#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ndj h ILE 17 N 0.00 0.90 -1.86 -0.61 2.04 -1.97 -3.47 117.51 112.55 1ndj h ILE 17 Ca 0.00 -2.45 -0.65 0.00 1.00 0.00 0.00 64.86 62.75 1ndj h ILE 17 Cb 0.00 2.71 0.05 0.00 -0.74 0.00 0.00 36.82 38.84 1ndj h ILE 17 CO 0.00 0.83 0.58 0.41 0.00 0.00 0.00 178.15 179.97 1ndj n THR 18 N -3.66 0.02 -1.12 -0.27 -1.04 -1.26 -4.76 114.28 102.19 1ndj n THR 18 Ca -0.26 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.75 1ndj n THR 18 Cb 1.03 -1.06 0.00 0.00 -1.82 0.00 0.00 70.33 68.48 1ndj n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ndj n GLY 19 N 2.87 -0.21 3.50 3.41 0.00 -0.38 -5.01 105.19 109.36 1ndj n GLY 19 Ca 0.18 -1.65 -0.33 0.00 0.00 0.00 0.00 46.02 44.22 1ndj n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ndj s THR 20 N -2.09 3.58 0.09 2.61 2.01 -1.26 -1.72 115.64 118.85 1ndj s THR 20 Ca 0.00 -0.49 0.04 0.00 0.31 0.00 0.00 61.69 61.55 1ndj s THR 20 Cb 0.00 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 69.97 1ndj s THR 20 CO 0.00 0.54 -0.12 0.26 -0.69 0.00 0.00 174.62 174.62 1ndj s TRP 21 N -0.11 1.12 -0.02 4.92 0.52 0.17 -4.65 118.94 120.88 1ndj s TRP 21 Ca 0.01 -0.56 0.03 0.00 0.02 0.00 0.00 56.10 55.60 1ndj s TRP 21 Cb -0.13 -0.62 -0.00 0.00 -1.15 0.00 0.00 33.47 31.57 1ndj s TRP 21 CO 0.03 0.03 -0.10 0.71 0.02 0.00 0.00 176.95 177.64 1ndj s TYR 22 N -1.91 1.04 0.56 -1.98 1.51 -0.14 -0.13 117.35 116.30 1ndj s TYR 22 Ca 0.02 -0.24 0.07 0.00 -1.01 0.00 0.00 57.07 55.91 1ndj s TYR 22 Cb -0.06 -0.71 0.10 0.00 -0.11 0.00 0.00 41.96 41.17 1ndj s TYR 22 CO 0.01 -0.08 0.77 0.27 -1.11 0.00 0.00 175.55 175.41 1ndj n ASN 23 N 3.12 1.80 0.00 2.29 0.23 -1.03 0.51 115.26 122.18 1ndj n ASN 23 Ca -0.17 -2.34 0.13 0.00 -0.53 0.00 0.00 54.58 51.68 1ndj n ASN 23 Cb 0.55 -0.43 0.60 0.00 -2.08 0.00 0.00 39.78 38.42 1ndj n ASN 23 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ndj n GLN 24 N -2.26 0.00 0.00 -3.83 0.00 -1.23 -2.35 117.38 107.73 1ndj n GLN 24 Ca 0.15 0.02 0.13 0.00 0.00 0.00 0.00 57.00 57.31 1ndj n GLN 24 Cb 0.55 -1.50 0.46 0.00 0.00 0.00 0.00 30.24 29.75 1ndj n GLN 24 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1ndj n LEU 25 N -1.51 0.86 0.00 2.61 4.77 -1.26 -4.91 117.00 117.55 1ndj n LEU 25 Ca 0.07 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 1ndj n LEU 25 Cb 0.33 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1ndj n LEU 25 CO 0.26 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1ndj n GLY 26 N 1.31 0.70 3.72 -0.72 0.00 -0.99 -4.65 105.19 104.56 1ndj n GLY 26 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1ndj n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ndj s SER 27 N -3.00 3.99 -0.16 1.61 0.01 -1.26 -4.73 113.70 110.15 1ndj s SER 27 Ca 0.00 2.23 0.01 0.00 1.31 0.00 0.00 55.95 59.50 1ndj s SER 27 Cb 0.00 -2.57 0.02 0.00 0.21 0.00 0.00 66.02 63.68 1ndj s SER 27 CO 0.00 -2.40 -0.17 -0.89 0.41 0.00 0.00 173.24 170.19 1ndj s THR 28 N -2.28 1.83 -0.32 1.44 2.01 -0.95 -2.46 115.64 114.91 1ndj s THR 28 Ca 0.70 -0.80 -0.07 0.00 0.31 0.00 0.00 61.69 61.84 1ndj s THR 28 Cb -0.26 -1.68 0.03 0.00 0.01 0.00 0.00 72.50 70.60 1ndj s THR 28 CO 0.49 0.50 0.10 0.12 -0.69 0.00 0.00 174.62 175.14 1ndj s PHE 29 N 1.35 3.21 -0.25 4.92 5.36 0.82 -1.96 117.98 131.43 1ndj s PHE 29 Ca 0.04 -1.25 -0.07 0.00 -0.96 0.00 0.00 56.93 54.70 1ndj s PHE 29 Cb -0.13 -2.27 -0.02 0.00 -0.34 0.00 0.00 43.02 40.26 1ndj s PHE 29 CO -0.11 -0.67 0.05 0.42 -1.46 0.00 0.00 175.22 173.45 1ndj s ILE 30 N 1.44 4.10 0.07 3.12 1.01 -0.60 0.42 121.20 130.76 1ndj s ILE 30 Ca -0.00 -0.32 -0.08 0.00 0.00 0.00 0.00 60.65 60.25 1ndj s ILE 30 Cb -0.19 -2.94 -0.00 0.00 0.01 0.00 0.00 42.46 39.33 1ndj s ILE 30 CO 0.03 0.31 0.16 0.68 0.00 0.00 0.00 174.94 176.12 1ndj s VAL 31 N 1.57 0.14 -0.14 2.92 -7.23 -0.70 -1.47 120.40 115.49 1ndj s VAL 31 Ca 0.06 -1.15 0.02 0.00 -1.81 0.00 0.00 61.98 59.09 1ndj s VAL 31 Cb -0.15 -1.20 0.00 0.00 0.56 0.00 0.00 36.38 35.59 1ndj s VAL 31 CO 0.02 -0.64 -0.21 -0.89 -0.31 0.00 0.00 175.10 173.08 1ndj s THR 32 N -3.41 2.23 -0.62 5.32 2.01 0.27 -1.25 115.64 120.20 1ndj s THR 32 Ca 0.02 -0.93 -0.14 0.00 0.31 0.00 0.00 61.69 60.94 1ndj s THR 32 Cb 0.03 -1.90 0.16 0.00 0.01 0.00 0.00 72.50 70.80 1ndj s THR 32 CO -0.08 0.54 0.56 0.00 -0.69 0.00 0.00 174.62 174.95 1ndj s ALA 33 N 0.71 3.75 0.74 7.40 0.00 -1.26 -1.69 121.76 131.41 1ndj s ALA 33 Ca -0.09 -2.79 -0.11 0.00 0.00 0.00 0.00 51.96 48.97 1ndj s ALA 33 Cb -0.16 -3.28 0.04 0.00 0.00 0.00 0.00 23.12 19.72 1ndj s ALA 33 CO 0.01 -2.09 1.08 0.20 0.00 0.00 0.00 175.76 174.96 1ndj s GLY 34 N 2.99 1.70 0.01 0.00 0.00 -0.46 -4.86 107.32 106.71 1ndj s GLY 34 Ca 0.08 0.22 0.12 0.00 0.00 0.00 0.00 44.72 45.14 1ndj s GLY 34 CO -0.01 0.55 1.37 0.00 0.00 0.00 0.00 173.10 175.01 1ndj n ALA 35 N -3.33 1.51 -0.28 3.20 0.00 -1.26 -2.64 120.51 117.71 1ndj n ALA 35 Ca 0.09 -0.03 -0.02 0.00 0.00 0.00 0.00 53.44 53.48 1ndj n ALA 35 Cb 0.53 -1.19 0.21 0.00 0.00 0.00 0.00 19.45 19.01 1ndj n ALA 35 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1ndj n ASP 36 N -1.54 3.86 0.00 0.00 3.85 -1.26 -4.87 116.55 116.60 1ndj n ASP 36 Ca 0.03 -2.74 0.00 0.00 -0.71 0.00 0.00 54.79 51.37 1ndj n ASP 36 Cb 0.13 -0.65 0.00 0.00 -1.35 0.00 0.00 41.12 39.25 1ndj n ASP 36 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1ndj n GLY 37 N 0.09 0.32 3.91 6.12 0.00 -1.08 -5.01 105.19 109.54 1ndj n GLY 37 Ca 0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 1ndj n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ndj s ALA 38 N -1.70 3.67 -0.11 4.61 0.00 -1.25 -1.86 121.76 125.12 1ndj s ALA 38 Ca 0.00 -0.59 0.02 0.00 0.00 0.00 0.00 51.96 51.39 1ndj s ALA 38 Cb 0.00 -2.24 0.01 0.00 0.00 0.00 0.00 23.12 20.89 1ndj s ALA 38 CO 0.00 0.33 -0.17 -0.51 0.00 0.00 0.00 175.76 175.41 1ndj s LEU 39 N -3.38 1.82 0.00 0.00 1.02 -0.21 -1.35 118.68 116.58 1ndj s LEU 39 Ca 0.43 -0.46 -0.04 0.00 0.02 0.00 0.00 54.13 54.08 1ndj s LEU 39 Cb -0.11 -1.16 -0.00 0.00 0.02 0.00 0.00 46.19 44.94 1ndj s LEU 39 CO 0.29 0.05 0.07 -0.89 0.02 0.00 0.00 176.35 175.89 1ndj s THR 40 N 0.83 0.07 -4.61 5.49 2.01 -0.68 -0.23 115.64 118.53 1ndj s THR 40 Ca -0.09 -0.62 0.00 0.00 0.31 0.00 0.00 61.69 61.29 1ndj s THR 40 Cb -0.16 -0.31 0.00 0.00 0.01 0.00 0.00 72.50 72.04 1ndj s THR 40 CO 0.00 -0.34 0.00 0.61 -0.69 0.00 0.00 174.62 174.21 1ndj n GLY 41 N 1.83 -0.51 3.06 4.40 0.00 -1.21 0.98 105.19 113.74 1ndj n GLY 41 Ca -0.21 -0.79 -0.08 0.00 0.00 0.00 0.00 46.02 44.94 1ndj n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ndj s THR 42 N -3.85 0.18 -0.03 2.61 -4.23 -0.54 -1.73 115.64 108.05 1ndj s THR 42 Ca 0.00 -1.46 0.02 0.00 -1.18 0.00 0.00 61.69 59.07 1ndj s THR 42 Cb 0.00 -1.08 0.01 0.00 1.34 0.00 0.00 72.50 72.77 1ndj s THR 42 CO 0.00 -0.80 -0.07 0.12 -0.54 0.00 0.00 174.62 173.33 1ndj s PHE 43 N -3.06 0.83 -0.29 3.99 2.19 0.21 -1.56 117.98 120.28 1ndj s PHE 43 Ca -0.01 -0.21 0.03 0.00 0.33 0.00 0.00 56.93 57.07 1ndj s PHE 43 Cb 0.02 -0.62 0.07 0.00 -1.31 0.00 0.00 43.02 41.18 1ndj s PHE 43 CO -0.07 -0.12 -0.05 -2.00 1.83 0.00 0.00 175.22 174.81 1ndj s GLU 44 N 0.37 1.97 0.25 10.12 2.12 -0.83 -0.71 118.70 132.00 1ndj s GLU 44 Ca -0.05 -1.52 -0.30 0.00 0.36 0.00 0.00 54.97 53.46 1ndj s GLU 44 Cb -0.10 -2.99 -0.09 0.00 0.26 0.00 0.00 34.13 31.21 1ndj s GLU 44 CO 0.00 -0.70 1.25 0.45 -0.54 0.00 0.00 175.26 175.72 1ndj s SER 45 N 1.04 6.97 0.00 -1.70 0.15 -1.26 -2.25 113.70 116.65 1ndj s SER 45 Ca -0.02 2.42 0.28 0.00 0.70 0.00 0.00 55.95 59.33 1ndj s SER 45 Cb -0.20 -2.62 1.11 0.00 -1.71 0.00 0.00 66.02 62.60 1ndj s SER 45 CO -0.06 -0.42 1.84 0.00 1.20 0.00 0.00 173.24 175.79 1ndj n ALA 46 N 1.84 2.56 -2.49 5.45 0.00 -1.26 -4.69 120.51 121.91 1ndj n ALA 46 Ca 0.03 -0.15 -0.15 0.00 0.00 0.00 0.00 53.44 53.17 1ndj n ALA 46 Cb 0.43 -1.41 -0.07 0.00 0.00 0.00 0.00 19.45 18.40 1ndj n ALA 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1ndj s VAL 47 N -2.99 0.00 0.00 0.00 -7.23 -1.26 -4.99 120.40 103.93 1ndj s VAL 47 Ca 0.14 -1.85 0.00 0.00 -1.81 0.00 0.00 61.98 58.46 1ndj s VAL 47 Cb 0.19 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.62 1ndj s VAL 47 CO 0.56 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.96 1ndj n GLY 48 N -0.48 -2.75 2.69 2.32 0.00 -1.26 -4.45 105.19 101.25 1ndj n GLY 48 Ca 0.03 -1.74 -0.42 0.00 0.00 0.00 0.00 46.02 43.90 1ndj n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ndj n ASN 49 N -0.22 4.77 -4.06 1.61 2.85 -1.26 -4.82 115.26 114.13 1ndj n ASN 49 Ca 0.00 -2.85 -0.10 0.00 -0.11 0.00 0.00 54.58 51.52 1ndj n ASN 49 Cb 0.00 -1.61 -0.08 0.00 1.24 0.00 0.00 39.78 39.33 1ndj n ASN 49 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1ndj s ALA 50 N 2.57 0.38 0.00 5.20 0.00 -1.26 -4.45 121.76 124.20 1ndj s ALA 50 Ca 0.49 -1.18 0.00 0.00 0.00 0.00 0.00 51.96 51.27 1ndj s ALA 50 Cb 0.14 1.03 0.00 0.00 0.00 0.00 0.00 23.12 24.29 1ndj s ALA 50 CO -0.07 -0.65 0.00 -0.85 0.00 0.00 0.00 175.76 174.19 1ndj n GLU 51 N -0.24 0.00 -0.80 0.00 0.28 -1.26 -4.97 120.64 113.66 1ndj n GLU 51 Ca -0.04 0.00 0.10 0.00 -0.16 0.00 0.00 57.16 57.07 1ndj n GLU 51 Cb 0.64 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.47 1ndj n GLU 51 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1ndj n SER 52 N 0.00 -4.78 -4.78 -1.84 2.88 -1.26 -4.78 113.62 99.06 1ndj n SER 52 Ca 0.00 0.56 -0.37 0.00 -1.33 0.00 0.00 58.87 57.73 1ndj n SER 52 Cb 0.00 -2.57 -0.03 0.00 -0.75 0.00 0.00 64.21 60.86 1ndj n SER 52 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1ndj s ARG 53 N -2.67 4.14 0.06 -1.46 0.52 -1.26 -4.57 118.95 113.71 1ndj s ARG 53 Ca 0.00 1.63 0.09 0.00 -0.52 0.00 0.00 55.73 56.94 1ndj s ARG 53 Cb 0.00 -2.61 -0.03 0.00 0.52 0.00 0.00 34.95 32.83 1ndj s ARG 53 CO 0.00 -0.19 -0.26 0.71 0.02 0.00 0.00 175.30 175.58 1ndj s TYR 54 N -1.55 2.34 0.23 -0.53 1.51 0.12 -4.88 117.35 114.58 1ndj s TYR 54 Ca 0.57 -0.39 -0.31 0.00 -1.01 0.00 0.00 57.07 55.93 1ndj s TYR 54 Cb -0.25 -1.37 -0.10 0.00 -0.11 0.00 0.00 41.96 40.12 1ndj s TYR 54 CO 0.32 0.18 1.54 0.08 -1.11 0.00 0.00 175.55 176.55 1ndj s VAL 55 N -0.86 2.47 0.31 0.71 1.01 -1.26 -0.62 120.40 122.15 1ndj s VAL 55 Ca 0.12 0.37 0.10 0.00 0.00 0.00 0.00 61.98 62.58 1ndj s VAL 55 Cb -0.10 -3.24 -0.06 0.00 0.00 0.00 0.00 36.38 32.99 1ndj s VAL 55 CO 0.03 0.05 -0.14 -1.48 0.00 0.00 0.00 175.10 173.56 1ndj s LEU 56 N 0.20 2.65 0.01 3.92 0.05 -0.70 -4.35 118.68 120.46 1ndj s LEU 56 Ca 0.65 -1.12 -0.26 0.00 0.05 0.00 0.00 54.13 53.45 1ndj s LEU 56 Cb -0.44 -1.00 0.06 0.00 -2.05 0.00 0.00 46.19 42.76 1ndj s LEU 56 CO 0.40 -0.12 0.58 0.28 -0.55 0.00 0.00 176.35 176.94 1ndj s THR 57 N -2.62 0.02 0.00 5.48 -1.32 -0.98 -3.28 115.64 112.94 1ndj s THR 57 Ca 0.31 -0.13 0.00 0.00 -1.21 0.00 0.00 61.69 60.66 1ndj s THR 57 Cb -0.01 -0.96 0.00 0.00 -1.51 0.00 0.00 72.50 70.03 1ndj s THR 57 CO 0.15 -0.07 0.00 0.61 -2.21 0.00 0.00 174.62 173.10 1ndj n GLY 58 N 0.62 2.34 3.20 6.08 0.00 0.69 -1.28 105.19 116.84 1ndj n GLY 58 Ca -0.19 -0.65 -0.11 0.00 0.00 0.00 0.00 46.02 45.08 1ndj n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ndj s ARG 59 N 1.19 0.73 0.06 1.61 1.81 -0.56 -1.05 118.95 122.74 1ndj s ARG 59 Ca 0.00 -0.59 -0.10 0.00 -1.72 0.00 0.00 55.73 53.32 1ndj s ARG 59 Cb 0.00 0.31 0.00 0.00 -0.45 0.00 0.00 34.95 34.81 1ndj s ARG 59 CO 0.00 -0.22 0.21 1.52 -0.68 0.00 0.00 175.30 176.13 1ndj s TYR 60 N -2.56 0.07 -0.40 -0.53 1.13 -0.78 -0.85 117.35 113.44 1ndj s TYR 60 Ca -0.05 -0.37 -0.29 0.00 -1.41 0.00 0.00 57.07 54.95 1ndj s TYR 60 Cb -0.01 -0.02 0.02 0.00 -1.10 0.00 0.00 41.96 40.85 1ndj s TYR 60 CO -0.04 -0.50 1.21 0.34 -2.51 0.00 0.00 175.55 174.05 1ndj s ASP 61 N -2.45 6.65 0.00 -0.18 2.15 0.54 -4.61 116.67 118.77 1ndj s ASP 61 Ca -0.00 0.81 0.29 0.00 0.43 0.00 0.00 52.55 54.08 1ndj s ASP 61 Cb 0.02 -2.54 1.31 0.00 -0.30 0.00 0.00 42.92 41.40 1ndj s ASP 61 CO -0.07 -1.18 1.94 -1.54 -0.17 0.00 0.00 175.17 174.16 1ndj n SER 62 N 7.79 0.06 -3.26 -0.34 3.41 -1.26 -4.13 113.62 115.88 1ndj n SER 62 Ca 0.13 0.14 -0.25 0.00 -0.26 0.00 0.00 58.87 58.64 1ndj n SER 62 Cb 0.48 -0.35 -0.07 0.00 -0.26 0.00 0.00 64.21 64.01 1ndj n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ndj n ALA 63 N -1.38 2.92 -1.24 7.33 0.00 -1.26 -5.08 120.51 121.80 1ndj n ALA 63 Ca 0.10 -3.81 -0.30 0.00 0.00 0.00 0.00 53.44 49.44 1ndj n ALA 63 Cb 0.30 -0.84 0.13 0.00 0.00 0.00 0.00 19.45 19.05 1ndj n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ndj s PRO 64 N -1.55 1.30 0.64 0.00 0.04 -1.26 -4.96 135.00 129.20 1ndj s PRO 64 Ca 0.36 0.78 -0.17 0.00 0.04 0.00 0.00 61.00 62.01 1ndj s PRO 64 Cb 0.16 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.84 1ndj s PRO 64 CO -0.08 -2.20 0.85 0.00 0.04 0.00 0.00 177.00 175.61 1ndj n ALA 65 N -3.85 -0.29 0.08 8.56 0.00 -1.26 -4.95 120.51 118.80 1ndj n ALA 65 Ca 0.07 -0.07 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1ndj n ALA 65 Cb 0.55 -2.04 -0.07 0.00 0.00 0.00 0.00 19.45 17.89 1ndj n ALA 65 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1ndj h THR 66 N 0.17 1.40 -1.06 0.00 2.02 -1.95 -3.32 112.91 110.18 1ndj h THR 66 Ca -0.48 -2.56 0.28 0.00 0.77 0.00 0.00 66.41 64.42 1ndj h THR 66 Cb 1.36 2.55 -0.10 0.00 -1.74 0.00 0.00 68.15 70.23 1ndj h THR 66 CO 0.48 0.76 0.68 -2.24 0.37 0.00 0.00 175.52 175.58 1ndj h ASP 67 N 0.21 0.43 0.00 4.18 3.04 -2.04 -3.45 116.42 118.79 1ndj h ASP 67 Ca -0.10 0.09 0.00 0.00 -3.24 0.00 0.00 57.03 53.77 1ndj h ASP 67 Cb 1.69 0.02 0.00 0.00 -1.04 0.00 0.00 39.33 40.00 1ndj h ASP 67 CO 0.18 0.07 0.00 0.61 -2.04 0.00 0.00 179.24 178.06 1ndj n GLY 68 N -1.48 1.66 3.92 7.15 0.00 -1.25 -5.13 105.19 110.06 1ndj n GLY 68 Ca 0.26 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.02 1ndj n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ndj s SER 69 N -2.00 6.01 1.14 1.61 0.01 -1.26 -5.06 113.70 114.15 1ndj s SER 69 Ca 0.00 0.68 -0.12 0.00 1.31 0.00 0.00 55.95 57.82 1ndj s SER 69 Cb 0.00 -1.94 0.27 0.00 0.21 0.00 0.00 66.02 64.56 1ndj s SER 69 CO 0.00 -0.69 1.04 -0.83 0.41 0.00 0.00 173.24 173.17 1ndj s GLY 70 N -4.17 1.56 -0.37 3.44 0.00 -1.26 -4.75 107.32 101.77 1ndj s GLY 70 Ca 0.48 -0.04 -0.17 0.00 0.00 0.00 0.00 44.72 44.99 1ndj s GLY 70 CO 0.42 0.65 0.43 -1.59 0.00 0.00 0.00 173.10 173.01 1ndj s THR 71 N -2.48 5.09 0.46 0.90 2.01 -0.35 -4.79 115.64 116.48 1ndj s THR 71 Ca 0.68 0.02 -0.21 0.00 0.31 0.00 0.00 61.69 62.49 1ndj s THR 71 Cb -0.25 -3.94 -0.08 0.00 0.01 0.00 0.00 72.50 68.25 1ndj s THR 71 CO 0.64 -0.24 1.06 0.00 -0.69 0.00 0.00 174.62 175.40 1ndj s ALA 72 N 2.18 2.92 0.31 7.40 0.00 -1.26 -0.54 121.76 132.77 1ndj s ALA 72 Ca 0.14 0.69 -0.19 0.00 0.00 0.00 0.00 51.96 52.60 1ndj s ALA 72 Cb -0.16 -3.28 0.05 0.00 0.00 0.00 0.00 23.12 19.72 1ndj s ALA 72 CO 0.13 -0.37 0.81 -0.48 0.00 0.00 0.00 175.76 175.85 1ndj s LEU 73 N -3.23 -0.10 -0.13 0.00 0.05 -0.95 -0.34 118.68 113.99 1ndj s LEU 73 Ca 0.65 -0.84 -0.30 0.00 0.05 0.00 0.00 54.13 53.68 1ndj s LEU 73 Cb -0.20 2.66 0.12 0.00 -2.05 0.00 0.00 46.19 46.73 1ndj s LEU 73 CO 0.24 -1.42 1.01 -0.83 -0.55 0.00 0.00 176.35 174.80 1ndj s GLY 74 N -3.04 -0.31 0.15 -3.48 0.00 -0.03 -1.99 107.32 98.62 1ndj s GLY 74 Ca 0.14 1.72 -0.13 0.00 0.00 0.00 0.00 44.72 46.45 1ndj s GLY 74 CO 0.08 0.77 0.38 0.66 0.00 0.00 0.00 173.10 174.99 1ndj s TRP 75 N -1.85 0.04 0.04 1.90 -2.14 -0.03 -1.50 118.94 115.40 1ndj s TRP 75 Ca 0.02 -0.39 0.07 0.00 2.66 0.00 0.00 56.10 58.46 1ndj s TRP 75 Cb -0.01 0.17 -0.02 0.00 -3.10 0.00 0.00 33.47 30.51 1ndj s TRP 75 CO -0.03 -0.75 -0.19 0.99 -2.66 0.00 0.00 176.95 174.31 1ndj s THR 76 N -3.88 1.55 -0.12 0.66 2.01 -0.41 -0.69 115.64 114.76 1ndj s THR 76 Ca 0.09 -1.12 0.01 0.00 0.31 0.00 0.00 61.69 60.98 1ndj s THR 76 Cb 0.02 -1.35 0.02 0.00 0.01 0.00 0.00 72.50 71.20 1ndj s THR 76 CO -0.06 0.19 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.23 1ndj s VAL 77 N -0.77 1.50 -0.25 3.82 1.01 -0.37 -2.32 120.40 123.02 1ndj s VAL 77 Ca 0.06 -0.62 -0.20 0.00 0.00 0.00 0.00 61.98 61.23 1ndj s VAL 77 Cb -0.08 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.89 1ndj s VAL 77 CO 0.01 0.44 0.60 0.00 0.00 0.00 0.00 175.10 176.16 1ndj s ALA 78 N 1.22 3.61 0.00 5.51 0.00 -1.26 -1.00 121.76 129.84 1ndj s ALA 78 Ca -0.02 -0.47 -0.03 0.00 0.00 0.00 0.00 51.96 51.45 1ndj s ALA 78 Cb -0.14 -3.00 -0.13 0.00 0.00 0.00 0.00 23.12 19.85 1ndj s ALA 78 CO -0.05 -0.79 2.36 0.91 0.00 0.00 0.00 175.76 178.19 1ndj n TRP 79 N 5.67 0.00 -5.10 0.00 7.02 0.47 -4.74 117.44 120.76 1ndj n TRP 79 Ca -0.01 -0.99 -0.32 0.00 -1.02 0.00 0.00 57.50 55.15 1ndj n TRP 79 Cb 0.49 -0.98 -0.16 0.00 -2.42 0.00 0.00 31.31 28.24 1ndj n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1ndj s LYS 80 N 1.12 3.01 0.04 -0.99 2.20 -1.26 -2.59 119.74 121.26 1ndj s LYS 80 Ca 0.32 -0.83 0.00 0.00 -0.36 0.00 0.00 55.97 55.11 1ndj s LYS 80 Cb 0.15 -2.36 -0.00 0.00 -1.51 0.00 0.00 37.83 34.11 1ndj s LYS 80 CO 0.00 0.25 0.04 0.27 -0.36 0.00 0.00 175.35 175.56 1ndj n ASN 81 N 3.34 -0.12 0.25 1.43 0.23 -0.16 -4.73 115.26 115.50 1ndj n ASN 81 Ca -0.18 -1.23 0.17 0.00 -0.53 0.00 0.00 54.58 52.81 1ndj n ASN 81 Cb 0.53 0.24 0.84 0.00 -2.08 0.00 0.00 39.78 39.31 1ndj n ASN 81 CO 0.00 0.00 0.00 0.78 -0.93 0.00 0.00 177.26 177.11 1ndj h ASN 82 N 0.23 0.00 0.00 0.53 4.21 -1.96 -3.22 115.58 115.37 1ndj h ASN 82 Ca -0.03 0.00 -0.40 0.00 1.21 0.00 0.00 56.30 57.08 1ndj h ASN 82 Cb 0.13 0.00 -0.07 0.00 -1.12 0.00 0.00 38.32 37.27 1ndj h ASN 82 CO 0.04 0.00 -2.47 -1.22 -1.29 0.00 0.00 177.43 172.49 1ndj n TYR 83 N -2.75 0.04 -3.97 1.19 4.01 -1.26 -5.05 117.16 109.37 1ndj n TYR 83 Ca -0.01 0.01 -0.09 0.00 -0.16 0.00 0.00 57.90 57.65 1ndj n TYR 83 Cb 0.13 -1.01 -0.05 0.00 -0.31 0.00 0.00 39.34 38.11 1ndj n TYR 83 CO 0.00 0.00 0.00 -0.98 -0.46 0.00 0.00 176.86 175.42 1ndj s ARG 84 N -2.52 1.59 -0.25 -0.72 1.70 -1.22 -5.12 118.95 112.41 1ndj s ARG 84 Ca -0.35 -1.20 -0.02 0.00 -0.47 0.00 0.00 55.73 53.69 1ndj s ARG 84 Cb 0.10 0.50 0.12 0.00 -0.57 0.00 0.00 34.95 35.09 1ndj s ARG 84 CO 0.59 -0.67 0.27 1.21 -1.08 0.00 0.00 175.30 175.62 1ndj s ASN 85 N -3.00 1.38 0.00 -2.89 3.84 -1.26 -0.99 114.94 112.03 1ndj s ASN 85 Ca 0.20 -0.41 0.18 0.00 0.21 0.00 0.00 52.86 53.05 1ndj s ASN 85 Cb -0.02 0.53 0.75 0.00 -0.55 0.00 0.00 41.25 41.96 1ndj s ASN 85 CO 0.09 -0.35 1.53 0.00 -2.79 0.00 0.00 177.10 175.58 1ndj n ALA 86 N 5.32 2.53 -3.81 1.71 0.00 -1.07 -4.92 120.51 120.27 1ndj n ALA 86 Ca -0.04 -0.42 -0.33 0.00 0.00 0.00 0.00 53.44 52.65 1ndj n ALA 86 Cb 0.48 -1.12 0.03 0.00 0.00 0.00 0.00 19.45 18.84 1ndj n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1ndj n HIS 87 N 0.06 -1.76 -3.44 0.00 8.25 -1.26 -4.86 115.22 112.22 1ndj n HIS 87 Ca 0.15 0.43 -0.13 0.00 -0.26 0.00 0.00 57.72 57.91 1ndj n HIS 87 Cb 0.25 -3.36 -0.02 0.00 1.12 0.00 0.00 29.99 27.98 1ndj n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1ndj s SER 88 N -3.65 -0.57 -0.01 0.41 1.04 -1.26 -1.59 113.70 108.08 1ndj s SER 88 Ca 0.39 0.06 -0.02 0.00 0.48 0.00 0.00 55.95 56.87 1ndj s SER 88 Cb -0.16 0.59 -0.00 0.00 0.10 0.00 0.00 66.02 66.55 1ndj s SER 88 CO 0.89 -0.93 0.04 0.00 0.98 0.00 0.00 173.24 174.22 1ndj s ALA 89 N -3.49 -0.09 -0.06 5.32 0.00 0.11 -0.40 121.76 123.16 1ndj s ALA 89 Ca -0.00 -0.03 0.02 0.00 0.00 0.00 0.00 51.96 51.95 1ndj s ALA 89 Cb -0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 1ndj s ALA 89 CO -0.11 -0.07 -0.10 0.99 0.00 0.00 0.00 175.76 176.47 1ndj s THR 90 N -0.39 3.40 -0.09 0.00 2.01 -0.17 -0.53 115.64 119.88 1ndj s THR 90 Ca -0.04 -0.59 0.04 0.00 0.31 0.00 0.00 61.69 61.40 1ndj s THR 90 Cb -0.03 -2.36 -0.00 0.00 0.01 0.00 0.00 72.50 70.12 1ndj s THR 90 CO -0.00 0.59 -0.23 0.42 -0.69 0.00 0.00 174.62 174.72 1ndj s THR 91 N -0.76 1.94 -0.20 -0.82 -4.23 -0.26 -1.24 115.64 110.08 1ndj s THR 91 Ca 0.12 -0.96 -0.07 0.00 -1.18 0.00 0.00 61.69 59.59 1ndj s THR 91 Cb -0.11 -1.68 -0.04 0.00 1.34 0.00 0.00 72.50 72.02 1ndj s THR 91 CO 0.01 0.54 0.06 0.26 -0.54 0.00 0.00 174.62 174.95 1ndj s TRP 92 N 0.25 3.20 -0.12 3.99 0.51 0.14 -1.20 118.94 125.71 1ndj s TRP 92 Ca -0.15 -0.04 0.02 0.00 -2.12 0.00 0.00 56.10 53.82 1ndj s TRP 92 Cb -0.17 -2.11 0.01 0.00 -0.81 0.00 0.00 33.47 30.39 1ndj s TRP 92 CO 0.07 0.03 -0.19 0.45 -0.51 0.00 0.00 176.95 176.80 1ndj s SER 93 N 0.66 2.81 0.00 2.95 0.15 0.81 -0.85 113.70 120.23 1ndj s SER 93 Ca 0.03 -0.52 0.00 0.00 0.70 0.00 0.00 55.95 56.16 1ndj s SER 93 Cb -0.13 -1.28 0.00 0.00 -1.71 0.00 0.00 66.02 62.89 1ndj s SER 93 CO 0.02 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.13 1ndj n GLY 94 N 4.07 1.68 2.97 9.45 0.00 -0.84 -1.41 105.19 121.10 1ndj n GLY 94 Ca -0.20 -0.45 -0.11 0.00 0.00 0.00 0.00 46.02 45.26 1ndj n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1ndj s GLN 95 N 1.60 0.21 0.06 1.61 -2.07 -0.76 -2.23 119.66 118.09 1ndj s GLN 95 Ca 0.00 -0.25 -0.24 0.00 -1.82 0.00 0.00 55.36 53.05 1ndj s GLN 95 Cb 0.00 0.08 -0.06 0.00 -1.09 0.00 0.00 33.01 31.95 1ndj s GLN 95 CO 0.00 -0.04 0.75 -0.47 -1.32 0.00 0.00 175.29 174.21 1ndj s TYR 96 N -0.72 3.76 -0.28 9.60 5.04 0.29 -1.33 117.35 133.71 1ndj s TYR 96 Ca -0.08 1.47 0.01 0.00 -2.44 0.00 0.00 57.07 56.03 1ndj s TYR 96 Cb -0.05 -2.79 0.08 0.00 0.35 0.00 0.00 41.96 39.55 1ndj s TYR 96 CO -0.00 0.32 0.00 0.08 -1.34 0.00 0.00 175.55 174.61 1ndj s VAL 97 N -0.23 1.61 1.24 3.14 1.01 0.10 -1.21 120.40 126.05 1ndj s VAL 97 Ca 0.37 -1.56 -0.17 0.00 0.00 0.00 0.00 61.98 60.62 1ndj s VAL 97 Cb -0.21 -2.01 0.30 0.00 0.00 0.00 0.00 36.38 34.46 1ndj s VAL 97 CO 0.23 -0.34 1.02 -0.83 0.00 0.00 0.00 175.10 175.17 1ndj s GLY 98 N 1.31 1.51 0.00 4.51 0.00 -1.26 -0.79 107.32 112.59 1ndj s GLY 98 Ca 0.01 -0.56 0.00 0.00 0.00 0.00 0.00 44.72 44.18 1ndj s GLY 98 CO -0.10 0.28 0.00 0.61 0.00 0.00 0.00 173.10 173.88 1ndj n GLY 99 N 0.38 0.39 0.15 0.20 0.00 -1.26 -4.64 105.19 100.41 1ndj n GLY 99 Ca 0.08 -1.85 0.13 0.00 0.00 0.00 0.00 46.02 44.38 1ndj n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ndj h ALA 100 N 0.00 1.00 -2.06 4.61 0.00 -2.06 -3.15 119.26 117.61 1ndj h ALA 100 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.24 1ndj h ALA 100 Cb 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 17.79 17.42 1ndj h ALA 100 CO 0.00 0.00 -0.09 -1.91 0.00 0.00 0.00 179.25 177.25 1ndj n GLU 101 N -2.53 3.39 -1.97 0.00 0.00 -1.26 -5.08 120.64 113.19 1ndj n GLU 101 Ca 0.05 -4.67 -0.40 0.00 0.00 0.00 0.00 57.16 52.14 1ndj n GLU 101 Cb 0.43 -2.34 -0.00 0.00 0.00 0.00 0.00 31.44 29.53 1ndj n GLU 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ndj s ALA 102 N -2.83 3.34 0.03 4.31 0.00 -1.19 -4.91 121.76 120.51 1ndj s ALA 102 Ca 0.38 1.34 0.02 0.00 0.00 0.00 0.00 51.96 53.70 1ndj s ALA 102 Cb 0.14 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.72 1ndj s ALA 102 CO 0.00 -0.91 -0.06 1.03 0.00 0.00 0.00 175.76 175.82 1ndj s ARG 103 N -2.19 0.46 -0.31 0.00 3.00 0.03 -4.10 118.95 115.84 1ndj s ARG 103 Ca 0.56 -0.62 -0.02 0.00 0.00 0.00 0.00 55.73 55.64 1ndj s ARG 103 Cb -0.41 -0.24 0.05 0.00 0.00 0.00 0.00 34.95 34.36 1ndj s ARG 103 CO 0.53 0.04 0.02 0.42 0.00 0.00 0.00 175.30 176.32 1ndj s ILE 104 N -1.15 3.10 -0.37 1.52 1.01 -0.45 0.03 121.20 124.89 1ndj s ILE 104 Ca -0.09 -1.38 -0.16 0.00 0.00 0.00 0.00 60.65 59.02 1ndj s ILE 104 Cb -0.08 -2.80 -0.00 0.00 0.01 0.00 0.00 42.46 39.59 1ndj s ILE 104 CO 0.00 -0.14 0.39 0.20 0.00 0.00 0.00 174.94 175.39 1ndj s ASN 105 N 1.30 6.19 0.19 3.58 0.01 -0.44 -0.88 114.94 124.88 1ndj s ASN 105 Ca -0.04 -0.37 0.07 0.00 -0.71 0.00 0.00 52.86 51.82 1ndj s ASN 105 Cb -0.20 -2.21 -0.05 0.00 0.41 0.00 0.00 41.25 39.21 1ndj s ASN 105 CO -0.01 -0.42 -0.14 0.42 -1.51 0.00 0.00 177.10 175.44 1ndj s THR 106 N 2.07 1.64 0.03 1.60 -4.23 0.33 -1.82 115.64 115.24 1ndj s THR 106 Ca 0.12 -2.12 0.09 0.00 -1.18 0.00 0.00 61.69 58.59 1ndj s THR 106 Cb -0.17 -1.95 -0.03 0.00 1.34 0.00 0.00 72.50 71.69 1ndj s THR 106 CO 0.12 -0.57 -0.25 -1.10 -0.54 0.00 0.00 174.62 172.28 1ndj s GLN 107 N -3.49 1.93 0.11 3.99 -0.21 -0.50 -0.43 119.66 121.05 1ndj s GLN 107 Ca 0.20 -1.04 0.02 0.00 0.02 0.00 0.00 55.36 54.56 1ndj s GLN 107 Cb -0.01 -2.03 -0.04 0.00 1.00 0.00 0.00 33.01 31.93 1ndj s GLN 107 CO 0.06 0.53 -0.07 1.67 -2.12 0.00 0.00 175.29 175.35 1ndj s TRP 108 N -0.77 0.95 -0.12 0.91 1.48 -0.59 -0.13 118.94 120.68 1ndj s TRP 108 Ca 0.12 -0.88 0.00 0.00 -1.06 0.00 0.00 56.10 54.28 1ndj s TRP 108 Cb -0.10 -0.54 0.02 0.00 -1.16 0.00 0.00 33.47 31.70 1ndj s TRP 108 CO 0.02 -0.11 -0.10 -0.51 -4.06 0.00 0.00 176.95 172.18 1ndj s LEU 109 N -3.04 1.40 -0.31 -4.66 1.43 -0.34 -2.01 118.68 111.15 1ndj s LEU 109 Ca 0.12 -0.36 -0.01 0.00 -1.03 0.00 0.00 54.13 52.86 1ndj s LEU 109 Cb 0.05 -0.94 0.06 0.00 0.03 0.00 0.00 46.19 45.38 1ndj s LEU 109 CO -0.04 -0.08 0.01 -0.22 0.23 0.00 0.00 176.35 176.26 1ndj s LEU 110 N 1.49 4.07 -0.19 1.79 2.96 0.11 -1.10 118.68 127.80 1ndj s LEU 110 Ca 0.02 -1.46 -0.07 0.00 -0.22 0.00 0.00 54.13 52.40 1ndj s LEU 110 Cb -0.13 -1.69 -0.04 0.00 0.50 0.00 0.00 46.19 44.83 1ndj s LEU 110 CO -0.07 -0.30 0.05 -0.89 -1.32 0.00 0.00 176.35 173.82 1ndj s THR 111 N 1.19 4.56 0.20 3.68 2.01 0.31 -0.93 115.64 126.65 1ndj s THR 111 Ca -0.03 -0.11 -0.04 0.00 0.31 0.00 0.00 61.69 61.82 1ndj s THR 111 Cb -0.20 -3.06 -0.05 0.00 0.01 0.00 0.00 72.50 69.20 1ndj s THR 111 CO -0.03 0.45 0.43 -0.44 -0.69 0.00 0.00 174.62 174.34 1ndj s SER 112 N 0.56 6.45 0.04 3.53 0.01 -0.59 -0.71 113.70 122.98 1ndj s SER 112 Ca 0.02 0.57 -0.30 0.00 1.31 0.00 0.00 55.95 57.55 1ndj s SER 112 Cb -0.13 -2.08 -0.06 0.00 0.21 0.00 0.00 66.02 63.95 1ndj s SER 112 CO 0.01 -0.04 1.44 -0.83 0.41 0.00 0.00 173.24 174.23 1ndj s GLY 113 N -2.85 1.84 0.23 3.44 0.00 -0.62 -4.87 107.32 104.50 1ndj s GLY 113 Ca 0.41 0.98 0.02 0.00 0.00 0.00 0.00 44.72 46.14 1ndj s GLY 113 CO 0.27 2.53 0.05 -0.51 0.00 0.00 0.00 173.10 175.44 1ndj s THR 114 N 2.16 0.72 0.84 0.90 -4.23 -1.26 -5.02 115.64 109.75 1ndj s THR 114 Ca 0.66 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 59.05 1ndj s THR 114 Cb -0.34 -2.45 0.10 0.00 1.34 0.00 0.00 72.50 71.15 1ndj s THR 114 CO 0.28 -0.19 1.09 0.42 -0.54 0.00 0.00 174.62 175.68 1ndj s THR 115 N -3.64 2.91 0.44 3.99 -4.23 -1.26 -4.87 115.64 108.99 1ndj s THR 115 Ca 0.32 0.30 0.12 0.00 -1.18 0.00 0.00 61.69 61.25 1ndj s THR 115 Cb 0.07 -2.89 0.30 0.00 1.34 0.00 0.00 72.50 71.32 1ndj s THR 115 CO 0.10 -0.39 2.03 -0.33 -0.54 0.00 0.00 174.62 175.49 1ndj h GLU 116 N -1.31 0.38 -0.62 3.99 4.39 -2.00 -2.09 114.58 117.33 1ndj h GLU 116 Ca -0.48 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.19 1ndj h GLU 116 Cb 1.27 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.80 1ndj h GLU 116 CO 0.56 0.25 0.36 0.00 -1.16 0.00 0.00 179.01 179.02 1ndj h ALA 117 N 1.75 1.47 -0.60 3.43 0.00 -2.06 -2.61 119.26 120.63 1ndj h ALA 117 Ca 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ndj h ALA 117 Cb 0.30 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ndj h ALA 117 CO -0.05 0.45 0.00 0.09 0.00 0.00 0.00 179.25 179.74 1ndj n ASN 118 N -4.40 4.68 0.02 0.00 3.02 -0.81 -4.49 115.26 113.28 1ndj n ASN 118 Ca 0.06 -2.49 0.05 0.00 -0.03 0.00 0.00 54.58 52.17 1ndj n ASN 118 Cb 0.08 -0.56 0.45 0.00 -0.61 0.00 0.00 39.78 39.14 1ndj n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ndj h ALA 119 N 3.83 1.75 -0.85 5.41 0.00 -1.15 -0.90 119.26 127.35 1ndj h ALA 119 Ca 0.00 -0.02 0.21 0.00 0.00 0.00 0.00 54.91 55.10 1ndj h ALA 119 Cb 1.45 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.04 1ndj h ALA 119 CO 0.24 0.22 0.58 0.11 0.00 0.00 0.00 179.25 180.40 1ndj h TRP 120 N 0.49 0.31 -0.56 0.00 5.08 -1.82 0.25 115.95 119.71 1ndj h TRP 120 Ca 0.14 0.01 -0.28 0.00 1.08 0.00 0.00 58.89 59.84 1ndj h TRP 120 Cb -0.03 -0.09 -0.17 0.00 -3.00 0.00 0.00 29.16 25.87 1ndj h TRP 120 CO -0.00 0.08 0.15 0.36 -1.28 0.00 0.00 178.44 177.76 1ndj n LYS 121 N -4.42 2.05 0.22 0.12 2.85 -0.35 -4.66 118.16 113.97 1ndj n LYS 121 Ca 0.18 -3.13 0.12 0.00 -1.05 0.00 0.00 58.31 54.43 1ndj n LYS 121 Cb 0.76 -1.94 0.17 0.00 -0.65 0.00 0.00 35.03 33.38 1ndj n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1ndj h SER 122 N 1.08 0.00 -3.30 -5.58 4.64 -0.46 -3.46 113.55 106.47 1ndj h SER 122 Ca 0.34 -0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 61.08 1ndj h SER 122 Cb 2.05 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 63.79 1ndj h SER 122 CO 0.61 0.00 -0.84 -0.89 -0.87 0.00 0.00 176.83 174.85 1ndj s THR 123 N -3.21 1.50 0.21 2.95 2.01 -1.26 -1.55 115.64 116.30 1ndj s THR 123 Ca 0.07 -0.66 -0.09 0.00 0.31 0.00 0.00 61.69 61.32 1ndj s THR 123 Cb 0.05 -1.36 -0.07 0.00 0.01 0.00 0.00 72.50 71.13 1ndj s THR 123 CO 0.67 0.44 0.52 -0.76 -0.69 0.00 0.00 174.62 174.80 1ndj s LEU 124 N 0.86 4.19 -0.02 4.42 1.43 -0.11 -4.93 118.68 124.53 1ndj s LEU 124 Ca -0.09 0.87 0.04 0.00 -1.03 0.00 0.00 54.13 53.92 1ndj s LEU 124 Cb -0.15 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.45 1ndj s LEU 124 CO 0.00 -0.05 -0.14 0.54 0.23 0.00 0.00 176.35 176.94 1ndj s VAL 125 N -1.78 1.10 0.00 -1.59 0.11 -1.26 -0.71 120.40 116.26 1ndj s VAL 125 Ca 0.46 -0.58 0.00 0.00 -2.93 0.00 0.00 61.98 58.93 1ndj s VAL 125 Cb -0.11 -0.93 0.00 0.00 -1.53 0.00 0.00 36.38 33.80 1ndj s VAL 125 CO 0.22 0.32 0.00 0.61 -3.33 0.00 0.00 175.10 172.91 1ndj n GLY 126 N 2.90 2.62 2.93 6.54 0.00 -0.85 -5.00 105.19 114.33 1ndj n GLY 126 Ca -0.15 -1.14 -0.13 0.00 0.00 0.00 0.00 46.02 44.60 1ndj n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1ndj s HIS 127 N -6.68 -0.12 -0.10 1.61 -3.43 -1.26 -1.54 115.29 103.77 1ndj s HIS 127 Ca 0.00 0.34 0.03 0.00 -0.80 0.00 0.00 55.06 54.63 1ndj s HIS 127 Cb 0.00 -0.04 0.01 0.00 -1.43 0.00 0.00 32.58 31.12 1ndj s HIS 127 CO 0.00 -0.10 -0.20 -0.51 -2.00 0.00 0.00 174.74 171.93 1ndj s ASP 128 N 0.62 2.77 -0.25 7.38 1.01 0.43 -4.96 116.67 123.66 1ndj s ASP 128 Ca -0.05 -0.50 -0.03 0.00 0.71 0.00 0.00 52.55 52.68 1ndj s ASP 128 Cb -0.06 -1.27 0.02 0.00 1.01 0.00 0.00 42.92 42.62 1ndj s ASP 128 CO -0.03 0.10 -0.03 0.28 0.21 0.00 0.00 175.17 175.70 1ndj s THR 129 N 0.60 3.16 -0.16 -1.27 -1.32 -1.26 0.12 115.64 115.51 1ndj s THR 129 Ca -0.14 -0.86 -0.06 0.00 -1.21 0.00 0.00 61.69 59.42 1ndj s THR 129 Cb -0.17 -2.58 -0.04 0.00 -1.51 0.00 0.00 72.50 68.21 1ndj s THR 129 CO 0.04 0.23 0.06 -0.36 -2.21 0.00 0.00 174.62 172.38 1ndj s PHE 130 N 1.39 3.29 0.19 9.09 0.08 -0.06 -3.47 117.98 128.49 1ndj s PHE 130 Ca 0.02 0.17 0.08 0.00 0.12 0.00 0.00 56.93 57.31 1ndj s PHE 130 Cb -0.16 -2.01 -0.04 0.00 -0.57 0.00 0.00 43.02 40.23 1ndj s PHE 130 CO -0.03 0.30 -0.15 0.95 -0.10 0.00 0.00 175.22 176.19 1ndj s THR 131 N -0.06 1.69 -2.33 0.64 -4.23 0.18 -1.34 115.64 110.19 1ndj s THR 131 Ca 0.07 -2.12 0.29 0.00 -1.18 0.00 0.00 61.69 58.75 1ndj s THR 131 Cb -0.12 -1.96 0.68 0.00 1.34 0.00 0.00 72.50 72.44 1ndj s THR 131 CO 0.01 -0.55 1.91 0.29 -0.54 0.00 0.00 174.62 175.75