#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x68 s SER 2 N 0.00 6.94 0.00 1.61 0.15 -1.26 -4.91 113.70 116.23 1x68 s SER 2 Ca 0.00 2.20 0.24 0.00 0.70 0.00 0.00 55.95 59.08 1x68 s SER 2 Cb 0.00 -2.58 0.23 0.00 -1.71 0.00 0.00 66.02 61.96 1x68 s SER 2 CO 0.00 -0.56 1.23 -1.20 1.20 0.00 0.00 173.24 173.90 1x68 n SER 3 N 3.83 0.69 0.00 5.45 7.64 -1.26 -5.05 113.62 124.92 1x68 n SER 3 Ca 0.10 -0.53 0.00 0.00 1.01 0.00 0.00 58.87 59.45 1x68 n SER 3 Cb 0.44 0.53 0.00 0.00 -1.01 0.00 0.00 64.21 64.17 1x68 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x68 n GLY 4 N 1.50 -0.79 0.32 0.23 0.00 -1.26 -5.00 105.19 100.20 1x68 n GLY 4 Ca 0.05 -1.54 0.04 0.00 0.00 0.00 0.00 46.02 44.56 1x68 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x68 n SER 5 N 3.00 1.75 -0.09 1.61 3.41 -1.26 -5.07 113.62 116.97 1x68 n SER 5 Ca 0.00 -1.40 0.00 0.00 -0.26 0.00 0.00 58.87 57.21 1x68 n SER 5 Cb 0.00 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 1x68 n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1x68 n SER 6 N 0.41 0.00 -0.88 4.04 7.64 -1.26 -4.39 113.62 119.17 1x68 n SER 6 Ca 0.05 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.93 1x68 n SER 6 Cb 0.21 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 1x68 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x68 n GLY 7 N 0.09 2.00 3.62 0.23 0.00 -1.26 -2.97 105.19 106.91 1x68 n GLY 7 Ca 0.00 -0.97 -0.43 0.00 0.00 0.00 0.00 46.02 44.63 1x68 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x68 h VAL 9 N 6.60 0.03 -0.01 0.00 2.07 -1.72 0.36 116.25 123.58 1x68 h VAL 9 Ca -0.43 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1x68 h VAL 9 Cb 1.23 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 1x68 h VAL 9 CO 0.96 0.00 -0.16 0.00 0.02 0.00 0.00 177.57 178.39 1x68 n ALA 10 N -2.04 2.89 -0.73 1.67 0.00 -1.26 -4.57 120.51 116.47 1x68 n ALA 10 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1x68 n ALA 10 Cb 0.18 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.43 1x68 n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x68 n SER 12 N 0.00 -2.89 -4.46 0.00 7.64 0.10 -4.98 113.62 109.04 1x68 n SER 12 Ca 0.00 -0.81 -0.33 0.00 1.01 0.00 0.00 58.87 58.75 1x68 n SER 12 Cb 0.00 -4.30 -0.13 0.00 -1.01 0.00 0.00 64.21 58.77 1x68 n SER 12 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1x68 s LYS 13 N -5.62 2.77 -0.35 1.43 -0.14 -1.26 -4.91 119.74 111.66 1x68 s LYS 13 Ca 0.16 -0.68 -0.28 0.00 -1.36 0.00 0.00 55.97 53.81 1x68 s LYS 13 Cb -0.04 -2.47 -0.02 0.00 -1.68 0.00 0.00 37.83 33.62 1x68 s LYS 13 CO 0.80 0.52 1.86 -1.25 -0.76 0.00 0.00 175.35 176.51 1x68 s PRO 14 N -0.45 3.21 0.08 -1.68 0.04 -1.26 -2.18 135.00 132.76 1x68 s PRO 14 Ca 0.06 1.40 -0.31 0.00 0.04 0.00 0.00 61.00 62.19 1x68 s PRO 14 Cb -0.12 -4.24 -0.06 0.00 0.04 0.00 0.00 34.50 30.12 1x68 s PRO 14 CO 0.02 -2.00 1.27 0.42 0.04 0.00 0.00 177.00 176.74 1x68 s ILE 15 N 7.37 3.79 1.26 0.56 1.01 -1.16 -4.98 121.20 129.05 1x68 s ILE 15 Ca 0.81 1.28 -0.17 0.00 0.00 0.00 0.00 60.65 62.57 1x68 s ILE 15 Cb -0.22 -3.82 0.31 0.00 0.01 0.00 0.00 42.46 38.74 1x68 s ILE 15 CO 0.32 0.10 1.00 -0.44 0.00 0.00 0.00 174.94 175.92 1x68 s SER 16 N 1.10 0.29 1.16 3.58 0.01 -1.26 -4.90 113.70 113.68 1x68 s SER 16 Ca 0.61 1.17 -0.09 0.00 1.31 0.00 0.00 55.95 58.94 1x68 s SER 16 Cb -0.32 -1.76 0.14 0.00 0.21 0.00 0.00 66.02 64.29 1x68 s SER 16 CO 0.29 -4.57 0.40 0.61 0.41 0.00 0.00 173.24 170.38 1x68 n GLY 17 N 0.73 -3.26 0.50 3.44 0.00 -1.26 -4.81 105.19 100.53 1x68 n GLY 17 Ca 0.07 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.74 1x68 n GLY 17 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1x68 n LEU 18 N 0.00 0.36 -1.15 0.99 7.94 -1.26 -4.02 117.00 119.86 1x68 n LEU 18 Ca 0.06 -0.18 0.00 0.00 -1.11 0.00 0.00 56.01 54.78 1x68 n LEU 18 Cb 0.25 -0.18 0.00 0.00 0.53 0.00 0.00 43.42 44.02 1x68 n LEU 18 CO 0.16 0.09 0.39 1.07 -1.11 0.00 0.00 177.39 177.99 1x68 n THR 19 N 0.32 0.78 -0.09 1.96 5.66 -1.26 -4.57 114.28 117.08 1x68 n THR 19 Ca 0.00 -0.07 0.00 0.00 -3.05 0.00 0.00 64.05 60.93 1x68 n THR 19 Cb 0.09 -0.93 0.00 0.00 -1.55 0.00 0.00 70.33 67.94 1x68 n THR 19 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1x68 n GLY 20 N 0.90 0.65 3.58 1.09 0.00 -1.26 -5.03 105.19 105.12 1x68 n GLY 20 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1x68 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x68 s ALA 21 N -2.13 2.36 -0.22 4.61 0.00 -1.26 -4.93 121.76 120.21 1x68 s ALA 21 Ca 0.00 0.30 -0.29 0.00 0.00 0.00 0.00 51.96 51.97 1x68 s ALA 21 Cb 0.00 -4.17 -0.01 0.00 0.00 0.00 0.00 23.12 18.94 1x68 s ALA 21 CO 0.00 -3.38 1.33 0.21 0.00 0.00 0.00 175.76 173.92 1x68 s LYS 22 N 6.87 4.07 0.17 0.00 2.47 -1.26 -4.95 119.74 127.10 1x68 s LYS 22 Ca 0.92 1.53 0.00 0.00 -1.56 0.00 0.00 55.97 56.86 1x68 s LYS 22 Cb -0.24 -3.85 -0.04 0.00 -1.46 0.00 0.00 37.83 32.24 1x68 s LYS 22 CO 0.31 -0.93 0.06 -0.59 0.16 0.00 0.00 175.35 174.36 1x68 s PHE 23 N 4.03 1.11 -0.19 4.03 -0.12 -1.26 -3.71 117.98 121.87 1x68 s PHE 23 Ca 0.58 -1.20 0.01 0.00 -0.05 0.00 0.00 56.93 56.26 1x68 s PHE 23 Cb -0.21 -0.61 0.04 0.00 -0.63 0.00 0.00 43.02 41.61 1x68 s PHE 23 CO 0.20 -0.44 -0.09 0.42 -0.05 0.00 0.00 175.22 175.26 1x68 s ILE 24 N -3.93 1.53 -0.29 -4.49 -1.09 -0.22 -4.85 121.20 107.87 1x68 s ILE 24 Ca 0.29 -0.92 -0.09 0.00 -2.23 0.00 0.00 60.65 57.70 1x68 s ILE 24 Cb 0.07 -1.63 -0.02 0.00 -1.58 0.00 0.00 42.46 39.31 1x68 s ILE 24 CO 0.06 0.17 0.13 0.00 -1.23 0.00 0.00 174.94 174.07 1x68 s PHE 26 N 1.63 -0.14 -0.69 0.00 5.36 -0.60 -4.98 117.98 118.55 1x68 s PHE 26 Ca 0.05 0.33 -0.20 0.00 -0.96 0.00 0.00 56.93 56.15 1x68 s PHE 26 Cb -0.16 0.04 0.03 0.00 -0.34 0.00 0.00 43.02 42.59 1x68 s PHE 26 CO 0.06 -0.18 0.39 1.04 -1.46 0.00 0.00 175.22 175.07 1x68 n GLN 27 N 2.43 -0.57 -0.83 10.12 1.13 -1.26 -0.64 117.38 127.76 1x68 n GLN 27 Ca -0.16 -0.17 0.00 0.00 -1.94 0.00 0.00 57.00 54.73 1x68 n GLN 27 Cb 0.58 -1.01 0.00 0.00 0.11 0.00 0.00 30.24 29.92 1x68 n GLN 27 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1x68 n ASP 28 N -0.84 -2.80 -4.59 1.08 8.00 -1.26 -4.98 116.55 111.15 1x68 n ASP 28 Ca -0.07 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.19 1x68 n ASP 28 Cb 0.33 -2.32 -0.08 0.00 -0.02 0.00 0.00 41.12 39.02 1x68 n ASP 28 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1x68 s SER 29 N -2.12 4.14 -0.00 -2.24 0.01 0.19 -5.14 113.70 108.54 1x68 s SER 29 Ca 0.00 -0.88 0.06 0.00 1.31 0.00 0.00 55.95 56.44 1x68 s SER 29 Cb 0.00 -0.58 -0.02 0.00 0.21 0.00 0.00 66.02 65.64 1x68 s SER 29 CO 0.00 -0.08 -0.19 -1.10 0.41 0.00 0.00 173.24 172.28 1x68 s GLN 30 N -3.65 1.46 0.08 12.44 1.11 -1.26 -1.55 119.66 128.29 1x68 s GLN 30 Ca 0.32 -0.72 0.04 0.00 0.01 0.00 0.00 55.36 55.02 1x68 s GLN 30 Cb -0.04 -1.44 -0.03 0.00 -1.01 0.00 0.00 33.01 30.49 1x68 s GLN 30 CO 0.18 0.39 -0.11 -1.58 0.01 0.00 0.00 175.29 174.18 1x68 s TRP 31 N -0.52 1.06 0.16 0.91 0.51 0.11 -1.79 118.94 119.37 1x68 s TRP 31 Ca 0.07 -0.55 -0.22 0.00 -2.12 0.00 0.00 56.10 53.28 1x68 s TRP 31 Cb -0.07 -0.59 -0.08 0.00 -0.81 0.00 0.00 33.47 31.92 1x68 s TRP 31 CO -0.00 0.01 0.70 -1.01 -0.51 0.00 0.00 176.95 176.14 1x68 s HIS 32 N -1.82 3.79 0.18 -1.98 3.76 -1.26 -1.05 115.29 116.91 1x68 s HIS 32 Ca 0.00 1.45 -0.24 0.00 -0.15 0.00 0.00 55.06 56.12 1x68 s HIS 32 Cb -0.07 -2.64 0.07 0.00 1.11 0.00 0.00 32.58 31.06 1x68 s HIS 32 CO 0.01 0.48 1.57 0.66 -0.85 0.00 0.00 174.74 176.61 1x68 h SER 33 N 4.07 -1.42 0.35 1.40 4.64 -1.89 -0.31 113.55 120.40 1x68 h SER 33 Ca -0.48 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1x68 h SER 33 Cb 1.20 0.67 0.00 0.00 -0.31 0.00 0.00 62.40 63.96 1x68 h SER 33 CO 0.65 -0.32 0.00 -0.62 -0.87 0.00 0.00 176.83 175.67 1x68 n GLU 34 N -5.42 0.10 -0.11 4.77 1.02 -1.26 -2.57 120.64 117.17 1x68 n GLU 34 Ca 0.03 0.45 0.07 0.00 -0.02 0.00 0.00 57.16 57.69 1x68 n GLU 34 Cb 0.35 -1.73 0.12 0.00 -0.02 0.00 0.00 31.44 30.16 1x68 n GLU 34 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1x68 s PHE 36 N -2.23 3.40 0.34 0.00 5.36 -0.94 -4.74 117.98 119.17 1x68 s PHE 36 Ca 0.24 -1.78 -0.10 0.00 -0.96 0.00 0.00 56.93 54.33 1x68 s PHE 36 Cb 0.20 -3.32 0.02 0.00 -0.34 0.00 0.00 43.02 39.58 1x68 s PHE 36 CO 0.04 -0.95 0.61 0.54 -1.46 0.00 0.00 175.22 174.00 1x68 s ASN 37 N 2.48 0.32 -0.04 6.13 2.20 -1.26 -2.03 114.94 122.75 1x68 s ASN 37 Ca 0.05 -1.19 -0.31 0.00 -0.94 0.00 0.00 52.86 50.46 1x68 s ASN 37 Cb -0.25 0.72 -0.10 0.00 -2.00 0.00 0.00 41.25 39.62 1x68 s ASN 37 CO 0.00 -1.41 1.97 0.00 -2.94 0.00 0.00 177.10 174.72 1x68 n GLY 39 N 4.66 -0.59 0.02 0.00 0.00 -0.50 -0.65 105.19 108.12 1x68 n GLY 39 Ca 0.22 0.06 0.07 0.00 0.00 0.00 0.00 46.02 46.37 1x68 n GLY 39 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1x68 n LYS 40 N -1.71 0.66 0.00 1.61 5.02 -1.26 -4.84 118.16 117.63 1x68 n LYS 40 Ca -0.00 -0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 1x68 n LYS 40 Cb 0.04 -1.45 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 1x68 n LYS 40 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1x68 n SER 42 N 0.00 -1.39 -4.71 0.00 2.88 0.17 -4.97 113.62 105.61 1x68 n SER 42 Ca 0.00 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.16 1x68 n SER 42 Cb 0.00 -0.46 -0.06 0.00 -0.75 0.00 0.00 64.21 62.94 1x68 n SER 42 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1x68 s VAL 43 N -2.00 5.19 0.24 2.46 0.11 -1.26 -4.78 120.40 120.37 1x68 s VAL 43 Ca 0.00 0.86 -0.31 0.00 -2.93 0.00 0.00 61.98 59.61 1x68 s VAL 43 Cb 0.00 -3.78 -0.14 0.00 -1.53 0.00 0.00 36.38 30.92 1x68 s VAL 43 CO 0.00 0.30 1.20 -0.24 -3.33 0.00 0.00 175.10 173.03 1x68 n SER 44 N 3.94 1.86 -0.42 3.54 2.88 -1.26 -0.94 113.62 123.21 1x68 n SER 44 Ca -0.08 1.16 0.05 0.00 -1.33 0.00 0.00 58.87 58.67 1x68 n SER 44 Cb 0.51 -1.32 0.07 0.00 -0.75 0.00 0.00 64.21 62.72 1x68 n SER 44 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1x68 n LEU 45 N 1.74 2.13 -4.57 2.46 4.77 -0.86 -4.83 117.00 117.85 1x68 n LEU 45 Ca 0.12 -1.37 -0.41 0.00 -0.03 0.00 0.00 56.01 54.31 1x68 n LEU 45 Cb 0.30 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 1x68 n LEU 45 CO 0.61 0.47 1.93 0.52 -1.33 0.00 0.00 177.39 179.60 1x68 n VAL 46 N 0.44 0.15 -3.08 4.08 0.31 -1.26 -1.90 118.33 117.08 1x68 n VAL 46 Ca 0.07 -0.58 -0.21 0.00 -0.01 0.00 0.00 64.34 63.61 1x68 n VAL 46 Cb 0.29 -2.55 0.04 0.00 -0.91 0.00 0.00 33.84 30.71 1x68 n VAL 46 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1x68 n GLY 47 N 5.95 -0.44 3.24 2.92 0.00 -1.26 -5.01 105.19 110.59 1x68 n GLY 47 Ca 0.35 0.09 -0.13 0.00 0.00 0.00 0.00 46.02 46.32 1x68 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x68 s LYS 48 N -5.74 1.03 0.07 1.61 1.02 -0.80 -5.11 119.74 111.82 1x68 s LYS 48 Ca 0.34 -1.45 -0.31 0.00 0.02 0.00 0.00 55.97 54.57 1x68 s LYS 48 Cb -0.15 -0.48 -0.08 0.00 -0.52 0.00 0.00 37.83 36.60 1x68 s LYS 48 CO 0.41 0.01 1.67 0.20 -0.92 0.00 0.00 175.35 176.73 1x68 s GLY 49 N -3.15 1.54 0.28 -3.33 0.00 -1.26 -4.92 107.32 96.47 1x68 s GLY 49 Ca 0.17 1.22 0.02 0.00 0.00 0.00 0.00 44.72 46.13 1x68 s GLY 49 CO 0.00 2.92 0.10 -0.11 0.00 0.00 0.00 173.10 176.02 1x68 s PHE 50 N 2.72 1.61 0.08 1.90 -0.12 -1.26 -3.77 117.98 119.14 1x68 s PHE 50 Ca 0.75 -1.19 0.02 0.00 -0.05 0.00 0.00 56.93 56.45 1x68 s PHE 50 Cb -0.40 -0.95 -0.04 0.00 -0.63 0.00 0.00 43.02 41.00 1x68 s PHE 50 CO 0.33 -0.32 -0.07 -0.51 -0.05 0.00 0.00 175.22 174.60 1x68 s LEU 51 N -3.36 2.43 -0.11 -1.99 1.02 0.16 -4.87 118.68 111.96 1x68 s LEU 51 Ca 0.37 -0.86 -0.03 0.00 0.02 0.00 0.00 54.13 53.63 1x68 s LEU 51 Cb 0.07 -0.08 0.04 0.00 0.02 0.00 0.00 46.19 46.24 1x68 s LEU 51 CO 0.15 -0.39 0.04 0.42 0.02 0.00 0.00 176.35 176.59 1x68 s THR 52 N -2.93 0.18 -0.01 5.49 -4.23 -1.26 -1.16 115.64 111.72 1x68 s THR 52 Ca 0.05 -0.02 -0.04 0.00 -1.18 0.00 0.00 61.69 60.50 1x68 s THR 52 Cb 0.01 -0.56 -0.00 0.00 1.34 0.00 0.00 72.50 73.28 1x68 s THR 52 CO -0.03 0.01 0.07 -1.58 -0.54 0.00 0.00 174.62 172.54 1x68 s GLN 53 N 2.04 0.28 -1.62 3.99 0.74 -1.20 -4.90 119.66 118.99 1x68 s GLN 53 Ca 0.03 -0.24 -0.14 0.00 0.05 0.00 0.00 55.36 55.06 1x68 s GLN 53 Cb -0.14 0.11 0.12 0.00 1.10 0.00 0.00 33.01 34.20 1x68 s GLN 53 CO -0.06 -0.05 0.77 0.09 -0.55 0.00 0.00 175.29 175.48 1x68 n ASN 54 N 2.15 -3.09 0.00 6.67 4.13 -1.26 -1.27 115.26 122.59 1x68 n ASN 54 Ca -0.19 -0.96 0.00 0.00 1.68 0.00 0.00 54.58 55.11 1x68 n ASN 54 Cb 0.57 -3.06 0.00 0.00 -1.54 0.00 0.00 39.78 35.75 1x68 n ASN 54 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83 1x68 n LYS 55 N -4.45 -1.46 -2.87 3.52 2.85 -1.26 -5.00 118.16 109.49 1x68 n LYS 55 Ca -0.00 0.37 -0.21 0.00 -1.05 0.00 0.00 58.31 57.41 1x68 n LYS 55 Cb 0.53 -4.75 0.08 0.00 -0.65 0.00 0.00 35.03 30.24 1x68 n LYS 55 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1x68 s GLU 56 N -1.66 2.08 -0.11 -1.58 0.41 -0.40 -5.13 118.70 112.31 1x68 s GLU 56 Ca 0.00 -1.44 0.01 0.00 -0.41 0.00 0.00 54.97 53.13 1x68 s GLU 56 Cb 0.00 -2.53 0.02 0.00 -1.78 0.00 0.00 34.13 29.84 1x68 s GLU 56 CO 0.00 -1.07 -0.12 0.96 -0.49 0.00 0.00 175.26 174.54 1x68 s ILE 57 N -2.84 1.27 0.15 -1.63 -4.36 -1.26 -3.23 121.20 109.31 1x68 s ILE 57 Ca 0.63 -0.48 0.05 0.00 -0.26 0.00 0.00 60.65 60.60 1x68 s ILE 57 Cb -0.06 -1.21 -0.04 0.00 1.25 0.00 0.00 42.46 42.40 1x68 s ILE 57 CO 0.41 0.40 -0.10 -0.36 0.24 0.00 0.00 174.94 175.53 1x68 s PHE 58 N 1.33 1.31 0.51 1.37 0.08 -0.31 -1.42 117.98 120.86 1x68 s PHE 58 Ca -0.01 -0.75 -0.05 0.00 0.12 0.00 0.00 56.93 56.25 1x68 s PHE 58 Cb -0.14 -0.66 -0.01 0.00 -0.57 0.00 0.00 43.02 41.64 1x68 s PHE 58 CO -0.05 0.10 0.81 0.00 -0.10 0.00 0.00 175.22 175.98 1x68 h GLN 60 N 0.11 -0.26 -0.99 0.00 1.08 -1.90 0.31 115.11 113.47 1x68 h GLN 60 Ca -0.46 0.02 0.17 0.00 -1.45 0.00 0.00 58.65 56.92 1x68 h GLN 60 Cb 1.23 0.06 -0.10 0.00 -0.05 0.00 0.00 27.48 28.62 1x68 h GLN 60 CO 0.61 -0.17 0.60 -0.22 -0.95 0.00 0.00 178.83 178.69 1x68 h LYS 61 N -0.27 0.79 0.00 1.46 3.11 -1.95 0.16 116.57 119.87 1x68 h LYS 61 Ca 0.09 -0.05 -0.18 0.00 -2.81 0.00 0.00 60.65 57.70 1x68 h LYS 61 Cb 0.39 -0.18 -0.03 0.00 -1.00 0.00 0.00 32.23 31.42 1x68 h LYS 61 CO -0.24 0.52 -0.84 0.00 -2.81 0.00 0.00 179.45 176.08 1x68 n GLY 63 N 1.11 2.61 3.51 0.00 0.00 0.01 -4.79 105.19 107.64 1x68 n GLY 63 Ca 0.00 -0.83 -0.43 0.00 0.00 0.00 0.00 46.02 44.75 1x68 n GLY 63 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x68 n SER 64 N 1.25 5.05 -0.42 1.61 2.88 0.42 -4.80 113.62 119.61 1x68 n SER 64 Ca 0.25 -2.95 0.03 0.00 -1.33 0.00 0.00 58.87 54.88 1x68 n SER 64 Cb 0.83 -1.67 -0.02 0.00 -0.75 0.00 0.00 64.21 62.60 1x68 n SER 64 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x68 n GLY 65 N 4.80 -2.96 2.93 0.46 0.00 -1.26 -5.02 105.19 104.13 1x68 n GLY 65 Ca 0.44 -1.28 -0.15 0.00 0.00 0.00 0.00 46.02 45.03 1x68 n GLY 65 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1x68 s MET 66 N -3.76 0.09 -0.43 1.61 1.75 -1.26 -5.02 119.30 112.29 1x68 s MET 66 Ca 0.00 0.66 0.04 0.00 -1.25 0.00 0.00 55.69 55.14 1x68 s MET 66 Cb 0.00 -0.15 0.12 0.00 2.84 0.00 0.00 34.83 37.64 1x68 s MET 66 CO 0.00 -0.30 0.16 0.34 -0.65 0.00 0.00 175.02 174.57 1x68 s ASP 67 N 2.36 4.48 0.00 1.11 2.15 -1.26 -4.78 116.67 120.72 1x68 s ASP 67 Ca 0.02 -2.57 0.00 0.00 0.43 0.00 0.00 52.55 50.43 1x68 s ASP 67 Cb -0.12 -1.58 0.00 0.00 -0.30 0.00 0.00 42.92 40.92 1x68 s ASP 67 CO -0.07 -0.31 0.00 1.07 -0.17 0.00 0.00 175.17 175.69 1x68 n THR 68 N 3.69 0.00 -3.24 1.71 5.66 -1.26 -5.10 114.28 115.75 1x68 n THR 68 Ca 0.04 0.00 -0.02 0.00 -3.05 0.00 0.00 64.05 61.03 1x68 n THR 68 Cb 0.37 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.11 1x68 n THR 68 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1x68 s ASP 69 N -0.22 -0.70 -1.26 1.09 -1.08 -1.26 -5.06 116.67 108.17 1x68 s ASP 69 Ca 0.00 0.61 -0.17 0.00 -0.52 0.00 0.00 52.55 52.47 1x68 s ASP 69 Cb 0.00 1.73 -0.01 0.00 -1.46 0.00 0.00 42.92 43.18 1x68 s ASP 69 CO 0.00 -0.28 2.05 -0.38 0.52 0.00 0.00 175.17 177.08 1x68 n ILE 70 N 5.40 3.09 -0.97 4.11 5.41 -1.26 -4.85 119.36 130.31 1x68 n ILE 70 Ca -0.02 -2.85 -0.32 0.00 1.00 0.00 0.00 62.75 60.56 1x68 n ILE 70 Cb 0.51 -2.47 -0.03 0.00 -0.71 0.00 0.00 39.64 36.94 1x68 n ILE 70 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1x68 n SER 71 N 7.41 4.15 -3.59 4.38 7.64 -1.26 -4.78 113.62 127.58 1x68 n SER 71 Ca 0.50 -2.49 -0.27 0.00 1.01 0.00 0.00 58.87 57.62 1x68 n SER 71 Cb 0.41 -1.15 -0.09 0.00 -1.01 0.00 0.00 64.21 62.36 1x68 n SER 71 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x68 n GLY 72 N 4.05 4.54 0.64 0.23 0.00 -1.26 -4.93 105.19 108.45 1x68 n GLY 72 Ca 0.48 -2.71 0.00 0.00 0.00 0.00 0.00 46.02 43.79 1x68 n GLY 72 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x68 n PRO 73 N 1.24 0.68 -0.19 1.61 -0.04 -1.26 -4.07 135.00 132.96 1x68 n PRO 73 Ca 0.26 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.70 1x68 n PRO 73 Cb 0.39 -1.29 0.08 0.00 -0.04 0.00 0.00 33.50 32.64 1x68 n PRO 73 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1x68 h SER 74 N 0.41 0.34 -5.83 3.54 4.64 -1.99 -3.45 113.55 111.21 1x68 h SER 74 Ca 0.00 0.05 -0.44 0.00 -0.47 0.00 0.00 61.79 60.93 1x68 h SER 74 Cb 0.43 -0.01 -0.12 0.00 -0.31 0.00 0.00 62.40 62.40 1x68 h SER 74 CO 0.00 0.22 -0.41 -0.44 -0.87 0.00 0.00 176.83 175.34 1x68 s SER 75 N -5.47 1.59 0.00 4.97 0.01 -1.26 -5.34 113.70 108.20 1x68 s SER 75 Ca -0.13 -1.72 0.00 0.00 1.31 0.00 0.00 55.95 55.41 1x68 s SER 75 Cb 0.16 0.60 0.00 0.00 0.21 0.00 0.00 66.02 66.98 1x68 s SER 75 CO 0.74 -1.14 0.00 0.61 0.41 0.00 0.00 173.24 173.86