#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 -0.57 -0.76 1.61 1.04 -1.26 -5.09 113.70 108.66 1v5l s SER 2 Ca 0.00 0.18 -0.25 0.00 0.48 0.00 0.00 55.95 56.35 1v5l s SER 2 Cb 0.00 0.57 -0.03 0.00 0.10 0.00 0.00 66.02 66.65 1v5l s SER 2 CO 0.00 -0.85 1.89 -0.55 0.98 0.00 0.00 173.24 174.71 1v5l s SER 3 N -2.33 5.24 0.13 7.02 0.15 -1.26 -4.85 113.70 117.79 1v5l s SER 3 Ca -0.02 -0.21 -0.25 0.00 0.70 0.00 0.00 55.95 56.18 1v5l s SER 3 Cb -0.01 -2.55 0.08 0.00 -1.71 0.00 0.00 66.02 61.84 1v5l s SER 3 CO -0.07 -2.54 1.07 -0.83 1.20 0.00 0.00 173.24 172.07 1v5l s GLY 4 N 7.97 -0.11 -0.39 9.45 0.00 -1.26 -4.88 107.32 118.10 1v5l s GLY 4 Ca 0.68 0.01 0.05 0.00 0.00 0.00 0.00 44.72 45.46 1v5l s GLY 4 CO 0.09 1.47 1.52 -1.26 0.00 0.00 0.00 173.10 174.93 1v5l n SER 5 N -0.84 4.68 -4.57 1.64 2.88 -1.26 -4.98 113.62 111.17 1v5l n SER 5 Ca -0.04 -3.77 -0.42 0.00 -1.33 0.00 0.00 58.87 53.31 1v5l n SER 5 Cb 0.60 -0.62 -0.03 0.00 -0.75 0.00 0.00 64.21 63.41 1v5l n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1v5l s SER 6 N -2.71 6.19 -0.94 -3.46 1.04 -1.26 -4.70 113.70 107.86 1v5l s SER 6 Ca 0.52 0.08 -0.17 0.00 0.48 0.00 0.00 55.95 56.86 1v5l s SER 6 Cb 0.44 -2.55 0.16 0.00 0.10 0.00 0.00 66.02 64.17 1v5l s SER 6 CO 0.01 -1.70 1.06 -0.83 0.98 0.00 0.00 173.24 172.77 1v5l s GLY 7 N 4.01 2.22 0.42 7.32 0.00 -1.00 -5.00 107.32 115.29 1v5l s GLY 7 Ca 0.46 -3.01 -0.24 0.00 0.00 0.00 0.00 44.72 41.93 1v5l s GLY 7 CO 0.23 1.79 1.13 0.54 0.00 0.00 0.00 173.10 176.80 1v5l s ASN 8 N 3.08 6.44 -0.20 1.64 4.22 -1.26 -0.77 114.94 128.10 1v5l s ASN 8 Ca 0.30 2.24 -0.04 0.00 -2.14 0.00 0.00 52.86 53.22 1v5l s ASN 8 Cb -0.06 -2.60 0.10 0.00 1.28 0.00 0.00 41.25 39.96 1v5l s ASN 8 CO -0.08 -0.72 0.27 -0.69 -2.04 0.00 0.00 177.10 173.83 1v5l s VAL 9 N -1.54 -0.42 -0.25 3.54 1.01 -1.01 -4.91 120.40 116.81 1v5l s VAL 9 Ca 0.60 -0.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.56 1v5l s VAL 9 Cb -0.27 -0.66 0.04 0.00 0.00 0.00 0.00 36.38 35.49 1v5l s VAL 9 CO 0.34 -0.11 -0.07 -0.69 0.00 0.00 0.00 175.10 174.57 1v5l s VAL 10 N 2.40 2.70 -0.09 2.92 1.01 -1.26 -0.70 120.40 127.38 1v5l s VAL 10 Ca 0.07 -1.20 -0.08 0.00 0.00 0.00 0.00 61.98 60.77 1v5l s VAL 10 Cb -0.15 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 1v5l s VAL 10 CO -0.12 0.13 0.20 -0.76 0.00 0.00 0.00 175.10 174.55 1v5l s LEU 11 N 1.27 4.41 -0.01 3.92 1.43 -0.67 -4.95 118.68 124.07 1v5l s LEU 11 Ca -0.02 0.57 -0.30 0.00 -1.03 0.00 0.00 54.13 53.35 1v5l s LEU 11 Cb -0.18 -2.22 -0.05 0.00 0.03 0.00 0.00 46.19 43.77 1v5l s LEU 11 CO -0.05 0.38 1.46 -2.16 0.23 0.00 0.00 176.35 176.21 1v5l s PRO 12 N -1.11 4.25 0.00 1.29 0.04 -1.26 -2.54 135.00 135.67 1v5l s PRO 12 Ca 0.18 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.24 1v5l s PRO 12 Cb -0.13 -3.65 0.00 0.00 0.04 0.00 0.00 34.50 30.75 1v5l s PRO 12 CO 0.07 -0.65 0.00 0.41 0.04 0.00 0.00 177.00 176.87 1v5l n GLY 13 N 3.76 5.92 0.00 0.56 0.00 0.15 -4.86 105.19 110.71 1v5l n GLY 13 Ca 0.14 -2.06 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 -0.04 -1.02 -0.89 1.61 -0.04 -1.21 -4.87 135.00 128.54 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 0.19 0.00 -0.04 0.00 0.00 33.50 33.65 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 0.69 0.99 0.55 0.00 -1.26 -4.69 121.76 115.06 1v5l s ALA 15 Ca 0.00 -0.04 -0.12 0.00 0.00 0.00 0.00 51.96 51.79 1v5l s ALA 15 Cb 0.00 -3.24 0.18 0.00 0.00 0.00 0.00 23.12 20.06 1v5l s ALA 15 CO 0.00 -3.04 1.09 -1.25 0.00 0.00 0.00 175.76 172.56 1v5l s PRO 16 N -4.73 0.53 -0.21 0.00 0.04 -1.26 -5.15 135.00 124.23 1v5l s PRO 16 Ca 0.66 0.57 -0.16 0.00 0.04 0.00 0.00 61.00 62.10 1v5l s PRO 16 Cb -0.21 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.50 1v5l s PRO 16 CO 0.60 -2.67 -0.31 0.91 0.04 0.00 0.00 177.00 175.56 1v5l n TRP 17 N -4.14 0.12 0.00 0.56 7.02 -1.26 -4.93 117.44 114.80 1v5l n TRP 17 Ca 0.05 0.05 0.00 0.00 -1.02 0.00 0.00 57.50 56.59 1v5l n TRP 17 Cb 0.57 -0.71 0.00 0.00 -2.42 0.00 0.00 31.31 28.75 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 1.40 1.15 3.89 6.99 0.00 -1.26 -3.59 105.19 113.77 1v5l n GLY 18 Ca -0.27 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.54 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 -1.00 3.06 0.48 1.61 -0.71 -1.26 -0.43 117.98 119.72 1v5l s PHE 19 Ca 0.00 -0.21 0.05 0.00 -1.04 0.00 0.00 56.93 55.73 1v5l s PHE 19 Cb 0.00 -1.73 -0.02 0.00 -1.21 0.00 0.00 43.02 40.05 1v5l s PHE 19 CO 0.00 0.24 0.14 1.03 -1.34 0.00 0.00 175.22 175.29 1v5l s ARG 20 N -4.00 2.19 0.11 1.99 1.81 -0.25 -4.98 118.95 115.81 1v5l s ARG 20 Ca 0.39 -2.13 0.06 0.00 -1.72 0.00 0.00 55.73 52.33 1v5l s ARG 20 Cb -0.07 -1.80 -0.04 0.00 -0.45 0.00 0.00 34.95 32.59 1v5l s ARG 20 CO 0.28 -0.32 -0.14 -0.48 -0.68 0.00 0.00 175.30 173.96 1v5l s LEU 21 N -3.96 2.37 0.15 2.53 0.05 -1.26 -3.58 118.68 114.99 1v5l s LEU 21 Ca 0.25 -0.77 -0.06 0.00 0.05 0.00 0.00 54.13 53.61 1v5l s LEU 21 Cb 0.02 -0.54 -0.02 0.00 -2.05 0.00 0.00 46.19 43.60 1v5l s LEU 21 CO 0.14 -0.13 0.20 -0.55 -0.55 0.00 0.00 176.35 175.46 1v5l s SER 22 N -2.29 0.14 0.90 1.48 0.15 0.49 -4.24 113.70 110.34 1v5l s SER 22 Ca 0.06 -1.00 0.00 0.00 0.70 0.00 0.00 55.95 55.71 1v5l s SER 22 Cb -0.06 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.63 1v5l s SER 22 CO 0.03 -0.83 0.00 0.61 1.20 0.00 0.00 173.24 174.25 1v5l n GLY 23 N -0.17 0.96 0.00 9.45 0.00 -1.26 -2.24 105.19 111.93 1v5l n GLY 23 Ca -0.07 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 3.80 0.19 -0.02 0.00 -0.46 -4.46 105.19 104.24 1v5l n GLY 24 Ca 0.00 -0.87 0.13 0.00 0.00 0.00 0.00 46.02 45.29 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 3.64 0.00 0.03 -0.61 3.07 -1.75 -1.01 117.51 120.88 1v5l h ILE 25 Ca 0.00 -0.05 -0.30 0.00 1.55 0.00 0.00 64.86 66.06 1v5l h ILE 25 Cb 0.00 0.67 -0.04 0.00 -0.27 0.00 0.00 36.82 37.18 1v5l h ILE 25 CO 0.00 0.00 -1.70 -0.78 -1.05 0.00 0.00 178.15 174.62 1v5l h ASP 26 N 0.00 0.09 -0.36 2.16 1.82 -1.88 -3.32 116.42 114.93 1v5l h ASP 26 Ca 0.00 -0.19 0.00 0.00 -0.39 0.00 0.00 57.03 56.45 1v5l h ASP 26 Cb 0.07 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.05 1v5l h ASP 26 CO 0.00 1.17 0.00 0.49 -1.61 0.00 0.00 179.24 179.29 1v5l n PHE 27 N -3.16 0.54 -3.67 0.28 3.01 -0.45 -4.90 117.46 109.10 1v5l n PHE 27 Ca -0.18 -0.26 -0.26 0.00 1.01 0.00 0.00 57.45 57.76 1v5l n PHE 27 Cb 1.04 -0.03 0.05 0.00 -0.01 0.00 0.00 39.48 40.54 1v5l n PHE 27 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1v5l n ASN 28 N 0.55 -5.71 -3.92 4.37 4.13 -0.95 -4.85 115.26 108.87 1v5l n ASN 28 Ca 0.12 -0.61 -0.10 0.00 1.68 0.00 0.00 54.58 55.68 1v5l n ASN 28 Cb 0.35 -4.53 -0.10 0.00 -1.54 0.00 0.00 39.78 33.96 1v5l n ASN 28 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1v5l s GLN 29 N -6.38 0.55 0.32 3.52 -1.52 -0.77 -4.99 119.66 110.39 1v5l s GLN 29 Ca 0.59 -0.68 -0.29 0.00 -1.95 0.00 0.00 55.36 53.04 1v5l s GLN 29 Cb -0.28 0.22 -0.10 0.00 -0.22 0.00 0.00 33.01 32.63 1v5l s GLN 29 CO 0.73 -0.13 1.22 -1.25 -0.25 0.00 0.00 175.29 175.61 1v5l s PRO 30 N -2.32 4.41 -0.50 2.91 0.04 -1.26 -1.35 135.00 136.93 1v5l s PRO 30 Ca -0.07 2.03 -0.28 0.00 0.04 0.00 0.00 61.00 62.72 1v5l s PRO 30 Cb -0.03 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.46 1v5l s PRO 30 CO -0.03 -0.07 1.51 -0.51 0.04 0.00 0.00 177.00 177.93 1v5l s LEU 31 N -1.77 3.45 0.06 -3.56 1.43 -1.26 -4.16 118.68 112.88 1v5l s LEU 31 Ca 0.48 0.57 0.05 0.00 -1.03 0.00 0.00 54.13 54.21 1v5l s LEU 31 Cb -0.36 -3.19 -0.03 0.00 0.03 0.00 0.00 46.19 42.64 1v5l s LEU 31 CO 0.47 -1.70 -0.15 0.68 0.23 0.00 0.00 176.35 175.88 1v5l s VAL 32 N 6.31 1.21 0.35 -1.59 -7.23 -0.95 -0.29 120.40 118.21 1v5l s VAL 32 Ca 0.60 -1.21 -0.28 0.00 -1.81 0.00 0.00 61.98 59.27 1v5l s VAL 32 Cb -0.13 -1.12 -0.10 0.00 0.56 0.00 0.00 36.38 35.58 1v5l s VAL 32 CO 0.28 -0.10 1.36 -0.63 -0.31 0.00 0.00 175.10 175.70 1v5l s ILE 33 N -1.07 2.52 -0.16 -0.62 1.01 -1.19 0.19 121.20 121.88 1v5l s ILE 33 Ca 0.01 0.53 0.22 0.00 0.00 0.00 0.00 60.65 61.41 1v5l s ILE 33 Cb -0.09 -3.33 -0.18 0.00 0.01 0.00 0.00 42.46 38.86 1v5l s ILE 33 CO 0.02 0.12 0.75 0.35 0.00 0.00 0.00 174.94 176.19 1v5l n THR 34 N 0.67 0.28 -3.55 2.92 -2.24 -1.23 -3.19 114.28 107.93 1v5l n THR 34 Ca 0.00 -0.50 -0.07 0.00 -2.27 0.00 0.00 64.05 61.21 1v5l n THR 34 Cb 0.41 -0.13 -0.02 0.00 -2.10 0.00 0.00 70.33 68.50 1v5l n THR 34 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1v5l s ARG 35 N -3.43 0.73 -0.02 -0.78 6.06 -1.26 -4.90 118.95 115.34 1v5l s ARG 35 Ca -0.04 -0.29 0.01 0.00 -2.50 0.00 0.00 55.73 52.90 1v5l s ARG 35 Cb 0.12 0.32 0.02 0.00 0.06 0.00 0.00 34.95 35.47 1v5l s ARG 35 CO 0.85 -0.32 -0.00 0.42 -2.50 0.00 0.00 175.30 173.74 1v5l s ILE 36 N -2.96 0.17 -0.01 4.11 -1.09 -1.26 -1.10 121.20 119.06 1v5l s ILE 36 Ca 0.07 0.04 -0.30 0.00 -2.23 0.00 0.00 60.65 58.24 1v5l s ILE 36 Cb -0.01 -0.24 -0.08 0.00 -1.58 0.00 0.00 42.46 40.55 1v5l s ILE 36 CO -0.07 0.12 2.02 0.41 -1.23 0.00 0.00 174.94 176.19 1v5l n THR 37 N 3.87 0.69 -2.09 2.92 -1.04 0.42 -4.89 114.28 114.16 1v5l n THR 37 Ca -0.24 -0.19 -0.43 0.00 -2.04 0.00 0.00 64.05 61.15 1v5l n THR 37 Cb 0.52 -2.35 -0.03 0.00 -1.82 0.00 0.00 70.33 66.66 1v5l n THR 37 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1v5l s PRO 38 N 4.80 3.48 -0.23 -2.82 0.04 -1.26 -3.38 135.00 135.63 1v5l s PRO 38 Ca 0.91 1.38 -0.01 0.00 0.04 0.00 0.00 61.00 63.32 1v5l s PRO 38 Cb -0.43 -4.13 -0.01 0.00 0.04 0.00 0.00 34.50 29.98 1v5l s PRO 38 CO 0.41 -1.68 0.20 0.41 0.04 0.00 0.00 177.00 176.39 1v5l n GLY 39 N 5.20 -0.05 1.90 0.56 0.00 -1.26 -5.06 105.19 106.49 1v5l n GLY 39 Ca 0.21 -0.05 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.58 -1.17 0.20 1.61 3.41 -1.24 -4.98 113.62 109.88 1v5l n SER 40 Ca -0.01 -1.81 0.15 0.00 -0.26 0.00 0.00 58.87 56.94 1v5l n SER 40 Cb 0.52 1.94 0.77 0.00 -0.26 0.00 0.00 64.21 67.18 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 1.57 -1.89 0.39 116.57 120.97 1v5l h LYS 41 Ca -0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 1v5l h LYS 41 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1v5l h LYS 41 CO 0.22 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 179.10 1v5l n ALA 42 N -2.44 -0.18 -0.21 3.86 0.00 -1.24 -3.04 120.51 117.26 1v5l n ALA 42 Ca 0.01 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.40 1v5l n ALA 42 Cb 0.26 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.76 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 0.77 0.00 0.00 0.00 -1.56 -0.92 119.26 115.56 1v5l h ALA 43 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1v5l h ALA 43 Cb 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1v5l h ALA 43 CO 0.00 0.15 0.25 0.00 0.00 0.00 0.00 179.25 179.65 1v5l h ALA 44 N 1.24 1.18 -0.76 0.00 0.00 -0.37 0.47 119.26 121.02 1v5l h ALA 44 Ca 0.23 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.87 1v5l h ALA 44 Cb -0.03 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 17.60 1v5l h ALA 44 CO -0.08 -0.18 0.33 0.00 0.00 0.00 0.00 179.25 179.32 1v5l n ALA 45 N -1.64 4.74 -2.72 0.00 0.00 -0.36 -4.89 120.51 115.65 1v5l n ALA 45 Ca -0.01 -2.50 -0.17 0.00 0.00 0.00 0.00 53.44 50.76 1v5l n ALA 45 Cb 0.28 -1.25 0.02 0.00 0.00 0.00 0.00 19.45 18.50 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 -0.42 -5.06 -4.85 0.00 3.02 0.16 -4.96 115.26 103.15 1v5l n ASN 46 Ca 0.44 -0.17 -0.36 0.00 -0.03 0.00 0.00 54.58 54.45 1v5l n ASN 46 Cb 1.42 -3.97 -0.06 0.00 -0.61 0.00 0.00 39.78 36.56 1v5l n ASN 46 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1v5l s LEU 47 N -5.15 4.41 -0.03 3.41 1.43 -1.13 -5.03 118.68 116.59 1v5l s LEU 47 Ca 0.18 0.85 -0.24 0.00 -1.03 0.00 0.00 54.13 53.89 1v5l s LEU 47 Cb -0.08 -2.72 0.05 0.00 0.03 0.00 0.00 46.19 43.47 1v5l s LEU 47 CO 0.22 0.27 0.51 0.00 0.23 0.00 0.00 176.35 177.58 1v5l s PRO 49 N -1.28 2.59 0.00 0.00 0.04 -1.26 -3.08 135.00 132.01 1v5l s PRO 49 Ca -0.12 0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.16 1v5l s PRO 49 Cb -0.02 -4.67 0.00 0.00 0.04 0.00 0.00 34.50 29.85 1v5l s PRO 49 CO 0.07 -3.01 0.00 0.41 0.04 0.00 0.00 177.00 174.52 1v5l n GLY 50 N 6.18 0.09 3.77 0.56 0.00 -1.19 -4.91 105.19 109.69 1v5l n GLY 50 Ca 0.29 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.94 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 6.06 -0.23 1.61 1.01 -1.18 -4.80 116.67 119.14 1v5l s ASP 51 Ca 0.00 2.24 -0.13 0.00 0.71 0.00 0.00 52.55 55.37 1v5l s ASP 51 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.29 1v5l s ASP 51 CO 0.00 -0.99 0.28 -0.69 0.21 0.00 0.00 175.17 173.98 1v5l s VAL 52 N -1.64 5.27 -0.69 -1.27 1.01 -1.26 -3.18 120.40 118.64 1v5l s VAL 52 Ca 0.66 0.45 -0.25 0.00 0.00 0.00 0.00 61.98 62.84 1v5l s VAL 52 Cb -0.26 -3.62 0.05 0.00 0.00 0.00 0.00 36.38 32.55 1v5l s VAL 52 CO 0.31 0.29 1.13 -0.63 0.00 0.00 0.00 175.10 176.20 1v5l s ILE 53 N 1.26 4.01 -0.02 2.22 -1.09 0.61 -3.21 121.20 124.97 1v5l s ILE 53 Ca 0.13 0.10 -0.23 0.00 -2.23 0.00 0.00 60.65 58.42 1v5l s ILE 53 Cb -0.14 -4.80 -0.22 0.00 -1.58 0.00 0.00 42.46 35.72 1v5l s ILE 53 CO 0.07 -1.65 1.09 -0.07 -1.23 0.00 0.00 174.94 173.15 1v5l h LEU 54 N 12.21 0.31 -8.04 2.97 3.38 -0.52 -3.44 115.31 122.19 1v5l h LEU 54 Ca -0.28 -0.73 -0.24 0.00 0.09 0.00 0.00 57.88 56.73 1v5l h LEU 54 Cb 1.06 -0.09 -0.22 0.00 0.09 0.00 0.00 40.66 41.49 1v5l h LEU 54 CO 1.23 0.99 -0.72 0.00 0.09 0.00 0.00 178.44 180.03 1v5l s ALA 55 N -3.33 0.34 -0.21 1.53 0.00 -1.21 -1.85 121.76 117.04 1v5l s ALA 55 Ca -0.15 -0.58 -0.03 0.00 0.00 0.00 0.00 51.96 51.20 1v5l s ALA 55 Cb 0.02 0.06 -0.00 0.00 0.00 0.00 0.00 23.12 23.20 1v5l s ALA 55 CO 0.76 -0.06 -0.08 0.42 0.00 0.00 0.00 175.76 176.81 1v5l s ILE 56 N -1.17 3.10 -1.56 0.00 1.01 0.61 -1.94 121.20 121.26 1v5l s ILE 56 Ca -0.10 -0.59 -0.15 0.00 0.00 0.00 0.00 60.65 59.82 1v5l s ILE 56 Cb -0.08 -2.39 0.10 0.00 0.01 0.00 0.00 42.46 40.09 1v5l s ILE 56 CO -0.00 0.45 0.94 -0.67 0.00 0.00 0.00 174.94 175.66 1v5l n ASP 57 N 4.69 -4.62 -0.89 3.58 2.03 0.34 -1.17 116.55 120.50 1v5l n ASP 57 Ca -0.19 -0.79 -0.05 0.00 0.52 0.00 0.00 54.79 54.28 1v5l n ASP 57 Cb 0.51 -3.70 0.01 0.00 -0.72 0.00 0.00 41.12 37.22 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 -1.63 0.43 2.79 0.27 0.00 -1.00 -4.81 105.19 101.25 1v5l n GLY 58 Ca 0.05 -0.57 -0.16 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.70 -0.50 0.43 1.61 0.08 -0.32 -5.13 117.98 111.46 1v5l s PHE 59 Ca 0.07 0.16 -0.23 0.00 0.12 0.00 0.00 56.93 57.06 1v5l s PHE 59 Cb -0.03 -0.33 -0.12 0.00 -0.57 0.00 0.00 43.02 41.98 1v5l s PHE 59 CO 0.09 -0.79 0.70 0.41 -0.10 0.00 0.00 175.22 175.54 1v5l n GLY 60 N 5.33 -1.05 2.11 4.36 0.00 -1.26 -0.28 105.19 114.39 1v5l n GLY 60 Ca -0.03 0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.81 3.07 0.10 2.61 -2.24 -0.77 -4.50 114.28 111.75 1v5l n THR 61 Ca 0.11 -2.21 0.00 0.00 -2.27 0.00 0.00 64.05 59.68 1v5l n THR 61 Cb 0.40 -1.34 0.30 0.00 -2.10 0.00 0.00 70.33 67.60 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 1.87 0.24 0.00 -0.78 4.11 -1.88 -3.24 114.58 114.90 1v5l h GLU 62 Ca 0.38 -0.08 -0.11 0.00 0.07 0.00 0.00 59.36 59.62 1v5l h GLU 62 Cb 0.83 -0.02 -0.24 0.00 0.50 0.00 0.00 28.75 29.83 1v5l h GLU 62 CO 0.98 0.50 -0.81 0.43 0.07 0.00 0.00 179.01 180.17 1v5l n SER 63 N -4.15 1.16 -4.15 3.06 7.64 -1.26 -5.00 113.62 110.91 1v5l n SER 63 Ca -0.01 -2.56 -0.38 0.00 1.01 0.00 0.00 58.87 56.93 1v5l n SER 63 Cb 0.37 -0.36 -0.10 0.00 -1.01 0.00 0.00 64.21 63.11 1v5l n SER 63 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 1v5l s MET 64 N -0.98 2.24 0.56 1.43 0.00 -1.22 -5.06 119.30 116.26 1v5l s MET 64 Ca 0.32 -1.87 -0.17 0.00 0.00 0.00 0.00 55.69 53.98 1v5l s MET 64 Cb 0.35 -3.73 -0.05 0.00 0.00 0.00 0.00 34.83 31.40 1v5l s MET 64 CO -0.12 -1.13 1.06 0.95 0.00 0.00 0.00 175.02 175.77 1v5l s THR 65 N 1.11 3.77 0.16 10.11 -4.23 -1.26 -4.33 115.64 120.97 1v5l s THR 65 Ca 0.08 0.92 -0.13 0.00 -1.18 0.00 0.00 61.69 61.38 1v5l s THR 65 Cb -0.24 -3.39 0.15 0.00 1.34 0.00 0.00 72.50 70.36 1v5l s THR 65 CO -0.03 -0.42 1.08 1.57 -0.54 0.00 0.00 174.62 176.29 1v5l n HIS 66 N -1.71 -0.00 -0.30 3.99 -0.00 -1.26 0.24 115.22 116.17 1v5l n HIS 66 Ca 0.09 0.86 0.09 0.00 0.46 0.00 0.00 57.72 59.22 1v5l n HIS 66 Cb 0.53 -0.75 0.24 0.00 -0.12 0.00 0.00 29.99 29.89 1v5l n HIS 66 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1v5l h ALA 67 N 0.92 1.31 0.04 1.57 0.00 -1.92 -1.45 119.26 119.74 1v5l h ALA 67 Ca 0.23 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.25 1v5l h ALA 67 Cb 0.41 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1v5l h ALA 67 CO -0.69 -0.16 -0.02 -0.44 0.00 0.00 0.00 179.25 177.94 1v5l h ASP 68 N 0.56 -0.05 -1.04 0.00 5.19 0.27 -2.52 116.42 118.83 1v5l h ASP 68 Ca 0.48 -0.05 0.27 0.00 -0.62 0.00 0.00 57.03 57.11 1v5l h ASP 68 Cb 0.75 0.01 -0.09 0.00 0.18 0.00 0.00 39.33 40.18 1v5l h ASP 68 CO -0.40 0.02 0.67 0.00 -3.12 0.00 0.00 179.24 176.41 1v5l h ALA 69 N 0.85 2.23 -0.52 3.45 0.00 -0.42 0.48 119.26 125.33 1v5l h ALA 69 Ca -0.01 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1v5l h ALA 69 Cb 0.10 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1v5l h ALA 69 CO 0.01 -0.64 0.24 1.96 0.00 0.00 0.00 179.25 180.81 1v5l h GLN 70 N 0.39 0.73 0.00 0.00 1.08 -1.08 0.45 115.11 116.68 1v5l h GLN 70 Ca 0.60 -0.09 0.00 0.00 -1.45 0.00 0.00 58.65 57.71 1v5l h GLN 70 Cb 1.52 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 28.81 1v5l h GLN 70 CO -0.30 0.58 -0.47 -0.25 -0.95 0.00 0.00 178.83 177.44 1v5l n ASP 71 N -4.37 0.51 -0.06 1.46 9.92 0.15 -3.02 116.55 121.14 1v5l n ASP 71 Ca 0.04 -0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 54.18 1v5l n ASP 71 Cb 0.13 0.10 -0.14 0.00 -0.64 0.00 0.00 41.12 40.56 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 -1.73 0.67 0.09 -1.24 5.12 -0.08 -3.22 116.66 116.27 1v5l n ARG 72 Ca 0.05 0.17 -0.22 0.00 -1.93 0.00 0.00 57.85 55.92 1v5l n ARG 72 Cb 0.37 -1.66 -0.13 0.00 -1.16 0.00 0.00 32.46 29.88 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 1.32 -0.15 0.55 2.04 -0.27 -1.07 117.51 119.94 1v5l h ILE 73 Ca -0.42 -2.47 -0.19 0.00 1.00 0.00 0.00 64.86 62.77 1v5l h ILE 73 Cb 2.09 2.79 0.00 0.00 -0.74 0.00 0.00 36.82 40.96 1v5l h ILE 73 CO 0.05 0.74 -0.70 0.07 0.00 0.00 0.00 178.15 178.31 1v5l h LYS 74 N 0.16 0.62 -0.07 2.37 2.10 -1.74 -3.00 116.57 117.01 1v5l h LYS 74 Ca -0.19 -0.47 0.00 0.00 -2.00 0.00 0.00 60.65 57.99 1v5l h LYS 74 Cb 1.88 0.09 0.00 0.00 -0.90 0.00 0.00 32.23 33.30 1v5l h LYS 74 CO 0.23 1.09 0.00 0.00 -2.00 0.00 0.00 179.45 178.77 1v5l n ALA 75 N -2.55 2.55 -0.56 0.07 0.00 -1.20 -4.86 120.51 113.97 1v5l n ALA 75 Ca -0.05 -0.48 -0.18 0.00 0.00 0.00 0.00 53.44 52.73 1v5l n ALA 75 Cb 0.69 -1.13 0.14 0.00 0.00 0.00 0.00 19.45 19.15 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 0.24 -0.60 -1.99 0.00 0.00 -0.40 -5.00 120.51 112.75 1v5l n ALA 76 Ca 0.18 -0.98 -0.21 0.00 0.00 0.00 0.00 53.44 52.43 1v5l n ALA 76 Cb 0.35 -0.83 0.06 0.00 0.00 0.00 0.00 19.45 19.02 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 -1.89 5.03 0.59 0.00 0.01 -1.26 -4.92 113.70 111.26 1v5l s SER 77 Ca 0.34 -0.31 0.35 0.00 1.31 0.00 0.00 55.95 57.65 1v5l s SER 77 Cb -0.05 -0.40 1.25 0.00 0.21 0.00 0.00 66.02 67.02 1v5l s SER 77 CO 0.33 -1.33 1.44 0.22 0.41 0.00 0.00 173.24 174.31 1v5l h TYR 78 N -0.00 0.00 -3.62 2.43 5.03 -1.94 -3.35 116.97 115.51 1v5l h TYR 78 Ca -0.38 0.00 -0.41 0.00 2.58 0.00 0.00 58.73 60.52 1v5l h TYR 78 Cb 1.28 0.00 -0.32 0.00 1.55 0.00 0.00 36.73 39.24 1v5l h TYR 78 CO 0.22 0.00 -0.78 1.14 -1.32 0.00 0.00 178.16 177.42 1v5l s GLN 79 N -4.61 0.87 -0.29 1.82 1.03 -1.26 0.33 119.66 117.55 1v5l s GLN 79 Ca -0.04 -0.19 -0.11 0.00 0.04 0.00 0.00 55.36 55.06 1v5l s GLN 79 Cb 0.19 -0.83 -0.05 0.00 0.03 0.00 0.00 33.01 32.35 1v5l s GLN 79 CO 0.63 0.01 0.20 -1.17 -2.54 0.00 0.00 175.29 172.41 1v5l s LEU 80 N 0.55 4.06 -0.44 2.60 2.96 -1.05 -4.95 118.68 122.41 1v5l s LEU 80 Ca -0.08 -0.04 -0.10 0.00 -0.22 0.00 0.00 54.13 53.69 1v5l s LEU 80 Cb -0.11 -2.12 0.09 0.00 0.50 0.00 0.00 46.19 44.54 1v5l s LEU 80 CO 0.01 -0.07 0.30 0.00 -1.32 0.00 0.00 176.35 175.27 1v5l s LEU 82 N 1.43 2.98 -0.22 0.00 1.43 0.12 0.13 118.68 124.55 1v5l s LEU 82 Ca 0.04 -0.34 -0.22 0.00 -1.03 0.00 0.00 54.13 52.58 1v5l s LEU 82 Cb -0.24 -1.75 -0.02 0.00 0.03 0.00 0.00 46.19 44.21 1v5l s LEU 82 CO 0.02 0.01 0.69 -0.75 0.23 0.00 0.00 176.35 176.55 1v5l s LYS 83 N 1.28 4.19 0.03 1.70 2.20 -0.82 -2.42 119.74 125.91 1v5l s LYS 83 Ca 0.03 0.71 0.00 0.00 -0.36 0.00 0.00 55.97 56.36 1v5l s LYS 83 Cb -0.14 -3.61 -0.04 0.00 -1.51 0.00 0.00 37.83 32.53 1v5l s LYS 83 CO -0.01 -0.35 0.11 0.96 -0.36 0.00 0.00 175.35 175.70 1v5l s ILE 84 N 2.26 4.85 0.15 5.43 -4.36 0.05 0.25 121.20 129.84 1v5l s ILE 84 Ca 0.30 -0.47 -0.05 0.00 -0.26 0.00 0.00 60.65 60.18 1v5l s ILE 84 Cb -0.16 -3.28 -0.12 0.00 1.25 0.00 0.00 42.46 40.15 1v5l s ILE 84 CO 0.10 0.26 1.39 -0.78 0.24 0.00 0.00 174.94 176.14 1v5l h ASP 85 N 3.71 0.61 -2.63 4.36 1.82 -1.85 -2.64 116.42 119.81 1v5l h ASP 85 Ca -0.48 -0.41 -0.13 0.00 -0.39 0.00 0.00 57.03 55.62 1v5l h ASP 85 Cb 1.17 -0.18 0.05 0.00 0.68 0.00 0.00 39.33 41.05 1v5l h ASP 85 CO 0.66 1.17 -0.22 -1.14 -1.61 0.00 0.00 179.24 178.09 1v5l n ARG 86 N -3.86 -2.59 -2.87 0.28 0.63 -1.26 -4.71 116.66 102.28 1v5l n ARG 86 Ca -0.05 0.27 -0.42 0.00 -0.92 0.00 0.00 57.85 56.72 1v5l n ARG 86 Cb 0.73 -3.61 -0.04 0.00 0.45 0.00 0.00 32.46 29.99 1v5l n ARG 86 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1v5l s ALA 87 N -3.11 3.39 0.15 5.13 0.00 -1.26 -4.94 121.76 121.12 1v5l s ALA 87 Ca 0.18 -0.60 -0.23 0.00 0.00 0.00 0.00 51.96 51.32 1v5l s ALA 87 Cb -0.08 -3.48 0.03 0.00 0.00 0.00 0.00 23.12 19.59 1v5l s ALA 87 CO 0.24 -1.63 1.62 1.05 0.00 0.00 0.00 175.76 177.04 1v5l h GLU 88 N 8.58 -0.25 0.00 0.00 4.11 -2.01 -3.11 114.58 121.89 1v5l h GLU 88 Ca -0.24 0.02 -0.00 0.00 0.07 0.00 0.00 59.36 59.21 1v5l h GLU 88 Cb 1.08 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.39 1v5l h GLU 88 CO 0.96 -0.17 -0.10 2.41 0.07 0.00 0.00 179.01 182.18 1v5l n THR 89 N -5.39 1.60 -4.28 -1.06 -1.04 -1.26 -5.00 114.28 97.85 1v5l n THR 89 Ca -0.01 -1.95 -0.32 0.00 -2.04 0.00 0.00 64.05 59.74 1v5l n THR 89 Cb 0.30 -0.12 -0.09 0.00 -1.82 0.00 0.00 70.33 68.61 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 -1.19 -1.02 -1.30 -2.82 1.74 -1.18 -4.80 116.66 106.08 1v5l n ARG 90 Ca 0.14 0.11 -0.38 0.00 -0.77 0.00 0.00 57.85 56.95 1v5l n ARG 90 Cb 0.65 -3.56 0.04 0.00 -1.02 0.00 0.00 32.46 28.57 1v5l n ARG 90 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1v5l n LEU 91 N -4.61 -0.95 -4.56 0.55 7.99 -1.26 -4.80 117.00 109.36 1v5l n LEU 91 Ca -0.32 0.62 -0.42 0.00 -0.01 0.00 0.00 56.01 55.89 1v5l n LEU 91 Cb 0.69 -1.07 -0.02 0.00 -0.11 0.00 0.00 43.42 42.92 1v5l n LEU 91 CO 0.84 -3.78 1.68 0.86 -1.51 0.00 0.00 177.39 175.48 1v5l s TRP 92 N -1.88 2.67 0.00 -1.77 -0.11 -1.26 -4.92 118.94 111.66 1v5l s TRP 92 Ca 0.62 -1.21 -0.06 0.00 1.22 0.00 0.00 56.10 56.67 1v5l s TRP 92 Cb -0.41 -4.71 -0.00 0.00 -1.50 0.00 0.00 33.47 26.85 1v5l s TRP 92 CO 0.61 -1.86 0.11 -1.12 -4.62 0.00 0.00 176.95 170.07 1v5l s SER 93 N 4.59 0.04 0.34 5.86 0.01 -1.26 -5.03 113.70 118.25 1v5l s SER 93 Ca 0.49 -0.21 0.26 0.00 1.31 0.00 0.00 55.95 57.81 1v5l s SER 93 Cb 0.02 0.20 1.10 0.00 0.21 0.00 0.00 66.02 67.54 1v5l s SER 93 CO -0.02 -0.33 1.79 1.55 0.41 0.00 0.00 173.24 176.64 1v5l h PRO 94 N 4.47 0.00 -5.51 12.44 0.13 -2.03 -3.43 132.00 138.07 1v5l h PRO 94 Ca -0.30 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.43 1v5l h PRO 94 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1v5l h PRO 94 CO 0.41 0.00 1.43 0.94 -0.23 0.00 0.00 178.00 180.55 1v5l n GLN 95 N -2.47 0.86 -2.62 0.86 7.27 -1.26 -4.85 117.38 115.18 1v5l n GLN 95 Ca 0.02 -0.13 -0.43 0.00 0.07 0.00 0.00 57.00 56.53 1v5l n GLN 95 Cb 0.25 -3.28 0.00 0.00 2.41 0.00 0.00 30.24 29.62 1v5l n GLN 95 CO 0.00 0.00 0.00 1.33 0.07 0.00 0.00 177.06 178.46 1v5l n VAL 96 N 8.03 4.15 -3.39 1.69 0.24 -1.26 -4.52 118.33 123.27 1v5l n VAL 96 Ca 0.41 -4.38 -0.22 0.00 -2.04 0.00 0.00 64.34 58.12 1v5l n VAL 96 Cb 0.48 -2.43 -0.02 0.00 -1.47 0.00 0.00 33.84 30.40 1v5l n VAL 96 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1v5l n SER 97 N 5.76 -2.84 0.12 -1.34 3.41 -1.26 -4.79 113.62 112.68 1v5l n SER 97 Ca 0.41 -0.36 0.12 0.00 -0.26 0.00 0.00 58.87 58.78 1v5l n SER 97 Cb 0.41 -2.40 0.11 0.00 -0.26 0.00 0.00 64.21 62.07 1v5l n SER 97 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1v5l h SER 98 N -0.72 0.00 0.00 4.04 4.64 -1.93 -3.40 113.55 116.17 1v5l h SER 98 Ca -0.37 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1v5l h SER 98 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1v5l h SER 98 CO 0.49 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 177.09 1v5l n GLY 99 N 1.22 0.95 3.77 -0.77 0.00 -1.26 -4.80 105.19 104.30 1v5l n GLY 99 Ca 0.02 -1.17 -0.34 0.00 0.00 0.00 0.00 46.02 44.53 1v5l n GLY 99 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5l s PRO 100 N 0.00 3.14 -0.13 1.61 0.04 -1.26 -5.00 135.00 133.40 1v5l s PRO 100 Ca 0.00 1.53 -0.08 0.00 0.04 0.00 0.00 61.00 62.49 1v5l s PRO 100 Cb 0.00 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.50 1v5l s PRO 100 CO 0.00 -1.00 -0.20 -1.13 0.04 0.00 0.00 177.00 174.71 1v5l n SER 101 N -1.72 1.19 -0.23 6.66 3.41 -1.26 -4.67 113.62 117.00 1v5l n SER 101 Ca 0.11 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 1v5l n SER 101 Cb 0.51 -0.47 0.12 0.00 -0.26 0.00 0.00 64.21 64.11 1v5l n SER 101 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1v5l h SER 102 N -0.55 0.40 0.00 4.04 0.87 -2.04 -3.55 113.55 112.72 1v5l h SER 102 Ca -0.30 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 1v5l h SER 102 Cb 1.17 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 1v5l h SER 102 CO -0.18 0.24 0.00 0.61 -0.53 0.00 0.00 176.83 176.96