#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dwv n SER 10 N 0.00 0.50 -1.88 6.12 2.88 -1.26 -5.03 113.62 114.94 3dwv n SER 10 Ca 0.00 -0.49 -0.17 0.00 -1.33 0.00 0.00 58.87 56.88 3dwv n SER 10 Cb 0.00 0.00 0.14 0.00 -0.75 0.00 0.00 64.21 63.60 3dwv n SER 10 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3dwv n ALA 11 N -3.00 4.73 -1.32 -1.46 0.00 -1.26 -5.08 120.51 113.11 3dwv n ALA 11 Ca 0.00 -2.09 -0.52 0.00 0.00 0.00 0.00 53.44 50.83 3dwv n ALA 11 Cb 0.00 -1.32 -0.07 0.00 0.00 0.00 0.00 19.45 18.06 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 -0.67 -3.14 0.20 0.00 0.00 -1.26 -4.90 120.51 110.74 3dwv n ALA 12 Ca 0.43 0.52 0.02 0.00 0.00 0.00 0.00 53.44 54.41 3dwv n ALA 12 Cb 1.35 -1.55 -0.01 0.00 0.00 0.00 0.00 19.45 19.24 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 1.44 0.67 -3.65 0.00 3.41 -1.26 -5.09 113.62 109.14 3dwv n SER 13 Ca 0.18 -0.83 0.01 0.00 -0.26 0.00 0.00 58.87 57.96 3dwv n SER 13 Cb 0.06 0.61 -0.00 0.00 -0.26 0.00 0.00 64.21 64.62 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 -1.00 -0.08 0.23 4.04 1.04 -1.26 -4.68 113.70 112.00 3dwv s SER 14 Ca 0.03 -0.20 0.21 0.00 0.48 0.00 0.00 55.95 56.47 3dwv s SER 14 Cb 0.03 0.23 0.94 0.00 0.10 0.00 0.00 66.02 67.33 3dwv s SER 14 CO 0.13 -0.43 1.65 2.30 0.98 0.00 0.00 173.24 177.86 3dwv n ILE 15 N -0.51 0.94 1.23 -1.02 -5.35 0.00 -2.46 119.36 112.20 3dwv n ILE 15 Ca -0.08 0.35 0.14 0.00 -0.27 0.00 0.00 62.75 62.89 3dwv n ILE 15 Cb 0.62 -1.28 0.69 0.00 -1.74 0.00 0.00 39.64 37.93 3dwv n ILE 15 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3dwv n PHE 16 N -2.13 0.00 1.12 4.28 3.72 -1.26 -2.24 117.46 120.95 3dwv n PHE 16 Ca 0.01 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.52 3dwv n PHE 16 Cb 0.17 -0.37 0.58 0.00 -0.94 0.00 0.00 39.48 38.92 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 -1.37 0.00 -4.55 4.37 8.00 -1.03 -4.89 116.55 117.09 3dwv n ASP 17 Ca 0.11 -0.16 -0.29 0.00 0.71 0.00 0.00 54.79 55.16 3dwv n ASP 17 Cb 0.27 -0.23 -0.10 0.00 -0.02 0.00 0.00 41.12 41.04 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 -2.46 2.66 -0.00 1.24 0.40 -0.95 -5.09 117.98 113.77 3dwv s PHE 18 Ca 0.23 -0.20 -0.25 0.00 -0.60 0.00 0.00 56.93 56.11 3dwv s PHE 18 Cb 0.15 -1.39 -0.04 0.00 0.51 0.00 0.00 43.02 42.25 3dwv s PHE 18 CO 0.32 0.42 0.78 -2.00 0.70 0.00 0.00 175.22 175.45 3dwv s GLU 19 N -2.26 4.49 -0.04 0.44 2.12 -1.26 -5.00 118.70 117.19 3dwv s GLU 19 Ca 0.21 1.06 0.03 0.00 0.36 0.00 0.00 54.97 56.62 3dwv s GLU 19 Cb -0.11 -3.41 0.00 0.00 0.26 0.00 0.00 34.13 30.88 3dwv s GLU 19 CO 0.13 0.15 -0.11 0.08 -0.54 0.00 0.00 175.26 174.96 3dwv s VAL 20 N 0.44 0.96 -0.04 3.70 1.01 -1.26 -4.92 120.40 120.29 3dwv s VAL 20 Ca 0.40 -0.44 -0.00 0.00 0.00 0.00 0.00 61.98 61.94 3dwv s VAL 20 Cb -0.20 -0.86 -0.03 0.00 0.00 0.00 0.00 36.38 35.29 3dwv s VAL 20 CO 0.22 0.30 0.00 -0.76 0.00 0.00 0.00 175.10 174.86 3dwv s LEU 21 N 0.28 3.55 0.00 3.92 1.02 -1.26 -0.46 118.68 125.73 3dwv s LEU 21 Ca -0.06 0.06 -0.13 0.00 0.02 0.00 0.00 54.13 54.03 3dwv s LEU 21 Cb -0.11 -1.94 0.19 0.00 0.02 0.00 0.00 46.19 44.35 3dwv s LEU 21 CO 0.01 0.32 1.12 -0.90 0.02 0.00 0.00 176.35 176.92 3dwv n ASP 22 N 1.73 0.16 0.32 2.29 5.68 0.27 -1.09 116.55 125.90 3dwv n ASP 22 Ca -0.16 -1.45 0.19 0.00 -0.50 0.00 0.00 54.79 52.87 3dwv n ASP 22 Cb 0.53 -0.85 1.07 0.00 -1.14 0.00 0.00 41.12 40.73 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 -1.74 1.27 -0.38 2.12 0.00 -1.73 -0.20 119.26 118.59 3dwv h ALA 23 Ca -0.36 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3dwv h ALA 23 Cb 1.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.80 3dwv h ALA 23 CO 0.26 -0.02 0.00 -0.25 0.00 0.00 0.00 179.25 179.25 3dwv n ASP 24 N -3.44 3.55 -0.99 0.00 8.00 -1.26 -4.77 116.55 117.64 3dwv n ASP 24 Ca -0.03 -2.43 -0.13 0.00 0.71 0.00 0.00 54.79 52.91 3dwv n ASP 24 Cb 0.09 -0.54 -0.06 0.00 -0.02 0.00 0.00 41.12 40.59 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 0.49 0.00 -3.80 1.24 8.25 -0.11 -4.99 115.22 116.30 3dwv n HIS 25 Ca 0.17 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.30 3dwv n HIS 25 Cb 0.72 -2.62 -0.05 0.00 1.12 0.00 0.00 29.99 29.17 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 -3.00 3.53 -0.33 -0.41 -0.14 -1.26 -4.81 119.74 113.32 3dwv s LYS 26 Ca 0.00 -0.23 -0.40 0.00 -1.36 0.00 0.00 55.97 53.98 3dwv s LYS 26 Cb 0.00 -2.99 -0.15 0.00 -1.68 0.00 0.00 37.83 33.01 3dwv s LYS 26 CO 0.00 0.57 1.87 -2.30 -0.76 0.00 0.00 175.35 174.74 3dwv n PRO 27 N 0.46 0.94 -3.12 -1.68 -0.02 -1.26 -0.56 135.00 129.75 3dwv n PRO 27 Ca -0.06 0.32 -0.39 0.00 -2.02 0.00 0.00 63.50 61.35 3dwv n PRO 27 Cb 0.52 -2.08 -0.05 0.00 -0.02 0.00 0.00 33.50 31.87 3dwv n PRO 27 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3dwv s TYR 28 N 4.58 3.63 -1.03 6.00 5.04 0.40 -4.78 117.35 131.19 3dwv s TYR 28 Ca 1.04 1.23 -0.21 0.00 -2.44 0.00 0.00 57.07 56.68 3dwv s TYR 28 Cb -1.10 -2.71 -0.10 0.00 0.35 0.00 0.00 41.96 38.40 3dwv s TYR 28 CO 0.64 0.22 1.94 0.27 -1.34 0.00 0.00 175.55 177.27 3dwv n ASN 29 N 3.24 3.07 -0.06 4.32 0.23 -1.26 -4.69 115.26 120.10 3dwv n ASN 29 Ca -0.04 -2.72 -0.12 0.00 -0.53 0.00 0.00 54.58 51.17 3dwv n ASN 29 Cb 0.51 -1.45 -0.06 0.00 -2.08 0.00 0.00 39.78 36.71 3dwv n ASN 29 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 3dwv h LEU 30 N 14.82 0.32 0.00 -4.53 5.85 -1.94 -2.99 115.31 126.84 3dwv h LEU 30 Ca 0.36 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3dwv h LEU 30 Cb 0.78 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.73 3dwv h LEU 30 CO 1.64 0.58 0.00 0.55 -0.34 0.00 0.00 178.44 180.86 3dwv n VAL 31 N -4.70 1.83 0.29 1.05 3.14 -1.26 -1.07 118.33 117.61 3dwv n VAL 31 Ca -0.05 0.46 0.17 0.00 -2.96 0.00 0.00 64.34 61.96 3dwv n VAL 31 Cb 0.24 -1.44 0.82 0.00 -1.06 0.00 0.00 33.84 32.41 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 0.00 -0.01 1.45 3.07 -1.93 -1.28 115.11 116.42 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 0.02 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.58 3dwv h GLN 32 CO 0.00 0.00 -0.43 0.72 0.09 0.00 0.00 178.83 179.21 3dwv n HIS 33 N -2.72 0.00 -1.70 0.06 8.25 -0.24 -4.94 115.22 113.94 3dwv n HIS 33 Ca -0.01 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.05 3dwv n HIS 33 Cb 0.13 -0.09 0.02 0.00 1.12 0.00 0.00 29.99 31.17 3dwv n HIS 33 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 3dwv n LYS 34 N -0.66 1.83 0.00 -0.41 4.81 -0.48 -2.07 118.16 121.17 3dwv n LYS 34 Ca 0.10 0.65 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 3dwv n LYS 34 Cb 0.38 -2.38 0.00 0.00 0.02 0.00 0.00 35.03 33.05 3dwv n LYS 34 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3dwv n GLY 35 N 0.84 3.11 3.03 3.14 0.00 -0.09 -5.04 105.19 110.19 3dwv n GLY 35 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.89 0.48 0.89 1.61 0.01 -0.88 -4.89 113.70 110.04 3dwv s SER 36 Ca 0.00 -0.65 -0.11 0.00 1.31 0.00 0.00 55.95 56.50 3dwv s SER 36 Cb 0.00 0.11 0.13 0.00 0.21 0.00 0.00 66.02 66.46 3dwv s SER 36 CO 0.00 -0.35 1.10 -2.16 0.41 0.00 0.00 173.24 172.23 3dwv s PRO 37 N -2.15 1.27 0.13 12.44 0.04 -1.26 -4.46 135.00 141.01 3dwv s PRO 37 Ca -0.08 1.06 -0.11 0.00 0.04 0.00 0.00 61.00 61.91 3dwv s PRO 37 Cb -0.05 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.70 3dwv s PRO 37 CO -0.03 -2.30 0.29 -0.48 0.04 0.00 0.00 177.00 174.52 3dwv s LEU 38 N -6.31 0.98 -0.12 -3.56 2.34 -0.66 -3.28 118.68 108.07 3dwv s LEU 38 Ca 0.64 -0.68 0.03 0.00 0.06 0.00 0.00 54.13 54.18 3dwv s LEU 38 Cb -0.19 1.31 0.00 0.00 -0.56 0.00 0.00 46.19 46.74 3dwv s LEU 38 CO 0.58 -0.84 -0.22 -0.76 -1.06 0.00 0.00 176.35 174.04 3dwv s LEU 39 N -2.90 2.17 -0.27 1.48 1.43 -0.43 -0.13 118.68 120.03 3dwv s LEU 39 Ca 0.10 -0.55 -0.03 0.00 -1.03 0.00 0.00 54.13 52.62 3dwv s LEU 39 Cb 0.03 -1.45 0.03 0.00 0.03 0.00 0.00 46.19 44.83 3dwv s LEU 39 CO -0.06 0.13 -0.02 -0.63 0.23 0.00 0.00 176.35 176.00 3dwv s ILE 40 N 0.53 3.11 -0.04 -0.59 1.01 -0.39 -1.15 121.20 123.68 3dwv s ILE 40 Ca -0.14 -1.01 -0.03 0.00 0.00 0.00 0.00 60.65 59.47 3dwv s ILE 40 Cb -0.17 -2.61 -0.04 0.00 0.01 0.00 0.00 42.46 39.65 3dwv s ILE 40 CO 0.05 0.13 0.13 -0.31 0.00 0.00 0.00 174.94 174.93 3dwv s TYR 41 N 1.35 3.45 -0.08 3.97 1.51 -0.20 -1.22 117.35 126.13 3dwv s TYR 41 Ca -0.00 0.34 -0.10 0.00 -1.01 0.00 0.00 57.07 56.29 3dwv s TYR 41 Cb -0.17 -1.82 -0.05 0.00 -0.11 0.00 0.00 41.96 39.81 3dwv s TYR 41 CO -0.03 0.63 0.25 0.54 -1.11 0.00 0.00 175.55 175.83 3dwv s ASN 42 N -1.59 6.54 0.34 2.29 4.22 -0.88 -0.98 114.94 124.88 3dwv s ASN 42 Ca 0.22 0.65 0.04 0.00 -2.14 0.00 0.00 52.86 51.63 3dwv s ASN 42 Cb -0.12 -2.15 -0.02 0.00 1.28 0.00 0.00 41.25 40.25 3dwv s ASN 42 CO 0.13 0.35 0.15 1.33 -2.04 0.00 0.00 177.10 177.01 3dwv n VAL 43 N 2.09 0.00 -3.66 3.54 0.24 -0.29 0.72 118.33 120.97 3dwv n VAL 43 Ca -0.17 -2.08 -0.08 0.00 -2.04 0.00 0.00 64.34 59.98 3dwv n VAL 43 Cb 0.54 0.81 0.01 0.00 -1.47 0.00 0.00 33.84 33.72 3dwv n VAL 43 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dwv n ALA 44 N -1.25 -0.93 -1.10 2.33 0.00 -1.26 -1.53 120.51 116.76 3dwv n ALA 44 Ca -0.13 -0.97 -0.34 0.00 0.00 0.00 0.00 53.44 52.00 3dwv n ALA 44 Cb 0.53 0.77 0.11 0.00 0.00 0.00 0.00 19.45 20.87 3dwv n ALA 44 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3dwv n SER 45 N -1.49 0.06 -4.54 0.00 7.64 -1.26 -4.57 113.62 109.45 3dwv n SER 45 Ca -0.04 0.55 -0.43 0.00 1.01 0.00 0.00 58.87 59.96 3dwv n SER 45 Cb 0.41 -1.40 -0.05 0.00 -1.01 0.00 0.00 64.21 62.17 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 -3.72 3.42 -0.01 1.43 2.20 0.96 -4.85 119.74 119.18 3dwv s LYS 46 Ca 0.69 -0.07 0.15 0.00 -0.36 0.00 0.00 55.97 56.38 3dwv s LYS 46 Cb -0.29 -3.94 -0.19 0.00 -1.51 0.00 0.00 37.83 31.89 3dwv s LYS 46 CO 0.55 -1.14 0.54 0.00 -0.36 0.00 0.00 175.35 174.94 3dwv n GLY 48 N 1.45 1.41 2.91 0.00 0.00 -1.26 -4.93 105.19 104.76 3dwv n GLY 48 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.78 0.24 -0.01 1.61 2.02 -1.26 -5.04 117.35 114.13 3dwv s TYR 49 Ca 0.00 -0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.67 3dwv s TYR 49 Cb 0.00 -0.16 0.02 0.00 -0.40 0.00 0.00 41.96 41.42 3dwv s TYR 49 CO 0.00 -0.01 0.90 0.25 -1.57 0.00 0.00 175.55 175.12 3dwv n THR 50 N 3.06 0.15 -1.74 -0.71 -2.24 -1.26 -4.98 114.28 106.55 3dwv n THR 50 Ca -0.13 -0.17 -0.18 0.00 -2.27 0.00 0.00 64.05 61.29 3dwv n THR 50 Cb 0.59 0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 69.31 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 -0.11 -1.51 0.00 -0.78 5.02 -1.26 -1.47 118.16 118.05 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 0.64 -5.43 0.00 0.00 -0.02 0.00 0.00 35.03 30.22 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 -0.49 0.13 0.36 0.72 0.00 -1.26 -3.84 105.19 100.81 3dwv n GLY 52 Ca -0.19 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.80 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 1.33 0.88 -0.02 0.00 -1.19 -1.14 103.07 102.93 3dwv h GLY 53 Ca 0.00 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 46.81 3dwv h GLY 53 CO 0.00 0.50 0.07 -1.82 0.00 0.00 0.00 176.54 175.28 3dwv h TYR 54 N 1.28 0.25 -0.61 5.60 3.20 -1.91 0.72 116.97 125.51 3dwv h TYR 54 Ca 0.34 -0.02 -0.09 0.00 3.14 0.00 0.00 58.73 62.11 3dwv h TYR 54 Cb -0.14 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.04 3dwv h TYR 54 CO -0.00 0.32 0.03 1.49 -1.64 0.00 0.00 178.16 178.35 3dwv h GLU 55 N 0.11 1.05 -0.22 1.82 4.81 -1.94 -0.16 114.58 120.06 3dwv h GLU 55 Ca 0.06 -0.32 -0.02 0.00 -0.13 0.00 0.00 59.36 58.95 3dwv h GLU 55 Cb 0.17 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3dwv h GLU 55 CO -0.00 1.02 0.07 1.15 -0.73 0.00 0.00 179.01 180.52 3dwv h THR 56 N 0.95 1.19 -0.34 0.32 2.02 -1.03 0.45 112.91 116.47 3dwv h THR 56 Ca 0.18 -0.59 0.04 0.00 0.77 0.00 0.00 66.41 66.80 3dwv h THR 56 Cb 0.53 1.16 -0.04 0.00 -1.74 0.00 0.00 68.15 68.07 3dwv h THR 56 CO 0.03 0.19 0.12 0.00 0.37 0.00 0.00 175.52 176.23 3dwv h ALA 57 N 0.90 0.39 -0.46 6.16 0.00 -0.74 -1.76 119.26 123.75 3dwv h ALA 57 Ca 0.07 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 3dwv h ALA 57 Cb 0.23 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3dwv h ALA 57 CO -0.00 -0.27 -0.13 1.15 0.00 0.00 0.00 179.25 180.00 3dwv h THR 58 N 0.27 1.26 0.17 0.00 2.02 -0.92 -1.25 112.91 114.46 3dwv h THR 58 Ca 0.15 -1.23 -0.01 0.00 0.77 0.00 0.00 66.41 66.09 3dwv h THR 58 Cb 0.12 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 3dwv h THR 58 CO -0.15 0.42 -0.08 0.74 0.37 0.00 0.00 175.52 176.82 3dwv h THR 59 N 0.76 0.91 -0.85 3.16 2.02 -0.59 -1.47 112.91 116.85 3dwv h THR 59 Ca 0.12 -0.37 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 3dwv h THR 59 Cb 0.64 1.14 -0.04 0.00 -1.74 0.00 0.00 68.15 68.15 3dwv h THR 59 CO 0.04 0.09 0.51 -0.07 0.37 0.00 0.00 175.52 176.46 3dwv h LEU 60 N -0.41 1.03 0.28 2.58 3.38 -1.34 0.12 115.31 120.95 3dwv h LEU 60 Ca -0.02 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3dwv h LEU 60 Cb 0.32 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 3dwv h LEU 60 CO 0.04 0.80 -0.43 0.22 0.09 0.00 0.00 178.44 179.16 3dwv h TYR 61 N 1.17 -1.19 0.00 1.13 3.20 -1.12 -1.13 116.97 119.03 3dwv h TYR 61 Ca 0.31 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.16 3dwv h TYR 61 Cb -0.04 0.48 -0.00 0.00 1.54 0.00 0.00 36.73 38.71 3dwv h TYR 61 CO -0.00 -0.56 -0.14 -0.91 -1.64 0.00 0.00 178.16 174.91 3dwv h ASN 62 N -0.77 0.00 0.46 -2.11 2.35 -1.07 0.23 115.58 114.66 3dwv h ASN 62 Ca -0.01 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.47 3dwv h ASN 62 Cb 0.73 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.11 3dwv h ASN 62 CO -0.15 0.14 -1.18 0.50 -1.65 0.00 0.00 177.43 175.09 3dwv h LYS 63 N 0.00 0.37 -0.00 0.81 3.64 -0.60 -3.38 116.57 117.41 3dwv h LYS 63 Ca -0.00 -0.54 0.00 0.00 -1.27 0.00 0.00 60.65 58.84 3dwv h LYS 63 Cb 0.45 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 3dwv h LYS 63 CO 0.02 1.22 -0.02 0.66 -2.27 0.00 0.00 179.45 179.07 3dwv n TYR 64 N -3.64 0.00 0.15 1.91 4.01 -0.46 -4.69 117.16 114.44 3dwv n TYR 64 Ca -0.09 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.73 3dwv n TYR 64 Cb 0.97 0.00 0.59 0.00 -0.31 0.00 0.00 39.34 40.59 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 0.15 0.14 0.00 -0.72 2.10 -1.11 -0.70 116.57 116.43 3dwv h LYS 65 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 3dwv h LYS 65 Cb 0.04 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.34 3dwv h LYS 65 CO 0.00 0.10 0.00 -1.13 -2.00 0.00 0.00 179.45 176.42 3dwv n SER 66 N -4.50 0.66 -0.56 7.07 3.41 -1.26 -0.56 113.62 117.88 3dwv n SER 66 Ca 0.01 0.72 0.13 0.00 -0.26 0.00 0.00 58.87 59.47 3dwv n SER 66 Cb 0.16 -0.84 0.46 0.00 -0.26 0.00 0.00 64.21 63.73 3dwv n SER 66 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dwv n GLN 67 N -2.29 1.77 0.00 4.33 1.13 -0.27 -4.93 117.38 117.12 3dwv n GLN 67 Ca 0.01 -1.12 0.00 0.00 -1.94 0.00 0.00 57.00 53.95 3dwv n GLN 67 Cb 0.15 -1.47 0.00 0.00 0.11 0.00 0.00 30.24 29.03 3dwv n GLN 67 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dwv n GLY 68 N 1.20 0.52 3.78 1.08 0.00 0.28 -5.00 105.19 107.04 3dwv n GLY 68 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.00 3.11 0.21 1.61 5.36 -1.21 -4.68 117.98 120.38 3dwv s PHE 69 Ca 0.00 1.59 -0.01 0.00 -0.96 0.00 0.00 56.93 57.56 3dwv s PHE 69 Cb 0.00 -3.26 -0.04 0.00 -0.34 0.00 0.00 43.02 39.38 3dwv s PHE 69 CO 0.00 -1.03 0.13 -0.08 -1.46 0.00 0.00 175.22 172.78 3dwv s THR 70 N -1.57 0.04 -0.10 0.12 -1.32 -1.20 -4.16 115.64 107.45 3dwv s THR 70 Ca 0.59 -2.00 0.02 0.00 -1.21 0.00 0.00 61.69 59.09 3dwv s THR 70 Cb -0.26 -2.51 0.01 0.00 -1.51 0.00 0.00 72.50 68.24 3dwv s THR 70 CO 0.32 0.00 -0.14 -0.69 -2.21 0.00 0.00 174.62 171.90 3dwv s VAL 71 N -4.11 1.39 -0.07 5.08 1.01 -1.26 -1.32 120.40 121.13 3dwv s VAL 71 Ca 0.39 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.81 3dwv s VAL 71 Cb 0.07 -1.27 -0.02 0.00 0.00 0.00 0.00 36.38 35.15 3dwv s VAL 71 CO 0.13 0.42 -0.17 -0.76 0.00 0.00 0.00 175.10 174.71 3dwv s LEU 72 N 0.90 2.52 -0.14 3.92 1.43 -0.30 -3.62 118.68 123.40 3dwv s LEU 72 Ca -0.09 -0.32 -0.00 0.00 -1.03 0.00 0.00 54.13 52.69 3dwv s LEU 72 Cb -0.15 -1.51 -0.01 0.00 0.03 0.00 0.00 46.19 44.55 3dwv s LEU 72 CO 0.00 0.28 -0.13 0.00 0.23 0.00 0.00 176.35 176.73 3dwv s ALA 73 N -0.37 2.60 -0.34 4.21 0.00 -0.46 -1.03 121.76 126.38 3dwv s ALA 73 Ca 0.03 -0.93 -0.08 0.00 0.00 0.00 0.00 51.96 50.98 3dwv s ALA 73 Cb -0.12 -1.23 0.02 0.00 0.00 0.00 0.00 23.12 21.79 3dwv s ALA 73 CO 0.02 0.17 0.14 -0.06 0.00 0.00 0.00 175.76 176.03 3dwv s PHE 74 N 0.49 3.22 0.17 0.00 0.40 -0.15 0.20 117.98 122.31 3dwv s PHE 74 Ca -0.09 -1.08 -0.30 0.00 -0.60 0.00 0.00 56.93 54.85 3dwv s PHE 74 Cb -0.16 -2.34 -0.07 0.00 0.51 0.00 0.00 43.02 40.96 3dwv s PHE 74 CO 0.04 -0.64 1.10 -1.25 0.70 0.00 0.00 175.22 175.17 3dwv s PRO 75 N 1.50 4.59 0.50 0.24 0.04 -1.26 -1.14 135.00 139.47 3dwv s PRO 75 Ca 0.01 1.72 -0.20 0.00 0.04 0.00 0.00 61.00 62.56 3dwv s PRO 75 Cb -0.19 -3.28 -0.07 0.00 0.04 0.00 0.00 34.50 31.00 3dwv s PRO 75 CO 0.04 0.06 1.10 0.45 0.04 0.00 0.00 177.00 178.69 3dwv s SER 76 N -0.05 6.06 0.00 6.66 0.15 -0.58 -1.02 113.70 124.90 3dwv s SER 76 Ca 0.50 2.09 0.30 0.00 0.70 0.00 0.00 55.95 59.54 3dwv s SER 76 Cb -0.29 -2.58 1.39 0.00 -1.71 0.00 0.00 66.02 62.83 3dwv s SER 76 CO 0.35 -0.98 1.96 -0.46 1.20 0.00 0.00 173.24 175.30 3dwv n ASN 77 N -1.02 0.32 -1.44 5.45 2.04 0.21 -4.67 115.26 116.15 3dwv n ASN 77 Ca 0.10 -0.56 -0.17 0.00 -0.44 0.00 0.00 54.58 53.51 3dwv n ASN 77 Cb 0.51 -0.11 -0.06 0.00 -2.53 0.00 0.00 39.78 37.59 3dwv n ASN 77 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3dwv n GLN 78 N -1.00 -1.23 -3.39 -3.83 1.13 -1.26 -4.96 117.38 102.85 3dwv n GLN 78 Ca 0.16 1.05 -0.38 0.00 -1.94 0.00 0.00 57.00 55.89 3dwv n GLN 78 Cb 0.25 -5.32 -0.07 0.00 0.11 0.00 0.00 30.24 25.20 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 -2.68 3.39 0.00 1.08 5.36 -1.26 -4.79 117.98 119.08 3dwv s PHE 79 Ca 0.00 0.64 0.00 0.00 -0.96 0.00 0.00 56.93 56.61 3dwv s PHE 79 Cb 0.00 -2.52 0.00 0.00 -0.34 0.00 0.00 43.02 40.16 3dwv s PHE 79 CO 0.00 0.01 0.00 0.41 -1.46 0.00 0.00 175.22 174.18 3dwv n GLY 80 N 3.85 0.19 1.80 13.12 0.00 -1.26 -4.69 105.19 118.20 3dwv n GLY 80 Ca -0.08 -1.78 -0.09 0.00 0.00 0.00 0.00 46.02 44.07 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 0.35 4.17 0.51 -0.02 0.00 -1.26 -4.29 105.19 104.64 3dwv n GLY 81 Ca 0.00 -1.07 0.05 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.65 2.47 -1.61 1.61 0.00 -1.26 -4.94 117.38 113.00 3dwv n GLN 82 Ca 0.43 -1.81 -0.30 0.00 0.00 0.00 0.00 57.00 55.32 3dwv n GLN 82 Cb 1.36 -1.22 0.08 0.00 0.00 0.00 0.00 30.24 30.46 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 -0.96 2.25 0.85 2.61 0.41 -1.26 -4.68 118.70 117.92 3dwv s GLU 83 Ca 0.18 0.62 -0.12 0.00 -0.41 0.00 0.00 54.97 55.24 3dwv s GLU 83 Cb 0.10 -1.94 0.10 0.00 -1.78 0.00 0.00 34.13 30.61 3dwv s GLU 83 CO 0.13 -1.50 1.16 -2.30 -0.49 0.00 0.00 175.26 172.26 3dwv n PRO 84 N -3.35 -0.03 -0.22 0.39 -0.02 -1.26 -4.81 135.00 125.71 3dwv n PRO 84 Ca 0.07 0.07 0.03 0.00 -2.02 0.00 0.00 63.50 61.65 3dwv n PRO 84 Cb 0.56 -2.40 -0.01 0.00 -0.02 0.00 0.00 33.50 31.64 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 0.50 -1.42 3.63 -1.23 0.00 0.03 -4.70 105.19 102.00 3dwv n GLY 85 Ca 0.13 -1.48 -0.43 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 -2.99 6.83 0.58 1.61 3.84 -1.26 -4.93 114.94 118.63 3dwv s ASN 86 Ca 0.00 0.87 0.36 0.00 0.21 0.00 0.00 52.86 54.30 3dwv s ASN 86 Cb 0.00 -2.53 1.73 0.00 -0.55 0.00 0.00 41.25 39.90 3dwv s ASN 86 CO 0.00 -0.94 2.13 1.05 -2.79 0.00 0.00 177.10 176.55 3dwv h GLU 87 N 8.35 0.00 0.00 0.43 4.11 -1.89 -1.82 114.58 123.76 3dwv h GLU 87 Ca -0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.22 3dwv h GLU 87 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 3dwv h GLU 87 CO 1.04 0.03 -0.06 0.39 0.07 0.00 0.00 179.01 180.47 3dwv n GLU 88 N -3.19 0.18 0.22 1.06 1.02 -1.26 -4.12 120.64 114.55 3dwv n GLU 88 Ca -0.01 0.13 -0.15 0.00 -0.02 0.00 0.00 57.16 57.11 3dwv n GLU 88 Cb 0.22 -1.69 -0.08 0.00 -0.02 0.00 0.00 31.44 29.87 3dwv n GLU 88 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 3dwv h GLU 89 N 0.00 -0.51 0.00 3.49 4.81 -1.73 -0.31 114.58 120.33 3dwv h GLU 89 Ca 0.00 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3dwv h GLU 89 Cb 0.66 0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.15 3dwv h GLU 89 CO 0.00 -0.29 0.00 -0.84 -0.73 0.00 0.00 179.01 177.15 3dwv h ILE 90 N -0.61 0.00 0.00 2.32 3.07 -1.78 -0.94 117.51 119.56 3dwv h ILE 90 Ca -0.05 -0.28 -0.01 0.00 1.55 0.00 0.00 64.86 66.06 3dwv h ILE 90 Cb 0.45 1.16 0.00 0.00 -0.27 0.00 0.00 36.82 38.16 3dwv h ILE 90 CO 0.09 0.00 -0.03 0.50 -1.05 0.00 0.00 178.15 177.66 3dwv h LYS 91 N 0.00 0.02 0.00 0.16 3.11 -1.66 -3.38 116.57 114.82 3dwv h LYS 91 Ca 0.00 -0.02 -0.15 0.00 -2.81 0.00 0.00 60.65 57.67 3dwv h LYS 91 Cb 0.32 0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.53 3dwv h LYS 91 CO 0.00 0.83 -1.05 1.49 -2.81 0.00 0.00 179.45 177.91 3dwv h GLU 92 N -0.78 0.00 -5.70 1.90 4.81 -0.87 -3.47 114.58 110.46 3dwv h GLU 92 Ca -0.00 0.00 -0.49 0.00 -0.13 0.00 0.00 59.36 58.73 3dwv h GLU 92 Cb 0.84 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 30.08 3dwv h GLU 92 CO 0.01 0.41 -0.73 -0.06 -0.73 0.00 0.00 179.01 177.90 3dwv s PHE 93 N -2.93 1.87 -0.12 0.92 0.08 -0.37 -5.09 117.98 112.34 3dwv s PHE 93 Ca -0.00 -0.53 -0.29 0.00 0.12 0.00 0.00 56.93 56.22 3dwv s PHE 93 Cb 0.08 -0.88 -0.01 0.00 -0.57 0.00 0.00 43.02 41.65 3dwv s PHE 93 CO 0.79 0.43 1.02 0.08 -0.10 0.00 0.00 175.22 177.44 3dwv s VAL 94 N -2.87 4.74 0.05 -0.44 1.01 -1.26 -4.55 120.40 117.08 3dwv s VAL 94 Ca 0.25 2.02 0.06 0.00 0.00 0.00 0.00 61.98 64.31 3dwv s VAL 94 Cb -0.01 -4.30 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 3dwv s VAL 94 CO 0.09 -0.02 -0.18 0.00 0.00 0.00 0.00 175.10 174.99 3dwv s THR 96 N -0.92 1.42 0.33 0.00 -4.23 0.01 -4.83 115.64 107.43 3dwv s THR 96 Ca 0.04 -1.89 -0.28 0.00 -1.18 0.00 0.00 61.69 58.38 3dwv s THR 96 Cb -0.09 -2.31 -0.10 0.00 1.34 0.00 0.00 72.50 71.34 3dwv s THR 96 CO 0.02 0.00 1.26 -0.75 -0.54 0.00 0.00 174.62 174.61 3dwv s LYS 97 N -3.93 4.36 0.09 3.99 2.20 -1.26 -0.02 119.74 125.17 3dwv s LYS 97 Ca 0.16 2.12 -0.30 0.00 -0.36 0.00 0.00 55.97 57.58 3dwv s LYS 97 Cb 0.02 -3.04 -0.06 0.00 -1.51 0.00 0.00 37.83 33.24 3dwv s LYS 97 CO 0.09 -0.15 1.20 0.12 -0.36 0.00 0.00 175.35 176.26 3dwv s PHE 98 N -1.17 3.43 0.03 4.03 5.36 -1.26 -4.64 117.98 123.76 3dwv s PHE 98 Ca 0.49 1.32 0.03 0.00 -0.96 0.00 0.00 56.93 57.81 3dwv s PHE 98 Cb -0.38 -3.43 -0.02 0.00 -0.34 0.00 0.00 43.02 38.86 3dwv s PHE 98 CO 0.50 -1.30 -0.10 0.15 -1.46 0.00 0.00 175.22 173.01 3dwv s LYS 99 N 0.77 0.71 0.28 10.12 1.02 -1.26 -5.05 119.74 126.33 3dwv s LYS 99 Ca 0.58 -0.60 -0.19 0.00 0.02 0.00 0.00 55.97 55.77 3dwv s LYS 99 Cb -0.30 -0.65 0.02 0.00 -0.52 0.00 0.00 37.83 36.37 3dwv s LYS 99 CO 0.31 0.16 0.68 0.00 -0.92 0.00 0.00 175.35 175.58 3dwv s ALA 100 N -0.78 -1.01 -0.29 5.17 0.00 -1.26 -5.03 121.76 118.56 3dwv s ALA 100 Ca -0.01 -0.44 0.20 0.00 0.00 0.00 0.00 51.96 51.71 3dwv s ALA 100 Cb -0.07 0.88 0.14 0.00 0.00 0.00 0.00 23.12 24.08 3dwv s ALA 100 CO 0.01 -1.00 1.37 1.49 0.00 0.00 0.00 175.76 177.62 3dwv h GLU 101 N 2.04 0.00 -6.29 0.00 4.81 -2.00 -3.46 114.58 109.67 3dwv h GLU 101 Ca -0.21 0.00 -0.45 0.00 -0.13 0.00 0.00 59.36 58.57 3dwv h GLU 101 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 3dwv h GLU 101 CO 0.26 0.17 -0.36 -0.59 -0.73 0.00 0.00 179.01 177.77 3dwv s PHE 102 N -3.14 3.22 0.35 0.92 -0.12 -1.26 -5.05 117.98 112.90 3dwv s PHE 102 Ca 0.04 -0.14 -0.28 0.00 -0.05 0.00 0.00 56.93 56.49 3dwv s PHE 102 Cb 0.07 -1.88 -0.11 0.00 -0.63 0.00 0.00 43.02 40.47 3dwv s PHE 102 CO 0.73 0.11 1.44 -2.14 -0.05 0.00 0.00 175.22 175.32 3dwv s PRO 103 N -4.13 4.18 -0.15 1.99 0.02 -1.24 -4.88 135.00 130.80 3dwv s PRO 103 Ca 0.42 2.47 0.01 0.00 0.02 0.00 0.00 61.00 63.91 3dwv s PRO 103 Cb -0.09 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.42 3dwv s PRO 103 CO 0.31 -0.44 -0.17 0.42 -0.33 0.00 0.00 177.00 176.78 3dwv s ILE 104 N -0.99 2.46 0.69 2.83 1.01 -1.26 -1.35 121.20 124.59 3dwv s ILE 104 Ca 0.53 -0.84 0.00 0.00 0.00 0.00 0.00 60.65 60.34 3dwv s ILE 104 Cb -0.45 -2.02 0.11 0.00 0.01 0.00 0.00 42.46 40.11 3dwv s ILE 104 CO 0.58 0.52 0.95 -0.04 0.00 0.00 0.00 174.94 176.96 3dwv s MET 105 N 0.86 1.84 0.67 2.79 -1.94 0.13 -3.01 119.30 120.63 3dwv s MET 105 Ca -0.05 -1.10 -0.17 0.00 -1.71 0.00 0.00 55.69 52.66 3dwv s MET 105 Cb -0.15 -2.37 -0.00 0.00 2.01 0.00 0.00 34.83 34.31 3dwv s MET 105 CO -0.01 -1.31 1.21 0.00 -0.01 0.00 0.00 175.02 174.89 3dwv n ALA 106 N -2.73 0.75 -1.56 3.03 0.00 -0.25 -4.32 120.51 115.43 3dwv n ALA 106 Ca 0.14 -0.06 -0.34 0.00 0.00 0.00 0.00 53.44 53.18 3dwv n ALA 106 Cb 0.61 -2.27 0.05 0.00 0.00 0.00 0.00 19.45 17.84 3dwv n ALA 106 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3dwv s LYS 107 N -3.37 2.76 0.12 0.00 1.02 -1.26 -4.35 119.74 114.67 3dwv s LYS 107 Ca 0.80 1.60 -0.07 0.00 0.02 0.00 0.00 55.97 58.32 3dwv s LYS 107 Cb -0.37 -1.93 -0.01 0.00 -0.52 0.00 0.00 37.83 35.00 3dwv s LYS 107 CO 0.43 -1.32 0.19 0.96 -0.92 0.00 0.00 175.35 174.70 3dwv s ILE 108 N -2.02 0.11 0.14 2.17 -4.36 -0.19 -4.82 121.20 112.23 3dwv s ILE 108 Ca 0.72 -1.42 -0.30 0.00 -0.26 0.00 0.00 60.65 59.38 3dwv s ILE 108 Cb -0.25 -1.67 -0.06 0.00 1.25 0.00 0.00 42.46 41.72 3dwv s ILE 108 CO 0.38 -0.50 0.97 0.20 0.24 0.00 0.00 174.94 176.23 3dwv s ASN 109 N -2.94 7.51 -0.13 4.36 -0.87 -1.26 -0.62 114.94 120.98 3dwv s ASN 109 Ca 0.13 1.85 0.05 0.00 -1.57 0.00 0.00 52.86 53.32 3dwv s ASN 109 Cb 0.05 -2.59 -0.23 0.00 -0.02 0.00 0.00 41.25 38.45 3dwv s ASN 109 CO -0.04 -0.04 0.32 0.52 -2.57 0.00 0.00 177.10 175.28 3dwv n VAL 110 N 2.53 1.62 -4.49 1.60 0.31 -1.26 -1.15 118.33 117.48 3dwv n VAL 110 Ca 0.02 -0.72 -0.23 0.00 -0.01 0.00 0.00 64.34 63.39 3dwv n VAL 110 Cb 0.49 -1.25 -0.10 0.00 -0.91 0.00 0.00 33.84 32.07 3dwv n VAL 110 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3dwv s ASN 111 N -6.39 2.63 0.09 4.52 0.01 -1.26 -4.67 114.94 109.87 3dwv s ASN 111 Ca -0.17 -1.45 0.00 0.00 -0.71 0.00 0.00 52.86 50.53 3dwv s ASN 111 Cb 0.07 0.05 0.00 0.00 0.41 0.00 0.00 41.25 41.78 3dwv s ASN 111 CO 0.77 -0.68 0.00 0.61 -1.51 0.00 0.00 177.10 176.29 3dwv n GLY 112 N -0.78 -1.71 0.24 0.66 0.00 -1.26 -3.57 105.19 98.77 3dwv n GLY 112 Ca -0.04 -1.34 0.09 0.00 0.00 0.00 0.00 46.02 44.73 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 -0.66 1.61 5.08 -1.99 -2.43 114.58 116.19 3dwv h GLU 113 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3dwv h GLU 113 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3dwv h GLU 113 CO 0.00 0.20 0.00 -1.71 -1.00 0.00 0.00 179.01 176.50 3dwv n ASN 114 N -3.77 4.22 -4.70 1.42 5.15 -1.26 -5.00 115.26 111.30 3dwv n ASN 114 Ca -0.02 -2.21 -0.43 0.00 -0.60 0.00 0.00 54.58 51.33 3dwv n ASN 114 Cb 0.30 -0.51 -0.01 0.00 -0.53 0.00 0.00 39.78 39.04 3dwv n ASN 114 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3dwv n ALA 115 N 1.29 1.39 -1.80 5.20 0.00 -0.92 -4.52 120.51 121.16 3dwv n ALA 115 Ca 0.24 0.36 -0.41 0.00 0.00 0.00 0.00 53.44 53.63 3dwv n ALA 115 Cb 0.72 -2.27 -0.01 0.00 0.00 0.00 0.00 19.45 17.89 3dwv n ALA 115 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3dwv s HIS 116 N -1.02 2.83 0.51 0.00 2.46 -0.30 -4.74 115.29 115.03 3dwv s HIS 116 Ca 0.56 1.12 0.26 0.00 0.47 0.00 0.00 55.06 57.47 3dwv s HIS 116 Cb -0.57 -3.90 1.36 0.00 -0.13 0.00 0.00 32.58 29.34 3dwv s HIS 116 CO 0.61 -2.76 1.94 -1.35 -2.47 0.00 0.00 174.74 170.71 3dwv h PRO 117 N 3.90 0.08 -0.46 2.88 0.11 -1.92 0.63 132.00 137.21 3dwv h PRO 117 Ca -0.49 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.64 3dwv h PRO 117 Cb 1.23 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 3dwv h PRO 117 CO 0.70 0.05 0.28 1.25 -0.21 0.00 0.00 178.00 180.07 3dwv h LEU 118 N 0.08 0.45 -0.59 2.35 5.85 -1.91 0.37 115.31 121.91 3dwv h LEU 118 Ca 0.34 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.92 3dwv h LEU 118 Cb 1.25 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 3dwv h LEU 118 CO -0.03 0.32 -0.48 1.88 -0.34 0.00 0.00 178.44 179.79 3dwv h TYR 119 N 0.56 0.69 -0.60 1.25 -1.99 -1.29 -0.11 116.97 115.48 3dwv h TYR 119 Ca 0.18 -0.22 0.09 0.00 2.00 0.00 0.00 58.73 60.78 3dwv h TYR 119 Cb 0.00 -0.14 -0.07 0.00 2.00 0.00 0.00 36.73 38.53 3dwv h TYR 119 CO -0.07 0.93 0.24 0.93 -0.00 0.00 0.00 178.16 180.20 3dwv h GLU 120 N 0.45 0.42 -0.06 4.88 5.08 -0.74 0.27 114.58 124.89 3dwv h GLU 120 Ca 0.02 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3dwv h GLU 120 Cb 1.00 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.15 3dwv h GLU 120 CO 0.09 0.28 0.02 -0.92 -1.00 0.00 0.00 179.01 177.48 3dwv h TYR 121 N 0.43 0.09 -0.66 4.33 3.20 -0.69 -0.70 116.97 122.99 3dwv h TYR 121 Ca 0.30 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 62.07 3dwv h TYR 121 Cb 0.34 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.56 3dwv h TYR 121 CO -0.15 0.27 0.08 0.52 -1.64 0.00 0.00 178.16 177.23 3dwv h MET 122 N -0.11 1.10 -0.46 1.82 2.86 -0.75 -1.27 114.93 118.13 3dwv h MET 122 Ca 0.02 -0.31 -0.11 0.00 -2.06 0.00 0.00 59.70 57.23 3dwv h MET 122 Cb 0.22 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 3dwv h MET 122 CO -0.00 1.03 -0.17 0.87 1.06 0.00 0.00 176.91 179.70 3dwv h LYS 123 N 1.03 0.89 -0.06 1.72 1.57 -0.93 -0.50 116.57 120.28 3dwv h LYS 123 Ca 0.20 -0.34 -0.18 0.00 -1.87 0.00 0.00 60.65 58.46 3dwv h LYS 123 Cb 0.48 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 3dwv h LYS 123 CO 0.02 0.99 -0.72 -0.22 -0.57 0.00 0.00 179.45 178.94 3dwv h LYS 124 N 0.79 0.31 -0.16 3.15 3.64 -0.92 -2.63 116.57 120.75 3dwv h LYS 124 Ca 0.12 -0.26 -0.18 0.00 -1.27 0.00 0.00 60.65 59.06 3dwv h LYS 124 Cb 0.70 0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.58 3dwv h LYS 124 CO 0.05 0.91 -0.63 1.15 -2.27 0.00 0.00 179.45 178.66 3dwv h THR 125 N 0.21 1.33 -2.81 1.00 2.02 -0.90 -3.38 112.91 110.37 3dwv h THR 125 Ca -0.03 -1.92 -0.61 0.00 0.77 0.00 0.00 66.41 64.63 3dwv h THR 125 Cb 1.29 1.89 -0.40 0.00 -1.74 0.00 0.00 68.15 69.19 3dwv h THR 125 CO 0.12 0.59 -0.75 -0.54 0.37 0.00 0.00 175.52 175.31 3dwv s LYS 126 N -3.86 1.68 0.00 6.66 -0.14 -0.23 -4.98 119.74 118.87 3dwv s LYS 126 Ca -0.08 -2.64 0.28 0.00 -1.36 0.00 0.00 55.97 52.17 3dwv s LYS 126 Cb 0.11 -2.50 1.33 0.00 -1.68 0.00 0.00 37.83 35.08 3dwv s LYS 126 CO 0.85 -1.30 1.93 -0.35 -0.76 0.00 0.00 175.35 175.73 3dwv n PRO 127 N 2.60 0.27 -0.27 -1.68 -0.04 -0.99 -4.55 135.00 130.33 3dwv n PRO 127 Ca 0.21 0.03 0.04 0.00 -0.04 0.00 0.00 63.50 63.73 3dwv n PRO 127 Cb 0.39 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.34 3dwv n PRO 127 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dwv n GLY 128 N 1.16 -1.51 0.00 0.55 0.00 -1.26 -4.13 105.19 100.00 3dwv n GLY 128 Ca 0.11 -1.46 0.07 0.00 0.00 0.00 0.00 46.02 44.74 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 -1.83 0.00 -3.32 -0.61 -5.35 -1.26 -4.94 119.36 102.05 3dwv n ILE 129 Ca 0.00 -0.27 -0.39 0.00 -0.27 0.00 0.00 62.75 61.82 3dwv n ILE 129 Cb 0.12 0.49 -0.08 0.00 -1.74 0.00 0.00 39.64 38.44 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 -3.46 4.08 0.00 7.28 2.96 -1.26 -4.97 118.68 123.32 3dwv s LEU 130 Ca -0.01 0.47 0.00 0.00 -0.22 0.00 0.00 54.13 54.37 3dwv s LEU 130 Cb 0.09 -2.56 0.00 0.00 0.50 0.00 0.00 46.19 44.22 3dwv s LEU 130 CO 0.56 -0.19 0.00 0.00 -1.32 0.00 0.00 176.35 175.40 3dwv n ALA 131 N 5.12 0.00 -2.51 5.97 0.00 -1.26 -4.74 120.51 123.09 3dwv n ALA 131 Ca -0.06 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.19 3dwv n ALA 131 Cb 0.50 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.05 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 0.87 0.00 -2.24 -1.26 -4.98 114.28 106.68 3dwv n THR 132 Ca 0.00 -1.26 0.11 0.00 -2.27 0.00 0.00 64.05 60.63 3dwv n THR 132 Cb 0.00 -1.01 0.52 0.00 -2.10 0.00 0.00 70.33 67.74 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 -2.54 0.08 -1.49 -0.78 2.85 -1.26 -4.86 118.16 110.17 3dwv n LYS 133 Ca 0.13 0.09 -0.37 0.00 -1.05 0.00 0.00 58.31 57.12 3dwv n LYS 133 Cb 0.48 -1.50 0.06 0.00 -0.65 0.00 0.00 35.03 33.42 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 -1.45 -0.26 -2.65 0.58 0.00 -1.26 -4.87 120.51 110.60 3dwv n ALA 134 Ca 0.07 -0.09 -0.43 0.00 0.00 0.00 0.00 53.44 52.99 3dwv n ALA 134 Cb 0.25 -2.06 -0.02 0.00 0.00 0.00 0.00 19.45 17.62 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 4.67 -0.01 0.00 -1.09 -1.26 -4.92 121.20 116.93 3dwv s ILE 135 Ca 0.74 1.89 0.09 0.00 -2.23 0.00 0.00 60.65 61.15 3dwv s ILE 135 Cb -0.39 -4.30 -0.23 0.00 -1.58 0.00 0.00 42.46 35.96 3dwv s ILE 135 CO 0.49 -0.22 0.79 0.11 -1.23 0.00 0.00 174.94 174.88 3dwv h LYS 136 N 7.61 0.03 -5.44 2.79 1.57 -1.94 -3.36 116.57 117.83 3dwv h LYS 136 Ca -0.20 -0.05 -0.48 0.00 -1.87 0.00 0.00 60.65 58.05 3dwv h LYS 136 Cb 1.07 0.02 -0.26 0.00 0.08 0.00 0.00 32.23 33.13 3dwv h LYS 136 CO 0.97 0.68 -0.81 -1.58 -0.57 0.00 0.00 179.45 178.14 3dwv s TRP 137 N -2.62 1.34 0.77 -1.35 0.51 -1.26 -0.79 118.94 115.54 3dwv s TRP 137 Ca -0.05 -0.33 -0.15 0.00 -2.12 0.00 0.00 56.10 53.46 3dwv s TRP 137 Cb 0.08 -0.81 0.05 0.00 -0.81 0.00 0.00 33.47 31.99 3dwv s TRP 137 CO 0.82 0.03 1.19 0.09 -0.51 0.00 0.00 176.95 178.57 3dwv n ASN 138 N 2.12 1.15 -1.45 2.95 5.03 -1.26 -2.72 115.26 121.08 3dwv n ASN 138 Ca -0.17 0.64 -0.18 0.00 0.87 0.00 0.00 54.58 55.74 3dwv n ASN 138 Cb 0.55 -1.50 -0.07 0.00 -1.02 0.00 0.00 39.78 37.73 3dwv n ASN 138 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 3dwv n PHE 139 N -2.93 -0.08 -1.93 3.10 3.01 0.22 -4.62 117.46 114.23 3dwv n PHE 139 Ca 0.14 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.21 3dwv n PHE 139 Cb 0.50 -3.12 0.02 0.00 -0.01 0.00 0.00 39.48 36.86 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 -2.69 2.38 0.06 4.37 2.01 -1.10 -3.60 115.64 117.07 3dwv s THR 140 Ca 0.00 0.31 0.03 0.00 0.31 0.00 0.00 61.69 62.33 3dwv s THR 140 Cb 0.00 -3.17 -0.03 0.00 0.01 0.00 0.00 72.50 69.32 3dwv s THR 140 CO 0.00 0.02 -0.08 -0.94 -0.69 0.00 0.00 174.62 172.92 3dwv s SER 141 N -0.90 1.03 -0.15 3.53 1.04 -0.64 -2.08 113.70 115.53 3dwv s SER 141 Ca 0.65 -0.64 -0.01 0.00 0.48 0.00 0.00 55.95 56.42 3dwv s SER 141 Cb -0.38 0.03 -0.02 0.00 0.10 0.00 0.00 66.02 65.75 3dwv s SER 141 CO 0.47 -0.23 -0.10 -0.36 0.98 0.00 0.00 173.24 174.00 3dwv s PHE 142 N -1.78 2.88 -0.12 5.02 0.40 -0.36 0.11 117.98 124.13 3dwv s PHE 142 Ca -0.05 -0.63 -0.24 0.00 -0.60 0.00 0.00 56.93 55.40 3dwv s PHE 142 Cb -0.07 -1.91 -0.03 0.00 0.51 0.00 0.00 43.02 41.53 3dwv s PHE 142 CO -0.00 -0.24 0.76 -1.17 0.70 0.00 0.00 175.22 175.27 3dwv s LEU 143 N 0.53 4.25 -0.10 -0.37 2.96 0.80 -1.26 118.68 125.48 3dwv s LEU 143 Ca -0.07 1.18 0.00 0.00 -0.22 0.00 0.00 54.13 55.02 3dwv s LEU 143 Cb -0.15 -3.15 -0.02 0.00 0.50 0.00 0.00 46.19 43.36 3dwv s LEU 143 CO 0.03 -0.25 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.09 3dwv s ILE 144 N 1.45 3.40 0.00 6.68 -1.09 0.81 -0.47 121.20 131.98 3dwv s ILE 144 Ca 0.38 -0.56 0.00 0.00 -2.23 0.00 0.00 60.65 58.24 3dwv s ILE 144 Cb -0.17 -2.41 0.00 0.00 -1.58 0.00 0.00 42.46 38.29 3dwv s ILE 144 CO 0.16 0.55 0.00 -0.90 -1.23 0.00 0.00 174.94 173.52 3dwv n ASP 145 N 2.94 0.00 0.25 3.58 5.68 -0.19 -1.65 116.55 127.16 3dwv n ASP 145 Ca -0.18 -0.91 0.16 0.00 -0.50 0.00 0.00 54.79 53.36 3dwv n ASP 145 Cb 0.53 0.00 0.59 0.00 -1.14 0.00 0.00 41.12 41.10 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 -0.02 0.11 3.08 -1.89 -1.86 114.38 113.81 3dwv h ARG 146 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dwv h ARG 146 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3dwv h ARG 146 CO 0.00 0.00 -0.37 -0.25 -1.07 0.00 0.00 179.97 178.28 3dwv n ASP 147 N -2.99 2.25 0.00 7.04 8.00 -1.26 -0.91 116.55 128.69 3dwv n ASP 147 Ca 0.01 -1.63 0.00 0.00 0.71 0.00 0.00 54.79 53.89 3dwv n ASP 147 Cb 0.33 0.37 0.00 0.00 -0.02 0.00 0.00 41.12 41.80 3dwv n ASP 147 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dwv n GLY 148 N 1.40 0.73 3.71 0.44 0.00 -0.70 -4.75 105.19 106.03 3dwv n GLY 148 Ca 0.10 -0.22 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 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 5.08 0.11 1.61 1.01 -1.26 -0.82 120.40 124.14 3dwv s VAL 149 Ca 0.00 1.27 -0.31 0.00 0.00 0.00 0.00 61.98 62.93 3dwv s VAL 149 Cb 0.00 -3.96 -0.09 0.00 0.00 0.00 0.00 36.38 32.33 3dwv s VAL 149 CO 0.00 0.25 1.57 -2.84 0.00 0.00 0.00 175.10 174.08 3dwv s PRO 150 N 0.94 4.22 -0.00 2.72 0.02 -1.26 -1.02 135.00 140.62 3dwv s PRO 150 Ca 0.33 2.30 0.01 0.00 0.02 0.00 0.00 61.00 63.65 3dwv s PRO 150 Cb -0.17 -3.35 -0.01 0.00 0.02 0.00 0.00 34.50 30.99 3dwv s PRO 150 CO 0.14 -0.63 0.03 1.33 -0.33 0.00 0.00 177.00 177.54 3dwv n VAL 151 N 4.29 0.00 -3.61 3.83 0.24 0.38 -4.86 118.33 118.59 3dwv n VAL 151 Ca 0.14 -0.27 -0.16 0.00 -2.04 0.00 0.00 64.34 62.02 3dwv n VAL 151 Cb 0.40 0.76 -0.07 0.00 -1.47 0.00 0.00 33.84 33.46 3dwv n VAL 151 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3dwv s GLU 152 N -1.53 0.93 -0.14 7.34 2.56 -1.15 -4.98 118.70 121.73 3dwv s GLU 152 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.97 54.97 3dwv s GLU 152 Cb 0.01 0.43 -0.01 0.00 2.00 0.00 0.00 34.13 36.55 3dwv s GLU 152 CO 0.04 -0.29 -0.14 0.50 -0.56 0.00 0.00 175.26 174.80 3dwv s ARG 153 N -1.52 3.34 -0.05 4.30 3.52 -1.26 -0.14 118.95 127.13 3dwv s ARG 153 Ca -0.10 -0.71 0.06 0.00 -0.13 0.00 0.00 55.73 54.85 3dwv s ARG 153 Cb -0.02 -2.62 -0.02 0.00 -1.56 0.00 0.00 34.95 30.74 3dwv s ARG 153 CO 0.06 0.17 -0.24 -0.06 -0.81 0.00 0.00 175.30 174.41 3dwv s PHE 154 N 0.46 2.45 0.86 5.12 0.08 0.12 -4.98 117.98 122.09 3dwv s PHE 154 Ca -0.10 -0.58 -0.12 0.00 0.12 0.00 0.00 56.93 56.26 3dwv s PHE 154 Cb -0.16 -1.58 0.11 0.00 -0.57 0.00 0.00 43.02 40.82 3dwv s PHE 154 CO 0.05 -0.12 1.10 -1.54 -0.10 0.00 0.00 175.22 174.60 3dwv s SER 155 N -0.34 3.85 0.55 1.36 1.04 -1.26 -1.62 113.70 117.28 3dwv s SER 155 Ca 0.02 1.39 0.30 0.00 0.48 0.00 0.00 55.95 58.13 3dwv s SER 155 Cb -0.12 -2.09 1.63 0.00 0.10 0.00 0.00 66.02 65.54 3dwv s SER 155 CO 0.02 -2.39 2.15 1.55 0.98 0.00 0.00 173.24 175.55 3dwv h PRO 156 N -1.38 0.00 -0.00 4.02 0.13 -1.82 -1.88 132.00 131.08 3dwv h PRO 156 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3dwv h PRO 156 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 3dwv h PRO 156 CO 0.57 0.07 -0.07 0.41 -0.23 0.00 0.00 178.00 178.75 3dwv n GLY 157 N -0.88 -1.17 3.74 1.56 0.00 -1.25 -3.11 105.19 104.08 3dwv n GLY 157 Ca -0.02 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 3dwv n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dwv n ALA 158 N -1.19 1.76 -1.99 4.61 0.00 -0.71 -4.97 120.51 118.02 3dwv n ALA 158 Ca 0.13 0.24 -0.21 0.00 0.00 0.00 0.00 53.44 53.60 3dwv n ALA 158 Cb 0.27 -2.35 0.05 0.00 0.00 0.00 0.00 19.45 17.41 3dwv n ALA 158 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3dwv s SER 159 N -0.54 5.16 0.18 0.00 1.04 -1.26 -4.91 113.70 113.36 3dwv s SER 159 Ca 0.62 -0.21 -0.14 0.00 0.48 0.00 0.00 55.95 56.71 3dwv s SER 159 Cb -0.46 -0.59 0.08 0.00 0.10 0.00 0.00 66.02 65.14 3dwv s SER 159 CO 0.57 -1.23 1.84 0.58 0.98 0.00 0.00 173.24 175.98 3dwv h VAL 160 N 0.06 1.15 -0.65 5.02 2.07 -1.93 -1.27 116.25 120.70 3dwv h VAL 160 Ca -0.40 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 66.79 3dwv h VAL 160 Cb 1.29 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 3dwv h VAL 160 CO 0.48 0.15 0.23 0.11 0.02 0.00 0.00 177.57 178.56 3dwv h LYS 161 N 0.76 0.98 -0.44 1.57 1.79 -1.98 0.49 116.57 119.74 3dwv h LYS 161 Ca 0.20 -0.19 0.09 0.00 -2.18 0.00 0.00 60.65 58.57 3dwv h LYS 161 Cb -0.07 -0.15 -0.09 0.00 -1.58 0.00 0.00 32.23 30.34 3dwv h LYS 161 CO -0.04 0.84 -0.17 -0.44 -1.08 0.00 0.00 179.45 178.56 3dwv h ASP 162 N 0.92 -0.59 0.51 0.86 3.32 -1.77 -2.10 116.42 117.57 3dwv h ASP 162 Ca 0.21 0.15 -0.18 0.00 0.02 0.00 0.00 57.03 57.24 3dwv h ASP 162 Cb 0.25 0.34 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 3dwv h ASP 162 CO -0.01 -0.20 -0.77 0.40 -1.72 0.00 0.00 179.24 176.93 3dwv h ILE 163 N -0.07 1.46 0.00 0.35 2.04 -1.06 -3.15 117.51 117.07 3dwv h ILE 163 Ca 0.21 -2.38 -0.03 0.00 1.00 0.00 0.00 64.86 63.66 3dwv h ILE 163 Cb 0.40 2.29 -0.00 0.00 -0.74 0.00 0.00 36.82 38.77 3dwv h ILE 163 CO -0.49 0.70 -0.16 -0.33 0.00 0.00 0.00 178.15 177.86 3dwv h GLU 164 N 0.13 0.00 0.00 2.37 5.08 -0.33 0.35 114.58 122.17 3dwv h GLU 164 Ca -0.03 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3dwv h GLU 164 Cb 1.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.60 3dwv h GLU 164 CO 0.12 0.16 -0.01 1.49 -1.00 0.00 0.00 179.01 179.77 3dwv h GLU 165 N 0.00 0.00 0.00 2.33 4.81 -1.35 -1.04 114.58 119.33 3dwv h GLU 165 Ca -0.00 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.91 3dwv h GLU 165 Cb 0.33 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.65 3dwv h GLU 165 CO 0.02 0.01 -2.27 1.63 -0.73 0.00 0.00 179.01 177.68 3dwv n LYS 166 N -4.18 0.89 0.02 1.92 4.76 -0.87 -4.62 118.16 116.09 3dwv n LYS 166 Ca -0.03 -0.02 -0.18 0.00 -2.87 0.00 0.00 58.31 55.20 3dwv n LYS 166 Cb 0.10 -1.48 -0.11 0.00 -1.84 0.00 0.00 35.03 31.69 3dwv n LYS 166 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3dwv h LEU 167 N 0.00 0.62 -0.82 -0.35 5.85 -0.47 -3.35 115.31 116.78 3dwv h LEU 167 Ca -0.47 -0.77 0.02 0.00 0.84 0.00 0.00 57.88 57.50 3dwv h LEU 167 Cb 2.06 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.86 3dwv h LEU 167 CO 0.03 1.31 0.54 0.40 -0.34 0.00 0.00 178.44 180.37 3dwv h ILE 168 N 0.00 1.18 0.00 4.05 2.04 -1.45 0.15 117.51 123.48 3dwv h ILE 168 Ca -0.09 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.40 3dwv h ILE 168 Cb 1.43 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.52 3dwv h ILE 168 CO 0.14 0.20 0.00 -0.81 0.00 0.00 0.00 178.15 177.68 3dwv n PRO 169 N -4.54 0.01 0.03 2.37 -0.04 -1.26 -1.75 135.00 129.82 3dwv n PRO 169 Ca 0.09 0.33 0.12 0.00 -0.04 0.00 0.00 63.50 64.00 3dwv n PRO 169 Cb 0.04 -1.51 0.13 0.00 -0.04 0.00 0.00 33.50 32.12 3dwv n PRO 169 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3dwv n LEU 170 N -1.53 0.63 -0.10 1.53 4.77 0.49 -5.17 117.00 117.62 3dwv n LEU 170 Ca 0.02 0.05 0.16 0.00 -0.03 0.00 0.00 56.01 56.21 3dwv n LEU 170 Cb 0.12 -0.16 0.86 0.00 -2.33 0.00 0.00 43.42 41.91 3dwv n LEU 170 CO 0.10 0.04 1.06 0.18 -1.33 0.00 0.00 177.39 177.43