#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y3u s VAL 17 N 0.00 5.36 -0.38 1.39 1.01 0.89 -4.00 120.40 124.67 1y3u s VAL 17 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.29 1y3u s VAL 17 Cb 0.00 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.84 1y3u s VAL 17 CO 0.00 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.10 1y3u n GLY 18 N 3.69 0.60 0.00 4.51 0.00 -1.24 -1.44 105.19 111.31 1y3u n GLY 18 Ca -0.14 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1y3u n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y3u n GLY 19 N -2.34 1.91 3.14 -0.02 0.00 -1.26 -4.89 105.19 101.72 1y3u n GLY 19 Ca -0.04 -2.01 -0.09 0.00 0.00 0.00 0.00 46.02 43.88 1y3u n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1y3u s TYR 20 N 2.19 0.77 -0.12 1.61 1.13 -0.23 -4.92 117.35 117.78 1y3u s TYR 20 Ca 0.00 -1.00 -0.29 0.00 -1.41 0.00 0.00 57.07 54.36 1y3u s TYR 20 Cb 0.00 -0.48 -0.04 0.00 -1.10 0.00 0.00 41.96 40.34 1y3u s TYR 20 CO 0.00 -0.26 1.61 0.99 -2.51 0.00 0.00 175.55 175.38 1y3u s THR 21 N -3.77 3.68 0.23 -3.49 2.01 -1.26 -0.12 115.64 112.93 1y3u s THR 21 Ca 0.12 0.80 -0.07 0.00 0.31 0.00 0.00 61.69 62.85 1y3u s THR 21 Cb 0.06 -3.57 0.21 0.00 0.01 0.00 0.00 72.50 69.21 1y3u s THR 21 CO -0.06 -0.13 1.86 0.00 -0.69 0.00 0.00 174.62 175.60 1y3u n GLY 23 N -1.16 2.11 3.67 0.00 0.00 -1.26 -4.83 105.19 103.73 1y3u n GLY 23 Ca 0.10 -1.47 -0.49 0.00 0.00 0.00 0.00 46.02 44.16 1y3u n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y3u n ALA 24 N 2.26 0.71 -2.04 4.61 0.00 -1.26 -1.99 120.51 122.80 1y3u n ALA 24 Ca 0.00 0.37 -0.19 0.00 0.00 0.00 0.00 53.44 53.62 1y3u n ALA 24 Cb 0.00 -2.37 -0.04 0.00 0.00 0.00 0.00 19.45 17.04 1y3u n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1y3u n ASN 25 N 5.01 -5.39 -0.00 0.00 3.02 -1.26 -4.86 115.26 111.77 1y3u n ASN 25 Ca 0.21 0.17 0.13 0.00 -0.03 0.00 0.00 54.58 55.07 1y3u n ASN 25 Cb 0.26 -4.49 0.49 0.00 -0.61 0.00 0.00 39.78 35.43 1y3u n ASN 25 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1y3u n THR 26 N -3.40 0.00 -3.63 3.41 -2.24 -0.84 -4.13 114.28 103.45 1y3u n THR 26 Ca -0.21 -0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.30 1y3u n THR 26 Cb 0.65 -0.22 -0.10 0.00 -2.10 0.00 0.00 70.33 68.56 1y3u n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1y3u n VAL 27 N -1.48 1.04 0.52 2.28 0.31 -1.26 -4.97 118.33 114.77 1y3u n VAL 27 Ca 0.07 -4.60 0.10 0.00 -0.01 0.00 0.00 64.34 59.90 1y3u n VAL 27 Cb 0.34 -2.04 0.41 0.00 -0.91 0.00 0.00 33.84 31.63 1y3u n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1y3u n PRO 28 N 1.82 0.08 0.00 5.55 -0.04 -1.26 -2.01 135.00 139.14 1y3u n PRO 28 Ca 0.24 0.28 0.13 0.00 -0.04 0.00 0.00 63.50 64.11 1y3u n PRO 28 Cb 0.41 -1.64 0.32 0.00 -0.04 0.00 0.00 33.50 32.54 1y3u n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1y3u n TYR 29 N -1.80 0.00 -2.65 0.54 0.18 -1.14 -1.99 117.16 110.31 1y3u n TYR 29 Ca 0.03 0.00 -0.41 0.00 1.88 0.00 0.00 57.90 59.40 1y3u n TYR 29 Cb 0.22 -0.06 -0.04 0.00 -0.38 0.00 0.00 39.34 39.08 1y3u n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1y3u s GLN 30 N -2.35 4.62 0.25 -3.48 2.00 -0.85 -0.76 119.66 119.09 1y3u s GLN 30 Ca 0.27 1.54 0.11 0.00 -2.00 0.00 0.00 55.36 55.27 1y3u s GLN 30 Cb 0.19 -3.37 -0.05 0.00 0.80 0.00 0.00 33.01 30.59 1y3u s GLN 30 CO 0.47 0.09 -0.20 0.14 -0.50 0.00 0.00 175.29 175.29 1y3u s VAL 31 N 0.23 2.34 -0.15 1.34 -7.23 -0.39 -4.49 120.40 112.06 1y3u s VAL 31 Ca 0.50 -2.28 -0.01 0.00 -1.81 0.00 0.00 61.98 58.37 1y3u s VAL 31 Cb -0.25 -2.21 -0.02 0.00 0.56 0.00 0.00 36.38 34.46 1y3u s VAL 31 CO 0.31 -0.36 -0.10 -0.55 -0.31 0.00 0.00 175.10 174.09 1y3u s SER 32 N -3.27 4.20 -0.21 4.85 0.15 -0.56 -2.33 113.70 116.54 1y3u s SER 32 Ca 0.26 -0.30 -0.18 0.00 0.70 0.00 0.00 55.95 56.43 1y3u s SER 32 Cb -0.05 -1.66 -0.03 0.00 -1.71 0.00 0.00 66.02 62.56 1y3u s SER 32 CO 0.13 0.14 0.51 -0.76 1.20 0.00 0.00 173.24 174.46 1y3u s LEU 33 N 0.52 4.12 -0.07 3.45 1.43 0.19 -0.49 118.68 127.84 1y3u s LEU 33 Ca -0.07 0.63 0.03 0.00 -1.03 0.00 0.00 54.13 53.70 1y3u s LEU 33 Cb -0.15 -2.69 0.01 0.00 0.03 0.00 0.00 46.19 43.38 1y3u s LEU 33 CO 0.04 -0.20 -0.16 0.21 0.23 0.00 0.00 176.35 176.46 1y3u s ASN 34 N 1.24 2.20 -0.34 2.29 3.84 -0.32 -1.21 114.94 122.63 1y3u s ASN 34 Ca 0.23 -0.38 0.12 0.00 0.21 0.00 0.00 52.86 53.05 1y3u s ASN 34 Cb -0.15 -0.90 0.46 0.00 -0.55 0.00 0.00 41.25 40.10 1y3u s ASN 34 CO 0.09 0.10 1.08 -1.54 -2.79 0.00 0.00 177.10 174.04 1y3u n SER 37 N 3.55 3.24 0.00 -4.21 3.41 -1.26 -0.48 113.62 117.87 1y3u n SER 37 Ca -0.21 -3.13 0.00 0.00 -0.26 0.00 0.00 58.87 55.28 1y3u n SER 37 Cb 0.52 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 1y3u n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y3u n GLY 38 N -0.43 0.58 3.57 5.00 0.00 -1.26 -5.00 105.19 107.66 1y3u n GLY 38 Ca 0.26 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.21 1y3u n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1y3u s TYR 39 N -2.31 -0.25 0.11 1.61 1.13 -1.26 -5.14 117.35 111.24 1y3u s TYR 39 Ca 0.00 0.28 -0.31 0.00 -1.41 0.00 0.00 57.07 55.63 1y3u s TYR 39 Cb 0.00 0.50 -0.08 0.00 -1.10 0.00 0.00 41.96 41.28 1y3u s TYR 39 CO 0.00 -0.31 1.35 -1.58 -2.51 0.00 0.00 175.55 172.51 1y3u s HIS 40 N -1.99 3.28 0.00 -3.49 5.65 -1.26 -4.26 115.29 113.21 1y3u s HIS 40 Ca 0.05 1.02 0.00 0.00 0.25 0.00 0.00 55.06 56.38 1y3u s HIS 40 Cb -0.01 -3.63 0.00 0.00 -1.18 0.00 0.00 32.58 27.76 1y3u s HIS 40 CO -0.04 -2.17 0.00 1.97 -0.65 0.00 0.00 174.74 173.85 1y3u n PHE 41 N 3.87 0.00 -3.42 3.88 1.16 -0.35 -4.99 117.46 117.61 1y3u n PHE 41 Ca 0.11 0.00 -0.12 0.00 -1.87 0.00 0.00 57.45 55.57 1y3u n PHE 41 Cb 0.43 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.28 1y3u n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1y3u s GLY 43 N -2.70 1.76 0.09 0.00 0.00 0.17 -0.64 107.32 106.00 1y3u s GLY 43 Ca 0.01 -2.01 -0.26 0.00 0.00 0.00 0.00 44.72 42.46 1y3u s GLY 43 CO -0.12 -1.55 1.14 -0.32 0.00 0.00 0.00 173.10 172.25 1y3u s GLY 44 N -4.65 -0.10 -0.06 0.20 0.00 -0.98 -3.83 107.32 97.89 1y3u s GLY 44 Ca 0.62 0.03 0.02 0.00 0.00 0.00 0.00 44.72 45.39 1y3u s GLY 44 CO 0.40 2.49 -0.09 -0.56 0.00 0.00 0.00 173.10 175.33 1y3u s SER 45 N -3.37 1.51 -0.13 1.64 0.01 -0.69 -1.26 113.70 111.40 1y3u s SER 45 Ca 0.21 -0.24 -0.29 0.00 1.31 0.00 0.00 55.95 56.93 1y3u s SER 45 Cb -0.00 -0.70 -0.02 0.00 0.21 0.00 0.00 66.02 65.51 1y3u s SER 45 CO 0.01 -0.00 1.29 -0.22 0.41 0.00 0.00 173.24 174.73 1y3u s LEU 46 N 0.78 4.21 -0.01 2.44 2.96 0.06 -1.12 118.68 128.01 1y3u s LEU 46 Ca -0.13 1.77 0.09 0.00 -0.22 0.00 0.00 54.13 55.64 1y3u s LEU 46 Cb -0.15 -3.54 -0.12 0.00 0.50 0.00 0.00 46.19 42.88 1y3u s LEU 46 CO 0.02 -0.75 0.30 2.30 -1.32 0.00 0.00 176.35 176.91 1y3u n ILE 47 N 5.24 0.00 -2.83 6.68 -5.35 -0.35 -0.80 119.36 121.96 1y3u n ILE 47 Ca 0.14 -0.26 0.00 0.00 -0.27 0.00 0.00 62.75 62.36 1y3u n ILE 47 Cb 0.45 0.70 0.00 0.00 -1.74 0.00 0.00 39.64 39.05 1y3u n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1y3u n ASN 48 N -1.47 0.00 0.00 7.28 0.23 -1.20 -4.62 115.26 115.48 1y3u n ASN 48 Ca 0.00 -0.71 0.13 0.00 -0.53 0.00 0.00 54.58 53.48 1y3u n ASN 48 Cb 0.18 0.00 0.63 0.00 -2.08 0.00 0.00 39.78 38.51 1y3u n ASN 48 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1y3u n SER 49 N -0.87 0.00 0.00 0.53 3.41 -1.26 -3.52 113.62 111.91 1y3u n SER 49 Ca 0.00 0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 1y3u n SER 49 Cb 0.00 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.58 1y3u n SER 49 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1y3u n GLN 50 N -1.37 -0.18 -4.22 4.33 7.27 -1.26 -0.15 117.38 121.79 1y3u n GLN 50 Ca 0.10 -0.54 -0.18 0.00 0.07 0.00 0.00 57.00 56.45 1y3u n GLN 50 Cb 0.25 -0.88 -0.15 0.00 2.41 0.00 0.00 30.24 31.88 1y3u n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1y3u s TRP 51 N -0.14 0.63 -0.01 3.69 0.52 -1.23 -0.50 118.94 121.89 1y3u s TRP 51 Ca 0.00 -0.13 0.07 0.00 0.02 0.00 0.00 56.10 56.06 1y3u s TRP 51 Cb 0.00 -0.45 -0.02 0.00 -1.15 0.00 0.00 33.47 31.85 1y3u s TRP 51 CO 0.00 -0.05 -0.21 0.08 0.02 0.00 0.00 176.95 176.79 1y3u s VAL 52 N 0.10 2.51 -0.14 4.03 1.01 0.17 -1.21 120.40 126.86 1y3u s VAL 52 Ca -0.01 -1.02 -0.06 0.00 0.00 0.00 0.00 61.98 60.89 1y3u s VAL 52 Cb -0.05 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 1y3u s VAL 52 CO -0.00 0.53 0.06 -0.69 0.00 0.00 0.00 175.10 175.00 1y3u s VAL 53 N -0.72 4.83 0.00 2.92 1.01 -0.28 -0.15 120.40 128.01 1y3u s VAL 53 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.06 1y3u s VAL 53 Cb -0.10 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.16 1y3u s VAL 53 CO 0.01 0.54 0.00 -0.24 0.00 0.00 0.00 175.10 175.41 1y3u n SER 54 N 2.75 0.00 -4.80 3.32 2.88 0.06 -1.71 113.62 116.12 1y3u n SER 54 Ca -0.18 -0.95 -0.37 0.00 -1.33 0.00 0.00 58.87 56.04 1y3u n SER 54 Cb 0.53 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 1y3u n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1y3u s ALA 55 N -1.75 3.45 0.34 -1.46 0.00 -1.26 -1.15 121.76 119.93 1y3u s ALA 55 Ca 0.00 0.19 0.04 0.00 0.00 0.00 0.00 51.96 52.19 1y3u s ALA 55 Cb 0.00 -2.82 0.67 0.00 0.00 0.00 0.00 23.12 20.97 1y3u s ALA 55 CO 0.00 0.33 1.95 0.00 0.00 0.00 0.00 175.76 178.04 1y3u h ALA 56 N 3.82 1.64 0.00 0.00 0.00 -1.70 -2.18 119.26 120.84 1y3u h ALA 56 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1y3u h ALA 56 Cb 1.20 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1y3u h ALA 56 CO 0.65 0.25 0.00 -2.39 0.00 0.00 0.00 179.25 177.76 1y3u n HIS 57 N -4.48 0.00 1.25 0.00 1.44 -1.26 -1.29 115.22 110.88 1y3u n HIS 57 Ca 0.11 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.95 1y3u n HIS 57 Cb 0.21 -0.10 0.31 0.00 0.12 0.00 0.00 29.99 30.53 1y3u n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1y3u n TYR 59 N 0.17 2.12 -3.88 0.00 9.36 -0.41 -4.99 117.16 119.55 1y3u n TYR 59 Ca 0.15 0.36 -0.09 0.00 3.32 0.00 0.00 57.90 61.63 1y3u n TYR 59 Cb 0.42 -2.49 -0.00 0.00 -0.63 0.00 0.00 39.34 36.64 1y3u n TYR 59 CO 0.00 0.00 0.00 -1.59 0.22 0.00 0.00 176.86 175.49 1y3u s LYS 60 N 0.63 2.03 0.28 2.98 -2.85 -1.26 -5.15 119.74 116.40 1y3u s LYS 60 Ca 0.78 -1.36 -0.05 0.00 -1.00 0.00 0.00 55.97 54.34 1y3u s LYS 60 Cb -0.72 0.58 -0.05 0.00 -2.06 0.00 0.00 37.83 35.58 1y3u s LYS 60 CO 0.41 -0.93 0.55 -1.54 0.10 0.00 0.00 175.35 173.95 1y3u s SER 61 N -3.05 6.45 0.00 0.03 1.04 -1.26 -4.50 113.70 112.41 1y3u s SER 61 Ca 0.17 0.72 0.00 0.00 0.48 0.00 0.00 55.95 57.32 1y3u s SER 61 Cb -0.04 -2.15 0.00 0.00 0.10 0.00 0.00 66.02 63.93 1y3u s SER 61 CO 0.11 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.76 1y3u n GLY 62 N -0.88 0.68 3.70 7.32 0.00 -1.26 -5.02 105.19 109.73 1y3u n GLY 62 Ca -0.02 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 1y3u n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y3u s ILE 63 N -2.11 4.96 -0.19 -0.61 1.01 -1.26 -4.56 121.20 118.44 1y3u s ILE 63 Ca 0.00 1.64 -0.06 0.00 0.00 0.00 0.00 60.65 62.24 1y3u s ILE 63 Cb 0.00 -4.13 -0.03 0.00 0.01 0.00 0.00 42.46 38.31 1y3u s ILE 63 CO 0.00 0.16 0.01 -1.58 0.00 0.00 0.00 174.94 173.54 1y3u s GLN 64 N 1.26 3.74 -0.10 2.79 0.74 0.37 -1.63 119.66 126.83 1y3u s GLN 64 Ca 0.41 -0.46 -0.20 0.00 0.05 0.00 0.00 55.36 55.16 1y3u s GLN 64 Cb -0.18 -3.10 -0.04 0.00 1.10 0.00 0.00 33.01 30.79 1y3u s GLN 64 CO 0.19 0.14 0.55 0.08 -0.55 0.00 0.00 175.29 175.70 1y3u s VAL 65 N 0.69 5.13 -0.26 1.34 1.01 0.93 -1.18 120.40 128.07 1y3u s VAL 65 Ca 0.01 1.12 -0.01 0.00 0.00 0.00 0.00 61.98 63.10 1y3u s VAL 65 Cb -0.14 -3.89 0.04 0.00 0.00 0.00 0.00 36.38 32.38 1y3u s VAL 65 CO 0.02 0.31 -0.06 -0.13 0.00 0.00 0.00 175.10 175.24 1y3u s ARG 66 N 0.64 2.67 0.15 2.72 0.52 0.36 -1.16 118.95 124.85 1y3u s ARG 66 Ca 0.30 -1.09 0.04 0.00 -0.52 0.00 0.00 55.73 54.46 1y3u s ARG 66 Cb -0.16 -3.00 -0.04 0.00 0.52 0.00 0.00 34.95 32.27 1y3u s ARG 66 CO 0.13 -0.46 0.19 -0.51 0.02 0.00 0.00 175.30 174.66 1y3u s LEU 67 N 1.28 4.01 -0.85 2.53 1.43 0.40 -1.49 118.68 125.98 1y3u s LEU 67 Ca -0.02 -0.01 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1y3u s LEU 67 Cb -0.18 -2.60 0.00 0.00 0.03 0.00 0.00 46.19 43.44 1y3u s LEU 67 CO -0.04 0.07 0.00 0.61 0.23 0.00 0.00 176.35 177.22 1y3u n GLY 69 N -0.38 0.97 3.81 -3.19 0.00 -1.26 -1.27 105.19 103.87 1y3u n GLY 69 Ca -0.08 -0.45 -0.35 0.00 0.00 0.00 0.00 46.02 45.15 1y3u n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y3u s GLU 70 N -2.46 4.32 0.00 1.61 0.41 -1.26 -4.16 118.70 117.16 1y3u s GLU 70 Ca 0.00 1.09 0.00 0.00 -0.41 0.00 0.00 54.97 55.65 1y3u s GLU 70 Cb 0.00 -2.51 0.00 0.00 -1.78 0.00 0.00 34.13 29.84 1y3u s GLU 70 CO 0.00 0.16 0.00 -3.47 -0.49 0.00 0.00 175.26 171.46 1y3u n ASP 71 N -0.02 0.00 -4.61 -0.19 2.03 -1.26 -4.59 116.55 107.90 1y3u n ASP 71 Ca 0.04 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.92 1y3u n ASP 71 Cb 0.52 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.90 1y3u n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1y3u s ASN 72 N -1.33 6.75 0.00 1.67 3.84 -1.26 -3.26 114.94 121.35 1y3u s ASN 72 Ca 0.00 0.69 0.26 0.00 0.21 0.00 0.00 52.86 54.02 1y3u s ASN 72 Cb 0.00 -2.54 1.13 0.00 -0.55 0.00 0.00 41.25 39.29 1y3u s ASN 72 CO 0.00 -1.09 1.84 2.30 -2.79 0.00 0.00 177.10 177.36 1y3u n ILE 73 N 6.42 0.20 0.98 -5.21 -5.35 -0.57 -3.24 119.36 112.59 1y3u n ILE 73 Ca 0.12 0.05 0.11 0.00 -0.27 0.00 0.00 62.75 62.75 1y3u n ILE 73 Cb 0.48 -0.60 -0.01 0.00 -1.74 0.00 0.00 39.64 37.77 1y3u n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1y3u n ASN 74 N -1.48 1.92 -4.02 7.28 3.02 -1.26 -4.95 115.26 115.76 1y3u n ASN 74 Ca 0.07 -1.46 -0.19 0.00 -0.03 0.00 0.00 54.58 52.96 1y3u n ASN 74 Cb 0.30 0.52 -0.15 0.00 -0.61 0.00 0.00 39.78 39.84 1y3u n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1y3u s VAL 75 N -2.47 0.76 -0.41 2.41 1.01 -1.20 -5.11 120.40 115.39 1y3u s VAL 75 Ca 0.17 -0.39 -0.28 0.00 0.00 0.00 0.00 61.98 61.49 1y3u s VAL 75 Cb 0.17 -0.65 0.02 0.00 0.00 0.00 0.00 36.38 35.93 1y3u s VAL 75 CO 0.58 0.22 1.04 -0.69 0.00 0.00 0.00 175.10 176.25 1y3u s VAL 76 N -0.10 4.41 -0.37 2.92 1.01 -1.26 -4.73 120.40 122.28 1y3u s VAL 76 Ca 0.02 1.27 0.08 0.00 0.00 0.00 0.00 61.98 63.34 1y3u s VAL 76 Cb -0.05 -4.47 -0.09 0.00 0.00 0.00 0.00 36.38 31.77 1y3u s VAL 76 CO -0.00 -0.75 0.34 -0.62 0.00 0.00 0.00 175.10 174.07 1y3u n GLU 77 N 7.26 4.24 0.00 2.72 1.02 -1.26 -5.10 120.64 129.52 1y3u n GLU 77 Ca 0.10 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1y3u n GLU 77 Cb 0.48 -0.89 0.00 0.00 -0.02 0.00 0.00 31.44 31.01 1y3u n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y3u n GLY 78 N 1.21 2.36 2.78 0.62 0.00 -1.26 -5.00 105.19 105.90 1y3u n GLY 78 Ca 0.01 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.25 1y3u n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1y3u n ASN 79 N 0.00 0.00 -4.78 1.61 3.02 -1.26 -4.97 115.26 108.89 1y3u n ASN 79 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.18 1y3u n ASN 79 Cb 0.00 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.14 1y3u n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1y3u s GLU 80 N -0.07 4.14 -0.08 3.52 8.01 -1.26 -4.33 118.70 128.64 1y3u s GLU 80 Ca 0.00 1.63 0.01 0.00 0.01 0.00 0.00 54.97 56.62 1y3u s GLU 80 Cb 0.00 -2.61 0.02 0.00 -4.31 0.00 0.00 34.13 27.23 1y3u s GLU 80 CO 0.00 -0.19 -0.11 -0.65 0.01 0.00 0.00 175.26 174.33 1y3u s GLN 81 N -2.38 1.61 -0.23 1.61 -0.21 -0.40 -4.98 119.66 114.68 1y3u s GLN 81 Ca 0.57 -0.35 -0.05 0.00 0.02 0.00 0.00 55.36 55.54 1y3u s GLN 81 Cb -0.25 -1.43 -0.02 0.00 1.00 0.00 0.00 33.01 32.31 1y3u s GLN 81 CO 0.32 -0.06 0.01 -0.06 -2.12 0.00 0.00 175.29 173.37 1y3u s PHE 82 N 0.97 3.02 -0.06 0.91 0.08 -1.26 -0.45 117.98 121.18 1y3u s PHE 82 Ca -0.09 -0.68 -0.00 0.00 0.12 0.00 0.00 56.93 56.28 1y3u s PHE 82 Cb -0.15 -2.16 0.03 0.00 -0.57 0.00 0.00 43.02 40.16 1y3u s PHE 82 CO 0.00 -0.45 -0.02 0.42 -0.10 0.00 0.00 175.22 175.07 1y3u s ILE 83 N 1.51 0.45 0.54 0.64 1.01 -0.31 -4.99 121.20 120.06 1y3u s ILE 83 Ca 0.06 -0.00 -0.21 0.00 0.00 0.00 0.00 60.65 60.49 1y3u s ILE 83 Cb -0.15 -0.55 -0.05 0.00 0.01 0.00 0.00 42.46 41.73 1y3u s ILE 83 CO 0.00 0.24 1.30 -0.44 0.00 0.00 0.00 174.94 176.04 1y3u s SER 84 N 1.43 5.41 0.09 3.58 0.01 -1.26 -0.05 113.70 122.92 1y3u s SER 84 Ca -0.03 2.61 -0.31 0.00 1.31 0.00 0.00 55.95 59.54 1y3u s SER 84 Cb -0.13 -2.62 -0.07 0.00 0.21 0.00 0.00 66.02 63.41 1y3u s SER 84 CO -0.03 -1.46 1.27 0.00 0.41 0.00 0.00 173.24 173.43 1y3u s ALA 85 N -1.39 3.47 -0.02 1.44 0.00 -0.65 -1.12 121.76 123.49 1y3u s ALA 85 Ca 0.71 0.96 0.05 0.00 0.00 0.00 0.00 51.96 53.68 1y3u s ALA 85 Cb -0.37 -3.48 -0.24 0.00 0.00 0.00 0.00 23.12 19.04 1y3u s ALA 85 CO 0.43 -0.49 0.76 0.66 0.00 0.00 0.00 175.76 177.11 1y3u h SER 86 N 6.66 0.15 -5.00 0.00 4.64 -1.05 -3.44 113.55 115.51 1y3u h SER 86 Ca -0.42 -0.26 -0.08 0.00 -0.47 0.00 0.00 61.79 60.56 1y3u h SER 86 Cb 1.21 -0.05 -0.19 0.00 -0.31 0.00 0.00 62.40 63.06 1y3u h SER 86 CO 0.82 1.23 -0.01 -1.59 -0.87 0.00 0.00 176.83 176.41 1y3u s LYS 87 N -2.61 0.90 -0.08 4.77 -2.85 -1.19 -5.01 119.74 113.67 1y3u s LYS 87 Ca -0.07 0.03 0.03 0.00 -1.00 0.00 0.00 55.97 54.96 1y3u s LYS 87 Cb 0.08 0.42 0.01 0.00 -2.06 0.00 0.00 37.83 36.27 1y3u s LYS 87 CO 0.82 -0.28 -0.18 -1.12 0.10 0.00 0.00 175.35 174.69 1y3u s SER 88 N -1.32 2.45 -0.35 0.03 0.01 -1.26 -1.30 113.70 111.96 1y3u s SER 88 Ca -0.11 -0.43 0.02 0.00 1.31 0.00 0.00 55.95 56.73 1y3u s SER 88 Cb -0.02 -1.11 0.10 0.00 0.21 0.00 0.00 66.02 65.20 1y3u s SER 88 CO 0.07 0.10 0.07 -0.63 0.41 0.00 0.00 173.24 173.26 1y3u s ILE 89 N 0.47 2.57 0.26 1.44 1.01 0.88 -4.98 121.20 122.86 1y3u s ILE 89 Ca -0.16 -2.17 -0.30 0.00 0.00 0.00 0.00 60.65 58.03 1y3u s ILE 89 Cb -0.17 -2.80 -0.09 0.00 0.01 0.00 0.00 42.46 39.41 1y3u s ILE 89 CO 0.06 -0.55 1.03 -0.69 0.00 0.00 0.00 174.94 174.79 1y3u s VAL 90 N 1.00 3.76 0.11 2.92 1.01 -1.26 -0.92 120.40 127.02 1y3u s VAL 90 Ca 0.08 1.76 -0.35 0.00 0.00 0.00 0.00 61.98 63.47 1y3u s VAL 90 Cb -0.20 -4.12 -0.15 0.00 0.00 0.00 0.00 36.38 31.91 1y3u s VAL 90 CO -0.06 0.41 1.52 1.57 0.00 0.00 0.00 175.10 178.54 1y3u n HIS 91 N 1.30 2.04 0.21 5.22 -0.00 -0.60 -4.84 115.22 118.54 1y3u n HIS 91 Ca -0.01 0.37 0.18 0.00 0.46 0.00 0.00 57.72 58.72 1y3u n HIS 91 Cb 0.46 -2.48 0.84 0.00 -0.12 0.00 0.00 29.99 28.69 1y3u n HIS 91 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1y3u h PRO 92 N 5.71 0.00 -0.60 1.57 0.11 -1.93 -1.43 132.00 135.43 1y3u h PRO 92 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1y3u h PRO 92 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1y3u h PRO 92 CO 0.86 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 179.08 1y3u n SER 93 N -3.64 3.81 -4.69 -2.05 7.64 -1.26 -4.98 113.62 108.45 1y3u n SER 93 Ca 0.02 -2.11 -0.44 0.00 1.01 0.00 0.00 58.87 57.35 1y3u n SER 93 Cb 0.36 -0.44 -0.03 0.00 -1.01 0.00 0.00 64.21 63.09 1y3u n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y3u n TYR 94 N 1.17 2.50 -3.99 1.43 9.36 -0.54 -4.69 117.16 122.39 1y3u n TYR 94 Ca 0.21 0.20 -0.34 0.00 3.32 0.00 0.00 57.90 61.28 1y3u n TYR 94 Cb 0.62 -2.59 -0.15 0.00 -0.63 0.00 0.00 39.34 36.60 1y3u n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1y3u s ASN 95 N 0.92 4.02 0.10 2.98 3.84 -0.81 -4.98 114.94 121.01 1y3u s ASN 95 Ca 0.75 -0.72 0.23 0.00 0.21 0.00 0.00 52.86 53.33 1y3u s ASN 95 Cb -0.60 -1.63 0.91 0.00 -0.55 0.00 0.00 41.25 39.38 1y3u s ASN 95 CO 0.38 -0.07 1.71 -1.54 -2.79 0.00 0.00 177.10 174.78 1y3u n SER 96 N 4.68 0.33 -0.01 -4.21 3.41 -1.26 -0.45 113.62 116.10 1y3u n SER 96 Ca -0.18 0.56 -0.20 0.00 -0.26 0.00 0.00 58.87 58.79 1y3u n SER 96 Cb 0.49 -0.63 -0.14 0.00 -0.26 0.00 0.00 64.21 63.67 1y3u n SER 96 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1y3u h ASN 97 N 0.00 0.28 0.25 4.04 2.35 -1.98 -3.40 115.58 117.13 1y3u h ASN 97 Ca 0.00 -0.85 0.00 0.00 -0.55 0.00 0.00 56.30 54.90 1y3u h ASN 97 Cb 0.44 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.72 1y3u h ASN 97 CO 0.00 1.46 -0.92 0.35 -1.65 0.00 0.00 177.43 176.67 1y3u n THR 98 N -4.14 0.05 -1.15 2.81 -2.24 -1.14 -4.95 114.28 103.51 1y3u n THR 98 Ca -0.21 -0.09 -0.05 0.00 -2.27 0.00 0.00 64.05 61.43 1y3u n THR 98 Cb 0.79 0.54 -0.02 0.00 -2.10 0.00 0.00 70.33 69.53 1y3u n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1y3u n LEU 99 N -1.66 -0.09 -4.76 3.22 4.77 0.40 -4.99 117.00 113.89 1y3u n LEU 99 Ca 0.03 0.13 -0.41 0.00 -0.03 0.00 0.00 56.01 55.73 1y3u n LEU 99 Cb 0.37 -1.62 -0.03 0.00 -2.33 0.00 0.00 43.42 39.81 1y3u n LEU 99 CO 0.40 -0.54 0.95 0.21 -1.33 0.00 0.00 177.39 177.08 1y3u s ASN 100 N -2.41 6.90 -1.05 -1.43 3.04 -1.24 -3.07 114.94 115.67 1y3u s ASN 100 Ca 0.00 2.54 -0.05 0.00 0.04 0.00 0.00 52.86 55.39 1y3u s ASN 100 Cb 0.00 -2.63 0.01 0.00 -1.54 0.00 0.00 41.25 37.08 1y3u s ASN 100 CO 0.00 -0.46 0.90 0.59 -3.04 0.00 0.00 177.10 175.10 1y3u n ASN 101 N 1.35 -4.22 -4.28 -4.21 4.13 -1.26 -1.93 115.26 104.84 1y3u n ASN 101 Ca 0.01 -0.46 -0.43 0.00 1.68 0.00 0.00 54.58 55.39 1y3u n ASN 101 Cb 0.43 -4.20 0.00 0.00 -1.54 0.00 0.00 39.78 34.46 1y3u n ASN 101 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1y3u n ASP 102 N -2.37 4.59 -3.74 6.41 2.03 -1.17 -4.31 116.55 117.98 1y3u n ASP 102 Ca -0.08 -2.90 -0.13 0.00 0.52 0.00 0.00 54.79 52.19 1y3u n ASP 102 Cb 0.58 -1.71 -0.09 0.00 -0.72 0.00 0.00 41.12 39.18 1y3u n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1y3u s ILE 103 N 3.74 0.02 -0.03 5.18 2.07 -1.26 -4.00 121.20 126.92 1y3u s ILE 103 Ca 0.51 -0.19 -0.06 0.00 -1.41 0.00 0.00 60.65 59.51 1y3u s ILE 103 Cb 0.07 -0.58 0.01 0.00 0.13 0.00 0.00 42.46 42.09 1y3u s ILE 103 CO 0.02 -0.10 0.13 -0.32 -1.91 0.00 0.00 174.94 172.76 1y3u s MET 104 N -0.46 0.29 -0.09 3.50 -2.45 -0.30 -1.55 119.30 118.23 1y3u s MET 104 Ca -0.06 -0.06 -0.03 0.00 -1.25 0.00 0.00 55.69 54.30 1y3u s MET 104 Cb -0.04 0.13 -0.03 0.00 1.25 0.00 0.00 34.83 36.14 1y3u s MET 104 CO 0.02 -0.06 0.02 -0.51 1.05 0.00 0.00 175.02 175.55 1y3u s LEU 105 N -0.53 3.68 -0.13 4.11 1.43 -0.10 -0.76 118.68 126.39 1y3u s LEU 105 Ca -0.06 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.24 1y3u s LEU 105 Cb -0.04 -1.85 0.01 0.00 0.03 0.00 0.00 46.19 44.34 1y3u s LEU 105 CO 0.01 0.38 -0.21 -0.63 0.23 0.00 0.00 176.35 176.13 1y3u s ILE 106 N -0.86 1.92 -0.15 -0.59 1.01 0.78 -0.08 121.20 123.23 1y3u s ILE 106 Ca 0.13 -0.90 -0.14 0.00 0.00 0.00 0.00 60.65 59.74 1y3u s ILE 106 Cb -0.11 -1.70 -0.05 0.00 0.01 0.00 0.00 42.46 40.61 1y3u s ILE 106 CO 0.02 0.52 0.31 -0.75 0.00 0.00 0.00 174.94 175.05 1y3u s LYS 107 N 0.77 4.23 0.37 2.79 2.20 -0.42 -0.66 119.74 129.03 1y3u s LYS 107 Ca -0.09 0.14 -0.24 0.00 -0.36 0.00 0.00 55.97 55.42 1y3u s LYS 107 Cb -0.16 -3.41 -0.10 0.00 -1.51 0.00 0.00 37.83 32.65 1y3u s LYS 107 CO -0.00 0.26 0.97 -0.51 -0.36 0.00 0.00 175.35 175.71 1y3u s LEU 108 N 0.38 4.18 0.37 5.43 1.43 0.34 -0.52 118.68 130.29 1y3u s LEU 108 Ca 0.18 1.85 0.08 0.00 -1.03 0.00 0.00 54.13 55.20 1y3u s LEU 108 Cb -0.13 -4.20 0.72 0.00 0.03 0.00 0.00 46.19 42.60 1y3u s LEU 108 CO 0.05 -0.26 1.90 0.07 0.23 0.00 0.00 176.35 178.35 1y3u h LYS 109 N 2.65 0.35 -4.08 1.70 5.09 -1.41 -3.42 116.57 117.46 1y3u h LYS 109 Ca -0.48 -0.08 -0.14 0.00 0.09 0.00 0.00 60.65 60.05 1y3u h LYS 109 Cb 1.19 -0.05 -0.17 0.00 0.10 0.00 0.00 32.23 33.30 1y3u h LYS 109 CO 0.63 0.44 -0.66 -1.54 -2.09 0.00 0.00 179.45 176.24 1y3u s SER 110 N -6.83 0.35 0.25 7.07 1.04 -1.26 -4.99 113.70 109.33 1y3u s SER 110 Ca -0.06 -0.75 -0.30 0.00 0.48 0.00 0.00 55.95 55.32 1y3u s SER 110 Cb 0.15 0.17 -0.09 0.00 0.10 0.00 0.00 66.02 66.36 1y3u s SER 110 CO 0.74 -0.49 1.25 0.00 0.98 0.00 0.00 173.24 175.72 1y3u s ALA 111 N -2.90 3.48 0.62 5.32 0.00 -1.26 -4.88 121.76 122.14 1y3u s ALA 111 Ca -0.03 1.08 -0.18 0.00 0.00 0.00 0.00 51.96 52.84 1y3u s ALA 111 Cb 0.01 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 1y3u s ALA 111 CO -0.06 -0.46 1.19 0.00 0.00 0.00 0.00 175.76 176.43 1y3u s ALA 112 N -0.51 2.48 -0.41 0.00 0.00 0.78 -4.99 121.76 119.12 1y3u s ALA 112 Ca 0.51 0.93 -0.21 0.00 0.00 0.00 0.00 51.96 53.20 1y3u s ALA 112 Cb -0.36 -3.44 0.02 0.00 0.00 0.00 0.00 23.12 19.34 1y3u s ALA 112 CO 0.42 -1.25 0.67 0.45 0.00 0.00 0.00 175.76 176.05 1y3u s SER 113 N -1.77 6.38 0.22 0.00 0.15 -1.26 -4.89 113.70 112.54 1y3u s SER 113 Ca 0.76 -0.12 -0.30 0.00 0.70 0.00 0.00 55.95 56.99 1y3u s SER 113 Cb -0.29 -2.34 -0.09 0.00 -1.71 0.00 0.00 66.02 61.60 1y3u s SER 113 CO 0.35 -0.74 0.94 -0.76 1.20 0.00 0.00 173.24 174.22 1y3u s LEU 114 N 2.88 4.63 0.00 3.45 1.43 -1.26 -4.77 118.68 125.04 1y3u s LEU 114 Ca 0.25 1.92 0.00 0.00 -1.03 0.00 0.00 54.13 55.27 1y3u s LEU 114 Cb -0.14 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.49 1y3u s LEU 114 CO 0.18 0.14 0.00 -0.46 0.23 0.00 0.00 176.35 176.44 1y3u n ASN 115 N 1.62 0.00 0.16 2.29 0.23 0.27 -4.96 115.26 114.87 1y3u n ASN 115 Ca -0.02 -0.85 0.13 0.00 -0.53 0.00 0.00 54.58 53.31 1y3u n ASN 115 Cb 0.47 0.00 0.51 0.00 -2.08 0.00 0.00 39.78 38.68 1y3u n ASN 115 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1y3u h SER 116 N 0.00 0.00 0.00 0.53 0.02 -2.00 -2.84 113.55 109.26 1y3u h SER 116 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1y3u h SER 116 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1y3u h SER 116 CO 0.00 0.00 -1.41 0.54 -1.14 0.00 0.00 176.83 174.82 1y3u n ARG 117 N -2.44 0.93 -3.86 3.45 1.74 -1.26 -4.83 116.66 110.38 1y3u n ARG 117 Ca 0.02 -0.10 -0.30 0.00 -0.77 0.00 0.00 57.85 56.71 1y3u n ARG 117 Cb 0.29 -1.30 -0.16 0.00 -1.02 0.00 0.00 32.46 30.27 1y3u n ARG 117 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1y3u s VAL 118 N -2.83 1.26 0.07 1.55 1.01 -1.07 -4.51 120.40 115.88 1y3u s VAL 118 Ca -0.03 -1.23 -0.09 0.00 0.00 0.00 0.00 61.98 60.63 1y3u s VAL 118 Cb 0.10 -1.70 -0.00 0.00 0.00 0.00 0.00 36.38 34.78 1y3u s VAL 118 CO 0.59 -0.29 0.19 0.00 0.00 0.00 0.00 175.10 175.59 1y3u s ALA 119 N 1.49 -0.26 0.46 5.51 0.00 -0.84 -0.56 121.76 127.55 1y3u s ALA 119 Ca -0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 51.96 51.40 1y3u s ALA 119 Cb -0.18 0.43 -0.03 0.00 0.00 0.00 0.00 23.12 23.34 1y3u s ALA 119 CO -0.11 -0.47 0.74 -1.54 0.00 0.00 0.00 175.76 174.38 1y3u s SER 120 N -2.65 6.16 -0.06 0.00 1.04 -1.26 -2.87 113.70 114.06 1y3u s SER 120 Ca 0.02 0.75 0.02 0.00 0.48 0.00 0.00 55.95 57.22 1y3u s SER 120 Cb 0.03 -2.08 -0.03 0.00 0.10 0.00 0.00 66.02 64.04 1y3u s SER 120 CO -0.09 -0.58 -0.09 -0.51 0.98 0.00 0.00 173.24 172.95 1y3u s ILE 121 N -2.66 3.49 0.39 -1.02 1.10 0.02 -4.87 121.20 117.65 1y3u s ILE 121 Ca 0.47 -0.57 -0.25 0.00 -0.51 0.00 0.00 60.65 59.79 1y3u s ILE 121 Cb -0.10 -2.41 -0.09 0.00 0.15 0.00 0.00 42.46 40.01 1y3u s ILE 121 CO 0.42 0.59 1.12 -0.44 -2.11 0.00 0.00 174.94 174.52 1y3u s SER 122 N -0.81 6.66 0.36 4.50 0.01 -1.26 -4.58 113.70 118.57 1y3u s SER 122 Ca 0.12 2.22 -0.25 0.00 1.31 0.00 0.00 55.95 59.35 1y3u s SER 122 Cb -0.11 -2.60 -0.10 0.00 0.21 0.00 0.00 66.02 63.42 1y3u s SER 122 CO 0.01 -0.57 0.99 -0.76 0.41 0.00 0.00 173.24 173.32 1y3u s LEU 123 N -2.49 4.22 0.60 2.44 1.43 -1.26 -0.80 118.68 122.83 1y3u s LEU 123 Ca 0.57 1.90 -0.16 0.00 -1.03 0.00 0.00 54.13 55.41 1y3u s LEU 123 Cb -0.27 -4.13 -0.03 0.00 0.03 0.00 0.00 46.19 41.79 1y3u s LEU 123 CO 0.34 -0.26 1.07 -2.16 0.23 0.00 0.00 176.35 175.58 1y3u s PRO 124 N -2.33 3.23 -0.01 1.29 0.04 -1.26 -4.82 135.00 131.14 1y3u s PRO 124 Ca 0.54 1.27 0.22 0.00 0.04 0.00 0.00 61.00 63.07 1y3u s PRO 124 Cb -0.19 -2.02 -0.31 0.00 0.04 0.00 0.00 34.50 32.03 1y3u s PRO 124 CO 0.24 -0.89 0.55 0.25 0.04 0.00 0.00 177.00 177.19 1y3u n THR 125 N -2.03 0.04 -3.93 1.26 -2.24 -1.26 -4.97 114.28 101.15 1y3u n THR 125 Ca 0.09 -0.47 -0.09 0.00 -2.27 0.00 0.00 64.05 61.31 1y3u n THR 125 Cb 0.53 0.04 -0.07 0.00 -2.10 0.00 0.00 70.33 68.72 1y3u n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1y3u s SER 127 N -4.48 0.07 0.39 3.42 1.04 -1.26 -5.15 113.70 107.73 1y3u s SER 127 Ca -0.06 -0.80 -0.24 0.00 0.48 0.00 0.00 55.95 55.32 1y3u s SER 127 Cb 0.14 0.40 -0.09 0.00 0.10 0.00 0.00 66.02 66.57 1y3u s SER 127 CO 0.90 -0.83 1.05 0.00 0.98 0.00 0.00 173.24 175.34 1y3u s ALA 129 N -1.62 3.24 0.39 0.00 0.00 -1.26 -5.07 121.76 117.45 1y3u s ALA 129 Ca 0.56 0.12 -0.01 0.00 0.00 0.00 0.00 51.96 52.63 1y3u s ALA 129 Cb -0.23 -2.87 -0.03 0.00 0.00 0.00 0.00 23.12 19.99 1y3u s ALA 129 CO 0.29 0.25 0.63 -1.54 0.00 0.00 0.00 175.76 175.38 1y3u s SER 130 N -2.32 6.28 0.34 0.00 1.04 -1.26 -5.02 113.70 112.77 1y3u s SER 130 Ca 0.56 0.61 -0.28 0.00 0.48 0.00 0.00 55.95 57.33 1y3u s SER 130 Cb -0.10 -2.10 -0.12 0.00 0.10 0.00 0.00 66.02 63.79 1y3u s SER 130 CO 0.17 -0.39 1.20 0.00 0.98 0.00 0.00 173.24 175.20 1y3u n ALA 132 N -1.95 0.85 -0.24 5.32 0.00 -1.26 -2.06 120.51 121.17 1y3u n ALA 132 Ca -0.03 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1y3u n ALA 132 Cb 0.56 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1y3u n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y3u n GLY 133 N 0.91 1.34 3.74 0.00 0.00 0.77 -4.98 105.19 106.97 1y3u n GLY 133 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1y3u n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y3u s THR 134 N -2.82 2.79 -0.02 2.61 2.01 -0.88 -4.70 115.64 114.63 1y3u s THR 134 Ca 0.00 0.64 -0.15 0.00 0.31 0.00 0.00 61.69 62.48 1y3u s THR 134 Cb 0.00 -3.41 -0.05 0.00 0.01 0.00 0.00 72.50 69.05 1y3u s THR 134 CO 0.00 0.09 0.42 -1.10 -0.69 0.00 0.00 174.62 173.34 1y3u s GLN 135 N 0.03 4.02 0.16 4.92 -1.52 -1.26 -1.40 119.66 124.61 1y3u s GLN 135 Ca 0.61 0.42 0.04 0.00 -1.95 0.00 0.00 55.36 54.48 1y3u s GLN 135 Cb -0.41 -3.27 -0.05 0.00 -0.22 0.00 0.00 33.01 29.07 1y3u s GLN 135 CO 0.39 0.58 -0.07 0.00 -0.25 0.00 0.00 175.29 175.95 1y3u s LEU 137 N -3.18 3.10 -0.07 0.00 2.96 0.66 -1.01 118.68 121.13 1y3u s LEU 137 Ca 0.19 -0.24 0.05 0.00 -0.22 0.00 0.00 54.13 53.91 1y3u s LEU 137 Cb 0.04 -1.77 -0.01 0.00 0.50 0.00 0.00 46.19 44.95 1y3u s LEU 137 CO 0.02 0.09 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.26 1y3u s ILE 138 N 0.85 2.11 0.04 6.68 1.01 0.39 -1.16 121.20 131.12 1y3u s ILE 138 Ca -0.01 -1.03 -0.02 0.00 0.00 0.00 0.00 60.65 59.59 1y3u s ILE 138 Cb -0.15 -1.78 -0.02 0.00 0.01 0.00 0.00 42.46 40.52 1y3u s ILE 138 CO 0.02 0.57 0.01 -0.94 0.00 0.00 0.00 174.94 174.59 1y3u s SER 139 N -0.00 0.31 0.00 3.58 1.04 -1.23 0.03 113.70 117.42 1y3u s SER 139 Ca -0.08 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 55.66 1y3u s SER 139 Cb -0.15 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.15 1y3u s SER 139 CO 0.05 -0.47 0.00 0.61 0.98 0.00 0.00 173.24 174.41 1y3u n GLY 140 N 0.81 1.05 1.61 7.32 0.00 -0.54 -4.45 105.19 110.99 1y3u n GLY 140 Ca -0.19 -0.90 0.01 0.00 0.00 0.00 0.00 46.02 44.95 1y3u n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1y3u n TRP 141 N -0.37 1.85 -1.66 1.61 8.01 -1.26 -1.87 117.44 123.74 1y3u n TRP 141 Ca 0.00 -1.03 -0.20 0.00 -1.31 0.00 0.00 57.50 54.96 1y3u n TRP 141 Cb 0.00 -0.53 0.14 0.00 -2.01 0.00 0.00 31.31 28.91 1y3u n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1y3u n GLY 142 N -0.14 -1.33 3.74 6.99 0.00 -1.25 -4.40 105.19 108.79 1y3u n GLY 142 Ca 0.32 -1.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.22 1y3u n GLY 142 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1y3u n ASN 143 N -3.58 3.13 -0.90 1.61 5.15 0.13 -3.05 115.26 117.75 1y3u n ASN 143 Ca 0.12 1.16 0.09 0.00 -0.60 0.00 0.00 54.58 55.35 1y3u n ASN 143 Cb 0.40 -1.56 0.16 0.00 -0.53 0.00 0.00 39.78 38.26 1y3u n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1y3u n THR 144 N 0.06 0.47 -4.92 -0.44 -2.24 -0.48 -1.50 114.28 105.24 1y3u n THR 144 Ca 0.04 -0.74 -0.31 0.00 -2.27 0.00 0.00 64.05 60.77 1y3u n THR 144 Cb 0.39 0.97 -0.14 0.00 -2.10 0.00 0.00 70.33 69.45 1y3u n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1y3u s LYS 145 N -1.29 2.20 0.09 -0.78 3.01 -1.26 -4.44 119.74 117.27 1y3u s LYS 145 Ca 0.30 -0.89 -0.02 0.00 -1.01 0.00 0.00 55.97 54.35 1y3u s LYS 145 Cb 0.18 -2.20 -0.26 0.00 -1.01 0.00 0.00 37.83 34.54 1y3u s LYS 145 CO 0.25 0.57 1.18 0.66 0.51 0.00 0.00 175.35 178.52 1y3u h SER 146 N 5.06 0.34 -3.44 2.83 4.64 -1.93 -3.42 113.55 117.62 1y3u h SER 146 Ca -0.46 -0.36 -0.67 0.00 -0.47 0.00 0.00 61.79 59.83 1y3u h SER 146 Cb 1.14 -0.11 -0.32 0.00 -0.31 0.00 0.00 62.40 62.80 1y3u h SER 146 CO 0.48 1.27 -0.77 -0.55 -0.87 0.00 0.00 176.83 176.40 1y3u s SER 147 N -7.05 4.12 0.00 4.97 0.15 -1.26 -4.70 113.70 109.93 1y3u s SER 147 Ca -0.03 -0.82 0.00 0.00 0.70 0.00 0.00 55.95 55.80 1y3u s SER 147 Cb 0.08 -1.63 0.00 0.00 -1.71 0.00 0.00 66.02 62.75 1y3u s SER 147 CO 0.87 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.82 1y3u n GLY 148 N 4.66 -0.26 3.29 9.45 0.00 -1.26 -4.97 105.19 116.09 1y3u n GLY 148 Ca -0.17 -1.88 -0.33 0.00 0.00 0.00 0.00 46.02 43.64 1y3u n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y3u s THR 149 N -1.03 2.57 -0.29 2.61 2.01 -1.26 -4.53 115.64 115.72 1y3u s THR 149 Ca 0.00 -0.83 0.02 0.00 0.31 0.00 0.00 61.69 61.19 1y3u s THR 149 Cb 0.00 -2.04 0.18 0.00 0.01 0.00 0.00 72.50 70.65 1y3u s THR 149 CO 0.00 0.54 0.50 -0.55 -0.69 0.00 0.00 174.62 174.42 1y3u s SER 150 N 0.38 -0.64 -0.13 3.53 0.15 -1.26 -4.99 113.70 110.74 1y3u s SER 150 Ca -0.14 0.11 -0.12 0.00 0.70 0.00 0.00 55.95 56.49 1y3u s SER 150 Cb -0.17 1.61 -0.05 0.00 -1.71 0.00 0.00 66.02 65.71 1y3u s SER 150 CO 0.07 -0.31 0.26 -0.31 1.20 0.00 0.00 173.24 174.15 1y3u s TYR 151 N 2.70 3.52 0.59 3.44 2.02 -1.26 -1.39 117.35 126.97 1y3u s TYR 151 Ca 0.12 0.61 -0.10 0.00 -0.37 0.00 0.00 57.07 57.33 1y3u s TYR 151 Cb -0.12 -2.24 -0.04 0.00 -0.40 0.00 0.00 41.96 39.16 1y3u s TYR 151 CO -0.25 0.40 0.98 -1.25 -1.57 0.00 0.00 175.55 173.86 1y3u s PRO 152 N -0.07 3.61 -0.00 -1.71 0.04 -1.26 -4.99 135.00 130.62 1y3u s PRO 152 Ca 0.16 0.67 -0.17 0.00 0.04 0.00 0.00 61.00 61.70 1y3u s PRO 152 Cb -0.13 -2.14 -0.34 0.00 0.04 0.00 0.00 34.50 31.93 1y3u s PRO 152 CO 0.05 -0.49 0.92 -0.44 0.04 0.00 0.00 177.00 177.07 1y3u h ASP 153 N -0.15 0.72 -1.95 6.66 3.32 -1.94 -3.48 116.42 119.60 1y3u h ASP 153 Ca -0.45 -0.93 -0.51 0.00 0.02 0.00 0.00 57.03 55.16 1y3u h ASP 153 Cb 1.19 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 40.45 1y3u h ASP 153 CO 0.62 1.65 -0.50 0.68 -1.72 0.00 0.00 179.24 179.97 1y3u s VAL 154 N -2.55 3.59 0.16 -1.35 -7.23 -1.26 -1.51 120.40 110.24 1y3u s VAL 154 Ca -0.11 -1.49 -0.30 0.00 -1.81 0.00 0.00 61.98 58.26 1y3u s VAL 154 Cb 0.03 -3.15 -0.08 0.00 0.56 0.00 0.00 36.38 33.74 1y3u s VAL 154 CO 0.90 -0.23 1.23 -0.22 -0.31 0.00 0.00 175.10 176.48 1y3u s LEU 155 N -3.90 4.42 0.11 1.32 2.96 -1.20 -4.83 118.68 117.56 1y3u s LEU 155 Ca 0.38 2.23 0.05 0.00 -0.22 0.00 0.00 54.13 56.56 1y3u s LEU 155 Cb -0.05 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.00 1y3u s LEU 155 CO 0.25 -0.44 0.03 -0.54 -1.32 0.00 0.00 176.35 174.33 1y3u s LYS 156 N 0.18 2.63 0.07 1.98 -0.14 -0.78 -1.72 119.74 121.96 1y3u s LYS 156 Ca 0.56 -0.86 0.05 0.00 -1.36 0.00 0.00 55.97 54.37 1y3u s LYS 156 Cb -0.33 -2.56 -0.03 0.00 -1.68 0.00 0.00 37.83 33.23 1y3u s LYS 156 CO 0.35 0.52 -0.15 0.00 -0.76 0.00 0.00 175.35 175.31 1y3u s LEU 158 N -1.70 0.41 -0.13 0.00 2.96 0.10 -1.07 118.68 119.25 1y3u s LEU 158 Ca -0.01 0.47 -0.19 0.00 -0.22 0.00 0.00 54.13 54.17 1y3u s LEU 158 Cb -0.10 0.62 -0.04 0.00 0.50 0.00 0.00 46.19 47.17 1y3u s LEU 158 CO 0.02 -0.17 0.54 -0.54 -1.32 0.00 0.00 176.35 174.88 1y3u s LYS 159 N 1.37 4.32 -0.07 1.98 1.02 -1.26 -0.46 119.74 126.63 1y3u s LYS 159 Ca -0.08 0.53 -0.10 0.00 0.02 0.00 0.00 55.97 56.35 1y3u s LYS 159 Cb -0.11 -3.48 0.02 0.00 -0.52 0.00 0.00 37.83 33.75 1y3u s LYS 159 CO -0.08 0.05 0.25 0.00 -0.92 0.00 0.00 175.35 174.65 1y3u s ALA 160 N 0.97 -0.62 0.33 5.17 0.00 -0.18 -4.95 121.76 122.48 1y3u s ALA 160 Ca 0.28 0.54 -0.06 0.00 0.00 0.00 0.00 51.96 52.72 1y3u s ALA 160 Cb -0.16 -0.27 -0.05 0.00 0.00 0.00 0.00 23.12 22.64 1y3u s ALA 160 CO 0.11 -0.16 0.62 -1.25 0.00 0.00 0.00 175.76 175.09 1y3u s PRO 161 N -0.31 3.65 0.02 0.00 0.04 -1.26 -0.58 135.00 136.57 1y3u s PRO 161 Ca -0.04 0.11 -0.30 0.00 0.04 0.00 0.00 61.00 60.80 1y3u s PRO 161 Cb -0.03 -2.57 -0.05 0.00 0.04 0.00 0.00 34.50 31.89 1y3u s PRO 161 CO 0.01 0.12 1.18 0.42 0.04 0.00 0.00 177.00 178.78 1y3u s ILE 162 N -2.21 4.16 0.49 0.56 1.01 -0.49 -0.93 121.20 123.78 1y3u s ILE 162 Ca 0.46 1.54 -0.07 0.00 0.00 0.00 0.00 60.65 62.57 1y3u s ILE 162 Cb -0.10 -3.98 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 1y3u s ILE 162 CO 0.32 0.09 0.82 -0.76 0.00 0.00 0.00 174.94 175.40 1y3u s LEU 163 N 1.39 3.61 0.74 2.97 1.43 -0.28 -0.16 118.68 128.37 1y3u s LEU 163 Ca 0.57 1.05 -0.13 0.00 -1.03 0.00 0.00 54.13 54.59 1y3u s LEU 163 Cb -0.28 -4.00 0.04 0.00 0.03 0.00 0.00 46.19 41.99 1y3u s LEU 163 CO 0.27 -0.58 1.13 -0.94 0.23 0.00 0.00 176.35 176.46 1y3u s SER 164 N -3.91 4.46 0.37 2.29 1.04 -1.26 -4.68 113.70 112.01 1y3u s SER 164 Ca 0.49 2.06 0.05 0.00 0.48 0.00 0.00 55.95 59.04 1y3u s SER 164 Cb -0.10 -2.55 0.72 0.00 0.10 0.00 0.00 66.02 64.18 1y3u s SER 164 CO 0.43 -2.07 1.97 -2.24 0.98 0.00 0.00 173.24 172.31 1y3u h ASP 165 N -0.59 0.50 -0.23 7.02 2.03 -1.97 -1.40 116.42 121.78 1y3u h ASP 165 Ca -0.46 -0.05 -0.16 0.00 -0.73 0.00 0.00 57.03 55.64 1y3u h ASP 165 Cb 1.26 -0.13 -0.01 0.00 -0.83 0.00 0.00 39.33 39.62 1y3u h ASP 165 CO 0.51 0.46 -0.43 0.77 -1.03 0.00 0.00 179.24 179.52 1y3u h SER 166 N 0.55 0.85 -0.59 4.15 4.64 -1.98 0.45 113.55 121.62 1y3u h SER 166 Ca 0.14 -0.40 -0.05 0.00 -0.47 0.00 0.00 61.79 61.00 1y3u h SER 166 Cb 0.12 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 61.95 1y3u h SER 166 CO -0.01 1.16 0.18 0.28 -0.87 0.00 0.00 176.83 177.56 1y3u h SER 167 N 0.64 0.86 0.08 4.97 0.02 -1.83 0.13 113.55 118.42 1y3u h SER 167 Ca 0.04 -0.21 -0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1y3u h SER 167 Cb 1.00 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.31 1y3u h SER 167 CO 0.10 0.85 -0.04 0.00 -1.14 0.00 0.00 176.83 176.60 1y3u h LYS 169 N -0.11 0.00 -0.18 0.00 1.57 -0.87 -1.98 116.57 114.99 1y3u h LYS 169 Ca -0.01 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.64 1y3u h LYS 169 Cb 0.09 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1y3u h LYS 169 CO 0.02 0.23 -0.42 0.77 -0.57 0.00 0.00 179.45 179.48 1y3u h SER 170 N 0.00 0.46 0.33 0.86 0.02 -0.42 -2.63 113.55 112.17 1y3u h SER 170 Ca -0.00 -0.20 -0.17 0.00 -0.84 0.00 0.00 61.79 60.58 1y3u h SER 170 Cb 0.51 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 1y3u h SER 170 CO 0.03 0.82 -0.68 0.00 -1.14 0.00 0.00 176.83 175.87 1y3u h ALA 171 N 1.20 0.70 -2.08 3.77 0.00 -0.61 -3.37 119.26 118.87 1y3u h ALA 171 Ca 0.03 -0.59 -0.55 0.00 0.00 0.00 0.00 54.91 53.80 1y3u h ALA 171 Cb 0.89 -0.07 -0.40 0.00 0.00 0.00 0.00 17.79 18.20 1y3u h ALA 171 CO 0.07 0.76 -0.96 0.66 0.00 0.00 0.00 179.25 179.79 1y3u n TYR 172 N -3.84 1.25 -1.67 0.00 4.01 -0.81 -4.97 117.16 111.14 1y3u n TYR 172 Ca -0.03 -3.82 -0.47 0.00 -0.16 0.00 0.00 57.90 53.42 1y3u n TYR 172 Cb 0.67 -0.43 -0.04 0.00 -0.31 0.00 0.00 39.34 39.23 1y3u n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1y3u n PRO 173 N 0.74 2.08 -0.55 -0.72 -0.02 -1.00 -1.73 135.00 133.81 1y3u n PRO 173 Ca 0.25 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.49 1y3u n PRO 173 Cb 0.52 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1y3u n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1y3u n GLY 174 N 3.54 1.35 0.05 -1.23 0.00 -1.26 -4.86 105.19 102.77 1y3u n GLY 174 Ca 0.18 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.22 1y3u n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1y3u n GLN 175 N -2.00 3.78 -3.55 1.61 6.02 -0.71 -4.96 117.38 117.57 1y3u n GLN 175 Ca 0.00 -0.24 -0.39 0.00 -0.01 0.00 0.00 57.00 56.36 1y3u n GLN 175 Cb 0.00 -0.79 -0.11 0.00 1.02 0.00 0.00 30.24 30.36 1y3u n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1y3u s ILE 176 N -0.97 5.29 0.50 5.09 -1.09 -1.25 -5.03 121.20 123.74 1y3u s ILE 176 Ca 0.02 0.08 0.07 0.00 -2.23 0.00 0.00 60.65 58.59 1y3u s ILE 176 Cb 0.03 -3.61 0.04 0.00 -1.58 0.00 0.00 42.46 37.34 1y3u s ILE 176 CO 0.10 0.15 0.69 0.42 -1.23 0.00 0.00 174.94 175.08 1y3u s THR 177 N 1.78 2.63 -0.27 2.92 -4.23 -1.26 -4.99 115.64 112.22 1y3u s THR 177 Ca 0.07 -0.94 0.24 0.00 -1.18 0.00 0.00 61.69 59.89 1y3u s THR 177 Cb -0.16 -2.70 0.25 0.00 1.34 0.00 0.00 72.50 71.23 1y3u s THR 177 CO 0.11 0.00 1.74 0.77 -0.54 0.00 0.00 174.62 176.70 1y3u h SER 178 N 0.35 0.00 -0.37 3.99 4.64 -2.03 -2.38 113.55 117.74 1y3u h SER 178 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1y3u h SER 178 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1y3u h SER 178 CO 0.44 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.99 1y3u n ASN 179 N -2.34 2.82 -4.14 4.97 3.02 -1.26 -4.93 115.26 113.40 1y3u n ASN 179 Ca 0.00 -2.22 -0.15 0.00 -0.03 0.00 0.00 54.58 52.19 1y3u n ASN 179 Cb 0.15 -0.42 -0.11 0.00 -0.61 0.00 0.00 39.78 38.79 1y3u n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1y3u s MET 180 N -1.67 0.74 0.08 3.52 -1.94 -0.90 -0.94 119.30 118.18 1y3u s MET 180 Ca 0.29 -0.99 -0.05 0.00 -1.71 0.00 0.00 55.69 53.23 1y3u s MET 180 Cb 0.18 -0.50 -0.02 0.00 2.01 0.00 0.00 34.83 36.50 1y3u s MET 180 CO 0.15 0.09 0.08 -0.59 -0.01 0.00 0.00 175.02 174.74 1y3u s PHE 181 N -1.91 0.38 -0.01 -0.03 -0.12 0.01 -4.80 117.98 111.50 1y3u s PHE 181 Ca -0.01 -0.86 -0.03 0.00 -0.05 0.00 0.00 56.93 55.98 1y3u s PHE 181 Cb -0.06 -0.24 -0.04 0.00 -0.63 0.00 0.00 43.02 42.05 1y3u s PHE 181 CO 0.00 -0.47 0.18 0.00 -0.05 0.00 0.00 175.22 174.88 1y3u s ALA 183 N -1.32 -0.20 0.00 0.00 0.00 -0.83 -1.13 121.76 118.28 1y3u s ALA 183 Ca 0.27 -0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.00 1y3u s ALA 183 Cb -0.13 0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.10 1y3u s ALA 183 CO 0.19 -0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.17 1y3u n GLY 184 N 1.58 0.40 2.76 0.00 0.00 -0.11 -2.87 105.19 106.95 1y3u n GLY 184 Ca -0.22 -1.78 -0.24 0.00 0.00 0.00 0.00 46.02 43.78 1y3u n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1y3u s TYR 184 N -1.78 0.71 0.27 1.61 1.51 -1.26 -4.33 117.35 114.08 1y3u s TYR 184 Ca 0.00 -0.30 0.31 0.00 -1.01 0.00 0.00 57.07 56.07 1y3u s TYR 184 Cb 0.00 -0.84 1.41 0.00 -0.11 0.00 0.00 41.96 42.43 1y3u s TYR 184 CO 0.00 -0.39 2.02 -0.07 -1.11 0.00 0.00 175.55 176.00 1y3u h LEU 185 N 8.32 0.00 0.00 -1.29 3.38 -1.95 -2.23 115.31 121.54 1y3u h LEU 185 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1y3u h LEU 185 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1y3u h LEU 185 CO 0.27 0.09 0.00 -1.84 0.09 0.00 0.00 178.44 177.06 1y3u n GLU 186 N -3.33 0.03 0.00 1.13 0.00 -1.26 -0.14 120.64 117.07 1y3u n GLU 186 Ca -0.01 0.04 0.00 0.00 0.00 0.00 0.00 57.16 57.19 1y3u n GLU 186 Cb 0.29 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.23 1y3u n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1y3u n GLY 187 N 1.23 -0.52 0.77 -1.84 0.00 -0.84 -4.56 105.19 99.43 1y3u n GLY 187 Ca 0.07 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1y3u n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y3u n GLY 188 N -0.55 3.28 2.67 -0.02 0.00 0.06 -4.96 105.19 105.67 1y3u n GLY 188 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1y3u n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y3u s LYS 188 N -0.61 0.16 0.14 1.61 1.02 -1.26 -3.66 119.74 117.15 1y3u s LYS 188 Ca 0.00 0.09 -0.25 0.00 0.02 0.00 0.00 55.97 55.83 1y3u s LYS 188 Cb 0.00 -1.20 0.06 0.00 -0.52 0.00 0.00 37.83 36.17 1y3u s LYS 188 CO 0.00 -0.47 0.87 0.34 -0.92 0.00 0.00 175.35 175.17 1y3u s ASP 189 N 2.09 -0.27 0.78 2.83 2.15 -0.52 -4.33 116.67 119.40 1y3u s ASP 189 Ca 0.03 -0.32 -0.11 0.00 0.43 0.00 0.00 52.55 52.59 1y3u s ASP 189 Cb -0.14 0.52 0.07 0.00 -0.30 0.00 0.00 42.92 43.07 1y3u s ASP 189 CO -0.06 -0.93 1.13 -0.94 -0.17 0.00 0.00 175.17 174.21 1y3u s SER 190 N -2.82 4.65 0.11 -0.34 1.04 -1.26 -0.07 113.70 115.00 1y3u s SER 190 Ca 0.09 0.73 -0.02 0.00 0.48 0.00 0.00 55.95 57.23 1y3u s SER 190 Cb -0.02 -1.28 0.01 0.00 0.10 0.00 0.00 66.02 64.82 1y3u s SER 190 CO -0.01 -1.79 0.19 0.00 0.98 0.00 0.00 173.24 172.61 1y3u n GLN 192 N -0.17 1.38 0.00 0.00 7.27 -1.26 -0.76 117.38 123.84 1y3u n GLN 192 Ca -0.01 0.50 0.00 0.00 0.07 0.00 0.00 57.00 57.56 1y3u n GLN 192 Cb 0.18 -2.19 0.00 0.00 2.41 0.00 0.00 30.24 30.64 1y3u n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1y3u n GLY 193 N 3.28 2.57 0.03 1.69 0.00 -1.26 0.17 105.19 111.66 1y3u n GLY 193 Ca 0.21 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.34 1y3u n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1y3u n ASP 194 N 0.00 0.61 -4.53 1.61 8.00 0.06 -3.89 116.55 118.41 1y3u n ASP 194 Ca 0.00 -0.17 -0.52 0.00 0.71 0.00 0.00 54.79 54.81 1y3u n ASP 194 Cb 0.00 0.42 -0.05 0.00 -0.02 0.00 0.00 41.12 41.47 1y3u n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1y3u n SER 195 N -1.80 0.60 0.00 -2.24 7.64 -1.26 -1.96 113.62 114.60 1y3u n SER 195 Ca 0.04 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.06 1y3u n SER 195 Cb 0.39 -1.09 0.00 0.00 -1.01 0.00 0.00 64.21 62.50 1y3u n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1y3u n GLY 196 N 1.92 1.95 3.84 0.23 0.00 0.19 -0.66 105.19 112.66 1y3u n GLY 196 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1y3u n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1y3u s GLY 197 N -1.98 1.60 0.35 -0.02 0.00 -0.83 -3.35 107.32 103.09 1y3u s GLY 197 Ca 0.00 -0.64 -0.21 0.00 0.00 0.00 0.00 44.72 43.88 1y3u s GLY 197 CO 0.00 -0.08 0.86 2.56 0.00 0.00 0.00 173.10 176.45 1y3u s PRO 198 N -5.44 4.26 -0.28 2.90 0.04 -1.26 -0.84 135.00 134.39 1y3u s PRO 198 Ca 0.64 1.03 0.03 0.00 0.04 0.00 0.00 61.00 62.74 1y3u s PRO 198 Cb -0.12 -2.49 0.07 0.00 0.04 0.00 0.00 34.50 31.99 1y3u s PRO 198 CO 0.52 0.15 -0.06 0.08 0.04 0.00 0.00 177.00 177.72 1y3u s VAL 199 N -1.90 2.10 -0.13 -0.36 1.01 -0.59 -3.53 120.40 117.00 1y3u s VAL 199 Ca 0.54 -1.75 -0.00 0.00 0.00 0.00 0.00 61.98 60.77 1y3u s VAL 199 Cb -0.13 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.93 1y3u s VAL 199 CO 0.18 -0.18 -0.13 -0.69 0.00 0.00 0.00 175.10 174.28 1y3u s VAL 200 N 1.10 3.06 -0.07 2.92 1.01 -0.31 -0.90 120.40 127.21 1y3u s VAL 200 Ca -0.04 -0.65 -0.01 0.00 0.00 0.00 0.00 61.98 61.28 1y3u s VAL 200 Cb -0.20 -2.29 0.03 0.00 0.00 0.00 0.00 36.38 33.92 1y3u s VAL 200 CO -0.06 0.52 -0.02 0.00 0.00 0.00 0.00 175.10 175.54 1y3u n SER 202 N 4.85 -1.28 0.00 0.00 7.64 -1.26 -1.15 113.62 122.42 1y3u n SER 202 Ca -0.12 -0.92 0.00 0.00 1.01 0.00 0.00 58.87 58.83 1y3u n SER 202 Cb 0.50 -3.43 0.00 0.00 -1.01 0.00 0.00 64.21 60.27 1y3u n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1y3u n GLY 203 N -1.78 0.32 3.30 0.23 0.00 -1.26 -5.00 105.19 100.99 1y3u n GLY 203 Ca -0.24 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.53 1y3u n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y3u s LYS 204 N -0.82 1.24 -0.55 1.61 -0.14 -0.30 -4.19 119.74 116.60 1y3u s LYS 204 Ca 0.00 -1.14 -0.28 0.00 -1.36 0.00 0.00 55.97 53.18 1y3u s LYS 204 Cb 0.00 -1.51 0.03 0.00 -1.68 0.00 0.00 37.83 34.67 1y3u s LYS 204 CO 0.00 0.36 1.22 -1.17 -0.76 0.00 0.00 175.35 175.00 1y3u s LEU 209 N -1.76 3.49 -0.04 3.17 2.96 0.02 -0.94 118.68 125.59 1y3u s LEU 209 Ca 0.08 0.25 0.15 0.00 -0.22 0.00 0.00 54.13 54.39 1y3u s LEU 209 Cb -0.10 -3.27 -0.23 0.00 0.50 0.00 0.00 46.19 43.09 1y3u s LEU 209 CO 0.04 -1.45 0.30 0.00 -1.32 0.00 0.00 176.35 173.92 1y3u n GLN 210 N 8.31 0.64 -4.01 1.98 1.13 -0.08 -4.11 117.38 121.25 1y3u n GLN 210 Ca 0.10 -0.12 -0.10 0.00 -1.94 0.00 0.00 57.00 54.94 1y3u n GLN 210 Cb 0.49 -1.37 -0.08 0.00 0.11 0.00 0.00 30.24 29.39 1y3u n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1y3u s GLY 211 N -3.94 0.64 -0.07 1.08 0.00 -0.93 -1.09 107.32 103.00 1y3u s GLY 211 Ca -0.06 -1.05 0.03 0.00 0.00 0.00 0.00 44.72 43.64 1y3u s GLY 211 CO 0.64 -0.96 -0.14 -0.42 0.00 0.00 0.00 173.10 172.22 1y3u s ILE 212 N -4.00 1.32 -0.05 0.90 1.01 -1.11 -1.55 121.20 117.73 1y3u s ILE 212 Ca 0.20 -0.58 -0.30 0.00 0.00 0.00 0.00 60.65 59.97 1y3u s ILE 212 Cb 0.04 -1.19 -0.08 0.00 0.01 0.00 0.00 42.46 41.24 1y3u s ILE 212 CO 0.02 0.40 2.05 0.52 0.00 0.00 0.00 174.94 177.92 1y3u n VAL 213 N 3.78 0.63 0.00 2.92 0.31 -0.02 -1.79 118.33 124.17 1y3u n VAL 213 Ca -0.22 -0.23 -0.00 0.00 -0.01 0.00 0.00 64.34 63.88 1y3u n VAL 213 Cb 0.52 -2.36 -0.00 0.00 -0.91 0.00 0.00 33.84 31.09 1y3u n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1y3u n SER 214 N 8.72 0.13 -3.37 4.52 2.88 -1.02 -0.64 113.62 124.84 1y3u n SER 214 Ca 0.23 0.02 -0.11 0.00 -1.33 0.00 0.00 58.87 57.68 1y3u n SER 214 Cb 0.41 -0.14 -0.02 0.00 -0.75 0.00 0.00 64.21 63.71 1y3u n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1y3u s TRP 215 N -1.12 0.51 0.05 0.66 1.48 -0.59 -4.92 118.94 115.01 1y3u s TRP 215 Ca -0.01 -0.93 -0.12 0.00 -1.06 0.00 0.00 56.10 53.98 1y3u s TRP 215 Cb 0.00 0.32 0.04 0.00 -1.16 0.00 0.00 33.47 32.68 1y3u s TRP 215 CO 0.01 -1.25 0.58 0.41 -4.06 0.00 0.00 176.95 172.64 1y3u n GLY 216 N -0.50 0.73 3.08 3.67 0.00 -1.26 -0.34 105.19 110.57 1y3u n GLY 216 Ca -0.03 -1.00 -0.34 0.00 0.00 0.00 0.00 46.02 44.65 1y3u n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1y3u s SER 217 N -2.33 5.07 0.80 1.61 0.15 -1.26 -4.99 113.70 112.75 1y3u s SER 217 Ca 0.13 -2.08 0.00 0.00 0.70 0.00 0.00 55.95 54.70 1y3u s SER 217 Cb -0.01 -1.75 0.00 0.00 -1.71 0.00 0.00 66.02 62.55 1y3u s SER 217 CO 0.02 -0.48 0.00 0.61 1.20 0.00 0.00 173.24 174.58 1y3u n GLY 219 N 4.46 0.58 2.90 9.45 0.00 -1.26 -4.65 105.19 116.66 1y3u n GLY 219 Ca 0.00 -0.84 -0.16 0.00 0.00 0.00 0.00 46.02 45.02 1y3u n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y3u n ALA 221 N 3.49 -0.47 -1.84 0.00 0.00 -1.26 -4.64 120.51 115.79 1y3u n ALA 221 Ca -0.19 0.23 -0.32 0.00 0.00 0.00 0.00 53.44 53.15 1y3u n ALA 221 Cb 0.55 -2.07 -0.04 0.00 0.00 0.00 0.00 19.45 17.88 1y3u n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1y3u s GLN 221 N -4.45 4.03 0.40 0.00 -1.52 -1.26 -0.76 119.66 116.10 1y3u s GLN 221 Ca 0.00 1.00 -0.26 0.00 -1.95 0.00 0.00 55.36 54.16 1y3u s GLN 221 Cb 0.00 -2.15 -0.09 0.00 -0.22 0.00 0.00 33.01 30.56 1y3u s GLN 221 CO 0.00 -0.20 1.26 -1.59 -0.25 0.00 0.00 175.29 174.51 1y3u s LYS 222 N -3.81 4.00 -1.70 2.91 -2.85 -1.26 -2.85 119.74 114.17 1y3u s LYS 222 Ca 0.60 2.06 0.00 0.00 -1.00 0.00 0.00 55.97 57.63 1y3u s LYS 222 Cb -0.10 -2.74 0.00 0.00 -2.06 0.00 0.00 37.83 32.93 1y3u s LYS 222 CO 0.26 -0.43 0.00 0.09 0.10 0.00 0.00 175.35 175.37 1y3u n ASN 223 N 0.13 -5.54 -3.41 0.03 3.02 0.80 -4.91 115.26 105.38 1y3u n ASN 223 Ca 0.04 0.40 -0.26 0.00 -0.03 0.00 0.00 54.58 54.72 1y3u n ASN 223 Cb 0.44 -4.45 -0.09 0.00 -0.61 0.00 0.00 39.78 35.07 1y3u n ASN 223 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1y3u n LYS 224 N -1.73 0.89 -1.32 3.52 4.01 -1.13 -4.79 118.16 117.60 1y3u n LYS 224 Ca -0.16 -3.57 -0.29 0.00 -0.51 0.00 0.00 58.31 53.78 1y3u n LYS 224 Cb 0.63 -1.69 0.15 0.00 -0.51 0.00 0.00 35.03 33.61 1y3u n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 1y3u s PRO 225 N -0.87 0.87 0.49 1.97 0.04 -1.26 -4.49 135.00 131.75 1y3u s PRO 225 Ca 0.33 0.48 -0.20 0.00 0.04 0.00 0.00 61.00 61.65 1y3u s PRO 225 Cb 0.08 -1.79 -0.08 0.00 0.04 0.00 0.00 34.50 32.75 1y3u s PRO 225 CO -0.14 -2.42 1.05 0.20 0.04 0.00 0.00 177.00 175.72 1y3u s GLY 226 N -3.68 2.53 -0.09 0.56 0.00 -1.14 -4.64 107.32 100.87 1y3u s GLY 226 Ca 0.64 0.63 0.01 0.00 0.00 0.00 0.00 44.72 46.01 1y3u s GLY 226 CO 0.56 0.96 -0.11 0.14 0.00 0.00 0.00 173.10 174.65 1y3u s VAL 227 N -1.95 3.32 -0.01 1.40 1.01 0.54 -1.96 120.40 122.75 1y3u s VAL 227 Ca 0.68 -0.60 0.05 0.00 0.00 0.00 0.00 61.98 62.10 1y3u s VAL 227 Cb -0.17 -2.36 -0.01 0.00 0.00 0.00 0.00 36.38 33.84 1y3u s VAL 227 CO 0.21 0.56 -0.16 -0.31 0.00 0.00 0.00 175.10 175.40 1y3u s TYR 228 N -0.31 1.39 0.14 5.22 1.51 0.10 -1.55 117.35 123.84 1y3u s TYR 228 Ca 0.03 -0.27 -0.31 0.00 -1.01 0.00 0.00 57.07 55.51 1y3u s TYR 228 Cb -0.13 -0.89 -0.09 0.00 -0.11 0.00 0.00 41.96 40.74 1y3u s TYR 228 CO 0.03 -0.02 1.46 0.99 -1.11 0.00 0.00 175.55 176.89 1y3u s THR 229 N -0.39 3.01 -0.83 -0.71 2.01 -0.74 -0.81 115.64 117.18 1y3u s THR 229 Ca 0.06 0.73 -0.22 0.00 0.31 0.00 0.00 61.69 62.57 1y3u s THR 229 Cb -0.06 -3.47 0.08 0.00 0.01 0.00 0.00 72.50 69.06 1y3u s THR 229 CO -0.00 0.06 1.18 -0.75 -0.69 0.00 0.00 174.62 174.41 1y3u s LYS 230 N 1.03 3.37 0.39 4.92 2.20 -0.12 -2.75 119.74 128.79 1y3u s LYS 230 Ca 0.66 -1.05 0.09 0.00 -0.36 0.00 0.00 55.97 55.31 1y3u s LYS 230 Cb -0.40 -4.68 0.80 0.00 -1.51 0.00 0.00 37.83 32.05 1y3u s LYS 230 CO 0.31 -1.96 1.94 0.28 -0.36 0.00 0.00 175.35 175.57 1y3u h VAL 231 N 6.14 1.16 0.00 4.02 2.07 -1.41 -2.11 116.25 126.11 1y3u h VAL 231 Ca -0.05 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.82 1y3u h VAL 231 Cb 1.04 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1y3u h VAL 231 CO 1.24 0.21 0.00 0.00 0.02 0.00 0.00 177.57 179.04 1y3u n ASN 233 N -3.07 0.00 -0.37 0.00 3.02 -0.79 -3.80 115.26 110.24 1y3u n ASN 233 Ca -0.02 0.43 0.03 0.00 -0.03 0.00 0.00 54.58 54.99 1y3u n ASN 233 Cb 0.11 -0.47 0.08 0.00 -0.61 0.00 0.00 39.78 38.89 1y3u n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1y3u n TYR 234 N -1.47 0.24 -0.25 3.10 4.01 0.51 -4.78 117.16 118.52 1y3u n TYR 234 Ca 0.07 -0.43 -0.07 0.00 -0.16 0.00 0.00 57.90 57.31 1y3u n TYR 234 Cb 0.29 -0.03 0.04 0.00 -0.31 0.00 0.00 39.34 39.34 1y3u n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1y3u h VAL 235 N 1.24 1.25 -0.73 -0.72 2.07 -1.65 -0.30 116.25 117.41 1y3u h VAL 235 Ca 0.00 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 1y3u h VAL 235 Cb 0.59 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1y3u h VAL 235 CO 0.00 0.33 0.42 0.28 0.02 0.00 0.00 177.57 178.62 1y3u h SER 236 N 1.00 0.90 -0.47 0.57 0.02 -1.88 -1.01 113.55 112.67 1y3u h SER 236 Ca 0.22 -0.08 -0.03 0.00 -0.84 0.00 0.00 61.79 61.06 1y3u h SER 236 Cb 0.28 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 1y3u h SER 236 CO -0.01 0.72 0.19 -0.25 -1.14 0.00 0.00 176.83 176.34 1y3u h TRP 237 N 1.00 0.72 -0.37 3.45 7.01 -1.77 -1.12 115.95 124.88 1y3u h TRP 237 Ca 0.26 -0.06 -0.02 0.00 2.11 0.00 0.00 58.89 61.19 1y3u h TRP 237 Cb 0.01 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 26.83 1y3u h TRP 237 CO -0.01 0.61 0.17 0.82 -2.79 0.00 0.00 178.44 177.25 1y3u h ILE 238 N 0.62 1.17 -0.46 2.65 2.04 -0.80 -0.46 117.51 122.28 1y3u h ILE 238 Ca 0.16 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 1y3u h ILE 238 Cb 0.20 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 1y3u h ILE 238 CO -0.01 0.18 0.27 0.11 0.00 0.00 0.00 178.15 178.71 1y3u h LYS 239 N 0.46 0.63 -0.21 2.37 1.57 -1.09 0.12 116.57 120.42 1y3u h LYS 239 Ca 0.13 -0.06 -0.17 0.00 -1.87 0.00 0.00 60.65 58.68 1y3u h LYS 239 Cb 0.13 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1y3u h LYS 239 CO -0.01 0.47 -0.54 1.96 -0.57 0.00 0.00 179.45 180.75 1y3u h GLN 240 N 0.61 0.64 -0.35 3.15 4.20 -1.01 -1.75 115.11 120.61 1y3u h GLN 240 Ca 0.17 -0.40 -0.07 0.00 0.06 0.00 0.00 58.65 58.41 1y3u h GLN 240 Cb 0.01 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1y3u h GLN 240 CO -0.03 1.01 -0.05 1.15 -0.67 0.00 0.00 178.83 180.25 1y3u h THR 241 N 0.49 1.27 -0.46 -0.54 2.02 -0.88 -2.74 112.91 112.07 1y3u h THR 241 Ca 0.01 -1.07 -0.09 0.00 0.77 0.00 0.00 66.41 66.03 1y3u h THR 241 Cb 1.10 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 68.76 1y3u h THR 241 CO 0.11 0.35 -0.07 0.40 0.37 0.00 0.00 175.52 176.68 1y3u h ILE 242 N 0.44 1.25 0.00 3.11 2.04 -0.93 -2.58 117.51 120.85 1y3u h ILE 242 Ca 0.09 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.81 1y3u h ILE 242 Cb 0.53 0.98 -0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1y3u h ILE 242 CO 0.03 0.39 -0.05 0.00 0.00 0.00 0.00 178.15 178.52 1y3u h ALA 243 N 1.18 1.07 -0.43 1.87 0.00 -1.19 -2.65 119.26 119.11 1y3u h ALA 243 Ca 0.13 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1y3u h ALA 243 Cb 0.56 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1y3u h ALA 243 CO 0.03 0.06 0.00 -1.13 0.00 0.00 0.00 179.25 178.21 1y3u n SER 244 N -3.24 3.17 0.00 0.00 3.41 -1.05 -5.10 113.62 110.82 1y3u n SER 244 Ca -0.01 -1.95 0.00 0.00 -0.26 0.00 0.00 58.87 56.65 1y3u n SER 244 Cb 0.24 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1y3u n SER 244 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47