#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 0.00 -3.20 1.61 4.64 -2.13 -3.43 113.55 111.04 2dj1 h SER 2 Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 2dj1 h SER 2 Cb 0.00 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 61.72 2dj1 h SER 2 CO 0.00 0.36 -0.80 -0.94 -0.87 0.00 0.00 176.83 174.58 2dj1 s SER 3 N -6.39 2.13 0.95 4.97 1.04 -1.26 -5.13 113.70 110.01 2dj1 s SER 3 Ca 0.05 -0.30 -0.11 0.00 0.48 0.00 0.00 55.95 56.07 2dj1 s SER 3 Cb 0.07 -0.83 0.13 0.00 0.10 0.00 0.00 66.02 65.49 2dj1 s SER 3 CO 0.72 -0.11 0.93 0.61 0.98 0.00 0.00 173.24 176.38 2dj1 n GLY 4 N 4.85 -0.93 3.48 7.32 0.00 -1.26 -4.84 105.19 113.81 2dj1 n GLY 4 Ca -0.13 -0.76 -0.49 0.00 0.00 0.00 0.00 46.02 44.64 2dj1 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dj1 n SER 5 N -3.52 -0.11 -4.56 1.61 3.41 -1.26 -4.78 113.62 104.41 2dj1 n SER 5 Ca 0.10 1.15 -0.40 0.00 -0.26 0.00 0.00 58.87 59.46 2dj1 n SER 5 Cb 0.53 -1.07 -0.03 0.00 -0.26 0.00 0.00 64.21 63.38 2dj1 n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dj1 s SER 6 N -0.62 5.58 -0.06 4.04 0.01 -1.26 -4.94 113.70 116.45 2dj1 s SER 6 Ca 0.68 0.38 -0.17 0.00 1.31 0.00 0.00 55.95 58.15 2dj1 s SER 6 Cb -0.91 -2.53 0.04 0.00 0.21 0.00 0.00 66.02 62.82 2dj1 s SER 6 CO 0.56 -2.13 0.40 -0.83 0.41 0.00 0.00 173.24 171.66 2dj1 s GLY 7 N 6.81 -0.27 0.94 3.44 0.00 -1.26 -5.17 107.32 111.81 2dj1 s GLY 7 Ca 0.63 0.73 -0.15 0.00 0.00 0.00 0.00 44.72 45.93 2dj1 s GLY 7 CO 0.23 0.51 1.30 0.99 0.00 0.00 0.00 173.10 176.12 2dj1 s ASP 8 N -0.87 3.35 -1.04 1.64 1.11 -1.26 -4.91 116.67 114.69 2dj1 s ASP 8 Ca -0.09 0.34 -0.23 0.00 0.18 0.00 0.00 52.55 52.74 2dj1 s ASP 8 Cb -0.04 -0.46 -0.05 0.00 1.07 0.00 0.00 42.92 43.44 2dj1 s ASP 8 CO 0.04 -2.59 1.91 1.51 1.18 0.00 0.00 175.17 177.21 2dj1 s ASP 9 N -4.84 5.24 -0.08 0.27 -4.77 -1.26 -4.52 116.67 106.71 2dj1 s ASP 9 Ca 0.72 -1.18 -0.03 0.00 -3.30 0.00 0.00 52.55 48.75 2dj1 s ASP 9 Cb -0.05 -2.57 -0.04 0.00 -1.09 0.00 0.00 42.92 39.17 2dj1 s ASP 9 CO 0.52 -2.75 -0.10 -0.90 0.70 0.00 0.00 175.17 172.65 2dj1 n ASP 10 N 13.63 0.96 -4.05 2.11 5.68 -1.26 -4.89 116.55 128.74 2dj1 n ASP 10 Ca 0.42 0.08 -0.34 0.00 -0.50 0.00 0.00 54.79 54.45 2dj1 n ASP 10 Cb 0.47 -0.22 -0.09 0.00 -1.14 0.00 0.00 41.12 40.14 2dj1 n ASP 10 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 2dj1 s LEU 11 N -6.29 5.22 0.53 -2.12 1.43 -1.26 -5.06 118.68 111.13 2dj1 s LEU 11 Ca -0.11 -3.49 -0.03 0.00 -1.03 0.00 0.00 54.13 49.47 2dj1 s LEU 11 Cb 0.04 -1.82 0.00 0.00 0.03 0.00 0.00 46.19 44.45 2dj1 s LEU 11 CO 0.14 -0.21 0.80 -0.70 0.23 0.00 0.00 176.35 176.61 2dj1 s GLU 12 N -0.98 2.98 -0.16 1.70 2.56 -1.26 -5.01 118.70 118.52 2dj1 s GLU 12 Ca 0.23 -0.23 -0.04 0.00 0.00 0.00 0.00 54.97 54.93 2dj1 s GLU 12 Cb -0.11 -2.40 0.08 0.00 2.00 0.00 0.00 34.13 33.69 2dj1 s GLU 12 CO -0.10 -0.51 0.20 0.08 -0.56 0.00 0.00 175.26 174.37 2dj1 s VAL 13 N -2.80 -0.31 0.76 3.70 1.01 -1.26 -4.84 120.40 116.66 2dj1 s VAL 13 Ca 0.52 0.06 -0.09 0.00 0.00 0.00 0.00 61.98 62.46 2dj1 s VAL 13 Cb -0.10 -0.54 0.17 0.00 0.00 0.00 0.00 36.38 35.90 2dj1 s VAL 13 CO 0.42 -0.08 1.04 0.29 0.00 0.00 0.00 175.10 176.77 2dj1 n LYS 14 N 5.32 -0.72 -3.57 2.72 5.02 -1.26 -4.88 118.16 120.79 2dj1 n LYS 14 Ca -0.05 -1.96 -0.12 0.00 -2.02 0.00 0.00 58.31 54.15 2dj1 n LYS 14 Cb 0.50 -0.96 -0.05 0.00 -0.02 0.00 0.00 35.03 34.50 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 -5.22 1.08 -0.21 1.97 -1.05 -1.26 -1.08 118.70 112.93 2dj1 s GLU 15 Ca 0.62 -0.43 -0.04 0.00 -0.15 0.00 0.00 54.97 54.97 2dj1 s GLU 15 Cb -0.02 0.49 0.10 0.00 -0.44 0.00 0.00 34.13 34.25 2dj1 s GLU 15 CO 0.43 -0.41 0.23 -1.21 0.95 0.00 0.00 175.26 175.24 2dj1 s GLU 16 N -3.08 0.20 -1.93 -4.83 0.41 0.71 -4.86 118.70 105.32 2dj1 s GLU 16 Ca -0.02 0.16 0.00 0.00 -0.41 0.00 0.00 54.97 54.71 2dj1 s GLU 16 Cb 0.00 -1.17 0.00 0.00 -1.78 0.00 0.00 34.13 31.18 2dj1 s GLU 16 CO -0.07 -0.69 0.00 0.09 -0.49 0.00 0.00 175.26 174.10 2dj1 n ASN 17 N 5.32 -5.80 0.00 -0.19 3.02 -1.26 -0.88 115.26 115.46 2dj1 n ASN 17 Ca -0.05 0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.65 2dj1 n ASN 17 Cb 0.49 -4.92 0.00 0.00 -0.61 0.00 0.00 39.78 34.74 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 -0.82 0.07 3.51 7.41 0.00 -1.26 -4.61 105.19 109.49 2dj1 n GLY 18 Ca -0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 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 4.81 0.30 1.61 1.01 -0.06 -4.64 120.40 121.43 2dj1 s VAL 19 Ca 0.00 0.05 -0.29 0.00 0.00 0.00 0.00 61.98 61.74 2dj1 s VAL 19 Cb 0.00 -4.23 -0.10 0.00 0.00 0.00 0.00 36.38 32.05 2dj1 s VAL 19 CO 0.00 -0.65 1.21 0.26 0.00 0.00 0.00 175.10 175.92 2dj1 s TRP 20 N 2.85 3.31 -0.53 5.22 0.52 -0.73 -0.21 118.94 129.39 2dj1 s TRP 20 Ca 0.22 1.55 -0.16 0.00 0.02 0.00 0.00 56.10 57.73 2dj1 s TRP 20 Cb -0.15 -3.49 0.12 0.00 -1.15 0.00 0.00 33.47 28.81 2dj1 s TRP 20 CO 0.18 -1.23 0.47 0.08 0.02 0.00 0.00 176.95 176.48 2dj1 s VAL 21 N -1.10 5.16 0.42 4.03 1.01 -0.24 0.12 120.40 129.78 2dj1 s VAL 21 Ca 0.47 -1.44 0.01 0.00 0.00 0.00 0.00 61.98 61.02 2dj1 s VAL 21 Cb -0.36 -4.27 -0.01 0.00 0.00 0.00 0.00 36.38 31.74 2dj1 s VAL 21 CO 0.47 -0.82 0.62 -0.76 0.00 0.00 0.00 175.10 174.61 2dj1 s LEU 22 N 1.59 3.76 0.23 3.92 1.43 -0.81 -4.08 118.68 124.72 2dj1 s LEU 22 Ca 0.03 0.22 -0.19 0.00 -1.03 0.00 0.00 54.13 53.17 2dj1 s LEU 22 Cb -0.29 -3.11 0.03 0.00 0.03 0.00 0.00 46.19 42.85 2dj1 s LEU 22 CO 0.03 -0.60 0.61 0.54 0.23 0.00 0.00 176.35 177.17 2dj1 s ASN 23 N -4.18 -0.28 0.29 2.29 4.22 -1.26 -4.54 114.94 111.48 2dj1 s ASN 23 Ca 0.47 -0.54 0.14 0.00 -2.14 0.00 0.00 52.86 50.79 2dj1 s ASN 23 Cb -0.10 0.65 0.77 0.00 1.28 0.00 0.00 41.25 43.85 2dj1 s ASN 23 CO 0.36 -1.18 1.36 -0.67 -2.04 0.00 0.00 177.10 174.93 2dj1 n ASP 24 N -0.40 0.37 -0.00 3.54 2.03 -1.26 0.24 116.55 121.07 2dj1 n ASP 24 Ca -0.07 0.60 -0.02 0.00 0.52 0.00 0.00 54.79 55.81 2dj1 n ASP 24 Cb 0.61 -0.58 -0.11 0.00 -0.72 0.00 0.00 41.12 40.32 2dj1 n ASP 24 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dj1 n GLY 25 N -1.29 -1.12 0.07 0.27 0.00 -1.26 -4.32 105.19 97.54 2dj1 n GLY 25 Ca -0.01 -0.16 0.03 0.00 0.00 0.00 0.00 46.02 45.87 2dj1 n GLY 25 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2dj1 n ASN 26 N -2.85 1.57 0.15 1.61 0.23 0.96 -4.76 115.26 112.16 2dj1 n ASN 26 Ca -0.14 -2.13 -0.06 0.00 -0.53 0.00 0.00 54.58 51.72 2dj1 n ASN 26 Cb 0.91 -0.14 -0.03 0.00 -2.08 0.00 0.00 39.78 38.44 2dj1 n ASN 26 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 2dj1 h PHE 27 N 0.00 -0.36 -0.24 -2.53 3.57 0.30 -1.82 116.94 115.87 2dj1 h PHE 27 Ca 0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 2dj1 h PHE 27 Cb 0.80 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.65 2dj1 h PHE 27 CO 0.01 -0.22 0.15 -0.44 -2.23 0.00 0.00 178.31 175.57 2dj1 h ASP 28 N -0.47 0.28 -0.60 0.41 5.19 -1.86 -1.36 116.42 118.01 2dj1 h ASP 28 Ca -0.04 -0.04 0.12 0.00 -0.62 0.00 0.00 57.03 56.46 2dj1 h ASP 28 Cb 0.30 -0.07 -0.11 0.00 0.18 0.00 0.00 39.33 39.63 2dj1 h ASP 28 CO 0.07 0.23 -0.08 -1.13 -3.12 0.00 0.00 179.24 175.21 2dj1 h ASN 29 N 0.30 -0.42 0.69 6.45 -1.24 -1.86 1.82 115.58 121.31 2dj1 h ASN 29 Ca 0.09 0.17 -0.03 0.00 0.71 0.00 0.00 56.30 57.23 2dj1 h ASN 29 Cb 0.00 0.32 0.01 0.00 0.73 0.00 0.00 38.32 39.38 2dj1 h ASN 29 CO -0.02 -0.16 -0.33 0.15 -1.29 0.00 0.00 177.43 175.78 2dj1 h PHE 30 N 0.05 -0.85 0.00 0.67 3.04 -1.09 -2.83 116.94 115.93 2dj1 h PHE 30 Ca 0.30 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.23 2dj1 h PHE 30 Cb 0.48 0.28 0.00 0.00 2.56 0.00 0.00 35.95 39.27 2dj1 h PHE 30 CO -0.43 -0.53 0.00 1.33 -2.02 0.00 0.00 178.31 176.66 2dj1 n VAL 31 N -5.19 0.69 -0.02 1.41 0.24 -0.53 -3.42 118.33 111.51 2dj1 n VAL 31 Ca -0.11 0.17 -0.12 0.00 -2.04 0.00 0.00 64.34 62.23 2dj1 n VAL 31 Cb 0.36 -1.02 -0.06 0.00 -1.47 0.00 0.00 33.84 31.64 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 2.45 -0.61 -1.29 2.33 0.00 0.31 -2.66 119.26 119.79 2dj1 h ALA 32 Ca 0.00 -0.00 -0.70 0.00 0.00 0.00 0.00 54.91 54.20 2dj1 h ALA 32 Cb 0.07 0.84 -0.33 0.00 0.00 0.00 0.00 17.79 18.37 2dj1 h ALA 32 CO 0.00 -0.94 0.34 -0.25 0.00 0.00 0.00 179.25 178.40 2dj1 n ASP 33 N -5.43 6.36 -3.82 0.00 8.00 -1.22 -4.95 116.55 115.48 2dj1 n ASP 33 Ca -0.04 -3.77 -0.20 0.00 0.71 0.00 0.00 54.79 51.49 2dj1 n ASP 33 Cb 0.36 -0.84 -0.17 0.00 -0.02 0.00 0.00 41.12 40.46 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 -3.88 0.57 0.14 -1.24 -0.14 -1.00 -5.03 119.74 109.16 2dj1 s LYS 34 Ca 0.49 0.04 -0.09 0.00 -1.36 0.00 0.00 55.97 55.05 2dj1 s LYS 34 Cb 0.39 -0.78 -0.03 0.00 -1.68 0.00 0.00 37.83 35.73 2dj1 s LYS 34 CO -0.29 -0.18 1.42 -0.44 -0.76 0.00 0.00 175.35 175.09 2dj1 h ASP 35 N 7.65 0.85 -2.61 2.83 3.32 -1.92 -3.42 116.42 123.12 2dj1 h ASP 35 Ca -0.32 -0.48 -0.22 0.00 0.02 0.00 0.00 57.03 56.04 2dj1 h ASP 35 Cb 1.14 -0.24 -0.33 0.00 0.22 0.00 0.00 39.33 40.12 2dj1 h ASP 35 CO 0.38 1.25 -0.53 -0.89 -1.72 0.00 0.00 179.24 177.73 2dj1 s THR 36 N -4.00 -0.44 -0.10 0.35 2.01 -1.26 -1.13 115.64 111.06 2dj1 s THR 36 Ca -0.09 0.13 0.04 0.00 0.31 0.00 0.00 61.69 62.07 2dj1 s THR 36 Cb 0.10 -0.57 -0.00 0.00 0.01 0.00 0.00 72.50 72.04 2dj1 s THR 36 CO 0.88 0.00 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.89 2dj1 s VAL 37 N 2.43 2.16 -0.14 3.82 1.01 -0.63 -4.44 120.40 124.60 2dj1 s VAL 37 Ca 0.04 -0.98 -0.22 0.00 0.00 0.00 0.00 61.98 60.82 2dj1 s VAL 37 Cb -0.13 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 2dj1 s VAL 37 CO -0.11 0.56 0.66 -0.22 0.00 0.00 0.00 175.10 175.99 2dj1 s LEU 38 N 0.36 4.22 -0.01 3.92 2.96 -1.16 -0.54 118.68 128.43 2dj1 s LEU 38 Ca -0.18 0.99 0.07 0.00 -0.22 0.00 0.00 54.13 54.79 2dj1 s LEU 38 Cb -0.18 -2.97 -0.02 0.00 0.50 0.00 0.00 46.19 43.52 2dj1 s LEU 38 CO 0.08 -0.21 -0.22 -0.76 -1.32 0.00 0.00 176.35 173.93 2dj1 s LEU 39 N 1.44 2.34 -0.12 -0.68 1.43 -0.59 -1.48 118.68 121.01 2dj1 s LEU 39 Ca 0.32 -0.41 -0.02 0.00 -1.03 0.00 0.00 54.13 53.00 2dj1 s LEU 39 Cb -0.16 -1.42 0.04 0.00 0.03 0.00 0.00 46.19 44.68 2dj1 s LEU 39 CO 0.13 0.31 0.01 -0.70 0.23 0.00 0.00 176.35 176.33 2dj1 s GLU 40 N -0.87 0.64 0.10 1.70 -6.30 -0.76 -0.19 118.70 113.01 2dj1 s GLU 40 Ca 0.11 -0.10 -0.21 0.00 -2.50 0.00 0.00 54.97 52.27 2dj1 s GLU 40 Cb -0.10 -1.44 -0.07 0.00 0.00 0.00 0.00 34.13 32.52 2dj1 s GLU 40 CO 0.01 -0.44 0.63 -0.06 0.02 0.00 0.00 175.26 175.43 2dj1 s PHE 41 N 1.93 3.83 0.29 5.30 0.40 0.17 -0.58 117.98 129.32 2dj1 s PHE 41 Ca 0.03 1.38 -0.06 0.00 -0.60 0.00 0.00 56.93 57.68 2dj1 s PHE 41 Cb -0.14 -2.59 -0.01 0.00 0.51 0.00 0.00 43.02 40.80 2dj1 s PHE 41 CO -0.06 0.55 0.43 1.52 0.70 0.00 0.00 175.22 178.36 2dj1 s TYR 42 N -1.06 0.85 0.00 0.36 -0.85 -0.84 -1.72 117.35 114.09 2dj1 s TYR 42 Ca 0.31 -1.12 -0.01 0.00 -0.52 0.00 0.00 57.07 55.73 2dj1 s TYR 42 Cb -0.21 -0.06 -0.00 0.00 0.38 0.00 0.00 41.96 42.07 2dj1 s TYR 42 CO 0.21 -1.03 0.01 0.00 -1.52 0.00 0.00 175.55 173.22 2dj1 s ALA 43 N -3.50 -0.00 -0.98 9.51 0.00 -1.26 -3.46 121.76 122.06 2dj1 s ALA 43 Ca 0.29 -0.14 0.14 0.00 0.00 0.00 0.00 51.96 52.25 2dj1 s ALA 43 Cb 0.00 0.03 0.62 0.00 0.00 0.00 0.00 23.12 23.77 2dj1 s ALA 43 CO 0.16 -0.06 1.46 -0.35 0.00 0.00 0.00 175.76 176.97 2dj1 n PRO 44 N 2.60 0.01 -0.01 0.00 -0.04 -1.26 -2.28 135.00 134.01 2dj1 n PRO 44 Ca -0.16 0.26 0.06 0.00 -0.04 0.00 0.00 63.50 63.63 2dj1 n PRO 44 Cb 0.58 -1.51 -0.15 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.53 0.15 -2.19 0.54 4.27 -1.26 -4.86 117.44 112.57 2dj1 n TRP 45 Ca 0.03 0.05 -0.41 0.00 -3.89 0.00 0.00 57.50 53.28 2dj1 n TRP 45 Cb 0.17 -0.68 -0.03 0.00 -1.36 0.00 0.00 31.31 29.41 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 14.32 0.78 -0.44 0.00 0.00 -1.89 -2.90 103.07 112.94 2dj1 h GLY 47 Ca -0.28 -0.37 0.16 0.00 0.00 0.00 0.00 47.33 46.84 2dj1 h GLY 47 CO 1.16 0.35 -0.11 0.45 0.00 0.00 0.00 176.54 178.39 2dj1 h HIS 48 N 0.73 -0.26 -1.89 5.60 3.86 -1.96 0.43 115.15 121.65 2dj1 h HIS 48 Ca 0.18 0.06 0.55 0.00 -1.16 0.00 0.00 60.37 60.00 2dj1 h HIS 48 Cb 0.12 0.23 -0.08 0.00 1.06 0.00 0.00 27.41 28.74 2dj1 h HIS 48 CO 0.01 -0.29 1.36 0.00 0.86 0.00 0.00 177.93 179.86 2dj1 h LYS 50 N 0.00 -0.19 0.00 0.00 2.10 -0.32 2.16 116.57 120.32 2dj1 h LYS 50 Ca 0.91 0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.57 2dj1 h LYS 50 Cb 3.62 0.04 0.00 0.00 -0.90 0.00 0.00 32.23 34.99 2dj1 h LYS 50 CO -0.03 -0.13 0.00 1.96 -2.00 0.00 0.00 179.45 179.26 2dj1 h GLN 51 N -0.20 0.00 -0.15 0.07 4.20 -0.84 -3.03 115.11 115.17 2dj1 h GLN 51 Ca 0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.91 2dj1 h GLN 51 Cb 0.52 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.30 2dj1 h GLN 51 CO -0.58 0.00 0.00 0.34 -0.67 0.00 0.00 178.83 177.92 2dj1 n PHE 52 N -3.06 0.17 0.15 2.96 7.35 0.43 -4.14 117.46 121.33 2dj1 n PHE 52 Ca 0.03 -0.09 -0.07 0.00 -0.76 0.00 0.00 57.45 56.57 2dj1 n PHE 52 Cb 0.49 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.28 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 4.44 -0.48 0.00 3.13 0.00 0.35 -2.71 119.26 124.00 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 0.78 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2dj1 h ALA 53 CO 0.00 -0.44 0.00 -1.00 0.00 0.00 0.00 179.25 177.81 2dj1 h PRO 54 N -1.04 0.00 0.21 0.00 0.13 -1.77 -2.94 132.00 126.60 2dj1 h PRO 54 Ca -0.05 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.76 2dj1 h PRO 54 Cb 0.34 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.50 2dj1 h PRO 54 CO 0.08 0.00 -1.41 1.49 -0.23 0.00 0.00 178.00 177.93 2dj1 h GLU 55 N 0.00 0.51 -0.29 0.86 4.81 -1.72 -3.09 114.58 115.66 2dj1 h GLU 55 Ca 0.00 -0.83 -0.09 0.00 -0.13 0.00 0.00 59.36 58.31 2dj1 h GLU 55 Cb 0.41 0.30 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 2dj1 h GLU 55 CO 0.00 1.39 -0.16 -0.92 -0.73 0.00 0.00 179.01 178.60 2dj1 h TYR 56 N 0.15 0.72 -0.41 0.92 3.20 -1.31 -3.10 116.97 117.14 2dj1 h TYR 56 Ca -0.23 -0.18 0.02 0.00 3.14 0.00 0.00 58.73 61.49 2dj1 h TYR 56 Cb 2.10 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 40.18 2dj1 h TYR 56 CO 0.11 0.86 0.22 1.05 -1.64 0.00 0.00 178.16 178.77 2dj1 h GLU 57 N 0.36 0.44 -0.52 1.82 4.11 -1.64 -1.33 114.58 117.83 2dj1 h GLU 57 Ca 0.06 -0.03 0.14 0.00 0.07 0.00 0.00 59.36 59.61 2dj1 h GLU 57 Cb 0.68 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 2dj1 h GLU 57 CO 0.05 0.29 0.37 0.87 0.07 0.00 0.00 179.01 180.66 2dj1 h LYS 58 N 0.45 0.04 -0.01 1.06 1.57 -1.52 -0.29 116.57 117.87 2dj1 h LYS 58 Ca 0.17 -0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.70 2dj1 h LYS 58 Cb 0.04 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.35 2dj1 h LYS 58 CO -0.10 0.03 -0.97 0.82 -0.57 0.00 0.00 179.45 178.66 2dj1 h ILE 59 N 0.04 1.34 -0.02 1.86 2.04 -1.19 -3.08 117.51 118.50 2dj1 h ILE 59 Ca 0.25 -2.32 0.02 0.00 1.00 0.00 0.00 64.86 63.81 2dj1 h ILE 59 Cb 0.93 2.36 -0.05 0.00 -0.74 0.00 0.00 36.82 39.32 2dj1 h ILE 59 CO -0.01 0.71 -0.47 0.00 0.00 0.00 0.00 178.15 178.37 2dj1 h ALA 60 N 0.59 -0.89 -0.53 1.87 0.00 -0.47 0.11 119.26 119.96 2dj1 h ALA 60 Ca -0.10 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.79 2dj1 h ALA 60 Cb 1.61 0.91 -0.05 0.00 0.00 0.00 0.00 17.79 20.26 2dj1 h ALA 60 CO 0.18 -1.03 0.26 1.03 0.00 0.00 0.00 179.25 179.69 2dj1 h SER 61 N -0.57 0.37 -0.16 0.00 0.87 -1.66 0.21 113.55 112.60 2dj1 h SER 61 Ca 0.01 0.03 0.05 0.00 -1.23 0.00 0.00 61.79 60.66 2dj1 h SER 61 Cb 0.62 -0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 62.49 2dj1 h SER 61 CO -0.33 0.25 -0.23 0.74 -0.53 0.00 0.00 176.83 176.73 2dj1 h THR 62 N 0.50 0.43 0.00 2.23 2.02 -1.31 0.65 112.91 117.44 2dj1 h THR 62 Ca 0.24 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.42 2dj1 h THR 62 Cb 0.16 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.00 2dj1 h THR 62 CO -0.17 0.00 0.00 0.18 0.37 0.00 0.00 175.52 175.90 2dj1 n LEU 63 N -5.36 0.10 0.17 2.58 4.77 0.34 -3.45 117.00 116.15 2dj1 n LEU 63 Ca -0.02 0.52 -0.12 0.00 -0.03 0.00 0.00 56.01 56.35 2dj1 n LEU 63 Cb 0.28 -0.49 -0.07 0.00 -2.33 0.00 0.00 43.42 40.80 2dj1 n LEU 63 CO 0.18 -0.14 0.47 0.50 -1.33 0.00 0.00 177.39 177.07 2dj1 h LYS 64 N 0.00 -0.44 -1.00 3.23 3.64 0.18 -2.63 116.57 119.55 2dj1 h LYS 64 Ca 0.00 0.03 -0.32 0.00 -1.27 0.00 0.00 60.65 59.09 2dj1 h LYS 64 Cb 0.42 0.10 -0.19 0.00 -0.41 0.00 0.00 32.23 32.15 2dj1 h LYS 64 CO 0.00 -0.11 0.41 -0.25 -2.27 0.00 0.00 179.45 177.22 2dj1 n ASP 65 N -5.13 3.46 -4.98 4.20 9.92 -1.00 -4.40 116.55 118.63 2dj1 n ASP 65 Ca -0.09 -2.99 -0.20 0.00 -0.53 0.00 0.00 54.79 50.97 2dj1 n ASP 65 Cb 0.27 -0.71 -0.01 0.00 -0.64 0.00 0.00 41.12 40.03 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 -0.42 6.13 -0.16 -2.24 2.47 -1.20 -5.03 114.94 114.49 2dj1 s ASN 66 Ca 0.35 -0.02 0.02 0.00 0.42 0.00 0.00 52.86 53.63 2dj1 s ASN 66 Cb 0.30 -1.56 0.02 0.00 -1.45 0.00 0.00 41.25 38.55 2dj1 s ASN 66 CO 0.07 -0.29 -0.20 -1.81 -3.72 0.00 0.00 177.10 171.15 2dj1 s ASP 67 N -4.09 3.07 0.90 -4.21 1.11 -1.26 -1.45 116.67 110.74 2dj1 s ASP 67 Ca 0.40 -0.62 -0.12 0.00 0.18 0.00 0.00 52.55 52.40 2dj1 s ASP 67 Cb -0.09 -1.44 0.13 0.00 1.07 0.00 0.00 42.92 42.59 2dj1 s ASP 67 CO 0.31 0.03 1.09 -2.16 1.18 0.00 0.00 175.17 175.62 2dj1 s PRO 68 N 1.11 1.25 -0.39 8.23 0.04 -1.26 -5.03 135.00 138.96 2dj1 s PRO 68 Ca 0.00 0.82 -0.28 0.00 0.04 0.00 0.00 61.00 61.58 2dj1 s PRO 68 Cb -0.14 -1.81 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 2dj1 s PRO 68 CO -0.08 -2.25 1.72 -1.25 0.04 0.00 0.00 177.00 175.18 2dj1 s PRO 69 N -4.93 3.29 0.06 0.56 0.04 -0.53 -4.99 135.00 128.50 2dj1 s PRO 69 Ca 0.63 1.20 0.03 0.00 0.04 0.00 0.00 61.00 62.91 2dj1 s PRO 69 Cb -0.18 -4.19 -0.04 0.00 0.04 0.00 0.00 34.50 30.14 2dj1 s PRO 69 CO 0.57 -1.91 0.06 0.42 0.04 0.00 0.00 177.00 176.17 2dj1 s ILE 70 N 6.86 4.42 -0.23 0.56 1.01 -1.00 -5.00 121.20 127.83 2dj1 s ILE 70 Ca 0.74 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 60.65 2dj1 s ILE 70 Cb -0.19 -3.10 0.03 0.00 0.01 0.00 0.00 42.46 39.21 2dj1 s ILE 70 CO 0.32 0.18 -0.12 0.00 0.00 0.00 0.00 174.94 175.32 2dj1 s ALA 71 N -1.32 2.55 0.01 9.38 0.00 -1.26 -3.72 121.76 127.39 2dj1 s ALA 71 Ca 0.27 -1.45 -0.22 0.00 0.00 0.00 0.00 51.96 50.55 2dj1 s ALA 71 Cb -0.12 -1.50 -0.05 0.00 0.00 0.00 0.00 23.12 21.45 2dj1 s ALA 71 CO 0.19 -0.75 0.66 0.08 0.00 0.00 0.00 175.76 175.94 2dj1 s VAL 72 N 1.26 4.86 0.05 0.00 1.01 -1.26 -2.97 120.40 123.34 2dj1 s VAL 72 Ca -0.00 1.38 -0.01 0.00 0.00 0.00 0.00 61.98 63.34 2dj1 s VAL 72 Cb -0.16 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 2dj1 s VAL 72 CO -0.07 0.39 -0.03 0.00 0.00 0.00 0.00 175.10 175.39 2dj1 s ALA 73 N -0.09 0.48 0.25 5.51 0.00 -0.55 -1.77 121.76 125.59 2dj1 s ALA 73 Ca 0.34 -1.18 0.11 0.00 0.00 0.00 0.00 51.96 51.24 2dj1 s ALA 73 Cb -0.19 0.27 -0.05 0.00 0.00 0.00 0.00 23.12 23.15 2dj1 s ALA 73 CO 0.19 -0.36 -0.18 -1.59 0.00 0.00 0.00 175.76 173.82 2dj1 s LYS 74 N -3.82 1.73 -0.04 0.00 -2.85 0.12 -1.83 119.74 113.06 2dj1 s LYS 74 Ca 0.06 -1.64 -0.02 0.00 -1.00 0.00 0.00 55.97 53.36 2dj1 s LYS 74 Cb 0.07 -1.85 0.02 0.00 -2.06 0.00 0.00 37.83 34.01 2dj1 s LYS 74 CO -0.10 0.36 0.09 0.42 0.10 0.00 0.00 175.35 176.22 2dj1 s ILE 75 N -2.25 -0.02 -1.01 3.79 1.01 0.25 -1.93 121.20 121.05 2dj1 s ILE 75 Ca 0.28 0.08 -0.17 0.00 0.00 0.00 0.00 60.65 60.84 2dj1 s ILE 75 Cb -0.06 -0.15 0.16 0.00 0.01 0.00 0.00 42.46 42.42 2dj1 s ILE 75 CO 0.14 0.03 1.18 1.51 0.00 0.00 0.00 174.94 177.81 2dj1 s ASP 76 N 0.48 6.79 0.36 3.58 1.47 -1.26 -1.99 116.67 126.10 2dj1 s ASP 76 Ca -0.04 -2.43 0.18 0.00 1.18 0.00 0.00 52.55 51.44 2dj1 s ASP 76 Cb -0.05 -2.38 1.20 0.00 -0.34 0.00 0.00 42.92 41.35 2dj1 s ASP 76 CO -0.02 -0.90 1.64 0.00 0.68 0.00 0.00 175.17 176.57 2dj1 h ALA 77 N 8.18 2.09 -0.97 2.11 0.00 -1.78 0.86 119.26 129.76 2dj1 h ALA 77 Ca 0.20 0.21 0.08 0.00 0.00 0.00 0.00 54.91 55.40 2dj1 h ALA 77 Cb 0.98 0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.91 2dj1 h ALA 77 CO 1.11 -0.76 0.61 1.79 0.00 0.00 0.00 179.25 182.00 2dj1 h THR 78 N 0.20 1.03 0.00 0.00 1.35 -1.90 -2.24 112.91 111.35 2dj1 h THR 78 Ca 0.78 -0.37 -0.25 0.00 -0.55 0.00 0.00 66.41 66.02 2dj1 h THR 78 Cb 1.93 -0.14 -0.04 0.00 -1.73 0.00 0.00 68.15 68.17 2dj1 h THR 78 CO -0.64 0.20 -1.41 0.28 -0.25 0.00 0.00 175.52 173.70 2dj1 h SER 79 N 1.07 0.00 -3.44 5.36 0.02 0.17 -3.43 113.55 113.30 2dj1 h SER 79 Ca 0.44 0.00 -0.72 0.00 -0.84 0.00 0.00 61.79 60.67 2dj1 h SER 79 Cb 0.26 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 62.55 2dj1 h SER 79 CO -0.20 0.97 -0.44 0.00 -1.14 0.00 0.00 176.83 176.02 2dj1 s ALA 80 N -2.66 3.36 -0.13 3.77 0.00 0.87 -4.95 121.76 122.02 2dj1 s ALA 80 Ca -0.02 -2.03 -0.11 0.00 0.00 0.00 0.00 51.96 49.80 2dj1 s ALA 80 Cb 0.09 -2.76 -0.08 0.00 0.00 0.00 0.00 23.12 20.37 2dj1 s ALA 80 CO 0.82 -1.61 0.11 0.77 0.00 0.00 0.00 175.76 175.85 2dj1 h SER 81 N 8.51 0.00 -0.17 0.00 0.02 -1.84 -3.19 113.55 116.89 2dj1 h SER 81 Ca -0.25 -0.24 0.03 0.00 -0.84 0.00 0.00 61.79 60.49 2dj1 h SER 81 Cb 1.10 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.59 2dj1 h SER 81 CO 0.77 0.79 -0.37 -0.03 -1.14 0.00 0.00 176.83 176.84 2dj1 h MET 82 N -1.00 -0.33 -0.59 3.45 1.85 -1.93 -0.32 114.93 116.06 2dj1 h MET 82 Ca -0.05 0.02 0.12 0.00 -0.61 0.00 0.00 59.70 59.19 2dj1 h MET 82 Cb 0.49 0.08 -0.11 0.00 0.43 0.00 0.00 31.60 32.49 2dj1 h MET 82 CO -0.03 -0.22 -0.12 -0.07 -0.40 0.00 0.00 176.91 176.07 2dj1 h LEU 83 N -0.34 -0.49 -0.31 3.39 3.38 -1.97 -0.85 115.31 118.11 2dj1 h LEU 83 Ca 0.03 0.17 0.07 0.00 0.09 0.00 0.00 57.88 58.25 2dj1 h LEU 83 Cb 0.44 0.34 -0.08 0.00 0.09 0.00 0.00 40.66 41.45 2dj1 h LEU 83 CO -0.34 -0.18 -0.24 0.00 0.09 0.00 0.00 178.44 177.77 2dj1 h ALA 84 N 1.58 -0.07 0.00 1.53 0.00 -1.30 0.14 119.26 121.13 2dj1 h ALA 84 Ca 0.29 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 2dj1 h ALA 84 Cb 0.44 0.53 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 2dj1 h ALA 84 CO -0.59 -0.65 -0.02 0.77 0.00 0.00 0.00 179.25 178.77 2dj1 h SER 85 N -0.21 0.00 0.42 0.00 0.02 0.12 0.11 113.55 114.01 2dj1 h SER 85 Ca 0.16 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 2dj1 h SER 85 Cb 0.46 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 2dj1 h SER 85 CO -0.44 0.02 -0.33 0.50 -1.14 0.00 0.00 176.83 175.45 2dj1 h LYS 86 N 0.00 -0.71 -0.98 3.45 3.64 0.59 -2.60 116.57 119.96 2dj1 h LYS 86 Ca -0.00 0.05 -0.42 0.00 -1.27 0.00 0.00 60.65 59.01 2dj1 h LYS 86 Cb 0.05 0.16 -0.25 0.00 -0.41 0.00 0.00 32.23 31.78 2dj1 h LYS 86 CO 0.00 -0.47 0.53 1.19 -2.27 0.00 0.00 179.45 178.43 2dj1 n PHE 87 N -5.45 2.61 -4.34 1.91 3.01 -1.06 -4.90 117.46 109.24 2dj1 n PHE 87 Ca -0.11 -1.60 -0.36 0.00 1.01 0.00 0.00 57.45 56.39 2dj1 n PHE 87 Cb 0.35 -0.83 -0.08 0.00 -0.01 0.00 0.00 39.48 38.90 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 -0.83 -0.66 -4.55 4.37 2.03 -0.80 -4.74 116.55 111.36 2dj1 n ASP 88 Ca 0.50 -1.20 -0.35 0.00 0.52 0.00 0.00 54.79 54.26 2dj1 n ASP 88 Cb 1.49 -1.52 -0.04 0.00 -0.72 0.00 0.00 41.12 40.33 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 -3.63 3.27 -0.26 5.18 1.01 0.33 -4.77 120.40 121.53 2dj1 s VAL 89 Ca 0.48 0.06 0.09 0.00 0.00 0.00 0.00 61.98 62.60 2dj1 s VAL 89 Cb -0.28 -3.68 0.44 0.00 0.00 0.00 0.00 36.38 32.86 2dj1 s VAL 89 CO 0.97 -0.66 1.21 -0.24 0.00 0.00 0.00 175.10 176.38 2dj1 n SER 90 N 14.05 3.61 -3.57 3.32 2.88 -1.26 -4.82 113.62 127.83 2dj1 n SER 90 Ca 0.29 -3.82 0.03 0.00 -1.33 0.00 0.00 58.87 54.04 2dj1 n SER 90 Cb 0.51 -0.42 -0.00 0.00 -0.75 0.00 0.00 64.21 63.55 2dj1 n SER 90 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dj1 s GLY 91 N -3.44 -0.48 -0.04 0.46 0.00 -1.26 -5.19 107.32 97.37 2dj1 s GLY 91 Ca 0.46 0.95 -0.29 0.00 0.00 0.00 0.00 44.72 45.83 2dj1 s GLY 91 CO -0.01 0.18 0.79 -0.19 0.00 0.00 0.00 173.10 173.88 2dj1 s TYR 92 N -2.10 -0.50 0.36 1.90 1.51 -1.26 -4.12 117.35 113.14 2dj1 s TYR 92 Ca 0.15 0.69 -0.27 0.00 -1.01 0.00 0.00 57.07 56.63 2dj1 s TYR 92 Cb 0.07 0.47 -0.09 0.00 -0.11 0.00 0.00 41.96 42.30 2dj1 s TYR 92 CO -0.06 -0.57 1.21 -1.25 -1.11 0.00 0.00 175.55 173.77 2dj1 s PRO 93 N -1.96 4.26 -0.06 -1.71 0.04 -1.26 -5.04 135.00 129.27 2dj1 s PRO 93 Ca -0.04 1.97 0.04 0.00 0.04 0.00 0.00 61.00 63.01 2dj1 s PRO 93 Cb -0.00 -2.91 0.00 0.00 0.04 0.00 0.00 34.50 31.63 2dj1 s PRO 93 CO 0.00 -0.18 -0.18 0.99 0.04 0.00 0.00 177.00 177.67 2dj1 s THR 94 N -1.27 1.54 -0.06 1.26 2.01 -0.70 -5.01 115.64 113.41 2dj1 s THR 94 Ca 0.52 -0.75 0.03 0.00 0.31 0.00 0.00 61.69 61.80 2dj1 s THR 94 Cb -0.34 -1.34 -0.02 0.00 0.01 0.00 0.00 72.50 70.80 2dj1 s THR 94 CO 0.44 0.44 -0.14 -0.63 -0.69 0.00 0.00 174.62 174.05 2dj1 s ILE 95 N 0.27 3.09 0.22 1.82 1.01 -1.26 0.41 121.20 126.76 2dj1 s ILE 95 Ca -0.10 -0.70 -0.01 0.00 0.00 0.00 0.00 60.65 59.83 2dj1 s ILE 95 Cb -0.14 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.07 2dj1 s ILE 95 CO 0.04 0.58 0.18 -0.54 0.00 0.00 0.00 174.94 175.21 2dj1 s LYS 96 N -0.55 1.29 -0.03 2.79 -0.14 0.73 -3.68 119.74 120.15 2dj1 s LYS 96 Ca 0.08 -1.63 -0.01 0.00 -1.36 0.00 0.00 55.97 53.05 2dj1 s LYS 96 Cb -0.11 0.30 0.02 0.00 -1.68 0.00 0.00 37.83 36.35 2dj1 s LYS 96 CO 0.01 -0.44 0.06 0.42 -0.76 0.00 0.00 175.35 174.64 2dj1 s ILE 97 N -4.06 -0.04 -0.37 2.17 1.01 -1.11 -1.55 121.20 117.25 2dj1 s ILE 97 Ca 0.37 0.14 -0.13 0.00 0.00 0.00 0.00 60.65 61.04 2dj1 s ILE 97 Cb 0.06 -0.11 0.01 0.00 0.01 0.00 0.00 42.46 42.43 2dj1 s ILE 97 CO 0.13 0.06 0.25 -0.22 0.00 0.00 0.00 174.94 175.16 2dj1 s LEU 98 N 0.75 4.77 -0.40 2.97 2.96 0.30 -0.44 118.68 129.59 2dj1 s LEU 98 Ca -0.06 -0.77 -0.09 0.00 -0.22 0.00 0.00 54.13 52.99 2dj1 s LEU 98 Cb -0.09 -2.10 0.07 0.00 0.50 0.00 0.00 46.19 44.57 2dj1 s LEU 98 CO -0.03 -0.36 0.23 -0.75 -1.32 0.00 0.00 176.35 174.13 2dj1 s LYS 99 N 1.65 2.59 -0.44 1.98 2.47 0.20 -1.61 119.74 126.58 2dj1 s LYS 99 Ca 0.04 -1.41 0.00 0.00 -1.56 0.00 0.00 55.97 53.04 2dj1 s LYS 99 Cb -0.18 -3.72 0.00 0.00 -1.46 0.00 0.00 37.83 32.46 2dj1 s LYS 99 CO 0.09 -0.90 0.00 1.63 0.16 0.00 0.00 175.35 176.33 2dj1 n LYS 100 N 4.89 -2.04 0.00 4.03 5.02 -0.29 0.16 118.16 129.94 2dj1 n LYS 100 Ca -0.10 0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 2dj1 n LYS 100 Cb 0.43 -4.60 0.00 0.00 -0.02 0.00 0.00 35.03 30.84 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 -0.40 1.12 3.21 0.72 0.00 -1.26 -5.09 105.19 103.50 2dj1 n GLY 101 Ca -0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.22 3.01 -0.44 1.61 2.00 0.43 -5.07 119.66 120.98 2dj1 s GLN 102 Ca 0.00 -0.86 -0.28 0.00 -2.00 0.00 0.00 55.36 52.22 2dj1 s GLN 102 Cb 0.00 -2.91 0.00 0.00 0.80 0.00 0.00 33.01 30.91 2dj1 s GLN 102 CO 0.00 -0.31 1.49 0.00 -0.50 0.00 0.00 175.29 175.98 2dj1 s ALA 103 N 1.36 2.92 -0.45 1.58 0.00 -1.26 -0.63 121.76 125.28 2dj1 s ALA 103 Ca 0.03 -0.23 -0.16 0.00 0.00 0.00 0.00 51.96 51.59 2dj1 s ALA 103 Cb -0.15 -4.01 0.05 0.00 0.00 0.00 0.00 23.12 19.01 2dj1 s ALA 103 CO -0.06 -2.63 0.40 0.08 0.00 0.00 0.00 175.76 173.56 2dj1 s VAL 104 N 5.98 5.17 0.20 0.00 1.01 0.42 -4.97 120.40 128.20 2dj1 s VAL 104 Ca 0.63 -0.74 -0.31 0.00 0.00 0.00 0.00 61.98 61.55 2dj1 s VAL 104 Cb -0.14 -4.07 -0.10 0.00 0.00 0.00 0.00 36.38 32.06 2dj1 s VAL 104 CO 0.31 -0.50 1.54 -0.62 0.00 0.00 0.00 175.10 175.83 2dj1 s ASP 105 N 2.19 6.58 -0.27 3.32 2.15 -1.26 -2.74 116.67 126.64 2dj1 s ASP 105 Ca 0.07 2.67 -0.09 0.00 0.43 0.00 0.00 52.55 55.63 2dj1 s ASP 105 Cb -0.21 -2.60 -0.03 0.00 -0.30 0.00 0.00 42.92 39.78 2dj1 s ASP 105 CO 0.10 -0.81 0.12 -0.47 -0.17 0.00 0.00 175.17 173.94 2dj1 s TYR 106 N 0.76 3.14 -0.34 -5.34 5.04 -1.24 -4.99 117.35 114.38 2dj1 s TYR 106 Ca 0.67 -0.30 0.04 0.00 -2.44 0.00 0.00 57.07 55.04 2dj1 s TYR 106 Cb -0.44 -2.30 0.10 0.00 0.35 0.00 0.00 41.96 39.67 2dj1 s TYR 106 CO 0.36 -0.32 0.06 0.34 -1.34 0.00 0.00 175.55 174.64 2dj1 s ASP 107 N 1.66 4.69 -0.09 4.32 2.15 -1.26 -4.81 116.67 123.33 2dj1 s ASP 107 Ca 0.06 -2.12 -0.29 0.00 0.43 0.00 0.00 52.55 50.63 2dj1 s ASP 107 Cb -0.16 -1.55 0.09 0.00 -0.30 0.00 0.00 42.92 41.00 2dj1 s ASP 107 CO 0.06 -0.38 1.29 0.61 -0.17 0.00 0.00 175.17 176.58 2dj1 n GLY 108 N 4.29 0.10 3.57 2.66 0.00 -1.26 -5.10 105.19 109.45 2dj1 n GLY 108 Ca 0.03 -1.00 -0.41 0.00 0.00 0.00 0.00 46.02 44.65 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 -3.80 6.02 -0.80 1.61 0.01 -1.26 -4.90 113.70 110.58 2dj1 s SER 109 Ca 0.31 0.13 -0.26 0.00 1.31 0.00 0.00 55.95 57.44 2dj1 s SER 109 Cb -0.00 -2.55 -0.17 0.00 0.21 0.00 0.00 66.02 63.51 2dj1 s SER 109 CO -0.03 -1.83 2.50 -2.11 0.41 0.00 0.00 173.24 172.19 2dj1 n ARG 110 N 8.89 0.42 -3.97 12.44 1.85 -1.26 -4.51 116.66 130.52 2dj1 n ARG 110 Ca 0.11 -0.10 -0.08 0.00 -1.00 0.00 0.00 57.85 56.78 2dj1 n ARG 110 Cb 0.50 -2.36 -0.08 0.00 -1.05 0.00 0.00 32.46 29.46 2dj1 n ARG 110 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2dj1 s THR 111 N 9.65 0.16 0.42 8.89 -4.23 -1.26 -4.97 115.64 124.30 2dj1 s THR 111 Ca 1.18 -1.48 0.19 0.00 -1.18 0.00 0.00 61.69 60.39 2dj1 s THR 111 Cb -0.70 -1.52 0.20 0.00 1.34 0.00 0.00 72.50 71.82 2dj1 s THR 111 CO 0.38 -0.71 1.99 -0.61 -0.54 0.00 0.00 174.62 175.12 2dj1 h GLN 112 N 2.87 0.00 0.16 3.99 4.15 -1.89 0.17 115.11 124.57 2dj1 h GLN 112 Ca -0.34 0.00 -0.29 0.00 0.77 0.00 0.00 58.65 58.79 2dj1 h GLN 112 Cb 1.18 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.88 2dj1 h GLN 112 CO 0.59 0.20 -1.39 1.05 -1.93 0.00 0.00 178.83 177.35 2dj1 h GLU 113 N 0.00 0.34 0.08 1.69 4.11 -1.96 -3.21 114.58 115.64 2dj1 h GLU 113 Ca -0.00 -0.58 -0.00 0.00 0.07 0.00 0.00 59.36 58.84 2dj1 h GLU 113 Cb 0.40 0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2dj1 h GLU 113 CO 0.03 1.28 -0.04 0.93 0.07 0.00 0.00 179.01 181.28 2dj1 h GLU 114 N -0.14 -0.11 -0.96 1.06 4.39 -1.78 -1.53 114.58 115.50 2dj1 h GLU 114 Ca -0.27 0.01 0.31 0.00 0.34 0.00 0.00 59.36 59.75 2dj1 h GLU 114 Cb 1.89 0.02 -0.16 0.00 -0.10 0.00 0.00 28.75 30.40 2dj1 h GLU 114 CO 0.14 -0.07 0.35 0.82 -1.16 0.00 0.00 179.01 179.09 2dj1 h ILE 115 N -0.31 0.16 -0.01 3.13 2.04 -0.89 1.33 117.51 122.96 2dj1 h ILE 115 Ca -0.01 -0.05 -0.14 0.00 1.00 0.00 0.00 64.86 65.66 2dj1 h ILE 115 Cb 0.08 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.16 2dj1 h ILE 115 CO 0.02 0.03 -0.64 0.58 0.00 0.00 0.00 178.15 178.13 2dj1 h VAL 116 N 0.14 1.46 0.00 1.67 2.07 -1.66 -1.14 116.25 118.78 2dj1 h VAL 116 Ca 0.68 -2.19 -0.05 0.00 0.82 0.00 0.00 66.70 65.97 2dj1 h VAL 116 Cb 1.57 2.18 -0.01 0.00 -1.52 0.00 0.00 31.29 33.51 2dj1 h VAL 116 CO -0.73 0.63 -0.22 0.00 0.02 0.00 0.00 177.57 177.27 2dj1 h ALA 117 N 1.33 1.34 0.00 1.67 0.00 0.28 -2.31 119.26 121.57 2dj1 h ALA 117 Ca -0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 2dj1 h ALA 117 Cb 1.14 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2dj1 h ALA 117 CO 0.09 0.27 -0.81 1.17 0.00 0.00 0.00 179.25 179.96 2dj1 n LYS 118 N -3.84 0.49 0.27 0.00 3.00 -0.65 -3.52 118.16 113.91 2dj1 n LYS 118 Ca -0.02 0.43 0.13 0.00 -0.00 0.00 0.00 58.31 58.86 2dj1 n LYS 118 Cb 0.31 -1.62 0.59 0.00 0.00 0.00 0.00 35.03 34.32 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 -1.00 0.05 0.12 3.15 2.07 -1.29 0.60 116.25 119.94 2dj1 h VAL 119 Ca -0.07 0.00 -0.33 0.00 0.82 0.00 0.00 66.70 67.13 2dj1 h VAL 119 Cb 0.77 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 2dj1 h VAL 119 CO -0.04 0.00 -1.70 0.03 0.02 0.00 0.00 177.57 175.88 2dj1 h ARG 120 N 0.00 0.25 -0.01 1.57 3.08 -1.58 -3.11 114.38 114.58 2dj1 h ARG 120 Ca 0.06 -0.42 -0.11 0.00 0.07 0.00 0.00 59.98 59.58 2dj1 h ARG 120 Cb 1.18 0.16 0.01 0.00 0.08 0.00 0.00 29.97 31.39 2dj1 h ARG 120 CO -0.00 1.09 -0.41 1.05 -1.07 0.00 0.00 179.97 180.63 2dj1 h GLU 121 N 0.07 0.30 0.00 0.04 4.11 0.00 -3.23 114.58 115.87 2dj1 h GLU 121 Ca -0.31 -0.30 -0.04 0.00 0.07 0.00 0.00 59.36 58.78 2dj1 h GLU 121 Cb 2.04 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 31.36 2dj1 h GLU 121 CO 0.14 1.00 -0.17 0.28 0.07 0.00 0.00 179.01 180.32 2dj1 h VAL 122 N -0.28 0.78 0.00 -1.06 2.07 -0.93 -1.96 116.25 114.86 2dj1 h VAL 122 Ca -0.05 -0.68 -0.04 0.00 0.82 0.00 0.00 66.70 66.75 2dj1 h VAL 122 Cb 1.13 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 2dj1 h VAL 122 CO 0.08 0.17 -0.18 0.77 0.02 0.00 0.00 177.57 178.43 2dj1 h SER 123 N 0.00 0.00 -3.96 0.57 4.64 -1.55 -3.44 113.55 109.80 2dj1 h SER 123 Ca -0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2dj1 h SER 123 Cb 0.39 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 62.57 2dj1 h SER 123 CO 0.02 0.18 0.60 -1.10 -0.87 0.00 0.00 176.83 175.66 2dj1 s GLN 124 N -3.91 3.86 0.38 4.77 -1.52 -0.74 -4.85 119.66 117.65 2dj1 s GLN 124 Ca -0.01 2.12 0.17 0.00 -1.95 0.00 0.00 55.36 55.69 2dj1 s GLN 124 Cb 0.12 -2.67 0.75 0.00 -0.22 0.00 0.00 33.01 30.98 2dj1 s GLN 124 CO 0.61 -0.57 1.79 -1.00 -0.25 0.00 0.00 175.29 175.87 2dj1 h PRO 125 N 2.49 0.00 0.02 2.91 0.13 -1.87 -3.02 132.00 132.66 2dj1 h PRO 125 Ca -0.50 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.41 2dj1 h PRO 125 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 2dj1 h PRO 125 CO 0.62 0.38 -0.97 -0.44 -0.23 0.00 0.00 178.00 177.36 2dj1 h ASP 126 N 0.00 0.42 -1.87 1.44 3.32 -1.92 -3.46 116.42 114.35 2dj1 h ASP 126 Ca -0.00 -0.35 -0.63 0.00 0.02 0.00 0.00 57.03 56.07 2dj1 h ASP 126 Cb 0.78 -0.13 0.12 0.00 0.22 0.00 0.00 39.33 40.32 2dj1 h ASP 126 CO 0.05 1.17 -0.35 1.87 -1.72 0.00 0.00 179.24 180.26 2dj1 n TRP 127 N -3.68 -0.15 -4.07 4.55 -0.00 -1.14 -4.99 117.44 107.96 2dj1 n TRP 127 Ca -0.06 0.76 -0.13 0.00 -0.00 0.00 0.00 57.50 58.06 2dj1 n TRP 127 Cb 0.86 -2.03 -0.12 0.00 -0.00 0.00 0.00 31.31 30.01 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 -1.22 0.52 0.08 5.87 -4.23 -1.26 -5.00 115.64 110.40 2dj1 s THR 128 Ca 0.62 -0.97 -0.31 0.00 -1.18 0.00 0.00 61.69 59.84 2dj1 s THR 128 Cb -0.74 -0.58 -0.07 0.00 1.34 0.00 0.00 72.50 72.45 2dj1 s THR 128 CO 0.58 -0.32 1.39 -2.16 -0.54 0.00 0.00 174.62 173.57 2dj1 s PRO 129 N -1.40 4.32 0.98 3.99 0.04 -1.26 -5.02 135.00 136.64 2dj1 s PRO 129 Ca -0.09 2.03 -0.12 0.00 0.04 0.00 0.00 61.00 62.86 2dj1 s PRO 129 Cb -0.09 -3.35 0.18 0.00 0.04 0.00 0.00 34.50 31.27 2dj1 s PRO 129 CO 0.00 -0.47 1.09 -1.25 0.04 0.00 0.00 177.00 176.42 2dj1 s PRO 130 N 1.49 0.59 1.01 0.56 0.04 -1.26 -5.05 135.00 132.38 2dj1 s PRO 130 Ca 0.64 0.58 -0.17 0.00 0.04 0.00 0.00 61.00 62.09 2dj1 s PRO 130 Cb -0.35 -1.75 0.25 0.00 0.04 0.00 0.00 34.50 32.69 2dj1 s PRO 130 CO 0.29 -2.64 0.90 -0.35 0.04 0.00 0.00 177.00 175.24 2dj1 n PRO 131 N -4.12 -2.78 -3.90 0.56 -0.04 -1.26 -4.22 135.00 119.24 2dj1 n PRO 131 Ca 0.06 -1.44 -0.28 0.00 -0.04 0.00 0.00 63.50 61.79 2dj1 n PRO 131 Cb 0.57 -1.35 0.02 0.00 -0.04 0.00 0.00 33.50 32.70 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 -4.26 -5.05 -3.00 0.54 2.13 -1.26 -4.94 120.64 104.81 2dj1 n GLU 132 Ca 0.12 0.57 -0.38 0.00 0.66 0.00 0.00 57.16 58.13 2dj1 n GLU 132 Cb 0.48 -5.32 -0.06 0.00 0.27 0.00 0.00 31.44 26.81 2dj1 n GLU 132 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2dj1 s VAL 133 N -3.43 4.42 -1.17 6.31 0.11 -1.26 -3.91 120.40 121.46 2dj1 s VAL 133 Ca 0.48 1.58 -0.14 0.00 -2.93 0.00 0.00 61.98 60.98 2dj1 s VAL 133 Cb -0.24 -4.04 0.13 0.00 -1.53 0.00 0.00 36.38 30.70 2dj1 s VAL 133 CO 0.84 0.39 0.39 0.35 -3.33 0.00 0.00 175.10 173.74 2dj1 n THR 134 N 1.23 -0.20 -0.24 5.04 -2.24 -1.26 -4.78 114.28 111.82 2dj1 n THR 134 Ca -0.04 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.70 2dj1 n THR 134 Cb 0.50 -0.60 0.02 0.00 -2.10 0.00 0.00 70.33 68.14 2dj1 n THR 134 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2dj1 h SER 135 N -0.62 -1.21 0.00 3.42 4.64 -1.97 -3.25 113.55 114.55 2dj1 h SER 135 Ca -0.38 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 2dj1 h SER 135 Cb 1.25 0.61 0.00 0.00 -0.31 0.00 0.00 62.40 63.95 2dj1 h SER 135 CO 0.54 -0.30 0.00 0.61 -0.87 0.00 0.00 176.83 176.81 2dj1 n GLY 136 N -1.44 -0.44 3.56 -0.77 0.00 -1.26 -3.96 105.19 100.88 2dj1 n GLY 136 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 2.58 0.48 1.61 0.04 -1.22 -4.97 135.00 133.52 2dj1 s PRO 137 Ca 0.00 0.03 -0.19 0.00 0.04 0.00 0.00 61.00 60.88 2dj1 s PRO 137 Cb 0.00 -4.82 -0.09 0.00 0.04 0.00 0.00 34.50 29.63 2dj1 s PRO 137 CO 0.00 -3.15 0.99 -1.12 0.04 0.00 0.00 177.00 173.76 2dj1 s SER 138 N 8.06 6.61 -0.05 6.66 0.01 -1.25 -4.94 113.70 128.80 2dj1 s SER 138 Ca 0.69 1.73 -0.20 0.00 1.31 0.00 0.00 55.95 59.48 2dj1 s SER 138 Cb -0.09 -2.54 0.04 0.00 0.21 0.00 0.00 66.02 63.65 2dj1 s SER 138 CO 0.07 -0.59 0.45 -0.94 0.41 0.00 0.00 173.24 172.64 2dj1 s SER 139 N -2.39 -0.39 0.00 2.44 1.04 -1.26 -5.17 113.70 107.96 2dj1 s SER 139 Ca 0.63 0.43 0.00 0.00 0.48 0.00 0.00 55.95 57.48 2dj1 s SER 139 Cb -0.12 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.49 2dj1 s SER 139 CO 0.21 -0.45 0.00 0.61 0.98 0.00 0.00 173.24 174.59