#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 2.75 -3.21 1.61 3.41 -1.26 -4.99 113.62 111.93 1x4j n SER 2 Ca 0.00 1.19 0.04 0.00 -0.26 0.00 0.00 58.87 59.83 1x4j n SER 2 Cb 0.00 -1.47 -0.02 0.00 -0.26 0.00 0.00 64.21 62.47 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 -0.12 -1.10 0.00 4.04 0.15 -1.26 -5.14 113.70 110.27 1x4j s SER 3 Ca 0.59 0.80 0.00 0.00 0.70 0.00 0.00 55.95 58.05 1x4j s SER 3 Cb -0.59 1.97 0.00 0.00 -1.71 0.00 0.00 66.02 65.69 1x4j s SER 3 CO 0.58 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.43 1x4j n GLY 4 N 5.42 1.18 4.18 9.45 0.00 -1.26 -4.93 105.19 119.23 1x4j n GLY 4 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 1x4j n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x4j n SER 5 N 0.00 -2.66 -4.98 1.61 2.88 -1.26 -4.94 113.62 104.27 1x4j n SER 5 Ca 0.00 -1.02 -0.20 0.00 -1.33 0.00 0.00 58.87 56.33 1x4j n SER 5 Cb 0.00 -2.77 -0.00 0.00 -0.75 0.00 0.00 64.21 60.68 1x4j n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1x4j s SER 6 N -3.52 5.96 1.97 -3.46 1.04 -1.26 -4.78 113.70 109.65 1x4j s SER 6 Ca 0.59 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.91 1x4j s SER 6 Cb -0.32 -1.29 0.00 0.00 0.10 0.00 0.00 66.02 64.51 1x4j s SER 6 CO 0.92 -0.47 0.00 0.61 0.98 0.00 0.00 173.24 175.29 1x4j n GLY 7 N -1.70 2.14 3.55 7.32 0.00 -1.26 -4.48 105.19 110.76 1x4j n GLY 7 Ca -0.00 0.32 -0.32 0.00 0.00 0.00 0.00 46.02 46.02 1x4j n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x4j s GLN 8 N 0.00 2.25 0.72 1.61 -0.21 -1.26 -4.93 119.66 117.83 1x4j s GLN 8 Ca 0.00 0.79 -0.16 0.00 0.02 0.00 0.00 55.36 56.01 1x4j s GLN 8 Cb 0.00 -4.61 0.01 0.00 1.00 0.00 0.00 33.01 29.41 1x4j s GLN 8 CO 0.00 -3.30 1.10 1.28 -2.12 0.00 0.00 175.29 172.25 1x4j n LEU 9 N 15.07 4.34 -4.71 2.90 4.77 -1.26 -4.92 117.00 133.19 1x4j n LEU 9 Ca 0.33 0.70 -0.42 0.00 -0.03 0.00 0.00 56.01 56.59 1x4j n LEU 9 Cb 0.51 -1.46 -0.03 0.00 -2.33 0.00 0.00 43.42 40.11 1x4j n LEU 9 CO 0.67 -1.70 1.07 -2.16 -1.33 0.00 0.00 177.39 173.94 1x4j s PRO 10 N -3.47 4.31 -0.22 3.23 0.04 -1.26 -5.01 135.00 132.62 1x4j s PRO 10 Ca 0.76 2.03 -0.10 0.00 0.04 0.00 0.00 61.00 63.73 1x4j s PRO 10 Cb -0.35 -3.36 -0.05 0.00 0.04 0.00 0.00 34.50 30.79 1x4j s PRO 10 CO 0.48 -0.47 0.13 -1.54 0.04 0.00 0.00 177.00 175.63 1x4j s SER 11 N 1.36 6.02 -0.13 6.66 1.04 -1.26 -4.70 113.70 122.69 1x4j s SER 11 Ca 0.64 0.14 -0.20 0.00 0.48 0.00 0.00 55.95 57.01 1x4j s SER 11 Cb -0.35 -2.07 0.05 0.00 0.10 0.00 0.00 66.02 63.75 1x4j s SER 11 CO 0.29 0.12 0.51 -0.72 0.98 0.00 0.00 173.24 174.43 1x4j s TYR 12 N 0.70 -0.51 -0.00 5.02 -0.85 -1.26 -5.09 117.35 115.35 1x4j s TYR 12 Ca 0.07 1.13 -0.19 0.00 -0.52 0.00 0.00 57.07 57.55 1x4j s TYR 12 Cb -0.12 0.22 -0.06 0.00 0.38 0.00 0.00 41.96 42.38 1x4j s TYR 12 CO 0.01 -0.37 0.56 1.03 -1.52 0.00 0.00 175.55 175.26 1x4j s ARG 13 N -0.34 4.26 0.46 -3.49 0.52 -1.26 -3.74 118.95 115.35 1x4j s ARG 13 Ca -0.05 0.67 -0.22 0.00 -0.52 0.00 0.00 55.73 55.61 1x4j s ARG 13 Cb -0.03 -3.32 -0.10 0.00 0.52 0.00 0.00 34.95 32.02 1x4j s ARG 13 CO 0.03 0.43 0.85 0.34 0.02 0.00 0.00 175.30 176.97 1x4j n PHE 14 N 2.54 0.56 -3.60 -0.53 -0.00 -1.18 -4.92 117.46 110.32 1x4j n PHE 14 Ca -0.08 0.54 -0.24 0.00 -0.00 0.00 0.00 57.45 57.66 1x4j n PHE 14 Cb 0.51 -2.13 -0.17 0.00 -0.00 0.00 0.00 39.48 37.69 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 -0.90 2.11 0.00 -2.13 3.84 -1.26 -4.30 114.94 112.30 1x4j s ASN 15 Ca 0.66 -0.50 0.11 0.00 0.21 0.00 0.00 52.86 53.34 1x4j s ASN 15 Cb -0.54 -0.14 0.65 0.00 -0.55 0.00 0.00 41.25 40.67 1x4j s ASN 15 CO 0.55 -0.34 1.09 -0.81 -2.79 0.00 0.00 177.10 174.80 1x4j n PRO 16 N 5.29 0.49 -0.13 0.43 -0.04 -1.26 -1.09 135.00 138.69 1x4j n PRO 16 Ca -0.06 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.17 1x4j n PRO 16 Cb 0.49 -1.35 -0.11 0.00 -0.04 0.00 0.00 33.50 32.49 1x4j n PRO 16 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1x4j n ASN 17 N -0.85 1.98 -0.10 3.54 2.85 -1.26 -4.71 115.26 116.70 1x4j n ASN 17 Ca 0.08 0.04 -0.22 0.00 -0.11 0.00 0.00 54.58 54.37 1x4j n ASN 17 Cb 0.04 -0.57 -0.11 0.00 1.24 0.00 0.00 39.78 40.37 1x4j n ASN 17 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1x4j n ASN 18 N -3.61 1.86 -3.27 1.20 3.02 -1.11 -4.92 115.26 108.42 1x4j n ASN 18 Ca -0.48 0.42 -0.47 0.00 -0.03 0.00 0.00 54.58 54.02 1x4j n ASN 18 Cb 0.95 -0.96 -0.07 0.00 -0.61 0.00 0.00 39.78 39.09 1x4j n ASN 18 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1x4j n HIS 19 N -4.42 1.19 -0.07 3.10 8.25 -0.25 -4.84 115.22 118.18 1x4j n HIS 19 Ca -0.33 0.78 -0.21 0.00 -0.26 0.00 0.00 57.72 57.70 1x4j n HIS 19 Cb 0.69 -1.55 -0.13 0.00 1.12 0.00 0.00 29.99 30.12 1x4j n HIS 19 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1x4j n GLN 20 N 2.95 0.68 -2.20 -0.41 -0.00 -1.26 -4.93 117.38 112.21 1x4j n GLN 20 Ca 0.23 0.27 -0.32 0.00 -0.00 0.00 0.00 57.00 57.17 1x4j n GLN 20 Cb -0.04 -1.63 -0.01 0.00 -0.00 0.00 0.00 30.24 28.56 1x4j n GLN 20 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1x4j s SER 21 N -6.90 6.14 -0.00 2.61 1.04 -1.26 -4.98 113.70 110.35 1x4j s SER 21 Ca -0.29 1.72 0.00 0.00 0.48 0.00 0.00 55.95 57.86 1x4j s SER 21 Cb 0.08 -2.52 0.01 0.00 0.10 0.00 0.00 66.02 63.69 1x4j s SER 21 CO 0.66 -0.92 1.01 -1.84 0.98 0.00 0.00 173.24 173.12 1x4j n GLU 22 N -1.83 2.99 -0.37 4.02 -0.00 -1.26 -4.65 120.64 119.54 1x4j n GLU 22 Ca 0.08 -1.51 -0.01 0.00 -0.00 0.00 0.00 57.16 55.71 1x4j n GLU 22 Cb 0.53 -1.01 0.12 0.00 -0.00 0.00 0.00 31.44 31.09 1x4j n GLU 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1x4j n GLN 23 N -0.48 2.09 -1.94 3.44 10.64 -1.26 -4.86 117.38 125.01 1x4j n GLN 23 Ca 0.00 -1.14 -0.37 0.00 -1.83 0.00 0.00 57.00 53.67 1x4j n GLN 23 Cb 0.25 -1.66 -0.03 0.00 -0.86 0.00 0.00 30.24 27.94 1x4j n GLN 23 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.06 175.15 1x4j s THR 24 N -1.49 3.29 -0.02 -0.39 -1.32 -1.26 -4.92 115.64 109.53 1x4j s THR 24 Ca 0.20 0.13 -0.07 0.00 -1.21 0.00 0.00 61.69 60.75 1x4j s THR 24 Cb 0.16 -3.76 0.01 0.00 -1.51 0.00 0.00 72.50 67.40 1x4j s THR 24 CO 0.05 -0.73 0.15 -0.22 -2.21 0.00 0.00 174.62 171.66 1x4j s LEU 25 N 9.81 1.50 -0.57 9.08 0.20 -1.26 -4.36 118.68 133.09 1x4j s LEU 25 Ca 0.73 -0.05 -0.15 0.00 0.69 0.00 0.00 54.13 55.35 1x4j s LEU 25 Cb -0.13 0.64 0.14 0.00 -0.43 0.00 0.00 46.19 46.41 1x4j s LEU 25 CO 0.20 -0.28 0.52 0.00 -0.29 0.00 0.00 176.35 176.50 1x4j h VAL 27 N 5.77 0.50 0.25 0.00 3.04 -1.87 1.56 116.25 125.51 1x4j h VAL 27 Ca -0.24 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.44 1x4j h VAL 27 Cb 1.09 0.73 0.00 0.00 -2.01 0.00 0.00 31.29 31.10 1x4j h VAL 27 CO 0.99 0.00 -0.12 0.58 -1.01 0.00 0.00 177.57 178.01 1x4j h VAL 28 N 0.00 0.00 -0.56 1.51 2.07 -1.91 -3.27 116.25 114.10 1x4j h VAL 28 Ca 0.18 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.66 1x4j h VAL 28 Cb 0.89 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1x4j h VAL 28 CO -0.00 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.59 1x4j n MET 30 N 0.80 -1.28 -3.99 0.00 0.00 0.53 -4.91 117.12 108.27 1x4j n MET 30 Ca 0.24 0.19 -0.15 0.00 0.00 0.00 0.00 57.70 57.98 1x4j n MET 30 Cb 0.97 -4.66 -0.15 0.00 0.00 0.00 0.00 33.22 29.38 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 0.27 6.95 1.25 0.00 -4.77 -1.26 -1.46 116.67 117.65 1x4j s ASP 32 Ca -0.02 2.53 -0.16 0.00 -3.30 0.00 0.00 52.55 51.59 1x4j s ASP 32 Cb -0.05 -2.64 0.31 0.00 -1.09 0.00 0.00 42.92 39.45 1x4j s ASP 32 CO -0.01 -0.39 1.00 -0.36 0.70 0.00 0.00 175.17 176.11 1x4j s PHE 33 N -1.16 0.72 0.40 2.11 0.08 -1.26 -4.90 117.98 113.98 1x4j s PHE 33 Ca 0.47 0.91 -0.04 0.00 0.12 0.00 0.00 56.93 58.40 1x4j s PHE 33 Cb -0.37 -3.06 0.09 0.00 -0.57 0.00 0.00 43.02 39.11 1x4j s PHE 33 CO 0.48 -4.21 0.54 0.39 -0.10 0.00 0.00 175.22 172.33 1x4j n GLU 34 N -5.12 -0.16 0.02 0.44 1.02 -1.26 -5.02 120.64 110.56 1x4j n GLU 34 Ca 0.06 -1.12 0.04 0.00 -0.02 0.00 0.00 57.16 56.13 1x4j n GLU 34 Cb 0.57 -0.47 -0.10 0.00 -0.02 0.00 0.00 31.44 31.42 1x4j n GLU 34 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1x4j n SER 35 N -3.17 0.49 -3.19 1.62 7.64 -1.26 -4.55 113.62 111.20 1x4j n SER 35 Ca 0.08 0.20 -0.22 0.00 1.01 0.00 0.00 58.87 59.94 1x4j n SER 35 Cb 0.27 0.87 -0.05 0.00 -1.01 0.00 0.00 64.21 64.29 1x4j n SER 35 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1x4j n ARG 36 N -2.64 1.36 -3.84 1.43 1.85 -1.26 -4.03 116.66 109.53 1x4j n ARG 36 Ca -0.09 -3.67 -0.12 0.00 -1.00 0.00 0.00 57.85 52.97 1x4j n ARG 36 Cb 0.74 -1.66 -0.09 0.00 -1.05 0.00 0.00 32.46 30.40 1x4j n ARG 36 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1x4j s GLN 37 N -2.12 0.56 0.25 2.89 -0.21 -1.26 -4.97 119.66 114.80 1x4j s GLN 37 Ca 0.39 -0.38 -0.30 0.00 0.02 0.00 0.00 55.36 55.10 1x4j s GLN 37 Cb 0.25 0.24 -0.09 0.00 1.00 0.00 0.00 33.01 34.41 1x4j s GLN 37 CO -0.09 -0.15 1.11 -1.17 -2.12 0.00 0.00 175.29 172.87 1x4j s LEU 38 N -1.47 4.53 0.28 2.90 2.96 -1.26 -3.12 118.68 123.50 1x4j s LEU 38 Ca -0.13 2.24 0.02 0.00 -0.22 0.00 0.00 54.13 56.04 1x4j s LEU 38 Cb -0.06 -3.62 -0.05 0.00 0.50 0.00 0.00 46.19 42.96 1x4j s LEU 38 CO 0.02 -0.18 0.11 -0.76 -1.32 0.00 0.00 176.35 174.22 1x4j s LEU 39 N -1.15 1.70 -0.11 -0.68 1.43 -1.25 -3.62 118.68 115.00 1x4j s LEU 39 Ca 0.46 -1.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.12 1x4j s LEU 39 Cb -0.32 0.03 0.02 0.00 0.03 0.00 0.00 46.19 45.96 1x4j s LEU 39 CO 0.40 -0.77 -0.10 -0.13 0.23 0.00 0.00 176.35 175.97 1x4j s ARG 40 N -3.95 1.71 -0.36 1.70 1.81 0.71 -4.52 118.95 116.06 1x4j s ARG 40 Ca 0.36 -0.34 -0.15 0.00 -1.72 0.00 0.00 55.73 53.88 1x4j s ARG 40 Cb 0.07 -1.65 -0.01 0.00 -0.45 0.00 0.00 34.95 32.91 1x4j s ARG 40 CO 0.15 -0.20 0.34 0.08 -0.68 0.00 0.00 175.30 174.98 1x4j s VAL 41 N 1.46 5.20 0.86 3.52 1.01 -1.26 -0.55 120.40 130.65 1x4j s VAL 41 Ca 0.01 -0.13 -0.11 0.00 0.00 0.00 0.00 61.98 61.75 1x4j s VAL 41 Cb -0.13 -3.83 0.12 0.00 0.00 0.00 0.00 36.38 32.53 1x4j s VAL 41 CO -0.06 -0.13 1.17 -0.76 0.00 0.00 0.00 175.10 175.32 1x4j s LEU 42 N 1.93 2.98 0.00 3.92 1.43 0.18 -4.85 118.68 124.27 1x4j s LEU 42 Ca 0.10 2.27 0.09 0.00 -1.03 0.00 0.00 54.13 55.56 1x4j s LEU 42 Cb -0.17 -4.58 0.56 0.00 0.03 0.00 0.00 46.19 42.03 1x4j s LEU 42 CO 0.11 -2.91 1.00 -0.81 0.23 0.00 0.00 176.35 173.98 1x4j n PRO 43 N -3.81 0.49 -0.34 1.29 -0.04 -1.26 -2.05 135.00 129.27 1x4j n PRO 43 Ca 0.13 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.67 1x4j n PRO 43 Cb 0.51 -1.30 0.25 0.00 -0.04 0.00 0.00 33.50 32.92 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 0.82 -3.05 -4.08 0.00 2.85 -0.87 -5.05 115.26 105.88 1x4j n ASN 45 Ca 0.19 -0.17 -0.24 0.00 -0.11 0.00 0.00 54.58 54.25 1x4j n ASN 45 Cb 0.62 -1.90 -0.16 0.00 1.24 0.00 0.00 39.78 39.58 1x4j n ASN 45 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 1x4j s HIS 46 N -3.10 1.39 0.13 1.20 3.76 -1.23 -4.98 115.29 112.46 1x4j s HIS 46 Ca 0.14 -0.38 -0.15 0.00 -0.15 0.00 0.00 55.06 54.52 1x4j s HIS 46 Cb -0.06 -0.95 -0.07 0.00 1.11 0.00 0.00 32.58 32.61 1x4j s HIS 46 CO 0.22 -0.14 0.55 -1.21 -0.85 0.00 0.00 174.74 173.32 1x4j s GLU 47 N 0.09 4.03 0.23 1.40 2.02 -1.26 0.50 118.70 125.71 1x4j s GLU 47 Ca -0.03 0.55 -0.12 0.00 0.02 0.00 0.00 54.97 55.39 1x4j s GLU 47 Cb -0.10 -3.00 -0.00 0.00 0.10 0.00 0.00 34.13 31.13 1x4j s GLU 47 CO 0.01 0.51 0.44 -0.06 0.02 0.00 0.00 175.26 176.18 1x4j s PHE 48 N -1.39 0.36 0.07 1.61 0.08 0.29 -4.69 117.98 114.31 1x4j s PHE 48 Ca 0.36 -0.71 -0.29 0.00 0.12 0.00 0.00 56.93 56.41 1x4j s PHE 48 Cb -0.16 0.13 -0.05 0.00 -0.57 0.00 0.00 43.02 42.37 1x4j s PHE 48 CO 0.19 -0.93 0.91 -1.01 -0.10 0.00 0.00 175.22 174.29 1x4j s HIS 49 N -4.00 3.76 0.59 0.36 3.76 -1.26 -0.20 115.29 118.29 1x4j s HIS 49 Ca 0.21 1.70 0.29 0.00 -0.15 0.00 0.00 55.06 57.10 1x4j s HIS 49 Cb 0.00 -3.01 1.53 0.00 1.11 0.00 0.00 32.58 32.21 1x4j s HIS 49 CO 0.07 0.18 1.96 0.00 -0.85 0.00 0.00 174.74 176.09 1x4j h ALA 50 N 5.85 2.07 0.00 -1.40 0.00 -1.82 -0.33 119.26 123.63 1x4j h ALA 50 Ca -0.43 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.20 1x4j h ALA 50 Cb 1.21 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 1x4j h ALA 50 CO 0.72 -0.59 -1.47 0.36 0.00 0.00 0.00 179.25 178.27 1x4j n LYS 51 N -3.75 0.57 0.06 0.00 2.85 -1.26 -3.84 118.16 112.78 1x4j n LYS 51 Ca 0.06 0.53 -0.03 0.00 -1.05 0.00 0.00 58.31 57.82 1x4j n LYS 51 Cb 0.56 -1.71 -0.02 0.00 -0.65 0.00 0.00 35.03 33.22 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 -0.18 0.18 0.43 0.00 3.04 -1.33 0.75 116.25 119.14 1x4j h VAL 53 Ca -0.01 -0.06 -0.01 0.00 -1.01 0.00 0.00 66.70 65.61 1x4j h VAL 53 Cb 0.15 -0.02 -0.03 0.00 -2.01 0.00 0.00 31.29 29.38 1x4j h VAL 53 CO 0.01 0.03 -0.49 -0.78 -1.01 0.00 0.00 177.57 175.33 1x4j h ASP 54 N 0.18 -1.35 -0.81 3.17 1.82 -1.59 0.23 116.42 118.07 1x4j h ASP 54 Ca 0.75 0.11 0.00 0.00 -0.39 0.00 0.00 57.03 57.51 1x4j h ASP 54 Cb 1.80 0.45 -0.04 0.00 0.68 0.00 0.00 39.33 42.22 1x4j h ASP 54 CO -0.69 -0.63 0.51 0.50 -1.61 0.00 0.00 179.24 177.32 1x4j h LYS 55 N -0.94 1.09 0.75 0.28 3.64 -0.42 -2.89 116.57 118.09 1x4j h LYS 55 Ca -0.05 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.21 1x4j h LYS 55 Cb 0.83 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 1x4j h LYS 55 CO -0.09 0.75 -0.48 2.35 -2.27 0.00 0.00 179.45 179.71 1x4j h TRP 56 N 1.11 -1.28 -1.09 1.91 2.91 -0.64 -2.40 115.95 116.48 1x4j h TRP 56 Ca 0.29 -0.01 0.35 0.00 1.13 0.00 0.00 58.89 60.65 1x4j h TRP 56 Cb -0.08 0.46 -0.14 0.00 -0.51 0.00 0.00 29.16 28.90 1x4j h TRP 56 CO -0.01 -0.71 0.66 -0.07 -1.03 0.00 0.00 178.44 177.28 1x4j h LEU 57 N -1.16 0.43 -1.40 0.65 3.38 -0.46 1.19 115.31 117.93 1x4j h LEU 57 Ca -0.10 0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1x4j h LEU 57 Cb 0.94 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1x4j h LEU 57 CO 0.09 -0.12 0.28 0.11 0.09 0.00 0.00 178.44 178.89 1x4j h LYS 58 N 0.26 0.68 0.05 1.13 6.56 -1.22 -3.10 116.57 120.93 1x4j h LYS 58 Ca 0.74 -0.06 -0.20 0.00 -1.06 0.00 0.00 60.65 60.07 1x4j h LYS 58 Cb 1.91 -0.14 -0.01 0.00 -0.57 0.00 0.00 32.23 33.41 1x4j h LYS 58 CO -0.51 0.50 -1.04 0.00 -2.06 0.00 0.00 179.45 176.34 1x4j h ALA 59 N 1.62 0.16 -3.41 3.86 0.00 0.14 -3.46 119.26 118.17 1x4j h ALA 59 Ca 0.18 -0.99 -0.47 0.00 0.00 0.00 0.00 54.91 53.63 1x4j h ALA 59 Cb 0.01 0.45 -0.34 0.00 0.00 0.00 0.00 17.79 17.91 1x4j h ALA 59 CO -0.03 0.60 -0.80 -0.80 0.00 0.00 0.00 179.25 178.22 1x4j s ASN 60 N -6.79 1.49 -0.09 0.00 0.01 0.92 -5.01 114.94 105.46 1x4j s ASN 60 Ca -0.22 -0.23 0.00 0.00 -0.71 0.00 0.00 52.86 51.70 1x4j s ASN 60 Cb 0.03 -0.67 0.11 0.00 0.41 0.00 0.00 41.25 41.13 1x4j s ASN 60 CO 0.69 -0.02 1.41 0.54 -1.51 0.00 0.00 177.10 178.22 1x4j n ARG 61 N 4.04 1.25 -4.21 -0.60 1.74 -1.24 -3.67 116.66 113.97 1x4j n ARG 61 Ca -0.22 -0.57 -0.12 0.00 -0.77 0.00 0.00 57.85 56.17 1x4j n ARG 61 Cb 0.51 -1.22 -0.10 0.00 -1.02 0.00 0.00 32.46 30.63 1x4j n ARG 61 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1x4j s THR 62 N -0.69 0.49 0.00 0.55 -4.23 -1.26 -2.71 115.64 107.80 1x4j s THR 62 Ca 0.11 -1.95 -0.30 0.00 -1.18 0.00 0.00 61.69 58.36 1x4j s THR 62 Cb 0.09 -2.08 -0.04 0.00 1.34 0.00 0.00 72.50 71.81 1x4j s THR 62 CO 0.01 -0.49 1.13 0.00 -0.54 0.00 0.00 174.62 174.74 1x4j n PRO 64 N 4.35 0.49 0.04 0.00 -0.04 -1.26 0.50 135.00 139.07 1x4j n PRO 64 Ca 0.09 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1x4j n PRO 64 Cb 0.48 -1.01 -0.00 0.00 -0.04 0.00 0.00 33.50 32.93 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 -0.48 0.93 -1.06 0.52 5.41 -1.26 -4.82 119.36 118.59 1x4j n ILE 65 Ca 0.00 0.30 0.07 0.00 1.00 0.00 0.00 62.75 64.13 1x4j n ILE 65 Cb 0.00 -1.57 0.23 0.00 -0.71 0.00 0.00 39.64 37.59 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 -0.75 -2.60 -2.85 0.00 1.74 0.18 -4.80 116.66 107.58 1x4j n ARG 67 Ca 0.22 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.87 1x4j n ARG 67 Cb 0.86 -3.77 -0.04 0.00 -1.02 0.00 0.00 32.46 28.49 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 -1.65 3.27 -0.13 7.54 0.00 -1.26 -4.46 121.76 125.08 1x4j s ALA 68 Ca 0.00 -0.79 -0.42 0.00 0.00 0.00 0.00 51.96 50.76 1x4j s ALA 68 Cb 0.00 -3.59 -0.20 0.00 0.00 0.00 0.00 23.12 19.33 1x4j s ALA 68 CO 0.00 -1.97 1.20 -3.47 0.00 0.00 0.00 175.76 171.51 1x4j n ASP 69 N 7.03 0.30 0.15 0.00 -0.08 -1.26 -2.59 116.55 120.10 1x4j n ASP 69 Ca 0.06 1.16 0.12 0.00 -1.51 0.00 0.00 54.79 54.61 1x4j n ASP 69 Cb 0.48 -0.90 0.09 0.00 2.34 0.00 0.00 41.12 43.13 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 3.49 0.00 -3.48 1.67 4.64 -1.84 -3.47 113.55 114.56 1x4j h SER 70 Ca -0.49 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1x4j h SER 70 Cb 1.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 1x4j h SER 70 CO 0.73 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.30 1x4j n GLY 71 N 1.15 0.57 3.74 -0.77 0.00 -1.26 -4.85 105.19 103.78 1x4j n GLY 71 Ca 0.02 -1.86 -0.41 0.00 0.00 0.00 0.00 46.02 43.77 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 -1.40 4.41 -0.32 1.61 0.04 -1.26 -4.96 135.00 133.13 1x4j s PRO 72 Ca 0.00 2.04 -0.29 0.00 0.04 0.00 0.00 61.00 62.79 1x4j s PRO 72 Cb 0.00 -3.18 0.01 0.00 0.04 0.00 0.00 34.50 31.37 1x4j s PRO 72 CO 0.00 -0.19 1.24 0.45 0.04 0.00 0.00 177.00 178.54 1x4j s SER 73 N 0.10 6.72 0.14 6.66 0.15 -1.26 -4.93 113.70 121.29 1x4j s SER 73 Ca 0.54 1.11 -0.28 0.00 0.70 0.00 0.00 55.95 58.02 1x4j s SER 73 Cb -0.36 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 61.38 1x4j s SER 73 CO 0.40 -1.06 1.57 -1.28 1.20 0.00 0.00 173.24 174.08 1x4j h SER 74 N 9.06 -1.47 0.00 5.45 0.87 -2.01 -3.55 113.55 121.90 1x4j h SER 74 Ca -0.25 0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1x4j h SER 74 Cb 1.09 0.63 0.00 0.00 -0.44 0.00 0.00 62.40 63.67 1x4j h SER 74 CO 1.04 -0.39 0.00 0.61 -0.53 0.00 0.00 176.83 177.56