#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dwv h SER 10 N 0.00 0.00 -0.02 6.12 4.64 -2.06 -0.73 113.55 121.50 3dwv h SER 10 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dwv h SER 10 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3dwv h SER 10 CO 0.00 0.00 -0.17 0.00 -0.87 0.00 0.00 176.83 175.79 3dwv n ALA 11 N -1.90 2.84 -1.66 5.18 0.00 -1.26 -4.96 120.51 118.76 3dwv n ALA 11 Ca -0.01 -0.60 -0.45 0.00 0.00 0.00 0.00 53.44 52.37 3dwv n ALA 11 Cb 0.09 -0.61 -0.03 0.00 0.00 0.00 0.00 19.45 18.90 3dwv n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dwv n ALA 12 N 0.47 0.97 -0.59 0.00 0.00 -0.28 -4.86 120.51 116.22 3dwv n ALA 12 Ca 0.09 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.95 3dwv n ALA 12 Cb 0.41 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.59 3dwv n ALA 12 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3dwv n SER 13 N 2.33 0.10 -3.73 0.00 3.41 -1.26 -5.10 113.62 109.37 3dwv n SER 13 Ca 0.13 -0.71 -0.07 0.00 -0.26 0.00 0.00 58.87 57.96 3dwv n SER 13 Cb 0.30 0.04 -0.02 0.00 -0.26 0.00 0.00 64.21 64.28 3dwv n SER 13 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3dwv s SER 14 N -0.04 -0.30 0.61 4.04 1.04 -1.26 -4.67 113.70 113.12 3dwv s SER 14 Ca 0.00 -0.41 0.39 0.00 0.48 0.00 0.00 55.95 56.42 3dwv s SER 14 Cb 0.00 0.62 1.96 0.00 0.10 0.00 0.00 66.02 68.70 3dwv s SER 14 CO 0.00 -1.12 2.21 0.16 0.98 0.00 0.00 173.24 175.47 3dwv h ILE 15 N 2.00 0.04 0.00 -1.02 3.07 -1.09 -2.82 117.51 117.69 3dwv h ILE 15 Ca -0.23 -0.23 0.00 0.00 1.55 0.00 0.00 64.86 65.95 3dwv h ILE 15 Cb 1.26 1.22 0.00 0.00 -0.27 0.00 0.00 36.82 39.03 3dwv h ILE 15 CO 0.27 0.01 0.00 0.49 -1.05 0.00 0.00 178.15 177.86 3dwv n PHE 16 N -3.12 0.00 1.87 0.16 3.72 -1.26 -1.90 117.46 116.93 3dwv n PHE 16 Ca -0.02 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.54 3dwv n PHE 16 Cb 0.17 -0.11 0.86 0.00 -0.94 0.00 0.00 39.48 39.46 3dwv n PHE 16 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3dwv n ASP 17 N -1.11 0.26 -4.43 4.37 8.00 -1.06 -4.92 116.55 117.65 3dwv n ASP 17 Ca 0.15 -1.02 -0.30 0.00 0.71 0.00 0.00 54.79 54.33 3dwv n ASP 17 Cb 0.12 -0.02 -0.13 0.00 -0.02 0.00 0.00 41.12 41.08 3dwv n ASP 17 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3dwv s PHE 18 N -2.05 2.47 -0.05 1.24 0.08 -0.80 -5.10 117.98 113.78 3dwv s PHE 18 Ca 0.45 -0.31 -0.30 0.00 0.12 0.00 0.00 56.93 56.89 3dwv s PHE 18 Cb 0.22 -1.40 -0.02 0.00 -0.57 0.00 0.00 43.02 41.25 3dwv s PHE 18 CO 0.37 0.26 1.04 -2.00 -0.10 0.00 0.00 175.22 174.80 3dwv s GLU 19 N -1.61 4.46 -0.06 0.44 2.12 -1.26 -5.01 118.70 117.78 3dwv s GLU 19 Ca 0.15 1.47 0.02 0.00 0.36 0.00 0.00 54.97 56.97 3dwv s GLU 19 Cb -0.10 -3.50 0.02 0.00 0.26 0.00 0.00 34.13 30.80 3dwv s GLU 19 CO 0.06 -0.23 -0.10 0.08 -0.54 0.00 0.00 175.26 174.52 3dwv s VAL 20 N 1.60 0.95 -0.11 3.70 1.01 -1.26 -4.93 120.40 121.36 3dwv s VAL 20 Ca 0.52 -0.36 -0.04 0.00 0.00 0.00 0.00 61.98 62.09 3dwv s VAL 20 Cb -0.21 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 3dwv s VAL 20 CO 0.23 0.31 0.05 -0.76 0.00 0.00 0.00 175.10 174.94 3dwv s LEU 21 N 0.76 3.87 0.00 3.92 1.43 -1.26 0.04 118.68 127.44 3dwv s LEU 21 Ca -0.13 0.24 -0.13 0.00 -1.03 0.00 0.00 54.13 53.09 3dwv s LEU 21 Cb -0.15 -1.92 0.18 0.00 0.03 0.00 0.00 46.19 44.33 3dwv s LEU 21 CO 0.02 0.37 0.81 -0.90 0.23 0.00 0.00 176.35 176.88 3dwv n ASP 22 N 2.24 -0.90 0.19 2.29 5.68 -0.16 -1.35 116.55 124.55 3dwv n ASP 22 Ca -0.19 -1.12 0.14 0.00 -0.50 0.00 0.00 54.79 53.12 3dwv n ASP 22 Cb 0.54 -0.68 0.63 0.00 -1.14 0.00 0.00 41.12 40.48 3dwv n ASP 22 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3dwv h ALA 23 N -2.20 1.00 -0.68 2.12 0.00 -1.73 0.29 119.26 118.06 3dwv h ALA 23 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3dwv h ALA 23 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3dwv h ALA 23 CO 0.19 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.19 3dwv n ASP 24 N -2.51 4.10 -1.72 0.00 8.00 -1.26 -4.75 116.55 118.40 3dwv n ASP 24 Ca 0.00 -2.16 -0.15 0.00 0.71 0.00 0.00 54.79 53.20 3dwv n ASP 24 Cb 0.18 -0.51 -0.00 0.00 -0.02 0.00 0.00 41.12 40.77 3dwv n ASP 24 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3dwv n HIS 25 N 1.41 -0.77 -4.02 1.24 8.25 0.10 -5.01 115.22 116.41 3dwv n HIS 25 Ca 0.24 0.04 -0.21 0.00 -0.26 0.00 0.00 57.72 57.53 3dwv n HIS 25 Cb 0.70 -3.12 -0.03 0.00 1.12 0.00 0.00 29.99 28.65 3dwv n HIS 25 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3dwv s LYS 26 N -4.80 3.25 0.28 -0.41 1.02 -1.26 -4.82 119.74 113.00 3dwv s LYS 26 Ca 0.02 -0.87 -0.30 0.00 0.02 0.00 0.00 55.97 54.85 3dwv s LYS 26 Cb -0.01 -2.77 -0.11 0.00 -0.52 0.00 0.00 37.83 34.42 3dwv s LYS 26 CO 0.03 0.42 1.51 -2.14 -0.92 0.00 0.00 175.35 174.25 3dwv s PRO 27 N -3.93 4.19 -0.19 -1.68 0.02 -1.26 -0.99 135.00 131.16 3dwv s PRO 27 Ca 0.34 2.45 -0.06 0.00 0.02 0.00 0.00 61.00 63.74 3dwv s PRO 27 Cb -0.09 -3.06 -0.03 0.00 0.02 0.00 0.00 34.50 31.34 3dwv s PRO 27 CO 0.27 -0.52 0.04 -0.47 -0.33 0.00 0.00 177.00 175.99 3dwv s TYR 28 N -0.13 3.15 -1.06 6.54 5.04 0.11 -4.76 117.35 126.23 3dwv s TYR 28 Ca 0.60 -0.16 -0.24 0.00 -2.44 0.00 0.00 57.07 54.84 3dwv s TYR 28 Cb -0.45 -2.09 -0.08 0.00 0.35 0.00 0.00 41.96 39.69 3dwv s TYR 28 CO 0.47 -0.03 1.95 1.21 -1.34 0.00 0.00 175.55 177.81 3dwv s ASN 29 N 0.70 5.01 0.17 4.32 3.04 -1.26 -4.65 114.94 122.27 3dwv s ASN 29 Ca 0.02 -1.23 -0.04 0.00 0.04 0.00 0.00 52.86 51.65 3dwv s ASN 29 Cb -0.14 -2.58 0.05 0.00 -1.54 0.00 0.00 41.25 37.05 3dwv s ASN 29 CO 0.02 -3.01 1.45 0.25 -3.04 0.00 0.00 177.10 172.76 3dwv h LEU 30 N 18.02 0.60 -0.55 3.21 5.85 -1.95 -3.06 115.31 137.44 3dwv h LEU 30 Ca 0.16 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 58.52 3dwv h LEU 30 Cb 0.97 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.82 3dwv h LEU 30 CO 1.21 1.10 0.00 0.55 -0.34 0.00 0.00 178.44 180.96 3dwv n VAL 31 N -3.90 1.12 0.06 1.05 3.14 -1.26 -1.49 118.33 117.05 3dwv n VAL 31 Ca -0.04 0.39 0.16 0.00 -2.96 0.00 0.00 64.34 61.89 3dwv n VAL 31 Cb 0.67 -1.30 0.67 0.00 -1.06 0.00 0.00 33.84 32.82 3dwv n VAL 31 CO 0.00 0.00 0.00 0.06 -6.46 0.00 0.00 176.83 170.43 3dwv h GLN 32 N 0.00 0.02 -0.00 1.45 3.07 -1.94 -0.28 115.11 117.43 3dwv h GLN 32 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3dwv h GLN 32 Cb 0.19 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 27.75 3dwv h GLN 32 CO 0.00 0.02 -0.05 0.72 0.09 0.00 0.00 178.83 179.60 3dwv n HIS 33 N -4.43 0.00 -2.07 0.06 8.25 -0.56 -4.90 115.22 111.57 3dwv n HIS 33 Ca 0.06 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.12 3dwv n HIS 33 Cb 0.46 -0.20 -0.01 0.00 1.12 0.00 0.00 29.99 31.35 3dwv n HIS 33 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 3dwv s LYS 34 N -2.46 4.15 0.00 -0.41 2.20 -0.12 -3.18 119.74 119.91 3dwv s LYS 34 Ca 0.31 2.20 0.00 0.00 -0.36 0.00 0.00 55.97 58.12 3dwv s LYS 34 Cb 0.20 -2.90 0.00 0.00 -1.51 0.00 0.00 37.83 33.62 3dwv s LYS 34 CO 0.46 -0.36 0.00 0.41 -0.36 0.00 0.00 175.35 175.50 3dwv n GLY 35 N 0.71 1.30 3.06 5.54 0.00 0.60 -5.04 105.19 111.35 3dwv n GLY 35 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 3dwv n GLY 35 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dwv s SER 36 N -1.73 0.79 0.87 1.61 0.01 -1.19 -4.83 113.70 109.23 3dwv s SER 36 Ca 0.00 -0.56 -0.12 0.00 1.31 0.00 0.00 55.95 56.58 3dwv s SER 36 Cb 0.00 0.05 0.11 0.00 0.21 0.00 0.00 66.02 66.39 3dwv s SER 36 CO 0.00 -0.23 1.11 -2.16 0.41 0.00 0.00 173.24 172.37 3dwv s PRO 37 N -1.65 1.47 0.18 12.44 0.04 -1.26 -4.40 135.00 141.83 3dwv s PRO 37 Ca -0.10 0.54 -0.17 0.00 0.04 0.00 0.00 61.00 61.32 3dwv s PRO 37 Cb -0.09 -1.86 0.03 0.00 0.04 0.00 0.00 34.50 32.62 3dwv s PRO 37 CO 0.00 -2.03 0.49 -0.48 0.04 0.00 0.00 177.00 175.02 3dwv s LEU 38 N -6.01 0.17 -0.10 -3.56 2.34 -0.90 -3.39 118.68 107.24 3dwv s LEU 38 Ca 0.63 -0.48 0.04 0.00 0.06 0.00 0.00 54.13 54.38 3dwv s LEU 38 Cb -0.16 2.04 -0.00 0.00 -0.56 0.00 0.00 46.19 47.51 3dwv s LEU 38 CO 0.55 -1.01 -0.24 -0.76 -1.06 0.00 0.00 176.35 173.83 3dwv s LEU 39 N -2.87 2.11 -0.25 1.48 1.43 -0.65 -0.81 118.68 119.13 3dwv s LEU 39 Ca 0.09 -0.55 -0.01 0.00 -1.03 0.00 0.00 54.13 52.63 3dwv s LEU 39 Cb -0.00 -1.42 0.03 0.00 0.03 0.00 0.00 46.19 44.83 3dwv s LEU 39 CO -0.04 0.16 -0.08 -0.63 0.23 0.00 0.00 176.35 175.99 3dwv s ILE 40 N 0.33 2.71 -0.03 -0.59 1.01 0.11 -1.29 121.20 123.46 3dwv s ILE 40 Ca -0.18 -1.12 -0.02 0.00 0.00 0.00 0.00 60.65 59.33 3dwv s ILE 40 Cb -0.18 -2.39 -0.04 0.00 0.01 0.00 0.00 42.46 39.86 3dwv s ILE 40 CO 0.09 0.19 0.12 -0.31 0.00 0.00 0.00 174.94 175.03 3dwv s TYR 41 N 1.29 3.42 0.06 3.97 1.51 -0.32 -0.88 117.35 126.40 3dwv s TYR 41 Ca -0.01 0.31 -0.16 0.00 -1.01 0.00 0.00 57.07 56.20 3dwv s TYR 41 Cb -0.17 -1.80 -0.06 0.00 -0.11 0.00 0.00 41.96 39.81 3dwv s TYR 41 CO -0.05 0.61 0.49 0.54 -1.11 0.00 0.00 175.55 176.03 3dwv s ASN 42 N -1.66 6.90 0.33 2.29 4.22 -0.97 -0.38 114.94 125.66 3dwv s ASN 42 Ca 0.23 1.09 0.04 0.00 -2.14 0.00 0.00 52.86 52.08 3dwv s ASN 42 Cb -0.12 -2.29 -0.02 0.00 1.28 0.00 0.00 41.25 40.10 3dwv s ASN 42 CO 0.14 0.26 0.16 1.33 -2.04 0.00 0.00 177.10 176.95 3dwv n VAL 43 N 1.55 0.00 -3.86 3.54 0.24 0.08 -0.20 118.33 119.68 3dwv n VAL 43 Ca -0.11 -2.04 -0.09 0.00 -2.04 0.00 0.00 64.34 60.06 3dwv n VAL 43 Cb 0.52 0.82 0.00 0.00 -1.47 0.00 0.00 33.84 33.71 3dwv n VAL 43 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dwv s ALA 44 N -3.01 -0.64 0.77 2.33 0.00 -1.26 -1.30 121.76 118.65 3dwv s ALA 44 Ca 0.23 -0.75 -0.15 0.00 0.00 0.00 0.00 51.96 51.29 3dwv s ALA 44 Cb 0.01 0.79 0.02 0.00 0.00 0.00 0.00 23.12 23.94 3dwv s ALA 44 CO 0.16 -0.97 0.83 0.43 0.00 0.00 0.00 175.76 176.21 3dwv n SER 45 N -1.14 -0.19 -4.59 0.00 7.64 -1.26 -4.59 113.62 109.49 3dwv n SER 45 Ca -0.06 0.58 -0.43 0.00 1.01 0.00 0.00 58.87 59.97 3dwv n SER 45 Cb 0.60 -1.35 -0.02 0.00 -1.01 0.00 0.00 64.21 62.42 3dwv n SER 45 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 3dwv s LYS 46 N -3.41 3.65 -0.02 1.43 2.20 0.10 -4.82 119.74 118.87 3dwv s LYS 46 Ca 0.69 0.43 0.19 0.00 -0.36 0.00 0.00 55.97 56.93 3dwv s LYS 46 Cb -0.32 -3.94 -0.29 0.00 -1.51 0.00 0.00 37.83 31.78 3dwv s LYS 46 CO 0.55 -1.43 0.47 0.00 -0.36 0.00 0.00 175.35 174.57 3dwv n GLY 48 N 1.41 1.01 2.91 0.00 0.00 -1.26 -4.91 105.19 104.36 3dwv n GLY 48 Ca -0.03 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.83 3dwv n GLY 48 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dwv s TYR 49 N -0.09 0.43 -0.01 1.61 2.02 -1.26 -5.04 117.35 115.02 3dwv s TYR 49 Ca 0.00 -0.08 0.01 0.00 -0.37 0.00 0.00 57.07 56.64 3dwv s TYR 49 Cb 0.00 -0.34 0.02 0.00 -0.40 0.00 0.00 41.96 41.24 3dwv s TYR 49 CO 0.00 -0.05 0.76 0.25 -1.57 0.00 0.00 175.55 174.94 3dwv n THR 50 N 3.34 0.45 -1.69 -0.71 -2.24 -1.26 -5.00 114.28 107.17 3dwv n THR 50 Ca -0.17 -0.48 -0.17 0.00 -2.27 0.00 0.00 64.05 60.96 3dwv n THR 50 Cb 0.56 0.69 -0.06 0.00 -2.10 0.00 0.00 70.33 69.42 3dwv n THR 50 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3dwv n LYS 51 N -0.26 -1.21 -0.13 -0.78 5.02 -1.26 -1.99 118.16 117.55 3dwv n LYS 51 Ca 0.01 1.02 0.00 0.00 -2.02 0.00 0.00 58.31 57.32 3dwv n LYS 51 Cb 0.46 -5.29 0.00 0.00 -0.02 0.00 0.00 35.03 30.18 3dwv n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dwv n GLY 52 N -0.94 0.92 0.18 0.72 0.00 -1.26 -3.59 105.19 101.22 3dwv n GLY 52 Ca -0.18 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.76 3dwv n GLY 52 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dwv h GLY 53 N 0.00 0.60 0.55 -0.02 0.00 -1.25 -0.62 103.07 102.33 3dwv h GLY 53 Ca 0.00 -0.27 0.05 0.00 0.00 0.00 0.00 47.33 47.12 3dwv h GLY 53 CO 0.00 0.26 0.05 -1.82 0.00 0.00 0.00 176.54 175.03 3dwv h TYR 54 N 0.53 0.09 -0.29 5.60 3.20 -1.90 0.46 116.97 124.65 3dwv h TYR 54 Ca 0.14 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.02 3dwv h TYR 54 Cb 0.04 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 3dwv h TYR 54 CO -0.03 0.00 0.12 0.93 -1.64 0.00 0.00 178.16 177.54 3dwv h GLU 55 N 0.17 0.44 -0.10 1.82 5.08 -1.87 -1.55 114.58 118.57 3dwv h GLU 55 Ca 0.17 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 3dwv h GLU 55 Cb 0.20 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 3dwv h GLU 55 CO -0.23 0.46 0.01 1.79 -1.00 0.00 0.00 179.01 180.04 3dwv h THR 56 N 0.33 1.23 -0.83 1.13 1.35 -0.96 0.18 112.91 115.34 3dwv h THR 56 Ca 0.10 -0.71 0.07 0.00 -0.55 0.00 0.00 66.41 65.32 3dwv h THR 56 Cb 0.18 1.51 -0.06 0.00 -1.73 0.00 0.00 68.15 68.05 3dwv h THR 56 CO -0.01 0.20 0.50 0.00 -0.25 0.00 0.00 175.52 175.96 3dwv h ALA 57 N 0.77 1.15 -0.16 6.62 0.00 -0.88 -0.81 119.26 125.96 3dwv h ALA 57 Ca 0.03 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 3dwv h ALA 57 Cb 0.31 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3dwv h ALA 57 CO 0.00 0.20 -0.42 1.15 0.00 0.00 0.00 179.25 180.18 3dwv h THR 58 N 0.88 1.35 -0.45 0.00 2.02 -1.08 -1.27 112.91 114.37 3dwv h THR 58 Ca 0.37 -1.68 0.07 0.00 0.77 0.00 0.00 66.41 65.94 3dwv h THR 58 Cb 0.24 2.00 -0.06 0.00 -1.74 0.00 0.00 68.15 68.59 3dwv h THR 58 CO -0.20 0.51 0.11 0.74 0.37 0.00 0.00 175.52 177.06 3dwv h THR 59 N 0.20 0.79 -0.26 3.16 2.02 -0.74 -0.53 112.91 117.55 3dwv h THR 59 Ca -0.01 -0.09 -0.09 0.00 0.77 0.00 0.00 66.41 66.99 3dwv h THR 59 Cb 1.03 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.94 3dwv h THR 59 CO 0.09 0.05 -0.20 -0.07 0.37 0.00 0.00 175.52 175.75 3dwv h LEU 60 N 0.26 0.63 -0.34 2.58 3.38 -1.03 -0.95 115.31 119.84 3dwv h LEU 60 Ca 0.22 -0.45 0.07 0.00 0.09 0.00 0.00 57.88 57.81 3dwv h LEU 60 Cb 0.26 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 40.76 3dwv h LEU 60 CO -0.27 0.94 -0.24 0.22 0.09 0.00 0.00 178.44 179.19 3dwv h TYR 61 N 0.32 -0.63 -0.09 1.13 3.20 -1.07 -1.53 116.97 118.29 3dwv h TYR 61 Ca 0.05 0.04 -0.16 0.00 3.14 0.00 0.00 58.73 61.80 3dwv h TYR 61 Cb 0.75 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.34 3dwv h TYR 61 CO 0.07 -0.32 -0.63 -0.91 -1.64 0.00 0.00 178.16 174.73 3dwv h ASN 62 N -0.20 0.40 -0.59 -2.11 2.35 -1.00 0.97 115.58 115.39 3dwv h ASN 62 Ca 0.17 -0.23 -0.08 0.00 -0.55 0.00 0.00 56.30 55.61 3dwv h ASN 62 Cb 0.46 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.69 3dwv h ASN 62 CO -0.45 0.93 0.08 0.50 -1.65 0.00 0.00 177.43 176.83 3dwv h LYS 63 N 0.25 1.02 -0.00 0.81 3.64 -0.94 -3.38 116.57 117.98 3dwv h LYS 63 Ca -0.01 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 3dwv h LYS 63 Cb 1.17 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 3dwv h LYS 63 CO 0.11 0.95 -0.00 0.66 -2.27 0.00 0.00 179.45 178.90 3dwv n TYR 64 N -4.21 0.00 0.24 1.91 4.01 -0.60 -4.61 117.16 113.91 3dwv n TYR 64 Ca 0.04 0.00 0.18 0.00 -0.16 0.00 0.00 57.90 57.95 3dwv n TYR 64 Cb 0.29 0.00 0.89 0.00 -0.31 0.00 0.00 39.34 40.21 3dwv n TYR 64 CO 0.00 0.00 0.00 1.57 -0.46 0.00 0.00 176.86 177.97 3dwv h LYS 65 N 0.01 0.00 0.00 -0.72 2.10 -0.98 0.15 116.57 117.13 3dwv h LYS 65 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3dwv h LYS 65 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 3dwv h LYS 65 CO 0.00 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.11 3dwv h SER 66 N 0.00 0.00 -0.32 7.07 4.64 -1.84 -2.72 113.55 120.38 3dwv h SER 66 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3dwv h SER 66 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3dwv h SER 66 CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 3dwv n GLN 67 N -2.49 2.29 -1.28 4.77 6.02 0.53 -4.93 117.38 122.29 3dwv n GLN 67 Ca 0.02 -1.94 0.00 0.00 -0.01 0.00 0.00 57.00 55.07 3dwv n GLN 67 Cb 0.30 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.08 3dwv n GLN 67 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dwv n GLY 68 N 1.40 0.34 3.07 1.08 0.00 -1.03 -5.02 105.19 105.02 3dwv n GLY 68 Ca 0.18 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 3dwv n GLY 68 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3dwv s PHE 69 N -2.86 0.68 0.11 1.61 5.36 -1.20 -3.99 117.98 117.70 3dwv s PHE 69 Ca 0.00 -0.51 -0.04 0.00 -0.96 0.00 0.00 56.93 55.41 3dwv s PHE 69 Cb 0.00 -0.41 -0.03 0.00 -0.34 0.00 0.00 43.02 42.25 3dwv s PHE 69 CO 0.00 -0.08 0.11 -0.08 -1.46 0.00 0.00 175.22 173.70 3dwv s THR 70 N -1.46 0.14 -0.10 0.12 -1.32 -1.22 -4.26 115.64 107.54 3dwv s THR 70 Ca -0.09 -1.62 0.02 0.00 -1.21 0.00 0.00 61.69 58.78 3dwv s THR 70 Cb -0.09 -1.70 -0.02 0.00 -1.51 0.00 0.00 72.50 69.18 3dwv s THR 70 CO 0.00 -0.62 -0.15 -0.69 -2.21 0.00 0.00 174.62 170.94 3dwv s VAL 71 N -3.96 2.87 -0.04 5.08 1.01 -1.26 -1.63 120.40 122.47 3dwv s VAL 71 Ca 0.14 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.43 3dwv s VAL 71 Cb 0.06 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.26 3dwv s VAL 71 CO -0.05 0.55 -0.21 -0.76 0.00 0.00 0.00 175.10 174.63 3dwv s LEU 72 N 0.07 2.35 -0.15 3.92 1.43 -0.41 -3.79 118.68 122.10 3dwv s LEU 72 Ca -0.06 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.67 3dwv s LEU 72 Cb -0.15 -1.44 -0.00 0.00 0.03 0.00 0.00 46.19 44.63 3dwv s LEU 72 CO 0.05 0.31 -0.15 0.00 0.23 0.00 0.00 176.35 176.79 3dwv s ALA 73 N -0.55 2.52 -0.31 4.21 0.00 0.00 -1.17 121.76 126.46 3dwv s ALA 73 Ca 0.08 -1.02 -0.09 0.00 0.00 0.00 0.00 51.96 50.93 3dwv s ALA 73 Cb -0.11 -1.23 -0.00 0.00 0.00 0.00 0.00 23.12 21.78 3dwv s ALA 73 CO 0.01 0.02 0.14 -0.06 0.00 0.00 0.00 175.76 175.86 3dwv s PHE 74 N 0.73 3.17 0.36 0.00 0.40 0.49 -0.31 117.98 122.82 3dwv s PHE 74 Ca -0.06 -0.69 -0.25 0.00 -0.60 0.00 0.00 56.93 55.33 3dwv s PHE 74 Cb -0.15 -2.34 -0.09 0.00 0.51 0.00 0.00 43.02 40.95 3dwv s PHE 74 CO 0.01 -0.49 1.04 -1.25 0.70 0.00 0.00 175.22 175.23 3dwv s PRO 75 N 1.58 4.33 0.29 0.24 0.05 -1.26 -0.74 135.00 139.49 3dwv s PRO 75 Ca 0.04 1.52 -0.28 0.00 0.05 0.00 0.00 61.00 62.33 3dwv s PRO 75 Cb -0.17 -2.70 -0.09 0.00 0.05 0.00 0.00 34.50 31.58 3dwv s PRO 75 CO 0.05 0.00 0.96 0.45 0.05 0.00 0.00 177.00 178.52 3dwv s SER 76 N -1.46 7.42 0.00 6.66 0.15 -0.42 -1.79 113.70 124.26 3dwv s SER 76 Ca 0.54 1.94 0.19 0.00 0.70 0.00 0.00 55.95 59.32 3dwv s SER 76 Cb -0.23 -2.60 1.07 0.00 -1.71 0.00 0.00 66.02 62.56 3dwv s SER 76 CO 0.29 -0.01 1.70 -0.46 1.20 0.00 0.00 173.24 175.96 3dwv n ASN 77 N 0.96 0.23 -1.14 5.45 0.23 0.13 -4.74 115.26 116.38 3dwv n ASN 77 Ca 0.00 -1.45 -0.13 0.00 -0.53 0.00 0.00 54.58 52.47 3dwv n ASN 77 Cb 0.48 -0.01 -0.06 0.00 -2.08 0.00 0.00 39.78 38.11 3dwv n ASN 77 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3dwv n GLN 78 N -0.64 -1.55 -3.17 -3.83 1.13 -1.26 -4.93 117.38 103.13 3dwv n GLN 78 Ca 0.14 0.90 -0.40 0.00 -1.94 0.00 0.00 57.00 55.71 3dwv n GLN 78 Cb 0.10 -5.20 -0.06 0.00 0.11 0.00 0.00 30.24 25.19 3dwv n GLN 78 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 3dwv s PHE 79 N -2.10 3.41 0.00 1.08 5.36 -1.26 -4.50 117.98 119.97 3dwv s PHE 79 Ca 0.00 0.91 0.00 0.00 -0.96 0.00 0.00 56.93 56.88 3dwv s PHE 79 Cb 0.00 -2.74 0.00 0.00 -0.34 0.00 0.00 43.02 39.94 3dwv s PHE 79 CO 0.00 -0.09 0.00 0.41 -1.46 0.00 0.00 175.22 174.08 3dwv n GLY 80 N 3.69 0.85 0.89 13.12 0.00 -1.26 -4.63 105.19 117.85 3dwv n GLY 80 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 3dwv n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dwv n GLY 81 N -0.85 1.91 0.51 -0.02 0.00 -1.26 -4.88 105.19 100.61 3dwv n GLY 81 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 3dwv n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dwv n GLN 82 N -2.00 2.81 -1.59 1.61 0.00 -1.26 -4.91 117.38 112.04 3dwv n GLN 82 Ca 0.00 -2.11 -0.30 0.00 0.00 0.00 0.00 57.00 54.59 3dwv n GLN 82 Cb 0.00 -1.33 0.07 0.00 0.00 0.00 0.00 30.24 28.98 3dwv n GLN 82 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 3dwv s GLU 83 N -1.44 2.53 0.69 2.61 0.41 -1.26 -4.70 118.70 117.54 3dwv s GLU 83 Ca 0.22 0.76 -0.17 0.00 -0.41 0.00 0.00 54.97 55.37 3dwv s GLU 83 Cb 0.14 -1.96 0.00 0.00 -1.78 0.00 0.00 34.13 30.54 3dwv s GLU 83 CO 0.10 -1.33 1.08 -2.30 -0.49 0.00 0.00 175.26 172.32 3dwv n PRO 84 N -3.26 0.70 0.00 0.39 -0.02 -1.26 -4.78 135.00 126.77 3dwv n PRO 84 Ca 0.07 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 3dwv n PRO 84 Cb 0.55 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 3dwv n PRO 84 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dwv n GLY 85 N 1.02 -2.11 3.62 -1.23 0.00 -0.08 -4.68 105.19 101.73 3dwv n GLY 85 Ca 0.14 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 3dwv n GLY 85 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dwv s ASN 86 N -3.75 6.72 0.53 1.61 3.84 -1.26 -4.94 114.94 117.69 3dwv s ASN 86 Ca 0.00 0.80 0.34 0.00 0.21 0.00 0.00 52.86 54.21 3dwv s ASN 86 Cb 0.00 -2.42 1.57 0.00 -0.55 0.00 0.00 41.25 39.86 3dwv s ASN 86 CO 0.00 -0.58 2.03 1.05 -2.79 0.00 0.00 177.10 176.81 3dwv h GLU 87 N 7.96 0.00 0.00 0.43 4.11 -1.88 -2.40 114.58 122.80 3dwv h GLU 87 Ca -0.24 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.12 3dwv h GLU 87 Cb 1.10 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 3dwv h GLU 87 CO 0.88 0.00 -0.40 1.05 0.07 0.00 0.00 179.01 180.61 3dwv h GLU 88 N 0.00 0.00 -0.69 1.06 4.11 -2.00 -3.37 114.58 113.69 3dwv h GLU 88 Ca 0.00 0.00 0.05 0.00 0.07 0.00 0.00 59.36 59.48 3dwv h GLU 88 Cb 0.33 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.53 3dwv h GLU 88 CO 0.00 0.33 0.40 1.49 0.07 0.00 0.00 179.01 181.31 3dwv h GLU 89 N 0.00 0.74 0.00 1.06 4.81 -1.84 0.25 114.58 119.59 3dwv h GLU 89 Ca -0.01 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 3dwv h GLU 89 Cb 1.27 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.48 3dwv h GLU 89 CO 0.04 0.49 -0.07 -0.89 -0.73 0.00 0.00 179.01 177.85 3dwv n ILE 90 N -4.74 0.04 0.04 2.32 2.08 -1.26 -1.83 119.36 116.01 3dwv n ILE 90 Ca 0.08 -0.02 -0.20 0.00 0.56 0.00 0.00 62.75 63.17 3dwv n ILE 90 Cb 0.14 -0.40 -0.14 0.00 -0.75 0.00 0.00 39.64 38.49 3dwv n ILE 90 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 3dwv h LYS 91 N 0.00 0.27 0.02 0.38 1.79 -1.12 -3.38 116.57 114.53 3dwv h LYS 91 Ca 0.00 -0.47 -0.24 0.00 -2.18 0.00 0.00 60.65 57.76 3dwv h LYS 91 Cb 0.52 0.17 -0.03 0.00 -1.58 0.00 0.00 32.23 31.31 3dwv h LYS 91 CO 0.00 1.22 -1.21 0.93 -1.08 0.00 0.00 179.45 179.31 3dwv h GLU 92 N -0.39 0.04 -6.37 3.15 5.08 -0.62 -3.47 114.58 112.01 3dwv h GLU 92 Ca -0.18 -0.07 -0.62 0.00 -1.00 0.00 0.00 59.36 57.49 3dwv h GLU 92 Cb 1.64 0.03 -0.16 0.00 0.50 0.00 0.00 28.75 30.76 3dwv h GLU 92 CO 0.12 0.92 -0.79 -0.06 -1.00 0.00 0.00 179.01 178.20 3dwv s PHE 93 N -2.67 2.27 0.02 4.33 0.08 -0.76 -5.10 117.98 116.14 3dwv s PHE 93 Ca -0.01 -0.35 -0.30 0.00 0.12 0.00 0.00 56.93 56.38 3dwv s PHE 93 Cb 0.09 -1.05 -0.05 0.00 -0.57 0.00 0.00 43.02 41.44 3dwv s PHE 93 CO 0.83 0.60 1.24 0.08 -0.10 0.00 0.00 175.22 177.87 3dwv s VAL 94 N -2.13 4.01 -0.02 -0.44 1.01 -1.26 -4.65 120.40 116.92 3dwv s VAL 94 Ca 0.25 1.41 0.02 0.00 0.00 0.00 0.00 61.98 63.66 3dwv s VAL 94 Cb -0.06 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.42 3dwv s VAL 94 CO 0.12 0.06 -0.06 0.00 0.00 0.00 0.00 175.10 175.22 3dwv s THR 96 N 0.17 2.09 0.06 0.00 -4.23 0.04 -4.76 115.64 109.01 3dwv s THR 96 Ca -0.02 -1.55 -0.35 0.00 -1.18 0.00 0.00 61.69 58.59 3dwv s THR 96 Cb -0.06 -2.64 -0.14 0.00 1.34 0.00 0.00 72.50 70.99 3dwv s THR 96 CO -0.00 0.00 1.62 1.17 -0.54 0.00 0.00 174.62 176.87 3dwv n LYS 97 N -1.50 1.91 -1.73 3.99 4.81 -1.26 0.03 118.16 124.40 3dwv n LYS 97 Ca -0.01 0.69 -0.42 0.00 -0.87 0.00 0.00 58.31 57.70 3dwv n LYS 97 Cb 0.64 -2.45 -0.02 0.00 0.02 0.00 0.00 35.03 33.22 3dwv n LYS 97 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 3dwv n PHE 98 N 4.17 2.78 -4.21 5.64 7.35 -1.26 -4.63 117.46 127.29 3dwv n PHE 98 Ca 0.19 0.21 -0.16 0.00 -0.76 0.00 0.00 57.45 56.93 3dwv n PHE 98 Cb 0.26 -2.61 -0.14 0.00 0.35 0.00 0.00 39.48 37.34 3dwv n PHE 98 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 3dwv s LYS 99 N -0.03 0.57 0.22 -4.13 1.02 -1.26 -5.03 119.74 111.11 3dwv s LYS 99 Ca 0.67 -0.40 -0.21 0.00 0.02 0.00 0.00 55.97 56.06 3dwv s LYS 99 Cb -0.51 -0.51 0.04 0.00 -0.52 0.00 0.00 37.83 36.32 3dwv s LYS 99 CO 0.44 0.13 0.63 0.00 -0.92 0.00 0.00 175.35 175.64 3dwv s ALA 100 N -0.48 -1.25 -0.34 5.17 0.00 -1.26 -5.03 121.76 118.57 3dwv s ALA 100 Ca -0.00 -0.06 0.25 0.00 0.00 0.00 0.00 51.96 52.15 3dwv s ALA 100 Cb -0.05 0.87 0.54 0.00 0.00 0.00 0.00 23.12 24.48 3dwv s ALA 100 CO 0.00 -0.90 1.68 0.93 0.00 0.00 0.00 175.76 177.47 3dwv h GLU 101 N 2.05 0.00 -6.42 0.00 5.08 -2.01 -3.46 114.58 109.83 3dwv h GLU 101 Ca -0.26 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.65 3dwv h GLU 101 Cb 1.27 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.53 3dwv h GLU 101 CO 0.31 0.00 -0.28 -0.59 -1.00 0.00 0.00 179.01 177.46 3dwv s PHE 102 N -3.29 3.17 0.32 4.33 -0.12 -1.26 -5.06 117.98 116.07 3dwv s PHE 102 Ca 0.06 -0.07 -0.29 0.00 -0.05 0.00 0.00 56.93 56.58 3dwv s PHE 102 Cb 0.06 -2.05 -0.11 0.00 -0.63 0.00 0.00 43.02 40.29 3dwv s PHE 102 CO 0.64 -0.08 1.45 -2.14 -0.05 0.00 0.00 175.22 175.05 3dwv s PRO 103 N -4.27 4.21 -0.15 1.99 0.02 -1.25 -4.91 135.00 130.65 3dwv s PRO 103 Ca 0.45 2.43 -0.00 0.00 0.02 0.00 0.00 61.00 63.89 3dwv s PRO 103 Cb -0.10 -3.03 -0.01 0.00 0.02 0.00 0.00 34.50 31.38 3dwv s PRO 103 CO 0.33 -0.44 -0.13 -1.50 -0.33 0.00 0.00 177.00 174.93 3dwv s ILE 104 N -0.69 2.95 0.64 2.83 1.10 -1.26 -0.82 121.20 125.95 3dwv s ILE 104 Ca 0.55 -0.68 0.02 0.00 -0.51 0.00 0.00 60.65 60.02 3dwv s ILE 104 Cb -0.44 -2.25 0.09 0.00 0.15 0.00 0.00 42.46 40.01 3dwv s ILE 104 CO 0.54 0.51 0.88 -0.04 -2.11 0.00 0.00 174.94 174.72 3dwv s MET 105 N 0.60 2.06 0.64 3.50 -1.94 0.57 -3.12 119.30 121.62 3dwv s MET 105 Ca -0.08 -1.10 -0.17 0.00 -1.71 0.00 0.00 55.69 52.64 3dwv s MET 105 Cb -0.16 -2.44 -0.01 0.00 2.01 0.00 0.00 34.83 34.24 3dwv s MET 105 CO 0.03 -1.10 1.17 0.00 -0.01 0.00 0.00 175.02 175.10 3dwv s ALA 106 N -2.93 2.44 0.49 3.03 0.00 -0.46 -4.30 121.76 120.03 3dwv s ALA 106 Ca 0.63 0.81 -0.24 0.00 0.00 0.00 0.00 51.96 53.16 3dwv s ALA 106 Cb -0.07 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.58 3dwv s ALA 106 CO 0.41 -1.31 1.36 0.15 0.00 0.00 0.00 175.76 176.37 3dwv s LYS 107 N -3.69 3.49 0.35 0.00 1.02 -1.26 -4.45 119.74 115.19 3dwv s LYS 107 Ca 0.73 2.26 0.03 0.00 0.02 0.00 0.00 55.97 59.01 3dwv s LYS 107 Cb -0.26 -2.48 -0.01 0.00 -0.52 0.00 0.00 37.83 34.56 3dwv s LYS 107 CO 0.38 -0.92 0.39 0.96 -0.92 0.00 0.00 175.35 175.24 3dwv s ILE 108 N -1.28 0.00 -0.13 2.17 -0.00 -0.74 -4.79 121.20 116.43 3dwv s ILE 108 Ca 0.65 -1.79 -0.12 0.00 -0.00 0.00 0.00 60.65 59.39 3dwv s ILE 108 Cb -0.40 -2.60 -0.05 0.00 -0.00 0.00 0.00 42.46 39.41 3dwv s ILE 108 CO 0.50 0.00 0.25 0.20 -0.00 0.00 0.00 174.94 175.89 3dwv s ASN 109 N -3.32 6.45 -0.01 4.36 -0.87 -1.26 0.17 114.94 120.46 3dwv s ASN 109 Ca 0.36 0.53 0.14 0.00 -1.57 0.00 0.00 52.86 52.31 3dwv s ASN 109 Cb 0.01 -2.15 -0.19 0.00 -0.02 0.00 0.00 41.25 38.90 3dwv s ASN 109 CO 0.25 0.22 0.40 1.33 -2.57 0.00 0.00 177.10 176.74 3dwv n VAL 110 N 2.92 0.00 -4.64 1.60 0.24 -1.26 -1.21 118.33 115.99 3dwv n VAL 110 Ca -0.15 -0.26 -0.29 0.00 -2.04 0.00 0.00 64.34 61.60 3dwv n VAL 110 Cb 0.53 0.51 -0.10 0.00 -1.47 0.00 0.00 33.84 33.31 3dwv n VAL 110 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 3dwv s ASN 111 N -3.06 3.68 0.00 -1.34 0.01 -1.26 -4.73 114.94 108.24 3dwv s ASN 111 Ca -0.01 -1.48 0.00 0.00 -0.71 0.00 0.00 52.86 50.65 3dwv s ASN 111 Cb 0.09 0.00 0.00 0.00 0.41 0.00 0.00 41.25 41.76 3dwv s ASN 111 CO 0.56 -0.63 0.00 0.61 -1.51 0.00 0.00 177.10 176.13 3dwv n GLY 112 N -1.02 -2.52 0.26 0.66 0.00 -1.26 -3.59 105.19 97.72 3dwv n GLY 112 Ca -0.09 -1.63 0.09 0.00 0.00 0.00 0.00 46.02 44.39 3dwv n GLY 112 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3dwv h GLU 113 N 0.00 0.00 -0.73 1.61 5.08 -2.00 -0.94 114.58 117.60 3dwv h GLU 113 Ca 0.00 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.01 3dwv h GLU 113 Cb 0.00 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.04 3dwv h GLU 113 CO 0.00 0.04 0.34 -1.71 -1.00 0.00 0.00 179.01 176.69 3dwv n ASN 114 N -4.33 3.54 -4.63 1.42 4.05 -1.26 -4.98 115.26 109.06 3dwv n ASN 114 Ca -0.03 -3.58 -0.48 0.00 0.45 0.00 0.00 54.58 50.94 3dwv n ASN 114 Cb 0.13 -0.75 -0.05 0.00 1.23 0.00 0.00 39.78 40.34 3dwv n ASN 114 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3dwv n ALA 115 N -0.96 0.22 -1.69 5.20 0.00 -0.36 -4.51 120.51 118.41 3dwv n ALA 115 Ca 0.47 0.47 -0.44 0.00 0.00 0.00 0.00 53.44 53.94 3dwv n ALA 115 Cb 1.41 -2.20 -0.03 0.00 0.00 0.00 0.00 19.45 18.63 3dwv n ALA 115 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 3dwv n HIS 116 N 2.63 2.41 0.08 0.00 -0.00 -0.35 -4.77 115.22 115.22 3dwv n HIS 116 Ca 0.16 0.30 0.17 0.00 0.46 0.00 0.00 57.72 58.82 3dwv n HIS 116 Cb 0.25 -2.54 0.69 0.00 -0.12 0.00 0.00 29.99 28.27 3dwv n HIS 116 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3dwv h PRO 117 N 5.11 0.00 -0.89 1.57 0.11 -1.92 0.95 132.00 136.93 3dwv h PRO 117 Ca -0.45 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 3dwv h PRO 117 Cb 1.25 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.32 3dwv h PRO 117 CO 0.82 0.00 0.49 1.25 -0.21 0.00 0.00 178.00 180.35 3dwv h LEU 118 N 0.00 1.12 -0.33 2.35 6.46 -1.91 0.15 115.31 123.15 3dwv h LEU 118 Ca 0.18 -0.10 -0.13 0.00 -0.12 0.00 0.00 57.88 57.71 3dwv h LEU 118 Cb 0.73 -0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 40.37 3dwv h LEU 118 CO -0.00 0.90 -0.29 1.88 -0.62 0.00 0.00 178.44 180.31 3dwv h TYR 119 N 1.25 0.92 -0.92 1.25 -1.99 -1.21 -0.59 116.97 115.68 3dwv h TYR 119 Ca 0.31 -0.27 0.05 0.00 2.00 0.00 0.00 58.73 60.83 3dwv h TYR 119 Cb 0.03 -0.20 -0.06 0.00 2.00 0.00 0.00 36.73 38.51 3dwv h TYR 119 CO 0.01 1.03 0.59 0.93 -0.00 0.00 0.00 178.16 180.72 3dwv h GLU 120 N 0.54 1.06 -0.05 4.88 4.39 -0.79 0.19 114.58 124.80 3dwv h GLU 120 Ca 0.06 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 3dwv h GLU 120 Cb 0.86 -0.24 -0.00 0.00 -0.10 0.00 0.00 28.75 29.27 3dwv h GLU 120 CO 0.07 0.70 0.00 -0.92 -1.16 0.00 0.00 179.01 177.71 3dwv h TYR 121 N 1.09 0.10 -0.65 4.33 3.20 -0.49 -2.01 116.97 122.55 3dwv h TYR 121 Ca 0.39 -0.02 -0.08 0.00 3.14 0.00 0.00 58.73 62.16 3dwv h TYR 121 Cb 0.11 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.32 3dwv h TYR 121 CO -0.02 0.36 0.10 0.52 -1.64 0.00 0.00 178.16 177.48 3dwv h MET 122 N -0.19 1.06 -0.38 1.82 2.86 -0.73 -0.85 114.93 118.52 3dwv h MET 122 Ca 0.02 -0.28 -0.09 0.00 -2.06 0.00 0.00 59.70 57.29 3dwv h MET 122 Cb 0.32 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 3dwv h MET 122 CO 0.00 0.98 -0.11 0.87 1.06 0.00 0.00 176.91 179.70 3dwv h LYS 123 N 1.00 0.68 -0.08 1.72 1.57 -0.66 0.94 116.57 121.73 3dwv h LYS 123 Ca 0.20 -0.21 -0.22 0.00 -1.87 0.00 0.00 60.65 58.54 3dwv h LYS 123 Cb 0.43 -0.06 0.01 0.00 0.08 0.00 0.00 32.23 32.69 3dwv h LYS 123 CO 0.01 0.77 -0.84 1.57 -0.57 0.00 0.00 179.45 180.39 3dwv h LYS 124 N 0.62 0.61 -0.30 3.15 2.10 -1.22 -1.76 116.57 119.77 3dwv h LYS 124 Ca 0.11 -0.55 -0.05 0.00 -2.00 0.00 0.00 60.65 58.16 3dwv h LYS 124 Cb 0.55 0.13 -0.01 0.00 -0.90 0.00 0.00 32.23 32.00 3dwv h LYS 124 CO 0.03 1.17 -0.00 1.15 -2.00 0.00 0.00 179.45 179.80 3dwv h THR 125 N 0.39 1.26 -2.89 0.07 2.02 -0.79 -3.36 112.91 109.61 3dwv h THR 125 Ca -0.07 -0.95 -0.61 0.00 0.77 0.00 0.00 66.41 65.55 3dwv h THR 125 Cb 1.47 1.28 -0.41 0.00 -1.74 0.00 0.00 68.15 68.75 3dwv h THR 125 CO 0.16 0.31 -0.69 -0.54 0.37 0.00 0.00 175.52 175.13 3dwv s LYS 126 N -4.98 1.98 0.00 6.66 -0.14 0.29 -4.96 119.74 118.59 3dwv s LYS 126 Ca -0.13 -2.94 0.13 0.00 -1.36 0.00 0.00 55.97 51.67 3dwv s LYS 126 Cb 0.08 -2.83 0.76 0.00 -1.68 0.00 0.00 37.83 34.16 3dwv s LYS 126 CO 0.76 -1.30 1.23 -2.30 -0.76 0.00 0.00 175.35 172.98 3dwv n PRO 127 N 2.30 0.62 -0.80 -1.68 -0.02 -0.66 -4.53 135.00 130.24 3dwv n PRO 127 Ca 0.22 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.80 3dwv n PRO 127 Cb 0.38 -1.32 -0.03 0.00 -0.02 0.00 0.00 33.50 32.51 3dwv n PRO 127 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dwv n GLY 128 N 0.19 -1.98 0.00 -1.23 0.00 -1.26 -4.03 105.19 96.89 3dwv n GLY 128 Ca 0.10 -1.30 0.08 0.00 0.00 0.00 0.00 46.02 44.89 3dwv n GLY 128 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3dwv n ILE 129 N -3.15 0.00 -3.50 -0.61 -5.35 -1.26 -4.94 119.36 100.55 3dwv n ILE 129 Ca -0.01 -0.22 -0.37 0.00 -0.27 0.00 0.00 62.75 61.87 3dwv n ILE 129 Cb 0.37 0.65 -0.08 0.00 -1.74 0.00 0.00 39.64 38.83 3dwv n ILE 129 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 3dwv s LEU 130 N -3.32 4.16 0.00 7.28 2.96 -1.26 -4.98 118.68 123.51 3dwv s LEU 130 Ca 0.01 0.39 0.00 0.00 -0.22 0.00 0.00 54.13 54.31 3dwv s LEU 130 Cb 0.12 -2.36 0.00 0.00 0.50 0.00 0.00 46.19 44.45 3dwv s LEU 130 CO 0.67 0.00 0.00 0.00 -1.32 0.00 0.00 176.35 175.71 3dwv n ALA 131 N 4.24 0.00 -2.54 5.97 0.00 -1.26 -4.75 120.51 122.17 3dwv n ALA 131 Ca -0.11 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.12 3dwv n ALA 131 Cb 0.51 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.08 3dwv n ALA 131 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3dwv n THR 132 N 0.00 0.00 1.18 0.00 -2.24 -1.26 -4.97 114.28 106.99 3dwv n THR 132 Ca 0.00 -1.40 0.11 0.00 -2.27 0.00 0.00 64.05 60.49 3dwv n THR 132 Cb 0.00 -0.97 0.61 0.00 -2.10 0.00 0.00 70.33 67.87 3dwv n THR 132 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3dwv n LYS 133 N -2.73 0.43 -1.48 -0.78 2.85 -1.26 -4.85 118.16 110.34 3dwv n LYS 133 Ca 0.15 0.05 -0.37 0.00 -1.05 0.00 0.00 58.31 57.10 3dwv n LYS 133 Cb 0.54 -1.50 0.06 0.00 -0.65 0.00 0.00 35.03 33.48 3dwv n LYS 133 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3dwv n ALA 134 N -1.22 -0.26 -2.65 0.58 0.00 -1.26 -4.87 120.51 110.83 3dwv n ALA 134 Ca 0.13 -0.09 -0.43 0.00 0.00 0.00 0.00 53.44 53.05 3dwv n ALA 134 Cb 0.16 -2.06 -0.03 0.00 0.00 0.00 0.00 19.45 17.52 3dwv n ALA 134 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3dwv s ILE 135 N -1.67 4.70 -0.08 0.00 -1.09 -1.26 -4.92 121.20 116.88 3dwv s ILE 135 Ca 0.74 1.78 0.04 0.00 -2.23 0.00 0.00 60.65 60.98 3dwv s ILE 135 Cb -0.39 -4.26 -0.24 0.00 -1.58 0.00 0.00 42.46 35.99 3dwv s ILE 135 CO 0.49 -0.21 0.52 0.29 -1.23 0.00 0.00 174.94 174.80 3dwv n LYS 136 N 6.32 0.69 -4.36 2.79 5.02 -1.26 -4.13 118.16 123.23 3dwv n LYS 136 Ca 0.09 0.28 -0.18 0.00 -2.02 0.00 0.00 58.31 56.48 3dwv n LYS 136 Cb 0.47 -1.75 -0.10 0.00 -0.02 0.00 0.00 35.03 33.63 3dwv n LYS 136 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3dwv s TRP 137 N -2.58 1.67 0.45 2.13 0.51 -1.26 -0.90 118.94 118.96 3dwv s TRP 137 Ca -0.13 -0.84 -0.25 0.00 -2.12 0.00 0.00 56.10 52.77 3dwv s TRP 137 Cb 0.07 -0.96 -0.08 0.00 -0.81 0.00 0.00 33.47 31.69 3dwv s TRP 137 CO 0.80 0.07 1.39 -1.71 -0.51 0.00 0.00 176.95 176.99 3dwv n ASN 138 N -0.46 3.07 -1.25 2.95 5.15 -1.26 -3.27 115.26 120.19 3dwv n ASN 138 Ca -0.05 1.10 -0.13 0.00 -0.60 0.00 0.00 54.58 54.90 3dwv n ASN 138 Cb 0.63 -1.58 -0.03 0.00 -0.53 0.00 0.00 39.78 38.28 3dwv n ASN 138 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 3dwv n PHE 139 N -0.28 -0.29 -2.11 1.20 3.01 0.73 -4.61 117.46 115.11 3dwv n PHE 139 Ca 0.06 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.15 3dwv n PHE 139 Cb 0.41 -2.64 0.01 0.00 -0.01 0.00 0.00 39.48 37.26 3dwv n PHE 139 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 3dwv s THR 140 N -2.57 2.80 0.11 4.37 2.01 -1.20 -3.49 115.64 117.66 3dwv s THR 140 Ca 0.00 0.57 0.01 0.00 0.31 0.00 0.00 61.69 62.57 3dwv s THR 140 Cb 0.00 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.20 3dwv s THR 140 CO 0.00 -0.04 -0.03 -0.55 -0.69 0.00 0.00 174.62 173.31 3dwv s SER 141 N -1.36 0.89 -0.11 3.53 0.15 -0.56 -2.29 113.70 113.94 3dwv s SER 141 Ca 0.69 -1.07 0.03 0.00 0.70 0.00 0.00 55.95 56.30 3dwv s SER 141 Cb -0.31 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.16 3dwv s SER 141 CO 0.36 -0.55 -0.22 -0.36 1.20 0.00 0.00 173.24 173.67 3dwv s PHE 142 N -3.76 2.49 -0.13 3.44 0.40 -0.06 -0.20 117.98 120.16 3dwv s PHE 142 Ca 0.15 -1.11 -0.23 0.00 -0.60 0.00 0.00 56.93 55.14 3dwv s PHE 142 Cb 0.06 -1.69 -0.03 0.00 0.51 0.00 0.00 43.02 41.88 3dwv s PHE 142 CO -0.03 -0.48 0.71 -1.17 0.70 0.00 0.00 175.22 174.95 3dwv s LEU 143 N 0.56 4.23 -0.12 -0.37 2.96 0.05 -0.71 118.68 125.28 3dwv s LEU 143 Ca -0.14 1.09 -0.01 0.00 -0.22 0.00 0.00 54.13 54.84 3dwv s LEU 143 Cb -0.17 -3.07 -0.03 0.00 0.50 0.00 0.00 46.19 43.43 3dwv s LEU 143 CO 0.04 -0.23 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.14 3dwv s ILE 144 N 1.44 3.62 0.60 6.68 -1.09 0.01 -0.12 121.20 132.34 3dwv s ILE 144 Ca 0.35 -0.48 -0.09 0.00 -2.23 0.00 0.00 60.65 58.21 3dwv s ILE 144 Cb -0.17 -2.53 0.13 0.00 -1.58 0.00 0.00 42.46 38.31 3dwv s ILE 144 CO 0.14 0.54 0.81 -0.90 -1.23 0.00 0.00 174.94 174.31 3dwv n ASP 145 N 3.04 0.23 0.21 3.58 5.68 0.06 -2.12 116.55 127.23 3dwv n ASP 145 Ca -0.18 -1.39 0.17 0.00 -0.50 0.00 0.00 54.79 52.89 3dwv n ASP 145 Cb 0.53 -0.61 0.84 0.00 -1.14 0.00 0.00 41.12 40.74 3dwv n ASP 145 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 3dwv h ARG 146 N 0.00 0.00 -0.25 0.11 3.08 -1.88 -1.93 114.38 113.50 3dwv h ARG 146 Ca -0.26 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.71 3dwv h ARG 146 Cb 0.77 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.77 3dwv h ARG 146 CO 0.20 0.00 -0.06 -0.25 -1.07 0.00 0.00 179.97 178.79 3dwv n ASP 147 N -3.79 2.95 0.00 7.04 9.92 -1.26 -0.29 116.55 131.12 3dwv n ASP 147 Ca 0.01 -3.41 0.00 0.00 -0.53 0.00 0.00 54.79 50.86 3dwv n ASP 147 Cb 0.31 -0.57 0.00 0.00 -0.64 0.00 0.00 41.12 40.22 3dwv n ASP 147 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3dwv n GLY 148 N -0.94 0.71 3.72 0.44 0.00 -0.73 -4.78 105.19 103.62 3dwv n GLY 148 Ca 0.26 -0.29 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 3dwv n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dwv s VAL 149 N -2.00 5.20 -0.01 1.61 1.01 -1.26 -0.49 120.40 124.47 3dwv s VAL 149 Ca 0.00 0.90 -0.30 0.00 0.00 0.00 0.00 61.98 62.58 3dwv s VAL 149 Cb 0.00 -3.79 -0.07 0.00 0.00 0.00 0.00 36.38 32.52 3dwv s VAL 149 CO 0.00 0.33 1.66 -2.84 0.00 0.00 0.00 175.10 174.25 3dwv s PRO 150 N 0.61 4.19 -0.00 2.72 0.02 -1.26 -0.76 135.00 140.52 3dwv s PRO 150 Ca 0.25 2.24 0.01 0.00 0.02 0.00 0.00 61.00 63.52 3dwv s PRO 150 Cb -0.15 -3.86 -0.02 0.00 0.02 0.00 0.00 34.50 30.49 3dwv s PRO 150 CO 0.09 -0.80 0.03 1.33 -0.33 0.00 0.00 177.00 177.32 3dwv n VAL 151 N 5.22 0.00 -3.79 3.83 0.24 0.83 -4.83 118.33 119.83 3dwv n VAL 151 Ca 0.17 -0.17 -0.13 0.00 -2.04 0.00 0.00 64.34 62.17 3dwv n VAL 151 Cb 0.42 0.64 -0.09 0.00 -1.47 0.00 0.00 33.84 33.34 3dwv n VAL 151 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 3dwv s GLU 152 N -1.77 0.61 -0.14 7.34 0.41 -1.17 -4.99 118.70 118.99 3dwv s GLU 152 Ca -0.00 -0.26 -0.00 0.00 -0.41 0.00 0.00 54.97 54.30 3dwv s GLU 152 Cb 0.01 0.27 -0.01 0.00 -1.78 0.00 0.00 34.13 32.61 3dwv s GLU 152 CO 0.05 -0.16 -0.13 0.50 -0.49 0.00 0.00 175.26 175.02 3dwv s ARG 153 N -1.36 3.33 -0.06 1.61 3.52 -1.26 -0.77 118.95 123.97 3dwv s ARG 153 Ca -0.14 -0.70 0.03 0.00 -0.13 0.00 0.00 55.73 54.79 3dwv s ARG 153 Cb -0.06 -2.64 -0.02 0.00 -1.56 0.00 0.00 34.95 30.67 3dwv s ARG 153 CO 0.03 0.15 -0.15 -0.06 -0.81 0.00 0.00 175.30 174.46 3dwv s PHE 154 N 0.52 2.70 0.85 5.12 0.08 0.71 -4.98 117.98 122.97 3dwv s PHE 154 Ca -0.09 -0.27 -0.11 0.00 0.12 0.00 0.00 56.93 56.58 3dwv s PHE 154 Cb -0.16 -1.66 0.10 0.00 -0.57 0.00 0.00 43.02 40.73 3dwv s PHE 154 CO 0.04 0.10 1.10 -1.54 -0.10 0.00 0.00 175.22 174.82 3dwv s SER 155 N -0.53 3.83 0.58 1.36 1.04 -1.26 -1.50 113.70 117.21 3dwv s SER 155 Ca 0.07 1.73 0.34 0.00 0.48 0.00 0.00 55.95 58.58 3dwv s SER 155 Cb -0.12 -2.39 1.80 0.00 0.10 0.00 0.00 66.02 65.42 3dwv s SER 155 CO 0.01 -2.45 2.18 1.55 0.98 0.00 0.00 173.24 175.52 3dwv h PRO 156 N -1.42 0.00 -0.58 4.02 0.13 -1.81 -2.18 132.00 130.15 3dwv h PRO 156 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3dwv h PRO 156 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 3dwv h PRO 156 CO 0.51 0.05 0.00 0.41 -0.23 0.00 0.00 178.00 178.74 3dwv n GLY 157 N -0.81 1.82 3.75 1.56 0.00 -1.24 -2.86 105.19 107.41 3dwv n GLY 157 Ca -0.02 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 3dwv n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dwv s ALA 158 N -1.57 3.77 0.68 4.61 0.00 -0.82 -4.98 121.76 123.44 3dwv s ALA 158 Ca 0.37 1.58 -0.11 0.00 0.00 0.00 0.00 51.96 53.80 3dwv s ALA 158 Cb 0.22 -3.66 -0.00 0.00 0.00 0.00 0.00 23.12 19.68 3dwv s ALA 158 CO 0.21 -0.98 1.07 -1.54 0.00 0.00 0.00 175.76 174.51 3dwv s SER 159 N 0.58 5.69 0.25 0.00 1.04 -1.26 -4.92 113.70 115.09 3dwv s SER 159 Ca 0.65 1.21 -0.04 0.00 0.48 0.00 0.00 55.95 58.25 3dwv s SER 159 Cb -0.48 -2.09 0.38 0.00 0.10 0.00 0.00 66.02 63.93 3dwv s SER 159 CO 0.46 -1.19 1.85 0.58 0.98 0.00 0.00 173.24 175.93 3dwv h VAL 160 N -0.54 1.02 -0.50 5.02 2.07 -1.93 -2.42 116.25 118.97 3dwv h VAL 160 Ca -0.45 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 66.67 3dwv h VAL 160 Cb 1.23 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 3dwv h VAL 160 CO 0.63 0.18 0.06 0.50 0.02 0.00 0.00 177.57 178.97 3dwv h LYS 161 N 1.00 0.79 -0.45 1.57 1.63 -1.98 0.16 116.57 119.29 3dwv h LYS 161 Ca 0.41 -0.18 -0.08 0.00 -0.85 0.00 0.00 60.65 59.94 3dwv h LYS 161 Cb 0.23 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.73 3dwv h LYS 161 CO -0.19 0.76 -0.05 -0.44 -3.45 0.00 0.00 179.45 176.07 3dwv h ASP 162 N 0.75 0.74 0.19 4.20 3.32 -1.85 -1.77 116.42 122.00 3dwv h ASP 162 Ca 0.16 -0.19 -0.27 0.00 0.02 0.00 0.00 57.03 56.74 3dwv h ASP 162 Cb 0.37 -0.20 0.03 0.00 0.22 0.00 0.00 39.33 39.75 3dwv h ASP 162 CO 0.01 0.84 -1.17 0.40 -1.72 0.00 0.00 179.24 177.59 3dwv h ILE 163 N 0.70 1.37 -1.00 0.35 2.04 -1.01 -3.20 117.51 116.77 3dwv h ILE 163 Ca 0.13 -2.58 0.16 0.00 1.00 0.00 0.00 64.86 63.57 3dwv h ILE 163 Cb 0.50 3.05 -0.10 0.00 -0.74 0.00 0.00 36.82 39.53 3dwv h ILE 163 CO 0.03 0.76 0.62 -0.33 0.00 0.00 0.00 178.15 179.23 3dwv h GLU 164 N -0.04 0.84 -0.92 2.37 5.08 -0.64 0.42 114.58 121.69 3dwv h GLU 164 Ca -0.20 -0.05 0.22 0.00 -1.00 0.00 0.00 59.36 58.33 3dwv h GLU 164 Cb 1.91 -0.19 -0.12 0.00 0.50 0.00 0.00 28.75 30.85 3dwv h GLU 164 CO 0.22 0.56 0.45 1.49 -1.00 0.00 0.00 179.01 180.72 3dwv h GLU 165 N 0.87 0.44 0.16 2.33 4.57 -1.31 -0.73 114.58 120.91 3dwv h GLU 165 Ca 0.54 -0.03 -0.31 0.00 -1.18 0.00 0.00 59.36 58.39 3dwv h GLU 165 Cb 0.72 -0.10 0.01 0.00 -0.16 0.00 0.00 28.75 29.22 3dwv h GLU 165 CO -0.33 0.29 -1.53 0.87 -1.18 0.00 0.00 179.01 177.14 3dwv h LYS 166 N 0.46 0.34 -0.17 1.92 1.79 -1.45 -3.41 116.57 116.05 3dwv h LYS 166 Ca 0.58 -0.57 -0.20 0.00 -2.18 0.00 0.00 60.65 58.28 3dwv h LYS 166 Cb 1.09 0.21 0.01 0.00 -1.58 0.00 0.00 32.23 31.96 3dwv h LYS 166 CO -0.51 1.28 -0.66 1.25 -1.08 0.00 0.00 179.45 179.72 3dwv h LEU 167 N -0.10 0.87 -0.52 2.94 5.85 -0.50 -3.31 115.31 120.55 3dwv h LEU 167 Ca -0.31 -0.61 0.01 0.00 0.84 0.00 0.00 57.88 57.81 3dwv h LEU 167 Cb 1.93 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 42.68 3dwv h LEU 167 CO 0.13 1.34 0.34 0.40 -0.34 0.00 0.00 178.44 180.32 3dwv h ILE 168 N 0.46 1.13 -0.18 4.05 2.04 -1.37 0.12 117.51 123.76 3dwv h ILE 168 Ca -0.04 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.63 3dwv h ILE 168 Cb 1.29 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 3dwv h ILE 168 CO 0.14 0.13 0.15 -0.65 0.00 0.00 0.00 178.15 177.91 3dwv h PRO 169 N 0.71 0.00 0.00 2.37 0.11 -1.79 -1.89 132.00 131.50 3dwv h PRO 169 Ca 0.19 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.13 3dwv h PRO 169 Cb -0.08 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.00 3dwv h PRO 169 CO -0.04 0.00 -0.81 -0.07 -0.21 0.00 0.00 178.00 176.86 3dwv h LEU 170 N 0.00 0.00 0.00 2.35 3.38 -0.94 -3.53 115.31 116.57 3dwv h LEU 170 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3dwv h LEU 170 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3dwv h LEU 170 CO -0.00 0.81 0.00 0.18 0.09 0.00 0.00 178.44 179.52