 133 N 0.95 1.20 -0.34 -1.35 2.07 -1.38 -2.37 116.25 115.04 1k1d h VAL 133 Ca 0.17 -0.61 0.10 0.00 0.82 0.00 0.00 66.70 67.18 1k1d h VAL 133 Cb 0.53 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 1k1d h VAL 133 CO 0.03 0.17 0.26 -0.07 0.02 0.00 0.00 177.57 177.98 1k1d h LEU 134 N -0.06 0.00 -0.13 2.57 3.38 -0.46 -0.68 115.31 119.93 1k1d h LEU 134 Ca 0.03 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.77 1k1d h LEU 134 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1k1d h LEU 134 CO 0.00 0.00 -0.99 -0.33 0.09 0.00 0.00 178.44 177.21 1k1d h GLU 135 N 0.00 0.36 0.01 1.13 5.08 -0.97 -3.35 114.58 116.84 1k1d h GLU 135 Ca 0.16 -0.43 -0.12 0.00 -1.00 0.00 0.00 59.36 57.98 1k1d h GLU 135 Cb 0.67 0.13 0.01 0.00 0.50 0.00 0.00 28.75 30.06 1k1d h GLU 135 CO -0.00 1.11 -0.46 0.93 -1.00 0.00 0.00 179.01 179.59 1k1d h GLU 136 N 0.19 0.29 -0.82 2.33 5.08 -0.71 -3.38 114.58 117.56 1k1d h GLU 136 Ca -0.09 -0.33 0.09 0.00 -1.00 0.00 0.00 59.36 58.03 1k1d h GLU 136 Cb 1.64 0.10 -0.11 0.00 0.50 0.00 0.00 28.75 30.88 1k1d h GLU 136 CO 0.17 1.04 -0.43 1.28 -1.00 0.00 0.00 179.01 180.07 1k1d n LEU 137 N -4.34 -0.76 -0.29 1.33 4.77 -0.39 0.92 117.00 118.25 1k1d n LEU 137 Ca -0.10 1.44 0.12 0.00 -0.03 0.00 0.00 56.01 57.44 1k1d n LEU 137 Cb 0.61 -0.23 0.36 0.00 -2.33 0.00 0.00 43.42 41.84 1k1d n LEU 137 CO 0.43 -1.21 1.22 1.55 -1.33 0.00 0.00 177.39 178.05 1k1d h PRO 138 N 0.00 0.70 -0.23 3.23 0.13 -1.75 0.77 132.00 134.85 1k1d h PRO 138 Ca 0.18 -0.04 -0.17 0.00 -0.87 0.00 0.00 66.00 65.10 1k1d h PRO 138 Cb 0.38 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 31.36 1k1d h PRO 138 CO -0.78 0.46 -0.52 0.87 -0.23 0.00 0.00 178.00 177.80 1k1d h LYS 139 N 0.72 0.76 -0.09 0.86 1.57 0.37 -2.60 116.57 118.15 1k1d h LYS 139 Ca 0.47 -0.51 0.03 0.00 -1.87 0.00 0.00 60.65 58.77 1k1d h LYS 139 Cb 0.74 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.12 1k1d h LYS 139 CO -0.23 1.13 0.11 0.28 -0.57 0.00 0.00 179.45 180.18 1k1d h VAL 140 N 0.49 0.46 0.00 0.50 2.07 0.21 0.21 116.25 120.19 1k1d h VAL 140 Ca -0.00 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 1k1d h VAL 140 Cb 1.13 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1k1d h VAL 140 CO 0.11 0.00 -0.01 -0.07 0.02 0.00 0.00 177.57 177.63 1k1d h LEU 141 N 0.00 0.00 0.61 2.57 3.38 -0.74 -3.11 115.31 118.02 1k1d h LEU 141 Ca 0.04 -0.44 -0.03 0.00 0.09 0.00 0.00 57.88 57.54 1k1d h LEU 141 Cb 0.27 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.03 1k1d h LEU 141 CO -0.00 0.73 -0.29 -0.33 0.09 0.00 0.00 178.44 178.63 1k1d h GLU 142 N -1.00 -0.79 -5.52 1.13 3.07 -1.11 -3.38 114.58 106.98 1k1d h GLU 142 Ca -0.00 0.05 -0.60 0.00 -0.50 0.00 0.00 59.36 58.31 1k1d h GLU 142 Cb 0.45 0.18 -0.11 0.00 -0.84 0.00 0.00 28.75 28.43 1k1d h GLU 142 CO -0.00 -0.49 0.08 -2.00 -1.40 0.00 0.00 179.01 175.20 1k1d s GLU 143 N -4.70 4.14 0.00 2.33 2.56 0.72 -4.58 118.70 119.18 1k1d s GLU 143 Ca -0.14 0.50 0.00 0.00 0.00 0.00 0.00 54.97 55.33 1k1d s GLU 143 Cb 0.02 -3.62 0.00 0.00 2.00 0.00 0.00 34.13 32.53 1k1d s GLU 143 CO 0.45 -0.31 0.00 -1.91 -0.56 0.00 0.00 175.26 172.93 1k1d n GLU 144 N 5.35 0.00 -0.50 4.30 4.07 -1.26 -4.00 120.64 128.61 1k1d n GLU 144 Ca -0.02 0.40 -0.05 0.00 -0.06 0.00 0.00 57.16 57.43 1k1d n GLU 144 Cb 0.50 -0.43 -0.07 0.00 -0.06 0.00 0.00 31.44 31.38 1k1d n GLU 144 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1k1d n GLY 145 N 0.58 2.02 3.46 8.31 0.00 -1.26 -4.03 105.19 114.28 1k1d n GLY 145 Ca 0.00 -0.48 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 1k1d n GLY 145 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k1d s ILE 146 N 1.50 4.37 -0.33 -0.61 -1.09 -1.18 -0.57 121.20 123.28 1k1d s ILE 146 Ca 0.27 -0.66 0.15 0.00 -2.23 0.00 0.00 60.65 58.18 1k1d s ILE 146 Cb 0.13 -4.75 0.47 0.00 -1.58 0.00 0.00 42.46 36.73 1k1d s ILE 146 CO 0.00 -1.53 1.37 0.35 -1.23 0.00 0.00 174.94 173.91 1k1d n THR 147 N 5.90 1.99 -3.72 2.92 -2.24 -1.26 -4.21 114.28 113.66 1k1d n THR 147 Ca 0.06 -1.70 -0.28 0.00 -2.27 0.00 0.00 64.05 59.87 1k1d n THR 147 Cb 0.47 -0.09 -0.16 0.00 -2.10 0.00 0.00 70.33 68.45 1k1d n THR 147 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1k1d s SER 148 N -1.76 3.08 0.65 3.42 1.04 -1.26 -1.44 113.70 117.43 1k1d s SER 148 Ca 0.37 -0.95 0.03 0.00 0.48 0.00 0.00 55.95 55.88 1k1d s SER 148 Cb 0.29 -0.60 0.10 0.00 0.10 0.00 0.00 66.02 65.91 1k1d s SER 148 CO 0.10 -0.33 0.90 -0.76 0.98 0.00 0.00 173.24 174.13 1k1d s LEU 149 N 1.85 3.06 0.00 2.42 1.43 -0.69 -2.03 118.68 124.73 1k1d s LEU 149 Ca 0.01 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.64 1k1d s LEU 149 Cb -0.17 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.06 1k1d s LEU 149 CO -0.12 -1.61 0.00 0.52 0.23 0.00 0.00 176.35 175.36 1k1d n VAL 151 N -2.59 0.00 -3.41 -1.59 0.31 0.20 -0.96 118.33 110.29 1k1d n VAL 151 Ca 0.14 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 64.09 1k1d n VAL 151 Cb 0.61 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 33.45 1k1d n VAL 151 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1k1d s PHE 152 N -0.13 3.28 -0.88 3.52 0.40 -1.26 -1.16 117.98 121.75 1k1d s PHE 152 Ca 0.00 0.44 0.25 0.00 -0.60 0.00 0.00 56.93 57.01 1k1d s PHE 152 Cb 0.00 -2.54 0.44 0.00 0.51 0.00 0.00 43.02 41.43 1k1d s PHE 152 CO 0.00 -0.16 1.37 -1.33 0.70 0.00 0.00 175.22 175.80 1k1d n MET 153 N 5.08 0.10 -1.80 0.44 2.81 -0.61 -1.77 117.12 121.36 1k1d n MET 153 Ca -0.09 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 1k1d n MET 153 Cb 0.51 -1.55 0.00 0.00 -0.71 0.00 0.00 33.22 31.47 1k1d n MET 153 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1k1d n ALA 154 N -1.61 0.00 -2.75 3.04 0.00 -1.13 -2.47 120.51 115.60 1k1d n ALA 154 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.39 1k1d n ALA 154 Cb 0.37 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.87 1k1d n ALA 154 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1k1d n TYR 155 N -0.12 -1.43 -1.55 0.00 4.01 -1.26 -2.80 117.16 114.01 1k1d n TYR 155 Ca 0.00 0.56 -0.43 0.00 -0.16 0.00 0.00 57.90 57.87 1k1d n TYR 155 Cb 0.00 -3.73 -0.00 0.00 -0.31 0.00 0.00 39.34 35.30 1k1d n TYR 155 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1k1d n LYS 156 N -2.77 1.08 -2.30 -0.72 4.81 -1.26 -1.70 118.16 115.30 1k1d n LYS 156 Ca -0.12 0.38 -0.18 0.00 -0.87 0.00 0.00 58.31 57.53 1k1d n LYS 156 Cb 0.59 -1.78 -0.02 0.00 0.02 0.00 0.00 35.03 33.84 1k1d n LYS 156 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1k1d n ASN 157 N 1.02 -5.09 0.00 3.14 3.02 -1.26 -4.68 115.26 111.42 1k1d n ASN 157 Ca 0.10 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.77 1k1d n ASN 157 Cb 0.36 -4.30 0.00 0.00 -0.61 0.00 0.00 39.78 35.23 1k1d n ASN 157 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1k1d n VAL 158 N -3.57 0.00 0.00 2.41 0.31 -0.70 -4.99 118.33 111.80 1k1d n VAL 158 Ca -0.21 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1k1d n VAL 158 Cb 0.65 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.58 1k1d n VAL 158 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1k1d n PHE 159 N -1.17 0.00 -1.38 3.52 3.01 -0.69 -5.12 117.46 115.63 1k1d n PHE 159 Ca 0.00 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.06 1k1d n PHE 159 Cb 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 39.49 1k1d n PHE 159 CO 0.00 0.00 0.00 0.94 1.01 0.00 0.00 176.76 178.71 1k1d n GLN 160 N -0.37 0.31 -3.86 -1.08 7.27 -1.01 -4.36 117.38 114.30 1k1d n GLN 160 Ca 0.00 0.12 -0.12 0.00 0.07 0.00 0.00 57.00 57.07 1k1d n GLN 160 Cb 0.00 -1.36 -0.14 0.00 2.41 0.00 0.00 30.24 31.15 1k1d n GLN 160 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1k1d s ALA 161 N -1.73 -0.02 0.94 1.69 0.00 -0.73 -4.86 121.76 117.05 1k1d s ALA 161 Ca 0.63 0.06 -0.12 0.00 0.00 0.00 0.00 51.96 52.53 1k1d s ALA 161 Cb -0.53 -0.04 0.15 0.00 0.00 0.00 0.00 23.12 22.70 1k1d s ALA 161 CO 0.60 -0.02 1.09 0.16 0.00 0.00 0.00 175.76 177.59 1k1d s ASP 162 N 0.12 3.09 0.56 0.00 1.47 -1.26 -4.75 116.67 115.90 1k1d s ASP 162 Ca -0.01 1.44 0.25 0.00 1.18 0.00 0.00 52.55 55.41 1k1d s ASP 162 Cb -0.01 -2.11 1.62 0.00 -0.34 0.00 0.00 42.92 42.08 1k1d s ASP 162 CO -0.00 -2.87 2.21 0.44 0.68 0.00 0.00 175.17 175.63 1k1d h ASP 163 N -1.71 0.00 -0.34 2.11 3.32 -2.00 -0.91 116.42 116.90 1k1d h ASP 163 Ca -0.51 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.50 1k1d h ASP 163 Cb 1.30 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.83 1k1d h ASP 163 CO 0.55 0.01 0.07 1.23 -1.72 0.00 0.00 179.24 179.37 1k1d h GLY 164 N 0.03 0.59 0.95 2.75 0.00 -1.98 0.78 103.07 106.18 1k1d h GLY 164 Ca -0.00 -0.38 -0.05 0.00 0.00 0.00 0.00 47.33 46.90 1k1d h GLY 164 CO 0.00 0.36 0.10 -0.84 0.00 0.00 0.00 176.54 176.15 1k1d h THR 165 N 0.39 1.24 -0.12 4.70 2.02 -1.56 -0.23 112.91 119.34 1k1d h THR 165 Ca 0.10 -0.83 -0.00 0.00 0.77 0.00 0.00 66.41 66.45 1k1d h THR 165 Cb 0.33 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 1k1d h THR 165 CO 0.00 0.29 0.07 0.25 0.37 0.00 0.00 175.52 176.51 1k1d h LEU 166 N 0.58 0.15 0.05 2.58 5.85 -0.97 -1.59 115.31 121.96 1k1d h LEU 166 Ca 0.14 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1k1d h LEU 166 Cb 0.34 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 1k1d h LEU 166 CO 0.00 0.18 -0.07 0.22 -0.34 0.00 0.00 178.44 178.44 1k1d h TYR 167 N 0.11 -0.17 0.00 1.25 5.03 0.77 -0.79 116.97 123.18 1k1d h TYR 167 Ca 0.04 0.00 -0.03 0.00 2.58 0.00 0.00 58.73 61.32 1k1d h TYR 167 Cb 0.06 0.07 -0.00 0.00 1.55 0.00 0.00 36.73 38.40 1k1d h TYR 167 CO -0.05 -0.10 -0.15 0.00 -1.32 0.00 0.00 178.16 176.53 1k1d h THR 169 N 0.00 1.26 -0.64 0.00 2.02 -0.81 0.10 112.91 114.84 1k1d h THR 169 Ca -0.00 -0.95 0.06 0.00 0.77 0.00 0.00 66.41 66.29 1k1d h THR 169 Cb 0.28 1.29 -0.06 0.00 -1.74 0.00 0.00 68.15 67.92 1k1d h THR 169 CO 0.02 0.31 0.34 -0.07 0.37 0.00 0.00 175.52 176.49 1k1d h LEU 170 N 0.32 0.49 0.65 2.58 3.38 -0.27 0.38 115.31 122.85 1k1d h LEU 170 Ca 0.08 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1k1d h LEU 170 Cb 0.44 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.14 1k1d h LEU 170 CO 0.02 0.31 -0.31 -0.07 0.09 0.00 0.00 178.44 178.48 1k1d h LEU 171 N 0.63 -0.74 -0.78 1.67 3.38 -1.11 0.62 115.31 118.97 1k1d h LEU 171 Ca 0.29 -0.01 0.18 0.00 0.09 0.00 0.00 57.88 58.44 1k1d h LEU 171 Cb 0.21 0.19 -0.13 0.00 0.09 0.00 0.00 40.66 41.02 1k1d h LEU 171 CO -0.20 -0.43 0.08 0.00 0.09 0.00 0.00 178.44 177.98 1k1d h ALA 172 N -0.83 0.91 0.11 1.53 0.00 -0.44 0.17 119.26 120.72 1k1d h ALA 172 Ca -0.09 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1k1d h ALA 172 Cb 0.71 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1k1d h ALA 172 CO 0.15 -0.42 -0.09 0.00 0.00 0.00 0.00 179.25 178.88 1k1d h ALA 173 N 1.71 -0.19 -0.60 0.00 0.00 -0.01 0.61 119.26 120.78 1k1d h ALA 173 Ca 0.44 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.38 1k1d h ALA 173 Cb 0.81 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.68 1k1d h ALA 173 CO -0.65 -0.62 0.31 -0.22 0.00 0.00 0.00 179.25 178.08 1k1d h LYS 174 N -0.22 0.57 0.75 0.00 3.64 0.11 0.53 116.57 121.94 1k1d h LYS 174 Ca 0.00 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1k1d h LYS 174 Cb 0.20 -0.13 0.01 0.00 -0.41 0.00 0.00 32.23 31.90 1k1d h LYS 174 CO -0.02 0.37 -0.36 1.49 -2.27 0.00 0.00 179.45 178.67 1k1d h GLU 175 N 0.58 -0.96 0.00 1.90 4.81 -0.33 -3.25 114.58 117.33 1k1d h GLU 175 Ca 0.27 0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.55 1k1d h GLU 175 Cb 0.19 0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.78 1k1d h GLU 175 CO -0.19 -0.62 -0.10 -0.07 -0.73 0.00 0.00 179.01 177.30 1k1d h LEU 176 N -1.17 0.00 -0.91 1.64 3.38 0.40 -3.47 115.31 115.18 1k1d h LEU 176 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1k1d h LEU 176 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1k1d h LEU 176 CO 0.17 0.10 0.00 0.61 0.09 0.00 0.00 178.44 179.41 1k1d n GLY 177 N 0.02 0.52 3.40 0.83 0.00 0.17 -5.06 105.19 105.07 1k1d n GLY 177 Ca 0.00 -0.24 -0.20 0.00 0.00 0.00 0.00 46.02 45.58 1k1d n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k1d s ALA 178 N -2.01 2.23 -0.18 4.61 0.00 -0.35 -3.97 121.76 122.09 1k1d s ALA 178 Ca 0.00 -1.81 -0.06 0.00 0.00 0.00 0.00 51.96 50.09 1k1d s ALA 178 Cb 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.16 1k1d s ALA 178 CO 0.00 -0.01 0.03 -1.17 0.00 0.00 0.00 175.76 174.61 1k1d s LEU 179 N -3.40 3.56 -0.16 0.00 2.96 -0.52 -4.43 118.68 116.70 1k1d s LEU 179 Ca 0.27 -0.03 -0.22 0.00 -0.22 0.00 0.00 54.13 53.93 1k1d s LEU 179 Cb 0.02 -1.89 -0.03 0.00 0.50 0.00 0.00 46.19 44.79 1k1d s LEU 179 CO 0.10 0.15 0.67 -0.69 -1.32 0.00 0.00 176.35 175.26 1k1d s VAL 180 N 0.52 5.01 0.10 1.68 1.01 -1.12 -1.70 120.40 125.89 1k1d s VAL 180 Ca 0.01 1.31 0.03 0.00 0.00 0.00 0.00 61.98 63.33 1k1d s VAL 180 Cb -0.13 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 1k1d s VAL 180 CO 0.02 0.14 0.10 -0.04 0.00 0.00 0.00 175.10 175.32 1k1d s MET 181 N 1.63 2.93 -0.03 2.72 1.00 -0.13 -1.62 119.30 125.80 1k1d s MET 181 Ca 0.32 -0.70 -0.02 0.00 0.00 0.00 0.00 55.69 55.29 1k1d s MET 181 Cb -0.16 -2.74 0.02 0.00 0.00 0.00 0.00 34.83 31.95 1k1d s MET 181 CO 0.12 0.55 0.08 0.08 0.00 0.00 0.00 175.02 175.85 1k1d s VAL 182 N -1.47 -0.02 -0.68 -6.03 1.01 -0.86 -0.63 120.40 111.73 1k1d s VAL 182 Ca 0.30 0.07 -0.16 0.00 0.00 0.00 0.00 61.98 62.19 1k1d s VAL 182 Cb -0.12 -0.13 0.15 0.00 0.00 0.00 0.00 36.38 36.29 1k1d s VAL 182 CO 0.23 0.03 0.68 -2.28 0.00 0.00 0.00 175.10 173.76 1k1d s HIS 183 N 0.41 3.36 -1.09 5.22 2.46 -0.31 -1.80 115.29 123.55 1k1d s HIS 183 Ca -0.03 -1.46 -0.19 0.00 0.47 0.00 0.00 55.06 53.85 1k1d s HIS 183 Cb -0.04 -3.89 0.09 0.00 -0.13 0.00 0.00 32.58 28.61 1k1d s HIS 183 CO -0.02 -1.11 1.42 0.00 -2.47 0.00 0.00 174.74 172.57 1k1d s ALA 184 N 1.44 3.22 -0.04 1.58 0.00 -1.26 -1.57 121.76 125.13 1k1d s ALA 184 Ca 0.12 -2.71 -0.03 0.00 0.00 0.00 0.00 51.96 49.34 1k1d s ALA 184 Cb -0.20 -4.36 0.02 0.00 0.00 0.00 0.00 23.12 18.57 1k1d s ALA 184 CO -0.01 -3.25 0.10 -1.21 0.00 0.00 0.00 175.76 171.39 1k1d s GLU 185 N 3.67 0.10 -1.01 0.00 2.02 -1.26 -4.30 118.70 117.92 1k1d s GLU 185 Ca 0.44 0.19 -0.23 0.00 0.02 0.00 0.00 54.97 55.38 1k1d s GLU 185 Cb -0.01 -0.01 -0.02 0.00 0.10 0.00 0.00 34.13 34.20 1k1d s GLU 185 CO -0.04 -0.05 1.79 1.21 0.02 0.00 0.00 175.26 178.19 1k1d s ASN 186 N 0.32 5.64 0.23 -0.19 3.84 -0.91 -2.83 114.94 121.05 1k1d s ASN 186 Ca -0.02 -1.20 -0.08 0.00 0.21 0.00 0.00 52.86 51.77 1k1d s ASN 186 Cb -0.03 -2.57 0.39 0.00 -0.55 0.00 0.00 41.25 38.49 1k1d s ASN 186 CO -0.01 -2.33 1.66 1.23 -2.79 0.00 0.00 177.10 174.86 1k1d h GLY 187 N 16.02 0.83 1.04 1.21 0.00 -1.82 -1.54 103.07 118.82 1k1d h GLY 187 Ca 0.17 0.05 0.02 0.00 0.00 0.00 0.00 47.33 47.57 1k1d h GLY 187 CO 1.29 -0.22 0.61 -0.55 0.00 0.00 0.00 176.54 177.67 1k1d h ASP 188 N 0.16 1.04 0.02 0.19 3.32 -1.88 -0.10 116.42 119.17 1k1d h ASP 188 Ca 0.38 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.31 1k1d h ASP 188 Cb 0.64 -0.25 0.01 0.00 0.22 0.00 0.00 39.33 39.95 1k1d h ASP 188 CO -0.56 0.74 -0.40 0.58 -1.72 0.00 0.00 179.24 177.88 1k1d h VAL 189 N 1.22 1.54 -0.97 -1.35 2.07 -1.87 -3.09 116.25 113.81 1k1d h VAL 189 Ca 0.35 -2.12 0.20 0.00 0.82 0.00 0.00 66.70 65.95 1k1d h VAL 189 Cb -0.09 2.88 -0.09 0.00 -1.52 0.00 0.00 31.29 32.47 1k1d h VAL 189 CO -0.09 0.59 0.61 0.40 0.02 0.00 0.00 177.57 179.11 1k1d h ILE 190 N -0.45 0.68 0.50 4.57 2.04 -1.11 -1.45 117.51 122.29 1k1d h ILE 190 Ca -0.06 -0.20 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 1k1d h ILE 190 Cb 1.19 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 1k1d h ILE 190 CO 0.08 0.11 -0.31 -0.78 0.00 0.00 0.00 178.15 177.24 1k1d h ASP 191 N 0.58 -0.79 -0.57 1.72 1.82 -0.99 0.13 116.42 118.31 1k1d h ASP 191 Ca 0.53 0.05 0.02 0.00 -0.39 0.00 0.00 57.03 57.24 1k1d h ASP 191 Cb 1.07 0.24 -0.03 0.00 0.68 0.00 0.00 39.33 41.28 1k1d h ASP 191 CO -0.28 -0.49 0.36 1.88 -1.61 0.00 0.00 179.24 179.10 1k1d h TYR 192 N -0.77 0.67 -0.50 0.28 -1.99 -1.23 -0.60 116.97 112.83 1k1d h TYR 192 Ca -0.06 0.02 0.06 0.00 2.00 0.00 0.00 58.73 60.75 1k1d h TYR 192 Cb 0.64 -0.22 -0.05 0.00 2.00 0.00 0.00 36.73 39.09 1k1d h TYR 192 CO -0.10 0.39 0.20 -0.07 -0.00 0.00 0.00 178.16 178.58 1k1d h LEU 193 N 0.71 0.23 0.29 3.88 3.38 -1.11 0.17 115.31 122.85 1k1d h LEU 193 Ca 0.22 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 1k1d h LEU 193 Cb -0.01 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1k1d h LEU 193 CO -0.08 0.16 -0.20 0.74 0.09 0.00 0.00 178.44 179.14 1k1d h THR 194 N 0.39 0.57 -0.25 0.22 2.02 -0.13 0.56 112.91 116.29 1k1d h THR 194 Ca 0.24 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.46 1k1d h THR 194 Cb 0.23 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 1k1d h THR 194 CO -0.22 0.00 -0.03 0.11 0.37 0.00 0.00 175.52 175.75 1k1d h LYS 195 N -0.49 0.04 -0.55 6.66 1.57 -0.64 -2.20 116.57 120.96 1k1d h LYS 195 Ca -0.02 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1k1d h LYS 195 Cb 0.42 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 1k1d h LYS 195 CO 0.00 0.02 0.30 -0.22 -0.57 0.00 0.00 179.45 178.99 1k1d h LYS 196 N 0.04 0.78 -0.30 3.15 3.64 -0.51 -0.50 116.57 122.86 1k1d h LYS 196 Ca 0.12 -0.09 0.07 0.00 -1.27 0.00 0.00 60.65 59.47 1k1d h LYS 196 Cb 0.17 -0.15 -0.08 0.00 -0.41 0.00 0.00 32.23 31.76 1k1d h LYS 196 CO -0.23 0.60 -0.31 0.00 -2.27 0.00 0.00 179.45 177.24 1k1d h ALA 197 N 1.13 -0.23 -0.21 5.00 0.00 -0.46 -0.41 119.26 124.09 1k1d h ALA 197 Ca 0.19 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.20 1k1d h ALA 197 Cb 0.06 0.65 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1k1d h ALA 197 CO -0.03 -0.74 0.06 -0.07 0.00 0.00 0.00 179.25 178.48 1k1d h LEU 198 N -0.29 0.07 -2.05 0.00 3.38 -1.17 -1.12 115.31 114.12 1k1d h LEU 198 Ca 0.14 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.16 1k1d h LEU 198 Cb 0.53 0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 1k1d h LEU 198 CO -0.46 0.07 0.33 0.00 0.09 0.00 0.00 178.44 178.47 1k1d h ALA 199 N 1.13 1.46 -0.51 1.53 0.00 0.13 0.32 119.26 123.33 1k1d h ALA 199 Ca 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1k1d h ALA 199 Cb 0.06 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1k1d h ALA 199 CO -0.10 -0.37 0.00 -0.25 0.00 0.00 0.00 179.25 178.53 1k1d n ASP 200 N -3.06 3.63 0.00 0.00 8.00 -0.28 -4.96 116.55 119.87 1k1d n ASP 200 Ca -0.00 -2.16 0.00 0.00 0.71 0.00 0.00 54.79 53.34 1k1d n ASP 200 Cb 0.40 -0.39 0.00 0.00 -0.02 0.00 0.00 41.12 41.11 1k1d n ASP 200 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k1d n GLY 201 N 0.87 1.03 3.55 0.44 0.00 0.11 -4.98 105.19 106.21 1k1d n GLY 201 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1k1d n GLY 201 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1k1d s ASN 202 N -3.03 6.11 -0.00 1.61 0.01 -0.62 -4.74 114.94 114.28 1k1d s ASN 202 Ca 0.00 -0.51 0.03 0.00 -0.71 0.00 0.00 52.86 51.66 1k1d s ASN 202 Cb 0.00 -2.56 -0.03 0.00 0.41 0.00 0.00 41.25 39.07 1k1d s ASN 202 CO 0.00 -1.86 0.09 0.35 -1.51 0.00 0.00 177.10 174.17 1k1d n THR 203 N 6.54 0.00 -0.94 1.60 -2.24 -1.26 -3.90 114.28 114.08 1k1d n THR 203 Ca 0.09 -0.28 -0.33 0.00 -2.27 0.00 0.00 64.05 61.25 1k1d n THR 203 Cb 0.49 0.77 0.13 0.00 -2.10 0.00 0.00 70.33 69.62 1k1d n THR 203 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1k1d n ASP 204 N -1.28 -0.32 -0.27 3.42 8.00 -1.26 -1.70 116.55 123.14 1k1d n ASP 204 Ca 0.00 0.48 0.26 0.00 0.71 0.00 0.00 54.79 56.23 1k1d n ASP 204 Cb 0.05 -1.38 0.61 0.00 -0.02 0.00 0.00 41.12 40.38 1k1d n ASP 204 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 1k1d h PRO 205 N -1.25 0.22 -0.07 -0.24 0.11 -1.92 -1.48 132.00 127.38 1k1d h PRO 205 Ca -0.45 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 1k1d h PRO 205 Cb 1.29 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1k1d h PRO 205 CO 0.41 0.15 -0.17 0.97 -0.21 0.00 0.00 178.00 179.15 1k1d h ILE 206 N 0.23 1.16 0.00 4.15 2.10 -1.89 -1.56 117.51 121.70 1k1d h ILE 206 Ca 0.52 -0.72 0.00 0.00 1.08 0.00 0.00 64.86 65.74 1k1d h ILE 206 Cb 1.63 1.29 0.00 0.00 -1.09 0.00 0.00 36.82 38.65 1k1d h ILE 206 CO -0.15 0.21 0.00 -1.22 -1.08 0.00 0.00 178.15 175.92 1k1d n TYR 207 N -4.29 0.02 -0.14 2.19 4.02 -0.56 -0.87 117.16 117.53 1k1d n TYR 207 Ca -0.02 0.01 -0.10 0.00 -0.01 0.00 0.00 57.90 57.78 1k1d n TYR 207 Cb 0.26 -0.51 0.04 0.00 -0.02 0.00 0.00 39.34 39.11 1k1d n TYR 207 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1k1d h HIS 208 N 0.00 1.04 0.00 -0.72 2.76 -1.42 0.10 115.15 116.91 1k1d h HIS 208 Ca 0.00 -0.24 -0.00 0.00 -2.20 0.00 0.00 60.37 57.93 1k1d h HIS 208 Cb 0.18 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 28.89 1k1d h HIS 208 CO 0.00 1.02 -0.01 0.00 -1.30 0.00 0.00 177.93 177.64 1k1d h ALA 209 N 0.97 -0.00 0.00 5.26 0.00 -1.15 -3.31 119.26 121.04 1k1d h ALA 209 Ca 0.11 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 1k1d h ALA 209 Cb 0.74 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1k1d h ALA 209 CO 0.06 -0.04 -0.08 -0.07 0.00 0.00 0.00 179.25 179.12 1k1d h LEU 210 N -0.90 0.00 -0.22 0.00 3.38 -1.42 -1.15 115.31 115.00 1k1d h LEU 210 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1k1d h LEU 210 Cb 0.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1k1d h LEU 210 CO 0.00 0.08 0.00 1.07 0.09 0.00 0.00 178.44 179.68 1k1d n THR 211 N -3.88 0.76 -3.25 0.22 5.66 0.02 -4.15 114.28 109.66 1k1d n THR 211 Ca -0.02 0.15 -0.23 0.00 -3.05 0.00 0.00 64.05 60.89 1k1d n THR 211 Cb 0.17 -0.93 -0.07 0.00 -1.55 0.00 0.00 70.33 67.94 1k1d n THR 211 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 175.07 169.91 1k1d n ARG 212 N -1.81 0.40 -1.67 1.09 1.85 -0.43 -4.47 116.66 111.61 1k1d n ARG 212 Ca 0.04 -3.02 -0.38 0.00 -1.00 0.00 0.00 57.85 53.49 1k1d n ARG 212 Cb 0.24 -1.51 0.06 0.00 -1.05 0.00 0.00 32.46 30.20 1k1d n ARG 212 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1k1d n PRO 213 N 2.36 1.07 0.28 2.89 -0.04 -1.25 -4.78 135.00 135.54 1k1d n PRO 213 Ca 0.25 0.41 0.18 0.00 -0.04 0.00 0.00 63.50 64.31 1k1d n PRO 213 Cb 0.51 -2.35 0.94 0.00 -0.04 0.00 0.00 33.50 32.55 1k1d n PRO 213 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1k1d h PRO 214 N 0.61 0.00 -0.80 0.54 0.13 -1.98 -0.64 132.00 129.86 1k1d h PRO 214 Ca -0.50 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.69 1k1d h PRO 214 Cb 1.35 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.42 1k1d h PRO 214 CO 0.52 0.00 0.49 0.93 -0.23 0.00 0.00 178.00 179.71 1k1d h GLU 215 N 0.00 0.87 0.00 0.86 3.07 -1.99 0.26 114.58 117.65 1k1d h GLU 215 Ca 0.04 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 58.82 1k1d h GLU 215 Cb 0.43 -0.20 -0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1k1d h GLU 215 CO -0.00 0.58 -0.11 -0.07 -1.40 0.00 0.00 179.01 178.01 1k1d h LEU 216 N 0.90 0.00 0.21 1.33 3.38 -1.46 0.22 115.31 119.90 1k1d h LEU 216 Ca 0.35 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 58.04 1k1d h LEU 216 Cb 0.16 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.95 1k1d h LEU 216 CO -0.17 0.11 -1.26 -0.08 0.09 0.00 0.00 178.44 177.13 1k1d h GLU 217 N 0.00 0.45 -0.15 1.13 4.81 -1.08 -2.34 114.58 117.40 1k1d h GLU 217 Ca -0.00 -0.78 -0.01 0.00 -0.13 0.00 0.00 59.36 58.44 1k1d h GLU 217 Cb 0.58 0.29 -0.01 0.00 0.63 0.00 0.00 28.75 30.25 1k1d h GLU 217 CO 0.01 1.37 0.04 0.78 -0.73 0.00 0.00 179.01 180.48 1k1d h GLY 218 N -0.02 0.26 0.19 1.92 0.00 -0.79 -0.04 103.07 104.59 1k1d h GLY 218 Ca -0.22 -0.16 0.02 0.00 0.00 0.00 0.00 47.33 46.96 1k1d h GLY 218 CO 0.23 0.15 -0.48 -2.09 0.00 0.00 0.00 176.54 174.36 1k1d h GLU 219 N 0.05 -0.68 -0.21 4.80 4.22 -0.66 0.66 114.58 122.76 1k1d h GLU 219 Ca 0.05 0.05 0.05 0.00 0.08 0.00 0.00 59.36 59.59 1k1d h GLU 219 Cb 0.26 0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.61 1k1d h GLU 219 CO 0.00 -0.45 -0.14 0.00 -2.18 0.00 0.00 179.01 176.24 1k1d h ALA 220 N -0.34 0.01 -0.82 2.92 0.00 -1.45 -0.42 119.26 119.16 1k1d h ALA 220 Ca 0.01 0.08 0.16 0.00 0.00 0.00 0.00 54.91 55.16 1k1d h ALA 220 Cb 0.72 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 1k1d h ALA 220 CO -0.27 -0.57 0.55 1.15 0.00 0.00 0.00 179.25 180.10 1k1d h THR 221 N -0.14 0.77 -0.01 0.00 2.02 -0.47 -1.60 112.91 113.48 1k1d h THR 221 Ca 0.12 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.14 1k1d h THR 221 Cb 0.32 0.26 -0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1k1d h THR 221 CO -0.30 0.09 0.00 1.23 0.37 0.00 0.00 175.52 176.91 1k1d h GLY 222 N 0.47 0.02 0.45 2.16 0.00 0.81 -2.15 103.07 104.83 1k1d h GLY 222 Ca 0.41 -0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.75 1k1d h GLY 222 CO -0.15 0.01 -0.34 3.21 0.00 0.00 0.00 176.54 179.27 1k1d h ARG 223 N -0.20 -0.57 -0.83 4.80 3.08 -0.76 0.38 114.38 120.28 1k1d h ARG 223 Ca 0.00 0.04 0.20 0.00 0.07 0.00 0.00 59.98 60.30 1k1d h ARG 223 Cb 0.22 0.13 -0.14 0.00 0.08 0.00 0.00 29.97 30.26 1k1d h ARG 223 CO 0.00 -0.38 0.06 0.00 -1.07 0.00 0.00 179.97 178.58 1k1d h ALA 224 N 0.00 0.96 0.52 0.04 0.00 -1.34 0.46 119.26 119.90 1k1d h ALA 224 Ca 0.02 0.26 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 1k1d h ALA 224 Cb 0.60 0.43 0.01 0.00 0.00 0.00 0.00 17.79 18.83 1k1d h ALA 224 CO -0.17 -0.45 -0.25 0.00 0.00 0.00 0.00 179.25 178.38 1k1d h GLN 226 N -0.98 0.17 -0.42 0.00 4.20 0.72 0.16 115.11 118.97 1k1d h GLN 226 Ca -0.07 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 1k1d h GLN 226 Cb 0.62 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.34 1k1d h GLN 226 CO 0.12 0.11 0.20 -0.07 -0.67 0.00 0.00 178.83 178.52 1k1d h LEU 227 N 0.18 0.56 -1.81 1.46 3.38 -0.10 -0.62 115.31 118.35 1k1d h LEU 227 Ca 0.29 -0.14 0.10 0.00 0.09 0.00 0.00 57.88 58.22 1k1d h LEU 227 Cb 0.43 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1k1d h LEU 227 CO -0.42 0.54 0.33 0.74 0.09 0.00 0.00 178.44 179.72 1k1d h THR 228 N 0.54 0.87 0.35 0.22 2.02 0.12 0.30 112.91 117.33 1k1d h THR 228 Ca 0.14 -0.07 -0.02 0.00 0.77 0.00 0.00 66.41 67.23 1k1d h THR 228 Cb 0.13 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1k1d h THR 228 CO -0.02 0.04 -0.17 -0.08 0.37 0.00 0.00 175.52 175.66 1k1d h GLU 229 N 0.21 -0.46 -0.49 6.66 4.81 0.14 0.03 114.58 125.48 1k1d h GLU 229 Ca 0.22 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.58 1k1d h GLU 229 Cb 0.59 0.10 -0.10 0.00 0.63 0.00 0.00 28.75 29.97 1k1d h GLU 229 CO -0.04 -0.14 -0.20 1.25 -0.73 0.00 0.00 179.01 179.15 1k1d h LEU 230 N -0.92 -0.71 -1.51 1.64 5.85 -0.28 0.72 115.31 120.10 1k1d h LEU 230 Ca -0.05 0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 1k1d h LEU 230 Cb 0.53 0.40 -0.00 0.00 0.37 0.00 0.00 40.66 41.96 1k1d h LEU 230 CO 0.08 -0.23 -0.14 0.00 -0.34 0.00 0.00 178.44 177.81 1k1d h ALA 231 N 1.27 1.09 -0.71 1.25 0.00 -1.01 -3.47 119.26 117.67 1k1d h ALA 231 Ca 0.23 -0.12 -0.18 0.00 0.00 0.00 0.00 54.91 54.84 1k1d h ALA 231 Cb 0.45 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 1k1d h ALA 231 CO -0.55 0.17 -0.19 0.41 0.00 0.00 0.00 179.25 179.09 1k1d n GLY 232 N -0.17 0.72 0.00 0.00 0.00 0.24 -4.82 105.19 101.16 1k1d n GLY 232 Ca -0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1k1d n GLY 232 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1k1d n SER 233 N 0.46 0.00 -4.18 1.61 3.41 -0.92 -4.99 113.62 109.00 1k1d n SER 233 Ca -0.10 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.25 1k1d n SER 233 Cb 0.39 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.18 1k1d n SER 233 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k1d s GLN 234 N 4.01 1.71 0.20 4.33 0.00 -1.26 -4.43 119.66 124.22 1k1d s GLN 234 Ca 0.00 -0.68 0.11 0.00 -0.00 0.00 0.00 55.36 54.78 1k1d s GLN 234 Cb 0.00 -1.58 -0.04 0.00 0.00 0.00 0.00 33.01 31.39 1k1d s GLN 234 CO 0.00 0.36 -0.18 -1.17 0.00 0.00 0.00 175.29 174.30 1k1d s LEU 235 N -0.27 2.65 -0.30 2.60 2.96 -0.45 -2.81 118.68 123.05 1k1d s LEU 235 Ca 0.03 -0.79 -0.00 0.00 -0.22 0.00 0.00 54.13 53.15 1k1d s LEU 235 Cb -0.09 -1.33 0.14 0.00 0.50 0.00 0.00 46.19 45.40 1k1d s LEU 235 CO 0.01 0.10 0.29 -0.47 -1.32 0.00 0.00 176.35 174.96 1k1d s TYR 236 N -1.79 -0.38 -0.22 5.38 6.14 -0.64 -0.93 117.35 124.91 1k1d s TYR 236 Ca 0.23 -0.31 -0.29 0.00 0.64 0.00 0.00 57.07 57.34 1k1d s TYR 236 Cb -0.08 -0.49 0.00 0.00 0.42 0.00 0.00 41.96 41.81 1k1d s TYR 236 CO 0.12 -0.92 1.14 0.08 0.64 0.00 0.00 175.55 176.62 1k1d s VAL 237 N 2.22 4.48 0.47 3.14 1.01 0.18 -2.02 120.40 129.88 1k1d s VAL 237 Ca 0.10 1.78 -0.14 0.00 0.00 0.00 0.00 61.98 63.72 1k1d s VAL 237 Cb -0.14 -4.20 -0.07 0.00 0.00 0.00 0.00 36.38 31.97 1k1d s VAL 237 CO -0.29 -0.21 0.90 0.68 0.00 0.00 0.00 175.10 176.17 1k1d s VAL 238 N 3.43 4.64 -0.44 2.92 -7.23 -0.74 -1.58 120.40 121.39 1k1d s VAL 238 Ca 0.49 0.97 -0.06 0.00 -1.81 0.00 0.00 61.98 61.57 1k1d s VAL 238 Cb -0.17 -3.73 0.01 0.00 0.56 0.00 0.00 36.38 33.05 1k1d s VAL 238 CO 0.11 -0.62 0.37 0.00 -0.31 0.00 0.00 175.10 174.66 1k1d n HIS 239 N -1.46 -1.33 -2.35 2.82 1.44 -1.09 -4.69 115.22 108.57 1k1d n HIS 239 Ca 0.05 0.55 -0.42 0.00 -2.01 0.00 0.00 57.72 55.88 1k1d n HIS 239 Cb 0.54 -1.51 -0.03 0.00 0.12 0.00 0.00 29.99 29.12 1k1d n HIS 239 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1k1d s VAL 240 N -2.16 3.97 -0.06 0.61 1.01 0.45 -4.76 120.40 119.45 1k1d s VAL 240 Ca 0.06 1.34 -0.08 0.00 0.00 0.00 0.00 61.98 63.30 1k1d s VAL 240 Cb -0.01 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 1k1d s VAL 240 CO 0.54 0.01 -0.17 0.41 0.00 0.00 0.00 175.10 175.90 1k1d n THR 241 N 4.54 1.16 -2.65 3.92 -1.04 -1.26 -4.63 114.28 114.31 1k1d n THR 241 Ca 0.12 0.13 -0.21 0.00 -2.04 0.00 0.00 64.05 62.05 1k1d n THR 241 Cb 0.45 -1.86 0.05 0.00 -1.82 0.00 0.00 70.33 67.15 1k1d n THR 241 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1k1d h ALA 243 N -0.03 0.11 -0.87 0.00 0.00 -1.95 -2.77 119.26 113.76 1k1d h ALA 243 Ca -0.40 -0.21 0.23 0.00 0.00 0.00 0.00 54.91 54.52 1k1d h ALA 243 Cb 1.29 -0.03 -0.14 0.00 0.00 0.00 0.00 17.79 18.91 1k1d h ALA 243 CO 0.49 -0.16 0.20 1.96 0.00 0.00 0.00 179.25 181.74 1k1d h GLN 244 N -0.18 0.18 -0.15 0.00 7.50 -1.96 0.30 115.11 120.80 1k1d h GLN 244 Ca 0.02 -0.01 -0.02 0.00 0.50 0.00 0.00 58.65 59.14 1k1d h GLN 244 Cb 0.43 -0.04 -0.01 0.00 0.05 0.00 0.00 27.48 27.91 1k1d h GLN 244 CO 0.01 0.12 0.01 0.00 -1.50 0.00 0.00 178.83 177.47 1k1d h ALA 245 N 1.79 0.20 -0.90 3.87 0.00 -1.83 -2.49 119.26 119.89 1k1d h ALA 245 Ca 0.54 -0.17 0.10 0.00 0.00 0.00 0.00 54.91 55.38 1k1d h ALA 245 Cb 1.08 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.74 1k1d h ALA 245 CO -0.67 -0.13 0.54 0.28 0.00 0.00 0.00 179.25 179.27 1k1d h VAL 246 N 0.01 0.92 0.13 0.00 2.07 -0.37 -1.87 116.25 117.14 1k1d h VAL 246 Ca 0.04 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1k1d h VAL 246 Cb 0.33 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1k1d h VAL 246 CO 0.00 0.16 -0.10 -0.08 0.02 0.00 0.00 177.57 177.58 1k1d h GLU 247 N 0.89 -0.23 -0.38 1.57 4.81 -0.36 -0.54 114.58 120.33 1k1d h GLU 247 Ca 0.44 0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.75 1k1d h GLU 247 Cb 0.40 0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.78 1k1d h GLU 247 CO -0.25 -0.15 0.03 0.87 -0.73 0.00 0.00 179.01 178.78 1k1d h LYS 248 N -0.24 0.14 -0.11 1.92 1.79 -0.95 0.55 116.57 119.67 1k1d h LYS 248 Ca -0.00 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.43 1k1d h LYS 248 Cb 0.22 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.83 1k1d h LYS 248 CO -0.01 0.09 -0.05 0.82 -1.08 0.00 0.00 179.45 179.22 1k1d h ILE 249 N 0.14 1.11 -0.16 1.86 2.04 -1.14 -1.53 117.51 119.82 1k1d h ILE 249 Ca 0.19 -0.45 -0.05 0.00 1.00 0.00 0.00 64.86 65.55 1k1d h ILE 249 Cb 0.25 1.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.41 1k1d h ILE 249 CO -0.28 0.14 -0.10 0.00 0.00 0.00 0.00 178.15 177.90 1k1d h ALA 250 N 1.80 0.23 -0.06 1.87 0.00 0.69 -2.23 119.26 121.56 1k1d h ALA 250 Ca 0.04 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.68 1k1d h ALA 250 Cb 0.20 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1k1d h ALA 250 CO 0.01 0.07 -0.11 0.93 0.00 0.00 0.00 179.25 180.14 1k1d h GLU 251 N 0.01 -0.16 -0.12 0.00 5.08 -0.60 -1.49 114.58 117.30 1k1d h GLU 251 Ca 0.03 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.44 1k1d h GLU 251 Cb 0.60 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.82 1k1d h GLU 251 CO 0.03 -0.10 -0.47 0.00 -1.00 0.00 0.00 179.01 177.47 1k1d h ALA 252 N 0.86 -0.71 0.00 3.43 0.00 -1.23 -0.40 119.26 121.21 1k1d h ALA 252 Ca 0.06 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1k1d h ALA 252 Cb 0.25 0.86 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1k1d h ALA 252 CO -0.16 -0.99 -0.02 0.00 0.00 0.00 0.00 179.25 178.08 1k1d h ARG 253 N -0.54 0.00 -0.34 0.00 3.08 -1.23 -1.08 114.38 114.27 1k1d h ARG 253 Ca 0.06 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.97 1k1d h ARG 253 Cb 0.66 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 1k1d h ARG 253 CO -0.41 0.02 -0.33 -0.91 -1.07 0.00 0.00 179.97 177.28 1k1d h ASN 254 N 0.00 0.88 0.00 7.04 2.35 -0.02 -2.53 115.58 123.30 1k1d h ASN 254 Ca -0.00 -0.47 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 1k1d h ASN 254 Cb 0.08 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.20 1k1d h ASN 254 CO 0.00 1.16 0.00 0.29 -1.65 0.00 0.00 177.43 177.24 1k1d n LYS 255 N -4.16 0.62 -0.72 0.81 5.02 -0.45 -4.81 118.16 114.46 1k1d n LYS 255 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 1k1d n LYS 255 Cb 0.51 -1.20 0.00 0.00 -0.02 0.00 0.00 35.03 34.32 1k1d n LYS 255 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k1d n GLY 256 N 0.16 1.54 3.66 0.72 0.00 -0.95 -5.00 105.19 105.32 1k1d n GLY 256 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1k1d n GLY 256 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k1d n LEU 257 N 0.00 4.40 -3.89 0.99 4.77 -0.95 -4.87 117.00 117.46 1k1d n LEU 257 Ca 0.00 0.87 -0.43 0.00 -0.03 0.00 0.00 56.01 56.42 1k1d n LEU 257 Cb 0.00 -1.46 0.01 0.00 -2.33 0.00 0.00 43.42 39.64 1k1d n LEU 257 CO 0.00 -1.40 1.86 -0.67 -1.33 0.00 0.00 177.39 175.84 1k1d n ASP 258 N -0.90 5.24 -4.60 -1.43 -0.08 -1.26 -4.35 116.55 109.17 1k1d n ASP 258 Ca 0.13 -3.14 -0.31 0.00 -1.51 0.00 0.00 54.79 49.95 1k1d n ASP 258 Cb 0.46 -1.46 -0.10 0.00 2.34 0.00 0.00 41.12 42.37 1k1d n ASP 258 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1k1d s VAL 259 N 0.03 3.59 0.06 5.18 1.01 -1.26 -1.35 120.40 127.66 1k1d s VAL 259 Ca 0.39 -0.94 0.03 0.00 0.00 0.00 0.00 61.98 61.46 1k1d s VAL 259 Cb 0.09 -2.60 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 1k1d s VAL 259 CO 0.02 0.29 -0.10 0.26 0.00 0.00 0.00 175.10 175.56 1k1d s TRP 260 N -1.08 0.92 0.06 5.22 0.52 -0.11 -4.83 118.94 119.64 1k1d s TRP 260 Ca 0.19 -0.52 0.07 0.00 0.02 0.00 0.00 56.10 55.86 1k1d s TRP 260 Cb -0.11 -0.53 -0.03 0.00 -1.15 0.00 0.00 33.47 31.65 1k1d s TRP 260 CO 0.10 -0.02 -0.19 0.20 0.02 0.00 0.00 176.95 177.06 1k1d s GLY 261 N -1.80 1.08 0.05 0.98 0.00 -1.26 0.49 107.32 106.86 1k1d s GLY 261 Ca -0.04 -1.06 0.03 0.00 0.00 0.00 0.00 44.72 43.65 1k1d s GLY 261 CO 0.01 -1.02 -0.10 1.85 0.00 0.00 0.00 173.10 173.83 1k1d s GLU 262 N -1.39 0.64 0.37 2.90 2.12 -0.62 -1.64 118.70 121.08 1k1d s GLU 262 Ca 0.06 -0.83 0.04 0.00 0.36 0.00 0.00 54.97 54.60 1k1d s GLU 262 Cb -0.09 -0.49 -0.03 0.00 0.26 0.00 0.00 34.13 33.78 1k1d s GLU 262 CO 0.02 0.10 0.17 0.99 -0.54 0.00 0.00 175.26 176.00 1k1d s THR 263 N -1.33 0.41 0.02 -1.70 2.01 -0.36 0.17 115.64 114.85 1k1d s THR 263 Ca -0.07 -2.00 0.02 0.00 0.31 0.00 0.00 61.69 59.95 1k1d s THR 263 Cb -0.10 -2.42 -0.01 0.00 0.01 0.00 0.00 72.50 69.98 1k1d s THR 263 CO 0.01 0.00 -0.06 0.00 -0.69 0.00 0.00 174.62 173.88 1k1d h PRO 265 N 5.26 -0.00 -0.81 0.00 0.13 -1.89 0.37 132.00 135.05 1k1d h PRO 265 Ca -0.32 0.00 0.23 0.00 -0.87 0.00 0.00 66.00 65.05 1k1d h PRO 265 Cb 1.20 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.30 1k1d h PRO 265 CO 0.45 -0.00 0.66 -0.56 -0.23 0.00 0.00 178.00 178.33 1k1d h GLN 266 N -0.00 0.00 0.00 0.86 -0.00 -1.92 0.64 115.11 114.68 1k1d h GLN 266 Ca 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.07 1k1d h GLN 266 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.12 1k1d h GLN 266 CO -0.91 0.00 -0.83 0.66 -0.00 0.00 0.00 178.83 177.74 1k1d n TYR 267 N -4.00 0.56 -0.00 0.06 4.02 0.10 -1.86 117.16 116.04 1k1d n TYR 267 Ca 0.17 0.16 -0.10 0.00 -0.01 0.00 0.00 57.90 58.12 1k1d n TYR 267 Cb 0.95 -0.66 -0.14 0.00 -0.02 0.00 0.00 39.34 39.47 1k1d n TYR 267 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1k1d h LEU 268 N 0.00 0.05 0.00 7.72 5.85 0.31 -3.42 115.31 125.82 1k1d h LEU 268 Ca 0.00 -0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.50 1k1d h LEU 268 Cb 0.80 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 1k1d h LEU 268 CO 0.00 1.09 -1.45 0.52 -0.34 0.00 0.00 178.44 178.26 1k1d n VAL 269 N -3.14 0.45 -2.40 1.05 0.31 0.25 -4.88 118.33 109.98 1k1d n VAL 269 Ca -0.16 -0.16 -0.25 0.00 -0.01 0.00 0.00 64.34 63.77 1k1d n VAL 269 Cb 1.04 -0.93 0.10 0.00 -0.91 0.00 0.00 33.84 33.14 1k1d n VAL 269 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1k1d s LEU 270 N -5.64 2.94 0.30 7.52 1.43 -0.78 -5.07 118.68 119.39 1k1d s LEU 270 Ca -0.11 -0.00 -0.14 0.00 -1.03 0.00 0.00 54.13 52.85 1k1d s LEU 270 Cb 0.03 -2.46 0.02 0.00 0.03 0.00 0.00 46.19 43.80 1k1d s LEU 270 CO 0.17 -1.81 0.62 1.51 0.23 0.00 0.00 176.35 177.08 1k1d s ASP 271 N -4.65 0.02 0.37 2.29 1.47 -1.26 -4.65 116.67 110.25 1k1d s ASP 271 Ca 0.64 -0.96 0.18 0.00 1.18 0.00 0.00 52.55 53.59 1k1d s ASP 271 Cb -0.07 0.70 1.18 0.00 -0.34 0.00 0.00 42.92 44.39 1k1d s ASP 271 CO 0.45 -1.35 1.66 -0.61 0.68 0.00 0.00 175.17 175.99 1k1d h GLN 272 N 2.10 0.25 -0.91 2.11 4.15 -0.01 -2.12 115.11 120.67 1k1d h GLN 272 Ca -0.26 -0.01 0.14 0.00 0.77 0.00 0.00 58.65 59.29 1k1d h GLN 272 Cb 1.25 -0.06 -0.09 0.00 0.21 0.00 0.00 27.48 28.79 1k1d h GLN 272 CO 0.33 0.16 0.53 0.66 -1.93 0.00 0.00 178.83 178.58 1k1d h SER 273 N 0.25 0.71 0.00 -0.69 4.64 -1.92 -0.94 113.55 115.61 1k1d h SER 273 Ca 0.75 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 62.14 1k1d h SER 273 Cb 1.88 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.91 1k1d h SER 273 CO -0.57 0.33 0.40 1.88 -0.87 0.00 0.00 176.83 178.01 1k1d h TYR 274 N 0.78 0.00 0.00 4.77 -1.99 -1.76 0.50 116.97 119.27 1k1d h TYR 274 Ca 0.48 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.21 1k1d h TYR 274 Cb 0.60 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.33 1k1d h TYR 274 CO -0.05 0.00 -0.10 1.28 -0.00 0.00 0.00 178.16 179.30 1k1d n LEU 275 N -2.60 0.79 -0.05 3.88 4.77 -0.36 -3.45 117.00 119.98 1k1d n LEU 275 Ca -0.01 0.52 -0.09 0.00 -0.03 0.00 0.00 56.01 56.40 1k1d n LEU 275 Cb 0.44 -0.30 -0.15 0.00 -2.33 0.00 0.00 43.42 41.08 1k1d n LEU 275 CO 0.10 -0.16 -0.78 -0.62 -1.33 0.00 0.00 177.39 174.59 1k1d n GLU 276 N -2.23 0.66 -1.88 3.23 1.02 0.17 -3.48 120.64 118.13 1k1d n GLU 276 Ca 0.05 0.17 -0.32 0.00 -0.02 0.00 0.00 57.16 57.03 1k1d n GLU 276 Cb 0.43 -1.68 -0.04 0.00 -0.02 0.00 0.00 31.44 30.13 1k1d n GLU 276 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1k1d s LYS 277 N -2.57 2.37 -0.13 3.49 2.20 -1.10 -4.62 119.74 119.38 1k1d s LYS 277 Ca -0.07 0.57 -0.34 0.00 -0.36 0.00 0.00 55.97 55.78 1k1d s LYS 277 Cb 0.07 -4.63 0.14 0.00 -1.51 0.00 0.00 37.83 31.91 1k1d s LYS 277 CO 0.83 -3.19 1.36 -1.25 -0.36 0.00 0.00 175.35 172.73 1k1d s PRO 278 N 7.52 0.16 4.70 4.03 0.04 -1.26 -2.07 135.00 148.11 1k1d s PRO 278 Ca 0.77 -0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.74 1k1d s PRO 278 Cb -0.12 0.06 0.00 0.00 0.04 0.00 0.00 34.50 34.48 1k1d s PRO 278 CO 0.16 -0.07 0.00 0.09 0.04 0.00 0.00 177.00 177.22 1k1d n ASN 279 N -0.33 0.00 0.00 6.66 3.02 -1.26 -1.14 115.26 122.21 1k1d n ASN 279 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.50 1k1d n ASN 279 Cb 0.61 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.78 1k1d n ASN 279 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1k1d n PHE 280 N 0.00 0.00 -0.32 3.10 7.35 -1.26 -4.83 117.46 121.50 1k1d n PHE 280 Ca 0.00 0.00 0.36 0.00 -0.76 0.00 0.00 57.45 57.05 1k1d n PHE 280 Cb 0.00 0.00 0.73 0.00 0.35 0.00 0.00 39.48 40.56 1k1d n PHE 280 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1k1d h GLU 281 N 0.00 0.00 -0.63 -4.13 4.39 -1.29 -0.94 114.58 111.99 1k1d h GLU 281 Ca 0.00 0.00 0.13 0.00 0.34 0.00 0.00 59.36 59.83 1k1d h GLU 281 Cb 0.41 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 28.96 1k1d h GLU 281 CO 0.00 0.00 0.04 0.78 -1.16 0.00 0.00 179.01 178.67 1k1d h GLY 282 N 0.00 0.71 0.14 -3.84 0.00 -1.60 -0.91 103.07 97.57 1k1d h GLY 282 Ca 0.57 0.06 0.16 0.00 0.00 0.00 0.00 47.33 48.12 1k1d h GLY 282 CO -0.01 -0.19 0.78 0.00 0.00 0.00 0.00 176.54 177.12 1k1d h ALA 283 N 1.56 2.33 0.00 3.60 0.00 -1.45 0.33 119.26 125.64 1k1d h ALA 283 Ca 0.33 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 1k1d h ALA 283 Cb 0.54 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1k1d h ALA 283 CO -0.52 -1.06 -0.08 0.87 0.00 0.00 0.00 179.25 178.46 1k1d h LYS 284 N 0.00 0.00 -0.45 0.00 1.57 -1.36 -2.65 116.57 113.68 1k1d h LYS 284 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1k1d h LYS 284 Cb 1.81 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.12 1k1d h LYS 284 CO -0.00 0.08 0.00 0.66 -0.57 0.00 0.00 179.45 179.62 1k1d n TYR 285 N -3.64 0.83 -2.65 -1.35 4.01 0.12 -4.88 117.16 109.59 1k1d n TYR 285 Ca -0.02 -0.59 -0.43 0.00 -0.16 0.00 0.00 57.90 56.70 1k1d n TYR 285 Cb 0.19 -0.12 -0.02 0.00 -0.31 0.00 0.00 39.34 39.09 1k1d n TYR 285 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1k1d s VAL 286 N -1.48 4.44 0.11 -0.72 1.01 -1.00 -4.74 120.40 118.00 1k1d s VAL 286 Ca 0.36 1.51 -0.25 0.00 0.00 0.00 0.00 61.98 63.60 1k1d s VAL 286 Cb 0.22 -4.46 0.08 0.00 0.00 0.00 0.00 36.38 32.22 1k1d s VAL 286 CO 0.19 -0.64 0.71 -1.66 0.00 0.00 0.00 175.10 173.70 1k1d s TRP 287 N 3.85 -0.46 -0.04 5.22 -2.14 -1.26 -1.75 118.94 122.37 1k1d s TRP 287 Ca 0.45 0.27 0.07 0.00 2.66 0.00 0.00 56.10 59.54 1k1d s TRP 287 Cb -0.11 0.56 -0.02 0.00 -3.10 0.00 0.00 33.47 30.80 1k1d s TRP 287 CO 0.20 -0.76 -0.23 -1.12 -2.66 0.00 0.00 176.95 172.39 1k1d s SER 288 N -2.67 3.27 0.79 -2.66 0.01 -1.26 -2.95 113.70 108.23 1k1d s SER 288 Ca 0.03 -0.42 -0.12 0.00 1.31 0.00 0.00 55.95 56.75 1k1d s SER 288 Cb -0.01 -0.58 0.07 0.00 0.21 0.00 0.00 66.02 65.71 1k1d s SER 288 CO -0.11 0.31 1.13 -2.84 0.41 0.00 0.00 173.24 172.13 1k1d s PRO 289 N -0.51 1.98 0.67 12.44 0.02 -1.26 -5.04 135.00 143.30 1k1d s PRO 289 Ca 0.07 1.41 -0.14 0.00 0.02 0.00 0.00 61.00 62.35 1k1d s PRO 289 Cb -0.11 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.57 1k1d s PRO 289 CO 0.00 -1.89 1.10 -1.25 -0.33 0.00 0.00 177.00 174.63 1k1d s PRO 290 N -4.54 2.79 0.38 5.54 0.04 -1.15 -4.98 135.00 133.07 1k1d s PRO 290 Ca 0.66 1.30 -0.28 0.00 0.04 0.00 0.00 61.00 62.72 1k1d s PRO 290 Cb -0.21 -1.95 -0.10 0.00 0.04 0.00 0.00 34.50 32.27 1k1d s PRO 290 CO 0.52 -1.25 1.43 -0.51 0.04 0.00 0.00 177.00 177.24 1k1d s LEU 291 N -5.03 4.31 0.00 -3.56 1.43 -1.26 -4.98 118.68 109.60 1k1d s LEU 291 Ca 0.65 2.94 0.02 0.00 -1.03 0.00 0.00 54.13 56.70 1k1d s LEU 291 Cb -0.19 -3.71 0.02 0.00 0.03 0.00 0.00 46.19 42.34 1k1d s LEU 291 CO 0.44 -0.83 0.13 0.54 0.23 0.00 0.00 176.35 176.86 1k1d n ARG 292 N 0.44 1.03 -2.37 1.70 5.12 -1.26 -3.94 116.66 117.39 1k1d n ARG 292 Ca 0.01 -0.59 -0.41 0.00 -1.93 0.00 0.00 57.85 54.93 1k1d n ARG 292 Cb 0.40 -0.02 -0.04 0.00 -1.16 0.00 0.00 32.46 31.65 1k1d n ARG 292 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1k1d s GLU 293 N -2.47 4.52 0.23 5.56 2.02 -1.26 0.55 118.70 127.86 1k1d s GLU 293 Ca 0.10 1.90 0.14 0.00 0.02 0.00 0.00 54.97 57.13 1k1d s GLU 293 Cb -0.01 -3.20 0.83 0.00 0.10 0.00 0.00 34.13 31.86 1k1d s GLU 293 CO 0.06 -0.00 0.96 1.17 0.02 0.00 0.00 175.26 177.47 1k1d n LYS 294 N 1.82 -0.03 0.30 1.61 3.00 -1.26 -1.20 118.16 122.39 1k1d n LYS 294 Ca 0.02 0.83 0.17 0.00 -0.00 0.00 0.00 58.31 59.33 1k1d n LYS 294 Cb 0.44 -1.51 0.96 0.00 0.00 0.00 0.00 35.03 34.92 1k1d n LYS 294 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.40 177.51 1k1d h TRP 295 N 0.00 0.00 -0.05 5.64 5.08 -2.00 -2.52 115.95 122.11 1k1d h TRP 295 Ca 0.52 0.00 -0.09 0.00 1.08 0.00 0.00 58.89 60.40 1k1d h TRP 295 Cb 1.41 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.56 1k1d h TRP 295 CO -0.01 0.02 -0.37 0.45 -1.28 0.00 0.00 178.44 177.25 1k1d h HIS 296 N 0.00 0.11 -1.03 0.12 3.86 -1.53 -3.11 115.15 113.57 1k1d h HIS 296 Ca -0.00 -0.03 0.27 0.00 -1.16 0.00 0.00 60.37 59.45 1k1d h HIS 296 Cb 0.08 -0.03 -0.12 0.00 1.06 0.00 0.00 27.41 28.41 1k1d h HIS 296 CO 0.00 0.46 0.63 1.96 0.86 0.00 0.00 177.93 181.84 1k1d h GLN 297 N 0.09 0.47 0.64 2.45 4.20 -1.64 0.21 115.11 121.52 1k1d h GLN 297 Ca 0.01 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 1k1d h GLN 297 Cb 0.70 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 28.38 1k1d h GLN 297 CO 0.05 0.31 -0.31 0.93 -0.67 0.00 0.00 178.83 179.15 1k1d h GLU 298 N 0.48 -0.82 -0.69 1.46 5.08 -1.75 -0.41 114.58 117.94 1k1d h GLU 298 Ca 0.64 0.06 0.15 0.00 -1.00 0.00 0.00 59.36 59.21 1k1d h GLU 298 Cb 1.40 0.19 -0.12 0.00 0.50 0.00 0.00 28.75 30.72 1k1d h GLU 298 CO -0.42 -0.53 -0.02 0.28 -1.00 0.00 0.00 179.01 177.31 1k1d h VAL 299 N -0.90 0.40 0.45 3.13 2.07 -1.17 0.26 116.25 120.48 1k1d h VAL 299 Ca -0.09 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 1k1d h VAL 299 Cb 0.67 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1k1d h VAL 299 CO 0.14 0.02 -0.33 -0.07 0.02 0.00 0.00 177.57 177.35 1k1d h LEU 300 N 0.09 -0.86 -0.66 2.57 3.38 -0.89 0.67 115.31 119.62 1k1d h LEU 300 Ca 0.36 0.06 0.12 0.00 0.09 0.00 0.00 57.88 58.51 1k1d h LEU 300 Cb 0.61 0.27 -0.09 0.00 0.09 0.00 0.00 40.66 41.54 1k1d h LEU 300 CO -0.62 -0.50 0.21 -0.50 0.09 0.00 0.00 178.44 177.13 1k1d h TRP 301 N -0.76 0.35 -0.79 1.13 4.06 0.75 0.86 115.95 121.55 1k1d h TRP 301 Ca -0.04 0.04 -0.03 0.00 2.06 0.00 0.00 58.89 60.91 1k1d h TRP 301 Cb 0.65 -0.06 -0.04 0.00 -1.00 0.00 0.00 29.16 28.72 1k1d h TRP 301 CO -0.14 0.03 0.38 -0.91 -3.56 0.00 0.00 178.44 174.23 1k1d h ASN 302 N 0.36 1.03 -0.59 -3.49 2.35 -0.29 0.41 115.58 115.36 1k1d h ASN 302 Ca 0.35 -0.14 0.04 0.00 -0.55 0.00 0.00 56.30 56.00 1k1d h ASN 302 Cb 0.51 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.57 1k1d h ASN 302 CO -0.39 0.88 0.34 0.00 -1.65 0.00 0.00 177.43 176.61 1k1d h ALA 303 N 1.20 0.76 -0.57 -0.83 0.00 0.62 0.38 119.26 120.82 1k1d h ALA 303 Ca 0.27 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 1k1d h ALA 303 Cb 0.12 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1k1d h ALA 303 CO -0.03 0.05 0.13 1.25 0.00 0.00 0.00 179.25 180.65 1k1d h LEU 304 N 0.67 0.87 0.20 0.00 5.85 -0.06 0.43 115.31 123.27 1k1d h LEU 304 Ca 0.25 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1k1d h LEU 304 Cb 0.07 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.87 1k1d h LEU 304 CO -0.12 0.88 -0.10 0.50 -0.34 0.00 0.00 178.44 179.26 1k1d h LYS 305 N 0.82 -0.26 -0.00 1.25 3.64 0.63 -3.25 116.57 119.40 1k1d h LYS 305 Ca 0.18 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1k1d h LYS 305 Cb 0.36 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1k1d h LYS 305 CO 0.00 -0.03 -0.27 0.09 -2.27 0.00 0.00 179.45 176.98 1k1d n ASN 306 N -5.12 0.40 0.00 4.20 3.02 0.13 -4.96 115.26 112.92 1k1d n ASN 306 Ca -0.09 -0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.31 1k1d n ASN 306 Cb 0.19 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 1k1d n ASN 306 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1k1d n GLY 307 N 1.45 0.53 0.34 7.41 0.00 0.12 -4.96 105.19 110.07 1k1d n GLY 307 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.09 1k1d n GLY 307 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1k1d h GLN 308 N 4.07 0.98 -6.21 1.61 1.08 -0.86 -3.39 115.11 112.39 1k1d h GLN 308 Ca 0.00 -0.10 -0.69 0.00 -1.45 0.00 0.00 58.65 56.41 1k1d h GLN 308 Cb 0.00 -0.20 -0.21 0.00 -0.05 0.00 0.00 27.48 27.02 1k1d h GLN 308 CO 0.00 0.72 -0.73 -0.51 -0.95 0.00 0.00 178.83 177.36 1k1d s LEU 309 N -9.71 2.98 0.00 1.46 1.43 -0.97 -4.39 118.68 109.47 1k1d s LEU 309 Ca -0.11 -0.10 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 1k1d s LEU 309 Cb 0.17 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.76 1k1d s LEU 309 CO 0.79 0.35 0.28 0.00 0.23 0.00 0.00 176.35 178.00 1k1d n GLN 310 N 2.29 -0.54 -3.92 1.70 0.00 -0.65 -4.22 117.38 112.03 1k1d n GLN 310 Ca -0.18 -0.28 -0.10 0.00 0.00 0.00 0.00 57.00 56.45 1k1d n GLN 310 Cb 0.53 -0.77 -0.10 0.00 0.00 0.00 0.00 30.24 29.89 1k1d n GLN 310 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 1k1d s THR 311 N -0.00 0.10 -0.17 -0.39 -4.23 -1.11 -4.49 115.64 105.35 1k1d s THR 311 Ca 0.00 -0.83 0.00 0.00 -1.18 0.00 0.00 61.69 59.68 1k1d s THR 311 Cb 0.00 -0.43 0.01 0.00 1.34 0.00 0.00 72.50 73.42 1k1d s THR 311 CO 0.00 -0.46 -0.16 -0.22 -0.54 0.00 0.00 174.62 173.24 1k1d s LEU 312 N -1.52 2.35 0.36 4.79 2.96 -0.67 -1.23 118.68 125.73 1k1d s LEU 312 Ca -0.14 -0.55 0.09 0.00 -0.22 0.00 0.00 54.13 53.31 1k1d s LEU 312 Cb -0.08 -1.54 -0.07 0.00 0.50 0.00 0.00 46.19 45.01 1k1d s LEU 312 CO -0.00 0.03 -0.05 -0.83 -1.32 0.00 0.00 176.35 174.18 1k1d s GLY 313 N 1.10 2.28 -0.17 7.98 0.00 0.16 -4.72 107.32 113.95 1k1d s GLY 313 Ca 0.00 -2.14 -0.01 0.00 0.00 0.00 0.00 44.72 42.57 1k1d s GLY 313 CO -0.06 -2.04 0.16 -1.14 0.00 0.00 0.00 173.10 170.02 1k1d n SER 314 N -0.87 1.87 -2.44 1.64 3.41 -1.26 -3.85 113.62 112.12 1k1d n SER 314 Ca -0.05 0.09 -0.17 0.00 -0.26 0.00 0.00 58.87 58.48 1k1d n SER 314 Cb 0.64 -0.54 0.04 0.00 -0.26 0.00 0.00 64.21 64.09 1k1d n SER 314 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1k1d n ASP 315 N -3.33 -4.98 -4.68 4.04 2.03 -0.21 -4.79 116.55 104.64 1k1d n ASP 315 Ca -0.36 -0.29 -0.49 0.00 0.52 0.00 0.00 54.79 54.17 1k1d n ASP 315 Cb 1.03 -3.71 -0.05 0.00 -0.72 0.00 0.00 41.12 37.67 1k1d n ASP 315 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1k1d n GLN 316 N -3.38 2.07 -2.74 -0.67 -0.06 -1.13 -4.34 117.38 107.12 1k1d n GLN 316 Ca -0.04 0.76 -0.06 0.00 -2.00 0.00 0.00 57.00 55.66 1k1d n GLN 316 Cb 0.57 -2.57 0.03 0.00 -4.06 0.00 0.00 30.24 24.20 1k1d n GLN 316 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1k1d s SER 318 N -0.24 6.51 -0.18 0.00 1.04 -1.26 -2.44 113.70 117.13 1k1d s SER 318 Ca 0.30 2.32 -0.07 0.00 0.48 0.00 0.00 55.95 58.98 1k1d s SER 318 Cb 0.12 -2.61 0.08 0.00 0.10 0.00 0.00 66.02 63.70 1k1d s SER 318 CO -0.14 -0.68 0.40 -0.36 0.98 0.00 0.00 173.24 173.44 1k1d s PHE 319 N -1.44 -0.70 0.15 5.02 0.08 -1.26 -0.99 117.98 118.84 1k1d s PHE 319 Ca 0.58 1.39 -0.34 0.00 0.12 0.00 0.00 56.93 58.68 1k1d s PHE 319 Cb -0.30 0.26 -0.13 0.00 -0.57 0.00 0.00 43.02 42.28 1k1d s PHE 319 CO 0.38 -0.42 1.62 -0.25 -0.10 0.00 0.00 175.22 176.44 1k1d n ASP 320 N 5.01 3.27 0.04 1.36 8.00 -1.26 -4.60 116.55 128.37 1k1d n ASP 320 Ca -0.13 1.07 0.06 0.00 0.71 0.00 0.00 54.79 56.50 1k1d n ASP 320 Cb 0.51 -1.45 0.48 0.00 -0.02 0.00 0.00 41.12 40.65 1k1d n ASP 320 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1k1d h PHE 321 N 6.31 0.40 0.00 1.24 3.57 -1.95 -0.50 116.94 126.00 1k1d h PHE 321 Ca -0.45 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.06 1k1d h PHE 321 Cb 1.25 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.85 1k1d h PHE 321 CO 0.65 0.24 0.00 1.63 -2.23 0.00 0.00 178.31 178.60 1k1d n LYS 322 N -4.49 0.00 0.13 1.11 5.02 -1.26 -3.30 118.16 115.37 1k1d n LYS 322 Ca 0.03 0.01 -0.11 0.00 -2.02 0.00 0.00 58.31 56.22 1k1d n LYS 322 Cb 0.11 -0.59 -0.07 0.00 -0.02 0.00 0.00 35.03 34.46 1k1d n LYS 322 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1k1d h GLY 323 N 0.00 -0.41 0.00 0.72 0.00 -1.97 -3.31 103.07 98.10 1k1d h GLY 323 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.48 1k1d h GLY 323 CO 0.00 -0.15 0.00 -1.06 0.00 0.00 0.00 176.54 175.33 1k1d n GLN 324 N -5.06 0.00 -0.42 4.80 6.02 -0.99 -3.46 117.38 118.27 1k1d n GLN 324 Ca -0.08 0.27 0.35 0.00 -0.01 0.00 0.00 57.00 57.52 1k1d n GLN 324 Cb 0.26 -1.24 0.65 0.00 1.02 0.00 0.00 30.24 30.93 1k1d n GLN 324 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 1k1d h LYS 325 N 0.00 0.13 0.00 -1.09 1.79 -1.22 0.33 116.57 116.51 1k1d h LYS 325 Ca 0.00 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1k1d h LYS 325 Cb 0.00 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.62 1k1d h LYS 325 CO 0.00 0.09 0.00 0.39 -1.08 0.00 0.00 179.45 178.85 1k1d n GLU 326 N -4.48 0.07 0.12 3.15 1.02 -1.21 -2.93 120.64 116.38 1k1d n GLU 326 Ca 0.33 0.34 0.19 0.00 -0.02 0.00 0.00 57.16 57.99 1k1d n GLU 326 Cb 1.32 -1.64 0.76 0.00 -0.02 0.00 0.00 31.44 31.86 1k1d n GLU 326 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1k1d h LEU 327 N 0.00 0.00 -6.23 -4.62 3.38 -0.35 -2.85 115.31 104.63 1k1d h LEU 327 Ca 0.00 0.00 -0.70 0.00 0.09 0.00 0.00 57.88 57.27 1k1d h LEU 327 Cb 0.27 0.00 -0.35 0.00 0.09 0.00 0.00 40.66 40.67 1k1d h LEU 327 CO 0.00 0.00 0.14 0.61 0.09 0.00 0.00 178.44 179.28 1k1d n GLY 328 N -1.49 5.37 0.00 0.83 0.00 -1.14 -4.79 105.19 103.97 1k1d n GLY 328 Ca 0.06 -2.71 0.00 0.00 0.00 0.00 0.00 46.02 43.37 1k1d n GLY 328 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k1d n ARG 329 N 0.57 0.00 0.00 1.61 5.12 -1.08 -3.91 116.66 118.97 1k1d n ARG 329 Ca 0.33 0.05 0.00 0.00 -1.93 0.00 0.00 57.85 56.30 1k1d n ARG 329 Cb 0.35 -0.76 0.00 0.00 -1.16 0.00 0.00 32.46 30.89 1k1d n ARG 329 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1k1d n GLY 330 N 1.20 1.38 2.96 -0.13 0.00 -1.26 -4.49 105.19 104.84 1k1d n GLY 330 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1k1d n GLY 330 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1k1d s ASP 331 N -0.05 -0.01 0.31 1.61 -1.08 -1.25 -4.79 116.67 111.40 1k1d s ASP 331 Ca 0.00 -0.04 -0.00 0.00 -0.52 0.00 0.00 52.55 51.98 1k1d s ASP 331 Cb 0.00 1.30 0.49 0.00 -1.46 0.00 0.00 42.92 43.24 1k1d s ASP 331 CO 0.00 -0.33 1.92 2.19 0.52 0.00 0.00 175.17 179.48 1k1d h PHE 332 N 8.14 0.88 0.00 -5.34 -0.00 -1.50 -1.38 116.94 117.73 1k1d h PHE 332 Ca -0.12 -0.02 0.00 0.00 -0.00 0.00 0.00 57.97 57.83 1k1d h PHE 332 Cb 1.14 -0.28 0.00 0.00 -0.00 0.00 0.00 35.95 36.81 1k1d h PHE 332 CO 0.21 0.63 0.01 0.25 -0.00 0.00 0.00 178.31 179.41 1k1d n THR 333 N -4.36 1.60 0.25 0.88 -2.24 -1.26 -0.54 114.28 108.61 1k1d n THR 333 Ca 0.06 0.60 0.11 0.00 -2.27 0.00 0.00 64.05 62.55 1k1d n THR 333 Cb 0.12 -1.60 0.21 0.00 -2.10 0.00 0.00 70.33 66.96 1k1d n THR 333 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1k1d n LYS 334 N -1.80 2.45 -2.86 -0.78 5.02 -0.52 -4.89 118.16 114.78 1k1d n LYS 334 Ca -0.01 -2.25 -0.41 0.00 -2.02 0.00 0.00 58.31 53.62 1k1d n LYS 334 Cb 0.02 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.50 1k1d n LYS 334 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1k1d s ILE 335 N -1.41 4.88 0.05 -0.18 1.01 0.29 -2.87 121.20 122.97 1k1d s ILE 335 Ca 0.37 1.71 -0.30 0.00 0.00 0.00 0.00 60.65 62.43 1k1d s ILE 335 Cb 0.22 -4.17 -0.08 0.00 0.01 0.00 0.00 42.46 38.44 1k1d s ILE 335 CO 0.30 0.05 1.65 -2.16 0.00 0.00 0.00 174.94 174.78 1k1d s PRO 336 N 1.95 4.20 0.22 2.79 0.04 -1.26 -4.94 135.00 137.99 1k1d s PRO 336 Ca 0.41 2.31 -0.30 0.00 0.04 0.00 0.00 61.00 63.46 1k1d s PRO 336 Cb -0.17 -3.66 -0.09 0.00 0.04 0.00 0.00 34.50 30.62 1k1d s PRO 336 CO 0.15 -0.75 1.17 -0.80 0.04 0.00 0.00 177.00 176.81 1k1d s ASN 337 N 2.57 7.13 0.00 6.66 0.02 -1.26 -4.88 114.94 125.17 1k1d s ASN 337 Ca 0.74 2.27 0.00 0.00 -1.02 0.00 0.00 52.86 54.85 1k1d s ASN 337 Cb -0.39 -2.62 0.00 0.00 0.02 0.00 0.00 41.25 38.27 1k1d s ASN 337 CO 0.32 -0.31 0.00 0.61 0.02 0.00 0.00 177.10 177.74 1k1d n GLY 338 N 1.79 4.83 3.23 0.66 0.00 -0.71 -4.93 105.19 110.05 1k1d n GLY 338 Ca 0.02 -1.10 -0.19 0.00 0.00 0.00 0.00 46.02 44.75 1k1d n GLY 338 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1k1d s GLY 339 N 0.00 1.05 -0.92 -0.02 0.00 -1.02 -4.64 107.32 101.77 1k1d s GLY 339 Ca 0.00 -1.21 -0.24 0.00 0.00 0.00 0.00 44.72 43.26 1k1d s GLY 339 CO 0.00 -1.26 1.52 2.56 0.00 0.00 0.00 173.10 175.93 1k1d s PRO 340 N -2.34 3.27 0.00 2.90 0.04 -1.26 -1.87 135.00 135.74 1k1d s PRO 340 Ca 0.06 -0.69 0.00 0.00 0.04 0.00 0.00 61.00 60.41 1k1d s PRO 340 Cb -0.07 -5.01 0.00 0.00 0.04 0.00 0.00 34.50 29.46 1k1d s PRO 340 CO 0.03 -2.43 0.00 -0.89 0.04 0.00 0.00 177.00 173.75 1k1d n ILE 341 N 6.97 0.00 0.31 0.56 5.41 -1.26 -4.46 119.36 126.89 1k1d n ILE 341 Ca 0.27 -0.06 0.10 0.00 1.00 0.00 0.00 62.75 64.07 1k1d n ILE 341 Cb 0.50 0.45 0.54 0.00 -0.71 0.00 0.00 39.64 40.42 1k1d n ILE 341 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 176.55 176.26 1k1d h ILE 342 N 0.00 0.00 0.05 1.39 2.10 -1.87 -2.78 117.51 116.40 1k1d h ILE 342 Ca 0.00 0.00 -0.35 0.00 1.08 0.00 0.00 64.86 65.59 1k1d h ILE 342 Cb 0.00 0.44 -0.04 0.00 -1.09 0.00 0.00 36.82 36.13 1k1d h ILE 342 CO 0.00 0.00 -2.08 1.21 -1.08 0.00 0.00 178.15 176.20 1k1d n GLU 343 N -2.66 0.70 -0.03 2.19 2.13 -1.26 -4.21 120.64 117.49 1k1d n GLU 343 Ca -0.01 0.21 0.12 0.00 0.66 0.00 0.00 57.16 58.14 1k1d n GLU 343 Cb 0.53 -1.67 0.20 0.00 0.27 0.00 0.00 31.44 30.78 1k1d n GLU 343 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1k1d n ASP 344 N -3.24 2.75 -0.02 4.31 8.00 -1.06 -3.88 116.55 123.42 1k1d n ASP 344 Ca -0.31 -1.90 -0.03 0.00 0.71 0.00 0.00 54.79 53.26 1k1d n ASP 344 Cb 1.05 -0.04 -0.02 0.00 -0.02 0.00 0.00 41.12 42.09 1k1d n ASP 344 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1k1d h ARG 345 N 4.16 -0.09 -0.01 -1.24 2.43 -1.75 -1.02 114.38 116.85 1k1d h ARG 345 Ca 0.00 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 1k1d h ARG 345 Cb 0.89 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.41 1k1d h ARG 345 CO 0.00 -0.06 -0.33 0.28 -1.51 0.00 0.00 179.97 178.34 1k1d h VAL 346 N -0.10 0.28 -0.35 0.20 2.07 -1.82 -2.89 116.25 113.64 1k1d h VAL 346 Ca 0.01 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.61 1k1d h VAL 346 Cb 0.13 0.28 -0.08 0.00 -1.52 0.00 0.00 31.29 30.10 1k1d h VAL 346 CO -0.11 0.00 -0.19 0.28 0.02 0.00 0.00 177.57 177.56 1k1d h SER 347 N -0.48 -0.65 -0.80 0.57 0.02 -1.72 -2.21 113.55 108.29 1k1d h SER 347 Ca 0.06 0.14 0.10 0.00 -0.84 0.00 0.00 61.79 61.26 1k1d h SER 347 Cb 0.57 0.34 -0.07 0.00 0.14 0.00 0.00 62.40 63.38 1k1d h SER 347 CO -0.28 -0.23 0.44 0.40 -1.14 0.00 0.00 176.83 176.02 1k1d h ILE 348 N -0.14 0.87 -0.58 3.27 2.04 -1.08 0.45 117.51 122.35 1k1d h ILE 348 Ca 0.18 -0.25 -0.10 0.00 1.00 0.00 0.00 64.86 65.69 1k1d h ILE 348 Cb 0.41 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 1k1d h ILE 348 CO -0.44 0.13 -0.03 0.25 0.00 0.00 0.00 178.15 178.06 1k1d h LEU 349 N 0.73 1.01 0.08 1.44 5.85 -1.21 0.38 115.31 123.58 1k1d h LEU 349 Ca 0.39 -0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 1k1d h LEU 349 Cb 0.40 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.15 1k1d h LEU 349 CO -0.26 1.08 -0.04 0.15 -0.34 0.00 0.00 178.44 179.03 1k1d h PHE 350 N 0.93 -0.10 0.11 1.25 3.57 -0.84 0.53 116.94 122.39 1k1d h PHE 350 Ca 0.16 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 1k1d h PHE 350 Cb 0.58 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.35 1k1d h PHE 350 CO 0.04 0.12 -0.05 1.03 -2.23 0.00 0.00 178.31 177.21 1k1d h SER 351 N -0.30 -0.12 -0.05 0.41 0.87 -0.80 0.16 113.55 113.72 1k1d h SER 351 Ca -0.01 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.52 1k1d h SER 351 Cb 0.25 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.24 1k1d h SER 351 CO 0.02 -0.08 -0.04 -0.33 -0.53 0.00 0.00 176.83 175.87 1k1d h GLU 352 N -0.16 0.25 0.00 2.24 4.39 -0.36 -3.12 114.58 117.82 1k1d h GLU 352 Ca -0.01 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1k1d h GLU 352 Cb 0.11 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1k1d h GLU 352 CO 0.02 0.31 0.00 0.41 -1.16 0.00 0.00 179.01 178.59 1k1d n GLY 353 N -1.09 0.70 0.00 -3.84 0.00 0.18 -4.26 105.19 96.87 1k1d n GLY 353 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1k1d n GLY 353 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1k1d n VAL 354 N -0.57 0.00 0.17 1.61 0.31 -0.68 -2.07 118.33 117.11 1k1d n VAL 354 Ca 0.00 1.45 0.16 0.00 -0.01 0.00 0.00 64.34 65.94 1k1d n VAL 354 Cb 0.00 -2.07 0.57 0.00 -0.91 0.00 0.00 33.84 31.43 1k1d n VAL 354 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1k1d h LYS 355 N 0.00 0.00 -0.25 5.55 1.79 -0.71 -1.88 116.57 121.07 1k1d h LYS 355 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1k1d h LYS 355 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1k1d h LYS 355 CO 0.00 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 180.00 1k1d n LYS 356 N -3.10 2.03 0.00 3.15 5.02 -0.88 -4.99 118.16 119.38 1k1d n LYS 356 Ca 0.05 -1.90 0.00 0.00 -2.02 0.00 0.00 58.31 54.44 1k1d n LYS 356 Cb 0.76 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 34.40 1k1d n LYS 356 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k1d n GLY 357 N 1.02 2.21 3.89 0.72 0.00 -0.71 -5.03 105.19 107.29 1k1d n GLY 357 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 1k1d n GLY 357 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k1d s ARG 358 N -0.21 3.61 0.40 1.61 0.52 -0.95 -4.90 118.95 119.03 1k1d s ARG 358 Ca 0.00 0.48 0.00 0.00 -0.52 0.00 0.00 55.73 55.69 1k1d s ARG 358 Cb 0.00 -2.25 0.00 0.00 0.52 0.00 0.00 34.95 33.22 1k1d s ARG 358 CO 0.00 -0.33 0.00 -0.89 0.02 0.00 0.00 175.30 174.10 1k1d n ILE 359 N -2.30 0.00 -4.42 1.52 5.41 -1.26 -2.86 119.36 115.45 1k1d n ILE 359 Ca 0.03 0.39 -0.21 0.00 1.00 0.00 0.00 62.75 63.97 1k1d n ILE 359 Cb 0.54 -0.79 -0.10 0.00 -0.71 0.00 0.00 39.64 38.58 1k1d n ILE 359 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 1k1d s THR 360 N -3.22 1.59 0.42 1.39 2.01 -1.26 -4.61 115.64 111.96 1k1d s THR 360 Ca 0.00 -2.12 0.10 0.00 0.31 0.00 0.00 61.69 59.98 1k1d s THR 360 Cb 0.00 -2.43 0.29 0.00 0.01 0.00 0.00 72.50 70.37 1k1d s THR 360 CO 0.00 -0.31 2.03 0.25 -0.69 0.00 0.00 174.62 175.90 1k1d h LEU 361 N 2.30 0.42 0.08 4.42 5.85 -1.93 0.35 115.31 126.81 1k1d h LEU 361 Ca -0.40 -0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.17 1k1d h LEU 361 Cb 1.23 -0.10 0.02 0.00 0.37 0.00 0.00 40.66 42.18 1k1d h LEU 361 CO 0.67 0.29 -0.65 0.78 -0.34 0.00 0.00 178.44 179.19 1k1d h ASN 362 N 0.49 0.43 -0.90 1.25 2.35 -1.86 -3.06 115.58 114.28 1k1d h ASN 362 Ca 0.20 -0.89 0.08 0.00 -0.55 0.00 0.00 56.30 55.14 1k1d h ASN 362 Cb 0.18 -0.14 -0.06 0.00 0.05 0.00 0.00 38.32 38.35 1k1d h ASN 362 CO -0.05 1.28 0.58 1.56 -1.65 0.00 0.00 177.43 179.15 1k1d h GLN 363 N -0.36 0.93 0.25 0.81 4.20 -1.65 -0.68 115.11 118.61 1k1d h GLN 363 Ca -0.10 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.56 1k1d h GLN 363 Cb 1.45 -0.21 -0.04 0.00 0.30 0.00 0.00 27.48 28.99 1k1d h GLN 363 CO 0.12 0.61 -0.45 0.35 -0.67 0.00 0.00 178.83 178.80 1k1d h PHE 364 N 0.96 -1.27 -0.97 2.96 3.57 -0.34 0.51 116.94 122.35 1k1d h PHE 364 Ca 0.40 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.99 1k1d h PHE 364 Cb 0.30 0.52 -0.07 0.00 2.79 0.00 0.00 35.95 39.49 1k1d h PHE 364 CO -0.00 -0.57 0.63 0.28 -2.23 0.00 0.00 178.31 176.42 1k1d h VAL 365 N -0.77 1.06 0.22 1.41 2.07 -1.27 -0.76 116.25 118.20 1k1d h VAL 365 Ca -0.01 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 1k1d h VAL 365 Cb 0.74 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1k1d h VAL 365 CO -0.18 0.20 -0.11 -0.78 0.02 0.00 0.00 177.57 176.73 1k1d h ASP 366 N 1.11 -0.25 0.13 0.57 3.58 -0.40 0.72 116.42 121.88 1k1d h ASP 366 Ca 0.43 -0.18 -0.01 0.00 0.42 0.00 0.00 57.03 57.68 1k1d h ASP 366 Cb 0.21 0.06 -0.00 0.00 1.72 0.00 0.00 39.33 41.32 1k1d h ASP 366 CO -0.17 0.05 -0.07 0.40 -2.88 0.00 0.00 179.24 176.57 1k1d h ILE 367 N -0.57 0.77 0.00 2.25 2.04 0.52 -2.31 117.51 120.21 1k1d h ILE 367 Ca -0.03 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.56 1k1d h ILE 367 Cb 0.42 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.66 1k1d h ILE 367 CO 0.05 0.07 -1.36 0.52 0.00 0.00 0.00 178.15 177.43 1k1d n VAL 368 N -4.04 0.00 0.00 1.67 0.31 -0.34 -1.67 118.33 114.26 1k1d n VAL 368 Ca -0.03 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 1k1d n VAL 368 Cb 0.16 0.49 0.00 0.00 -0.91 0.00 0.00 33.84 33.57 1k1d n VAL 368 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1k1d n SER 369 N -1.80 0.00 -0.03 4.52 2.88 0.22 -1.63 113.62 117.79 1k1d n SER 369 Ca -0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 1k1d n SER 369 Cb 0.37 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.81 1k1d n SER 369 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1k1d h THR 370 N 0.00 0.00 -0.98 2.46 2.02 -1.50 -0.80 112.91 114.11 1k1d h THR 370 Ca 0.00 0.00 0.33 0.00 0.77 0.00 0.00 66.41 67.51 1k1d h THR 370 Cb 0.00 0.00 -0.16 0.00 -1.74 0.00 0.00 68.15 66.25 1k1d h THR 370 CO 0.00 0.00 0.46 -0.09 0.37 0.00 0.00 175.52 176.26 1k1d h ARG 371 N -0.05 0.18 0.05 6.66 9.65 -1.68 0.16 114.38 129.35 1k1d h ARG 371 Ca 0.01 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1k1d h ARG 371 Cb 0.08 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.62 1k1d h ARG 371 CO -0.09 0.12 -0.02 0.82 2.80 0.00 0.00 179.97 183.59 1k1d h ILE 372 N 0.18 1.19 -0.85 1.20 2.04 -1.59 -1.33 117.51 118.36 1k1d h ILE 372 Ca 0.73 -0.82 0.16 0.00 1.00 0.00 0.00 64.86 65.93 1k1d h ILE 372 Cb 1.73 1.73 -0.10 0.00 -0.74 0.00 0.00 36.82 39.43 1k1d h ILE 372 CO -0.69 0.20 0.42 0.00 0.00 0.00 0.00 178.15 178.08 1k1d h ALA 373 N 0.49 1.29 0.53 1.87 0.00 0.70 -0.85 119.26 123.28 1k1d h ALA 373 Ca -0.01 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1k1d h ALA 373 Cb 0.39 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.21 1k1d h ALA 373 CO 0.01 -0.15 -0.25 0.87 0.00 0.00 0.00 179.25 179.73 1k1d h LYS 374 N 0.56 -0.68 -0.52 0.00 1.57 -1.02 0.34 116.57 116.82 1k1d h LYS 374 Ca 0.48 0.05 0.14 0.00 -1.87 0.00 0.00 60.65 59.44 1k1d h LYS 374 Cb 0.73 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 33.17 1k1d h LYS 374 CO -0.40 -0.38 0.37 -0.07 -0.57 0.00 0.00 179.45 178.40 1k1d h LEU 375 N -1.01 0.06 -3.46 2.94 3.38 -0.77 -2.48 115.31 113.97 1k1d h LEU 375 Ca -0.07 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 1k1d h LEU 375 Cb 0.62 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.29 1k1d h LEU 375 CO 0.12 0.03 0.08 0.49 0.09 0.00 0.00 178.44 179.25 1k1d n PHE 376 N -4.40 1.54 -3.50 1.13 3.72 -0.37 -4.87 117.46 110.71 1k1d n PHE 376 Ca 0.09 -1.17 -0.21 0.00 -0.05 0.00 0.00 57.45 56.11 1k1d n PHE 376 Cb 0.55 -0.50 0.06 0.00 -0.94 0.00 0.00 39.48 38.65 1k1d n PHE 376 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1k1d n GLY 377 N -0.53 -0.79 0.00 1.37 0.00 -0.93 -4.40 105.19 99.91 1k1d n GLY 377 Ca 0.31 0.37 0.00 0.00 0.00 0.00 0.00 46.02 46.70 1k1d n GLY 377 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k1d n LEU 378 N -3.87 0.52 -4.82 0.99 4.77 0.11 -1.17 117.00 113.53 1k1d n LEU 378 Ca -0.17 -0.52 -0.38 0.00 -0.03 0.00 0.00 56.01 54.91 1k1d n LEU 378 Cb 0.63 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.66 1k1d n LEU 378 CO 0.64 0.13 0.18 0.12 -1.33 0.00 0.00 177.39 177.13 1k1d s PHE 379 N -0.00 3.76 -0.35 -1.77 2.19 -1.10 0.32 117.98 121.03 1k1d s PHE 379 Ca 0.00 1.12 0.09 0.00 0.33 0.00 0.00 56.93 58.47 1k1d s PHE 379 Cb 0.00 -2.39 0.69 0.00 -1.31 0.00 0.00 43.02 40.02 1k1d s PHE 379 CO 0.00 0.61 1.72 -0.35 1.83 0.00 0.00 175.22 179.03 1k1d n PRO 380 N 1.81 3.61 -0.15 10.12 -0.04 -1.26 -4.90 135.00 144.19 1k1d n PRO 380 Ca -0.12 -2.82 -0.09 0.00 -0.04 0.00 0.00 63.50 60.43 1k1d n PRO 380 Cb 0.52 -2.15 -0.01 0.00 -0.04 0.00 0.00 33.50 31.82 1k1d n PRO 380 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1k1d h LYS 381 N 2.56 0.67 -5.61 0.54 3.64 -1.51 -3.39 116.57 113.47 1k1d h LYS 381 Ca 0.23 -0.15 -0.59 0.00 -1.27 0.00 0.00 60.65 58.86 1k1d h LYS 381 Cb 2.19 -0.09 -0.13 0.00 -0.41 0.00 0.00 32.23 33.79 1k1d h LYS 381 CO 0.67 0.67 -0.61 0.15 -2.27 0.00 0.00 179.45 178.05 1k1d s LYS 382 N -5.36 1.87 0.00 1.90 -0.14 0.15 -1.04 119.74 117.13 1k1d s LYS 382 Ca -0.13 -2.04 0.00 0.00 -1.36 0.00 0.00 55.97 52.44 1k1d s LYS 382 Cb 0.10 -1.49 0.00 0.00 -1.68 0.00 0.00 37.83 34.76 1k1d s LYS 382 CO 0.77 -0.05 0.00 0.41 -0.76 0.00 0.00 175.35 175.72 1k1d n GLY 383 N -0.88 0.77 3.60 -3.33 0.00 -1.26 -4.12 105.19 99.97 1k1d n GLY 383 Ca -0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.89 1k1d n GLY 383 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1k1d s THR 384 N -2.83 0.00 -0.69 2.61 -1.32 -1.26 -3.36 115.64 108.79 1k1d s THR 384 Ca 0.00 -0.36 -0.02 0.00 -1.21 0.00 0.00 61.69 60.10 1k1d s THR 384 Cb 0.00 -1.42 0.17 0.00 -1.51 0.00 0.00 72.50 69.75 1k1d s THR 384 CO 0.00 0.00 0.52 -0.63 -2.21 0.00 0.00 174.62 172.30 1k1d s ILE 385 N -3.60 3.75 0.01 5.08 1.01 -1.26 -4.82 121.20 121.37 1k1d s ILE 385 Ca 0.06 -3.29 -0.12 0.00 0.00 0.00 0.00 60.65 57.30 1k1d s ILE 385 Cb -0.02 -3.42 0.01 0.00 0.01 0.00 0.00 42.46 39.04 1k1d s ILE 385 CO -0.05 -0.93 0.25 -0.69 0.00 0.00 0.00 174.94 173.52 1k1d s VAL 386 N -0.49 0.08 -0.27 2.92 1.01 -1.26 -5.00 120.40 117.38 1k1d s VAL 386 Ca 0.20 -0.62 -0.41 0.00 0.00 0.00 0.00 61.98 61.15 1k1d s VAL 386 Cb -0.17 -0.66 -0.17 0.00 0.00 0.00 0.00 36.38 35.39 1k1d s VAL 386 CO -0.06 -0.34 1.66 0.52 0.00 0.00 0.00 175.10 176.88 1k1d n VAL 387 N 1.13 0.21 0.00 2.92 0.31 -1.26 -0.74 118.33 120.91 1k1d n VAL 387 Ca -0.21 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1k1d n VAL 387 Cb 0.57 -1.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.48 1k1d n VAL 387 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1k1d n GLY 388 N 3.91 2.22 3.81 2.92 0.00 -0.18 -4.99 105.19 112.88 1k1d n GLY 388 Ca 0.26 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.96 1k1d n GLY 388 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1k1d s SER 389 N 0.22 5.84 0.59 1.61 0.01 0.08 -4.71 113.70 117.34 1k1d s SER 389 Ca 0.00 1.79 -0.20 0.00 1.31 0.00 0.00 55.95 58.85 1k1d s SER 389 Cb 0.00 -2.53 -0.03 0.00 0.21 0.00 0.00 66.02 63.67 1k1d s SER 389 CO 0.00 -1.13 1.30 0.47 0.41 0.00 0.00 173.24 174.29 1k1d n ASP 390 N -2.03 2.27 -2.77 2.44 9.92 -0.20 -1.28 116.55 124.89 1k1d n ASP 390 Ca 0.09 0.90 -0.28 0.00 -0.53 0.00 0.00 54.79 54.97 1k1d n ASP 390 Cb 0.53 -1.55 -0.09 0.00 -0.64 0.00 0.00 41.12 39.37 1k1d n ASP 390 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1k1d n ALA 391 N -1.45 7.05 -2.95 2.24 0.00 0.49 -4.64 120.51 121.24 1k1d n ALA 391 Ca 0.13 -2.85 -0.44 0.00 0.00 0.00 0.00 53.44 50.28 1k1d n ALA 391 Cb 0.46 -2.91 -0.04 0.00 0.00 0.00 0.00 19.45 16.97 1k1d n ALA 391 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1k1d s ASP 392 N 2.00 6.30 0.25 0.00 1.11 -1.26 -1.98 116.67 123.10 1k1d s ASP 392 Ca 0.68 -1.40 0.09 0.00 0.18 0.00 0.00 52.55 52.10 1k1d s ASP 392 Cb 0.24 -2.38 -0.05 0.00 1.07 0.00 0.00 42.92 41.80 1k1d s ASP 392 CO -0.04 -1.25 -0.15 -0.76 1.18 0.00 0.00 175.17 174.15 1k1d s LEU 393 N 3.28 2.57 -0.08 1.23 1.43 0.30 -0.13 118.68 127.29 1k1d s LEU 393 Ca 0.22 -1.06 -0.01 0.00 -1.03 0.00 0.00 54.13 52.25 1k1d s LEU 393 Cb -0.16 -0.85 0.03 0.00 0.03 0.00 0.00 46.19 45.24 1k1d s LEU 393 CO 0.04 -0.12 -0.00 -0.69 0.23 0.00 0.00 176.35 175.81 1k1d s VAL 394 N -2.78 0.42 -0.50 -1.59 1.01 -0.17 -1.26 120.40 115.52 1k1d s VAL 394 Ca 0.27 0.08 -0.19 0.00 0.00 0.00 0.00 61.98 62.14 1k1d s VAL 394 Cb -0.02 -0.58 0.06 0.00 0.00 0.00 0.00 36.38 35.85 1k1d s VAL 394 CO 0.11 0.26 0.60 -0.63 0.00 0.00 0.00 175.10 175.44 1k1d s ILE 395 N 1.95 4.91 -0.10 2.22 1.01 0.20 -1.10 121.20 130.29 1k1d s ILE 395 Ca 0.05 -0.55 -0.04 0.00 0.00 0.00 0.00 60.65 60.12 1k1d s ILE 395 Cb -0.12 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.03 1k1d s ILE 395 CO -0.05 -0.79 0.06 0.12 0.00 0.00 0.00 174.94 174.28 1k1d s PHE 396 N 2.54 3.34 -0.39 3.97 5.36 0.17 -0.12 117.98 132.85 1k1d s PHE 396 Ca 0.14 0.33 -0.10 0.00 -0.96 0.00 0.00 56.93 56.34 1k1d s PHE 396 Cb -0.20 -1.85 0.04 0.00 -0.34 0.00 0.00 43.02 40.68 1k1d s PHE 396 CO 0.11 0.58 0.22 0.34 -1.46 0.00 0.00 175.22 175.02 1k1d s ASP 397 N -0.98 5.69 0.00 6.13 -1.08 0.07 -0.66 116.67 125.85 1k1d s ASP 397 Ca 0.14 -1.16 0.22 0.00 -0.52 0.00 0.00 52.55 51.24 1k1d s ASP 397 Cb -0.12 -2.01 1.14 0.00 -1.46 0.00 0.00 42.92 40.48 1k1d s ASP 397 CO 0.03 -0.43 1.72 -0.81 0.52 0.00 0.00 175.17 176.21 1k1d n PRO 398 N 4.97 0.34 -0.03 4.34 -0.04 -1.26 -0.13 135.00 143.19 1k1d n PRO 398 Ca -0.11 0.07 -0.02 0.00 -0.04 0.00 0.00 63.50 63.40 1k1d n PRO 398 Cb 0.45 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.35 1k1d n PRO 398 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1k1d n ASN 399 N -1.27 3.05 -4.68 3.54 3.02 -1.26 -4.03 115.26 113.63 1k1d n ASN 399 Ca 0.11 0.00 -0.55 0.00 -0.03 0.00 0.00 54.58 54.11 1k1d n ASN 399 Cb 0.17 0.90 -0.07 0.00 -0.61 0.00 0.00 39.78 40.17 1k1d n ASN 399 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1k1d n ILE 400 N -2.15 0.35 -3.69 2.41 5.41 -1.26 -4.48 119.36 115.95 1k1d n ILE 400 Ca -0.10 -0.08 -0.36 0.00 1.00 0.00 0.00 62.75 63.21 1k1d n ILE 400 Cb 0.60 -1.38 -0.06 0.00 -0.71 0.00 0.00 39.64 38.10 1k1d n ILE 400 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1k1d s GLU 401 N 3.95 3.66 0.39 0.38 2.02 -1.26 -0.04 118.70 127.80 1k1d s GLU 401 Ca 0.99 0.09 -0.14 0.00 0.02 0.00 0.00 54.97 55.93 1k1d s GLU 401 Cb -0.99 -3.14 0.05 0.00 0.10 0.00 0.00 34.13 30.15 1k1d s GLU 401 CO 0.62 0.69 0.76 -0.98 0.02 0.00 0.00 175.26 176.37 1k1d s ARG 402 N -1.37 2.26 -0.10 1.61 1.70 0.11 -4.99 118.95 118.17 1k1d s ARG 402 Ca 0.24 -1.53 0.01 0.00 -0.47 0.00 0.00 55.73 53.98 1k1d s ARG 402 Cb -0.14 0.61 0.02 0.00 -0.57 0.00 0.00 34.95 34.87 1k1d s ARG 402 CO 0.12 -1.05 -0.10 0.08 -1.08 0.00 0.00 175.30 173.27 1k1d s VAL 403 N -2.21 1.15 -0.01 4.99 1.01 -1.26 -0.10 120.40 123.96 1k1d s VAL 403 Ca 0.18 -0.41 -0.30 0.00 0.00 0.00 0.00 61.98 61.44 1k1d s VAL 403 Cb -0.05 -1.11 -0.06 0.00 0.00 0.00 0.00 36.38 35.17 1k1d s VAL 403 CO 0.13 0.38 1.53 -0.63 0.00 0.00 0.00 175.10 176.51 1k1d s ILE 404 N 1.26 3.54 -0.05 2.22 1.01 0.50 -4.85 121.20 124.83 1k1d s ILE 404 Ca -0.03 0.86 -0.06 0.00 0.00 0.00 0.00 60.65 61.41 1k1d s ILE 404 Cb -0.14 -3.55 0.01 0.00 0.01 0.00 0.00 42.46 38.79 1k1d s ILE 404 CO -0.04 -0.03 0.17 -0.55 0.00 0.00 0.00 174.94 174.49 1k1d s SER 405 N 2.45 -0.15 0.43 3.58 0.15 -1.26 0.37 113.70 119.27 1k1d s SER 405 Ca 0.69 0.25 0.30 0.00 0.70 0.00 0.00 55.95 57.88 1k1d s SER 405 Cb -0.33 0.33 1.47 0.00 -1.71 0.00 0.00 66.02 65.78 1k1d s SER 405 CO 0.28 -0.11 1.90 0.00 1.20 0.00 0.00 173.24 176.50 1k1d h ALA 406 N 5.60 1.00 0.00 5.45 0.00 -1.90 0.56 119.26 129.97 1k1d h ALA 406 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1k1d h ALA 406 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1k1d h ALA 406 CO 0.40 0.00 0.00 -1.91 0.00 0.00 0.00 179.25 177.74 1k1d n GLU 407 N -2.58 0.19 0.00 0.00 4.07 -1.26 -3.70 120.64 117.36 1k1d n GLU 407 Ca -0.01 0.38 0.00 0.00 -0.06 0.00 0.00 57.16 57.47 1k1d n GLU 407 Cb 0.13 -1.83 0.00 0.00 -0.06 0.00 0.00 31.44 29.68 1k1d n GLU 407 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 1k1d n THR 408 N -2.18 0.00 -0.93 6.31 -1.04 0.17 -5.07 114.28 111.54 1k1d n THR 408 Ca 0.03 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.71 1k1d n THR 408 Cb 0.25 -0.59 0.13 0.00 -1.82 0.00 0.00 70.33 68.30 1k1d n THR 408 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1k1d n HIS 409 N -1.71 0.45 -0.99 -1.42 1.44 0.09 -4.92 115.22 108.15 1k1d n HIS 409 Ca 0.00 0.37 0.06 0.00 -2.01 0.00 0.00 57.72 56.13 1k1d n HIS 409 Cb 0.34 -2.00 0.32 0.00 0.12 0.00 0.00 29.99 28.78 1k1d n HIS 409 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1k1d n HIS 410 N -3.55 1.57 -3.34 -1.40 -0.00 -1.26 -4.96 115.22 102.28 1k1d n HIS 410 Ca 0.11 -0.90 -0.29 0.00 -0.00 0.00 0.00 57.72 56.64 1k1d n HIS 410 Cb 0.51 -0.45 -0.04 0.00 -0.00 0.00 0.00 29.99 30.02 1k1d n HIS 410 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 1k1d s MET 411 N -2.85 3.67 0.00 -0.41 -1.94 -1.26 -4.30 119.30 112.21 1k1d s MET 411 Ca 0.49 0.08 0.00 0.00 -1.71 0.00 0.00 55.69 54.54 1k1d s MET 411 Cb 0.39 -2.64 0.00 0.00 2.01 0.00 0.00 34.83 34.58 1k1d s MET 411 CO 0.12 0.23 0.87 0.00 -0.01 0.00 0.00 175.02 176.23 1k1d n ALA 412 N -0.75 2.40 -2.14 3.03 0.00 -1.26 -4.86 120.51 116.92 1k1d n ALA 412 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.10 1k1d n ALA 412 Cb 0.53 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.92 1k1d n ALA 412 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1k1d s VAL 413 N -1.93 4.67 -2.00 0.00 -7.23 -1.26 -4.86 120.40 107.79 1k1d s VAL 413 Ca 0.00 0.97 0.20 0.00 -1.81 0.00 0.00 61.98 61.34 1k1d s VAL 413 Cb 0.00 -3.63 0.57 0.00 0.56 0.00 0.00 36.38 33.88 1k1d s VAL 413 CO 0.00 -0.14 1.68 -0.90 -0.31 0.00 0.00 175.10 175.43 1k1d n ASP 414 N -0.25 0.00 -3.79 4.85 5.68 -1.26 -4.85 116.55 116.93 1k1d n ASP 414 Ca 0.03 -1.06 -0.10 0.00 -0.50 0.00 0.00 54.79 53.16 1k1d n ASP 414 Cb 0.53 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.47 1k1d n ASP 414 CO 0.00 0.00 0.00 -0.72 -1.33 0.00 0.00 177.20 175.15 1k1d s TYR 415 N -2.00 0.38 -0.04 2.11 1.13 -1.26 -4.92 117.35 112.75 1k1d s TYR 415 Ca 0.30 -0.76 -0.02 0.00 -1.41 0.00 0.00 57.07 55.18 1k1d s TYR 415 Cb 0.14 0.26 0.03 0.00 -1.10 0.00 0.00 41.96 41.29 1k1d s TYR 415 CO 0.23 -1.09 0.05 1.21 -2.51 0.00 0.00 175.55 173.45 1k1d s ASN 416 N -3.04 1.11 0.63 -0.18 3.84 -1.26 -4.88 114.94 111.15 1k1d s ASN 416 Ca 0.22 0.06 0.30 0.00 0.21 0.00 0.00 52.86 53.65 1k1d s ASN 416 Cb -0.02 -0.16 1.62 0.00 -0.55 0.00 0.00 41.25 42.15 1k1d s ASN 416 CO 0.11 -0.24 1.91 0.00 -2.79 0.00 0.00 177.10 176.08 1k1d h ALA 417 N 8.36 1.28 -0.48 1.71 0.00 -1.90 -0.66 119.26 127.56 1k1d h ALA 417 Ca -0.15 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.50 1k1d h ALA 417 Cb 1.12 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.76 1k1d h ALA 417 CO 0.18 -0.28 0.03 1.19 0.00 0.00 0.00 179.25 180.37 1k1d n PHE 418 N -2.82 1.49 -1.67 0.00 3.72 -1.26 -5.03 117.46 111.90 1k1d n PHE 418 Ca -0.02 -1.71 -0.47 0.00 -0.05 0.00 0.00 57.45 55.21 1k1d n PHE 418 Cb 0.33 -0.59 -0.04 0.00 -0.94 0.00 0.00 39.48 38.24 1k1d n PHE 418 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1k1d n GLU 419 N -1.12 2.10 0.00 -1.08 4.07 -0.26 -1.15 120.64 123.21 1k1d n GLU 419 Ca 0.39 0.76 0.00 0.00 -0.06 0.00 0.00 57.16 58.25 1k1d n GLU 419 Cb 1.13 -2.53 0.00 0.00 -0.06 0.00 0.00 31.44 29.97 1k1d n GLU 419 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1k1d n GLY 420 N 3.50 2.46 3.72 8.31 0.00 0.16 -4.99 105.19 118.34 1k1d n GLY 420 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1k1d n GLY 420 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1k1d s MET 421 N -0.19 4.29 0.08 1.61 0.00 -0.30 -4.73 119.30 120.06 1k1d s MET 421 Ca 0.00 2.16 -0.26 0.00 0.00 0.00 0.00 55.69 57.59 1k1d s MET 421 Cb 0.00 -3.22 -0.06 0.00 0.00 0.00 0.00 34.83 31.55 1k1d s MET 421 CO 0.00 -0.49 0.80 0.21 0.00 0.00 0.00 175.02 175.54 1k1d s LYS 422 N 1.12 4.54 0.01 4.11 2.20 -1.26 -0.37 119.74 130.09 1k1d s LYS 422 Ca 0.66 1.14 0.01 0.00 -0.36 0.00 0.00 55.97 57.43 1k1d s LYS 422 Cb -0.39 -3.34 -0.01 0.00 -1.51 0.00 0.00 37.83 32.58 1k1d s LYS 422 CO 0.30 0.34 -0.05 0.08 -0.36 0.00 0.00 175.35 175.66 1k1d s VAL 423 N -0.28 0.36 -0.14 4.02 1.01 0.85 -4.95 120.40 121.27 1k1d s VAL 423 Ca 0.39 -0.42 -0.04 0.00 0.00 0.00 0.00 61.98 61.91 1k1d s VAL 423 Cb -0.21 -0.35 -0.03 0.00 0.00 0.00 0.00 36.38 35.78 1k1d s VAL 423 CO 0.25 -0.05 0.00 -0.89 0.00 0.00 0.00 175.10 174.41 1k1d s THR 424 N -0.46 4.27 0.00 3.92 2.01 -1.26 -0.71 115.64 123.41 1k1d s THR 424 Ca -0.02 -0.24 0.00 0.00 0.31 0.00 0.00 61.69 61.74 1k1d s THR 424 Cb -0.04 -2.86 0.00 0.00 0.01 0.00 0.00 72.50 69.61 1k1d s THR 424 CO -0.00 0.52 0.00 0.61 -0.69 0.00 0.00 174.62 175.06 1k1d n GLY 425 N 3.08 1.42 3.60 4.40 0.00 0.94 -3.97 105.19 114.65 1k1d n GLY 425 Ca -0.18 -1.57 -0.15 0.00 0.00 0.00 0.00 46.02 44.13 1k1d n GLY 425 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1k1d s GLU 426 N -4.74 0.87 0.18 1.61 2.12 0.82 -4.89 118.70 114.66 1k1d s GLU 426 Ca 0.00 0.77 -0.30 0.00 0.36 0.00 0.00 54.97 55.79 1k1d s GLU 426 Cb 0.00 0.42 -0.08 0.00 0.26 0.00 0.00 34.13 34.73 1k1d s GLU 426 CO 0.00 -0.16 1.33 -2.14 -0.54 0.00 0.00 175.26 173.75 1k1d s PRO 427 N -0.07 4.37 -0.23 4.30 0.02 -1.26 -0.75 135.00 141.39 1k1d s PRO 427 Ca -0.03 2.05 -0.09 0.00 0.02 0.00 0.00 61.00 62.95 1k1d s PRO 427 Cb -0.04 -3.21 -0.11 0.00 0.02 0.00 0.00 34.50 31.17 1k1d s PRO 427 CO 0.03 -0.30 -0.28 0.28 -0.33 0.00 0.00 177.00 176.40 1k1d n VAL 428 N 2.97 1.26 -4.15 3.83 0.31 0.83 -4.63 118.33 118.73 1k1d n VAL 428 Ca 0.07 -0.35 -0.19 0.00 -0.01 0.00 0.00 64.34 63.87 1k1d n VAL 428 Cb 0.43 -1.72 -0.16 0.00 -0.91 0.00 0.00 33.84 31.47 1k1d n VAL 428 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1k1d s SER 429 N -6.91 0.83 -0.18 4.52 0.01 -0.96 -0.33 113.70 110.69 1k1d s SER 429 Ca -0.32 -0.11 0.00 0.00 1.31 0.00 0.00 55.95 56.83 1k1d s SER 429 Cb 0.12 -0.37 0.04 0.00 0.21 0.00 0.00 66.02 66.02 1k1d s SER 429 CO 0.42 -0.04 -0.08 -0.69 0.41 0.00 0.00 173.24 173.26 1k1d s VAL 430 N 0.75 1.39 -0.04 3.43 1.01 0.19 0.60 120.40 127.74 1k1d s VAL 430 Ca -0.10 -0.79 0.07 0.00 0.00 0.00 0.00 61.98 61.16 1k1d s VAL 430 Cb -0.13 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 1k1d s VAL 430 CO 0.00 0.19 -0.25 -1.48 0.00 0.00 0.00 175.10 173.55 1k1d s LEU 431 N 1.51 2.07 -0.26 3.92 2.34 -0.39 -0.62 118.68 127.25 1k1d s LEU 431 Ca 0.00 -0.49 -0.06 0.00 0.06 0.00 0.00 54.13 53.65 1k1d s LEU 431 Cb -0.15 -1.36 -0.01 0.00 -0.56 0.00 0.00 46.19 44.11 1k1d s LEU 431 CO -0.08 0.29 0.05 0.00 -1.06 0.00 0.00 176.35 175.54 1k1d n ARG 433 N 4.87 -1.65 0.00 0.00 1.74 -0.85 -2.42 116.66 118.34 1k1d n ARG 433 Ca -0.16 0.62 0.00 0.00 -0.77 0.00 0.00 57.85 57.55 1k1d n ARG 433 Cb 0.50 -4.82 0.00 0.00 -1.02 0.00 0.00 32.46 27.12 1k1d n ARG 433 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1k1d n GLY 434 N -1.50 1.50 3.67 -0.13 0.00 -0.84 -4.51 105.19 103.39 1k1d n GLY 434 Ca -0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 1k1d n GLY 434 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k1d s GLU 435 N 0.00 3.35 0.35 1.61 0.41 -1.02 -4.98 118.70 118.43 1k1d s GLU 435 Ca 0.00 -0.37 -0.28 0.00 -0.41 0.00 0.00 54.97 53.91 1k1d s GLU 435 Cb 0.00 -2.95 -0.10 0.00 -1.78 0.00 0.00 34.13 29.30 1k1d s GLU 435 CO 0.00 0.55 1.28 -0.06 -0.49 0.00 0.00 175.26 176.55 1k1d s PHE 436 N -0.45 3.02 -0.04 1.61 0.40 -1.26 -0.82 117.98 120.44 1k1d s PHE 436 Ca 0.09 1.44 0.04 0.00 -0.60 0.00 0.00 56.93 57.90 1k1d s PHE 436 Cb -0.12 -3.63 -0.05 0.00 0.51 0.00 0.00 43.02 39.73 1k1d s PHE 436 CO 0.02 -1.80 0.02 0.28 0.70 0.00 0.00 175.22 174.45 1k1d n VAL 437 N 0.57 0.24 -3.46 -0.44 0.31 0.21 -4.32 118.33 111.45 1k1d n VAL 437 Ca 0.01 -0.16 -0.16 0.00 -0.01 0.00 0.00 64.34 64.02 1k1d n VAL 437 Cb 0.43 -0.73 -0.12 0.00 -0.91 0.00 0.00 33.84 32.51 1k1d n VAL 437 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1k1d s VAL 438 N -2.12 -0.40 -0.12 2.52 1.01 -0.61 -1.70 120.40 118.98 1k1d s VAL 438 Ca -0.02 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 61.87 1k1d s VAL 438 Cb 0.01 -0.70 -0.02 0.00 0.00 0.00 0.00 36.38 35.67 1k1d s VAL 438 CO 0.17 -0.17 -0.12 -0.60 0.00 0.00 0.00 175.10 174.37 1k1d s ARG 439 N 2.38 3.26 -1.17 2.72 3.52 -0.07 0.55 118.95 130.15 1k1d s ARG 439 Ca 0.08 -0.67 -0.25 0.00 -0.13 0.00 0.00 55.73 54.76 1k1d s ARG 439 Cb -0.16 -2.61 0.01 0.00 -1.56 0.00 0.00 34.95 30.63 1k1d s ARG 439 CO -0.13 0.29 0.75 -0.25 -0.81 0.00 0.00 175.30 175.15 1k1d n ASP 440 N 3.32 -4.88 -2.14 -2.12 8.00 -0.59 -1.03 116.55 117.11 1k1d n ASP 440 Ca -0.18 -1.11 -0.09 0.00 0.71 0.00 0.00 54.79 54.12 1k1d n ASP 440 Cb 0.53 -2.85 -0.01 0.00 -0.02 0.00 0.00 41.12 38.77 1k1d n ASP 440 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1k1d n LYS 441 N -4.46 -2.10 -4.31 -1.24 5.02 0.56 -4.92 118.16 106.71 1k1d n LYS 441 Ca -0.10 0.47 -0.21 0.00 -2.02 0.00 0.00 58.31 56.45 1k1d n LYS 441 Cb 0.58 -4.94 -0.16 0.00 -0.02 0.00 0.00 35.03 30.50 1k1d n LYS 441 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1k1d s GLN 442 N -4.42 1.02 0.18 1.97 -0.44 -0.20 -5.13 119.66 112.64 1k1d s GLN 442 Ca 0.00 -0.22 -0.31 0.00 -2.50 0.00 0.00 55.36 52.33 1k1d s GLN 442 Cb 0.00 -0.94 -0.09 0.00 -1.64 0.00 0.00 33.01 30.33 1k1d s GLN 442 CO 0.00 -0.00 1.43 0.12 0.50 0.00 0.00 175.29 177.33 1k1d s PHE 443 N 0.64 3.14 0.00 1.67 5.36 -1.26 -0.89 117.98 126.63 1k1d s PHE 443 Ca -0.10 0.96 0.00 0.00 -0.96 0.00 0.00 56.93 56.83 1k1d s PHE 443 Cb -0.13 -3.76 0.00 0.00 -0.34 0.00 0.00 43.02 38.79 1k1d s PHE 443 CO 0.01 -2.59 0.61 1.33 -1.46 0.00 0.00 175.22 173.12 1k1d n VAL 444 N 3.22 0.00 -1.60 3.12 0.24 -0.69 -4.90 118.33 117.71 1k1d n VAL 444 Ca 0.10 0.00 -0.00 0.00 -2.04 0.00 0.00 64.34 62.39 1k1d n VAL 444 Cb 0.41 0.87 0.00 0.00 -1.47 0.00 0.00 33.84 33.65 1k1d n VAL 444 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1k1d n GLY 445 N 0.00 -0.21 3.03 7.63 0.00 -1.04 -4.80 105.19 109.80 1k1d n GLY 445 Ca 0.00 -1.81 -0.13 0.00 0.00 0.00 0.00 46.02 44.08 1k1d n GLY 445 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k1d s LYS 446 N -2.71 0.17 0.09 1.61 1.02 -1.26 -5.09 119.74 113.58 1k1d s LYS 446 Ca 0.00 0.70 -0.34 0.00 0.02 0.00 0.00 55.97 56.35 1k1d s LYS 446 Cb -0.00 -0.05 -0.14 0.00 -0.52 0.00 0.00 37.83 37.12 1k1d s LYS 446 CO 0.00 -0.25 1.62 -0.35 -0.92 0.00 0.00 175.35 175.45 1k1d n PRO 447 N 5.03 2.00 0.00 -1.68 -0.04 -1.26 -1.35 135.00 137.70 1k1d n PRO 447 Ca -0.12 0.73 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 1k1d n PRO 447 Cb 0.51 -2.49 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 1k1d n PRO 447 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1k1d n GLY 448 N 3.53 2.40 0.25 0.55 0.00 0.15 -4.57 105.19 107.51 1k1d n GLY 448 Ca 0.19 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.21 1k1d n GLY 448 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1k1d h TYR 449 N 0.00 0.38 -3.59 1.61 3.20 -0.73 -3.43 116.97 114.41 1k1d h TYR 449 Ca 0.00 -0.05 -0.52 0.00 3.14 0.00 0.00 58.73 61.30 1k1d h TYR 449 Cb 0.00 -0.11 0.05 0.00 1.54 0.00 0.00 36.73 38.21 1k1d h TYR 449 CO 0.00 0.47 0.65 0.20 -1.64 0.00 0.00 178.16 177.83 1k1d s GLY 450 N -3.98 2.68 0.14 1.82 0.00 0.39 -4.87 107.32 103.50 1k1d s GLY 450 Ca -0.06 1.17 0.11 0.00 0.00 0.00 0.00 44.72 45.93 1k1d s GLY 450 CO 0.75 1.99 -0.24 -0.86 0.00 0.00 0.00 173.10 174.74 1k1d s GLN 451 N -0.84 1.52 0.68 2.90 -2.07 -1.26 -4.67 119.66 115.93 1k1d s GLN 451 Ca 0.53 -1.34 -0.16 0.00 -1.82 0.00 0.00 55.36 52.57 1k1d s GLN 451 Cb -0.38 -1.94 0.01 0.00 -1.09 0.00 0.00 33.01 29.61 1k1d s GLN 451 CO 0.44 0.45 1.21 -0.47 -1.32 0.00 0.00 175.29 175.60 1k1d s TYR 452 N -1.21 2.17 -0.13 9.60 5.04 -1.26 -2.31 117.35 129.25 1k1d s TYR 452 Ca 0.16 1.56 0.01 0.00 -2.44 0.00 0.00 57.07 56.36 1k1d s TYR 452 Cb -0.10 -3.48 0.02 0.00 0.35 0.00 0.00 41.96 38.75 1k1d s TYR 452 CO 0.08 -2.50 -0.14 -0.51 -1.34 0.00 0.00 175.55 171.15 1k1d s LEU 453 N -4.78 1.63 0.05 6.97 1.43 0.19 -4.83 118.68 119.34 1k1d s LEU 453 Ca 0.76 -0.45 -0.26 0.00 -1.03 0.00 0.00 54.13 53.15 1k1d s LEU 453 Cb -0.30 -1.11 -0.05 0.00 0.03 0.00 0.00 46.19 44.76 1k1d s LEU 453 CO 0.41 -0.05 0.79 -0.54 0.23 0.00 0.00 176.35 177.20 1k1d s LYS 454 N 1.39 4.52 0.09 1.70 1.02 -1.26 -4.58 119.74 122.62 1k1d s LYS 454 Ca 0.02 1.11 0.05 0.00 0.02 0.00 0.00 55.97 57.17 1k1d s LYS 454 Cb -0.13 -3.37 -0.04 0.00 -0.52 0.00 0.00 37.83 33.77 1k1d s LYS 454 CO -0.08 0.26 -0.02 1.03 -0.92 0.00 0.00 175.35 175.62 1k1d s ARG 455 N 0.02 2.48 0.82 1.68 0.52 0.26 -4.81 118.95 119.92 1k1d s ARG 455 Ca 0.40 -0.87 -0.14 0.00 -0.52 0.00 0.00 55.73 54.59 1k1d s ARG 455 Cb -0.21 -2.50 0.01 0.00 0.52 0.00 0.00 34.95 32.78 1k1d s ARG 455 CO 0.24 0.53 0.62 0.00 0.02 0.00 0.00 175.30 176.71 1k1d n ALA 456 N 0.58 -1.61 0.86 2.13 0.00 -0.32 -4.60 120.51 117.55 1k1d n ALA 456 Ca -0.11 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 52.93 1k1d n ALA 456 Cb 0.52 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 18.06 1k1d n ALA 456 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1k1d n LYS 457 N -1.61 0.86 -1.27 0.00 4.81 -1.26 -4.51 118.16 115.18 1k1d n LYS 457 Ca 0.10 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.49 1k1d n LYS 457 Cb 0.51 -1.10 -0.02 0.00 0.02 0.00 0.00 35.03 34.44 1k1d n LYS 457 CO 0.00 0.00 0.00 0.98 1.17 0.00 0.00 177.40 179.55 1k1d n TYR 458 N 0.53 -0.03 -2.75 5.64 9.36 -1.25 -4.44 117.16 124.21 1k1d n TYR 458 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1k1d n TYR 458 Cb 0.41 -1.20 0.00 0.00 -0.63 0.00 0.00 39.34 37.91 1k1d n TYR 458 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1k1d n GLY 459 N -2.24 6.71 0.00 2.98 0.00 -1.26 -5.05 105.19 106.32 1k1d n GLY 459 Ca -0.05 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.15 1k1d n GLY 459 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73