#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dj1 n SER 2 N 0.00 -2.66 -3.64 1.61 3.41 -1.26 -5.01 113.62 106.07 2dj1 n SER 2 Ca 0.00 0.52 -0.04 0.00 -0.26 0.00 0.00 58.87 59.09 2dj1 n SER 2 Cb 0.00 -1.05 -0.07 0.00 -0.26 0.00 0.00 64.21 62.83 2dj1 n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2dj1 s SER 3 N -1.31 -0.44 0.00 4.04 0.15 -1.26 -5.15 113.70 109.74 2dj1 s SER 3 Ca 0.59 0.74 0.00 0.00 0.70 0.00 0.00 55.95 57.98 2dj1 s SER 3 Cb -0.35 1.05 0.00 0.00 -1.71 0.00 0.00 66.02 65.01 2dj1 s SER 3 CO 0.65 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.58 2dj1 n GLY 4 N 3.17 2.45 3.28 9.45 0.00 -1.26 -5.15 105.19 117.12 2dj1 n GLY 4 Ca -0.16 -1.31 -0.15 0.00 0.00 0.00 0.00 46.02 44.40 2dj1 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dj1 s SER 5 N 0.00 1.04 0.03 1.61 0.01 -1.26 -5.17 113.70 109.96 2dj1 s SER 5 Ca 0.00 -1.33 -0.07 0.00 1.31 0.00 0.00 55.95 55.86 2dj1 s SER 5 Cb 0.00 0.18 -0.01 0.00 0.21 0.00 0.00 66.02 66.41 2dj1 s SER 5 CO 0.00 -0.71 0.13 -0.44 0.41 0.00 0.00 173.24 172.63 2dj1 s SER 6 N -3.25 0.12 0.00 2.44 0.01 -1.26 -5.10 113.70 106.66 2dj1 s SER 6 Ca 0.34 -0.43 0.00 0.00 1.31 0.00 0.00 55.95 57.17 2dj1 s SER 6 Cb 0.07 0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.54 2dj1 s SER 6 CO 0.11 -0.49 0.00 0.61 0.41 0.00 0.00 173.24 173.88 2dj1 n GLY 7 N 0.88 -0.64 3.31 3.44 0.00 -1.26 -5.10 105.19 105.82 2dj1 n GLY 7 Ca -0.20 0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 2dj1 n GLY 7 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dj1 s ASP 8 N 0.61 4.37 -0.51 1.61 2.15 -1.26 -5.07 116.67 118.57 2dj1 s ASP 8 Ca 0.00 -0.42 -0.28 0.00 0.43 0.00 0.00 52.55 52.27 2dj1 s ASP 8 Cb 0.00 -1.75 0.02 0.00 -0.30 0.00 0.00 42.92 40.89 2dj1 s ASP 8 CO 0.00 -0.03 1.29 -0.62 -0.17 0.00 0.00 175.17 175.64 2dj1 s ASP 9 N 1.48 6.37 -0.18 -0.34 2.15 -1.26 -4.82 116.67 120.08 2dj1 s ASP 9 Ca 0.05 0.40 -0.05 0.00 0.43 0.00 0.00 52.55 53.39 2dj1 s ASP 9 Cb -0.15 -2.55 -0.09 0.00 -0.30 0.00 0.00 42.92 39.84 2dj1 s ASP 9 CO -0.03 -1.49 -0.20 -0.67 -0.17 0.00 0.00 175.17 172.62 2dj1 n ASP 10 N 8.73 1.87 -4.54 -0.34 2.03 -1.26 -4.84 116.55 118.19 2dj1 n ASP 10 Ca 0.12 0.09 -0.41 0.00 0.52 0.00 0.00 54.79 55.11 2dj1 n ASP 10 Cb 0.49 -0.42 -0.03 0.00 -0.72 0.00 0.00 41.12 40.44 2dj1 n ASP 10 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2dj1 s LEU 11 N -6.57 3.68 0.73 -2.67 1.43 -1.26 -4.99 118.68 109.03 2dj1 s LEU 11 Ca -0.24 -1.39 -0.09 0.00 -1.03 0.00 0.00 54.13 51.38 2dj1 s LEU 11 Cb 0.08 -2.54 0.06 0.00 0.03 0.00 0.00 46.19 43.82 2dj1 s LEU 11 CO 0.35 -1.49 1.06 -0.70 0.23 0.00 0.00 176.35 175.80 2dj1 s GLU 12 N 4.76 2.20 -0.06 1.70 2.12 -1.26 -4.91 118.70 123.24 2dj1 s GLU 12 Ca 0.42 -0.09 -0.03 0.00 0.36 0.00 0.00 54.97 55.64 2dj1 s GLU 12 Cb -0.02 -2.10 0.03 0.00 0.26 0.00 0.00 34.13 32.30 2dj1 s GLU 12 CO -0.06 -1.31 0.13 0.08 -0.54 0.00 0.00 175.26 173.55 2dj1 s VAL 13 N -3.34 -0.03 0.38 3.70 1.01 -1.26 -4.74 120.40 116.11 2dj1 s VAL 13 Ca 0.60 0.12 0.06 0.00 0.00 0.00 0.00 61.98 62.77 2dj1 s VAL 13 Cb -0.11 -0.21 0.06 0.00 0.00 0.00 0.00 36.38 36.13 2dj1 s VAL 13 CO 0.46 0.05 0.52 0.29 0.00 0.00 0.00 175.10 176.42 2dj1 n LYS 14 N 3.80 0.75 -3.73 2.72 5.02 -1.26 -4.95 118.16 120.51 2dj1 n LYS 14 Ca -0.22 -2.07 -0.14 0.00 -2.02 0.00 0.00 58.31 53.87 2dj1 n LYS 14 Cb 0.54 -0.14 -0.08 0.00 -0.02 0.00 0.00 35.03 35.32 2dj1 n LYS 14 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2dj1 s GLU 15 N -3.72 0.70 -0.25 1.97 -1.05 -1.26 -1.14 118.70 113.94 2dj1 s GLU 15 Ca 0.39 -0.07 -0.02 0.00 -0.15 0.00 0.00 54.97 55.12 2dj1 s GLU 15 Cb -0.03 0.32 0.08 0.00 -0.44 0.00 0.00 34.13 34.06 2dj1 s GLU 15 CO 0.25 -0.19 0.07 -1.21 0.95 0.00 0.00 175.26 175.13 2dj1 s GLU 16 N -1.17 0.60 -1.45 -4.83 0.41 0.11 -4.83 118.70 107.55 2dj1 s GLU 16 Ca -0.12 -0.68 -0.11 0.00 -0.41 0.00 0.00 54.97 53.64 2dj1 s GLU 16 Cb -0.04 -1.91 0.05 0.00 -1.78 0.00 0.00 34.13 30.44 2dj1 s GLU 16 CO 0.05 -0.83 1.08 0.09 -0.49 0.00 0.00 175.26 175.16 2dj1 n ASN 17 N 5.01 -5.51 0.00 -0.19 4.13 -1.26 -0.76 115.26 116.67 2dj1 n ASN 17 Ca -0.06 -0.66 0.00 0.00 1.68 0.00 0.00 54.58 55.54 2dj1 n ASN 17 Cb 0.44 -4.45 0.00 0.00 -1.54 0.00 0.00 39.78 34.23 2dj1 n ASN 17 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2dj1 n GLY 18 N -1.84 2.06 3.48 7.41 0.00 -1.26 -4.70 105.19 110.33 2dj1 n GLY 18 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.33 4.58 0.30 1.61 1.01 0.06 -4.69 120.40 120.94 2dj1 s VAL 19 Ca 0.00 -0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.54 2dj1 s VAL 19 Cb 0.00 -4.46 -0.10 0.00 0.00 0.00 0.00 36.38 31.81 2dj1 s VAL 19 CO 0.00 -1.04 1.40 0.26 0.00 0.00 0.00 175.10 175.72 2dj1 s TRP 20 N 3.40 2.96 -0.62 5.22 0.52 -0.68 0.07 118.94 129.82 2dj1 s TRP 20 Ca 0.23 1.20 -0.18 0.00 0.02 0.00 0.00 56.10 57.36 2dj1 s TRP 20 Cb -0.16 -3.80 0.12 0.00 -1.15 0.00 0.00 33.47 28.47 2dj1 s TRP 20 CO 0.15 -2.42 0.70 0.08 0.02 0.00 0.00 176.95 175.48 2dj1 s VAL 21 N -0.62 4.92 0.25 4.03 1.01 -0.29 -0.60 120.40 129.10 2dj1 s VAL 21 Ca 0.54 -1.20 0.06 0.00 0.00 0.00 0.00 61.98 61.39 2dj1 s VAL 21 Cb -0.42 -4.48 -0.03 0.00 0.00 0.00 0.00 36.38 31.44 2dj1 s VAL 21 CO 0.50 -1.10 0.25 -0.76 0.00 0.00 0.00 175.10 173.98 2dj1 s LEU 22 N 2.36 3.97 0.01 3.92 1.43 -0.95 -4.14 118.68 125.29 2dj1 s LEU 22 Ca 0.12 -0.15 -0.29 0.00 -1.03 0.00 0.00 54.13 52.77 2dj1 s LEU 22 Cb -0.23 -2.50 0.11 0.00 0.03 0.00 0.00 46.19 43.59 2dj1 s LEU 22 CO 0.04 -0.05 1.18 0.54 0.23 0.00 0.00 176.35 178.29 2dj1 s ASN 23 N -3.88 -0.11 0.65 2.29 4.22 -1.26 -4.26 114.94 112.59 2dj1 s ASN 23 Ca 0.33 -0.19 0.16 0.00 -2.14 0.00 0.00 52.86 51.03 2dj1 s ASN 23 Cb -0.08 0.26 0.85 0.00 1.28 0.00 0.00 41.25 43.55 2dj1 s ASN 23 CO 0.26 -0.47 1.47 -2.24 -2.04 0.00 0.00 177.10 174.08 2dj1 h ASP 24 N 2.00 0.00 0.12 3.54 2.03 -1.97 1.69 116.42 123.83 2dj1 h ASP 24 Ca -0.26 0.00 -0.28 0.00 -0.73 0.00 0.00 57.03 55.76 2dj1 h ASP 24 Cb 1.21 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.73 2dj1 h ASP 24 CO 0.27 0.00 -1.13 1.23 -1.03 0.00 0.00 179.24 178.58 2dj1 h GLY 25 N 0.00 0.69 -3.39 7.15 0.00 -1.99 -3.38 103.07 102.16 2dj1 h GLY 25 Ca 0.05 -1.33 -0.20 0.00 0.00 0.00 0.00 47.33 45.85 2dj1 h GLY 25 CO -0.00 1.17 -0.95 1.16 0.00 0.00 0.00 176.54 177.93 2dj1 n ASN 26 N -3.80 1.68 -0.01 0.19 6.94 0.21 -4.84 115.26 115.64 2dj1 n ASN 26 Ca -0.12 -2.51 -0.00 0.00 -0.02 0.00 0.00 54.58 51.93 2dj1 n ASN 26 Cb 0.93 -0.39 -0.00 0.00 -2.36 0.00 0.00 39.78 37.96 2dj1 n ASN 26 CO 0.00 0.00 0.00 0.15 -1.03 0.00 0.00 177.26 176.38 2dj1 h PHE 27 N 1.56 0.00 -0.26 -2.53 3.04 0.20 -3.08 116.94 115.86 2dj1 h PHE 27 Ca -0.10 0.00 0.06 0.00 3.98 0.00 0.00 57.97 61.91 2dj1 h PHE 27 Cb 1.54 0.00 -0.06 0.00 2.56 0.00 0.00 35.95 39.98 2dj1 h PHE 27 CO 0.44 0.00 -0.17 0.38 -2.02 0.00 0.00 178.31 176.94 2dj1 h ASP 28 N -0.15 -0.54 -0.74 0.41 3.04 -1.85 0.12 116.42 116.70 2dj1 h ASP 28 Ca 0.00 0.12 0.14 0.00 -3.24 0.00 0.00 57.03 54.05 2dj1 h ASP 28 Cb 0.01 0.28 -0.09 0.00 -1.04 0.00 0.00 39.33 38.49 2dj1 h ASP 28 CO 0.00 -0.20 0.28 -1.13 -2.04 0.00 0.00 179.24 176.15 2dj1 h ASN 29 N -0.15 0.25 0.46 4.15 -1.24 -1.91 1.02 115.58 118.17 2dj1 h ASN 29 Ca 0.14 0.11 -0.02 0.00 0.71 0.00 0.00 56.30 57.24 2dj1 h ASN 29 Cb 0.36 0.09 0.00 0.00 0.73 0.00 0.00 38.32 39.51 2dj1 h ASN 29 CO -0.35 0.09 -0.22 0.15 -1.29 0.00 0.00 177.43 175.81 2dj1 h PHE 30 N 0.42 -0.57 0.00 0.67 3.57 -1.19 -3.00 116.94 116.84 2dj1 h PHE 30 Ca 0.41 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.89 2dj1 h PHE 30 Cb 0.61 0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.54 2dj1 h PHE 30 CO -0.17 -0.36 0.00 1.33 -2.23 0.00 0.00 178.31 176.88 2dj1 n VAL 31 N -4.39 1.22 0.21 1.41 0.24 0.33 -3.12 118.33 114.24 2dj1 n VAL 31 Ca -0.08 0.31 -0.17 0.00 -2.04 0.00 0.00 64.34 62.36 2dj1 n VAL 31 Cb 0.24 -1.23 -0.09 0.00 -1.47 0.00 0.00 33.84 31.29 2dj1 n VAL 31 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dj1 h ALA 32 N 2.19 -0.99 -1.02 2.33 0.00 0.12 -2.84 119.26 119.06 2dj1 h ALA 32 Ca 0.00 -0.14 -0.76 0.00 0.00 0.00 0.00 54.91 54.01 2dj1 h ALA 32 Cb 0.05 0.74 -0.28 0.00 0.00 0.00 0.00 17.79 18.31 2dj1 h ALA 32 CO 0.00 -1.11 0.98 -3.47 0.00 0.00 0.00 179.25 175.65 2dj1 n ASP 33 N -5.52 7.43 -3.93 0.00 -0.08 -1.18 -4.93 116.55 108.34 2dj1 n ASP 33 Ca -0.10 -3.83 -0.17 0.00 -1.51 0.00 0.00 54.79 49.18 2dj1 n ASP 33 Cb 0.43 -1.04 -0.15 0.00 2.34 0.00 0.00 41.12 42.70 2dj1 n ASP 33 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2dj1 s LYS 34 N -4.04 0.53 -0.13 -0.67 -0.14 -1.07 -5.05 119.74 109.16 2dj1 s LYS 34 Ca 0.53 -0.14 -0.25 0.00 -1.36 0.00 0.00 55.97 54.74 2dj1 s LYS 34 Cb 0.44 -0.54 -0.26 0.00 -1.68 0.00 0.00 37.83 35.79 2dj1 s LYS 34 CO -0.38 0.04 0.67 0.38 -0.76 0.00 0.00 175.35 175.30 2dj1 h ASP 35 N 6.44 0.12 -3.02 2.83 3.04 -1.91 -3.41 116.42 120.53 2dj1 h ASP 35 Ca -0.33 -0.89 -0.47 0.00 -3.24 0.00 0.00 57.03 52.11 2dj1 h ASP 35 Cb 1.17 -0.04 -0.41 0.00 -1.04 0.00 0.00 39.33 39.01 2dj1 h ASP 35 CO 0.49 1.22 -0.75 -0.89 -2.04 0.00 0.00 179.24 177.27 2dj1 s THR 36 N -2.31 -0.09 -0.15 1.15 2.01 -1.26 -0.42 115.64 114.57 2dj1 s THR 36 Ca -0.20 -0.22 -0.01 0.00 0.31 0.00 0.00 61.69 61.57 2dj1 s THR 36 Cb 0.00 -0.61 -0.01 0.00 0.01 0.00 0.00 72.50 71.89 2dj1 s THR 36 CO 0.71 -0.33 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.50 2dj1 s VAL 37 N 2.14 3.00 -0.34 3.82 1.01 -0.74 -4.30 120.40 124.98 2dj1 s VAL 37 Ca 0.03 -0.66 -0.23 0.00 0.00 0.00 0.00 61.98 61.12 2dj1 s VAL 37 Cb -0.16 -2.28 0.00 0.00 0.00 0.00 0.00 36.38 33.95 2dj1 s VAL 37 CO -0.12 0.51 0.76 -0.22 0.00 0.00 0.00 175.10 176.02 2dj1 s LEU 38 N 0.65 4.13 0.03 3.92 2.96 -1.11 -1.02 118.68 128.25 2dj1 s LEU 38 Ca -0.07 0.41 0.03 0.00 -0.22 0.00 0.00 54.13 54.29 2dj1 s LEU 38 Cb -0.15 -3.00 -0.04 0.00 0.50 0.00 0.00 46.19 43.50 2dj1 s LEU 38 CO 0.02 -0.67 -0.01 -0.76 -1.32 0.00 0.00 176.35 173.62 2dj1 s LEU 39 N 2.98 3.46 -0.07 -0.68 1.43 -0.62 -0.77 118.68 124.40 2dj1 s LEU 39 Ca 0.30 -0.09 -0.03 0.00 -1.03 0.00 0.00 54.13 53.29 2dj1 s LEU 39 Cb -0.14 -2.06 0.04 0.00 0.03 0.00 0.00 46.19 44.06 2dj1 s LEU 39 CO 0.15 0.24 0.07 -0.70 0.23 0.00 0.00 176.35 176.34 2dj1 s GLU 40 N -1.82 -0.04 0.21 1.70 -6.30 -0.95 -0.15 118.70 111.35 2dj1 s GLU 40 Ca 0.22 0.26 -0.18 0.00 -2.50 0.00 0.00 54.97 52.77 2dj1 s GLU 40 Cb -0.12 -0.85 -0.08 0.00 0.00 0.00 0.00 34.13 33.09 2dj1 s GLU 40 CO 0.13 -0.42 0.68 -0.06 0.02 0.00 0.00 175.26 175.61 2dj1 s PHE 41 N 2.16 3.61 0.38 5.30 0.40 0.34 -0.96 117.98 129.21 2dj1 s PHE 41 Ca 0.04 1.29 -0.11 0.00 -0.60 0.00 0.00 56.93 57.55 2dj1 s PHE 41 Cb -0.13 -2.54 0.05 0.00 0.51 0.00 0.00 43.02 40.90 2dj1 s PHE 41 CO -0.05 0.34 0.70 2.48 0.70 0.00 0.00 175.22 179.39 2dj1 n TYR 42 N 0.64 -2.11 -3.78 0.36 0.18 -0.84 -2.49 117.16 109.12 2dj1 n TYR 42 Ca -0.03 -1.97 -0.13 0.00 1.88 0.00 0.00 57.90 57.66 2dj1 n TYR 42 Cb 0.51 0.82 -0.11 0.00 -0.38 0.00 0.00 39.34 40.18 2dj1 n TYR 42 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2dj1 s ALA 43 N -2.25 -0.64 0.17 -3.48 0.00 -1.26 -3.65 121.76 110.65 2dj1 s ALA 43 Ca 0.19 0.70 0.29 0.00 0.00 0.00 0.00 51.96 53.14 2dj1 s ALA 43 Cb -0.04 -0.40 1.20 0.00 0.00 0.00 0.00 23.12 23.89 2dj1 s ALA 43 CO 0.14 -0.13 1.93 -1.00 0.00 0.00 0.00 175.76 176.71 2dj1 h PRO 44 N 5.63 0.00 0.00 0.00 0.13 -2.01 -2.66 132.00 133.10 2dj1 h PRO 44 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2dj1 h PRO 44 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2dj1 h PRO 44 CO 0.35 0.12 -0.90 -2.67 -0.23 0.00 0.00 178.00 174.67 2dj1 n TRP 45 N -3.30 0.41 -2.88 1.56 4.27 -1.26 -4.88 117.44 111.36 2dj1 n TRP 45 Ca -0.00 0.12 -0.41 0.00 -3.89 0.00 0.00 57.50 53.32 2dj1 n TRP 45 Cb 0.35 -0.55 -0.04 0.00 -1.36 0.00 0.00 31.31 29.71 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 6.56 0.31 -1.03 0.00 0.00 -1.89 -3.28 103.07 103.74 2dj1 h GLY 47 Ca -0.41 -0.65 0.42 0.00 0.00 0.00 0.00 47.33 46.69 2dj1 h GLY 47 CO 0.74 0.57 0.92 0.45 0.00 0.00 0.00 176.54 179.23 2dj1 h HIS 48 N -0.38 0.39 -0.40 5.60 3.86 -1.93 0.68 115.15 122.97 2dj1 h HIS 48 Ca -0.08 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.12 2dj1 h HIS 48 Cb 1.35 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 29.70 2dj1 h HIS 48 CO 0.19 -0.11 0.15 0.00 0.86 0.00 0.00 177.93 179.01 2dj1 h LYS 50 N 0.49 -0.07 0.00 0.00 1.57 0.25 2.04 116.57 120.85 2dj1 h LYS 50 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 2dj1 h LYS 50 Cb 0.21 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2dj1 h LYS 50 CO -0.01 -0.04 0.00 1.96 -0.57 0.00 0.00 179.45 180.79 2dj1 h GLN 51 N -0.07 0.00 -0.27 3.15 4.20 -1.48 -1.55 115.11 119.09 2dj1 h GLN 51 Ca 0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.96 2dj1 h GLN 51 Cb 0.45 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.23 2dj1 h GLN 51 CO -0.57 0.00 0.00 0.34 -0.67 0.00 0.00 178.83 177.93 2dj1 n PHE 52 N -3.07 0.35 0.15 2.96 7.35 0.21 -4.52 117.46 120.88 2dj1 n PHE 52 Ca -0.01 -0.33 -0.07 0.00 -0.76 0.00 0.00 57.45 56.28 2dj1 n PHE 52 Cb 0.19 -0.02 -0.03 0.00 0.35 0.00 0.00 39.48 39.98 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 2.39 -0.48 0.00 3.13 0.00 0.40 -2.75 119.26 121.95 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 0.69 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2dj1 h ALA 53 CO 0.00 -0.45 0.00 -0.35 0.00 0.00 0.00 179.25 178.45 2dj1 n PRO 54 N -4.76 0.06 0.04 0.00 -0.04 -1.26 -2.68 135.00 126.36 2dj1 n PRO 54 Ca -0.05 0.23 -0.20 0.00 -0.04 0.00 0.00 63.50 63.43 2dj1 n PRO 54 Cb 0.17 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.99 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 0.28 0.04 0.54 4.81 -1.79 -3.33 114.58 115.13 2dj1 h GLU 55 Ca 0.00 -0.47 -0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2dj1 h GLU 55 Cb 0.21 0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.77 2dj1 h GLU 55 CO 0.00 1.16 -0.02 -0.92 -0.73 0.00 0.00 179.01 178.50 2dj1 h TYR 56 N 0.08 -0.05 -0.65 0.92 3.20 -1.26 -3.01 116.97 116.19 2dj1 h TYR 56 Ca -0.35 -0.00 0.19 0.00 3.14 0.00 0.00 58.73 61.71 2dj1 h TYR 56 Cb 2.05 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 40.31 2dj1 h TYR 56 CO 0.07 0.41 0.56 1.05 -1.64 0.00 0.00 178.16 178.61 2dj1 h GLU 57 N -0.53 0.00 -0.45 1.82 4.11 -1.72 0.14 114.58 117.96 2dj1 h GLU 57 Ca -0.01 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.34 2dj1 h GLU 57 Cb 0.48 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2dj1 h GLU 57 CO 0.01 0.00 -0.07 0.87 0.07 0.00 0.00 179.01 179.89 2dj1 h LYS 58 N 0.00 0.84 -0.45 1.06 1.57 -1.63 -2.98 116.57 114.98 2dj1 h LYS 58 Ca 0.31 -0.30 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 2dj1 h LYS 58 Cb 1.42 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.65 2dj1 h LYS 58 CO -0.00 0.93 0.07 0.82 -0.57 0.00 0.00 179.45 180.69 2dj1 h ILE 59 N 0.67 1.21 -0.36 1.86 2.04 -0.74 -3.14 117.51 119.07 2dj1 h ILE 59 Ca 0.12 -0.81 0.04 0.00 1.00 0.00 0.00 64.86 65.21 2dj1 h ILE 59 Cb 0.59 0.80 -0.07 0.00 -0.74 0.00 0.00 36.82 37.40 2dj1 h ILE 59 CO 0.04 0.29 -0.50 0.00 0.00 0.00 0.00 178.15 177.98 2dj1 h ALA 60 N 1.40 -0.74 -0.20 1.87 0.00 -1.33 0.36 119.26 120.62 2dj1 h ALA 60 Ca 0.15 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.11 2dj1 h ALA 60 Cb 0.32 1.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 2dj1 h ALA 60 CO 0.00 -0.98 0.16 1.03 0.00 0.00 0.00 179.25 179.47 2dj1 h SER 61 N -0.37 0.00 0.21 0.00 0.87 -1.63 0.34 113.55 112.98 2dj1 h SER 61 Ca 0.06 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 2dj1 h SER 61 Cb 0.54 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 2dj1 h SER 61 CO -0.53 0.00 -0.10 0.74 -0.53 0.00 0.00 176.83 176.41 2dj1 h THR 62 N 0.00 0.00 0.00 2.23 2.02 -0.43 -3.25 112.91 113.48 2dj1 h THR 62 Ca 0.10 -0.22 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 2dj1 h THR 62 Cb 0.42 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.83 2dj1 h THR 62 CO -0.00 0.00 -0.02 -0.07 0.37 0.00 0.00 175.52 175.80 2dj1 h LEU 63 N -0.49 0.00 0.22 2.58 3.38 -0.43 -2.96 115.31 117.60 2dj1 h LEU 63 Ca -0.03 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2dj1 h LEU 63 Cb 0.21 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2dj1 h LEU 63 CO 0.05 0.02 -0.35 0.50 0.09 0.00 0.00 178.44 178.74 2dj1 h LYS 64 N 0.00 -0.62 -1.03 1.13 3.64 -0.35 -1.90 116.57 117.44 2dj1 h LYS 64 Ca -0.00 0.04 -0.36 0.00 -1.27 0.00 0.00 60.65 59.07 2dj1 h LYS 64 Cb 0.17 0.14 -0.21 0.00 -0.41 0.00 0.00 32.23 31.93 2dj1 h LYS 64 CO 0.00 -0.41 0.45 -0.25 -2.27 0.00 0.00 179.45 176.97 2dj1 n ASP 65 N -5.45 3.78 -4.97 4.20 8.00 -1.12 -4.50 116.55 116.49 2dj1 n ASP 65 Ca -0.08 -3.09 -0.21 0.00 0.71 0.00 0.00 54.79 52.12 2dj1 n ASP 65 Cb 0.35 -0.75 -0.02 0.00 -0.02 0.00 0.00 41.12 40.69 2dj1 n ASP 65 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2dj1 s ASN 66 N -0.53 6.27 -0.17 -2.24 2.47 -0.72 -5.03 114.94 114.98 2dj1 s ASN 66 Ca 0.38 0.05 0.01 0.00 0.42 0.00 0.00 52.86 53.73 2dj1 s ASN 66 Cb 0.32 -1.78 0.01 0.00 -1.45 0.00 0.00 41.25 38.36 2dj1 s ASN 66 CO 0.07 -0.14 -0.18 -0.62 -3.72 0.00 0.00 177.10 172.51 2dj1 s ASP 67 N -4.01 3.32 0.92 -4.21 2.15 -1.26 -1.39 116.67 112.19 2dj1 s ASP 67 Ca 0.36 -0.59 -0.12 0.00 0.43 0.00 0.00 52.55 52.64 2dj1 s ASP 67 Cb -0.09 -1.51 0.14 0.00 -0.30 0.00 0.00 42.92 41.16 2dj1 s ASP 67 CO 0.30 0.03 1.09 -2.16 -0.17 0.00 0.00 175.17 174.26 2dj1 s PRO 68 N 1.12 1.04 -0.69 4.34 0.04 -1.26 -5.04 135.00 134.55 2dj1 s PRO 68 Ca 0.01 0.75 -0.26 0.00 0.04 0.00 0.00 61.00 61.53 2dj1 s PRO 68 Cb -0.14 -1.79 -0.03 0.00 0.04 0.00 0.00 34.50 32.58 2dj1 s PRO 68 CO -0.07 -2.37 1.89 -1.25 0.04 0.00 0.00 177.00 175.23 2dj1 s PRO 69 N -4.94 2.60 0.39 0.56 0.04 -0.49 -4.98 135.00 128.19 2dj1 s PRO 69 Ca 0.64 0.37 -0.07 0.00 0.04 0.00 0.00 61.00 61.97 2dj1 s PRO 69 Cb -0.18 -4.57 -0.05 0.00 0.04 0.00 0.00 34.50 29.73 2dj1 s PRO 69 CO 0.57 -2.91 0.71 0.42 0.04 0.00 0.00 177.00 175.83 2dj1 s ILE 70 N 9.36 4.89 -0.27 0.56 1.01 -1.18 -5.02 121.20 130.54 2dj1 s ILE 70 Ca 0.68 0.34 0.03 0.00 0.00 0.00 0.00 60.65 61.69 2dj1 s ILE 70 Cb -0.11 -3.77 0.07 0.00 0.01 0.00 0.00 42.46 38.66 2dj1 s ILE 70 CO 0.15 -0.54 -0.05 0.00 0.00 0.00 0.00 174.94 174.50 2dj1 s ALA 71 N -2.37 2.46 -0.14 9.38 0.00 -1.26 -4.11 121.76 125.72 2dj1 s ALA 71 Ca 0.48 -1.83 -0.27 0.00 0.00 0.00 0.00 51.96 50.34 2dj1 s ALA 71 Cb -0.10 -1.63 -0.02 0.00 0.00 0.00 0.00 23.12 21.37 2dj1 s ALA 71 CO 0.34 -1.32 0.88 0.08 0.00 0.00 0.00 175.76 175.73 2dj1 s VAL 72 N 1.15 4.87 0.30 0.00 1.01 -1.26 -2.74 120.40 123.72 2dj1 s VAL 72 Ca -0.03 1.75 0.03 0.00 0.00 0.00 0.00 61.98 63.72 2dj1 s VAL 72 Cb -0.19 -4.19 -0.05 0.00 0.00 0.00 0.00 36.38 31.95 2dj1 s VAL 72 CO -0.07 0.05 0.08 0.00 0.00 0.00 0.00 175.10 175.16 2dj1 s ALA 73 N 1.94 2.10 0.03 5.51 0.00 0.05 -1.69 121.76 129.70 2dj1 s ALA 73 Ca 0.42 -1.91 0.02 0.00 0.00 0.00 0.00 51.96 50.49 2dj1 s ALA 73 Cb -0.17 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 23.79 2dj1 s ALA 73 CO 0.15 -0.39 -0.07 -1.59 0.00 0.00 0.00 175.76 173.87 2dj1 s LYS 74 N -3.94 0.48 0.04 0.00 -2.85 0.23 -2.24 119.74 111.46 2dj1 s LYS 74 Ca 0.36 -0.63 0.03 0.00 -1.00 0.00 0.00 55.97 54.73 2dj1 s LYS 74 Cb 0.08 -0.27 -0.02 0.00 -2.06 0.00 0.00 37.83 35.56 2dj1 s LYS 74 CO 0.15 0.05 -0.09 0.42 0.10 0.00 0.00 175.35 175.98 2dj1 s ILE 75 N -1.14 0.64 -0.90 3.79 1.01 -0.13 -2.23 121.20 122.23 2dj1 s ILE 75 Ca -0.08 -0.95 -0.13 0.00 0.00 0.00 0.00 60.65 59.49 2dj1 s ILE 75 Cb -0.08 -0.65 0.23 0.00 0.01 0.00 0.00 42.46 41.96 2dj1 s ILE 75 CO 0.00 -0.24 0.87 1.51 0.00 0.00 0.00 174.94 177.09 2dj1 s ASP 76 N -1.30 6.89 0.21 3.58 1.47 -1.26 -1.98 116.67 124.28 2dj1 s ASP 76 Ca -0.06 -2.88 -0.18 0.00 1.18 0.00 0.00 52.55 50.61 2dj1 s ASP 76 Cb -0.08 -2.22 0.20 0.00 -0.34 0.00 0.00 42.92 40.47 2dj1 s ASP 76 CO 0.01 -0.53 1.58 0.00 0.68 0.00 0.00 175.17 176.90 2dj1 h ALA 77 N 7.56 0.11 -1.68 2.11 0.00 -1.79 0.66 119.26 126.23 2dj1 h ALA 77 Ca 0.13 0.22 0.50 0.00 0.00 0.00 0.00 54.91 55.77 2dj1 h ALA 77 Cb 1.00 0.83 -0.09 0.00 0.00 0.00 0.00 17.79 19.53 2dj1 h ALA 77 CO 0.83 -0.62 1.18 0.00 0.00 0.00 0.00 179.25 180.65 2dj1 h THR 78 N -0.09 0.10 0.04 0.00 1.03 -1.92 0.55 112.91 112.62 2dj1 h THR 78 Ca 0.29 -0.01 -0.36 0.00 -0.01 0.00 0.00 66.41 66.33 2dj1 h THR 78 Cb 0.57 0.08 -0.05 0.00 -1.07 0.00 0.00 68.15 67.68 2dj1 h THR 78 CO -0.80 0.00 -2.16 -0.24 -0.01 0.00 0.00 175.52 172.31 2dj1 n SER 79 N -4.18 1.41 -4.63 0.00 2.88 0.20 -4.87 113.62 104.43 2dj1 n SER 79 Ca 0.40 0.10 -0.39 0.00 -1.33 0.00 0.00 58.87 57.65 2dj1 n SER 79 Cb 1.74 -0.20 -0.08 0.00 -0.75 0.00 0.00 64.21 64.92 2dj1 n SER 79 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dj1 s ALA 80 N -2.54 3.57 -0.23 -1.46 0.00 0.19 -4.95 121.76 116.34 2dj1 s ALA 80 Ca -0.20 -0.71 -0.02 0.00 0.00 0.00 0.00 51.96 51.03 2dj1 s ALA 80 Cb 0.07 -2.65 -0.19 0.00 0.00 0.00 0.00 23.12 20.35 2dj1 s ALA 80 CO 0.74 -0.49 -0.08 0.43 0.00 0.00 0.00 175.76 176.36 2dj1 n SER 81 N 4.93 2.01 0.03 0.00 7.64 -1.26 -3.73 113.62 123.24 2dj1 n SER 81 Ca -0.09 -0.01 -0.01 0.00 1.01 0.00 0.00 58.87 59.76 2dj1 n SER 81 Cb 0.51 -0.56 -0.01 0.00 -1.01 0.00 0.00 64.21 63.14 2dj1 n SER 81 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2dj1 h MET 82 N -0.07 -0.08 -0.70 1.43 2.86 -1.94 -1.01 114.93 115.42 2dj1 h MET 82 Ca -0.55 0.01 0.09 0.00 -2.06 0.00 0.00 59.70 57.19 2dj1 h MET 82 Cb 1.90 0.02 -0.07 0.00 0.06 0.00 0.00 31.60 33.51 2dj1 h MET 82 CO -0.07 -0.05 0.34 -0.07 1.06 0.00 0.00 176.91 178.12 2dj1 h LEU 83 N -0.09 0.44 -0.97 1.22 3.38 -1.98 -0.78 115.31 116.54 2dj1 h LEU 83 Ca -0.01 0.06 0.20 0.00 0.09 0.00 0.00 57.88 58.22 2dj1 h LEU 83 Cb 0.07 -0.01 -0.11 0.00 0.09 0.00 0.00 40.66 40.70 2dj1 h LEU 83 CO -0.00 0.25 0.56 0.00 0.09 0.00 0.00 178.44 179.34 2dj1 h ALA 84 N 1.43 1.60 0.00 1.53 0.00 -1.62 0.14 119.26 122.34 2dj1 h ALA 84 Ca 0.35 0.10 -0.19 0.00 0.00 0.00 0.00 54.91 55.17 2dj1 h ALA 84 Cb 0.37 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2dj1 h ALA 84 CO -0.27 -0.13 -0.88 1.03 0.00 0.00 0.00 179.25 179.00 2dj1 h SER 85 N 0.67 0.00 0.38 0.00 0.87 0.13 0.27 113.55 115.86 2dj1 h SER 85 Ca 0.57 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 61.13 2dj1 h SER 85 Cb 0.93 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.87 2dj1 h SER 85 CO -0.41 0.88 -0.35 0.50 -0.53 0.00 0.00 176.83 176.92 2dj1 h LYS 86 N 0.00 -0.71 -0.74 2.24 3.64 0.59 -2.37 116.57 119.22 2dj1 h LYS 86 Ca -0.01 0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.35 2dj1 h LYS 86 Cb 1.61 0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 33.55 2dj1 h LYS 86 CO 0.11 -0.48 0.09 1.19 -2.27 0.00 0.00 179.45 178.09 2dj1 n PHE 87 N -5.46 1.71 -4.31 1.91 3.01 -0.91 -4.91 117.46 108.49 2dj1 n PHE 87 Ca -0.10 -0.71 -0.32 0.00 1.01 0.00 0.00 57.45 57.32 2dj1 n PHE 87 Cb 0.36 -0.48 -0.09 0.00 -0.01 0.00 0.00 39.48 39.26 2dj1 n PHE 87 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 2dj1 n ASP 88 N 0.26 0.51 -4.56 4.37 -0.08 -0.89 -4.77 116.55 111.40 2dj1 n ASP 88 Ca 0.25 -1.25 -0.39 0.00 -1.51 0.00 0.00 54.79 51.89 2dj1 n ASP 88 Cb 1.04 -1.56 -0.03 0.00 2.34 0.00 0.00 41.12 42.92 2dj1 n ASP 88 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2dj1 s VAL 89 N -4.18 3.43 -0.28 5.18 1.01 0.90 -4.81 120.40 121.65 2dj1 s VAL 89 Ca 0.13 0.27 0.08 0.00 0.00 0.00 0.00 61.98 62.46 2dj1 s VAL 89 Cb -0.08 -4.04 0.45 0.00 0.00 0.00 0.00 36.38 32.71 2dj1 s VAL 89 CO 0.98 -0.98 1.27 -1.20 0.00 0.00 0.00 175.10 175.17 2dj1 n SER 90 N 12.06 3.80 0.00 3.32 7.64 -1.26 -4.88 113.62 134.30 2dj1 n SER 90 Ca 0.18 -3.81 0.00 0.00 1.01 0.00 0.00 58.87 56.26 2dj1 n SER 90 Cb 0.51 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 2dj1 n SER 90 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dj1 n GLY 91 N -0.89 -0.25 3.51 0.23 0.00 -1.26 -5.18 105.19 101.34 2dj1 n GLY 91 Ca 0.36 -0.92 -0.18 0.00 0.00 0.00 0.00 46.02 45.29 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 -0.65 0.59 1.61 1.51 -1.26 -4.20 117.35 112.94 2dj1 s TYR 92 Ca 0.00 1.07 -0.18 0.00 -1.01 0.00 0.00 57.07 56.96 2dj1 s TYR 92 Cb 0.00 0.42 -0.03 0.00 -0.11 0.00 0.00 41.96 42.24 2dj1 s TYR 92 CO 0.00 -0.63 1.12 -1.25 -1.11 0.00 0.00 175.55 173.68 2dj1 s PRO 93 N -1.37 3.13 -0.19 -1.71 0.04 -1.26 -4.83 135.00 128.80 2dj1 s PRO 93 Ca -0.10 1.52 -0.03 0.00 0.04 0.00 0.00 61.00 62.43 2dj1 s PRO 93 Cb -0.00 -1.98 0.06 0.00 0.04 0.00 0.00 34.50 32.61 2dj1 s PRO 93 CO 0.08 -1.01 0.03 0.99 0.04 0.00 0.00 177.00 177.13 2dj1 s THR 94 N -2.00 0.54 -0.07 1.26 2.01 -1.04 -5.02 115.64 111.32 2dj1 s THR 94 Ca 0.70 -0.54 -0.14 0.00 0.31 0.00 0.00 61.69 62.02 2dj1 s THR 94 Cb -0.22 -1.03 -0.05 0.00 0.01 0.00 0.00 72.50 71.21 2dj1 s THR 94 CO 0.33 -0.19 0.35 -0.63 -0.69 0.00 0.00 174.62 173.79 2dj1 s ILE 95 N 1.85 5.18 0.16 1.82 1.01 -1.26 -0.50 121.20 129.46 2dj1 s ILE 95 Ca -0.01 0.70 0.01 0.00 0.00 0.00 0.00 60.65 61.35 2dj1 s ILE 95 Cb -0.17 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 2dj1 s ILE 95 CO -0.08 0.51 0.03 -0.54 0.00 0.00 0.00 174.94 174.86 2dj1 s LYS 96 N -0.48 1.06 -0.10 2.79 -0.14 0.79 -3.02 119.74 120.65 2dj1 s LYS 96 Ca 0.21 -1.51 -0.02 0.00 -1.36 0.00 0.00 55.97 53.28 2dj1 s LYS 96 Cb -0.15 -0.05 0.04 0.00 -1.68 0.00 0.00 37.83 35.99 2dj1 s LYS 96 CO 0.09 -0.20 0.04 0.42 -0.76 0.00 0.00 175.35 174.94 2dj1 s ILE 97 N -3.83 0.15 -0.46 2.17 1.01 -1.10 -1.60 121.20 117.53 2dj1 s ILE 97 Ca 0.25 0.08 -0.22 0.00 0.00 0.00 0.00 60.65 60.76 2dj1 s ILE 97 Cb 0.07 -0.48 0.03 0.00 0.01 0.00 0.00 42.46 42.08 2dj1 s ILE 97 CO 0.04 0.07 0.75 -0.22 0.00 0.00 0.00 174.94 175.58 2dj1 s LEU 98 N 2.05 4.37 -0.43 2.97 2.96 -0.19 -1.63 118.68 128.78 2dj1 s LEU 98 Ca 0.04 -0.27 -0.11 0.00 -0.22 0.00 0.00 54.13 53.56 2dj1 s LEU 98 Cb -0.13 -2.84 0.07 0.00 0.50 0.00 0.00 46.19 43.79 2dj1 s LEU 98 CO -0.06 -0.92 0.30 -0.75 -1.32 0.00 0.00 176.35 173.61 2dj1 s LYS 99 N 3.19 2.74 -0.57 1.98 2.47 0.01 -1.79 119.74 127.77 2dj1 s LYS 99 Ca 0.27 -1.39 0.00 0.00 -1.56 0.00 0.00 55.97 53.28 2dj1 s LYS 99 Cb -0.13 -3.89 0.00 0.00 -1.46 0.00 0.00 37.83 32.35 2dj1 s LYS 99 CO 0.20 -0.96 0.00 1.63 0.16 0.00 0.00 175.35 176.39 2dj1 n LYS 100 N 5.01 -1.88 0.00 4.03 5.02 0.44 0.15 118.16 130.92 2dj1 n LYS 100 Ca -0.11 0.32 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2dj1 n LYS 100 Cb 0.43 -4.65 0.00 0.00 -0.02 0.00 0.00 35.03 30.79 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 -0.38 1.13 3.26 0.72 0.00 -1.26 -5.09 105.19 103.57 2dj1 n GLY 101 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 2dj1 n GLY 101 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dj1 s GLN 102 N -0.31 3.09 -0.00 1.61 2.00 0.39 -5.08 119.66 121.35 2dj1 s GLN 102 Ca 0.00 -0.82 -0.30 0.00 -2.00 0.00 0.00 55.36 52.24 2dj1 s GLN 102 Cb 0.00 -3.05 -0.05 0.00 0.80 0.00 0.00 33.01 30.71 2dj1 s GLN 102 CO 0.00 -0.32 1.31 0.00 -0.50 0.00 0.00 175.29 175.77 2dj1 s ALA 103 N 1.41 3.53 -0.36 1.58 0.00 -1.26 -0.81 121.76 125.85 2dj1 s ALA 103 Ca 0.03 0.81 0.04 0.00 0.00 0.00 0.00 51.96 52.84 2dj1 s ALA 103 Cb -0.16 -3.54 0.10 0.00 0.00 0.00 0.00 23.12 19.52 2dj1 s ALA 103 CO -0.03 -0.77 0.08 0.08 0.00 0.00 0.00 175.76 175.11 2dj1 s VAL 104 N 2.05 2.16 0.06 0.00 1.01 -0.65 -4.99 120.40 120.05 2dj1 s VAL 104 Ca 0.61 -2.36 -0.30 0.00 0.00 0.00 0.00 61.98 59.93 2dj1 s VAL 104 Cb -0.29 -2.59 -0.08 0.00 0.00 0.00 0.00 36.38 33.41 2dj1 s VAL 104 CO 0.26 -0.63 1.75 -1.81 0.00 0.00 0.00 175.10 174.67 2dj1 s ASP 105 N 0.85 6.54 -0.22 3.32 1.01 -1.26 -2.73 116.67 124.18 2dj1 s ASP 105 Ca 0.12 2.54 -0.23 0.00 0.71 0.00 0.00 52.55 55.69 2dj1 s ASP 105 Cb -0.20 -2.55 -0.01 0.00 1.01 0.00 0.00 42.92 41.17 2dj1 s ASP 105 CO -0.09 -0.95 0.75 -0.47 0.21 0.00 0.00 175.17 174.62 2dj1 s TYR 106 N 3.23 3.34 -0.32 4.23 5.04 -1.17 -5.02 117.35 126.68 2dj1 s TYR 106 Ca 0.78 1.05 0.00 0.00 -2.44 0.00 0.00 57.07 56.47 2dj1 s TYR 106 Cb -0.41 -2.95 0.07 0.00 0.35 0.00 0.00 41.96 39.03 2dj1 s TYR 106 CO 0.34 -0.31 0.02 -0.51 -1.34 0.00 0.00 175.55 173.76 2dj1 s ASP 107 N 1.30 4.84 0.00 4.32 1.01 -1.26 -4.81 116.67 122.07 2dj1 s ASP 107 Ca 0.33 -1.63 0.00 0.00 0.71 0.00 0.00 52.55 51.96 2dj1 s ASP 107 Cb -0.16 -1.68 0.00 0.00 1.01 0.00 0.00 42.92 42.09 2dj1 s ASP 107 CO 0.09 -0.32 0.00 0.61 0.21 0.00 0.00 175.17 175.76 2dj1 n GLY 108 N 4.50 -1.57 3.84 0.21 0.00 -1.26 -5.15 105.19 105.76 2dj1 n GLY 108 Ca -0.08 -1.11 -0.32 0.00 0.00 0.00 0.00 46.02 44.51 2dj1 n GLY 108 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dj1 s SER 109 N -3.06 6.47 -0.52 1.61 0.15 -1.26 -5.01 113.70 112.08 2dj1 s SER 109 Ca 0.00 1.61 -0.23 0.00 0.70 0.00 0.00 55.95 58.03 2dj1 s SER 109 Cb 0.00 -2.51 0.04 0.00 -1.71 0.00 0.00 66.02 61.84 2dj1 s SER 109 CO 0.00 -0.69 0.84 -0.13 1.20 0.00 0.00 173.24 174.46 2dj1 s ARG 110 N -4.09 3.30 -0.08 5.44 3.00 -1.26 -4.55 118.95 120.71 2dj1 s ARG 110 Ca 0.60 -0.38 -0.24 0.00 0.00 0.00 0.00 55.73 55.71 2dj1 s ARG 110 Cb -0.11 -4.04 0.05 0.00 0.00 0.00 0.00 34.95 30.85 2dj1 s ARG 110 CO 0.33 -1.36 0.55 0.95 0.00 0.00 0.00 175.30 175.77 2dj1 s THR 111 N 3.53 0.02 0.58 0.02 -4.23 -1.26 -5.02 115.64 109.27 2dj1 s THR 111 Ca 0.27 -0.13 0.28 0.00 -1.18 0.00 0.00 61.69 60.92 2dj1 s THR 111 Cb -0.14 -0.84 0.36 0.00 1.34 0.00 0.00 72.50 73.22 2dj1 s THR 111 CO 0.18 -0.07 2.09 1.56 -0.54 0.00 0.00 174.62 177.83 2dj1 h GLN 112 N 3.80 0.00 0.06 3.99 7.50 -1.94 -0.27 115.11 128.25 2dj1 h GLN 112 Ca -0.28 0.00 -0.00 0.00 0.50 0.00 0.00 58.65 58.87 2dj1 h GLN 112 Cb 1.16 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.69 2dj1 h GLN 112 CO 0.33 0.00 -0.03 0.93 -1.50 0.00 0.00 178.83 178.56 2dj1 h GLU 113 N 0.00 -0.08 0.34 1.46 5.08 -1.97 -3.00 114.58 116.41 2dj1 h GLU 113 Ca 0.10 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 2dj1 h GLU 113 Cb 0.53 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2dj1 h GLU 113 CO -0.00 -0.05 -0.41 0.93 -1.00 0.00 0.00 179.01 178.48 2dj1 h GLU 114 N -0.70 -0.73 -0.82 2.33 4.39 -1.83 0.51 114.58 117.72 2dj1 h GLU 114 Ca -0.01 0.05 0.20 0.00 0.34 0.00 0.00 59.36 59.94 2dj1 h GLU 114 Cb 0.07 0.17 -0.14 0.00 -0.10 0.00 0.00 28.75 28.74 2dj1 h GLU 114 CO 0.01 -0.49 0.03 0.82 -1.16 0.00 0.00 179.01 178.22 2dj1 h ILE 115 N -0.76 0.27 0.00 3.13 2.04 -1.25 0.91 117.51 121.85 2dj1 h ILE 115 Ca -0.04 -0.03 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 2dj1 h ILE 115 Cb 0.67 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 2dj1 h ILE 115 CO -0.09 0.02 -0.31 0.58 0.00 0.00 0.00 178.15 178.35 2dj1 h VAL 116 N 0.10 0.79 0.00 1.67 2.07 -1.31 -0.84 116.25 118.73 2dj1 h VAL 116 Ca 0.46 -1.31 -0.11 0.00 0.82 0.00 0.00 66.70 66.57 2dj1 h VAL 116 Cb 0.85 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 32.42 2dj1 h VAL 116 CO -0.72 0.31 -0.50 0.00 0.02 0.00 0.00 177.57 176.67 2dj1 h ALA 117 N 1.69 1.12 0.11 1.67 0.00 0.59 -1.37 119.26 123.08 2dj1 h ALA 117 Ca -0.00 -0.46 -0.36 0.00 0.00 0.00 0.00 54.91 54.09 2dj1 h ALA 117 Cb 0.79 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2dj1 h ALA 117 CO 0.04 0.63 -2.02 1.17 0.00 0.00 0.00 179.25 179.07 2dj1 n LYS 118 N -3.87 0.75 0.10 0.00 3.00 -0.42 -3.18 118.16 114.53 2dj1 n LYS 118 Ca -0.01 0.26 0.01 0.00 -0.00 0.00 0.00 58.31 58.57 2dj1 n LYS 118 Cb 0.53 -1.69 0.33 0.00 0.00 0.00 0.00 35.03 34.19 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 0.03 1.22 0.06 3.15 2.07 -1.19 0.93 116.25 122.52 2dj1 h VAL 119 Ca -0.44 -1.03 -0.22 0.00 0.82 0.00 0.00 66.70 65.83 2dj1 h VAL 119 Cb 2.00 1.35 0.02 0.00 -1.52 0.00 0.00 31.29 33.14 2dj1 h VAL 119 CO 0.06 0.32 -0.90 0.08 0.02 0.00 0.00 177.57 177.15 2dj1 h ARG 120 N 0.24 0.50 -0.19 1.57 0.11 -1.41 -2.59 114.38 112.61 2dj1 h ARG 120 Ca 0.04 -0.62 -0.06 0.00 0.10 0.00 0.00 59.98 59.44 2dj1 h ARG 120 Cb 0.52 0.20 -0.00 0.00 1.11 0.00 0.00 29.97 31.79 2dj1 h ARG 120 CO 0.04 1.25 -0.12 1.05 0.10 0.00 0.00 179.97 182.28 2dj1 h GLU 121 N 0.04 0.42 -0.18 0.08 4.11 -1.48 -3.21 114.58 114.36 2dj1 h GLU 121 Ca -0.13 -0.20 0.00 0.00 0.07 0.00 0.00 59.36 59.10 2dj1 h GLU 121 Cb 1.61 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.85 2dj1 h GLU 121 CO 0.17 0.73 0.11 0.28 0.07 0.00 0.00 179.01 180.38 2dj1 h VAL 122 N 0.10 1.06 -1.18 -1.06 2.07 -0.93 -2.20 116.25 114.11 2dj1 h VAL 122 Ca 0.04 -0.14 0.34 0.00 0.82 0.00 0.00 66.70 67.76 2dj1 h VAL 122 Cb 0.62 0.84 -0.07 0.00 -1.52 0.00 0.00 31.29 31.16 2dj1 h VAL 122 CO 0.03 0.06 0.82 0.77 0.02 0.00 0.00 177.57 179.28 2dj1 h SER 123 N 0.22 0.14 -3.22 0.57 4.64 -1.48 -3.42 113.55 111.00 2dj1 h SER 123 Ca 0.06 0.03 -0.58 0.00 -0.47 0.00 0.00 61.79 60.84 2dj1 h SER 123 Cb 0.00 0.01 0.12 0.00 -0.31 0.00 0.00 62.40 62.23 2dj1 h SER 123 CO -0.01 0.01 0.33 0.00 -0.87 0.00 0.00 176.83 176.29 2dj1 n GLN 124 N -4.33 1.67 0.22 4.77 1.13 -0.83 -4.88 117.38 115.14 2dj1 n GLN 124 Ca 0.27 0.59 0.10 0.00 -1.94 0.00 0.00 57.00 56.02 2dj1 n GLN 124 Cb 1.19 -2.19 0.50 0.00 0.11 0.00 0.00 30.24 29.85 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 1.92 0.00 0.06 -1.09 0.13 -1.87 -3.05 132.00 128.10 2dj1 h PRO 125 Ca -0.45 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.40 2dj1 h PRO 125 Cb 1.31 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.46 2dj1 h PRO 125 CO 0.59 0.23 -1.12 -0.44 -0.23 0.00 0.00 178.00 177.03 2dj1 h ASP 126 N 0.00 0.80 -2.64 1.44 5.19 -1.91 -3.46 116.42 115.85 2dj1 h ASP 126 Ca -0.00 -0.69 -0.57 0.00 -0.62 0.00 0.00 57.03 55.14 2dj1 h ASP 126 Cb 0.67 -0.25 0.19 0.00 0.18 0.00 0.00 39.33 40.12 2dj1 h ASP 126 CO 0.03 1.50 -0.86 1.87 -3.12 0.00 0.00 179.24 178.66 2dj1 n TRP 127 N -3.79 -2.15 -3.81 4.55 -0.00 -1.15 -5.01 117.44 106.08 2dj1 n TRP 127 Ca -0.11 0.32 -0.12 0.00 -0.00 0.00 0.00 57.50 57.59 2dj1 n TRP 127 Cb 0.93 -1.77 -0.10 0.00 -0.00 0.00 0.00 31.31 30.37 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 -1.95 0.05 0.47 5.87 -4.23 -1.26 -5.01 115.64 109.58 2dj1 s THR 128 Ca 0.59 -0.39 -0.22 0.00 -1.18 0.00 0.00 61.69 60.48 2dj1 s THR 128 Cb -0.37 -0.46 -0.07 0.00 1.34 0.00 0.00 72.50 72.94 2dj1 s THR 128 CO 0.64 -0.22 1.16 -2.16 -0.54 0.00 0.00 174.62 173.51 2dj1 s PRO 129 N -0.85 3.71 0.88 3.99 0.04 -1.26 -5.03 135.00 136.48 2dj1 s PRO 129 Ca -0.09 1.75 -0.11 0.00 0.04 0.00 0.00 61.00 62.58 2dj1 s PRO 129 Cb -0.05 -2.36 0.12 0.00 0.04 0.00 0.00 34.50 32.25 2dj1 s PRO 129 CO 0.02 -0.58 1.09 -1.25 0.04 0.00 0.00 177.00 176.32 2dj1 s PRO 130 N -2.77 1.40 0.00 0.56 0.04 -1.26 -4.90 135.00 128.07 2dj1 s PRO 130 Ca 0.65 0.88 0.15 0.00 0.04 0.00 0.00 61.00 62.71 2dj1 s PRO 130 Cb -0.28 -1.82 0.89 0.00 0.04 0.00 0.00 34.50 33.33 2dj1 s PRO 130 CO 0.34 -2.16 1.30 -0.35 0.04 0.00 0.00 177.00 176.17 2dj1 n PRO 131 N -3.83 0.49 -2.18 0.56 -0.04 -1.26 -4.51 135.00 124.23 2dj1 n PRO 131 Ca 0.07 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.18 2dj1 n PRO 131 Cb 0.55 -1.48 -0.04 0.00 -0.04 0.00 0.00 33.50 32.50 2dj1 n PRO 131 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2dj1 n GLU 132 N -0.98 2.22 -2.32 0.54 4.07 -1.26 -4.91 120.64 118.01 2dj1 n GLU 132 Ca 0.11 -2.73 -0.41 0.00 -0.06 0.00 0.00 57.16 54.07 2dj1 n GLU 132 Cb 0.05 -3.58 -0.03 0.00 -0.06 0.00 0.00 31.44 27.83 2dj1 n GLU 132 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 2dj1 s VAL 133 N 7.89 3.67 -0.30 6.31 -7.23 -1.26 -4.87 120.40 124.60 2dj1 s VAL 133 Ca 0.62 0.53 -0.01 0.00 -1.81 0.00 0.00 61.98 61.30 2dj1 s VAL 133 Cb 0.03 -4.35 0.17 0.00 0.56 0.00 0.00 36.38 32.79 2dj1 s VAL 133 CO 0.11 -1.16 2.12 0.35 -0.31 0.00 0.00 175.10 176.21 2dj1 n THR 134 N 6.90 2.78 -4.10 5.32 -2.24 -1.26 -4.90 114.28 116.78 2dj1 n THR 134 Ca 0.13 -1.69 -0.36 0.00 -2.27 0.00 0.00 64.05 59.86 2dj1 n THR 134 Cb 0.50 -1.39 -0.08 0.00 -2.10 0.00 0.00 70.33 67.26 2dj1 n THR 134 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2dj1 s SER 135 N 0.36 5.79 0.00 3.42 0.01 -1.26 -5.02 113.70 117.00 2dj1 s SER 135 Ca 0.32 0.27 0.00 0.00 1.31 0.00 0.00 55.95 57.85 2dj1 s SER 135 Cb 0.24 -1.81 0.00 0.00 0.21 0.00 0.00 66.02 64.66 2dj1 s SER 135 CO -0.02 0.35 0.00 0.61 0.41 0.00 0.00 173.24 174.59 2dj1 n GLY 136 N 2.35 -2.08 0.00 3.44 0.00 -1.26 -5.00 105.19 102.63 2dj1 n GLY 136 Ca -0.19 1.01 0.08 0.00 0.00 0.00 0.00 46.02 46.91 2dj1 n GLY 136 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dj1 n PRO 137 N 0.00 0.31 -3.73 1.61 -0.04 -1.26 -4.87 135.00 127.03 2dj1 n PRO 137 Ca 0.00 0.09 -0.24 0.00 -0.04 0.00 0.00 63.50 63.32 2dj1 n PRO 137 Cb 0.00 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.00 2dj1 n PRO 137 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dj1 n SER 138 N -1.18 -2.65 -3.90 3.54 3.41 -1.26 -2.32 113.62 109.26 2dj1 n SER 138 Ca 0.09 -0.77 -0.28 0.00 -0.26 0.00 0.00 58.87 57.65 2dj1 n SER 138 Cb 0.10 -4.19 -0.04 0.00 -0.26 0.00 0.00 64.21 59.82 2dj1 n SER 138 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2dj1 n SER 139 N -3.00 -0.87 0.00 4.04 2.88 -1.26 -5.36 113.62 110.04 2dj1 n SER 139 Ca -0.18 -0.95 0.00 0.00 -1.33 0.00 0.00 58.87 56.41 2dj1 n SER 139 Cb 0.63 -1.16 0.00 0.00 -0.75 0.00 0.00 64.21 62.93 2dj1 n SER 139 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42