#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dj1 h SER 2 N 0.00 0.25 -4.97 1.61 0.02 -2.11 -3.46 113.55 104.89 2dj1 h SER 2 Ca 0.00 -0.29 -0.09 0.00 -0.84 0.00 0.00 61.79 60.57 2dj1 h SER 2 Cb 0.00 -0.07 -0.20 0.00 0.14 0.00 0.00 62.40 62.28 2dj1 h SER 2 CO 0.00 0.48 -0.06 -0.44 -1.14 0.00 0.00 176.83 175.67 2dj1 s SER 3 N -5.74 -0.41 0.00 3.07 0.01 -1.26 -5.14 113.70 104.23 2dj1 s SER 3 Ca -0.14 0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.51 2dj1 s SER 3 Cb 0.06 0.43 0.00 0.00 0.21 0.00 0.00 66.02 66.72 2dj1 s SER 3 CO 0.71 -0.52 0.00 0.61 0.41 0.00 0.00 173.24 174.46 2dj1 n GLY 4 N 1.14 0.08 3.55 3.44 0.00 -1.26 -4.89 105.19 107.25 2dj1 n GLY 4 Ca -0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 2dj1 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dj1 s SER 5 N -1.00 6.23 0.05 1.61 0.15 -1.26 -4.99 113.70 114.49 2dj1 s SER 5 Ca 0.00 -0.76 0.02 0.00 0.70 0.00 0.00 55.95 55.91 2dj1 s SER 5 Cb 0.00 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.71 2dj1 s SER 5 CO 0.00 -1.76 0.07 -0.55 1.20 0.00 0.00 173.24 172.20 2dj1 s SER 6 N 4.33 5.49 0.00 5.45 0.15 -1.26 -4.98 113.70 122.88 2dj1 s SER 6 Ca 0.40 0.02 0.00 0.00 0.70 0.00 0.00 55.95 57.07 2dj1 s SER 6 Cb -0.05 -1.49 0.00 0.00 -1.71 0.00 0.00 66.02 62.76 2dj1 s SER 6 CO 0.07 0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.33 2dj1 n GLY 7 N 0.76 1.17 3.18 9.45 0.00 -1.26 -5.14 105.19 113.35 2dj1 n GLY 7 Ca -0.11 -1.06 0.05 0.00 0.00 0.00 0.00 46.02 44.91 2dj1 n GLY 7 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2dj1 s ASP 8 N 0.00 -0.48 -0.77 1.61 -4.77 -1.26 -5.11 116.67 105.89 2dj1 s ASP 8 Ca 0.00 0.36 -0.17 0.00 -3.30 0.00 0.00 52.55 49.44 2dj1 s ASP 8 Cb 0.00 1.43 0.16 0.00 -1.09 0.00 0.00 42.92 43.42 2dj1 s ASP 8 CO 0.00 -0.09 0.82 -0.62 0.70 0.00 0.00 175.17 175.98 2dj1 s ASP 9 N 2.83 6.54 0.00 2.11 -1.08 -1.26 -4.67 116.67 121.14 2dj1 s ASP 9 Ca -0.00 -2.14 0.00 0.00 -0.52 0.00 0.00 52.55 49.88 2dj1 s ASP 9 Cb -0.09 -2.28 0.00 0.00 -1.46 0.00 0.00 42.92 39.09 2dj1 s ASP 9 CO -0.12 -0.86 0.00 0.47 0.52 0.00 0.00 175.17 175.18 2dj1 n ASP 10 N 5.31 3.02 -4.55 -0.34 9.92 -1.26 -4.99 116.55 123.66 2dj1 n ASP 10 Ca 0.08 0.00 -0.37 0.00 -0.53 0.00 0.00 54.79 53.97 2dj1 n ASP 10 Cb 0.46 0.28 -0.03 0.00 -0.64 0.00 0.00 41.12 41.19 2dj1 n ASP 10 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2dj1 s LEU 11 N -2.96 3.28 0.33 0.64 1.02 -1.26 -4.96 118.68 114.77 2dj1 s LEU 11 Ca 0.00 0.29 0.08 0.00 0.02 0.00 0.00 54.13 54.52 2dj1 s LEU 11 Cb 0.00 -2.53 -0.04 0.00 0.02 0.00 0.00 46.19 43.64 2dj1 s LEU 11 CO 0.00 -2.44 0.11 -0.70 0.02 0.00 0.00 176.35 173.34 2dj1 s GLU 12 N 7.11 2.34 -0.05 1.70 2.12 -1.26 -5.06 118.70 125.60 2dj1 s GLU 12 Ca 0.69 -1.54 -0.02 0.00 0.36 0.00 0.00 54.97 54.46 2dj1 s GLU 12 Cb -0.12 -2.16 0.03 0.00 0.26 0.00 0.00 34.13 32.14 2dj1 s GLU 12 CO 0.19 0.15 0.04 0.08 -0.54 0.00 0.00 175.26 175.19 2dj1 s VAL 13 N -2.41 0.06 0.72 3.70 1.01 -1.26 -4.77 120.40 117.45 2dj1 s VAL 13 Ca 0.36 0.32 -0.01 0.00 0.00 0.00 0.00 61.98 62.65 2dj1 s VAL 13 Cb -0.03 -0.29 0.13 0.00 0.00 0.00 0.00 36.38 36.19 2dj1 s VAL 13 CO 0.22 0.20 1.00 -0.54 0.00 0.00 0.00 175.10 175.98 2dj1 s LYS 14 N 2.10 1.66 0.04 2.72 1.02 -1.26 -4.91 119.74 121.11 2dj1 s LYS 14 Ca 0.05 -1.10 -0.10 0.00 0.02 0.00 0.00 55.97 54.83 2dj1 s LYS 14 Cb -0.12 -2.32 0.01 0.00 -0.52 0.00 0.00 37.83 34.87 2dj1 s LYS 14 CO -0.04 -1.46 0.22 -1.83 -0.92 0.00 0.00 175.35 171.31 2dj1 s GLU 15 N -5.15 0.72 -0.06 1.68 1.03 -1.26 -0.34 118.70 115.30 2dj1 s GLU 15 Ca 0.66 -0.61 -0.03 0.00 0.03 0.00 0.00 54.97 55.03 2dj1 s GLU 15 Cb -0.05 0.30 0.04 0.00 -0.80 0.00 0.00 34.13 33.61 2dj1 s GLU 15 CO 0.44 -0.21 0.07 -1.21 -1.33 0.00 0.00 175.26 173.03 2dj1 s GLU 16 N -2.57 -0.05 -1.29 -4.83 2.02 0.14 -4.83 118.70 107.28 2dj1 s GLU 16 Ca -0.05 0.33 0.00 0.00 0.02 0.00 0.00 54.97 55.27 2dj1 s GLU 16 Cb -0.01 -0.69 0.00 0.00 0.10 0.00 0.00 34.13 33.53 2dj1 s GLU 16 CO -0.04 -0.38 0.00 0.09 0.02 0.00 0.00 175.26 174.95 2dj1 n ASN 17 N 5.30 -4.33 0.00 -0.19 3.02 -1.26 -0.09 115.26 117.71 2dj1 n ASN 17 Ca -0.04 0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 2dj1 n ASN 17 Cb 0.50 -3.71 0.00 0.00 -0.61 0.00 0.00 39.78 35.96 2dj1 n ASN 17 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2dj1 n GLY 18 N -0.76 0.77 3.05 7.41 0.00 -1.26 -4.90 105.19 109.50 2dj1 n GLY 18 Ca -0.17 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.26 2dj1 n GLY 18 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dj1 s VAL 19 N -2.00 2.08 0.29 1.61 1.01 0.88 -4.71 120.40 119.55 2dj1 s VAL 19 Ca 0.00 -1.56 -0.29 0.00 0.00 0.00 0.00 61.98 60.12 2dj1 s VAL 19 Cb 0.00 -2.20 -0.10 0.00 0.00 0.00 0.00 36.38 34.08 2dj1 s VAL 19 CO 0.00 -0.03 1.41 0.26 0.00 0.00 0.00 175.10 176.75 2dj1 s TRP 20 N 1.15 2.97 -0.59 5.22 0.52 -1.05 0.24 118.94 127.40 2dj1 s TRP 20 Ca -0.08 1.15 -0.19 0.00 0.02 0.00 0.00 56.10 57.00 2dj1 s TRP 20 Cb -0.20 -3.81 0.11 0.00 -1.15 0.00 0.00 33.47 28.42 2dj1 s TRP 20 CO -0.05 -2.50 0.69 0.08 0.02 0.00 0.00 176.95 175.19 2dj1 s VAL 21 N -0.45 4.85 0.33 4.03 1.01 0.53 -1.97 120.40 128.72 2dj1 s VAL 21 Ca 0.56 -1.04 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 2dj1 s VAL 21 Cb -0.42 -4.48 -0.04 0.00 0.00 0.00 0.00 36.38 31.44 2dj1 s VAL 21 CO 0.48 -1.11 0.56 -0.76 0.00 0.00 0.00 175.10 174.27 2dj1 s LEU 22 N 2.60 4.01 -0.04 3.92 1.43 -1.07 -4.28 118.68 125.25 2dj1 s LEU 22 Ca 0.11 0.61 -0.30 0.00 -1.03 0.00 0.00 54.13 53.52 2dj1 s LEU 22 Cb -0.24 -3.45 0.11 0.00 0.03 0.00 0.00 46.19 42.63 2dj1 s LEU 22 CO 0.06 -0.27 0.98 0.54 0.23 0.00 0.00 176.35 177.89 2dj1 s ASN 23 N -3.62 -0.29 0.63 2.29 4.22 -1.26 -4.47 114.94 112.44 2dj1 s ASN 23 Ca 0.42 -0.04 0.19 0.00 -2.14 0.00 0.00 52.86 51.29 2dj1 s ASN 23 Cb -0.10 0.33 0.78 0.00 1.28 0.00 0.00 41.25 43.54 2dj1 s ASN 23 CO 0.34 -0.54 1.36 -2.24 -2.04 0.00 0.00 177.10 173.97 2dj1 h ASP 24 N 2.00 0.00 -0.16 3.54 2.03 -1.97 1.63 116.42 123.49 2dj1 h ASP 24 Ca -0.20 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.04 2dj1 h ASP 24 Cb 1.22 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.72 2dj1 h ASP 24 CO 0.28 0.00 -0.15 1.23 -1.03 0.00 0.00 179.24 179.58 2dj1 h GLY 25 N 0.00 0.43 -1.66 7.15 0.00 -1.99 -3.36 103.07 103.64 2dj1 h GLY 25 Ca 0.24 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 2dj1 h GLY 25 CO -0.00 0.39 -0.65 1.16 0.00 0.00 0.00 176.54 177.43 2dj1 n ASN 26 N -4.53 1.31 0.00 0.19 6.94 0.18 -4.87 115.26 114.49 2dj1 n ASN 26 Ca -0.06 -2.86 0.00 0.00 -0.02 0.00 0.00 54.58 51.64 2dj1 n ASN 26 Cb 0.36 -0.39 0.00 0.00 -2.36 0.00 0.00 39.78 37.39 2dj1 n ASN 26 CO 0.00 0.00 0.00 0.33 -1.03 0.00 0.00 177.26 176.56 2dj1 n PHE 27 N -0.40 0.00 -0.31 -2.53 -0.00 0.50 -2.01 117.46 112.71 2dj1 n PHE 27 Ca 0.11 0.00 0.19 0.00 -0.00 0.00 0.00 57.45 57.75 2dj1 n PHE 27 Cb 0.86 -0.36 0.45 0.00 -0.00 0.00 0.00 39.48 40.44 2dj1 n PHE 27 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 2dj1 h ASP 28 N 0.00 0.54 -0.80 -2.13 3.32 -1.84 0.20 116.42 115.71 2dj1 h ASP 28 Ca 0.00 0.08 -0.05 0.00 0.02 0.00 0.00 57.03 57.08 2dj1 h ASP 28 Cb 0.00 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 2dj1 h ASP 28 CO 0.00 0.16 0.31 -1.13 -1.72 0.00 0.00 179.24 176.86 2dj1 h ASN 29 N 0.51 1.11 0.59 6.45 -1.24 -1.90 0.52 115.58 121.62 2dj1 h ASN 29 Ca 0.56 -0.18 -0.03 0.00 0.71 0.00 0.00 56.30 57.37 2dj1 h ASN 29 Cb 1.25 -0.29 0.01 0.00 0.73 0.00 0.00 38.32 40.02 2dj1 h ASN 29 CO -0.30 0.98 -0.29 0.15 -1.29 0.00 0.00 177.43 176.69 2dj1 h PHE 30 N 1.16 -0.74 0.00 0.67 3.57 -0.02 -3.14 116.94 118.45 2dj1 h PHE 30 Ca 0.26 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.73 2dj1 h PHE 30 Cb 0.23 0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 2dj1 h PHE 30 CO 0.02 -0.43 -0.06 -0.39 -2.23 0.00 0.00 178.31 175.22 2dj1 h VAL 31 N -1.17 0.27 -0.88 1.41 -1.51 -1.32 -2.69 116.25 110.36 2dj1 h VAL 31 Ca -0.08 -0.39 0.15 0.00 -1.23 0.00 0.00 66.70 65.15 2dj1 h VAL 31 Cb 0.64 1.30 -0.07 0.00 -2.13 0.00 0.00 31.29 31.03 2dj1 h VAL 31 CO 0.13 0.06 0.57 0.00 -1.23 0.00 0.00 177.57 177.10 2dj1 h ALA 32 N 1.94 1.92 -0.83 5.19 0.00 0.10 -1.06 119.26 126.53 2dj1 h ALA 32 Ca -0.00 0.02 -0.58 0.00 0.00 0.00 0.00 54.91 54.34 2dj1 h ALA 32 Cb 0.29 -0.10 -0.36 0.00 0.00 0.00 0.00 17.79 17.62 2dj1 h ALA 32 CO 0.01 -0.17 -0.15 -0.25 0.00 0.00 0.00 179.25 178.68 2dj1 n ASP 33 N -4.55 5.87 -3.70 0.00 8.00 -1.02 -4.96 116.55 116.20 2dj1 n ASP 33 Ca 0.17 -3.77 -0.11 0.00 0.71 0.00 0.00 54.79 51.79 2dj1 n ASP 33 Cb 0.52 -0.59 -0.10 0.00 -0.02 0.00 0.00 41.12 40.93 2dj1 n ASP 33 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2dj1 s LYS 34 N -3.67 0.50 -0.05 -1.24 1.02 -0.40 -5.06 119.74 110.83 2dj1 s LYS 34 Ca 0.56 0.77 -0.26 0.00 0.02 0.00 0.00 55.97 57.06 2dj1 s LYS 34 Cb 0.45 0.13 -0.22 0.00 -0.52 0.00 0.00 37.83 37.67 2dj1 s LYS 34 CO 0.02 -0.11 1.09 0.22 -0.92 0.00 0.00 175.35 175.65 2dj1 h ASP 35 N 6.30 0.08 -3.29 2.83 1.82 -1.93 -3.41 116.42 118.81 2dj1 h ASP 35 Ca -0.32 -0.68 -0.55 0.00 -0.39 0.00 0.00 57.03 55.09 2dj1 h ASP 35 Cb 1.19 -0.02 -0.35 0.00 0.68 0.00 0.00 39.33 40.82 2dj1 h ASP 35 CO 0.24 0.75 -0.82 -0.89 -1.61 0.00 0.00 179.24 176.91 2dj1 s THR 36 N -3.49 1.27 -0.10 2.25 2.01 -1.26 0.08 115.64 116.40 2dj1 s THR 36 Ca -0.17 -0.50 -0.01 0.00 0.31 0.00 0.00 61.69 61.32 2dj1 s THR 36 Cb 0.01 -1.18 0.03 0.00 0.01 0.00 0.00 72.50 71.36 2dj1 s THR 36 CO 0.70 0.40 -0.00 -0.69 -0.69 0.00 0.00 174.62 174.33 2dj1 s VAL 37 N 1.07 0.50 0.07 3.82 1.01 -0.96 -4.50 120.40 121.40 2dj1 s VAL 37 Ca -0.06 -0.06 -0.30 0.00 0.00 0.00 0.00 61.98 61.56 2dj1 s VAL 37 Cb -0.15 -0.70 -0.05 0.00 0.00 0.00 0.00 36.38 35.49 2dj1 s VAL 37 CO -0.02 0.19 1.04 -0.22 0.00 0.00 0.00 175.10 176.10 2dj1 s LEU 38 N 1.91 4.42 -0.07 3.92 2.96 -1.20 -2.16 118.68 128.46 2dj1 s LEU 38 Ca 0.04 1.83 0.02 0.00 -0.22 0.00 0.00 54.13 55.80 2dj1 s LEU 38 Cb -0.13 -3.58 0.02 0.00 0.50 0.00 0.00 46.19 42.99 2dj1 s LEU 38 CO -0.06 -0.25 -0.11 -0.76 -1.32 0.00 0.00 176.35 173.84 2dj1 s LEU 39 N 0.57 1.56 -0.19 -0.68 1.43 -0.78 -1.76 118.68 118.84 2dj1 s LEU 39 Ca 0.52 -0.30 -0.00 0.00 -1.03 0.00 0.00 54.13 53.32 2dj1 s LEU 39 Cb -0.25 -0.82 0.01 0.00 0.03 0.00 0.00 46.19 45.16 2dj1 s LEU 39 CO 0.30 0.00 -0.15 -0.70 0.23 0.00 0.00 176.35 176.03 2dj1 s GLU 40 N 0.85 3.12 0.13 1.70 2.12 -0.64 -0.26 118.70 125.72 2dj1 s GLU 40 Ca -0.11 -0.76 -0.18 0.00 0.36 0.00 0.00 54.97 54.27 2dj1 s GLU 40 Cb -0.15 -2.70 -0.07 0.00 0.26 0.00 0.00 34.13 31.47 2dj1 s GLU 40 CO 0.01 -0.18 0.61 -0.06 -0.54 0.00 0.00 175.26 175.10 2dj1 s PHE 41 N 1.29 3.72 0.23 5.30 0.40 0.93 -0.34 117.98 129.50 2dj1 s PHE 41 Ca 0.04 1.26 -0.13 0.00 -0.60 0.00 0.00 56.93 57.49 2dj1 s PHE 41 Cb -0.14 -2.50 0.00 0.00 0.51 0.00 0.00 43.02 40.89 2dj1 s PHE 41 CO -0.09 0.49 0.46 1.52 0.70 0.00 0.00 175.22 178.30 2dj1 s TYR 42 N -1.30 0.28 0.00 0.36 -0.85 -0.75 -2.59 117.35 112.50 2dj1 s TYR 42 Ca 0.35 -0.64 0.02 0.00 -0.52 0.00 0.00 57.07 56.28 2dj1 s TYR 42 Cb -0.18 0.20 -0.01 0.00 0.38 0.00 0.00 41.96 42.35 2dj1 s TYR 42 CO 0.20 -0.95 -0.07 0.00 -1.52 0.00 0.00 175.55 173.21 2dj1 s ALA 43 N -3.99 0.60 -0.09 9.51 0.00 -1.26 -3.61 121.76 122.93 2dj1 s ALA 43 Ca 0.19 -0.37 0.30 0.00 0.00 0.00 0.00 51.96 52.09 2dj1 s ALA 43 Cb -0.00 -0.13 1.27 0.00 0.00 0.00 0.00 23.12 24.25 2dj1 s ALA 43 CO 0.06 0.13 1.90 -1.00 0.00 0.00 0.00 175.76 176.85 2dj1 h PRO 44 N 5.78 0.00 0.00 0.00 0.13 -2.00 -2.86 132.00 133.05 2dj1 h PRO 44 Ca -0.30 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.56 2dj1 h PRO 44 Cb 1.19 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.27 2dj1 h PRO 44 CO 0.49 0.00 -1.68 -2.67 -0.23 0.00 0.00 178.00 173.90 2dj1 n TRP 45 N -2.79 0.93 -2.43 1.56 4.27 -1.26 -4.71 117.44 113.02 2dj1 n TRP 45 Ca 0.01 0.33 -0.38 0.00 -3.89 0.00 0.00 57.50 53.57 2dj1 n TRP 45 Cb 0.27 -1.15 -0.03 0.00 -1.36 0.00 0.00 31.31 29.04 2dj1 n TRP 45 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2dj1 h GLY 47 N 14.03 0.00 1.75 0.00 0.00 -1.84 -1.86 103.07 115.15 2dj1 h GLY 47 Ca 0.12 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.47 2dj1 h GLY 47 CO 1.36 0.00 0.11 0.84 0.00 0.00 0.00 176.54 178.85 2dj1 h HIS 48 N 0.00 0.00 0.01 5.60 6.17 -1.94 0.15 115.15 125.13 2dj1 h HIS 48 Ca -0.00 0.00 -0.19 0.00 0.71 0.00 0.00 60.37 60.89 2dj1 h HIS 48 Cb 0.10 0.00 -0.01 0.00 2.52 0.00 0.00 27.41 30.01 2dj1 h HIS 48 CO 0.00 0.00 -0.88 0.00 0.71 0.00 0.00 177.93 177.76 2dj1 h LYS 50 N 0.08 0.17 -0.06 0.00 1.57 -1.12 0.64 116.57 117.86 2dj1 h LYS 50 Ca -0.04 -0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.59 2dj1 h LYS 50 Cb 1.51 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.77 2dj1 h LYS 50 CO 0.13 0.11 -0.60 -0.56 -0.57 0.00 0.00 179.45 177.96 2dj1 h GLN 51 N 0.18 0.22 -0.01 3.15 3.07 -1.67 -2.95 115.11 117.11 2dj1 h GLN 51 Ca 0.50 -0.15 0.00 0.00 0.09 0.00 0.00 58.65 59.09 2dj1 h GLN 51 Cb 1.67 0.02 0.00 0.00 0.08 0.00 0.00 27.48 29.25 2dj1 h GLN 51 CO -0.11 0.75 -0.42 0.34 0.09 0.00 0.00 178.83 179.48 2dj1 n PHE 52 N -3.87 0.00 0.10 0.06 7.35 0.18 -4.37 117.46 116.91 2dj1 n PHE 52 Ca -0.02 0.00 -0.14 0.00 -0.76 0.00 0.00 57.45 56.52 2dj1 n PHE 52 Cb 0.61 -0.12 -0.09 0.00 0.35 0.00 0.00 39.48 40.23 2dj1 n PHE 52 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2dj1 h ALA 53 N 3.48 -0.95 0.00 3.13 0.00 -0.06 0.11 119.26 124.97 2dj1 h ALA 53 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2dj1 h ALA 53 Cb 0.54 0.84 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2dj1 h ALA 53 CO 0.00 -1.06 0.00 -0.35 0.00 0.00 0.00 179.25 177.84 2dj1 n PRO 54 N -5.08 0.16 0.09 0.00 -0.04 -1.26 -2.64 135.00 126.22 2dj1 n PRO 54 Ca -0.07 0.39 -0.16 0.00 -0.04 0.00 0.00 63.50 63.62 2dj1 n PRO 54 Cb 0.36 -1.80 -0.14 0.00 -0.04 0.00 0.00 33.50 31.87 2dj1 n PRO 54 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2dj1 h GLU 55 N 0.00 0.27 -0.08 0.54 4.81 -1.43 -3.26 114.58 115.43 2dj1 h GLU 55 Ca 0.00 -0.46 -0.03 0.00 -0.13 0.00 0.00 59.36 58.74 2dj1 h GLU 55 Cb 0.34 0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.89 2dj1 h GLU 55 CO 0.00 1.18 -0.06 -0.92 -0.73 0.00 0.00 179.01 178.48 2dj1 h TYR 56 N 0.07 0.21 -0.82 0.92 3.20 -0.60 -3.06 116.97 116.89 2dj1 h TYR 56 Ca -0.18 -0.06 0.16 0.00 3.14 0.00 0.00 58.73 61.79 2dj1 h TYR 56 Cb 2.00 -0.05 -0.06 0.00 1.54 0.00 0.00 36.73 40.17 2dj1 h TYR 56 CO 0.07 0.58 0.54 0.93 -1.64 0.00 0.00 178.16 178.64 2dj1 h GLU 57 N -0.23 0.43 0.00 1.82 5.08 -1.68 0.35 114.58 120.35 2dj1 h GLU 57 Ca 0.01 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2dj1 h GLU 57 Cb 0.54 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2dj1 h GLU 57 CO 0.02 0.28 -0.17 0.87 -1.00 0.00 0.00 179.01 179.01 2dj1 h LYS 58 N 0.44 0.00 0.09 2.33 1.57 -1.57 -2.63 116.57 116.80 2dj1 h LYS 58 Ca 0.41 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.93 2dj1 h LYS 58 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.24 2dj1 h LYS 58 CO -0.14 0.17 -1.16 0.82 -0.57 0.00 0.00 179.45 178.57 2dj1 h ILE 59 N 0.00 1.50 0.37 1.86 2.04 -0.30 -3.28 117.51 119.70 2dj1 h ILE 59 Ca -0.00 -2.96 -0.01 0.00 1.00 0.00 0.00 64.86 62.89 2dj1 h ILE 59 Cb 0.45 2.83 -0.02 0.00 -0.74 0.00 0.00 36.82 39.35 2dj1 h ILE 59 CO 0.02 0.87 -0.30 0.00 0.00 0.00 0.00 178.15 178.74 2dj1 h ALA 60 N 0.65 -0.67 -0.18 1.87 0.00 -1.08 -0.87 119.26 118.98 2dj1 h ALA 60 Ca -0.11 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.73 2dj1 h ALA 60 Cb 1.87 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 20.06 2dj1 h ALA 60 CO 0.19 -0.90 0.24 1.03 0.00 0.00 0.00 179.25 179.81 2dj1 h SER 61 N -0.67 0.00 0.10 0.00 0.87 -1.67 0.68 113.55 112.87 2dj1 h SER 61 Ca -0.03 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.53 2dj1 h SER 61 Cb 0.59 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.55 2dj1 h SER 61 CO -0.02 0.00 -0.05 0.74 -0.53 0.00 0.00 176.83 176.97 2dj1 h THR 62 N 0.00 0.00 0.00 2.23 2.02 -1.33 -3.31 112.91 112.52 2dj1 h THR 62 Ca 0.09 -0.44 -0.01 0.00 0.77 0.00 0.00 66.41 66.82 2dj1 h THR 62 Cb 0.57 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.98 2dj1 h THR 62 CO -0.00 0.00 -0.04 -0.07 0.37 0.00 0.00 175.52 175.78 2dj1 h LEU 63 N -0.58 0.00 -0.11 2.58 3.38 -0.97 -2.78 115.31 116.83 2dj1 h LEU 63 Ca -0.01 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.99 2dj1 h LEU 63 Cb 0.11 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 2dj1 h LEU 63 CO 0.02 0.04 -0.14 0.50 0.09 0.00 0.00 178.44 178.95 2dj1 h LYS 64 N 0.00 -0.18 -0.64 1.13 3.64 0.32 -1.77 116.57 119.08 2dj1 h LYS 64 Ca -0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2dj1 h LYS 64 Cb 0.33 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2dj1 h LYS 64 CO 0.01 -0.12 0.00 -0.25 -2.27 0.00 0.00 179.45 176.82 2dj1 n ASP 65 N -5.29 4.92 -4.86 4.20 9.92 -1.14 -4.34 116.55 119.96 2dj1 n ASP 65 Ca -0.03 -2.62 -0.30 0.00 -0.53 0.00 0.00 54.79 51.31 2dj1 n ASP 65 Cb 0.21 -0.61 0.06 0.00 -0.64 0.00 0.00 41.12 40.13 2dj1 n ASP 65 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 2dj1 s ASN 66 N -0.80 5.12 -0.16 -2.24 2.47 -0.69 -4.96 114.94 113.69 2dj1 s ASN 66 Ca 0.49 1.15 0.01 0.00 0.42 0.00 0.00 52.86 54.93 2dj1 s ASN 66 Cb 0.34 -1.91 0.02 0.00 -1.45 0.00 0.00 41.25 38.26 2dj1 s ASN 66 CO 0.20 -1.55 -0.17 -0.62 -3.72 0.00 0.00 177.10 171.24 2dj1 s ASP 67 N -4.26 2.86 0.98 -4.21 2.15 -1.26 -1.68 116.67 111.25 2dj1 s ASP 67 Ca 0.59 -0.55 -0.12 0.00 0.43 0.00 0.00 52.55 52.90 2dj1 s ASP 67 Cb -0.12 -1.30 0.18 0.00 -0.30 0.00 0.00 42.92 41.38 2dj1 s ASP 67 CO 0.52 -0.03 1.09 -2.16 -0.17 0.00 0.00 175.17 174.43 2dj1 s PRO 68 N 1.37 0.60 -0.15 4.34 0.04 -1.26 -5.07 135.00 134.86 2dj1 s PRO 68 Ca 0.04 0.58 -0.29 0.00 0.04 0.00 0.00 61.00 61.37 2dj1 s PRO 68 Cb -0.13 -1.75 -0.03 0.00 0.04 0.00 0.00 34.50 32.62 2dj1 s PRO 68 CO -0.11 -2.63 1.56 -1.25 0.04 0.00 0.00 177.00 174.61 2dj1 s PRO 69 N -4.96 4.03 0.02 0.56 0.04 -0.67 -5.00 135.00 129.01 2dj1 s PRO 69 Ca 0.65 1.86 0.07 0.00 0.04 0.00 0.00 61.00 63.61 2dj1 s PRO 69 Cb -0.18 -3.96 -0.03 0.00 0.04 0.00 0.00 34.50 30.36 2dj1 s PRO 69 CO 0.57 -1.01 -0.19 0.42 0.04 0.00 0.00 177.00 176.84 2dj1 s ILE 70 N 4.42 2.70 -0.26 0.56 1.01 -1.07 -5.02 121.20 123.54 2dj1 s ILE 70 Ca 0.69 -1.10 -0.07 0.00 0.00 0.00 0.00 60.65 60.17 2dj1 s ILE 70 Cb -0.27 -2.09 -0.02 0.00 0.01 0.00 0.00 42.46 40.08 2dj1 s ILE 70 CO 0.26 0.42 0.07 0.00 0.00 0.00 0.00 174.94 175.69 2dj1 s ALA 71 N -0.84 3.12 -0.06 9.38 0.00 -1.26 -3.59 121.76 128.51 2dj1 s ALA 71 Ca 0.13 -1.19 -0.20 0.00 0.00 0.00 0.00 51.96 50.70 2dj1 s ALA 71 Cb -0.10 -2.07 -0.05 0.00 0.00 0.00 0.00 23.12 20.90 2dj1 s ALA 71 CO 0.03 -0.57 0.55 0.08 0.00 0.00 0.00 175.76 175.86 2dj1 s VAL 72 N 1.59 5.06 0.02 0.00 1.01 -1.26 -3.22 120.40 123.59 2dj1 s VAL 72 Ca 0.06 1.13 -0.02 0.00 0.00 0.00 0.00 61.98 63.15 2dj1 s VAL 72 Cb -0.15 -3.89 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 2dj1 s VAL 72 CO 0.03 0.36 0.01 0.00 0.00 0.00 0.00 175.10 175.50 2dj1 s ALA 73 N 0.28 0.01 0.18 5.51 0.00 -0.72 -2.53 121.76 124.49 2dj1 s ALA 73 Ca 0.30 -0.47 0.09 0.00 0.00 0.00 0.00 51.96 51.87 2dj1 s ALA 73 Cb -0.17 0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 2dj1 s ALA 73 CO 0.14 -0.17 -0.12 -1.59 0.00 0.00 0.00 175.76 174.02 2dj1 s LYS 74 N -1.45 1.98 0.03 0.00 -2.85 -0.83 -1.63 119.74 114.99 2dj1 s LYS 74 Ca -0.16 -1.31 0.00 0.00 -1.00 0.00 0.00 55.97 53.50 2dj1 s LYS 74 Cb -0.09 -2.11 -0.02 0.00 -2.06 0.00 0.00 37.83 33.54 2dj1 s LYS 74 CO -0.00 0.43 -0.03 0.42 0.10 0.00 0.00 175.35 176.26 2dj1 s ILE 75 N -1.72 0.17 -0.88 3.79 1.01 0.53 -2.59 121.20 121.51 2dj1 s ILE 75 Ca 0.24 -1.03 -0.10 0.00 0.00 0.00 0.00 60.65 59.77 2dj1 s ILE 75 Cb -0.09 -0.44 0.23 0.00 0.01 0.00 0.00 42.46 42.17 2dj1 s ILE 75 CO 0.14 -0.55 0.81 1.51 0.00 0.00 0.00 174.94 176.85 2dj1 s ASP 76 N -1.64 6.57 0.30 3.58 1.47 -1.26 -1.81 116.67 123.87 2dj1 s ASP 76 Ca -0.13 -3.08 0.05 0.00 1.18 0.00 0.00 52.55 50.58 2dj1 s ASP 76 Cb -0.08 -2.12 0.82 0.00 -0.34 0.00 0.00 42.92 41.20 2dj1 s ASP 76 CO -0.02 -0.42 1.46 0.00 0.68 0.00 0.00 175.17 176.88 2dj1 n ALA 77 N 3.37 0.57 -0.30 2.11 0.00 -1.24 0.12 120.51 125.14 2dj1 n ALA 77 Ca 0.16 0.99 0.13 0.00 0.00 0.00 0.00 53.44 54.72 2dj1 n ALA 77 Cb 0.42 -0.77 0.30 0.00 0.00 0.00 0.00 19.45 19.40 2dj1 n ALA 77 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2dj1 h THR 78 N 0.00 0.48 0.20 0.00 1.35 -1.92 -1.01 112.91 112.02 2dj1 h THR 78 Ca 0.61 -0.14 -0.33 0.00 -0.55 0.00 0.00 66.41 66.00 2dj1 h THR 78 Cb 1.34 0.05 0.02 0.00 -1.73 0.00 0.00 68.15 67.83 2dj1 h THR 78 CO -0.85 0.07 -1.55 0.28 -0.25 0.00 0.00 175.52 173.23 2dj1 h SER 79 N 0.40 0.67 -3.18 5.36 0.02 0.59 -3.42 113.55 114.00 2dj1 h SER 79 Ca 0.55 -0.82 -0.72 0.00 -0.84 0.00 0.00 61.79 59.96 2dj1 h SER 79 Cb 1.04 -0.22 -0.21 0.00 0.14 0.00 0.00 62.40 63.15 2dj1 h SER 79 CO -0.52 1.66 -0.11 0.00 -1.14 0.00 0.00 176.83 176.71 2dj1 s ALA 80 N -2.60 3.50 -0.12 3.77 0.00 -0.16 -4.93 121.76 121.22 2dj1 s ALA 80 Ca -0.11 -2.09 -0.16 0.00 0.00 0.00 0.00 51.96 49.60 2dj1 s ALA 80 Cb 0.05 -3.27 -0.14 0.00 0.00 0.00 0.00 23.12 19.75 2dj1 s ALA 80 CO 0.90 -1.98 0.45 1.03 0.00 0.00 0.00 175.76 176.16 2dj1 h SER 81 N 8.93 -0.01 -0.18 0.00 0.87 -1.83 -2.84 113.55 118.50 2dj1 h SER 81 Ca -0.29 -0.54 0.03 0.00 -1.23 0.00 0.00 61.79 59.76 2dj1 h SER 81 Cb 1.10 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.01 2dj1 h SER 81 CO 0.97 0.75 -0.38 -0.03 -0.53 0.00 0.00 176.83 177.61 2dj1 h MET 82 N -0.99 -0.34 -0.27 2.24 1.85 -1.92 0.23 114.93 115.73 2dj1 h MET 82 Ca -0.00 0.02 0.06 0.00 -0.61 0.00 0.00 59.70 59.17 2dj1 h MET 82 Cb 0.55 0.08 -0.06 0.00 0.43 0.00 0.00 31.60 32.60 2dj1 h MET 82 CO 0.00 -0.23 -0.11 -0.07 -0.40 0.00 0.00 176.91 176.10 2dj1 h LEU 83 N -0.35 -0.39 -0.62 3.39 3.38 -1.96 0.53 115.31 119.29 2dj1 h LEU 83 Ca 0.03 0.10 0.12 0.00 0.09 0.00 0.00 57.88 58.23 2dj1 h LEU 83 Cb 0.45 0.22 -0.10 0.00 0.09 0.00 0.00 40.66 41.33 2dj1 h LEU 83 CO -0.35 -0.15 0.07 0.00 0.09 0.00 0.00 178.44 178.10 2dj1 h ALA 84 N 1.17 0.68 0.00 1.53 0.00 -1.13 0.25 119.26 121.76 2dj1 h ALA 84 Ca 0.14 0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 2dj1 h ALA 84 Cb 0.28 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2dj1 h ALA 84 CO -0.32 -0.35 -0.20 1.03 0.00 0.00 0.00 179.25 179.41 2dj1 h SER 85 N 0.19 0.00 -0.07 0.00 0.87 0.23 0.38 113.55 115.16 2dj1 h SER 85 Ca 0.33 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.89 2dj1 h SER 85 Cb 0.52 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.47 2dj1 h SER 85 CO -0.47 0.20 0.04 0.50 -0.53 0.00 0.00 176.83 176.57 2dj1 h LYS 86 N 0.00 0.08 -0.67 2.24 3.64 0.17 -2.45 116.57 119.58 2dj1 h LYS 86 Ca -0.00 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 2dj1 h LYS 86 Cb 0.66 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.43 2dj1 h LYS 86 CO 0.03 0.05 0.07 1.19 -2.27 0.00 0.00 179.45 178.52 2dj1 n PHE 87 N -5.05 1.99 -4.25 1.91 3.01 -1.06 -4.92 117.46 109.09 2dj1 n PHE 87 Ca -0.06 -0.78 -0.34 0.00 1.01 0.00 0.00 57.45 57.28 2dj1 n PHE 87 Cb 0.03 -0.52 -0.05 0.00 -0.01 0.00 0.00 39.48 38.93 2dj1 n PHE 87 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 2dj1 n ASP 88 N 0.38 -1.62 -4.61 4.37 8.00 -0.92 -4.81 116.55 117.34 2dj1 n ASP 88 Ca 0.28 -1.10 -0.43 0.00 0.71 0.00 0.00 54.79 54.25 2dj1 n ASP 88 Cb 1.16 -2.39 -0.03 0.00 -0.02 0.00 0.00 41.12 39.84 2dj1 n ASP 88 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2dj1 s VAL 89 N -3.62 3.57 -0.36 2.53 1.01 0.10 -4.87 120.40 118.76 2dj1 s VAL 89 Ca 0.47 0.61 0.11 0.00 0.00 0.00 0.00 61.98 63.16 2dj1 s VAL 89 Cb -0.26 -3.70 0.45 0.00 0.00 0.00 0.00 36.38 32.87 2dj1 s VAL 89 CO 0.95 -0.39 1.08 -0.24 0.00 0.00 0.00 175.10 176.50 2dj1 n SER 90 N 9.52 3.52 0.00 3.32 2.88 -1.26 -4.83 113.62 126.77 2dj1 n SER 90 Ca 0.21 -3.26 0.00 0.00 -1.33 0.00 0.00 58.87 54.49 2dj1 n SER 90 Cb 0.46 -0.46 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2dj1 n SER 90 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dj1 n GLY 91 N -0.42 -0.39 3.52 0.46 0.00 -1.26 -5.18 105.19 101.92 2dj1 n GLY 91 Ca 0.28 -1.19 -0.14 0.00 0.00 0.00 0.00 46.02 44.97 2dj1 n GLY 91 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2dj1 s TYR 92 N -2.00 -0.52 0.45 1.61 1.51 -1.26 -4.18 117.35 112.96 2dj1 s TYR 92 Ca 0.00 0.75 -0.23 0.00 -1.01 0.00 0.00 57.07 56.58 2dj1 s TYR 92 Cb 0.00 0.46 -0.08 0.00 -0.11 0.00 0.00 41.96 42.23 2dj1 s TYR 92 CO 0.00 -0.55 1.17 -1.25 -1.11 0.00 0.00 175.55 173.81 2dj1 s PRO 93 N -1.76 3.82 -0.19 -1.71 0.04 -1.26 -4.97 135.00 128.97 2dj1 s PRO 93 Ca -0.05 1.80 -0.02 0.00 0.04 0.00 0.00 61.00 62.78 2dj1 s PRO 93 Cb -0.00 -2.47 0.06 0.00 0.04 0.00 0.00 34.50 32.12 2dj1 s PRO 93 CO 0.02 -0.51 0.01 0.99 0.04 0.00 0.00 177.00 177.55 2dj1 s THR 94 N -1.51 0.72 -0.07 1.26 2.01 -1.07 -5.03 115.64 111.96 2dj1 s THR 94 Ca 0.62 -0.61 -0.10 0.00 0.31 0.00 0.00 61.69 61.91 2dj1 s THR 94 Cb -0.29 -1.13 -0.05 0.00 0.01 0.00 0.00 72.50 71.04 2dj1 s THR 94 CO 0.36 -0.12 0.25 -0.63 -0.69 0.00 0.00 174.62 173.80 2dj1 s ILE 95 N 1.77 5.31 0.18 1.82 1.01 -1.26 -0.05 121.20 129.97 2dj1 s ILE 95 Ca -0.01 0.46 0.00 0.00 0.00 0.00 0.00 60.65 61.10 2dj1 s ILE 95 Cb -0.17 -3.53 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 2dj1 s ILE 95 CO -0.07 0.59 0.06 -0.54 0.00 0.00 0.00 174.94 174.97 2dj1 s LYS 96 N -1.09 1.11 -0.03 2.79 -0.14 0.64 -3.97 119.74 119.06 2dj1 s LYS 96 Ca 0.19 -1.55 0.01 0.00 -1.36 0.00 0.00 55.97 53.25 2dj1 s LYS 96 Cb -0.14 -0.01 0.02 0.00 -1.68 0.00 0.00 37.83 36.02 2dj1 s LYS 96 CO 0.08 -0.24 -0.02 0.42 -0.76 0.00 0.00 175.35 174.83 2dj1 s ILE 97 N -3.88 0.32 -0.22 2.17 1.01 -1.19 -1.86 121.20 117.55 2dj1 s ILE 97 Ca 0.29 -0.02 -0.09 0.00 0.00 0.00 0.00 60.65 60.82 2dj1 s ILE 97 Cb 0.07 -0.37 -0.04 0.00 0.01 0.00 0.00 42.46 42.12 2dj1 s ILE 97 CO 0.06 0.16 0.11 -0.22 0.00 0.00 0.00 174.94 175.06 2dj1 s LEU 98 N 0.82 3.90 -0.43 2.97 2.96 -0.92 -0.81 118.68 127.17 2dj1 s LEU 98 Ca -0.09 0.04 0.02 0.00 -0.22 0.00 0.00 54.13 53.88 2dj1 s LEU 98 Cb -0.12 -2.03 0.12 0.00 0.50 0.00 0.00 46.19 44.65 2dj1 s LEU 98 CO -0.01 0.08 0.18 -0.75 -1.32 0.00 0.00 176.35 174.53 2dj1 s LYS 99 N 0.95 1.84 -1.05 1.98 2.47 0.50 -2.27 119.74 124.16 2dj1 s LYS 99 Ca 0.06 -2.14 0.00 0.00 -1.56 0.00 0.00 55.97 52.33 2dj1 s LYS 99 Cb -0.13 -3.37 0.00 0.00 -1.46 0.00 0.00 37.83 32.86 2dj1 s LYS 99 CO 0.03 -1.04 0.00 1.63 0.16 0.00 0.00 175.35 176.13 2dj1 n LYS 100 N 3.93 -1.86 0.00 4.03 5.02 0.11 -0.11 118.16 129.28 2dj1 n LYS 100 Ca 0.03 0.59 0.00 0.00 -2.02 0.00 0.00 58.31 56.92 2dj1 n LYS 100 Cb 0.39 -5.02 0.00 0.00 -0.02 0.00 0.00 35.03 30.38 2dj1 n LYS 100 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dj1 n GLY 101 N -0.54 1.22 3.30 0.72 0.00 -1.26 -5.10 105.19 103.53 2dj1 n GLY 101 Ca -0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 2dj1 n GLY 101 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dj1 s GLN 102 N -0.36 3.32 -0.27 1.61 1.11 0.84 -5.09 119.66 120.82 2dj1 s GLN 102 Ca 0.00 -0.67 -0.29 0.00 0.01 0.00 0.00 55.36 54.40 2dj1 s GLN 102 Cb 0.00 -2.82 0.01 0.00 -1.01 0.00 0.00 33.01 29.19 2dj1 s GLN 102 CO 0.00 -0.07 1.10 0.00 0.01 0.00 0.00 175.29 176.33 2dj1 s ALA 103 N 1.08 3.58 -0.47 6.09 0.00 -1.26 -0.37 121.76 130.41 2dj1 s ALA 103 Ca 0.00 0.09 -0.04 0.00 0.00 0.00 0.00 51.96 52.01 2dj1 s ALA 103 Cb -0.15 -3.63 0.12 0.00 0.00 0.00 0.00 23.12 19.47 2dj1 s ALA 103 CO -0.02 -1.31 0.29 0.08 0.00 0.00 0.00 175.76 174.80 2dj1 s VAL 104 N 3.52 3.60 0.20 0.00 1.01 0.01 -5.01 120.40 123.73 2dj1 s VAL 104 Ca 0.47 -2.20 -0.32 0.00 0.00 0.00 0.00 61.98 59.93 2dj1 s VAL 104 Cb -0.14 -3.41 -0.12 0.00 0.00 0.00 0.00 36.38 32.70 2dj1 s VAL 104 CO 0.12 -0.75 1.69 -0.67 0.00 0.00 0.00 175.10 175.49 2dj1 n ASP 105 N 4.42 3.79 -0.08 3.32 -0.08 -1.26 -3.14 116.55 123.53 2dj1 n ASP 105 Ca -0.01 1.07 -0.07 0.00 -1.51 0.00 0.00 54.79 54.27 2dj1 n ASP 105 Cb 0.41 -1.54 -0.02 0.00 2.34 0.00 0.00 41.12 42.30 2dj1 n ASP 105 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2dj1 n TYR 106 N 3.79 0.42 -3.91 -0.67 9.36 -1.25 -4.97 117.16 119.92 2dj1 n TYR 106 Ca 0.16 0.18 -0.25 0.00 3.32 0.00 0.00 57.90 61.31 2dj1 n TYR 106 Cb 0.34 -0.60 -0.07 0.00 -0.63 0.00 0.00 39.34 38.37 2dj1 n TYR 106 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 2dj1 n ASP 107 N -4.43 0.42 -2.05 2.98 5.75 -1.26 -4.89 116.55 113.07 2dj1 n ASP 107 Ca -0.10 -0.99 -0.01 0.00 -0.01 0.00 0.00 54.79 53.67 2dj1 n ASP 107 Cb 0.38 -1.22 -0.00 0.00 -1.03 0.00 0.00 41.12 39.24 2dj1 n ASP 107 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dj1 n GLY 108 N -2.19 4.16 3.68 6.12 0.00 -1.26 -5.08 105.19 110.62 2dj1 n GLY 108 Ca -0.24 -2.18 -0.43 0.00 0.00 0.00 0.00 46.02 43.16 2dj1 n GLY 108 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dj1 n SER 109 N -1.13 3.97 -4.56 1.61 7.64 -1.26 -4.88 113.62 115.01 2dj1 n SER 109 Ca -0.01 0.96 -0.37 0.00 1.01 0.00 0.00 58.87 60.46 2dj1 n SER 109 Cb 0.03 -1.51 -0.04 0.00 -1.01 0.00 0.00 64.21 61.68 2dj1 n SER 109 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2dj1 s ARG 110 N 3.46 3.18 -0.16 1.43 3.52 -1.26 -4.24 118.95 124.88 2dj1 s ARG 110 Ca 0.86 -0.64 -0.10 0.00 -0.13 0.00 0.00 55.73 55.72 2dj1 s ARG 110 Cb -0.50 -5.04 0.05 0.00 -1.56 0.00 0.00 34.95 27.90 2dj1 s ARG 110 CO 0.41 -2.56 0.40 0.95 -0.81 0.00 0.00 175.30 173.69 2dj1 s THR 111 N 6.79 -0.02 0.45 4.11 -4.23 -1.26 -5.02 115.64 116.46 2dj1 s THR 111 Ca 0.53 0.08 0.32 0.00 -1.18 0.00 0.00 61.69 61.43 2dj1 s THR 111 Cb -0.04 -0.59 0.51 0.00 1.34 0.00 0.00 72.50 73.72 2dj1 s THR 111 CO -0.02 0.03 1.63 -0.61 -0.54 0.00 0.00 174.62 175.11 2dj1 h GLN 112 N 6.77 0.08 0.07 3.99 4.15 -1.91 0.14 115.11 128.40 2dj1 h GLN 112 Ca -0.35 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.06 2dj1 h GLN 112 Cb 1.18 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.86 2dj1 h GLN 112 CO 0.29 0.05 -0.03 0.93 -1.93 0.00 0.00 178.83 178.14 2dj1 h GLU 113 N 0.08 -0.09 -0.16 1.69 4.39 -1.95 -3.03 114.58 115.51 2dj1 h GLU 113 Ca 0.82 0.01 0.03 0.00 0.34 0.00 0.00 59.36 60.56 2dj1 h GLU 113 Cb 2.65 0.02 -0.06 0.00 -0.10 0.00 0.00 28.75 31.26 2dj1 h GLU 113 CO -0.37 -0.06 -0.50 0.93 -1.16 0.00 0.00 179.01 177.85 2dj1 h GLU 114 N -0.18 -0.49 -1.52 2.33 4.39 -1.60 0.39 114.58 117.90 2dj1 h GLU 114 Ca -0.01 0.03 0.45 0.00 0.34 0.00 0.00 59.36 60.18 2dj1 h GLU 114 Cb 0.07 0.11 -0.09 0.00 -0.10 0.00 0.00 28.75 28.74 2dj1 h GLU 114 CO 0.02 -0.33 1.06 0.82 -1.16 0.00 0.00 179.01 179.42 2dj1 h ILE 115 N -0.51 0.17 0.00 3.13 2.04 -0.94 1.45 117.51 122.86 2dj1 h ILE 115 Ca 0.03 -0.02 -0.24 0.00 1.00 0.00 0.00 64.86 65.63 2dj1 h ILE 115 Cb 0.61 0.12 -0.04 0.00 -0.74 0.00 0.00 36.82 36.77 2dj1 h ILE 115 CO -0.42 0.01 -1.39 0.58 0.00 0.00 0.00 178.15 176.92 2dj1 h VAL 116 N 0.05 1.08 0.00 1.67 2.07 -0.55 -3.01 116.25 117.56 2dj1 h VAL 116 Ca 0.79 -2.82 -0.03 0.00 0.82 0.00 0.00 66.70 65.45 2dj1 h VAL 116 Cb 2.89 2.51 -0.00 0.00 -1.52 0.00 0.00 31.29 35.16 2dj1 h VAL 116 CO -0.15 0.61 -0.14 0.00 0.02 0.00 0.00 177.57 177.91 2dj1 h ALA 117 N 1.07 1.51 0.07 1.67 0.00 0.59 0.57 119.26 124.74 2dj1 h ALA 117 Ca -0.17 -0.13 -0.35 0.00 0.00 0.00 0.00 54.91 54.27 2dj1 h ALA 117 Cb 1.86 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.59 2dj1 h ALA 117 CO 0.09 0.17 -1.97 1.17 0.00 0.00 0.00 179.25 178.72 2dj1 n LYS 118 N -4.00 0.71 0.13 0.00 3.00 -0.76 -3.01 118.16 114.24 2dj1 n LYS 118 Ca -0.02 0.25 -0.01 0.00 -0.00 0.00 0.00 58.31 58.53 2dj1 n LYS 118 Cb 0.23 -1.71 0.23 0.00 0.00 0.00 0.00 35.03 33.78 2dj1 n LYS 118 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2dj1 h VAL 119 N 0.04 1.35 0.11 3.15 2.07 -1.36 -0.78 116.25 120.83 2dj1 h VAL 119 Ca -0.40 -1.69 -0.28 0.00 0.82 0.00 0.00 66.70 65.15 2dj1 h VAL 119 Cb 2.03 1.87 -0.01 0.00 -1.52 0.00 0.00 31.29 33.66 2dj1 h VAL 119 CO 0.07 0.49 -1.36 0.08 0.02 0.00 0.00 177.57 176.87 2dj1 h ARG 120 N 0.08 0.23 0.02 1.57 0.11 -1.05 -3.17 114.38 112.17 2dj1 h ARG 120 Ca 0.00 -0.39 -0.00 0.00 0.10 0.00 0.00 59.98 59.69 2dj1 h ARG 120 Cb 0.89 0.15 0.00 0.00 1.11 0.00 0.00 29.97 32.12 2dj1 h ARG 120 CO 0.07 1.13 -0.01 1.05 0.10 0.00 0.00 179.97 182.31 2dj1 h GLU 121 N 0.06 -0.02 -0.58 0.08 4.11 -1.45 -3.28 114.58 113.49 2dj1 h GLU 121 Ca -0.17 0.00 0.10 0.00 0.07 0.00 0.00 59.36 59.35 2dj1 h GLU 121 Cb 1.98 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 31.16 2dj1 h GLU 121 CO 0.18 0.57 0.18 0.28 0.07 0.00 0.00 179.01 180.29 2dj1 h VAL 122 N -0.64 0.74 -1.05 -1.06 2.07 -1.29 -0.02 116.25 115.00 2dj1 h VAL 122 Ca -0.00 -0.12 0.29 0.00 0.82 0.00 0.00 66.70 67.69 2dj1 h VAL 122 Cb 0.60 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.67 2dj1 h VAL 122 CO 0.00 0.06 0.72 0.77 0.02 0.00 0.00 177.57 179.15 2dj1 h SER 123 N 0.34 0.21 -3.83 0.57 4.64 -1.61 -3.42 113.55 110.46 2dj1 h SER 123 Ca 0.30 0.04 -0.55 0.00 -0.47 0.00 0.00 61.79 61.11 2dj1 h SER 123 Cb 0.39 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 62.59 2dj1 h SER 123 CO -0.33 0.05 0.71 0.00 -0.87 0.00 0.00 176.83 176.39 2dj1 n GLN 124 N -4.40 2.51 0.23 4.77 1.13 -0.02 -4.90 117.38 116.69 2dj1 n GLN 124 Ca 0.24 0.88 0.10 0.00 -1.94 0.00 0.00 57.00 56.28 2dj1 n GLN 124 Cb 1.01 -2.61 0.51 0.00 0.11 0.00 0.00 30.24 29.26 2dj1 n GLN 124 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 2dj1 h PRO 125 N 2.76 0.00 0.00 -1.09 0.13 -1.86 -2.85 132.00 129.09 2dj1 h PRO 125 Ca -0.50 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.46 2dj1 h PRO 125 Cb 1.25 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 2dj1 h PRO 125 CO 0.63 0.22 -0.80 0.22 -0.23 0.00 0.00 178.00 178.04 2dj1 h ASP 126 N 0.00 0.00 -3.08 1.44 1.82 -1.91 -3.46 116.42 111.23 2dj1 h ASP 126 Ca -0.00 0.00 -0.58 0.00 -0.39 0.00 0.00 57.03 56.06 2dj1 h ASP 126 Cb 0.66 0.00 0.13 0.00 0.68 0.00 0.00 39.33 40.80 2dj1 h ASP 126 CO 0.03 0.80 0.15 1.87 -1.61 0.00 0.00 179.24 180.48 2dj1 n TRP 127 N -3.44 1.13 -4.08 0.28 -0.00 -1.08 -5.01 117.44 105.24 2dj1 n TRP 127 Ca 0.00 0.55 -0.13 0.00 -0.00 0.00 0.00 57.50 57.91 2dj1 n TRP 127 Cb 0.81 -2.22 -0.12 0.00 -0.00 0.00 0.00 31.31 29.78 2dj1 n TRP 127 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 177.69 178.64 2dj1 s THR 128 N -1.30 0.52 0.03 5.87 -4.23 -1.26 -5.01 115.64 110.26 2dj1 s THR 128 Ca 0.64 -0.94 -0.30 0.00 -1.18 0.00 0.00 61.69 59.90 2dj1 s THR 128 Cb -0.55 -0.57 -0.06 0.00 1.34 0.00 0.00 72.50 72.66 2dj1 s THR 128 CO 0.56 -0.30 1.42 -2.16 -0.54 0.00 0.00 174.62 173.60 2dj1 s PRO 129 N -1.35 4.28 0.20 3.99 0.04 -1.26 -4.99 135.00 135.92 2dj1 s PRO 129 Ca -0.08 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 62.68 2dj1 s PRO 129 Cb -0.09 -3.51 -0.09 0.00 0.04 0.00 0.00 34.50 30.86 2dj1 s PRO 129 CO 0.00 -0.56 1.30 -1.25 0.04 0.00 0.00 177.00 176.53 2dj1 s PRO 130 N 2.14 4.40 0.20 0.56 0.04 -1.26 -5.03 135.00 136.04 2dj1 s PRO 130 Ca 0.65 2.04 -0.03 0.00 0.04 0.00 0.00 61.00 63.70 2dj1 s PRO 130 Cb -0.33 -3.19 0.05 0.00 0.04 0.00 0.00 34.50 31.06 2dj1 s PRO 130 CO 0.28 -0.24 0.18 -0.35 0.04 0.00 0.00 177.00 176.91 2dj1 n PRO 131 N 2.55 -1.36 -4.17 0.56 -0.04 -1.26 -4.25 135.00 127.03 2dj1 n PRO 131 Ca 0.06 -0.28 -0.33 0.00 -0.04 0.00 0.00 63.50 62.91 2dj1 n PRO 131 Cb 0.43 -0.26 -0.03 0.00 -0.04 0.00 0.00 33.50 33.59 2dj1 n PRO 131 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2dj1 n GLU 132 N -2.05 -2.90 -1.40 0.54 1.02 -1.26 -4.79 120.64 109.81 2dj1 n GLU 132 Ca 0.02 0.35 -0.46 0.00 -0.02 0.00 0.00 57.16 57.05 2dj1 n GLU 132 Cb 0.09 -4.78 -0.02 0.00 -0.02 0.00 0.00 31.44 26.71 2dj1 n GLU 132 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 2dj1 n VAL 133 N -4.39 1.65 0.32 2.62 3.14 -1.26 -4.90 118.33 115.52 2dj1 n VAL 133 Ca -0.07 -0.50 -0.13 0.00 -2.96 0.00 0.00 64.34 60.68 2dj1 n VAL 133 Cb 0.56 -0.13 -0.06 0.00 -1.06 0.00 0.00 33.84 33.16 2dj1 n VAL 133 CO 0.00 0.00 0.00 0.71 -6.46 0.00 0.00 176.83 171.08 2dj1 h THR 134 N 0.90 0.00 -1.54 1.55 1.35 -1.93 -3.42 112.91 109.81 2dj1 h THR 134 Ca -0.32 -0.03 -0.74 0.00 -0.55 0.00 0.00 66.41 64.78 2dj1 h THR 134 Cb 1.43 0.00 0.02 0.00 -1.73 0.00 0.00 68.15 67.87 2dj1 h THR 134 CO 0.54 0.00 0.84 -1.54 -0.25 0.00 0.00 175.52 175.11 2dj1 n SER 135 N -4.28 2.26 -4.20 5.36 3.41 -1.26 -4.90 113.62 110.01 2dj1 n SER 135 Ca -0.10 1.08 -0.40 0.00 -0.26 0.00 0.00 58.87 59.19 2dj1 n SER 135 Cb 0.32 -1.14 -0.05 0.00 -0.26 0.00 0.00 64.21 63.08 2dj1 n SER 135 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dj1 s GLY 136 N 3.14 2.86 0.00 5.00 0.00 -1.26 -4.88 107.32 112.18 2dj1 s GLY 136 Ca 0.97 -3.57 0.11 0.00 0.00 0.00 0.00 44.72 42.23 2dj1 s GLY 136 CO 0.64 1.21 1.10 -1.55 0.00 0.00 0.00 173.10 174.49 2dj1 n PRO 137 N 3.08 0.48 -3.11 2.90 -0.04 -1.26 -4.85 135.00 132.21 2dj1 n PRO 137 Ca 0.17 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.49 2dj1 n PRO 137 Cb 0.40 -1.36 0.07 0.00 -0.04 0.00 0.00 33.50 32.57 2dj1 n PRO 137 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dj1 n SER 138 N -0.86 -3.65 -0.02 3.54 7.64 -1.26 -4.97 113.62 114.04 2dj1 n SER 138 Ca 0.08 -0.55 -0.04 0.00 1.01 0.00 0.00 58.87 59.37 2dj1 n SER 138 Cb 0.04 -4.43 -0.01 0.00 -1.01 0.00 0.00 64.21 58.80 2dj1 n SER 138 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2dj1 n SER 139 N -2.86 0.41 0.00 6.43 3.41 -1.26 -5.34 113.62 114.41 2dj1 n SER 139 Ca -0.17 0.07 0.09 0.00 -0.26 0.00 0.00 58.87 58.60 2dj1 n SER 139 Cb 0.63 -0.16 0.53 0.00 -0.26 0.00 0.00 64.21 64.94 2dj1 n SER 139 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49