#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4j n SER 2 N 0.00 1.22 -4.91 1.61 3.41 -1.26 -4.92 113.62 108.78 1x4j n SER 2 Ca 0.00 1.17 -0.33 0.00 -0.26 0.00 0.00 58.87 59.46 1x4j n SER 2 Cb 0.00 -0.92 -0.05 0.00 -0.26 0.00 0.00 64.21 62.99 1x4j n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1x4j s SER 3 N 2.73 6.39 0.13 4.04 0.15 -1.26 -5.07 113.70 120.81 1x4j s SER 3 Ca 1.03 0.36 -0.31 0.00 0.70 0.00 0.00 55.95 57.73 1x4j s SER 3 Cb -1.42 -2.00 -0.08 0.00 -1.71 0.00 0.00 66.02 60.81 1x4j s SER 3 CO 0.77 0.22 1.29 -0.83 1.20 0.00 0.00 173.24 175.90 1x4j s GLY 4 N -2.12 2.30 0.30 9.45 0.00 -1.26 -5.03 107.32 110.96 1x4j s GLY 4 Ca 0.31 1.02 0.04 0.00 0.00 0.00 0.00 44.72 46.09 1x4j s GLY 4 CO 0.22 2.13 0.45 -0.45 0.00 0.00 0.00 173.10 175.45 1x4j s SER 5 N 0.77 6.16 -0.25 1.64 0.15 -1.26 -5.10 113.70 115.81 1x4j s SER 5 Ca 0.59 0.06 -0.02 0.00 0.70 0.00 0.00 55.95 57.29 1x4j s SER 5 Cb -0.34 -1.66 0.08 0.00 -1.71 0.00 0.00 66.02 62.39 1x4j s SER 5 CO 0.33 -0.28 0.05 -0.44 1.20 0.00 0.00 173.24 174.11 1x4j s SER 6 N -4.07 3.53 0.00 5.45 0.01 -1.26 -4.86 113.70 112.50 1x4j s SER 6 Ca 0.40 -1.23 0.00 0.00 1.31 0.00 0.00 55.95 56.42 1x4j s SER 6 Cb -0.09 -0.78 0.00 0.00 0.21 0.00 0.00 66.02 65.36 1x4j s SER 6 CO 0.31 -0.35 0.00 0.61 0.41 0.00 0.00 173.24 174.23 1x4j n GLY 7 N 4.92 0.28 3.31 3.44 0.00 -1.26 -5.15 105.19 110.73 1x4j n GLY 7 Ca -0.06 -0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.70 1x4j n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1x4j s GLN 8 N 0.00 1.19 0.66 1.61 -2.07 -1.26 -5.13 119.66 114.66 1x4j s GLN 8 Ca 0.00 -1.26 -0.16 0.00 -1.82 0.00 0.00 55.36 52.12 1x4j s GLN 8 Cb 0.00 -1.39 0.00 0.00 -1.09 0.00 0.00 33.01 30.54 1x4j s GLN 8 CO 0.00 0.31 1.19 -0.51 -1.32 0.00 0.00 175.29 174.96 1x4j s LEU 9 N -2.18 3.46 0.21 2.60 1.43 -1.26 -4.96 118.68 117.98 1x4j s LEU 9 Ca 0.10 2.29 -0.30 0.00 -1.03 0.00 0.00 54.13 55.19 1x4j s LEU 9 Cb -0.08 -4.58 -0.09 0.00 0.03 0.00 0.00 46.19 41.46 1x4j s LEU 9 CO 0.05 -1.88 1.29 -2.16 0.23 0.00 0.00 176.35 173.89 1x4j s PRO 10 N -3.73 4.40 -0.20 1.29 0.04 -1.26 -5.02 135.00 130.52 1x4j s PRO 10 Ca 0.74 2.05 -0.08 0.00 0.04 0.00 0.00 61.00 63.74 1x4j s PRO 10 Cb -0.28 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.03 1x4j s PRO 10 CO 0.40 -0.22 0.09 -1.54 0.04 0.00 0.00 177.00 175.77 1x4j s SER 11 N 0.22 5.75 0.00 6.66 1.04 -1.26 -4.55 113.70 121.57 1x4j s SER 11 Ca 0.55 0.08 -0.10 0.00 0.48 0.00 0.00 55.95 56.97 1x4j s SER 11 Cb -0.36 -2.00 0.01 0.00 0.10 0.00 0.00 66.02 63.76 1x4j s SER 11 CO 0.39 0.13 0.19 -0.72 0.98 0.00 0.00 173.24 174.22 1x4j s TYR 12 N 0.62 -0.02 -0.04 5.02 -0.85 -1.26 -5.04 117.35 115.78 1x4j s TYR 12 Ca 0.05 -0.04 -0.17 0.00 -0.52 0.00 0.00 57.07 56.38 1x4j s TYR 12 Cb -0.13 -0.00 -0.05 0.00 0.38 0.00 0.00 41.96 42.16 1x4j s TYR 12 CO 0.01 -0.34 0.48 1.03 -1.52 0.00 0.00 175.55 175.21 1x4j s ARG 13 N -1.53 4.18 -0.14 -3.49 0.52 -1.26 -3.17 118.95 114.06 1x4j s ARG 13 Ca -0.13 0.50 -0.34 0.00 -0.52 0.00 0.00 55.73 55.24 1x4j s ARG 13 Cb -0.06 -3.33 -0.12 0.00 0.52 0.00 0.00 34.95 31.97 1x4j s ARG 13 CO 0.02 0.43 1.93 0.34 0.02 0.00 0.00 175.30 178.03 1x4j n PHE 14 N 2.68 2.22 -3.53 -0.53 -0.00 -1.08 -4.88 117.46 112.34 1x4j n PHE 14 Ca -0.10 0.05 -0.42 0.00 -0.00 0.00 0.00 57.45 56.98 1x4j n PHE 14 Cb 0.52 -2.64 -0.09 0.00 -0.00 0.00 0.00 39.48 37.26 1x4j n PHE 14 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.76 177.97 1x4j s ASN 15 N 4.66 5.85 0.00 -2.13 3.84 -1.26 -3.33 114.94 122.56 1x4j s ASN 15 Ca 0.96 -1.31 0.10 0.00 0.21 0.00 0.00 52.86 52.81 1x4j s ASN 15 Cb -0.72 -2.07 0.58 0.00 -0.55 0.00 0.00 41.25 38.49 1x4j s ASN 15 CO 0.52 -0.54 1.02 -0.81 -2.79 0.00 0.00 177.10 174.50 1x4j n PRO 16 N 5.04 0.49 -0.08 0.43 -0.04 -1.26 -2.52 135.00 137.07 1x4j n PRO 16 Ca -0.11 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.25 1x4j n PRO 16 Cb 0.44 -1.31 -0.09 0.00 -0.04 0.00 0.00 33.50 32.50 1x4j n PRO 16 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1x4j n ASN 17 N -0.81 2.24 -3.53 3.54 4.13 -1.26 -4.99 115.26 114.57 1x4j n ASN 17 Ca 0.07 -0.06 -0.01 0.00 1.68 0.00 0.00 54.58 56.27 1x4j n ASN 17 Cb 0.03 0.18 -0.04 0.00 -1.54 0.00 0.00 39.78 38.42 1x4j n ASN 17 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1x4j s ASN 18 N -5.27 -1.09 0.24 6.41 4.22 -1.05 -5.17 114.94 113.24 1x4j s ASN 18 Ca -0.17 1.33 0.11 0.00 -2.14 0.00 0.00 52.86 52.00 1x4j s ASN 18 Cb 0.05 2.16 -0.05 0.00 1.28 0.00 0.00 41.25 44.70 1x4j s ASN 18 CO 0.47 -0.23 -0.20 -1.38 -2.04 0.00 0.00 177.10 173.72 1x4j s HIS 19 N 2.86 2.34 0.20 1.54 -3.43 -1.25 -4.53 115.29 113.02 1x4j s HIS 19 Ca 0.01 -0.33 -0.11 0.00 -0.80 0.00 0.00 55.06 53.83 1x4j s HIS 19 Cb -0.13 -1.08 0.16 0.00 -1.43 0.00 0.00 32.58 30.10 1x4j s HIS 19 CO -0.19 0.62 1.86 -0.56 -2.00 0.00 0.00 174.74 174.47 1x4j h GLN 20 N 2.65 0.88 -4.19 -0.38 3.07 -2.00 -3.41 115.11 111.74 1x4j h GLN 20 Ca -0.43 -0.05 -0.49 0.00 0.09 0.00 0.00 58.65 57.76 1x4j h GLN 20 Cb 1.24 -0.20 -0.36 0.00 0.08 0.00 0.00 27.48 28.24 1x4j h GLN 20 CO 0.55 0.58 -0.80 -1.54 0.09 0.00 0.00 178.83 177.72 1x4j s SER 21 N -5.79 1.83 0.65 0.06 1.04 -1.26 -5.00 113.70 105.24 1x4j s SER 21 Ca -0.13 -0.24 0.27 0.00 0.48 0.00 0.00 55.95 56.33 1x4j s SER 21 Cb 0.15 -0.72 1.47 0.00 0.10 0.00 0.00 66.02 67.02 1x4j s SER 21 CO 0.77 -0.09 1.84 1.05 0.98 0.00 0.00 173.24 177.79 1x4j h GLU 22 N 7.81 0.00 -4.81 4.02 4.11 -2.03 -3.32 114.58 120.36 1x4j h GLU 22 Ca -0.30 0.00 -0.70 0.00 0.07 0.00 0.00 59.36 58.44 1x4j h GLU 22 Cb 1.14 0.00 -0.19 0.00 0.50 0.00 0.00 28.75 30.20 1x4j h GLU 22 CO 0.41 0.00 0.44 1.14 0.07 0.00 0.00 179.01 181.07 1x4j s GLN 23 N -4.19 3.34 -0.36 1.06 -2.07 -1.26 -4.98 119.66 111.20 1x4j s GLN 23 Ca -0.03 -1.57 0.04 0.00 -1.82 0.00 0.00 55.36 51.98 1x4j s GLN 23 Cb 0.09 -4.52 0.10 0.00 -1.09 0.00 0.00 33.01 27.60 1x4j s GLN 23 CO 0.31 -1.64 0.07 -0.08 -1.32 0.00 0.00 175.29 172.63 1x4j s THR 24 N 2.55 2.26 0.00 3.63 -1.32 -1.25 -4.85 115.64 116.66 1x4j s THR 24 Ca 0.22 -2.42 -0.08 0.00 -1.21 0.00 0.00 61.69 58.20 1x4j s THR 24 Cb -0.14 -2.66 0.00 0.00 -1.51 0.00 0.00 72.50 68.19 1x4j s THR 24 CO -0.01 -0.62 0.15 -0.22 -2.21 0.00 0.00 174.62 171.70 1x4j s LEU 25 N 0.80 1.52 -0.65 9.08 0.20 -1.26 -4.47 118.68 123.91 1x4j s LEU 25 Ca 0.12 -0.19 -0.14 0.00 0.69 0.00 0.00 54.13 54.61 1x4j s LEU 25 Cb -0.20 0.70 0.16 0.00 -0.43 0.00 0.00 46.19 46.43 1x4j s LEU 25 CO -0.08 -0.37 0.58 0.00 -0.29 0.00 0.00 176.35 176.20 1x4j h VAL 27 N 5.47 0.63 0.00 0.00 3.04 -1.87 2.20 116.25 125.73 1x4j h VAL 27 Ca -0.12 -0.20 0.00 0.00 -1.01 0.00 0.00 66.70 65.36 1x4j h VAL 27 Cb 1.07 -0.01 0.00 0.00 -2.01 0.00 0.00 31.29 30.34 1x4j h VAL 27 CO 0.90 0.11 0.00 0.52 -1.01 0.00 0.00 177.57 178.09 1x4j n VAL 28 N -4.70 0.00 -0.72 1.51 0.31 -1.26 -2.92 118.33 110.55 1x4j n VAL 28 Ca 0.24 1.47 0.00 0.00 -0.01 0.00 0.00 64.34 66.04 1x4j n VAL 28 Cb 0.69 -2.30 0.31 0.00 -0.91 0.00 0.00 33.84 31.63 1x4j n VAL 28 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1x4j n MET 30 N 0.22 -0.78 -3.83 0.00 0.00 0.74 -4.90 117.12 108.57 1x4j n MET 30 Ca 0.30 -0.03 -0.13 0.00 0.00 0.00 0.00 57.70 57.85 1x4j n MET 30 Cb 1.18 -1.89 -0.14 0.00 0.00 0.00 0.00 33.22 32.37 1x4j n MET 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1x4j s ASP 32 N 0.34 6.63 0.37 0.00 1.47 -1.26 -1.00 116.67 123.22 1x4j s ASP 32 Ca -0.03 0.88 -0.14 0.00 1.18 0.00 0.00 52.55 54.44 1x4j s ASP 32 Cb -0.04 -2.54 -0.12 0.00 -0.34 0.00 0.00 42.92 39.88 1x4j s ASP 32 CO -0.01 -1.18 -0.06 0.49 0.68 0.00 0.00 175.17 175.09 1x4j n PHE 33 N 7.82 -2.11 -2.45 2.11 3.72 -1.26 -4.95 117.46 120.34 1x4j n PHE 33 Ca 0.14 0.38 -0.21 0.00 -0.05 0.00 0.00 57.45 57.70 1x4j n PHE 33 Cb 0.48 -1.31 0.12 0.00 -0.94 0.00 0.00 39.48 37.82 1x4j n PHE 33 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1x4j n GLU 34 N 1.13 -0.20 -3.13 -1.08 1.02 -1.26 -5.07 120.64 112.05 1x4j n GLU 34 Ca 0.07 -2.31 -0.33 0.00 -0.02 0.00 0.00 57.16 54.57 1x4j n GLU 34 Cb 0.35 -0.68 -0.06 0.00 -0.02 0.00 0.00 31.44 31.03 1x4j n GLU 34 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1x4j s SER 35 N -4.69 6.80 -1.24 1.62 1.04 -1.26 -4.17 113.70 111.80 1x4j s SER 35 Ca 0.60 1.30 -0.01 0.00 0.48 0.00 0.00 55.95 58.32 1x4j s SER 35 Cb -0.03 -2.38 -0.00 0.00 0.10 0.00 0.00 66.02 63.71 1x4j s SER 35 CO 0.40 -0.19 0.85 0.54 0.98 0.00 0.00 173.24 175.83 1x4j n ARG 36 N -0.27 -5.56 -3.96 4.02 1.74 -1.21 -4.95 116.66 106.46 1x4j n ARG 36 Ca 0.03 0.74 -0.11 0.00 -0.77 0.00 0.00 57.85 57.74 1x4j n ARG 36 Cb 0.53 -5.52 -0.12 0.00 -1.02 0.00 0.00 32.46 26.33 1x4j n ARG 36 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1x4j s GLN 37 N -5.62 0.23 0.32 5.56 -1.52 -1.26 -4.96 119.66 112.42 1x4j s GLN 37 Ca 0.03 -0.38 -0.28 0.00 -1.95 0.00 0.00 55.36 52.78 1x4j s GLN 37 Cb -0.01 -0.00 -0.09 0.00 -0.22 0.00 0.00 33.01 32.69 1x4j s GLN 37 CO 0.77 -0.01 1.08 -1.17 -0.25 0.00 0.00 175.29 175.71 1x4j s LEU 38 N -0.86 4.42 0.09 2.90 2.96 -1.26 -2.65 118.68 124.28 1x4j s LEU 38 Ca -0.09 2.20 -0.02 0.00 -0.22 0.00 0.00 54.13 56.00 1x4j s LEU 38 Cb -0.06 -3.81 -0.04 0.00 0.50 0.00 0.00 46.19 42.79 1x4j s LEU 38 CO -0.00 -0.26 0.04 -0.76 -1.32 0.00 0.00 176.35 174.04 1x4j s LEU 39 N -1.83 2.05 -0.10 -0.68 1.43 -1.19 -3.40 118.68 114.96 1x4j s LEU 39 Ca 0.49 -1.05 0.00 0.00 -1.03 0.00 0.00 54.13 52.53 1x4j s LEU 39 Cb -0.29 0.35 0.02 0.00 0.03 0.00 0.00 46.19 46.30 1x4j s LEU 39 CO 0.37 -0.68 -0.08 -0.13 0.23 0.00 0.00 176.35 176.06 1x4j s ARG 40 N -3.97 1.49 -0.25 1.70 1.81 -0.76 -4.18 118.95 114.78 1x4j s ARG 40 Ca 0.14 -0.26 -0.13 0.00 -1.72 0.00 0.00 55.73 53.76 1x4j s ARG 40 Cb 0.07 -1.48 -0.04 0.00 -0.45 0.00 0.00 34.95 33.05 1x4j s ARG 40 CO -0.05 -0.20 0.28 0.08 -0.68 0.00 0.00 175.30 174.74 1x4j s VAL 41 N 1.45 5.26 0.83 3.52 1.01 -1.26 -1.50 120.40 129.71 1x4j s VAL 41 Ca -0.00 0.41 -0.11 0.00 0.00 0.00 0.00 61.98 62.28 1x4j s VAL 41 Cb -0.13 -3.62 0.10 0.00 0.00 0.00 0.00 36.38 32.73 1x4j s VAL 41 CO -0.05 0.24 1.15 -0.76 0.00 0.00 0.00 175.10 175.68 1x4j s LEU 42 N 1.59 3.01 0.00 3.92 1.43 0.21 -4.85 118.68 123.99 1x4j s LEU 42 Ca 0.12 2.14 0.08 0.00 -1.03 0.00 0.00 54.13 55.44 1x4j s LEU 42 Cb -0.15 -4.56 0.46 0.00 0.03 0.00 0.00 46.19 41.97 1x4j s LEU 42 CO 0.08 -2.64 0.91 -0.81 0.23 0.00 0.00 176.35 174.13 1x4j n PRO 43 N -3.69 0.49 -0.28 1.29 -0.04 -1.26 -2.00 135.00 129.52 1x4j n PRO 43 Ca 0.12 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.65 1x4j n PRO 43 Cb 0.52 -1.24 0.20 0.00 -0.04 0.00 0.00 33.50 32.94 1x4j n PRO 43 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x4j n ASN 45 N 0.52 -2.17 -3.88 0.00 5.15 -0.85 -5.07 115.26 108.96 1x4j n ASN 45 Ca 0.16 -0.17 -0.17 0.00 -0.60 0.00 0.00 54.58 53.80 1x4j n ASN 45 Cb 0.56 -1.78 -0.15 0.00 -0.53 0.00 0.00 39.78 37.87 1x4j n ASN 45 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 1x4j s HIS 46 N -3.10 0.40 0.14 1.20 3.76 -1.23 -4.97 115.29 111.49 1x4j s HIS 46 Ca 0.02 -0.06 -0.14 0.00 -0.15 0.00 0.00 55.06 54.73 1x4j s HIS 46 Cb -0.00 -0.39 -0.07 0.00 1.11 0.00 0.00 32.58 33.23 1x4j s HIS 46 CO 0.20 -0.09 0.54 -1.21 -0.85 0.00 0.00 174.74 173.33 1x4j s GLU 47 N 0.58 3.96 0.29 1.40 2.02 -1.26 0.66 118.70 126.35 1x4j s GLU 47 Ca -0.06 0.46 -0.08 0.00 0.02 0.00 0.00 54.97 55.31 1x4j s GLU 47 Cb -0.09 -2.94 0.00 0.00 0.10 0.00 0.00 34.13 31.20 1x4j s GLU 47 CO -0.01 0.48 0.49 -0.06 0.02 0.00 0.00 175.26 176.18 1x4j s PHE 48 N -1.46 0.65 -0.20 1.61 0.08 -0.56 -4.64 117.98 113.46 1x4j s PHE 48 Ca 0.37 -0.98 -0.24 0.00 0.12 0.00 0.00 56.93 56.20 1x4j s PHE 48 Cb -0.15 0.10 -0.01 0.00 -0.57 0.00 0.00 43.02 42.39 1x4j s PHE 48 CO 0.19 -1.08 0.78 -1.01 -0.10 0.00 0.00 175.22 174.00 1x4j s HIS 49 N -3.50 3.38 0.58 0.36 3.76 -1.26 -1.83 115.29 116.77 1x4j s HIS 49 Ca 0.26 1.14 0.41 0.00 -0.15 0.00 0.00 55.06 56.72 1x4j s HIS 49 Cb -0.01 -2.97 1.44 0.00 1.11 0.00 0.00 32.58 32.16 1x4j s HIS 49 CO 0.14 -0.27 1.49 0.00 -0.85 0.00 0.00 174.74 175.25 1x4j h ALA 50 N 7.47 3.51 0.00 -1.40 0.00 -1.83 0.82 119.26 127.83 1x4j h ALA 50 Ca -0.28 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.45 1x4j h ALA 50 Cb 1.12 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 1x4j h ALA 50 CO 0.83 -2.14 -0.97 0.36 0.00 0.00 0.00 179.25 177.33 1x4j n LYS 51 N -3.69 0.51 0.02 0.00 2.85 -1.26 -4.12 118.16 112.46 1x4j n LYS 51 Ca 0.36 0.50 -0.06 0.00 -1.05 0.00 0.00 58.31 58.06 1x4j n LYS 51 Cb 1.80 -1.68 -0.04 0.00 -0.65 0.00 0.00 35.03 34.47 1x4j n LYS 51 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1x4j h VAL 53 N -0.27 0.04 -0.14 0.00 3.04 -1.28 1.69 116.25 119.33 1x4j h VAL 53 Ca 0.00 0.00 -0.23 0.00 -1.01 0.00 0.00 66.70 65.47 1x4j h VAL 53 Cb 0.28 0.04 0.01 0.00 -2.01 0.00 0.00 31.29 29.62 1x4j h VAL 53 CO -0.14 0.00 -0.79 -0.78 -1.01 0.00 0.00 177.57 174.85 1x4j h ASP 54 N 0.00 0.94 -0.17 3.17 3.58 -1.08 -2.11 116.42 120.75 1x4j h ASP 54 Ca 0.77 -0.64 -0.12 0.00 0.42 0.00 0.00 57.03 57.47 1x4j h ASP 54 Cb 3.40 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 44.16 1x4j h ASP 54 CO -0.01 1.43 -0.29 0.11 -2.88 0.00 0.00 179.24 177.60 1x4j h LYS 55 N 0.51 0.65 0.45 0.28 1.79 0.31 -2.90 116.57 117.66 1x4j h LYS 55 Ca -0.06 -0.28 -0.02 0.00 -2.18 0.00 0.00 60.65 58.11 1x4j h LYS 55 Cb 1.43 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.06 1x4j h LYS 55 CO 0.16 0.87 -0.21 2.35 -1.08 0.00 0.00 179.45 181.54 1x4j h TRP 56 N 0.56 -0.55 -1.03 -1.35 2.91 -1.35 -3.19 115.95 111.95 1x4j h TRP 56 Ca 0.07 -0.01 0.37 0.00 1.13 0.00 0.00 58.89 60.45 1x4j h TRP 56 Cb 0.78 0.18 -0.16 0.00 -0.51 0.00 0.00 29.16 29.46 1x4j h TRP 56 CO 0.03 -0.34 0.59 -0.07 -1.03 0.00 0.00 178.44 177.62 1x4j h LEU 57 N -1.02 0.42 -0.60 0.65 3.38 -1.43 0.76 115.31 117.47 1x4j h LEU 57 Ca -0.06 0.21 0.06 0.00 0.09 0.00 0.00 57.88 58.18 1x4j h LEU 57 Cb 0.46 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.34 1x4j h LEU 57 CO 0.10 -0.26 0.31 0.50 0.09 0.00 0.00 178.44 179.19 1x4j h LYS 58 N 0.18 0.57 0.03 1.13 3.64 -1.52 -2.96 116.57 117.63 1x4j h LYS 58 Ca 0.79 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 60.04 1x4j h LYS 58 Cb 1.98 -0.13 0.01 0.00 -0.41 0.00 0.00 32.23 33.68 1x4j h LYS 58 CO -0.65 0.38 -0.39 0.00 -2.27 0.00 0.00 179.45 176.51 1x4j h ALA 59 N 1.33 0.01 -3.38 5.00 0.00 0.39 -3.45 119.26 119.14 1x4j h ALA 59 Ca 0.27 -0.54 -0.37 0.00 0.00 0.00 0.00 54.91 54.27 1x4j h ALA 59 Cb 0.19 0.03 -0.37 0.00 0.00 0.00 0.00 17.79 17.64 1x4j h ALA 59 CO -0.18 0.18 -0.75 -0.80 0.00 0.00 0.00 179.25 177.70 1x4j s ASN 60 N -6.52 0.90 0.00 0.00 0.01 0.53 -5.03 114.94 104.83 1x4j s ASN 60 Ca -0.15 -0.00 -0.05 0.00 -0.71 0.00 0.00 52.86 51.95 1x4j s ASN 60 Cb 0.01 -0.24 -0.21 0.00 0.41 0.00 0.00 41.25 41.21 1x4j s ASN 60 CO 0.77 -0.17 2.99 -1.14 -1.51 0.00 0.00 177.10 178.04 1x4j n ARG 61 N 4.74 1.59 -4.19 -0.60 3.00 -1.20 -3.55 116.66 116.46 1x4j n ARG 61 Ca -0.15 -0.79 -0.16 0.00 -0.00 0.00 0.00 57.85 56.76 1x4j n ARG 61 Cb 0.50 -1.88 -0.07 0.00 0.00 0.00 0.00 32.46 31.01 1x4j n ARG 61 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1x4j s THR 62 N 1.36 0.00 -0.17 5.15 -4.23 -1.26 -3.23 115.64 113.25 1x4j s THR 62 Ca 0.53 -1.83 -0.21 0.00 -1.18 0.00 0.00 61.69 59.00 1x4j s THR 62 Cb 0.25 -2.53 -0.03 0.00 1.34 0.00 0.00 72.50 71.53 1x4j s THR 62 CO 0.00 0.00 0.61 0.00 -0.54 0.00 0.00 174.62 174.69 1x4j n PRO 64 N 4.71 0.49 0.02 0.00 -0.04 -1.26 0.23 135.00 139.15 1x4j n PRO 64 Ca -0.02 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.42 1x4j n PRO 64 Cb 0.50 -1.08 -0.00 0.00 -0.04 0.00 0.00 33.50 32.88 1x4j n PRO 64 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1x4j n ILE 65 N -0.58 0.99 -1.05 0.52 5.41 -1.26 -4.81 119.36 118.58 1x4j n ILE 65 Ca 0.02 0.30 0.05 0.00 1.00 0.00 0.00 62.75 64.12 1x4j n ILE 65 Cb 0.01 -1.59 0.27 0.00 -0.71 0.00 0.00 39.64 37.62 1x4j n ILE 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1x4j n ARG 67 N -0.46 -2.11 -2.69 0.00 1.74 0.14 -4.79 116.66 108.48 1x4j n ARG 67 Ca 0.26 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.91 1x4j n ARG 67 Cb 0.99 -4.00 -0.03 0.00 -1.02 0.00 0.00 32.46 28.40 1x4j n ARG 67 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1x4j s ALA 68 N -1.50 3.16 0.02 7.54 0.00 -1.26 -4.47 121.76 125.25 1x4j s ALA 68 Ca 0.00 -0.69 -0.39 0.00 0.00 0.00 0.00 51.96 50.88 1x4j s ALA 68 Cb 0.00 -3.82 -0.20 0.00 0.00 0.00 0.00 23.12 19.10 1x4j s ALA 68 CO 0.00 -2.27 1.02 -3.47 0.00 0.00 0.00 175.76 171.04 1x4j n ASP 69 N 7.69 -0.11 -0.00 0.00 -0.08 -1.26 -2.80 116.55 119.98 1x4j n ASP 69 Ca 0.09 1.16 -0.18 0.00 -1.51 0.00 0.00 54.79 54.34 1x4j n ASP 69 Cb 0.49 -0.93 -0.09 0.00 2.34 0.00 0.00 41.12 42.93 1x4j n ASP 69 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 1x4j h SER 70 N 2.82 0.81 -1.76 1.67 4.64 -1.86 -3.46 113.55 116.41 1x4j h SER 70 Ca -0.48 -0.68 0.25 0.00 -0.47 0.00 0.00 61.79 60.40 1x4j h SER 70 Cb 1.43 -0.24 -0.05 0.00 -0.31 0.00 0.00 62.40 63.23 1x4j h SER 70 CO 0.64 1.37 0.67 0.61 -0.87 0.00 0.00 176.83 179.25 1x4j n GLY 71 N 0.85 0.38 3.77 -0.77 0.00 -1.26 -4.83 105.19 103.33 1x4j n GLY 71 Ca -0.09 -1.01 -0.37 0.00 0.00 0.00 0.00 46.02 44.55 1x4j n GLY 71 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4j s PRO 72 N -2.02 3.71 -1.03 1.61 0.04 -1.26 -4.93 135.00 131.13 1x4j s PRO 72 Ca 0.23 1.75 -0.23 0.00 0.04 0.00 0.00 61.00 62.79 1x4j s PRO 72 Cb -0.01 -2.36 0.01 0.00 0.04 0.00 0.00 34.50 32.18 1x4j s PRO 72 CO 0.00 -0.59 1.69 -1.12 0.04 0.00 0.00 177.00 177.03 1x4j s SER 73 N -1.42 5.97 -0.07 6.66 0.01 -1.26 -4.79 113.70 118.80 1x4j s SER 73 Ca 0.65 -1.34 -0.03 0.00 1.31 0.00 0.00 55.95 56.54 1x4j s SER 73 Cb -0.28 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.37 1x4j s SER 73 CO 0.34 -2.01 0.13 -1.28 0.41 0.00 0.00 173.24 170.83 1x4j h SER 74 N 10.01 -0.09 0.00 2.44 0.87 -2.05 -3.56 113.55 121.17 1x4j h SER 74 Ca 0.20 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 1x4j h SER 74 Cb 0.99 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.97 1x4j h SER 74 CO 1.34 0.32 0.00 0.61 -0.53 0.00 0.00 176.83 178.57