#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2djr n SER 2 N 0.00 -3.26 -4.30 1.61 2.88 -1.26 -1.14 113.62 108.15 2djr n SER 2 Ca 0.00 -0.88 -0.38 0.00 -1.33 0.00 0.00 58.87 56.28 2djr n SER 2 Cb 0.00 -3.49 -0.08 0.00 -0.75 0.00 0.00 64.21 59.89 2djr n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2djr n SER 3 N -2.84 -1.42 -3.64 -3.46 3.41 -1.26 -4.83 113.62 99.58 2djr n SER 3 Ca -0.05 -1.15 -0.04 0.00 -0.26 0.00 0.00 58.87 57.37 2djr n SER 3 Cb 0.56 -1.47 -0.06 0.00 -0.26 0.00 0.00 64.21 62.98 2djr n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2djr s GLY 4 N -3.20 0.18 -0.05 5.00 0.00 -0.29 -5.16 107.32 103.80 2djr s GLY 4 Ca 0.70 3.13 0.00 0.00 0.00 0.00 0.00 44.72 48.55 2djr s GLY 4 CO 0.95 1.65 -0.03 -0.56 0.00 0.00 0.00 173.10 175.11 2djr s SER 5 N -0.29 4.97 0.53 1.64 0.01 -1.26 -4.68 113.70 114.62 2djr s SER 5 Ca 0.06 0.03 0.04 0.00 1.31 0.00 0.00 55.95 57.39 2djr s SER 5 Cb -0.04 -1.31 0.04 0.00 0.21 0.00 0.00 66.02 64.92 2djr s SER 5 CO -0.11 0.34 0.30 -1.20 0.41 0.00 0.00 173.24 172.98 2djr n SER 6 N 1.92 2.88 -1.89 2.44 7.64 -1.26 -4.74 113.62 120.61 2djr n SER 6 Ca -0.17 -2.93 -0.15 0.00 1.01 0.00 0.00 58.87 56.63 2djr n SER 6 Cb 0.53 0.05 0.01 0.00 -1.01 0.00 0.00 64.21 63.79 2djr n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2djr n GLY 7 N -1.35 -0.17 0.04 0.23 0.00 -1.26 -4.90 105.19 97.78 2djr n GLY 7 Ca -0.07 -0.22 0.09 0.00 0.00 0.00 0.00 46.02 45.83 2djr n GLY 7 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2djr n SER 8 N -0.94 1.01 0.05 1.61 3.41 -1.26 -4.35 113.62 113.15 2djr n SER 8 Ca -0.12 -1.01 0.21 0.00 -0.26 0.00 0.00 58.87 57.69 2djr n SER 8 Cb 0.60 0.95 0.73 0.00 -0.26 0.00 0.00 64.21 66.24 2djr n SER 8 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2djr h GLU 9 N 0.20 0.00 -0.54 4.33 4.57 -1.97 0.51 114.58 121.67 2djr h GLU 9 Ca 0.00 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 58.27 2djr h GLU 9 Cb 0.48 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.04 2djr h GLU 9 CO 0.00 0.00 0.37 0.00 -1.18 0.00 0.00 179.01 178.20 2djr h ALA 10 N 1.64 2.01 -0.73 2.92 0.00 -1.99 -0.73 119.26 122.37 2djr h ALA 10 Ca 0.22 -0.01 0.21 0.00 0.00 0.00 0.00 54.91 55.33 2djr h ALA 10 Cb 1.02 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 2djr h ALA 10 CO -0.00 -0.12 0.52 -1.49 0.00 0.00 0.00 179.25 178.16 2djr h TRP 11 N 0.38 0.01 -0.05 0.00 4.06 -1.21 0.27 115.95 119.42 2djr h TRP 11 Ca 0.25 0.00 0.01 0.00 2.06 0.00 0.00 58.89 61.21 2djr h TRP 11 Cb 0.47 -0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.63 2djr h TRP 11 CO -0.00 0.00 0.16 0.93 -3.56 0.00 0.00 178.44 175.97 2djr h GLU 12 N 0.01 0.00 -0.47 0.49 4.39 -1.30 0.34 114.58 118.04 2djr h GLU 12 Ca 0.35 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.05 2djr h GLU 12 Cb 1.38 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.03 2djr h GLU 12 CO -0.01 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 178.50 2djr n TYR 13 N -3.22 1.56 -3.65 4.33 4.02 0.95 -4.80 117.16 116.35 2djr n TYR 13 Ca -0.02 -0.76 -0.15 0.00 -0.01 0.00 0.00 57.90 56.97 2djr n TYR 13 Cb 0.23 -0.39 -0.07 0.00 -0.02 0.00 0.00 39.34 39.09 2djr n TYR 13 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 2djr s PHE 14 N -2.61 -0.36 -0.05 -0.72 0.40 0.12 -0.00 117.98 114.75 2djr s PHE 14 Ca 0.49 0.52 -0.02 0.00 -0.60 0.00 0.00 56.93 57.32 2djr s PHE 14 Cb 0.37 0.24 0.04 0.00 0.51 0.00 0.00 43.02 44.17 2djr s PHE 14 CO 0.15 -0.52 0.09 -3.38 0.70 0.00 0.00 175.22 172.26 2djr s HIS 15 N -1.66 -0.06 0.40 0.36 -3.43 0.24 -4.81 115.29 106.33 2djr s HIS 15 Ca -0.10 0.35 -0.25 0.00 -0.80 0.00 0.00 55.06 54.26 2djr s HIS 15 Cb -0.02 -0.24 -0.08 0.00 -1.43 0.00 0.00 32.58 30.80 2djr s HIS 15 CO 0.04 -0.17 1.14 -0.51 -2.00 0.00 0.00 174.74 173.24 2djr s LEU 16 N 1.54 4.17 0.03 5.38 1.43 -1.26 -0.16 118.68 129.80 2djr s LEU 16 Ca -0.04 2.26 -0.10 0.00 -1.03 0.00 0.00 54.13 55.23 2djr s LEU 16 Cb -0.12 -4.08 -0.05 0.00 0.03 0.00 0.00 46.19 41.97 2djr s LEU 16 CO -0.04 -0.65 0.34 0.00 0.23 0.00 0.00 176.35 176.23 2djr s ALA 17 N -1.48 3.77 0.60 4.21 0.00 -1.25 -4.91 121.76 122.70 2djr s ALA 17 Ca 0.58 -0.43 -0.17 0.00 0.00 0.00 0.00 51.96 51.94 2djr s ALA 17 Cb -0.28 -2.21 -0.03 0.00 0.00 0.00 0.00 23.12 20.60 2djr s ALA 17 CO 0.35 0.58 1.12 -1.25 0.00 0.00 0.00 175.76 176.56 2djr s PRO 18 N -1.63 3.09 -0.18 0.00 0.04 -1.26 -4.54 135.00 130.53 2djr s PRO 18 Ca 0.28 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.83 2djr s PRO 18 Cb -0.14 -1.98 0.04 0.00 0.04 0.00 0.00 34.50 32.46 2djr s PRO 18 CO 0.15 -1.04 -0.09 0.00 0.04 0.00 0.00 177.00 176.07 2djr s ALA 19 N -2.04 1.79 -0.45 8.56 0.00 -1.26 -4.89 121.76 123.46 2djr s ALA 19 Ca 0.70 -1.02 -0.09 0.00 0.00 0.00 0.00 51.96 51.55 2djr s ALA 19 Cb -0.22 -1.19 0.11 0.00 0.00 0.00 0.00 23.12 21.81 2djr s ALA 19 CO 0.34 -0.74 0.32 1.03 0.00 0.00 0.00 175.76 176.70 2djr s ARG 20 N 1.50 2.51 -1.22 0.00 3.00 -1.26 -4.57 118.95 118.91 2djr s ARG 20 Ca 0.00 -1.67 -0.06 0.00 0.00 0.00 0.00 55.73 54.00 2djr s ARG 20 Cb -0.15 -3.88 0.01 0.00 0.00 0.00 0.00 34.95 30.92 2djr s ARG 20 CO -0.08 -1.12 1.06 0.00 0.00 0.00 0.00 175.30 175.15 2djr n ALA 21 N 4.91 -1.36 -2.00 2.13 0.00 -1.26 -4.96 120.51 117.97 2djr n ALA 21 Ca -0.09 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2djr n ALA 21 Cb 0.41 -4.47 0.00 0.00 0.00 0.00 0.00 19.45 15.40 2djr n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2djr n GLY 22 N -1.72 0.85 1.54 0.00 0.00 -1.26 -5.10 105.19 99.50 2djr n GLY 22 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2djr n GLY 22 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2djr n HIS 23 N 0.00 -1.28 -3.64 1.61 8.25 -1.26 -5.14 115.22 113.76 2djr n HIS 23 Ca 0.00 0.23 -0.05 0.00 -0.26 0.00 0.00 57.72 57.63 2djr n HIS 23 Cb 0.00 0.31 -0.07 0.00 1.12 0.00 0.00 29.99 31.35 2djr n HIS 23 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 2djr s HIS 24 N -2.00 -0.21 -2.00 4.41 5.65 -1.26 -5.01 115.29 114.88 2djr s HIS 24 Ca 0.00 0.49 0.11 0.00 0.25 0.00 0.00 55.06 55.91 2djr s HIS 24 Cb 0.00 0.44 0.67 0.00 -1.18 0.00 0.00 32.58 32.51 2djr s HIS 24 CO 0.00 -0.11 1.10 -0.35 -0.65 0.00 0.00 174.74 174.73 2djr n PRO 25 N 1.71 0.49 -3.39 2.88 -0.04 -1.26 -3.76 135.00 131.62 2djr n PRO 25 Ca -0.10 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.09 2djr n PRO 25 Cb 0.57 -1.36 -0.08 0.00 -0.04 0.00 0.00 33.50 32.59 2djr n PRO 25 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2djr n ASN 26 N -0.86 3.05 0.02 3.54 4.05 -1.26 -4.23 115.26 119.57 2djr n ASN 26 Ca 0.08 -3.29 0.00 0.00 0.45 0.00 0.00 54.58 51.82 2djr n ASN 26 Cb 0.04 -0.67 0.00 0.00 1.23 0.00 0.00 39.78 40.38 2djr n ASN 26 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2djr n GLN 27 N 0.99 0.00 -4.29 1.20 10.64 -1.25 -5.09 117.38 119.58 2djr n GLN 27 Ca 0.28 0.00 -0.24 0.00 -1.83 0.00 0.00 57.00 55.21 2djr n GLN 27 Cb 0.43 -0.39 -0.13 0.00 -0.86 0.00 0.00 30.24 29.30 2djr n GLN 27 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 2djr s TYR 28 N -2.00 1.82 -0.13 2.61 1.51 -1.26 -4.39 117.35 115.52 2djr s TYR 28 Ca 0.00 -0.42 -0.01 0.00 -1.01 0.00 0.00 57.07 55.64 2djr s TYR 28 Cb 0.00 -1.00 -0.02 0.00 -0.11 0.00 0.00 41.96 40.83 2djr s TYR 28 CO 0.00 0.22 -0.10 0.00 -1.11 0.00 0.00 175.55 174.55 2djr s ALA 29 N -1.16 2.75 -0.39 3.71 0.00 -0.43 -3.81 121.76 122.43 2djr s ALA 29 Ca 0.07 -0.88 -0.19 0.00 0.00 0.00 0.00 51.96 50.96 2djr s ALA 29 Cb -0.10 -1.28 0.01 0.00 0.00 0.00 0.00 23.12 21.75 2djr s ALA 29 CO 0.04 0.29 0.56 0.99 0.00 0.00 0.00 175.76 177.64 2djr s THR 30 N 0.19 4.95 0.16 0.00 2.01 0.77 -0.19 115.64 123.53 2djr s THR 30 Ca -0.06 0.23 -0.31 0.00 0.31 0.00 0.00 61.69 61.85 2djr s THR 30 Cb -0.15 -4.06 -0.11 0.00 0.01 0.00 0.00 72.50 68.19 2djr s THR 30 CO 0.04 -0.37 1.77 0.00 -0.69 0.00 0.00 174.62 175.38 2djr n ARG 32 N 4.83 1.09 -0.10 0.00 1.74 0.99 -1.41 116.66 123.81 2djr n ARG 32 Ca 0.17 -0.51 -0.19 0.00 -0.77 0.00 0.00 57.85 56.54 2djr n ARG 32 Cb 0.37 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 30.21 2djr n ARG 32 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2djr h LEU 33 N 1.25 0.00 0.00 0.55 3.38 -1.90 -3.44 115.31 115.14 2djr h LEU 33 Ca 0.00 -0.47 -0.16 0.00 0.09 0.00 0.00 57.88 57.34 2djr h LEU 33 Cb 0.40 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 2djr h LEU 33 CO 0.00 1.37 -1.58 0.00 0.09 0.00 0.00 178.44 178.33 2djr n GLY 35 N 2.90 1.93 3.79 0.00 0.00 -0.50 -5.05 105.19 108.27 2djr n GLY 35 Ca -0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 2djr n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2djr s ARG 36 N -0.48 3.10 -0.11 1.61 0.52 -1.26 -4.75 118.95 117.57 2djr s ARG 36 Ca 0.00 -0.48 -0.29 0.00 -0.52 0.00 0.00 55.73 54.45 2djr s ARG 36 Cb 0.00 -2.88 -0.01 0.00 0.52 0.00 0.00 34.95 32.58 2djr s ARG 36 CO 0.00 0.65 0.97 -0.65 0.02 0.00 0.00 175.30 176.29 2djr s GLN 37 N -1.78 4.41 -0.11 3.54 -0.21 -1.26 -1.25 119.66 122.99 2djr s GLN 37 Ca 0.24 1.32 -0.00 0.00 0.02 0.00 0.00 55.36 56.93 2djr s GLN 37 Cb -0.12 -3.54 0.02 0.00 1.00 0.00 0.00 33.01 30.37 2djr s GLN 37 CO 0.15 -0.30 -0.08 0.08 -2.12 0.00 0.00 175.29 173.02 2djr s VAL 38 N 1.97 1.06 0.12 1.09 1.01 0.73 -4.93 120.40 121.45 2djr s VAL 38 Ca 0.47 -0.31 -0.13 0.00 0.00 0.00 0.00 61.98 62.01 2djr s VAL 38 Cb -0.18 -1.07 -0.07 0.00 0.00 0.00 0.00 36.38 35.07 2djr s VAL 38 CO 0.17 0.37 0.50 -0.94 0.00 0.00 0.00 175.10 175.21 2djr s SER 39 N 1.66 6.77 0.00 3.32 1.04 -1.26 -1.31 113.70 123.92 2djr s SER 39 Ca 0.04 0.99 0.00 0.00 0.48 0.00 0.00 55.95 57.46 2djr s SER 39 Cb -0.13 -2.25 0.00 0.00 0.10 0.00 0.00 66.02 63.74 2djr s SER 39 CO -0.08 0.13 0.09 0.54 0.98 0.00 0.00 173.24 174.89 2djr n ARG 40 N 0.84 0.00 0.00 4.02 1.74 -1.26 -4.97 116.66 117.03 2djr n ARG 40 Ca -0.06 0.42 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 2djr n ARG 40 Cb 0.52 -0.97 0.00 0.00 -1.02 0.00 0.00 32.46 30.99 2djr n ARG 40 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2djr n GLY 41 N 1.79 0.43 3.70 -0.13 0.00 -1.26 -4.91 105.19 104.80 2djr n GLY 41 Ca 0.00 -2.29 -0.29 0.00 0.00 0.00 0.00 46.02 43.44 2djr n GLY 41 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2djr s PRO 42 N -0.36 0.94 -0.43 1.61 0.04 -1.26 -4.34 135.00 131.19 2djr s PRO 42 Ca 0.00 0.70 -0.22 0.00 0.04 0.00 0.00 61.00 61.52 2djr s PRO 42 Cb 0.00 -1.78 0.03 0.00 0.04 0.00 0.00 34.50 32.79 2djr s PRO 42 CO 0.00 -2.43 0.50 0.41 0.04 0.00 0.00 177.00 175.52 2djr n GLY 43 N -1.12 -0.17 3.99 0.56 0.00 -1.26 -4.96 105.19 102.24 2djr n GLY 43 Ca 0.06 0.78 -0.21 0.00 0.00 0.00 0.00 46.02 46.65 2djr n GLY 43 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2djr s VAL 44 N -1.56 2.11 -0.94 1.61 -7.23 -1.26 -4.69 120.40 108.43 2djr s VAL 44 Ca 0.22 -1.15 -0.04 0.00 -1.81 0.00 0.00 61.98 59.20 2djr s VAL 44 Cb -0.02 -2.26 0.00 0.00 0.56 0.00 0.00 36.38 34.67 2djr s VAL 44 CO 0.68 0.00 0.81 -3.20 -0.31 0.00 0.00 175.10 173.08 2djr n ASN 45 N -2.05 -3.97 -0.55 4.85 2.85 -1.26 -4.94 115.26 110.19 2djr n ASN 45 Ca 0.10 -0.42 0.06 0.00 -0.11 0.00 0.00 54.58 54.22 2djr n ASN 45 Cb 0.62 -3.83 0.20 0.00 1.24 0.00 0.00 39.78 38.01 2djr n ASN 45 CO 0.00 0.00 0.00 0.55 -2.11 0.00 0.00 177.26 175.70 2djr n VAL 46 N -3.92 2.18 0.00 3.44 3.14 -1.26 -5.07 118.33 116.84 2djr n VAL 46 Ca -0.08 -3.16 0.00 0.00 -2.96 0.00 0.00 64.34 58.14 2djr n VAL 46 Cb 0.57 -0.24 0.00 0.00 -1.06 0.00 0.00 33.84 33.11 2djr n VAL 46 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2djr n GLY 47 N -1.15 0.52 3.54 7.55 0.00 -1.26 -5.00 105.19 109.40 2djr n GLY 47 Ca 0.19 -1.18 -0.34 0.00 0.00 0.00 0.00 46.02 44.68 2djr n GLY 47 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2djr n THR 48 N 0.00 -0.06 -1.71 2.61 -1.04 -1.26 -4.87 114.28 107.95 2djr n THR 48 Ca 0.00 -0.60 -0.42 0.00 -2.04 0.00 0.00 64.05 60.99 2djr n THR 48 Cb 0.00 -2.18 -0.03 0.00 -1.82 0.00 0.00 70.33 66.30 2djr n THR 48 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2djr s THR 49 N 11.53 2.28 0.40 12.58 2.01 -1.26 -4.80 115.64 138.37 2djr s THR 49 Ca 1.06 0.02 0.34 0.00 0.31 0.00 0.00 61.69 63.42 2djr s THR 49 Cb -0.41 -3.01 0.50 0.00 0.01 0.00 0.00 72.50 69.60 2djr s THR 49 CO 0.30 0.00 1.22 0.00 -0.69 0.00 0.00 174.62 175.45 2djr n ALA 50 N 4.88 1.32 0.27 7.40 0.00 -1.26 0.11 120.51 133.23 2djr n ALA 50 Ca 0.17 0.58 -0.16 0.00 0.00 0.00 0.00 53.44 54.03 2djr n ALA 50 Cb 0.37 -0.87 -0.08 0.00 0.00 0.00 0.00 19.45 18.87 2djr n ALA 50 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2djr h LEU 51 N 0.00 -0.55 -0.52 0.00 3.38 -1.93 -3.09 115.31 112.61 2djr h LEU 51 Ca 0.72 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.79 2djr h LEU 51 Cb 2.66 0.14 -0.10 0.00 0.09 0.00 0.00 40.66 43.44 2djr h LEU 51 CO -0.15 -0.38 -0.35 -0.50 0.09 0.00 0.00 178.44 177.15 2djr h TRP 52 N -0.67 -0.99 -0.99 1.13 4.06 0.42 0.84 115.95 119.75 2djr h TRP 52 Ca -0.07 0.07 0.31 0.00 2.06 0.00 0.00 58.89 61.27 2djr h TRP 52 Cb 0.51 0.51 -0.18 0.00 -1.00 0.00 0.00 29.16 29.00 2djr h TRP 52 CO -0.04 -0.39 0.19 0.87 -3.56 0.00 0.00 178.44 175.51 2djr h LYS 53 N -0.21 0.02 -0.22 0.49 1.57 -1.51 0.68 116.57 117.39 2djr h LYS 53 Ca 0.20 -0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.91 2djr h LYS 53 Cb 0.55 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 2djr h LYS 53 CO -0.63 0.01 -0.15 1.25 -0.57 0.00 0.00 179.45 179.36 2djr h HIS 54 N 0.02 0.57 -0.91 -1.35 2.76 -0.85 0.03 115.15 115.42 2djr h HIS 54 Ca 0.67 -0.16 0.05 0.00 -2.20 0.00 0.00 60.37 58.73 2djr h HIS 54 Cb 1.53 -0.13 -0.06 0.00 1.55 0.00 0.00 27.41 30.30 2djr h HIS 54 CO -0.34 0.80 0.59 -0.07 -1.30 0.00 0.00 177.93 177.60 2djr h LEU 55 N 0.19 0.96 -0.06 0.26 3.38 0.10 -0.12 115.31 120.01 2djr h LEU 55 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2djr h LEU 55 Cb 0.67 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2djr h LEU 55 CO 0.04 0.64 -0.20 0.29 0.09 0.00 0.00 178.44 179.30 2djr n LYS 56 N -4.53 0.19 0.02 1.13 5.02 0.61 0.25 118.16 120.84 2djr n LYS 56 Ca 0.12 -0.06 -0.20 0.00 -2.02 0.00 0.00 58.31 56.15 2djr n LYS 56 Cb 0.12 -1.50 -0.14 0.00 -0.02 0.00 0.00 35.03 33.49 2djr n LYS 56 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2djr h SER 57 N 0.16 0.38 0.00 4.39 0.87 0.81 -3.37 113.55 116.80 2djr h SER 57 Ca 0.00 -0.90 0.00 0.00 -1.23 0.00 0.00 61.79 59.66 2djr h SER 57 Cb 0.46 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 2djr h SER 57 CO 0.00 1.46 -0.86 1.15 -0.53 0.00 0.00 176.83 178.05 2djr n MET 58 N -4.09 0.51 -0.33 2.24 0.00 -0.61 -4.69 117.12 110.15 2djr n MET 58 Ca -0.19 0.00 0.01 0.00 0.00 0.00 0.00 57.70 57.52 2djr n MET 58 Cb 0.82 -0.93 0.13 0.00 0.00 0.00 0.00 33.22 33.24 2djr n MET 58 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 2djr n HIS 59 N -2.27 0.78 -0.08 3.17 8.25 0.63 -4.30 115.22 121.40 2djr n HIS 59 Ca 0.00 -0.37 0.18 0.00 -0.26 0.00 0.00 57.72 57.27 2djr n HIS 59 Cb 0.43 -0.28 0.59 0.00 1.12 0.00 0.00 29.99 31.85 2djr n HIS 59 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 2djr h ARG 60 N 1.21 0.21 -0.17 -0.41 2.43 -0.36 -0.58 114.38 116.70 2djr h ARG 60 Ca 0.04 -0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 59.04 2djr h ARG 60 Cb 1.12 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2djr h ARG 60 CO 0.21 0.14 -0.49 0.93 -1.51 0.00 0.00 179.97 179.24 2djr h GLU 61 N 0.22 0.63 -0.60 0.20 5.08 -1.84 -2.28 114.58 115.99 2djr h GLU 61 Ca 0.31 -0.45 -0.05 0.00 -1.00 0.00 0.00 59.36 58.16 2djr h GLU 61 Cb 0.92 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.22 2djr h GLU 61 CO -0.06 1.07 0.16 1.49 -1.00 0.00 0.00 179.01 180.67 2djr h GLU 62 N 0.30 0.92 0.48 2.33 4.81 -1.48 -2.17 114.58 119.78 2djr h GLU 62 Ca -0.01 -0.19 -0.02 0.00 -0.13 0.00 0.00 59.36 59.00 2djr h GLU 62 Cb 1.11 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.36 2djr h GLU 62 CO 0.11 0.82 -0.23 -0.07 -0.73 0.00 0.00 179.01 178.90 2djr h LEU 63 N 0.89 -0.55 -0.48 1.64 3.38 -1.23 -2.98 115.31 115.99 2djr h LEU 63 Ca 0.19 -0.07 0.10 0.00 0.09 0.00 0.00 57.88 58.19 2djr h LEU 63 Cb 0.30 0.14 -0.10 0.00 0.09 0.00 0.00 40.66 41.09 2djr h LEU 63 CO -0.00 -0.16 -0.24 -0.33 0.09 0.00 0.00 178.44 177.80 2djr h GLU 64 N -1.03 -0.13 -0.84 1.13 5.08 -1.40 0.35 114.58 117.74 2djr h GLU 64 Ca -0.07 0.01 0.20 0.00 -1.00 0.00 0.00 59.36 58.50 2djr h GLU 64 Cb 0.59 0.03 -0.12 0.00 0.50 0.00 0.00 28.75 29.74 2djr h GLU 64 CO 0.11 -0.09 0.29 0.87 -1.00 0.00 0.00 179.01 179.19 2djr h LYS 65 N -0.14 0.32 -6.79 2.33 1.57 -1.45 -3.42 116.57 109.00 2djr h LYS 65 Ca 0.22 -0.02 -0.45 0.00 -1.87 0.00 0.00 60.65 58.54 2djr h LYS 65 Cb 0.49 -0.07 0.05 0.00 0.08 0.00 0.00 32.23 32.77 2djr h LYS 65 CO -0.56 0.21 -0.06 -1.12 -0.57 0.00 0.00 179.45 177.35 2djr s SER 66 N -5.19 5.14 -0.04 0.86 0.01 0.04 -4.96 113.70 109.55 2djr s SER 66 Ca -0.12 -0.27 -0.05 0.00 1.31 0.00 0.00 55.95 56.82 2djr s SER 66 Cb 0.24 -0.51 -0.23 0.00 0.21 0.00 0.00 66.02 65.73 2djr s SER 66 CO 0.77 -1.24 3.19 0.61 0.41 0.00 0.00 173.24 176.97 2djr n GLY 67 N -2.33 2.76 0.50 3.44 0.00 -1.26 -3.56 105.19 104.74 2djr n GLY 67 Ca 0.10 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.07 2djr n GLY 67 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2djr n HIS 68 N 2.60 0.00 -0.32 1.61 8.25 -1.22 -4.79 115.22 121.35 2djr n HIS 68 Ca 0.38 0.00 0.19 0.00 -0.26 0.00 0.00 57.72 58.03 2djr n HIS 68 Cb 0.78 0.06 0.38 0.00 1.12 0.00 0.00 29.99 32.33 2djr n HIS 68 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 2djr h GLY 69 N 0.00 1.65 -3.66 -1.41 0.00 -1.40 0.40 103.07 98.65 2djr h GLY 69 Ca 0.00 -0.06 -0.30 0.00 0.00 0.00 0.00 47.33 46.97 2djr h GLY 69 CO 0.00 -0.50 0.30 -1.06 0.00 0.00 0.00 176.54 175.27 2djr n GLN 70 N -5.25 1.83 -3.48 4.80 6.02 -1.26 -4.77 117.38 115.26 2djr n GLN 70 Ca 0.27 -1.46 -0.42 0.00 -0.01 0.00 0.00 57.00 55.37 2djr n GLN 70 Cb 0.87 -1.66 -0.04 0.00 1.02 0.00 0.00 30.24 30.42 2djr n GLN 70 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2djr s SER 71 N 0.59 6.32 0.00 1.08 0.01 0.14 -4.96 113.70 116.89 2djr s SER 71 Ca 0.35 -3.04 0.00 0.00 1.31 0.00 0.00 55.95 54.57 2djr s SER 71 Cb 0.24 -2.07 0.00 0.00 0.21 0.00 0.00 66.02 64.40 2djr s SER 71 CO -0.05 -0.41 0.00 0.61 0.41 0.00 0.00 173.24 173.80 2djr n GLY 72 N 3.39 2.11 0.17 3.44 0.00 -1.26 -5.02 105.19 108.01 2djr n GLY 72 Ca 0.15 0.23 0.01 0.00 0.00 0.00 0.00 46.02 46.41 2djr n GLY 72 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2djr h PRO 73 N 0.00 0.00 -4.54 1.61 0.13 -2.02 -3.42 132.00 123.75 2djr h PRO 73 Ca 0.00 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.62 2djr h PRO 73 Cb 0.00 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 30.80 2djr h PRO 73 CO 0.00 0.48 -0.81 -1.54 -0.23 0.00 0.00 178.00 175.89 2djr s SER 74 N -6.86 1.77 -0.27 1.44 1.04 -1.26 -5.11 113.70 104.46 2djr s SER 74 Ca -0.02 -0.30 -0.00 0.00 0.48 0.00 0.00 55.95 56.11 2djr s SER 74 Cb 0.13 -0.82 0.15 0.00 0.10 0.00 0.00 66.02 65.58 2djr s SER 74 CO 0.74 0.03 0.42 -0.55 0.98 0.00 0.00 173.24 174.86 2djr s SER 75 N 0.68 0.08 0.00 7.02 0.15 -1.26 -5.16 113.70 115.21 2djr s SER 75 Ca -0.14 0.05 0.00 0.00 0.70 0.00 0.00 55.95 56.56 2djr s SER 75 Cb -0.16 1.24 0.00 0.00 -1.71 0.00 0.00 66.02 65.39 2djr s SER 75 CO 0.04 -0.32 0.04 0.61 1.20 0.00 0.00 173.24 174.81