#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jdu n THR 2 N 0.00 1.27 -4.20 0.00 -1.04 -1.26 -5.02 114.28 104.03 2jdu n THR 2 Ca 0.00 -0.32 -0.16 0.00 -2.04 0.00 0.00 64.05 61.53 2jdu n THR 2 Cb 0.00 -1.91 -0.11 0.00 -1.82 0.00 0.00 70.33 66.50 2jdu n THR 2 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2jdu s GLN 3 N -0.91 0.92 0.00 -2.82 -1.52 -1.26 -4.84 119.66 109.23 2jdu s GLN 3 Ca 0.62 -1.19 0.00 0.00 -1.95 0.00 0.00 55.36 52.84 2jdu s GLN 3 Cb -0.51 -0.69 0.00 0.00 -0.22 0.00 0.00 33.01 31.59 2jdu s GLN 3 CO 0.53 0.12 0.00 0.41 -0.25 0.00 0.00 175.29 176.10 2jdu n GLY 4 N 0.56 0.53 3.32 3.09 0.00 -1.26 -4.90 105.19 106.53 2jdu n GLY 4 Ca -0.16 -0.06 -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 2.72 -0.01 1.61 1.01 -1.26 -0.39 120.40 122.08 2jdu s VAL 5 Ca 0.00 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.22 2jdu s VAL 5 Cb 0.00 -2.12 0.00 0.00 0.00 0.00 0.00 36.38 34.26 2jdu s VAL 5 CO 0.00 0.53 -0.06 -0.36 0.00 0.00 0.00 175.10 175.21 2jdu s PHE 6 N 0.40 0.65 -0.39 5.22 0.08 0.23 -5.01 117.98 119.16 2jdu s PHE 6 Ca -0.13 -0.13 -0.17 0.00 0.12 0.00 0.00 56.93 56.61 2jdu s PHE 6 Cb -0.16 -0.46 0.01 0.00 -0.57 0.00 0.00 43.02 41.84 2jdu s PHE 6 CO 0.06 -0.05 0.46 0.99 -0.10 0.00 0.00 175.22 176.59 2jdu s THR 7 N 0.07 5.05 0.41 0.64 2.01 -1.26 -1.22 115.64 121.34 2jdu s THR 7 Ca -0.01 -0.06 0.01 0.00 0.31 0.00 0.00 61.69 61.94 2jdu s THR 7 Cb -0.05 -4.00 -0.01 0.00 0.01 0.00 0.00 72.50 68.44 2jdu s THR 7 CO -0.00 -0.33 0.62 -0.76 -0.69 0.00 0.00 174.62 173.46 2jdu s LEU 8 N 2.26 3.77 0.52 4.42 1.02 0.39 -5.01 118.68 126.04 2jdu s LEU 8 Ca 0.15 0.30 -0.22 0.00 0.02 0.00 0.00 54.13 54.38 2jdu s LEU 8 Cb -0.16 -3.18 -0.06 0.00 0.02 0.00 0.00 46.19 42.81 2jdu s LEU 8 CO 0.14 -0.57 1.33 -2.16 0.02 0.00 0.00 176.35 175.11 2jdu s PRO 9 N -4.46 3.32 0.61 1.29 0.04 -1.26 -4.40 135.00 130.13 2jdu s PRO 9 Ca 0.46 2.18 -0.18 0.00 0.04 0.00 0.00 61.00 63.50 2jdu s PRO 9 Cb -0.10 -2.34 -0.03 0.00 0.04 0.00 0.00 34.50 32.07 2jdu s PRO 9 CO 0.37 -1.03 1.20 0.00 0.04 0.00 0.00 177.00 177.58 2jdu s ALA 10 N -1.33 2.50 -1.41 8.56 0.00 -1.26 -3.74 121.76 125.08 2jdu s ALA 10 Ca 0.69 0.95 -0.04 0.00 0.00 0.00 0.00 51.96 53.55 2jdu s ALA 10 Cb -0.39 -3.44 0.03 0.00 0.00 0.00 0.00 23.12 19.32 2jdu s ALA 10 CO 0.47 -1.22 0.69 -1.71 0.00 0.00 0.00 175.76 173.98 2jdu n ASN 11 N -1.75 -1.85 -4.16 0.00 5.15 0.70 -4.90 115.26 108.45 2jdu n ASN 11 Ca 0.13 -0.88 -0.27 0.00 -0.60 0.00 0.00 54.58 52.96 2jdu n ASN 11 Cb 0.50 -3.65 -0.16 0.00 -0.53 0.00 0.00 39.78 35.94 2jdu n ASN 11 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2jdu s THR 12 N -3.65 1.55 0.21 -0.44 2.01 -1.25 -4.86 115.64 109.21 2jdu s THR 12 Ca 0.20 -0.78 -0.30 0.00 0.31 0.00 0.00 61.69 61.12 2jdu s THR 12 Cb -0.10 -1.32 -0.08 0.00 0.01 0.00 0.00 72.50 71.00 2jdu s THR 12 CO 0.85 0.44 1.14 -0.13 -0.69 0.00 0.00 174.62 176.23 2jdu s ARG 13 N -0.01 4.56 0.04 4.92 0.52 -1.26 -0.42 118.95 127.30 2jdu s ARG 13 Ca -0.03 1.81 -0.00 0.00 -0.52 0.00 0.00 55.73 56.98 2jdu s ARG 13 Cb -0.12 -3.24 -0.03 0.00 0.52 0.00 0.00 34.95 32.08 2jdu s ARG 13 CO 0.02 0.04 -0.03 -0.59 0.02 0.00 0.00 175.30 174.76 2jdu s PHE 14 N -0.40 0.43 -0.01 -0.53 -0.71 0.18 -4.05 117.98 112.89 2jdu s PHE 14 Ca 0.49 -0.84 -0.15 0.00 -1.04 0.00 0.00 56.93 55.39 2jdu s PHE 14 Cb -0.31 -0.31 -0.06 0.00 -1.21 0.00 0.00 43.02 41.13 2jdu s PHE 14 CO 0.37 -0.29 0.41 0.20 -1.34 0.00 0.00 175.22 174.57 2jdu s GLY 15 N -2.32 2.47 -0.06 1.99 0.00 0.01 -1.22 107.32 108.19 2jdu s GLY 15 Ca -0.02 -0.22 0.03 0.00 0.00 0.00 0.00 44.72 44.50 2jdu s GLY 15 CO -0.06 0.19 -0.13 0.54 0.00 0.00 0.00 173.10 173.64 2jdu s VAL 16 N -0.94 1.16 -0.02 1.40 0.11 -0.16 -1.27 120.40 120.68 2jdu s VAL 16 Ca 0.24 -0.51 -0.01 0.00 -2.93 0.00 0.00 61.98 58.76 2jdu s VAL 16 Cb -0.17 -1.04 0.02 0.00 -1.53 0.00 0.00 36.38 33.66 2jdu s VAL 16 CO 0.13 0.35 0.05 -0.89 -3.33 0.00 0.00 175.10 171.41 2jdu s THR 17 N 0.48 -0.02 0.01 5.04 2.01 -0.38 -1.28 115.64 121.50 2jdu s THR 17 Ca -0.11 0.08 0.08 0.00 0.31 0.00 0.00 61.69 62.06 2jdu s THR 17 Cb -0.14 -0.09 -0.02 0.00 0.01 0.00 0.00 72.50 72.25 2jdu s THR 17 CO 0.03 0.03 -0.26 0.00 -0.69 0.00 0.00 174.62 173.74 2jdu s ALA 18 N 0.46 2.15 -0.00 7.40 0.00 -0.24 -0.86 121.76 130.67 2jdu s ALA 18 Ca -0.04 -1.16 0.07 0.00 0.00 0.00 0.00 51.96 50.83 2jdu s ALA 18 Cb -0.05 -0.51 -0.02 0.00 0.00 0.00 0.00 23.12 22.54 2jdu s ALA 18 CO -0.02 0.52 -0.21 -0.06 0.00 0.00 0.00 175.76 175.99 2jdu s PHE 19 N -0.68 1.87 -0.05 0.00 0.08 0.43 -1.32 117.98 118.31 2jdu s PHE 19 Ca 0.10 -0.36 0.03 0.00 0.12 0.00 0.00 56.93 56.82 2jdu s PHE 19 Cb -0.10 -1.18 -0.03 0.00 -0.57 0.00 0.00 43.02 41.14 2jdu s PHE 19 CO 0.00 0.00 -0.12 0.00 -0.10 0.00 0.00 175.22 175.00 2jdu s ALA 20 N -0.57 2.76 -0.42 5.36 0.00 -0.61 -0.91 121.76 127.38 2jdu s ALA 20 Ca 0.08 -0.96 0.08 0.00 0.00 0.00 0.00 51.96 51.16 2jdu s ALA 20 Cb -0.08 -1.04 0.25 0.00 0.00 0.00 0.00 23.12 22.25 2jdu s ALA 20 CO -0.00 0.56 0.63 0.09 0.00 0.00 0.00 175.76 177.04 2jdu n ASN 21 N 2.26 -0.63 -3.54 0.00 3.02 -0.38 -1.60 115.26 114.39 2jdu n ASN 21 Ca -0.17 -2.87 -0.17 0.00 -0.03 0.00 0.00 54.58 51.34 2jdu n ASN 21 Cb 0.52 0.03 -0.06 0.00 -0.61 0.00 0.00 39.78 39.66 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 -1.36 -0.62 0.22 6.41 0.15 0.82 -4.11 113.70 115.21 2jdu s SER 22 Ca 0.34 0.72 0.22 0.00 0.70 0.00 0.00 55.95 57.94 2jdu s SER 22 Cb 0.19 0.57 0.93 0.00 -1.71 0.00 0.00 66.02 66.00 2jdu s SER 22 CO -0.14 -0.54 1.68 -1.54 1.20 0.00 0.00 173.24 173.89 2jdu n SER 23 N 1.01 0.58 -4.90 5.45 3.41 -1.26 -3.82 113.62 114.10 2jdu n SER 23 Ca -0.17 0.64 -0.32 0.00 -0.26 0.00 0.00 58.87 58.75 2jdu n SER 23 Cb 0.57 -0.76 -0.05 0.00 -0.26 0.00 0.00 64.21 63.71 2jdu n SER 23 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2jdu s ASN 24 N -4.07 6.49 0.11 4.04 0.01 -1.26 -4.96 114.94 115.29 2jdu s ASN 24 Ca 0.05 0.57 -0.31 0.00 -0.71 0.00 0.00 52.86 52.46 2jdu s ASN 24 Cb 0.10 -2.08 -0.08 0.00 0.41 0.00 0.00 41.25 39.59 2jdu s ASN 24 CO 0.38 0.10 1.43 -0.89 -1.51 0.00 0.00 177.10 176.61 2jdu s THR 25 N -1.57 3.25 0.04 1.60 2.01 -1.26 -4.73 115.64 114.97 2jdu s THR 25 Ca 0.38 0.87 -0.04 0.00 0.31 0.00 0.00 61.69 63.20 2jdu s THR 25 Cb -0.13 -3.56 -0.05 0.00 0.01 0.00 0.00 72.50 68.78 2jdu s THR 25 CO 0.23 0.06 0.26 -1.10 -0.69 0.00 0.00 174.62 173.38 2jdu s GLN 26 N 1.31 3.54 -0.12 4.92 -1.52 -0.16 -4.39 119.66 123.24 2jdu s GLN 26 Ca 0.66 -0.19 0.01 0.00 -1.95 0.00 0.00 55.36 53.88 2jdu s GLN 26 Cb -0.37 -3.03 0.02 0.00 -0.22 0.00 0.00 33.01 29.41 2jdu s GLN 26 CO 0.30 0.61 -0.12 0.99 -0.25 0.00 0.00 175.29 176.82 2jdu s THR 27 N -1.42 1.34 -0.16 -0.19 2.01 -0.23 -2.11 115.64 114.88 2jdu s THR 27 Ca 0.32 -0.51 -0.01 0.00 0.31 0.00 0.00 61.69 61.80 2jdu s THR 27 Cb -0.13 -1.27 -0.01 0.00 0.01 0.00 0.00 72.50 71.10 2jdu s THR 27 CO 0.21 0.42 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.76 2jdu s VAL 28 N 1.38 3.19 -0.07 3.82 1.01 0.12 -0.88 120.40 128.97 2jdu s VAL 28 Ca 0.01 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.41 2jdu s VAL 28 Cb -0.13 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 2jdu s VAL 28 CO -0.07 0.50 -0.12 0.20 0.00 0.00 0.00 175.10 175.61 2jdu s ASN 29 N 0.69 4.21 -0.19 3.32 0.01 0.38 -0.89 114.94 122.46 2jdu s ASN 29 Ca -0.05 -0.16 -0.01 0.00 -0.71 0.00 0.00 52.86 51.93 2jdu s ASN 29 Cb -0.15 -1.05 0.01 0.00 0.41 0.00 0.00 41.25 40.47 2jdu s ASN 29 CO 0.02 0.32 -0.15 -0.69 -1.51 0.00 0.00 177.10 175.10 2jdu s VAL 30 N -0.59 2.51 -0.12 1.60 1.01 -0.00 -1.09 120.40 123.72 2jdu s VAL 30 Ca 0.09 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 2jdu s VAL 30 Cb -0.11 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 2jdu s VAL 30 CO 0.01 0.50 0.04 -0.76 0.00 0.00 0.00 175.10 174.90 2jdu s LEU 31 N 1.33 3.79 -0.15 3.92 1.02 0.62 -0.33 118.68 128.88 2jdu s LEU 31 Ca 0.05 0.19 0.02 0.00 0.02 0.00 0.00 54.13 54.40 2jdu s LEU 31 Cb -0.14 -1.90 0.01 0.00 0.02 0.00 0.00 46.19 44.18 2jdu s LEU 31 CO -0.09 0.33 -0.20 -0.69 0.02 0.00 0.00 176.35 175.72 2jdu s VAL 32 N -0.56 2.20 -1.45 -1.59 1.01 0.30 -1.24 120.40 119.07 2jdu s VAL 32 Ca 0.10 -0.92 -0.01 0.00 0.00 0.00 0.00 61.98 61.15 2jdu s VAL 32 Cb -0.12 -1.90 0.01 0.00 0.00 0.00 0.00 36.38 34.37 2jdu s VAL 32 CO 0.02 0.54 0.36 -3.20 0.00 0.00 0.00 175.10 172.82 2jdu n ASN 33 N 4.19 -0.21 -0.21 3.32 5.15 -0.26 -1.73 115.26 125.52 2jdu n ASN 33 Ca -0.20 -1.06 -0.03 0.00 -0.60 0.00 0.00 54.58 52.69 2jdu n ASN 33 Cb 0.51 -2.76 -0.01 0.00 -0.53 0.00 0.00 39.78 36.99 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 -2.95 -4.77 -4.30 1.20 5.03 -1.26 -4.99 115.26 103.21 2jdu n ASN 34 Ca -0.30 0.07 -0.31 0.00 0.87 0.00 0.00 54.58 54.91 2jdu n ASN 34 Cb 0.68 -2.51 -0.16 0.00 -1.02 0.00 0.00 39.78 36.76 2jdu n ASN 34 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2jdu s GLU 35 N -1.62 2.33 0.09 3.52 0.41 -0.70 -5.06 118.70 117.67 2jdu s GLU 35 Ca 0.00 -0.90 -0.31 0.00 -0.41 0.00 0.00 54.97 53.35 2jdu s GLU 35 Cb 0.00 -2.12 -0.09 0.00 -1.78 0.00 0.00 34.13 30.14 2jdu s GLU 35 CO 0.00 0.49 1.79 0.99 -0.49 0.00 0.00 175.26 178.04 2jdu s THR 36 N -0.43 2.76 -0.02 3.63 2.01 -1.26 -0.54 115.64 121.80 2jdu s THR 36 Ca 0.04 0.19 0.05 0.00 0.31 0.00 0.00 61.69 62.29 2jdu s THR 36 Cb -0.12 -3.12 -0.08 0.00 0.01 0.00 0.00 72.50 69.19 2jdu s THR 36 CO 0.01 -0.00 0.09 0.00 -0.69 0.00 0.00 174.62 174.03 2jdu n ALA 37 N 5.90 2.10 -3.40 7.40 0.00 0.56 -4.86 120.51 128.21 2jdu n ALA 37 Ca 0.17 -0.19 -0.16 0.00 0.00 0.00 0.00 53.44 53.27 2jdu n ALA 37 Cb 0.39 -0.09 -0.07 0.00 0.00 0.00 0.00 19.45 19.68 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 -2.30 -1.33 -0.02 0.00 0.00 -1.01 -5.01 121.76 112.09 2jdu s ALA 38 Ca -0.02 0.89 -0.00 0.00 0.00 0.00 0.00 51.96 52.83 2jdu s ALA 38 Cb 0.03 0.01 0.03 0.00 0.00 0.00 0.00 23.12 23.19 2jdu s ALA 38 CO 0.22 -0.32 0.03 0.99 0.00 0.00 0.00 175.76 176.68 2jdu s THR 39 N -1.22 -0.05 0.10 0.00 2.01 -1.26 -0.82 115.64 114.40 2jdu s THR 39 Ca -0.12 0.19 0.08 0.00 0.31 0.00 0.00 61.69 62.15 2jdu s THR 39 Cb -0.02 -0.08 -0.03 0.00 0.01 0.00 0.00 72.50 72.37 2jdu s THR 39 CO 0.07 0.08 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.53 2jdu s PHE 40 N 0.97 1.66 0.02 4.92 0.08 -0.07 -4.97 117.98 120.58 2jdu s PHE 40 Ca -0.08 -0.43 -0.18 0.00 0.12 0.00 0.00 56.93 56.36 2jdu s PHE 40 Cb -0.12 -0.92 0.04 0.00 -0.57 0.00 0.00 43.02 41.45 2jdu s PHE 40 CO -0.03 0.17 0.41 0.45 -0.10 0.00 0.00 175.22 176.12 2jdu s SER 41 N -1.88 -0.29 0.00 1.36 0.15 -1.26 0.12 113.70 111.90 2jdu s SER 41 Ca 0.05 0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.80 2jdu s SER 41 Cb -0.10 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 2jdu s SER 41 CO 0.04 -0.59 0.00 0.61 1.20 0.00 0.00 173.24 174.50 2jdu n GLY 42 N 0.78 -0.75 2.66 9.45 0.00 -0.90 -4.85 105.19 111.58 2jdu n GLY 42 Ca -0.19 -1.02 -0.23 0.00 0.00 0.00 0.00 46.02 44.58 2jdu n GLY 42 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jdu s GLN 43 N -2.00 0.17 -0.01 1.61 -0.44 -1.26 -0.99 119.66 116.74 2jdu s GLN 43 Ca 0.00 -0.11 -0.10 0.00 -2.50 0.00 0.00 55.36 52.65 2jdu s GLN 43 Cb 0.00 -1.32 0.01 0.00 -1.64 0.00 0.00 33.01 30.06 2jdu s GLN 43 CO 0.00 -0.80 0.19 0.45 0.50 0.00 0.00 175.29 175.63 2jdu s SER 44 N 2.22 -0.05 -0.16 6.67 0.15 -1.25 -5.02 113.70 116.26 2jdu s SER 44 Ca 0.06 -0.09 0.16 0.00 0.70 0.00 0.00 55.95 56.78 2jdu s SER 44 Cb -0.16 0.25 0.54 0.00 -1.71 0.00 0.00 66.02 64.94 2jdu s SER 44 CO -0.20 -0.38 1.44 0.35 1.20 0.00 0.00 173.24 175.65 2jdu n THR 45 N 1.46 2.14 -2.59 6.45 -2.24 -1.26 -0.13 114.28 118.11 2jdu n THR 45 Ca -0.22 -1.69 -0.02 0.00 -2.27 0.00 0.00 64.05 59.85 2jdu n THR 45 Cb 0.56 -0.14 0.05 0.00 -2.10 0.00 0.00 70.33 68.69 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 -0.20 1.92 -1.25 3.42 5.15 -1.26 -4.82 115.26 118.21 2jdu n ASN 46 Ca 0.21 -2.35 -0.11 0.00 -0.60 0.00 0.00 54.58 51.73 2jdu n ASN 46 Cb 0.86 -0.42 -0.01 0.00 -0.53 0.00 0.00 39.78 39.67 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 -0.41 -3.78 -4.66 1.20 5.15 -0.63 -4.96 115.26 107.18 2jdu n ASN 47 Ca 0.12 0.03 -0.44 0.00 -0.60 0.00 0.00 54.58 53.70 2jdu n ASN 47 Cb 0.89 -2.92 -0.01 0.00 -0.53 0.00 0.00 39.78 37.21 2jdu n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jdu n ALA 48 N -1.20 0.73 -2.78 5.20 0.00 -1.22 -4.51 120.51 116.73 2jdu n ALA 48 Ca -0.13 0.38 -0.43 0.00 0.00 0.00 0.00 53.44 53.26 2jdu n ALA 48 Cb 0.57 -2.17 -0.02 0.00 0.00 0.00 0.00 19.45 17.83 2jdu n ALA 48 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2jdu s VAL 49 N -0.93 4.46 0.08 0.00 1.01 -1.26 -1.57 120.40 122.20 2jdu s VAL 49 Ca 0.58 -1.51 0.33 0.00 0.00 0.00 0.00 61.98 61.39 2jdu s VAL 49 Cb -0.63 -4.93 0.39 0.00 0.00 0.00 0.00 36.38 31.21 2jdu s VAL 49 CO 0.60 -1.71 1.98 0.16 0.00 0.00 0.00 175.10 176.12 2jdu h ILE 50 N 5.94 0.00 -2.11 2.22 3.07 -1.54 -3.45 117.51 121.64 2jdu h ILE 50 Ca 0.22 -0.51 0.07 0.00 1.55 0.00 0.00 64.86 66.20 2jdu h ILE 50 Cb 0.98 1.50 -0.18 0.00 -0.27 0.00 0.00 36.82 38.86 2jdu h ILE 50 CO 1.26 0.00 0.45 -0.83 -1.05 0.00 0.00 178.15 177.98 2jdu s GLY 51 N -4.16 -0.44 -0.18 0.16 0.00 -1.21 -4.36 107.32 97.13 2jdu s GLY 51 Ca 0.01 1.29 -0.19 0.00 0.00 0.00 0.00 44.72 45.83 2jdu s GLY 51 CO 0.54 0.58 0.52 -1.08 0.00 0.00 0.00 173.10 173.67 2jdu s THR 52 N -2.39 0.00 -0.14 0.90 -1.32 -1.26 -1.08 115.64 110.36 2jdu s THR 52 Ca 0.01 -0.03 -0.29 0.00 -1.21 0.00 0.00 61.69 60.18 2jdu s THR 52 Cb -0.01 -0.74 0.07 0.00 -1.51 0.00 0.00 72.50 70.31 2jdu s THR 52 CO -0.04 -0.01 0.70 -1.58 -2.21 0.00 0.00 174.62 171.47 2jdu s GLN 53 N 0.11 0.97 -0.15 7.08 0.74 -0.41 -5.00 119.66 123.00 2jdu s GLN 53 Ca -0.01 0.55 -0.16 0.00 0.05 0.00 0.00 55.36 55.78 2jdu s GLN 53 Cb -0.04 0.46 -0.04 0.00 1.10 0.00 0.00 33.01 34.50 2jdu s GLN 53 CO 0.01 -0.24 0.41 0.08 -0.55 0.00 0.00 175.29 175.01 2jdu s VAL 54 N -0.57 5.22 0.20 1.34 1.01 -1.26 -0.99 120.40 125.35 2jdu s VAL 54 Ca -0.07 0.79 0.07 0.00 0.00 0.00 0.00 61.98 62.77 2jdu s VAL 54 Cb -0.02 -3.75 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 2jdu s VAL 54 CO 0.06 0.32 -0.12 -0.76 0.00 0.00 0.00 175.10 174.60 2jdu s LEU 55 N 0.77 2.53 -0.17 3.92 1.43 -0.36 -4.97 118.68 121.84 2jdu s LEU 55 Ca 0.22 -1.04 -0.07 0.00 -1.03 0.00 0.00 54.13 52.21 2jdu s LEU 55 Cb -0.14 -0.58 -0.04 0.00 0.03 0.00 0.00 46.19 45.45 2jdu s LEU 55 CO 0.08 -0.23 0.08 0.21 0.23 0.00 0.00 176.35 176.72 2jdu s ASN 56 N -3.29 5.82 0.06 2.29 3.84 -1.26 -0.64 114.94 121.75 2jdu s ASN 56 Ca 0.22 0.18 0.16 0.00 0.21 0.00 0.00 52.86 53.63 2jdu s ASN 56 Cb 0.01 -1.95 0.68 0.00 -0.55 0.00 0.00 41.25 39.43 2jdu s ASN 56 CO 0.06 0.23 1.50 -1.54 -2.79 0.00 0.00 177.10 174.57 2jdu n SER 57 N 3.14 0.16 -0.51 -4.21 3.41 0.44 -4.89 113.62 111.15 2jdu n SER 57 Ca -0.17 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 58.98 2jdu n SER 57 Cb 0.53 -0.57 -0.00 0.00 -0.26 0.00 0.00 64.21 63.90 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 -0.08 -1.53 0.22 5.00 0.00 -1.26 -2.49 105.19 105.05 2jdu n GLY 58 Ca 0.03 -1.21 0.11 0.00 0.00 0.00 0.00 46.02 44.95 2jdu n GLY 58 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jdu h SER 59 N -0.03 0.00 0.87 1.61 4.64 -1.95 0.20 113.55 118.90 2jdu h SER 59 Ca 0.00 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.21 2jdu h SER 59 Cb 0.03 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.10 2jdu h SER 59 CO 0.00 0.15 -1.20 0.77 -0.87 0.00 0.00 176.83 175.68 2jdu h SER 60 N 0.00 0.00 0.00 4.97 4.64 -1.97 -3.45 113.55 117.74 2jdu h SER 60 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jdu h SER 60 Cb 0.88 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 2jdu h SER 60 CO 0.02 0.39 0.00 0.61 -0.87 0.00 0.00 176.83 176.98 2jdu n GLY 61 N 1.32 0.44 3.67 -0.77 0.00 -1.04 -4.84 105.19 103.97 2jdu n GLY 61 Ca -0.06 0.00 -0.42 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 -0.62 4.31 -0.07 1.61 2.20 -1.26 -0.46 119.74 125.45 2jdu s LYS 62 Ca 0.00 1.16 0.03 0.00 -0.36 0.00 0.00 55.97 56.81 2jdu s LYS 62 Cb 0.00 -3.58 0.00 0.00 -1.51 0.00 0.00 37.83 32.74 2jdu s LYS 62 CO 0.00 -0.40 -0.17 0.08 -0.36 0.00 0.00 175.35 174.50 2jdu s VAL 63 N 2.37 1.49 -0.05 4.02 1.01 -0.36 -1.10 120.40 127.78 2jdu s VAL 63 Ca 0.41 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.71 2jdu s VAL 63 Cb -0.17 -1.31 0.02 0.00 0.00 0.00 0.00 36.38 34.92 2jdu s VAL 63 CO 0.12 0.43 -0.08 -1.58 0.00 0.00 0.00 175.10 173.99 2jdu s GLN 64 N 0.39 1.21 -0.18 2.72 0.74 -0.37 -0.60 119.66 123.57 2jdu s GLN 64 Ca -0.13 -0.27 -0.07 0.00 0.05 0.00 0.00 55.36 54.95 2jdu s GLN 64 Cb -0.15 -1.08 -0.04 0.00 1.10 0.00 0.00 33.01 32.84 2jdu s GLN 64 CO 0.05 -0.00 0.04 0.08 -0.55 0.00 0.00 175.29 174.90 2jdu s VAL 65 N 0.68 4.58 0.02 1.34 1.01 0.48 -0.28 120.40 128.23 2jdu s VAL 65 Ca -0.12 -0.11 0.07 0.00 0.00 0.00 0.00 61.98 61.82 2jdu s VAL 65 Cb -0.14 -3.05 -0.02 0.00 0.00 0.00 0.00 36.38 33.17 2jdu s VAL 65 CO 0.02 0.47 -0.20 -1.10 0.00 0.00 0.00 175.10 174.28 2jdu s GLN 66 N 0.36 1.48 -0.02 2.72 -0.21 -0.25 -4.73 119.66 119.01 2jdu s GLN 66 Ca 0.01 -0.84 0.04 0.00 0.02 0.00 0.00 55.36 54.59 2jdu s GLN 66 Cb -0.13 -1.53 -0.01 0.00 1.00 0.00 0.00 33.01 32.35 2jdu s GLN 66 CO 0.01 0.40 -0.15 0.08 -2.12 0.00 0.00 175.29 173.51 2jdu s VAL 67 N -0.66 1.23 0.06 1.09 1.01 -1.26 -0.47 120.40 121.40 2jdu s VAL 67 Ca 0.07 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.41 2jdu s VAL 67 Cb -0.08 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 2jdu s VAL 67 CO 0.01 0.35 -0.05 -0.94 0.00 0.00 0.00 175.10 174.47 2jdu s SER 68 N -0.21 0.72 -0.19 3.32 1.04 -0.06 -0.75 113.70 117.58 2jdu s SER 68 Ca 0.03 -0.90 -0.00 0.00 0.48 0.00 0.00 55.95 55.55 2jdu s SER 68 Cb -0.08 0.14 0.05 0.00 0.10 0.00 0.00 66.02 66.23 2jdu s SER 68 CO 0.00 -0.48 -0.06 -0.69 0.98 0.00 0.00 173.24 172.99 2jdu s VAL 69 N -3.31 1.28 -0.97 5.02 1.01 -0.22 -1.07 120.40 122.14 2jdu s VAL 69 Ca 0.04 -0.81 -0.04 0.00 0.00 0.00 0.00 61.98 61.18 2jdu s VAL 69 Cb 0.03 -1.46 0.03 0.00 0.00 0.00 0.00 36.38 34.99 2jdu s VAL 69 CO -0.06 0.09 0.19 -0.46 0.00 0.00 0.00 175.10 174.86 2jdu n ASN 70 N 4.80 -3.30 0.00 3.32 0.23 -1.26 -1.37 115.26 117.68 2jdu n ASN 70 Ca -0.13 0.01 0.00 0.00 -0.53 0.00 0.00 54.58 53.93 2jdu n ASN 70 Cb 0.47 -2.80 0.00 0.00 -2.08 0.00 0.00 39.78 35.37 2jdu n ASN 70 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2jdu n GLY 71 N -0.89 3.09 3.66 4.83 0.00 -1.26 -5.06 105.19 109.56 2jdu n GLY 71 Ca -0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 2jdu n GLY 71 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2jdu s ARG 72 N -0.65 4.19 0.31 1.61 3.52 -0.47 -5.03 118.95 122.44 2jdu s ARG 72 Ca 0.00 0.48 -0.29 0.00 -0.13 0.00 0.00 55.73 55.79 2jdu s ARG 72 Cb 0.00 -3.57 -0.11 0.00 -1.56 0.00 0.00 34.95 29.71 2jdu s ARG 72 CO 0.00 -0.19 1.52 -2.14 -0.81 0.00 0.00 175.30 173.68 2jdu s PRO 73 N 1.76 4.15 0.43 5.12 0.02 -1.26 -1.05 135.00 144.16 2jdu s PRO 73 Ca 0.26 2.51 -0.09 0.00 0.02 0.00 0.00 61.00 63.69 2jdu s PRO 73 Cb -0.16 -3.02 -0.06 0.00 0.02 0.00 0.00 34.50 31.29 2jdu s PRO 73 CO 0.10 -0.54 0.79 -1.12 -0.33 0.00 0.00 177.00 175.89 2jdu s SER 74 N 0.21 6.46 0.20 2.53 0.01 0.07 -4.89 113.70 118.29 2jdu s SER 74 Ca 0.58 1.11 -0.30 0.00 1.31 0.00 0.00 55.95 58.65 2jdu s SER 74 Cb -0.46 -2.32 -0.08 0.00 0.21 0.00 0.00 66.02 63.38 2jdu s SER 74 CO 0.52 -0.46 1.06 -0.62 0.41 0.00 0.00 173.24 174.15 2jdu s ASP 75 N -3.39 7.36 0.11 2.44 2.15 -0.96 -4.78 116.67 119.60 2jdu s ASP 75 Ca 0.51 2.07 0.06 0.00 0.43 0.00 0.00 52.55 55.61 2jdu s ASP 75 Cb -0.10 -2.61 -0.04 0.00 -0.30 0.00 0.00 42.92 39.87 2jdu s ASP 75 CO 0.35 -0.13 -0.01 -0.76 -0.17 0.00 0.00 175.17 174.45 2jdu s LEU 76 N -0.66 3.38 0.09 -1.34 1.43 -1.26 -1.32 118.68 119.00 2jdu s LEU 76 Ca 0.47 -0.26 0.07 0.00 -1.03 0.00 0.00 54.13 53.38 2jdu s LEU 76 Cb -0.29 -2.10 -0.03 0.00 0.03 0.00 0.00 46.19 43.80 2jdu s LEU 76 CO 0.35 0.15 -0.18 0.68 0.23 0.00 0.00 176.35 177.58 2jdu s VAL 77 N -1.40 1.46 0.20 -1.59 -7.23 -0.37 -4.87 120.40 106.58 2jdu s VAL 77 Ca 0.26 -1.46 -0.23 0.00 -1.81 0.00 0.00 61.98 58.74 2jdu s VAL 77 Cb -0.11 -1.36 0.05 0.00 0.56 0.00 0.00 36.38 35.52 2jdu s VAL 77 CO 0.18 -0.14 0.68 -0.94 -0.31 0.00 0.00 175.10 174.57 2jdu s SER 78 N -1.86 -0.42 0.06 4.85 1.04 -1.26 -0.63 113.70 115.48 2jdu s SER 78 Ca 0.03 -0.26 -0.27 0.00 0.48 0.00 0.00 55.95 55.93 2jdu s SER 78 Cb -0.10 0.63 0.09 0.00 0.10 0.00 0.00 66.02 66.74 2jdu s SER 78 CO 0.03 -1.10 0.87 0.00 0.98 0.00 0.00 173.24 174.03 2jdu s ALA 79 N -3.76 -1.74 0.02 5.32 0.00 -0.87 -4.92 121.76 115.80 2jdu s ALA 79 Ca 0.06 0.69 0.07 0.00 0.00 0.00 0.00 51.96 52.79 2jdu s ALA 79 Cb -0.03 0.53 -0.03 0.00 0.00 0.00 0.00 23.12 23.60 2jdu s ALA 79 CO -0.04 -0.80 -0.21 -1.14 0.00 0.00 0.00 175.76 173.57 2jdu s GLN 80 N -3.25 2.05 -0.01 0.00 0.74 -1.26 -0.66 119.66 117.28 2jdu s GLN 80 Ca 0.07 -0.97 0.02 0.00 0.05 0.00 0.00 55.36 54.52 2jdu s GLN 80 Cb -0.01 -2.12 -0.01 0.00 1.10 0.00 0.00 33.01 31.97 2jdu s GLN 80 CO -0.06 0.55 -0.07 0.54 -0.55 0.00 0.00 175.29 175.69 2jdu s VAL 81 N -0.81 0.58 -0.11 1.34 0.11 0.17 -5.00 120.40 116.67 2jdu s VAL 81 Ca 0.12 -0.31 0.03 0.00 -2.93 0.00 0.00 61.98 58.89 2jdu s VAL 81 Cb -0.10 -0.49 0.01 0.00 -1.53 0.00 0.00 36.38 34.27 2jdu s VAL 81 CO 0.03 0.16 -0.21 -0.63 -3.33 0.00 0.00 175.10 171.12 2jdu s ILE 82 N -0.17 1.92 -0.08 7.04 1.01 -1.26 -1.04 121.20 128.63 2jdu s ILE 82 Ca 0.03 -0.92 -0.01 0.00 0.00 0.00 0.00 60.65 59.75 2jdu s ILE 82 Cb -0.03 -1.69 -0.03 0.00 0.01 0.00 0.00 42.46 40.72 2jdu s ILE 82 CO -0.00 0.53 -0.02 -0.76 0.00 0.00 0.00 174.94 174.68 2jdu s LEU 83 N 0.64 3.43 -1.12 2.97 1.43 0.18 -4.55 118.68 121.65 2jdu s LEU 83 Ca -0.12 0.08 -0.10 0.00 -1.03 0.00 0.00 54.13 52.95 2jdu s LEU 83 Cb -0.16 -1.78 0.09 0.00 0.03 0.00 0.00 46.19 44.37 2jdu s LEU 83 CO 0.03 0.37 0.38 1.07 0.23 0.00 0.00 176.35 178.43 2jdu n THR 84 N 2.14 -0.53 -1.78 5.49 5.66 -1.26 -1.25 114.28 122.74 2jdu n THR 84 Ca -0.18 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.62 2jdu n THR 84 Cb 0.53 -1.12 -0.07 0.00 -1.55 0.00 0.00 70.33 68.13 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 -2.13 -5.42 0.00 1.09 5.15 -1.26 -4.67 115.26 108.01 2jdu n ASN 85 Ca 0.01 0.38 0.00 0.00 -0.60 0.00 0.00 54.58 54.38 2jdu n ASN 85 Cb 0.51 -4.73 0.00 0.00 -0.53 0.00 0.00 39.78 35.03 2jdu n ASN 85 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 2jdu n GLU 86 N -2.49 0.55 -3.61 1.20 0.00 -0.45 -5.09 120.64 110.74 2jdu n GLU 86 Ca -0.21 0.00 -0.38 0.00 0.00 0.00 0.00 57.16 56.57 2jdu n GLU 86 Cb 0.67 -0.19 -0.11 0.00 0.00 0.00 0.00 31.44 31.81 2jdu n GLU 86 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 2jdu s LEU 87 N -0.76 4.03 -0.09 4.31 2.96 -0.38 -4.38 118.68 124.37 2jdu s LEU 87 Ca 0.00 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 53.95 2jdu s LEU 87 Cb 0.00 -2.11 -0.02 0.00 0.50 0.00 0.00 46.19 44.56 2jdu s LEU 87 CO 0.00 -0.02 -0.15 0.20 -1.32 0.00 0.00 176.35 175.06 2jdu s ASN 88 N 1.56 3.92 -0.08 3.68 -0.87 -0.08 -0.64 114.94 122.43 2jdu s ASN 88 Ca 0.07 -0.30 0.03 0.00 -1.57 0.00 0.00 52.86 51.09 2jdu s ASN 88 Cb -0.15 -1.26 0.01 0.00 -0.02 0.00 0.00 41.25 39.83 2jdu s ASN 88 CO 0.09 0.24 -0.17 -0.36 -2.57 0.00 0.00 177.10 174.33 2jdu s PHE 89 N -0.10 1.94 -0.17 2.20 0.40 -0.21 -2.02 117.98 120.02 2jdu s PHE 89 Ca -0.02 -0.78 -0.03 0.00 -0.60 0.00 0.00 56.93 55.50 2jdu s PHE 89 Cb -0.14 -1.35 -0.02 0.00 0.51 0.00 0.00 43.02 42.02 2jdu s PHE 89 CO 0.04 -0.35 -0.06 0.00 0.70 0.00 0.00 175.22 175.55 2jdu s ALA 90 N 0.58 2.87 -0.05 5.36 0.00 0.19 -0.66 121.76 130.05 2jdu s ALA 90 Ca -0.15 -0.93 0.06 0.00 0.00 0.00 0.00 51.96 50.94 2jdu s ALA 90 Cb -0.17 -1.53 -0.01 0.00 0.00 0.00 0.00 23.12 21.42 2jdu s ALA 90 CO 0.05 0.05 -0.24 -0.51 0.00 0.00 0.00 175.76 175.11 2jdu s LEU 91 N 0.66 2.04 -0.02 0.00 1.43 0.17 -0.36 118.68 122.60 2jdu s LEU 91 Ca -0.03 -0.48 0.02 0.00 -1.03 0.00 0.00 54.13 52.61 2jdu s LEU 91 Cb -0.15 -1.30 0.00 0.00 0.03 0.00 0.00 46.19 44.78 2jdu s LEU 91 CO 0.02 0.24 -0.07 -0.69 0.23 0.00 0.00 176.35 176.09 2jdu s VAL 92 N -0.21 0.59 0.32 -1.59 1.01 0.08 -2.05 120.40 118.55 2jdu s VAL 92 Ca -0.01 -0.28 0.08 0.00 0.00 0.00 0.00 61.98 61.77 2jdu s VAL 92 Cb -0.13 -0.53 -0.06 0.00 0.00 0.00 0.00 36.38 35.66 2jdu s VAL 92 CO 0.03 0.19 -0.08 -0.83 0.00 0.00 0.00 175.10 174.40 2jdu s GLY 93 N 0.12 2.04 -0.04 4.51 0.00 0.19 -0.80 107.32 113.34 2jdu s GLY 93 Ca -0.01 -2.01 -0.16 0.00 0.00 0.00 0.00 44.72 42.54 2jdu s GLY 93 CO -0.00 -1.95 0.35 -1.35 0.00 0.00 0.00 173.10 170.15 2jdu s SER 94 N -3.54 -0.26 -0.09 1.64 1.04 -0.69 -1.24 113.70 110.55 2jdu s SER 94 Ca 0.31 0.25 0.01 0.00 0.48 0.00 0.00 55.95 57.01 2jdu s SER 94 Cb 0.03 0.41 0.02 0.00 0.10 0.00 0.00 66.02 66.57 2jdu s SER 94 CO 0.15 -0.41 -0.12 -0.70 0.98 0.00 0.00 173.24 173.13 2jdu s GLU 95 N -1.06 1.88 0.00 4.02 2.56 -0.44 -1.63 118.70 124.03 2jdu s GLU 95 Ca -0.11 -0.44 0.13 0.00 0.00 0.00 0.00 54.97 54.55 2jdu s GLU 95 Cb -0.04 -1.65 0.21 0.00 2.00 0.00 0.00 34.13 34.64 2jdu s GLU 95 CO 0.04 -0.08 1.07 -0.40 -0.56 0.00 0.00 175.26 175.33 2jdu n ASP 96 N 4.24 2.49 0.00 -1.70 5.68 -1.26 -2.27 116.55 123.73 2jdu n ASP 96 Ca -0.19 -1.73 0.00 0.00 -0.50 0.00 0.00 54.79 52.37 2jdu n ASP 96 Cb 0.51 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.38 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 0.71 4.71 0.01 6.12 0.00 -1.26 -5.07 105.19 110.41 2jdu n GLY 97 Ca 0.10 -0.71 0.01 0.00 0.00 0.00 0.00 46.02 45.43 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 0.00 1.05 2.61 -2.24 -1.26 -4.70 114.28 109.75 2jdu n THR 98 Ca 0.00 -0.44 0.12 0.00 -2.27 0.00 0.00 64.05 61.46 2jdu n THR 98 Cb 0.00 1.00 0.14 0.00 -2.10 0.00 0.00 70.33 69.37 2jdu n THR 98 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2jdu n ASP 99 N -0.98 0.99 -3.88 3.42 5.75 -1.26 -4.98 116.55 115.61 2jdu n ASP 99 Ca 0.01 -0.80 -0.29 0.00 -0.01 0.00 0.00 54.79 53.70 2jdu n ASP 99 Cb 0.05 0.47 0.03 0.00 -1.03 0.00 0.00 41.12 40.63 2jdu n ASP 99 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2jdu n ASN 100 N -1.08 -4.60 0.14 -1.12 3.02 -1.26 -4.90 115.26 105.47 2jdu n ASN 100 Ca 0.07 -0.77 0.13 0.00 -0.03 0.00 0.00 54.58 53.98 2jdu n ASN 100 Cb 0.36 -3.96 0.29 0.00 -0.61 0.00 0.00 39.78 35.86 2jdu n ASN 100 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 2jdu h ASP 101 N -2.11 0.00 -4.04 6.41 2.03 -1.93 -3.48 116.42 113.30 2jdu h ASP 101 Ca -0.58 -0.01 -0.21 0.00 -0.73 0.00 0.00 57.03 55.50 2jdu h ASP 101 Cb 1.37 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.86 2jdu h ASP 101 CO 0.66 0.01 -0.27 -1.22 -1.03 0.00 0.00 179.24 177.39 2jdu n TYR 102 N -2.57 -1.52 -0.39 4.15 4.01 -1.26 -4.83 117.16 114.76 2jdu n TYR 102 Ca 0.05 0.01 0.04 0.00 -0.16 0.00 0.00 57.90 57.84 2jdu n TYR 102 Cb 0.47 -2.47 0.09 0.00 -0.31 0.00 0.00 39.34 37.12 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 -1.76 2.45 -0.15 7.72 6.94 -1.14 -1.71 115.26 127.60 2jdu n ASN 103 Ca -0.12 -2.36 -0.11 0.00 -0.02 0.00 0.00 54.58 51.96 2jdu n ASN 103 Cb 0.59 -0.20 -0.01 0.00 -2.36 0.00 0.00 39.78 37.80 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 0.56 0.90 -3.72 0.53 3.32 -1.46 -3.23 116.42 113.33 2jdu h ASP 104 Ca 0.00 -0.37 -0.44 0.00 0.02 0.00 0.00 57.03 56.23 2jdu h ASP 104 Cb 0.76 -0.25 -0.32 0.00 0.22 0.00 0.00 39.33 39.74 2jdu h ASP 104 CO 0.02 1.07 -0.79 0.00 -1.72 0.00 0.00 179.24 177.82 2jdu s ALA 105 N -4.75 0.92 -0.10 3.45 0.00 -1.26 -1.25 121.76 118.78 2jdu s ALA 105 Ca -0.12 -0.32 0.03 0.00 0.00 0.00 0.00 51.96 51.55 2jdu s ALA 105 Cb 0.11 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 2jdu s ALA 105 CO 0.84 0.12 -0.21 0.08 0.00 0.00 0.00 175.76 176.60 2jdu s VAL 106 N 0.34 2.36 -0.06 0.00 1.01 -0.09 -2.34 120.40 121.63 2jdu s VAL 106 Ca -0.06 -0.92 0.04 0.00 0.00 0.00 0.00 61.98 61.04 2jdu s VAL 106 Cb -0.10 -1.92 -0.00 0.00 0.00 0.00 0.00 36.38 34.35 2jdu s VAL 106 CO 0.01 0.55 -0.18 -0.69 0.00 0.00 0.00 175.10 174.79 2jdu s VAL 107 N 0.23 1.53 -0.10 2.92 1.01 0.02 -0.43 120.40 125.57 2jdu s VAL 107 Ca -0.13 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.12 2jdu s VAL 107 Cb -0.17 -1.32 0.01 0.00 0.00 0.00 0.00 36.38 34.90 2jdu s VAL 107 CO 0.07 0.44 -0.18 -0.69 0.00 0.00 0.00 175.10 174.73 2jdu s VAL 108 N 0.17 1.67 -0.12 2.92 1.01 -0.04 -0.74 120.40 125.26 2jdu s VAL 108 Ca -0.08 -0.77 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 2jdu s VAL 108 Cb -0.13 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.74 2jdu s VAL 108 CO 0.03 0.47 -0.07 -0.63 0.00 0.00 0.00 175.10 174.91 2jdu s ILE 109 N 0.66 3.67 0.01 2.22 1.01 0.51 -1.25 121.20 128.03 2jdu s ILE 109 Ca -0.13 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.08 2jdu s ILE 109 Cb -0.16 -2.56 -0.01 0.00 0.01 0.00 0.00 42.46 39.73 2jdu s ILE 109 CO 0.03 0.53 -0.06 0.54 0.00 0.00 0.00 174.94 175.98 2jdu s ASN 110 N 0.00 0.72 0.14 3.58 4.22 -0.40 -0.64 114.94 122.57 2jdu s ASN 110 Ca -0.01 -0.24 -0.18 0.00 -2.14 0.00 0.00 52.86 50.30 2jdu s ASN 110 Cb -0.14 -0.04 0.04 0.00 1.28 0.00 0.00 41.25 42.40 2jdu s ASN 110 CO 0.03 -0.01 0.46 -1.66 -2.04 0.00 0.00 177.10 173.87 2jdu s TRP 111 N -0.51 -0.27 0.70 1.54 -2.14 -0.86 -0.81 118.94 116.60 2jdu s TRP 111 Ca -0.01 -0.02 -0.11 0.00 2.66 0.00 0.00 56.10 58.61 2jdu s TRP 111 Cb -0.05 0.34 0.01 0.00 -3.10 0.00 0.00 33.47 30.67 2jdu s TRP 111 CO -0.00 -0.75 1.07 -1.25 -2.66 0.00 0.00 176.95 173.36 2jdu s PRO 112 N -3.80 2.92 0.49 3.25 0.04 -1.26 -0.90 135.00 135.74 2jdu s PRO 112 Ca 0.03 0.71 0.08 0.00 0.04 0.00 0.00 61.00 61.87 2jdu s PRO 112 Cb 0.01 -2.01 0.03 0.00 0.04 0.00 0.00 34.50 32.58 2jdu s PRO 112 CO -0.11 -1.05 0.59 -0.51 0.04 0.00 0.00 177.00 175.95 2jdu s LEU 113 N -5.45 3.30 0.00 -3.56 1.43 -1.26 -4.99 118.68 108.15 2jdu s LEU 113 Ca 0.58 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.95 2jdu s LEU 113 Cb -0.13 -2.01 0.00 0.00 0.03 0.00 0.00 46.19 44.08 2jdu s LEU 113 CO 0.54 -0.98 0.00 0.61 0.23 0.00 0.00 176.35 176.75