#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5l s SER 2 N 0.00 5.00 -0.64 1.61 0.15 -1.26 -5.06 113.70 113.50 1v5l s SER 2 Ca 0.00 -0.24 -0.27 0.00 0.70 0.00 0.00 55.95 56.14 1v5l s SER 2 Cb 0.00 -1.17 0.01 0.00 -1.71 0.00 0.00 66.02 63.15 1v5l s SER 2 CO 0.00 0.14 1.47 -0.44 1.20 0.00 0.00 173.24 175.60 1v5l s SER 3 N -2.58 5.94 0.00 5.45 0.01 -1.26 -4.78 113.70 116.48 1v5l s SER 3 Ca 0.27 0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.53 1v5l s SER 3 Cb -0.11 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.57 1v5l s SER 3 CO 0.19 -1.92 0.00 0.61 0.41 0.00 0.00 173.24 172.53 1v5l n GLY 4 N 5.41 2.14 2.94 3.44 0.00 -1.26 -4.88 105.19 112.97 1v5l n GLY 4 Ca 0.11 0.18 -0.14 0.00 0.00 0.00 0.00 46.02 46.16 1v5l n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v5l s SER 5 N 0.00 0.58 0.02 1.61 0.15 -1.26 -4.78 113.70 110.03 1v5l s SER 5 Ca 0.00 0.34 -0.39 0.00 0.70 0.00 0.00 55.95 56.60 1v5l s SER 5 Cb 0.00 0.70 -0.20 0.00 -1.71 0.00 0.00 66.02 64.82 1v5l s SER 5 CO 0.00 -0.27 1.04 -1.54 1.20 0.00 0.00 173.24 173.67 1v5l n SER 6 N 5.35 -0.01 -4.20 5.45 3.41 -1.24 -4.78 113.62 117.60 1v5l n SER 6 Ca -0.06 1.16 -0.37 0.00 -0.26 0.00 0.00 58.87 59.34 1v5l n SER 6 Cb 0.50 -0.94 -0.12 0.00 -0.26 0.00 0.00 64.21 63.38 1v5l n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1v5l s GLY 7 N -0.06 1.86 0.01 5.00 0.00 -0.74 -5.03 107.32 108.37 1v5l s GLY 7 Ca 0.88 -2.00 -0.15 0.00 0.00 0.00 0.00 44.72 43.45 1v5l s GLY 7 CO 0.56 0.83 0.42 0.54 0.00 0.00 0.00 173.10 175.45 1v5l s ASN 8 N 1.54 6.82 -0.08 1.64 4.22 -1.26 -0.20 114.94 127.61 1v5l s ASN 8 Ca 0.00 0.98 -0.03 0.00 -2.14 0.00 0.00 52.86 51.67 1v5l s ASN 8 Cb -0.21 -2.26 0.05 0.00 1.28 0.00 0.00 41.25 40.11 1v5l s ASN 8 CO -0.00 0.32 0.13 -0.69 -2.04 0.00 0.00 177.10 174.81 1v5l s VAL 9 N -1.09 -0.20 -0.32 3.54 1.01 -0.61 -4.95 120.40 117.78 1v5l s VAL 9 Ca 0.24 0.31 0.03 0.00 0.00 0.00 0.00 61.98 62.56 1v5l s VAL 9 Cb -0.17 -0.29 0.09 0.00 0.00 0.00 0.00 36.38 36.01 1v5l s VAL 9 CO 0.14 0.10 0.02 -0.69 0.00 0.00 0.00 175.10 174.67 1v5l s VAL 10 N 2.24 2.06 0.02 2.92 1.01 -1.26 -0.03 120.40 127.36 1v5l s VAL 10 Ca 0.04 -2.05 -0.24 0.00 0.00 0.00 0.00 61.98 59.74 1v5l s VAL 10 Cb -0.13 -2.45 -0.05 0.00 0.00 0.00 0.00 36.38 33.76 1v5l s VAL 10 CO -0.05 -0.48 0.71 -0.76 0.00 0.00 0.00 175.10 174.52 1v5l s LEU 11 N 1.05 4.43 0.04 3.92 1.43 -0.12 -4.88 118.68 124.55 1v5l s LEU 11 Ca 0.06 1.35 -0.31 0.00 -1.03 0.00 0.00 54.13 54.20 1v5l s LEU 11 Cb -0.19 -3.13 -0.06 0.00 0.03 0.00 0.00 46.19 42.83 1v5l s LEU 11 CO -0.09 0.03 1.42 -2.16 0.23 0.00 0.00 176.35 175.77 1v5l s PRO 12 N -0.01 4.29 0.00 1.29 0.04 -1.26 -1.25 135.00 138.09 1v5l s PRO 12 Ca 0.36 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.43 1v5l s PRO 12 Cb -0.20 -3.47 0.00 0.00 0.04 0.00 0.00 34.50 30.87 1v5l s PRO 12 CO 0.21 -0.54 0.00 0.41 0.04 0.00 0.00 177.00 177.12 1v5l n GLY 13 N 3.62 5.22 0.00 0.56 0.00 0.43 -4.88 105.19 110.14 1v5l n GLY 13 Ca 0.13 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 44.11 1v5l n GLY 13 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1v5l n PRO 14 N -0.00 -0.74 -1.20 1.61 -0.04 -1.24 -4.87 135.00 128.51 1v5l n PRO 14 Ca 0.00 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.17 1v5l n PRO 14 Cb 0.00 0.00 0.16 0.00 -0.04 0.00 0.00 33.50 33.62 1v5l n PRO 14 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1v5l s ALA 15 N -2.98 1.24 1.05 0.55 0.00 -1.26 -4.69 121.76 115.67 1v5l s ALA 15 Ca 0.00 -0.25 -0.14 0.00 0.00 0.00 0.00 51.96 51.57 1v5l s ALA 15 Cb 0.00 -3.14 0.21 0.00 0.00 0.00 0.00 23.12 20.19 1v5l s ALA 15 CO 0.00 -2.61 1.10 -1.25 0.00 0.00 0.00 175.76 173.00 1v5l s PRO 16 N -4.97 0.00 -0.26 0.00 0.04 -1.26 -5.14 135.00 123.40 1v5l s PRO 16 Ca 0.64 0.37 -0.14 0.00 0.04 0.00 0.00 61.00 61.91 1v5l s PRO 16 Cb -0.18 -1.70 -0.11 0.00 0.04 0.00 0.00 34.50 32.55 1v5l s PRO 16 CO 0.57 -2.99 -0.35 0.91 0.04 0.00 0.00 177.00 175.18 1v5l n TRP 17 N -4.33 0.00 0.00 0.56 7.02 -1.26 -4.95 117.44 114.48 1v5l n TRP 17 Ca 0.07 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.55 1v5l n TRP 17 Cb 0.58 -0.93 0.00 0.00 -2.42 0.00 0.00 31.31 28.54 1v5l n TRP 17 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1v5l n GLY 18 N 1.31 1.36 3.87 6.99 0.00 -1.26 -2.56 105.19 114.91 1v5l n GLY 18 Ca -0.50 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.31 1v5l n GLY 18 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1v5l s PHE 19 N -2.00 3.16 0.48 1.61 -0.71 -1.26 -1.66 117.98 117.60 1v5l s PHE 19 Ca 0.00 -0.13 0.04 0.00 -1.04 0.00 0.00 56.93 55.80 1v5l s PHE 19 Cb 0.00 -1.54 -0.03 0.00 -1.21 0.00 0.00 43.02 40.24 1v5l s PHE 19 CO 0.00 0.41 0.09 1.03 -1.34 0.00 0.00 175.22 175.41 1v5l s ARG 20 N -3.92 2.15 0.06 1.99 1.81 -0.94 -4.98 118.95 115.13 1v5l s ARG 20 Ca 0.35 -2.20 0.03 0.00 -1.72 0.00 0.00 55.73 52.19 1v5l s ARG 20 Cb -0.08 -1.70 -0.03 0.00 -0.45 0.00 0.00 34.95 32.69 1v5l s ARG 20 CO 0.27 -0.29 -0.09 -0.48 -0.68 0.00 0.00 175.30 174.02 1v5l s LEU 21 N -3.90 2.32 -0.12 2.53 0.05 -1.26 -3.37 118.68 114.92 1v5l s LEU 21 Ca 0.22 -0.66 -0.18 0.00 0.05 0.00 0.00 54.13 53.55 1v5l s LEU 21 Cb 0.03 -0.25 0.04 0.00 -2.05 0.00 0.00 46.19 43.96 1v5l s LEU 21 CO 0.12 -0.22 0.46 -0.55 -0.55 0.00 0.00 176.35 175.61 1v5l s SER 22 N -1.94 -0.44 0.00 1.48 0.15 0.42 -4.48 113.70 108.89 1v5l s SER 22 Ca -0.03 0.72 0.00 0.00 0.70 0.00 0.00 55.95 57.34 1v5l s SER 22 Cb -0.07 0.76 0.00 0.00 -1.71 0.00 0.00 66.02 65.00 1v5l s SER 22 CO 0.00 -0.29 0.00 0.61 1.20 0.00 0.00 173.24 174.77 1v5l n GLY 23 N 2.22 -1.82 0.00 9.45 0.00 -1.26 -0.28 105.19 113.50 1v5l n GLY 23 Ca -0.16 -1.85 0.00 0.00 0.00 0.00 0.00 46.02 44.01 1v5l n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v5l n GLY 24 N 0.00 3.37 0.55 -0.02 0.00 0.39 -4.40 105.19 105.08 1v5l n GLY 24 Ca 0.00 -0.09 0.42 0.00 0.00 0.00 0.00 46.02 46.35 1v5l n GLY 24 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1v5l h ILE 25 N 0.00 0.11 -0.37 -0.61 3.07 -1.75 1.52 117.51 119.48 1v5l h ILE 25 Ca 0.00 -0.02 -0.14 0.00 1.55 0.00 0.00 64.86 66.26 1v5l h ILE 25 Cb 0.00 0.05 -0.01 0.00 -0.27 0.00 0.00 36.82 36.59 1v5l h ILE 25 CO 0.00 0.01 -0.32 -0.78 -1.05 0.00 0.00 178.15 176.01 1v5l h ASP 26 N 0.05 0.85 -0.30 2.16 1.82 -1.90 -2.73 116.42 116.37 1v5l h ASP 26 Ca 0.84 -0.35 -0.01 0.00 -0.39 0.00 0.00 57.03 57.11 1v5l h ASP 26 Cb 2.93 -0.24 -0.01 0.00 0.68 0.00 0.00 39.33 42.70 1v5l h ASP 26 CO -0.26 1.10 0.01 0.49 -1.61 0.00 0.00 179.24 178.97 1v5l n PHE 27 N -4.07 1.09 -2.27 0.28 3.72 0.51 -4.86 117.46 111.86 1v5l n PHE 27 Ca -0.01 -0.40 -0.12 0.00 -0.05 0.00 0.00 57.45 56.87 1v5l n PHE 27 Cb 0.50 -0.32 -0.01 0.00 -0.94 0.00 0.00 39.48 38.70 1v5l n PHE 27 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1v5l n ASN 28 N 0.29 -3.65 -4.06 4.37 3.02 -0.83 -4.79 115.26 109.61 1v5l n ASN 28 Ca 0.15 0.22 -0.22 0.00 -0.03 0.00 0.00 54.58 54.70 1v5l n ASN 28 Cb 0.75 -3.16 -0.15 0.00 -0.61 0.00 0.00 39.78 36.60 1v5l n ASN 28 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1v5l s GLN 29 N -4.70 1.20 0.29 3.52 2.00 -0.99 -4.98 119.66 116.00 1v5l s GLN 29 Ca 0.00 -0.43 -0.29 0.00 -2.00 0.00 0.00 55.36 52.64 1v5l s GLN 29 Cb 0.00 -1.10 -0.10 0.00 0.80 0.00 0.00 33.01 32.61 1v5l s GLN 29 CO 0.00 0.20 1.24 -1.25 -0.50 0.00 0.00 175.29 174.98 1v5l s PRO 30 N -0.01 4.45 -0.49 1.67 0.04 -1.26 0.15 135.00 139.55 1v5l s PRO 30 Ca -0.01 2.06 -0.27 0.00 0.04 0.00 0.00 61.00 62.83 1v5l s PRO 30 Cb -0.08 -3.13 -0.05 0.00 0.04 0.00 0.00 34.50 31.28 1v5l s PRO 30 CO 0.01 -0.07 2.16 -0.51 0.04 0.00 0.00 177.00 178.62 1v5l s LEU 31 N -1.42 3.38 0.36 -3.56 1.43 -1.25 -4.41 118.68 113.20 1v5l s LEU 31 Ca 0.49 0.94 0.09 0.00 -1.03 0.00 0.00 54.13 54.61 1v5l s LEU 31 Cb -0.37 -2.71 -0.06 0.00 0.03 0.00 0.00 46.19 43.09 1v5l s LEU 31 CO 0.47 -2.52 -0.01 0.68 0.23 0.00 0.00 176.35 175.20 1v5l s VAL 32 N 10.34 2.40 0.08 -1.59 -7.23 0.61 0.05 120.40 125.06 1v5l s VAL 32 Ca 0.86 -2.02 -0.27 0.00 -1.81 0.00 0.00 61.98 58.74 1v5l s VAL 32 Cb -0.18 -2.80 -0.06 0.00 0.56 0.00 0.00 36.38 33.91 1v5l s VAL 32 CO 0.26 -0.16 0.86 -0.63 -0.31 0.00 0.00 175.10 175.12 1v5l s ILE 33 N -2.58 4.60 -0.12 -0.62 1.01 -1.20 0.16 121.20 122.46 1v5l s ILE 33 Ca 0.35 1.85 -0.19 0.00 0.00 0.00 0.00 60.65 62.66 1v5l s ILE 33 Cb 0.02 -4.22 -0.26 0.00 0.01 0.00 0.00 42.46 38.02 1v5l s ILE 33 CO 0.19 0.35 0.56 0.71 0.00 0.00 0.00 174.94 176.74 1v5l h THR 34 N 4.05 1.15 -3.65 2.92 1.35 -1.78 -2.57 112.91 114.38 1v5l h THR 34 Ca -0.43 -2.37 -0.07 0.00 -0.55 0.00 0.00 66.41 62.98 1v5l h THR 34 Cb 1.21 2.76 -0.12 0.00 -1.73 0.00 0.00 68.15 70.27 1v5l h THR 34 CO 0.71 0.63 -0.21 -0.13 -0.25 0.00 0.00 175.52 176.28 1v5l s ARG 35 N -2.42 1.14 -0.06 4.72 1.81 -1.26 -4.75 118.95 118.12 1v5l s ARG 35 Ca -0.21 -0.99 0.01 0.00 -1.72 0.00 0.00 55.73 52.82 1v5l s ARG 35 Cb 0.03 0.42 0.02 0.00 -0.45 0.00 0.00 34.95 34.98 1v5l s ARG 35 CO 0.73 -0.43 -0.05 0.42 -0.68 0.00 0.00 175.30 175.29 1v5l s ILE 36 N -3.90 0.67 -0.00 1.52 -1.09 -1.26 -2.21 121.20 114.93 1v5l s ILE 36 Ca 0.11 -0.16 -0.30 0.00 -2.23 0.00 0.00 60.65 58.07 1v5l s ILE 36 Cb 0.02 -0.70 -0.08 0.00 -1.58 0.00 0.00 42.46 40.12 1v5l s ILE 36 CO -0.05 0.27 1.89 -0.89 -1.23 0.00 0.00 174.94 174.93 1v5l s THR 37 N 1.17 3.18 -0.24 2.92 2.01 -0.66 -4.82 115.64 119.20 1v5l s THR 37 Ca -0.07 0.22 -0.29 0.00 0.31 0.00 0.00 61.69 61.87 1v5l s THR 37 Cb -0.14 -3.15 -0.02 0.00 0.01 0.00 0.00 72.50 69.20 1v5l s THR 37 CO -0.01 -0.03 1.62 -2.16 -0.69 0.00 0.00 174.62 173.35 1v5l s PRO 38 N 4.44 3.74 -0.24 4.92 0.04 -1.26 -2.29 135.00 144.34 1v5l s PRO 38 Ca 0.85 1.61 -0.01 0.00 0.04 0.00 0.00 61.00 63.48 1v5l s PRO 38 Cb -0.39 -4.05 -0.01 0.00 0.04 0.00 0.00 34.50 30.09 1v5l s PRO 38 CO 0.38 -1.36 0.22 0.41 0.04 0.00 0.00 177.00 176.69 1v5l n GLY 39 N 4.75 -0.20 1.96 0.56 0.00 -1.26 -5.00 105.19 105.99 1v5l n GLY 39 Ca 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 46.02 46.17 1v5l n GLY 39 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1v5l n SER 40 N -1.52 -0.86 0.05 1.61 3.41 -1.25 -4.94 113.62 110.12 1v5l n SER 40 Ca -0.01 -1.44 0.22 0.00 -0.26 0.00 0.00 58.87 57.38 1v5l n SER 40 Cb 0.51 1.40 0.73 0.00 -0.26 0.00 0.00 64.21 66.59 1v5l n SER 40 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1v5l h LYS 41 N 0.00 0.00 0.00 4.33 1.79 -1.89 0.73 116.57 121.54 1v5l h LYS 41 Ca -0.14 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 1v5l h LYS 41 Cb 0.61 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.26 1v5l h LYS 41 CO 0.18 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.55 1v5l n ALA 42 N -2.38 -0.08 -0.09 3.86 0.00 -1.06 -3.34 120.51 117.42 1v5l n ALA 42 Ca 0.09 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.45 1v5l n ALA 42 Cb 0.70 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.14 1v5l n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v5l h ALA 43 N -2.00 0.38 0.00 0.00 0.00 -1.27 -1.15 119.26 115.22 1v5l h ALA 43 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1v5l h ALA 43 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1v5l h ALA 43 CO 0.00 -0.19 0.33 0.00 0.00 0.00 0.00 179.25 179.39 1v5l h ALA 44 N 1.13 1.27 -0.66 0.00 0.00 0.30 0.69 119.26 121.99 1v5l h ALA 44 Ca 0.12 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.89 1v5l h ALA 44 Cb -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.70 1v5l h ALA 44 CO -0.05 -0.27 0.17 0.00 0.00 0.00 0.00 179.25 179.10 1v5l n ALA 45 N -1.69 4.27 -3.76 0.00 0.00 -0.44 -4.90 120.51 114.00 1v5l n ALA 45 Ca -0.01 -2.07 -0.27 0.00 0.00 0.00 0.00 53.44 51.09 1v5l n ALA 45 Cb 0.36 -1.21 0.05 0.00 0.00 0.00 0.00 19.45 18.65 1v5l n ALA 45 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1v5l n ASN 46 N 0.13 -5.45 -4.91 0.00 4.13 0.24 -4.97 115.26 104.43 1v5l n ASN 46 Ca 0.35 -0.67 -0.28 0.00 1.68 0.00 0.00 54.58 55.66 1v5l n ASN 46 Cb 1.28 -4.45 -0.03 0.00 -1.54 0.00 0.00 39.78 35.04 1v5l n ASN 46 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1v5l s LEU 47 N -7.28 4.07 -0.19 3.41 1.43 -1.18 -5.05 118.68 113.90 1v5l s LEU 47 Ca 0.61 0.66 -0.24 0.00 -1.03 0.00 0.00 54.13 54.12 1v5l s LEU 47 Cb -0.29 -3.48 0.06 0.00 0.03 0.00 0.00 46.19 42.52 1v5l s LEU 47 CO 0.78 -0.19 0.64 0.00 0.23 0.00 0.00 176.35 177.81 1v5l s PRO 49 N -0.12 2.98 0.00 0.00 0.04 -1.26 -3.15 135.00 133.49 1v5l s PRO 49 Ca -0.03 0.93 0.00 0.00 0.04 0.00 0.00 61.00 61.93 1v5l s PRO 49 Cb -0.03 -4.28 0.00 0.00 0.04 0.00 0.00 34.50 30.22 1v5l s PRO 49 CO 0.03 -2.30 0.00 0.41 0.04 0.00 0.00 177.00 175.18 1v5l n GLY 50 N 5.53 0.50 3.75 0.56 0.00 -0.97 -4.92 105.19 109.64 1v5l n GLY 50 Ca 0.21 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 1v5l n GLY 50 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1v5l s ASP 51 N 0.00 5.12 -0.38 1.61 1.01 -1.19 -4.76 116.67 118.08 1v5l s ASP 51 Ca 0.00 2.59 -0.15 0.00 0.71 0.00 0.00 52.55 55.70 1v5l s ASP 51 Cb 0.00 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 41.32 1v5l s ASP 51 CO 0.00 -1.65 0.30 -0.69 0.21 0.00 0.00 175.17 173.33 1v5l s VAL 52 N -1.43 5.25 -0.60 -1.27 1.01 -1.26 -3.22 120.40 118.88 1v5l s VAL 52 Ca 0.76 -0.45 -0.27 0.00 0.00 0.00 0.00 61.98 62.02 1v5l s VAL 52 Cb -0.36 -3.86 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 1v5l s VAL 52 CO 0.40 -0.21 1.81 -0.63 0.00 0.00 0.00 175.10 176.48 1v5l s ILE 53 N 1.75 3.40 0.04 2.22 -1.09 0.11 -2.96 121.20 124.66 1v5l s ILE 53 Ca 0.06 0.25 -0.18 0.00 -2.23 0.00 0.00 60.65 58.56 1v5l s ILE 53 Cb -0.18 -3.98 -0.20 0.00 -1.58 0.00 0.00 42.46 36.52 1v5l s ILE 53 CO 0.11 -0.93 1.19 -0.07 -1.23 0.00 0.00 174.94 174.01 1v5l h LEU 54 N 15.96 0.66 -7.58 2.97 3.38 -1.15 -3.42 115.31 126.13 1v5l h LEU 54 Ca -0.27 -0.68 -0.14 0.00 0.09 0.00 0.00 57.88 56.88 1v5l h LEU 54 Cb 1.15 -0.20 -0.22 0.00 0.09 0.00 0.00 40.66 41.49 1v5l h LEU 54 CO 1.21 1.24 -0.39 0.00 0.09 0.00 0.00 178.44 180.59 1v5l s ALA 55 N -3.51 -0.59 -0.17 1.53 0.00 -1.25 -2.09 121.76 115.69 1v5l s ALA 55 Ca -0.12 0.30 -0.02 0.00 0.00 0.00 0.00 51.96 52.12 1v5l s ALA 55 Cb 0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.09 1v5l s ALA 55 CO 0.84 -0.20 -0.09 0.42 0.00 0.00 0.00 175.76 176.74 1v5l s ILE 56 N -0.88 3.28 -1.07 0.00 1.01 0.76 -1.27 121.20 123.02 1v5l s ILE 56 Ca -0.10 -0.56 -0.02 0.00 0.00 0.00 0.00 60.65 59.97 1v5l s ILE 56 Cb -0.05 -2.43 0.02 0.00 0.01 0.00 0.00 42.46 40.01 1v5l s ILE 56 CO 0.02 0.48 0.13 -0.67 0.00 0.00 0.00 174.94 174.90 1v5l n ASP 57 N 4.01 -3.80 -0.40 3.58 2.03 0.24 -0.97 116.55 121.24 1v5l n ASP 57 Ca -0.18 0.07 0.00 0.00 0.52 0.00 0.00 54.79 55.19 1v5l n ASP 57 Cb 0.52 -3.21 0.00 0.00 -0.72 0.00 0.00 41.12 37.71 1v5l n ASP 57 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1v5l n GLY 58 N -0.90 0.94 2.93 0.27 0.00 -1.24 -4.95 105.19 102.24 1v5l n GLY 58 Ca -0.11 -0.59 -0.08 0.00 0.00 0.00 0.00 46.02 45.24 1v5l n GLY 58 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1v5l s PHE 59 N -2.80 -0.89 0.51 1.61 0.08 -0.14 -5.12 117.98 111.23 1v5l s PHE 59 Ca 0.00 0.85 -0.20 0.00 0.12 0.00 0.00 56.93 57.70 1v5l s PHE 59 Cb 0.00 0.04 -0.10 0.00 -0.57 0.00 0.00 43.02 42.39 1v5l s PHE 59 CO 0.00 -0.75 0.62 0.41 -0.10 0.00 0.00 175.22 175.40 1v5l n GLY 60 N 5.37 -1.25 2.06 4.36 0.00 -1.26 -0.17 105.19 114.30 1v5l n GLY 60 Ca -0.03 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 1v5l n GLY 60 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1v5l n THR 61 N -1.32 3.07 0.15 2.61 -2.24 -0.89 -4.39 114.28 111.27 1v5l n THR 61 Ca 0.11 -2.08 0.02 0.00 -2.27 0.00 0.00 64.05 59.84 1v5l n THR 61 Cb 0.44 -1.11 0.14 0.00 -2.10 0.00 0.00 70.33 67.70 1v5l n THR 61 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1v5l h GLU 62 N 1.51 0.00 0.00 -0.78 4.11 -1.89 -3.31 114.58 114.22 1v5l h GLU 62 Ca 0.45 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.87 1v5l h GLU 62 Cb 1.20 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 1v5l h GLU 62 CO 1.09 0.52 -0.36 -1.13 0.07 0.00 0.00 179.01 179.20 1v5l n SER 63 N -3.38 0.89 -4.16 3.06 3.41 -1.26 -5.01 113.62 107.17 1v5l n SER 63 Ca 0.01 -2.42 -0.35 0.00 -0.26 0.00 0.00 58.87 55.85 1v5l n SER 63 Cb 0.67 -0.29 -0.13 0.00 -0.26 0.00 0.00 64.21 64.19 1v5l n SER 63 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 1v5l s MET 64 N -1.06 2.32 0.84 4.33 -2.45 -1.25 -5.08 119.30 116.96 1v5l s MET 64 Ca 0.14 -1.38 -0.12 0.00 -1.25 0.00 0.00 55.69 53.07 1v5l s MET 64 Cb 0.12 -3.26 0.10 0.00 1.25 0.00 0.00 34.83 33.05 1v5l s MET 64 CO -0.00 -0.71 1.12 0.95 1.05 0.00 0.00 175.02 177.42 1v5l s THR 65 N 1.22 2.59 0.21 10.11 -4.23 -1.26 -4.41 115.64 119.88 1v5l s THR 65 Ca -0.02 0.19 -0.13 0.00 -1.18 0.00 0.00 61.69 60.55 1v5l s THR 65 Cb -0.20 -2.96 0.24 0.00 1.34 0.00 0.00 72.50 70.93 1v5l s THR 65 CO -0.02 -0.25 1.62 -0.74 -0.54 0.00 0.00 174.62 174.69 1v5l h HIS 66 N -1.25 -0.36 -0.78 3.99 2.76 -1.89 0.15 115.15 117.78 1v5l h HIS 66 Ca -0.48 0.06 0.05 0.00 -2.20 0.00 0.00 60.37 57.79 1v5l h HIS 66 Cb 1.30 0.26 -0.05 0.00 1.55 0.00 0.00 27.41 30.46 1v5l h HIS 66 CO 0.39 -0.28 0.48 0.00 -1.30 0.00 0.00 177.93 177.22 1v5l h ALA 67 N 1.64 1.04 -0.86 5.26 0.00 -1.92 -2.02 119.26 122.40 1v5l h ALA 67 Ca 0.31 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 1v5l h ALA 67 Cb 0.48 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1v5l h ALA 67 CO -0.67 0.24 0.44 -0.44 0.00 0.00 0.00 179.25 178.82 1v5l h ASP 68 N 0.91 1.10 -1.00 0.00 5.19 -1.13 -2.53 116.42 118.96 1v5l h ASP 68 Ca 0.33 -0.12 0.10 0.00 -0.62 0.00 0.00 57.03 56.71 1v5l h ASP 68 Cb 0.10 -0.28 -0.08 0.00 0.18 0.00 0.00 39.33 39.25 1v5l h ASP 68 CO -0.14 0.91 0.64 0.00 -3.12 0.00 0.00 179.24 177.53 1v5l h ALA 69 N 1.24 1.47 -0.37 3.45 0.00 -0.29 -0.42 119.26 124.33 1v5l h ALA 69 Ca 0.30 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.23 1v5l h ALA 69 Cb 0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1v5l h ALA 69 CO -0.04 0.32 0.24 1.96 0.00 0.00 0.00 179.25 181.74 1v5l h GLN 70 N 1.08 0.42 0.00 0.00 1.08 -1.23 0.15 115.11 116.60 1v5l h GLN 70 Ca 0.47 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.64 1v5l h GLN 70 Cb 0.35 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.69 1v5l h GLN 70 CO -0.22 0.27 0.00 -0.25 -0.95 0.00 0.00 178.83 177.68 1v5l n ASP 71 N -4.48 0.35 -0.09 1.46 9.92 -0.19 -1.49 116.55 122.02 1v5l n ASP 71 Ca 0.03 0.55 -0.14 0.00 -0.53 0.00 0.00 54.79 54.69 1v5l n ASP 71 Cb 0.12 -0.64 -0.14 0.00 -0.64 0.00 0.00 41.12 39.82 1v5l n ASP 71 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1v5l n ARG 72 N -1.84 0.68 0.13 -1.24 5.12 0.31 -3.67 116.66 116.14 1v5l n ARG 72 Ca 0.05 0.12 -0.21 0.00 -1.93 0.00 0.00 57.85 55.88 1v5l n ARG 72 Cb 0.32 -1.57 -0.15 0.00 -1.16 0.00 0.00 32.46 29.90 1v5l n ARG 72 CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 1v5l h ILE 73 N 0.01 1.38 -0.38 0.55 2.04 -0.99 -2.47 117.51 117.66 1v5l h ILE 73 Ca -0.52 -2.87 -0.16 0.00 1.00 0.00 0.00 64.86 62.31 1v5l h ILE 73 Cb 2.06 3.00 -0.01 0.00 -0.74 0.00 0.00 36.82 41.13 1v5l h ILE 73 CO -0.01 0.85 -0.38 0.07 0.00 0.00 0.00 178.15 178.68 1v5l h LYS 74 N 0.12 0.91 -0.59 2.37 2.10 -1.48 -2.86 116.57 117.13 1v5l h LYS 74 Ca -0.20 -0.47 0.00 0.00 -2.00 0.00 0.00 60.65 57.97 1v5l h LYS 74 Cb 2.09 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 33.43 1v5l h LYS 74 CO 0.25 1.13 0.00 0.00 -2.00 0.00 0.00 179.45 178.82 1v5l n ALA 75 N -2.54 2.84 -0.66 0.07 0.00 -1.24 -4.96 120.51 114.02 1v5l n ALA 75 Ca -0.02 -1.03 -0.07 0.00 0.00 0.00 0.00 53.44 52.32 1v5l n ALA 75 Cb 0.54 -1.01 0.11 0.00 0.00 0.00 0.00 19.45 19.09 1v5l n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v5l n ALA 76 N 0.72 -2.01 -2.64 0.00 0.00 -0.93 -5.00 120.51 110.66 1v5l n ALA 76 Ca 0.17 -0.58 -0.30 0.00 0.00 0.00 0.00 53.44 52.72 1v5l n ALA 76 Cb 0.61 -0.05 -0.06 0.00 0.00 0.00 0.00 19.45 19.95 1v5l n ALA 76 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1v5l s SER 77 N -2.08 4.26 0.53 0.00 0.01 -1.26 -4.96 113.70 110.20 1v5l s SER 77 Ca 0.25 -1.49 0.33 0.00 1.31 0.00 0.00 55.95 56.36 1v5l s SER 77 Cb -0.04 0.36 1.15 0.00 0.21 0.00 0.00 66.02 67.70 1v5l s SER 77 CO 0.21 -0.87 1.28 0.00 0.41 0.00 0.00 173.24 174.28 1v5l n TYR 78 N -1.37 0.00 -4.19 2.43 9.36 -1.26 -4.00 117.16 118.12 1v5l n TYR 78 Ca -0.13 0.00 -0.18 0.00 3.32 0.00 0.00 57.90 60.91 1v5l n TYR 78 Cb 0.66 -0.33 -0.16 0.00 -0.63 0.00 0.00 39.34 38.89 1v5l n TYR 78 CO 0.00 0.00 0.00 1.14 0.22 0.00 0.00 176.86 178.22 1v5l s GLN 79 N -4.42 0.68 -0.28 2.98 -2.07 -1.26 0.16 119.66 115.46 1v5l s GLN 79 Ca -0.03 -0.16 -0.14 0.00 -1.82 0.00 0.00 55.36 53.21 1v5l s GLN 79 Cb 0.18 -0.68 -0.04 0.00 -1.09 0.00 0.00 33.01 31.37 1v5l s GLN 79 CO 0.59 0.02 0.31 -1.17 -1.32 0.00 0.00 175.29 173.72 1v5l s LEU 80 N 0.44 4.06 -0.44 2.60 2.96 -0.38 -4.93 118.68 122.98 1v5l s LEU 80 Ca -0.06 0.16 -0.13 0.00 -0.22 0.00 0.00 54.13 53.89 1v5l s LEU 80 Cb -0.09 -2.32 0.06 0.00 0.50 0.00 0.00 46.19 44.33 1v5l s LEU 80 CO -0.00 -0.15 0.33 0.00 -1.32 0.00 0.00 176.35 175.20 1v5l s LEU 82 N 1.58 2.30 -0.02 0.00 1.43 0.96 0.79 118.68 125.72 1v5l s LEU 82 Ca 0.04 -0.46 -0.13 0.00 -1.03 0.00 0.00 54.13 52.55 1v5l s LEU 82 Cb -0.23 -1.47 -0.05 0.00 0.03 0.00 0.00 46.19 44.47 1v5l s LEU 82 CO 0.06 0.20 0.35 -0.75 0.23 0.00 0.00 176.35 176.44 1v5l s LYS 83 N 0.14 3.80 0.06 1.70 2.47 -0.39 -1.58 119.74 125.94 1v5l s LYS 83 Ca -0.11 0.27 0.04 0.00 -1.56 0.00 0.00 55.97 54.62 1v5l s LYS 83 Cb -0.16 -3.19 -0.03 0.00 -1.46 0.00 0.00 37.83 32.99 1v5l s LYS 83 CO 0.06 0.70 -0.12 0.96 0.16 0.00 0.00 175.35 177.10 1v5l s ILE 84 N -1.10 0.96 -0.49 5.43 -5.25 0.72 -0.57 121.20 120.89 1v5l s ILE 84 Ca 0.23 -1.23 0.03 0.00 -0.99 0.00 0.00 60.65 58.69 1v5l s ILE 84 Cb -0.15 -0.94 0.51 0.00 2.95 0.00 0.00 42.46 44.82 1v5l s ILE 84 CO 0.12 -0.26 1.76 -0.67 -1.79 0.00 0.00 174.94 174.10 1v5l n ASP 85 N 1.36 5.42 -3.79 4.36 -0.08 -1.16 -1.80 116.55 120.87 1v5l n ASP 85 Ca -0.21 -3.75 -0.24 0.00 -1.51 0.00 0.00 54.79 49.08 1v5l n ASP 85 Cb 0.54 -0.77 -0.07 0.00 2.34 0.00 0.00 41.12 43.16 1v5l n ASP 85 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1v5l n ARG 86 N -0.97 -0.93 -1.97 -0.67 1.85 -1.26 -4.73 116.66 107.98 1v5l n ARG 86 Ca 0.54 0.07 -0.42 0.00 -1.00 0.00 0.00 57.85 57.04 1v5l n ARG 86 Cb 1.00 -2.71 -0.03 0.00 -1.05 0.00 0.00 32.46 29.68 1v5l n ARG 86 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1v5l s ALA 87 N -3.78 2.71 -0.10 2.89 0.00 -1.26 -4.84 121.76 117.37 1v5l s ALA 87 Ca 0.10 0.14 -0.15 0.00 0.00 0.00 0.00 51.96 52.05 1v5l s ALA 87 Cb -0.06 -4.07 -0.27 0.00 0.00 0.00 0.00 23.12 18.72 1v5l s ALA 87 CO 0.72 -2.90 0.54 1.05 0.00 0.00 0.00 175.76 175.17 1v5l h GLU 88 N 13.57 0.24 0.00 0.00 4.11 -1.91 -3.42 114.58 127.18 1v5l h GLU 88 Ca -0.32 -0.42 0.00 0.00 0.07 0.00 0.00 59.36 58.69 1v5l h GLU 88 Cb 1.18 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.58 1v5l h GLU 88 CO 1.06 1.20 0.00 2.41 0.07 0.00 0.00 179.01 183.75 1v5l n THR 89 N -3.90 0.00 -3.99 -1.06 -1.04 -1.26 -5.03 114.28 98.00 1v5l n THR 89 Ca -0.25 -0.34 -0.27 0.00 -2.04 0.00 0.00 64.05 61.14 1v5l n THR 89 Cb 0.91 1.03 -0.02 0.00 -1.82 0.00 0.00 70.33 70.43 1v5l n THR 89 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1v5l n ARG 90 N -0.62 -3.35 -3.25 -2.82 1.74 -1.26 -4.95 116.66 102.15 1v5l n ARG 90 Ca 0.00 0.41 -0.28 0.00 -0.77 0.00 0.00 57.85 57.21 1v5l n ARG 90 Cb 0.01 -4.63 -0.02 0.00 -1.02 0.00 0.00 32.46 26.79 1v5l n ARG 90 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1v5l s LEU 91 N -7.02 3.99 -0.78 0.55 2.96 -1.26 -4.90 118.68 112.23 1v5l s LEU 91 Ca 0.12 0.71 -0.17 0.00 -0.22 0.00 0.00 54.13 54.57 1v5l s LEU 91 Cb -0.07 -3.55 -0.21 0.00 0.50 0.00 0.00 46.19 42.86 1v5l s LEU 91 CO 0.89 -0.26 1.93 1.87 -1.32 0.00 0.00 176.35 179.46 1v5l n TRP 92 N -1.24 0.26 -3.58 5.38 -0.00 -1.26 -4.80 117.44 112.19 1v5l n TRP 92 Ca -0.02 0.18 -0.16 0.00 -0.00 0.00 0.00 57.50 57.50 1v5l n TRP 92 Cb 0.54 -1.26 -0.07 0.00 -0.00 0.00 0.00 31.31 30.53 1v5l n TRP 92 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 1v5l s SER 93 N 4.17 -0.71 1.08 5.87 0.15 -1.26 -5.18 113.70 117.82 1v5l s SER 93 Ca 1.05 1.14 -0.15 0.00 0.70 0.00 0.00 55.95 58.69 1v5l s SER 93 Cb -0.85 1.08 0.23 0.00 -1.71 0.00 0.00 66.02 64.77 1v5l s SER 93 CO 0.41 -0.40 1.10 -2.16 1.20 0.00 0.00 173.24 173.39 1v5l s PRO 94 N -0.28 -0.24 -0.98 5.44 0.04 -1.26 -4.96 135.00 132.77 1v5l s PRO 94 Ca -0.05 0.28 -0.16 0.00 0.04 0.00 0.00 61.00 61.12 1v5l s PRO 94 Cb -0.03 -1.68 0.17 0.00 0.04 0.00 0.00 34.50 33.00 1v5l s PRO 94 CO 0.05 -3.13 1.10 1.14 0.04 0.00 0.00 177.00 176.20 1v5l s GLN 95 N -5.12 3.75 0.07 4.56 0.00 -1.26 -4.81 119.66 116.86 1v5l s GLN 95 Ca 0.67 -2.22 0.28 0.00 -0.00 0.00 0.00 55.36 54.10 1v5l s GLN 95 Cb -0.15 -4.80 1.09 0.00 0.00 0.00 0.00 33.01 29.14 1v5l s GLN 95 CO 0.57 -1.61 1.87 0.28 0.00 0.00 0.00 175.29 176.40 1v5l n VAL 96 N 4.72 0.20 -0.03 3.63 0.31 -1.26 -3.66 118.33 122.25 1v5l n VAL 96 Ca 0.24 -0.10 -0.15 0.00 -0.01 0.00 0.00 64.34 64.33 1v5l n VAL 96 Cb 0.46 -0.52 -0.11 0.00 -0.91 0.00 0.00 33.84 32.76 1v5l n VAL 96 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1v5l h SER 97 N 0.00 0.24 -0.56 4.52 0.02 -1.87 -3.42 113.55 112.48 1v5l h SER 97 Ca 0.00 -0.75 -0.57 0.00 -0.84 0.00 0.00 61.79 59.63 1v5l h SER 97 Cb 0.58 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 63.00 1v5l h SER 97 CO 0.00 0.95 1.59 -1.20 -1.14 0.00 0.00 176.83 177.04 1v5l n SER 98 N -4.51 1.17 -4.56 3.07 7.64 -1.24 -3.62 113.62 111.57 1v5l n SER 98 Ca -0.09 0.16 -0.58 0.00 1.01 0.00 0.00 58.87 59.37 1v5l n SER 98 Cb 0.49 -1.13 -0.08 0.00 -1.01 0.00 0.00 64.21 62.49 1v5l n SER 98 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v5l n GLY 99 N 6.56 0.06 0.00 0.23 0.00 -1.26 -4.78 105.19 106.00 1v5l n GLY 99 Ca 0.53 0.78 0.07 0.00 0.00 0.00 0.00 46.02 47.39 1v5l n GLY 99 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1v5l n PRO 100 N 2.28 0.49 -1.30 1.61 -0.04 -1.26 -4.87 135.00 131.91 1v5l n PRO 100 Ca 0.21 0.00 -0.50 0.00 -0.04 0.00 0.00 63.50 63.17 1v5l n PRO 100 Cb 0.10 -1.43 -0.07 0.00 -0.04 0.00 0.00 33.50 32.06 1v5l n PRO 100 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1v5l n SER 101 N -0.93 0.87 -4.88 3.54 2.88 -1.26 -4.89 113.62 108.94 1v5l n SER 101 Ca 0.10 0.89 -0.33 0.00 -1.33 0.00 0.00 58.87 58.19 1v5l n SER 101 Cb 0.05 -0.66 -0.05 0.00 -0.75 0.00 0.00 64.21 62.80 1v5l n SER 101 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1v5l s SER 102 N 2.15 6.55 0.00 -3.46 1.04 -1.26 -5.26 113.70 113.46 1v5l s SER 102 Ca 0.78 0.66 0.00 0.00 0.48 0.00 0.00 55.95 57.87 1v5l s SER 102 Cb -1.11 -2.13 0.00 0.00 0.10 0.00 0.00 66.02 62.88 1v5l s SER 102 CO 0.60 0.13 0.00 0.61 0.98 0.00 0.00 173.24 175.57