#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 0.01 -3.30 1.61 7.64 -1.26 -5.07 113.62 113.25 1x4y n SER 2 Ca 0.00 0.01 -0.02 0.00 1.01 0.00 0.00 58.87 59.87 1x4y n SER 2 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 1x4y n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1x4y s SER 3 N -5.01 -0.71 -0.21 6.43 0.15 -1.26 -5.03 113.70 108.06 1x4y s SER 3 Ca 0.00 0.71 0.18 0.00 0.70 0.00 0.00 55.95 57.54 1x4y s SER 3 Cb 0.00 1.75 0.41 0.00 -1.71 0.00 0.00 66.02 66.46 1x4y s SER 3 CO 0.00 -0.27 1.23 0.61 1.20 0.00 0.00 173.24 176.02 1x4y n GLY 4 N 5.41 1.57 1.53 9.45 0.00 -1.26 -4.93 105.19 116.95 1x4y n GLY 4 Ca -0.03 -0.64 -0.05 0.00 0.00 0.00 0.00 46.02 45.29 1x4y n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x4y n SER 5 N -0.62 5.06 -4.40 1.61 3.41 -1.26 -4.92 113.62 112.50 1x4y n SER 5 Ca -0.05 -2.54 -0.49 0.00 -0.26 0.00 0.00 58.87 55.53 1x4y n SER 5 Cb 0.87 -0.96 -0.13 0.00 -0.26 0.00 0.00 64.21 63.73 1x4y n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1x4y n SER 6 N 0.87 0.67 -0.22 4.04 7.64 -1.26 -4.43 113.62 120.92 1x4y n SER 6 Ca 0.10 0.37 0.03 0.00 1.01 0.00 0.00 58.87 60.38 1x4y n SER 6 Cb 0.57 -0.96 -0.01 0.00 -1.01 0.00 0.00 64.21 62.80 1x4y n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4y n GLY 7 N 6.89 -1.88 3.76 0.23 0.00 -1.26 -4.25 105.19 108.66 1x4y n GLY 7 Ca 0.59 -1.45 -0.41 0.00 0.00 0.00 0.00 46.02 44.75 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 -1.95 4.45 0.00 1.61 0.04 -1.26 -4.87 135.00 133.02 1x4y s PRO 8 Ca 0.00 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.10 1x4y s PRO 8 Cb 0.00 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.40 1x4y s PRO 8 CO 0.00 -0.09 0.00 1.33 0.04 0.00 0.00 177.00 178.28 1x4y n VAL 9 N 1.37 0.00 -0.44 -0.36 0.24 -1.26 -3.04 118.33 114.84 1x4y n VAL 9 Ca 0.01 0.00 0.38 0.00 -2.04 0.00 0.00 64.34 62.69 1x4y n VAL 9 Cb 0.43 -0.60 0.65 0.00 -1.47 0.00 0.00 33.84 32.85 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 -2.42 1.29 -1.51 2.33 0.00 -1.26 -0.10 120.51 118.83 1x4y n ALA 10 Ca 0.00 0.87 0.07 0.00 0.00 0.00 0.00 53.44 54.38 1x4y n ALA 10 Cb 0.39 -1.03 -0.04 0.00 0.00 0.00 0.00 19.45 18.77 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 -1.47 -3.57 3.75 0.00 0.00 -1.26 -4.65 105.19 97.98 1x4y n GLY 11 Ca 0.39 -0.86 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 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 -4.97 1.83 -0.17 1.61 0.04 -1.26 -4.94 135.00 127.14 1x4y s PRO 12 Ca 0.00 1.03 -0.02 0.00 0.04 0.00 0.00 61.00 62.05 1x4y s PRO 12 Cb 0.00 -1.86 0.05 0.00 0.04 0.00 0.00 34.50 32.73 1x4y s PRO 12 CO 0.00 -1.90 0.02 -0.47 0.04 0.00 0.00 177.00 174.69 1x4y s TYR 13 N -2.91 1.07 0.02 0.56 5.04 -1.10 -4.46 117.35 115.57 1x4y s TYR 13 Ca 0.62 -0.78 -0.30 0.00 -2.44 0.00 0.00 57.07 54.17 1x4y s TYR 13 Cb -0.18 -1.03 -0.08 0.00 0.35 0.00 0.00 41.96 41.02 1x4y s TYR 13 CO 0.56 -0.57 1.87 0.42 -1.34 0.00 0.00 175.55 176.50 1x4y s ILE 14 N 1.84 3.15 -0.14 3.14 1.01 -1.26 -2.16 121.20 126.78 1x4y s ILE 14 Ca 0.00 0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.89 1x4y s ILE 14 Cb -0.16 -3.14 0.03 0.00 0.01 0.00 0.00 42.46 39.19 1x4y s ILE 14 CO -0.07 -0.02 0.83 0.35 0.00 0.00 0.00 174.94 176.03 1x4y n THR 15 N 5.47 0.59 -3.65 2.92 -2.24 -1.02 -4.97 114.28 111.37 1x4y n THR 15 Ca 0.19 -0.80 -0.09 0.00 -2.27 0.00 0.00 64.05 61.09 1x4y n THR 15 Cb 0.41 0.72 -0.10 0.00 -2.10 0.00 0.00 70.33 69.26 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 -0.64 -0.77 -0.16 4.78 2.19 -1.18 -5.02 117.98 117.18 1x4y s PHE 16 Ca 0.02 1.47 -0.04 0.00 0.33 0.00 0.00 56.93 58.71 1x4y s PHE 16 Cb 0.01 0.27 0.06 0.00 -1.31 0.00 0.00 43.02 42.05 1x4y s PHE 16 CO 0.02 -0.48 0.08 0.95 1.83 0.00 0.00 175.22 177.62 1x4y s THR 17 N 2.60 -0.03 0.01 0.12 -4.23 -1.26 -1.29 115.64 111.56 1x4y s THR 17 Ca -0.01 -0.14 0.00 0.00 -1.18 0.00 0.00 61.69 60.36 1x4y s THR 17 Cb -0.12 -0.57 -0.01 0.00 1.34 0.00 0.00 72.50 73.14 1x4y s THR 17 CO -0.12 -0.22 -0.01 1.51 -0.54 0.00 0.00 174.62 175.23 1x4y s ASP 18 N 2.11 0.11 -0.25 3.99 -4.77 -0.14 -4.94 116.67 112.79 1x4y s ASP 18 Ca 0.02 -0.15 -0.26 0.00 -3.30 0.00 0.00 52.55 48.86 1x4y s ASP 18 Cb -0.16 0.02 0.00 0.00 -1.09 0.00 0.00 42.92 41.70 1x4y s ASP 18 CO -0.08 -0.08 0.91 0.00 0.70 0.00 0.00 175.17 176.62 1x4y s ALA 19 N -0.42 3.64 -0.15 2.11 0.00 -1.26 0.26 121.76 125.94 1x4y s ALA 19 Ca -0.04 -0.05 0.15 0.00 0.00 0.00 0.00 51.96 52.02 1x4y s ALA 19 Cb -0.03 -3.40 0.04 0.00 0.00 0.00 0.00 23.12 19.73 1x4y s ALA 19 CO -0.00 -1.02 1.38 0.28 0.00 0.00 0.00 175.76 176.40 1x4y h VAL 20 N 5.47 0.85 -2.22 0.00 2.07 -1.73 -3.46 116.25 117.22 1x4y h VAL 20 Ca -0.22 -2.22 0.06 0.00 0.82 0.00 0.00 66.70 65.14 1x4y h VAL 20 Cb 1.08 2.39 -0.01 0.00 -1.52 0.00 0.00 31.29 33.24 1x4y h VAL 20 CO 0.92 0.48 0.27 0.59 0.02 0.00 0.00 177.57 179.85 1x4y n ASN 21 N -3.19 -1.02 0.22 0.57 3.02 -0.48 -4.92 115.26 109.46 1x4y n ASN 21 Ca 0.01 -1.59 0.10 0.00 -0.03 0.00 0.00 54.58 53.07 1x4y n ASN 21 Cb 0.75 1.67 0.46 0.00 -0.61 0.00 0.00 39.78 42.04 1x4y n ASN 21 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 1x4y h GLU 22 N 0.00 0.00 0.00 3.52 9.09 -1.89 -2.25 114.58 123.05 1x4y h GLU 22 Ca -0.16 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.25 1x4y h GLU 22 Cb 0.65 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.75 1x4y h GLU 22 CO 0.20 0.24 -0.07 0.25 0.05 0.00 0.00 179.01 179.68 1x4y n THR 23 N -3.43 1.14 -4.00 -1.06 -2.24 -1.26 -2.44 114.28 100.99 1x4y n THR 23 Ca -0.00 -1.30 -0.12 0.00 -2.27 0.00 0.00 64.05 60.36 1x4y n THR 23 Cb 0.43 0.24 -0.12 0.00 -2.10 0.00 0.00 70.33 68.77 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 -1.56 0.22 -0.03 4.28 2.01 -1.18 -1.70 115.64 117.68 1x4y s THR 24 Ca 0.14 -0.58 -0.02 0.00 0.31 0.00 0.00 61.69 61.54 1x4y s THR 24 Cb 0.12 -0.28 0.02 0.00 0.01 0.00 0.00 72.50 72.37 1x4y s THR 24 CO 0.01 -0.23 0.07 -0.63 -0.69 0.00 0.00 174.62 173.15 1x4y s ILE 25 N -0.81 -0.03 -0.22 1.82 1.01 -0.42 -1.39 121.20 121.17 1x4y s ILE 25 Ca -0.07 0.10 -0.07 0.00 0.00 0.00 0.00 60.65 60.61 1x4y s ILE 25 Cb -0.06 -0.13 -0.03 0.00 0.01 0.00 0.00 42.46 42.25 1x4y s ILE 25 CO -0.00 0.04 0.07 -0.32 0.00 0.00 0.00 174.94 174.73 1x4y s MET 26 N 0.59 3.80 -0.03 2.79 -2.45 0.14 0.82 119.30 124.96 1x4y s MET 26 Ca -0.05 -0.42 0.01 0.00 -1.25 0.00 0.00 55.69 53.99 1x4y s MET 26 Cb -0.06 -3.29 0.01 0.00 1.25 0.00 0.00 34.83 32.74 1x4y s MET 26 CO -0.02 0.01 -0.04 -0.48 1.05 0.00 0.00 175.02 175.54 1x4y s LEU 27 N 1.09 1.54 -0.02 4.11 2.34 -0.75 -0.96 118.68 126.03 1x4y s LEU 27 Ca 0.04 -0.10 0.08 0.00 0.06 0.00 0.00 54.13 54.21 1x4y s LEU 27 Cb -0.14 -0.35 -0.02 0.00 -0.56 0.00 0.00 46.19 45.12 1x4y s LEU 27 CO 0.03 -0.02 -0.25 -0.54 -1.06 0.00 0.00 176.35 174.51 1x4y s LYS 28 N 0.56 2.12 0.27 1.48 1.02 -0.41 -2.62 119.74 122.16 1x4y s LYS 28 Ca -0.07 -0.91 0.09 0.00 0.02 0.00 0.00 55.97 55.11 1x4y s LYS 28 Cb -0.10 -2.02 -0.04 0.00 -0.52 0.00 0.00 37.83 35.15 1x4y s LYS 28 CO -0.00 0.53 0.00 1.67 -0.92 0.00 0.00 175.35 176.63 1x4y s TRP 29 N -0.55 2.69 0.27 3.18 -2.14 -1.06 -2.44 118.94 118.89 1x4y s TRP 29 Ca 0.08 -0.24 0.10 0.00 2.66 0.00 0.00 56.10 58.71 1x4y s TRP 29 Cb -0.10 -1.23 -0.05 0.00 -3.10 0.00 0.00 33.47 28.99 1x4y s TRP 29 CO -0.00 0.60 -0.17 0.00 -2.66 0.00 0.00 176.95 174.72 1x4y s MET 30 N -3.68 1.61 0.01 3.25 0.23 -0.92 -4.82 119.30 114.97 1x4y s MET 30 Ca 0.32 -1.75 0.03 0.00 -1.03 0.00 0.00 55.69 53.26 1x4y s MET 30 Cb -0.06 -1.57 -0.01 0.00 -1.53 0.00 0.00 34.83 31.66 1x4y s MET 30 CO 0.20 0.26 -0.09 -0.47 -2.03 0.00 0.00 175.02 172.89 1x4y s TYR 31 N -2.66 0.79 -0.16 3.16 6.14 -1.26 -2.70 117.35 120.66 1x4y s TYR 31 Ca 0.28 -0.21 0.01 0.00 0.64 0.00 0.00 57.07 57.79 1x4y s TYR 31 Cb -0.03 -0.50 0.02 0.00 0.42 0.00 0.00 41.96 41.88 1x4y s TYR 31 CO 0.13 -0.01 -0.18 0.42 0.64 0.00 0.00 175.55 176.55 1x4y s ILE 32 N -0.43 1.85 0.28 3.14 1.09 -1.26 -5.01 121.20 120.87 1x4y s ILE 32 Ca 0.01 -0.82 0.07 0.00 -1.10 0.00 0.00 60.65 58.81 1x4y s ILE 32 Cb -0.05 -1.69 0.02 0.00 -1.06 0.00 0.00 42.46 39.68 1x4y s ILE 32 CO 0.00 0.51 1.67 1.55 -0.10 0.00 0.00 174.94 178.57 1x4y h PRO 33 N 7.83 0.21 0.00 2.79 0.13 -2.01 -3.35 132.00 137.61 1x4y h PRO 33 Ca -0.40 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1x4y h PRO 33 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1x4y h PRO 33 CO 0.58 0.64 0.00 0.00 -0.23 0.00 0.00 178.00 178.99 1x4y n ALA 34 N -2.47 0.00 -1.37 -0.56 0.00 -1.26 -0.75 120.51 114.10 1x4y n ALA 34 Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.19 1x4y n ALA 34 Cb 0.52 0.38 -0.08 0.00 0.00 0.00 0.00 19.45 20.27 1x4y n ALA 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1x4y n SER 35 N -2.27 6.19 -4.29 0.00 2.88 -1.26 -4.89 113.62 109.98 1x4y n SER 35 Ca 0.00 -3.04 -0.27 0.00 -1.33 0.00 0.00 58.87 54.23 1x4y n SER 35 Cb 0.00 -1.27 -0.14 0.00 -0.75 0.00 0.00 64.21 62.05 1x4y n SER 35 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1x4y s ASN 36 N 0.73 2.74 -0.23 -3.46 2.47 0.07 -4.62 114.94 112.64 1x4y s ASN 36 Ca 0.60 -0.59 0.02 0.00 0.42 0.00 0.00 52.86 53.31 1x4y s ASN 36 Cb 0.37 -0.22 0.32 0.00 -1.45 0.00 0.00 41.25 40.26 1x4y s ASN 36 CO -0.17 0.17 1.50 0.59 -3.72 0.00 0.00 177.10 175.47 1x4y n ASN 37 N 1.63 3.64 -4.20 -4.21 3.02 -1.26 -4.85 115.26 109.02 1x4y n ASN 37 Ca -0.18 -2.81 -0.37 0.00 -0.03 0.00 0.00 54.58 51.20 1x4y n ASN 37 Cb 0.53 -0.70 -0.07 0.00 -0.61 0.00 0.00 39.78 38.93 1x4y n ASN 37 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1x4y n ASN 38 N -0.25 -1.27 -4.73 6.41 2.85 -1.26 -4.89 115.26 112.13 1x4y n ASN 38 Ca 0.29 -1.12 -0.35 0.00 -0.11 0.00 0.00 54.58 53.29 1x4y n ASN 38 Cb 1.03 -1.42 -0.09 0.00 1.24 0.00 0.00 39.78 40.54 1x4y n ASN 38 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 1x4y s THR 39 N -3.18 4.56 0.11 -0.44 -1.32 -1.26 -5.08 115.64 109.03 1x4y s THR 39 Ca 0.64 -0.18 -0.31 0.00 -1.21 0.00 0.00 61.69 60.63 1x4y s THR 39 Cb -0.37 -2.95 -0.08 0.00 -1.51 0.00 0.00 72.50 67.59 1x4y s THR 39 CO 0.91 0.58 1.36 -2.16 -2.21 0.00 0.00 174.62 173.11 1x4y s PRO 40 N -0.99 4.34 0.02 7.08 0.04 -1.26 -4.99 135.00 139.25 1x4y s PRO 40 Ca 0.14 2.03 -0.18 0.00 0.04 0.00 0.00 61.00 63.04 1x4y s PRO 40 Cb -0.11 -3.26 -0.06 0.00 0.04 0.00 0.00 34.50 31.11 1x4y s PRO 40 CO 0.04 -0.40 0.50 0.42 0.04 0.00 0.00 177.00 177.59 1x4y s ILE 41 N 1.05 4.90 0.09 0.56 1.01 -1.26 -4.64 121.20 122.90 1x4y s ILE 41 Ca 0.63 1.06 -0.14 0.00 0.00 0.00 0.00 60.65 62.20 1x4y s ILE 41 Cb -0.36 -3.82 -0.14 0.00 0.01 0.00 0.00 42.46 38.15 1x4y s ILE 41 CO 0.30 0.54 1.32 0.45 0.00 0.00 0.00 174.94 177.55 1x4y h HIS 42 N 4.85 0.94 0.00 3.97 3.86 -1.79 -3.41 115.15 123.58 1x4y h HIS 42 Ca -0.49 -0.38 0.00 0.00 -1.16 0.00 0.00 60.37 58.34 1x4y h HIS 42 Cb 1.21 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 29.52 1x4y h HIS 42 CO 0.68 1.18 0.00 0.41 0.86 0.00 0.00 177.93 181.07 1x4y n GLY 43 N 0.55 1.65 2.97 2.45 0.00 -1.25 -3.55 105.19 108.03 1x4y n GLY 43 Ca -0.06 -0.30 -0.14 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.94 -0.34 -0.13 1.61 0.08 0.63 -4.04 117.98 114.85 1x4y s PHE 44 Ca 0.00 0.84 -0.10 0.00 0.12 0.00 0.00 56.93 57.79 1x4y s PHE 44 Cb 0.00 -0.08 -0.05 0.00 -0.57 0.00 0.00 43.02 42.33 1x4y s PHE 44 CO 0.00 -0.31 0.19 0.71 -0.10 0.00 0.00 175.22 175.71 1x4y s TYR 45 N 2.13 3.55 -0.14 0.36 2.02 -0.05 0.58 117.35 125.80 1x4y s TYR 45 Ca -0.01 0.54 0.00 0.00 -0.37 0.00 0.00 57.07 57.24 1x4y s TYR 45 Cb -0.12 -2.09 0.02 0.00 -0.40 0.00 0.00 41.96 39.38 1x4y s TYR 45 CO -0.08 0.55 -0.13 0.42 -1.57 0.00 0.00 175.55 174.75 1x4y s ILE 46 N -0.50 1.47 0.09 2.71 1.01 -0.11 -0.24 121.20 125.63 1x4y s ILE 46 Ca 0.14 -0.57 0.04 0.00 0.00 0.00 0.00 60.65 60.26 1x4y s ILE 46 Cb -0.12 -1.40 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 1x4y s ILE 46 CO 0.04 0.44 0.05 -0.31 0.00 0.00 0.00 174.94 175.16 1x4y s TYR 47 N 1.52 3.11 -0.24 3.97 1.51 -0.25 -0.51 117.35 126.46 1x4y s TYR 47 Ca 0.05 0.03 -0.22 0.00 -1.01 0.00 0.00 57.07 55.92 1x4y s TYR 47 Cb -0.13 -1.58 0.06 0.00 -0.11 0.00 0.00 41.96 40.20 1x4y s TYR 47 CO -0.10 0.51 0.65 1.52 -1.11 0.00 0.00 175.55 177.01 1x4y s TYR 48 N -1.38 -0.71 -0.16 2.71 1.13 -1.25 -2.34 117.35 115.35 1x4y s TYR 48 Ca 0.28 1.74 -0.17 0.00 -1.41 0.00 0.00 57.07 57.50 1x4y s TYR 48 Cb -0.12 0.25 0.05 0.00 -1.10 0.00 0.00 41.96 41.03 1x4y s TYR 48 CO 0.21 -0.34 0.48 -0.98 -2.51 0.00 0.00 175.55 172.40 1x4y s ARG 49 N 0.35 0.59 0.51 -3.49 1.04 -1.24 -2.41 118.95 114.30 1x4y s ARG 49 Ca -0.00 0.60 -0.21 0.00 -1.04 0.00 0.00 55.73 55.08 1x4y s ARG 49 Cb -0.05 0.28 -0.06 0.00 -2.04 0.00 0.00 34.95 33.08 1x4y s ARG 49 CO 0.01 -0.08 1.14 -1.25 -0.04 0.00 0.00 175.30 175.07 1x4y s PRO 50 N 0.10 3.50 0.58 3.89 0.04 -1.26 -3.69 135.00 138.15 1x4y s PRO 50 Ca -0.01 1.66 0.28 0.00 0.04 0.00 0.00 61.00 62.97 1x4y s PRO 50 Cb -0.03 -2.14 1.65 0.00 0.04 0.00 0.00 34.50 34.01 1x4y s PRO 50 CO 0.01 -0.74 2.14 0.00 0.04 0.00 0.00 177.00 178.45 1x4y h THR 51 N 1.43 0.55 0.00 1.26 1.03 -1.93 0.24 112.91 115.49 1x4y h THR 51 Ca -0.50 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.90 1x4y h THR 51 Cb 1.26 0.89 0.00 0.00 -1.07 0.00 0.00 68.15 69.22 1x4y h THR 51 CO 0.58 0.00 0.00 -0.78 -0.01 0.00 0.00 175.52 175.31 1x4y h ASP 52 N 0.00 0.00 -1.94 0.00 1.82 -1.93 -3.45 116.42 110.92 1x4y h ASP 52 Ca 0.07 0.00 -0.23 0.00 -0.39 0.00 0.00 57.03 56.48 1x4y h ASP 52 Cb 0.36 0.00 0.13 0.00 0.68 0.00 0.00 39.33 40.50 1x4y h ASP 52 CO -0.00 0.00 -0.34 -1.20 -1.61 0.00 0.00 179.24 176.09 1x4y n SER 53 N -2.39 -2.96 0.01 2.28 7.64 0.86 -5.01 113.62 114.05 1x4y n SER 53 Ca 0.03 -0.36 -0.03 0.00 1.01 0.00 0.00 58.87 59.52 1x4y n SER 53 Cb 0.33 -0.76 -0.01 0.00 -1.01 0.00 0.00 64.21 62.76 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 -1.09 0.98 -2.74 6.43 -0.08 -1.26 -5.06 116.55 113.73 1x4y n ASP 54 Ca 0.05 0.14 -0.14 0.00 -1.51 0.00 0.00 54.79 53.33 1x4y n ASP 54 Cb 0.36 -0.33 -0.04 0.00 2.34 0.00 0.00 41.12 43.45 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 -3.53 -0.93 -0.01 1.67 6.94 -1.26 -5.00 115.26 113.14 1x4y n ASN 55 Ca -0.04 -2.67 0.23 0.00 -0.02 0.00 0.00 54.58 52.07 1x4y n ASN 55 Cb 0.23 1.84 0.63 0.00 -2.36 0.00 0.00 39.78 40.12 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 1.67 0.00 -0.08 0.53 5.19 -2.00 0.33 116.42 122.06 1x4y h ASP 56 Ca -0.21 0.00 0.02 0.00 -0.62 0.00 0.00 57.03 56.22 1x4y h ASP 56 Cb 0.99 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.50 1x4y h ASP 56 CO 0.30 0.00 0.66 -1.28 -3.12 0.00 0.00 179.24 175.80 1x4y h SER 57 N 0.00 0.00 0.01 6.45 0.87 -2.04 0.89 113.55 119.73 1x4y h SER 57 Ca 0.30 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.55 1x4y h SER 57 Cb 1.78 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.70 1x4y h SER 57 CO -0.00 0.00 -1.69 0.47 -0.53 0.00 0.00 176.83 175.08 1x4y n ASP 58 N -2.79 1.90 -3.97 6.23 9.92 0.11 -4.93 116.55 123.02 1x4y n ASP 58 Ca 0.01 0.38 -0.57 0.00 -0.53 0.00 0.00 54.79 54.07 1x4y n ASP 58 Cb 0.71 -0.91 -0.08 0.00 -0.64 0.00 0.00 41.12 40.20 1x4y n ASP 58 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 1x4y n TYR 59 N -4.31 1.46 -2.31 1.24 4.01 0.30 -4.84 117.16 112.72 1x4y n TYR 59 Ca -0.39 0.95 -0.11 0.00 -0.16 0.00 0.00 57.90 58.19 1x4y n TYR 59 Cb 0.77 -1.87 0.06 0.00 -0.31 0.00 0.00 39.34 37.99 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 3.42 0.17 -3.71 -0.72 5.02 -1.01 -4.85 118.16 116.49 1x4y n LYS 60 Ca 0.26 -1.27 -0.12 0.00 -2.02 0.00 0.00 58.31 55.16 1x4y n LYS 60 Cb -0.05 -0.36 -0.13 0.00 -0.02 0.00 0.00 35.03 34.48 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 -3.77 0.21 -0.22 1.97 2.20 -1.24 -3.87 119.74 115.01 1x4y s LYS 61 Ca 0.32 0.62 0.01 0.00 -0.36 0.00 0.00 55.97 56.57 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 0.22 -0.20 -0.10 -0.51 -0.36 0.00 0.00 175.35 174.40 1x4y s ASP 62 N 1.62 3.81 0.22 1.43 1.11 0.34 -4.86 116.67 120.33 1x4y s ASP 62 Ca -0.06 -1.10 -0.30 0.00 0.18 0.00 0.00 52.55 51.27 1x4y s ASP 62 Cb -0.11 -1.32 -0.08 0.00 1.07 0.00 0.00 42.92 42.48 1x4y s ASP 62 CO -0.09 -0.18 1.00 -0.32 1.18 0.00 0.00 175.17 176.76 1x4y s MET 63 N 1.31 4.75 -0.02 8.23 1.75 -1.26 -0.94 119.30 133.13 1x4y s MET 63 Ca -0.04 1.58 -0.05 0.00 -1.25 0.00 0.00 55.69 55.93 1x4y s MET 63 Cb -0.18 -3.28 0.00 0.00 2.84 0.00 0.00 34.83 34.22 1x4y s MET 63 CO -0.07 0.34 0.11 0.08 -0.65 0.00 0.00 175.02 174.83 1x4y s VAL 64 N -0.84 0.04 0.42 10.11 1.01 0.20 -4.90 120.40 126.44 1x4y s VAL 64 Ca 0.44 -0.37 -0.13 0.00 0.00 0.00 0.00 61.98 61.91 1x4y s VAL 64 Cb -0.27 -0.28 -0.11 0.00 0.00 0.00 0.00 36.38 35.71 1x4y s VAL 64 CO 0.34 -0.20 -0.15 -0.62 0.00 0.00 0.00 175.10 174.47 1x4y n GLU 65 N 2.26 0.00 0.00 2.72 -0.58 -1.26 0.23 120.64 124.01 1x4y n GLU 65 Ca -0.18 0.00 0.14 0.00 -0.42 0.00 0.00 57.16 56.70 1x4y n GLU 65 Cb 0.57 -0.75 0.84 0.00 -0.57 0.00 0.00 31.44 31.53 1x4y n GLU 65 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1x4y n GLY 66 N 1.97 -0.99 0.00 0.62 0.00 -1.23 -3.10 105.19 102.46 1x4y n GLY 66 Ca 0.05 -0.18 0.02 0.00 0.00 0.00 0.00 46.02 45.92 1x4y n GLY 66 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1x4y n ASP 67 N -0.95 2.29 -4.73 1.61 8.00 -1.26 -4.80 116.55 116.72 1x4y n ASP 67 Ca 0.21 -0.27 -0.41 0.00 0.71 0.00 0.00 54.79 55.03 1x4y n ASP 67 Cb 0.10 1.10 -0.04 0.00 -0.02 0.00 0.00 41.12 42.26 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 -1.87 4.53 -0.09 -1.24 6.06 -1.18 -4.93 118.95 120.22 1x4y s ARG 68 Ca -0.00 1.73 0.13 0.00 -2.50 0.00 0.00 55.73 55.09 1x4y s ARG 68 Cb 0.03 -3.31 0.23 0.00 0.06 0.00 0.00 34.95 31.96 1x4y s ARG 68 CO 0.17 -0.06 1.14 0.66 -2.50 0.00 0.00 175.30 174.70 1x4y n TYR 69 N 3.00 0.10 -3.82 5.12 4.02 -1.26 -4.88 117.16 119.44 1x4y n TYR 69 Ca 0.05 -0.83 -0.12 0.00 -0.01 0.00 0.00 57.90 56.99 1x4y n TYR 69 Cb 0.46 -0.13 -0.12 0.00 -0.02 0.00 0.00 39.34 39.53 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 -2.28 -0.15 -0.24 -0.72 1.48 -1.26 -2.55 118.94 113.22 1x4y s TRP 70 Ca 0.24 0.35 -0.23 0.00 -1.06 0.00 0.00 56.10 55.40 1x4y s TRP 70 Cb 0.20 0.04 0.06 0.00 -1.16 0.00 0.00 33.47 32.62 1x4y s TRP 70 CO 0.03 -0.13 0.67 -1.58 -4.06 0.00 0.00 176.95 171.88 1x4y s HIS 71 N -0.19 -0.73 -0.32 1.66 2.46 -1.08 -5.04 115.29 112.05 1x4y s HIS 71 Ca -0.03 1.77 -0.02 0.00 0.47 0.00 0.00 55.06 57.24 1x4y s HIS 71 Cb -0.02 0.25 0.06 0.00 -0.13 0.00 0.00 32.58 32.74 1x4y s HIS 71 CO 0.01 -0.36 0.04 -1.54 -2.47 0.00 0.00 174.74 170.41 1x4y s SER 72 N 0.31 4.98 0.71 9.88 1.04 -1.26 -1.80 113.70 127.56 1x4y s SER 72 Ca -0.00 -1.36 -0.13 0.00 0.48 0.00 0.00 55.95 54.94 1x4y s SER 72 Cb -0.05 -1.74 0.02 0.00 0.10 0.00 0.00 66.02 64.36 1x4y s SER 72 CO 0.01 -0.30 1.09 -0.63 0.98 0.00 0.00 173.24 174.39 1x4y s ILE 73 N 1.25 3.37 0.28 -1.02 1.01 0.24 -4.81 121.20 121.53 1x4y s ILE 73 Ca -0.03 0.54 0.02 0.00 0.00 0.00 0.00 60.65 61.18 1x4y s ILE 73 Cb -0.20 -3.06 -0.01 0.00 0.01 0.00 0.00 42.46 39.20 1x4y s ILE 73 CO -0.01 -0.49 0.33 -1.20 0.00 0.00 0.00 174.94 173.57 1x4y n SER 74 N -2.93 -0.89 -3.63 3.58 7.64 -1.26 -1.30 113.62 114.84 1x4y n SER 74 Ca 0.09 -2.68 -0.22 0.00 1.01 0.00 0.00 58.87 57.07 1x4y n SER 74 Cb 0.53 1.79 0.06 0.00 -1.01 0.00 0.00 64.21 65.57 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 -0.50 -2.22 -4.12 1.43 8.25 -0.69 -4.91 115.22 112.47 1x4y n HIS 75 Ca 0.03 0.91 -0.28 0.00 -0.26 0.00 0.00 57.72 58.12 1x4y n HIS 75 Cb 0.49 -4.67 -0.02 0.00 1.12 0.00 0.00 29.99 26.91 1x4y n HIS 75 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1x4y s LEU 76 N -6.77 2.57 0.06 2.41 1.43 -1.05 -5.06 118.68 112.26 1x4y s LEU 76 Ca 0.20 -1.37 -0.13 0.00 -1.03 0.00 0.00 54.13 51.79 1x4y s LEU 76 Cb -0.09 -1.05 -0.06 0.00 0.03 0.00 0.00 46.19 45.02 1x4y s LEU 76 CO 0.77 -1.06 0.45 -1.10 0.23 0.00 0.00 176.35 175.64 1x4y s GLN 77 N -4.19 3.90 0.48 1.70 -0.21 -1.26 -4.48 119.66 115.60 1x4y s GLN 77 Ca 0.26 0.37 -0.22 0.00 0.02 0.00 0.00 55.36 55.79 1x4y s GLN 77 Cb -0.01 -3.09 -0.07 0.00 1.00 0.00 0.00 33.01 30.84 1x4y s GLN 77 CO 0.16 0.60 1.15 -1.25 -2.12 0.00 0.00 175.29 173.83 1x4y s PRO 78 N -1.54 3.64 -1.22 2.91 0.04 -1.02 -3.46 135.00 134.35 1x4y s PRO 78 Ca 0.30 1.73 -0.09 0.00 0.04 0.00 0.00 61.00 62.98 1x4y s PRO 78 Cb -0.16 -2.29 0.09 0.00 0.04 0.00 0.00 34.50 32.19 1x4y s PRO 78 CO 0.17 -0.64 0.22 -0.85 0.04 0.00 0.00 177.00 175.94 1x4y n GLU 79 N -0.73 -0.87 -3.84 4.56 0.28 0.62 -4.85 120.64 115.82 1x4y n GLU 79 Ca 0.09 0.08 -0.35 0.00 -0.16 0.00 0.00 57.16 56.81 1x4y n GLU 79 Cb 0.49 -2.95 -0.13 0.00 1.43 0.00 0.00 31.44 30.29 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 -3.24 3.13 -0.58 3.84 2.01 -1.22 -4.89 115.64 114.70 1x4y s THR 80 Ca 0.31 -1.80 -0.27 0.00 0.31 0.00 0.00 61.69 60.24 1x4y s THR 80 Cb -0.18 -3.02 0.00 0.00 0.01 0.00 0.00 72.50 69.31 1x4y s THR 80 CO 0.72 -0.46 1.56 -0.55 -0.69 0.00 0.00 174.62 175.19 1x4y s SER 81 N 1.54 5.87 0.15 3.53 0.15 -1.26 -3.92 113.70 119.76 1x4y s SER 81 Ca 0.03 0.30 0.06 0.00 0.70 0.00 0.00 55.95 57.04 1x4y s SER 81 Cb -0.21 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.51 1x4y s SER 81 CO -0.03 -1.91 -0.13 -0.72 1.20 0.00 0.00 173.24 171.66 1x4y s TYR 82 N 6.92 1.42 0.53 3.44 -0.85 -1.26 -4.46 117.35 123.09 1x4y s TYR 82 Ca 0.57 -0.64 -0.18 0.00 -0.52 0.00 0.00 57.07 56.30 1x4y s TYR 82 Cb -0.12 -0.71 -0.07 0.00 0.38 0.00 0.00 41.96 41.44 1x4y s TYR 82 CO 0.23 0.18 1.03 0.16 -1.52 0.00 0.00 175.55 175.63 1x4y s ASP 83 N -2.98 6.24 -0.08 -0.18 1.47 -1.24 -3.59 116.67 116.32 1x4y s ASP 83 Ca 0.16 1.79 -0.04 0.00 1.18 0.00 0.00 52.55 55.63 1x4y s ASP 83 Cb -0.01 -2.54 0.04 0.00 -0.34 0.00 0.00 42.92 40.07 1x4y s ASP 83 CO 0.03 -0.85 0.18 -0.63 0.68 0.00 0.00 175.17 174.58 1x4y s ILE 84 N -2.32 -0.04 0.29 2.11 1.01 -0.06 -3.67 121.20 118.52 1x4y s ILE 84 Ca 0.64 0.13 -0.02 0.00 0.00 0.00 0.00 60.65 61.40 1x4y s ILE 84 Cb -0.14 -0.28 -0.02 0.00 0.01 0.00 0.00 42.46 42.03 1x4y s ILE 84 CO 0.28 0.05 0.34 -1.59 0.00 0.00 0.00 174.94 174.03 1x4y s LYS 85 N 0.98 1.63 0.35 2.79 -2.85 -0.99 -0.61 119.74 121.05 1x4y s LYS 85 Ca -0.07 -1.70 -0.13 0.00 -1.00 0.00 0.00 55.97 53.06 1x4y s LYS 85 Cb -0.09 0.38 0.03 0.00 -2.06 0.00 0.00 37.83 36.09 1x4y s LYS 85 CO -0.05 -0.63 0.69 0.00 0.10 0.00 0.00 175.35 175.46 1x4y s MET 86 N -3.60 2.06 -0.24 1.78 0.23 -1.26 -1.09 119.30 117.17 1x4y s MET 86 Ca 0.34 -1.43 -0.27 0.00 -1.03 0.00 0.00 55.69 53.30 1x4y s MET 86 Cb 0.02 0.57 0.12 0.00 -1.53 0.00 0.00 34.83 34.02 1x4y s MET 86 CO 0.18 -0.93 1.03 -1.14 -2.03 0.00 0.00 175.02 172.13 1x4y s GLN 87 N -2.81 0.52 0.44 3.16 0.74 0.67 -2.31 119.66 120.08 1x4y s GLN 87 Ca 0.19 0.45 0.03 0.00 0.05 0.00 0.00 55.36 56.08 1x4y s GLN 87 Cb -0.04 0.25 0.01 0.00 1.10 0.00 0.00 33.01 34.33 1x4y s GLN 87 CO 0.13 -0.10 0.63 0.00 -0.55 0.00 0.00 175.29 175.40 1x4y s PHE 89 N -2.48 0.22 0.18 0.00 -0.71 -1.26 -0.33 117.98 113.61 1x4y s PHE 89 Ca 0.51 -0.57 -0.22 0.00 -1.04 0.00 0.00 56.93 55.61 1x4y s PHE 89 Cb -0.10 0.19 0.06 0.00 -1.21 0.00 0.00 43.02 41.96 1x4y s PHE 89 CO 0.35 -0.90 0.61 1.21 -1.34 0.00 0.00 175.22 175.15 1x4y s ASN 90 N -2.96 -0.47 0.33 1.98 2.47 -1.12 -2.14 114.94 113.03 1x4y s ASN 90 Ca 0.17 -0.17 0.25 0.00 0.42 0.00 0.00 52.86 53.53 1x4y s ASN 90 Cb 0.00 0.62 1.11 0.00 -1.45 0.00 0.00 41.25 41.53 1x4y s ASN 90 CO 0.03 -1.05 1.15 1.21 -3.72 0.00 0.00 177.10 174.72 1x4y n GLU 91 N -0.39 -0.02 0.11 0.43 4.07 -1.26 -0.44 120.64 123.14 1x4y n GLU 91 Ca -0.14 0.91 -0.05 0.00 -0.06 0.00 0.00 57.16 57.82 1x4y n GLU 91 Cb 0.64 -1.82 -0.02 0.00 -0.06 0.00 0.00 31.44 30.18 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 -0.33 -2.90 8.31 0.00 -1.92 -3.50 103.07 102.73 1x4y h GLY 92 Ca 0.65 0.12 0.32 0.00 0.00 0.00 0.00 47.33 48.42 1x4y h GLY 92 CO -0.31 -0.12 0.83 -0.32 0.00 0.00 0.00 176.54 176.62 1x4y s GLY 93 N -2.00 -0.40 0.44 4.60 0.00 0.42 -4.75 107.32 105.63 1x4y s GLY 93 Ca -0.05 0.81 -0.23 0.00 0.00 0.00 0.00 44.72 45.25 1x4y s GLY 93 CO 0.14 0.17 1.13 -0.54 0.00 0.00 0.00 173.10 174.00 1x4y s GLU 94 N -2.42 3.89 0.59 2.90 2.02 -1.26 -2.79 118.70 121.62 1x4y s GLU 94 Ca 0.14 1.69 -0.09 0.00 0.02 0.00 0.00 54.97 56.73 1x4y s GLU 94 Cb 0.04 -2.45 0.13 0.00 0.10 0.00 0.00 34.13 31.96 1x4y s GLU 94 CO -0.04 -0.42 0.80 -1.13 0.02 0.00 0.00 175.26 174.49 1x4y n SER 95 N -0.36 0.15 -4.73 -0.19 3.41 0.56 -4.76 113.62 107.70 1x4y n SER 95 Ca 0.07 -1.35 -0.30 0.00 -0.26 0.00 0.00 58.87 57.03 1x4y n SER 95 Cb 0.49 -0.60 0.14 0.00 -0.26 0.00 0.00 64.21 63.97 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 -4.71 1.24 -0.24 4.33 2.02 0.85 -4.83 118.70 117.36 1x4y s GLU 96 Ca 0.46 0.71 -0.29 0.00 0.02 0.00 0.00 54.97 55.88 1x4y s GLU 96 Cb -0.01 -1.82 0.01 0.00 0.10 0.00 0.00 34.13 32.41 1x4y s GLU 96 CO 0.32 -2.23 1.04 -0.06 0.02 0.00 0.00 175.26 174.35 1x4y s PHE 97 N -2.99 3.31 1.38 1.61 0.40 -1.26 -4.65 117.98 115.78 1x4y s PHE 97 Ca 0.63 1.42 -0.21 0.00 -0.60 0.00 0.00 56.93 58.17 1x4y s PHE 97 Cb -0.17 -3.32 0.35 0.00 0.51 0.00 0.00 43.02 40.39 1x4y s PHE 97 CO 0.56 -0.52 0.87 -1.13 0.70 0.00 0.00 175.22 175.71 1x4y n SER 98 N 6.38 -3.49 -4.82 1.36 3.41 -0.98 -4.98 113.62 110.51 1x4y n SER 98 Ca 0.12 -0.66 -0.31 0.00 -0.26 0.00 0.00 58.87 57.76 1x4y n SER 98 Cb 0.46 -1.06 0.04 0.00 -0.26 0.00 0.00 64.21 63.39 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 -2.82 5.52 -0.29 4.04 6.03 -1.26 -4.80 114.94 121.36 1x4y s ASN 99 Ca 0.66 1.61 -0.22 0.00 -1.03 0.00 0.00 52.86 53.89 1x4y s ASN 99 Cb -0.16 -2.50 -0.01 0.00 -3.03 0.00 0.00 41.25 35.56 1x4y s ASN 99 CO 0.59 -1.35 0.70 -0.69 -2.03 0.00 0.00 177.10 174.32 1x4y s VAL 100 N -3.00 4.89 -0.22 3.54 1.01 -1.26 -4.58 120.40 120.78 1x4y s VAL 100 Ca 0.58 1.11 -0.05 0.00 0.00 0.00 0.00 61.98 63.62 1x4y s VAL 100 Cb -0.14 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 1x4y s VAL 100 CO 0.53 -0.13 -0.02 -0.04 0.00 0.00 0.00 175.10 175.44 1x4y s MET 101 N 2.72 3.48 -0.66 2.72 1.00 0.23 -4.91 119.30 123.88 1x4y s MET 101 Ca 0.29 -0.58 -0.19 0.00 0.00 0.00 0.00 55.69 55.21 1x4y s MET 101 Cb -0.15 -3.06 0.11 0.00 0.00 0.00 0.00 34.83 31.73 1x4y s MET 101 CO 0.11 -0.13 0.79 0.42 0.00 0.00 0.00 175.02 176.21 1x4y s ILE 102 N 1.35 4.82 -0.40 2.53 1.01 -1.26 -0.88 121.20 128.37 1x4y s ILE 102 Ca 0.04 -1.12 -0.08 0.00 0.00 0.00 0.00 60.65 59.50 1x4y s ILE 102 Cb -0.14 -4.55 0.07 0.00 0.01 0.00 0.00 42.46 37.85 1x4y s ILE 102 CO -0.01 -1.21 0.21 0.00 0.00 0.00 0.00 174.94 173.94 1x4y s GLU 104 N 1.39 4.36 1.07 0.00 2.12 -1.26 -4.44 118.70 121.93 1x4y s GLU 104 Ca 0.02 1.72 -0.18 0.00 0.36 0.00 0.00 54.97 56.89 1x4y s GLU 104 Cb -0.22 -3.53 0.27 0.00 0.26 0.00 0.00 34.13 30.91 1x4y s GLU 104 CO 0.02 -0.43 0.78 0.25 -0.54 0.00 0.00 175.26 175.34 1x4y n THR 105 N 4.51 0.00 -3.27 -1.70 -2.24 -1.25 -4.54 114.28 105.79 1x4y n THR 105 Ca 0.11 -0.20 -0.30 0.00 -2.27 0.00 0.00 64.05 61.39 1x4y n THR 105 Cb 0.46 -0.99 -0.04 0.00 -2.10 0.00 0.00 70.33 67.66 1x4y n THR 105 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1x4y s LYS 106 N -4.81 3.72 0.06 -0.78 -0.14 -0.85 -4.16 119.74 112.77 1x4y s LYS 106 Ca 0.55 0.18 -0.31 0.00 -1.36 0.00 0.00 55.97 55.04 1x4y s LYS 106 Cb -0.07 -2.60 -0.06 0.00 -1.68 0.00 0.00 37.83 33.43 1x4y s LYS 106 CO 0.44 0.20 1.19 0.00 -0.76 0.00 0.00 175.35 176.42 1x4y s ALA 107 N -2.05 3.38 0.45 5.17 0.00 -1.26 -0.27 121.76 127.18 1x4y s ALA 107 Ca 0.46 0.84 -0.21 0.00 0.00 0.00 0.00 51.96 53.06 1x4y s ALA 107 Cb -0.11 -3.44 -0.10 0.00 0.00 0.00 0.00 23.12 19.47 1x4y s ALA 107 CO 0.27 -0.43 0.98 -0.98 0.00 0.00 0.00 175.76 175.60 1x4y s ARG 108 N 1.07 4.10 -0.84 0.00 1.70 -1.26 -4.85 118.95 118.87 1x4y s ARG 108 Ca 0.59 1.18 -0.21 0.00 -0.47 0.00 0.00 55.73 56.82 1x4y s ARG 108 Cb -0.29 -2.16 0.09 0.00 -0.57 0.00 0.00 34.95 32.03 1x4y s ARG 108 CO 0.29 -0.15 1.12 -1.12 -1.08 0.00 0.00 175.30 174.37 1x4y s SER 109 N -2.15 6.43 0.44 -2.89 0.01 -1.26 -4.99 113.70 109.29 1x4y s SER 109 Ca 0.63 -1.52 0.03 0.00 1.31 0.00 0.00 55.95 56.40 1x4y s SER 109 Cb -0.11 -2.44 -0.03 0.00 0.21 0.00 0.00 66.02 63.65 1x4y s SER 109 CO 0.15 -1.30 0.06 -0.83 0.41 0.00 0.00 173.24 171.74 1x4y s GLY 110 N 3.86 2.71 0.61 3.44 0.00 -1.26 -5.14 107.32 111.53 1x4y s GLY 110 Ca 0.31 -1.08 -0.17 0.00 0.00 0.00 0.00 44.72 43.78 1x4y s GLY 110 CO -0.02 -1.99 1.12 2.56 0.00 0.00 0.00 173.10 174.77 1x4y s PRO 111 N -3.79 3.05 -0.15 2.90 0.04 -1.26 -5.05 135.00 130.74 1x4y s PRO 111 Ca 0.19 1.49 0.00 0.00 0.04 0.00 0.00 61.00 62.72 1x4y s PRO 111 Cb 0.03 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.63 1x4y s PRO 111 CO 0.11 -1.07 -0.10 -1.54 0.04 0.00 0.00 177.00 174.43 1x4y s SER 112 N -2.22 2.70 -0.13 6.66 1.04 -1.26 -5.12 113.70 115.37 1x4y s SER 112 Ca 0.70 -0.54 -0.05 0.00 0.48 0.00 0.00 55.95 56.54 1x4y s SER 112 Cb -0.22 -1.05 -0.04 0.00 0.10 0.00 0.00 66.02 64.81 1x4y s SER 112 CO 0.35 -0.11 0.04 -0.55 0.98 0.00 0.00 173.24 173.94 1x4y s SER 113 N 1.56 5.46 0.00 7.02 0.15 -1.26 -5.37 113.70 121.26 1x4y s SER 113 Ca 0.03 0.13 0.00 0.00 0.70 0.00 0.00 55.95 56.81 1x4y s SER 113 Cb -0.14 -1.77 0.00 0.00 -1.71 0.00 0.00 66.02 62.40 1x4y s SER 113 CO -0.09 0.28 0.00 0.61 1.20 0.00 0.00 173.24 175.24