#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ndj n ILE 17 N 0.00 1.57 -1.80 -0.61 5.41 -1.26 -4.95 119.36 117.72 1ndj n ILE 17 Ca 0.00 -0.76 -0.41 0.00 1.00 0.00 0.00 62.75 62.58 1ndj n ILE 17 Cb 0.00 -1.06 -0.01 0.00 -0.71 0.00 0.00 39.64 37.86 1ndj n ILE 17 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 1ndj s THR 18 N -2.56 2.07 -2.70 1.39 2.01 -1.26 -4.80 115.64 109.80 1ndj s THR 18 Ca -0.12 0.07 0.00 0.00 0.31 0.00 0.00 61.69 61.95 1ndj s THR 18 Cb 0.07 -3.04 0.00 0.00 0.01 0.00 0.00 72.50 69.54 1ndj s THR 18 CO 0.79 0.02 0.00 0.61 -0.69 0.00 0.00 174.62 175.35 1ndj n GLY 19 N 0.96 0.77 3.62 4.40 0.00 0.19 -4.98 105.19 110.16 1ndj n GLY 19 Ca 0.03 -2.06 -0.34 0.00 0.00 0.00 0.00 46.02 43.65 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 -1.64 4.64 0.09 2.61 2.01 -1.26 -0.46 115.64 121.63 1ndj s THR 20 Ca 0.00 -0.09 0.03 0.00 0.31 0.00 0.00 61.69 61.94 1ndj s THR 20 Cb 0.00 -3.07 -0.03 0.00 0.01 0.00 0.00 72.50 69.41 1ndj s THR 20 CO 0.00 0.48 -0.10 0.26 -0.69 0.00 0.00 174.62 174.57 1ndj s TRP 21 N 0.24 1.00 -0.01 4.92 0.52 0.34 -4.58 118.94 121.37 1ndj s TRP 21 Ca 0.03 -0.63 0.04 0.00 0.02 0.00 0.00 56.10 55.55 1ndj s TRP 21 Cb -0.13 -0.56 -0.01 0.00 -1.15 0.00 0.00 33.47 31.63 1ndj s TRP 21 CO 0.01 -0.02 -0.13 0.71 0.02 0.00 0.00 176.95 177.54 1ndj s TYR 22 N -2.25 1.18 0.37 -1.98 2.02 0.29 -1.68 117.35 115.29 1ndj s TYR 22 Ca 0.03 -0.24 0.07 0.00 -0.37 0.00 0.00 57.07 56.56 1ndj s TYR 22 Cb -0.04 -0.77 -0.01 0.00 -0.40 0.00 0.00 41.96 40.75 1ndj s TYR 22 CO -0.00 -0.04 0.48 0.54 -1.57 0.00 0.00 175.55 174.96 1ndj s ASN 23 N -0.22 5.73 0.59 2.29 2.20 -1.08 0.16 114.94 124.60 1ndj s ASN 23 Ca 0.03 -0.34 0.36 0.00 -0.94 0.00 0.00 52.86 51.97 1ndj s ASN 23 Cb -0.06 -0.96 1.94 0.00 -2.00 0.00 0.00 41.25 40.17 1ndj s ASN 23 CO -0.00 -0.55 2.08 0.06 -2.94 0.00 0.00 177.10 175.75 1ndj h GLN 24 N 0.85 0.00 -0.22 3.55 -0.00 -1.91 -0.86 115.11 116.52 1ndj h GLN 24 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.22 1ndj h GLN 24 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.75 1ndj h GLN 24 CO 0.51 0.00 0.00 1.28 -0.00 0.00 0.00 178.83 180.62 1ndj n LEU 25 N -2.83 2.29 0.00 0.06 4.77 -1.26 -4.94 117.00 115.09 1ndj n LEU 25 Ca -0.02 -0.95 0.00 0.00 -0.03 0.00 0.00 56.01 55.01 1ndj n LEU 25 Cb 0.15 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1ndj n LEU 25 CO 0.16 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 1ndj n GLY 26 N 1.26 3.15 3.49 -0.72 0.00 -0.33 -4.66 105.19 107.39 1ndj n GLY 26 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1ndj n GLY 26 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ndj n SER 27 N 0.12 -1.02 -4.16 1.61 7.64 -1.26 -4.69 113.62 111.85 1ndj n SER 27 Ca 0.00 0.52 -0.33 0.00 1.01 0.00 0.00 58.87 60.07 1ndj n SER 27 Cb 0.00 -1.27 -0.16 0.00 -1.01 0.00 0.00 64.21 61.77 1ndj n SER 27 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ndj s THR 28 N -2.07 2.12 -0.34 0.44 2.01 0.44 -2.65 115.64 115.58 1ndj s THR 28 Ca 0.65 -0.95 -0.03 0.00 0.31 0.00 0.00 61.69 61.67 1ndj s THR 28 Cb -0.30 -1.86 0.07 0.00 0.01 0.00 0.00 72.50 70.41 1ndj s THR 28 CO 0.59 0.54 0.09 0.12 -0.69 0.00 0.00 174.62 175.27 1ndj s PHE 29 N 0.98 3.38 -0.23 4.92 5.36 -0.68 0.74 117.98 132.45 1ndj s PHE 29 Ca -0.03 -1.99 -0.06 0.00 -0.96 0.00 0.00 56.93 53.90 1ndj s PHE 29 Cb -0.15 -2.52 -0.02 0.00 -0.34 0.00 0.00 43.02 40.00 1ndj s PHE 29 CO -0.06 -0.85 0.02 0.42 -1.46 0.00 0.00 175.22 173.29 1ndj s ILE 30 N 1.24 3.92 0.01 3.12 1.01 0.31 -0.50 121.20 130.31 1ndj s ILE 30 Ca 0.00 -0.31 -0.00 0.00 0.00 0.00 0.00 60.65 60.34 1ndj s ILE 30 Cb -0.21 -2.81 -0.02 0.00 0.01 0.00 0.00 42.46 39.44 1ndj s ILE 30 CO -0.02 0.38 -0.02 0.54 0.00 0.00 0.00 174.94 175.83 1ndj s VAL 31 N 1.45 0.09 -0.14 2.92 0.11 0.40 -0.05 120.40 125.17 1ndj s VAL 31 Ca 0.05 -0.72 0.02 0.00 -2.93 0.00 0.00 61.98 58.40 1ndj s VAL 31 Cb -0.15 -0.22 0.01 0.00 -1.53 0.00 0.00 36.38 34.49 1ndj s VAL 31 CO 0.01 -0.40 -0.21 -0.89 -3.33 0.00 0.00 175.10 170.29 1ndj s THR 32 N -1.17 2.20 -0.60 5.04 2.01 0.13 0.55 115.64 123.81 1ndj s THR 32 Ca -0.13 -0.93 -0.18 0.00 0.31 0.00 0.00 61.69 60.76 1ndj s THR 32 Cb -0.08 -1.89 0.12 0.00 0.01 0.00 0.00 72.50 70.66 1ndj s THR 32 CO -0.01 0.54 0.65 0.00 -0.69 0.00 0.00 174.62 175.12 1ndj s ALA 33 N 0.78 3.53 0.85 7.40 0.00 -1.26 -1.47 121.76 131.60 1ndj s ALA 33 Ca -0.08 -2.41 -0.11 0.00 0.00 0.00 0.00 51.96 49.36 1ndj s ALA 33 Cb -0.16 -3.45 0.10 0.00 0.00 0.00 0.00 23.12 19.61 1ndj s ALA 33 CO -0.01 -2.25 1.10 0.20 0.00 0.00 0.00 175.76 174.80 1ndj s GLY 34 N 3.54 1.65 0.49 0.00 0.00 0.44 -4.88 107.32 108.57 1ndj s GLY 34 Ca 0.09 0.17 0.27 0.00 0.00 0.00 0.00 44.72 45.25 1ndj s GLY 34 CO 0.04 0.60 1.98 0.00 0.00 0.00 0.00 173.10 175.71 1ndj h ALA 35 N -1.45 1.16 -0.00 3.20 0.00 -1.97 -2.71 119.26 117.48 1ndj h ALA 35 Ca -0.46 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1ndj h ALA 35 Cb 1.26 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1ndj h ALA 35 CO 0.51 0.20 -0.31 -0.40 0.00 0.00 0.00 179.25 179.25 1ndj n ASP 36 N -3.51 0.54 0.00 0.00 5.75 -1.26 -4.90 116.55 113.18 1ndj n ASP 36 Ca -0.01 -0.34 0.00 0.00 -0.01 0.00 0.00 54.79 54.43 1ndj n ASP 36 Cb 0.31 0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.47 1ndj n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ndj n GLY 37 N 1.43 1.25 3.73 6.12 0.00 -1.02 -4.89 105.19 111.81 1ndj n GLY 37 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.00 3.34 -0.18 4.61 0.00 -1.25 -0.18 121.76 126.10 1ndj s ALA 38 Ca 0.00 0.77 -0.02 0.00 0.00 0.00 0.00 51.96 52.71 1ndj s ALA 38 Cb 0.00 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 1ndj s ALA 38 CO 0.00 -0.23 -0.08 -0.51 0.00 0.00 0.00 175.76 174.94 1ndj s LEU 39 N 0.05 2.83 0.08 0.00 1.02 0.20 -0.42 118.68 122.43 1ndj s LEU 39 Ca 0.51 -0.36 0.02 0.00 0.02 0.00 0.00 54.13 54.31 1ndj s LEU 39 Cb -0.28 -1.69 -0.04 0.00 0.02 0.00 0.00 46.19 44.20 1ndj s LEU 39 CO 0.33 0.06 -0.06 0.42 0.02 0.00 0.00 176.35 177.11 1ndj s THR 40 N 1.02 0.58 -1.17 5.49 -4.23 -0.54 0.18 115.64 116.97 1ndj s THR 40 Ca -0.00 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 1ndj s THR 40 Cb -0.15 -1.34 0.00 0.00 1.34 0.00 0.00 72.50 72.36 1ndj s THR 40 CO -0.01 -0.75 0.00 0.61 -0.54 0.00 0.00 174.62 173.94 1ndj n GLY 41 N 0.42 -0.16 3.44 3.99 0.00 -0.99 0.19 105.19 112.09 1ndj n GLY 41 Ca -0.16 -0.79 -0.13 0.00 0.00 0.00 0.00 46.02 44.95 1ndj n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ndj s THR 42 N -4.00 -0.00 -0.12 2.61 2.01 0.93 -1.86 115.64 115.21 1ndj s THR 42 Ca 0.00 0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.01 1ndj s THR 42 Cb 0.00 -0.76 -0.02 0.00 0.01 0.00 0.00 72.50 71.73 1ndj s THR 42 CO 0.00 0.00 -0.12 0.12 -0.69 0.00 0.00 174.62 173.93 1ndj s PHE 43 N 0.54 2.81 -0.23 4.92 2.19 -0.46 -0.53 117.98 127.22 1ndj s PHE 43 Ca -0.02 -0.52 0.02 0.00 0.33 0.00 0.00 56.93 56.75 1ndj s PHE 43 Cb -0.04 -1.81 0.05 0.00 -1.31 0.00 0.00 43.02 39.90 1ndj s PHE 43 CO -0.03 -0.12 -0.13 -2.00 1.83 0.00 0.00 175.22 174.78 1ndj s GLU 44 N 0.14 2.37 -0.16 10.12 2.12 0.23 -0.94 118.70 132.58 1ndj s GLU 44 Ca -0.06 -1.16 -0.20 0.00 0.36 0.00 0.00 54.97 53.91 1ndj s GLU 44 Cb -0.15 -2.76 -0.03 0.00 0.26 0.00 0.00 34.13 31.45 1ndj s GLU 44 CO 0.05 -0.47 0.57 0.45 -0.54 0.00 0.00 175.26 175.32 1ndj s SER 45 N 1.19 6.70 0.10 -1.70 0.15 -1.26 -0.42 113.70 118.45 1ndj s SER 45 Ca -0.05 0.85 0.28 0.00 0.70 0.00 0.00 55.95 57.72 1ndj s SER 45 Cb -0.18 -2.33 1.04 0.00 -1.71 0.00 0.00 66.02 62.85 1ndj s SER 45 CO -0.07 -0.15 1.86 0.00 1.20 0.00 0.00 173.24 176.07 1ndj n ALA 46 N 4.42 2.31 -2.53 5.45 0.00 -1.26 -4.79 120.51 124.10 1ndj n ALA 46 Ca -0.04 -0.06 -0.24 0.00 0.00 0.00 0.00 53.44 53.10 1ndj n ALA 46 Cb 0.51 -1.47 -0.13 0.00 0.00 0.00 0.00 19.45 18.36 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 -3.05 1.66 0.00 0.00 -7.23 -1.26 -5.02 120.40 105.50 1ndj s VAL 47 Ca 0.12 -1.41 0.00 0.00 -1.81 0.00 0.00 61.98 58.88 1ndj s VAL 47 Cb 0.16 -1.49 0.00 0.00 0.56 0.00 0.00 36.38 35.61 1ndj s VAL 47 CO 0.56 0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.98 1ndj n GLY 48 N 1.36 -1.20 2.92 2.32 0.00 -1.26 -4.48 105.19 104.85 1ndj n GLY 48 Ca -0.19 -1.26 -0.42 0.00 0.00 0.00 0.00 46.02 44.15 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 0.27 4.50 -3.74 1.61 5.15 -1.26 -4.83 115.26 116.96 1ndj n ASN 49 Ca 0.00 -2.95 -0.13 0.00 -0.60 0.00 0.00 54.58 50.90 1ndj n ASN 49 Cb 0.00 -1.60 -0.10 0.00 -0.53 0.00 0.00 39.78 37.55 1ndj n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ndj s ALA 50 N 2.21 -0.96 -0.06 5.20 0.00 -1.26 -4.43 121.76 122.46 1ndj s ALA 50 Ca 0.45 1.06 -0.04 0.00 0.00 0.00 0.00 51.96 53.43 1ndj s ALA 50 Cb 0.10 -0.60 0.03 0.00 0.00 0.00 0.00 23.12 22.65 1ndj s ALA 50 CO -0.03 -0.19 0.14 -1.83 0.00 0.00 0.00 175.76 173.85 1ndj s GLU 51 N 0.13 0.12 2.85 0.00 -1.05 -1.26 -4.92 118.70 114.57 1ndj s GLU 51 Ca -0.01 0.31 0.00 0.00 -0.15 0.00 0.00 54.97 55.12 1ndj s GLU 51 Cb -0.03 -0.09 0.00 0.00 -0.44 0.00 0.00 34.13 33.58 1ndj s GLU 51 CO 0.01 -0.11 0.00 0.43 0.95 0.00 0.00 175.26 176.54 1ndj n SER 52 N 3.78 -1.85 -4.91 0.83 7.64 -1.26 -4.84 113.62 113.01 1ndj n SER 52 Ca -0.21 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.36 1ndj n SER 52 Cb 0.54 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.70 1ndj n SER 52 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ndj s ARG 53 N 0.00 3.58 0.09 1.43 3.03 -1.26 -4.28 118.95 121.54 1ndj s ARG 53 Ca 0.00 -0.17 0.08 0.00 2.03 0.00 0.00 55.73 57.67 1ndj s ARG 53 Cb 0.00 -2.86 -0.03 0.00 -1.03 0.00 0.00 34.95 31.03 1ndj s ARG 53 CO 0.00 0.46 -0.21 0.71 -1.13 0.00 0.00 175.30 175.12 1ndj s TYR 54 N -1.71 1.82 0.26 5.89 2.02 -0.11 -4.87 117.35 120.65 1ndj s TYR 54 Ca 0.40 -0.41 -0.29 0.00 -0.37 0.00 0.00 57.07 56.40 1ndj s TYR 54 Cb -0.12 -1.01 -0.09 0.00 -0.40 0.00 0.00 41.96 40.34 1ndj s TYR 54 CO 0.26 0.19 1.17 0.08 -1.57 0.00 0.00 175.55 175.68 1ndj s VAL 55 N -1.09 3.36 0.18 0.71 1.01 -1.26 -1.35 120.40 121.95 1ndj s VAL 55 Ca 0.07 1.29 0.09 0.00 0.00 0.00 0.00 61.98 63.43 1ndj s VAL 55 Cb -0.10 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1ndj s VAL 55 CO 0.04 0.28 -0.19 -1.48 0.00 0.00 0.00 175.10 173.75 1ndj s LEU 56 N -1.13 2.46 -0.07 3.92 0.05 -0.78 -4.32 118.68 118.82 1ndj s LEU 56 Ca 0.48 -0.90 -0.15 0.00 0.05 0.00 0.00 54.13 53.61 1ndj s LEU 56 Cb -0.34 -0.87 0.03 0.00 -2.05 0.00 0.00 46.19 42.96 1ndj s LEU 56 CO 0.42 -0.03 0.37 0.28 -0.55 0.00 0.00 176.35 176.84 1ndj s THR 57 N -2.15 0.03 0.00 5.48 -1.32 -1.11 -2.35 115.64 114.21 1ndj s THR 57 Ca 0.18 -0.24 0.00 0.00 -1.21 0.00 0.00 61.69 60.43 1ndj s THR 57 Cb -0.05 -0.61 0.00 0.00 -1.51 0.00 0.00 72.50 70.32 1ndj s THR 57 CO 0.08 -0.13 0.00 0.61 -2.21 0.00 0.00 174.62 172.97 1ndj n GLY 58 N 1.93 2.01 3.00 6.08 0.00 0.13 -2.11 105.19 116.22 1ndj n GLY 58 Ca -0.18 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 44.90 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 -0.63 0.36 0.09 1.61 1.81 -0.66 -0.63 118.95 120.90 1ndj s ARG 59 Ca 0.00 -0.67 -0.01 0.00 -1.72 0.00 0.00 55.73 53.33 1ndj s ARG 59 Cb 0.00 0.13 -0.04 0.00 -0.45 0.00 0.00 34.95 34.59 1ndj s ARG 59 CO 0.00 -0.06 -0.00 1.52 -0.68 0.00 0.00 175.30 176.08 1ndj s TYR 60 N -1.76 0.72 -0.55 -0.53 1.13 0.75 -1.59 117.35 115.51 1ndj s TYR 60 Ca -0.13 -1.11 -0.28 0.00 -1.41 0.00 0.00 57.07 54.14 1ndj s TYR 60 Cb -0.08 -0.45 0.00 0.00 -1.10 0.00 0.00 41.96 40.33 1ndj s TYR 60 CO -0.02 -0.40 1.55 0.34 -2.51 0.00 0.00 175.55 174.51 1ndj s ASP 61 N -2.99 5.92 0.00 -0.18 2.15 -0.18 -4.59 116.67 116.79 1ndj s ASP 61 Ca 0.15 0.38 0.12 0.00 0.43 0.00 0.00 52.55 53.63 1ndj s ASP 61 Cb 0.07 -2.54 0.44 0.00 -0.30 0.00 0.00 42.92 40.59 1ndj s ASP 61 CO -0.04 -1.86 1.33 -1.54 -0.17 0.00 0.00 175.17 172.89 1ndj n SER 62 N 10.32 1.37 -3.12 -0.34 3.41 -1.26 -3.91 113.62 120.09 1ndj n SER 62 Ca 0.15 -1.88 -0.21 0.00 -0.26 0.00 0.00 58.87 56.67 1ndj n SER 62 Cb 0.49 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.27 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 0.21 2.76 -0.73 7.33 0.00 -1.26 -5.05 120.51 123.76 1ndj n ALA 63 Ca 0.11 -3.77 -0.30 0.00 0.00 0.00 0.00 53.44 49.49 1ndj n ALA 63 Cb 0.24 -0.87 0.20 0.00 0.00 0.00 0.00 19.45 19.01 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 -2.71 0.24 0.95 0.00 0.04 -1.25 -5.00 135.00 127.27 1ndj s PRO 64 Ca 0.42 1.11 -0.12 0.00 0.04 0.00 0.00 61.00 62.46 1ndj s PRO 64 Cb 0.33 -1.67 0.16 0.00 0.04 0.00 0.00 34.50 33.36 1ndj s PRO 64 CO -0.10 -3.02 1.09 0.00 0.04 0.00 0.00 177.00 175.01 1ndj s ALA 65 N -2.63 1.13 -1.63 8.56 0.00 -1.26 -4.98 121.76 120.95 1ndj s ALA 65 Ca 0.67 0.02 0.13 0.00 0.00 0.00 0.00 51.96 52.78 1ndj s ALA 65 Cb -0.23 -3.24 0.10 0.00 0.00 0.00 0.00 23.12 19.75 1ndj s ALA 65 CO 0.61 -2.72 0.91 2.41 0.00 0.00 0.00 175.76 176.97 1ndj n THR 66 N -4.15 0.00 0.79 0.00 -1.04 -1.26 -4.63 114.28 103.99 1ndj n THR 66 Ca 0.07 -0.49 0.00 0.00 -2.04 0.00 0.00 64.05 61.59 1ndj n THR 66 Cb 0.55 1.27 0.00 0.00 -1.82 0.00 0.00 70.33 70.32 1ndj n THR 66 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1ndj n ASP 67 N 0.66 3.33 -0.01 8.00 5.68 -1.26 -4.74 116.55 128.22 1ndj n ASP 67 Ca 0.08 -2.06 -0.00 0.00 -0.50 0.00 0.00 54.79 52.31 1ndj n ASP 67 Cb 0.33 -0.59 -0.00 0.00 -1.14 0.00 0.00 41.12 39.72 1ndj n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ndj n GLY 68 N 0.64 0.31 3.85 6.12 0.00 -1.26 -5.02 105.19 109.82 1ndj n GLY 68 Ca 0.00 -0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.01 6.22 0.83 1.61 0.01 -1.26 -5.06 113.70 114.04 1ndj s SER 69 Ca 0.00 1.55 -0.09 0.00 1.31 0.00 0.00 55.95 58.72 1ndj s SER 69 Cb 0.00 -2.49 0.15 0.00 0.21 0.00 0.00 66.02 63.89 1ndj s SER 69 CO 0.00 -0.87 1.15 -0.83 0.41 0.00 0.00 173.24 173.10 1ndj s GLY 70 N -3.56 1.76 -0.34 3.44 0.00 -1.26 -4.84 107.32 102.52 1ndj s GLY 70 Ca 0.58 -1.39 -0.09 0.00 0.00 0.00 0.00 44.72 43.82 1ndj s GLY 70 CO 0.44 -0.74 0.15 -1.59 0.00 0.00 0.00 173.10 171.35 1ndj s THR 71 N -3.51 4.33 0.37 0.90 2.01 0.09 -4.78 115.64 115.06 1ndj s THR 71 Ca 0.69 -0.77 -0.26 0.00 0.31 0.00 0.00 61.69 61.66 1ndj s THR 71 Cb -0.05 -3.34 -0.09 0.00 0.01 0.00 0.00 72.50 69.03 1ndj s THR 71 CO 0.48 -0.09 1.16 0.00 -0.69 0.00 0.00 174.62 175.48 1ndj s ALA 72 N 1.53 3.23 0.22 7.40 0.00 -1.26 -0.26 121.76 132.63 1ndj s ALA 72 Ca 0.02 0.96 -0.23 0.00 0.00 0.00 0.00 51.96 52.71 1ndj s ALA 72 Cb -0.18 -3.37 0.04 0.00 0.00 0.00 0.00 23.12 19.61 1ndj s ALA 72 CO 0.05 -0.43 0.80 -0.48 0.00 0.00 0.00 175.76 175.70 1ndj s LEU 73 N -2.22 -0.25 0.12 0.00 2.34 -0.23 -1.02 118.68 117.42 1ndj s LEU 73 Ca 0.54 -0.49 -0.25 0.00 0.06 0.00 0.00 54.13 53.99 1ndj s LEU 73 Cb -0.31 2.51 0.07 0.00 -0.56 0.00 0.00 46.19 47.90 1ndj s LEU 73 CO 0.39 -1.16 0.72 -0.83 -1.06 0.00 0.00 176.35 174.42 1ndj s GLY 74 N -2.91 -0.49 0.20 -3.48 0.00 -0.62 -1.05 107.32 98.97 1ndj s GLY 74 Ca 0.11 0.54 -0.12 0.00 0.00 0.00 0.00 44.72 45.24 1ndj s GLY 74 CO 0.04 0.18 0.42 0.66 0.00 0.00 0.00 173.10 174.39 1ndj s TRP 75 N -3.55 0.26 -0.01 1.90 -2.14 -0.72 -1.66 118.94 113.02 1ndj s TRP 75 Ca 0.04 -0.62 0.05 0.00 2.66 0.00 0.00 56.10 58.23 1ndj s TRP 75 Cb -0.02 0.14 -0.01 0.00 -3.10 0.00 0.00 33.47 30.49 1ndj s TRP 75 CO -0.09 -0.87 -0.16 0.99 -2.66 0.00 0.00 176.95 174.16 1ndj s THR 76 N -3.97 1.29 -0.13 0.66 2.01 -0.90 -0.26 115.64 114.34 1ndj s THR 76 Ca 0.17 -0.70 0.03 0.00 0.31 0.00 0.00 61.69 61.50 1ndj s THR 76 Cb 0.01 -1.07 0.01 0.00 0.01 0.00 0.00 72.50 71.45 1ndj s THR 76 CO 0.03 0.36 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.41 1ndj s VAL 77 N -0.39 2.01 -0.20 3.82 1.01 0.63 -2.76 120.40 124.53 1ndj s VAL 77 Ca 0.06 -0.96 -0.14 0.00 0.00 0.00 0.00 61.98 60.94 1ndj s VAL 77 Cb -0.06 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 1ndj s VAL 77 CO -0.01 0.54 0.33 0.00 0.00 0.00 0.00 175.10 175.96 1ndj s ALA 78 N 0.70 3.57 -0.90 5.51 0.00 -1.26 -1.02 121.76 128.36 1ndj s ALA 78 Ca -0.10 -0.57 -0.08 0.00 0.00 0.00 0.00 51.96 51.21 1ndj s ALA 78 Cb -0.16 -2.51 -0.15 0.00 0.00 0.00 0.00 23.12 20.30 1ndj s ALA 78 CO 0.01 -0.17 3.20 0.91 0.00 0.00 0.00 175.76 179.71 1ndj n TRP 79 N 4.19 1.41 -4.39 0.00 7.02 -0.23 -4.75 117.44 120.70 1ndj n TRP 79 Ca -0.10 -2.39 -0.24 0.00 -1.02 0.00 0.00 57.50 53.75 1ndj n TRP 79 Cb 0.51 -2.05 -0.17 0.00 -2.42 0.00 0.00 31.31 27.19 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 1.36 1.51 0.00 -0.99 2.20 -1.26 -0.22 119.74 122.34 1ndj s LYS 80 Ca 0.68 -0.33 0.00 0.00 -0.36 0.00 0.00 55.97 55.96 1ndj s LYS 80 Cb 0.25 -1.34 0.00 0.00 -1.51 0.00 0.00 37.83 35.23 1ndj s LYS 80 CO -0.04 -0.05 0.00 0.27 -0.36 0.00 0.00 175.35 175.17 1ndj n ASN 81 N 4.06 0.00 0.30 1.43 0.23 -0.56 -4.72 115.26 116.00 1ndj n ASN 81 Ca -0.21 -0.87 0.16 0.00 -0.53 0.00 0.00 54.58 53.13 1ndj n ASN 81 Cb 0.51 0.00 0.97 0.00 -2.08 0.00 0.00 39.78 39.18 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 0.00 0.00 0.00 0.53 -0.26 -1.95 -3.20 115.58 110.70 1ndj h ASN 82 Ca 0.00 0.00 -0.24 0.00 -0.56 0.00 0.00 56.30 55.50 1ndj h ASN 82 Cb 0.00 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 37.21 1ndj h ASN 82 CO 0.00 0.00 -2.02 -1.22 -1.06 0.00 0.00 177.43 173.13 1ndj n TYR 83 N -3.72 0.00 -3.81 1.19 4.01 -1.26 -5.05 117.16 108.52 1ndj n TYR 83 Ca -0.03 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.66 1ndj n TYR 83 Cb 0.08 -0.71 -0.01 0.00 -0.31 0.00 0.00 39.34 38.39 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 -2.49 1.48 -0.16 -0.72 1.70 -1.21 -5.09 118.95 112.46 1ndj s ARG 84 Ca -0.07 -0.86 -0.04 0.00 -0.47 0.00 0.00 55.73 54.28 1ndj s ARG 84 Cb 0.05 0.48 0.07 0.00 -0.57 0.00 0.00 34.95 34.98 1ndj s ARG 84 CO 0.65 -0.68 0.13 1.21 -1.08 0.00 0.00 175.30 175.52 1ndj s ASN 85 N -3.03 1.92 0.00 -2.89 3.84 -1.26 -1.50 114.94 112.02 1ndj s ASN 85 Ca 0.14 -0.41 0.29 0.00 0.21 0.00 0.00 52.86 53.09 1ndj s ASN 85 Cb -0.03 -0.04 1.29 0.00 -0.55 0.00 0.00 41.25 41.92 1ndj s ASN 85 CO 0.05 -0.33 1.89 0.00 -2.79 0.00 0.00 177.10 175.92 1ndj n ALA 86 N 5.29 2.71 -3.75 1.71 0.00 0.69 -4.95 120.51 122.21 1ndj n ALA 86 Ca -0.06 -0.32 -0.33 0.00 0.00 0.00 0.00 53.44 52.73 1ndj n ALA 86 Cb 0.49 -1.31 0.04 0.00 0.00 0.00 0.00 19.45 18.67 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 -0.59 -1.82 -3.55 0.00 -0.00 -1.26 -4.85 115.22 103.15 1ndj n HIS 87 Ca 0.18 0.42 -0.08 0.00 -0.00 0.00 0.00 57.72 58.24 1ndj n HIS 87 Cb 0.27 -3.37 -0.02 0.00 -0.00 0.00 0.00 29.99 26.87 1ndj n HIS 87 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 1ndj s SER 88 N -3.54 -0.36 -0.02 0.41 1.04 -1.26 -1.25 113.70 108.72 1ndj s SER 88 Ca 0.45 -0.11 -0.04 0.00 0.48 0.00 0.00 55.95 56.73 1ndj s SER 88 Cb -0.17 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.41 1ndj s SER 88 CO 0.88 -0.77 0.10 0.00 0.98 0.00 0.00 173.24 174.43 1ndj s ALA 89 N -3.30 -0.24 -0.04 5.32 0.00 0.11 -1.07 121.76 122.55 1ndj s ALA 89 Ca 0.06 0.03 0.06 0.00 0.00 0.00 0.00 51.96 52.11 1ndj s ALA 89 Cb -0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 1ndj s ALA 89 CO -0.07 -0.12 -0.21 0.99 0.00 0.00 0.00 175.76 176.35 1ndj s THR 90 N -0.65 2.42 -0.07 0.00 2.01 -0.19 0.04 115.64 119.21 1ndj s THR 90 Ca -0.07 -0.95 0.04 0.00 0.31 0.00 0.00 61.69 61.01 1ndj s THR 90 Cb -0.04 -1.90 -0.02 0.00 0.01 0.00 0.00 72.50 70.55 1ndj s THR 90 CO 0.00 0.58 -0.18 0.42 -0.69 0.00 0.00 174.62 174.75 1ndj s THR 91 N -0.49 2.65 -0.16 -0.82 -4.23 -0.68 -0.26 115.64 111.64 1ndj s THR 91 Ca 0.06 -0.85 -0.02 0.00 -1.18 0.00 0.00 61.69 59.69 1ndj s THR 91 Cb -0.11 -2.03 -0.02 0.00 1.34 0.00 0.00 72.50 71.68 1ndj s THR 91 CO 0.01 0.57 -0.07 0.26 -0.54 0.00 0.00 174.62 174.85 1ndj s TRP 92 N -0.28 2.93 -0.11 3.99 0.51 0.64 -1.34 118.94 125.28 1ndj s TRP 92 Ca 0.01 -0.56 0.03 0.00 -2.12 0.00 0.00 56.10 53.46 1ndj s TRP 92 Cb -0.13 -1.95 0.01 0.00 -0.81 0.00 0.00 33.47 30.59 1ndj s TRP 92 CO 0.03 -0.21 -0.20 0.45 -0.51 0.00 0.00 176.95 176.51 1ndj s SER 93 N 0.60 2.78 0.00 2.95 0.15 -0.02 -1.76 113.70 118.41 1ndj s SER 93 Ca -0.05 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.09 1ndj s SER 93 Cb -0.15 -1.27 0.00 0.00 -1.71 0.00 0.00 66.02 62.89 1ndj s SER 93 CO 0.03 0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.16 1ndj n GLY 94 N 3.90 1.59 3.01 9.45 0.00 -0.21 -1.39 105.19 121.54 1ndj n GLY 94 Ca -0.20 -0.72 -0.11 0.00 0.00 0.00 0.00 46.02 44.99 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 0.25 0.29 -0.06 1.61 -2.07 -0.85 -1.07 119.66 117.77 1ndj s GLN 95 Ca 0.00 -0.32 -0.20 0.00 -1.82 0.00 0.00 55.36 53.03 1ndj s GLN 95 Cb 0.00 0.12 -0.05 0.00 -1.09 0.00 0.00 33.01 31.99 1ndj s GLN 95 CO 0.00 -0.06 0.55 -0.47 -1.32 0.00 0.00 175.29 174.00 1ndj s TYR 96 N -0.95 3.61 -0.16 9.60 5.04 0.64 -1.66 117.35 133.46 1ndj s TYR 96 Ca -0.10 1.07 0.01 0.00 -2.44 0.00 0.00 57.07 55.61 1ndj s TYR 96 Cb -0.06 -2.59 0.02 0.00 0.35 0.00 0.00 41.96 39.68 1ndj s TYR 96 CO 0.00 0.27 -0.17 0.08 -1.34 0.00 0.00 175.55 174.39 1ndj s VAL 97 N 0.20 1.80 0.00 3.14 1.01 -0.10 -0.73 120.40 125.72 1ndj s VAL 97 Ca 0.30 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.49 1ndj s VAL 97 Cb -0.17 -1.66 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1ndj s VAL 97 CO 0.14 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.34 1ndj n GLY 98 N 4.70 1.25 1.13 4.51 0.00 -1.26 -0.87 105.19 114.66 1ndj n GLY 98 Ca -0.19 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1ndj n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ndj n GLY 99 N 5.00 -1.79 0.35 -0.02 0.00 -1.26 -4.20 105.19 103.27 1ndj n GLY 99 Ca 0.00 -1.96 0.10 0.00 0.00 0.00 0.00 46.02 44.16 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 1.92 -2.02 4.61 0.00 -2.07 -3.00 119.26 118.70 1ndj h ALA 100 Ca 0.00 -0.01 -0.66 0.00 0.00 0.00 0.00 54.91 54.23 1ndj h ALA 100 Cb 0.00 -0.11 -0.37 0.00 0.00 0.00 0.00 17.79 17.30 1ndj h ALA 100 CO 0.00 -0.03 -0.13 -1.91 0.00 0.00 0.00 179.25 177.17 1ndj n GLU 101 N -4.48 3.62 -2.14 0.00 4.07 -1.26 -5.05 120.64 115.40 1ndj n GLU 101 Ca 0.09 -4.74 -0.41 0.00 -0.06 0.00 0.00 57.16 52.04 1ndj n GLU 101 Cb 0.31 -2.32 -0.02 0.00 -0.06 0.00 0.00 31.44 29.34 1ndj n GLU 101 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1ndj s ALA 102 N -3.28 3.50 0.16 4.31 0.00 -1.14 -4.84 121.76 120.47 1ndj s ALA 102 Ca 0.42 1.23 -0.15 0.00 0.00 0.00 0.00 51.96 53.47 1ndj s ALA 102 Cb 0.20 -3.47 0.02 0.00 0.00 0.00 0.00 23.12 19.87 1ndj s ALA 102 CO -0.07 -0.61 0.42 1.03 0.00 0.00 0.00 175.76 176.53 1ndj s ARG 103 N -1.66 1.22 -0.23 0.00 0.52 -0.05 -4.33 118.95 114.43 1ndj s ARG 103 Ca 0.49 -0.90 0.02 0.00 -0.52 0.00 0.00 55.73 54.82 1ndj s ARG 103 Cb -0.39 0.47 0.05 0.00 0.52 0.00 0.00 34.95 35.60 1ndj s ARG 103 CO 0.51 -0.49 -0.10 0.42 0.02 0.00 0.00 175.30 175.66 1ndj s ILE 104 N -3.88 1.83 -0.25 1.52 1.01 -0.68 -0.92 121.20 119.82 1ndj s ILE 104 Ca 0.09 -1.29 -0.18 0.00 0.00 0.00 0.00 60.65 59.27 1ndj s ILE 104 Cb 0.01 -1.95 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 1ndj s ILE 104 CO -0.05 0.05 0.51 0.20 0.00 0.00 0.00 174.94 175.65 1ndj s ASN 105 N 1.28 6.44 0.28 3.58 0.01 -0.67 -0.54 114.94 125.32 1ndj s ASN 105 Ca -0.05 0.53 0.05 0.00 -0.71 0.00 0.00 52.86 52.69 1ndj s ASN 105 Cb -0.18 -2.28 -0.06 0.00 0.41 0.00 0.00 41.25 39.14 1ndj s ASN 105 CO -0.07 -0.27 -0.02 0.42 -1.51 0.00 0.00 177.10 175.65 1ndj s THR 106 N 2.20 1.43 0.06 1.60 -4.23 0.02 -2.00 115.64 114.71 1ndj s THR 106 Ca 0.21 -2.08 0.08 0.00 -1.18 0.00 0.00 61.69 58.72 1ndj s THR 106 Cb -0.16 -2.50 -0.03 0.00 1.34 0.00 0.00 72.50 71.16 1ndj s THR 106 CO 0.09 -0.25 -0.21 -1.10 -0.54 0.00 0.00 174.62 172.61 1ndj s GLN 107 N -3.79 1.35 0.11 3.99 -0.21 -0.48 -2.16 119.66 118.47 1ndj s GLN 107 Ca 0.31 -1.01 0.04 0.00 0.02 0.00 0.00 55.36 54.71 1ndj s GLN 107 Cb 0.05 -1.51 -0.04 0.00 1.00 0.00 0.00 33.01 32.51 1ndj s GLN 107 CO 0.12 0.38 -0.10 1.67 -2.12 0.00 0.00 175.29 175.24 1ndj s TRP 108 N -0.89 1.10 -0.14 0.91 1.48 0.23 -0.84 118.94 120.81 1ndj s TRP 108 Ca 0.08 -0.70 0.00 0.00 -1.06 0.00 0.00 56.10 54.42 1ndj s TRP 108 Cb -0.09 -0.59 0.02 0.00 -1.16 0.00 0.00 33.47 31.65 1ndj s TRP 108 CO 0.02 0.01 -0.13 -0.51 -4.06 0.00 0.00 176.95 172.28 1ndj s LEU 109 N -2.66 1.61 -0.37 -4.66 1.43 -0.45 -0.87 118.68 112.71 1ndj s LEU 109 Ca 0.09 -0.45 -0.08 0.00 -1.03 0.00 0.00 54.13 52.66 1ndj s LEU 109 Cb -0.01 -1.11 0.06 0.00 0.03 0.00 0.00 46.19 45.15 1ndj s LEU 109 CO -0.00 -0.06 0.17 -0.22 0.23 0.00 0.00 176.35 176.47 1ndj s LEU 110 N 1.45 4.69 -0.22 1.79 2.96 0.13 -1.69 118.68 127.80 1ndj s LEU 110 Ca 0.03 -1.30 -0.09 0.00 -0.22 0.00 0.00 54.13 52.55 1ndj s LEU 110 Cb -0.13 -1.92 -0.05 0.00 0.50 0.00 0.00 46.19 44.59 1ndj s LEU 110 CO -0.09 -0.42 0.13 -0.89 -1.32 0.00 0.00 176.35 173.76 1ndj s THR 111 N 1.41 5.17 -0.04 3.68 2.01 0.11 -0.55 115.64 127.41 1ndj s THR 111 Ca 0.01 0.11 -0.02 0.00 0.31 0.00 0.00 61.69 62.10 1ndj s THR 111 Cb -0.21 -3.38 -0.04 0.00 0.01 0.00 0.00 72.50 68.88 1ndj s THR 111 CO 0.03 0.39 0.06 -0.44 -0.69 0.00 0.00 174.62 173.96 1ndj s SER 112 N 0.82 5.58 0.35 3.53 0.01 -0.46 0.09 113.70 123.62 1ndj s SER 112 Ca 0.06 0.17 -0.29 0.00 1.31 0.00 0.00 55.95 57.21 1ndj s SER 112 Cb -0.13 -1.61 -0.11 0.00 0.21 0.00 0.00 66.02 64.38 1ndj s SER 112 CO 0.02 0.32 1.44 -0.83 0.41 0.00 0.00 173.24 174.61 1ndj s GLY 113 N -1.36 2.85 0.14 3.44 0.00 -0.38 -4.79 107.32 107.21 1ndj s GLY 113 Ca 0.19 1.47 -0.23 0.00 0.00 0.00 0.00 44.72 46.14 1ndj s GLY 113 CO 0.09 2.19 0.58 -0.51 0.00 0.00 0.00 173.10 175.44 1ndj s THR 114 N -0.95 0.01 0.87 0.90 -4.23 -1.26 -4.99 115.64 105.98 1ndj s THR 114 Ca 0.53 -0.07 -0.12 0.00 -1.18 0.00 0.00 61.69 60.85 1ndj s THR 114 Cb -0.44 -1.02 0.11 0.00 1.34 0.00 0.00 72.50 72.49 1ndj s THR 114 CO 0.58 -0.04 1.10 0.42 -0.54 0.00 0.00 174.62 176.13 1ndj s THR 115 N -3.52 2.75 0.49 3.99 -4.23 -1.26 -4.84 115.64 109.02 1ndj s THR 115 Ca 0.00 0.24 0.15 0.00 -1.18 0.00 0.00 61.69 60.90 1ndj s THR 115 Cb -0.01 -2.82 0.25 0.00 1.34 0.00 0.00 72.50 71.26 1ndj s THR 115 CO -0.11 -0.32 2.10 -0.33 -0.54 0.00 0.00 174.62 175.43 1ndj h GLU 116 N -1.41 0.04 0.00 3.99 4.39 -2.02 -1.80 114.58 117.77 1ndj h GLU 116 Ca -0.49 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.17 1ndj h GLU 116 Cb 1.28 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.92 1ndj h GLU 116 CO 0.56 0.08 -0.19 0.00 -1.16 0.00 0.00 179.01 178.30 1ndj h ALA 117 N 1.93 1.38 -0.52 3.43 0.00 -2.07 -2.32 119.26 121.09 1ndj h ALA 117 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1ndj h ALA 117 Cb 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ndj h ALA 117 CO 0.00 0.23 0.00 0.09 0.00 0.00 0.00 179.25 179.58 1ndj n ASN 118 N -3.86 3.48 0.06 0.00 3.02 -0.72 -4.60 115.26 112.63 1ndj n ASN 118 Ca -0.02 -1.97 0.07 0.00 -0.03 0.00 0.00 54.58 52.63 1ndj n ASN 118 Cb 0.28 -0.34 0.51 0.00 -0.61 0.00 0.00 39.78 39.62 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 3.64 1.88 -0.88 5.41 0.00 -0.98 -1.29 119.26 127.04 1ndj h ALA 119 Ca 0.00 -0.02 0.23 0.00 0.00 0.00 0.00 54.91 55.12 1ndj h ALA 119 Cb 0.90 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 1ndj h ALA 119 CO 0.00 0.08 0.61 0.11 0.00 0.00 0.00 179.25 180.05 1ndj h TRP 120 N 0.35 0.24 -0.64 0.00 5.08 -1.81 -1.33 115.95 117.84 1ndj h TRP 120 Ca 0.14 0.01 -0.36 0.00 1.08 0.00 0.00 58.89 59.75 1ndj h TRP 120 Cb 0.11 -0.07 -0.21 0.00 -3.00 0.00 0.00 29.16 25.98 1ndj h TRP 120 CO -0.00 0.06 0.19 0.36 -1.28 0.00 0.00 178.44 177.77 1ndj n LYS 121 N -4.39 2.16 0.14 0.12 2.85 -0.49 -4.67 118.16 113.89 1ndj n LYS 121 Ca 0.18 -3.22 0.03 0.00 -1.05 0.00 0.00 58.31 54.26 1ndj n LYS 121 Cb 0.83 -2.01 0.03 0.00 -0.65 0.00 0.00 35.03 33.23 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 1.18 0.00 -3.29 -5.58 4.64 -1.30 -3.47 113.55 105.74 1ndj h SER 122 Ca 0.40 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 61.12 1ndj h SER 122 Cb 1.94 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 63.69 1ndj h SER 122 CO 0.76 0.44 -0.84 -0.89 -0.87 0.00 0.00 176.83 175.43 1ndj s THR 123 N -2.99 1.62 -0.06 2.95 2.01 -1.26 -1.36 115.64 116.55 1ndj s THR 123 Ca 0.04 -0.73 -0.07 0.00 0.31 0.00 0.00 61.69 61.23 1ndj s THR 123 Cb 0.07 -1.46 -0.04 0.00 0.01 0.00 0.00 72.50 71.08 1ndj s THR 123 CO 0.74 0.46 0.21 -0.76 -0.69 0.00 0.00 174.62 174.58 1ndj s LEU 124 N 0.81 4.39 -0.01 4.42 1.43 0.28 -4.93 118.68 125.08 1ndj s LEU 124 Ca -0.10 0.53 0.07 0.00 -1.03 0.00 0.00 54.13 53.60 1ndj s LEU 124 Cb -0.16 -2.35 -0.02 0.00 0.03 0.00 0.00 46.19 43.69 1ndj s LEU 124 CO 0.01 0.34 -0.23 0.54 0.23 0.00 0.00 176.35 177.24 1ndj s VAL 125 N -1.14 2.34 0.00 -1.59 0.11 -1.26 0.19 120.40 119.05 1ndj s VAL 125 Ca 0.21 -1.08 0.00 0.00 -2.93 0.00 0.00 61.98 58.17 1ndj s VAL 125 Cb -0.13 -1.87 0.00 0.00 -1.53 0.00 0.00 36.38 32.85 1ndj s VAL 125 CO 0.10 0.52 0.00 0.61 -3.33 0.00 0.00 175.10 173.00 1ndj n GLY 126 N 2.22 2.31 2.88 6.54 0.00 -0.05 -4.97 105.19 114.12 1ndj n GLY 126 Ca -0.16 -0.96 -0.12 0.00 0.00 0.00 0.00 46.02 44.77 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 -7.30 -0.02 -0.07 1.61 -3.43 -1.26 0.77 115.29 105.59 1ndj s HIS 127 Ca 0.00 0.09 0.01 0.00 -0.80 0.00 0.00 55.06 54.36 1ndj s HIS 127 Cb 0.00 -0.02 0.02 0.00 -1.43 0.00 0.00 32.58 31.15 1ndj s HIS 127 CO 0.00 -0.03 -0.09 -0.51 -2.00 0.00 0.00 174.74 172.11 1ndj s ASP 128 N 0.17 1.70 -0.24 7.38 1.01 -0.92 -4.98 116.67 120.80 1ndj s ASP 128 Ca -0.01 -0.26 -0.10 0.00 0.71 0.00 0.00 52.55 52.89 1ndj s ASP 128 Cb -0.02 -0.74 -0.05 0.00 1.01 0.00 0.00 42.92 43.13 1ndj s ASP 128 CO -0.00 -0.03 0.13 -0.89 0.21 0.00 0.00 175.17 174.59 1ndj s THR 129 N 1.02 5.12 -0.15 -1.27 2.01 -1.26 -0.80 115.64 120.31 1ndj s THR 129 Ca -0.08 0.10 -0.05 0.00 0.31 0.00 0.00 61.69 61.97 1ndj s THR 129 Cb -0.15 -3.38 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 1ndj s THR 129 CO -0.00 0.35 0.01 -0.36 -0.69 0.00 0.00 174.62 173.93 1ndj s PHE 130 N 1.08 3.15 0.21 4.92 0.40 0.29 -3.30 117.98 124.74 1ndj s PHE 130 Ca 0.06 -0.03 0.11 0.00 -0.60 0.00 0.00 56.93 56.48 1ndj s PHE 130 Cb -0.14 -1.96 -0.05 0.00 0.51 0.00 0.00 43.02 41.39 1ndj s PHE 130 CO 0.04 0.17 -0.23 0.99 0.70 0.00 0.00 175.22 176.90 1ndj s THR 131 N 0.04 2.42 -2.00 0.64 2.01 0.43 -1.69 115.64 117.48 1ndj s THR 131 Ca 0.03 -2.09 0.16 0.00 0.31 0.00 0.00 61.69 60.09 1ndj s THR 131 Cb -0.13 -2.18 0.45 0.00 0.01 0.00 0.00 72.50 70.65 1ndj s THR 131 CO 0.02 -0.17 1.35 0.29 -0.69 0.00 0.00 174.62 175.41