#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuk s SER 2 N 0.00 4.57 0.49 1.61 1.04 -1.26 -5.12 113.70 115.03 2yuk s SER 2 Ca 0.00 0.09 0.04 0.00 0.48 0.00 0.00 55.95 56.57 2yuk s SER 2 Cb 0.00 -0.64 -0.01 0.00 0.10 0.00 0.00 66.02 65.47 2yuk s SER 2 CO 0.00 -1.72 0.17 -0.94 0.98 0.00 0.00 173.24 171.73 2yuk s SER 3 N -4.61 4.33 0.00 7.02 1.04 -1.26 -5.05 113.70 115.17 2yuk s SER 3 Ca 0.63 -1.39 0.00 0.00 0.48 0.00 0.00 55.95 55.67 2yuk s SER 3 Cb -0.08 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.25 2yuk s SER 3 CO 0.44 -0.84 0.00 0.61 0.98 0.00 0.00 173.24 174.43 2yuk n GLY 4 N -1.39 0.06 3.37 7.32 0.00 -1.26 -5.02 105.19 108.27 2yuk n GLY 4 Ca -0.09 -1.68 -0.32 0.00 0.00 0.00 0.00 46.02 43.93 2yuk n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yuk s SER 5 N -4.00 3.71 -0.35 1.61 1.04 -1.26 -5.05 113.70 109.40 2yuk s SER 5 Ca 0.00 -0.34 -0.36 0.00 0.48 0.00 0.00 55.95 55.73 2yuk s SER 5 Cb 0.00 -1.11 -0.16 0.00 0.10 0.00 0.00 66.02 64.86 2yuk s SER 5 CO 0.00 0.25 1.20 -1.20 0.98 0.00 0.00 173.24 174.47 2yuk n SER 6 N 2.92 0.84 -3.40 7.02 7.64 -1.26 -4.55 113.62 122.84 2yuk n SER 6 Ca -0.18 0.92 -0.48 0.00 1.01 0.00 0.00 58.87 60.15 2yuk n SER 6 Cb 0.52 -0.69 -0.07 0.00 -1.01 0.00 0.00 64.21 62.97 2yuk n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yuk n GLY 7 N 2.91 0.08 3.38 0.23 0.00 -1.26 -4.58 105.19 105.94 2yuk n GLY 7 Ca 0.23 0.70 -0.55 0.00 0.00 0.00 0.00 46.02 46.40 2yuk n GLY 7 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2yuk n ASN 8 N 2.57 1.51 -4.43 1.61 4.13 -1.26 -4.84 115.26 114.55 2yuk n ASN 8 Ca 0.21 0.58 -0.44 0.00 1.68 0.00 0.00 54.58 56.60 2yuk n ASN 8 Cb -0.03 -1.09 -0.01 0.00 -1.54 0.00 0.00 39.78 37.12 2yuk n ASN 8 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2yuk s ALA 9 N 6.48 4.02 -0.30 5.41 0.00 -1.26 -4.85 121.76 131.26 2yuk s ALA 9 Ca 1.14 -3.34 -0.12 0.00 0.00 0.00 0.00 51.96 49.64 2yuk s ALA 9 Cb -1.16 -3.97 0.18 0.00 0.00 0.00 0.00 23.12 18.16 2yuk s ALA 9 CO 0.58 -2.68 1.03 -1.14 0.00 0.00 0.00 175.76 173.56 2yuk s GLN 10 N 1.18 0.19 -0.12 0.00 2.00 -1.26 -5.14 119.66 116.51 2yuk s GLN 10 Ca 0.37 0.29 -0.30 0.00 -2.00 0.00 0.00 55.36 53.72 2yuk s GLN 10 Cb -0.05 0.15 -0.02 0.00 0.80 0.00 0.00 33.01 33.89 2yuk s GLN 10 CO -0.04 -0.25 1.24 1.03 -0.50 0.00 0.00 175.29 176.77 2yuk s ARG 11 N 2.95 4.28 0.09 1.67 3.00 -1.26 -4.96 118.95 124.72 2yuk s ARG 11 Ca 0.07 1.67 -0.17 0.00 0.00 0.00 0.00 55.73 57.30 2yuk s ARG 11 Cb -0.08 -3.68 0.04 0.00 0.00 0.00 0.00 34.95 31.23 2yuk s ARG 11 CO -0.15 -0.60 0.41 -1.12 0.00 0.00 0.00 175.30 173.84 2yuk s SER 12 N 1.78 -0.25 0.63 0.23 0.01 -1.26 -5.02 113.70 109.82 2yuk s SER 12 Ca 0.55 -0.20 0.36 0.00 1.31 0.00 0.00 55.95 57.97 2yuk s SER 12 Cb -0.23 0.46 2.00 0.00 0.21 0.00 0.00 66.02 68.45 2yuk s SER 12 CO 0.18 -0.78 2.21 0.71 0.41 0.00 0.00 173.24 175.96 2yuk h THR 13 N 2.60 0.22 0.00 1.44 1.35 -2.00 -0.59 112.91 115.93 2yuk h THR 13 Ca -0.33 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.52 2yuk h THR 13 Cb 1.24 0.90 -0.00 0.00 -1.73 0.00 0.00 68.15 68.56 2yuk h THR 13 CO 0.46 0.00 -0.03 -0.07 -0.25 0.00 0.00 175.52 175.62 2yuk h LEU 14 N 0.00 0.00 0.06 3.87 3.38 -1.97 -2.85 115.31 117.79 2yuk h LEU 14 Ca 0.02 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.78 2yuk h LEU 14 Cb 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2yuk h LEU 14 CO -0.00 0.03 -1.09 0.50 0.09 0.00 0.00 178.44 177.98 2yuk h LYS 15 N 0.00 0.12 -0.90 1.13 3.64 -1.47 -3.37 116.57 115.71 2yuk h LYS 15 Ca -0.00 -0.20 0.18 0.00 -1.27 0.00 0.00 60.65 59.36 2yuk h LYS 15 Cb 0.06 0.08 -0.17 0.00 -0.41 0.00 0.00 32.23 31.79 2yuk h LYS 15 CO 0.00 1.10 -0.23 -1.49 -2.27 0.00 0.00 179.45 176.56 2yuk h TRP 16 N -0.66 -0.49 -1.13 1.91 4.06 -1.43 0.85 115.95 119.05 2yuk h TRP 16 Ca -0.26 0.08 0.34 0.00 2.06 0.00 0.00 58.89 61.11 2yuk h TRP 16 Cb 1.47 0.36 -0.12 0.00 -1.00 0.00 0.00 29.16 29.87 2yuk h TRP 16 CO 0.15 -0.39 0.71 1.49 -3.56 0.00 0.00 178.44 176.84 2yuk h GLU 17 N -0.00 0.26 0.28 0.49 4.22 -1.68 0.27 114.58 118.42 2yuk h GLU 17 Ca 0.43 -0.02 -0.01 0.00 0.08 0.00 0.00 59.36 59.84 2yuk h GLU 17 Cb 0.66 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.85 2yuk h GLU 17 CO -0.93 0.18 -0.14 0.87 -2.18 0.00 0.00 179.01 176.81 2yuk h LYS 18 N 0.27 -0.36 -0.19 1.92 1.57 0.52 -3.18 116.57 117.12 2yuk h LYS 18 Ca 0.70 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 59.57 2yuk h LYS 18 Cb 1.92 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 34.30 2yuk h LYS 18 CO -0.41 -0.05 0.25 0.93 -0.57 0.00 0.00 179.45 179.60 2yuk h GLU 19 N -0.98 0.00 -0.16 3.15 4.39 -0.77 0.28 114.58 120.50 2yuk h GLU 19 Ca -0.04 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 2yuk h GLU 19 Cb 0.48 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 2yuk h GLU 19 CO 0.06 0.00 0.08 0.93 -1.16 0.00 0.00 179.01 178.93 2yuk h GLU 20 N 0.00 0.21 -0.00 2.33 4.39 -0.52 -1.37 114.58 119.63 2yuk h GLU 20 Ca 0.09 -0.02 -0.17 0.00 0.34 0.00 0.00 59.36 59.61 2yuk h GLU 20 Cb 0.59 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.17 2yuk h GLU 20 CO -0.00 0.16 -0.77 0.00 -1.16 0.00 0.00 179.01 177.24 2yuk h ALA 21 N 1.88 0.71 0.00 3.43 0.00 -1.03 -2.99 119.26 121.26 2yuk h ALA 21 Ca 0.06 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2yuk h ALA 21 Cb 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2yuk h ALA 21 CO -0.01 0.94 0.00 1.28 0.00 0.00 0.00 179.25 181.46 2yuk n LEU 22 N -3.64 0.59 0.00 0.00 4.77 -0.55 -4.93 117.00 113.24 2yuk n LEU 22 Ca -0.01 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 2yuk n LEU 22 Cb 0.74 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2yuk n LEU 22 CO 0.44 -0.32 0.00 0.61 -1.33 0.00 0.00 177.39 176.79 2yuk n GLY 23 N 0.68 2.76 0.20 -0.72 0.00 -1.01 0.02 105.19 107.12 2yuk n GLY 23 Ca 0.04 0.32 0.14 0.00 0.00 0.00 0.00 46.02 46.52 2yuk n GLY 23 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2yuk h GLU 24 N 0.00 0.00 -0.10 1.61 5.08 -1.88 0.20 114.58 119.49 2yuk h GLU 24 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2yuk h GLU 24 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2yuk h GLU 24 CO 0.00 0.00 0.00 -1.33 -1.00 0.00 0.00 179.01 176.68 2yuk n MET 25 N -2.46 1.76 -1.66 2.33 2.81 0.10 -4.94 117.12 115.06 2yuk n MET 25 Ca -0.02 -1.12 -0.54 0.00 -1.81 0.00 0.00 57.70 54.22 2yuk n MET 25 Cb 0.06 -1.44 -0.06 0.00 -0.71 0.00 0.00 33.22 31.06 2yuk n MET 25 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2yuk n ALA 26 N 0.34 -0.26 1.06 3.04 0.00 0.71 -4.81 120.51 120.60 2yuk n ALA 26 Ca 0.18 0.43 0.01 0.00 0.00 0.00 0.00 53.44 54.05 2yuk n ALA 26 Cb 0.36 -2.21 0.04 0.00 0.00 0.00 0.00 19.45 17.64 2yuk n ALA 26 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2yuk n THR 27 N 3.81 0.22 -4.40 0.00 -2.24 -1.26 -4.50 114.28 105.91 2yuk n THR 27 Ca 0.22 -0.12 -0.24 0.00 -2.27 0.00 0.00 64.05 61.64 2yuk n THR 27 Cb 0.18 -0.34 -0.11 0.00 -2.10 0.00 0.00 70.33 67.96 2yuk n THR 27 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2yuk s VAL 28 N -1.36 2.18 -0.03 2.28 1.01 -1.26 -4.44 120.40 118.78 2yuk s VAL 28 Ca 0.05 -2.12 -0.19 0.00 0.00 0.00 0.00 61.98 59.72 2yuk s VAL 28 Cb 0.04 -2.08 -0.12 0.00 0.00 0.00 0.00 36.38 34.21 2yuk s VAL 28 CO 0.02 -0.29 0.83 0.00 0.00 0.00 0.00 175.10 175.66 2yuk h ALA 29 N 2.90 -0.49 0.08 5.51 0.00 -1.88 -2.89 119.26 122.50 2yuk h ALA 29 Ca -0.43 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.31 2yuk h ALA 29 Cb 1.22 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.20 2yuk h ALA 29 CO 0.53 -0.50 -0.04 -1.00 0.00 0.00 0.00 179.25 178.24 2yuk h PRO 30 N -1.03 -0.10 0.00 0.00 0.13 -1.92 -1.54 132.00 127.54 2yuk h PRO 30 Ca -0.05 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 2yuk h PRO 30 Cb 0.50 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.65 2yuk h PRO 30 CO 0.08 0.35 0.14 0.28 -0.23 0.00 0.00 178.00 178.62 2yuk h VAL 31 N -0.59 0.00 0.00 1.56 2.07 -1.90 -2.38 116.25 115.00 2yuk h VAL 31 Ca -0.01 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 67.32 2yuk h VAL 31 Cb 0.50 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 2yuk h VAL 31 CO 0.02 0.00 -1.25 -0.11 0.02 0.00 0.00 177.57 176.25 2yuk n LEU 32 N -2.53 1.87 -0.25 2.57 7.94 -1.09 -3.61 117.00 121.89 2yuk n LEU 32 Ca -0.02 0.46 -0.04 0.00 -1.11 0.00 0.00 56.01 55.30 2yuk n LEU 32 Cb 0.18 -0.90 0.02 0.00 0.53 0.00 0.00 43.42 43.24 2yuk n LEU 32 CO 0.12 0.09 0.62 0.22 -1.11 0.00 0.00 177.39 177.32 2yuk h TYR 33 N -1.00 -0.97 -0.45 1.96 5.03 -0.78 0.66 116.97 121.42 2yuk h TYR 33 Ca -0.29 0.08 0.01 0.00 2.58 0.00 0.00 58.73 61.11 2yuk h TYR 33 Cb 1.13 0.53 -0.02 0.00 1.55 0.00 0.00 36.73 39.91 2yuk h TYR 33 CO -0.05 -0.39 0.29 1.79 -1.32 0.00 0.00 178.16 178.48 2yuk h THR 34 N -0.12 1.11 -1.03 1.81 1.35 -1.70 0.33 112.91 114.67 2yuk h THR 34 Ca 0.26 -0.21 0.27 0.00 -0.55 0.00 0.00 66.41 66.19 2yuk h THR 34 Cb 0.56 0.45 -0.07 0.00 -1.73 0.00 0.00 68.15 67.36 2yuk h THR 34 CO -0.76 0.11 0.69 0.78 -0.25 0.00 0.00 175.52 176.09 2yuk h ASN 35 N 0.60 0.29 0.00 5.36 2.35 -0.96 0.89 115.58 124.10 2yuk h ASN 35 Ca 0.17 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2yuk h ASN 35 Cb -0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.31 2yuk h ASN 35 CO -0.04 0.07 -0.31 -0.38 -1.65 0.00 0.00 177.43 175.12 2yuk n ILE 36 N -4.47 0.70 -0.18 2.81 5.41 -0.74 -4.00 119.36 118.90 2yuk n ILE 36 Ca 0.23 0.35 -0.01 0.00 1.00 0.00 0.00 62.75 64.33 2yuk n ILE 36 Cb 0.93 -1.93 0.08 0.00 -0.71 0.00 0.00 39.64 38.02 2yuk n ILE 36 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 2yuk h ASN 37 N -0.49 -0.19 -3.67 4.38 2.35 -0.29 -3.23 115.58 114.44 2yuk h ASN 37 Ca 0.00 0.13 -0.69 0.00 -0.55 0.00 0.00 56.30 55.19 2yuk h ASN 37 Cb 0.31 0.22 -0.36 0.00 0.05 0.00 0.00 38.32 38.53 2yuk h ASN 37 CO 0.00 -0.07 -0.27 -0.36 -1.65 0.00 0.00 177.43 175.08 2yuk s PHE 38 N -6.15 3.64 0.18 1.19 0.40 0.31 -4.91 117.98 112.64 2yuk s PHE 38 Ca -0.13 -2.95 -0.07 0.00 -0.60 0.00 0.00 56.93 53.18 2yuk s PHE 38 Cb 0.17 -3.15 0.07 0.00 0.51 0.00 0.00 43.02 40.62 2yuk s PHE 38 CO 0.73 -0.75 1.52 -1.00 0.70 0.00 0.00 175.22 176.42 2yuk h PRO 39 N 6.34 0.77 -0.30 0.24 0.13 -1.65 -2.85 132.00 134.68 2yuk h PRO 39 Ca 0.08 -0.41 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2yuk h PRO 39 Cb 0.86 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.01 2yuk h PRO 39 CO 0.78 1.03 0.00 0.09 -0.23 0.00 0.00 178.00 179.67 2yuk n ASN 40 N -4.04 1.66 -0.27 1.44 4.13 -1.26 -4.50 115.26 112.42 2yuk n ASN 40 Ca -0.02 -1.98 -0.07 0.00 1.68 0.00 0.00 54.58 54.19 2yuk n ASN 40 Cb 0.54 -0.20 -0.06 0.00 -1.54 0.00 0.00 39.78 38.51 2yuk n ASN 40 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 2yuk n LEU 41 N 0.40 -0.68 -0.29 3.41 7.94 -1.08 0.60 117.00 127.30 2yuk n LEU 41 Ca 0.11 1.39 0.14 0.00 -1.11 0.00 0.00 56.01 56.53 2yuk n LEU 41 Cb 0.27 -0.27 0.27 0.00 0.53 0.00 0.00 43.42 44.21 2yuk n LEU 41 CO 0.07 -1.05 0.69 2.29 -1.11 0.00 0.00 177.39 178.29 2yuk n LYS 42 N -4.49 -0.07 0.36 1.96 2.85 -1.26 0.14 118.16 117.66 2yuk n LYS 42 Ca 0.01 1.26 -0.18 0.00 -1.05 0.00 0.00 58.31 58.35 2yuk n LYS 42 Cb 0.17 -2.02 -0.09 0.00 -0.65 0.00 0.00 35.03 32.43 2yuk n LYS 42 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 2yuk h GLU 43 N 0.00 -0.97 -1.00 -1.58 5.08 -0.19 -1.01 114.58 114.92 2yuk h GLU 43 Ca 0.53 0.07 0.17 0.00 -1.00 0.00 0.00 59.36 59.12 2yuk h GLU 43 Cb 1.13 0.22 -0.10 0.00 0.50 0.00 0.00 28.75 30.50 2yuk h GLU 43 CO -0.78 -0.64 0.61 0.93 -1.00 0.00 0.00 179.01 178.12 2yuk h GLU 44 N -1.00 0.81 -2.98 2.33 4.39 0.02 -3.33 114.58 114.83 2yuk h GLU 44 Ca -0.08 -0.05 -0.58 0.00 0.34 0.00 0.00 59.36 58.99 2yuk h GLU 44 Cb 0.81 -0.18 -0.40 0.00 -0.10 0.00 0.00 28.75 28.88 2yuk h GLU 44 CO 0.08 0.54 -0.78 -0.06 -1.16 0.00 0.00 179.01 177.62 2yuk s PHE 45 N -5.90 1.30 0.08 4.33 0.40 -0.12 -4.99 117.98 113.08 2yuk s PHE 45 Ca -0.12 -1.80 -0.17 0.00 -0.60 0.00 0.00 56.93 54.24 2yuk s PHE 45 Cb 0.24 -1.41 -0.10 0.00 0.51 0.00 0.00 43.02 42.25 2yuk s PHE 45 CO 0.80 -0.83 1.40 -1.00 0.70 0.00 0.00 175.22 176.29 2yuk h PRO 46 N 7.37 0.59 -6.36 0.24 0.13 -1.31 -3.40 132.00 129.26 2yuk h PRO 46 Ca -0.04 -0.31 -0.57 0.00 -0.87 0.00 0.00 66.00 64.21 2yuk h PRO 46 Cb 0.97 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.07 2yuk h PRO 46 CO 0.41 0.90 1.06 -0.51 -0.23 0.00 0.00 178.00 179.63 2yuk s ASP 47 N -6.40 6.46 0.13 1.44 1.11 -1.26 -4.90 116.67 113.26 2yuk s ASP 47 Ca -0.13 1.28 -0.32 0.00 0.18 0.00 0.00 52.55 53.55 2yuk s ASP 47 Cb 0.08 -2.54 -0.10 0.00 1.07 0.00 0.00 42.92 41.43 2yuk s ASP 47 CO 0.80 -1.25 1.55 -0.25 1.18 0.00 0.00 175.17 177.21 2yuk h TRP 48 N 10.27 -1.69 -1.23 4.23 -0.00 -1.98 0.61 115.95 126.15 2yuk h TRP 48 Ca -0.29 0.08 0.36 0.00 -0.00 0.00 0.00 58.89 59.04 2yuk h TRP 48 Cb 1.12 0.80 -0.05 0.00 -0.00 0.00 0.00 29.16 31.03 2yuk h TRP 48 CO 0.91 -0.48 1.20 1.15 -0.00 0.00 0.00 178.44 181.22 2yuk h THR 49 N -0.37 0.05 0.02 2.65 2.02 -1.97 0.97 112.91 116.28 2yuk h THR 49 Ca 0.08 0.00 -0.37 0.00 0.77 0.00 0.00 66.41 66.89 2yuk h THR 49 Cb 0.59 0.07 -0.06 0.00 -1.74 0.00 0.00 68.15 67.01 2yuk h THR 49 CO -0.62 0.00 -2.28 0.41 0.37 0.00 0.00 175.52 173.40 2yuk n THR 50 N -3.50 1.53 0.06 3.16 -1.04 0.17 -4.26 114.28 110.40 2yuk n THR 50 Ca 0.27 -0.68 -0.13 0.00 -2.04 0.00 0.00 64.05 61.47 2yuk n THR 50 Cb 1.57 -1.20 -0.09 0.00 -1.82 0.00 0.00 70.33 68.79 2yuk n THR 50 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 2yuk h ARG 51 N 0.01 -0.16 -0.90 -2.82 2.43 0.51 -3.15 114.38 110.31 2yuk h ARG 51 Ca -0.51 0.01 0.25 0.00 -0.81 0.00 0.00 59.98 58.92 2yuk h ARG 51 Cb 2.03 0.04 -0.14 0.00 -0.42 0.00 0.00 29.97 31.47 2yuk h ARG 51 CO -0.01 0.22 0.27 -0.24 -1.51 0.00 0.00 179.97 178.71 2yuk h VAL 52 N -0.57 0.29 -0.81 0.20 3.04 -0.53 0.64 116.25 118.51 2yuk h VAL 52 Ca -0.02 -0.07 0.02 0.00 -1.01 0.00 0.00 66.70 65.63 2yuk h VAL 52 Cb 0.45 0.07 -0.04 0.00 -2.01 0.00 0.00 31.29 29.75 2yuk h VAL 52 CO 0.03 0.04 0.54 0.11 -1.01 0.00 0.00 177.57 177.27 2yuk h LYS 53 N 0.21 1.01 -0.11 4.17 1.57 -1.73 -1.34 116.57 120.36 2yuk h LYS 53 Ca 0.58 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 59.24 2yuk h LYS 53 Cb 1.20 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.27 2yuk h LYS 53 CO -0.66 0.67 -0.21 1.96 -0.57 0.00 0.00 179.45 180.63 2yuk h GLN 54 N 1.04 0.18 -0.34 3.15 1.08 0.32 -2.36 115.11 118.18 2yuk h GLN 54 Ca 0.31 -0.05 -0.10 0.00 -1.45 0.00 0.00 58.65 57.37 2yuk h GLN 54 Cb -0.03 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.37 2yuk h GLN 54 CO -0.08 0.39 -0.19 0.82 -0.95 0.00 0.00 178.83 178.82 2yuk h ILE 55 N 0.17 1.26 0.33 2.54 2.04 -0.68 -1.98 117.51 121.20 2yuk h ILE 55 Ca 0.03 -1.22 -0.02 0.00 1.00 0.00 0.00 64.86 64.65 2yuk h ILE 55 Cb 0.48 1.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 2yuk h ILE 55 CO 0.03 0.40 -0.16 0.00 0.00 0.00 0.00 178.15 178.42 2yuk h ALA 56 N 1.23 -0.45 -0.53 1.87 0.00 -1.24 -1.57 119.26 118.59 2yuk h ALA 56 Ca 0.09 -0.16 0.11 0.00 0.00 0.00 0.00 54.91 54.94 2yuk h ALA 56 Cb 0.64 0.17 -0.09 0.00 0.00 0.00 0.00 17.79 18.51 2yuk h ALA 56 CO 0.05 -0.46 -0.04 1.57 0.00 0.00 0.00 179.25 180.36 2yuk h LYS 57 N -1.03 0.08 -0.71 0.00 2.10 -1.49 0.20 116.57 115.72 2yuk h LYS 57 Ca -0.05 -0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.55 2yuk h LYS 57 Cb 0.47 -0.02 -0.03 0.00 -0.90 0.00 0.00 32.23 31.75 2yuk h LYS 57 CO 0.07 0.05 0.26 -0.07 -2.00 0.00 0.00 179.45 177.77 2yuk h LEU 58 N 0.08 0.98 -0.09 7.07 3.38 -1.45 -1.33 115.31 123.96 2yuk h LEU 58 Ca 0.26 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2yuk h LEU 58 Cb 0.41 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 2yuk h LEU 58 CO -0.47 0.89 0.03 -0.25 0.09 0.00 0.00 178.44 178.73 2yuk h TRP 59 N 1.04 0.14 -0.65 1.13 2.91 -0.00 -2.88 115.95 117.64 2yuk h TRP 59 Ca 0.24 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.22 2yuk h TRP 59 Cb 0.23 -0.04 -0.03 0.00 -0.51 0.00 0.00 29.16 28.81 2yuk h TRP 59 CO 0.02 0.29 0.32 0.00 -1.03 0.00 0.00 178.44 178.04 2yuk h ARG 60 N -0.05 0.91 -0.74 2.65 3.08 -0.53 -2.54 114.38 117.16 2yuk h ARG 60 Ca 0.03 -0.11 0.08 0.00 0.07 0.00 0.00 59.98 60.05 2yuk h ARG 60 Cb 0.21 -0.17 -0.07 0.00 0.08 0.00 0.00 29.97 30.02 2yuk h ARG 60 CO -0.00 0.69 0.41 0.87 -1.07 0.00 0.00 179.97 180.87 2yuk h LYS 61 N 0.91 0.69 -7.13 0.04 1.57 -1.05 -3.42 116.57 108.18 2yuk h LYS 61 Ca 0.23 -0.04 -0.53 0.00 -1.87 0.00 0.00 60.65 58.43 2yuk h LYS 61 Cb 0.08 -0.16 0.13 0.00 0.08 0.00 0.00 32.23 32.36 2yuk h LYS 61 CO -0.03 0.46 0.45 0.00 -0.57 0.00 0.00 179.45 179.75 2yuk s ALA 62 N -6.06 2.39 0.34 3.86 0.00 -0.96 -5.02 121.76 116.31 2yuk s ALA 62 Ca -0.13 0.96 -0.07 0.00 0.00 0.00 0.00 51.96 52.73 2yuk s ALA 62 Cb 0.18 -3.46 -0.06 0.00 0.00 0.00 0.00 23.12 19.78 2yuk s ALA 62 CO 0.77 -1.44 0.64 0.45 0.00 0.00 0.00 175.76 176.18 2yuk s SER 63 N -1.78 6.46 0.23 0.00 0.15 -1.26 -4.91 113.70 112.60 2yuk s SER 63 Ca 0.76 0.87 -0.08 0.00 0.70 0.00 0.00 55.95 58.20 2yuk s SER 63 Cb -0.30 -2.21 0.39 0.00 -1.71 0.00 0.00 66.02 62.18 2yuk s SER 63 CO 0.38 -0.29 1.64 0.28 1.20 0.00 0.00 173.24 176.46 2yuk h SER 64 N 1.44 -0.34 -0.17 5.45 0.02 -1.95 0.85 113.55 118.86 2yuk h SER 64 Ca -0.47 0.18 0.05 0.00 -0.84 0.00 0.00 61.79 60.71 2yuk h SER 64 Cb 1.19 0.32 -0.01 0.00 0.14 0.00 0.00 62.40 64.05 2yuk h SER 64 CO 0.65 -0.16 0.20 0.06 -1.14 0.00 0.00 176.83 176.44 2yuk h GLN 65 N 0.10 0.00 0.18 3.45 3.07 -2.00 0.25 115.11 120.17 2yuk h GLN 65 Ca 0.38 0.00 -0.33 0.00 0.09 0.00 0.00 58.65 58.80 2yuk h GLN 65 Cb 0.65 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.23 2yuk h GLN 65 CO -0.62 0.00 -1.54 1.49 0.09 0.00 0.00 178.83 178.25 2yuk h GLU 66 N 0.00 0.39 0.00 0.06 4.81 0.31 -3.29 114.58 116.85 2yuk h GLU 66 Ca 0.08 -0.66 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 2yuk h GLU 66 Cb 0.47 0.25 0.00 0.00 0.63 0.00 0.00 28.75 30.10 2yuk h GLU 66 CO -0.00 1.29 0.00 0.00 -0.73 0.00 0.00 179.01 179.57 2yuk h ARG 67 N 0.11 0.00 -0.78 1.92 3.08 0.06 -3.36 114.38 115.40 2yuk h ARG 67 Ca -0.26 0.00 0.08 0.00 0.07 0.00 0.00 59.98 59.87 2yuk h ARG 67 Cb 2.08 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 32.03 2yuk h ARG 67 CO 0.21 0.00 -0.43 0.00 -1.07 0.00 0.00 179.97 178.68 2yuk n ALA 68 N -1.86 -0.42 0.02 0.04 0.00 0.73 0.18 120.51 119.20 2yuk n ALA 68 Ca 0.05 0.69 -0.13 0.00 0.00 0.00 0.00 53.44 54.05 2yuk n ALA 68 Cb 0.44 -0.16 -0.09 0.00 0.00 0.00 0.00 19.45 19.64 2yuk n ALA 68 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2yuk h PRO 69 N 0.00 -0.10 0.00 0.00 0.13 -1.82 -2.85 132.00 127.37 2yuk h PRO 69 Ca 0.15 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2yuk h PRO 69 Cb 0.35 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.50 2yuk h PRO 69 CO -0.74 0.35 0.03 1.88 -0.23 0.00 0.00 178.00 179.29 2yuk h TYR 70 N -0.58 0.00 0.19 1.56 0.05 -1.37 0.15 116.97 116.96 2yuk h TYR 70 Ca -0.01 0.00 -0.34 0.00 0.05 0.00 0.00 58.73 58.43 2yuk h TYR 70 Cb 0.49 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.25 2yuk h TYR 70 CO 0.08 0.00 -1.67 0.28 -1.05 0.00 0.00 178.16 175.80 2yuk h VAL 71 N 0.00 1.04 0.07 -2.88 2.07 0.20 -3.28 116.25 113.46 2yuk h VAL 71 Ca 0.00 -2.60 -0.11 0.00 0.82 0.00 0.00 66.70 64.81 2yuk h VAL 71 Cb 0.06 2.81 0.01 0.00 -1.52 0.00 0.00 31.29 32.65 2yuk h VAL 71 CO 0.00 0.84 -0.51 -0.61 0.02 0.00 0.00 177.57 177.32 2yuk h GLN 72 N 0.11 0.15 -0.67 1.57 5.75 -0.97 -3.33 115.11 117.72 2yuk h GLN 72 Ca -0.31 -0.25 0.14 0.00 -0.15 0.00 0.00 58.65 58.08 2yuk h GLN 72 Cb 2.10 0.09 -0.12 0.00 1.07 0.00 0.00 27.48 30.63 2yuk h GLN 72 CO 0.19 1.12 -0.02 -0.22 -2.65 0.00 0.00 178.83 177.26 2yuk h LYS 73 N -0.68 0.10 -0.81 1.69 3.64 -0.95 0.13 116.57 119.69 2yuk h LYS 73 Ca -0.10 -0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.43 2yuk h LYS 73 Cb 1.35 -0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 33.05 2yuk h LYS 73 CO 0.06 0.06 0.37 0.00 -2.27 0.00 0.00 179.45 177.68 2yuk h ALA 74 N 1.63 1.19 -0.19 5.00 0.00 -1.69 0.51 119.26 125.70 2yuk h ALA 74 Ca 0.35 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.31 2yuk h ALA 74 Cb 0.59 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2yuk h ALA 74 CO -0.60 -0.17 -0.11 0.00 0.00 0.00 0.00 179.25 178.38 2yuk h ARG 75 N 0.52 0.42 -0.06 0.00 3.08 -0.92 -3.02 114.38 114.40 2yuk h ARG 75 Ca 0.45 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 60.26 2yuk h ARG 75 Cb 0.67 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 2yuk h ARG 75 CO -0.39 0.72 -0.20 0.22 -1.07 0.00 0.00 179.97 179.26 2yuk h ASP 76 N 0.10 0.08 0.03 7.04 1.82 -0.09 -2.22 116.42 123.19 2yuk h ASP 76 Ca 0.04 -0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.65 2yuk h ASP 76 Cb 0.61 -0.02 -0.00 0.00 0.68 0.00 0.00 39.33 40.59 2yuk h ASP 76 CO 0.03 0.29 -0.05 0.78 -1.61 0.00 0.00 179.24 178.69 2yuk h ASN 77 N 0.08 0.05 0.19 2.28 2.35 0.11 -1.51 115.58 119.14 2yuk h ASN 77 Ca 0.02 -0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.67 2yuk h ASN 77 Cb 0.40 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 2yuk h ASN 77 CO 0.03 0.11 -0.35 0.03 -1.65 0.00 0.00 177.43 175.59 2yuk h ARG 78 N 0.05 0.23 -0.01 0.81 3.08 -1.38 -3.17 114.38 114.00 2yuk h ARG 78 Ca 0.01 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 2yuk h ARG 78 Cb 0.12 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.16 2yuk h ARG 78 CO 0.01 0.56 -0.03 0.00 -1.07 0.00 0.00 179.97 179.44 2yuk h ALA 79 N 1.44 0.02 -1.00 0.04 0.00 -1.35 -3.22 119.26 115.19 2yuk h ALA 79 Ca 0.02 -0.31 0.38 0.00 0.00 0.00 0.00 54.91 55.01 2yuk h ALA 79 Cb 0.72 -0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.33 2yuk h ALA 79 CO 0.05 -0.16 0.48 0.00 0.00 0.00 0.00 179.25 179.63 2yuk h ALA 80 N 0.42 2.00 0.76 0.00 0.00 -1.45 0.67 119.26 121.66 2yuk h ALA 80 Ca -0.00 0.26 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 2yuk h ALA 80 Cb 0.62 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 2yuk h ALA 80 CO 0.01 -0.84 -0.45 -0.07 0.00 0.00 0.00 179.25 177.90 2yuk h LEU 81 N 0.06 -1.13 -0.60 0.00 3.38 -1.60 0.69 115.31 116.11 2yuk h LEU 81 Ca 0.79 0.06 0.12 0.00 0.09 0.00 0.00 57.88 58.95 2yuk h LEU 81 Cb 2.01 0.32 -0.10 0.00 0.09 0.00 0.00 40.66 42.98 2yuk h LEU 81 CO -0.76 -0.70 0.02 0.03 0.09 0.00 0.00 178.44 177.12 2yuk h ARG 82 N -1.13 0.13 0.00 1.13 -0.00 -1.00 -3.20 114.38 110.32 2yuk h ARG 82 Ca -0.10 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.37 2yuk h ARG 82 Cb 0.90 -0.03 0.00 0.00 0.00 0.00 0.00 29.97 30.84 2yuk h ARG 82 CO 0.11 0.09 0.00 -0.89 0.00 0.00 0.00 179.97 179.28 2yuk n ILE 83 N -5.25 0.00 -0.37 2.04 -0.00 -0.60 -4.86 119.36 110.32 2yuk n ILE 83 Ca 0.08 0.92 -0.22 0.00 -0.00 0.00 0.00 62.75 63.53 2yuk n ILE 83 Cb 0.34 -1.77 0.21 0.00 -0.00 0.00 0.00 39.64 38.42 2yuk n ILE 83 CO 0.00 0.00 0.00 0.59 -0.00 0.00 0.00 176.55 177.14 2yuk n ASN 84 N -1.47 -3.59 -3.26 4.38 3.02 0.24 -4.03 115.26 110.55 2yuk n ASN 84 Ca 0.00 -0.63 -0.22 0.00 -0.03 0.00 0.00 54.58 53.70 2yuk n ASN 84 Cb 0.00 -0.86 0.07 0.00 -0.61 0.00 0.00 39.78 38.38 2yuk n ASN 84 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2yuk n LYS 85 N -3.35 -6.88 -1.69 3.52 4.81 -1.26 -4.79 118.16 108.53 2yuk n LYS 85 Ca 0.10 0.78 -0.60 0.00 -0.87 0.00 0.00 58.31 57.73 2yuk n LYS 85 Cb 0.43 -5.63 -0.08 0.00 0.02 0.00 0.00 35.03 29.77 2yuk n LYS 85 CO 0.00 0.00 0.00 1.55 1.17 0.00 0.00 177.40 180.12 2yuk n VAL 86 N -4.76 0.17 -3.94 3.15 3.14 -1.26 -4.95 118.33 109.89 2yuk n VAL 86 Ca -0.01 -0.03 -0.10 0.00 -2.96 0.00 0.00 64.34 61.24 2yuk n VAL 86 Cb 0.57 -0.90 -0.12 0.00 -1.06 0.00 0.00 33.84 32.33 2yuk n VAL 86 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2yuk s GLN 87 N 2.75 0.20 -0.21 1.45 -2.07 -1.26 -5.14 119.66 115.38 2yuk s GLN 87 Ca 0.98 -0.38 -0.01 0.00 -1.82 0.00 0.00 55.36 54.13 2yuk s GLN 87 Cb -1.18 0.07 0.01 0.00 -1.09 0.00 0.00 33.01 30.83 2yuk s GLN 87 CO 0.67 -0.03 -0.13 1.41 -1.32 0.00 0.00 175.29 175.89 2yuk s MET 88 N -0.93 3.05 -0.02 9.60 1.75 -1.26 -5.11 119.30 126.38 2yuk s MET 88 Ca -0.10 -0.81 0.07 0.00 -1.25 0.00 0.00 55.69 53.59 2yuk s MET 88 Cb -0.06 -2.78 -0.02 0.00 2.84 0.00 0.00 34.83 34.81 2yuk s MET 88 CO -0.01 -0.25 -0.23 -1.12 -0.65 0.00 0.00 175.02 172.76 2yuk s SER 89 N 1.34 2.69 0.00 1.11 0.01 -1.26 -5.36 113.70 112.24 2yuk s SER 89 Ca 0.04 -0.42 0.29 0.00 1.31 0.00 0.00 55.95 57.17 2yuk s SER 89 Cb -0.14 -0.33 1.28 0.00 0.21 0.00 0.00 66.02 67.04 2yuk s SER 89 CO -0.08 0.28 1.88 -3.20 0.41 0.00 0.00 173.24 172.52