#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dj1 s SER 2 N 0.00 6.01 -0.18 1.61 0.15 -1.26 -5.01 113.70 115.02 2dj1 s SER 2 Ca 0.00 0.21 -0.24 0.00 0.70 0.00 0.00 55.95 56.63 2dj1 s SER 2 Cb 0.00 -2.02 -0.21 0.00 -1.71 0.00 0.00 66.02 62.08 2dj1 s SER 2 CO 0.00 0.22 0.39 0.28 1.20 0.00 0.00 173.24 175.33 2dj1 h SER 3 N 6.39 0.00 0.00 5.45 0.02 -2.08 -3.50 113.55 119.83 2dj1 h SER 3 Ca -0.42 -0.66 0.00 0.00 -0.84 0.00 0.00 61.79 59.87 2dj1 h SER 3 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2dj1 h SER 3 CO 0.71 1.30 0.00 0.61 -1.14 0.00 0.00 176.83 178.31 2dj1 n GLY 4 N 1.50 1.80 3.43 -3.77 0.00 -1.26 -5.04 105.19 101.85 2dj1 n GLY 4 Ca -0.24 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.59 2dj1 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dj1 n SER 5 N 0.00 3.69 -3.62 1.61 2.88 -1.26 -4.80 113.62 112.12 2dj1 n SER 5 Ca 0.00 -2.78 -0.29 0.00 -1.33 0.00 0.00 58.87 54.46 2dj1 n SER 5 Cb 0.00 -1.65 -0.13 0.00 -0.75 0.00 0.00 64.21 61.68 2dj1 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dj1 s SER 6 N 5.22 3.45 -0.30 -3.46 0.15 -1.26 -5.08 113.70 112.42 2dj1 s SER 6 Ca 0.60 -2.28 0.01 0.00 0.70 0.00 0.00 55.95 54.98 2dj1 s SER 6 Cb 0.04 -0.75 0.09 0.00 -1.71 0.00 0.00 66.02 63.69 2dj1 s SER 6 CO 0.09 -0.31 0.05 -0.83 1.20 0.00 0.00 173.24 173.45 2dj1 s GLY 7 N 0.85 1.41 0.07 9.45 0.00 -1.26 -5.11 107.32 112.72 2dj1 s GLY 7 Ca 0.16 -1.89 -0.00 0.00 0.00 0.00 0.00 44.72 42.99 2dj1 s GLY 7 CO -0.04 1.24 0.22 0.99 0.00 0.00 0.00 173.10 175.51 2dj1 s ASP 8 N 1.33 6.37 0.00 1.64 1.11 -1.26 -4.97 116.67 120.88 2dj1 s ASP 8 Ca 0.07 0.29 0.14 0.00 0.18 0.00 0.00 52.55 53.23 2dj1 s ASP 8 Cb -0.18 -1.97 0.82 0.00 1.07 0.00 0.00 42.92 42.67 2dj1 s ASP 8 CO -0.15 0.16 1.32 0.47 1.18 0.00 0.00 175.17 178.15 2dj1 n ASP 9 N 0.27 0.00 -0.05 0.27 8.00 -1.26 -2.88 116.55 120.91 2dj1 n ASP 9 Ca -0.05 -0.30 -0.14 0.00 0.71 0.00 0.00 54.79 55.02 2dj1 n ASP 9 Cb 0.51 -0.09 -0.08 0.00 -0.02 0.00 0.00 41.12 41.45 2dj1 n ASP 9 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2dj1 h ASP 10 N 0.00 0.37 -3.36 -2.24 5.19 -2.01 -3.39 116.42 110.97 2dj1 h ASP 10 Ca 0.00 -0.54 -0.61 0.00 -0.62 0.00 0.00 57.03 55.26 2dj1 h ASP 10 Cb 0.04 -0.10 -0.40 0.00 0.18 0.00 0.00 39.33 39.04 2dj1 h ASP 10 CO 0.00 0.84 -0.73 -0.76 -3.12 0.00 0.00 179.24 175.47 2dj1 s LEU 11 N -8.97 3.11 0.05 1.55 1.43 -1.14 -4.96 118.68 109.75 2dj1 s LEU 11 Ca -0.14 -2.97 0.03 0.00 -1.03 0.00 0.00 54.13 50.02 2dj1 s LEU 11 Cb 0.04 -1.14 -0.04 0.00 0.03 0.00 0.00 46.19 45.09 2dj1 s LEU 11 CO 0.76 -0.21 0.01 -1.83 0.23 0.00 0.00 176.35 175.30 2dj1 s GLU 12 N -0.11 2.69 -0.10 1.70 -1.05 -1.26 -4.76 118.70 115.81 2dj1 s GLU 12 Ca 0.21 -0.72 0.01 0.00 -0.15 0.00 0.00 54.97 54.32 2dj1 s GLU 12 Cb -0.17 -2.62 0.02 0.00 -0.44 0.00 0.00 34.13 30.92 2dj1 s GLU 12 CO -0.06 0.58 -0.12 0.08 0.95 0.00 0.00 175.26 176.69 2dj1 s VAL 13 N -1.23 1.27 0.57 1.83 1.01 -1.26 -4.77 120.40 117.82 2dj1 s VAL 13 Ca 0.24 -0.49 0.09 0.00 0.00 0.00 0.00 61.98 61.82 2dj1 s VAL 13 Cb -0.12 -1.20 0.08 0.00 0.00 0.00 0.00 36.38 35.14 2dj1 s VAL 13 CO 0.16 0.40 0.78 -0.54 0.00 0.00 0.00 175.10 175.90 2dj1 s LYS 14 N 1.20 2.32 -0.04 2.72 1.02 -1.26 -4.92 119.74 120.79 2dj1 s LYS 14 Ca -0.03 -1.58 -0.14 0.00 0.02 0.00 0.00 55.97 54.23 2dj1 s LYS 14 Cb -0.14 -2.64 0.03 0.00 -0.52 0.00 0.00 37.83 34.55 2dj1 s LYS 14 CO -0.04 -0.84 0.32 -1.83 -0.92 0.00 0.00 175.35 172.04 2dj1 s GLU 15 N -4.66 0.62 -0.40 1.68 -1.05 -1.26 0.04 118.70 113.66 2dj1 s GLU 15 Ca 0.61 -0.06 0.01 0.00 -0.15 0.00 0.00 54.97 55.39 2dj1 s GLU 15 Cb -0.06 0.28 0.13 0.00 -0.44 0.00 0.00 34.13 34.04 2dj1 s GLU 15 CO 0.39 -0.16 0.22 -1.21 0.95 0.00 0.00 175.26 175.45 2dj1 s GLU 16 N -1.04 1.01 -0.39 -4.83 2.02 0.61 -4.83 118.70 111.26 2dj1 s GLU 16 Ca -0.11 -1.72 -0.02 0.00 0.02 0.00 0.00 54.97 53.14 2dj1 s GLU 16 Cb -0.05 -1.99 0.00 0.00 0.10 0.00 0.00 34.13 32.19 2dj1 s GLU 16 CO 0.04 -1.16 0.34 -1.71 0.02 0.00 0.00 175.26 172.78 2dj1 n ASN 17 N 3.81 -3.07 0.00 -0.19 2.85 -1.26 -3.23 115.26 114.17 2dj1 n ASN 17 Ca 0.09 -0.16 0.00 0.00 -0.11 0.00 0.00 54.58 54.40 2dj1 n ASN 17 Cb 0.36 -1.82 0.00 0.00 1.24 0.00 0.00 39.78 39.56 2dj1 n ASN 17 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2dj1 n GLY 18 N -0.96 3.10 3.57 8.20 0.00 -1.26 -4.86 105.19 112.97 2dj1 n GLY 18 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.85 4.41 0.68 1.61 1.01 -1.20 -4.76 120.40 120.31 2dj1 s VAL 19 Ca 0.00 0.76 -0.16 0.00 0.00 0.00 0.00 61.98 62.58 2dj1 s VAL 19 Cb 0.00 -4.48 0.01 0.00 0.00 0.00 0.00 36.38 31.91 2dj1 s VAL 19 CO 0.00 -0.90 1.17 0.26 0.00 0.00 0.00 175.10 175.62 2dj1 s TRP 20 N 3.90 2.34 -0.44 5.22 0.52 -0.73 -0.29 118.94 129.47 2dj1 s TRP 20 Ca 0.38 1.57 -0.06 0.00 0.02 0.00 0.00 56.10 58.00 2dj1 s TRP 20 Cb -0.10 -3.35 0.11 0.00 -1.15 0.00 0.00 33.47 28.98 2dj1 s TRP 20 CO 0.26 -2.16 0.27 0.08 0.02 0.00 0.00 176.95 175.43 2dj1 s VAL 21 N -2.05 3.80 0.36 4.03 1.01 0.11 -0.76 120.40 126.90 2dj1 s VAL 21 Ca 0.72 -1.87 0.02 0.00 0.00 0.00 0.00 61.98 60.85 2dj1 s VAL 21 Cb -0.26 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 2dj1 s VAL 21 CO 0.41 -0.71 0.55 -0.76 0.00 0.00 0.00 175.10 174.59 2dj1 s LEU 22 N 1.27 3.94 -0.06 3.92 1.43 -0.62 -4.12 118.68 124.44 2dj1 s LEU 22 Ca 0.06 0.28 -0.32 0.00 -1.03 0.00 0.00 54.13 53.13 2dj1 s LEU 22 Cb -0.24 -3.15 0.12 0.00 0.03 0.00 0.00 46.19 42.95 2dj1 s LEU 22 CO -0.02 -0.40 1.24 0.54 0.23 0.00 0.00 176.35 177.94 2dj1 s ASN 23 N -4.10 -0.09 0.62 2.29 4.22 -1.26 -4.41 114.94 112.21 2dj1 s ASN 23 Ca 0.42 -0.10 0.21 0.00 -2.14 0.00 0.00 52.86 51.25 2dj1 s ASN 23 Cb -0.10 0.18 0.82 0.00 1.28 0.00 0.00 41.25 43.43 2dj1 s ASN 23 CO 0.35 -0.31 1.35 -2.24 -2.04 0.00 0.00 177.10 174.21 2dj1 h ASP 24 N 2.00 0.00 -0.00 3.54 2.03 -1.97 1.56 116.42 123.58 2dj1 h ASP 24 Ca -0.23 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 55.85 2dj1 h ASP 24 Cb 1.19 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 39.71 2dj1 h ASP 24 CO 0.26 0.00 -0.86 1.23 -1.03 0.00 0.00 179.24 178.85 2dj1 h GLY 25 N 0.00 0.66 -3.58 7.15 0.00 -1.97 -3.37 103.07 101.96 2dj1 h GLY 25 Ca 0.31 -1.14 -0.26 0.00 0.00 0.00 0.00 47.33 46.23 2dj1 h GLY 25 CO -0.00 1.01 -0.91 1.16 0.00 0.00 0.00 176.54 177.80 2dj1 n ASN 26 N -4.01 2.32 -0.08 0.19 6.94 0.32 -4.80 115.26 116.15 2dj1 n ASN 26 Ca -0.11 -2.82 -0.16 0.00 -0.02 0.00 0.00 54.58 51.48 2dj1 n ASN 26 Cb 0.79 -0.41 -0.13 0.00 -2.36 0.00 0.00 39.78 37.68 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 1.81 0.01 0.13 -2.53 3.04 0.16 -3.16 116.94 116.41 2dj1 h PHE 27 Ca -0.00 -0.01 -0.21 0.00 3.98 0.00 0.00 57.97 61.73 2dj1 h PHE 27 Cb 1.44 -0.00 0.02 0.00 2.56 0.00 0.00 35.95 39.97 2dj1 h PHE 27 CO 0.56 1.12 -0.91 0.22 -2.02 0.00 0.00 178.31 177.29 2dj1 h ASP 28 N -0.99 0.57 -0.83 0.41 3.58 -1.85 -3.00 116.42 114.32 2dj1 h ASP 28 Ca -0.09 -0.90 0.10 0.00 0.42 0.00 0.00 57.03 56.56 2dj1 h ASP 28 Cb 1.09 -0.18 -0.07 0.00 1.72 0.00 0.00 39.33 41.88 2dj1 h ASP 28 CO -0.05 1.43 0.47 0.78 -2.88 0.00 0.00 179.24 178.99 2dj1 h ASN 29 N -0.19 0.67 0.65 2.28 4.21 -1.87 0.75 115.58 122.07 2dj1 h ASN 29 Ca -0.15 0.05 -0.03 0.00 1.21 0.00 0.00 56.30 57.38 2dj1 h ASN 29 Cb 1.68 -0.08 0.01 0.00 -1.12 0.00 0.00 38.32 38.81 2dj1 h ASN 29 CO 0.17 0.38 -0.31 0.15 -1.29 0.00 0.00 177.43 176.53 2dj1 h PHE 30 N 0.78 -0.80 0.00 1.19 3.57 -1.64 -3.04 116.94 117.00 2dj1 h PHE 30 Ca 0.40 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.88 2dj1 h PHE 30 Cb 0.38 0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.38 2dj1 h PHE 30 CO -0.06 -0.47 -0.02 -0.39 -2.23 0.00 0.00 178.31 175.13 2dj1 h VAL 31 N -1.17 0.33 -1.00 1.41 -1.51 -1.36 -2.47 116.25 110.48 2dj1 h VAL 31 Ca -0.09 -0.14 0.24 0.00 -1.23 0.00 0.00 66.70 65.48 2dj1 h VAL 31 Cb 0.69 1.10 -0.09 0.00 -2.13 0.00 0.00 31.29 30.86 2dj1 h VAL 31 CO 0.15 0.02 0.64 0.00 -1.23 0.00 0.00 177.57 177.15 2dj1 h ALA 32 N 1.98 2.10 -0.67 5.19 0.00 0.65 0.42 119.26 128.93 2dj1 h ALA 32 Ca -0.00 0.06 -0.47 0.00 0.00 0.00 0.00 54.91 54.50 2dj1 h ALA 32 Cb 0.10 -0.01 -0.31 0.00 0.00 0.00 0.00 17.79 17.57 2dj1 h ALA 32 CO 0.00 -0.48 -0.31 -0.25 0.00 0.00 0.00 179.25 178.22 2dj1 n ASP 33 N -4.63 4.77 -3.59 0.00 8.00 -0.93 -4.94 116.55 115.23 2dj1 n ASP 33 Ca 0.24 -3.78 -0.08 0.00 0.71 0.00 0.00 54.79 51.87 2dj1 n ASP 33 Cb 0.77 -0.54 -0.09 0.00 -0.02 0.00 0.00 41.12 41.24 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 -3.55 0.33 0.06 -1.24 1.02 0.14 -5.05 119.74 111.44 2dj1 s LYS 34 Ca 0.52 0.93 -0.29 0.00 0.02 0.00 0.00 55.97 57.15 2dj1 s LYS 34 Cb 0.43 0.16 -0.17 0.00 -0.52 0.00 0.00 37.83 37.73 2dj1 s LYS 34 CO 0.01 -0.34 1.54 0.38 -0.92 0.00 0.00 175.35 176.02 2dj1 h ASP 35 N 8.17 -0.49 -3.32 2.83 2.03 -1.92 -3.43 116.42 120.30 2dj1 h ASP 35 Ca -0.17 -0.04 -0.66 0.00 -0.73 0.00 0.00 57.03 55.44 2dj1 h ASP 35 Cb 1.12 0.13 -0.27 0.00 -0.83 0.00 0.00 39.33 39.47 2dj1 h ASP 35 CO 0.15 -0.27 -0.75 -0.89 -1.03 0.00 0.00 179.24 176.45 2dj1 s THR 36 N -5.68 3.15 -0.09 1.15 2.01 -1.26 -1.06 115.64 113.86 2dj1 s THR 36 Ca -0.16 -0.61 -0.01 0.00 0.31 0.00 0.00 61.69 61.23 2dj1 s THR 36 Cb 0.04 -2.36 0.03 0.00 0.01 0.00 0.00 72.50 70.21 2dj1 s THR 36 CO 0.61 0.49 -0.03 -0.69 -0.69 0.00 0.00 174.62 174.31 2dj1 s VAL 37 N 0.75 0.66 -0.25 3.82 1.01 -0.26 -4.61 120.40 121.52 2dj1 s VAL 37 Ca -0.04 -0.07 -0.25 0.00 0.00 0.00 0.00 61.98 61.61 2dj1 s VAL 37 Cb -0.15 -0.77 -0.00 0.00 0.00 0.00 0.00 36.38 35.46 2dj1 s VAL 37 CO 0.02 0.29 0.86 -0.22 0.00 0.00 0.00 175.10 176.05 2dj1 s LEU 38 N 1.86 4.08 -0.10 3.92 2.96 -1.24 -0.14 118.68 130.01 2dj1 s LEU 38 Ca 0.05 1.06 0.01 0.00 -0.22 0.00 0.00 54.13 55.02 2dj1 s LEU 38 Cb -0.13 -3.24 -0.02 0.00 0.50 0.00 0.00 46.19 43.31 2dj1 s LEU 38 CO -0.07 -0.56 -0.13 -0.76 -1.32 0.00 0.00 176.35 173.52 2dj1 s LEU 39 N 2.93 2.73 -0.19 -0.68 1.43 -0.87 -2.18 118.68 121.86 2dj1 s LEU 39 Ca 0.36 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 53.19 2dj1 s LEU 39 Cb -0.15 -1.60 0.04 0.00 0.03 0.00 0.00 46.19 44.51 2dj1 s LEU 39 CO 0.08 0.22 -0.11 -0.70 0.23 0.00 0.00 176.35 176.07 2dj1 s GLU 40 N 0.00 2.08 0.07 1.70 2.12 -0.94 -0.26 118.70 123.48 2dj1 s GLU 40 Ca -0.04 -0.80 -0.21 0.00 0.36 0.00 0.00 54.97 54.29 2dj1 s GLU 40 Cb -0.14 -2.37 -0.07 0.00 0.26 0.00 0.00 34.13 31.82 2dj1 s GLU 40 CO 0.04 -0.39 0.63 -0.06 -0.54 0.00 0.00 175.26 174.93 2dj1 s PHE 41 N 1.41 3.80 0.30 5.30 0.40 0.12 -1.08 117.98 128.22 2dj1 s PHE 41 Ca -0.00 1.34 -0.08 0.00 -0.60 0.00 0.00 56.93 57.59 2dj1 s PHE 41 Cb -0.16 -2.60 0.00 0.00 0.51 0.00 0.00 43.02 40.78 2dj1 s PHE 41 CO -0.09 0.50 0.47 1.52 0.70 0.00 0.00 175.22 178.33 2dj1 s TYR 42 N -0.84 0.71 0.00 0.36 -0.85 -1.10 -1.80 117.35 113.83 2dj1 s TYR 42 Ca 0.31 -1.03 0.03 0.00 -0.52 0.00 0.00 57.07 55.87 2dj1 s TYR 42 Cb -0.20 0.06 -0.01 0.00 0.38 0.00 0.00 41.96 42.19 2dj1 s TYR 42 CO 0.20 -1.07 -0.11 0.00 -1.52 0.00 0.00 175.55 173.05 2dj1 s ALA 43 N -3.49 0.90 -0.89 9.51 0.00 -1.26 -3.53 121.76 123.01 2dj1 s ALA 43 Ca 0.27 -0.54 0.16 0.00 0.00 0.00 0.00 51.96 51.85 2dj1 s ALA 43 Cb -0.00 -0.20 0.69 0.00 0.00 0.00 0.00 23.12 23.61 2dj1 s ALA 43 CO 0.14 0.20 1.51 -0.35 0.00 0.00 0.00 175.76 177.26 2dj1 n PRO 44 N 2.57 0.04 -0.01 0.00 -0.04 -1.26 -2.24 135.00 134.07 2dj1 n PRO 44 Ca -0.15 0.29 0.09 0.00 -0.04 0.00 0.00 63.50 63.69 2dj1 n PRO 44 Cb 0.56 -1.58 -0.13 0.00 -0.04 0.00 0.00 33.50 32.31 2dj1 n PRO 44 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2dj1 n TRP 45 N -1.65 0.00 -2.39 0.54 4.27 -1.26 -4.81 117.44 112.14 2dj1 n TRP 45 Ca 0.03 0.00 -0.37 0.00 -3.89 0.00 0.00 57.50 53.27 2dj1 n TRP 45 Cb 0.18 -0.29 -0.03 0.00 -1.36 0.00 0.00 31.31 29.81 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 14.50 0.71 -0.41 0.00 0.00 -1.87 -0.86 103.07 115.14 2dj1 h GLY 47 Ca 0.24 -0.11 0.15 0.00 0.00 0.00 0.00 47.33 47.61 2dj1 h GLY 47 CO 1.36 -0.09 -0.14 0.45 0.00 0.00 0.00 176.54 178.12 2dj1 h HIS 48 N 0.21 -0.30 -1.33 5.60 3.86 -1.95 0.36 115.15 121.60 2dj1 h HIS 48 Ca 0.58 0.06 0.39 0.00 -1.16 0.00 0.00 60.37 60.24 2dj1 h HIS 48 Cb 1.84 0.25 -0.05 0.00 1.06 0.00 0.00 27.41 30.51 2dj1 h HIS 48 CO -0.00 -0.29 1.24 0.00 0.86 0.00 0.00 177.93 179.74 2dj1 h LYS 50 N 0.00 -0.33 0.00 0.00 2.10 -0.46 1.95 116.57 119.83 2dj1 h LYS 50 Ca 0.63 0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 59.29 2dj1 h LYS 50 Cb 3.11 0.07 -0.00 0.00 -0.90 0.00 0.00 32.23 34.51 2dj1 h LYS 50 CO -0.01 -0.22 -0.09 -0.56 -2.00 0.00 0.00 179.45 176.57 2dj1 h GLN 51 N -0.34 0.00 -0.03 0.07 3.07 -0.28 -1.63 115.11 115.98 2dj1 h GLN 51 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.79 2dj1 h GLN 51 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.97 2dj1 h GLN 51 CO -0.17 0.09 -0.10 0.34 0.09 0.00 0.00 178.83 179.07 2dj1 n PHE 52 N -3.43 0.00 0.37 0.06 7.35 -0.39 -4.26 117.46 117.16 2dj1 n PHE 52 Ca -0.01 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 56.53 2dj1 n PHE 52 Cb 0.25 0.00 -0.07 0.00 0.35 0.00 0.00 39.48 40.01 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 4.40 -0.97 0.00 3.13 0.00 0.41 -2.00 119.26 124.22 2dj1 h ALA 53 Ca 0.00 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 2dj1 h ALA 53 Cb 0.92 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2dj1 h ALA 53 CO 0.00 -0.90 -0.30 -1.00 0.00 0.00 0.00 179.25 177.05 2dj1 h PRO 54 N -1.24 0.00 -0.34 0.00 0.13 -1.79 -2.85 132.00 125.91 2dj1 h PRO 54 Ca -0.10 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.87 2dj1 h PRO 54 Cb 0.74 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.86 2dj1 h PRO 54 CO 0.16 0.30 -0.44 1.49 -0.23 0.00 0.00 178.00 179.28 2dj1 h GLU 55 N 0.00 0.87 0.31 0.86 4.57 -1.73 -3.12 114.58 116.34 2dj1 h GLU 55 Ca -0.00 -0.49 -0.02 0.00 -1.18 0.00 0.00 59.36 57.67 2dj1 h GLU 55 Cb 0.72 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.34 2dj1 h GLU 55 CO 0.04 1.13 -0.15 -0.92 -1.18 0.00 0.00 179.01 177.93 2dj1 h TYR 56 N 0.70 -0.39 -0.96 0.92 3.20 -1.24 -3.25 116.97 115.95 2dj1 h TYR 56 Ca 0.04 -0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.06 2dj1 h TYR 56 Cb 1.03 0.13 -0.16 0.00 1.54 0.00 0.00 36.73 39.27 2dj1 h TYR 56 CO 0.06 -0.05 -0.36 0.93 -1.64 0.00 0.00 178.16 177.11 2dj1 h GLU 57 N -0.88 -0.01 -0.72 1.82 5.08 -1.59 0.39 114.58 118.67 2dj1 h GLU 57 Ca -0.04 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.47 2dj1 h GLU 57 Cb 0.52 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.64 2dj1 h GLU 57 CO 0.07 -0.01 -0.10 0.87 -1.00 0.00 0.00 179.01 178.84 2dj1 h LYS 58 N -0.01 0.04 -0.33 2.33 1.57 -1.60 0.27 116.57 118.84 2dj1 h LYS 58 Ca 0.36 -0.00 0.04 0.00 -1.87 0.00 0.00 60.65 59.18 2dj1 h LYS 58 Cb 0.62 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.88 2dj1 h LYS 58 CO -0.97 0.03 0.10 0.82 -0.57 0.00 0.00 179.45 178.86 2dj1 h ILE 59 N 0.04 0.88 -0.97 1.86 2.04 -0.27 -2.89 117.51 118.20 2dj1 h ILE 59 Ca 0.37 -0.08 0.09 0.00 1.00 0.00 0.00 64.86 66.24 2dj1 h ILE 59 Cb 0.60 0.63 -0.12 0.00 -0.74 0.00 0.00 36.82 37.19 2dj1 h ILE 59 CO -0.69 0.04 -0.56 0.00 0.00 0.00 0.00 178.15 176.94 2dj1 n ALA 60 N -2.34 -0.58 0.09 1.87 0.00 0.07 -0.87 120.51 118.75 2dj1 n ALA 60 Ca 0.01 0.84 -0.12 0.00 0.00 0.00 0.00 53.44 54.16 2dj1 n ALA 60 Cb 0.13 -0.16 -0.05 0.00 0.00 0.00 0.00 19.45 19.37 2dj1 n ALA 60 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2dj1 h SER 61 N 0.00 -0.84 -0.60 0.00 0.87 -1.42 0.13 113.55 111.69 2dj1 h SER 61 Ca 0.17 0.11 0.07 0.00 -1.23 0.00 0.00 61.79 60.91 2dj1 h SER 61 Cb 0.41 0.33 -0.10 0.00 -0.44 0.00 0.00 62.40 62.60 2dj1 h SER 61 CO -0.92 -0.37 -0.52 0.74 -0.53 0.00 0.00 176.83 175.24 2dj1 h THR 62 N -0.47 0.03 0.00 2.23 2.02 -0.81 0.90 112.91 116.80 2dj1 h THR 62 Ca 0.05 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.23 2dj1 h THR 62 Cb 0.53 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.96 2dj1 h THR 62 CO -0.21 0.00 0.00 0.18 0.37 0.00 0.00 175.52 175.86 2dj1 n LEU 63 N -5.36 0.67 0.37 2.58 4.77 -0.25 -3.31 117.00 116.47 2dj1 n LEU 63 Ca -0.00 0.69 -0.15 0.00 -0.03 0.00 0.00 56.01 56.52 2dj1 n LEU 63 Cb 0.33 -0.63 -0.07 0.00 -2.33 0.00 0.00 43.42 40.72 2dj1 n LEU 63 CO -0.04 -0.64 0.47 0.50 -1.33 0.00 0.00 177.39 176.35 2dj1 h LYS 64 N 0.00 -0.93 -1.08 3.23 3.64 0.37 -2.88 116.57 118.92 2dj1 h LYS 64 Ca 0.00 0.06 -0.22 0.00 -1.27 0.00 0.00 60.65 59.22 2dj1 h LYS 64 Cb 0.30 0.21 -0.13 0.00 -0.41 0.00 0.00 32.23 32.20 2dj1 h LYS 64 CO 0.00 -0.62 0.28 -0.25 -2.27 0.00 0.00 179.45 176.60 2dj1 n ASP 65 N -4.84 3.72 -4.94 4.20 8.00 -1.02 -4.34 116.55 117.33 2dj1 n ASP 65 Ca -0.12 -2.70 -0.25 0.00 0.71 0.00 0.00 54.79 52.43 2dj1 n ASP 65 Cb 0.38 -0.70 -0.02 0.00 -0.02 0.00 0.00 41.12 40.76 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 0.11 6.35 -0.20 -2.24 2.47 -1.13 -5.02 114.94 115.28 2dj1 s ASN 66 Ca 0.24 0.34 -0.02 0.00 0.42 0.00 0.00 52.86 53.84 2dj1 s ASN 66 Cb 0.20 -1.98 0.00 0.00 -1.45 0.00 0.00 41.25 38.02 2dj1 s ASN 66 CO 0.04 -0.11 -0.10 -0.62 -3.72 0.00 0.00 177.10 172.58 2dj1 s ASP 67 N -3.57 3.88 1.00 -4.21 2.15 -1.26 -1.14 116.67 113.52 2dj1 s ASP 67 Ca 0.38 -0.47 -0.12 0.00 0.43 0.00 0.00 52.55 52.76 2dj1 s ASP 67 Cb -0.10 -1.64 0.19 0.00 -0.30 0.00 0.00 42.92 41.07 2dj1 s ASP 67 CO 0.31 0.00 1.09 -2.16 -0.17 0.00 0.00 175.17 174.24 2dj1 s PRO 68 N 1.33 0.41 -0.70 4.34 0.04 -1.26 -5.04 135.00 134.12 2dj1 s PRO 68 Ca 0.04 0.52 -0.26 0.00 0.04 0.00 0.00 61.00 61.34 2dj1 s PRO 68 Cb -0.14 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.64 2dj1 s PRO 68 CO -0.06 -2.74 1.89 -1.25 0.04 0.00 0.00 177.00 174.88 2dj1 s PRO 69 N -4.96 2.60 0.04 0.56 0.04 -0.29 -4.97 135.00 128.01 2dj1 s PRO 69 Ca 0.65 0.34 -0.12 0.00 0.04 0.00 0.00 61.00 61.91 2dj1 s PRO 69 Cb -0.19 -4.60 -0.06 0.00 0.04 0.00 0.00 34.50 29.70 2dj1 s PRO 69 CO 0.58 -2.94 0.40 0.42 0.04 0.00 0.00 177.00 175.50 2dj1 s ILE 70 N 9.41 5.07 -0.19 0.56 1.01 -1.10 -5.02 121.20 130.94 2dj1 s ILE 70 Ca 0.68 0.63 -0.02 0.00 0.00 0.00 0.00 60.65 61.94 2dj1 s ILE 70 Cb -0.11 -3.67 -0.00 0.00 0.01 0.00 0.00 42.46 38.69 2dj1 s ILE 70 CO 0.14 0.43 -0.10 0.00 0.00 0.00 0.00 174.94 175.42 2dj1 s ALA 71 N -1.24 2.66 -0.05 9.38 0.00 -1.26 -3.72 121.76 127.54 2dj1 s ALA 71 Ca 0.28 -1.13 -0.19 0.00 0.00 0.00 0.00 51.96 50.92 2dj1 s ALA 71 Cb -0.15 -1.49 -0.05 0.00 0.00 0.00 0.00 23.12 21.43 2dj1 s ALA 71 CO 0.15 -0.29 0.53 0.08 0.00 0.00 0.00 175.76 176.23 2dj1 s VAL 72 N 1.23 5.03 0.11 0.00 1.01 -1.26 -3.67 120.40 122.84 2dj1 s VAL 72 Ca 0.03 1.08 -0.03 0.00 0.00 0.00 0.00 61.98 63.06 2dj1 s VAL 72 Cb -0.14 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 2dj1 s VAL 72 CO -0.04 0.40 0.08 0.00 0.00 0.00 0.00 175.10 175.55 2dj1 s ALA 73 N 0.00 0.49 0.23 5.51 0.00 -0.92 -1.77 121.76 125.29 2dj1 s ALA 73 Ca 0.28 -1.19 0.07 0.00 0.00 0.00 0.00 51.96 51.12 2dj1 s ALA 73 Cb -0.17 0.64 -0.05 0.00 0.00 0.00 0.00 23.12 23.55 2dj1 s ALA 73 CO 0.14 -0.48 -0.12 -1.59 0.00 0.00 0.00 175.76 173.71 2dj1 s LYS 74 N -3.97 1.39 -0.06 0.00 -2.85 0.06 -2.22 119.74 112.09 2dj1 s LYS 74 Ca 0.16 -1.64 -0.04 0.00 -1.00 0.00 0.00 55.97 53.44 2dj1 s LYS 74 Cb 0.07 -1.13 0.02 0.00 -2.06 0.00 0.00 37.83 34.73 2dj1 s LYS 74 CO -0.04 0.15 0.15 0.42 0.10 0.00 0.00 175.35 176.13 2dj1 s ILE 75 N -2.98 -0.02 -0.96 3.79 1.01 -0.24 -1.60 121.20 120.21 2dj1 s ILE 75 Ca 0.25 0.06 -0.19 0.00 0.00 0.00 0.00 60.65 60.76 2dj1 s ILE 75 Cb 0.00 -0.22 0.12 0.00 0.01 0.00 0.00 42.46 42.37 2dj1 s ILE 75 CO 0.08 0.02 1.21 -1.81 0.00 0.00 0.00 174.94 174.44 2dj1 s ASP 76 N 0.43 6.62 0.39 3.58 1.11 -1.26 -2.72 116.67 124.81 2dj1 s ASP 76 Ca -0.03 -1.95 0.22 0.00 0.18 0.00 0.00 52.55 50.97 2dj1 s ASP 76 Cb -0.04 -2.43 1.26 0.00 1.07 0.00 0.00 42.92 42.77 2dj1 s ASP 76 CO -0.02 -1.15 1.65 0.00 1.18 0.00 0.00 175.17 176.84 2dj1 h ALA 77 N 8.97 2.34 -0.84 5.23 0.00 -1.81 0.90 119.26 134.06 2dj1 h ALA 77 Ca 0.17 0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.30 2dj1 h ALA 77 Cb 1.02 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 2dj1 h ALA 77 CO 1.18 -0.96 0.55 1.79 0.00 0.00 0.00 179.25 181.81 2dj1 h THR 78 N 0.20 1.05 0.13 0.00 1.35 -1.89 -2.45 112.91 111.29 2dj1 h THR 78 Ca 0.77 -0.32 -0.31 0.00 -0.55 0.00 0.00 66.41 66.00 2dj1 h THR 78 Cb 2.09 0.04 -0.00 0.00 -1.73 0.00 0.00 68.15 68.55 2dj1 h THR 78 CO -0.51 0.17 -1.53 -1.28 -0.25 0.00 0.00 175.52 172.13 2dj1 h SER 79 N 0.92 0.42 -3.11 5.36 0.87 0.36 -3.42 113.55 114.96 2dj1 h SER 79 Ca 0.36 -0.57 -0.76 0.00 -1.23 0.00 0.00 61.79 59.59 2dj1 h SER 79 Cb 0.23 -0.14 -0.24 0.00 -0.44 0.00 0.00 62.40 61.82 2dj1 h SER 79 CO -0.13 1.48 -0.18 0.00 -0.53 0.00 0.00 176.83 177.47 2dj1 s ALA 80 N -2.62 3.66 -0.34 6.23 0.00 -0.16 -4.88 121.76 123.65 2dj1 s ALA 80 Ca -0.09 -2.56 0.22 0.00 0.00 0.00 0.00 51.96 49.52 2dj1 s ALA 80 Cb 0.07 -3.30 0.20 0.00 0.00 0.00 0.00 23.12 20.08 2dj1 s ALA 80 CO 0.86 -2.06 1.41 0.66 0.00 0.00 0.00 175.76 176.63 2dj1 h SER 81 N 8.85 0.00 0.01 0.00 4.64 -1.82 -2.81 113.55 122.42 2dj1 h SER 81 Ca -0.28 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.04 2dj1 h SER 81 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2dj1 h SER 81 CO 1.03 0.09 -0.00 -0.03 -0.87 0.00 0.00 176.83 177.05 2dj1 h MET 82 N 0.00 -0.01 -0.56 4.77 1.85 -1.90 -3.09 114.93 115.99 2dj1 h MET 82 Ca -0.01 0.00 -0.04 0.00 -0.61 0.00 0.00 59.70 59.04 2dj1 h MET 82 Cb 1.08 0.00 -0.03 0.00 0.43 0.00 0.00 31.60 33.09 2dj1 h MET 82 CO 0.01 0.35 0.19 -0.07 -0.40 0.00 0.00 176.91 176.99 2dj1 h LEU 83 N -1.00 0.76 -0.32 3.39 3.38 -1.96 -2.03 115.31 117.52 2dj1 h LEU 83 Ca -0.00 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 57.87 2dj1 h LEU 83 Cb 0.37 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2dj1 h LEU 83 CO 0.00 0.71 0.19 0.00 0.09 0.00 0.00 178.44 179.43 2dj1 h ALA 84 N 1.40 0.41 0.00 1.53 0.00 -1.64 -1.69 119.26 119.27 2dj1 h ALA 84 Ca 0.19 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2dj1 h ALA 84 Cb 0.22 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2dj1 h ALA 84 CO -0.01 -0.16 -0.04 1.03 0.00 0.00 0.00 179.25 180.07 2dj1 h SER 85 N 0.40 0.00 0.56 0.00 0.87 -1.41 -0.41 113.55 113.56 2dj1 h SER 85 Ca 0.13 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.66 2dj1 h SER 85 Cb -0.01 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 61.96 2dj1 h SER 85 CO -0.05 0.04 -0.27 0.50 -0.53 0.00 0.00 176.83 176.51 2dj1 h LYS 86 N 0.00 -0.73 -0.90 2.24 3.64 -0.57 -2.90 116.57 117.36 2dj1 h LYS 86 Ca -0.00 0.05 -0.22 0.00 -1.27 0.00 0.00 60.65 59.21 2dj1 h LYS 86 Cb 0.56 0.16 -0.13 0.00 -0.41 0.00 0.00 32.23 32.42 2dj1 h LYS 86 CO 0.00 -0.44 0.27 1.19 -2.27 0.00 0.00 179.45 178.21 2dj1 n PHE 87 N -5.37 1.81 -4.27 1.91 3.01 -1.14 -4.90 117.46 108.51 2dj1 n PHE 87 Ca -0.12 -1.05 -0.32 0.00 1.01 0.00 0.00 57.45 56.97 2dj1 n PHE 87 Cb 0.33 -0.59 -0.09 0.00 -0.01 0.00 0.00 39.48 39.12 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 -0.22 0.41 -4.59 4.37 2.03 -1.09 -4.77 116.55 112.69 2dj1 n ASP 88 Ca 0.32 -1.22 -0.42 0.00 0.52 0.00 0.00 54.79 53.99 2dj1 n ASP 88 Cb 1.14 -1.52 -0.03 0.00 -0.72 0.00 0.00 41.12 39.99 2dj1 n ASP 88 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2dj1 s VAL 89 N -4.10 3.52 -0.33 5.18 1.01 -0.18 -4.85 120.40 120.65 2dj1 s VAL 89 Ca 0.15 0.49 0.11 0.00 0.00 0.00 0.00 61.98 62.73 2dj1 s VAL 89 Cb -0.09 -3.83 0.46 0.00 0.00 0.00 0.00 36.38 32.92 2dj1 s VAL 89 CO 0.96 -0.61 1.12 -0.24 0.00 0.00 0.00 175.10 176.33 2dj1 n SER 90 N 10.66 3.83 0.00 3.32 2.88 -1.26 -4.86 113.62 128.19 2dj1 n SER 90 Ca 0.21 -3.30 0.00 0.00 -1.33 0.00 0.00 58.87 54.45 2dj1 n SER 90 Cb 0.48 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 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 -0.54 1.09 3.52 0.46 0.00 -1.26 -5.18 105.19 103.27 2dj1 n GLY 91 Ca 0.32 -0.92 -0.15 0.00 0.00 0.00 0.00 46.02 45.26 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 -0.57 0.49 1.61 1.51 -1.26 -4.17 117.35 112.95 2dj1 s TYR 92 Ca 0.00 0.91 -0.22 0.00 -1.01 0.00 0.00 57.07 56.75 2dj1 s TYR 92 Cb 0.00 0.44 -0.07 0.00 -0.11 0.00 0.00 41.96 42.22 2dj1 s TYR 92 CO 0.00 -0.57 1.15 -1.25 -1.11 0.00 0.00 175.55 173.77 2dj1 s PRO 93 N -1.51 3.63 -0.14 -1.71 0.04 -1.26 -5.00 135.00 129.05 2dj1 s PRO 93 Ca -0.07 1.73 -0.01 0.00 0.04 0.00 0.00 61.00 62.68 2dj1 s PRO 93 Cb -0.00 -2.28 0.04 0.00 0.04 0.00 0.00 34.50 32.29 2dj1 s PRO 93 CO 0.05 -0.65 -0.02 0.99 0.04 0.00 0.00 177.00 177.42 2dj1 s THR 94 N -1.61 0.76 -0.11 1.26 2.01 -0.74 -5.02 115.64 112.19 2dj1 s THR 94 Ca 0.66 -0.36 -0.06 0.00 0.31 0.00 0.00 61.69 62.24 2dj1 s THR 94 Cb -0.27 -0.99 -0.04 0.00 0.01 0.00 0.00 72.50 71.21 2dj1 s THR 94 CO 0.32 0.12 0.10 -0.63 -0.69 0.00 0.00 174.62 173.85 2dj1 s ILE 95 N 1.79 5.19 0.32 1.82 1.01 -1.26 0.13 121.20 130.20 2dj1 s ILE 95 Ca 0.02 0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.77 2dj1 s ILE 95 Cb -0.14 -3.25 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 2dj1 s ILE 95 CO -0.07 0.61 0.35 -0.54 0.00 0.00 0.00 174.94 175.29 2dj1 s LYS 96 N -1.02 1.76 -0.06 2.79 1.02 0.64 -2.78 119.74 122.10 2dj1 s LYS 96 Ca 0.15 -1.85 -0.03 0.00 0.02 0.00 0.00 55.97 54.26 2dj1 s LYS 96 Cb -0.12 0.37 0.03 0.00 -0.52 0.00 0.00 37.83 37.59 2dj1 s LYS 96 CO 0.04 -0.68 0.14 0.42 -0.92 0.00 0.00 175.35 174.34 2dj1 s ILE 97 N -3.37 -0.03 -0.26 2.17 1.01 -1.05 -2.05 121.20 117.62 2dj1 s ILE 97 Ca 0.36 0.12 -0.09 0.00 0.00 0.00 0.00 60.65 61.04 2dj1 s ILE 97 Cb 0.02 -0.22 -0.04 0.00 0.01 0.00 0.00 42.46 42.23 2dj1 s ILE 97 CO 0.22 0.05 0.12 -0.22 0.00 0.00 0.00 174.94 175.11 2dj1 s LEU 98 N 0.78 3.70 -0.36 2.97 2.96 0.80 -0.72 118.68 128.81 2dj1 s LEU 98 Ca -0.06 -0.14 0.00 0.00 -0.22 0.00 0.00 54.13 53.72 2dj1 s LEU 98 Cb -0.08 -2.01 0.09 0.00 0.50 0.00 0.00 46.19 44.70 2dj1 s LEU 98 CO -0.04 -0.05 0.10 -0.75 -1.32 0.00 0.00 176.35 174.29 2dj1 s LYS 99 N 1.67 1.90 -0.86 1.98 2.47 0.15 -1.10 119.74 125.95 2dj1 s LYS 99 Ca 0.07 -1.73 0.00 0.00 -1.56 0.00 0.00 55.97 52.75 2dj1 s LYS 99 Cb -0.16 -3.35 0.00 0.00 -1.46 0.00 0.00 37.83 32.87 2dj1 s LYS 99 CO 0.07 -0.92 0.00 1.63 0.16 0.00 0.00 175.35 176.28 2dj1 n LYS 100 N 4.47 -2.04 0.00 4.03 4.76 -0.22 0.87 118.16 130.03 2dj1 n LYS 100 Ca -0.02 0.49 0.00 0.00 -2.87 0.00 0.00 58.31 55.90 2dj1 n LYS 100 Cb 0.42 -4.94 0.00 0.00 -1.84 0.00 0.00 35.03 28.67 2dj1 n LYS 100 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dj1 n GLY 101 N -0.56 1.06 3.44 0.72 0.00 -1.26 -5.08 105.19 103.51 2dj1 n GLY 101 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.85 3.50 -0.10 1.61 -0.21 0.25 -5.07 119.66 118.79 2dj1 s GLN 102 Ca 0.00 -0.59 -0.30 0.00 0.02 0.00 0.00 55.36 54.49 2dj1 s GLN 102 Cb 0.00 -3.45 -0.02 0.00 1.00 0.00 0.00 33.01 30.54 2dj1 s GLN 102 CO 0.00 -0.30 1.13 0.00 -2.12 0.00 0.00 175.29 174.00 2dj1 s ALA 103 N 1.61 3.50 -0.47 6.09 0.00 -1.26 -0.68 121.76 130.56 2dj1 s ALA 103 Ca 0.05 0.49 0.03 0.00 0.00 0.00 0.00 51.96 52.54 2dj1 s ALA 103 Cb -0.16 -3.51 0.12 0.00 0.00 0.00 0.00 23.12 19.58 2dj1 s ALA 103 CO 0.05 -0.78 0.21 0.08 0.00 0.00 0.00 175.76 175.31 2dj1 s VAL 104 N 2.37 2.58 0.28 0.00 1.01 0.10 -4.99 120.40 121.75 2dj1 s VAL 104 Ca 0.52 -2.97 -0.30 0.00 0.00 0.00 0.00 61.98 59.23 2dj1 s VAL 104 Cb -0.22 -2.82 -0.12 0.00 0.00 0.00 0.00 36.38 33.23 2dj1 s VAL 104 CO 0.19 -0.74 1.55 -0.90 0.00 0.00 0.00 175.10 175.19 2dj1 n ASP 105 N 3.51 3.57 -4.08 3.32 5.75 -1.26 -2.53 116.55 124.82 2dj1 n ASP 105 Ca 0.05 1.14 -0.36 0.00 -0.01 0.00 0.00 54.79 55.61 2dj1 n ASP 105 Cb 0.36 -1.55 -0.10 0.00 -1.03 0.00 0.00 41.12 38.80 2dj1 n ASP 105 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 2dj1 s TYR 106 N 0.00 3.42 -0.72 2.11 5.04 -1.12 -4.94 117.35 121.14 2dj1 s TYR 106 Ca 0.65 -2.78 -0.02 0.00 -2.44 0.00 0.00 57.07 52.48 2dj1 s TYR 106 Cb -0.54 -3.17 0.29 0.00 0.35 0.00 0.00 41.96 38.89 2dj1 s TYR 106 CO 0.48 -0.82 2.20 -3.47 -1.34 0.00 0.00 175.55 172.60 2dj1 n ASP 107 N 3.32 7.29 0.00 4.32 2.03 -1.26 -4.60 116.55 127.64 2dj1 n ASP 107 Ca 0.09 -3.67 0.00 0.00 0.52 0.00 0.00 54.79 51.74 2dj1 n ASP 107 Cb 0.37 -1.09 0.00 0.00 -0.72 0.00 0.00 41.12 39.68 2dj1 n ASP 107 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dj1 n GLY 108 N -0.24 6.23 3.65 0.27 0.00 -1.26 -5.08 105.19 108.77 2dj1 n GLY 108 Ca 0.53 -2.03 -0.43 0.00 0.00 0.00 0.00 46.02 44.10 2dj1 n GLY 108 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dj1 s SER 109 N 0.48 7.03 -1.04 1.61 0.01 -1.26 -4.93 113.70 115.59 2dj1 s SER 109 Ca 0.00 1.35 -0.20 0.00 1.31 0.00 0.00 55.95 58.41 2dj1 s SER 109 Cb 0.00 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.60 2dj1 s SER 109 CO 0.00 -0.74 1.96 0.54 0.41 0.00 0.00 173.24 175.41 2dj1 n ARG 110 N 6.52 1.93 -4.41 12.44 1.74 -1.26 -4.17 116.66 129.45 2dj1 n ARG 110 Ca 0.12 -2.27 -0.22 0.00 -0.77 0.00 0.00 57.85 54.71 2dj1 n ARG 110 Cb 0.46 -3.23 -0.13 0.00 -1.02 0.00 0.00 32.46 28.53 2dj1 n ARG 110 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2dj1 s THR 111 N 6.05 1.35 0.56 0.55 -4.23 -1.26 -4.98 115.64 113.68 2dj1 s THR 111 Ca 0.58 -1.16 0.30 0.00 -1.18 0.00 0.00 61.69 60.23 2dj1 s THR 111 Cb 0.10 -1.22 0.43 0.00 1.34 0.00 0.00 72.50 73.16 2dj1 s THR 111 CO 0.08 0.03 1.87 -0.61 -0.54 0.00 0.00 174.62 175.46 2dj1 h GLN 112 N 4.73 0.00 0.16 3.99 4.15 -1.89 0.43 115.11 126.67 2dj1 h GLN 112 Ca -0.41 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.01 2dj1 h GLN 112 Cb 1.18 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.87 2dj1 h GLN 112 CO 0.43 0.00 -0.08 0.93 -1.93 0.00 0.00 178.83 178.18 2dj1 h GLU 113 N 0.00 -0.20 0.45 1.69 5.08 -1.95 -2.91 114.58 116.74 2dj1 h GLU 113 Ca 0.33 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.68 2dj1 h GLU 113 Cb 1.50 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.80 2dj1 h GLU 113 CO -0.00 -0.14 -0.22 0.93 -1.00 0.00 0.00 179.01 178.59 2dj1 h GLU 114 N -0.98 -0.58 -0.56 2.33 4.39 -1.66 0.80 114.58 118.32 2dj1 h GLU 114 Ca -0.02 0.04 0.11 0.00 0.34 0.00 0.00 59.36 59.83 2dj1 h GLU 114 Cb 0.16 0.13 -0.11 0.00 -0.10 0.00 0.00 28.75 28.83 2dj1 h GLU 114 CO 0.04 -0.39 -0.18 0.82 -1.16 0.00 0.00 179.01 178.14 2dj1 h ILE 115 N -0.61 0.37 -0.16 3.13 2.04 -0.32 0.21 117.51 122.17 2dj1 h ILE 115 Ca -0.06 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 2dj1 h ILE 115 Cb 0.46 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 2dj1 h ILE 115 CO 0.10 0.00 -0.24 0.58 0.00 0.00 0.00 178.15 178.60 2dj1 h VAL 116 N -0.05 1.24 0.58 1.67 2.07 -1.37 -2.52 116.25 117.88 2dj1 h VAL 116 Ca 0.26 -1.10 -0.03 0.00 0.82 0.00 0.00 66.70 66.65 2dj1 h VAL 116 Cb 0.45 1.38 0.01 0.00 -1.52 0.00 0.00 31.29 31.61 2dj1 h VAL 116 CO -0.60 0.34 -0.28 0.00 0.02 0.00 0.00 177.57 177.05 2dj1 h ALA 117 N 1.50 -0.78 0.34 1.67 0.00 0.18 -2.20 119.26 119.97 2dj1 h ALA 117 Ca 0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2dj1 h ALA 117 Cb 0.56 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2dj1 h ALA 117 CO 0.04 -0.83 -0.32 -0.22 0.00 0.00 0.00 179.25 177.92 2dj1 h LYS 118 N -0.99 -0.63 -0.92 0.00 1.63 -0.90 0.26 116.57 115.03 2dj1 h LYS 118 Ca -0.08 0.04 0.13 0.00 -0.85 0.00 0.00 60.65 59.90 2dj1 h LYS 118 Cb 0.66 0.14 -0.14 0.00 -0.60 0.00 0.00 32.23 32.28 2dj1 h LYS 118 CO 0.13 -0.42 -0.42 0.28 -3.45 0.00 0.00 179.45 175.57 2dj1 h VAL 119 N -0.65 0.03 -0.50 2.00 2.07 -1.55 0.84 116.25 118.48 2dj1 h VAL 119 Ca -0.04 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 2dj1 h VAL 119 Cb 0.56 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 2dj1 h VAL 119 CO -0.03 0.00 0.22 0.03 0.02 0.00 0.00 177.57 177.81 2dj1 h ARG 120 N -0.04 0.70 -0.53 1.57 3.08 -1.22 -0.67 114.38 117.27 2dj1 h ARG 120 Ca 0.29 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 60.19 2dj1 h ARG 120 Cb 0.56 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 2dj1 h ARG 120 CO -0.92 0.56 0.09 1.49 -1.07 0.00 0.00 179.97 180.12 2dj1 h GLU 121 N 0.70 0.87 -0.32 0.04 4.81 0.41 -3.07 114.58 118.03 2dj1 h GLU 121 Ca 0.17 -0.23 -0.15 0.00 -0.13 0.00 0.00 59.36 59.02 2dj1 h GLU 121 Cb 0.11 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 2dj1 h GLU 121 CO -0.02 0.85 -0.37 0.28 -0.73 0.00 0.00 179.01 179.02 2dj1 h VAL 122 N 0.76 1.29 -0.44 0.32 2.07 -0.02 -2.95 116.25 117.28 2dj1 h VAL 122 Ca 0.16 -1.55 0.13 0.00 0.82 0.00 0.00 66.70 66.25 2dj1 h VAL 122 Cb 0.40 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 2dj1 h VAL 122 CO 0.01 0.51 0.61 0.77 0.02 0.00 0.00 177.57 179.49 2dj1 h SER 123 N 0.59 0.00 -3.92 0.57 4.64 -1.04 -3.41 113.55 110.98 2dj1 h SER 123 Ca 0.04 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.84 2dj1 h SER 123 Cb 0.96 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.13 2dj1 h SER 123 CO 0.09 0.00 0.62 -1.10 -0.87 0.00 0.00 176.83 175.57 2dj1 s GLN 124 N -4.45 4.14 0.40 4.77 -1.52 -1.11 -4.93 119.66 116.97 2dj1 s GLN 124 Ca -0.04 2.16 0.19 0.00 -1.95 0.00 0.00 55.36 55.72 2dj1 s GLN 124 Cb 0.13 -2.89 0.82 0.00 -0.22 0.00 0.00 33.01 30.86 2dj1 s GLN 124 CO 0.45 -0.35 1.81 -1.00 -0.25 0.00 0.00 175.29 175.95 2dj1 h PRO 125 N 2.98 0.00 0.05 2.91 0.13 -1.89 -3.08 132.00 133.10 2dj1 h PRO 125 Ca -0.49 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.36 2dj1 h PRO 125 Cb 1.24 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.39 2dj1 h PRO 125 CO 0.64 0.33 -1.12 0.38 -0.23 0.00 0.00 178.00 178.00 2dj1 h ASP 126 N 0.00 0.83 -2.89 1.44 2.03 -1.91 -3.45 116.42 112.47 2dj1 h ASP 126 Ca -0.00 -0.71 -0.59 0.00 -0.73 0.00 0.00 57.03 55.00 2dj1 h ASP 126 Cb 0.74 -0.26 0.12 0.00 -0.83 0.00 0.00 39.33 39.10 2dj1 h ASP 126 CO 0.04 1.52 0.24 1.87 -1.03 0.00 0.00 179.24 181.88 2dj1 n TRP 127 N -3.80 1.52 -4.37 4.15 -0.00 -1.17 -5.00 117.44 108.77 2dj1 n TRP 127 Ca -0.11 0.62 -0.21 0.00 -0.00 0.00 0.00 57.50 57.79 2dj1 n TRP 127 Cb 0.92 -2.29 -0.13 0.00 -0.00 0.00 0.00 31.31 29.81 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 -1.14 1.27 0.46 5.87 -4.23 -1.26 -4.95 115.64 111.66 2dj1 s THR 128 Ca 0.59 -1.13 -0.23 0.00 -1.18 0.00 0.00 61.69 59.74 2dj1 s THR 128 Cb -0.62 -1.15 -0.07 0.00 1.34 0.00 0.00 72.50 72.00 2dj1 s THR 128 CO 0.60 -0.00 1.16 -2.16 -0.54 0.00 0.00 174.62 173.68 2dj1 s PRO 129 N -1.31 3.74 0.99 3.99 0.04 -1.26 -5.03 135.00 136.16 2dj1 s PRO 129 Ca 0.02 1.77 -0.12 0.00 0.04 0.00 0.00 61.00 62.71 2dj1 s PRO 129 Cb -0.09 -2.39 0.18 0.00 0.04 0.00 0.00 34.50 32.24 2dj1 s PRO 129 CO 0.02 -0.56 1.09 -1.25 0.04 0.00 0.00 177.00 176.34 2dj1 s PRO 130 N -2.72 0.53 0.00 0.56 0.04 -1.26 -4.90 135.00 127.25 2dj1 s PRO 130 Ca 0.64 0.56 0.14 0.00 0.04 0.00 0.00 61.00 62.38 2dj1 s PRO 130 Cb -0.28 -1.75 0.85 0.00 0.04 0.00 0.00 34.50 33.36 2dj1 s PRO 130 CO 0.34 -2.67 1.27 -0.35 0.04 0.00 0.00 177.00 175.62 2dj1 n PRO 131 N -4.14 0.49 -2.06 0.56 -0.04 -1.26 -4.54 135.00 124.00 2dj1 n PRO 131 Ca 0.05 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.21 2dj1 n PRO 131 Cb 0.57 -1.46 -0.06 0.00 -0.04 0.00 0.00 33.50 32.52 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 -0.96 1.75 -3.98 0.54 4.07 -1.26 -4.92 120.64 115.88 2dj1 n GLU 132 Ca 0.11 -2.51 -0.36 0.00 -0.06 0.00 0.00 57.16 54.34 2dj1 n GLU 132 Cb 0.05 -3.67 -0.06 0.00 -0.06 0.00 0.00 31.44 27.70 2dj1 n GLU 132 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 2dj1 s VAL 133 N 10.11 5.24 0.20 6.31 0.11 -1.26 -4.98 120.40 136.13 2dj1 s VAL 133 Ca 0.66 0.02 -0.31 0.00 -2.93 0.00 0.00 61.98 59.42 2dj1 s VAL 133 Cb 0.01 -3.31 -0.11 0.00 -1.53 0.00 0.00 36.38 31.44 2dj1 s VAL 133 CO 0.13 0.54 1.58 0.28 -3.33 0.00 0.00 175.10 174.30 2dj1 s THR 134 N -1.07 2.44 0.06 5.04 -1.32 -1.26 -4.93 115.64 114.60 2dj1 s THR 134 Ca 0.17 0.33 -0.26 0.00 -1.21 0.00 0.00 61.69 60.73 2dj1 s THR 134 Cb -0.12 -3.21 -0.17 0.00 -1.51 0.00 0.00 72.50 67.49 2dj1 s THR 134 CO 0.07 0.03 1.57 -1.28 -2.21 0.00 0.00 174.62 172.80 2dj1 h SER 135 N 6.24 -0.27 -1.04 8.08 0.87 -2.01 -3.49 113.55 121.93 2dj1 h SER 135 Ca -0.44 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 2dj1 h SER 135 Cb 1.21 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 2dj1 h SER 135 CO 0.88 -0.09 0.00 0.61 -0.53 0.00 0.00 176.83 177.70 2dj1 n GLY 136 N -0.91 0.20 3.73 5.77 0.00 -1.26 -5.06 105.19 107.66 2dj1 n GLY 136 Ca -0.09 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.41 2dj1 n GLY 136 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dj1 s PRO 137 N -4.22 1.43 -0.21 1.61 0.04 -1.26 -5.07 135.00 127.32 2dj1 s PRO 137 Ca 0.00 0.88 -0.04 0.00 0.04 0.00 0.00 61.00 61.88 2dj1 s PRO 137 Cb 0.00 -1.82 0.09 0.00 0.04 0.00 0.00 34.50 32.81 2dj1 s PRO 137 CO 0.00 -2.14 0.21 -1.12 0.04 0.00 0.00 177.00 173.99 2dj1 s SER 138 N -3.42 1.54 0.58 6.66 0.01 -1.26 -5.15 113.70 112.66 2dj1 s SER 138 Ca 0.63 -0.31 -0.05 0.00 1.31 0.00 0.00 55.95 57.52 2dj1 s SER 138 Cb -0.18 0.31 0.01 0.00 0.21 0.00 0.00 66.02 66.37 2dj1 s SER 138 CO 0.57 -0.33 0.88 -0.44 0.41 0.00 0.00 173.24 174.32 2dj1 s SER 139 N 2.30 5.62 0.00 2.44 0.01 -1.26 -5.36 113.70 117.46 2dj1 s SER 139 Ca 0.07 0.68 0.00 0.00 1.31 0.00 0.00 55.95 58.00 2dj1 s SER 139 Cb -0.16 -1.70 0.00 0.00 0.21 0.00 0.00 66.02 64.38 2dj1 s SER 139 CO -0.13 -1.02 0.00 0.61 0.41 0.00 0.00 173.24 173.10