#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4y n SER 2 N 0.00 1.50 -4.88 1.61 2.88 -1.26 -4.90 113.62 108.57 1x4y n SER 2 Ca 0.00 0.17 -0.30 0.00 -1.33 0.00 0.00 58.87 57.41 1x4y n SER 2 Cb 0.00 -1.20 0.02 0.00 -0.75 0.00 0.00 64.21 62.28 1x4y n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1x4y s SER 3 N 8.74 6.02 0.00 -3.46 0.01 -1.26 -4.97 113.70 118.78 1x4y s SER 3 Ca 1.16 1.22 0.00 0.00 1.31 0.00 0.00 55.95 59.63 1x4y s SER 3 Cb -0.89 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 63.09 1x4y s SER 3 CO 0.46 -0.93 0.00 0.61 0.41 0.00 0.00 173.24 173.78 1x4y n GLY 4 N -2.71 -0.50 3.12 3.44 0.00 -1.26 -5.14 105.19 102.14 1x4y n GLY 4 Ca 0.05 0.10 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 1x4y n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4y s SER 5 N -4.00 -0.21 -1.01 1.61 1.04 -1.26 -5.09 113.70 104.77 1x4y s SER 5 Ca 0.00 0.37 -0.22 0.00 0.48 0.00 0.00 55.95 56.58 1x4y s SER 5 Cb 0.00 0.44 0.07 0.00 0.10 0.00 0.00 66.02 66.62 1x4y s SER 5 CO 0.00 -0.14 1.40 -0.44 0.98 0.00 0.00 173.24 175.04 1x4y s SER 6 N -0.14 6.53 0.10 7.02 0.01 -1.26 -4.93 113.70 121.03 1x4y s SER 6 Ca -0.02 -1.58 0.00 0.00 1.31 0.00 0.00 55.95 55.65 1x4y s SER 6 Cb -0.03 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.67 1x4y s SER 6 CO 0.01 -1.42 0.00 0.61 0.41 0.00 0.00 173.24 172.85 1x4y n GLY 7 N 6.60 2.40 3.75 3.44 0.00 -1.26 -4.42 105.19 115.69 1x4y n GLY 7 Ca 0.32 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.89 1x4y n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4y s PRO 8 N 0.00 4.41 0.00 1.61 0.04 -1.26 -4.93 135.00 134.87 1x4y s PRO 8 Ca 0.00 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.09 1x4y s PRO 8 Cb 0.00 -3.17 0.00 0.00 0.04 0.00 0.00 34.50 31.37 1x4y s PRO 8 CO 0.00 -0.18 0.00 1.33 0.04 0.00 0.00 177.00 178.19 1x4y n VAL 9 N 2.05 0.00 -0.35 -0.36 0.24 -1.26 -3.59 118.33 115.05 1x4y n VAL 9 Ca 0.04 0.00 0.33 0.00 -2.04 0.00 0.00 64.34 62.67 1x4y n VAL 9 Cb 0.43 -0.73 0.60 0.00 -1.47 0.00 0.00 33.84 32.66 1x4y n VAL 9 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1x4y n ALA 10 N -2.56 1.09 -1.50 2.33 0.00 -1.26 -2.29 120.51 116.32 1x4y n ALA 10 Ca 0.00 0.94 0.07 0.00 0.00 0.00 0.00 53.44 54.46 1x4y n ALA 10 Cb 0.44 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.85 1x4y n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x4y n GLY 11 N -1.32 -3.52 3.77 0.00 0.00 -1.26 -4.83 105.19 98.02 1x4y n GLY 11 Ca 0.37 -0.85 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 1x4y n GLY 11 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4y s PRO 12 N -4.94 2.20 -0.13 1.61 0.04 -1.26 -4.79 135.00 127.72 1x4y s PRO 12 Ca 0.00 1.15 -0.00 0.00 0.04 0.00 0.00 61.00 62.19 1x4y s PRO 12 Cb 0.00 -1.89 0.03 0.00 0.04 0.00 0.00 34.50 32.68 1x4y s PRO 12 CO 0.00 -1.68 -0.07 -0.47 0.04 0.00 0.00 177.00 174.83 1x4y s TYR 13 N -2.91 1.56 -0.22 0.56 5.04 -0.88 -4.49 117.35 116.01 1x4y s TYR 13 Ca 0.61 -0.87 -0.29 0.00 -2.44 0.00 0.00 57.07 54.08 1x4y s TYR 13 Cb -0.17 -1.26 -0.03 0.00 0.35 0.00 0.00 41.96 40.84 1x4y s TYR 13 CO 0.56 -0.55 1.77 0.42 -1.34 0.00 0.00 175.55 176.41 1x4y s ILE 14 N 1.68 3.48 -1.03 3.14 1.01 -1.26 -0.89 121.20 127.33 1x4y s ILE 14 Ca 0.03 0.53 0.11 0.00 0.00 0.00 0.00 60.65 61.33 1x4y s ILE 14 Cb -0.14 -3.53 0.30 0.00 0.01 0.00 0.00 42.46 39.10 1x4y s ILE 14 CO -0.08 -0.26 1.23 0.35 0.00 0.00 0.00 174.94 176.18 1x4y n THR 15 N 6.76 0.90 -3.66 2.92 -2.24 -0.40 -4.94 114.28 113.62 1x4y n THR 15 Ca 0.21 -0.95 -0.06 0.00 -2.27 0.00 0.00 64.05 60.98 1x4y n THR 15 Cb 0.45 0.58 -0.07 0.00 -2.10 0.00 0.00 70.33 69.18 1x4y n THR 15 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1x4y s PHE 16 N -1.00 -1.00 -0.17 4.78 5.36 -1.08 -4.98 117.98 119.89 1x4y s PHE 16 Ca 0.23 1.90 -0.05 0.00 -0.96 0.00 0.00 56.93 58.06 1x4y s PHE 16 Cb 0.12 0.55 0.06 0.00 -0.34 0.00 0.00 43.02 43.41 1x4y s PHE 16 CO 0.16 -0.52 0.10 0.95 -1.46 0.00 0.00 175.22 174.45 1x4y s THR 17 N 2.16 -0.12 0.07 0.12 -4.23 -1.26 -0.99 115.64 111.39 1x4y s THR 17 Ca -0.07 -0.12 0.00 0.00 -1.18 0.00 0.00 61.69 60.32 1x4y s THR 17 Cb -0.09 -0.56 -0.04 0.00 1.34 0.00 0.00 72.50 73.15 1x4y s THR 17 CO -0.17 -0.25 -0.05 -1.81 -0.54 0.00 0.00 174.62 171.81 1x4y s ASP 18 N 2.16 0.75 -0.47 3.99 1.01 -0.39 -4.94 116.67 118.79 1x4y s ASP 18 Ca 0.03 -0.92 -0.16 0.00 0.71 0.00 0.00 52.55 52.21 1x4y s ASP 18 Cb -0.16 0.14 0.07 0.00 1.01 0.00 0.00 42.92 43.97 1x4y s ASP 18 CO -0.09 -0.48 0.39 0.00 0.21 0.00 0.00 175.17 175.20 1x4y s ALA 19 N -3.35 3.55 0.38 5.23 0.00 -1.26 0.05 121.76 126.36 1x4y s ALA 19 Ca 0.05 -2.06 0.24 0.00 0.00 0.00 0.00 51.96 50.18 1x4y s ALA 19 Cb 0.04 -3.06 1.24 0.00 0.00 0.00 0.00 23.12 21.34 1x4y s ALA 19 CO -0.06 -1.71 2.00 0.28 0.00 0.00 0.00 175.76 176.27 1x4y h VAL 20 N 5.74 0.72 -2.77 0.00 2.07 -1.78 -3.45 116.25 116.78 1x4y h VAL 20 Ca -0.28 -0.71 0.07 0.00 0.82 0.00 0.00 66.70 66.60 1x4y h VAL 20 Cb 1.11 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 1x4y h VAL 20 CO 0.87 0.17 0.44 0.20 0.02 0.00 0.00 177.57 179.27 1x4y s ASN 21 N -6.36 0.02 0.43 0.57 0.01 -0.80 -4.92 114.94 103.89 1x4y s ASN 21 Ca -0.03 -0.92 0.13 0.00 -0.71 0.00 0.00 52.86 51.33 1x4y s ASN 21 Cb 0.13 0.67 0.94 0.00 0.41 0.00 0.00 41.25 43.40 1x4y s ASN 21 CO 0.62 -1.34 1.97 1.05 -1.51 0.00 0.00 177.10 177.89 1x4y h GLU 22 N 2.00 0.07 0.00 -0.60 9.09 -1.89 -2.78 114.58 120.47 1x4y h GLU 22 Ca -0.30 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.09 1x4y h GLU 22 Cb 1.23 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 28.32 1x4y h GLU 22 CO 0.39 0.24 -0.00 0.25 0.05 0.00 0.00 179.01 179.93 1x4y n THR 23 N -4.31 1.75 -4.03 -1.06 -2.24 -1.26 -2.98 114.28 100.15 1x4y n THR 23 Ca -0.02 -2.07 -0.11 0.00 -2.27 0.00 0.00 64.05 59.58 1x4y n THR 23 Cb 0.25 -0.13 -0.11 0.00 -2.10 0.00 0.00 70.33 68.24 1x4y n THR 23 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1x4y s THR 24 N -2.59 0.33 -0.11 4.28 2.01 -1.05 -2.16 115.64 116.34 1x4y s THR 24 Ca 0.27 -1.09 -0.07 0.00 0.31 0.00 0.00 61.69 61.11 1x4y s THR 24 Cb 0.24 -0.55 0.04 0.00 0.01 0.00 0.00 72.50 72.23 1x4y s THR 24 CO 0.03 -0.50 0.28 -0.63 -0.69 0.00 0.00 174.62 173.10 1x4y s ILE 25 N -1.68 -0.02 -0.24 1.82 1.01 -0.81 -1.90 121.20 119.38 1x4y s ILE 25 Ca -0.11 0.08 -0.05 0.00 0.00 0.00 0.00 60.65 60.57 1x4y s ILE 25 Cb -0.08 -0.41 -0.01 0.00 0.01 0.00 0.00 42.46 41.96 1x4y s ILE 25 CO -0.01 0.03 0.01 -0.32 0.00 0.00 0.00 174.94 174.66 1x4y s MET 26 N 0.83 3.45 -0.03 2.79 -2.45 0.11 -0.73 119.30 123.27 1x4y s MET 26 Ca -0.06 -0.59 0.04 0.00 -1.25 0.00 0.00 55.69 53.83 1x4y s MET 26 Cb -0.07 -3.17 -0.01 0.00 1.25 0.00 0.00 34.83 32.84 1x4y s MET 26 CO -0.05 -0.22 -0.16 -0.48 1.05 0.00 0.00 175.02 175.15 1x4y s LEU 27 N 1.53 1.94 -0.04 4.11 2.34 -1.05 -1.27 118.68 126.24 1x4y s LEU 27 Ca 0.06 -0.31 0.06 0.00 0.06 0.00 0.00 54.13 53.99 1x4y s LEU 27 Cb -0.15 -0.88 -0.02 0.00 -0.56 0.00 0.00 46.19 44.58 1x4y s LEU 27 CO 0.00 0.16 -0.21 -0.54 -1.06 0.00 0.00 176.35 174.70 1x4y s LYS 28 N -0.10 2.37 0.28 1.48 1.02 -0.16 -2.88 119.74 121.75 1x4y s LYS 28 Ca 0.00 -0.84 0.12 0.00 0.02 0.00 0.00 55.97 55.27 1x4y s LYS 28 Cb -0.09 -2.20 -0.05 0.00 -0.52 0.00 0.00 37.83 34.97 1x4y s LYS 28 CO 0.01 0.53 -0.18 1.67 -0.92 0.00 0.00 175.35 176.46 1x4y s TRP 29 N -0.53 2.32 0.32 3.18 -2.14 -1.00 -1.28 118.94 119.82 1x4y s TRP 29 Ca 0.07 -0.34 0.10 0.00 2.66 0.00 0.00 56.10 58.60 1x4y s TRP 29 Cb -0.11 -1.03 -0.06 0.00 -3.10 0.00 0.00 33.47 29.17 1x4y s TRP 29 CO 0.01 0.70 -0.10 0.00 -2.66 0.00 0.00 176.95 174.90 1x4y s MET 30 N -3.53 1.86 -0.07 3.25 0.23 -0.07 -4.85 119.30 116.12 1x4y s MET 30 Ca 0.30 -1.81 0.05 0.00 -1.03 0.00 0.00 55.69 53.21 1x4y s MET 30 Cb -0.05 -1.80 -0.01 0.00 -1.53 0.00 0.00 34.83 31.45 1x4y s MET 30 CO 0.15 0.22 -0.23 -0.47 -2.03 0.00 0.00 175.02 172.66 1x4y s TYR 31 N -2.54 2.31 -0.58 3.16 5.04 -1.26 -2.08 117.35 121.40 1x4y s TYR 31 Ca 0.32 -0.76 -0.13 0.00 -2.44 0.00 0.00 57.07 54.07 1x4y s TYR 31 Cb -0.01 -1.53 0.15 0.00 0.35 0.00 0.00 41.96 40.91 1x4y s TYR 31 CO 0.17 -0.26 0.50 0.42 -1.34 0.00 0.00 175.55 175.04 1x4y s ILE 32 N 0.02 4.89 0.28 3.14 -1.09 -1.26 -4.91 121.20 122.27 1x4y s ILE 32 Ca -0.08 -1.87 0.17 0.00 -2.23 0.00 0.00 60.65 56.64 1x4y s ILE 32 Cb -0.14 -4.14 0.13 0.00 -1.58 0.00 0.00 42.46 36.72 1x4y s ILE 32 CO 0.05 -0.87 1.79 1.55 -1.23 0.00 0.00 174.94 176.23 1x4y h PRO 33 N 8.42 0.00 0.24 2.79 0.13 -1.98 -3.25 132.00 138.35 1x4y h PRO 33 Ca -0.17 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.95 1x4y h PRO 33 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 1x4y h PRO 33 CO 0.91 0.37 -0.22 0.00 -0.23 0.00 0.00 178.00 178.83 1x4y h ALA 34 N 1.63 -0.95 -0.28 -0.56 0.00 -2.07 -2.63 119.26 114.41 1x4y h ALA 34 Ca -0.00 -0.09 -0.19 0.00 0.00 0.00 0.00 54.91 54.63 1x4y h ALA 34 Cb 0.77 0.44 -0.08 0.00 0.00 0.00 0.00 17.79 18.92 1x4y h ALA 34 CO 0.05 -0.96 0.24 0.43 0.00 0.00 0.00 179.25 179.01 1x4y n SER 35 N -3.66 5.73 -4.69 0.00 7.64 -1.24 -4.87 113.62 112.52 1x4y n SER 35 Ca -0.05 -2.76 -0.23 0.00 1.01 0.00 0.00 58.87 56.83 1x4y n SER 35 Cb 0.20 -1.04 -0.07 0.00 -1.01 0.00 0.00 64.21 62.30 1x4y n SER 35 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1x4y s ASN 36 N 0.86 4.62 -0.37 6.43 2.47 -0.99 -4.67 114.94 123.29 1x4y s ASN 36 Ca 0.18 -0.70 0.07 0.00 0.42 0.00 0.00 52.86 52.84 1x4y s ASN 36 Cb 0.14 -0.81 0.72 0.00 -1.45 0.00 0.00 41.25 39.85 1x4y s ASN 36 CO 0.00 -0.13 1.86 0.59 -3.72 0.00 0.00 177.10 175.69 1x4y n ASN 37 N -1.01 4.44 -4.26 -4.21 3.02 -1.26 -4.92 115.26 107.07 1x4y n ASN 37 Ca -0.05 -3.37 -0.33 0.00 -0.03 0.00 0.00 54.58 50.81 1x4y n ASN 37 Cb 0.60 -0.79 -0.06 0.00 -0.61 0.00 0.00 39.78 38.92 1x4y n ASN 37 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1x4y n ASN 38 N -0.53 -0.56 -4.55 6.41 4.13 -1.26 -4.93 115.26 113.98 1x4y n ASN 38 Ca 0.49 -1.16 -0.33 0.00 1.68 0.00 0.00 54.58 55.25 1x4y n ASN 38 Cb 1.51 -2.15 -0.12 0.00 -1.54 0.00 0.00 39.78 37.48 1x4y n ASN 38 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 1x4y s THR 39 N -3.89 3.47 0.30 3.41 -1.32 -1.26 -5.10 115.64 111.24 1x4y s THR 39 Ca 0.28 -0.60 -0.29 0.00 -1.21 0.00 0.00 61.69 59.87 1x4y s THR 39 Cb -0.16 -2.41 -0.10 0.00 -1.51 0.00 0.00 72.50 68.33 1x4y s THR 39 CO 0.97 0.57 1.23 -2.16 -2.21 0.00 0.00 174.62 173.02 1x4y s PRO 40 N -0.85 4.46 -0.07 7.08 0.04 -1.26 -4.99 135.00 139.41 1x4y s PRO 40 Ca 0.13 2.06 -0.02 0.00 0.04 0.00 0.00 61.00 63.20 1x4y s PRO 40 Cb -0.11 -3.12 -0.04 0.00 0.04 0.00 0.00 34.50 31.27 1x4y s PRO 40 CO 0.02 -0.05 0.04 0.42 0.04 0.00 0.00 177.00 177.47 1x4y s ILE 41 N -1.04 4.59 0.07 0.56 1.01 -1.26 -4.64 121.20 120.49 1x4y s ILE 41 Ca 0.48 -0.21 -0.16 0.00 0.00 0.00 0.00 60.65 60.76 1x4y s ILE 41 Cb -0.37 -2.98 -0.16 0.00 0.01 0.00 0.00 42.46 38.96 1x4y s ILE 41 CO 0.47 0.56 1.28 0.45 0.00 0.00 0.00 174.94 177.70 1x4y h HIS 42 N 4.91 0.84 -0.06 3.97 3.86 -1.61 -3.44 115.15 123.62 1x4y h HIS 42 Ca -0.51 -0.36 0.00 0.00 -1.16 0.00 0.00 60.37 58.34 1x4y h HIS 42 Cb 1.20 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 29.53 1x4y h HIS 42 CO 0.66 1.15 0.00 0.41 0.86 0.00 0.00 177.93 181.00 1x4y n GLY 43 N 0.64 1.62 2.72 2.45 0.00 -1.20 -3.61 105.19 107.81 1x4y n GLY 43 Ca -0.07 -0.38 -0.18 0.00 0.00 0.00 0.00 46.02 45.39 1x4y n GLY 43 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x4y s PHE 44 N -1.27 0.03 -0.09 1.61 0.08 0.12 -3.74 117.98 114.73 1x4y s PHE 44 Ca 0.00 0.23 -0.06 0.00 0.12 0.00 0.00 56.93 57.22 1x4y s PHE 44 Cb 0.00 -0.37 -0.04 0.00 -0.57 0.00 0.00 43.02 42.04 1x4y s PHE 44 CO 0.00 -0.15 0.15 0.71 -0.10 0.00 0.00 175.22 175.83 1x4y s TYR 45 N 1.71 3.59 -0.08 0.36 2.02 0.91 0.41 117.35 126.28 1x4y s TYR 45 Ca -0.01 0.49 -0.00 0.00 -0.37 0.00 0.00 57.07 57.18 1x4y s TYR 45 Cb -0.12 -1.91 0.02 0.00 -0.40 0.00 0.00 41.96 39.55 1x4y s TYR 45 CO -0.03 0.72 -0.05 0.42 -1.57 0.00 0.00 175.55 175.04 1x4y s ILE 46 N -1.11 0.69 0.09 2.71 1.01 -0.57 -0.29 121.20 123.73 1x4y s ILE 46 Ca 0.18 -0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.75 1x4y s ILE 46 Cb -0.12 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.57 1x4y s ILE 46 CO 0.08 0.29 0.03 -0.31 0.00 0.00 0.00 174.94 175.03 1x4y s TYR 47 N 1.47 3.06 0.02 3.97 1.51 -0.37 -0.31 117.35 126.70 1x4y s TYR 47 Ca -0.01 0.01 -0.22 0.00 -1.01 0.00 0.00 57.07 55.83 1x4y s TYR 47 Cb -0.13 -1.56 0.05 0.00 -0.11 0.00 0.00 41.96 40.21 1x4y s TYR 47 CO -0.04 0.50 0.50 1.52 -1.11 0.00 0.00 175.55 176.92 1x4y s TYR 48 N -1.38 -0.40 -0.27 2.71 1.13 -1.25 -2.93 117.35 114.96 1x4y s TYR 48 Ca 0.27 0.53 -0.26 0.00 -1.41 0.00 0.00 57.07 56.20 1x4y s TYR 48 Cb -0.12 0.29 0.15 0.00 -1.10 0.00 0.00 41.96 41.18 1x4y s TYR 48 CO 0.20 -0.58 1.16 -0.98 -2.51 0.00 0.00 175.55 172.84 1x4y s ARG 49 N -2.02 0.36 0.41 -3.49 1.04 -1.26 -2.05 118.95 111.94 1x4y s ARG 49 Ca -0.08 0.34 -0.25 0.00 -1.04 0.00 0.00 55.73 54.71 1x4y s ARG 49 Cb -0.01 0.18 -0.08 0.00 -2.04 0.00 0.00 34.95 32.99 1x4y s ARG 49 CO 0.01 -0.06 1.19 -1.25 -0.04 0.00 0.00 175.30 175.15 1x4y s PRO 50 N -0.11 4.00 0.47 3.89 0.04 -1.26 -4.21 135.00 137.82 1x4y s PRO 50 Ca 0.04 1.87 0.19 0.00 0.04 0.00 0.00 61.00 63.15 1x4y s PRO 50 Cb -0.04 -2.65 1.19 0.00 0.04 0.00 0.00 34.50 33.04 1x4y s PRO 50 CO -0.08 -0.37 1.96 0.00 0.04 0.00 0.00 177.00 178.55 1x4y h THR 51 N 2.28 0.78 0.00 1.26 1.03 -1.94 0.44 112.91 116.77 1x4y h THR 51 Ca -0.49 -0.08 0.00 0.00 -0.01 0.00 0.00 66.41 65.83 1x4y h THR 51 Cb 1.24 0.51 0.00 0.00 -1.07 0.00 0.00 68.15 68.83 1x4y h THR 51 CO 0.62 0.04 0.00 -0.67 -0.01 0.00 0.00 175.52 175.51 1x4y n ASP 52 N -4.44 0.00 -3.10 0.00 -0.08 -1.26 -4.77 116.55 102.90 1x4y n ASP 52 Ca 0.12 -0.35 -0.16 0.00 -1.51 0.00 0.00 54.79 52.89 1x4y n ASP 52 Cb 0.55 -0.06 0.15 0.00 2.34 0.00 0.00 41.12 44.10 1x4y n ASP 52 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1x4y n SER 53 N -1.06 -2.91 0.01 1.67 7.64 0.15 -5.03 113.62 114.09 1x4y n SER 53 Ca 0.10 -0.51 -0.01 0.00 1.01 0.00 0.00 58.87 59.45 1x4y n SER 53 Cb 0.06 -0.52 -0.00 0.00 -1.01 0.00 0.00 64.21 62.74 1x4y n SER 53 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1x4y n ASP 54 N -4.40 0.48 -2.03 6.43 -0.08 -1.26 -5.09 116.55 110.60 1x4y n ASP 54 Ca 0.07 0.07 -0.07 0.00 -1.51 0.00 0.00 54.79 53.35 1x4y n ASP 54 Cb 0.31 -0.16 -0.00 0.00 2.34 0.00 0.00 41.12 43.61 1x4y n ASP 54 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 1x4y n ASN 55 N -3.24 -0.96 -0.18 1.67 6.94 -1.26 -5.01 115.26 113.22 1x4y n ASN 55 Ca -0.03 -1.96 0.29 0.00 -0.02 0.00 0.00 54.58 52.87 1x4y n ASN 55 Cb 0.36 1.69 0.73 0.00 -2.36 0.00 0.00 39.78 40.19 1x4y n ASN 55 CO 0.00 0.00 0.00 -2.24 -1.03 0.00 0.00 177.26 173.99 1x4y h ASP 56 N 1.07 0.00 -0.67 0.53 2.03 -2.00 -0.76 116.42 116.61 1x4y h ASP 56 Ca -0.16 0.00 0.20 0.00 -0.73 0.00 0.00 57.03 56.33 1x4y h ASP 56 Cb 0.66 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 39.13 1x4y h ASP 56 CO 0.21 0.00 1.04 -1.28 -1.03 0.00 0.00 179.24 178.18 1x4y h SER 57 N 0.00 0.00 0.00 4.15 0.87 -2.03 0.36 113.55 116.90 1x4y h SER 57 Ca 0.43 0.00 -0.26 0.00 -1.23 0.00 0.00 61.79 60.73 1x4y h SER 57 Cb 1.79 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.71 1x4y h SER 57 CO -0.00 0.00 -1.42 0.47 -0.53 0.00 0.00 176.83 175.34 1x4y n ASP 58 N -3.11 1.87 -3.66 6.23 8.00 -0.29 -4.93 116.55 120.67 1x4y n ASP 58 Ca 0.15 0.41 -0.52 0.00 0.71 0.00 0.00 54.79 55.54 1x4y n ASP 58 Cb 1.25 -0.95 -0.08 0.00 -0.02 0.00 0.00 41.12 41.32 1x4y n ASP 58 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1x4y n TYR 59 N -4.41 1.32 -2.49 1.24 4.01 0.13 -4.88 117.16 112.08 1x4y n TYR 59 Ca -0.35 0.88 -0.13 0.00 -0.16 0.00 0.00 57.90 58.15 1x4y n TYR 59 Cb 0.71 -1.72 0.06 0.00 -0.31 0.00 0.00 39.34 38.09 1x4y n TYR 59 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1x4y n LYS 60 N 3.00 0.25 -3.63 -0.72 5.02 -0.87 -4.86 118.16 116.35 1x4y n LYS 60 Ca 0.24 -1.54 -0.16 0.00 -2.02 0.00 0.00 58.31 54.83 1x4y n LYS 60 Cb -0.04 -0.36 -0.14 0.00 -0.02 0.00 0.00 35.03 34.47 1x4y n LYS 60 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1x4y s LYS 61 N -3.88 0.10 -0.31 1.97 2.20 -1.25 -3.83 119.74 114.74 1x4y s LYS 61 Ca 0.37 0.55 -0.01 0.00 -0.36 0.00 0.00 55.97 56.52 1x4y s LYS 61 Cb -0.02 -0.39 0.06 0.00 -1.51 0.00 0.00 37.83 35.97 1x4y s LYS 61 CO 0.24 -0.37 0.02 -0.51 -0.36 0.00 0.00 175.35 174.37 1x4y s ASP 62 N 2.34 4.89 0.44 1.43 1.11 0.58 -4.88 116.67 122.58 1x4y s ASP 62 Ca 0.03 -1.44 -0.22 0.00 0.18 0.00 0.00 52.55 51.10 1x4y s ASP 62 Cb -0.13 -1.71 -0.08 0.00 1.07 0.00 0.00 42.92 42.07 1x4y s ASP 62 CO -0.08 -0.30 1.07 -0.32 1.18 0.00 0.00 175.17 176.72 1x4y s MET 63 N 1.20 3.95 -0.01 8.23 1.75 -1.26 -1.52 119.30 131.64 1x4y s MET 63 Ca -0.03 1.52 -0.04 0.00 -1.25 0.00 0.00 55.69 55.89 1x4y s MET 63 Cb -0.20 -2.36 -0.00 0.00 2.84 0.00 0.00 34.83 35.11 1x4y s MET 63 CO -0.02 -0.33 0.08 0.08 -0.65 0.00 0.00 175.02 174.18 1x4y s VAL 64 N -1.74 0.05 0.48 10.11 1.01 0.16 -4.92 120.40 125.56 1x4y s VAL 64 Ca 0.62 -0.44 -0.20 0.00 0.00 0.00 0.00 61.98 61.96 1x4y s VAL 64 Cb -0.22 -0.27 -0.12 0.00 0.00 0.00 0.00 36.38 35.78 1x4y s VAL 64 CO 0.27 -0.24 0.40 -0.62 0.00 0.00 0.00 175.10 174.90 1x4y n GLU 65 N 2.17 0.42 0.26 2.72 -0.58 -1.26 0.16 120.64 124.53 1x4y n GLU 65 Ca -0.18 0.16 0.13 0.00 -0.42 0.00 0.00 57.16 56.85 1x4y n GLU 65 Cb 0.57 -1.44 0.65 0.00 -0.57 0.00 0.00 31.44 30.65 1x4y n GLU 65 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1x4y h GLY 66 N 0.47 0.00 0.97 0.62 0.00 -1.84 -2.17 103.07 101.11 1x4y h GLY 66 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1x4y h GLY 66 CO 0.48 0.00 -0.43 1.22 0.00 0.00 0.00 176.54 177.81 1x4y n ASP 67 N -3.38 0.53 -4.75 0.19 8.00 -1.26 -4.86 116.55 111.03 1x4y n ASP 67 Ca -0.01 -0.29 -0.39 0.00 0.71 0.00 0.00 54.79 54.82 1x4y n ASP 67 Cb 0.31 0.18 -0.06 0.00 -0.02 0.00 0.00 41.12 41.54 1x4y n ASP 67 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1x4y s ARG 68 N -2.93 4.33 -0.03 -1.24 6.06 -0.82 -4.95 118.95 119.37 1x4y s ARG 68 Ca 0.13 0.68 0.06 0.00 -2.50 0.00 0.00 55.73 54.10 1x4y s ARG 68 Cb 0.18 -3.38 0.14 0.00 0.06 0.00 0.00 34.95 31.96 1x4y s ARG 68 CO 0.66 0.28 1.10 0.66 -2.50 0.00 0.00 175.30 175.50 1x4y n TYR 69 N 3.10 0.16 -3.83 5.12 4.02 -1.26 -4.81 117.16 119.65 1x4y n TYR 69 Ca -0.06 -0.60 -0.12 0.00 -0.01 0.00 0.00 57.90 57.10 1x4y n TYR 69 Cb 0.51 -0.08 -0.11 0.00 -0.02 0.00 0.00 39.34 39.64 1x4y n TYR 69 CO 0.00 0.00 0.00 1.67 -1.01 0.00 0.00 176.86 177.52 1x4y s TRP 70 N -1.41 -0.10 -0.10 -0.72 1.48 -1.26 -2.36 118.94 114.46 1x4y s TRP 70 Ca 0.13 0.22 -0.13 0.00 -1.06 0.00 0.00 56.10 55.26 1x4y s TRP 70 Cb 0.09 0.02 0.03 0.00 -1.16 0.00 0.00 33.47 32.45 1x4y s TRP 70 CO 0.04 -0.19 0.34 -1.58 -4.06 0.00 0.00 176.95 171.50 1x4y s HIS 71 N -0.59 -0.33 -0.33 1.66 2.46 -1.14 -5.05 115.29 111.98 1x4y s HIS 71 Ca -0.07 0.75 -0.02 0.00 0.47 0.00 0.00 55.06 56.18 1x4y s HIS 71 Cb -0.04 0.12 0.06 0.00 -0.13 0.00 0.00 32.58 32.60 1x4y s HIS 71 CO 0.01 -0.25 0.06 -1.54 -2.47 0.00 0.00 174.74 170.55 1x4y s SER 72 N -0.27 5.02 0.62 9.88 1.04 -1.26 -2.54 113.70 126.19 1x4y s SER 72 Ca -0.04 -1.45 -0.15 0.00 0.48 0.00 0.00 55.95 54.79 1x4y s SER 72 Cb -0.03 -1.75 -0.02 0.00 0.10 0.00 0.00 66.02 64.31 1x4y s SER 72 CO 0.02 -0.33 1.08 -0.63 0.98 0.00 0.00 173.24 174.35 1x4y s ILE 73 N 1.24 3.60 0.30 -1.02 1.01 0.09 -4.83 121.20 121.58 1x4y s ILE 73 Ca -0.01 0.75 0.03 0.00 0.00 0.00 0.00 60.65 61.42 1x4y s ILE 73 Cb -0.20 -3.28 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 1x4y s ILE 73 CO -0.01 -0.45 0.28 -0.44 0.00 0.00 0.00 174.94 174.31 1x4y s SER 74 N -2.72 1.11 -1.18 3.58 0.01 -1.26 -1.93 113.70 111.32 1x4y s SER 74 Ca 0.65 -1.59 -0.06 0.00 1.31 0.00 0.00 55.95 56.26 1x4y s SER 74 Cb -0.18 0.53 0.01 0.00 0.21 0.00 0.00 66.02 66.59 1x4y s SER 74 CO 0.39 -1.05 1.01 1.41 0.41 0.00 0.00 173.24 175.41 1x4y n HIS 75 N -0.52 -2.40 -3.62 2.43 8.25 -0.92 -4.95 115.22 113.49 1x4y n HIS 75 Ca 0.05 0.89 -0.19 0.00 -0.26 0.00 0.00 57.72 58.21 1x4y n HIS 75 Cb 0.63 -4.68 0.01 0.00 1.12 0.00 0.00 29.99 27.08 1x4y n HIS 75 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1x4y n LEU 76 N -4.32 0.00 -4.84 2.41 4.77 -1.10 -5.08 117.00 108.83 1x4y n LEU 76 Ca -0.07 -2.18 -0.37 0.00 -0.03 0.00 0.00 56.01 53.36 1x4y n LEU 76 Cb 0.58 -0.10 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 1x4y n LEU 76 CO 0.57 -0.55 -0.07 -1.10 -1.33 0.00 0.00 177.39 174.91 1x4y s GLN 77 N -3.84 3.72 0.64 3.23 1.11 -1.26 -4.60 119.66 118.66 1x4y s GLN 77 Ca 0.30 0.05 -0.16 0.00 0.01 0.00 0.00 55.36 55.56 1x4y s GLN 77 Cb -0.02 -3.24 -0.01 0.00 -1.01 0.00 0.00 33.01 28.73 1x4y s GLN 77 CO 0.19 0.66 1.11 -1.25 0.01 0.00 0.00 175.29 176.02 1x4y s PRO 78 N -0.78 2.87 -0.84 2.91 0.04 -1.16 -3.33 135.00 134.71 1x4y s PRO 78 Ca 0.17 1.42 -0.11 0.00 0.04 0.00 0.00 61.00 62.53 1x4y s PRO 78 Cb -0.13 -1.96 0.11 0.00 0.04 0.00 0.00 34.50 32.56 1x4y s PRO 78 CO 0.06 -1.20 0.27 -0.85 0.04 0.00 0.00 177.00 175.32 1x4y n GLU 79 N -2.27 -1.49 -3.73 4.56 0.28 -0.48 -4.83 120.64 112.68 1x4y n GLU 79 Ca 0.11 0.06 -0.38 0.00 -0.16 0.00 0.00 57.16 56.79 1x4y n GLU 79 Cb 0.52 -3.49 -0.12 0.00 1.43 0.00 0.00 31.44 29.78 1x4y n GLU 79 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1x4y s THR 80 N -2.21 3.76 -0.61 3.84 2.01 -1.21 -4.89 115.64 116.33 1x4y s THR 80 Ca 0.37 -1.32 -0.26 0.00 0.31 0.00 0.00 61.69 60.79 1x4y s THR 80 Cb -0.22 -3.22 0.04 0.00 0.01 0.00 0.00 72.50 69.11 1x4y s THR 80 CO 0.46 -0.31 1.10 -0.55 -0.69 0.00 0.00 174.62 174.63 1x4y s SER 81 N 1.61 6.33 0.11 3.53 0.15 -1.26 -3.74 113.70 120.42 1x4y s SER 81 Ca 0.00 -0.26 0.05 0.00 0.70 0.00 0.00 55.95 56.45 1x4y s SER 81 Cb -0.21 -2.50 -0.04 0.00 -1.71 0.00 0.00 66.02 61.57 1x4y s SER 81 CO 0.01 -1.46 -0.13 -0.72 1.20 0.00 0.00 173.24 172.15 1x4y s TYR 82 N 4.68 1.25 0.56 3.44 -0.85 -1.26 -4.50 117.35 120.66 1x4y s TYR 82 Ca 0.35 -0.57 -0.18 0.00 -0.52 0.00 0.00 57.07 56.15 1x4y s TYR 82 Cb -0.10 -0.67 -0.05 0.00 0.38 0.00 0.00 41.96 41.52 1x4y s TYR 82 CO 0.20 0.08 1.09 -0.51 -1.52 0.00 0.00 175.55 174.89 1x4y s ASP 83 N -2.33 5.77 -0.01 -0.18 1.01 -1.26 -3.58 116.67 116.08 1x4y s ASP 83 Ca 0.06 2.03 -0.00 0.00 0.71 0.00 0.00 52.55 55.34 1x4y s ASP 83 Cb -0.05 -2.56 0.01 0.00 1.01 0.00 0.00 42.92 41.33 1x4y s ASP 83 CO 0.02 -1.18 0.03 -0.63 0.21 0.00 0.00 175.17 173.62 1x4y s ILE 84 N -2.04 -0.02 0.20 0.77 1.01 -0.36 -4.14 121.20 116.63 1x4y s ILE 84 Ca 0.69 0.09 -0.04 0.00 0.00 0.00 0.00 60.65 61.39 1x4y s ILE 84 Cb -0.20 -0.06 -0.03 0.00 0.01 0.00 0.00 42.46 42.18 1x4y s ILE 84 CO 0.30 0.04 0.20 -1.59 0.00 0.00 0.00 174.94 173.88 1x4y s LYS 85 N 0.47 1.24 0.32 2.79 -2.85 -1.15 -0.62 119.74 119.93 1x4y s LYS 85 Ca -0.04 -1.52 -0.14 0.00 -1.00 0.00 0.00 55.97 53.27 1x4y s LYS 85 Cb -0.06 0.31 0.02 0.00 -2.06 0.00 0.00 37.83 36.05 1x4y s LYS 85 CO -0.01 -0.43 0.63 0.00 0.10 0.00 0.00 175.35 175.64 1x4y s MET 86 N -4.12 1.88 -0.17 1.78 0.23 -1.26 -1.24 119.30 116.41 1x4y s MET 86 Ca 0.34 -1.35 -0.29 0.00 -1.03 0.00 0.00 55.69 53.36 1x4y s MET 86 Cb 0.05 0.55 0.12 0.00 -1.53 0.00 0.00 34.83 34.02 1x4y s MET 86 CO 0.10 -0.84 0.97 -1.14 -2.03 0.00 0.00 175.02 172.09 1x4y s GLN 87 N -3.29 0.62 0.22 3.16 -0.44 0.60 -0.70 119.66 119.83 1x4y s GLN 87 Ca 0.19 0.24 0.05 0.00 -2.50 0.00 0.00 55.36 53.34 1x4y s GLN 87 Cb -0.03 0.29 -0.03 0.00 -1.64 0.00 0.00 33.01 31.60 1x4y s GLN 87 CO 0.11 -0.18 0.28 0.00 0.50 0.00 0.00 175.29 176.01 1x4y s PHE 89 N -1.95 0.65 0.27 0.00 -0.71 -1.24 0.33 117.98 115.33 1x4y s PHE 89 Ca 0.34 -0.99 -0.16 0.00 -1.04 0.00 0.00 56.93 55.07 1x4y s PHE 89 Cb -0.09 -0.22 0.01 0.00 -1.21 0.00 0.00 43.02 41.51 1x4y s PHE 89 CO 0.27 -0.70 0.61 0.54 -1.34 0.00 0.00 175.22 174.61 1x4y s ASN 90 N -3.03 -0.13 0.42 1.98 4.22 -1.12 -1.49 114.94 115.79 1x4y s ASN 90 Ca 0.24 -0.81 0.33 0.00 -2.14 0.00 0.00 52.86 50.47 1x4y s ASN 90 Cb 0.04 0.67 1.41 0.00 1.28 0.00 0.00 41.25 44.66 1x4y s ASN 90 CO 0.04 -1.28 1.44 1.21 -2.04 0.00 0.00 177.10 176.47 1x4y n GLU 91 N -0.43 -0.03 -0.03 3.55 4.07 -1.26 0.10 120.64 126.61 1x4y n GLU 91 Ca -0.03 1.13 -0.13 0.00 -0.06 0.00 0.00 57.16 58.07 1x4y n GLU 91 Cb 0.60 -2.28 -0.08 0.00 -0.06 0.00 0.00 31.44 29.62 1x4y n GLU 91 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 1x4y h GLY 92 N 0.00 0.20 0.00 8.31 0.00 -1.95 -3.50 103.07 106.13 1x4y h GLY 92 Ca 0.82 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.96 1x4y h GLY 92 CO -0.37 0.17 0.00 0.61 0.00 0.00 0.00 176.54 176.96 1x4y n GLY 93 N 0.15 2.62 3.73 4.60 0.00 0.29 -4.56 105.19 112.02 1x4y n GLY 93 Ca -0.07 -1.05 -0.36 0.00 0.00 0.00 0.00 46.02 44.54 1x4y n GLY 93 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x4y s GLU 94 N -2.03 2.57 0.47 1.61 2.02 -1.26 -2.79 118.70 119.28 1x4y s GLU 94 Ca 0.00 1.97 0.03 0.00 0.02 0.00 0.00 54.97 56.99 1x4y s GLU 94 Cb 0.00 -1.86 0.09 0.00 0.10 0.00 0.00 34.13 32.46 1x4y s GLU 94 CO 0.00 -1.56 0.64 -1.13 0.02 0.00 0.00 175.26 173.23 1x4y n SER 95 N -1.97 1.14 -4.48 -0.19 3.41 0.15 -4.82 113.62 106.87 1x4y n SER 95 Ca 0.15 -1.90 -0.28 0.00 -0.26 0.00 0.00 58.87 56.58 1x4y n SER 95 Cb 0.49 -0.39 0.26 0.00 -0.26 0.00 0.00 64.21 64.31 1x4y n SER 95 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1x4y s GLU 96 N -4.10 -1.01 -0.23 4.33 2.02 -0.97 -4.78 118.70 113.95 1x4y s GLU 96 Ca 0.45 0.90 -0.21 0.00 0.02 0.00 0.00 54.97 56.13 1x4y s GLU 96 Cb -0.03 -1.54 -0.02 0.00 0.10 0.00 0.00 34.13 32.64 1x4y s GLU 96 CO 0.29 -3.81 0.65 -0.06 0.02 0.00 0.00 175.26 172.35 1x4y s PHE 97 N -2.42 3.32 1.24 1.61 0.40 -1.26 -4.56 117.98 116.30 1x4y s PHE 97 Ca 0.69 0.89 -0.18 0.00 -0.60 0.00 0.00 56.93 57.72 1x4y s PHE 97 Cb -0.26 -2.84 0.26 0.00 0.51 0.00 0.00 43.02 40.69 1x4y s PHE 97 CO 0.65 -0.28 0.62 -1.13 0.70 0.00 0.00 175.22 175.78 1x4y n SER 98 N 5.50 -2.98 -4.71 1.36 3.41 0.12 -4.97 113.62 111.35 1x4y n SER 98 Ca -0.00 -0.45 -0.29 0.00 -0.26 0.00 0.00 58.87 57.87 1x4y n SER 98 Cb 0.49 -1.01 0.15 0.00 -0.26 0.00 0.00 64.21 63.59 1x4y n SER 98 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1x4y s ASN 99 N -2.41 3.10 -0.32 4.04 2.20 -1.26 -4.69 114.94 115.59 1x4y s ASN 99 Ca 0.59 1.23 -0.15 0.00 -0.94 0.00 0.00 52.86 53.59 1x4y s ASN 99 Cb -0.14 -1.89 -0.02 0.00 -2.00 0.00 0.00 41.25 37.20 1x4y s ASN 99 CO 0.56 -2.84 0.34 -0.69 -2.94 0.00 0.00 177.10 171.53 1x4y s VAL 100 N -3.03 5.19 -0.20 3.54 1.01 -1.26 -4.50 120.40 121.15 1x4y s VAL 100 Ca 0.64 0.18 -0.03 0.00 0.00 0.00 0.00 61.98 62.76 1x4y s VAL 100 Cb -0.17 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 1x4y s VAL 100 CO 0.56 0.01 -0.05 -0.04 0.00 0.00 0.00 175.10 175.58 1x4y s MET 101 N 1.99 3.40 -0.72 2.72 -1.94 0.20 -4.89 119.30 120.06 1x4y s MET 101 Ca 0.12 -0.62 -0.22 0.00 -1.71 0.00 0.00 55.69 53.26 1x4y s MET 101 Cb -0.16 -2.95 0.08 0.00 2.01 0.00 0.00 34.83 33.80 1x4y s MET 101 CO 0.11 -0.11 1.00 0.42 -0.01 0.00 0.00 175.02 176.43 1x4y s ILE 102 N 1.26 4.40 -0.45 2.53 1.01 -1.26 -1.22 121.20 127.46 1x4y s ILE 102 Ca 0.03 -0.61 -0.12 0.00 0.00 0.00 0.00 60.65 59.95 1x4y s ILE 102 Cb -0.14 -4.71 0.09 0.00 0.01 0.00 0.00 42.46 37.70 1x4y s ILE 102 CO -0.02 -1.47 0.34 0.00 0.00 0.00 0.00 174.94 173.79 1x4y s GLU 104 N 1.51 4.39 1.18 0.00 2.12 -1.26 -4.39 118.70 122.24 1x4y s GLU 104 Ca 0.04 1.50 -0.17 0.00 0.36 0.00 0.00 54.97 56.70 1x4y s GLU 104 Cb -0.24 -3.55 0.27 0.00 0.26 0.00 0.00 34.13 30.87 1x4y s GLU 104 CO 0.03 -0.37 1.07 0.95 -0.54 0.00 0.00 175.26 176.41 1x4y s THR 105 N 2.10 1.70 0.33 -1.70 -4.23 -1.25 -4.56 115.64 108.04 1x4y s THR 105 Ca 0.51 0.00 -0.10 0.00 -1.18 0.00 0.00 61.69 60.92 1x4y s THR 105 Cb -0.21 -2.40 -0.07 0.00 1.34 0.00 0.00 72.50 71.17 1x4y s THR 105 CO 0.19 0.00 0.68 -0.54 -0.54 0.00 0.00 174.62 174.41 1x4y s LYS 106 N -5.15 3.80 0.24 3.99 1.02 -1.21 -4.04 119.74 118.38 1x4y s LYS 106 Ca 0.69 0.38 -0.30 0.00 0.02 0.00 0.00 55.97 56.76 1x4y s LYS 106 Cb -0.14 -2.49 -0.09 0.00 -0.52 0.00 0.00 37.83 34.58 1x4y s LYS 106 CO 0.58 0.12 1.34 0.00 -0.92 0.00 0.00 175.35 176.46 1x4y s ALA 107 N -2.14 3.55 -2.07 5.17 0.00 -1.26 -1.38 121.76 123.64 1x4y s ALA 107 Ca 0.50 1.19 0.14 0.00 0.00 0.00 0.00 51.96 53.79 1x4y s ALA 107 Cb -0.10 -3.50 0.44 0.00 0.00 0.00 0.00 23.12 19.95 1x4y s ALA 107 CO 0.26 -0.60 1.35 2.89 0.00 0.00 0.00 175.76 179.66 1x4y n ARG 108 N 2.23 1.92 -1.32 0.00 -4.01 -1.26 -4.84 116.66 109.38 1x4y n ARG 108 Ca 0.05 -1.42 -0.30 0.00 -1.04 0.00 0.00 57.85 55.14 1x4y n ARG 108 Cb 0.42 -1.34 0.10 0.00 -3.04 0.00 0.00 32.46 28.60 1x4y n ARG 108 CO 0.00 0.00 0.00 -1.12 -3.04 0.00 0.00 177.63 173.47 1x4y s SER 109 N -1.12 4.32 0.00 2.89 0.01 -1.26 -4.91 113.70 113.62 1x4y s SER 109 Ca 0.29 1.63 0.00 0.00 1.31 0.00 0.00 55.95 59.18 1x4y s SER 109 Cb 0.15 -2.36 0.00 0.00 0.21 0.00 0.00 66.02 64.02 1x4y s SER 109 CO 0.20 -2.12 0.00 0.61 0.41 0.00 0.00 173.24 172.34 1x4y n GLY 110 N -1.40 2.01 0.23 3.44 0.00 -1.26 -4.81 105.19 103.40 1x4y n GLY 110 Ca 0.08 -2.06 -0.08 0.00 0.00 0.00 0.00 46.02 43.97 1x4y n GLY 110 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x4y h PRO 111 N 0.00 0.57 -6.68 1.61 0.13 -2.03 -3.45 132.00 122.16 1x4y h PRO 111 Ca 0.00 -0.30 -0.45 0.00 -0.87 0.00 0.00 66.00 64.39 1x4y h PRO 111 Cb 0.00 0.01 0.03 0.00 0.13 0.00 0.00 31.00 31.17 1x4y h PRO 111 CO 0.00 0.89 -0.12 -1.12 -0.23 0.00 0.00 178.00 177.42 1x4y s SER 112 N -6.86 5.64 0.02 1.44 0.01 -1.26 -5.03 113.70 107.66 1x4y s SER 112 Ca -0.07 0.06 -0.17 0.00 1.31 0.00 0.00 55.95 57.07 1x4y s SER 112 Cb 0.12 -1.19 -0.28 0.00 0.21 0.00 0.00 66.02 64.88 1x4y s SER 112 CO 0.83 -0.83 1.06 0.77 0.41 0.00 0.00 173.24 175.48 1x4y h SER 113 N 0.37 0.73 -0.01 2.44 4.64 -1.91 -3.46 113.55 116.35 1x4y h SER 113 Ca -0.44 -0.83 0.00 0.00 -0.47 0.00 0.00 61.79 60.05 1x4y h SER 113 Cb 1.27 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1x4y h SER 113 CO 0.54 1.49 0.00 0.61 -0.87 0.00 0.00 176.83 178.60