#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4y s SER 2 N 0.00 6.03 -1.62 1.61 0.15 -1.26 -3.15 113.70 115.47 1x4y s SER 2 Ca 0.00 1.59 -0.09 0.00 0.70 0.00 0.00 55.95 58.15 1x4y s SER 2 Cb 0.00 -2.53 0.08 0.00 -1.71 0.00 0.00 66.02 61.87 1x4y s SER 2 CO 0.00 -1.55 0.41 -0.24 1.20 0.00 0.00 173.24 173.06 1x4y n SER 3 N 9.68 -0.93 -3.91 5.45 2.88 -1.26 -4.88 113.62 120.65 1x4y n SER 3 Ca 0.22 -1.14 -0.33 0.00 -1.33 0.00 0.00 58.87 56.29 1x4y n SER 3 Cb 0.46 -2.26 -0.07 0.00 -0.75 0.00 0.00 64.21 61.59 1x4y n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4y n GLY 4 N -1.85 4.37 3.81 0.46 0.00 -1.19 -5.05 105.19 105.74 1x4y n GLY 4 Ca -0.14 -2.64 -0.36 0.00 0.00 0.00 0.00 46.02 42.87 1x4y n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x4y s SER 5 N -1.09 6.33 0.04 1.61 0.15 -1.26 -4.27 113.70 115.21 1x4y s SER 5 Ca 0.30 0.38 -0.24 0.00 0.70 0.00 0.00 55.95 57.09 1x4y s SER 5 Cb -0.00 -2.09 -0.06 0.00 -1.71 0.00 0.00 66.02 62.17 1x4y s SER 5 CO -0.09 0.31 0.74 -0.44 1.20 0.00 0.00 173.24 174.97 1x4y s SER 6 N -0.43 7.19 0.41 5.45 0.01 -1.26 -4.88 113.70 120.19 1x4y s SER 6 Ca 0.12 1.42 0.00 0.00 1.31 0.00 0.00 55.95 58.80 1x4y s SER 6 Cb -0.12 -2.46 0.00 0.00 0.21 0.00 0.00 66.02 63.66 1x4y s SER 6 CO 0.02 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.31 1x4y n GLY 7 N 2.38 -3.52 3.77 3.44 0.00 -1.26 -4.72 105.19 105.27 1x4y n GLY 7 Ca -0.03 -1.05 -0.37 0.00 0.00 0.00 0.00 46.02 44.57 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 -4.66 3.74 0.00 1.61 0.04 -1.26 -4.89 135.00 129.57 1x4y s PRO 8 Ca 0.00 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.80 1x4y s PRO 8 Cb 0.00 -2.39 0.00 0.00 0.04 0.00 0.00 34.50 32.15 1x4y s PRO 8 CO 0.00 -0.56 0.00 1.33 0.04 0.00 0.00 177.00 177.81 1x4y n VAL 9 N -0.52 0.00 -0.30 -0.36 0.24 -1.26 -3.72 118.33 112.41 1x4y n VAL 9 Ca 0.07 0.00 0.26 0.00 -2.04 0.00 0.00 64.34 62.63 1x4y n VAL 9 Cb 0.48 -0.38 0.59 0.00 -1.47 0.00 0.00 33.84 33.07 1x4y n VAL 9 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1x4y h ALA 10 N 0.00 2.51 -3.64 2.33 0.00 -1.93 -3.04 119.26 115.49 1x4y h ALA 10 Ca 0.00 0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1x4y h ALA 10 Cb 0.70 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 1x4y h ALA 10 CO 0.00 -0.87 -0.95 0.41 0.00 0.00 0.00 179.25 177.84 1x4y n GLY 11 N -1.58 -3.65 3.74 0.00 0.00 -1.26 -4.80 105.19 97.65 1x4y n GLY 11 Ca 0.24 -0.79 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 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 -5.20 1.68 -0.11 1.61 0.04 -1.26 -4.92 135.00 126.84 1x4y s PRO 12 Ca 0.00 0.97 -0.01 0.00 0.04 0.00 0.00 61.00 62.00 1x4y s PRO 12 Cb 0.00 -1.85 0.03 0.00 0.04 0.00 0.00 34.50 32.73 1x4y s PRO 12 CO 0.00 -1.99 -0.02 -0.47 0.04 0.00 0.00 177.00 174.56 1x4y s TYR 13 N -2.92 1.04 -0.01 0.56 5.04 -1.15 -4.51 117.35 115.40 1x4y s TYR 13 Ca 0.62 -0.53 -0.30 0.00 -2.44 0.00 0.00 57.07 54.43 1x4y s TYR 13 Cb -0.18 -1.00 -0.06 0.00 0.35 0.00 0.00 41.96 41.07 1x4y s TYR 13 CO 0.57 -0.45 1.55 0.42 -1.34 0.00 0.00 175.55 176.29 1x4y s ILE 14 N 1.85 3.51 0.00 3.14 1.01 -1.26 -1.78 121.20 127.67 1x4y s ILE 14 Ca 0.03 0.82 0.00 0.00 0.00 0.00 0.00 60.65 61.50 1x4y s ILE 14 Cb -0.13 -3.53 0.00 0.00 0.01 0.00 0.00 42.46 38.81 1x4y s ILE 14 CO -0.07 -0.03 0.94 0.35 0.00 0.00 0.00 174.94 176.13 1x4y n THR 15 N 5.00 0.88 -3.68 2.92 -2.24 -0.94 -4.98 114.28 111.24 1x4y n THR 15 Ca 0.15 -0.92 -0.11 0.00 -2.27 0.00 0.00 64.05 60.91 1x4y n THR 15 Cb 0.43 0.56 -0.11 0.00 -2.10 0.00 0.00 70.33 69.11 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 -0.88 -0.60 -0.19 4.78 2.19 -1.17 -5.00 117.98 117.12 1x4y s PHE 16 Ca 0.00 1.24 -0.04 0.00 0.33 0.00 0.00 56.93 58.46 1x4y s PHE 16 Cb 0.00 0.18 0.09 0.00 -1.31 0.00 0.00 43.02 41.97 1x4y s PHE 16 CO 0.00 -0.38 0.19 0.95 1.83 0.00 0.00 175.22 177.81 1x4y s THR 17 N 2.09 -0.27 -0.10 0.12 -4.23 -1.26 -2.00 115.64 109.99 1x4y s THR 17 Ca -0.04 -0.11 -0.07 0.00 -1.18 0.00 0.00 61.69 60.29 1x4y s THR 17 Cb -0.11 -0.65 0.03 0.00 1.34 0.00 0.00 72.50 73.12 1x4y s THR 17 CO -0.11 -0.21 0.24 -1.81 -0.54 0.00 0.00 174.62 172.19 1x4y s ASP 18 N 2.29 -0.26 -0.32 3.99 1.01 -0.66 -4.95 116.67 117.77 1x4y s ASP 18 Ca 0.06 0.50 -0.29 0.00 0.71 0.00 0.00 52.55 53.53 1x4y s ASP 18 Cb -0.16 0.45 0.01 0.00 1.01 0.00 0.00 42.92 44.23 1x4y s ASP 18 CO -0.11 -0.12 1.22 0.00 0.21 0.00 0.00 175.17 176.37 1x4y s ALA 19 N 0.64 3.39 0.07 5.23 0.00 -1.26 -0.10 121.76 129.73 1x4y s ALA 19 Ca -0.04 0.02 0.23 0.00 0.00 0.00 0.00 51.96 52.17 1x4y s ALA 19 Cb -0.06 -3.75 0.81 0.00 0.00 0.00 0.00 23.12 20.13 1x4y s ALA 19 CO -0.04 -1.71 1.78 0.28 0.00 0.00 0.00 175.76 176.07 1x4y h VAL 20 N 5.91 0.53 -2.62 0.00 2.07 -1.48 -3.46 116.25 117.20 1x4y h VAL 20 Ca -0.24 -1.21 0.13 0.00 0.82 0.00 0.00 66.70 66.20 1x4y h VAL 20 Cb 1.08 1.84 -0.03 0.00 -1.52 0.00 0.00 31.29 32.66 1x4y h VAL 20 CO 1.04 0.23 0.52 0.20 0.02 0.00 0.00 177.57 179.58 1x4y s ASN 21 N -6.20 -0.01 0.39 0.57 0.01 -0.44 -4.90 114.94 104.37 1x4y s ASN 21 Ca 0.01 -0.75 0.28 0.00 -0.71 0.00 0.00 52.86 51.69 1x4y s ASN 21 Cb 0.10 0.57 1.33 0.00 0.41 0.00 0.00 41.25 43.65 1x4y s ASN 21 CO 0.65 -1.12 1.84 1.05 -1.51 0.00 0.00 177.10 178.00 1x4y h GLU 22 N 2.00 0.00 0.00 -0.60 9.09 -1.90 -2.61 114.58 120.56 1x4y h GLU 22 Ca -0.28 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.13 1x4y h GLU 22 Cb 1.22 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.32 1x4y h GLU 22 CO 0.36 0.00 -0.25 0.25 0.05 0.00 0.00 179.01 179.42 1x4y n THR 23 N -2.50 0.50 -3.99 -1.06 -2.24 -1.26 -2.54 114.28 101.19 1x4y n THR 23 Ca -0.00 -0.58 -0.12 0.00 -2.27 0.00 0.00 64.05 61.08 1x4y n THR 23 Cb 0.15 0.44 -0.13 0.00 -2.10 0.00 0.00 70.33 68.69 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 -0.71 0.20 -0.03 4.28 2.01 -1.00 -2.06 115.64 118.33 1x4y s THR 24 Ca 0.07 -0.52 -0.01 0.00 0.31 0.00 0.00 61.69 61.54 1x4y s THR 24 Cb 0.06 -0.25 0.02 0.00 0.01 0.00 0.00 72.50 72.34 1x4y s THR 24 CO 0.01 -0.21 0.06 -0.63 -0.69 0.00 0.00 174.62 173.16 1x4y s ILE 25 N -0.73 -0.04 -0.23 1.82 1.01 -0.15 -1.23 121.20 121.64 1x4y s ILE 25 Ca -0.07 0.15 -0.06 0.00 0.00 0.00 0.00 60.65 60.67 1x4y s ILE 25 Cb -0.05 -0.11 -0.03 0.00 0.01 0.00 0.00 42.46 42.28 1x4y s ILE 25 CO -0.00 0.06 0.04 -0.32 0.00 0.00 0.00 174.94 174.72 1x4y s MET 26 N 0.79 3.62 -0.03 2.79 -2.45 0.86 -0.06 119.30 124.82 1x4y s MET 26 Ca -0.06 -0.50 0.02 0.00 -1.25 0.00 0.00 55.69 53.90 1x4y s MET 26 Cb -0.09 -3.23 0.01 0.00 1.25 0.00 0.00 34.83 32.76 1x4y s MET 26 CO -0.03 -0.14 -0.09 -0.48 1.05 0.00 0.00 175.02 175.33 1x4y s LEU 27 N 1.44 1.75 -0.03 4.11 2.34 -1.03 -1.66 118.68 125.61 1x4y s LEU 27 Ca 0.05 -0.20 0.07 0.00 0.06 0.00 0.00 54.13 54.12 1x4y s LEU 27 Cb -0.15 -0.58 -0.02 0.00 -0.56 0.00 0.00 46.19 44.89 1x4y s LEU 27 CO 0.02 0.06 -0.24 -0.54 -1.06 0.00 0.00 176.35 174.59 1x4y s LYS 28 N 0.27 2.03 0.33 1.48 1.02 -0.85 -2.69 119.74 121.34 1x4y s LYS 28 Ca -0.05 -0.85 0.09 0.00 0.02 0.00 0.00 55.97 55.18 1x4y s LYS 28 Cb -0.10 -1.91 -0.05 0.00 -0.52 0.00 0.00 37.83 35.26 1x4y s LYS 28 CO 0.01 0.48 0.09 1.67 -0.92 0.00 0.00 175.35 176.68 1x4y s TRP 29 N -0.47 2.66 0.32 3.18 -2.14 -1.00 -2.21 118.94 119.28 1x4y s TRP 29 Ca 0.07 -0.38 0.08 0.00 2.66 0.00 0.00 56.10 58.52 1x4y s TRP 29 Cb -0.10 -1.56 -0.06 0.00 -3.10 0.00 0.00 33.47 28.65 1x4y s TRP 29 CO -0.00 0.40 -0.07 0.00 -2.66 0.00 0.00 176.95 174.62 1x4y s MET 30 N -3.79 1.71 -0.04 3.25 0.23 -0.73 -4.86 119.30 115.06 1x4y s MET 30 Ca 0.36 -1.88 0.02 0.00 -1.03 0.00 0.00 55.69 53.16 1x4y s MET 30 Cb -0.02 -1.44 0.01 0.00 -1.53 0.00 0.00 34.83 31.85 1x4y s MET 30 CO 0.21 0.08 -0.07 -0.47 -2.03 0.00 0.00 175.02 172.74 1x4y s TYR 31 N -2.81 0.90 -0.44 3.16 5.04 -1.26 -2.93 117.35 119.02 1x4y s TYR 31 Ca 0.31 -0.26 -0.03 0.00 -2.44 0.00 0.00 57.07 54.66 1x4y s TYR 31 Cb 0.04 -0.70 0.12 0.00 0.35 0.00 0.00 41.96 41.76 1x4y s TYR 31 CO 0.15 -0.16 0.25 0.42 -1.34 0.00 0.00 175.55 174.86 1x4y s ILE 32 N 0.57 3.42 -0.57 3.14 1.09 -1.26 -4.93 121.20 122.65 1x4y s ILE 32 Ca -0.09 -2.15 0.22 0.00 -1.10 0.00 0.00 60.65 57.54 1x4y s ILE 32 Cb -0.12 -3.32 0.22 0.00 -1.06 0.00 0.00 42.46 38.18 1x4y s ILE 32 CO 0.01 -0.72 1.67 -0.81 -0.10 0.00 0.00 174.94 174.98 1x4y n PRO 33 N 4.48 0.16 0.16 2.79 -0.04 -1.26 -3.67 135.00 137.63 1x4y n PRO 33 Ca -0.01 0.40 -0.11 0.00 -0.04 0.00 0.00 63.50 63.74 1x4y n PRO 33 Cb 0.41 -1.81 -0.06 0.00 -0.04 0.00 0.00 33.50 32.00 1x4y n PRO 33 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x4y h ALA 34 N 2.30 -0.97 -0.72 0.55 0.00 -2.06 -2.75 119.26 115.61 1x4y h ALA 34 Ca 0.00 -0.11 -0.46 0.00 0.00 0.00 0.00 54.91 54.34 1x4y h ALA 34 Cb 0.34 0.55 -0.21 0.00 0.00 0.00 0.00 17.79 18.47 1x4y h ALA 34 CO 0.00 -1.00 0.60 0.43 0.00 0.00 0.00 179.25 179.28 1x4y n SER 35 N -4.18 6.23 -4.64 0.00 7.64 -1.24 -4.92 113.62 112.52 1x4y n SER 35 Ca -0.07 -3.35 -0.24 0.00 1.01 0.00 0.00 58.87 56.22 1x4y n SER 35 Cb 0.27 -0.96 -0.08 0.00 -1.01 0.00 0.00 64.21 62.44 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 -0.74 4.54 -0.36 6.43 3.04 -1.04 -4.79 114.94 122.03 1x4y s ASN 36 Ca 0.46 -0.60 0.02 0.00 0.04 0.00 0.00 52.86 52.77 1x4y s ASN 36 Cb 0.36 -0.86 0.43 0.00 -1.54 0.00 0.00 41.25 39.65 1x4y s ASN 36 CO 0.01 0.03 1.75 -3.20 -3.04 0.00 0.00 177.10 172.64 1x4y n ASN 37 N -0.67 4.44 -3.98 -4.21 2.85 -1.26 -4.88 115.26 107.55 1x4y n ASN 37 Ca -0.07 -3.19 -0.31 0.00 -0.11 0.00 0.00 54.58 50.89 1x4y n ASN 37 Cb 0.58 -0.81 -0.07 0.00 1.24 0.00 0.00 39.78 40.71 1x4y n ASN 37 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1x4y n ASN 38 N -0.54 -0.52 -4.84 1.20 4.13 -1.26 -4.88 115.26 108.55 1x4y n ASN 38 Ca 0.43 -1.03 -0.36 0.00 1.68 0.00 0.00 54.58 55.30 1x4y n ASN 38 Cb 1.14 -1.30 -0.07 0.00 -1.54 0.00 0.00 39.78 38.02 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 -3.39 5.26 0.21 3.41 -1.32 -1.26 -5.08 115.64 113.47 1x4y s THR 39 Ca 0.39 0.07 -0.30 0.00 -1.21 0.00 0.00 61.69 60.65 1x4y s THR 39 Cb -0.23 -3.30 -0.09 0.00 -1.51 0.00 0.00 72.50 67.38 1x4y s THR 39 CO 0.83 0.58 1.29 -2.16 -2.21 0.00 0.00 174.62 172.96 1x4y s PRO 40 N -1.10 4.40 -0.12 7.08 0.04 -1.26 -4.96 135.00 139.07 1x4y s PRO 40 Ca 0.16 2.04 -0.06 0.00 0.04 0.00 0.00 61.00 63.18 1x4y s PRO 40 Cb -0.12 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.19 1x4y s PRO 40 CO 0.05 -0.22 0.10 0.42 0.04 0.00 0.00 177.00 177.39 1x4y s ILE 41 N -0.03 5.13 0.09 0.56 1.01 -1.26 -4.58 121.20 122.12 1x4y s ILE 41 Ca 0.55 0.07 -0.17 0.00 0.00 0.00 0.00 60.65 61.10 1x4y s ILE 41 Cb -0.36 -3.23 -0.08 0.00 0.01 0.00 0.00 42.46 38.80 1x4y s ILE 41 CO 0.39 0.59 1.48 0.45 0.00 0.00 0.00 174.94 177.85 1x4y h HIS 42 N 5.34 0.63 0.00 3.97 3.86 -1.63 -3.44 115.15 123.88 1x4y h HIS 42 Ca -0.51 -0.14 0.00 0.00 -1.16 0.00 0.00 60.37 58.56 1x4y h HIS 42 Cb 1.21 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 29.53 1x4y h HIS 42 CO 0.69 0.76 0.00 0.41 0.86 0.00 0.00 177.93 180.66 1x4y n GLY 43 N -0.14 1.88 2.96 2.45 0.00 -1.24 -3.97 105.19 107.14 1x4y n GLY 43 Ca -0.03 -0.16 -0.14 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.18 -0.37 -0.07 1.61 0.08 0.18 -4.04 117.98 115.19 1x4y s PHE 44 Ca 0.00 0.85 -0.12 0.00 0.12 0.00 0.00 56.93 57.78 1x4y s PHE 44 Cb 0.00 -0.10 -0.05 0.00 -0.57 0.00 0.00 43.02 42.30 1x4y s PHE 44 CO 0.00 -0.36 0.31 0.71 -0.10 0.00 0.00 175.22 175.78 1x4y s TYR 45 N 2.39 3.63 -0.10 0.36 2.02 0.54 -0.00 117.35 126.20 1x4y s TYR 45 Ca 0.02 0.78 0.01 0.00 -0.37 0.00 0.00 57.07 57.50 1x4y s TYR 45 Cb -0.12 -2.21 0.02 0.00 -0.40 0.00 0.00 41.96 39.25 1x4y s TYR 45 CO -0.08 0.57 -0.09 0.42 -1.57 0.00 0.00 175.55 174.79 1x4y s ILE 46 N -0.68 1.06 0.05 2.71 1.01 -0.73 -0.29 121.20 124.33 1x4y s ILE 46 Ca 0.20 -0.36 0.02 0.00 0.00 0.00 0.00 60.65 60.51 1x4y s ILE 46 Cb -0.15 -1.04 -0.04 0.00 0.01 0.00 0.00 42.46 41.25 1x4y s ILE 46 CO 0.09 0.36 0.05 -0.31 0.00 0.00 0.00 174.94 175.13 1x4y s TYR 47 N 1.31 3.15 -0.15 3.97 1.51 -0.28 -0.94 117.35 125.92 1x4y s TYR 47 Ca -0.02 0.08 -0.24 0.00 -1.01 0.00 0.00 57.07 55.88 1x4y s TYR 47 Cb -0.14 -1.64 0.06 0.00 -0.11 0.00 0.00 41.96 40.14 1x4y s TYR 47 CO -0.04 0.51 0.61 1.52 -1.11 0.00 0.00 175.55 177.03 1x4y s TYR 48 N -1.28 -0.62 -0.28 2.71 1.13 -1.25 -3.14 117.35 114.62 1x4y s TYR 48 Ca 0.26 1.35 -0.25 0.00 -1.41 0.00 0.00 57.07 57.02 1x4y s TYR 48 Cb -0.12 0.27 0.11 0.00 -1.10 0.00 0.00 41.96 41.12 1x4y s TYR 48 CO 0.18 -0.42 0.97 -0.98 -2.51 0.00 0.00 175.55 172.78 1x4y s ARG 49 N -0.32 0.57 0.47 -3.49 1.04 -1.26 -2.59 118.95 113.37 1x4y s ARG 49 Ca -0.05 0.69 -0.23 0.00 -1.04 0.00 0.00 55.73 55.10 1x4y s ARG 49 Cb -0.03 0.27 -0.07 0.00 -2.04 0.00 0.00 34.95 33.08 1x4y s ARG 49 CO 0.04 -0.07 1.16 -1.25 -0.04 0.00 0.00 175.30 175.14 1x4y s PRO 50 N 0.30 3.72 0.64 3.89 0.04 -1.26 -4.25 135.00 138.08 1x4y s PRO 50 Ca 0.02 1.76 0.31 0.00 0.04 0.00 0.00 61.00 63.13 1x4y s PRO 50 Cb -0.05 -2.37 1.70 0.00 0.04 0.00 0.00 34.50 33.82 1x4y s PRO 50 CO -0.05 -0.58 2.01 0.00 0.04 0.00 0.00 177.00 178.42 1x4y h THR 51 N 1.82 0.16 0.00 1.26 1.03 -1.93 0.42 112.91 115.67 1x4y h THR 51 Ca -0.49 0.00 -0.05 0.00 -0.01 0.00 0.00 66.41 65.85 1x4y h THR 51 Cb 1.25 0.73 -0.01 0.00 -1.07 0.00 0.00 68.15 69.05 1x4y h THR 51 CO 0.60 0.00 -0.26 -0.78 -0.01 0.00 0.00 175.52 175.07 1x4y h ASP 52 N 0.00 0.00 -2.74 0.00 1.82 -1.94 -3.46 116.42 110.11 1x4y h ASP 52 Ca 0.06 0.00 -0.58 0.00 -0.39 0.00 0.00 57.03 56.12 1x4y h ASP 52 Cb 0.65 0.00 0.18 0.00 0.68 0.00 0.00 39.33 40.84 1x4y h ASP 52 CO -0.00 0.26 -0.65 -1.20 -1.61 0.00 0.00 179.24 176.03 1x4y n SER 53 N -3.34 -1.97 0.36 2.28 7.64 0.15 -4.91 113.62 113.82 1x4y n SER 53 Ca 0.01 0.65 -0.17 0.00 1.01 0.00 0.00 58.87 60.37 1x4y n SER 53 Cb 0.49 -1.08 -0.08 0.00 -1.01 0.00 0.00 64.21 62.52 1x4y n SER 53 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1x4y h ASP 54 N -0.03 -0.78 -2.10 6.43 1.82 -1.89 -3.49 116.42 116.39 1x4y h ASP 54 Ca -0.44 -0.01 -0.02 0.00 -0.39 0.00 0.00 57.03 56.17 1x4y h ASP 54 Cb 1.39 0.20 0.00 0.00 0.68 0.00 0.00 39.33 41.61 1x4y h ASP 54 CO 0.43 -0.46 0.14 -0.46 -1.61 0.00 0.00 179.24 177.29 1x4y n ASN 55 N -5.43 -1.24 -0.34 2.28 6.94 -1.26 -5.02 115.26 111.18 1x4y n ASN 55 Ca -0.13 -1.87 0.23 0.00 -0.02 0.00 0.00 54.58 52.79 1x4y n ASN 55 Cb 0.38 2.07 0.49 0.00 -2.36 0.00 0.00 39.78 40.37 1x4y n ASN 55 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 1x4y h ASP 56 N 1.08 0.48 -0.43 0.53 5.19 -1.98 0.22 116.42 121.51 1x4y h ASP 56 Ca -0.18 0.12 0.12 0.00 -0.62 0.00 0.00 57.03 56.47 1x4y h ASP 56 Cb 0.67 0.05 -0.02 0.00 0.18 0.00 0.00 39.33 40.21 1x4y h ASP 56 CO 0.23 0.03 0.92 -1.28 -3.12 0.00 0.00 179.24 176.02 1x4y h SER 57 N 0.39 0.00 0.19 6.45 0.87 -2.01 1.29 113.55 120.74 1x4y h SER 57 Ca 0.65 0.00 -0.30 0.00 -1.23 0.00 0.00 61.79 60.91 1x4y h SER 57 Cb 1.59 0.00 0.03 0.00 -0.44 0.00 0.00 62.40 63.59 1x4y h SER 57 CO -0.39 0.00 -1.29 -0.78 -0.53 0.00 0.00 176.83 173.84 1x4y h ASP 58 N 0.00 0.80 -0.75 6.23 1.82 -0.97 -3.46 116.42 120.09 1x4y h ASP 58 Ca 0.20 -0.89 -0.65 0.00 -0.39 0.00 0.00 57.03 55.31 1x4y h ASP 58 Cb 2.04 -0.26 0.01 0.00 0.68 0.00 0.00 39.33 41.81 1x4y h ASP 58 CO -0.00 1.62 0.45 -1.22 -1.61 0.00 0.00 179.24 178.48 1x4y n TYR 59 N -3.82 1.19 -2.03 0.28 4.01 0.44 -4.91 117.16 112.33 1x4y n TYR 59 Ca -0.15 0.85 -0.13 0.00 -0.16 0.00 0.00 57.90 58.31 1x4y n TYR 59 Cb 1.02 -1.65 0.08 0.00 -0.31 0.00 0.00 39.34 38.47 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 2.71 -0.11 -3.69 -0.72 5.02 -1.07 -4.86 118.16 115.45 1x4y n LYS 60 Ca 0.22 -1.22 -0.13 0.00 -2.02 0.00 0.00 58.31 55.16 1x4y n LYS 60 Cb -0.03 -0.47 -0.13 0.00 -0.02 0.00 0.00 35.03 34.37 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 -4.03 0.16 -0.23 1.97 2.20 -1.25 -3.92 119.74 114.63 1x4y s LYS 61 Ca 0.35 0.65 0.02 0.00 -0.36 0.00 0.00 55.97 56.63 1x4y s LYS 61 Cb -0.02 -0.08 0.05 0.00 -1.51 0.00 0.00 37.83 36.27 1x4y s LYS 61 CO 0.24 -0.24 -0.11 -0.51 -0.36 0.00 0.00 175.35 174.37 1x4y s ASP 62 N 1.98 3.97 0.25 1.43 1.01 -0.12 -4.89 116.67 120.29 1x4y s ASP 62 Ca -0.03 -1.17 -0.30 0.00 0.71 0.00 0.00 52.55 51.77 1x4y s ASP 62 Cb -0.11 -1.40 -0.09 0.00 1.01 0.00 0.00 42.92 42.32 1x4y s ASP 62 CO -0.08 -0.17 1.10 -0.32 0.21 0.00 0.00 175.17 175.91 1x4y s MET 63 N 1.24 4.63 0.01 8.23 1.75 -1.26 -1.77 119.30 132.13 1x4y s MET 63 Ca -0.05 1.77 0.01 0.00 -1.25 0.00 0.00 55.69 56.17 1x4y s MET 63 Cb -0.18 -3.22 -0.01 0.00 2.84 0.00 0.00 34.83 34.26 1x4y s MET 63 CO -0.07 0.17 -0.04 0.08 -0.65 0.00 0.00 175.02 174.52 1x4y s VAL 64 N -0.87 0.27 0.48 10.11 1.01 1.00 -4.92 120.40 127.48 1x4y s VAL 64 Ca 0.46 -0.32 -0.19 0.00 0.00 0.00 0.00 61.98 61.93 1x4y s VAL 64 Cb -0.31 -0.27 -0.15 0.00 0.00 0.00 0.00 36.38 35.65 1x4y s VAL 64 CO 0.39 -0.04 -0.05 -0.62 0.00 0.00 0.00 175.10 174.78 1x4y n GLU 65 N 2.68 0.02 0.20 2.72 -0.58 -1.26 0.51 120.64 124.92 1x4y n GLU 65 Ca -0.15 0.01 0.07 0.00 -0.42 0.00 0.00 57.16 56.67 1x4y n GLU 65 Cb 0.58 -1.02 0.38 0.00 -0.57 0.00 0.00 31.44 30.81 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 0.09 0.00 -0.11 0.62 0.00 -1.82 -2.64 103.07 99.20 1x4y h GLY 66 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1x4y h GLY 66 CO 0.43 0.00 -0.09 1.22 0.00 0.00 0.00 176.54 178.10 1x4y n ASP 67 N -3.54 1.24 -4.71 0.19 9.92 -1.26 -4.84 116.55 113.55 1x4y n ASP 67 Ca -0.00 -1.23 -0.38 0.00 -0.53 0.00 0.00 54.79 52.65 1x4y n ASP 67 Cb 0.47 0.04 -0.06 0.00 -0.64 0.00 0.00 41.12 40.93 1x4y n ASP 67 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1x4y s ARG 68 N -2.19 4.29 -0.06 -1.24 6.06 -0.99 -4.95 118.95 119.87 1x4y s ARG 68 Ca 0.33 0.38 0.10 0.00 -2.50 0.00 0.00 55.73 54.04 1x4y s ARG 68 Cb 0.20 -3.47 0.26 0.00 0.06 0.00 0.00 34.95 32.00 1x4y s ARG 68 CO 0.41 0.09 1.19 0.66 -2.50 0.00 0.00 175.30 175.15 1x4y n TYR 69 N 3.95 0.35 -3.93 5.12 4.02 -1.26 -4.84 117.16 120.57 1x4y n TYR 69 Ca -0.07 -0.65 -0.10 0.00 -0.01 0.00 0.00 57.90 57.06 1x4y n TYR 69 Cb 0.51 -0.11 -0.11 0.00 -0.02 0.00 0.00 39.34 39.61 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 -1.66 0.15 -0.26 -0.72 1.48 -1.26 -2.37 118.94 114.30 1x4y s TRP 70 Ca 0.21 -0.32 -0.16 0.00 -1.06 0.00 0.00 56.10 54.78 1x4y s TRP 70 Cb 0.15 -0.12 0.07 0.00 -1.16 0.00 0.00 33.47 32.42 1x4y s TRP 70 CO 0.08 -0.19 0.64 -1.58 -4.06 0.00 0.00 176.95 171.84 1x4y s HIS 71 N -1.20 -0.96 -0.42 1.66 2.46 -1.09 -5.04 115.29 110.70 1x4y s HIS 71 Ca -0.13 1.96 -0.10 0.00 0.47 0.00 0.00 55.06 57.27 1x4y s HIS 71 Cb -0.08 0.54 0.07 0.00 -0.13 0.00 0.00 32.58 32.98 1x4y s HIS 71 CO -0.00 -0.48 0.26 -1.54 -2.47 0.00 0.00 174.74 170.51 1x4y s SER 72 N 1.46 5.68 0.43 9.88 1.04 -1.26 -2.45 113.70 128.48 1x4y s SER 72 Ca -0.09 -1.46 -0.23 0.00 0.48 0.00 0.00 55.95 54.65 1x4y s SER 72 Cb -0.06 -2.00 -0.08 0.00 0.10 0.00 0.00 66.02 63.98 1x4y s SER 72 CO -0.17 -0.54 1.09 -0.63 0.98 0.00 0.00 173.24 173.98 1x4y s ILE 73 N 1.45 3.49 0.35 -1.02 1.01 0.92 -4.83 121.20 122.57 1x4y s ILE 73 Ca 0.03 1.11 0.04 0.00 0.00 0.00 0.00 60.65 61.84 1x4y s ILE 73 Cb -0.23 -3.56 -0.02 0.00 0.01 0.00 0.00 42.46 38.67 1x4y s ILE 73 CO 0.03 -0.02 0.16 -1.20 0.00 0.00 0.00 174.94 173.90 1x4y n SER 74 N -0.32 0.78 -3.58 3.58 7.64 -1.26 -0.98 113.62 119.48 1x4y n SER 74 Ca 0.06 -2.97 -0.20 0.00 1.01 0.00 0.00 58.87 56.77 1x4y n SER 74 Cb 0.49 1.07 0.05 0.00 -1.01 0.00 0.00 64.21 64.81 1x4y n SER 74 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1x4y n HIS 75 N -0.77 -2.04 -3.89 1.43 8.25 -0.88 -4.93 115.22 112.39 1x4y n HIS 75 Ca -0.02 0.84 -0.17 0.00 -0.26 0.00 0.00 57.72 58.11 1x4y n HIS 75 Cb 0.55 -4.50 -0.01 0.00 1.12 0.00 0.00 29.99 27.16 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 -4.13 0.00 -4.87 2.41 4.77 -1.09 -5.07 117.00 109.02 1x4y n LEU 76 Ca -0.26 -1.86 -0.37 0.00 -0.03 0.00 0.00 56.01 53.48 1x4y n LEU 76 Cb 0.67 0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.72 1x4y n LEU 76 CO 0.65 -0.43 -0.10 -1.10 -1.33 0.00 0.00 177.39 175.09 1x4y s GLN 77 N -3.38 3.56 0.50 3.23 1.11 -1.26 -4.63 119.66 118.79 1x4y s GLN 77 Ca 0.16 0.00 -0.21 0.00 0.01 0.00 0.00 55.36 55.32 1x4y s GLN 77 Cb -0.01 -3.19 -0.07 0.00 -1.01 0.00 0.00 33.01 28.73 1x4y s GLN 77 CO 0.10 0.75 1.15 -1.25 0.01 0.00 0.00 175.29 176.05 1x4y s PRO 78 N -1.09 3.56 -1.29 2.91 0.04 -1.05 -3.41 135.00 134.66 1x4y s PRO 78 Ca 0.18 1.69 -0.13 0.00 0.04 0.00 0.00 61.00 62.78 1x4y s PRO 78 Cb -0.13 -2.21 0.13 0.00 0.04 0.00 0.00 34.50 32.33 1x4y s PRO 78 CO 0.07 -0.70 0.33 -0.85 0.04 0.00 0.00 177.00 175.89 1x4y n GLU 79 N -0.89 -0.83 -3.76 4.56 0.28 0.86 -4.84 120.64 116.02 1x4y n GLU 79 Ca 0.09 0.09 -0.37 0.00 -0.16 0.00 0.00 57.16 56.82 1x4y n GLU 79 Cb 0.49 -3.17 -0.12 0.00 1.43 0.00 0.00 31.44 30.08 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 -2.92 3.44 -0.65 3.84 2.01 -1.22 -4.89 115.64 115.25 1x4y s THR 80 Ca 0.46 -1.80 -0.27 0.00 0.31 0.00 0.00 61.69 60.39 1x4y s THR 80 Cb -0.27 -3.24 0.01 0.00 0.01 0.00 0.00 72.50 69.02 1x4y s THR 80 CO 0.73 -0.55 1.45 -0.55 -0.69 0.00 0.00 174.62 175.01 1x4y s SER 81 N 1.80 5.96 0.14 3.53 0.15 -1.26 -3.91 113.70 120.12 1x4y s SER 81 Ca 0.05 -0.01 0.06 0.00 0.70 0.00 0.00 55.95 56.75 1x4y s SER 81 Cb -0.22 -2.55 -0.04 0.00 -1.71 0.00 0.00 66.02 61.50 1x4y s SER 81 CO -0.02 -1.91 -0.15 -0.72 1.20 0.00 0.00 173.24 171.64 1x4y s TYR 82 N 6.57 1.51 0.58 3.44 -0.85 -1.26 -4.52 117.35 122.81 1x4y s TYR 82 Ca 0.48 -0.56 -0.17 0.00 -0.52 0.00 0.00 57.07 56.30 1x4y s TYR 82 Cb -0.10 -0.77 -0.04 0.00 0.38 0.00 0.00 41.96 41.43 1x4y s TYR 82 CO 0.20 0.20 1.06 -0.51 -1.52 0.00 0.00 175.55 174.98 1x4y s ASP 83 N -2.67 5.82 -0.06 -0.18 1.01 -1.26 -3.54 116.67 115.79 1x4y s ASP 83 Ca 0.13 1.88 -0.03 0.00 0.71 0.00 0.00 52.55 55.24 1x4y s ASP 83 Cb -0.04 -2.54 0.04 0.00 1.01 0.00 0.00 42.92 41.39 1x4y s ASP 83 CO 0.04 -1.14 0.13 -0.63 0.21 0.00 0.00 175.17 173.78 1x4y s ILE 84 N -2.30 -0.05 0.13 0.77 1.01 -0.36 -4.18 121.20 116.23 1x4y s ILE 84 Ca 0.65 0.18 -0.04 0.00 0.00 0.00 0.00 60.65 61.44 1x4y s ILE 84 Cb -0.17 -0.22 -0.03 0.00 0.01 0.00 0.00 42.46 42.05 1x4y s ILE 84 CO 0.33 0.07 0.14 -1.59 0.00 0.00 0.00 174.94 173.90 1x4y s LYS 85 N 1.13 0.97 0.32 2.79 -2.85 -1.19 -0.62 119.74 120.29 1x4y s LYS 85 Ca -0.09 -1.28 -0.01 0.00 -1.00 0.00 0.00 55.97 53.58 1x4y s LYS 85 Cb -0.11 0.30 -0.01 0.00 -2.06 0.00 0.00 37.83 35.94 1x4y s LYS 85 CO -0.05 -0.31 0.40 0.00 0.10 0.00 0.00 175.35 175.49 1x4y s MET 86 N -3.99 1.78 -0.21 1.78 0.23 -1.26 -1.13 119.30 116.50 1x4y s MET 86 Ca 0.18 -1.75 -0.28 0.00 -1.03 0.00 0.00 55.69 52.82 1x4y s MET 86 Cb 0.06 0.41 0.11 0.00 -1.53 0.00 0.00 34.83 33.88 1x4y s MET 86 CO -0.01 -0.71 0.95 -1.14 -2.03 0.00 0.00 175.02 172.08 1x4y s GLN 87 N -3.33 0.63 0.15 3.16 0.74 0.60 -1.13 119.66 120.49 1x4y s GLN 87 Ca 0.33 0.42 0.03 0.00 0.05 0.00 0.00 55.36 56.19 1x4y s GLN 87 Cb 0.01 0.30 -0.04 0.00 1.10 0.00 0.00 33.01 34.39 1x4y s GLN 87 CO 0.20 -0.14 0.23 0.00 -0.55 0.00 0.00 175.29 175.02 1x4y s PHE 89 N -1.73 1.43 0.05 0.00 -0.71 -1.26 -1.15 117.98 114.61 1x4y s PHE 89 Ca 0.33 -1.49 -0.28 0.00 -1.04 0.00 0.00 56.93 54.45 1x4y s PHE 89 Cb -0.11 -0.64 0.10 0.00 -1.21 0.00 0.00 43.02 41.15 1x4y s PHE 89 CO 0.27 -0.72 1.13 0.54 -1.34 0.00 0.00 175.22 175.09 1x4y s ASN 90 N -3.26 -0.13 0.32 1.98 4.22 -0.35 -1.56 114.94 116.17 1x4y s ASN 90 Ca 0.40 -0.24 0.20 0.00 -2.14 0.00 0.00 52.86 51.08 1x4y s ASN 90 Cb 0.05 0.31 1.15 0.00 1.28 0.00 0.00 41.25 44.04 1x4y s ASN 90 CO 0.19 -0.57 1.30 -1.84 -2.04 0.00 0.00 177.10 174.14 1x4y n GLU 91 N -0.45 -0.04 -0.11 3.55 0.28 -1.26 0.17 120.64 122.77 1x4y n GLU 91 Ca -0.07 1.11 -0.10 0.00 -0.16 0.00 0.00 57.16 57.94 1x4y n GLU 91 Cb 0.62 -2.05 -0.02 0.00 1.43 0.00 0.00 31.44 31.41 1x4y n GLU 91 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 1x4y h GLY 92 N 0.00 0.60 0.00 -1.84 0.00 -1.91 -3.48 103.07 96.44 1x4y h GLY 92 Ca 0.71 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.64 1x4y h GLY 92 CO -0.56 0.37 0.00 0.61 0.00 0.00 0.00 176.54 176.96 1x4y n GLY 93 N -0.48 -0.77 3.87 4.60 0.00 0.45 -4.47 105.19 108.38 1x4y n GLY 93 Ca -0.02 -1.36 -0.31 0.00 0.00 0.00 0.00 46.02 44.34 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 -2.00 3.84 0.33 1.61 2.02 -1.26 -1.21 118.70 122.02 1x4y s GLU 94 Ca 0.00 0.43 0.03 0.00 0.02 0.00 0.00 54.97 55.45 1x4y s GLU 94 Cb 0.00 -2.50 0.06 0.00 0.10 0.00 0.00 34.13 31.79 1x4y s GLU 94 CO 0.00 0.14 0.45 -1.13 0.02 0.00 0.00 175.26 174.74 1x4y n SER 95 N -0.67 0.94 -4.74 -0.19 3.41 -0.30 -4.81 113.62 107.25 1x4y n SER 95 Ca 0.02 -1.71 -0.31 0.00 -0.26 0.00 0.00 58.87 56.60 1x4y n SER 95 Cb 0.53 -0.26 0.11 0.00 -0.26 0.00 0.00 64.21 64.33 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 -3.51 1.89 -0.33 4.33 0.41 -1.15 -4.84 118.70 115.49 1x4y s GLU 96 Ca 0.32 1.19 -0.29 0.00 -0.41 0.00 0.00 54.97 55.79 1x4y s GLU 96 Cb -0.02 -1.85 0.01 0.00 -1.78 0.00 0.00 34.13 30.49 1x4y s GLU 96 CO 0.21 -1.91 1.16 -0.06 -0.49 0.00 0.00 175.26 174.17 1x4y s PHE 97 N -2.86 2.95 1.04 1.61 0.40 -1.26 -4.66 117.98 115.20 1x4y s PHE 97 Ca 0.62 1.03 -0.16 0.00 -0.60 0.00 0.00 56.93 57.82 1x4y s PHE 97 Cb -0.18 -3.86 0.06 0.00 0.51 0.00 0.00 43.02 39.55 1x4y s PHE 97 CO 0.57 -1.15 0.11 0.45 0.70 0.00 0.00 175.22 175.90 1x4y n SER 98 N 7.24 -2.38 -4.62 1.36 2.88 -0.29 -4.92 113.62 112.88 1x4y n SER 98 Ca 0.13 0.09 -0.30 0.00 -1.33 0.00 0.00 58.87 57.45 1x4y n SER 98 Cb 0.47 -1.05 0.19 0.00 -0.75 0.00 0.00 64.21 63.07 1x4y n SER 98 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1x4y s ASN 99 N -1.87 2.39 -0.39 -3.46 6.03 -1.26 -4.64 114.94 111.74 1x4y s ASN 99 Ca 0.55 1.99 -0.18 0.00 -1.03 0.00 0.00 52.86 54.19 1x4y s ASN 99 Cb -0.15 -2.49 0.01 0.00 -3.03 0.00 0.00 41.25 35.58 1x4y s ASN 99 CO 0.67 -3.40 0.50 -0.69 -2.03 0.00 0.00 177.10 172.15 1x4y s VAL 100 N -2.60 5.02 -0.25 3.54 1.01 -1.26 -4.52 120.40 121.34 1x4y s VAL 100 Ca 0.67 0.03 -0.08 0.00 0.00 0.00 0.00 61.98 62.60 1x4y s VAL 100 Cb -0.23 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.09 1x4y s VAL 100 CO 0.60 -0.35 0.08 -0.04 0.00 0.00 0.00 175.10 175.39 1x4y s MET 101 N 2.36 3.72 -0.63 2.72 -1.94 0.20 -4.88 119.30 120.86 1x4y s MET 101 Ca 0.17 -0.45 -0.22 0.00 -1.71 0.00 0.00 55.69 53.48 1x4y s MET 101 Cb -0.16 -3.36 0.07 0.00 2.01 0.00 0.00 34.83 33.40 1x4y s MET 101 CO 0.14 -0.15 0.89 0.42 -0.01 0.00 0.00 175.02 176.32 1x4y s ILE 102 N 1.52 4.46 -0.36 2.53 1.01 -1.26 -1.22 121.20 127.88 1x4y s ILE 102 Ca 0.06 -0.43 -0.07 0.00 0.00 0.00 0.00 60.65 60.21 1x4y s ILE 102 Cb -0.15 -4.61 0.05 0.00 0.01 0.00 0.00 42.46 37.76 1x4y s ILE 102 CO 0.04 -1.33 0.14 0.00 0.00 0.00 0.00 174.94 173.79 1x4y s GLU 104 N 1.39 4.50 1.23 0.00 2.12 -1.26 -4.35 118.70 122.34 1x4y s GLU 104 Ca -0.00 1.45 -0.21 0.00 0.36 0.00 0.00 54.97 56.58 1x4y s GLU 104 Cb -0.20 -3.48 0.30 0.00 0.26 0.00 0.00 34.13 31.01 1x4y s GLU 104 CO 0.02 -0.16 1.13 0.95 -0.54 0.00 0.00 175.26 176.67 1x4y s THR 105 N 1.34 1.54 0.36 -1.70 -4.23 -1.25 -4.43 115.64 107.27 1x4y s THR 105 Ca 0.52 0.00 -0.11 0.00 -1.18 0.00 0.00 61.69 60.92 1x4y s THR 105 Cb -0.21 -2.53 -0.07 0.00 1.34 0.00 0.00 72.50 71.03 1x4y s THR 105 CO 0.25 0.00 0.73 -0.54 -0.54 0.00 0.00 174.62 174.52 1x4y s LYS 106 N -5.55 3.83 0.11 3.99 -0.14 -1.14 -4.04 119.74 116.80 1x4y s LYS 106 Ca 0.73 0.47 -0.30 0.00 -1.36 0.00 0.00 55.97 55.51 1x4y s LYS 106 Cb -0.07 -2.44 -0.06 0.00 -1.68 0.00 0.00 37.83 33.58 1x4y s LYS 106 CO 0.55 0.07 1.09 0.00 -0.76 0.00 0.00 175.35 176.30 1x4y s ALA 107 N -2.20 3.32 -1.24 5.17 0.00 -1.26 -0.09 121.76 125.46 1x4y s ALA 107 Ca 0.51 0.74 -0.20 0.00 0.00 0.00 0.00 51.96 53.02 1x4y s ALA 107 Cb -0.10 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 1x4y s ALA 107 CO 0.26 -0.24 1.85 2.89 0.00 0.00 0.00 175.76 180.52 1x4y n ARG 108 N 3.09 2.46 -5.22 0.00 1.85 -1.26 -4.86 116.66 112.71 1x4y n ARG 108 Ca 0.05 -2.87 -0.31 0.00 -1.00 0.00 0.00 57.85 53.71 1x4y n ARG 108 Cb 0.47 -3.57 -0.16 0.00 -1.05 0.00 0.00 32.46 28.16 1x4y n ARG 108 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1x4y s SER 109 N 5.16 3.24 0.39 2.89 0.15 -1.26 -5.05 113.70 119.23 1x4y s SER 109 Ca 0.60 -0.43 0.00 0.00 0.70 0.00 0.00 55.95 56.82 1x4y s SER 109 Cb 0.03 -0.51 0.00 0.00 -1.71 0.00 0.00 66.02 63.83 1x4y s SER 109 CO 0.10 0.31 0.00 0.61 1.20 0.00 0.00 173.24 175.46 1x4y n GLY 110 N 2.50 -3.24 3.71 9.45 0.00 -1.26 -4.82 105.19 111.52 1x4y n GLY 110 Ca -0.16 -1.15 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 1x4y n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4y s PRO 111 N -4.10 4.33 -0.18 1.61 0.04 -1.26 -4.94 135.00 130.49 1x4y s PRO 111 Ca 0.00 2.03 -0.29 0.00 0.04 0.00 0.00 61.00 62.79 1x4y s PRO 111 Cb 0.00 -3.31 -0.05 0.00 0.04 0.00 0.00 34.50 31.19 1x4y s PRO 111 CO 0.00 -0.44 1.94 -1.54 0.04 0.00 0.00 177.00 177.00 1x4y s SER 112 N 1.22 5.98 -0.24 6.66 1.04 -1.26 -4.94 113.70 122.16 1x4y s SER 112 Ca 0.64 1.89 -0.03 0.00 0.48 0.00 0.00 55.95 58.93 1x4y s SER 112 Cb -0.35 -2.52 0.13 0.00 0.10 0.00 0.00 66.02 63.37 1x4y s SER 112 CO 0.30 -1.54 0.36 -0.55 0.98 0.00 0.00 173.24 172.79 1x4y s SER 113 N 6.04 0.40 0.00 7.02 0.15 -1.26 -5.28 113.70 120.77 1x4y s SER 113 Ca 0.87 0.14 0.00 0.00 0.70 0.00 0.00 55.95 57.65 1x4y s SER 113 Cb -0.31 1.02 0.00 0.00 -1.71 0.00 0.00 66.02 65.02 1x4y s SER 113 CO 0.35 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 175.09