#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y5a s VAL 17 N 0.00 5.32 -0.00 1.39 1.01 -0.09 -3.97 120.40 124.05 1y5a s VAL 17 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1y5a s VAL 17 Cb 0.00 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.97 1y5a s VAL 17 CO 0.00 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.17 1y5a n GLY 18 N 3.35 0.46 0.00 4.51 0.00 -1.22 -1.52 105.19 110.77 1y5a n GLY 18 Ca -0.17 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1y5a n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y5a n GLY 19 N -2.98 1.79 3.14 -0.02 0.00 -1.26 -4.85 105.19 101.01 1y5a n GLY 19 Ca -0.00 -2.01 -0.09 0.00 0.00 0.00 0.00 46.02 43.92 1y5a n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1y5a s TYR 20 N 1.98 0.75 -0.03 1.61 1.13 -0.01 -4.94 117.35 117.83 1y5a s TYR 20 Ca 0.00 -0.98 -0.30 0.00 -1.41 0.00 0.00 57.07 54.38 1y5a s TYR 20 Cb 0.00 -0.47 -0.07 0.00 -1.10 0.00 0.00 41.96 40.32 1y5a s TYR 20 CO 0.00 -0.24 1.83 0.99 -2.51 0.00 0.00 175.55 175.62 1y5a s THR 21 N -3.75 3.29 0.25 -3.49 2.01 -1.26 -0.34 115.64 112.35 1y5a s THR 21 Ca 0.10 0.34 -0.05 0.00 0.31 0.00 0.00 61.69 62.40 1y5a s THR 21 Cb 0.06 -3.23 0.18 0.00 0.01 0.00 0.00 72.50 69.52 1y5a s THR 21 CO -0.07 -0.04 1.83 0.00 -0.69 0.00 0.00 174.62 175.65 1y5a n GLY 23 N -0.97 2.25 3.67 0.00 0.00 -1.26 -4.83 105.19 104.05 1y5a n GLY 23 Ca 0.07 -1.51 -0.49 0.00 0.00 0.00 0.00 46.02 44.09 1y5a n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y5a n ALA 24 N 1.96 0.76 -1.53 4.61 0.00 -1.26 -2.39 120.51 122.66 1y5a n ALA 24 Ca 0.00 0.36 -0.16 0.00 0.00 0.00 0.00 53.44 53.64 1y5a n ALA 24 Cb 0.00 -2.39 -0.06 0.00 0.00 0.00 0.00 19.45 16.99 1y5a n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1y5a n ASN 25 N 5.25 -4.92 -0.13 0.00 5.03 -1.26 -4.86 115.26 114.37 1y5a n ASN 25 Ca 0.21 0.36 0.14 0.00 0.87 0.00 0.00 54.58 56.17 1y5a n ASN 25 Cb 0.27 -3.85 0.66 0.00 -1.02 0.00 0.00 39.78 35.84 1y5a n ASN 25 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1y5a n THR 26 N -2.66 0.00 -3.43 3.41 -2.24 -1.01 -3.92 114.28 104.44 1y5a n THR 26 Ca -0.16 -0.07 -0.26 0.00 -2.27 0.00 0.00 64.05 61.29 1y5a n THR 26 Cb 0.54 -0.12 -0.08 0.00 -2.10 0.00 0.00 70.33 68.57 1y5a n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1y5a n VAL 27 N -0.87 1.32 0.58 2.28 0.31 -1.26 -5.00 118.33 115.69 1y5a n VAL 27 Ca 0.16 -4.78 0.08 0.00 -0.01 0.00 0.00 64.34 59.80 1y5a n VAL 27 Cb 0.26 -2.05 0.36 0.00 -0.91 0.00 0.00 33.84 31.50 1y5a n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1y5a n PRO 28 N 1.26 0.00 0.01 5.55 -0.04 -1.25 -1.64 135.00 138.89 1y5a n PRO 28 Ca 0.26 0.21 0.12 0.00 -0.04 0.00 0.00 63.50 64.06 1y5a n PRO 28 Cb 0.43 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.69 1y5a n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1y5a n TYR 29 N -1.50 0.07 -2.27 0.54 0.18 -1.11 -1.62 117.16 111.46 1y5a n TYR 29 Ca 0.04 0.02 -0.42 0.00 1.88 0.00 0.00 57.90 59.42 1y5a n TYR 29 Cb 0.20 -0.34 -0.03 0.00 -0.38 0.00 0.00 39.34 38.79 1y5a n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1y5a s GLN 30 N -3.02 4.31 0.27 -3.48 2.00 -0.65 -1.20 119.66 117.88 1y5a s GLN 30 Ca 0.11 1.92 0.11 0.00 -2.00 0.00 0.00 55.36 55.49 1y5a s GLN 30 Cb 0.17 -3.53 -0.05 0.00 0.80 0.00 0.00 33.01 30.41 1y5a s GLN 30 CO 0.68 -0.52 -0.11 0.14 -0.50 0.00 0.00 175.29 174.97 1y5a s VAL 31 N 2.18 2.93 -0.14 1.34 -7.23 0.06 -4.54 120.40 115.00 1y5a s VAL 31 Ca 0.62 -2.15 -0.03 0.00 -1.81 0.00 0.00 61.98 58.62 1y5a s VAL 31 Cb -0.31 -2.54 -0.03 0.00 0.56 0.00 0.00 36.38 34.06 1y5a s VAL 31 CO 0.26 -0.37 -0.05 -0.55 -0.31 0.00 0.00 175.10 174.09 1y5a s SER 32 N -3.52 4.72 -0.20 4.85 0.15 -0.58 -2.06 113.70 117.06 1y5a s SER 32 Ca 0.30 -0.12 -0.15 0.00 0.70 0.00 0.00 55.95 56.67 1y5a s SER 32 Cb -0.06 -1.69 -0.04 0.00 -1.71 0.00 0.00 66.02 62.52 1y5a s SER 32 CO 0.17 0.20 0.38 -0.76 1.20 0.00 0.00 173.24 174.43 1y5a s LEU 33 N 0.18 4.16 -0.08 3.45 1.43 0.15 -0.92 118.68 127.05 1y5a s LEU 33 Ca -0.02 0.50 0.03 0.00 -1.03 0.00 0.00 54.13 53.61 1y5a s LEU 33 Cb -0.14 -2.48 0.00 0.00 0.03 0.00 0.00 46.19 43.60 1y5a s LEU 33 CO 0.03 -0.05 -0.19 0.21 0.23 0.00 0.00 176.35 176.58 1y5a s ASN 34 N 0.99 2.52 -0.35 2.29 3.84 -0.15 -1.12 114.94 122.96 1y5a s ASN 34 Ca 0.18 -0.44 0.12 0.00 0.21 0.00 0.00 52.86 52.93 1y5a s ASN 34 Cb -0.15 -1.09 0.45 0.00 -0.55 0.00 0.00 41.25 39.92 1y5a s ASN 34 CO 0.07 0.12 1.06 -1.54 -2.79 0.00 0.00 177.10 174.02 1y5a n SER 37 N 3.56 3.17 0.00 -4.21 3.41 -1.26 -1.24 113.62 117.06 1y5a n SER 37 Ca -0.20 -3.15 0.00 0.00 -0.26 0.00 0.00 58.87 55.26 1y5a n SER 37 Cb 0.52 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 1y5a n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y5a n GLY 38 N -0.37 0.72 3.57 5.00 0.00 -1.26 -5.01 105.19 107.84 1y5a n GLY 38 Ca 0.25 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.19 1y5a n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1y5a s TYR 39 N -2.08 -0.28 0.19 1.61 -0.85 -1.26 -5.14 117.35 109.54 1y5a s TYR 39 Ca 0.00 0.38 -0.31 0.00 -0.52 0.00 0.00 57.07 56.62 1y5a s TYR 39 Cb 0.00 0.48 -0.10 0.00 0.38 0.00 0.00 41.96 42.72 1y5a s TYR 39 CO 0.00 -0.32 1.52 -1.58 -1.52 0.00 0.00 175.55 173.65 1y5a s HIS 40 N -1.71 3.06 0.00 -3.49 5.65 -1.26 -4.24 115.29 113.29 1y5a s HIS 40 Ca 0.03 0.76 0.00 0.00 0.25 0.00 0.00 55.06 56.10 1y5a s HIS 40 Cb -0.01 -3.88 0.00 0.00 -1.18 0.00 0.00 32.58 27.51 1y5a s HIS 40 CO -0.03 -3.15 0.00 1.97 -0.65 0.00 0.00 174.74 172.89 1y5a n PHE 41 N 3.48 0.00 -3.48 3.88 -1.74 -0.27 -4.96 117.46 114.38 1y5a n PHE 41 Ca 0.12 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.90 1y5a n PHE 41 Cb 0.39 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.37 1y5a n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1y5a s GLY 43 N -2.36 1.76 0.18 0.00 0.00 0.55 -0.67 107.32 106.78 1y5a s GLY 43 Ca 0.01 -1.52 -0.23 0.00 0.00 0.00 0.00 44.72 42.97 1y5a s GLY 43 CO -0.08 -0.95 0.97 -0.32 0.00 0.00 0.00 173.10 172.72 1y5a s GLY 44 N -4.72 -0.09 -0.07 0.20 0.00 -0.87 -3.75 107.32 98.02 1y5a s GLY 44 Ca 0.67 -0.08 0.01 0.00 0.00 0.00 0.00 44.72 45.32 1y5a s GLY 44 CO 0.46 0.67 -0.09 -0.56 0.00 0.00 0.00 173.10 173.58 1y5a s SER 45 N -3.09 1.61 -0.08 1.64 0.01 -0.05 -0.76 113.70 112.98 1y5a s SER 45 Ca 0.15 -0.24 -0.30 0.00 1.31 0.00 0.00 55.95 56.87 1y5a s SER 45 Cb -0.02 -0.71 -0.03 0.00 0.21 0.00 0.00 66.02 65.47 1y5a s SER 45 CO 0.04 -0.03 1.24 -0.22 0.41 0.00 0.00 173.24 174.67 1y5a s LEU 46 N 0.99 4.26 -0.00 2.44 2.96 -0.34 -0.62 118.68 128.37 1y5a s LEU 46 Ca -0.09 1.81 0.08 0.00 -0.22 0.00 0.00 54.13 55.71 1y5a s LEU 46 Cb -0.15 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 42.89 1y5a s LEU 46 CO 0.00 -0.64 0.29 2.30 -1.32 0.00 0.00 176.35 176.98 1y5a n ILE 47 N 4.81 0.00 -3.57 6.68 -5.35 -0.06 -1.20 119.36 120.67 1y5a n ILE 47 Ca 0.12 -0.27 -0.05 0.00 -0.27 0.00 0.00 62.75 62.29 1y5a n ILE 47 Cb 0.46 0.76 0.02 0.00 -1.74 0.00 0.00 39.64 39.13 1y5a n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1y5a n ASN 48 N -1.40 -1.37 0.14 7.28 0.23 -1.19 -4.60 115.26 114.36 1y5a n ASN 48 Ca 0.00 -1.89 0.11 0.00 -0.53 0.00 0.00 54.58 52.28 1y5a n ASN 48 Cb 0.16 2.27 0.53 0.00 -2.08 0.00 0.00 39.78 40.65 1y5a n ASN 48 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1y5a n SER 49 N -1.25 0.60 -0.04 0.53 3.41 -1.26 -2.95 113.62 112.65 1y5a n SER 49 Ca -0.04 0.71 0.02 0.00 -0.26 0.00 0.00 58.87 59.29 1y5a n SER 49 Cb 0.38 -0.81 -0.01 0.00 -0.26 0.00 0.00 64.21 63.51 1y5a n SER 49 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1y5a n GLN 50 N -2.23 4.16 -4.00 4.33 6.02 -1.26 -0.56 117.38 123.85 1y5a n GLN 50 Ca 0.00 -0.20 -0.13 0.00 -0.01 0.00 0.00 57.00 56.67 1y5a n GLN 50 Cb 0.13 -0.77 -0.14 0.00 1.02 0.00 0.00 30.24 30.48 1y5a n GLN 50 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1y5a s TRP 51 N -1.04 0.25 -0.02 1.08 0.52 -1.15 -0.85 118.94 117.72 1y5a s TRP 51 Ca 0.02 -0.14 0.08 0.00 0.02 0.00 0.00 56.10 56.08 1y5a s TRP 51 Cb 0.03 -0.16 -0.02 0.00 -1.15 0.00 0.00 33.47 32.17 1y5a s TRP 51 CO 0.11 -0.03 -0.26 0.08 0.02 0.00 0.00 176.95 176.88 1y5a s VAL 52 N -0.33 2.10 -0.19 4.03 1.01 -0.11 -0.88 120.40 126.02 1y5a s VAL 52 Ca -0.02 -1.12 -0.10 0.00 0.00 0.00 0.00 61.98 60.74 1y5a s VAL 52 Cb -0.03 -1.73 -0.05 0.00 0.00 0.00 0.00 36.38 34.57 1y5a s VAL 52 CO -0.00 0.56 0.15 -0.69 0.00 0.00 0.00 175.10 175.12 1y5a s VAL 53 N -0.63 5.40 0.22 2.92 1.01 0.21 -0.98 120.40 128.55 1y5a s VAL 53 Ca 0.10 0.24 0.04 0.00 0.00 0.00 0.00 61.98 62.36 1y5a s VAL 53 Cb -0.10 -3.49 -0.01 0.00 0.00 0.00 0.00 36.38 32.78 1y5a s VAL 53 CO -0.01 0.44 0.21 -0.24 0.00 0.00 0.00 175.10 175.50 1y5a n SER 54 N 3.51 -0.54 -4.73 3.32 2.88 -0.38 -0.87 113.62 116.80 1y5a n SER 54 Ca -0.16 -2.41 -0.41 0.00 -1.33 0.00 0.00 58.87 54.57 1y5a n SER 54 Cb 0.52 1.20 -0.05 0.00 -0.75 0.00 0.00 64.21 65.14 1y5a n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1y5a s ALA 55 N -2.80 3.29 0.47 -1.46 0.00 -1.26 -0.85 121.76 119.15 1y5a s ALA 55 Ca 0.25 0.64 0.14 0.00 0.00 0.00 0.00 51.96 52.98 1y5a s ALA 55 Cb 0.01 -3.28 1.11 0.00 0.00 0.00 0.00 23.12 20.96 1y5a s ALA 55 CO 0.18 -0.02 2.08 0.00 0.00 0.00 0.00 175.76 177.99 1y5a h ALA 56 N 5.21 1.96 0.00 0.00 0.00 -1.68 -1.06 119.26 123.69 1y5a h ALA 56 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1y5a h ALA 56 Cb 1.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1y5a h ALA 56 CO 0.71 -0.00 0.00 -2.39 0.00 0.00 0.00 179.25 177.57 1y5a n HIS 57 N -4.49 0.00 1.43 0.00 1.44 -1.26 -1.33 115.22 111.01 1y5a n HIS 57 Ca 0.02 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.87 1y5a n HIS 57 Cb 0.18 -0.32 0.47 0.00 0.12 0.00 0.00 29.99 30.44 1y5a n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1y5a n TYR 59 N 0.34 1.96 -3.70 0.00 9.36 -0.44 -4.99 117.16 119.68 1y5a n TYR 59 Ca 0.18 0.53 -0.06 0.00 3.32 0.00 0.00 57.90 61.87 1y5a n TYR 59 Cb 0.39 -2.40 -0.02 0.00 -0.63 0.00 0.00 39.34 36.68 1y5a n TYR 59 CO 0.00 0.00 0.00 -1.59 0.22 0.00 0.00 176.86 175.49 1y5a s LYS 60 N -0.91 1.32 0.57 2.98 -2.85 -1.26 -5.14 119.74 114.44 1y5a s LYS 60 Ca 0.64 -0.67 -0.09 0.00 -1.00 0.00 0.00 55.97 54.86 1y5a s LYS 60 Cb -0.66 0.49 -0.04 0.00 -2.06 0.00 0.00 37.83 35.56 1y5a s LYS 60 CO 0.54 -0.60 0.93 -1.54 0.10 0.00 0.00 175.35 174.79 1y5a s SER 61 N -2.83 6.23 -0.55 0.03 1.04 -1.26 -4.49 113.70 111.86 1y5a s SER 61 Ca 0.09 1.21 -0.03 0.00 0.48 0.00 0.00 55.95 57.71 1y5a s SER 61 Cb -0.03 -2.37 0.00 0.00 0.10 0.00 0.00 66.02 63.73 1y5a s SER 61 CO -0.00 -0.76 0.35 0.61 0.98 0.00 0.00 173.24 174.42 1y5a n GLY 62 N -2.56 0.31 3.74 7.32 0.00 -1.26 -5.00 105.19 107.74 1y5a n GLY 62 Ca 0.04 -0.37 -0.40 0.00 0.00 0.00 0.00 46.02 45.28 1y5a n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y5a s ILE 63 N -2.96 4.79 -0.17 -0.61 1.01 -1.26 -4.62 121.20 117.38 1y5a s ILE 63 Ca 0.17 1.65 -0.03 0.00 0.00 0.00 0.00 60.65 62.45 1y5a s ILE 63 Cb -0.08 -4.13 -0.02 0.00 0.01 0.00 0.00 42.46 38.25 1y5a s ILE 63 CO 0.22 0.33 -0.06 -1.58 0.00 0.00 0.00 174.94 173.84 1y5a s GLN 64 N 0.18 3.53 -0.10 2.79 0.74 -0.37 -1.16 119.66 125.28 1y5a s GLN 64 Ca 0.40 -0.59 -0.21 0.00 0.05 0.00 0.00 55.36 55.02 1y5a s GLN 64 Cb -0.20 -2.87 -0.04 0.00 1.10 0.00 0.00 33.01 31.00 1y5a s GLN 64 CO 0.23 0.12 0.58 0.08 -0.55 0.00 0.00 175.29 175.75 1y5a s VAL 65 N 0.64 5.12 -0.24 1.34 1.01 0.27 -0.98 120.40 127.57 1y5a s VAL 65 Ca -0.04 1.18 -0.00 0.00 0.00 0.00 0.00 61.98 63.12 1y5a s VAL 65 Cb -0.15 -3.92 0.03 0.00 0.00 0.00 0.00 36.38 32.35 1y5a s VAL 65 CO 0.02 0.29 -0.10 -0.13 0.00 0.00 0.00 175.10 175.19 1y5a s ARG 66 N 0.71 2.76 0.23 2.72 0.52 -0.10 -0.88 118.95 124.92 1y5a s ARG 66 Ca 0.31 -1.01 0.07 0.00 -0.52 0.00 0.00 55.73 54.58 1y5a s ARG 66 Cb -0.16 -2.89 -0.04 0.00 0.52 0.00 0.00 34.95 32.38 1y5a s ARG 66 CO 0.14 -0.39 0.13 -0.51 0.02 0.00 0.00 175.30 174.69 1y5a s LEU 67 N 1.28 3.66 -1.30 2.53 1.02 -0.07 -1.53 118.68 124.27 1y5a s LEU 67 Ca -0.00 -0.31 0.00 0.00 0.02 0.00 0.00 54.13 53.84 1y5a s LEU 67 Cb -0.16 -2.22 0.00 0.00 0.02 0.00 0.00 46.19 43.83 1y5a s LEU 67 CO -0.06 0.00 0.00 0.61 0.02 0.00 0.00 176.35 176.92 1y5a n GLY 69 N -0.87 1.24 3.79 -3.19 0.00 -1.26 -1.59 105.19 103.31 1y5a n GLY 69 Ca -0.08 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.11 1y5a n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y5a s GLU 70 N -3.15 4.47 0.00 1.61 0.41 -1.26 -4.02 118.70 116.76 1y5a s GLU 70 Ca 0.00 1.07 0.00 0.00 -0.41 0.00 0.00 54.97 55.63 1y5a s GLU 70 Cb 0.00 -3.13 0.00 0.00 -1.78 0.00 0.00 34.13 29.22 1y5a s GLU 70 CO 0.00 0.51 0.00 -3.47 -0.49 0.00 0.00 175.26 171.81 1y5a n ASP 71 N 1.30 0.00 -4.61 -0.19 2.03 -1.26 -4.55 116.55 109.27 1y5a n ASP 71 Ca -0.05 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.84 1y5a n ASP 71 Cb 0.49 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.87 1y5a n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1y5a s ASN 72 N 0.84 6.31 0.00 1.67 3.84 -1.25 -3.62 114.94 122.72 1y5a s ASN 72 Ca 0.00 1.21 0.28 0.00 0.21 0.00 0.00 52.86 54.56 1y5a s ASN 72 Cb 0.00 -2.53 1.49 0.00 -0.55 0.00 0.00 41.25 39.66 1y5a s ASN 72 CO 0.00 -1.39 1.99 2.30 -2.79 0.00 0.00 177.10 177.21 1y5a n ILE 73 N 6.83 0.07 0.46 -5.21 -5.35 0.02 -2.89 119.36 113.29 1y5a n ILE 73 Ca 0.18 0.02 0.10 0.00 -0.27 0.00 0.00 62.75 62.78 1y5a n ILE 73 Cb 0.47 -0.56 0.14 0.00 -1.74 0.00 0.00 39.64 37.95 1y5a n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1y5a n ASN 74 N -1.22 2.91 -3.89 7.28 3.02 -1.26 -4.97 115.26 117.14 1y5a n ASN 74 Ca 0.15 -1.86 -0.18 0.00 -0.03 0.00 0.00 54.58 52.66 1y5a n ASN 74 Cb 0.19 -0.12 -0.16 0.00 -0.61 0.00 0.00 39.78 39.08 1y5a n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1y5a s VAL 75 N -1.42 0.44 -0.50 2.41 1.01 -1.14 -5.10 120.40 116.10 1y5a s VAL 75 Ca 0.28 -0.11 -0.28 0.00 0.00 0.00 0.00 61.98 61.87 1y5a s VAL 75 Cb 0.18 -0.46 0.03 0.00 0.00 0.00 0.00 36.38 36.13 1y5a s VAL 75 CO 0.25 0.18 1.09 -0.69 0.00 0.00 0.00 175.10 175.94 1y5a s VAL 76 N 0.69 4.24 -1.86 2.92 1.01 -1.26 -4.69 120.40 121.45 1y5a s VAL 76 Ca -0.08 1.02 0.19 0.00 0.00 0.00 0.00 61.98 63.10 1y5a s VAL 76 Cb -0.12 -4.59 0.03 0.00 0.00 0.00 0.00 36.38 31.71 1y5a s VAL 76 CO -0.00 -1.04 0.98 -0.62 0.00 0.00 0.00 175.10 174.42 1y5a n GLU 77 N 7.79 1.57 0.00 2.72 1.02 -1.26 -5.01 120.64 127.47 1y5a n GLU 77 Ca 0.10 -1.07 0.00 0.00 -0.02 0.00 0.00 57.16 56.17 1y5a n GLU 77 Cb 0.49 -1.35 0.00 0.00 -0.02 0.00 0.00 31.44 30.56 1y5a n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y5a n GLY 78 N 1.21 0.77 0.02 0.62 0.00 -1.26 -4.95 105.19 101.60 1y5a n GLY 78 Ca 0.08 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.12 1y5a n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1y5a n ASN 79 N 0.00 1.94 -4.79 1.61 3.02 -1.26 -5.06 115.26 110.72 1y5a n ASN 79 Ca 0.00 -2.17 -0.34 0.00 -0.03 0.00 0.00 54.58 52.05 1y5a n ASN 79 Cb 0.00 -0.09 -0.02 0.00 -0.61 0.00 0.00 39.78 39.06 1y5a n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1y5a s GLU 80 N -1.31 3.61 -0.12 3.52 8.01 -1.26 -4.36 118.70 126.80 1y5a s GLU 80 Ca 0.06 1.39 -0.00 0.00 0.01 0.00 0.00 54.97 56.43 1y5a s GLU 80 Cb 0.06 -2.06 0.02 0.00 -4.31 0.00 0.00 34.13 27.84 1y5a s GLU 80 CO 0.01 -0.59 -0.10 -0.65 0.01 0.00 0.00 175.26 173.94 1y5a s GLN 81 N -3.39 1.75 -0.29 1.61 -0.21 -0.62 -4.97 119.66 113.54 1y5a s GLN 81 Ca 0.68 -0.35 -0.10 0.00 0.02 0.00 0.00 55.36 55.61 1y5a s GLN 81 Cb -0.18 -1.72 -0.02 0.00 1.00 0.00 0.00 33.01 32.09 1y5a s GLN 81 CO 0.24 -0.24 0.15 -0.06 -2.12 0.00 0.00 175.29 173.27 1y5a s PHE 82 N 1.58 3.17 -0.04 0.91 0.08 -1.26 -0.89 117.98 121.53 1y5a s PHE 82 Ca 0.04 -0.34 0.01 0.00 0.12 0.00 0.00 56.93 56.76 1y5a s PHE 82 Cb -0.13 -2.35 0.02 0.00 -0.57 0.00 0.00 43.02 40.00 1y5a s PHE 82 CO -0.08 -0.35 -0.05 0.42 -0.10 0.00 0.00 175.22 175.05 1y5a s ILE 83 N 1.66 0.56 0.48 0.64 1.01 -0.06 -4.98 121.20 120.52 1y5a s ILE 83 Ca 0.06 -0.15 -0.21 0.00 0.00 0.00 0.00 60.65 60.35 1y5a s ILE 83 Cb -0.16 -0.58 -0.08 0.00 0.01 0.00 0.00 42.46 41.65 1y5a s ILE 83 CO 0.07 0.23 1.09 -0.44 0.00 0.00 0.00 174.94 175.89 1y5a s SER 84 N 0.85 6.20 0.23 3.58 0.01 -1.26 -0.57 113.70 122.75 1y5a s SER 84 Ca -0.12 2.08 -0.30 0.00 1.31 0.00 0.00 55.95 58.92 1y5a s SER 84 Cb -0.14 -2.58 -0.09 0.00 0.21 0.00 0.00 66.02 63.42 1y5a s SER 84 CO 0.01 -0.88 1.16 0.00 0.41 0.00 0.00 173.24 173.93 1y5a s ALA 85 N -1.80 3.42 -0.08 1.44 0.00 -0.31 -0.95 121.76 123.49 1y5a s ALA 85 Ca 0.67 0.94 0.22 0.00 0.00 0.00 0.00 51.96 53.79 1y5a s ALA 85 Cb -0.21 -3.38 -0.32 0.00 0.00 0.00 0.00 23.12 19.20 1y5a s ALA 85 CO 0.25 -0.30 0.52 -1.13 0.00 0.00 0.00 175.76 175.10 1y5a n SER 86 N 1.91 0.07 -3.52 0.00 3.41 0.34 -4.72 113.62 111.10 1y5a n SER 86 Ca 0.02 -0.03 -0.14 0.00 -0.26 0.00 0.00 58.87 58.46 1y5a n SER 86 Cb 0.45 1.91 -0.05 0.00 -0.26 0.00 0.00 64.21 66.26 1y5a n SER 86 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1y5a s LYS 87 N -3.49 0.93 0.01 4.33 -2.85 -1.23 -5.01 119.74 112.42 1y5a s LYS 87 Ca -0.07 0.04 0.05 0.00 -1.00 0.00 0.00 55.97 54.99 1y5a s LYS 87 Cb 0.14 0.44 -0.02 0.00 -2.06 0.00 0.00 37.83 36.33 1y5a s LYS 87 CO 0.90 -0.33 -0.15 -1.12 0.10 0.00 0.00 175.35 174.75 1y5a s SER 88 N -1.58 1.79 -0.22 0.03 0.01 -1.26 -1.02 113.70 111.44 1y5a s SER 88 Ca -0.04 -0.35 -0.03 0.00 1.31 0.00 0.00 55.95 56.84 1y5a s SER 88 Cb -0.00 -0.17 0.07 0.00 0.21 0.00 0.00 66.02 66.13 1y5a s SER 88 CO 0.02 0.14 0.06 -0.63 0.41 0.00 0.00 173.24 173.23 1y5a s ILE 89 N -0.54 0.44 0.26 1.44 1.01 0.25 -5.00 121.20 119.06 1y5a s ILE 89 Ca 0.05 -0.66 -0.29 0.00 0.00 0.00 0.00 60.65 59.75 1y5a s ILE 89 Cb -0.07 -1.07 -0.09 0.00 0.01 0.00 0.00 42.46 41.24 1y5a s ILE 89 CO 0.00 -0.34 0.96 -0.69 0.00 0.00 0.00 174.94 174.87 1y5a s VAL 90 N 1.88 4.04 0.23 2.92 1.01 -1.26 -1.10 120.40 128.12 1y5a s VAL 90 Ca 0.02 1.97 -0.31 0.00 0.00 0.00 0.00 61.98 63.67 1y5a s VAL 90 Cb -0.17 -4.22 -0.15 0.00 0.00 0.00 0.00 36.38 31.84 1y5a s VAL 90 CO -0.14 0.41 1.11 1.57 0.00 0.00 0.00 175.10 178.05 1y5a n HIS 91 N 1.26 1.34 0.28 5.22 -0.00 -0.69 -4.84 115.22 117.78 1y5a n HIS 91 Ca -0.01 0.67 0.13 0.00 0.46 0.00 0.00 57.72 58.97 1y5a n HIS 91 Cb 0.47 -2.28 0.82 0.00 -0.12 0.00 0.00 29.99 28.89 1y5a n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1y5a h PRO 92 N 2.82 0.00 -0.54 1.57 0.13 -1.93 -2.39 132.00 131.66 1y5a h PRO 92 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1y5a h PRO 92 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 1y5a h PRO 92 CO 0.66 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.86 1y5a n SER 93 N -4.08 3.83 -4.69 1.44 7.64 -1.26 -5.01 113.62 111.49 1y5a n SER 93 Ca -0.03 -2.20 -0.44 0.00 1.01 0.00 0.00 58.87 57.21 1y5a n SER 93 Cb 0.10 -0.43 -0.04 0.00 -1.01 0.00 0.00 64.21 62.83 1y5a n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y5a n TYR 94 N 0.95 2.49 -3.85 1.43 9.36 -0.90 -4.66 117.16 121.99 1y5a n TYR 94 Ca 0.20 0.15 -0.36 0.00 3.32 0.00 0.00 57.90 61.21 1y5a n TYR 94 Cb 0.65 -2.61 -0.13 0.00 -0.63 0.00 0.00 39.34 36.62 1y5a n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1y5a s ASN 95 N 1.15 4.92 0.12 2.98 3.84 -0.66 -5.01 114.94 122.29 1y5a s ASN 95 Ca 0.78 -1.02 0.23 0.00 0.21 0.00 0.00 52.86 53.05 1y5a s ASN 95 Cb -0.60 -1.78 0.90 0.00 -0.55 0.00 0.00 41.25 39.22 1y5a s ASN 95 CO 0.36 -0.23 1.70 -1.54 -2.79 0.00 0.00 177.10 174.60 1y5a n SER 96 N 4.74 0.38 0.02 -4.21 3.41 -1.26 0.04 113.62 116.73 1y5a n SER 96 Ca -0.14 0.57 -0.21 0.00 -0.26 0.00 0.00 58.87 58.83 1y5a n SER 96 Cb 0.46 -0.66 -0.14 0.00 -0.26 0.00 0.00 64.21 63.61 1y5a n SER 96 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 1y5a h GLU 97 N 0.00 0.25 0.00 4.33 4.11 -1.98 -3.39 114.58 117.91 1y5a h GLU 97 Ca 0.00 -0.43 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1y5a h GLU 97 Cb 0.44 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1y5a h GLU 97 CO 0.00 1.21 -1.24 0.25 0.07 0.00 0.00 179.01 179.30 1y5a n THR 98 N -4.00 0.04 -1.69 -1.06 -2.24 -1.17 -5.00 114.28 99.15 1y5a n THR 98 Ca -0.22 -0.18 -0.20 0.00 -2.27 0.00 0.00 64.05 61.18 1y5a n THR 98 Cb 0.87 0.55 -0.08 0.00 -2.10 0.00 0.00 70.33 69.58 1y5a n THR 98 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1y5a n TYR 99 N -1.79 -0.17 -1.78 4.78 4.02 0.11 -4.98 117.16 117.36 1y5a n TYR 99 Ca 0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.49 1y5a n TYR 99 Cb 0.41 -3.47 -0.03 0.00 -0.02 0.00 0.00 39.34 36.23 1y5a n TYR 99 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1y5a s ASN 100 N -2.63 6.43 -0.84 7.72 2.47 -1.23 -2.81 114.94 124.05 1y5a s ASN 100 Ca 0.00 2.80 -0.02 0.00 0.42 0.00 0.00 52.86 56.06 1y5a s ASN 100 Cb 0.00 -2.60 0.00 0.00 -1.45 0.00 0.00 41.25 37.21 1y5a s ASN 100 CO 0.00 -0.94 0.71 0.59 -3.72 0.00 0.00 177.10 173.74 1y5a n ASN 101 N 4.07 -2.97 -4.20 -4.21 3.02 -1.26 -1.65 115.26 108.06 1y5a n ASN 101 Ca 0.16 -0.40 -0.43 0.00 -0.03 0.00 0.00 54.58 53.88 1y5a n ASN 101 Cb 0.36 -3.58 0.00 0.00 -0.61 0.00 0.00 39.78 35.95 1y5a n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1y5a n ASP 102 N -2.14 4.80 -3.75 6.41 2.03 -1.12 -4.26 116.55 118.51 1y5a n ASP 102 Ca -0.13 -2.96 -0.13 0.00 0.52 0.00 0.00 54.79 52.09 1y5a n ASP 102 Cb 0.59 -1.63 -0.10 0.00 -0.72 0.00 0.00 41.12 39.27 1y5a n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1y5a s ILE 103 N 2.48 0.03 0.00 5.18 2.07 -1.26 -3.85 121.20 125.85 1y5a s ILE 103 Ca 0.46 -0.22 -0.12 0.00 -1.41 0.00 0.00 60.65 59.37 1y5a s ILE 103 Cb 0.06 -0.55 0.01 0.00 0.13 0.00 0.00 42.46 42.11 1y5a s ILE 103 CO 0.00 -0.12 0.24 0.00 -1.91 0.00 0.00 174.94 173.16 1y5a s MET 104 N -0.52 0.63 -0.05 3.50 0.23 -0.03 -1.71 119.30 121.34 1y5a s MET 104 Ca -0.06 -0.34 0.02 0.00 -1.03 0.00 0.00 55.69 54.27 1y5a s MET 104 Cb -0.04 0.27 -0.03 0.00 -1.53 0.00 0.00 34.83 33.50 1y5a s MET 104 CO 0.02 -0.17 -0.08 -0.51 -2.03 0.00 0.00 175.02 172.26 1y5a s LEU 105 N -1.50 3.12 -0.09 0.18 1.43 -0.26 -1.25 118.68 120.30 1y5a s LEU 105 Ca -0.12 -0.07 0.01 0.00 -1.03 0.00 0.00 54.13 52.92 1y5a s LEU 105 Cb -0.05 -1.70 0.02 0.00 0.03 0.00 0.00 46.19 44.48 1y5a s LEU 105 CO 0.02 0.34 -0.13 -0.63 0.23 0.00 0.00 176.35 176.18 1y5a s ILE 106 N -0.85 1.29 -0.05 -0.59 1.01 -0.15 -0.58 121.20 121.28 1y5a s ILE 106 Ca 0.13 -0.52 -0.17 0.00 0.00 0.00 0.00 60.65 60.09 1y5a s ILE 106 Cb -0.11 -1.20 -0.05 0.00 0.01 0.00 0.00 42.46 41.11 1y5a s ILE 106 CO 0.03 0.40 0.47 -0.75 0.00 0.00 0.00 174.94 175.09 1y5a s LYS 107 N 1.01 4.18 0.17 2.79 2.20 -0.19 -0.93 119.74 128.96 1y5a s LYS 107 Ca -0.07 0.49 -0.26 0.00 -0.36 0.00 0.00 55.97 55.76 1y5a s LYS 107 Cb -0.15 -3.33 -0.08 0.00 -1.51 0.00 0.00 37.83 32.76 1y5a s LYS 107 CO -0.01 0.42 0.82 -0.51 -0.36 0.00 0.00 175.35 175.70 1y5a s LEU 108 N -0.23 4.59 0.44 5.43 1.43 -0.03 -0.51 118.68 129.80 1y5a s LEU 108 Ca 0.26 1.70 0.13 0.00 -1.03 0.00 0.00 54.13 55.19 1y5a s LEU 108 Cb -0.16 -3.37 0.98 0.00 0.03 0.00 0.00 46.19 43.66 1y5a s LEU 108 CO 0.13 0.17 1.99 0.07 0.23 0.00 0.00 176.35 178.94 1y5a h LYS 109 N 4.48 0.07 -4.30 1.70 5.09 -1.33 -3.42 116.57 118.85 1y5a h LYS 109 Ca -0.46 -0.01 -0.25 0.00 0.09 0.00 0.00 60.65 60.02 1y5a h LYS 109 Cb 1.21 -0.01 -0.22 0.00 0.10 0.00 0.00 32.23 33.30 1y5a h LYS 109 CO 0.67 0.21 -0.72 -1.54 -2.09 0.00 0.00 179.45 175.98 1y5a s SER 110 N -6.98 0.58 0.37 7.07 1.04 -1.26 -4.99 113.70 109.53 1y5a s SER 110 Ca -0.04 -0.44 -0.28 0.00 0.48 0.00 0.00 55.95 55.66 1y5a s SER 110 Cb 0.16 0.04 -0.10 0.00 0.10 0.00 0.00 66.02 66.22 1y5a s SER 110 CO 0.70 -0.19 1.38 0.00 0.98 0.00 0.00 173.24 176.12 1y5a s ALA 111 N -1.16 3.48 0.52 5.32 0.00 -1.26 -4.92 121.76 123.74 1y5a s ALA 111 Ca -0.10 1.39 -0.21 0.00 0.00 0.00 0.00 51.96 53.04 1y5a s ALA 111 Cb -0.08 -3.54 -0.06 0.00 0.00 0.00 0.00 23.12 19.44 1y5a s ALA 111 CO -0.00 -0.85 1.18 0.00 0.00 0.00 0.00 175.76 176.09 1y5a s ALA 112 N -1.15 2.79 -0.55 0.00 0.00 0.28 -4.99 121.76 118.14 1y5a s ALA 112 Ca 0.52 0.96 -0.25 0.00 0.00 0.00 0.00 51.96 53.19 1y5a s ALA 112 Cb -0.42 -3.41 0.04 0.00 0.00 0.00 0.00 23.12 19.33 1y5a s ALA 112 CO 0.56 -0.86 0.98 0.45 0.00 0.00 0.00 175.76 176.89 1y5a s SER 113 N -1.48 6.36 0.18 0.00 0.15 -1.26 -4.86 113.70 112.80 1y5a s SER 113 Ca 0.70 -0.26 -0.30 0.00 0.70 0.00 0.00 55.95 56.79 1y5a s SER 113 Cb -0.29 -2.46 -0.08 0.00 -1.71 0.00 0.00 66.02 61.49 1y5a s SER 113 CO 0.33 -1.26 0.99 -0.76 1.20 0.00 0.00 173.24 173.74 1y5a s LEU 114 N 4.10 4.56 0.00 3.45 1.43 -1.26 -4.82 118.68 126.13 1y5a s LEU 114 Ca 0.33 1.94 -0.02 0.00 -1.03 0.00 0.00 54.13 55.34 1y5a s LEU 114 Cb -0.12 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.51 1y5a s LEU 114 CO 0.20 -0.01 0.14 -0.46 0.23 0.00 0.00 176.35 176.46 1y5a n ASN 115 N 2.09 -0.41 0.11 2.29 0.23 -0.10 -4.99 115.26 114.49 1y5a n ASN 115 Ca 0.00 -1.33 0.12 0.00 -0.53 0.00 0.00 54.58 52.84 1y5a n ASN 115 Cb 0.47 0.70 0.47 0.00 -2.08 0.00 0.00 39.78 39.34 1y5a n ASN 115 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1y5a n SER 116 N -1.32 0.64 -0.00 0.53 3.41 -1.26 -2.56 113.62 113.05 1y5a n SER 116 Ca -0.01 0.63 0.10 0.00 -0.26 0.00 0.00 58.87 59.33 1y5a n SER 116 Cb 0.12 -0.78 -0.13 0.00 -0.26 0.00 0.00 64.21 63.16 1y5a n SER 116 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1y5a n ARG 117 N -2.18 0.14 -3.69 4.33 1.74 -1.26 -4.78 116.66 110.95 1y5a n ARG 117 Ca 0.03 -0.03 -0.30 0.00 -0.77 0.00 0.00 57.85 56.78 1y5a n ARG 117 Cb 0.27 -1.50 -0.15 0.00 -1.02 0.00 0.00 32.46 30.06 1y5a n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1y5a s VAL 118 N -3.08 0.68 -0.01 1.55 1.01 -1.06 -4.15 120.40 115.33 1y5a s VAL 118 Ca 0.05 -1.25 -0.06 0.00 0.00 0.00 0.00 61.98 60.72 1y5a s VAL 118 Cb 0.16 -1.51 0.00 0.00 0.00 0.00 0.00 36.38 35.03 1y5a s VAL 118 CO 0.87 -0.68 0.12 0.00 0.00 0.00 0.00 175.10 175.42 1y5a s ALA 119 N 1.72 -0.29 0.48 5.51 0.00 -0.64 -0.92 121.76 127.62 1y5a s ALA 119 Ca 0.09 -0.02 -0.14 0.00 0.00 0.00 0.00 51.96 51.89 1y5a s ALA 119 Cb -0.17 0.01 -0.07 0.00 0.00 0.00 0.00 23.12 22.89 1y5a s ALA 119 CO -0.27 -0.16 0.91 -1.54 0.00 0.00 0.00 175.76 174.69 1y5a s SER 120 N -0.96 6.56 -0.07 0.00 1.04 -1.26 -2.75 113.70 116.26 1y5a s SER 120 Ca -0.10 1.40 0.01 0.00 0.48 0.00 0.00 55.95 57.73 1y5a s SER 120 Cb -0.06 -2.44 -0.03 0.00 0.10 0.00 0.00 66.02 63.60 1y5a s SER 120 CO 0.01 -0.53 -0.08 -0.51 0.98 0.00 0.00 173.24 173.11 1y5a s ILE 121 N -2.56 3.61 0.52 -1.02 1.10 -0.34 -4.86 121.20 117.65 1y5a s ILE 121 Ca 0.56 -0.51 -0.18 0.00 -0.51 0.00 0.00 60.65 60.01 1y5a s ILE 121 Cb -0.10 -2.48 -0.07 0.00 0.15 0.00 0.00 42.46 39.96 1y5a s ILE 121 CO 0.33 0.59 1.03 -0.44 -2.11 0.00 0.00 174.94 174.34 1y5a s SER 122 N -0.68 6.22 0.41 4.50 0.01 -1.26 -4.57 113.70 118.33 1y5a s SER 122 Ca 0.10 1.84 -0.16 0.00 1.31 0.00 0.00 55.95 59.04 1y5a s SER 122 Cb -0.11 -2.54 -0.09 0.00 0.21 0.00 0.00 66.02 63.48 1y5a s SER 122 CO 0.02 -0.87 0.86 -0.76 0.41 0.00 0.00 173.24 172.90 1y5a s LEU 123 N -3.87 3.89 0.62 2.44 1.43 -1.26 -1.09 118.68 120.84 1y5a s LEU 123 Ca 0.65 1.44 -0.19 0.00 -1.03 0.00 0.00 54.13 55.00 1y5a s LEU 123 Cb -0.15 -4.30 -0.02 0.00 0.03 0.00 0.00 46.19 41.75 1y5a s LEU 123 CO 0.26 -0.37 1.32 -2.84 0.23 0.00 0.00 176.35 174.96 1y5a s PRO 124 N -3.42 2.71 0.06 1.29 0.02 -1.26 -4.80 135.00 129.60 1y5a s PRO 124 Ca 0.57 2.14 0.19 0.00 0.02 0.00 0.00 61.00 63.92 1y5a s PRO 124 Cb -0.10 -1.97 -0.14 0.00 0.02 0.00 0.00 34.50 32.31 1y5a s PRO 124 CO 0.21 -1.50 0.75 0.25 -0.33 0.00 0.00 177.00 176.39 1y5a n THR 125 N -1.65 0.86 -3.93 0.99 -2.24 -1.26 -4.97 114.28 102.08 1y5a n THR 125 Ca 0.14 -0.64 -0.09 0.00 -2.27 0.00 0.00 64.05 61.19 1y5a n THR 125 Cb 0.47 -0.48 -0.05 0.00 -2.10 0.00 0.00 70.33 68.17 1y5a n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1y5a s SER 127 N -5.43 -0.12 0.79 3.42 1.04 -1.26 -5.17 113.70 106.97 1y5a s SER 127 Ca -0.04 -0.80 -0.11 0.00 0.48 0.00 0.00 55.95 55.48 1y5a s SER 127 Cb 0.10 0.58 0.06 0.00 0.10 0.00 0.00 66.02 66.86 1y5a s SER 127 CO 0.82 -1.11 1.09 0.00 0.98 0.00 0.00 173.24 175.02 1y5a s ALA 129 N -2.98 3.86 0.39 0.00 0.00 -1.26 -5.10 121.76 116.66 1y5a s ALA 129 Ca 0.61 -0.62 0.02 0.00 0.00 0.00 0.00 51.96 51.98 1y5a s ALA 129 Cb -0.16 -2.05 -0.01 0.00 0.00 0.00 0.00 23.12 20.90 1y5a s ALA 129 CO 0.56 0.69 0.58 -1.54 0.00 0.00 0.00 175.76 176.04 1y5a s SER 130 N -2.12 5.96 0.49 0.00 1.04 -1.26 -5.02 113.70 112.79 1y5a s SER 130 Ca 0.34 0.15 -0.23 0.00 0.48 0.00 0.00 55.95 56.69 1y5a s SER 130 Cb -0.13 -1.53 -0.07 0.00 0.10 0.00 0.00 66.02 64.39 1y5a s SER 130 CO 0.22 -0.53 1.25 0.00 0.98 0.00 0.00 173.24 175.16 1y5a n ALA 132 N -1.87 1.23 0.00 5.32 0.00 -1.26 -2.22 120.51 121.70 1y5a n ALA 132 Ca -0.01 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1y5a n ALA 132 Cb 0.58 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.75 1y5a n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y5a n GLY 133 N 0.86 1.82 3.75 0.00 0.00 0.57 -4.98 105.19 107.22 1y5a n GLY 133 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1y5a n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y5a s THR 134 N -2.57 2.73 0.21 2.61 2.01 -0.94 -4.65 115.64 115.04 1y5a s THR 134 Ca 0.00 0.65 -0.20 0.00 0.31 0.00 0.00 61.69 62.44 1y5a s THR 134 Cb 0.00 -3.41 -0.08 0.00 0.01 0.00 0.00 72.50 69.02 1y5a s THR 134 CO 0.00 0.12 0.73 -1.58 -0.69 0.00 0.00 174.62 173.20 1y5a s GLN 135 N -0.79 4.30 0.17 4.92 2.00 -1.26 -0.75 119.66 128.25 1y5a s GLN 135 Ca 0.56 0.91 0.01 0.00 -2.00 0.00 0.00 55.36 54.84 1y5a s GLN 135 Cb -0.41 -2.94 -0.05 0.00 0.80 0.00 0.00 33.01 30.42 1y5a s GLN 135 CO 0.46 0.42 0.02 0.00 -0.50 0.00 0.00 175.29 175.69 1y5a s LEU 137 N -3.16 2.97 -0.06 0.00 2.96 0.11 -1.29 118.68 120.22 1y5a s LEU 137 Ca 0.25 -0.33 0.02 0.00 -0.22 0.00 0.00 54.13 53.85 1y5a s LEU 137 Cb 0.06 -1.75 -0.03 0.00 0.50 0.00 0.00 46.19 44.98 1y5a s LEU 137 CO 0.04 0.02 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.35 1y5a s ILE 138 N 1.22 3.24 0.07 6.68 1.01 0.19 -1.41 121.20 132.20 1y5a s ILE 138 Ca 0.03 -0.65 -0.08 0.00 0.00 0.00 0.00 60.65 59.95 1y5a s ILE 138 Cb -0.14 -2.29 -0.01 0.00 0.01 0.00 0.00 42.46 40.03 1y5a s ILE 138 CO -0.01 0.59 0.16 -0.94 0.00 0.00 0.00 174.94 174.73 1y5a s SER 139 N -0.65 0.15 0.00 3.58 1.04 -1.22 -0.25 113.70 116.35 1y5a s SER 139 Ca 0.10 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 55.91 1y5a s SER 139 Cb -0.11 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.31 1y5a s SER 139 CO 0.01 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.19 1y5a n GLY 140 N 0.22 0.70 1.58 7.32 0.00 -0.44 -4.42 105.19 110.15 1y5a n GLY 140 Ca -0.16 -1.04 0.03 0.00 0.00 0.00 0.00 46.02 44.85 1y5a n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1y5a n TRP 141 N -0.57 1.80 -1.38 1.61 8.01 -1.26 -1.68 117.44 123.98 1y5a n TRP 141 Ca 0.00 -0.99 -0.30 0.00 -1.31 0.00 0.00 57.50 54.91 1y5a n TRP 141 Cb 0.00 -0.51 0.20 0.00 -2.01 0.00 0.00 31.31 28.99 1y5a n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1y5a s GLY 142 N -1.34 1.63 0.37 6.99 0.00 -1.25 -4.36 107.32 109.36 1y5a s GLY 142 Ca 0.51 -0.88 -0.26 0.00 0.00 0.00 0.00 44.72 44.08 1y5a s GLY 142 CO 0.12 -0.11 1.15 -2.01 0.00 0.00 0.00 173.10 172.26 1y5a n ASN 143 N -4.29 2.01 -0.67 1.64 5.15 -0.14 -2.95 115.26 116.01 1y5a n ASN 143 Ca 0.12 1.13 0.07 0.00 -0.60 0.00 0.00 54.58 55.30 1y5a n ASN 143 Cb 0.59 -1.41 0.10 0.00 -0.53 0.00 0.00 39.78 38.53 1y5a n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1y5a n THR 144 N -0.05 0.29 -4.85 -0.44 -2.24 -0.49 -0.72 114.28 105.77 1y5a n THR 144 Ca 0.07 -0.65 -0.32 0.00 -2.27 0.00 0.00 64.05 60.88 1y5a n THR 144 Cb 0.37 1.08 -0.13 0.00 -2.10 0.00 0.00 70.33 69.55 1y5a n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1y5a s LYS 145 N -1.18 2.44 0.26 -0.78 1.02 -1.26 -4.42 119.74 115.83 1y5a s LYS 145 Ca 0.21 -0.74 0.16 0.00 0.02 0.00 0.00 55.97 55.63 1y5a s LYS 145 Cb 0.14 -2.35 0.06 0.00 -0.52 0.00 0.00 37.83 35.16 1y5a s LYS 145 CO 0.19 0.61 1.36 0.66 -0.92 0.00 0.00 175.35 177.25 1y5a h SER 146 N 5.21 0.00 -3.23 2.83 4.64 -1.94 -3.42 113.55 117.64 1y5a h SER 146 Ca -0.47 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.32 1y5a h SER 146 Cb 1.15 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 62.88 1y5a h SER 146 CO 0.50 0.44 -0.81 -0.55 -0.87 0.00 0.00 176.83 175.54 1y5a s SER 147 N -6.29 2.13 0.00 4.97 0.15 -1.26 -4.59 113.70 108.81 1y5a s SER 147 Ca 0.03 -0.32 0.00 0.00 0.70 0.00 0.00 55.95 56.36 1y5a s SER 147 Cb 0.07 -0.87 0.00 0.00 -1.71 0.00 0.00 66.02 63.52 1y5a s SER 147 CO 0.75 -0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.72 1y5a n GLY 148 N 4.67 -1.80 2.73 9.45 0.00 -1.26 -4.98 105.19 113.99 1y5a n GLY 148 Ca -0.15 -1.57 -0.18 0.00 0.00 0.00 0.00 46.02 44.12 1y5a n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y5a s THR 149 N 0.00 -0.05 -0.22 2.61 2.01 -1.26 -4.57 115.64 114.16 1y5a s THR 149 Ca 0.00 0.30 -0.08 0.00 0.31 0.00 0.00 61.69 62.22 1y5a s THR 149 Cb 0.00 -0.14 0.10 0.00 0.01 0.00 0.00 72.50 72.46 1y5a s THR 149 CO 0.00 0.14 0.49 -0.55 -0.69 0.00 0.00 174.62 174.01 1y5a s SER 150 N 1.59 -0.52 -0.18 3.53 0.15 -1.26 -4.98 113.70 112.04 1y5a s SER 150 Ca -0.02 1.15 -0.05 0.00 0.70 0.00 0.00 55.95 57.73 1y5a s SER 150 Cb -0.13 1.55 -0.03 0.00 -1.71 0.00 0.00 66.02 65.71 1y5a s SER 150 CO -0.03 -0.23 0.01 -0.31 1.20 0.00 0.00 173.24 173.88 1y5a s TYR 151 N 2.57 3.11 0.50 3.44 1.51 -1.26 -1.40 117.35 125.81 1y5a s TYR 151 Ca -0.04 -0.20 -0.13 0.00 -1.01 0.00 0.00 57.07 55.70 1y5a s TYR 151 Cb -0.12 -2.03 -0.06 0.00 -0.11 0.00 0.00 41.96 39.64 1y5a s TYR 151 CO -0.15 -0.02 0.91 -1.25 -1.11 0.00 0.00 175.55 173.94 1y5a s PRO 152 N 0.52 3.80 -0.02 -1.71 0.04 -1.26 -4.98 135.00 131.40 1y5a s PRO 152 Ca -0.00 0.71 0.19 0.00 0.04 0.00 0.00 61.00 61.94 1y5a s PRO 152 Cb -0.14 -2.22 -0.27 0.00 0.04 0.00 0.00 34.50 31.91 1y5a s PRO 152 CO 0.02 -0.25 0.55 -0.25 0.04 0.00 0.00 177.00 177.12 1y5a n ASP 153 N -1.75 0.64 -4.96 6.66 8.00 -1.26 -4.88 116.55 119.00 1y5a n ASP 153 Ca 0.05 -0.31 -0.23 0.00 0.71 0.00 0.00 54.79 55.00 1y5a n ASP 153 Cb 0.54 1.60 -0.02 0.00 -0.02 0.00 0.00 41.12 43.22 1y5a n ASP 153 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1y5a s VAL 154 N -3.18 5.28 0.19 2.53 -7.23 -1.26 -0.80 120.40 115.94 1y5a s VAL 154 Ca -0.02 -0.83 -0.30 0.00 -1.81 0.00 0.00 61.98 59.01 1y5a s VAL 154 Cb 0.13 -3.81 -0.09 0.00 0.56 0.00 0.00 36.38 33.17 1y5a s VAL 154 CO 0.80 -0.24 1.40 -0.22 -0.31 0.00 0.00 175.10 176.53 1y5a s LEU 155 N -3.69 4.39 0.07 1.32 2.96 -1.24 -4.82 118.68 117.68 1y5a s LEU 155 Ca 0.35 2.49 0.03 0.00 -0.22 0.00 0.00 54.13 56.78 1y5a s LEU 155 Cb -0.10 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 1y5a s LEU 155 CO 0.29 -0.64 0.05 -0.54 -1.32 0.00 0.00 176.35 174.19 1y5a s LYS 156 N 0.20 2.79 0.08 1.98 -0.14 -0.67 -1.42 119.74 122.56 1y5a s LYS 156 Ca 0.61 -0.71 0.07 0.00 -1.36 0.00 0.00 55.97 54.57 1y5a s LYS 156 Cb -0.39 -2.68 -0.03 0.00 -1.68 0.00 0.00 37.83 33.05 1y5a s LYS 156 CO 0.37 0.57 -0.18 0.00 -0.76 0.00 0.00 175.35 175.35 1y5a s LEU 158 N -1.77 0.65 -0.11 0.00 2.96 0.66 -0.83 118.68 120.24 1y5a s LEU 158 Ca 0.03 0.31 -0.21 0.00 -0.22 0.00 0.00 54.13 54.04 1y5a s LEU 158 Cb -0.10 0.37 -0.04 0.00 0.50 0.00 0.00 46.19 46.92 1y5a s LEU 158 CO 0.03 -0.16 0.61 -0.54 -1.32 0.00 0.00 176.35 174.98 1y5a s LYS 159 N 1.26 4.36 -0.17 1.98 -0.14 -1.26 -0.63 119.74 125.14 1y5a s LYS 159 Ca -0.08 0.68 -0.15 0.00 -1.36 0.00 0.00 55.97 55.05 1y5a s LYS 159 Cb -0.12 -3.47 0.04 0.00 -1.68 0.00 0.00 37.83 32.61 1y5a s LYS 159 CO -0.06 0.03 0.44 0.00 -0.76 0.00 0.00 175.35 175.01 1y5a s ALA 160 N 0.97 -1.10 0.28 5.17 0.00 -0.41 -4.97 121.76 121.71 1y5a s ALA 160 Ca 0.32 1.25 -0.10 0.00 0.00 0.00 0.00 51.96 53.42 1y5a s ALA 160 Cb -0.16 -0.72 -0.07 0.00 0.00 0.00 0.00 23.12 22.16 1y5a s ALA 160 CO 0.14 -0.21 0.62 -1.25 0.00 0.00 0.00 175.76 175.06 1y5a s PRO 161 N 0.22 3.82 0.17 0.00 0.04 -1.26 -0.31 135.00 137.67 1y5a s PRO 161 Ca -0.00 0.35 -0.31 0.00 0.04 0.00 0.00 61.00 61.07 1y5a s PRO 161 Cb -0.03 -2.56 -0.10 0.00 0.04 0.00 0.00 34.50 31.85 1y5a s PRO 161 CO 0.01 0.21 1.52 0.42 0.04 0.00 0.00 177.00 179.20 1y5a s ILE 162 N -1.98 2.75 0.34 0.56 1.01 0.07 -1.54 121.20 122.41 1y5a s ILE 162 Ca 0.49 0.55 -0.03 0.00 0.00 0.00 0.00 60.65 61.66 1y5a s ILE 162 Cb -0.11 -3.35 -0.04 0.00 0.01 0.00 0.00 42.46 38.97 1y5a s ILE 162 CO 0.23 0.05 0.60 -0.76 0.00 0.00 0.00 174.94 175.06 1y5a s LEU 163 N 0.93 3.96 0.63 2.97 1.43 -0.30 -0.31 118.68 127.99 1y5a s LEU 163 Ca 0.68 0.67 -0.17 0.00 -1.03 0.00 0.00 54.13 54.27 1y5a s LEU 163 Cb -0.42 -3.53 -0.02 0.00 0.03 0.00 0.00 46.19 42.26 1y5a s LEU 163 CO 0.33 -0.30 1.18 -0.94 0.23 0.00 0.00 176.35 176.85 1y5a s SER 164 N -3.62 5.01 0.30 2.29 1.04 -1.26 -4.62 113.70 112.84 1y5a s SER 164 Ca 0.43 2.29 0.01 0.00 0.48 0.00 0.00 55.95 59.16 1y5a s SER 164 Cb -0.10 -2.59 0.54 0.00 0.10 0.00 0.00 66.02 63.97 1y5a s SER 164 CO 0.35 -1.71 1.91 0.44 0.98 0.00 0.00 173.24 175.21 1y5a h ASP 165 N 0.51 0.90 -0.64 7.02 5.19 -1.96 -1.12 116.42 126.31 1y5a h ASP 165 Ca -0.49 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 55.93 1y5a h ASP 165 Cb 1.28 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 40.58 1y5a h ASP 165 CO 0.54 0.57 0.40 0.77 -3.12 0.00 0.00 179.24 178.40 1y5a h SER 166 N 1.02 0.76 -0.15 6.45 4.64 -1.99 0.91 113.55 125.19 1y5a h SER 166 Ca 0.39 -0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.56 1y5a h SER 166 Cb 0.22 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1y5a h SER 166 CO -0.15 0.58 -0.26 0.28 -0.87 0.00 0.00 176.83 176.40 1y5a h SER 167 N 0.87 0.62 0.35 4.97 0.02 -1.81 -1.25 113.55 117.33 1y5a h SER 167 Ca 0.23 -0.23 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1y5a h SER 167 Cb -0.05 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.32 1y5a h SER 167 CO -0.05 0.87 -0.17 0.00 -1.14 0.00 0.00 176.83 176.34 1y5a h LYS 169 N -0.66 0.07 -0.31 0.00 1.57 -0.79 -2.38 116.57 114.07 1y5a h LYS 169 Ca -0.05 -0.02 -0.16 0.00 -1.87 0.00 0.00 60.65 58.56 1y5a h LYS 169 Cb 0.47 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 1y5a h LYS 169 CO 0.08 0.26 -0.43 0.77 -0.57 0.00 0.00 179.45 179.56 1y5a h SER 170 N 0.07 0.91 0.27 0.86 0.02 -1.15 -0.13 113.55 114.40 1y5a h SER 170 Ca 0.01 -0.50 -0.05 0.00 -0.84 0.00 0.00 61.79 60.41 1y5a h SER 170 Cb 0.37 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1y5a h SER 170 CO 0.03 1.23 -0.26 0.00 -1.14 0.00 0.00 176.83 176.69 1y5a h ALA 171 N 0.70 1.54 -2.07 3.77 0.00 -1.07 -3.34 119.26 118.79 1y5a h ALA 171 Ca 0.03 -0.24 -0.54 0.00 0.00 0.00 0.00 54.91 54.16 1y5a h ALA 171 Cb 1.03 -0.04 -0.40 0.00 0.00 0.00 0.00 17.79 18.37 1y5a h ALA 171 CO 0.10 0.32 -1.00 0.66 0.00 0.00 0.00 179.25 179.33 1y5a n TYR 172 N -4.19 0.99 -1.65 0.00 4.01 -0.92 -4.96 117.16 110.43 1y5a n TYR 172 Ca -0.02 -3.79 -0.46 0.00 -0.16 0.00 0.00 57.90 53.46 1y5a n TYR 172 Cb 0.31 -0.42 -0.04 0.00 -0.31 0.00 0.00 39.34 38.88 1y5a n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1y5a n PRO 173 N 0.73 1.88 -0.88 -0.72 -0.02 -0.10 -2.01 135.00 133.89 1y5a n PRO 173 Ca 0.25 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 1y5a n PRO 173 Cb 0.54 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1y5a n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1y5a n GLY 174 N 2.53 0.27 0.00 -1.23 0.00 -1.26 -4.84 105.19 100.66 1y5a n GLY 174 Ca 0.14 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.21 1y5a n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1y5a n GLN 175 N -1.13 2.27 -3.54 1.61 1.13 -0.85 -4.99 117.38 111.89 1y5a n GLN 175 Ca 0.00 -0.04 -0.37 0.00 -1.94 0.00 0.00 57.00 54.65 1y5a n GLN 175 Cb 0.19 -1.07 -0.09 0.00 0.11 0.00 0.00 30.24 29.38 1y5a n GLN 175 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1y5a s ILE 176 N -2.24 5.29 0.51 5.09 -1.09 -1.25 -5.03 121.20 122.48 1y5a s ILE 176 Ca 0.00 0.42 0.09 0.00 -2.23 0.00 0.00 60.65 58.93 1y5a s ILE 176 Cb 0.07 -3.60 0.05 0.00 -1.58 0.00 0.00 42.46 37.40 1y5a s ILE 176 CO 0.39 0.31 0.70 0.42 -1.23 0.00 0.00 174.94 175.53 1y5a s THR 177 N 1.13 2.50 -0.49 2.92 -4.23 -1.26 -5.00 115.64 111.22 1y5a s THR 177 Ca 0.13 -1.00 0.20 0.00 -1.18 0.00 0.00 61.69 59.84 1y5a s THR 177 Cb -0.14 -2.51 0.21 0.00 1.34 0.00 0.00 72.50 71.40 1y5a s THR 177 CO 0.06 0.00 1.62 -1.54 -0.54 0.00 0.00 174.62 174.22 1y5a n SER 178 N -2.08 0.52 -0.64 3.99 3.41 -1.26 -2.09 113.62 115.46 1y5a n SER 178 Ca 0.12 0.67 0.06 0.00 -0.26 0.00 0.00 58.87 59.46 1y5a n SER 178 Cb 0.60 -0.76 0.15 0.00 -0.26 0.00 0.00 64.21 63.95 1y5a n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1y5a n ASN 179 N -2.12 1.87 -4.14 4.04 3.02 -1.26 -4.90 115.26 111.77 1y5a n ASN 179 Ca 0.01 -2.00 -0.18 0.00 -0.03 0.00 0.00 54.58 52.37 1y5a n ASN 179 Cb 0.15 -0.24 -0.13 0.00 -0.61 0.00 0.00 39.78 38.96 1y5a n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1y5a s MET 180 N -1.54 0.83 0.06 3.52 -1.94 -0.89 -1.08 119.30 118.26 1y5a s MET 180 Ca 0.23 -0.82 -0.04 0.00 -1.71 0.00 0.00 55.69 53.36 1y5a s MET 180 Cb 0.12 -0.81 -0.03 0.00 2.01 0.00 0.00 34.83 36.12 1y5a s MET 180 CO 0.16 0.19 0.04 -0.59 -0.01 0.00 0.00 175.02 174.81 1y5a s PHE 181 N -1.05 0.38 0.06 -0.03 -0.12 -0.29 -4.78 117.98 112.14 1y5a s PHE 181 Ca -0.01 -0.87 0.02 0.00 -0.05 0.00 0.00 56.93 56.02 1y5a s PHE 181 Cb -0.09 -0.27 -0.04 0.00 -0.63 0.00 0.00 43.02 42.00 1y5a s PHE 181 CO 0.02 -0.42 0.09 0.00 -0.05 0.00 0.00 175.22 174.86 1y5a s ALA 183 N -1.35 -0.22 0.00 0.00 0.00 -0.89 -1.15 121.76 118.15 1y5a s ALA 183 Ca 0.28 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.93 1y5a s ALA 183 Cb -0.12 0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.18 1y5a s ALA 183 CO 0.21 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 176.12 1y5a n GLY 184 N 1.14 0.37 2.81 0.00 0.00 -0.59 -2.72 105.19 106.20 1y5a n GLY 184 Ca -0.21 -1.67 -0.17 0.00 0.00 0.00 0.00 46.02 43.97 1y5a n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1y5a s TYR 184 N -2.12 -0.14 0.34 1.61 1.51 -1.26 -4.27 117.35 113.01 1y5a s TYR 184 Ca 0.00 0.56 0.36 0.00 -1.01 0.00 0.00 57.07 56.97 1y5a s TYR 184 Cb 0.00 -0.29 1.70 0.00 -0.11 0.00 0.00 41.96 43.26 1y5a s TYR 184 CO 0.00 -0.26 2.12 -0.07 -1.11 0.00 0.00 175.55 176.23 1y5a h LEU 185 N 8.34 0.00 -0.19 -1.29 3.38 -1.95 -2.44 115.31 121.15 1y5a h LEU 185 Ca -0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1y5a h LEU 185 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1y5a h LEU 185 CO 0.15 0.03 0.00 -0.62 0.09 0.00 0.00 178.44 178.10 1y5a n GLU 186 N -3.20 0.18 0.00 1.13 -0.58 -1.26 -0.47 120.64 116.44 1y5a n GLU 186 Ca -0.01 0.24 0.00 0.00 -0.42 0.00 0.00 57.16 56.97 1y5a n GLU 186 Cb 0.23 -1.75 0.00 0.00 -0.57 0.00 0.00 31.44 29.34 1y5a n GLU 186 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1y5a n GLY 187 N 0.88 -0.17 0.83 0.62 0.00 -0.92 -4.48 105.19 101.96 1y5a n GLY 187 Ca 0.05 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1y5a n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y5a n GLY 188 N -0.20 3.21 2.71 -0.02 0.00 0.44 -4.96 105.19 106.37 1y5a n GLY 188 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1y5a n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y5a s LYS 188 N -0.50 0.27 0.10 1.61 1.02 -1.26 -3.46 119.74 117.53 1y5a s LYS 188 Ca 0.00 0.18 -0.26 0.00 0.02 0.00 0.00 55.97 55.91 1y5a s LYS 188 Cb 0.00 -0.91 0.08 0.00 -0.52 0.00 0.00 37.83 36.48 1y5a s LYS 188 CO 0.00 -0.36 0.96 0.34 -0.92 0.00 0.00 175.35 175.37 1y5a s ASP 189 N 2.06 -0.22 0.90 2.83 2.15 -0.58 -4.34 116.67 119.48 1y5a s ASP 189 Ca 0.04 -0.28 -0.13 0.00 0.43 0.00 0.00 52.55 52.61 1y5a s ASP 189 Cb -0.13 0.44 0.17 0.00 -0.30 0.00 0.00 42.92 43.10 1y5a s ASP 189 CO -0.05 -0.79 1.25 -0.94 -0.17 0.00 0.00 175.17 174.48 1y5a s SER 190 N -2.82 3.53 0.38 -0.34 1.04 -1.26 -0.92 113.70 113.31 1y5a s SER 190 Ca 0.10 0.28 -0.13 0.00 0.48 0.00 0.00 55.95 56.68 1y5a s SER 190 Cb -0.01 -0.45 0.05 0.00 0.10 0.00 0.00 66.02 65.70 1y5a s SER 190 CO -0.01 -2.47 0.73 0.00 0.98 0.00 0.00 173.24 172.47 1y5a n GLN 192 N -0.54 1.38 0.00 0.00 6.02 -1.26 -0.95 117.38 122.03 1y5a n GLN 192 Ca -0.07 0.50 0.00 0.00 -0.01 0.00 0.00 57.00 57.42 1y5a n GLN 192 Cb 0.60 -2.16 0.00 0.00 1.02 0.00 0.00 30.24 29.70 1y5a n GLN 192 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1y5a n GLY 193 N 2.69 1.21 0.03 1.08 0.00 -1.26 -0.97 105.19 107.98 1y5a n GLY 193 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 1y5a n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1y5a n ASP 194 N 0.00 0.63 -4.64 1.61 8.00 -0.12 -3.82 116.55 118.21 1y5a n ASP 194 Ca 0.00 -0.16 -0.42 0.00 0.71 0.00 0.00 54.79 54.92 1y5a n ASP 194 Cb 0.00 0.49 0.01 0.00 -0.02 0.00 0.00 41.12 41.59 1y5a n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1y5a n SER 195 N -1.87 1.67 0.00 -2.24 7.64 -1.26 -1.68 113.62 115.88 1y5a n SER 195 Ca 0.03 1.08 0.00 0.00 1.01 0.00 0.00 58.87 60.99 1y5a n SER 195 Cb 0.41 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.22 1y5a n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1y5a n GLY 196 N 1.07 2.50 3.91 0.23 0.00 -0.27 -0.33 105.19 112.30 1y5a n GLY 196 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1y5a n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1y5a s GLY 197 N -1.90 1.69 0.34 -0.02 0.00 -0.68 -3.28 107.32 103.48 1y5a s GLY 197 Ca 0.00 -0.94 -0.22 0.00 0.00 0.00 0.00 44.72 43.57 1y5a s GLY 197 CO 0.00 -0.30 0.88 2.56 0.00 0.00 0.00 173.10 176.25 1y5a s PRO 198 N -5.74 4.33 -0.28 2.90 0.04 -1.26 -1.36 135.00 133.64 1y5a s PRO 198 Ca 0.68 1.10 0.03 0.00 0.04 0.00 0.00 61.00 62.85 1y5a s PRO 198 Cb -0.07 -2.55 0.07 0.00 0.04 0.00 0.00 34.50 31.98 1y5a s PRO 198 CO 0.51 0.18 -0.07 0.08 0.04 0.00 0.00 177.00 177.74 1y5a s VAL 199 N -1.84 2.27 -0.13 -0.36 1.01 -0.07 -3.44 120.40 117.84 1y5a s VAL 199 Ca 0.54 -1.75 -0.01 0.00 0.00 0.00 0.00 61.98 60.76 1y5a s VAL 199 Cb -0.14 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 1y5a s VAL 199 CO 0.19 -0.14 -0.12 -0.69 0.00 0.00 0.00 175.10 174.34 1y5a s VAL 200 N 1.08 3.19 -0.10 2.92 1.01 -0.50 -1.10 120.40 126.91 1y5a s VAL 200 Ca -0.05 -0.61 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 1y5a s VAL 200 Cb -0.20 -2.35 0.03 0.00 0.00 0.00 0.00 36.38 33.86 1y5a s VAL 200 CO -0.05 0.52 -0.04 0.00 0.00 0.00 0.00 175.10 175.53 1y5a n SER 202 N 5.03 -4.11 0.00 0.00 7.64 -1.26 -1.59 113.62 119.34 1y5a n SER 202 Ca -0.10 -0.83 0.00 0.00 1.01 0.00 0.00 58.87 58.95 1y5a n SER 202 Cb 0.50 -3.68 0.00 0.00 -1.01 0.00 0.00 64.21 60.02 1y5a n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1y5a n GLY 203 N -1.65 0.81 3.34 0.23 0.00 -1.26 -5.02 105.19 101.63 1y5a n GLY 203 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1y5a n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y5a s LYS 204 N -0.20 1.81 -0.77 1.61 -0.14 -0.62 -4.03 119.74 117.41 1y5a s LYS 204 Ca 0.00 -1.08 -0.26 0.00 -1.36 0.00 0.00 55.97 53.27 1y5a s LYS 204 Cb 0.00 -1.96 0.02 0.00 -1.68 0.00 0.00 37.83 34.21 1y5a s LYS 204 CO 0.00 0.51 1.47 -1.17 -0.76 0.00 0.00 175.35 175.40 1y5a s LEU 209 N -1.17 3.24 0.00 3.17 2.96 -0.25 -1.10 118.68 125.53 1y5a s LEU 209 Ca 0.11 -0.46 0.22 0.00 -0.22 0.00 0.00 54.13 53.78 1y5a s LEU 209 Cb -0.10 -2.56 -0.28 0.00 0.50 0.00 0.00 46.19 43.75 1y5a s LEU 209 CO 0.02 -1.95 0.55 0.00 -1.32 0.00 0.00 176.35 173.65 1y5a n GLN 210 N 9.23 0.65 -4.05 1.98 1.13 -0.26 -4.15 117.38 121.91 1y5a n GLN 210 Ca 0.14 -0.14 -0.10 0.00 -1.94 0.00 0.00 57.00 54.96 1y5a n GLN 210 Cb 0.50 -1.57 -0.08 0.00 0.11 0.00 0.00 30.24 29.20 1y5a n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1y5a s GLY 211 N -4.53 0.73 -0.06 1.08 0.00 -0.69 -1.32 107.32 102.52 1y5a s GLY 211 Ca -0.07 -1.17 0.02 0.00 0.00 0.00 0.00 44.72 43.51 1y5a s GLY 211 CO 0.89 -1.09 -0.13 -0.42 0.00 0.00 0.00 173.10 172.35 1y5a s ILE 212 N -4.01 1.18 -0.07 0.90 1.01 -1.05 -0.89 121.20 118.28 1y5a s ILE 212 Ca 0.21 -0.51 -0.31 0.00 0.00 0.00 0.00 60.65 60.03 1y5a s ILE 212 Cb 0.05 -1.07 -0.09 0.00 0.01 0.00 0.00 42.46 41.36 1y5a s ILE 212 CO 0.01 0.36 2.01 0.52 0.00 0.00 0.00 174.94 177.85 1y5a n VAL 213 N 3.75 0.61 0.02 2.92 0.31 -0.46 -1.28 118.33 124.19 1y5a n VAL 213 Ca -0.22 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 1y5a n VAL 213 Cb 0.52 -2.22 0.00 0.00 -0.91 0.00 0.00 33.84 31.23 1y5a n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1y5a n SER 214 N 8.28 0.36 -2.27 4.52 2.88 -1.06 -1.12 113.62 125.21 1y5a n SER 214 Ca 0.24 0.05 -0.07 0.00 -1.33 0.00 0.00 58.87 57.75 1y5a n SER 214 Cb 0.38 -0.11 0.01 0.00 -0.75 0.00 0.00 64.21 63.74 1y5a n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1y5a n TRP 215 N -2.83 -1.77 -3.34 0.66 4.27 -0.54 -4.95 117.44 108.94 1y5a n TRP 215 Ca 0.00 -1.38 0.00 0.00 -3.89 0.00 0.00 57.50 52.23 1y5a n TRP 215 Cb 0.00 0.59 0.00 0.00 -1.36 0.00 0.00 31.31 30.54 1y5a n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1y5a n GLY 216 N -0.38 -0.96 2.91 -1.67 0.00 -1.26 -0.45 105.19 103.38 1y5a n GLY 216 Ca -0.05 -0.87 -0.30 0.00 0.00 0.00 0.00 46.02 44.80 1y5a n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1y5a s SER 217 N -4.00 3.93 0.78 1.61 0.15 -1.26 -5.02 113.70 109.89 1y5a s SER 217 Ca 0.00 -1.34 0.00 0.00 0.70 0.00 0.00 55.95 55.31 1y5a s SER 217 Cb 0.00 -1.15 0.00 0.00 -1.71 0.00 0.00 66.02 63.16 1y5a s SER 217 CO 0.00 -0.28 0.00 0.61 1.20 0.00 0.00 173.24 174.77 1y5a n GLY 219 N 4.67 0.65 2.81 9.45 0.00 -1.26 -4.59 105.19 116.92 1y5a n GLY 219 Ca -0.09 -0.76 -0.15 0.00 0.00 0.00 0.00 46.02 45.02 1y5a n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y5a n ALA 221 N 4.45 -0.56 -2.34 0.00 0.00 -1.26 -4.56 120.51 116.23 1y5a n ALA 221 Ca -0.22 0.16 -0.31 0.00 0.00 0.00 0.00 53.44 53.06 1y5a n ALA 221 Cb 0.50 -2.21 -0.05 0.00 0.00 0.00 0.00 19.45 17.69 1y5a n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1y5a s GLN 221 N -5.00 3.83 0.34 0.00 -1.52 -1.26 -0.42 119.66 115.63 1y5a s GLN 221 Ca 0.07 0.36 -0.29 0.00 -1.95 0.00 0.00 55.36 53.55 1y5a s GLN 221 Cb -0.03 -2.57 -0.11 0.00 -0.22 0.00 0.00 33.01 30.09 1y5a s GLN 221 CO 0.08 0.23 1.46 0.21 -0.25 0.00 0.00 175.29 177.02 1y5a s LYS 222 N -3.06 4.18 -1.64 2.91 2.20 -1.26 -2.53 119.74 120.55 1y5a s LYS 222 Ca 0.49 2.47 0.00 0.00 -0.36 0.00 0.00 55.97 58.57 1y5a s LYS 222 Cb -0.11 -3.01 0.00 0.00 -1.51 0.00 0.00 37.83 33.20 1y5a s LYS 222 CO 0.22 -0.46 0.00 0.09 -0.36 0.00 0.00 175.35 174.84 1y5a n ASN 223 N 0.94 -5.31 -3.42 1.43 3.02 0.38 -4.92 115.26 107.38 1y5a n ASN 223 Ca 0.02 0.38 -0.26 0.00 -0.03 0.00 0.00 54.58 54.69 1y5a n ASN 223 Cb 0.40 -4.17 -0.09 0.00 -0.61 0.00 0.00 39.78 35.31 1y5a n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1y5a n LYS 224 N -1.94 1.27 -1.36 3.52 4.76 -1.05 -4.66 118.16 118.71 1y5a n LYS 224 Ca -0.15 -3.82 -0.30 0.00 -2.87 0.00 0.00 58.31 51.17 1y5a n LYS 224 Cb 0.58 -1.78 0.11 0.00 -1.84 0.00 0.00 35.03 32.10 1y5a n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1y5a s PRO 225 N -1.30 1.76 0.58 1.97 0.04 -1.26 -4.43 135.00 132.36 1y5a s PRO 225 Ca 0.34 0.80 -0.19 0.00 0.04 0.00 0.00 61.00 61.99 1y5a s PRO 225 Cb 0.10 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.73 1y5a s PRO 225 CO -0.11 -1.89 1.21 0.20 0.04 0.00 0.00 177.00 176.45 1y5a s GLY 226 N -3.61 2.75 -0.10 0.56 0.00 -1.10 -4.68 107.32 101.14 1y5a s GLY 226 Ca 0.62 1.02 0.02 0.00 0.00 0.00 0.00 44.72 46.38 1y5a s GLY 226 CO 0.56 1.42 -0.16 0.14 0.00 0.00 0.00 173.10 175.06 1y5a s VAL 227 N -1.58 2.85 -0.01 1.40 1.01 0.41 -2.09 120.40 122.40 1y5a s VAL 227 Ca 0.76 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 62.02 1y5a s VAL 227 Cb -0.31 -2.15 -0.01 0.00 0.00 0.00 0.00 36.38 33.92 1y5a s VAL 227 CO 0.34 0.55 -0.11 -0.31 0.00 0.00 0.00 175.10 175.57 1y5a s TYR 228 N -0.03 1.01 0.16 5.22 1.51 0.06 -1.47 117.35 123.81 1y5a s TYR 228 Ca -0.04 -0.20 -0.31 0.00 -1.01 0.00 0.00 57.07 55.51 1y5a s TYR 228 Cb -0.14 -0.66 -0.09 0.00 -0.11 0.00 0.00 41.96 40.96 1y5a s TYR 228 CO 0.04 -0.03 1.45 0.99 -1.11 0.00 0.00 175.55 176.89 1y5a s THR 229 N -0.20 2.97 -1.02 -0.71 2.01 -0.41 -1.14 115.64 117.14 1y5a s THR 229 Ca 0.03 0.72 -0.19 0.00 0.31 0.00 0.00 61.69 62.56 1y5a s THR 229 Cb -0.05 -3.46 0.11 0.00 0.01 0.00 0.00 72.50 69.11 1y5a s THR 229 CO -0.00 0.07 1.30 -0.75 -0.69 0.00 0.00 174.62 174.55 1y5a s LYS 230 N 0.81 3.70 0.50 4.92 2.20 -0.24 -2.53 119.74 129.10 1y5a s LYS 230 Ca 0.65 -1.72 0.18 0.00 -0.36 0.00 0.00 55.97 54.71 1y5a s LYS 230 Cb -0.40 -5.11 1.25 0.00 -1.51 0.00 0.00 37.83 32.06 1y5a s LYS 230 CO 0.33 -1.93 2.08 0.28 -0.36 0.00 0.00 175.35 175.75 1y5a h VAL 231 N 5.91 0.92 -0.15 4.02 2.07 -1.49 -2.42 116.25 125.10 1y5a h VAL 231 Ca 0.21 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.75 1y5a h VAL 231 Cb 0.99 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1y5a h VAL 231 CO 1.24 0.02 0.13 0.00 0.02 0.00 0.00 177.57 178.97 1y5a h ASN 233 N 0.00 0.00 -0.23 0.00 4.21 -1.83 -3.19 115.58 114.54 1y5a h ASN 233 Ca 0.07 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.58 1y5a h ASN 233 Cb 0.32 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.52 1y5a h ASN 233 CO -0.00 0.00 0.00 -1.22 -1.29 0.00 0.00 177.43 174.92 1y5a n TYR 234 N -2.33 0.30 -0.17 1.19 4.01 -0.26 -4.70 117.16 115.20 1y5a n TYR 234 Ca 0.03 -0.28 -0.09 0.00 -0.16 0.00 0.00 57.90 57.39 1y5a n TYR 234 Cb 0.30 -0.01 0.04 0.00 -0.31 0.00 0.00 39.34 39.35 1y5a n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1y5a h VAL 235 N 2.39 1.27 -0.50 -0.72 2.07 -1.55 0.79 116.25 119.99 1y5a h VAL 235 Ca 0.00 -1.26 -0.02 0.00 0.82 0.00 0.00 66.70 66.23 1y5a h VAL 235 Cb 0.66 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1y5a h VAL 235 CO 0.00 0.44 0.22 -1.28 0.02 0.00 0.00 177.57 176.97 1y5a h SER 236 N 0.87 0.68 -0.80 0.57 0.87 -1.85 -0.12 113.55 113.77 1y5a h SER 236 Ca 0.14 -0.15 -0.05 0.00 -1.23 0.00 0.00 61.79 60.49 1y5a h SER 236 Cb 0.67 -0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 62.42 1y5a h SER 236 CO 0.05 0.65 0.32 -0.25 -0.53 0.00 0.00 176.83 177.06 1y5a h TRP 237 N 0.67 1.22 -0.03 2.24 7.01 -1.77 -1.11 115.95 124.18 1y5a h TRP 237 Ca 0.17 -0.09 -0.00 0.00 2.11 0.00 0.00 58.89 61.07 1y5a h TRP 237 Cb 0.17 -0.37 -0.00 0.00 -2.10 0.00 0.00 29.16 26.86 1y5a h TRP 237 CO 0.00 0.92 0.01 0.82 -2.79 0.00 0.00 178.44 177.41 1y5a h ILE 238 N 1.17 1.10 -0.57 2.65 2.04 -0.48 0.69 117.51 124.10 1y5a h ILE 238 Ca 0.27 -0.29 -0.08 0.00 1.00 0.00 0.00 64.86 65.76 1y5a h ILE 238 Cb 0.22 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 1y5a h ILE 238 CO -0.02 0.08 0.04 0.11 0.00 0.00 0.00 178.15 178.36 1y5a h LYS 239 N -0.07 0.99 -0.49 2.37 1.57 -0.78 -0.38 116.57 119.79 1y5a h LYS 239 Ca 0.01 -0.30 -0.11 0.00 -1.87 0.00 0.00 60.65 58.39 1y5a h LYS 239 Cb 0.12 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1y5a h LYS 239 CO -0.00 0.97 -0.12 1.96 -0.57 0.00 0.00 179.45 181.68 1y5a h GLN 240 N 0.88 0.94 -0.06 3.15 4.20 -1.15 -2.29 115.11 120.78 1y5a h GLN 240 Ca 0.17 -0.36 -0.01 0.00 0.06 0.00 0.00 58.65 58.51 1y5a h GLN 240 Cb 0.50 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 1y5a h GLN 240 CO 0.02 1.02 0.00 1.15 -0.67 0.00 0.00 178.83 180.36 1y5a h THR 241 N 0.79 1.25 -0.18 -0.54 2.02 -0.53 -2.85 112.91 112.87 1y5a h THR 241 Ca 0.12 -0.77 -0.11 0.00 0.77 0.00 0.00 66.41 66.43 1y5a h THR 241 Cb 0.68 1.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 1y5a h THR 241 CO 0.05 0.21 -0.35 0.16 0.37 0.00 0.00 175.52 175.96 1y5a h ILE 242 N -0.18 1.29 0.00 3.11 3.07 -1.10 -2.50 117.51 121.20 1y5a h ILE 242 Ca 0.02 -1.42 -0.02 0.00 1.55 0.00 0.00 64.86 64.98 1y5a h ILE 242 Cb 0.33 1.53 -0.00 0.00 -0.27 0.00 0.00 36.82 38.41 1y5a h ILE 242 CO 0.00 0.44 -0.09 0.00 -1.05 0.00 0.00 178.15 177.45 1y5a h ALA 243 N 1.30 1.20 -0.52 0.16 0.00 -1.37 -2.94 119.26 117.09 1y5a h ALA 243 Ca 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1y5a h ALA 243 Cb 0.77 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1y5a h ALA 243 CO 0.06 0.12 0.00 0.43 0.00 0.00 0.00 179.25 179.86 1y5a n SER 244 N -3.49 3.48 0.00 0.00 7.64 -0.97 -5.10 113.62 115.19 1y5a n SER 244 Ca -0.02 -1.97 0.00 0.00 1.01 0.00 0.00 58.87 57.90 1y5a n SER 244 Cb 0.24 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.10 1y5a n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62