#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 1.09 0.19 1.61 1.04 -1.26 -5.12 113.70 111.26 1x4y s SER 2 Ca 0.00 -0.09 -0.31 0.00 0.48 0.00 0.00 55.95 56.03 1x4y s SER 2 Cb 0.00 -0.41 -0.16 0.00 0.10 0.00 0.00 66.02 65.55 1x4y s SER 2 CO 0.00 -0.11 0.95 -1.54 0.98 0.00 0.00 173.24 173.52 1x4y n SER 3 N 4.46 0.56 0.00 7.02 3.41 -1.26 -4.90 113.62 122.91 1x4y n SER 3 Ca -0.19 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.57 1x4y n SER 3 Cb 0.50 -1.14 0.00 0.00 -0.26 0.00 0.00 64.21 63.31 1x4y n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x4y n GLY 4 N 1.76 0.59 3.26 5.00 0.00 -1.26 -4.98 105.19 109.56 1x4y n GLY 4 Ca 0.15 -0.03 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 1x4y n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x4y n SER 5 N 0.00 -2.13 -4.49 1.61 7.64 -1.26 -4.81 113.62 110.18 1x4y n SER 5 Ca 0.00 -0.21 -0.43 0.00 1.01 0.00 0.00 58.87 59.23 1x4y n SER 5 Cb 0.00 -1.86 -0.02 0.00 -1.01 0.00 0.00 64.21 61.33 1x4y n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x4y s SER 6 N -2.52 6.76 0.00 6.43 0.01 -1.26 -4.86 113.70 118.26 1x4y s SER 6 Ca 0.32 -2.26 0.00 0.00 1.31 0.00 0.00 55.95 55.33 1x4y s SER 6 Cb -0.18 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.59 1x4y s SER 6 CO 0.40 -1.07 0.00 0.61 0.41 0.00 0.00 173.24 173.59 1x4y n GLY 7 N 5.34 3.81 3.71 3.44 0.00 -1.26 -4.22 105.19 116.01 1x4y n GLY 7 Ca 0.32 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.68 4.32 -0.09 1.61 0.04 -1.26 -4.92 135.00 132.02 1x4y s PRO 8 Ca 0.00 2.03 -0.02 0.00 0.04 0.00 0.00 61.00 63.05 1x4y s PRO 8 Cb 0.00 -3.35 -0.05 0.00 0.04 0.00 0.00 34.50 31.14 1x4y s PRO 8 CO 0.00 -0.46 -0.10 1.33 0.04 0.00 0.00 177.00 177.81 1x4y n VAL 9 N 4.15 0.50 -0.33 -0.36 0.24 -1.26 -3.70 118.33 117.57 1x4y n VAL 9 Ca 0.12 -0.16 0.18 0.00 -2.04 0.00 0.00 64.34 62.44 1x4y n VAL 9 Cb 0.43 -1.18 0.36 0.00 -1.47 0.00 0.00 33.84 31.98 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 -0.15 1.42 -2.52 2.33 0.00 -1.91 -2.78 119.26 115.64 1x4y h ALA 10 Ca -0.21 0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1x4y h ALA 10 Cb 1.26 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.54 1x4y h ALA 10 CO -0.08 -0.64 -0.65 0.41 0.00 0.00 0.00 179.25 178.28 1x4y n GLY 11 N -1.42 -3.71 3.75 0.00 0.00 -1.26 -4.71 105.19 97.83 1x4y n GLY 11 Ca 0.26 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 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 -4.90 1.82 -0.03 1.61 0.04 -1.26 -4.86 135.00 127.40 1x4y s PRO 12 Ca 0.00 1.02 0.01 0.00 0.04 0.00 0.00 61.00 62.07 1x4y s PRO 12 Cb 0.00 -1.86 0.02 0.00 0.04 0.00 0.00 34.50 32.70 1x4y s PRO 12 CO 0.00 -1.91 -0.05 -0.47 0.04 0.00 0.00 177.00 174.62 1x4y s TYR 13 N -2.92 0.69 -0.01 0.56 5.04 -1.00 -4.31 117.35 115.41 1x4y s TYR 13 Ca 0.62 -0.17 -0.30 0.00 -2.44 0.00 0.00 57.07 54.78 1x4y s TYR 13 Cb -0.17 -0.59 -0.05 0.00 0.35 0.00 0.00 41.96 41.50 1x4y s TYR 13 CO 0.56 -0.14 1.25 0.42 -1.34 0.00 0.00 175.55 176.31 1x4y s ILE 14 N 0.66 4.04 0.00 3.14 1.01 -1.26 -0.73 121.20 128.06 1x4y s ILE 14 Ca -0.09 1.41 0.00 0.00 0.00 0.00 0.00 60.65 61.98 1x4y s ILE 14 Cb -0.12 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.44 1x4y s ILE 14 CO 0.00 0.03 0.75 0.35 0.00 0.00 0.00 174.94 176.07 1x4y n THR 15 N 4.44 0.54 -3.66 2.92 -2.24 -0.86 -4.96 114.28 110.46 1x4y n THR 15 Ca 0.11 -0.73 -0.06 0.00 -2.27 0.00 0.00 64.05 61.10 1x4y n THR 15 Cb 0.45 0.76 -0.08 0.00 -2.10 0.00 0.00 70.33 69.37 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 -0.54 -0.97 -0.17 4.78 2.19 -1.16 -5.01 117.98 117.11 1x4y s PHE 16 Ca 0.00 1.81 -0.05 0.00 0.33 0.00 0.00 56.93 59.02 1x4y s PHE 16 Cb 0.00 0.49 0.06 0.00 -1.31 0.00 0.00 43.02 42.26 1x4y s PHE 16 CO 0.00 -0.52 0.09 0.95 1.83 0.00 0.00 175.22 177.57 1x4y s THR 17 N 2.38 -0.08 0.03 0.12 -4.23 -1.26 -1.50 115.64 111.10 1x4y s THR 17 Ca -0.05 -0.17 0.00 0.00 -1.18 0.00 0.00 61.69 60.30 1x4y s THR 17 Cb -0.10 -0.58 -0.02 0.00 1.34 0.00 0.00 72.50 73.13 1x4y s THR 17 CO -0.16 -0.28 -0.04 -1.81 -0.54 0.00 0.00 174.62 171.80 1x4y s ASP 18 N 2.13 0.42 -0.39 3.99 1.01 -0.66 -4.95 116.67 118.23 1x4y s ASP 18 Ca 0.02 -0.60 -0.19 0.00 0.71 0.00 0.00 52.55 52.49 1x4y s ASP 18 Cb -0.16 0.10 0.01 0.00 1.01 0.00 0.00 42.92 43.88 1x4y s ASP 18 CO -0.09 -0.33 0.53 0.00 0.21 0.00 0.00 175.17 175.49 1x4y s ALA 19 N -1.88 3.42 0.25 5.23 0.00 -1.26 -0.22 121.76 127.31 1x4y s ALA 19 Ca -0.11 -1.19 0.12 0.00 0.00 0.00 0.00 51.96 50.79 1x4y s ALA 19 Cb -0.07 -3.11 0.42 0.00 0.00 0.00 0.00 23.12 20.36 1x4y s ALA 19 CO -0.02 -1.48 1.64 0.28 0.00 0.00 0.00 175.76 176.18 1x4y h VAL 20 N 5.72 1.33 -2.97 0.00 2.07 -1.68 -3.46 116.25 117.27 1x4y h VAL 20 Ca -0.27 -1.99 -0.03 0.00 0.82 0.00 0.00 66.70 65.23 1x4y h VAL 20 Cb 1.11 2.10 0.01 0.00 -1.52 0.00 0.00 31.29 32.99 1x4y h VAL 20 CO 0.81 0.56 0.26 0.59 0.02 0.00 0.00 177.57 179.81 1x4y n ASN 21 N -3.76 -2.18 0.07 0.57 3.02 0.01 -4.93 115.26 108.06 1x4y n ASN 21 Ca -0.01 -2.53 0.10 0.00 -0.03 0.00 0.00 54.58 52.12 1x4y n ASN 21 Cb 0.59 3.64 0.43 0.00 -0.61 0.00 0.00 39.78 43.83 1x4y n ASN 21 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1x4y n GLU 22 N -0.51 0.11 0.00 3.52 0.00 -1.26 -2.87 120.64 119.63 1x4y n GLU 22 Ca -0.08 0.30 0.00 0.00 0.00 0.00 0.00 57.16 57.37 1x4y n GLU 22 Cb 0.57 -1.70 0.00 0.00 0.00 0.00 0.00 31.44 30.31 1x4y n GLU 22 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1x4y n THR 23 N -1.91 0.29 -4.08 3.84 -2.24 -1.26 -2.40 114.28 106.51 1x4y n THR 23 Ca 0.03 -0.32 -0.14 0.00 -2.27 0.00 0.00 64.05 61.36 1x4y n THR 23 Cb 0.24 0.97 -0.13 0.00 -2.10 0.00 0.00 70.33 69.31 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 -0.29 0.41 0.01 4.28 2.01 -1.16 -2.24 115.64 118.67 1x4y s THR 24 Ca 0.00 -0.61 0.01 0.00 0.31 0.00 0.00 61.69 61.39 1x4y s THR 24 Cb 0.00 -0.43 -0.01 0.00 0.01 0.00 0.00 72.50 72.08 1x4y s THR 24 CO 0.00 -0.14 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.12 1x4y s ILE 25 N -0.74 0.24 -0.22 1.82 1.01 -0.63 -0.81 121.20 121.87 1x4y s ILE 25 Ca -0.04 -0.33 -0.03 0.00 0.00 0.00 0.00 60.65 60.25 1x4y s ILE 25 Cb -0.06 -0.24 0.00 0.00 0.01 0.00 0.00 42.46 42.17 1x4y s ILE 25 CO 0.00 -0.06 -0.06 -0.32 0.00 0.00 0.00 174.94 174.49 1x4y s MET 26 N -0.42 3.25 -0.04 2.79 -2.45 0.69 -0.50 119.30 122.63 1x4y s MET 26 Ca -0.02 -0.70 0.04 0.00 -1.25 0.00 0.00 55.69 53.75 1x4y s MET 26 Cb -0.03 -2.96 -0.00 0.00 1.25 0.00 0.00 34.83 33.08 1x4y s MET 26 CO -0.00 -0.23 -0.15 -0.48 1.05 0.00 0.00 175.02 175.20 1x4y s LEU 27 N 1.44 1.88 -0.05 4.11 2.34 -1.10 -1.65 118.68 125.63 1x4y s LEU 27 Ca 0.05 -0.31 0.06 0.00 0.06 0.00 0.00 54.13 53.99 1x4y s LEU 27 Cb -0.14 -0.86 -0.01 0.00 -0.56 0.00 0.00 46.19 44.61 1x4y s LEU 27 CO -0.04 0.13 -0.25 -0.54 -1.06 0.00 0.00 176.35 174.59 1x4y s LYS 28 N 0.08 2.49 0.31 1.48 1.02 -0.56 -2.74 119.74 121.82 1x4y s LYS 28 Ca -0.04 -0.89 0.09 0.00 0.02 0.00 0.00 55.97 55.15 1x4y s LYS 28 Cb -0.11 -2.13 -0.04 0.00 -0.52 0.00 0.00 37.83 35.03 1x4y s LYS 28 CO 0.02 0.39 0.05 1.67 -0.92 0.00 0.00 175.35 176.55 1x4y s TRP 29 N -0.18 2.67 0.27 3.18 -2.14 -1.02 -2.03 118.94 119.68 1x4y s TRP 29 Ca -0.03 -0.32 0.08 0.00 2.66 0.00 0.00 56.10 58.50 1x4y s TRP 29 Cb -0.13 -1.40 -0.05 0.00 -3.10 0.00 0.00 33.47 28.78 1x4y s TRP 29 CO 0.03 0.50 -0.12 0.00 -2.66 0.00 0.00 176.95 174.70 1x4y s MET 30 N -3.74 1.55 -0.04 3.25 0.23 0.09 -4.83 119.30 115.81 1x4y s MET 30 Ca 0.34 -1.74 0.04 0.00 -1.03 0.00 0.00 55.69 53.30 1x4y s MET 30 Cb -0.04 -1.35 -0.00 0.00 -1.53 0.00 0.00 34.83 31.91 1x4y s MET 30 CO 0.21 0.16 -0.16 -0.47 -2.03 0.00 0.00 175.02 172.73 1x4y s TYR 31 N -2.84 1.55 -0.41 3.16 5.04 -1.26 -2.37 117.35 120.21 1x4y s TYR 31 Ca 0.28 -0.43 -0.06 0.00 -2.44 0.00 0.00 57.07 54.42 1x4y s TYR 31 Cb 0.00 -1.05 0.09 0.00 0.35 0.00 0.00 41.96 41.36 1x4y s TYR 31 CO 0.12 -0.14 0.23 0.42 -1.34 0.00 0.00 175.55 174.84 1x4y s ILE 32 N 0.04 3.80 -0.49 3.14 1.09 -1.26 -4.94 121.20 122.58 1x4y s ILE 32 Ca -0.03 -1.68 0.23 0.00 -1.10 0.00 0.00 60.65 58.07 1x4y s ILE 32 Cb -0.11 -3.43 0.24 0.00 -1.06 0.00 0.00 42.46 38.10 1x4y s ILE 32 CO 0.02 -0.58 1.70 -0.81 -0.10 0.00 0.00 174.94 175.17 1x4y n PRO 33 N 4.78 0.19 0.02 2.79 -0.04 -1.26 -3.77 135.00 137.72 1x4y n PRO 33 Ca -0.07 0.42 -0.01 0.00 -0.04 0.00 0.00 63.50 63.80 1x4y n PRO 33 Cb 0.42 -1.86 -0.01 0.00 -0.04 0.00 0.00 33.50 32.01 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 2.27 -0.87 -0.36 0.55 0.00 -2.06 -2.99 119.26 115.79 1x4y h ALA 34 Ca 0.00 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.60 1x4y h ALA 34 Cb 0.35 0.18 -0.12 0.00 0.00 0.00 0.00 17.79 18.21 1x4y h ALA 34 CO 0.00 -0.87 0.26 0.45 0.00 0.00 0.00 179.25 179.09 1x4y n SER 35 N -2.34 6.17 -4.56 0.00 2.88 -1.25 -4.89 113.62 109.63 1x4y n SER 35 Ca -0.01 -2.93 -0.24 0.00 -1.33 0.00 0.00 58.87 54.36 1x4y n SER 35 Cb 0.03 -1.15 -0.09 0.00 -0.75 0.00 0.00 64.21 62.26 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 0.70 4.11 -0.14 -3.46 3.04 -1.13 -4.62 114.94 113.43 1x4y s ASN 36 Ca 0.36 -0.81 0.12 0.00 0.04 0.00 0.00 52.86 52.57 1x4y s ASN 36 Cb 0.24 -0.60 0.59 0.00 -1.54 0.00 0.00 41.25 39.95 1x4y s ASN 36 CO -0.05 0.02 1.43 0.59 -3.04 0.00 0.00 177.10 176.05 1x4y n ASN 37 N -0.74 4.21 -3.67 -4.21 4.13 -1.26 -4.90 115.26 108.83 1x4y n ASN 37 Ca -0.06 -2.54 -0.27 0.00 1.68 0.00 0.00 54.58 53.38 1x4y n ASN 37 Cb 0.59 -0.58 0.03 0.00 -1.54 0.00 0.00 39.78 38.28 1x4y n ASN 37 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1x4y n ASN 38 N 0.62 -5.01 -4.75 6.41 2.85 -1.26 -4.96 115.26 109.15 1x4y n ASN 38 Ca 0.20 -0.62 -0.36 0.00 -0.11 0.00 0.00 54.58 53.70 1x4y n ASN 38 Cb 0.85 -4.02 -0.08 0.00 1.24 0.00 0.00 39.78 37.77 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 -3.22 4.83 0.20 -0.44 -1.32 -1.26 -5.08 115.64 109.35 1x4y s THR 39 Ca 0.57 -0.05 -0.30 0.00 -1.21 0.00 0.00 61.69 60.70 1x4y s THR 39 Cb -0.28 -3.08 -0.09 0.00 -1.51 0.00 0.00 72.50 67.54 1x4y s THR 39 CO 0.70 0.60 1.30 -2.16 -2.21 0.00 0.00 174.62 172.84 1x4y s PRO 40 N -0.81 4.40 0.03 7.08 0.04 -1.26 -4.98 135.00 139.50 1x4y s PRO 40 Ca 0.13 2.04 -0.11 0.00 0.04 0.00 0.00 61.00 63.10 1x4y s PRO 40 Cb -0.12 -3.19 -0.06 0.00 0.04 0.00 0.00 34.50 31.17 1x4y s PRO 40 CO 0.03 -0.23 0.38 0.42 0.04 0.00 0.00 177.00 177.63 1x4y s ILE 41 N 0.05 5.11 0.03 0.56 1.01 -1.26 -4.66 121.20 122.04 1x4y s ILE 41 Ca 0.56 0.56 -0.18 0.00 0.00 0.00 0.00 60.65 61.58 1x4y s ILE 41 Cb -0.36 -3.65 -0.19 0.00 0.01 0.00 0.00 42.46 38.27 1x4y s ILE 41 CO 0.39 0.43 1.21 0.45 0.00 0.00 0.00 174.94 177.41 1x4y h HIS 42 N 4.19 0.66 0.00 3.97 3.86 -1.80 -3.44 115.15 122.59 1x4y h HIS 42 Ca -0.51 -0.30 0.00 0.00 -1.16 0.00 0.00 60.37 58.41 1x4y h HIS 42 Cb 1.21 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.58 1x4y h HIS 42 CO 0.69 1.07 0.00 0.41 0.86 0.00 0.00 177.93 180.96 1x4y n GLY 43 N 0.75 2.39 3.31 2.45 0.00 -1.21 -3.84 105.19 109.04 1x4y n GLY 43 Ca -0.08 -0.13 -0.07 0.00 0.00 0.00 0.00 46.02 45.73 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 0.04 -0.88 0.03 1.61 0.08 0.25 -4.19 117.98 114.91 1x4y s PHE 44 Ca 0.00 1.62 -0.09 0.00 0.12 0.00 0.00 56.93 58.58 1x4y s PHE 44 Cb 0.00 0.37 -0.05 0.00 -0.57 0.00 0.00 43.02 42.77 1x4y s PHE 44 CO 0.00 -0.52 0.33 0.71 -0.10 0.00 0.00 175.22 175.64 1x4y s TYR 45 N 2.66 3.61 -0.07 0.36 2.02 0.91 0.16 117.35 126.98 1x4y s TYR 45 Ca -0.02 0.72 0.01 0.00 -0.37 0.00 0.00 57.07 57.42 1x4y s TYR 45 Cb -0.12 -2.10 0.02 0.00 -0.40 0.00 0.00 41.96 39.36 1x4y s TYR 45 CO -0.14 0.59 -0.09 0.42 -1.57 0.00 0.00 175.55 174.76 1x4y s ILE 46 N -1.29 0.93 0.10 2.71 1.01 -0.30 -0.11 121.20 124.25 1x4y s ILE 46 Ca 0.28 -0.32 0.07 0.00 0.00 0.00 0.00 60.65 60.69 1x4y s ILE 46 Cb -0.14 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.39 1x4y s ILE 46 CO 0.16 0.32 -0.11 -0.31 0.00 0.00 0.00 174.94 174.99 1x4y s TYR 47 N 1.03 2.70 -0.15 3.97 1.51 0.33 -0.35 117.35 126.40 1x4y s TYR 47 Ca -0.08 -0.18 -0.25 0.00 -1.01 0.00 0.00 57.07 55.56 1x4y s TYR 47 Cb -0.14 -1.42 0.06 0.00 -0.11 0.00 0.00 41.96 40.35 1x4y s TYR 47 CO -0.00 0.42 0.62 1.52 -1.11 0.00 0.00 175.55 177.00 1x4y s TYR 48 N -1.20 -0.63 -0.22 2.71 1.13 -1.25 -2.11 117.35 115.78 1x4y s TYR 48 Ca 0.21 1.35 -0.22 0.00 -1.41 0.00 0.00 57.07 57.00 1x4y s TYR 48 Cb -0.11 0.29 0.06 0.00 -1.10 0.00 0.00 41.96 41.10 1x4y s TYR 48 CO 0.13 -0.45 0.62 -0.98 -2.51 0.00 0.00 175.55 172.36 1x4y s ARG 49 N -0.40 0.74 0.42 -3.49 1.04 -1.24 -2.05 118.95 113.96 1x4y s ARG 49 Ca -0.05 0.83 -0.25 0.00 -1.04 0.00 0.00 55.73 55.22 1x4y s ARG 49 Cb -0.03 0.36 -0.08 0.00 -2.04 0.00 0.00 34.95 33.16 1x4y s ARG 49 CO 0.05 -0.10 1.18 -1.25 -0.04 0.00 0.00 175.30 175.14 1x4y s PRO 50 N 0.25 3.96 0.55 3.89 0.04 -1.26 -3.73 135.00 138.71 1x4y s PRO 50 Ca -0.01 1.86 0.28 0.00 0.04 0.00 0.00 61.00 63.17 1x4y s PRO 50 Cb -0.04 -2.61 1.46 0.00 0.04 0.00 0.00 34.50 33.35 1x4y s PRO 50 CO 0.01 -0.40 1.96 0.00 0.04 0.00 0.00 177.00 178.61 1x4y h THR 51 N 2.22 0.57 0.00 1.26 1.03 -1.93 0.48 112.91 116.53 1x4y h THR 51 Ca -0.49 0.00 -0.03 0.00 -0.01 0.00 0.00 66.41 65.88 1x4y h THR 51 Cb 1.24 0.68 -0.00 0.00 -1.07 0.00 0.00 68.15 69.00 1x4y h THR 51 CO 0.62 0.00 -0.15 -0.78 -0.01 0.00 0.00 175.52 175.19 1x4y h ASP 52 N 0.00 0.00 -1.75 0.00 3.58 -1.92 -3.45 116.42 112.87 1x4y h ASP 52 Ca 0.25 0.00 -0.48 0.00 0.42 0.00 0.00 57.03 57.22 1x4y h ASP 52 Cb 1.11 0.00 0.25 0.00 1.72 0.00 0.00 39.33 42.41 1x4y h ASP 52 CO -0.00 0.15 -1.85 -1.20 -2.88 0.00 0.00 179.24 173.46 1x4y n SER 53 N -3.36 -2.83 -0.03 2.28 7.64 0.17 -4.99 113.62 112.50 1x4y n SER 53 Ca -0.00 -0.04 -0.04 0.00 1.01 0.00 0.00 58.87 59.80 1x4y n SER 53 Cb 0.36 -0.75 -0.01 0.00 -1.01 0.00 0.00 64.21 62.80 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 0.90 1.06 -3.73 6.43 2.03 -1.26 -5.05 116.55 116.93 1x4y n ASP 54 Ca -0.00 0.17 -0.24 0.00 0.52 0.00 0.00 54.79 55.24 1x4y n ASP 54 Cb 0.68 -0.53 -0.07 0.00 -0.72 0.00 0.00 41.12 40.47 1x4y n ASP 54 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1x4y n ASN 55 N -3.55 0.65 0.10 1.67 3.02 -1.26 -5.00 115.26 110.89 1x4y n ASN 55 Ca -0.06 -3.22 0.19 0.00 -0.03 0.00 0.00 54.58 51.46 1x4y n ASN 55 Cb 0.24 1.25 0.61 0.00 -0.61 0.00 0.00 39.78 41.27 1x4y n ASN 55 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 1x4y h ASP 56 N 1.78 0.00 -0.56 6.41 2.03 -1.99 -0.41 116.42 123.68 1x4y h ASP 56 Ca -0.30 0.00 0.16 0.00 -0.73 0.00 0.00 57.03 56.17 1x4y h ASP 56 Cb 1.23 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.71 1x4y h ASP 56 CO 0.46 0.00 0.83 0.28 -1.03 0.00 0.00 179.24 179.78 1x4y h SER 57 N 0.00 0.00 0.11 4.15 0.02 -2.03 0.47 113.55 116.26 1x4y h SER 57 Ca 0.20 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.88 1x4y h SER 57 Cb 1.52 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.05 1x4y h SER 57 CO -0.00 0.00 -1.40 0.44 -1.14 0.00 0.00 176.83 174.73 1x4y h ASP 58 N 0.00 0.35 -0.99 3.07 5.19 -1.46 -3.47 116.42 119.12 1x4y h ASP 58 Ca 0.27 -0.84 -0.85 0.00 -0.62 0.00 0.00 57.03 54.98 1x4y h ASP 58 Cb 1.93 -0.12 0.02 0.00 0.18 0.00 0.00 39.33 41.34 1x4y h ASP 58 CO -0.00 1.61 0.56 -1.22 -3.12 0.00 0.00 179.24 177.06 1x4y n TYR 59 N -3.95 1.52 -2.58 4.55 4.01 0.16 -4.80 117.16 116.07 1x4y n TYR 59 Ca -0.25 1.12 -0.11 0.00 -0.16 0.00 0.00 57.90 58.50 1x4y n TYR 59 Cb 0.89 -2.18 0.05 0.00 -0.31 0.00 0.00 39.34 37.79 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 3.47 0.40 -3.72 -0.72 5.02 -0.87 -4.85 118.16 116.89 1x4y n LYS 60 Ca 0.29 -1.40 -0.12 0.00 -2.02 0.00 0.00 58.31 55.05 1x4y n LYS 60 Cb -0.03 -0.27 -0.13 0.00 -0.02 0.00 0.00 35.03 34.58 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 -3.62 0.23 -0.21 1.97 2.20 -1.24 -3.85 119.74 115.23 1x4y s LYS 61 Ca 0.32 0.57 -0.02 0.00 -0.36 0.00 0.00 55.97 56.48 1x4y s LYS 61 Cb -0.02 -0.11 0.06 0.00 -1.51 0.00 0.00 37.83 36.25 1x4y s LYS 61 CO 0.21 -0.16 0.01 -0.51 -0.36 0.00 0.00 175.35 174.54 1x4y s ASP 62 N 1.30 3.16 0.40 1.43 1.11 0.52 -4.88 116.67 119.72 1x4y s ASP 62 Ca -0.09 -0.92 -0.25 0.00 0.18 0.00 0.00 52.55 51.47 1x4y s ASP 62 Cb -0.10 -0.75 -0.08 0.00 1.07 0.00 0.00 42.92 43.06 1x4y s ASP 62 CO -0.09 -0.29 1.14 -0.32 1.18 0.00 0.00 175.17 176.79 1x4y s MET 63 N 1.74 4.07 0.02 8.23 1.75 -1.26 -1.15 119.30 132.71 1x4y s MET 63 Ca -0.02 1.77 -0.02 0.00 -1.25 0.00 0.00 55.69 56.17 1x4y s MET 63 Cb -0.18 -2.65 -0.02 0.00 2.84 0.00 0.00 34.83 34.83 1x4y s MET 63 CO -0.08 -0.28 0.00 0.08 -0.65 0.00 0.00 175.02 174.09 1x4y s VAL 64 N -1.46 0.13 0.66 10.11 1.01 0.42 -4.91 120.40 126.36 1x4y s VAL 64 Ca 0.57 -1.05 -0.17 0.00 0.00 0.00 0.00 61.98 61.33 1x4y s VAL 64 Cb -0.29 -0.55 -0.13 0.00 0.00 0.00 0.00 36.38 35.41 1x4y s VAL 64 CO 0.36 -0.58 -0.16 -0.62 0.00 0.00 0.00 175.10 174.10 1x4y n GLU 65 N 1.25 0.07 0.22 2.72 4.71 -1.26 0.85 120.64 129.19 1x4y n GLU 65 Ca -0.22 0.03 0.12 0.00 -0.01 0.00 0.00 57.16 57.08 1x4y n GLU 65 Cb 0.56 -1.16 0.23 0.00 -1.01 0.00 0.00 31.44 30.07 1x4y n GLU 65 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 1x4y h GLY 66 N -0.29 0.00 0.11 0.62 0.00 -1.80 -3.30 103.07 98.41 1x4y h GLY 66 Ca -0.43 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.54 1x4y h GLY 66 CO 0.38 0.00 -2.33 2.09 0.00 0.00 0.00 176.54 176.68 1x4y n ASP 67 N -3.12 0.39 -4.71 0.19 5.68 -1.26 -4.84 116.55 108.87 1x4y n ASP 67 Ca 0.03 0.03 -0.42 0.00 -0.50 0.00 0.00 54.79 53.93 1x4y n ASP 67 Cb 0.52 0.68 -0.03 0.00 -1.14 0.00 0.00 41.12 41.15 1x4y n ASP 67 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 1x4y s ARG 68 N -2.51 4.23 -0.21 0.11 3.52 -1.24 -4.90 118.95 117.95 1x4y s ARG 68 Ca -0.13 2.30 0.15 0.00 -0.13 0.00 0.00 55.73 57.91 1x4y s ARG 68 Cb 0.07 -3.27 0.54 0.00 -1.56 0.00 0.00 34.95 30.73 1x4y s ARG 68 CO 0.80 -0.60 1.46 0.66 -0.81 0.00 0.00 175.30 176.81 1x4y n TYR 69 N 4.33 1.10 -3.87 5.12 4.02 -1.26 -4.73 117.16 121.87 1x4y n TYR 69 Ca 0.14 -1.05 -0.11 0.00 -0.01 0.00 0.00 57.90 56.86 1x4y n TYR 69 Cb 0.40 -0.38 -0.11 0.00 -0.02 0.00 0.00 39.34 39.22 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 -2.93 0.00 -0.26 -0.72 1.48 -1.26 -2.43 118.94 112.81 1x4y s TRP 70 Ca 0.44 0.00 -0.14 0.00 -1.06 0.00 0.00 56.10 55.34 1x4y s TRP 70 Cb 0.36 -0.03 0.08 0.00 -1.16 0.00 0.00 33.47 32.72 1x4y s TRP 70 CO 0.07 -0.17 0.63 -1.58 -4.06 0.00 0.00 176.95 171.85 1x4y s HIS 71 N -0.76 -1.01 -0.31 1.66 2.46 -1.11 -4.99 115.29 111.23 1x4y s HIS 71 Ca -0.08 2.00 -0.10 0.00 0.47 0.00 0.00 55.06 57.35 1x4y s HIS 71 Cb -0.05 0.59 -0.01 0.00 -0.13 0.00 0.00 32.58 32.98 1x4y s HIS 71 CO 0.01 -0.51 0.15 -1.54 -2.47 0.00 0.00 174.74 170.38 1x4y s SER 72 N 1.73 5.56 0.45 9.88 1.04 -1.26 -2.73 113.70 128.37 1x4y s SER 72 Ca -0.09 -0.54 -0.15 0.00 0.48 0.00 0.00 55.95 55.64 1x4y s SER 72 Cb -0.06 -2.00 -0.08 0.00 0.10 0.00 0.00 66.02 63.97 1x4y s SER 72 CO -0.19 -0.20 0.90 -0.63 0.98 0.00 0.00 173.24 174.10 1x4y s ILE 73 N 1.61 4.59 0.35 -1.02 1.01 0.35 -4.87 121.20 123.23 1x4y s ILE 73 Ca 0.04 1.08 0.06 0.00 0.00 0.00 0.00 60.65 61.83 1x4y s ILE 73 Cb -0.17 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.58 1x4y s ILE 73 CO 0.06 -0.53 0.23 -0.44 0.00 0.00 0.00 174.94 174.26 1x4y s SER 74 N -2.87 2.00 -1.25 3.58 0.01 -1.26 -1.60 113.70 112.31 1x4y s SER 74 Ca 0.57 -1.73 -0.05 0.00 1.31 0.00 0.00 55.95 56.04 1x4y s SER 74 Cb -0.10 0.55 0.01 0.00 0.21 0.00 0.00 66.02 66.69 1x4y s SER 74 CO 0.27 -1.03 1.07 1.41 0.41 0.00 0.00 173.24 175.38 1x4y n HIS 75 N -0.71 -2.52 -3.51 2.43 8.25 -0.95 -4.95 115.22 113.26 1x4y n HIS 75 Ca 0.03 0.95 -0.17 0.00 -0.26 0.00 0.00 57.72 58.28 1x4y n HIS 75 Cb 0.63 -4.94 0.02 0.00 1.12 0.00 0.00 29.99 26.81 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 -4.52 0.00 -4.85 2.41 4.77 -1.04 -5.08 117.00 108.68 1x4y n LEU 76 Ca -0.11 -1.94 -0.36 0.00 -0.03 0.00 0.00 56.01 53.57 1x4y n LEU 76 Cb 0.60 -0.12 -0.06 0.00 -2.33 0.00 0.00 43.42 41.50 1x4y n LEU 76 CO 0.61 -0.55 -0.19 -1.10 -1.33 0.00 0.00 177.39 174.84 1x4y s GLN 77 N -3.69 3.37 0.55 3.23 1.11 -1.26 -4.64 119.66 118.32 1x4y s GLN 77 Ca 0.29 -0.19 -0.19 0.00 0.01 0.00 0.00 55.36 55.28 1x4y s GLN 77 Cb -0.02 -3.12 -0.06 0.00 -1.01 0.00 0.00 33.01 28.80 1x4y s GLN 77 CO 0.19 0.76 1.13 -1.25 0.01 0.00 0.00 175.29 176.12 1x4y s PRO 78 N -1.09 3.34 -1.31 2.91 0.04 -1.01 -3.40 135.00 134.48 1x4y s PRO 78 Ca 0.16 1.60 -0.15 0.00 0.04 0.00 0.00 61.00 62.64 1x4y s PRO 78 Cb -0.12 -2.00 0.15 0.00 0.04 0.00 0.00 34.50 32.57 1x4y s PRO 78 CO 0.05 -0.86 0.38 -0.85 0.04 0.00 0.00 177.00 175.76 1x4y n GLU 79 N -1.34 -0.81 -3.72 4.56 0.28 0.15 -4.84 120.64 114.92 1x4y n GLU 79 Ca 0.12 0.10 -0.37 0.00 -0.16 0.00 0.00 57.16 56.84 1x4y n GLU 79 Cb 0.51 -3.25 -0.11 0.00 1.43 0.00 0.00 31.44 30.02 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 -2.72 3.54 -0.54 3.84 2.01 -1.22 -4.89 115.64 115.67 1x4y s THR 80 Ca 0.54 -1.88 -0.28 0.00 0.31 0.00 0.00 61.69 60.38 1x4y s THR 80 Cb -0.31 -3.35 0.01 0.00 0.01 0.00 0.00 72.50 68.86 1x4y s THR 80 CO 0.72 -0.64 1.48 -0.55 -0.69 0.00 0.00 174.62 174.94 1x4y s SER 81 N 1.97 6.06 0.11 3.53 0.15 -1.26 -3.94 113.70 120.32 1x4y s SER 81 Ca 0.06 0.40 0.03 0.00 0.70 0.00 0.00 55.95 57.14 1x4y s SER 81 Cb -0.23 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.50 1x4y s SER 81 CO -0.03 -1.74 -0.09 -0.72 1.20 0.00 0.00 173.24 171.86 1x4y s TYR 82 N 6.31 1.06 0.52 3.44 -0.85 -1.26 -4.42 117.35 122.16 1x4y s TYR 82 Ca 0.56 -0.75 -0.19 0.00 -0.52 0.00 0.00 57.07 56.17 1x4y s TYR 82 Cb -0.12 -0.57 -0.07 0.00 0.38 0.00 0.00 41.96 41.58 1x4y s TYR 82 CO 0.26 -0.02 1.06 0.16 -1.52 0.00 0.00 175.55 175.49 1x4y s ASP 83 N -2.78 6.09 -0.08 -0.18 1.47 -1.24 -3.41 116.67 116.53 1x4y s ASP 83 Ca 0.10 1.94 -0.03 0.00 1.18 0.00 0.00 52.55 55.74 1x4y s ASP 83 Cb 0.01 -2.56 0.04 0.00 -0.34 0.00 0.00 42.92 40.07 1x4y s ASP 83 CO -0.01 -0.96 0.15 -0.63 0.68 0.00 0.00 175.17 174.40 1x4y s ILE 84 N -2.06 -0.22 0.27 2.11 1.01 0.55 -3.64 121.20 119.22 1x4y s ILE 84 Ca 0.67 0.34 0.02 0.00 0.00 0.00 0.00 60.65 61.68 1x4y s ILE 84 Cb -0.18 -0.27 -0.05 0.00 0.01 0.00 0.00 42.46 41.97 1x4y s ILE 84 CO 0.25 0.14 0.09 -1.59 0.00 0.00 0.00 174.94 173.84 1x4y s LYS 85 N 2.13 1.47 0.23 2.79 -2.85 -0.90 -0.90 119.74 121.70 1x4y s LYS 85 Ca 0.02 -1.80 -0.15 0.00 -1.00 0.00 0.00 55.97 53.04 1x4y s LYS 85 Cb -0.12 -0.36 0.01 0.00 -2.06 0.00 0.00 37.83 35.30 1x4y s LYS 85 CO -0.05 -0.29 0.50 0.00 0.10 0.00 0.00 175.35 175.61 1x4y s MET 86 N -4.00 1.48 -0.12 1.78 0.23 -1.26 -0.51 119.30 116.90 1x4y s MET 86 Ca 0.37 -1.09 -0.25 0.00 -1.03 0.00 0.00 55.69 53.70 1x4y s MET 86 Cb 0.08 0.49 0.06 0.00 -1.53 0.00 0.00 34.83 33.93 1x4y s MET 86 CO 0.14 -0.62 0.60 -1.14 -2.03 0.00 0.00 175.02 171.97 1x4y s GLN 87 N -3.95 0.86 0.35 3.16 -0.44 0.84 -1.35 119.66 119.12 1x4y s GLN 87 Ca 0.16 0.44 0.05 0.00 -2.50 0.00 0.00 55.36 53.51 1x4y s GLN 87 Cb -0.01 0.41 -0.01 0.00 -1.64 0.00 0.00 33.01 31.76 1x4y s GLN 87 CO 0.04 -0.21 0.51 0.00 0.50 0.00 0.00 175.29 176.13 1x4y s PHE 89 N -2.25 -0.21 0.34 0.00 -0.71 -1.26 -0.22 117.98 113.67 1x4y s PHE 89 Ca 0.45 0.02 -0.09 0.00 -1.04 0.00 0.00 56.93 56.26 1x4y s PHE 89 Cb -0.10 0.22 0.02 0.00 -1.21 0.00 0.00 43.02 41.95 1x4y s PHE 89 CO 0.33 -0.62 0.60 0.54 -1.34 0.00 0.00 175.22 174.72 1x4y s ASN 90 N -2.40 0.40 0.46 1.98 4.22 -0.50 -2.19 114.94 116.91 1x4y s ASN 90 Ca -0.01 -1.25 0.32 0.00 -2.14 0.00 0.00 52.86 49.78 1x4y s ASN 90 Cb 0.01 0.72 1.43 0.00 1.28 0.00 0.00 41.25 44.69 1x4y s ASN 90 CO -0.07 -1.42 1.66 1.05 -2.04 0.00 0.00 177.10 176.28 1x4y h GLU 91 N 2.08 0.11 -0.19 3.55 4.11 -1.96 1.00 114.58 123.28 1x4y h GLU 91 Ca -0.29 -0.01 -0.14 0.00 0.07 0.00 0.00 59.36 59.00 1x4y h GLU 91 Cb 1.25 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 1x4y h GLU 91 CO 0.38 0.07 -0.46 0.78 0.07 0.00 0.00 179.01 179.85 1x4y h GLY 92 N 0.11 0.54 0.00 1.06 0.00 -1.93 -3.50 103.07 99.36 1x4y h GLY 92 Ca 0.77 -0.57 0.00 0.00 0.00 0.00 0.00 47.33 47.53 1x4y h GLY 92 CO -0.29 0.51 0.00 0.61 0.00 0.00 0.00 176.54 177.37 1x4y n GLY 93 N 0.07 -0.01 3.79 4.60 0.00 0.35 -4.64 105.19 109.34 1x4y n GLY 93 Ca -0.02 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 43.89 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 -1.49 4.23 0.50 1.61 2.02 -1.26 -1.41 118.70 122.90 1x4y s GLU 94 Ca 0.00 1.35 0.00 0.00 0.02 0.00 0.00 54.97 56.34 1x4y s GLU 94 Cb 0.00 -2.45 0.10 0.00 0.10 0.00 0.00 34.13 31.88 1x4y s GLU 94 CO 0.00 -0.05 0.68 -1.13 0.02 0.00 0.00 175.26 174.78 1x4y n SER 95 N -0.19 0.98 -4.65 -0.19 3.41 0.69 -4.87 113.62 108.81 1x4y n SER 95 Ca 0.05 -1.81 -0.30 0.00 -0.26 0.00 0.00 58.87 56.55 1x4y n SER 95 Cb 0.51 -0.44 0.17 0.00 -0.26 0.00 0.00 64.21 64.20 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 -4.24 0.64 -0.36 4.33 0.41 -1.05 -4.77 118.70 113.65 1x4y s GLU 96 Ca 0.46 1.02 -0.24 0.00 -0.41 0.00 0.00 54.97 55.80 1x4y s GLU 96 Cb -0.03 -1.72 0.01 0.00 -1.78 0.00 0.00 34.13 30.61 1x4y s GLU 96 CO 0.30 -2.72 0.82 -0.06 -0.49 0.00 0.00 175.26 173.11 1x4y s PHE 97 N -2.73 3.11 0.98 1.61 0.08 -1.26 -4.53 117.98 115.23 1x4y s PHE 97 Ca 0.65 0.63 -0.12 0.00 0.12 0.00 0.00 56.93 58.21 1x4y s PHE 97 Cb -0.21 -3.45 0.17 0.00 -0.57 0.00 0.00 43.02 38.96 1x4y s PHE 97 CO 0.59 -0.75 0.37 -1.13 -0.10 0.00 0.00 175.22 174.20 1x4y n SER 98 N 6.50 -3.03 -4.82 1.36 3.41 -0.46 -4.93 113.62 111.66 1x4y n SER 98 Ca 0.04 -0.40 -0.32 0.00 -0.26 0.00 0.00 58.87 57.93 1x4y n SER 98 Cb 0.48 -0.75 0.01 0.00 -0.26 0.00 0.00 64.21 63.69 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 -1.97 5.91 -0.31 4.04 6.03 -1.26 -4.75 114.94 122.63 1x4y s ASN 99 Ca 0.33 1.71 -0.24 0.00 -1.03 0.00 0.00 52.86 53.64 1x4y s ASN 99 Cb -0.06 -2.52 0.00 0.00 -3.03 0.00 0.00 41.25 35.65 1x4y s ASN 99 CO 0.29 -1.08 0.79 -0.69 -2.03 0.00 0.00 177.10 174.39 1x4y s VAL 100 N -2.62 4.79 -0.19 3.54 1.01 -1.26 -4.57 120.40 121.09 1x4y s VAL 100 Ca 0.61 1.19 -0.05 0.00 0.00 0.00 0.00 61.98 63.73 1x4y s VAL 100 Cb -0.14 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 1x4y s VAL 100 CO 0.40 -0.26 -0.00 -0.04 0.00 0.00 0.00 175.10 175.20 1x4y s MET 101 N 2.97 3.65 -0.69 2.72 1.00 -0.08 -4.88 119.30 123.99 1x4y s MET 101 Ca 0.33 -0.51 -0.19 0.00 0.00 0.00 0.00 55.69 55.32 1x4y s MET 101 Cb -0.14 -3.07 0.11 0.00 0.00 0.00 0.00 34.83 31.74 1x4y s MET 101 CO 0.13 0.06 0.83 0.42 0.00 0.00 0.00 175.02 176.46 1x4y s ILE 102 N 0.87 4.78 -0.34 2.53 1.01 -1.26 -0.33 121.20 128.46 1x4y s ILE 102 Ca 0.01 -1.12 -0.08 0.00 0.00 0.00 0.00 60.65 59.46 1x4y s ILE 102 Cb -0.14 -4.58 0.03 0.00 0.01 0.00 0.00 42.46 37.78 1x4y s ILE 102 CO 0.02 -1.25 0.14 0.00 0.00 0.00 0.00 174.94 173.85 1x4y s GLU 104 N 1.49 4.35 1.37 0.00 2.12 -1.26 -4.27 118.70 122.50 1x4y s GLU 104 Ca 0.01 1.15 -0.23 0.00 0.36 0.00 0.00 54.97 56.26 1x4y s GLU 104 Cb -0.19 -3.56 0.35 0.00 0.26 0.00 0.00 34.13 30.99 1x4y s GLU 104 CO 0.04 -0.31 0.99 0.95 -0.54 0.00 0.00 175.26 176.40 1x4y s THR 105 N 2.04 1.27 0.36 -1.70 -4.23 -1.25 -4.58 115.64 107.54 1x4y s THR 105 Ca 0.42 0.00 -0.07 0.00 -1.18 0.00 0.00 61.69 60.86 1x4y s THR 105 Cb -0.17 -2.23 -0.05 0.00 1.34 0.00 0.00 72.50 71.38 1x4y s THR 105 CO 0.15 0.00 0.67 -0.54 -0.54 0.00 0.00 174.62 174.36 1x4y s LYS 106 N -5.28 3.68 0.10 3.99 1.02 -1.14 -3.99 119.74 118.11 1x4y s LYS 106 Ca 0.70 0.21 -0.31 0.00 0.02 0.00 0.00 55.97 56.59 1x4y s LYS 106 Cb -0.10 -2.51 -0.07 0.00 -0.52 0.00 0.00 37.83 34.63 1x4y s LYS 106 CO 0.57 0.06 1.27 0.00 -0.92 0.00 0.00 175.35 176.33 1x4y s ALA 107 N -2.29 3.47 0.46 5.17 0.00 -1.26 -0.67 121.76 126.64 1x4y s ALA 107 Ca 0.47 0.97 -0.22 0.00 0.00 0.00 0.00 51.96 53.18 1x4y s ALA 107 Cb -0.10 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.45 1x4y s ALA 107 CO 0.32 -0.50 1.05 -0.98 0.00 0.00 0.00 175.76 175.65 1x4y s ARG 108 N 0.92 3.92 -0.11 0.00 1.70 -1.26 -4.83 118.95 119.28 1x4y s ARG 108 Ca 0.60 1.43 -0.06 0.00 -0.47 0.00 0.00 55.73 57.23 1x4y s ARG 108 Cb -0.33 -2.25 -0.04 0.00 -0.57 0.00 0.00 34.95 31.76 1x4y s ARG 108 CO 0.31 -0.34 0.14 0.45 -1.08 0.00 0.00 175.30 174.78 1x4y s SER 109 N -1.82 6.37 0.05 -2.89 0.15 -1.26 -5.08 113.70 109.23 1x4y s SER 109 Ca 0.64 0.45 -0.01 0.00 0.70 0.00 0.00 55.95 57.74 1x4y s SER 109 Cb -0.19 -2.05 0.00 0.00 -1.71 0.00 0.00 66.02 62.07 1x4y s SER 109 CO 0.23 0.39 0.08 0.61 1.20 0.00 0.00 173.24 175.75 1x4y n GLY 110 N 1.85 2.83 0.26 9.45 0.00 -1.26 -5.06 105.19 113.26 1x4y n GLY 110 Ca -0.19 -1.36 -0.13 0.00 0.00 0.00 0.00 46.02 44.34 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 0.91 -4.67 1.61 0.13 -2.08 -3.40 132.00 124.49 1x4y h PRO 111 Ca -0.04 -0.48 -0.71 0.00 -0.87 0.00 0.00 66.00 63.90 1x4y h PRO 111 Cb 0.18 0.02 -0.20 0.00 0.13 0.00 0.00 31.00 31.13 1x4y h PRO 111 CO 0.06 1.13 -0.22 0.45 -0.23 0.00 0.00 178.00 179.18 1x4y s SER 112 N -6.84 6.18 0.03 1.44 0.15 -1.26 -5.06 113.70 108.33 1x4y s SER 112 Ca -0.11 -0.94 0.05 0.00 0.70 0.00 0.00 55.95 55.65 1x4y s SER 112 Cb 0.11 -2.22 -0.03 0.00 -1.71 0.00 0.00 66.02 62.17 1x4y s SER 112 CO 0.88 -0.65 -0.12 -0.55 1.20 0.00 0.00 173.24 174.00 1x4y s SER 113 N 2.20 4.21 0.00 5.45 0.15 -1.26 -5.12 113.70 119.32 1x4y s SER 113 Ca 0.09 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.45 1x4y s SER 113 Cb -0.20 -0.84 0.00 0.00 -1.71 0.00 0.00 66.02 63.27 1x4y s SER 113 CO 0.11 0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.42