#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 1.82 -4.11 2.03 -1.04 -1.26 -4.97 114.28 106.75 1k1d n THR 2 Ca 0.00 -0.50 -0.08 0.00 -2.04 0.00 0.00 64.05 61.43 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 -1.36 0.66 -0.10 -2.82 1.02 -0.97 -4.08 119.74 112.09 1k1d s LYS 3 Ca 0.62 -1.22 -0.03 0.00 0.02 0.00 0.00 55.97 55.35 1k1d s LYS 3 Cb -0.73 0.08 0.04 0.00 -0.52 0.00 0.00 37.83 36.70 1k1d s LYS 3 CO 0.58 -0.08 0.08 0.42 -0.92 0.00 0.00 175.35 175.44 1k1d s ILE 4 N -3.71 -0.12 -0.47 2.17 1.01 -1.05 -0.69 121.20 118.36 1k1d s ILE 4 Ca 0.07 0.18 -0.17 0.00 0.00 0.00 0.00 60.65 60.74 1k1d s ILE 4 Cb 0.06 -0.33 0.05 0.00 0.01 0.00 0.00 42.46 42.25 1k1d s ILE 4 CO -0.08 -0.01 0.46 -0.63 0.00 0.00 0.00 174.94 174.69 1k1d s ILE 5 N 2.17 5.10 0.30 2.92 1.01 -0.48 0.11 121.20 132.32 1k1d s ILE 5 Ca 0.04 -0.70 0.08 0.00 0.00 0.00 0.00 60.65 60.06 1k1d s ILE 5 Cb -0.14 -4.14 -0.04 0.00 0.01 0.00 0.00 42.46 38.16 1k1d s ILE 5 CO -0.06 -0.59 0.19 -1.59 0.00 0.00 0.00 174.94 172.89 1k1d s LYS 6 N 2.05 2.63 -1.95 2.79 -2.85 -0.02 -1.39 119.74 121.00 1k1d s LYS 6 Ca 0.09 -1.31 0.00 0.00 -1.00 0.00 0.00 55.97 53.75 1k1d s LYS 6 Cb -0.21 -2.38 0.00 0.00 -2.06 0.00 0.00 37.83 33.18 1k1d s LYS 6 CO 0.10 0.22 0.00 0.09 0.10 0.00 0.00 175.35 175.86 1k1d n ASN 7 N -1.20 -5.30 -4.99 0.03 3.02 -1.26 -0.09 115.26 105.46 1k1d n ASN 7 Ca -0.04 0.39 -0.19 0.00 -0.03 0.00 0.00 54.58 54.71 1k1d n ASN 7 Cb 0.59 -4.45 -0.00 0.00 -0.61 0.00 0.00 39.78 35.31 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 -2.70 1.63 -0.35 7.41 0.00 -1.25 -3.00 107.32 109.04 1k1d s GLY 8 Ca 0.00 -1.48 -0.10 0.00 0.00 0.00 0.00 44.72 43.14 1k1d s GLY 8 CO 0.00 -1.39 0.19 -1.59 0.00 0.00 0.00 173.10 170.31 1k1d s THR 9 N -2.19 4.56 0.08 0.90 2.01 -0.03 -3.31 115.64 117.65 1k1d s THR 9 Ca 0.46 -0.74 -0.30 0.00 0.31 0.00 0.00 61.69 61.42 1k1d s THR 9 Cb -0.09 -3.48 -0.05 0.00 0.01 0.00 0.00 72.50 68.88 1k1d s THR 9 CO 0.31 -0.14 1.03 -0.63 -0.69 0.00 0.00 174.62 174.50 1k1d s ILE 10 N 1.57 4.42 -0.28 1.82 1.01 0.28 -0.62 121.20 129.40 1k1d s ILE 10 Ca 0.03 1.88 -0.02 0.00 0.00 0.00 0.00 60.65 62.53 1k1d s ILE 10 Cb -0.19 -4.20 0.09 0.00 0.01 0.00 0.00 42.46 38.18 1k1d s ILE 10 CO 0.06 0.22 0.09 -0.69 0.00 0.00 0.00 174.94 174.63 1k1d s VAL 11 N 0.46 0.56 0.19 2.92 1.01 -0.99 -1.00 120.40 123.55 1k1d s VAL 11 Ca 0.51 -1.06 0.02 0.00 0.00 0.00 0.00 61.98 61.44 1k1d s VAL 11 Cb -0.25 -1.36 0.04 0.00 0.00 0.00 0.00 36.38 34.81 1k1d s VAL 11 CO 0.30 -0.60 0.26 0.35 0.00 0.00 0.00 175.10 175.42 1k1d n THR 12 N 4.99 0.00 0.37 3.92 -2.24 0.64 -4.42 114.28 117.54 1k1d n THR 12 Ca -0.04 -0.53 0.10 0.00 -2.27 0.00 0.00 64.05 61.31 1k1d n THR 12 Cb 0.43 -1.03 0.43 0.00 -2.10 0.00 0.00 70.33 68.06 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 -2.88 1.54 0.00 6.98 0.00 -1.26 -3.93 120.51 120.95 1k1d n ALA 13 Ca -0.04 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1k1d n ALA 13 Cb 0.18 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.31 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 -2.01 0.00 -3.64 0.00 -1.04 -1.26 -4.55 114.28 101.77 1k1d n THR 14 Ca 0.02 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.80 1k1d n THR 14 Cb 0.17 -0.76 -0.02 0.00 -1.82 0.00 0.00 70.33 67.91 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 -4.33 6.31 -0.28 8.00 1.01 -1.25 -5.00 116.67 121.13 1k1d s ASP 15 Ca 0.00 0.30 -0.00 0.00 0.71 0.00 0.00 52.55 53.56 1k1d s ASP 15 Cb 0.00 -1.96 0.14 0.00 1.01 0.00 0.00 42.92 42.11 1k1d s ASP 15 CO 0.00 -0.18 0.35 -0.89 0.21 0.00 0.00 175.17 174.66 1k1d s THR 16 N -2.14 -0.53 0.26 -1.27 2.01 -1.25 -0.26 115.64 112.46 1k1d s THR 16 Ca 0.37 -0.31 -0.08 0.00 0.31 0.00 0.00 61.69 61.99 1k1d s THR 16 Cb -0.10 -0.94 -0.01 0.00 0.01 0.00 0.00 72.50 71.47 1k1d s THR 16 CO 0.33 -0.31 0.42 -0.72 -0.69 0.00 0.00 174.62 173.64 1k1d s TYR 17 N 2.47 0.67 -0.16 4.92 1.13 -0.17 -4.97 117.35 121.24 1k1d s TYR 17 Ca 0.10 -0.98 -0.03 0.00 -1.41 0.00 0.00 57.07 54.75 1k1d s TYR 17 Cb -0.14 -0.01 -0.02 0.00 -1.10 0.00 0.00 41.96 40.69 1k1d s TYR 17 CO -0.27 -0.97 -0.05 -1.21 -2.51 0.00 0.00 175.55 170.54 1k1d s GLU 18 N -3.80 3.60 0.12 -3.49 2.02 -1.26 0.10 118.70 115.98 1k1d s GLU 18 Ca 0.27 -0.56 -0.24 0.00 0.02 0.00 0.00 54.97 54.46 1k1d s GLU 18 Cb 0.01 -2.89 0.08 0.00 0.10 0.00 0.00 34.13 31.43 1k1d s GLU 18 CO 0.12 0.19 1.12 0.00 0.02 0.00 0.00 175.26 176.71 1k1d s ALA 19 N 0.49 -1.89 0.15 5.21 0.00 -1.21 -4.84 121.76 119.68 1k1d s ALA 19 Ca -0.04 -0.19 0.08 0.00 0.00 0.00 0.00 51.96 51.81 1k1d s ALA 19 Cb -0.15 0.79 -0.04 0.00 0.00 0.00 0.00 23.12 23.73 1k1d s ALA 19 CO 0.03 -1.09 -0.09 -1.01 0.00 0.00 0.00 175.76 173.60 1k1d s HIS 20 N -2.14 2.69 -0.15 0.00 3.76 0.67 -3.93 115.29 116.19 1k1d s HIS 20 Ca 0.24 -0.19 -0.01 0.00 -0.15 0.00 0.00 55.06 54.95 1k1d s HIS 20 Cb -0.02 -1.35 -0.01 0.00 1.11 0.00 0.00 32.58 32.31 1k1d s HIS 20 CO 0.03 0.48 -0.11 -0.51 -0.85 0.00 0.00 174.74 173.77 1k1d s LEU 21 N -2.60 2.73 -0.42 0.89 1.43 -0.49 -1.94 118.68 118.28 1k1d s LEU 21 Ca 0.24 -0.36 -0.15 0.00 -1.03 0.00 0.00 54.13 52.83 1k1d s LEU 21 Cb -0.10 -1.63 0.03 0.00 0.03 0.00 0.00 46.19 44.52 1k1d s LEU 21 CO 0.15 0.11 0.32 -0.22 0.23 0.00 0.00 176.35 176.94 1k1d s LEU 22 N 0.67 5.20 0.00 1.79 2.96 0.37 -1.39 118.68 128.28 1k1d s LEU 22 Ca -0.06 -0.99 -0.20 0.00 -0.22 0.00 0.00 54.13 52.66 1k1d s LEU 22 Cb -0.15 -2.16 -0.06 0.00 0.50 0.00 0.00 46.19 44.32 1k1d s LEU 22 CO 0.02 -0.49 0.56 -0.63 -1.32 0.00 0.00 176.35 174.50 1k1d s ILE 23 N 1.67 4.91 0.00 6.68 1.01 0.13 -0.39 121.20 135.21 1k1d s ILE 23 Ca 0.05 1.18 0.00 0.00 0.00 0.00 0.00 60.65 61.87 1k1d s ILE 23 Cb -0.20 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.38 1k1d s ILE 23 CO 0.09 0.45 0.00 1.17 0.00 0.00 0.00 174.94 176.65 1k1d n LYS 24 N 2.53 0.00 -0.55 2.79 3.00 0.49 -2.30 118.16 124.11 1k1d n LYS 24 Ca -0.08 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.19 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 4.18 0.00 3.14 9.92 -1.26 -4.39 116.55 128.14 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 2.01 0.64 3.51 0.44 0.00 -1.26 -4.98 105.19 105.55 1k1d n GLY 26 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.15 1.75 -0.39 1.61 1.02 -1.26 -0.52 119.74 121.80 1k1d s LYS 27 Ca 0.00 -1.96 -0.27 0.00 0.02 0.00 0.00 55.97 53.76 1k1d s LYS 27 Cb 0.00 -1.26 0.02 0.00 -0.52 0.00 0.00 37.83 36.07 1k1d s LYS 27 CO 0.00 -0.07 1.01 0.42 -0.92 0.00 0.00 175.35 175.79 1k1d s ILE 28 N -2.98 4.47 -0.11 2.17 1.01 -0.57 -0.38 121.20 124.81 1k1d s ILE 28 Ca 0.34 1.29 -0.27 0.00 0.00 0.00 0.00 60.65 62.01 1k1d s ILE 28 Cb 0.08 -4.42 -0.27 0.00 0.01 0.00 0.00 42.46 37.86 1k1d s ILE 28 CO 0.16 -0.65 0.84 0.00 0.00 0.00 0.00 174.94 175.28 1k1d h ALA 29 N 8.60 -0.02 -2.35 9.38 0.00 -1.04 -0.04 119.26 133.79 1k1d h ALA 29 Ca -0.23 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1k1d h ALA 29 Cb 1.07 0.02 -0.16 0.00 0.00 0.00 0.00 17.79 18.72 1k1d h ALA 29 CO 1.03 0.08 0.30 0.00 0.00 0.00 0.00 179.25 180.66 1k1d s MET 30 N -2.42 1.04 -0.00 0.00 0.23 -1.08 -4.79 119.30 112.27 1k1d s MET 30 Ca -0.17 -0.12 0.07 0.00 -1.03 0.00 0.00 55.69 54.44 1k1d s MET 30 Cb -0.02 0.48 -0.02 0.00 -1.53 0.00 0.00 34.83 33.75 1k1d s MET 30 CO 0.73 -0.40 -0.22 0.42 -2.03 0.00 0.00 175.02 173.51 1k1d s ILE 31 N -2.45 1.78 -2.16 3.16 1.01 -1.26 -0.48 121.20 120.80 1k1d s ILE 31 Ca -0.03 -1.03 0.00 0.00 0.00 0.00 0.00 60.65 59.59 1k1d s ILE 31 Cb -0.01 -1.49 0.00 0.00 0.01 0.00 0.00 42.46 40.97 1k1d s ILE 31 CO -0.03 0.44 0.00 0.61 0.00 0.00 0.00 174.94 175.96 1k1d n GLY 32 N 2.35 -1.65 3.70 6.18 0.00 -0.82 -4.96 105.19 110.00 1k1d n GLY 32 Ca -0.16 -1.08 -0.29 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.53 2.59 -1.30 1.61 -2.07 -1.26 0.24 119.66 117.95 1k1d s GLN 33 Ca 0.00 -0.90 -0.01 0.00 -1.82 0.00 0.00 55.36 52.64 1k1d s GLN 33 Cb 0.00 -2.53 -0.00 0.00 -1.09 0.00 0.00 33.01 29.39 1k1d s GLN 33 CO 0.00 0.51 0.71 0.09 -1.32 0.00 0.00 175.29 175.28 1k1d n ASN 34 N 0.25 -1.37 -4.81 12.60 3.02 -1.26 -4.94 115.26 118.75 1k1d n ASN 34 Ca -0.10 -0.82 -0.33 0.00 -0.03 0.00 0.00 54.58 53.30 1k1d n ASN 34 Cb 0.53 -4.07 -0.04 0.00 -0.61 0.00 0.00 39.78 35.59 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 -6.64 3.79 -0.03 3.41 1.43 -1.26 -5.06 118.68 114.32 1k1d s LEU 35 Ca 0.02 1.78 -0.19 0.00 -1.03 0.00 0.00 54.13 54.72 1k1d s LEU 35 Cb -0.01 -4.54 0.03 0.00 0.03 0.00 0.00 46.19 41.71 1k1d s LEU 35 CO 0.81 -0.67 0.40 -1.61 0.23 0.00 0.00 176.35 175.51 1k1d s GLU 36 N -3.47 0.76 -0.30 1.70 2.02 -1.26 -5.11 118.70 113.04 1k1d s GLU 36 Ca 0.64 -0.07 -0.15 0.00 0.02 0.00 0.00 54.97 55.41 1k1d s GLU 36 Cb -0.13 0.34 0.17 0.00 0.10 0.00 0.00 34.13 34.62 1k1d s GLU 36 CO 0.22 -0.22 1.12 -2.00 0.02 0.00 0.00 175.26 174.41 1k1d s GLU 37 N -1.26 0.13 -0.09 1.61 2.12 -1.26 -5.13 118.70 114.82 1k1d s GLU 37 Ca -0.13 0.23 -0.40 0.00 0.36 0.00 0.00 54.97 55.03 1k1d s GLU 37 Cb -0.04 0.13 -0.18 0.00 0.26 0.00 0.00 34.13 34.29 1k1d s GLU 37 CO 0.06 -0.13 1.34 1.17 -0.54 0.00 0.00 175.26 177.15 1k1d n LYS 38 N 5.47 0.55 -1.84 4.30 4.81 -1.26 -3.63 118.16 126.55 1k1d n LYS 38 Ca -0.08 0.20 -0.01 0.00 -0.87 0.00 0.00 58.31 57.55 1k1d n LYS 38 Cb 0.54 -1.77 -0.01 0.00 0.02 0.00 0.00 35.03 33.81 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 2.61 -3.41 0.00 3.14 0.00 -1.26 -5.04 105.19 101.23 1k1d n GLY 39 Ca 0.22 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.32 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 0.32 0.00 0.00 4.61 0.00 -1.24 -4.70 120.51 119.50 1k1d n ALA 40 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1k1d n ALA 40 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.53 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 -0.57 0.00 2.13 -1.26 -2.52 120.64 118.43 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 -3.18 0.00 0.00 0.27 0.00 0.00 31.44 28.75 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 -1.43 -0.19 -3.41 6.31 0.31 -1.26 -4.87 118.33 113.79 1k1d n VAL 42 Ca 0.00 0.01 -0.38 0.00 -0.01 0.00 0.00 64.34 63.96 1k1d n VAL 42 Cb 0.00 -0.43 -0.06 0.00 -0.91 0.00 0.00 33.84 32.44 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 -0.02 5.00 -0.24 2.52 -1.09 0.30 -4.93 121.20 122.74 1k1d s ILE 43 Ca 0.00 0.95 -0.10 0.00 -2.23 0.00 0.00 60.65 59.26 1k1d s ILE 43 Cb 0.00 -3.78 -0.05 0.00 -1.58 0.00 0.00 42.46 37.05 1k1d s ILE 43 CO 0.00 0.52 0.16 -0.62 -1.23 0.00 0.00 174.94 173.76 1k1d s ASP 44 N -0.70 6.12 -0.14 3.58 2.15 -1.26 -0.84 116.67 125.58 1k1d s ASP 44 Ca 0.25 0.12 0.17 0.00 0.43 0.00 0.00 52.55 53.53 1k1d s ASP 44 Cb -0.17 -2.10 0.36 0.00 -0.30 0.00 0.00 42.92 40.71 1k1d s ASP 44 CO 0.14 0.08 1.24 0.00 -0.17 0.00 0.00 175.17 176.45 1k1d n ALA 45 N 4.21 2.49 -1.42 3.66 0.00 0.86 -4.93 120.51 125.39 1k1d n ALA 45 Ca -0.15 -2.42 -0.44 0.00 0.00 0.00 0.00 53.44 50.43 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 -1.04 0.37 -3.36 0.00 5.02 -1.16 -1.42 118.16 116.57 1k1d n LYS 46 Ca 0.17 0.13 -0.24 0.00 -2.02 0.00 0.00 58.31 56.35 1k1d n LYS 46 Cb 0.70 -1.28 0.02 0.00 -0.02 0.00 0.00 35.03 34.46 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 1.90 -0.51 3.13 0.72 0.00 -1.26 -4.97 105.19 104.19 1k1d n GLY 47 Ca 0.13 0.14 -0.09 0.00 0.00 0.00 0.00 46.02 46.21 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 -3.17 3.48 -0.28 0.00 2.02 0.08 -0.86 117.35 118.62 1k1d s TYR 49 Ca -0.00 0.21 0.01 0.00 -0.37 0.00 0.00 57.07 56.92 1k1d s TYR 49 Cb 0.02 -1.76 0.08 0.00 -0.40 0.00 0.00 41.96 39.91 1k1d s TYR 49 CO -0.07 0.38 0.03 0.08 -1.57 0.00 0.00 175.55 174.41 1k1d s VAL 50 N -1.93 1.36 0.19 0.71 1.01 0.21 -0.93 120.40 121.02 1k1d s VAL 50 Ca 0.37 -1.48 0.04 0.00 0.00 0.00 0.00 61.98 60.91 1k1d s VAL 50 Cb -0.10 -1.88 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 1k1d s VAL 50 CO 0.30 -0.44 0.32 -0.36 0.00 0.00 0.00 175.10 174.92 1k1d s PHE 51 N 1.41 3.46 0.18 5.22 0.08 -0.34 -2.36 117.98 125.63 1k1d s PHE 51 Ca 0.04 0.05 -0.30 0.00 0.12 0.00 0.00 56.93 56.84 1k1d s PHE 51 Cb -0.18 -1.61 -0.08 0.00 -0.57 0.00 0.00 43.02 40.58 1k1d s PHE 51 CO -0.14 0.48 1.14 -2.14 -0.10 0.00 0.00 175.22 174.46 1k1d s PRO 52 N -3.60 4.55 0.32 0.24 0.02 -1.26 -1.13 135.00 134.14 1k1d s PRO 52 Ca 0.34 1.78 -0.25 0.00 0.02 0.00 0.00 61.00 62.90 1k1d s PRO 52 Cb -0.10 -3.26 -0.15 0.00 0.02 0.00 0.00 34.50 31.00 1k1d s PRO 52 CO 0.29 0.01 0.41 0.41 -0.33 0.00 0.00 177.00 177.79 1k1d n GLY 53 N 2.10 -1.93 3.81 0.52 0.00 0.94 -4.77 105.19 105.86 1k1d n GLY 53 Ca 0.03 0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.96 2.03 -0.14 -0.02 0.00 0.12 -4.62 107.32 103.73 1k1d s GLY 54 Ca 0.62 0.32 0.00 0.00 0.00 0.00 0.00 44.72 45.66 1k1d s GLY 54 CO 0.59 0.64 -0.14 -0.42 0.00 0.00 0.00 173.10 173.77 1k1d s ILE 55 N -2.58 1.52 -0.50 0.90 1.01 -0.53 -0.92 121.20 120.11 1k1d s ILE 55 Ca 0.62 -0.61 -0.14 0.00 0.00 0.00 0.00 60.65 60.52 1k1d s ILE 55 Cb -0.15 -1.43 0.11 0.00 0.01 0.00 0.00 42.46 40.99 1k1d s ILE 55 CO 0.41 0.45 0.42 -0.62 0.00 0.00 0.00 174.94 175.60 1k1d s ASP 56 N 1.44 6.05 0.00 3.58 -1.08 -0.10 -4.69 116.67 121.87 1k1d s ASP 56 Ca 0.04 -1.64 0.32 0.00 -0.52 0.00 0.00 52.55 50.74 1k1d s ASP 56 Cb -0.13 -2.15 1.84 0.00 -1.46 0.00 0.00 42.92 41.02 1k1d s ASP 56 CO -0.09 -0.74 2.20 -0.81 0.52 0.00 0.00 175.17 176.24 1k1d n PRO 57 N 5.15 0.93 -3.79 4.34 -0.04 -1.26 -0.98 135.00 139.35 1k1d n PRO 57 Ca -0.12 -0.02 -0.29 0.00 -0.04 0.00 0.00 63.50 63.03 1k1d n PRO 57 Cb 0.42 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.25 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 -2.08 2.68 0.02 0.54 2.46 -1.25 -4.66 115.29 113.00 1k1d s HIS 58 Ca 0.45 -2.90 0.07 0.00 0.47 0.00 0.00 55.06 53.15 1k1d s HIS 58 Cb 0.22 -2.25 -0.02 0.00 -0.13 0.00 0.00 32.58 30.40 1k1d s HIS 58 CO 0.38 -0.69 -0.20 0.99 -2.47 0.00 0.00 174.74 172.75 1k1d s THR 59 N -0.47 1.58 -0.40 0.89 2.01 -1.17 -0.90 115.64 117.19 1k1d s THR 59 Ca 0.22 -1.06 0.02 0.00 0.31 0.00 0.00 61.69 61.18 1k1d s THR 59 Cb -0.14 -1.36 0.15 0.00 0.01 0.00 0.00 72.50 71.16 1k1d s THR 59 CO -0.09 0.27 0.26 -1.00 -0.69 0.00 0.00 174.62 173.38 1k1d s HIS 60 N -0.68 1.13 0.00 4.92 3.76 -0.61 -1.53 115.29 122.27 1k1d s HIS 60 Ca 0.07 -2.01 0.00 0.00 -0.15 0.00 0.00 55.06 52.97 1k1d s HIS 60 Cb -0.08 -1.13 0.00 0.00 1.11 0.00 0.00 32.58 32.47 1k1d s HIS 60 CO 0.01 -0.81 0.00 1.28 -0.85 0.00 0.00 174.74 174.37 1k1d n LEU 61 N 3.54 1.94 -0.45 0.89 4.77 -1.26 -4.29 117.00 122.14 1k1d n LEU 61 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1k1d n LEU 61 Cb 0.40 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.50 1k1d n LEU 61 CO 0.14 0.00 0.32 -0.67 -1.33 0.00 0.00 177.39 175.86 1k1d n ASP 62 N -0.82 0.97 -4.77 -1.43 -0.08 -1.26 -4.41 116.55 104.75 1k1d n ASP 62 Ca 0.00 -2.03 -0.39 0.00 -1.51 0.00 0.00 54.79 50.86 1k1d n ASP 62 Cb 0.00 -0.40 -0.01 0.00 2.34 0.00 0.00 41.12 43.04 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 -1.26 4.10 -0.33 -0.67 0.23 -1.26 -4.75 119.30 115.36 1k1d s MET 63 Ca 0.02 2.06 -0.11 0.00 -1.03 0.00 0.00 55.69 56.63 1k1d s MET 63 Cb 0.01 -2.82 -0.01 0.00 -1.53 0.00 0.00 34.83 30.49 1k1d s MET 63 CO 0.01 -0.35 0.19 -2.14 -2.03 0.00 0.00 175.02 170.70 1k1d s PRO 64 N -2.13 3.32 -0.73 3.16 0.02 -1.26 -1.53 135.00 135.86 1k1d s PRO 64 Ca 0.55 -0.74 0.04 0.00 0.02 0.00 0.00 61.00 60.86 1k1d s PRO 64 Cb -0.36 -3.68 0.23 0.00 0.02 0.00 0.00 34.50 30.71 1k1d s PRO 64 CO 0.46 -0.47 0.77 -0.11 -0.33 0.00 0.00 177.00 177.33 1k1d n LEU 65 N 5.03 3.92 0.00 -5.54 7.94 -0.90 -4.96 117.00 122.49 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 0.49 -0.79 0.00 0.00 0.53 0.00 0.00 43.42 43.64 1k1d n LEU 65 CO 0.35 1.90 0.00 0.61 -1.11 0.00 0.00 177.39 179.15 1k1d n GLY 66 N 1.29 0.50 0.00 -3.96 0.00 -1.26 -4.55 105.19 97.21 1k1d n GLY 66 Ca 0.26 -1.96 0.15 0.00 0.00 0.00 0.00 46.02 44.48 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 -1.07 3.76 -0.02 0.00 -1.26 -4.79 105.19 101.81 1k1d n GLY 67 Ca 0.00 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.19 2.01 0.09 2.61 -1.32 -1.26 -5.16 115.64 110.41 1k1d s THR 68 Ca 0.40 -1.73 0.04 0.00 -1.21 0.00 0.00 61.69 59.19 1k1d s THR 68 Cb 0.21 -2.74 -0.03 0.00 -1.51 0.00 0.00 72.50 68.43 1k1d s THR 68 CO 0.39 0.00 -0.10 -0.69 -2.21 0.00 0.00 174.62 172.01 1k1d s VAL 69 N -2.68 0.88 0.16 5.08 1.01 -1.26 -2.11 120.40 121.48 1k1d s VAL 69 Ca 0.34 -1.53 -0.33 0.00 0.00 0.00 0.00 61.98 60.47 1k1d s VAL 69 Cb 0.03 -1.22 -0.16 0.00 0.00 0.00 0.00 36.38 35.02 1k1d s VAL 69 CO 0.19 -0.51 1.05 0.41 0.00 0.00 0.00 175.10 176.24 1k1d n THR 70 N 0.75 1.00 -0.15 3.92 -1.04 -0.58 -4.85 114.28 113.33 1k1d n THR 70 Ca -0.17 -0.25 -0.01 0.00 -2.04 0.00 0.00 64.05 61.57 1k1d n THR 70 Cb 0.57 -0.61 0.23 0.00 -1.82 0.00 0.00 70.33 68.70 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 2.88 0.86 -5.56 -2.82 1.63 -1.38 -3.40 116.57 108.79 1k1d h LYS 71 Ca -0.42 -0.12 -0.60 0.00 -0.85 0.00 0.00 60.65 58.67 1k1d h LYS 71 Cb 1.37 -0.16 -0.10 0.00 -0.60 0.00 0.00 32.23 32.74 1k1d h LYS 71 CO 0.67 0.68 -0.07 -0.51 -3.45 0.00 0.00 179.45 176.77 1k1d s ASP 72 N -6.51 6.57 0.35 4.20 1.01 -1.26 -4.83 116.67 116.21 1k1d s ASP 72 Ca -0.10 0.68 0.04 0.00 0.71 0.00 0.00 52.55 53.88 1k1d s ASP 72 Cb 0.16 -2.29 0.05 0.00 1.01 0.00 0.00 42.92 41.86 1k1d s ASP 72 CO 0.79 -0.15 0.42 -0.90 0.21 0.00 0.00 175.17 175.54 1k1d n ASP 73 N 4.60 0.96 0.33 0.27 5.75 -1.26 -4.20 116.55 123.00 1k1d n ASP 73 Ca -0.05 -1.72 0.21 0.00 -0.01 0.00 0.00 54.79 53.22 1k1d n ASP 73 Cb 0.51 -0.24 1.12 0.00 -1.03 0.00 0.00 41.12 41.48 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 -0.08 0.00 0.00 2.11 -1.00 -1.85 -1.14 116.94 114.97 1k1d h PHE 74 Ca -0.14 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.63 1k1d h PHE 74 Cb 0.62 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.18 1k1d h PHE 74 CO 0.00 0.00 -0.09 1.49 -1.61 0.00 0.00 178.31 178.11 1k1d h GLU 75 N 0.00 0.00 -0.18 1.51 4.81 -1.88 -3.04 114.58 115.80 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 0.08 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1k1d h GLU 75 CO 0.00 0.24 0.11 0.66 -0.73 0.00 0.00 179.01 179.29 1k1d h SER 76 N -1.00 0.22 -0.98 1.04 4.64 -1.86 -2.47 113.55 113.14 1k1d h SER 76 Ca -0.01 -0.04 0.10 0.00 -0.47 0.00 0.00 61.79 61.37 1k1d h SER 76 Cb 0.29 -0.05 -0.07 0.00 -0.31 0.00 0.00 62.40 62.25 1k1d h SER 76 CO -0.01 0.19 0.63 1.23 -0.87 0.00 0.00 176.83 178.00 1k1d h GLY 77 N 0.22 1.52 0.89 -0.77 0.00 -1.38 0.11 103.07 103.66 1k1d h GLY 77 Ca 0.07 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 1k1d h GLY 77 CO -0.01 0.23 0.08 -0.84 0.00 0.00 0.00 176.54 176.00 1k1d h THR 78 N 1.02 1.17 -0.27 4.70 2.02 -1.36 -0.83 112.91 119.37 1k1d h THR 78 Ca 0.46 -0.52 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 1k1d h THR 78 Cb 0.37 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 1k1d h THR 78 CO -0.21 0.17 0.15 0.40 0.37 0.00 0.00 175.52 176.39 1k1d h ILE 79 N 0.19 1.12 0.25 3.11 2.04 -0.91 0.58 117.51 123.89 1k1d h ILE 79 Ca 0.07 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.63 1k1d h ILE 79 Cb 0.19 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1k1d h ILE 79 CO -0.01 0.12 -0.52 0.00 0.00 0.00 0.00 178.15 177.75 1k1d h ALA 80 N 1.03 -1.03 -0.98 1.87 0.00 -0.61 0.25 119.26 119.78 1k1d h ALA 80 Ca 0.09 -0.14 0.17 0.00 0.00 0.00 0.00 54.91 55.04 1k1d h ALA 80 Cb 0.06 0.83 -0.09 0.00 0.00 0.00 0.00 17.79 18.58 1k1d h ALA 80 CO -0.02 -1.14 0.61 0.00 0.00 0.00 0.00 179.25 178.71 1k1d h ALA 81 N -0.62 1.73 -0.45 0.00 0.00 -1.02 -0.15 119.26 118.76 1k1d h ALA 81 Ca -0.02 0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1k1d h ALA 81 Cb 0.80 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1k1d h ALA 81 CO -0.21 -0.05 0.24 0.00 0.00 0.00 0.00 179.25 179.23 1k1d h ALA 82 N 1.61 0.56 -0.33 0.00 0.00 0.96 0.95 119.26 123.01 1k1d h ALA 82 Ca 0.54 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.37 1k1d h ALA 82 Cb 0.83 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1k1d h ALA 82 CO -0.31 -0.10 -0.15 0.74 0.00 0.00 0.00 179.25 179.43 1k1d h PHE 83 N 0.48 0.65 0.00 0.00 -1.00 0.63 -2.70 116.94 115.00 1k1d h PHE 83 Ca 0.19 -0.12 0.00 0.00 2.81 0.00 0.00 57.97 60.85 1k1d h PHE 83 Cb 0.06 -0.17 0.00 0.00 3.61 0.00 0.00 35.95 39.45 1k1d h PHE 83 CO -0.09 0.72 0.00 0.41 -1.61 0.00 0.00 178.31 177.74 1k1d n GLY 84 N -0.50 -0.69 0.85 -1.45 0.00 -0.24 -4.63 105.19 98.54 1k1d n GLY 84 Ca 0.01 -0.12 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 0.78 3.66 -0.02 0.00 -0.91 -4.31 105.19 104.65 1k1d n GLY 85 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.15 5.21 -0.76 2.61 2.01 0.22 -0.70 115.64 122.08 1k1d s THR 86 Ca 0.00 0.12 0.07 0.00 0.31 0.00 0.00 61.69 62.19 1k1d s THR 86 Cb 0.00 -3.40 0.09 0.00 0.01 0.00 0.00 72.50 69.20 1k1d s THR 86 CO 0.00 0.40 0.83 0.35 -0.69 0.00 0.00 174.62 175.50 1k1d n THR 87 N 3.94 0.26 -3.69 -0.82 -2.24 -0.09 -3.11 114.28 108.53 1k1d n THR 87 Ca -0.16 -0.63 -0.10 0.00 -2.27 0.00 0.00 64.05 60.89 1k1d n THR 87 Cb 0.52 0.97 -0.11 0.00 -2.10 0.00 0.00 70.33 69.61 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 -0.67 -0.06 0.17 4.28 2.01 -1.09 -2.96 115.64 117.31 1k1d s THR 88 Ca 0.09 0.10 0.08 0.00 0.31 0.00 0.00 61.69 62.28 1k1d s THR 88 Cb 0.06 -0.61 -0.04 0.00 0.01 0.00 0.00 72.50 71.92 1k1d s THR 88 CO 0.09 0.04 -0.18 0.27 -0.69 0.00 0.00 174.62 174.15 1k1d s ILE 89 N 1.48 1.79 -0.31 1.82 -4.36 -0.93 -0.92 121.20 119.76 1k1d s ILE 89 Ca -0.09 -1.93 0.01 0.00 -0.26 0.00 0.00 60.65 58.37 1k1d s ILE 89 Cb -0.09 -1.84 0.10 0.00 1.25 0.00 0.00 42.46 41.88 1k1d s ILE 89 CO -0.13 -0.34 0.08 -0.63 0.24 0.00 0.00 174.94 174.16 1k1d s ILE 90 N -2.12 1.27 0.37 8.37 1.01 -0.16 -0.99 121.20 128.96 1k1d s ILE 90 Ca 0.16 -1.63 -0.14 0.00 0.00 0.00 0.00 60.65 59.05 1k1d s ILE 90 Cb -0.05 -1.93 -0.08 0.00 0.01 0.00 0.00 42.46 40.41 1k1d s ILE 90 CO 0.06 -0.62 0.78 -0.62 0.00 0.00 0.00 174.94 174.54 1k1d s ASP 91 N 1.42 6.67 -0.56 3.58 -1.08 -0.73 -3.04 116.67 122.93 1k1d s ASP 91 Ca 0.09 1.27 -0.22 0.00 -0.52 0.00 0.00 52.55 53.16 1k1d s ASP 91 Cb -0.18 -2.37 0.05 0.00 -1.46 0.00 0.00 42.92 38.96 1k1d s ASP 91 CO -0.19 -0.32 0.86 -0.36 0.52 0.00 0.00 175.17 175.68 1k1d s PHE 92 N -2.19 2.83 -0.47 -5.34 0.40 -0.58 -0.95 117.98 111.68 1k1d s PHE 92 Ca 0.54 -0.28 -0.29 0.00 -0.60 0.00 0.00 56.93 56.30 1k1d s PHE 92 Cb -0.10 -3.99 0.01 0.00 0.51 0.00 0.00 43.02 39.46 1k1d s PHE 92 CO 0.24 -1.34 1.36 0.00 0.70 0.00 0.00 175.22 176.18 1k1d s LEU 94 N 5.45 3.64 0.07 0.00 1.43 -1.26 -1.29 118.68 126.71 1k1d s LEU 94 Ca 0.56 1.98 0.06 0.00 -1.03 0.00 0.00 54.13 55.71 1k1d s LEU 94 Cb -0.11 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 41.52 1k1d s LEU 94 CO 0.30 -1.17 -0.17 -0.89 0.23 0.00 0.00 176.35 174.64 1k1d s THR 95 N -2.11 1.39 0.01 5.49 2.01 -1.26 -4.81 115.64 116.36 1k1d s THR 95 Ca 0.68 -1.29 0.04 0.00 0.31 0.00 0.00 61.69 61.43 1k1d s THR 95 Cb -0.19 -1.27 -0.03 0.00 0.01 0.00 0.00 72.50 71.01 1k1d s THR 95 CO 0.31 -0.04 -0.11 0.20 -0.69 0.00 0.00 174.62 174.28 1k1d s ASN 96 N -1.55 4.32 0.57 3.53 0.01 -1.26 -4.84 114.94 115.72 1k1d s ASN 96 Ca 0.03 -0.23 -0.20 0.00 -0.71 0.00 0.00 52.86 51.75 1k1d s ASN 96 Cb -0.09 -0.92 -0.04 0.00 0.41 0.00 0.00 41.25 40.61 1k1d s ASN 96 CO 0.03 0.28 1.25 -0.54 -1.51 0.00 0.00 177.10 176.61 1k1d s LYS 97 N -1.36 3.04 0.00 -0.60 1.02 -1.26 -2.92 119.74 117.66 1k1d s LYS 97 Ca 0.16 1.95 0.00 0.00 0.02 0.00 0.00 55.97 58.09 1k1d s LYS 97 Cb -0.11 -2.04 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 1k1d s LYS 97 CO 0.06 -1.18 0.00 0.41 -0.92 0.00 0.00 175.35 173.72 1k1d n GLY 98 N 0.61 1.72 3.73 -3.33 0.00 -1.26 -4.93 105.19 101.72 1k1d n GLY 98 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 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 4.50 0.20 1.61 2.12 -1.15 -5.01 118.70 120.96 1k1d s GLU 99 Ca 0.00 1.09 -0.33 0.00 0.36 0.00 0.00 54.97 56.09 1k1d s GLU 99 Cb 0.00 -3.42 -0.13 0.00 0.26 0.00 0.00 34.13 30.84 1k1d s GLU 99 CO 0.00 0.12 1.59 -0.35 -0.54 0.00 0.00 175.26 176.08 1k1d n PRO 100 N 3.42 2.36 -0.29 4.30 -0.04 -1.26 -4.72 135.00 138.77 1k1d n PRO 100 Ca 0.00 0.85 0.16 0.00 -0.04 0.00 0.00 63.50 64.47 1k1d n PRO 100 Cb 0.51 -2.62 0.42 0.00 -0.04 0.00 0.00 33.50 31.77 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 5.75 0.58 -0.77 1.53 3.38 -1.95 -0.06 115.31 123.78 1k1d h LEU 101 Ca -0.45 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1k1d h LEU 101 Cb 1.24 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1k1d h LEU 101 CO 0.88 0.24 0.00 0.29 0.09 0.00 0.00 178.44 179.93 1k1d n LYS 102 N -4.60 0.20 0.31 1.13 5.02 -1.26 -1.87 118.16 117.09 1k1d n LYS 102 Ca 0.20 0.44 -0.13 0.00 -2.02 0.00 0.00 58.31 56.80 1k1d n LYS 102 Cb 0.62 -1.90 -0.06 0.00 -0.02 0.00 0.00 35.03 33.67 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 -0.79 -0.40 1.97 1.63 -1.37 -2.69 116.57 114.92 1k1d h LYS 103 Ca 0.00 0.05 0.05 0.00 -0.85 0.00 0.00 60.65 59.91 1k1d h LYS 103 Cb 0.35 0.18 -0.05 0.00 -0.60 0.00 0.00 32.23 32.12 1k1d h LYS 103 CO 0.00 -0.51 0.13 0.00 -3.45 0.00 0.00 179.45 175.62 1k1d h ALA 104 N -1.14 0.47 -0.92 5.00 0.00 -1.56 -1.78 119.26 119.34 1k1d h ALA 104 Ca -0.08 0.06 0.16 0.00 0.00 0.00 0.00 54.91 55.04 1k1d h ALA 104 Cb 0.65 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.41 1k1d h ALA 104 CO 0.14 -0.27 0.59 0.82 0.00 0.00 0.00 179.25 180.53 1k1d h ILE 105 N 0.28 0.79 0.05 0.00 2.04 -1.41 0.47 117.51 119.72 1k1d h ILE 105 Ca 0.19 -0.23 -0.23 0.00 1.00 0.00 0.00 64.86 65.59 1k1d h ILE 105 Cb 0.19 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 1k1d h ILE 105 CO -0.20 0.12 -1.03 -0.33 0.00 0.00 0.00 178.15 176.71 1k1d h GLU 106 N 0.67 0.21 -0.54 2.37 5.08 -1.05 -1.40 114.58 119.91 1k1d h GLU 106 Ca 0.47 -0.29 0.04 0.00 -1.00 0.00 0.00 59.36 58.59 1k1d h GLU 106 Cb 0.82 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 30.12 1k1d h GLU 106 CO -0.23 1.07 0.30 1.15 -1.00 0.00 0.00 179.01 180.30 1k1d h THR 107 N 0.09 0.99 -0.23 1.13 2.02 -0.19 -0.48 112.91 116.23 1k1d h THR 107 Ca -0.07 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 66.87 1k1d h THR 107 Cb 1.72 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 68.48 1k1d h THR 107 CO 0.16 0.10 -0.02 -0.50 0.37 0.00 0.00 175.52 175.64 1k1d h TRP 108 N 0.57 0.47 -0.76 3.16 6.55 -0.94 -1.95 115.95 123.06 1k1d h TRP 108 Ca 0.23 -0.09 0.18 0.00 0.95 0.00 0.00 58.89 60.16 1k1d h TRP 108 Cb 0.11 -0.12 -0.05 0.00 -0.86 0.00 0.00 29.16 28.25 1k1d h TRP 108 CO -0.09 0.62 0.52 0.45 -1.05 0.00 0.00 178.44 178.89 1k1d h HIS 109 N 0.18 0.32 -0.17 0.49 3.86 -0.69 0.33 115.15 119.48 1k1d h HIS 109 Ca 0.06 0.01 -0.10 0.00 -1.16 0.00 0.00 60.37 59.19 1k1d h HIS 109 Cb 0.45 -0.10 -0.00 0.00 1.06 0.00 0.00 27.41 28.82 1k1d h HIS 109 CO 0.04 0.11 -0.28 -0.91 0.86 0.00 0.00 177.93 177.75 1k1d h ASN 110 N 0.26 0.53 -0.92 2.45 2.35 -0.63 0.35 115.58 119.97 1k1d h ASN 110 Ca 0.37 -0.53 0.12 0.00 -0.55 0.00 0.00 56.30 55.71 1k1d h ASN 110 Cb 1.07 -0.15 -0.09 0.00 0.05 0.00 0.00 38.32 39.21 1k1d h ASN 110 CO -0.09 0.96 0.55 0.11 -1.65 0.00 0.00 177.43 177.31 1k1d h LYS 111 N 0.12 0.82 0.13 0.81 1.57 -0.22 -3.00 116.57 116.80 1k1d h LYS 111 Ca 0.01 -0.05 -0.24 0.00 -1.87 0.00 0.00 60.65 58.50 1k1d h LYS 111 Cb 0.86 -0.19 0.01 0.00 0.08 0.00 0.00 32.23 32.99 1k1d h LYS 111 CO 0.06 0.54 -1.20 0.00 -0.57 0.00 0.00 179.45 178.29 1k1d h ALA 112 N 1.53 0.07 -0.45 3.86 0.00 -1.21 -3.41 119.26 119.64 1k1d h ALA 112 Ca 0.47 -0.94 -0.47 0.00 0.00 0.00 0.00 54.91 53.97 1k1d h ALA 112 Cb 0.52 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1k1d h ALA 112 CO -0.29 0.66 0.44 0.09 0.00 0.00 0.00 179.25 180.15 1k1d n ASN 113 N -4.00 0.62 0.00 0.00 3.02 0.12 -0.95 115.26 114.07 1k1d n ASN 113 Ca -0.21 0.60 0.00 0.00 -0.03 0.00 0.00 54.58 54.94 1k1d n ASN 113 Cb 0.88 -0.48 0.00 0.00 -0.61 0.00 0.00 39.78 39.56 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 2.55 0.10 0.00 7.41 0.00 -1.26 -4.76 105.19 109.23 1k1d n GLY 114 Ca 0.19 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.42 1.54 -2.35 1.61 5.02 -0.13 -2.13 118.16 121.31 1k1d n LYS 115 Ca 0.00 -0.04 -0.41 0.00 -2.02 0.00 0.00 58.31 55.84 1k1d n LYS 115 Cb 0.28 -1.04 -0.03 0.00 -0.02 0.00 0.00 35.03 34.21 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 -2.18 3.45 -0.14 7.82 0.00 -1.16 -4.03 121.76 125.52 1k1d s ALA 116 Ca -0.01 0.97 0.19 0.00 0.00 0.00 0.00 51.96 53.11 1k1d s ALA 116 Cb 0.04 -3.44 -0.15 0.00 0.00 0.00 0.00 23.12 19.57 1k1d s ALA 116 CO 0.25 -0.42 0.73 0.28 0.00 0.00 0.00 175.76 176.60 1k1d n VAL 117 N 2.85 0.89 -4.49 0.00 0.31 -1.26 0.36 118.33 116.99 1k1d n VAL 117 Ca 0.06 -0.65 -0.24 0.00 -0.01 0.00 0.00 64.34 63.50 1k1d n VAL 117 Cb 0.44 -0.50 -0.09 0.00 -0.91 0.00 0.00 33.84 32.78 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 -3.07 0.91 0.74 2.52 -4.36 -1.26 -3.69 121.20 112.98 1k1d s ILE 118 Ca -0.04 -2.00 -0.11 0.00 -0.26 0.00 0.00 60.65 58.24 1k1d s ILE 118 Cb 0.09 -2.56 0.03 0.00 1.25 0.00 0.00 42.46 41.28 1k1d s ILE 118 CO 0.83 0.00 1.07 -1.81 0.24 0.00 0.00 174.94 175.27 1k1d s ASP 119 N -3.56 4.96 0.23 4.36 1.01 -1.16 -4.02 116.67 118.51 1k1d s ASP 119 Ca 0.29 1.65 -0.19 0.00 0.71 0.00 0.00 52.55 55.01 1k1d s ASP 119 Cb 0.06 -2.46 0.03 0.00 1.01 0.00 0.00 42.92 41.56 1k1d s ASP 119 CO 0.14 -1.72 0.61 -0.72 0.21 0.00 0.00 175.17 173.70 1k1d s TYR 120 N -3.01 -0.15 0.21 4.23 1.13 -1.02 -2.18 117.35 116.57 1k1d s TYR 120 Ca 0.59 -0.22 0.00 0.00 -1.41 0.00 0.00 57.07 56.04 1k1d s TYR 120 Cb -0.15 0.52 -0.00 0.00 -1.10 0.00 0.00 41.96 41.23 1k1d s TYR 120 CO 0.55 -1.05 0.27 0.41 -2.51 0.00 0.00 175.55 173.22 1k1d n GLY 121 N -0.40 2.72 3.21 5.49 0.00 -0.16 0.46 105.19 116.52 1k1d n GLY 121 Ca -0.08 -1.60 -0.12 0.00 0.00 0.00 0.00 46.02 44.22 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 -3.48 1.09 0.00 1.61 0.08 -1.26 -1.78 117.98 114.25 1k1d s PHE 122 Ca 0.20 -0.90 0.07 0.00 0.12 0.00 0.00 56.93 56.41 1k1d s PHE 122 Cb -0.00 -0.61 -0.03 0.00 -0.57 0.00 0.00 43.02 41.82 1k1d s PHE 122 CO 0.14 -0.10 -0.20 -1.01 -0.10 0.00 0.00 175.22 173.95 1k1d s HIS 123 N -3.55 2.50 -0.23 0.36 3.76 -0.13 -4.68 115.29 113.33 1k1d s HIS 123 Ca 0.17 -0.30 -0.09 0.00 -0.15 0.00 0.00 55.06 54.69 1k1d s HIS 123 Cb 0.05 -1.50 -0.04 0.00 1.11 0.00 0.00 32.58 32.19 1k1d s HIS 123 CO -0.01 0.14 0.11 -1.17 -0.85 0.00 0.00 174.74 172.96 1k1d s LEU 124 N -1.02 3.81 0.42 0.89 2.96 -0.88 -0.20 118.68 124.66 1k1d s LEU 124 Ca 0.12 -0.00 -0.23 0.00 -0.22 0.00 0.00 54.13 53.80 1k1d s LEU 124 Cb -0.10 -2.01 -0.09 0.00 0.50 0.00 0.00 46.19 44.49 1k1d s LEU 124 CO 0.02 0.06 1.02 -0.32 -1.32 0.00 0.00 176.35 175.81 1k1d s MET 125 N 1.07 4.11 -0.09 1.98 -2.45 -0.42 -4.36 119.30 119.15 1k1d s MET 125 Ca 0.05 1.40 -0.01 0.00 -1.25 0.00 0.00 55.69 55.88 1k1d s MET 125 Cb -0.14 -2.39 0.03 0.00 1.25 0.00 0.00 34.83 33.58 1k1d s MET 125 CO 0.04 -0.17 -0.01 0.42 1.05 0.00 0.00 175.02 176.35 1k1d s ILE 126 N -1.82 0.52 -0.58 10.11 1.01 -1.26 -4.47 121.20 124.72 1k1d s ILE 126 Ca 0.60 0.01 0.08 0.00 0.00 0.00 0.00 60.65 61.34 1k1d s ILE 126 Cb -0.18 -0.66 -0.05 0.00 0.01 0.00 0.00 42.46 41.57 1k1d s ILE 126 CO 0.23 0.26 0.46 -1.54 0.00 0.00 0.00 174.94 174.35 1k1d n SER 127 N 5.10 0.73 -3.57 3.58 3.41 -1.26 -4.61 113.62 117.00 1k1d n SER 127 Ca -0.08 -0.86 -0.12 0.00 -0.26 0.00 0.00 58.87 57.55 1k1d n SER 127 Cb 0.50 0.75 -0.05 0.00 -0.26 0.00 0.00 64.21 65.15 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 -1.53 0.66 -0.43 4.33 -1.05 -1.26 -4.78 118.70 114.65 1k1d s GLU 128 Ca 0.05 0.17 -0.05 0.00 -0.15 0.00 0.00 54.97 54.99 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 0.28 -0.20 0.25 0.96 0.95 0.00 0.00 175.26 177.50 1k1d s ILE 129 N -1.10 3.56 0.30 1.83 -4.36 -1.26 -4.95 121.20 115.21 1k1d s ILE 129 Ca -0.03 -1.99 0.07 0.00 -0.26 0.00 0.00 60.65 58.44 1k1d s ILE 129 Cb -0.00 -3.41 -0.03 0.00 1.25 0.00 0.00 42.46 40.27 1k1d s ILE 129 CO 0.03 -0.72 0.28 -0.89 0.24 0.00 0.00 174.94 173.88 1k1d s THR 130 N 1.19 4.08 0.37 8.37 2.01 -1.26 -4.96 115.64 125.45 1k1d s THR 130 Ca 0.08 -1.31 0.04 0.00 0.31 0.00 0.00 61.69 60.80 1k1d s THR 130 Cb -0.24 -3.35 0.25 0.00 0.01 0.00 0.00 72.50 69.18 1k1d s THR 130 CO -0.03 -0.25 2.01 0.44 -0.69 0.00 0.00 174.62 176.10 1k1d h ASP 131 N 1.30 0.62 -0.67 3.53 3.32 -1.98 0.21 116.42 122.76 1k1d h ASP 131 Ca -0.47 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 56.48 1k1d h ASP 131 Cb 1.25 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.61 1k1d h ASP 131 CO 0.59 0.47 0.14 0.44 -1.72 0.00 0.00 179.24 179.17 1k1d h ASP 132 N 0.73 1.04 -0.11 6.45 3.32 -2.00 -1.94 116.42 123.91 1k1d h ASP 132 Ca 0.19 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 1k1d h ASP 132 Cb -0.04 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.23 1k1d h ASP 132 CO -0.04 1.01 0.01 0.58 -1.72 0.00 0.00 179.24 179.08 1k1d h VAL 133 N 1.03 1.23 -0.31 -1.35 2.07 -1.38 -2.37 116.25 115.18 1k1d h VAL 133 Ca 0.21 -0.73 0.09 0.00 0.82 0.00 0.00 66.70 67.09 1k1d h VAL 133 Cb 0.39 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 1k1d h VAL 133 CO 0.01 0.21 0.25 -0.07 0.02 0.00 0.00 177.57 177.98 1k1d h LEU 134 N -0.06 0.00 -0.04 2.57 3.38 -0.41 -0.94 115.31 119.81 1k1d h LEU 134 Ca 0.03 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.75 1k1d h LEU 134 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1k1d h LEU 134 CO 0.00 0.00 -1.09 -0.33 0.09 0.00 0.00 178.44 177.12 1k1d h GLU 135 N 0.00 0.34 0.02 1.13 5.08 -1.01 -3.36 114.58 116.79 1k1d h GLU 135 Ca 0.15 -0.45 -0.14 0.00 -1.00 0.00 0.00 59.36 57.92 1k1d h GLU 135 Cb 0.64 0.15 0.01 0.00 0.50 0.00 0.00 28.75 30.05 1k1d h GLU 135 CO -0.00 1.16 -0.55 0.93 -1.00 0.00 0.00 179.01 179.55 1k1d h GLU 136 N 0.15 0.33 -0.85 2.33 5.08 -0.73 -3.38 114.58 117.52 1k1d h GLU 136 Ca -0.11 -0.39 0.09 0.00 -1.00 0.00 0.00 59.36 57.96 1k1d h GLU 136 Cb 1.76 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 31.02 1k1d h GLU 136 CO 0.18 1.09 -0.44 1.28 -1.00 0.00 0.00 179.01 180.12 1k1d n LEU 137 N -4.27 -0.78 -0.26 1.33 4.77 -0.47 0.80 117.00 118.11 1k1d n LEU 137 Ca -0.11 1.49 0.12 0.00 -0.03 0.00 0.00 56.01 57.49 1k1d n LEU 137 Cb 0.66 -0.24 0.38 0.00 -2.33 0.00 0.00 43.42 41.89 1k1d n LEU 137 CO 0.45 -1.26 1.22 1.55 -1.33 0.00 0.00 177.39 178.02 1k1d h PRO 138 N 0.00 0.66 -0.20 3.23 0.13 -1.75 0.11 132.00 134.18 1k1d h PRO 138 Ca 0.19 -0.04 -0.18 0.00 -0.87 0.00 0.00 66.00 65.10 1k1d h PRO 138 Cb 0.40 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 31.39 1k1d h PRO 138 CO -0.81 0.44 -0.59 0.87 -0.23 0.00 0.00 178.00 177.68 1k1d h LYS 139 N 0.68 0.75 -0.11 0.86 1.57 0.21 -2.67 116.57 117.86 1k1d h LYS 139 Ca 0.45 -0.54 0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1k1d h LYS 139 Cb 0.73 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.12 1k1d h LYS 139 CO -0.20 1.16 0.13 0.28 -0.57 0.00 0.00 179.45 180.25 1k1d h VAL 140 N 0.48 0.47 0.00 0.50 2.07 0.26 0.16 116.25 120.18 1k1d h VAL 140 Ca -0.02 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 1k1d h VAL 140 Cb 1.21 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1k1d h VAL 140 CO 0.13 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 0.68 2.57 3.38 -0.77 -3.09 115.31 118.08 1k1d h LEU 141 Ca 0.05 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.59 1k1d h LEU 141 Cb 0.31 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.06 1k1d h LEU 141 CO -0.00 0.70 -0.33 -0.33 0.09 0.00 0.00 178.44 178.58 1k1d h GLU 142 N -1.00 -0.88 -5.51 1.13 3.07 -1.15 -3.38 114.58 106.86 1k1d h GLU 142 Ca -0.00 0.06 -0.61 0.00 -0.50 0.00 0.00 59.36 58.31 1k1d h GLU 142 Cb 0.40 0.20 -0.11 0.00 -0.84 0.00 0.00 28.75 28.40 1k1d h GLU 142 CO -0.00 -0.57 0.12 -2.00 -1.40 0.00 0.00 179.01 175.16 1k1d s GLU 143 N -4.76 4.13 0.00 2.33 2.56 0.51 -4.58 118.70 118.89 1k1d s GLU 143 Ca -0.14 0.52 0.00 0.00 0.00 0.00 0.00 54.97 55.35 1k1d s GLU 143 Cb 0.02 -3.63 0.00 0.00 2.00 0.00 0.00 34.13 32.51 1k1d s GLU 143 CO 0.45 -0.36 0.00 -1.91 -0.56 0.00 0.00 175.26 172.88 1k1d n GLU 144 N 5.52 0.00 -0.59 4.30 4.07 -1.26 -4.04 120.64 128.64 1k1d n GLU 144 Ca -0.01 0.38 -0.06 0.00 -0.06 0.00 0.00 57.16 57.40 1k1d n GLU 144 Cb 0.49 -0.38 -0.09 0.00 -0.06 0.00 0.00 31.44 31.40 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 0.74 2.21 3.45 8.31 0.00 -1.26 -4.03 105.19 114.61 1k1d n GLY 145 Ca 0.00 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 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 1.53 4.47 -0.38 -0.61 -1.09 -1.17 -0.68 121.20 123.27 1k1d s ILE 146 Ca 0.36 -0.80 0.15 0.00 -2.23 0.00 0.00 60.65 58.13 1k1d s ILE 146 Cb 0.17 -4.71 0.44 0.00 -1.58 0.00 0.00 42.46 36.78 1k1d s ILE 146 CO 0.00 -1.46 1.35 0.35 -1.23 0.00 0.00 174.94 173.94 1k1d n THR 147 N 5.79 1.86 -3.72 2.92 -2.24 -1.26 -4.20 114.28 113.43 1k1d n THR 147 Ca 0.05 -1.63 -0.29 0.00 -2.27 0.00 0.00 64.05 59.92 1k1d n THR 147 Cb 0.46 -0.02 -0.16 0.00 -2.10 0.00 0.00 70.33 68.52 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 -1.69 3.35 0.73 3.42 1.04 -1.26 -1.26 113.70 118.02 1k1d s SER 148 Ca 0.35 -1.13 -0.05 0.00 0.48 0.00 0.00 55.95 55.60 1k1d s SER 148 Cb 0.27 -0.68 0.11 0.00 0.10 0.00 0.00 66.02 65.81 1k1d s SER 148 CO 0.10 -0.35 1.02 -0.76 0.98 0.00 0.00 173.24 174.23 1k1d s LEU 149 N 1.79 2.93 0.00 2.42 1.43 -0.87 -2.08 118.68 124.30 1k1d s LEU 149 Ca 0.03 0.03 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 1k1d s LEU 149 Cb -0.17 -2.49 0.00 0.00 0.03 0.00 0.00 46.19 43.56 1k1d s LEU 149 CO -0.16 -1.82 0.00 0.52 0.23 0.00 0.00 176.35 175.12 1k1d n VAL 151 N -2.94 0.00 -3.29 -1.59 0.31 0.65 -1.20 118.33 110.27 1k1d n VAL 151 Ca 0.12 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 64.06 1k1d n VAL 151 Cb 0.60 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.46 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 0.00 3.34 -0.83 3.52 0.40 -1.26 -1.30 117.98 121.86 1k1d s PHE 152 Ca 0.00 0.69 0.24 0.00 -0.60 0.00 0.00 56.93 57.25 1k1d s PHE 152 Cb 0.00 -2.64 0.29 0.00 0.51 0.00 0.00 43.02 41.18 1k1d s PHE 152 CO 0.00 -0.13 1.25 -1.33 0.70 0.00 0.00 175.22 175.72 1k1d n MET 153 N 4.90 0.13 -1.65 0.44 2.81 -0.66 -1.76 117.12 121.33 1k1d n MET 153 Ca -0.06 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 55.85 1k1d n MET 153 Cb 0.50 -1.56 0.00 0.00 -0.71 0.00 0.00 33.22 31.45 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 -1.65 0.00 -2.92 3.04 0.00 -1.10 -2.39 120.51 115.49 1k1d n ALA 154 Ca 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.37 1k1d n ALA 154 Cb 0.38 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.89 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 -0.07 -1.56 -1.51 0.00 4.01 -1.26 -2.72 117.16 114.04 1k1d n TYR 155 Ca 0.00 0.64 -0.43 0.00 -0.16 0.00 0.00 57.90 57.94 1k1d n TYR 155 Cb 0.00 -4.01 -0.00 0.00 -0.31 0.00 0.00 39.34 35.02 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 -3.05 0.85 -2.23 -0.72 4.81 -1.26 -1.49 118.16 115.07 1k1d n LYS 156 Ca -0.16 0.30 -0.16 0.00 -0.87 0.00 0.00 58.31 57.42 1k1d n LYS 156 Cb 0.61 -1.62 -0.02 0.00 0.02 0.00 0.00 35.03 34.02 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 1.24 -4.68 0.00 3.14 3.02 -1.26 -4.67 115.26 112.05 1k1d n ASN 157 Ca 0.11 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 1k1d n ASN 157 Cb 0.35 -3.99 0.00 0.00 -0.61 0.00 0.00 39.78 35.53 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 -3.35 0.00 0.00 2.41 0.31 -0.55 -4.99 118.33 112.16 1k1d n VAL 158 Ca -0.19 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 1k1d n VAL 158 Cb 0.62 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.55 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 -1.24 0.00 -1.38 3.52 3.01 -0.66 -5.12 117.46 115.59 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 0.01 0.00 -0.01 0.00 0.00 39.48 39.48 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 -0.38 0.31 -3.90 -1.08 7.27 -1.06 -4.35 117.38 114.18 1k1d n GLN 160 Ca 0.00 0.11 -0.11 0.00 0.07 0.00 0.00 57.00 57.07 1k1d n GLN 160 Cb 0.00 -1.33 -0.13 0.00 2.41 0.00 0.00 30.24 31.19 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 -1.70 0.02 0.82 1.69 0.00 -0.72 -4.86 121.76 117.02 1k1d s ALA 161 Ca 0.62 -0.18 -0.11 0.00 0.00 0.00 0.00 51.96 52.29 1k1d s ALA 161 Cb -0.55 0.04 0.08 0.00 0.00 0.00 0.00 23.12 22.70 1k1d s ALA 161 CO 0.60 -0.06 1.09 0.16 0.00 0.00 0.00 175.76 177.56 1k1d s ASP 162 N -0.49 4.27 0.55 0.00 1.47 -1.26 -4.78 116.67 116.43 1k1d s ASP 162 Ca -0.05 1.38 0.24 0.00 1.18 0.00 0.00 52.55 55.30 1k1d s ASP 162 Cb -0.03 -2.11 1.47 0.00 -0.34 0.00 0.00 42.92 41.91 1k1d s ASP 162 CO -0.00 -2.12 2.09 0.44 0.68 0.00 0.00 175.17 176.25 1k1d h ASP 163 N -1.19 0.00 -0.49 2.11 3.32 -2.00 -0.13 116.42 118.03 1k1d h ASP 163 Ca -0.47 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.52 1k1d h ASP 163 Cb 1.27 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.80 1k1d h ASP 163 CO 0.58 0.00 0.07 1.23 -1.72 0.00 0.00 179.24 179.40 1k1d h GLY 164 N 0.00 0.89 0.94 2.75 0.00 -1.98 1.01 103.07 106.68 1k1d h GLY 164 Ca 0.11 -0.60 -0.06 0.00 0.00 0.00 0.00 47.33 46.78 1k1d h GLY 164 CO -0.00 0.55 -0.00 -0.84 0.00 0.00 0.00 176.54 176.25 1k1d h THR 165 N 0.70 1.26 -0.04 4.70 2.02 -1.41 -0.78 112.91 119.35 1k1d h THR 165 Ca 0.15 -1.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.32 1k1d h THR 165 Cb 0.41 1.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.96 1k1d h THR 165 CO 0.01 0.34 0.02 0.25 0.37 0.00 0.00 175.52 176.51 1k1d h LEU 166 N 0.50 0.05 -0.03 2.58 5.85 -0.92 -1.03 115.31 122.32 1k1d h LEU 166 Ca 0.11 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.77 1k1d h LEU 166 Cb 0.47 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 1k1d h LEU 166 CO 0.02 0.11 -0.05 0.22 -0.34 0.00 0.00 178.44 178.41 1k1d h TYR 167 N -0.01 -0.11 0.00 1.25 5.03 0.12 -0.67 116.97 122.58 1k1d h TYR 167 Ca 0.01 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.29 1k1d h TYR 167 Cb 0.07 0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.40 1k1d h TYR 167 CO -0.05 -0.07 -0.19 0.00 -1.32 0.00 0.00 178.16 176.53 1k1d h THR 169 N 0.00 1.28 -0.63 0.00 2.02 -0.56 0.09 112.91 115.11 1k1d h THR 169 Ca -0.00 -1.14 0.06 0.00 0.77 0.00 0.00 66.41 66.10 1k1d h THR 169 Cb 0.37 1.35 -0.05 0.00 -1.74 0.00 0.00 68.15 68.08 1k1d h THR 169 CO 0.02 0.37 0.34 -0.07 0.37 0.00 0.00 175.52 176.55 1k1d h LEU 170 N 0.41 0.48 0.54 2.58 3.38 -0.27 0.36 115.31 122.80 1k1d h LEU 170 Ca 0.08 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1k1d h LEU 170 Cb 0.58 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.28 1k1d h LEU 170 CO 0.03 0.31 -0.26 -0.07 0.09 0.00 0.00 178.44 178.55 1k1d h LEU 171 N 0.62 -0.61 -0.71 1.67 3.38 -1.12 0.41 115.31 118.95 1k1d h LEU 171 Ca 0.29 -0.04 0.16 0.00 0.09 0.00 0.00 57.88 58.37 1k1d h LEU 171 Cb 0.20 0.16 -0.12 0.00 0.09 0.00 0.00 40.66 40.98 1k1d h LEU 171 CO -0.19 -0.32 0.01 0.00 0.09 0.00 0.00 178.44 178.03 1k1d h ALA 172 N -0.54 0.73 0.06 1.53 0.00 -0.67 0.18 119.26 120.55 1k1d h ALA 172 Ca -0.07 0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.07 1k1d h ALA 172 Cb 0.62 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1k1d h ALA 172 CO 0.12 -0.41 -0.10 0.00 0.00 0.00 0.00 179.25 178.86 1k1d h ALA 173 N 1.66 -0.16 -0.53 0.00 0.00 -0.06 0.65 119.26 120.82 1k1d h ALA 173 Ca 0.38 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.34 1k1d h ALA 173 Cb 0.66 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 1k1d h ALA 173 CO -0.62 -0.61 0.25 -0.22 0.00 0.00 0.00 179.25 178.05 1k1d h LYS 174 N -0.21 0.47 0.78 0.00 3.64 0.49 0.59 116.57 122.33 1k1d h LYS 174 Ca 0.02 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 1k1d h LYS 174 Cb 0.23 -0.11 0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1k1d h LYS 174 CO -0.06 0.31 -0.37 1.49 -2.27 0.00 0.00 179.45 178.54 1k1d h GLU 175 N 0.48 -1.01 0.00 1.90 4.81 -0.26 -3.24 114.58 117.27 1k1d h GLU 175 Ca 0.24 0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.52 1k1d h GLU 175 Cb 0.19 0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.79 1k1d h GLU 175 CO -0.19 -0.66 -0.12 -0.07 -0.73 0.00 0.00 179.01 177.25 1k1d h LEU 176 N -1.21 0.00 -1.09 1.64 3.38 0.41 -3.47 115.31 114.97 1k1d h LEU 176 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1k1d h LEU 176 Cb 0.82 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1k1d h LEU 176 CO 0.18 0.12 0.00 0.61 0.09 0.00 0.00 178.44 179.43 1k1d n GLY 177 N -0.01 0.56 3.37 0.83 0.00 0.19 -5.05 105.19 105.07 1k1d n GLY 177 Ca 0.00 -0.30 -0.19 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.09 2.07 -0.18 4.61 0.00 -0.22 -4.03 121.76 121.92 1k1d s ALA 178 Ca 0.00 -1.77 -0.06 0.00 0.00 0.00 0.00 51.96 50.13 1k1d s ALA 178 Cb 0.00 0.16 -0.03 0.00 0.00 0.00 0.00 23.12 23.25 1k1d s ALA 178 CO 0.00 -0.07 0.02 -1.17 0.00 0.00 0.00 175.76 174.54 1k1d s LEU 179 N -3.36 3.53 -0.15 0.00 2.96 -0.39 -4.42 118.68 116.86 1k1d s LEU 179 Ca 0.26 -0.04 -0.22 0.00 -0.22 0.00 0.00 54.13 53.91 1k1d s LEU 179 Cb 0.03 -1.88 -0.03 0.00 0.50 0.00 0.00 46.19 44.81 1k1d s LEU 179 CO 0.09 0.15 0.68 -0.69 -1.32 0.00 0.00 176.35 175.26 1k1d s VAL 180 N 0.48 5.01 0.09 1.68 1.01 -1.08 -2.05 120.40 125.55 1k1d s VAL 180 Ca 0.00 1.32 0.03 0.00 0.00 0.00 0.00 61.98 63.33 1k1d s VAL 180 Cb -0.13 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 1k1d s VAL 180 CO 0.02 0.15 0.12 -0.04 0.00 0.00 0.00 175.10 175.34 1k1d s MET 181 N 1.56 3.01 -0.04 2.72 1.00 -0.34 -1.26 119.30 125.94 1k1d s MET 181 Ca 0.33 -0.66 -0.03 0.00 0.00 0.00 0.00 55.69 55.32 1k1d s MET 181 Cb -0.16 -2.78 0.02 0.00 0.00 0.00 0.00 34.83 31.90 1k1d s MET 181 CO 0.13 0.56 0.10 0.08 0.00 0.00 0.00 175.02 175.89 1k1d s VAL 182 N -1.47 -0.02 -0.67 -6.03 1.01 -0.77 -0.26 120.40 112.20 1k1d s VAL 182 Ca 0.31 0.06 -0.17 0.00 0.00 0.00 0.00 61.98 62.18 1k1d s VAL 182 Cb -0.12 -0.16 0.15 0.00 0.00 0.00 0.00 36.38 36.24 1k1d s VAL 182 CO 0.23 0.02 0.69 -2.28 0.00 0.00 0.00 175.10 173.77 1k1d s HIS 183 N 0.40 3.31 -1.05 5.22 2.46 -0.42 -1.90 115.29 123.32 1k1d s HIS 183 Ca -0.03 -1.40 -0.20 0.00 0.47 0.00 0.00 55.06 53.90 1k1d s HIS 183 Cb -0.04 -3.91 0.10 0.00 -0.13 0.00 0.00 32.58 28.60 1k1d s HIS 183 CO -0.02 -1.13 1.37 0.00 -2.47 0.00 0.00 174.74 172.50 1k1d s ALA 184 N 1.60 3.19 -0.08 1.58 0.00 -1.26 -1.66 121.76 125.13 1k1d s ALA 184 Ca 0.12 -2.67 -0.05 0.00 0.00 0.00 0.00 51.96 49.36 1k1d s ALA 184 Cb -0.21 -4.33 0.03 0.00 0.00 0.00 0.00 23.12 18.62 1k1d s ALA 184 CO -0.00 -3.25 0.19 -1.21 0.00 0.00 0.00 175.76 171.49 1k1d s GLU 185 N 3.64 0.18 -1.04 0.00 2.02 -1.26 -4.28 118.70 117.96 1k1d s GLU 185 Ca 0.42 0.35 -0.23 0.00 0.02 0.00 0.00 54.97 55.53 1k1d s GLU 185 Cb -0.01 -0.03 -0.04 0.00 0.10 0.00 0.00 34.13 34.14 1k1d s GLU 185 CO -0.06 -0.10 1.88 1.21 0.02 0.00 0.00 175.26 178.21 1k1d s ASN 186 N 0.68 5.34 0.26 -0.19 3.84 -0.98 -2.70 114.94 121.18 1k1d s ASN 186 Ca -0.05 -1.20 -0.03 0.00 0.21 0.00 0.00 52.86 51.79 1k1d s ASN 186 Cb -0.06 -2.57 0.52 0.00 -0.55 0.00 0.00 41.25 38.59 1k1d s ASN 186 CO -0.04 -2.64 1.69 1.23 -2.79 0.00 0.00 177.10 174.56 1k1d h GLY 187 N 17.00 1.15 1.00 1.21 0.00 -1.80 -1.84 103.07 119.79 1k1d h GLY 187 Ca 0.17 -0.08 0.01 0.00 0.00 0.00 0.00 47.33 47.43 1k1d h GLY 187 CO 1.25 -0.20 0.59 -0.55 0.00 0.00 0.00 176.54 177.63 1k1d h ASP 188 N 0.32 1.01 -0.01 0.19 3.32 -1.88 0.07 116.42 119.44 1k1d h ASP 188 Ca 0.45 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 57.37 1k1d h ASP 188 Cb 0.77 -0.25 0.01 0.00 0.22 0.00 0.00 39.33 40.08 1k1d h ASP 188 CO -0.50 0.73 -0.40 0.58 -1.72 0.00 0.00 179.24 177.93 1k1d h VAL 189 N 1.19 1.48 -0.97 -1.35 2.07 -1.88 -3.03 116.25 113.76 1k1d h VAL 189 Ca 0.33 -1.96 0.19 0.00 0.82 0.00 0.00 66.70 66.08 1k1d h VAL 189 Cb -0.13 2.62 -0.09 0.00 -1.52 0.00 0.00 31.29 32.18 1k1d h VAL 189 CO -0.07 0.55 0.61 0.40 0.02 0.00 0.00 177.57 179.08 1k1d h ILE 190 N -0.28 0.70 0.42 4.57 2.04 -1.21 -1.34 117.51 122.41 1k1d h ILE 190 Ca -0.05 -0.21 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 1k1d h ILE 190 Cb 1.12 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 1k1d h ILE 190 CO 0.08 0.11 -0.29 -0.78 0.00 0.00 0.00 178.15 177.28 1k1d h ASP 191 N 0.63 -0.74 -0.63 1.72 1.82 -0.89 0.19 116.42 118.52 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 1.00 0.23 -0.04 0.00 0.68 0.00 0.00 39.33 41.21 1k1d h ASP 191 CO -0.29 -0.44 0.40 1.88 -1.61 0.00 0.00 179.24 179.18 1k1d h TYR 192 N -0.69 0.76 -0.45 0.28 -1.99 -1.22 -0.24 116.97 113.41 1k1d h TYR 192 Ca -0.04 0.02 0.04 0.00 2.00 0.00 0.00 58.73 60.75 1k1d h TYR 192 Cb 0.58 -0.25 -0.04 0.00 2.00 0.00 0.00 36.73 39.02 1k1d h TYR 192 CO -0.12 0.46 0.21 -0.07 -0.00 0.00 0.00 178.16 178.64 1k1d h LEU 193 N 0.81 0.28 0.35 3.88 3.38 -1.04 0.52 115.31 123.49 1k1d h LEU 193 Ca 0.24 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 1k1d h LEU 193 Cb -0.04 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1k1d h LEU 193 CO -0.07 0.20 -0.24 0.74 0.09 0.00 0.00 178.44 179.16 1k1d h THR 194 N 0.42 0.49 -0.31 0.22 2.02 -0.00 0.08 112.91 115.83 1k1d h THR 194 Ca 0.20 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.44 1k1d h THR 194 Cb 0.14 0.49 -0.05 0.00 -1.74 0.00 0.00 68.15 66.98 1k1d h THR 194 CO -0.16 0.00 -0.05 0.11 0.37 0.00 0.00 175.52 175.79 1k1d h LYS 195 N -0.58 0.03 -0.65 6.66 1.57 -0.65 -2.25 116.57 120.70 1k1d h LYS 195 Ca -0.03 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1k1d h LYS 195 Cb 0.49 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 1k1d h LYS 195 CO 0.01 0.02 0.37 -0.22 -0.57 0.00 0.00 179.45 179.06 1k1d h LYS 196 N 0.03 0.90 -0.22 3.15 3.64 -0.75 -0.38 116.57 122.93 1k1d h LYS 196 Ca 0.15 -0.09 0.06 0.00 -1.27 0.00 0.00 60.65 59.49 1k1d h LYS 196 Cb 0.22 -0.18 -0.07 0.00 -0.41 0.00 0.00 32.23 31.79 1k1d h LYS 196 CO -0.29 0.66 -0.28 0.00 -2.27 0.00 0.00 179.45 177.27 1k1d h ALA 197 N 1.18 -0.22 -0.03 5.00 0.00 -0.49 -0.44 119.26 124.26 1k1d h ALA 197 Ca 0.23 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.21 1k1d h ALA 197 Cb 0.01 0.56 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1k1d h ALA 197 CO -0.04 -0.72 -0.04 -0.07 0.00 0.00 0.00 179.25 178.38 1k1d h LEU 198 N -0.30 -0.12 -1.75 0.00 3.38 -1.17 -1.03 115.31 114.32 1k1d h LEU 198 Ca 0.13 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1k1d h LEU 198 Cb 0.50 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1k1d h LEU 198 CO -0.39 -0.06 0.35 0.00 0.09 0.00 0.00 178.44 178.43 1k1d h ALA 199 N 0.97 1.33 -0.43 1.53 0.00 -0.05 0.38 119.26 123.00 1k1d h ALA 199 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1k1d h ALA 199 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1k1d h ALA 199 CO -0.07 -0.33 0.00 -0.25 0.00 0.00 0.00 179.25 178.60 1k1d n ASP 200 N -2.74 3.45 0.00 0.00 8.00 -0.27 -4.96 116.55 120.02 1k1d n ASP 200 Ca -0.02 -2.21 0.00 0.00 0.71 0.00 0.00 54.79 53.27 1k1d n ASP 200 Cb 0.39 -0.36 0.00 0.00 -0.02 0.00 0.00 41.12 41.13 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 0.60 1.06 3.55 0.44 0.00 0.13 -4.97 105.19 106.00 1k1d n GLY 201 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.05 6.04 -0.00 1.61 0.01 -0.51 -4.74 114.94 114.31 1k1d s ASN 202 Ca 0.00 -0.31 0.01 0.00 -0.71 0.00 0.00 52.86 51.85 1k1d s ASN 202 Cb 0.00 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.09 1k1d s ASN 202 CO 0.00 -1.90 0.03 0.35 -1.51 0.00 0.00 177.10 174.07 1k1d n THR 203 N 6.51 0.00 -1.04 1.60 -2.24 -1.26 -3.88 114.28 113.97 1k1d n THR 203 Ca 0.06 -0.34 -0.34 0.00 -2.27 0.00 0.00 64.05 61.16 1k1d n THR 203 Cb 0.49 0.85 0.12 0.00 -2.10 0.00 0.00 70.33 69.69 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 -1.17 0.20 -0.30 3.42 8.00 -1.26 -1.90 116.55 123.53 1k1d n ASP 204 Ca 0.00 0.54 0.27 0.00 0.71 0.00 0.00 54.79 56.30 1k1d n ASP 204 Cb 0.02 -1.42 0.60 0.00 -0.02 0.00 0.00 41.12 40.30 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 -1.02 0.23 0.00 -0.24 0.11 -1.92 -1.12 132.00 128.04 1k1d h PRO 205 Ca -0.45 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 1k1d h PRO 205 Cb 1.30 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1k1d h PRO 205 CO 0.43 0.15 -0.19 0.97 -0.21 0.00 0.00 178.00 179.16 1k1d h ILE 206 N 0.24 1.11 0.00 4.15 2.10 -1.89 -1.55 117.51 121.66 1k1d h ILE 206 Ca 0.56 -0.65 0.00 0.00 1.08 0.00 0.00 64.86 65.85 1k1d h ILE 206 Cb 1.73 1.35 0.00 0.00 -1.09 0.00 0.00 36.82 38.81 1k1d h ILE 206 CO -0.17 0.18 0.00 -1.22 -1.08 0.00 0.00 178.15 175.86 1k1d n TYR 207 N -4.28 0.11 -0.14 2.19 4.02 -0.42 -1.16 117.16 117.47 1k1d n TYR 207 Ca -0.02 0.05 -0.08 0.00 -0.01 0.00 0.00 57.90 57.83 1k1d n TYR 207 Cb 0.25 -0.58 0.07 0.00 -0.02 0.00 0.00 39.34 39.06 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 1.00 0.01 -0.72 2.76 -1.41 0.70 115.15 117.49 1k1d h HIS 208 Ca 0.00 -0.20 -0.00 0.00 -2.20 0.00 0.00 60.37 57.97 1k1d h HIS 208 Cb 0.22 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 28.93 1k1d h HIS 208 CO 0.00 0.96 -0.01 0.00 -1.30 0.00 0.00 177.93 177.58 1k1d h ALA 209 N 1.05 -0.02 0.00 5.26 0.00 -1.28 -3.32 119.26 120.95 1k1d h ALA 209 Ca 0.13 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1k1d h ALA 209 Cb 0.64 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1k1d h ALA 209 CO 0.04 -0.06 -0.02 -0.07 0.00 0.00 0.00 179.25 179.15 1k1d h LEU 210 N -0.93 0.00 -0.40 0.00 3.38 -1.43 -0.25 115.31 115.69 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 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1k1d h LEU 210 CO 0.00 0.02 0.00 1.07 0.09 0.00 0.00 178.44 179.62 1k1d n THR 211 N -4.17 0.82 -3.30 0.22 5.66 0.24 -4.10 114.28 109.65 1k1d n THR 211 Ca -0.03 0.18 -0.26 0.00 -3.05 0.00 0.00 64.05 60.90 1k1d n THR 211 Cb 0.11 -1.03 -0.09 0.00 -1.55 0.00 0.00 70.33 67.77 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 -1.99 0.39 -1.68 1.09 1.85 -0.11 -4.47 116.66 111.75 1k1d n ARG 212 Ca 0.03 -3.17 -0.38 0.00 -1.00 0.00 0.00 57.85 53.33 1k1d n ARG 212 Cb 0.23 -1.49 0.05 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 2.30 1.21 0.30 2.89 -0.04 -1.25 -4.78 135.00 135.62 1k1d n PRO 213 Ca 0.26 0.46 0.18 0.00 -0.04 0.00 0.00 63.50 64.36 1k1d n PRO 213 Cb 0.50 -2.37 0.95 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 0.83 0.00 -0.90 0.54 0.13 -1.97 -0.58 132.00 130.05 1k1d h PRO 214 Ca -0.49 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1k1d h PRO 214 Cb 1.34 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.42 1k1d h PRO 214 CO 0.53 0.00 0.59 0.93 -0.23 0.00 0.00 178.00 179.82 1k1d h GLU 215 N 0.00 1.19 0.00 0.86 3.07 -1.99 0.39 114.58 118.10 1k1d h GLU 215 Ca 0.02 -0.08 -0.04 0.00 -0.50 0.00 0.00 59.36 58.77 1k1d h GLU 215 Cb 0.43 -0.27 -0.01 0.00 -0.84 0.00 0.00 28.75 28.07 1k1d h GLU 215 CO -0.00 0.79 -0.18 -0.07 -1.40 0.00 0.00 179.01 178.16 1k1d h LEU 216 N 1.22 0.00 0.20 1.33 3.38 -1.45 0.17 115.31 120.17 1k1d h LEU 216 Ca 0.33 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 58.02 1k1d h LEU 216 Cb -0.13 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.65 1k1d h LEU 216 CO -0.07 0.18 -1.20 -0.08 0.09 0.00 0.00 178.44 177.35 1k1d h GLU 217 N 0.00 0.46 -0.23 1.13 4.81 -1.14 -2.52 114.58 117.09 1k1d h GLU 217 Ca -0.00 -0.77 -0.02 0.00 -0.13 0.00 0.00 59.36 58.44 1k1d h GLU 217 Cb 0.70 0.28 -0.01 0.00 0.63 0.00 0.00 28.75 30.35 1k1d h GLU 217 CO 0.02 1.36 0.05 0.78 -0.73 0.00 0.00 179.01 180.50 1k1d h GLY 218 N -0.04 0.41 0.42 1.92 0.00 -0.84 -0.05 103.07 104.88 1k1d h GLY 218 Ca -0.21 -0.26 0.01 0.00 0.00 0.00 0.00 47.33 46.87 1k1d h GLY 218 CO 0.23 0.24 -0.39 -2.09 0.00 0.00 0.00 176.54 174.52 1k1d h GLU 219 N 0.20 -0.67 -0.15 4.80 4.22 -0.73 -0.41 114.58 121.83 1k1d h GLU 219 Ca 0.07 0.05 0.05 0.00 0.08 0.00 0.00 59.36 59.61 1k1d h GLU 219 Cb 0.29 0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.64 1k1d h GLU 219 CO 0.00 -0.45 -0.19 0.00 -2.18 0.00 0.00 179.01 176.20 1k1d h ALA 220 N -0.22 -0.11 -0.98 2.92 0.00 -1.41 -1.16 119.26 118.30 1k1d h ALA 220 Ca 0.00 0.05 0.20 0.00 0.00 0.00 0.00 54.91 55.17 1k1d h ALA 220 Cb 0.68 0.38 -0.09 0.00 0.00 0.00 0.00 17.79 18.75 1k1d h ALA 220 CO -0.17 -0.64 0.62 1.15 0.00 0.00 0.00 179.25 180.21 1k1d h THR 221 N -0.23 0.68 -0.11 0.00 2.02 -0.58 -1.37 112.91 113.33 1k1d h THR 221 Ca 0.10 -0.21 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 1k1d h THR 221 Cb 0.38 0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 66.80 1k1d h THR 221 CO -0.28 0.11 0.05 1.23 0.37 0.00 0.00 175.52 177.00 1k1d h GLY 222 N 0.62 0.17 0.60 2.16 0.00 0.16 -1.92 103.07 104.86 1k1d h GLY 222 Ca 0.55 -0.09 0.01 0.00 0.00 0.00 0.00 47.33 47.80 1k1d h GLY 222 CO -0.31 0.09 -0.25 3.21 0.00 0.00 0.00 176.54 179.28 1k1d h ARG 223 N 0.03 -0.46 -0.77 4.80 3.08 -0.79 0.36 114.38 120.62 1k1d h ARG 223 Ca 0.04 0.03 0.18 0.00 0.07 0.00 0.00 59.98 60.30 1k1d h ARG 223 Cb 0.16 0.10 -0.13 0.00 0.08 0.00 0.00 29.97 30.18 1k1d h ARG 223 CO -0.00 -0.31 0.01 0.00 -1.07 0.00 0.00 179.97 178.60 1k1d h ALA 224 N 0.24 0.81 0.70 0.04 0.00 -1.32 0.44 119.26 120.17 1k1d h ALA 224 Ca 0.02 0.25 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 1k1d h ALA 224 Cb 0.49 0.43 0.01 0.00 0.00 0.00 0.00 17.79 18.71 1k1d h ALA 224 CO -0.12 -0.43 -0.34 0.00 0.00 0.00 0.00 179.25 178.36 1k1d h GLN 226 N -1.16 0.26 -0.23 0.00 4.20 0.54 0.21 115.11 118.93 1k1d h GLN 226 Ca -0.10 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.58 1k1d h GLN 226 Cb 0.75 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.46 1k1d h GLN 226 CO 0.16 0.17 0.08 -0.07 -0.67 0.00 0.00 178.83 178.50 1k1d h LEU 227 N 0.27 0.33 -1.66 1.46 3.38 -0.13 -1.00 115.31 117.96 1k1d h LEU 227 Ca 0.37 -0.19 0.14 0.00 0.09 0.00 0.00 57.88 58.29 1k1d h LEU 227 Cb 0.60 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 1k1d h LEU 227 CO -0.46 0.43 0.46 0.74 0.09 0.00 0.00 178.44 179.70 1k1d h THR 228 N 0.21 0.80 0.35 0.22 2.02 0.14 0.44 112.91 117.10 1k1d h THR 228 Ca 0.08 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 67.12 1k1d h THR 228 Cb 0.21 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 1k1d h THR 228 CO -0.00 0.06 -0.17 -0.08 0.37 0.00 0.00 175.52 175.70 1k1d h GLU 229 N 0.34 -0.46 -0.49 6.66 4.81 -0.03 0.04 114.58 125.44 1k1d h GLU 229 Ca 0.33 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.69 1k1d h GLU 229 Cb 0.82 0.10 -0.10 0.00 0.63 0.00 0.00 28.75 30.20 1k1d h GLU 229 CO -0.09 -0.14 -0.18 1.25 -0.73 0.00 0.00 179.01 179.12 1k1d h LEU 230 N -0.86 -0.65 -1.57 1.64 5.85 -0.16 0.20 115.31 119.75 1k1d h LEU 230 Ca -0.05 0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1k1d h LEU 230 Cb 0.53 0.38 -0.00 0.00 0.37 0.00 0.00 40.66 41.94 1k1d h LEU 230 CO 0.08 -0.22 -0.05 0.00 -0.34 0.00 0.00 178.44 177.91 1k1d h ALA 231 N 1.32 1.03 -1.06 1.25 0.00 -0.96 -3.47 119.26 117.37 1k1d h ALA 231 Ca 0.23 -0.05 -0.23 0.00 0.00 0.00 0.00 54.91 54.86 1k1d h ALA 231 Cb 0.43 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.16 1k1d h ALA 231 CO -0.54 0.07 -0.25 0.41 0.00 0.00 0.00 179.25 178.93 1k1d n GLY 232 N -0.10 0.63 0.00 0.00 0.00 0.69 -4.82 105.19 101.58 1k1d n GLY 232 Ca -0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.02 0.00 -4.17 1.61 3.41 -0.96 -4.99 113.62 108.50 1k1d n SER 233 Ca -0.13 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.21 1k1d n SER 233 Cb 0.48 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.27 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 3.75 1.90 0.19 4.33 0.00 -1.26 -4.43 119.66 124.14 1k1d s GLN 234 Ca 0.00 -0.68 0.10 0.00 -0.00 0.00 0.00 55.36 54.78 1k1d s GLN 234 Cb 0.00 -1.67 -0.04 0.00 0.00 0.00 0.00 33.01 31.30 1k1d s GLN 234 CO 0.00 0.30 -0.15 -1.17 0.00 0.00 0.00 175.29 174.27 1k1d s LEU 235 N -0.08 2.79 -0.31 2.60 2.96 -0.51 -2.63 118.68 123.50 1k1d s LEU 235 Ca -0.02 -0.68 -0.00 0.00 -0.22 0.00 0.00 54.13 53.21 1k1d s LEU 235 Cb -0.11 -1.49 0.13 0.00 0.50 0.00 0.00 46.19 45.22 1k1d s LEU 235 CO 0.02 0.11 0.27 -0.47 -1.32 0.00 0.00 176.35 174.96 1k1d s TYR 236 N -1.70 -0.21 -0.31 5.38 6.14 -0.39 -0.92 117.35 125.34 1k1d s TYR 236 Ca 0.23 -0.51 -0.29 0.00 0.64 0.00 0.00 57.07 57.14 1k1d s TYR 236 Cb -0.08 -0.57 0.01 0.00 0.42 0.00 0.00 41.96 41.74 1k1d s TYR 236 CO 0.13 -0.91 1.22 0.08 0.64 0.00 0.00 175.55 176.71 1k1d s VAL 237 N 2.07 4.27 0.53 3.14 1.01 0.14 -1.84 120.40 129.72 1k1d s VAL 237 Ca 0.11 1.45 -0.16 0.00 0.00 0.00 0.00 61.98 63.38 1k1d s VAL 237 Cb -0.15 -4.25 -0.07 0.00 0.00 0.00 0.00 36.38 31.90 1k1d s VAL 237 CO -0.27 -0.48 1.00 0.68 0.00 0.00 0.00 175.10 176.03 1k1d s VAL 238 N 4.09 4.45 -0.38 2.92 -7.23 -0.80 -1.64 120.40 121.82 1k1d s VAL 238 Ca 0.52 1.16 -0.10 0.00 -1.81 0.00 0.00 61.98 61.76 1k1d s VAL 238 Cb -0.15 -3.68 0.01 0.00 0.56 0.00 0.00 36.38 33.12 1k1d s VAL 238 CO 0.20 -0.68 0.36 0.00 -0.31 0.00 0.00 175.10 174.67 1k1d n HIS 239 N -1.67 -1.31 -2.46 2.82 1.44 -1.13 -4.69 115.22 108.22 1k1d n HIS 239 Ca 0.07 0.54 -0.42 0.00 -2.01 0.00 0.00 57.72 55.90 1k1d n HIS 239 Cb 0.54 -1.30 -0.03 0.00 0.12 0.00 0.00 29.99 29.32 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 -1.80 4.23 -0.04 0.61 1.01 0.41 -4.77 120.40 120.04 1k1d s VAL 240 Ca 0.10 1.57 -0.07 0.00 0.00 0.00 0.00 61.98 63.58 1k1d s VAL 240 Cb -0.01 -4.01 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 1k1d s VAL 240 CO 0.50 0.05 -0.14 0.41 0.00 0.00 0.00 175.10 175.92 1k1d n THR 241 N 4.35 1.11 -2.66 3.92 -1.04 -1.26 -4.62 114.28 114.07 1k1d n THR 241 Ca 0.10 0.15 -0.21 0.00 -2.04 0.00 0.00 64.05 62.05 1k1d n THR 241 Cb 0.47 -1.82 0.05 0.00 -1.82 0.00 0.00 70.33 67.21 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 -0.04 0.12 -0.91 0.00 0.00 -1.95 -2.64 119.26 113.86 1k1d h ALA 243 Ca -0.40 -0.24 0.25 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 -0.12 0.33 1.96 0.00 0.00 0.00 179.25 181.91 1k1d h GLN 244 N -0.18 0.26 0.03 0.00 7.50 -1.95 0.29 115.11 121.06 1k1d h GLN 244 Ca 0.02 -0.02 -0.00 0.00 0.50 0.00 0.00 58.65 59.15 1k1d h GLN 244 Cb 0.49 -0.06 0.00 0.00 0.05 0.00 0.00 27.48 27.96 1k1d h GLN 244 CO 0.01 0.17 -0.01 0.00 -1.50 0.00 0.00 178.83 177.50 1k1d h ALA 245 N 1.78 -0.04 -0.96 3.87 0.00 -1.82 -2.41 119.26 119.69 1k1d h ALA 245 Ca 0.59 -0.14 0.16 0.00 0.00 0.00 0.00 54.91 55.52 1k1d h ALA 245 Cb 1.21 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.92 1k1d h ALA 245 CO -0.62 -0.38 0.57 0.28 0.00 0.00 0.00 179.25 179.10 1k1d h VAL 246 N -0.32 0.77 0.11 0.00 2.07 -0.21 -1.72 116.25 116.95 1k1d h VAL 246 Ca -0.00 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1k1d h VAL 246 Cb 0.30 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.99 1k1d h VAL 246 CO 0.01 0.14 -0.05 -0.08 0.02 0.00 0.00 177.57 177.60 1k1d h GLU 247 N 0.78 -0.15 -0.41 1.57 4.81 -0.48 -0.16 114.58 120.54 1k1d h GLU 247 Ca 0.53 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.83 1k1d h GLU 247 Cb 0.72 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.09 1k1d h GLU 247 CO -0.35 -0.06 0.10 0.87 -0.73 0.00 0.00 179.01 178.85 1k1d h LYS 248 N -0.20 0.24 -0.15 1.92 1.79 -0.83 -0.32 116.57 119.01 1k1d h LYS 248 Ca -0.02 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.41 1k1d h LYS 248 Cb 0.16 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.74 1k1d h LYS 248 CO 0.03 0.16 -0.05 0.82 -1.08 0.00 0.00 179.45 179.32 1k1d h ILE 249 N 0.24 1.13 -0.22 1.86 2.04 -1.18 -1.40 117.51 119.98 1k1d h ILE 249 Ca 0.20 -0.55 -0.06 0.00 1.00 0.00 0.00 64.86 65.45 1k1d h ILE 249 Cb 0.22 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 1k1d h ILE 249 CO -0.24 0.18 -0.11 0.00 0.00 0.00 0.00 178.15 177.98 1k1d h ALA 250 N 1.73 0.31 -0.14 1.87 0.00 0.56 -2.42 119.26 121.17 1k1d h ALA 250 Ca 0.05 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.68 1k1d h ALA 250 Cb 0.24 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1k1d h ALA 250 CO 0.01 0.15 0.01 0.93 0.00 0.00 0.00 179.25 180.36 1k1d h GLU 251 N 0.17 0.07 0.02 0.00 5.08 -0.70 -1.69 114.58 117.53 1k1d h GLU 251 Ca 0.05 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1k1d h GLU 251 Cb 0.60 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.79 1k1d h GLU 251 CO 0.03 0.04 -0.50 0.00 -1.00 0.00 0.00 179.01 177.59 1k1d h ALA 252 N 1.11 -0.93 -0.07 3.43 0.00 -1.21 -0.71 119.26 120.88 1k1d h ALA 252 Ca 0.07 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1k1d h ALA 252 Cb 0.07 0.91 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1k1d h ALA 252 CO -0.10 -1.07 0.09 0.00 0.00 0.00 0.00 179.25 178.16 1k1d h ARG 253 N -0.64 0.00 -0.41 0.00 3.08 -1.33 -0.26 114.38 114.83 1k1d h ARG 253 Ca 0.01 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.91 1k1d h ARG 253 Cb 0.68 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 1k1d h ARG 253 CO -0.32 0.00 -0.32 -0.91 -1.07 0.00 0.00 179.97 177.35 1k1d h ASN 254 N 0.00 0.99 0.00 7.04 2.35 -0.19 -2.48 115.58 123.29 1k1d h ASN 254 Ca 0.03 -0.44 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 1k1d h ASN 254 Cb 0.20 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.30 1k1d h ASN 254 CO -0.00 1.22 0.00 0.29 -1.65 0.00 0.00 177.43 177.29 1k1d n LYS 255 N -4.10 0.66 -0.50 0.81 5.02 -0.14 -4.81 118.16 115.10 1k1d n LYS 255 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1k1d n LYS 255 Cb 0.51 -1.22 0.00 0.00 -0.02 0.00 0.00 35.03 34.30 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 0.23 1.74 3.70 0.72 0.00 -0.93 -5.00 105.19 105.66 1k1d n GLY 256 Ca 0.07 0.00 -0.39 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 4.69 -3.79 0.99 4.77 -1.01 -4.87 117.00 117.78 1k1d n LEU 257 Ca 0.00 0.98 -0.42 0.00 -0.03 0.00 0.00 56.01 56.54 1k1d n LEU 257 Cb 0.00 -1.51 0.00 0.00 -2.33 0.00 0.00 43.42 39.58 1k1d n LEU 257 CO 0.00 -0.86 2.16 -0.67 -1.33 0.00 0.00 177.39 176.68 1k1d n ASP 258 N -0.58 5.25 -4.61 -1.43 -0.08 -1.26 -4.28 116.55 109.56 1k1d n ASP 258 Ca 0.10 -3.06 -0.32 0.00 -1.51 0.00 0.00 54.79 50.00 1k1d n ASP 258 Cb 0.44 -1.50 -0.10 0.00 2.34 0.00 0.00 41.12 42.30 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 0.74 3.76 0.07 5.18 1.01 -1.26 -1.42 120.40 128.48 1k1d s VAL 259 Ca 0.43 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.71 1k1d s VAL 259 Cb 0.11 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 1k1d s VAL 259 CO -0.02 0.39 -0.13 0.26 0.00 0.00 0.00 175.10 175.60 1k1d s TRP 260 N -1.02 1.11 0.07 5.22 0.52 -0.10 -4.82 118.94 119.93 1k1d s TRP 260 Ca 0.18 -0.49 0.08 0.00 0.02 0.00 0.00 56.10 55.88 1k1d s TRP 260 Cb -0.11 -0.62 -0.03 0.00 -1.15 0.00 0.00 33.47 31.55 1k1d s TRP 260 CO 0.08 0.03 -0.20 0.20 0.02 0.00 0.00 176.95 177.08 1k1d s GLY 261 N -1.80 1.16 0.05 0.98 0.00 -1.26 0.23 107.32 106.69 1k1d s GLY 261 Ca -0.02 -1.14 0.03 0.00 0.00 0.00 0.00 44.72 43.58 1k1d s GLY 261 CO 0.02 -1.11 -0.08 1.85 0.00 0.00 0.00 173.10 173.77 1k1d s GLU 262 N -1.56 0.61 0.34 2.90 2.12 -0.65 -1.70 118.70 120.75 1k1d s GLU 262 Ca 0.06 -0.87 0.04 0.00 0.36 0.00 0.00 54.97 54.57 1k1d s GLU 262 Cb -0.09 -0.35 -0.03 0.00 0.26 0.00 0.00 34.13 33.92 1k1d s GLU 262 CO 0.03 0.06 0.18 0.99 -0.54 0.00 0.00 175.26 175.98 1k1d s THR 263 N -1.70 0.30 0.02 -1.70 2.01 -0.53 0.16 115.64 114.20 1k1d s THR 263 Ca -0.06 -2.00 0.02 0.00 0.31 0.00 0.00 61.69 59.96 1k1d s THR 263 Cb -0.08 -2.46 -0.01 0.00 0.01 0.00 0.00 72.50 69.95 1k1d s THR 263 CO -0.00 0.00 -0.07 0.00 -0.69 0.00 0.00 174.62 173.86 1k1d h PRO 265 N 5.22 -0.01 -1.04 0.00 0.13 -1.89 0.45 132.00 134.86 1k1d h PRO 265 Ca -0.32 0.00 0.30 0.00 -0.87 0.00 0.00 66.00 65.10 1k1d h PRO 265 Cb 1.20 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.28 1k1d h PRO 265 CO 0.45 -0.00 0.74 -0.56 -0.23 0.00 0.00 178.00 178.40 1k1d h GLN 266 N -0.01 0.03 0.00 0.86 -0.00 -1.92 0.86 115.11 114.93 1k1d h GLN 266 Ca 0.43 -0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.07 1k1d h GLN 266 Cb 0.66 -0.01 0.00 0.00 -0.00 0.00 0.00 27.48 28.14 1k1d h GLN 266 CO -0.95 0.02 -0.62 0.66 -0.00 0.00 0.00 178.83 177.95 1k1d n TYR 267 N -4.25 0.57 -0.02 0.06 4.02 0.13 -1.73 117.16 115.94 1k1d n TYR 267 Ca 0.22 0.17 -0.09 0.00 -0.01 0.00 0.00 57.90 58.18 1k1d n TYR 267 Cb 1.09 -0.67 -0.14 0.00 -0.02 0.00 0.00 39.34 39.60 1k1d n TYR 267 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 176.86 175.74 1k1d n LEU 268 N -2.12 0.95 -0.05 7.72 7.94 0.27 -4.59 117.00 127.12 1k1d n LEU 268 Ca 0.03 0.38 -0.08 0.00 -1.11 0.00 0.00 56.01 55.24 1k1d n LEU 268 Cb 0.44 0.10 -0.04 0.00 0.53 0.00 0.00 43.42 44.45 1k1d n LEU 268 CO 0.36 0.42 -0.80 0.52 -1.11 0.00 0.00 177.39 176.78 1k1d n VAL 269 N -3.06 0.51 -2.31 1.96 0.31 0.58 -4.88 118.33 111.44 1k1d n VAL 269 Ca -0.19 -0.17 -0.25 0.00 -0.01 0.00 0.00 64.34 63.72 1k1d n VAL 269 Cb 1.06 -1.14 0.08 0.00 -0.91 0.00 0.00 33.84 32.93 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 -5.92 2.91 0.32 7.52 1.43 -0.70 -5.07 118.68 119.16 1k1d s LEU 270 Ca -0.12 0.22 -0.11 0.00 -1.03 0.00 0.00 54.13 53.08 1k1d s LEU 270 Cb 0.04 -2.79 0.02 0.00 0.03 0.00 0.00 46.19 43.49 1k1d s LEU 270 CO 0.19 -1.69 0.59 1.51 0.23 0.00 0.00 176.35 177.18 1k1d s ASP 271 N -4.58 0.26 0.32 2.29 1.47 -1.26 -4.62 116.67 110.55 1k1d s ASP 271 Ca 0.62 -1.15 0.11 0.00 1.18 0.00 0.00 52.55 53.31 1k1d s ASP 271 Cb -0.09 0.70 0.97 0.00 -0.34 0.00 0.00 42.92 44.16 1k1d s ASP 271 CO 0.44 -1.37 1.66 -0.61 0.68 0.00 0.00 175.17 175.98 1k1d h GLN 272 N 2.11 0.30 -0.81 2.11 4.15 0.10 -2.34 115.11 120.73 1k1d h GLN 272 Ca -0.28 -0.02 0.17 0.00 0.77 0.00 0.00 58.65 59.29 1k1d h GLN 272 Cb 1.25 -0.07 -0.11 0.00 0.21 0.00 0.00 27.48 28.76 1k1d h GLN 272 CO 0.37 0.20 0.33 0.66 -1.93 0.00 0.00 178.83 178.46 1k1d h SER 273 N 0.31 0.29 0.00 -0.69 4.64 -1.92 -0.53 113.55 115.65 1k1d h SER 273 Ca 0.68 0.13 0.00 0.00 -0.47 0.00 0.00 61.79 62.12 1k1d h SER 273 Cb 1.48 0.11 0.00 0.00 -0.31 0.00 0.00 62.40 63.67 1k1d h SER 273 CO -0.61 0.07 0.50 1.88 -0.87 0.00 0.00 176.83 177.80 1k1d h TYR 274 N 0.43 0.00 0.00 4.77 -1.99 -1.80 0.56 116.97 118.94 1k1d h TYR 274 Ca 0.46 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.19 1k1d h TYR 274 Cb 0.77 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.50 1k1d h TYR 274 CO -0.16 0.00 -0.05 -0.07 -0.00 0.00 0.00 178.16 177.88 1k1d h LEU 275 N 0.00 0.00 0.01 3.88 3.38 -1.29 -3.25 115.31 118.03 1k1d h LEU 275 Ca 0.00 -0.01 -0.33 0.00 0.09 0.00 0.00 57.88 57.63 1k1d h LEU 275 Cb 1.00 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.70 1k1d h LEU 275 CO 0.00 0.01 -1.97 -0.62 0.09 0.00 0.00 178.44 175.95 1k1d n GLU 276 N -2.39 0.66 -1.79 1.13 1.02 0.20 -3.46 120.64 116.00 1k1d n GLU 276 Ca 0.05 0.20 -0.31 0.00 -0.02 0.00 0.00 57.16 57.09 1k1d n GLU 276 Cb 0.45 -1.69 -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 -2.56 2.23 -0.11 3.49 2.20 -1.10 -4.62 119.74 119.28 1k1d s LYS 277 Ca -0.09 0.69 -0.33 0.00 -0.36 0.00 0.00 55.97 55.87 1k1d s LYS 277 Cb 0.07 -4.65 0.14 0.00 -1.51 0.00 0.00 37.83 31.88 1k1d s LYS 277 CO 0.81 -3.38 1.34 -1.25 -0.36 0.00 0.00 175.35 172.51 1k1d s PRO 278 N 7.82 0.21 4.48 4.03 0.04 -1.26 -2.09 135.00 148.22 1k1d s PRO 278 Ca 0.83 -0.11 0.00 0.00 0.04 0.00 0.00 61.00 61.76 1k1d s PRO 278 Cb -0.13 0.08 0.00 0.00 0.04 0.00 0.00 34.50 34.49 1k1d s PRO 278 CO 0.16 -0.09 0.00 0.09 0.04 0.00 0.00 177.00 177.19 1k1d n ASN 279 N -0.35 0.00 0.00 6.66 3.02 -1.26 -1.09 115.26 122.23 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 -0.27 3.10 7.35 -1.26 -4.84 117.46 121.54 1k1d n PHE 280 Ca 0.00 0.00 0.33 0.00 -0.76 0.00 0.00 57.45 57.02 1k1d n PHE 280 Cb 0.00 0.00 0.72 0.00 0.35 0.00 0.00 39.48 40.55 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 -0.60 -4.13 4.39 -1.26 -1.56 114.58 111.42 1k1d h GLU 281 Ca 0.00 0.00 0.12 0.00 0.34 0.00 0.00 59.36 59.82 1k1d h GLU 281 Cb 0.45 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 29.00 1k1d h GLU 281 CO 0.00 0.00 -0.06 0.78 -1.16 0.00 0.00 179.01 178.57 1k1d h GLY 282 N 0.00 0.55 0.08 -3.84 0.00 -1.60 -0.97 103.07 97.29 1k1d h GLY 282 Ca 0.52 0.13 0.15 0.00 0.00 0.00 0.00 47.33 48.14 1k1d h GLY 282 CO -0.01 -0.21 0.81 0.00 0.00 0.00 0.00 176.54 177.14 1k1d h ALA 283 N 1.57 2.32 0.00 3.60 0.00 -1.56 0.42 119.26 125.61 1k1d h ALA 283 Ca 0.30 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1k1d h ALA 283 Cb 0.48 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1k1d h ALA 283 CO -0.56 -1.09 -0.11 0.87 0.00 0.00 0.00 179.25 178.37 1k1d h LYS 284 N 0.00 0.00 -0.44 0.00 1.57 -1.37 -2.65 116.57 113.68 1k1d h LYS 284 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1k1d h LYS 284 Cb 1.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.19 1k1d h LYS 284 CO -0.00 0.11 0.00 0.66 -0.57 0.00 0.00 179.45 179.64 1k1d n TYR 285 N -3.67 1.04 -2.80 -1.35 4.01 0.15 -4.88 117.16 109.65 1k1d n TYR 285 Ca -0.02 -0.67 -0.42 0.00 -0.16 0.00 0.00 57.90 56.63 1k1d n TYR 285 Cb 0.22 -0.21 -0.04 0.00 -0.31 0.00 0.00 39.34 39.00 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 -1.93 4.62 0.06 -0.72 1.01 -1.00 -4.74 120.40 117.70 1k1d s VAL 286 Ca 0.40 1.33 -0.26 0.00 0.00 0.00 0.00 61.98 63.45 1k1d s VAL 286 Cb 0.27 -4.31 0.09 0.00 0.00 0.00 0.00 36.38 32.44 1k1d s VAL 286 CO 0.17 -0.45 0.74 -1.66 0.00 0.00 0.00 175.10 173.91 1k1d s TRP 287 N 3.38 -0.46 -0.05 5.22 -2.14 -1.26 -1.76 118.94 121.87 1k1d s TRP 287 Ca 0.38 0.35 0.05 0.00 2.66 0.00 0.00 56.10 59.55 1k1d s TRP 287 Cb -0.13 0.54 -0.02 0.00 -3.10 0.00 0.00 33.47 30.76 1k1d s TRP 287 CO 0.16 -0.68 -0.20 -1.12 -2.66 0.00 0.00 176.95 172.45 1k1d s SER 288 N -2.45 3.49 0.78 -2.66 0.01 -1.26 -2.89 113.70 108.71 1k1d s SER 288 Ca 0.02 -0.37 -0.13 0.00 1.31 0.00 0.00 55.95 56.78 1k1d s SER 288 Cb -0.01 -0.77 0.06 0.00 0.21 0.00 0.00 66.02 65.52 1k1d s SER 288 CO -0.09 0.30 1.14 -2.84 0.41 0.00 0.00 173.24 172.16 1k1d s PRO 289 N -0.45 1.99 0.67 12.44 0.02 -1.26 -5.04 135.00 143.37 1k1d s PRO 289 Ca 0.05 1.48 -0.14 0.00 0.02 0.00 0.00 61.00 62.41 1k1d s PRO 289 Cb -0.12 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.56 1k1d s PRO 289 CO 0.01 -1.89 1.09 -1.25 -0.33 0.00 0.00 177.00 174.64 1k1d s PRO 290 N -4.40 2.82 0.41 5.54 0.04 -1.14 -4.98 135.00 133.30 1k1d s PRO 290 Ca 0.68 1.30 -0.27 0.00 0.04 0.00 0.00 61.00 62.75 1k1d s PRO 290 Cb -0.23 -1.96 -0.10 0.00 0.04 0.00 0.00 34.50 32.26 1k1d s PRO 290 CO 0.51 -1.22 1.45 -0.51 0.04 0.00 0.00 177.00 177.26 1k1d s LEU 291 N -4.99 4.22 0.00 -3.56 1.43 -1.26 -4.98 118.68 109.54 1k1d s LEU 291 Ca 0.65 2.96 0.02 0.00 -1.03 0.00 0.00 54.13 56.73 1k1d s LEU 291 Cb -0.19 -3.80 0.02 0.00 0.03 0.00 0.00 46.19 42.24 1k1d s LEU 291 CO 0.44 -1.01 0.13 0.54 0.23 0.00 0.00 176.35 176.68 1k1d n ARG 292 N 0.14 1.07 -2.32 1.70 5.12 -1.26 -4.01 116.66 117.10 1k1d n ARG 292 Ca 0.03 -0.64 -0.41 0.00 -1.93 0.00 0.00 57.85 54.90 1k1d n ARG 292 Cb 0.41 -0.01 -0.03 0.00 -1.16 0.00 0.00 32.46 31.67 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 -2.49 4.47 0.21 5.56 2.02 -1.26 0.66 118.70 127.87 1k1d s GLU 293 Ca 0.10 1.95 0.13 0.00 0.02 0.00 0.00 54.97 57.17 1k1d s GLU 293 Cb -0.01 -3.21 0.77 0.00 0.10 0.00 0.00 34.13 31.79 1k1d s GLU 293 CO 0.06 -0.11 0.89 1.17 0.02 0.00 0.00 175.26 177.29 1k1d n LYS 294 N 2.25 -0.03 0.30 1.61 3.00 -1.26 -1.11 118.16 122.91 1k1d n LYS 294 Ca 0.04 0.77 0.17 0.00 -0.00 0.00 0.00 58.31 59.29 1k1d n LYS 294 Cb 0.44 -1.40 0.96 0.00 0.00 0.00 0.00 35.03 35.03 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 -0.03 5.64 5.08 -2.00 -2.42 115.95 122.21 1k1d h TRP 295 Ca 0.48 0.00 -0.09 0.00 1.08 0.00 0.00 58.89 60.36 1k1d h TRP 295 Cb 1.32 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.47 1k1d h TRP 295 CO -0.01 0.03 -0.39 0.45 -1.28 0.00 0.00 178.44 177.25 1k1d h HIS 296 N 0.00 0.08 -1.03 0.12 3.86 -1.49 -3.10 115.15 113.59 1k1d h HIS 296 Ca -0.00 -0.02 0.26 0.00 -1.16 0.00 0.00 60.37 59.45 1k1d h HIS 296 Cb 0.13 -0.02 -0.11 0.00 1.06 0.00 0.00 27.41 28.48 1k1d h HIS 296 CO 0.00 0.45 0.64 1.96 0.86 0.00 0.00 177.93 181.84 1k1d h GLN 297 N 0.06 0.46 0.65 2.45 4.20 -1.62 -0.39 115.11 120.91 1k1d h GLN 297 Ca 0.00 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 1k1d h GLN 297 Cb 0.72 -0.10 0.01 0.00 0.30 0.00 0.00 27.48 28.40 1k1d h GLN 297 CO 0.05 0.30 -0.31 0.93 -0.67 0.00 0.00 178.83 179.13 1k1d h GLU 298 N 0.47 -0.85 -0.73 1.46 5.08 -1.74 -1.05 114.58 117.23 1k1d h GLU 298 Ca 0.62 0.06 0.16 0.00 -1.00 0.00 0.00 59.36 59.19 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 -0.36 -0.54 0.01 0.28 -1.00 0.00 0.00 179.01 177.40 1k1d h VAL 299 N -0.96 0.38 0.39 3.13 2.07 -1.28 0.23 116.25 120.21 1k1d h VAL 299 Ca -0.09 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 1k1d h VAL 299 Cb 0.70 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 1k1d h VAL 299 CO 0.15 0.02 -0.31 -0.07 0.02 0.00 0.00 177.57 177.38 1k1d h LEU 300 N 0.11 -0.82 -0.55 2.57 3.38 -0.94 0.43 115.31 119.49 1k1d h LEU 300 Ca 0.39 0.06 0.09 0.00 0.09 0.00 0.00 57.88 58.52 1k1d h LEU 300 Cb 0.68 0.26 -0.07 0.00 0.09 0.00 0.00 40.66 41.62 1k1d h LEU 300 CO -0.63 -0.46 0.13 -0.50 0.09 0.00 0.00 178.44 177.07 1k1d h TRP 301 N -0.70 0.21 -0.89 1.13 4.06 0.34 0.84 115.95 120.94 1k1d h TRP 301 Ca -0.03 0.03 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 1k1d h TRP 301 Cb 0.61 -0.01 -0.04 0.00 -1.00 0.00 0.00 29.16 28.72 1k1d h TRP 301 CO -0.15 0.00 0.55 -0.91 -3.56 0.00 0.00 178.44 174.38 1k1d h ASN 302 N 0.27 1.06 -0.44 -3.49 2.35 -0.39 0.52 115.58 115.45 1k1d h ASN 302 Ca 0.28 -0.06 0.02 0.00 -0.55 0.00 0.00 56.30 56.00 1k1d h ASN 302 Cb 0.38 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.45 1k1d h ASN 302 CO -0.35 0.80 0.25 0.00 -1.65 0.00 0.00 177.43 176.48 1k1d h ALA 303 N 1.30 0.56 -0.79 -0.83 0.00 0.44 0.51 119.26 120.46 1k1d h ALA 303 Ca 0.32 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 1k1d h ALA 303 Cb -0.08 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1k1d h ALA 303 CO -0.06 -0.08 0.30 1.25 0.00 0.00 0.00 179.25 180.65 1k1d h LEU 304 N 0.50 1.10 0.09 0.00 5.85 -0.02 0.45 115.31 123.28 1k1d h LEU 304 Ca 0.18 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 1k1d h LEU 304 Cb 0.04 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 40.78 1k1d h LEU 304 CO -0.10 0.99 -0.04 0.50 -0.34 0.00 0.00 178.44 179.44 1k1d h LYS 305 N 1.15 -0.12 -0.00 1.25 3.64 0.11 -3.27 116.57 119.34 1k1d h LYS 305 Ca 0.26 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 1k1d h LYS 305 Cb 0.24 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1k1d h LYS 305 CO -0.02 0.19 -0.29 0.09 -2.27 0.00 0.00 179.45 177.15 1k1d n ASN 306 N -5.00 0.53 0.00 4.20 3.02 0.17 -4.96 115.26 113.21 1k1d n ASN 306 Ca -0.08 -0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.12 1k1d n ASN 306 Cb 0.19 0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.40 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 1.42 0.55 0.33 7.41 0.00 0.13 -4.96 105.19 110.07 1k1d n GLY 307 Ca 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 4.38 0.91 -6.34 1.61 1.08 -1.03 -3.39 115.11 112.32 1k1d h GLN 308 Ca 0.00 -0.10 -0.69 0.00 -1.45 0.00 0.00 58.65 56.42 1k1d h GLN 308 Cb 0.00 -0.18 -0.22 0.00 -0.05 0.00 0.00 27.48 27.03 1k1d h GLN 308 CO 0.00 0.67 -0.76 -0.51 -0.95 0.00 0.00 178.83 177.28 1k1d s LEU 309 N -9.66 2.81 0.00 1.46 1.43 -1.02 -4.41 118.68 109.29 1k1d s LEU 309 Ca -0.10 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1k1d s LEU 309 Cb 0.17 -1.59 0.00 0.00 0.03 0.00 0.00 46.19 44.80 1k1d s LEU 309 CO 0.79 0.33 0.33 0.00 0.23 0.00 0.00 176.35 178.02 1k1d n GLN 310 N 2.11 -0.35 -3.91 1.70 0.00 -0.69 -4.20 117.38 112.04 1k1d n GLN 310 Ca -0.17 -0.36 -0.10 0.00 0.00 0.00 0.00 57.00 56.37 1k1d n GLN 310 Cb 0.52 -0.78 -0.10 0.00 0.00 0.00 0.00 30.24 29.88 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 -0.05 0.10 -0.18 -0.39 -4.23 -1.11 -4.51 115.64 105.26 1k1d s THR 311 Ca 0.00 -0.85 0.00 0.00 -1.18 0.00 0.00 61.69 59.66 1k1d s THR 311 Cb 0.00 -0.52 0.01 0.00 1.34 0.00 0.00 72.50 73.34 1k1d s THR 311 CO 0.00 -0.47 -0.17 -0.22 -0.54 0.00 0.00 174.62 173.22 1k1d s LEU 312 N -1.60 2.29 0.33 4.79 2.96 -0.62 -1.45 118.68 125.38 1k1d s LEU 312 Ca -0.12 -0.59 0.09 0.00 -0.22 0.00 0.00 54.13 53.29 1k1d s LEU 312 Cb -0.06 -1.53 -0.06 0.00 0.50 0.00 0.00 46.19 45.04 1k1d s LEU 312 CO -0.01 0.00 -0.03 -0.83 -1.32 0.00 0.00 176.35 174.16 1k1d s GLY 313 N 1.28 2.08 -0.15 7.98 0.00 0.17 -4.75 107.32 113.94 1k1d s GLY 313 Ca 0.04 -1.98 -0.06 0.00 0.00 0.00 0.00 44.72 42.71 1k1d s GLY 313 CO -0.10 -1.94 0.26 -1.14 0.00 0.00 0.00 173.10 170.18 1k1d n SER 314 N -0.88 2.09 -2.06 1.64 3.41 -1.26 -3.83 113.62 112.73 1k1d n SER 314 Ca -0.05 0.17 -0.14 0.00 -0.26 0.00 0.00 58.87 58.59 1k1d n SER 314 Cb 0.62 -0.80 0.03 0.00 -0.26 0.00 0.00 64.21 63.80 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 -3.51 -4.47 -4.68 4.04 2.03 -0.07 -4.80 116.55 105.09 1k1d n ASP 315 Ca -0.34 -0.21 -0.50 0.00 0.52 0.00 0.00 54.79 54.25 1k1d n ASP 315 Cb 1.02 -3.29 -0.05 0.00 -0.72 0.00 0.00 41.12 38.08 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 -2.89 1.90 -2.74 -0.67 -0.06 -1.13 -4.37 117.38 107.40 1k1d n GLN 316 Ca -0.06 0.69 -0.06 0.00 -2.00 0.00 0.00 57.00 55.58 1k1d n GLN 316 Cb 0.57 -2.48 0.03 0.00 -4.06 0.00 0.00 30.24 24.30 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 6.70 -0.17 0.00 1.04 -1.25 -2.15 113.70 117.63 1k1d s SER 318 Ca 0.30 2.29 -0.07 0.00 0.48 0.00 0.00 55.95 58.95 1k1d s SER 318 Cb 0.12 -2.61 0.07 0.00 0.10 0.00 0.00 66.02 63.70 1k1d s SER 318 CO -0.14 -0.55 0.38 -0.36 0.98 0.00 0.00 173.24 173.56 1k1d s PHE 319 N -1.40 -0.65 0.14 5.02 0.08 -1.26 -1.00 117.98 118.90 1k1d s PHE 319 Ca 0.55 1.32 -0.33 0.00 0.12 0.00 0.00 56.93 58.58 1k1d s PHE 319 Cb -0.30 0.23 -0.13 0.00 -0.57 0.00 0.00 43.02 42.25 1k1d s PHE 319 CO 0.38 -0.40 1.67 -0.25 -0.10 0.00 0.00 175.22 176.51 1k1d n ASP 320 N 4.93 3.40 -0.04 1.36 8.00 -1.26 -4.62 116.55 128.33 1k1d n ASP 320 Ca -0.14 1.06 0.09 0.00 0.71 0.00 0.00 54.79 56.50 1k1d n ASP 320 Cb 0.52 -1.46 0.47 0.00 -0.02 0.00 0.00 41.12 40.63 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 6.76 0.46 0.00 1.24 3.57 -1.95 -0.61 116.94 126.41 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 1.24 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.83 1k1d h PHE 321 CO 0.68 0.25 0.00 1.63 -2.23 0.00 0.00 178.31 178.63 1k1d n LYS 322 N -4.47 0.00 0.12 1.11 5.02 -1.26 -3.24 118.16 115.43 1k1d n LYS 322 Ca 0.07 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.24 1k1d n LYS 322 Cb 0.24 -0.49 -0.08 0.00 -0.02 0.00 0.00 35.03 34.68 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 -0.35 0.00 0.72 0.00 -1.98 -3.29 103.07 98.17 1k1d h GLY 323 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1k1d h GLY 323 CO 0.00 -0.13 0.00 -1.06 0.00 0.00 0.00 176.54 175.35 1k1d n GLN 324 N -5.04 0.00 -0.41 4.80 6.02 -0.99 -3.43 117.38 118.33 1k1d n GLN 324 Ca -0.09 0.27 0.33 0.00 -0.01 0.00 0.00 57.00 57.51 1k1d n GLN 324 Cb 0.26 -1.26 0.62 0.00 1.02 0.00 0.00 30.24 30.88 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 0.16 0.00 -1.09 1.79 -1.24 0.39 116.57 116.58 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 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.61 1k1d h LYS 325 CO 0.00 0.11 0.00 0.39 -1.08 0.00 0.00 179.45 178.87 1k1d n GLU 326 N -4.59 0.15 0.04 3.15 1.02 -1.20 -2.90 120.64 116.30 1k1d n GLU 326 Ca 0.33 0.44 0.21 0.00 -0.02 0.00 0.00 57.16 58.12 1k1d n GLU 326 Cb 1.28 -1.82 0.73 0.00 -0.02 0.00 0.00 31.44 31.61 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 -6.17 -4.62 3.38 -0.24 -2.71 115.31 104.95 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 0.12 0.61 0.09 0.00 0.00 178.44 179.26 1k1d n GLY 328 N -1.54 5.42 0.00 0.83 0.00 -1.14 -4.80 105.19 103.95 1k1d n GLY 328 Ca 0.09 -2.71 0.00 0.00 0.00 0.00 0.00 46.02 43.40 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 0.48 0.00 -0.06 1.61 5.12 -1.02 -3.93 116.66 118.86 1k1d n ARG 329 Ca 0.33 0.11 0.01 0.00 -1.93 0.00 0.00 57.85 56.37 1k1d n ARG 329 Cb 0.35 -0.82 0.03 0.00 -1.16 0.00 0.00 32.46 30.86 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 1.11 1.20 2.92 -0.13 0.00 -1.26 -4.51 105.19 104.52 1k1d n GLY 330 Ca 0.00 -0.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.22 0.28 0.26 1.61 -1.08 -1.25 -4.79 116.67 111.48 1k1d s ASP 331 Ca 0.04 -0.04 -0.03 0.00 -0.52 0.00 0.00 52.55 52.00 1k1d s ASP 331 Cb 0.03 1.13 0.34 0.00 -1.46 0.00 0.00 42.92 42.96 1k1d s ASP 331 CO 0.01 -0.32 1.81 2.19 0.52 0.00 0.00 175.17 179.38 1k1d h PHE 332 N 8.17 0.94 0.00 -5.34 -0.00 -1.55 -1.88 116.94 117.28 1k1d h PHE 332 Ca -0.15 -0.09 0.00 0.00 -0.00 0.00 0.00 57.97 57.74 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 0.19 0.77 0.03 0.25 -0.00 0.00 0.00 178.31 179.55 1k1d n THR 333 N -4.27 1.62 0.43 0.88 -2.24 -1.26 -0.42 114.28 109.02 1k1d n THR 333 Ca 0.05 0.57 0.11 0.00 -2.27 0.00 0.00 64.05 62.51 1k1d n THR 333 Cb 0.22 -1.57 0.17 0.00 -2.10 0.00 0.00 70.33 67.05 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 -1.70 2.31 -2.77 -0.78 5.02 -0.71 -4.89 118.16 114.65 1k1d n LYS 334 Ca -0.00 -2.10 -0.42 0.00 -2.02 0.00 0.00 58.31 53.76 1k1d n LYS 334 Cb 0.04 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 33.56 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 -1.51 4.82 0.04 -0.18 1.01 0.44 -3.00 121.20 122.82 1k1d s ILE 335 Ca 0.33 1.88 -0.30 0.00 0.00 0.00 0.00 60.65 62.56 1k1d s ILE 335 Cb 0.20 -4.24 -0.08 0.00 0.01 0.00 0.00 42.46 38.35 1k1d s ILE 335 CO 0.29 0.02 1.65 -2.16 0.00 0.00 0.00 174.94 174.73 1k1d s PRO 336 N 2.05 4.20 0.21 2.79 0.04 -1.26 -4.95 135.00 138.08 1k1d s PRO 336 Ca 0.44 2.29 -0.30 0.00 0.04 0.00 0.00 61.00 63.48 1k1d s PRO 336 Cb -0.18 -3.71 -0.08 0.00 0.04 0.00 0.00 34.50 30.57 1k1d s PRO 336 CO 0.16 -0.76 1.20 -0.80 0.04 0.00 0.00 177.00 176.84 1k1d s ASN 337 N 2.67 7.07 0.00 6.66 0.02 -1.26 -4.88 114.94 125.21 1k1d s ASN 337 Ca 0.74 2.29 0.00 0.00 -1.02 0.00 0.00 52.86 54.87 1k1d s ASN 337 Cb -0.38 -2.61 0.00 0.00 0.02 0.00 0.00 41.25 38.28 1k1d s ASN 337 CO 0.32 -0.37 0.00 0.61 0.02 0.00 0.00 177.10 177.68 1k1d n GLY 338 N 1.97 4.87 3.27 0.66 0.00 -0.72 -4.93 105.19 110.31 1k1d n GLY 338 Ca 0.03 -1.06 -0.20 0.00 0.00 0.00 0.00 46.02 44.80 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 1.20 -0.92 -0.02 0.00 -0.91 -4.61 107.32 102.05 1k1d s GLY 339 Ca 0.00 -1.35 -0.24 0.00 0.00 0.00 0.00 44.72 43.13 1k1d s GLY 339 CO 0.00 -1.40 1.45 2.56 0.00 0.00 0.00 173.10 175.71 1k1d s PRO 340 N -2.61 3.38 0.00 2.90 0.04 -1.26 -1.68 135.00 135.76 1k1d s PRO 340 Ca 0.11 -0.76 0.00 0.00 0.04 0.00 0.00 61.00 60.38 1k1d s PRO 340 Cb -0.06 -4.97 0.00 0.00 0.04 0.00 0.00 34.50 29.51 1k1d s PRO 340 CO 0.04 -2.29 0.00 -0.89 0.04 0.00 0.00 177.00 173.91 1k1d n ILE 341 N 6.82 0.00 0.29 0.56 5.41 -1.26 -4.44 119.36 126.74 1k1d n ILE 341 Ca 0.25 -0.02 0.10 0.00 1.00 0.00 0.00 62.75 64.07 1k1d n ILE 341 Cb 0.50 0.38 0.52 0.00 -0.71 0.00 0.00 39.64 40.33 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 0.03 1.39 2.10 -1.87 -2.72 117.51 116.44 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 0.42 -0.05 0.00 -1.09 0.00 0.00 36.82 36.10 1k1d h ILE 342 CO 0.00 0.00 -2.13 1.21 -1.08 0.00 0.00 178.15 176.15 1k1d n GLU 343 N -2.59 0.68 -0.12 2.19 2.13 -1.26 -4.16 120.64 117.51 1k1d n GLU 343 Ca -0.01 0.17 0.12 0.00 0.66 0.00 0.00 57.16 58.10 1k1d n GLU 343 Cb 0.52 -1.64 0.19 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 -3.11 3.24 0.00 4.31 8.00 -1.04 -3.89 116.55 124.07 1k1d n ASP 344 Ca -0.31 -1.98 0.00 0.00 0.71 0.00 0.00 54.79 53.21 1k1d n ASP 344 Cb 1.07 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 42.00 1k1d n ASP 344 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1k1d n ARG 345 N 1.40 0.00 0.06 -1.24 0.63 -1.15 -1.25 116.66 115.11 1k1d n ARG 345 Ca 0.18 0.80 -0.14 0.00 -0.92 0.00 0.00 57.85 57.77 1k1d n ARG 345 Cb 0.60 -1.48 -0.08 0.00 0.45 0.00 0.00 32.46 31.95 1k1d n ARG 345 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1k1d h VAL 346 N 0.00 0.10 -0.45 5.15 2.07 -1.82 -2.83 116.25 118.47 1k1d h VAL 346 Ca 0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 1k1d h VAL 346 Cb 0.00 0.10 -0.10 0.00 -1.52 0.00 0.00 31.29 29.77 1k1d h VAL 346 CO 0.00 0.00 -0.31 0.28 0.02 0.00 0.00 177.57 177.56 1k1d h SER 347 N -0.62 -1.05 -0.94 0.57 0.02 -1.73 -1.68 113.55 108.12 1k1d h SER 347 Ca 0.04 0.20 0.13 0.00 -0.84 0.00 0.00 61.79 61.31 1k1d h SER 347 Cb 0.68 0.51 -0.09 0.00 0.14 0.00 0.00 62.40 63.64 1k1d h SER 347 CO -0.33 -0.31 0.57 0.40 -1.14 0.00 0.00 176.83 176.02 1k1d h ILE 348 N -0.22 0.86 -0.46 3.27 2.04 -1.00 0.37 117.51 122.38 1k1d h ILE 348 Ca 0.19 -0.30 -0.12 0.00 1.00 0.00 0.00 64.86 65.63 1k1d h ILE 348 Cb 0.53 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1k1d h ILE 348 CO -0.57 0.16 -0.21 0.25 0.00 0.00 0.00 178.15 177.78 1k1d h LEU 349 N 0.86 0.94 0.24 1.44 5.85 -1.09 0.49 115.31 124.04 1k1d h LEU 349 Ca 0.48 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 1k1d h LEU 349 Cb 0.54 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1k1d h LEU 349 CO -0.29 1.11 -0.11 0.15 -0.34 0.00 0.00 178.44 178.95 1k1d h PHE 350 N 0.80 -0.30 0.18 1.25 3.57 -0.64 0.65 116.94 122.45 1k1d h PHE 350 Ca 0.11 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 1k1d h PHE 350 Cb 0.76 0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.60 1k1d h PHE 350 CO 0.05 -0.08 -0.09 1.03 -2.23 0.00 0.00 178.31 176.99 1k1d h SER 351 N -0.47 -0.21 0.23 0.41 0.87 -0.85 0.22 113.55 113.76 1k1d h SER 351 Ca -0.03 0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.49 1k1d h SER 351 Cb 0.35 0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.36 1k1d h SER 351 CO 0.05 -0.14 -0.20 -0.33 -0.53 0.00 0.00 176.83 175.68 1k1d h GLU 352 N -0.26 0.00 0.00 2.24 4.39 -0.13 -3.13 114.58 117.69 1k1d h GLU 352 Ca -0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1k1d h GLU 352 Cb 0.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1k1d h GLU 352 CO 0.04 0.20 0.00 0.41 -1.16 0.00 0.00 179.01 178.50 1k1d n GLY 353 N -0.90 0.37 0.01 -3.84 0.00 0.22 -4.31 105.19 96.73 1k1d n GLY 353 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.99 1k1d n GLY 353 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1k1d h VAL 354 N 0.00 0.00 -0.45 1.61 2.07 -0.60 -2.17 116.25 116.71 1k1d h VAL 354 Ca 0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 1k1d h VAL 354 Cb 0.00 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.75 1k1d h VAL 354 CO 0.00 0.00 0.67 0.11 0.02 0.00 0.00 177.57 178.37 1k1d h LYS 355 N -0.01 0.00 -0.33 1.57 1.79 -0.61 -1.95 116.57 117.03 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 0.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 1k1d h LYS 355 CO -0.01 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 179.99 1k1d n LYS 356 N -3.32 2.24 0.00 3.15 5.02 -0.97 -4.99 118.16 119.29 1k1d n LYS 356 Ca 0.09 -2.03 0.00 0.00 -2.02 0.00 0.00 58.31 54.34 1k1d n LYS 356 Cb 0.83 -1.39 0.00 0.00 -0.02 0.00 0.00 35.03 34.45 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 1.06 2.46 3.89 0.72 0.00 -0.73 -5.03 105.19 107.56 1k1d n GLY 357 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.32 3.61 0.42 1.61 0.52 -0.85 -4.90 118.95 119.04 1k1d s ARG 358 Ca 0.00 0.37 0.00 0.00 -0.52 0.00 0.00 55.73 55.58 1k1d s ARG 358 Cb 0.00 -2.32 0.00 0.00 0.52 0.00 0.00 34.95 33.15 1k1d s ARG 358 CO 0.00 -0.23 0.00 -0.89 0.02 0.00 0.00 175.30 174.20 1k1d n ILE 359 N -2.11 -0.01 -4.41 1.52 5.41 -1.26 -2.88 119.36 115.62 1k1d n ILE 359 Ca 0.02 0.42 -0.21 0.00 1.00 0.00 0.00 62.75 63.99 1k1d n ILE 359 Cb 0.55 -0.84 -0.10 0.00 -0.71 0.00 0.00 39.64 38.53 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 -3.26 1.63 0.44 1.39 2.01 -1.26 -4.62 115.64 111.96 1k1d s THR 360 Ca 0.00 -2.13 0.12 0.00 0.31 0.00 0.00 61.69 59.99 1k1d s THR 360 Cb 0.00 -2.38 0.31 0.00 0.01 0.00 0.00 72.50 70.44 1k1d s THR 360 CO 0.00 -0.35 2.02 0.25 -0.69 0.00 0.00 174.62 175.85 1k1d h LEU 361 N 2.33 0.36 0.09 4.42 5.85 -1.92 0.34 115.31 126.78 1k1d h LEU 361 Ca -0.40 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.16 1k1d h LEU 361 Cb 1.23 -0.08 0.02 0.00 0.37 0.00 0.00 40.66 42.20 1k1d h LEU 361 CO 0.66 0.23 -0.72 0.78 -0.34 0.00 0.00 178.44 179.05 1k1d h ASN 362 N 0.41 0.48 -0.95 1.25 2.35 -1.86 -3.04 115.58 114.21 1k1d h ASN 362 Ca 0.21 -0.89 0.07 0.00 -0.55 0.00 0.00 56.30 55.15 1k1d h ASN 362 Cb 0.32 -0.15 -0.07 0.00 0.05 0.00 0.00 38.32 38.47 1k1d h ASN 362 CO -0.05 1.32 0.61 1.56 -1.65 0.00 0.00 177.43 179.21 1k1d h GLN 363 N -0.30 1.05 0.16 0.81 4.20 -1.64 -0.70 115.11 118.69 1k1d h GLN 363 Ca -0.12 -0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.54 1k1d h GLN 363 Cb 1.51 -0.24 -0.05 0.00 0.30 0.00 0.00 27.48 29.01 1k1d h GLN 363 CO 0.14 0.70 -0.51 0.35 -0.67 0.00 0.00 178.83 178.83 1k1d h PHE 364 N 1.08 -1.46 -0.90 2.96 3.57 -0.38 0.50 116.94 122.31 1k1d h PHE 364 Ca 0.42 0.04 0.07 0.00 3.53 0.00 0.00 57.97 62.03 1k1d h PHE 364 Cb 0.21 0.62 -0.06 0.00 2.79 0.00 0.00 35.95 39.50 1k1d h PHE 364 CO -0.01 -0.59 0.58 0.28 -2.23 0.00 0.00 178.31 176.34 1k1d h VAL 365 N -0.76 1.04 0.13 1.41 2.07 -1.31 -1.17 116.25 117.65 1k1d h VAL 365 Ca -0.01 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1k1d h VAL 365 Cb 0.76 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1k1d h VAL 365 CO -0.26 0.18 -0.06 -0.78 0.02 0.00 0.00 177.57 176.67 1k1d h ASP 366 N 0.99 -0.15 0.17 0.57 3.58 -0.30 0.18 116.42 121.46 1k1d h ASP 366 Ca 0.40 -0.25 -0.02 0.00 0.42 0.00 0.00 57.03 57.58 1k1d h ASP 366 Cb 0.26 0.04 -0.00 0.00 1.72 0.00 0.00 39.33 41.34 1k1d h ASP 366 CO -0.16 0.18 -0.08 0.40 -2.88 0.00 0.00 179.24 176.70 1k1d h ILE 367 N -0.49 0.70 0.00 2.25 2.04 0.46 -2.09 117.51 120.38 1k1d h ILE 367 Ca -0.02 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.53 1k1d h ILE 367 Cb 0.39 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.66 1k1d h ILE 367 CO 0.03 0.08 -1.20 0.52 0.00 0.00 0.00 178.15 177.58 1k1d n VAL 368 N -3.92 0.00 0.00 1.67 0.31 -0.49 -1.59 118.33 114.31 1k1d n VAL 368 Ca -0.02 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 1k1d n VAL 368 Cb 0.17 0.59 0.00 0.00 -0.91 0.00 0.00 33.84 33.69 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 -1.69 0.00 -0.05 4.52 2.88 0.03 -1.45 113.62 117.86 1k1d n SER 369 Ca 0.00 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.51 1k1d n SER 369 Cb 0.32 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.76 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 -1.00 2.46 2.02 -1.48 -0.98 112.91 113.92 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 -0.15 0.00 -1.74 0.00 0.00 68.15 66.26 1k1d h THR 370 CO 0.00 0.00 0.57 -0.09 0.37 0.00 0.00 175.52 176.37 1k1d h ARG 371 N -0.06 0.29 0.12 6.66 9.65 -1.64 0.10 114.38 129.50 1k1d h ARG 371 Ca 0.02 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.88 1k1d h ARG 371 Cb 0.12 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.63 1k1d h ARG 371 CO -0.15 0.20 -0.06 0.82 2.80 0.00 0.00 179.97 183.58 1k1d h ILE 372 N 0.30 1.07 -0.89 1.20 2.04 -1.55 -1.66 117.51 118.01 1k1d h ILE 372 Ca 0.74 -0.83 0.17 0.00 1.00 0.00 0.00 64.86 65.95 1k1d h ILE 372 Cb 1.72 1.58 -0.10 0.00 -0.74 0.00 0.00 36.82 39.27 1k1d h ILE 372 CO -0.62 0.20 0.47 0.00 0.00 0.00 0.00 178.15 178.20 1k1d h ALA 373 N 0.26 1.40 0.51 1.87 0.00 0.44 -1.01 119.26 122.72 1k1d h ALA 373 Ca -0.02 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1k1d h ALA 373 Cb 0.44 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1k1d h ALA 373 CO 0.03 -0.14 -0.24 0.87 0.00 0.00 0.00 179.25 179.76 1k1d h LYS 374 N 0.60 -0.66 -0.33 0.00 1.57 -1.05 0.40 116.57 117.10 1k1d h LYS 374 Ca 0.51 0.04 0.10 0.00 -1.87 0.00 0.00 60.65 59.43 1k1d h LYS 374 Cb 0.80 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.25 1k1d h LYS 374 CO -0.40 -0.35 0.25 -0.07 -0.57 0.00 0.00 179.45 178.30 1k1d h LEU 375 N -0.96 0.00 -3.43 2.94 3.38 -0.71 -2.58 115.31 113.94 1k1d h LEU 375 Ca -0.07 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.76 1k1d h LEU 375 Cb 0.61 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.28 1k1d h LEU 375 CO 0.11 0.00 0.07 0.49 0.09 0.00 0.00 178.44 179.20 1k1d n PHE 376 N -4.39 1.43 -3.59 1.13 3.72 -0.44 -4.87 117.46 110.46 1k1d n PHE 376 Ca 0.05 -1.26 -0.24 0.00 -0.05 0.00 0.00 57.45 55.95 1k1d n PHE 376 Cb 0.42 -0.49 0.05 0.00 -0.94 0.00 0.00 39.48 38.51 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 -0.71 -0.77 0.00 1.37 0.00 -0.95 -4.41 105.19 99.72 1k1d n GLY 377 Ca 0.32 0.36 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 -3.99 0.48 -4.82 0.99 4.77 0.14 -1.22 117.00 113.34 1k1d n LEU 378 Ca -0.17 -0.53 -0.38 0.00 -0.03 0.00 0.00 56.01 54.90 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 0.66 0.12 0.22 0.12 -1.33 0.00 0.00 177.39 177.17 1k1d s PHE 379 N -0.11 3.78 -0.34 -1.77 2.19 -1.08 0.25 117.98 120.91 1k1d s PHE 379 Ca 0.00 1.18 0.10 0.00 0.33 0.00 0.00 56.93 58.54 1k1d s PHE 379 Cb 0.00 -2.43 0.72 0.00 -1.31 0.00 0.00 43.02 40.00 1k1d s PHE 379 CO 0.00 0.60 1.71 -0.35 1.83 0.00 0.00 175.22 179.02 1k1d n PRO 380 N 1.77 3.88 -0.20 10.12 -0.04 -1.26 -4.90 135.00 144.36 1k1d n PRO 380 Ca -0.11 -2.87 -0.08 0.00 -0.04 0.00 0.00 63.50 60.39 1k1d n PRO 380 Cb 0.51 -2.18 0.02 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 2.86 0.86 -5.55 0.54 3.64 -1.54 -3.39 116.57 113.98 1k1d h LYS 381 Ca 0.18 -0.16 -0.57 0.00 -1.27 0.00 0.00 60.65 58.82 1k1d h LYS 381 Cb 2.14 -0.14 -0.13 0.00 -0.41 0.00 0.00 32.23 33.69 1k1d h LYS 381 CO 0.63 0.75 -0.62 0.15 -2.27 0.00 0.00 179.45 178.09 1k1d s LYS 382 N -5.51 1.82 0.00 1.90 -0.14 0.14 -0.97 119.74 116.98 1k1d s LYS 382 Ca -0.13 -2.01 0.00 0.00 -1.36 0.00 0.00 55.97 52.48 1k1d s LYS 382 Cb 0.12 -1.38 0.00 0.00 -1.68 0.00 0.00 37.83 34.89 1k1d s LYS 382 CO 0.79 -0.06 0.00 0.41 -0.76 0.00 0.00 175.35 175.73 1k1d n GLY 383 N -0.83 0.79 3.59 -3.33 0.00 -1.26 -4.09 105.19 100.05 1k1d n GLY 383 Ca -0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.98 0.00 -0.69 2.61 -1.32 -1.26 -3.28 115.64 108.73 1k1d s THR 384 Ca 0.00 -0.35 -0.03 0.00 -1.21 0.00 0.00 61.69 60.10 1k1d s THR 384 Cb 0.00 -1.37 0.18 0.00 -1.51 0.00 0.00 72.50 69.79 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 -3.68 3.91 0.01 5.08 1.01 -1.26 -4.81 121.20 121.46 1k1d s ILE 385 Ca 0.05 -3.13 -0.13 0.00 0.00 0.00 0.00 60.65 57.44 1k1d s ILE 385 Cb -0.02 -3.51 0.02 0.00 0.01 0.00 0.00 42.46 38.95 1k1d s ILE 385 CO -0.05 -0.93 0.28 -0.69 0.00 0.00 0.00 174.94 173.55 1k1d s VAL 386 N -0.32 0.07 -0.26 2.92 1.01 -1.26 -5.00 120.40 117.56 1k1d s VAL 386 Ca 0.19 -0.60 -0.40 0.00 0.00 0.00 0.00 61.98 61.16 1k1d s VAL 386 Cb -0.17 -0.74 -0.16 0.00 0.00 0.00 0.00 36.38 35.30 1k1d s VAL 386 CO -0.05 -0.33 1.69 0.52 0.00 0.00 0.00 175.10 176.93 1k1d n VAL 387 N 0.99 0.26 0.00 2.92 0.31 -1.26 -0.76 118.33 120.78 1k1d n VAL 387 Ca -0.20 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 1k1d n VAL 387 Cb 0.57 -1.12 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 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 4.01 2.13 3.80 2.92 0.00 -0.03 -4.99 105.19 113.04 1k1d n GLY 388 Ca 0.26 -0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 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 0.24 5.67 0.59 1.61 0.01 0.06 -4.70 113.70 117.18 1k1d s SER 389 Ca 0.00 1.81 -0.20 0.00 1.31 0.00 0.00 55.95 58.87 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 -1.24 1.30 0.47 0.41 0.00 0.00 173.24 174.18 1k1d n ASP 390 N -2.20 2.27 -2.75 2.44 9.92 -0.14 -1.52 116.55 124.58 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 -1.46 7.05 -2.98 2.24 0.00 0.32 -4.65 120.51 121.04 1k1d n ALA 391 Ca 0.13 -2.82 -0.44 0.00 0.00 0.00 0.00 53.44 50.31 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 2.04 6.30 0.26 0.00 1.11 -1.26 -1.97 116.67 123.17 1k1d s ASP 392 Ca 0.68 -1.45 0.09 0.00 0.18 0.00 0.00 52.55 52.05 1k1d s ASP 392 Cb 0.24 -2.36 -0.05 0.00 1.07 0.00 0.00 42.92 41.81 1k1d s ASP 392 CO -0.04 -1.21 -0.15 -0.76 1.18 0.00 0.00 175.17 174.20 1k1d s LEU 393 N 3.11 2.58 -0.07 1.23 1.43 0.43 -0.04 118.68 127.35 1k1d s LEU 393 Ca 0.21 -1.07 -0.01 0.00 -1.03 0.00 0.00 54.13 52.22 1k1d s LEU 393 Cb -0.16 -0.87 0.03 0.00 0.03 0.00 0.00 46.19 45.21 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 -2.76 0.37 -0.50 -1.59 1.01 -0.28 -1.31 120.40 115.34 1k1d s VAL 394 Ca 0.28 0.12 -0.19 0.00 0.00 0.00 0.00 61.98 62.19 1k1d s VAL 394 Cb -0.01 -0.53 0.06 0.00 0.00 0.00 0.00 36.38 35.89 1k1d s VAL 394 CO 0.12 0.26 0.61 -0.63 0.00 0.00 0.00 175.10 175.46 1k1d s ILE 395 N 1.97 4.89 -0.10 2.22 1.01 0.20 -1.20 121.20 130.21 1k1d s ILE 395 Ca 0.05 -0.52 -0.03 0.00 0.00 0.00 0.00 60.65 60.15 1k1d s ILE 395 Cb -0.12 -4.29 -0.03 0.00 0.01 0.00 0.00 42.46 38.02 1k1d s ILE 395 CO -0.05 -0.79 0.04 0.12 0.00 0.00 0.00 174.94 174.25 1k1d s PHE 396 N 2.58 3.27 -0.39 3.97 5.36 -0.11 -0.02 117.98 132.64 1k1d s PHE 396 Ca 0.15 0.28 -0.11 0.00 -0.96 0.00 0.00 56.93 56.28 1k1d s PHE 396 Cb -0.19 -1.83 0.04 0.00 -0.34 0.00 0.00 43.02 40.69 1k1d s PHE 396 CO 0.12 0.53 0.24 0.34 -1.46 0.00 0.00 175.22 174.99 1k1d s ASP 397 N -0.90 5.78 0.00 6.13 -1.08 -0.05 -0.74 116.67 125.80 1k1d s ASP 397 Ca 0.14 -1.10 0.23 0.00 -0.52 0.00 0.00 52.55 51.29 1k1d s ASP 397 Cb -0.12 -2.04 1.17 0.00 -1.46 0.00 0.00 42.92 40.48 1k1d s ASP 397 CO 0.03 -0.44 1.75 -0.81 0.52 0.00 0.00 175.17 176.21 1k1d n PRO 398 N 5.01 0.36 -0.03 4.34 -0.04 -1.26 -0.23 135.00 143.16 1k1d n PRO 398 Ca -0.11 0.06 -0.02 0.00 -0.04 0.00 0.00 63.50 63.39 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 -1.26 3.21 -4.64 3.54 3.02 -1.26 -4.00 115.26 113.87 1k1d n ASN 399 Ca 0.11 0.00 -0.56 0.00 -0.03 0.00 0.00 54.58 54.11 1k1d n ASN 399 Cb 0.17 0.84 -0.07 0.00 -0.61 0.00 0.00 39.78 40.11 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 0.30 -3.61 2.41 5.41 -1.26 -4.49 119.36 115.97 1k1d n ILE 400 Ca -0.09 -0.10 -0.36 0.00 1.00 0.00 0.00 62.75 63.20 1k1d n ILE 400 Cb 0.61 -1.33 -0.06 0.00 -0.71 0.00 0.00 39.64 38.15 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 4.25 3.74 0.39 0.38 2.02 -1.26 -0.08 118.70 128.13 1k1d s GLU 401 Ca 1.01 0.16 -0.15 0.00 0.02 0.00 0.00 54.97 56.02 1k1d s GLU 401 Cb -1.02 -3.08 0.06 0.00 0.10 0.00 0.00 34.13 30.19 1k1d s GLU 401 CO 0.62 0.63 0.78 2.89 0.02 0.00 0.00 175.26 180.19 1k1d n ARG 402 N 1.25 1.12 -4.28 1.61 1.85 0.01 -4.99 116.66 113.23 1k1d n ARG 402 Ca -0.11 -2.20 -0.26 0.00 -1.00 0.00 0.00 57.85 54.28 1k1d n ARG 402 Cb 0.53 2.74 -0.17 0.00 -1.05 0.00 0.00 32.46 34.51 1k1d n ARG 402 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1k1d s VAL 403 N -2.12 1.10 0.02 8.89 1.01 -1.26 0.10 120.40 128.15 1k1d s VAL 403 Ca 0.16 -0.41 -0.30 0.00 0.00 0.00 0.00 61.98 61.43 1k1d s VAL 403 Cb -0.05 -1.06 -0.06 0.00 0.00 0.00 0.00 36.38 35.21 1k1d s VAL 403 CO 0.12 0.36 1.45 -0.63 0.00 0.00 0.00 175.10 176.40 1k1d s ILE 404 N 1.12 3.55 -0.09 2.22 1.01 0.10 -4.86 121.20 124.24 1k1d s ILE 404 Ca -0.06 0.97 -0.09 0.00 0.00 0.00 0.00 60.65 61.47 1k1d s ILE 404 Cb -0.14 -3.62 0.02 0.00 0.01 0.00 0.00 42.46 38.73 1k1d s ILE 404 CO -0.02 0.01 0.25 -0.55 0.00 0.00 0.00 174.94 174.62 1k1d s SER 405 N 1.90 -0.26 0.51 3.58 0.15 -1.26 0.34 113.70 118.66 1k1d s SER 405 Ca 0.66 0.49 0.34 0.00 0.70 0.00 0.00 55.95 58.14 1k1d s SER 405 Cb -0.33 0.50 1.77 0.00 -1.71 0.00 0.00 66.02 66.24 1k1d s SER 405 CO 0.28 -0.09 2.04 0.00 1.20 0.00 0.00 173.24 176.68 1k1d h ALA 406 N 5.75 1.00 0.00 5.45 0.00 -1.90 0.72 119.26 130.28 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 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1k1d h ALA 406 CO 0.35 0.00 0.00 -1.91 0.00 0.00 0.00 179.25 177.69 1k1d n GLU 407 N -2.76 0.20 0.00 0.00 4.07 -1.26 -3.70 120.64 117.19 1k1d n GLU 407 Ca -0.01 0.41 0.00 0.00 -0.06 0.00 0.00 57.16 57.49 1k1d n GLU 407 Cb 0.11 -1.87 0.00 0.00 -0.06 0.00 0.00 31.44 29.62 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 -2.25 0.00 -1.01 6.31 -1.04 0.23 -5.07 114.28 111.45 1k1d n THR 408 Ca 0.02 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.69 1k1d n THR 408 Cb 0.24 -0.87 0.11 0.00 -1.82 0.00 0.00 70.33 67.99 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 -1.95 -0.33 -1.02 -1.42 1.44 0.24 -4.92 115.22 107.25 1k1d n HIS 409 Ca 0.00 0.33 0.04 0.00 -2.01 0.00 0.00 57.72 56.08 1k1d n HIS 409 Cb 0.46 -1.93 0.30 0.00 0.12 0.00 0.00 29.99 28.95 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 -3.20 1.55 -3.44 -1.40 -0.00 -1.26 -4.96 115.22 102.51 1k1d n HIS 410 Ca 0.10 -0.97 -0.30 0.00 -0.00 0.00 0.00 57.72 56.55 1k1d n HIS 410 Cb 0.51 -0.46 -0.04 0.00 -0.00 0.00 0.00 29.99 30.01 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 -2.89 3.70 0.00 -0.41 -1.94 -1.26 -4.27 119.30 112.22 1k1d s MET 411 Ca 0.48 0.09 0.00 0.00 -1.71 0.00 0.00 55.69 54.55 1k1d s MET 411 Cb 0.39 -2.69 0.00 0.00 2.01 0.00 0.00 34.83 34.54 1k1d s MET 411 CO 0.11 0.31 0.81 0.00 -0.01 0.00 0.00 175.02 176.24 1k1d n ALA 412 N -0.42 2.34 -2.15 3.03 0.00 -1.26 -4.86 120.51 117.20 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 4.68 -2.00 0.00 -7.23 -1.26 -4.85 120.40 107.81 1k1d s VAL 413 Ca 0.00 0.96 0.22 0.00 -1.81 0.00 0.00 61.98 61.34 1k1d s VAL 413 Cb 0.00 -3.63 0.62 0.00 0.56 0.00 0.00 36.38 33.93 1k1d s VAL 413 CO 0.00 -0.15 1.75 -0.90 -0.31 0.00 0.00 175.10 175.49 1k1d n ASP 414 N -0.27 0.00 -3.79 4.85 5.68 -1.26 -4.85 116.55 116.90 1k1d n ASP 414 Ca 0.03 -1.04 -0.10 0.00 -0.50 0.00 0.00 54.79 53.18 1k1d n ASP 414 Cb 0.53 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.46 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 0.45 -0.05 2.11 1.13 -1.26 -4.92 117.35 112.81 1k1d s TYR 415 Ca 0.33 -0.82 -0.02 0.00 -1.41 0.00 0.00 57.07 55.15 1k1d s TYR 415 Cb 0.15 0.20 0.03 0.00 -1.10 0.00 0.00 41.96 41.24 1k1d s TYR 415 CO 0.25 -1.07 0.06 1.21 -2.51 0.00 0.00 175.55 173.50 1k1d s ASN 416 N -3.06 1.25 0.53 -0.18 3.84 -1.26 -4.88 114.94 111.19 1k1d s ASN 416 Ca 0.23 0.02 0.22 0.00 0.21 0.00 0.00 52.86 53.54 1k1d s ASN 416 Cb -0.01 -0.16 1.19 0.00 -0.55 0.00 0.00 41.25 41.72 1k1d s ASN 416 CO 0.11 -0.26 1.63 0.00 -2.79 0.00 0.00 177.10 175.80 1k1d h ALA 417 N 8.43 1.30 -0.33 1.71 0.00 -1.90 -0.22 119.26 128.26 1k1d h ALA 417 Ca -0.13 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.61 1k1d h ALA 417 Cb 1.12 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.81 1k1d h ALA 417 CO 0.17 -0.30 -0.12 1.19 0.00 0.00 0.00 179.25 180.18 1k1d n PHE 418 N -2.53 1.02 -1.67 0.00 3.72 -1.26 -5.04 117.46 111.70 1k1d n PHE 418 Ca -0.01 -1.62 -0.47 0.00 -0.05 0.00 0.00 57.45 55.30 1k1d n PHE 418 Cb 0.38 -0.48 -0.04 0.00 -0.94 0.00 0.00 39.48 38.40 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 -1.13 2.10 -0.03 -1.08 4.07 -0.10 -1.20 120.64 123.28 1k1d n GLU 419 Ca 0.32 0.76 0.00 0.00 -0.06 0.00 0.00 57.16 58.18 1k1d n GLU 419 Cb 1.01 -2.53 0.00 0.00 -0.06 0.00 0.00 31.44 29.86 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 3.49 2.42 3.72 8.31 0.00 0.15 -4.99 105.19 118.30 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 -0.17 4.30 0.05 1.61 0.00 -0.34 -4.73 119.30 120.02 1k1d s MET 421 Ca 0.00 2.14 -0.25 0.00 0.00 0.00 0.00 55.69 57.58 1k1d s MET 421 Cb 0.00 -3.22 -0.06 0.00 0.00 0.00 0.00 34.83 31.56 1k1d s MET 421 CO 0.00 -0.46 0.76 0.21 0.00 0.00 0.00 175.02 175.54 1k1d s LYS 422 N 0.95 4.49 0.00 4.11 2.20 -1.26 0.00 119.74 130.24 1k1d s LYS 422 Ca 0.65 1.06 0.01 0.00 -0.36 0.00 0.00 55.97 57.33 1k1d s LYS 422 Cb -0.38 -3.36 -0.01 0.00 -1.51 0.00 0.00 37.83 32.57 1k1d s LYS 422 CO 0.32 0.30 -0.04 0.08 -0.36 0.00 0.00 175.35 175.64 1k1d s VAL 423 N -0.10 0.33 -0.14 4.02 1.01 0.12 -4.95 120.40 120.68 1k1d s VAL 423 Ca 0.38 -0.30 -0.05 0.00 0.00 0.00 0.00 61.98 62.01 1k1d s VAL 423 Cb -0.21 -0.31 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 1k1d s VAL 423 CO 0.23 0.01 0.04 -0.89 0.00 0.00 0.00 175.10 174.49 1k1d s THR 424 N -0.29 4.59 0.00 3.92 2.01 -1.26 -0.81 115.64 123.80 1k1d s THR 424 Ca -0.00 -0.12 0.00 0.00 0.31 0.00 0.00 61.69 61.88 1k1d s THR 424 Cb -0.03 -3.02 0.00 0.00 0.01 0.00 0.00 72.50 69.47 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 2.96 1.36 3.62 4.40 0.00 0.88 -3.99 105.19 114.42 1k1d n GLY 425 Ca -0.18 -1.57 -0.13 0.00 0.00 0.00 0.00 46.02 44.14 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 -4.71 0.76 0.19 1.61 2.12 0.68 -4.90 118.70 114.45 1k1d s GLU 426 Ca 0.00 0.76 -0.30 0.00 0.36 0.00 0.00 54.97 55.78 1k1d s GLU 426 Cb 0.00 0.37 -0.09 0.00 0.26 0.00 0.00 34.13 34.67 1k1d s GLU 426 CO 0.00 -0.12 1.37 -2.14 -0.54 0.00 0.00 175.26 173.82 1k1d s PRO 427 N 0.07 4.34 -0.21 4.30 0.02 -1.26 -0.87 135.00 141.38 1k1d s PRO 427 Ca -0.01 2.12 -0.07 0.00 0.02 0.00 0.00 61.00 63.07 1k1d s PRO 427 Cb -0.04 -3.19 -0.11 0.00 0.02 0.00 0.00 34.50 31.19 1k1d s PRO 427 CO 0.00 -0.35 -0.25 0.28 -0.33 0.00 0.00 177.00 176.36 1k1d n VAL 428 N 2.93 1.18 -4.07 3.83 0.31 0.97 -4.64 118.33 118.85 1k1d n VAL 428 Ca 0.08 -0.35 -0.18 0.00 -0.01 0.00 0.00 64.34 63.88 1k1d n VAL 428 Cb 0.42 -1.60 -0.16 0.00 -0.91 0.00 0.00 33.84 31.59 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 -6.62 0.67 -0.18 4.52 0.01 -0.97 -0.13 113.70 111.00 1k1d s SER 429 Ca -0.29 -0.08 0.00 0.00 1.31 0.00 0.00 55.95 56.89 1k1d s SER 429 Cb 0.10 -0.31 0.04 0.00 0.21 0.00 0.00 66.02 66.06 1k1d s SER 429 CO 0.41 -0.06 -0.08 -0.69 0.41 0.00 0.00 173.24 173.24 1k1d s VAL 430 N 0.83 1.33 -0.03 3.43 1.01 0.23 0.63 120.40 127.83 1k1d s VAL 430 Ca -0.10 -0.77 0.07 0.00 0.00 0.00 0.00 61.98 61.19 1k1d s VAL 430 Cb -0.13 -1.46 -0.02 0.00 0.00 0.00 0.00 36.38 34.78 1k1d s VAL 430 CO -0.01 0.16 -0.26 -1.48 0.00 0.00 0.00 175.10 173.52 1k1d s LEU 431 N 1.54 2.05 -0.25 3.92 2.34 -0.43 -0.45 118.68 127.40 1k1d s LEU 431 Ca 0.00 -0.48 -0.05 0.00 0.06 0.00 0.00 54.13 53.66 1k1d s LEU 431 Cb -0.15 -1.34 -0.00 0.00 -0.56 0.00 0.00 46.19 44.13 1k1d s LEU 431 CO -0.08 0.30 0.02 0.00 -1.06 0.00 0.00 176.35 175.52 1k1d n ARG 433 N 4.83 -2.05 0.00 0.00 1.74 -0.85 -2.55 116.66 117.78 1k1d n ARG 433 Ca -0.16 0.65 0.00 0.00 -0.77 0.00 0.00 57.85 57.56 1k1d n ARG 433 Cb 0.50 -4.96 0.00 0.00 -1.02 0.00 0.00 32.46 26.98 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 -1.47 1.51 3.69 -0.13 0.00 -0.83 -4.49 105.19 103.46 1k1d n GLY 434 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 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 3.42 0.35 1.61 0.41 -1.06 -4.98 118.70 118.45 1k1d s GLU 435 Ca 0.00 -0.35 -0.28 0.00 -0.41 0.00 0.00 54.97 53.93 1k1d s GLU 435 Cb 0.00 -3.00 -0.10 0.00 -1.78 0.00 0.00 34.13 29.26 1k1d s GLU 435 CO 0.00 0.55 1.28 -0.06 -0.49 0.00 0.00 175.26 176.54 1k1d s PHE 436 N -0.43 3.04 -0.05 1.61 0.40 -1.26 -0.68 117.98 120.60 1k1d s PHE 436 Ca 0.09 1.44 0.05 0.00 -0.60 0.00 0.00 56.93 57.91 1k1d s PHE 436 Cb -0.12 -3.64 -0.07 0.00 0.51 0.00 0.00 43.02 39.71 1k1d s PHE 436 CO 0.02 -1.79 0.03 0.28 0.70 0.00 0.00 175.22 174.46 1k1d n VAL 437 N 0.64 0.33 -3.47 -0.44 0.31 0.40 -4.27 118.33 111.83 1k1d n VAL 437 Ca 0.01 -0.21 -0.16 0.00 -0.01 0.00 0.00 64.34 63.97 1k1d n VAL 437 Cb 0.43 -0.77 -0.12 0.00 -0.91 0.00 0.00 33.84 32.47 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 -2.14 -0.40 -0.13 2.52 1.01 -0.61 -1.57 120.40 119.07 1k1d s VAL 438 Ca -0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.86 1k1d s VAL 438 Cb 0.02 -0.70 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 1k1d s VAL 438 CO 0.21 -0.17 -0.11 -0.60 0.00 0.00 0.00 175.10 174.44 1k1d s ARG 439 N 2.38 3.41 -1.16 2.72 3.52 -0.23 0.75 118.95 130.34 1k1d s ARG 439 Ca 0.08 -0.64 -0.21 0.00 -0.13 0.00 0.00 55.73 54.83 1k1d s ARG 439 Cb -0.15 -2.69 -0.00 0.00 -1.56 0.00 0.00 34.95 30.54 1k1d s ARG 439 CO -0.13 0.25 0.76 -0.25 -0.81 0.00 0.00 175.30 175.12 1k1d n ASP 440 N 3.45 -4.84 -2.04 -2.12 8.00 -0.33 -1.33 116.55 117.34 1k1d n ASP 440 Ca -0.18 -1.04 -0.10 0.00 0.71 0.00 0.00 54.79 54.18 1k1d n ASP 440 Cb 0.53 -3.20 -0.02 0.00 -0.02 0.00 0.00 41.12 38.41 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 -4.28 -1.98 -4.31 -1.24 5.02 0.82 -4.92 118.16 107.26 1k1d n LYS 441 Ca -0.11 0.50 -0.21 0.00 -2.02 0.00 0.00 58.31 56.47 1k1d n LYS 441 Cb 0.59 -4.94 -0.16 0.00 -0.02 0.00 0.00 35.03 30.51 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 -4.25 1.02 0.20 1.97 -0.44 -0.44 -5.13 119.66 112.59 1k1d s GLN 442 Ca 0.00 -0.22 -0.30 0.00 -2.50 0.00 0.00 55.36 52.34 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 1.40 0.12 0.50 0.00 0.00 175.29 177.31 1k1d s PHE 443 N 0.63 3.14 0.00 1.67 5.36 -1.26 -1.07 117.98 126.45 1k1d s PHE 443 Ca -0.10 1.03 0.00 0.00 -0.96 0.00 0.00 56.93 56.90 1k1d s PHE 443 Cb -0.13 -3.74 0.00 0.00 -0.34 0.00 0.00 43.02 38.81 1k1d s PHE 443 CO 0.01 -2.45 0.53 1.33 -1.46 0.00 0.00 175.22 173.17 1k1d n VAL 444 N 2.90 0.00 -1.45 3.12 0.24 -0.61 -4.90 118.33 117.62 1k1d n VAL 444 Ca 0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.38 1k1d n VAL 444 Cb 0.41 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.64 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 -0.39 3.00 7.63 0.00 -1.00 -4.80 105.19 109.63 1k1d n GLY 445 Ca 0.00 -1.78 -0.13 0.00 0.00 0.00 0.00 46.02 44.11 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 -2.67 0.16 0.09 1.61 1.02 -1.26 -5.09 119.74 113.61 1k1d s LYS 446 Ca 0.00 0.62 -0.34 0.00 0.02 0.00 0.00 55.97 56.28 1k1d s LYS 446 Cb 0.00 -0.10 -0.13 0.00 -0.52 0.00 0.00 37.83 37.08 1k1d s LYS 446 CO 0.00 -0.23 1.69 -0.35 -0.92 0.00 0.00 175.35 175.54 1k1d n PRO 447 N 4.83 2.26 0.00 -1.68 -0.04 -1.26 -1.46 135.00 137.65 1k1d n PRO 447 Ca -0.15 0.82 0.00 0.00 -0.04 0.00 0.00 63.50 64.13 1k1d n PRO 447 Cb 0.51 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.34 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 3.79 2.34 0.25 0.55 0.00 0.16 -4.56 105.19 107.72 1k1d n GLY 448 Ca 0.18 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.20 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 0.45 -3.81 1.61 3.20 -0.75 -3.43 116.97 114.24 1k1d h TYR 449 Ca 0.00 -0.06 -0.52 0.00 3.14 0.00 0.00 58.73 61.28 1k1d h TYR 449 Cb 0.00 -0.12 0.06 0.00 1.54 0.00 0.00 36.73 38.21 1k1d h TYR 449 CO 0.00 0.54 0.63 0.20 -1.64 0.00 0.00 178.16 177.89 1k1d s GLY 450 N -3.97 2.93 0.13 1.82 0.00 0.44 -4.86 107.32 103.81 1k1d s GLY 450 Ca -0.07 1.21 0.10 0.00 0.00 0.00 0.00 44.72 45.97 1k1d s GLY 450 CO 0.76 1.90 -0.24 -0.86 0.00 0.00 0.00 173.10 174.66 1k1d s GLN 451 N -1.55 1.30 0.72 2.90 -2.07 -1.26 -4.69 119.66 115.02 1k1d s GLN 451 Ca 0.49 -1.30 -0.15 0.00 -1.82 0.00 0.00 55.36 52.58 1k1d s GLN 451 Cb -0.39 -1.66 0.03 0.00 -1.09 0.00 0.00 33.01 29.90 1k1d s GLN 451 CO 0.50 0.38 1.21 -0.47 -1.32 0.00 0.00 175.29 175.59 1k1d s TYR 452 N -1.24 2.08 -0.13 9.60 5.04 -1.26 -2.42 117.35 129.03 1k1d s TYR 452 Ca 0.12 1.59 0.01 0.00 -2.44 0.00 0.00 57.07 56.35 1k1d s TYR 452 Cb -0.09 -3.47 0.02 0.00 0.35 0.00 0.00 41.96 38.77 1k1d s TYR 452 CO 0.06 -2.57 -0.13 -0.51 -1.34 0.00 0.00 175.55 171.06 1k1d s LEU 453 N -5.08 1.56 0.03 6.97 1.43 0.17 -4.82 118.68 118.95 1k1d s LEU 453 Ca 0.74 -0.42 -0.25 0.00 -1.03 0.00 0.00 54.13 53.17 1k1d s LEU 453 Cb -0.29 -1.06 -0.05 0.00 0.03 0.00 0.00 46.19 44.82 1k1d s LEU 453 CO 0.44 -0.05 0.78 -0.54 0.23 0.00 0.00 176.35 177.22 1k1d s LYS 454 N 1.39 4.50 0.13 1.70 1.02 -1.26 -4.57 119.74 122.65 1k1d s LYS 454 Ca 0.01 1.08 0.06 0.00 0.02 0.00 0.00 55.97 57.15 1k1d s LYS 454 Cb -0.13 -3.39 -0.04 0.00 -0.52 0.00 0.00 37.83 33.75 1k1d s LYS 454 CO -0.07 0.21 0.00 1.03 -0.92 0.00 0.00 175.35 175.60 1k1d s ARG 455 N 0.19 2.49 0.82 1.68 0.52 0.14 -4.80 118.95 119.98 1k1d s ARG 455 Ca 0.40 -0.95 -0.14 0.00 -0.52 0.00 0.00 55.73 54.52 1k1d s ARG 455 Cb -0.20 -2.47 0.03 0.00 0.52 0.00 0.00 34.95 32.83 1k1d s ARG 455 CO 0.23 0.50 0.77 0.00 0.02 0.00 0.00 175.30 176.82 1k1d n ALA 456 N 0.28 -1.22 0.86 2.13 0.00 -0.36 -4.61 120.51 117.59 1k1d n ALA 456 Ca -0.10 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1k1d n ALA 456 Cb 0.53 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 17.98 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 -2.06 0.86 -1.27 0.00 4.81 -1.26 -4.51 118.16 114.73 1k1d n LYS 457 Ca 0.11 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.49 1k1d n LYS 457 Cb 0.51 -1.08 -0.02 0.00 0.02 0.00 0.00 35.03 34.46 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 0.56 -0.03 -2.80 5.64 9.36 -1.26 -4.46 117.16 124.16 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 0.43 -1.35 0.00 0.00 -0.63 0.00 0.00 39.34 37.79 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 -2.16 6.92 0.00 2.98 0.00 -1.26 -5.05 105.19 106.62 1k1d n GLY 459 Ca -0.06 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.09 1k1d n GLY 459 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73