#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jdu s THR 2 N 0.00 2.30 0.12 0.00 2.01 -1.26 -5.02 115.64 113.80 2jdu s THR 2 Ca 0.00 0.31 0.05 0.00 0.31 0.00 0.00 61.69 62.35 2jdu s THR 2 Cb 0.00 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.28 2jdu s THR 2 CO 0.00 0.07 -0.11 -1.10 -0.69 0.00 0.00 174.62 172.79 2jdu s GLN 3 N -1.99 0.98 -0.00 4.92 -1.52 -1.26 -4.84 119.66 115.94 2jdu s GLN 3 Ca 0.52 -1.31 0.00 0.00 -1.95 0.00 0.00 55.36 52.62 2jdu s GLN 3 Cb -0.44 -0.65 0.00 0.00 -0.22 0.00 0.00 33.01 31.70 2jdu s GLN 3 CO 0.59 0.10 0.00 0.41 -0.25 0.00 0.00 175.29 176.14 2jdu n GLY 4 N 0.21 0.49 3.38 3.09 0.00 -1.26 -4.90 105.19 106.19 2jdu n GLY 4 Ca -0.13 -0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 2jdu n GLY 4 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jdu s VAL 5 N -2.00 3.12 -0.00 1.61 1.01 -1.26 -0.46 120.40 122.42 2jdu s VAL 5 Ca 0.00 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.37 2jdu s VAL 5 Cb 0.00 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 34.06 2jdu s VAL 5 CO 0.00 0.52 -0.07 -0.36 0.00 0.00 0.00 175.10 175.19 2jdu s PHE 6 N 0.40 0.63 -0.40 5.22 0.08 0.42 -5.01 117.98 119.31 2jdu s PHE 6 Ca -0.10 -0.13 -0.15 0.00 0.12 0.00 0.00 56.93 56.67 2jdu s PHE 6 Cb -0.16 -0.40 0.01 0.00 -0.57 0.00 0.00 43.02 41.90 2jdu s PHE 6 CO 0.05 -0.01 0.33 0.99 -0.10 0.00 0.00 175.22 176.48 2jdu s THR 7 N -0.19 5.22 0.42 0.64 2.01 -1.26 -0.97 115.64 121.51 2jdu s THR 7 Ca 0.02 -0.49 0.00 0.00 0.31 0.00 0.00 61.69 61.54 2jdu s THR 7 Cb -0.03 -3.92 -0.01 0.00 0.01 0.00 0.00 72.50 68.55 2jdu s THR 7 CO -0.00 -0.29 0.64 -0.76 -0.69 0.00 0.00 174.62 173.52 2jdu s LEU 8 N 1.81 3.75 0.55 4.42 1.02 0.61 -5.01 118.68 125.82 2jdu s LEU 8 Ca 0.07 0.34 -0.22 0.00 0.02 0.00 0.00 54.13 54.35 2jdu s LEU 8 Cb -0.18 -3.22 -0.05 0.00 0.02 0.00 0.00 46.19 42.76 2jdu s LEU 8 CO 0.11 -0.58 1.31 -0.81 0.02 0.00 0.00 176.35 176.40 2jdu n PRO 9 N -2.00 1.61 -1.93 1.29 -0.04 -1.26 -4.36 135.00 128.31 2jdu n PRO 9 Ca -0.00 0.59 -0.36 0.00 -0.04 0.00 0.00 63.50 63.69 2jdu n PRO 9 Cb 0.57 -2.52 0.04 0.00 -0.04 0.00 0.00 33.50 31.55 2jdu n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jdu s ALA 10 N -1.30 2.49 -1.39 0.55 0.00 -1.26 -3.79 121.76 117.05 2jdu s ALA 10 Ca 0.72 1.02 -0.04 0.00 0.00 0.00 0.00 51.96 53.66 2jdu s ALA 10 Cb -0.42 -3.46 0.02 0.00 0.00 0.00 0.00 23.12 19.26 2jdu s ALA 10 CO 0.49 -1.27 0.70 0.09 0.00 0.00 0.00 175.76 175.77 2jdu n ASN 11 N -1.73 -1.83 -4.08 0.00 3.02 0.33 -4.92 115.26 106.06 2jdu n ASN 11 Ca 0.14 -0.86 -0.24 0.00 -0.03 0.00 0.00 54.58 53.59 2jdu n ASN 11 Cb 0.49 -3.76 -0.16 0.00 -0.61 0.00 0.00 39.78 35.74 2jdu n ASN 11 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2jdu s THR 12 N -3.64 1.20 0.36 3.41 2.01 -1.25 -4.88 115.64 112.84 2jdu s THR 12 Ca 0.17 -0.58 -0.26 0.00 0.31 0.00 0.00 61.69 61.33 2jdu s THR 12 Cb -0.09 -1.04 -0.09 0.00 0.01 0.00 0.00 72.50 71.29 2jdu s THR 12 CO 0.84 0.35 1.11 -0.13 -0.69 0.00 0.00 174.62 176.10 2jdu s ARG 13 N 0.18 4.30 0.04 4.92 0.52 -1.26 -0.80 118.95 126.84 2jdu s ARG 13 Ca -0.05 1.73 -0.01 0.00 -0.52 0.00 0.00 55.73 56.87 2jdu s ARG 13 Cb -0.11 -2.81 -0.03 0.00 0.52 0.00 0.00 34.95 32.52 2jdu s ARG 13 CO 0.02 -0.08 -0.01 -0.59 0.02 0.00 0.00 175.30 174.66 2jdu s PHE 14 N -1.40 0.39 0.05 -0.53 -0.71 -0.06 -4.20 117.98 111.51 2jdu s PHE 14 Ca 0.53 -0.83 -0.02 0.00 -1.04 0.00 0.00 56.93 55.57 2jdu s PHE 14 Cb -0.28 -0.29 -0.04 0.00 -1.21 0.00 0.00 43.02 41.19 2jdu s PHE 14 CO 0.36 -0.33 0.24 0.20 -1.34 0.00 0.00 175.22 174.35 2jdu s GLY 15 N -2.38 2.20 -0.03 1.99 0.00 -0.25 -1.00 107.32 107.86 2jdu s GLY 15 Ca -0.01 -0.74 0.02 0.00 0.00 0.00 0.00 44.72 43.99 2jdu s GLY 15 CO -0.07 -0.66 -0.08 0.54 0.00 0.00 0.00 173.10 172.83 2jdu s VAL 16 N -1.45 0.74 -0.01 1.40 0.11 -0.04 -1.47 120.40 119.68 2jdu s VAL 16 Ca 0.33 -0.33 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 2jdu s VAL 16 Cb -0.13 -0.66 0.01 0.00 -1.53 0.00 0.00 36.38 34.07 2jdu s VAL 16 CO 0.23 0.23 -0.00 -0.89 -3.33 0.00 0.00 175.10 171.34 2jdu s THR 17 N 0.23 0.06 -0.06 5.04 2.01 -0.19 -1.32 115.64 121.41 2jdu s THR 17 Ca -0.03 0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.01 2jdu s THR 17 Cb -0.09 -0.08 0.01 0.00 0.01 0.00 0.00 72.50 72.35 2jdu s THR 17 CO 0.00 0.04 -0.14 0.00 -0.69 0.00 0.00 174.62 173.83 2jdu s ALA 18 N 0.22 1.37 0.10 7.40 0.00 -0.17 -0.88 121.76 129.80 2jdu s ALA 18 Ca -0.02 -0.54 0.10 0.00 0.00 0.00 0.00 51.96 51.51 2jdu s ALA 18 Cb -0.03 -0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.52 2jdu s ALA 18 CO -0.01 0.19 -0.26 -0.06 0.00 0.00 0.00 175.76 175.62 2jdu s PHE 19 N 0.37 2.27 0.10 0.00 0.08 0.06 -0.04 117.98 120.82 2jdu s PHE 19 Ca -0.10 -0.39 0.10 0.00 0.12 0.00 0.00 56.93 56.66 2jdu s PHE 19 Cb -0.14 -1.27 -0.04 0.00 -0.57 0.00 0.00 43.02 41.01 2jdu s PHE 19 CO 0.03 0.26 -0.25 0.00 -0.10 0.00 0.00 175.22 175.16 2jdu s ALA 20 N -0.98 2.41 -0.43 5.36 0.00 -0.86 -1.09 121.76 126.17 2jdu s ALA 20 Ca 0.13 -1.39 0.07 0.00 0.00 0.00 0.00 51.96 50.77 2jdu s ALA 20 Cb -0.10 -0.47 0.23 0.00 0.00 0.00 0.00 23.12 22.79 2jdu s ALA 20 CO 0.05 0.55 0.64 0.09 0.00 0.00 0.00 175.76 177.09 2jdu n ASN 21 N 1.14 -1.19 -3.50 0.00 3.02 -0.14 -1.76 115.26 112.83 2jdu n ASN 21 Ca -0.17 -2.89 -0.11 0.00 -0.03 0.00 0.00 54.58 51.38 2jdu n ASN 21 Cb 0.53 0.38 -0.03 0.00 -0.61 0.00 0.00 39.78 40.04 2jdu n ASN 21 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2jdu s SER 22 N -1.10 -0.45 0.39 6.41 0.15 0.27 -4.27 113.70 115.09 2jdu s SER 22 Ca 0.33 0.18 0.26 0.00 0.70 0.00 0.00 55.95 57.42 2jdu s SER 22 Cb 0.17 0.44 0.75 0.00 -1.71 0.00 0.00 66.02 65.66 2jdu s SER 22 CO -0.16 -0.65 1.74 0.28 1.20 0.00 0.00 173.24 175.65 2jdu h SER 23 N 2.25 0.00 -3.54 5.45 0.02 -1.98 -3.32 113.55 112.43 2jdu h SER 23 Ca -0.25 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.18 2jdu h SER 23 Cb 1.23 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.74 2jdu h SER 23 CO 0.34 0.00 0.21 0.20 -1.14 0.00 0.00 176.83 176.43 2jdu s ASN 24 N -5.51 7.40 0.32 3.07 0.01 -1.26 -4.95 114.94 114.03 2jdu s ASN 24 Ca 0.06 1.66 -0.29 0.00 -0.71 0.00 0.00 52.86 53.58 2jdu s ASN 24 Cb 0.08 -2.51 -0.10 0.00 0.41 0.00 0.00 41.25 39.12 2jdu s ASN 24 CO 0.60 0.16 1.41 -0.89 -1.51 0.00 0.00 177.10 176.87 2jdu s THR 25 N -0.95 2.47 -0.01 1.60 2.01 -1.26 -4.75 115.64 114.76 2jdu s THR 25 Ca 0.37 0.45 0.01 0.00 0.31 0.00 0.00 61.69 62.83 2jdu s THR 25 Cb -0.23 -3.29 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 2jdu s THR 25 CO 0.27 0.10 0.01 -1.10 -0.69 0.00 0.00 174.62 173.20 2jdu s GLN 26 N -1.41 2.83 -0.13 4.92 -1.52 0.01 -4.50 119.66 119.86 2jdu s GLN 26 Ca 0.54 -0.58 0.03 0.00 -1.95 0.00 0.00 55.36 53.39 2jdu s GLN 26 Cb -0.43 -2.70 0.01 0.00 -0.22 0.00 0.00 33.01 29.67 2jdu s GLN 26 CO 0.53 0.63 -0.22 0.99 -0.25 0.00 0.00 175.29 176.97 2jdu s THR 27 N -1.09 2.11 -0.14 -0.19 2.01 -0.45 -1.77 115.64 116.12 2jdu s THR 27 Ca 0.20 -0.98 0.02 0.00 0.31 0.00 0.00 61.69 61.23 2jdu s THR 27 Cb -0.12 -1.83 0.00 0.00 0.01 0.00 0.00 72.50 70.57 2jdu s THR 27 CO 0.10 0.55 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.71 2jdu s VAL 28 N 0.64 2.38 -0.13 3.82 1.01 0.86 -0.79 120.40 128.20 2jdu s VAL 28 Ca -0.11 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 60.98 2jdu s VAL 28 Cb -0.16 -1.97 -0.02 0.00 0.00 0.00 0.00 36.38 34.22 2jdu s VAL 28 CO 0.02 0.53 -0.08 0.20 0.00 0.00 0.00 175.10 175.78 2jdu s ASN 29 N 0.74 4.49 -0.22 3.32 0.01 0.29 -0.65 114.94 122.91 2jdu s ASN 29 Ca -0.08 -0.17 -0.03 0.00 -0.71 0.00 0.00 52.86 51.87 2jdu s ASN 29 Cb -0.16 -1.57 0.00 0.00 0.41 0.00 0.00 41.25 39.94 2jdu s ASN 29 CO 0.00 0.21 -0.06 -0.69 -1.51 0.00 0.00 177.10 175.06 2jdu s VAL 30 N 0.08 3.12 -0.09 1.60 1.01 0.14 -1.21 120.40 125.05 2jdu s VAL 30 Ca -0.03 -0.67 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 2jdu s VAL 30 Cb -0.14 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 2jdu s VAL 30 CO 0.03 0.38 0.05 -0.76 0.00 0.00 0.00 175.10 174.80 2jdu s LEU 31 N 1.42 3.83 -0.16 3.92 1.02 0.11 -0.26 118.68 128.56 2jdu s LEU 31 Ca 0.04 0.24 0.01 0.00 0.02 0.00 0.00 54.13 54.44 2jdu s LEU 31 Cb -0.15 -1.92 0.02 0.00 0.02 0.00 0.00 46.19 44.16 2jdu s LEU 31 CO -0.05 0.38 -0.20 -0.69 0.02 0.00 0.00 176.35 175.82 2jdu s VAL 32 N -0.95 1.98 -1.45 -1.59 1.01 -0.23 -0.96 120.40 118.22 2jdu s VAL 32 Ca 0.14 -0.90 -0.05 0.00 0.00 0.00 0.00 61.98 61.17 2jdu s VAL 32 Cb -0.12 -1.79 0.04 0.00 0.00 0.00 0.00 36.38 34.52 2jdu s VAL 32 CO 0.03 0.53 0.63 -3.20 0.00 0.00 0.00 175.10 173.09 2jdu n ASN 33 N 4.50 -1.67 -0.97 3.32 5.15 -0.47 -1.99 115.26 123.12 2jdu n ASN 33 Ca -0.20 -0.93 -0.13 0.00 -0.60 0.00 0.00 54.58 52.72 2jdu n ASN 33 Cb 0.50 -3.38 -0.05 0.00 -0.53 0.00 0.00 39.78 36.32 2jdu n ASN 33 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2jdu n ASN 34 N -2.93 -4.73 -4.16 1.20 3.02 -1.26 -5.01 115.26 101.40 2jdu n ASN 34 Ca -0.20 0.31 -0.25 0.00 -0.03 0.00 0.00 54.58 54.42 2jdu n ASN 34 Cb 0.63 -3.34 -0.15 0.00 -0.61 0.00 0.00 39.78 36.31 2jdu n ASN 34 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2jdu s GLU 35 N -3.01 1.46 0.07 3.52 0.41 -0.84 -5.09 118.70 115.22 2jdu s GLU 35 Ca 0.00 -0.61 -0.32 0.00 -0.41 0.00 0.00 54.97 53.63 2jdu s GLU 35 Cb 0.00 -1.38 -0.11 0.00 -1.78 0.00 0.00 34.13 30.86 2jdu s GLU 35 CO 0.00 0.35 1.86 2.41 -0.49 0.00 0.00 175.26 179.40 2jdu n THR 36 N 2.73 0.48 -0.04 3.63 -1.04 -1.26 -1.07 114.28 117.72 2jdu n THR 36 Ca -0.15 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.77 2jdu n THR 36 Cb 0.54 -2.10 -0.12 0.00 -1.82 0.00 0.00 70.33 66.84 2jdu n THR 36 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jdu n ALA 37 N 6.14 2.10 -3.48 2.41 0.00 0.64 -4.88 120.51 123.44 2jdu n ALA 37 Ca 0.19 -0.66 -0.16 0.00 0.00 0.00 0.00 53.44 52.81 2jdu n ALA 37 Cb 0.36 -0.29 -0.07 0.00 0.00 0.00 0.00 19.45 19.46 2jdu n ALA 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jdu s ALA 38 N -2.70 -1.57 0.03 0.00 0.00 -1.04 -5.00 121.76 111.46 2jdu s ALA 38 Ca -0.06 1.27 0.02 0.00 0.00 0.00 0.00 51.96 53.19 2jdu s ALA 38 Cb 0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 2jdu s ALA 38 CO 0.61 -0.34 -0.08 -0.08 0.00 0.00 0.00 175.76 175.88 2jdu s THR 39 N -0.88 0.56 0.00 0.00 -1.32 -1.26 -0.68 115.64 112.05 2jdu s THR 39 Ca -0.09 -0.78 0.01 0.00 -1.21 0.00 0.00 61.69 59.62 2jdu s THR 39 Cb -0.02 -0.56 -0.01 0.00 -1.51 0.00 0.00 72.50 70.40 2jdu s THR 39 CO 0.07 -0.17 -0.04 -0.36 -2.21 0.00 0.00 174.62 171.90 2jdu s PHE 40 N -0.90 0.39 -0.13 9.09 0.08 0.17 -4.99 117.98 121.69 2jdu s PHE 40 Ca -0.05 -0.11 -0.06 0.00 0.12 0.00 0.00 56.93 56.83 2jdu s PHE 40 Cb -0.07 -0.25 0.05 0.00 -0.57 0.00 0.00 43.02 42.19 2jdu s PHE 40 CO 0.00 -0.02 0.29 -1.12 -0.10 0.00 0.00 175.22 174.28 2jdu s SER 41 N -0.25 -0.21 0.12 1.36 0.01 -1.26 -0.10 113.70 113.37 2jdu s SER 41 Ca 0.00 0.63 -0.26 0.00 1.31 0.00 0.00 55.95 57.64 2jdu s SER 41 Cb -0.02 0.57 0.08 0.00 0.21 0.00 0.00 66.02 66.86 2jdu s SER 41 CO -0.00 -0.19 1.05 -0.83 0.41 0.00 0.00 173.24 173.68 2jdu s GLY 42 N 1.54 -0.25 -0.04 3.44 0.00 -0.73 -4.98 107.32 106.31 2jdu s GLY 42 Ca -0.07 0.22 0.01 0.00 0.00 0.00 0.00 44.72 44.88 2jdu s GLY 42 CO -0.10 0.25 -0.05 1.62 0.00 0.00 0.00 173.10 174.82 2jdu s GLN 43 N -2.99 0.85 -0.16 2.90 -0.44 -1.26 -0.81 119.66 117.75 2jdu s GLN 43 Ca 0.14 -0.15 -0.26 0.00 -2.50 0.00 0.00 55.36 52.59 2jdu s GLN 43 Cb 0.00 -0.83 0.07 0.00 -1.64 0.00 0.00 33.01 30.61 2jdu s GLN 43 CO 0.01 -0.03 0.66 0.45 0.50 0.00 0.00 175.29 176.88 2jdu s SER 44 N 0.72 -0.66 -0.08 6.67 0.15 -1.25 -4.99 113.70 114.25 2jdu s SER 44 Ca -0.10 1.04 0.17 0.00 0.70 0.00 0.00 55.95 57.76 2jdu s SER 44 Cb -0.13 0.99 0.59 0.00 -1.71 0.00 0.00 66.02 65.76 2jdu s SER 44 CO 0.00 -0.40 1.50 0.35 1.20 0.00 0.00 173.24 175.90 2jdu n THR 45 N 1.91 1.62 -2.65 6.45 -2.24 -1.25 -0.57 114.28 117.55 2jdu n THR 45 Ca -0.16 -1.24 -0.04 0.00 -2.27 0.00 0.00 64.05 60.34 2jdu n THR 45 Cb 0.56 0.20 0.05 0.00 -2.10 0.00 0.00 70.33 69.03 2jdu n THR 45 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2jdu n ASN 46 N 0.80 2.11 -1.55 3.42 5.15 -1.26 -4.80 115.26 119.12 2jdu n ASN 46 Ca 0.22 -2.35 -0.17 0.00 -0.60 0.00 0.00 54.58 51.67 2jdu n ASN 46 Cb 0.76 -0.44 -0.05 0.00 -0.53 0.00 0.00 39.78 39.51 2jdu n ASN 46 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2jdu n ASN 47 N -0.55 -5.08 -4.75 1.20 5.15 -0.72 -4.94 115.26 105.57 2jdu n ASN 47 Ca 0.14 0.27 -0.38 0.00 -0.60 0.00 0.00 54.58 54.01 2jdu n ASN 47 Cb 0.85 -4.12 0.03 0.00 -0.53 0.00 0.00 39.78 36.02 2jdu n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jdu s ALA 48 N -2.72 2.82 -0.16 5.20 0.00 -1.24 -4.55 121.76 121.11 2jdu s ALA 48 Ca 0.00 1.27 -0.29 0.00 0.00 0.00 0.00 51.96 52.93 2jdu s ALA 48 Cb 0.00 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.55 2jdu s ALA 48 CO 0.00 -1.28 1.53 0.08 0.00 0.00 0.00 175.76 176.09 2jdu s VAL 49 N -1.35 3.81 -1.55 0.00 1.01 -1.26 -2.02 120.40 119.05 2jdu s VAL 49 Ca 0.71 0.96 0.22 0.00 0.00 0.00 0.00 61.98 63.87 2jdu s VAL 49 Cb -0.38 -3.71 -0.11 0.00 0.00 0.00 0.00 36.38 32.17 2jdu s VAL 49 CO 0.45 -0.19 1.00 2.30 0.00 0.00 0.00 175.10 178.67 2jdu n ILE 50 N 5.84 0.00 -3.62 2.22 -5.35 0.94 -4.98 119.36 114.41 2jdu n ILE 50 Ca 0.17 -0.14 -0.06 0.00 -0.27 0.00 0.00 62.75 62.45 2jdu n ILE 50 Cb 0.44 1.13 -0.05 0.00 -1.74 0.00 0.00 39.64 39.43 2jdu n ILE 50 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2jdu s GLY 51 N -2.73 -0.03 -0.10 3.28 0.00 -1.19 -4.13 107.32 102.42 2jdu s GLY 51 Ca 0.13 2.61 -0.13 0.00 0.00 0.00 0.00 44.72 47.34 2jdu s GLY 51 CO 0.71 1.26 0.33 -1.08 0.00 0.00 0.00 173.10 174.33 2jdu s THR 52 N -0.78 0.01 0.15 0.90 -1.32 -1.26 -1.00 115.64 112.34 2jdu s THR 52 Ca 0.04 -0.12 -0.19 0.00 -1.21 0.00 0.00 61.69 60.21 2jdu s THR 52 Cb -0.02 -0.51 0.05 0.00 -1.51 0.00 0.00 72.50 70.51 2jdu s THR 52 CO -0.05 -0.07 0.50 -1.58 -2.21 0.00 0.00 174.62 171.21 2jdu s GLN 53 N -0.21 1.20 -0.15 7.08 2.00 -0.44 -5.00 119.66 124.15 2jdu s GLN 53 Ca -0.04 -0.64 -0.01 0.00 -2.00 0.00 0.00 55.36 52.67 2jdu s GLN 53 Cb -0.03 0.53 -0.01 0.00 0.80 0.00 0.00 33.01 34.29 2jdu s GLN 53 CO 0.01 -0.50 -0.10 0.08 -0.50 0.00 0.00 175.29 174.28 2jdu s VAL 54 N -3.79 3.20 0.30 1.34 1.01 -1.26 -0.86 120.40 120.33 2jdu s VAL 54 Ca 0.03 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.45 2jdu s VAL 54 Cb 0.00 -2.37 -0.06 0.00 0.00 0.00 0.00 36.38 33.95 2jdu s VAL 54 CO -0.11 0.50 0.06 -0.76 0.00 0.00 0.00 175.10 174.80 2jdu s LEU 55 N 0.55 2.06 -0.12 3.92 1.43 -0.17 -4.97 118.68 121.37 2jdu s LEU 55 Ca -0.07 -1.36 -0.01 0.00 -1.03 0.00 0.00 54.13 51.65 2jdu s LEU 55 Cb -0.15 -0.28 -0.02 0.00 0.03 0.00 0.00 46.19 45.76 2jdu s LEU 55 CO 0.03 -0.62 -0.08 0.21 0.23 0.00 0.00 176.35 176.12 2jdu s ASN 56 N -3.43 4.50 0.00 2.29 3.84 -1.26 -0.89 114.94 119.99 2jdu s ASN 56 Ca 0.36 -0.17 0.13 0.00 0.21 0.00 0.00 52.86 53.40 2jdu s ASN 56 Cb 0.08 -1.55 0.58 0.00 -0.55 0.00 0.00 41.25 39.81 2jdu s ASN 56 CO 0.14 0.22 1.41 -1.54 -2.79 0.00 0.00 177.10 174.55 2jdu n SER 57 N 3.18 0.00 -0.45 -4.21 3.41 0.02 -4.91 113.62 110.66 2jdu n SER 57 Ca -0.18 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 2jdu n SER 57 Cb 0.53 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 2jdu n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jdu n GLY 58 N -0.14 -1.06 0.23 5.00 0.00 -1.26 -2.47 105.19 105.50 2jdu n GLY 58 Ca 0.04 -1.13 -0.03 0.00 0.00 0.00 0.00 46.02 44.89 2jdu n GLY 58 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2jdu h SER 59 N 0.00 0.46 0.76 1.61 0.02 -1.95 0.99 113.55 115.43 2jdu h SER 59 Ca 0.00 -0.16 -0.08 0.00 -0.84 0.00 0.00 61.79 60.71 2jdu h SER 59 Cb 0.00 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 2jdu h SER 59 CO 0.00 0.72 -1.30 -1.54 -1.14 0.00 0.00 176.83 173.58 2jdu n SER 60 N -4.11 0.76 0.00 3.07 3.41 -1.26 -4.77 113.62 110.72 2jdu n SER 60 Ca -0.01 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.92 2jdu n SER 60 Cb 0.42 0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.84 2jdu n SER 60 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jdu n GLY 61 N 1.29 0.48 3.66 5.00 0.00 -1.03 -4.79 105.19 109.80 2jdu n GLY 61 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 2jdu n GLY 61 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2jdu s LYS 62 N -0.57 4.27 -0.06 1.61 2.20 -1.26 -0.29 119.74 125.64 2jdu s LYS 62 Ca 0.00 1.38 0.05 0.00 -0.36 0.00 0.00 55.97 57.04 2jdu s LYS 62 Cb 0.00 -3.64 -0.00 0.00 -1.51 0.00 0.00 37.83 32.67 2jdu s LYS 62 CO 0.00 -0.62 -0.20 0.08 -0.36 0.00 0.00 175.35 174.25 2jdu s VAL 63 N 3.16 1.71 -0.04 4.02 1.01 -0.14 -1.37 120.40 128.74 2jdu s VAL 63 Ca 0.45 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.60 2jdu s VAL 63 Cb -0.16 -1.47 0.01 0.00 0.00 0.00 0.00 36.38 34.76 2jdu s VAL 63 CO 0.07 0.48 -0.12 -1.58 0.00 0.00 0.00 175.10 173.95 2jdu s GLN 64 N 0.10 1.42 -0.17 2.72 0.74 -0.13 -0.43 119.66 123.91 2jdu s GLN 64 Ca -0.08 -0.41 -0.06 0.00 0.05 0.00 0.00 55.36 54.86 2jdu s GLN 64 Cb -0.14 -1.24 -0.04 0.00 1.10 0.00 0.00 33.01 32.70 2jdu s GLN 64 CO 0.04 0.10 0.05 0.08 -0.55 0.00 0.00 175.29 175.01 2jdu s VAL 65 N 0.36 4.66 -0.01 1.34 1.01 0.39 0.07 120.40 128.22 2jdu s VAL 65 Ca -0.08 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 61.87 2jdu s VAL 65 Cb -0.12 -3.08 -0.01 0.00 0.00 0.00 0.00 36.38 33.17 2jdu s VAL 65 CO 0.02 0.49 -0.18 -1.10 0.00 0.00 0.00 175.10 174.33 2jdu s GLN 66 N 0.18 1.42 -0.03 2.72 -0.21 -0.35 -4.73 119.66 118.67 2jdu s GLN 66 Ca 0.04 -0.65 0.06 0.00 0.02 0.00 0.00 55.36 54.83 2jdu s GLN 66 Cb -0.12 -1.38 -0.01 0.00 1.00 0.00 0.00 33.01 32.49 2jdu s GLN 66 CO 0.01 0.38 -0.20 0.08 -2.12 0.00 0.00 175.29 173.44 2jdu s VAL 67 N -0.44 1.61 0.04 1.09 1.01 -1.26 -0.55 120.40 121.90 2jdu s VAL 67 Ca 0.07 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.21 2jdu s VAL 67 Cb -0.07 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 2jdu s VAL 67 CO -0.01 0.46 -0.06 -0.94 0.00 0.00 0.00 175.10 174.55 2jdu s SER 68 N -0.32 0.68 -0.06 3.32 1.04 0.03 -0.77 113.70 117.63 2jdu s SER 68 Ca 0.04 -0.57 -0.01 0.00 0.48 0.00 0.00 55.95 55.89 2jdu s SER 68 Cb -0.09 0.06 0.03 0.00 0.10 0.00 0.00 66.02 66.12 2jdu s SER 68 CO 0.00 -0.26 0.00 -0.69 0.98 0.00 0.00 173.24 173.28 2jdu s VAL 69 N -1.60 0.32 -1.70 5.02 1.01 -0.40 -1.34 120.40 121.70 2jdu s VAL 69 Ca -0.10 0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.99 2jdu s VAL 69 Cb -0.09 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.83 2jdu s VAL 69 CO -0.01 0.23 0.00 0.59 0.00 0.00 0.00 175.10 175.91 2jdu n ASN 70 N 4.85 -5.26 0.00 3.32 5.03 -1.26 -1.53 115.26 120.41 2jdu n ASN 70 Ca -0.12 0.15 0.00 0.00 0.87 0.00 0.00 54.58 55.48 2jdu n ASN 70 Cb 0.50 -4.48 0.00 0.00 -1.02 0.00 0.00 39.78 34.79 2jdu n ASN 70 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2jdu n GLY 71 N -0.79 0.92 3.69 7.41 0.00 -1.26 -5.04 105.19 110.12 2jdu n GLY 71 Ca -0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 2jdu n GLY 71 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jdu s ARG 72 N -0.43 3.85 0.12 1.61 3.00 -0.58 -5.07 118.95 121.46 2jdu s ARG 72 Ca 0.00 -0.29 -0.31 0.00 0.00 0.00 0.00 55.73 55.13 2jdu s ARG 72 Cb 0.00 -3.21 -0.09 0.00 0.00 0.00 0.00 34.95 31.65 2jdu s ARG 72 CO 0.00 0.39 1.48 -1.25 0.00 0.00 0.00 175.30 175.93 2jdu s PRO 73 N 0.04 4.27 0.28 3.54 0.04 -1.26 -1.28 135.00 140.63 2jdu s PRO 73 Ca 0.07 2.20 -0.28 0.00 0.04 0.00 0.00 61.00 63.02 2jdu s PRO 73 Cb -0.12 -3.27 -0.09 0.00 0.04 0.00 0.00 34.50 31.05 2jdu s PRO 73 CO 0.00 -0.54 0.97 -1.12 0.04 0.00 0.00 177.00 176.36 2jdu s SER 74 N 1.31 7.43 0.23 6.66 0.01 0.05 -4.94 113.70 124.44 2jdu s SER 74 Ca 0.68 1.97 -0.30 0.00 1.31 0.00 0.00 55.95 59.61 2jdu s SER 74 Cb -0.39 -2.60 -0.09 0.00 0.21 0.00 0.00 66.02 63.15 2jdu s SER 74 CO 0.31 -0.00 1.19 -1.81 0.41 0.00 0.00 173.24 173.33 2jdu s ASP 75 N -1.30 7.10 0.20 2.44 1.01 -1.17 -4.71 116.67 120.23 2jdu s ASP 75 Ca 0.46 2.29 0.08 0.00 0.71 0.00 0.00 52.55 56.09 2jdu s ASP 75 Cb -0.24 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.03 2jdu s ASP 75 CO 0.30 -0.33 0.00 -0.76 0.21 0.00 0.00 175.17 174.60 2jdu s LEU 76 N -0.71 3.29 0.04 1.23 1.43 -1.26 -1.36 118.68 121.34 2jdu s LEU 76 Ca 0.50 -0.45 0.06 0.00 -1.03 0.00 0.00 54.13 53.21 2jdu s LEU 76 Cb -0.33 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 43.95 2jdu s LEU 76 CO 0.39 0.07 -0.17 0.68 0.23 0.00 0.00 176.35 177.55 2jdu s VAL 77 N -1.86 1.38 0.16 -1.59 -7.23 -0.34 -4.85 120.40 106.07 2jdu s VAL 77 Ca 0.28 -1.08 -0.16 0.00 -1.81 0.00 0.00 61.98 59.21 2jdu s VAL 77 Cb -0.09 -1.22 0.03 0.00 0.56 0.00 0.00 36.38 35.66 2jdu s VAL 77 CO 0.19 0.12 0.43 -0.94 -0.31 0.00 0.00 175.10 174.59 2jdu s SER 78 N -1.13 -0.22 0.08 4.85 1.04 -1.26 -0.93 113.70 116.13 2jdu s SER 78 Ca 0.05 -0.43 -0.26 0.00 0.48 0.00 0.00 55.95 55.78 2jdu s SER 78 Cb -0.08 0.51 0.08 0.00 0.10 0.00 0.00 66.02 66.63 2jdu s SER 78 CO 0.01 -0.93 0.87 0.00 0.98 0.00 0.00 173.24 174.18 2jdu s ALA 79 N -3.85 -1.71 -0.04 5.32 0.00 -0.80 -4.92 121.76 115.76 2jdu s ALA 79 Ca 0.07 0.59 0.06 0.00 0.00 0.00 0.00 51.96 52.67 2jdu s ALA 79 Cb 0.01 0.57 -0.02 0.00 0.00 0.00 0.00 23.12 23.68 2jdu s ALA 79 CO -0.07 -0.84 -0.23 -1.14 0.00 0.00 0.00 175.76 173.48 2jdu s GLN 80 N -3.28 2.37 -0.02 0.00 0.74 -1.26 -1.02 119.66 117.19 2jdu s GLN 80 Ca 0.07 -0.86 0.05 0.00 0.05 0.00 0.00 55.36 54.67 2jdu s GLN 80 Cb -0.01 -2.17 -0.01 0.00 1.10 0.00 0.00 33.01 31.91 2jdu s GLN 80 CO -0.05 0.51 -0.17 0.08 -0.55 0.00 0.00 175.29 175.12 2jdu s VAL 81 N -0.48 1.34 -0.13 1.34 1.01 0.16 -4.99 120.40 118.66 2jdu s VAL 81 Ca 0.06 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.35 2jdu s VAL 81 Cb -0.11 -1.13 0.02 0.00 0.00 0.00 0.00 36.38 35.15 2jdu s VAL 81 CO 0.01 0.38 -0.17 -0.63 0.00 0.00 0.00 175.10 174.70 2jdu s ILE 82 N -0.23 1.67 -0.10 2.22 1.01 -1.26 -0.86 121.20 123.65 2jdu s ILE 82 Ca 0.03 -0.73 -0.04 0.00 0.00 0.00 0.00 60.65 59.90 2jdu s ILE 82 Cb -0.08 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.83 2jdu s ILE 82 CO 0.00 0.48 0.07 -0.76 0.00 0.00 0.00 174.94 174.73 2jdu s LEU 83 N 1.10 3.99 -1.00 2.97 1.43 0.18 -4.50 118.68 122.84 2jdu s LEU 83 Ca -0.03 0.30 -0.09 0.00 -1.03 0.00 0.00 54.13 53.28 2jdu s LEU 83 Cb -0.14 -1.96 0.09 0.00 0.03 0.00 0.00 46.19 44.21 2jdu s LEU 83 CO -0.05 0.39 0.32 1.07 0.23 0.00 0.00 176.35 178.32 2jdu n THR 84 N 2.03 -0.39 -1.43 5.49 5.66 -1.26 -1.45 114.28 122.94 2jdu n THR 84 Ca -0.19 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.66 2jdu n THR 84 Cb 0.54 -0.89 -0.06 0.00 -1.55 0.00 0.00 70.33 68.37 2jdu n THR 84 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2jdu n ASN 85 N -2.04 -5.35 0.00 1.09 5.15 -1.26 -4.68 115.26 108.16 2jdu n ASN 85 Ca 0.02 0.36 0.00 0.00 -0.60 0.00 0.00 54.58 54.36 2jdu n ASN 85 Cb 0.51 -4.14 0.00 0.00 -0.53 0.00 0.00 39.78 35.62 2jdu n ASN 85 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2jdu n GLU 86 N -1.80 0.00 -3.57 1.20 -0.58 -0.63 -5.08 120.64 110.18 2jdu n GLU 86 Ca -0.15 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.21 2jdu n GLU 86 Cb 0.58 -0.45 -0.11 0.00 -0.57 0.00 0.00 31.44 30.89 2jdu n GLU 86 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2jdu s LEU 87 N -2.34 4.05 -0.10 -4.62 2.96 -0.53 -4.35 118.68 113.75 2jdu s LEU 87 Ca 0.00 -0.01 0.00 0.00 -0.22 0.00 0.00 54.13 53.90 2jdu s LEU 87 Cb 0.00 -2.15 -0.02 0.00 0.50 0.00 0.00 46.19 44.52 2jdu s LEU 87 CO 0.00 -0.07 -0.10 0.20 -1.32 0.00 0.00 176.35 175.06 2jdu s ASN 88 N 1.75 4.31 -0.06 3.68 -0.87 0.07 -0.65 114.94 123.17 2jdu s ASN 88 Ca 0.08 -0.18 0.04 0.00 -1.57 0.00 0.00 52.86 51.22 2jdu s ASN 88 Cb -0.16 -1.35 0.00 0.00 -0.02 0.00 0.00 41.25 39.73 2jdu s ASN 88 CO 0.11 0.26 -0.18 -0.36 -2.57 0.00 0.00 177.10 174.36 2jdu s PHE 89 N -0.20 1.88 -0.17 2.20 0.40 -0.04 -2.13 117.98 119.93 2jdu s PHE 89 Ca 0.01 -0.65 -0.00 0.00 -0.60 0.00 0.00 56.93 55.69 2jdu s PHE 89 Cb -0.13 -1.29 0.00 0.00 0.51 0.00 0.00 43.02 42.11 2jdu s PHE 89 CO 0.03 -0.27 -0.14 0.00 0.70 0.00 0.00 175.22 175.54 2jdu s ALA 90 N 0.30 2.53 -0.05 5.36 0.00 0.20 -0.66 121.76 129.43 2jdu s ALA 90 Ca -0.11 -1.10 0.05 0.00 0.00 0.00 0.00 51.96 50.81 2jdu s ALA 90 Cb -0.15 -1.31 -0.01 0.00 0.00 0.00 0.00 23.12 21.66 2jdu s ALA 90 CO 0.04 -0.16 -0.21 -0.51 0.00 0.00 0.00 175.76 174.92 2jdu s LEU 91 N 1.02 2.00 -0.02 0.00 1.43 -0.19 -0.20 118.68 122.72 2jdu s LEU 91 Ca -0.01 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.67 2jdu s LEU 91 Cb -0.15 -1.18 0.01 0.00 0.03 0.00 0.00 46.19 44.91 2jdu s LEU 91 CO -0.03 0.20 -0.04 -0.69 0.23 0.00 0.00 176.35 176.02 2jdu s VAL 92 N -0.08 0.41 0.20 -1.59 1.01 -0.35 -1.90 120.40 118.10 2jdu s VAL 92 Ca -0.03 -0.13 0.11 0.00 0.00 0.00 0.00 61.98 61.93 2jdu s VAL 92 Cb -0.13 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 2jdu s VAL 92 CO 0.03 0.16 -0.20 -0.83 0.00 0.00 0.00 175.10 174.26 2jdu s GLY 93 N 0.48 1.73 0.04 4.51 0.00 -0.11 -0.75 107.32 113.22 2jdu s GLY 93 Ca -0.06 -1.62 0.01 0.00 0.00 0.00 0.00 44.72 43.06 2jdu s GLY 93 CO -0.00 -1.65 -0.06 -1.35 0.00 0.00 0.00 173.10 170.03 2jdu s SER 94 N -2.81 0.71 -0.10 1.64 1.04 -0.76 -1.20 113.70 112.22 2jdu s SER 94 Ca 0.23 -0.60 0.01 0.00 0.48 0.00 0.00 55.95 56.07 2jdu s SER 94 Cb -0.08 0.07 0.02 0.00 0.10 0.00 0.00 66.02 66.12 2jdu s SER 94 CO 0.12 -0.27 -0.13 -0.70 0.98 0.00 0.00 173.24 173.24 2jdu s GLU 95 N -1.87 1.97 0.00 4.02 2.56 -0.46 -1.78 118.70 123.13 2jdu s GLU 95 Ca -0.09 -0.47 0.18 0.00 0.00 0.00 0.00 54.97 54.60 2jdu s GLU 95 Cb -0.08 -1.72 0.01 0.00 2.00 0.00 0.00 34.13 34.34 2jdu s GLU 95 CO -0.01 -0.08 0.94 -0.40 -0.56 0.00 0.00 175.26 175.15 2jdu n ASP 96 N 4.25 1.83 0.00 -1.70 5.68 -1.26 -3.05 116.55 122.30 2jdu n ASP 96 Ca -0.19 -1.41 0.00 0.00 -0.50 0.00 0.00 54.79 52.69 2jdu n ASP 96 Cb 0.51 0.43 0.00 0.00 -1.14 0.00 0.00 41.12 40.92 2jdu n ASP 96 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2jdu n GLY 97 N 1.22 4.30 0.03 6.12 0.00 -1.26 -5.07 105.19 110.52 2jdu n GLY 97 Ca 0.08 -0.55 -0.03 0.00 0.00 0.00 0.00 46.02 45.52 2jdu n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jdu n THR 98 N 0.00 0.36 -0.29 2.61 -2.24 -1.26 -4.87 114.28 108.59 2jdu n THR 98 Ca 0.00 -0.22 0.34 0.00 -2.27 0.00 0.00 64.05 61.91 2jdu n THR 98 Cb 0.00 -0.86 0.71 0.00 -2.10 0.00 0.00 70.33 68.09 2jdu n THR 98 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 2jdu h ASP 99 N 0.00 0.00 0.00 3.42 2.03 -2.01 -3.46 116.42 116.41 2jdu h ASP 99 Ca -0.14 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.16 2jdu h ASP 99 Cb 1.32 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.82 2jdu h ASP 99 CO 0.01 0.00 0.00 -3.20 -1.03 0.00 0.00 179.24 175.02 2jdu n ASN 100 N -3.92 -2.26 0.05 4.15 4.05 -1.26 -4.87 115.26 111.20 2jdu n ASN 100 Ca 0.25 0.00 0.13 0.00 0.45 0.00 0.00 54.58 55.41 2jdu n ASN 100 Cb 1.29 -0.38 0.44 0.00 1.23 0.00 0.00 39.78 42.36 2jdu n ASN 100 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 2jdu n ASP 101 N 0.00 0.47 -3.36 1.20 8.00 -1.26 -4.95 116.55 116.65 2jdu n ASP 101 Ca 0.00 0.40 -0.24 0.00 0.71 0.00 0.00 54.79 55.66 2jdu n ASP 101 Cb 0.00 -0.45 0.03 0.00 -0.02 0.00 0.00 41.12 40.68 2jdu n ASP 101 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2jdu n TYR 102 N -1.89 -2.16 -0.30 1.24 4.01 -1.26 -4.87 117.16 111.93 2jdu n TYR 102 Ca 0.06 0.67 0.03 0.00 -0.16 0.00 0.00 57.90 58.50 2jdu n TYR 102 Cb 0.39 -4.15 0.07 0.00 -0.31 0.00 0.00 39.34 35.33 2jdu n TYR 102 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2jdu n ASN 103 N -2.62 2.31 -0.18 7.72 6.94 -1.13 -1.90 115.26 126.41 2jdu n ASN 103 Ca -0.04 -2.28 -0.09 0.00 -0.02 0.00 0.00 54.58 52.15 2jdu n ASN 103 Cb 0.57 -0.15 0.01 0.00 -2.36 0.00 0.00 39.78 37.85 2jdu n ASN 103 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 2jdu h ASP 104 N 0.40 0.78 -3.92 0.53 3.32 -1.53 -3.26 116.42 112.74 2jdu h ASP 104 Ca 0.00 -0.24 -0.50 0.00 0.02 0.00 0.00 57.03 56.31 2jdu h ASP 104 Cb 0.69 -0.20 -0.31 0.00 0.22 0.00 0.00 39.33 39.73 2jdu h ASP 104 CO 0.01 0.81 -0.82 0.00 -1.72 0.00 0.00 179.24 177.53 2jdu s ALA 105 N -5.28 1.25 -0.09 3.45 0.00 -1.25 -0.96 121.76 118.87 2jdu s ALA 105 Ca -0.13 -0.55 0.04 0.00 0.00 0.00 0.00 51.96 51.32 2jdu s ALA 105 Cb 0.12 -0.41 -0.00 0.00 0.00 0.00 0.00 23.12 22.82 2jdu s ALA 105 CO 0.80 0.23 -0.24 0.08 0.00 0.00 0.00 175.76 176.63 2jdu s VAL 106 N 0.04 2.02 -0.06 0.00 1.01 -0.25 -1.83 120.40 121.34 2jdu s VAL 106 Ca -0.02 -1.01 0.04 0.00 0.00 0.00 0.00 61.98 60.99 2jdu s VAL 106 Cb -0.10 -1.74 0.00 0.00 0.00 0.00 0.00 36.38 34.54 2jdu s VAL 106 CO 0.01 0.55 -0.17 -0.69 0.00 0.00 0.00 175.10 174.80 2jdu s VAL 107 N 0.24 1.46 -0.11 2.92 1.01 0.07 -0.76 120.40 125.23 2jdu s VAL 107 Ca -0.15 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.14 2jdu s VAL 107 Cb -0.17 -1.27 0.01 0.00 0.00 0.00 0.00 36.38 34.95 2jdu s VAL 107 CO 0.08 0.42 -0.20 -0.69 0.00 0.00 0.00 175.10 174.71 2jdu s VAL 108 N 0.22 1.81 -0.13 2.92 1.01 -0.05 -1.22 120.40 124.95 2jdu s VAL 108 Ca -0.08 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 2jdu s VAL 108 Cb -0.13 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 2jdu s VAL 108 CO 0.03 0.50 -0.06 -0.63 0.00 0.00 0.00 175.10 174.94 2jdu s ILE 109 N 0.74 3.68 -0.00 2.22 1.01 0.72 -1.02 121.20 128.55 2jdu s ILE 109 Ca -0.10 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.12 2jdu s ILE 109 Cb -0.16 -2.57 -0.01 0.00 0.01 0.00 0.00 42.46 39.73 2jdu s ILE 109 CO 0.01 0.52 -0.07 0.54 0.00 0.00 0.00 174.94 175.95 2jdu s ASN 110 N 0.08 0.84 0.19 3.58 4.22 -0.54 -0.63 114.94 122.68 2jdu s ASN 110 Ca -0.02 -0.13 -0.17 0.00 -2.14 0.00 0.00 52.86 50.40 2jdu s ASN 110 Cb -0.14 -0.09 0.03 0.00 1.28 0.00 0.00 41.25 42.33 2jdu s ASN 110 CO 0.03 0.09 0.49 -1.66 -2.04 0.00 0.00 177.10 174.01 2jdu s TRP 111 N -0.18 -0.08 0.78 1.54 -2.14 -0.90 -1.09 118.94 116.87 2jdu s TRP 111 Ca 0.03 -0.26 -0.11 0.00 2.66 0.00 0.00 56.10 58.42 2jdu s TRP 111 Cb -0.03 0.34 0.06 0.00 -3.10 0.00 0.00 33.47 30.75 2jdu s TRP 111 CO -0.00 -0.88 1.09 -1.25 -2.66 0.00 0.00 176.95 173.24 2jdu s PRO 112 N -3.87 2.19 0.48 3.25 0.04 -1.26 -0.75 135.00 135.06 2jdu s PRO 112 Ca 0.09 0.81 0.08 0.00 0.04 0.00 0.00 61.00 62.03 2jdu s PRO 112 Cb -0.00 -1.92 0.03 0.00 0.04 0.00 0.00 34.50 32.65 2jdu s PRO 112 CO -0.03 -1.59 0.61 -0.51 0.04 0.00 0.00 177.00 175.51 2jdu s LEU 113 N -5.81 3.40 0.00 -3.56 1.43 -1.26 -5.00 118.68 107.89 2jdu s LEU 113 Ca 0.61 -0.64 0.32 0.00 -1.03 0.00 0.00 54.13 53.38 2jdu s LEU 113 Cb -0.15 -2.18 1.90 0.00 0.03 0.00 0.00 46.19 45.79 2jdu s LEU 113 CO 0.55 -0.95 2.22 0.61 0.23 0.00 0.00 176.35 179.01