#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 -0.25 -0.03 1.61 0.15 -1.26 -5.17 113.70 108.76 1v5l s SER 2 Ca 0.00 0.41 0.01 0.00 0.70 0.00 0.00 55.95 57.07 1v5l s SER 2 Cb 0.00 0.91 0.02 0.00 -1.71 0.00 0.00 66.02 65.24 1v5l s SER 2 CO 0.00 -0.07 -0.01 -0.94 1.20 0.00 0.00 173.24 173.42 1v5l s SER 3 N 0.88 0.45 0.00 5.45 1.04 -1.26 -5.13 113.70 115.13 1v5l s SER 3 Ca -0.05 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.34 1v5l s SER 3 Cb -0.03 -0.21 0.00 0.00 0.10 0.00 0.00 66.02 65.88 1v5l s SER 3 CO -0.12 -0.07 0.00 0.61 0.98 0.00 0.00 173.24 174.64 1v5l n GLY 4 N 3.90 4.07 2.16 7.32 0.00 -1.26 -5.00 105.19 116.38 1v5l n GLY 4 Ca -0.24 -0.41 -0.25 0.00 0.00 0.00 0.00 46.02 45.11 1v5l n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v5l n SER 5 N 0.00 4.97 -4.33 1.61 7.64 -1.26 -5.08 113.62 117.17 1v5l n SER 5 Ca 0.00 -3.74 -0.33 0.00 1.01 0.00 0.00 58.87 55.81 1v5l n SER 5 Cb 0.00 -0.40 0.14 0.00 -1.01 0.00 0.00 64.21 62.95 1v5l n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1v5l n SER 6 N -0.65 -2.35 -3.16 6.43 7.64 -1.26 -4.15 113.62 116.13 1v5l n SER 6 Ca 0.43 0.11 0.02 0.00 1.01 0.00 0.00 58.87 60.44 1v5l n SER 6 Cb 0.87 -1.07 -0.01 0.00 -1.01 0.00 0.00 64.21 63.00 1v5l n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1v5l s GLY 7 N -1.89 -1.29 0.23 0.23 0.00 -1.11 -4.83 107.32 98.66 1v5l s GLY 7 Ca 0.56 0.52 -0.30 0.00 0.00 0.00 0.00 44.72 45.50 1v5l s GLY 7 CO 0.67 3.74 1.10 0.54 0.00 0.00 0.00 173.10 179.15 1v5l s ASN 8 N 2.08 7.28 -0.17 1.64 4.22 -1.26 -1.93 114.94 126.78 1v5l s ASN 8 Ca 0.15 2.17 -0.04 0.00 -2.14 0.00 0.00 52.86 53.00 1v5l s ASN 8 Cb -0.04 -2.61 0.08 0.00 1.28 0.00 0.00 41.25 39.95 1v5l s ASN 8 CO -0.12 -0.18 0.21 -0.69 -2.04 0.00 0.00 177.10 174.28 1v5l s VAL 9 N -0.68 -0.30 -0.31 3.54 1.01 -1.15 -4.98 120.40 117.53 1v5l s VAL 9 Ca 0.47 -0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.46 1v5l s VAL 9 Cb -0.31 -0.59 0.08 0.00 0.00 0.00 0.00 36.38 35.57 1v5l s VAL 9 CO 0.38 -0.12 -0.01 -0.69 0.00 0.00 0.00 175.10 174.66 1v5l s VAL 10 N 2.32 2.48 0.06 2.92 1.01 -1.26 -0.33 120.40 127.59 1v5l s VAL 10 Ca 0.05 -1.85 -0.28 0.00 0.00 0.00 0.00 61.98 59.90 1v5l s VAL 10 Cb -0.15 -2.59 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 1v5l s VAL 10 CO -0.10 -0.29 0.88 -0.76 0.00 0.00 0.00 175.10 174.83 1v5l s LEU 11 N 1.07 4.45 -0.11 3.92 1.43 -0.28 -4.88 118.68 124.28 1v5l s LEU 11 Ca -0.00 1.61 -0.29 0.00 -1.03 0.00 0.00 54.13 54.41 1v5l s LEU 11 Cb -0.20 -3.43 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 1v5l s LEU 11 CO -0.05 -0.08 1.53 -2.16 0.23 0.00 0.00 176.35 175.82 1v5l s PRO 12 N 0.21 4.15 0.00 1.29 0.04 -1.26 -2.09 135.00 137.34 1v5l s PRO 12 Ca 0.44 1.97 0.00 0.00 0.04 0.00 0.00 61.00 63.45 1v5l s PRO 12 Cb -0.22 -3.93 0.00 0.00 0.04 0.00 0.00 34.50 30.40 1v5l s PRO 12 CO 0.26 -0.86 0.00 0.41 0.04 0.00 0.00 177.00 176.86 1v5l n GLY 13 N 4.04 4.08 3.59 0.56 0.00 0.11 -4.88 105.19 112.69 1v5l n GLY 13 Ca 0.16 -1.90 -0.30 0.00 0.00 0.00 0.00 46.02 43.98 1v5l n GLY 13 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5l s PRO 14 N 2.61 -1.29 1.09 1.61 0.04 -1.22 -4.89 135.00 132.95 1v5l s PRO 14 Ca 0.00 -0.09 -0.19 0.00 0.04 0.00 0.00 61.00 60.76 1v5l s PRO 14 Cb 0.00 -1.59 0.06 0.00 0.04 0.00 0.00 34.50 33.01 1v5l s PRO 14 CO 0.00 -3.75 -0.11 0.00 0.04 0.00 0.00 177.00 173.18 1v5l n ALA 15 N -4.78 -4.15 -1.06 8.56 0.00 -1.26 -4.80 120.51 113.02 1v5l n ALA 15 Ca 0.14 -1.20 -0.19 0.00 0.00 0.00 0.00 53.44 52.18 1v5l n ALA 15 Cb 0.60 -1.48 0.25 0.00 0.00 0.00 0.00 19.45 18.81 1v5l n ALA 15 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1v5l n PRO 16 N -1.52 -3.12 -0.01 0.00 -0.04 -1.26 -5.16 135.00 123.89 1v5l n PRO 16 Ca 0.01 -1.71 -0.05 0.00 -0.04 0.00 0.00 63.50 61.70 1v5l n PRO 16 Cb 0.62 -1.61 -0.02 0.00 -0.04 0.00 0.00 33.50 32.46 1v5l n PRO 16 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1v5l n TRP 17 N -4.82 0.00 0.00 0.54 7.02 -1.26 -4.92 117.44 114.00 1v5l n TRP 17 Ca 0.15 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.63 1v5l n TRP 17 Cb 0.58 -0.19 0.00 0.00 -2.42 0.00 0.00 31.31 29.28 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 2.75 1.40 3.01 6.99 0.00 -1.26 -2.35 105.19 115.73 1v5l n GLY 18 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.17 0.49 1.61 -0.12 -1.26 -0.98 117.98 115.56 1v5l s PHE 19 Ca 0.00 0.42 0.09 0.00 -0.05 0.00 0.00 56.93 57.39 1v5l s PHE 19 Cb 0.00 0.03 0.05 0.00 -0.63 0.00 0.00 43.02 42.47 1v5l s PHE 19 CO 0.00 -0.10 0.66 1.03 -0.05 0.00 0.00 175.22 176.77 1v5l s ARG 20 N 0.29 2.56 0.22 1.99 1.81 -0.22 -4.96 118.95 120.64 1v5l s ARG 20 Ca -0.02 -1.46 0.09 0.00 -1.72 0.00 0.00 55.73 52.63 1v5l s ARG 20 Cb -0.03 -2.68 -0.05 0.00 -0.45 0.00 0.00 34.95 31.74 1v5l s ARG 20 CO -0.01 -0.55 -0.17 -0.48 -0.68 0.00 0.00 175.30 173.41 1v5l s LEU 21 N -4.49 2.54 0.01 2.53 0.05 -1.26 -2.65 118.68 115.41 1v5l s LEU 21 Ca 0.57 -0.99 -0.03 0.00 0.05 0.00 0.00 54.13 53.73 1v5l s LEU 21 Cb -0.08 -0.85 -0.01 0.00 -2.05 0.00 0.00 46.19 43.21 1v5l s LEU 21 CO 0.35 -0.07 0.04 -0.55 -0.55 0.00 0.00 176.35 175.57 1v5l s SER 22 N -3.25 0.13 0.00 1.48 0.15 0.53 -4.20 113.70 108.54 1v5l s SER 22 Ca 0.24 -0.32 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1v5l s SER 22 Cb -0.03 0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.42 1v5l s SER 22 CO 0.09 -0.29 0.00 0.61 1.20 0.00 0.00 173.24 174.85 1v5l n GLY 23 N 1.71 -0.07 0.00 9.45 0.00 -1.26 -1.54 105.19 113.49 1v5l n GLY 23 Ca -0.22 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.76 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 4.08 0.36 -0.02 0.00 -0.28 -4.55 105.19 104.78 1v5l n GLY 24 Ca 0.00 -0.59 0.10 0.00 0.00 0.00 0.00 46.02 45.54 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 0.03 0.14 -0.61 3.07 -1.74 1.26 117.51 119.67 1v5l h ILE 25 Ca 0.00 0.00 -0.29 0.00 1.55 0.00 0.00 64.86 66.12 1v5l h ILE 25 Cb 0.00 0.29 0.01 0.00 -0.27 0.00 0.00 36.82 36.85 1v5l h ILE 25 CO 0.00 0.00 -1.34 -0.78 -1.05 0.00 0.00 178.15 174.98 1v5l h ASP 26 N 0.00 0.48 -0.37 2.16 1.82 -1.88 -3.25 116.42 115.38 1v5l h ASP 26 Ca 0.07 -0.54 0.00 0.00 -0.39 0.00 0.00 57.03 56.17 1v5l h ASP 26 Cb 1.55 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 41.41 1v5l h ASP 26 CO -0.00 1.43 0.00 0.49 -1.61 0.00 0.00 179.24 179.55 1v5l n PHE 27 N -3.54 1.17 -3.84 0.28 3.72 0.43 -4.89 117.46 110.78 1v5l n PHE 27 Ca -0.11 -0.42 -0.27 0.00 -0.05 0.00 0.00 57.45 56.59 1v5l n PHE 27 Cb 1.04 -0.29 0.03 0.00 -0.94 0.00 0.00 39.48 39.32 1v5l n PHE 27 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1v5l n ASN 28 N 0.47 -3.90 -3.92 4.37 2.85 -0.87 -4.84 115.26 109.42 1v5l n ASN 28 Ca 0.17 -0.78 -0.10 0.00 -0.11 0.00 0.00 54.58 53.76 1v5l n ASN 28 Cb 0.76 -3.99 -0.10 0.00 1.24 0.00 0.00 39.78 37.69 1v5l n ASN 28 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 1v5l s GLN 29 N -6.43 0.48 0.38 1.20 -0.21 -1.07 -4.98 119.66 109.03 1v5l s GLN 29 Ca 0.48 -0.58 -0.26 0.00 0.02 0.00 0.00 55.36 55.02 1v5l s GLN 29 Cb -0.24 0.19 -0.09 0.00 1.00 0.00 0.00 33.01 33.87 1v5l s GLN 29 CO 0.82 -0.11 1.20 -1.25 -2.12 0.00 0.00 175.29 173.83 1v5l s PRO 30 N -1.83 4.14 -0.85 2.91 0.04 -1.26 -1.13 135.00 137.01 1v5l s PRO 30 Ca -0.12 1.92 -0.25 0.00 0.04 0.00 0.00 61.00 62.60 1v5l s PRO 30 Cb -0.06 -2.79 0.04 0.00 0.04 0.00 0.00 34.50 31.73 1v5l s PRO 30 CO -0.01 -0.27 1.32 -0.51 0.04 0.00 0.00 177.00 177.58 1v5l s LEU 31 N -2.29 3.42 0.51 -3.56 1.43 -1.25 -4.01 118.68 112.94 1v5l s LEU 31 Ca 0.55 -0.93 0.03 0.00 -1.03 0.00 0.00 54.13 52.75 1v5l s LEU 31 Cb -0.33 -2.55 -0.00 0.00 0.03 0.00 0.00 46.19 43.34 1v5l s LEU 31 CO 0.42 -1.66 0.12 0.68 0.23 0.00 0.00 176.35 176.14 1v5l s VAL 32 N 5.25 1.35 0.06 -1.59 -7.23 -0.59 0.12 120.40 117.77 1v5l s VAL 32 Ca 0.39 -1.85 -0.25 0.00 -1.81 0.00 0.00 61.98 58.46 1v5l s VAL 32 Cb -0.05 -2.20 -0.06 0.00 0.56 0.00 0.00 36.38 34.63 1v5l s VAL 32 CO 0.04 0.00 0.76 -0.63 -0.31 0.00 0.00 175.10 174.96 1v5l s ILE 33 N -2.84 4.68 -0.19 -0.62 1.01 -0.99 0.20 121.20 122.46 1v5l s ILE 33 Ca 0.15 1.63 0.10 0.00 0.00 0.00 0.00 60.65 62.53 1v5l s ILE 33 Cb 0.01 -4.11 -0.22 0.00 0.01 0.00 0.00 42.46 38.14 1v5l s ILE 33 CO 0.09 0.39 0.08 0.35 0.00 0.00 0.00 174.94 175.85 1v5l n THR 34 N 2.63 1.49 -3.71 2.92 -2.24 -1.08 -1.58 114.28 112.71 1v5l n THR 34 Ca -0.03 -0.74 -0.10 0.00 -2.27 0.00 0.00 64.05 60.91 1v5l n THR 34 Cb 0.50 -0.97 -0.06 0.00 -2.10 0.00 0.00 70.33 67.70 1v5l n THR 34 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1v5l s ARG 35 N -2.52 0.98 -0.03 -0.78 1.81 -1.26 -4.82 118.95 112.33 1v5l s ARG 35 Ca -0.19 -0.76 -0.03 0.00 -1.72 0.00 0.00 55.73 53.03 1v5l s ARG 35 Cb 0.07 0.42 0.01 0.00 -0.45 0.00 0.00 34.95 35.00 1v5l s ARG 35 CO 0.75 -0.36 0.09 0.42 -0.68 0.00 0.00 175.30 175.52 1v5l s ILE 36 N -3.70 0.02 -0.36 1.52 -1.09 -1.26 -1.05 121.20 115.27 1v5l s ILE 36 Ca 0.03 -0.14 -0.29 0.00 -2.23 0.00 0.00 60.65 58.02 1v5l s ILE 36 Cb 0.03 -0.18 0.02 0.00 -1.58 0.00 0.00 42.46 40.74 1v5l s ILE 36 CO -0.11 -0.08 1.13 -0.89 -1.23 0.00 0.00 174.94 173.76 1v5l s THR 37 N -0.21 4.37 -0.39 2.92 2.01 -0.15 -4.91 115.64 119.28 1v5l s THR 37 Ca -0.03 1.53 -0.28 0.00 0.31 0.00 0.00 61.69 63.22 1v5l s THR 37 Cb -0.02 -4.44 -0.01 0.00 0.01 0.00 0.00 72.50 68.04 1v5l s THR 37 CO 0.00 -0.63 1.72 -2.16 -0.69 0.00 0.00 174.62 172.86 1v5l s PRO 38 N 3.96 3.28 0.00 4.92 0.04 -1.26 -2.31 135.00 143.63 1v5l s PRO 38 Ca 0.48 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.72 1v5l s PRO 38 Cb -0.11 -4.19 0.00 0.00 0.04 0.00 0.00 34.50 30.24 1v5l s PRO 38 CO 0.21 -1.92 0.00 0.41 0.04 0.00 0.00 177.00 175.74 1v5l n GLY 39 N 5.39 0.80 3.12 0.56 0.00 -1.26 -5.02 105.19 108.78 1v5l n GLY 39 Ca 0.21 -0.46 -0.04 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.75 -1.62 0.06 1.61 3.41 -1.23 -4.93 113.62 110.17 1v5l n SER 40 Ca 0.00 -1.98 0.21 0.00 -0.26 0.00 0.00 58.87 56.84 1v5l n SER 40 Cb 0.27 2.66 0.72 0.00 -0.26 0.00 0.00 64.21 67.60 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 -1.88 0.79 116.57 121.59 1v5l h LYS 41 Ca -0.24 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.23 1v5l h LYS 41 Cb 0.99 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 1v5l h LYS 41 CO 0.32 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.69 1v5l n ALA 42 N -2.33 -0.08 -0.08 3.86 0.00 -0.99 -3.25 120.51 117.64 1v5l n ALA 42 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.44 1v5l n ALA 42 Cb 0.71 0.00 -0.02 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 0.36 -0.38 0.00 0.00 -1.25 -1.79 119.26 114.20 1v5l h ALA 43 Ca 0.00 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 54.98 1v5l h ALA 43 Cb 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1v5l h ALA 43 CO 0.00 -0.15 0.55 0.00 0.00 0.00 0.00 179.25 179.65 1v5l h ALA 44 N 1.07 2.05 -0.29 0.00 0.00 0.40 0.82 119.26 123.31 1v5l h ALA 44 Ca 0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1v5l h ALA 44 Cb -0.00 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1v5l h ALA 44 CO -0.02 -0.74 0.01 0.00 0.00 0.00 0.00 179.25 178.49 1v5l n ALA 45 N -2.19 3.22 -2.51 0.00 0.00 -0.69 -4.85 120.51 113.50 1v5l n ALA 45 Ca 0.07 -0.97 -0.18 0.00 0.00 0.00 0.00 53.44 52.36 1v5l n ALA 45 Cb 0.70 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 19.09 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 0.29 -5.30 -4.79 0.00 3.02 0.28 -4.97 115.26 103.79 1v5l n ASN 46 Ca 0.14 -0.08 -0.39 0.00 -0.03 0.00 0.00 54.58 54.22 1v5l n ASN 46 Cb 0.74 -4.31 -0.06 0.00 -0.61 0.00 0.00 39.78 35.54 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 -5.34 4.52 0.01 3.41 1.43 -1.13 -5.04 118.68 116.54 1v5l s LEU 47 Ca 0.08 1.36 0.00 0.00 -1.03 0.00 0.00 54.13 54.54 1v5l s LEU 47 Cb -0.03 -3.03 -0.01 0.00 0.03 0.00 0.00 46.19 43.15 1v5l s LEU 47 CO 0.09 0.21 -0.01 0.00 0.23 0.00 0.00 176.35 176.88 1v5l s PRO 49 N -0.53 2.57 0.00 0.00 0.04 -1.26 -3.00 135.00 132.82 1v5l s PRO 49 Ca -0.06 -0.18 0.00 0.00 0.04 0.00 0.00 61.00 60.81 1v5l s PRO 49 Cb -0.04 -4.98 0.00 0.00 0.04 0.00 0.00 34.50 29.53 1v5l s PRO 49 CO -0.00 -3.29 0.00 0.41 0.04 0.00 0.00 177.00 174.16 1v5l n GLY 50 N 6.71 0.37 3.61 0.56 0.00 -0.61 -4.85 105.19 110.97 1v5l n GLY 50 Ca 0.38 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.04 1v5l n GLY 50 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1v5l n ASP 51 N 0.00 0.40 -4.86 1.61 9.92 -1.16 -4.57 116.55 117.88 1v5l n ASP 51 Ca 0.00 0.67 -0.36 0.00 -0.53 0.00 0.00 54.79 54.57 1v5l n ASP 51 Cb 0.00 -1.40 -0.06 0.00 -0.64 0.00 0.00 41.12 39.03 1v5l n ASP 51 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1v5l s VAL 52 N -1.82 5.16 -0.47 2.53 1.01 -1.26 -2.34 120.40 123.21 1v5l s VAL 52 Ca 0.73 0.50 -0.12 0.00 0.00 0.00 0.00 61.98 63.08 1v5l s VAL 52 Cb -0.35 -3.62 0.10 0.00 0.00 0.00 0.00 36.38 32.51 1v5l s VAL 52 CO 0.51 0.43 0.37 -0.63 0.00 0.00 0.00 175.10 175.78 1v5l s ILE 53 N -1.24 4.67 -0.04 2.22 -1.09 0.32 -3.72 121.20 122.32 1v5l s ILE 53 Ca 0.27 -1.46 -0.23 0.00 -2.23 0.00 0.00 60.65 57.01 1v5l s ILE 53 Cb -0.14 -3.93 -0.26 0.00 -1.58 0.00 0.00 42.46 36.55 1v5l s ILE 53 CO 0.15 -0.68 0.99 -0.07 -1.23 0.00 0.00 174.94 174.10 1v5l h LEU 54 N 8.61 0.38 -7.60 2.97 3.38 -1.32 -3.42 115.31 118.31 1v5l h LEU 54 Ca -0.25 -0.84 -0.18 0.00 0.09 0.00 0.00 57.88 56.70 1v5l h LEU 54 Cb 1.09 -0.12 -0.25 0.00 0.09 0.00 0.00 40.66 41.47 1v5l h LEU 54 CO 0.88 1.18 -0.52 0.00 0.09 0.00 0.00 178.44 180.06 1v5l s ALA 55 N -2.89 -0.39 -0.11 1.53 0.00 -1.25 -2.09 121.76 116.57 1v5l s ALA 55 Ca -0.15 0.35 -0.03 0.00 0.00 0.00 0.00 51.96 52.13 1v5l s ALA 55 Cb 0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 23.12 22.90 1v5l s ALA 55 CO 0.79 -0.10 0.03 0.42 0.00 0.00 0.00 175.76 176.89 1v5l s ILE 56 N -0.19 4.52 -1.28 0.00 1.01 0.86 -1.89 121.20 124.23 1v5l s ILE 56 Ca -0.03 -0.16 -0.12 0.00 0.00 0.00 0.00 60.65 60.34 1v5l s ILE 56 Cb -0.02 -2.93 0.12 0.00 0.01 0.00 0.00 42.46 39.63 1v5l s ILE 56 CO 0.00 0.58 0.31 -0.90 0.00 0.00 0.00 174.94 174.93 1v5l n ASP 57 N 2.36 -0.73 -1.64 3.58 5.75 0.65 0.19 116.55 126.71 1v5l n ASP 57 Ca -0.19 -0.90 -0.08 0.00 -0.01 0.00 0.00 54.79 53.62 1v5l n ASP 57 Cb 0.54 -1.14 0.03 0.00 -1.03 0.00 0.00 41.12 39.51 1v5l n ASP 57 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1v5l n GLY 58 N -1.26 0.36 2.95 6.12 0.00 -1.16 -4.82 105.19 107.39 1v5l n GLY 58 Ca -0.01 -0.34 -0.07 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.11 -1.04 0.48 1.61 0.08 0.51 -5.02 117.98 111.48 1v5l s PHE 59 Ca 0.14 0.71 -0.22 0.00 0.12 0.00 0.00 56.93 57.69 1v5l s PHE 59 Cb -0.06 0.01 -0.10 0.00 -0.57 0.00 0.00 43.02 42.31 1v5l s PHE 59 CO 0.25 -0.87 0.83 0.41 -0.10 0.00 0.00 175.22 175.74 1v5l n GLY 60 N 5.37 -0.69 2.01 4.36 0.00 -1.26 -0.10 105.19 114.88 1v5l n GLY 60 Ca -0.01 0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.99 3.00 0.10 2.61 -2.24 -0.89 -4.47 114.28 111.40 1v5l n THR 61 Ca 0.11 -1.99 -0.01 0.00 -2.27 0.00 0.00 64.05 59.89 1v5l n THR 61 Cb 0.42 -1.28 0.27 0.00 -2.10 0.00 0.00 70.33 67.64 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 1.60 0.24 0.00 -0.78 9.09 -1.89 -3.27 114.58 119.58 1v5l h GLU 62 Ca 0.38 -0.10 -0.13 0.00 0.05 0.00 0.00 59.36 59.56 1v5l h GLU 62 Cb 0.90 -0.01 -0.29 0.00 -1.65 0.00 0.00 28.75 27.70 1v5l h GLU 62 CO 0.98 0.55 -0.90 0.45 0.05 0.00 0.00 179.01 180.14 1v5l n SER 63 N -4.09 1.18 -4.15 3.06 2.88 -1.26 -5.01 113.62 106.22 1v5l n SER 63 Ca -0.01 -2.48 -0.37 0.00 -1.33 0.00 0.00 58.87 54.68 1v5l n SER 63 Cb 0.42 -0.36 -0.11 0.00 -0.75 0.00 0.00 64.21 63.41 1v5l n SER 63 CO 0.00 0.00 0.00 -0.32 -1.23 0.00 0.00 175.04 173.49 1v5l s MET 64 N -0.81 2.16 0.93 -1.46 0.00 -1.23 -5.07 119.30 113.81 1v5l s MET 64 Ca 0.35 -1.71 -0.12 0.00 0.00 0.00 0.00 55.69 54.21 1v5l s MET 64 Cb 0.38 -3.59 0.15 0.00 0.00 0.00 0.00 34.83 31.77 1v5l s MET 64 CO -0.14 -1.02 1.09 0.95 0.00 0.00 0.00 175.02 175.90 1v5l s THR 65 N 1.20 2.43 0.18 10.11 -4.23 -1.26 -4.31 115.64 119.76 1v5l s THR 65 Ca 0.06 0.14 -0.24 0.00 -1.18 0.00 0.00 61.69 60.46 1v5l s THR 65 Cb -0.23 -2.65 0.06 0.00 1.34 0.00 0.00 72.50 71.03 1v5l s THR 65 CO -0.03 -0.18 1.57 -0.74 -0.54 0.00 0.00 174.62 174.70 1v5l h HIS 66 N -1.66 -1.23 -0.66 3.99 2.76 -1.86 0.13 115.15 116.61 1v5l h HIS 66 Ca -0.51 0.08 0.10 0.00 -2.20 0.00 0.00 60.37 57.84 1v5l h HIS 66 Cb 1.30 0.63 -0.08 0.00 1.55 0.00 0.00 27.41 30.81 1v5l h HIS 66 CO 0.37 -0.41 0.28 0.00 -1.30 0.00 0.00 177.93 176.86 1v5l h ALA 67 N 0.72 0.89 -0.85 5.26 0.00 -1.92 -1.03 119.26 122.33 1v5l h ALA 67 Ca 0.20 0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.25 1v5l h ALA 67 Cb 0.56 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.32 1v5l h ALA 67 CO -0.71 -0.15 0.52 -0.44 0.00 0.00 0.00 179.25 178.46 1v5l h ASP 68 N 0.47 0.82 -0.01 0.00 3.32 -1.15 -2.21 116.42 117.65 1v5l h ASP 68 Ca 0.34 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1v5l h ASP 68 Cb 0.42 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 1v5l h ASP 68 CO -0.31 0.52 0.00 0.00 -1.72 0.00 0.00 179.24 177.74 1v5l h ALA 69 N 1.40 0.01 -0.78 3.45 0.00 0.20 -1.06 119.26 122.49 1v5l h ALA 69 Ca 0.37 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.38 1v5l h ALA 69 Cb 0.17 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1v5l h ALA 69 CO -0.17 -0.48 0.51 1.96 0.00 0.00 0.00 179.25 181.07 1v5l h GLN 70 N -0.02 0.57 0.00 0.00 4.20 -0.96 0.45 115.11 119.36 1v5l h GLN 70 Ca 0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1v5l h GLN 70 Cb 0.03 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.68 1v5l h GLN 70 CO -0.00 0.38 -0.06 -0.25 -0.67 0.00 0.00 178.83 178.23 1v5l n ASP 71 N -4.50 0.37 -0.07 1.46 9.92 -0.87 -2.63 116.55 120.22 1v5l n ASP 71 Ca 0.14 0.47 -0.12 0.00 -0.53 0.00 0.00 54.79 54.75 1v5l n ASP 71 Cb 0.42 -0.54 -0.15 0.00 -0.64 0.00 0.00 41.12 40.21 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 -1.81 0.67 0.01 -1.24 5.12 0.12 -3.58 116.66 115.95 1v5l n ARG 72 Ca 0.06 0.14 -0.18 0.00 -1.93 0.00 0.00 57.85 55.95 1v5l n ARG 72 Cb 0.38 -1.63 -0.10 0.00 -1.16 0.00 0.00 32.46 29.95 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 1.39 -0.17 0.55 2.04 -0.52 -2.39 117.51 118.41 1v5l h ILE 73 Ca -0.46 -2.07 -0.10 0.00 1.00 0.00 0.00 64.86 63.23 1v5l h ILE 73 Cb 2.10 2.48 -0.01 0.00 -0.74 0.00 0.00 36.82 40.65 1v5l h ILE 73 CO 0.03 0.62 -0.33 0.07 0.00 0.00 0.00 178.15 178.54 1v5l h LYS 74 N 0.04 0.35 -0.65 2.37 2.10 -1.71 -2.51 116.57 116.56 1v5l h LYS 74 Ca -0.08 -0.15 0.00 0.00 -2.00 0.00 0.00 60.65 58.42 1v5l h LYS 74 Cb 1.37 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.69 1v5l h LYS 74 CO 0.13 0.64 0.00 0.00 -2.00 0.00 0.00 179.45 178.23 1v5l n ALA 75 N -2.48 3.30 -0.60 0.07 0.00 -1.23 -4.91 120.51 114.66 1v5l n ALA 75 Ca -0.01 -1.38 -0.08 0.00 0.00 0.00 0.00 53.44 51.97 1v5l n ALA 75 Cb 0.44 -1.06 0.14 0.00 0.00 0.00 0.00 19.45 18.96 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 0.66 -2.44 -2.54 0.00 0.00 -0.90 -4.99 120.51 110.29 1v5l n ALA 76 Ca 0.21 -0.71 -0.29 0.00 0.00 0.00 0.00 53.44 52.65 1v5l n ALA 76 Cb 0.87 -0.06 -0.04 0.00 0.00 0.00 0.00 19.45 20.22 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 -2.23 4.43 0.39 0.00 0.01 -1.26 -4.91 113.70 110.13 1v5l s SER 77 Ca 0.31 -1.41 0.29 0.00 1.31 0.00 0.00 55.95 56.45 1v5l s SER 77 Cb -0.05 0.44 1.32 0.00 0.21 0.00 0.00 66.02 67.94 1v5l s SER 77 CO 0.26 -0.99 1.37 0.00 0.41 0.00 0.00 173.24 174.29 1v5l n TYR 78 N -1.55 0.60 -4.14 2.43 4.19 -1.26 -3.88 117.16 113.54 1v5l n TYR 78 Ca -0.09 0.60 -0.24 0.00 3.31 0.00 0.00 57.90 61.48 1v5l n TYR 78 Cb 0.65 -1.02 -0.17 0.00 0.49 0.00 0.00 39.34 39.29 1v5l n TYR 78 CO 0.00 0.00 0.00 1.14 0.91 0.00 0.00 176.86 178.91 1v5l s GLN 79 N -5.03 1.31 -0.34 2.98 -2.07 -1.26 0.08 119.66 115.33 1v5l s GLN 79 Ca -0.06 -0.22 -0.18 0.00 -1.82 0.00 0.00 55.36 53.08 1v5l s GLN 79 Cb 0.27 -1.29 -0.01 0.00 -1.09 0.00 0.00 33.01 30.89 1v5l s GLN 79 CO 0.72 -0.14 0.49 -1.17 -1.32 0.00 0.00 175.29 173.87 1v5l s LEU 80 N 1.26 4.32 -0.38 2.60 2.96 -0.89 -4.94 118.68 123.61 1v5l s LEU 80 Ca -0.04 0.01 -0.14 0.00 -0.22 0.00 0.00 54.13 53.73 1v5l s LEU 80 Cb -0.14 -2.56 0.01 0.00 0.50 0.00 0.00 46.19 44.00 1v5l s LEU 80 CO -0.03 -0.43 0.30 0.00 -1.32 0.00 0.00 176.35 174.87 1v5l s LEU 82 N 1.75 2.21 0.07 0.00 1.43 0.55 0.24 118.68 124.93 1v5l s LEU 82 Ca 0.06 -0.82 -0.22 0.00 -1.03 0.00 0.00 54.13 52.12 1v5l s LEU 82 Cb -0.18 -1.26 -0.06 0.00 0.03 0.00 0.00 46.19 44.72 1v5l s LEU 82 CO 0.11 -0.12 0.67 -0.75 0.23 0.00 0.00 176.35 176.49 1v5l s LYS 83 N 1.39 4.39 0.10 1.70 2.20 -0.79 -2.91 119.74 125.82 1v5l s LYS 83 Ca 0.00 0.91 0.09 0.00 -0.36 0.00 0.00 55.97 56.61 1v5l s LYS 83 Cb -0.15 -3.30 -0.03 0.00 -1.51 0.00 0.00 37.83 32.83 1v5l s LYS 83 CO -0.09 0.46 -0.22 0.96 -0.36 0.00 0.00 175.35 176.10 1v5l s ILE 84 N -0.60 1.80 -1.20 5.43 -5.25 -0.81 -0.92 121.20 119.64 1v5l s ILE 84 Ca 0.33 -1.55 0.07 0.00 -0.99 0.00 0.00 60.65 58.51 1v5l s ILE 84 Cb -0.20 -1.62 0.30 0.00 2.95 0.00 0.00 42.46 43.89 1v5l s ILE 84 CO 0.21 -0.01 1.09 -0.67 -1.79 0.00 0.00 174.94 173.76 1v5l n ASP 85 N 1.12 2.40 -3.97 4.36 2.03 -1.24 -2.75 116.55 118.49 1v5l n ASP 85 Ca -0.19 -2.23 -0.25 0.00 0.52 0.00 0.00 54.79 52.64 1v5l n ASP 85 Cb 0.53 -0.43 -0.08 0.00 -0.72 0.00 0.00 41.12 40.42 1v5l n ASP 85 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 1v5l n ARG 86 N 0.30 -0.95 -3.61 -0.67 0.00 -1.26 -4.87 116.66 105.60 1v5l n ARG 86 Ca 0.11 0.07 -0.40 0.00 -0.00 0.00 0.00 57.85 57.63 1v5l n ARG 86 Cb 0.48 -2.92 -0.10 0.00 0.00 0.00 0.00 32.46 29.92 1v5l n ARG 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1v5l s ALA 87 N -4.08 3.29 -0.10 5.13 0.00 -1.26 -4.93 121.76 119.82 1v5l s ALA 87 Ca 0.02 -2.27 -0.13 0.00 0.00 0.00 0.00 51.96 49.58 1v5l s ALA 87 Cb -0.01 -2.66 -0.27 0.00 0.00 0.00 0.00 23.12 20.18 1v5l s ALA 87 CO 0.81 -1.72 0.52 1.05 0.00 0.00 0.00 175.76 176.42 1v5l h GLU 88 N 8.38 0.27 0.00 0.00 4.11 -1.95 -3.37 114.58 122.01 1v5l h GLU 88 Ca -0.22 -0.46 -0.02 0.00 0.07 0.00 0.00 59.36 58.74 1v5l h GLU 88 Cb 1.08 0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.49 1v5l h GLU 88 CO 0.77 1.22 -1.17 0.25 0.07 0.00 0.00 179.01 180.15 1v5l n THR 89 N -3.79 0.60 -3.55 -1.06 -2.24 -1.26 -4.96 114.28 98.03 1v5l n THR 89 Ca -0.27 -0.56 -0.18 0.00 -2.27 0.00 0.00 64.05 60.77 1v5l n THR 89 Cb 0.96 -0.33 -0.06 0.00 -2.10 0.00 0.00 70.33 68.80 1v5l n THR 89 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1v5l n ARG 90 N -2.64 -0.96 0.11 -0.78 1.74 -1.26 -4.77 116.66 108.10 1v5l n ARG 90 Ca -0.02 0.05 -0.18 0.00 -0.77 0.00 0.00 57.85 56.94 1v5l n ARG 90 Cb 0.58 -2.12 -0.14 0.00 -1.02 0.00 0.00 32.46 29.76 1v5l n ARG 90 CO 0.00 0.00 0.00 1.37 -1.52 0.00 0.00 177.63 177.48 1v5l h LEU 91 N -0.62 0.52 -2.89 0.55 -0.00 -1.96 -3.25 115.31 107.66 1v5l h LEU 91 Ca -0.38 -0.56 0.00 0.00 -0.00 0.00 0.00 57.88 56.93 1v5l h LEU 91 Cb 0.81 -0.17 0.00 0.00 -0.00 0.00 0.00 40.66 41.31 1v5l h LEU 91 CO 0.42 1.44 0.00 1.87 -0.00 0.00 0.00 178.44 182.17 1v5l n TRP 92 N -3.57 1.53 -3.73 0.17 -0.00 -1.26 -4.93 117.44 105.65 1v5l n TRP 92 Ca -0.11 -0.54 -0.23 0.00 -0.00 0.00 0.00 57.50 56.62 1v5l n TRP 92 Cb 1.04 -0.38 -0.03 0.00 -0.00 0.00 0.00 31.31 31.94 1v5l n TRP 92 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 177.69 178.12 1v5l n SER 93 N 0.55 -0.57 0.02 5.87 7.64 -1.23 -4.81 113.62 121.09 1v5l n SER 93 Ca 0.21 -0.78 -0.13 0.00 1.01 0.00 0.00 58.87 59.18 1v5l n SER 93 Cb 0.94 -0.96 -0.09 0.00 -1.01 0.00 0.00 64.21 63.08 1v5l n SER 93 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1v5l h PRO 94 N -0.58 -0.09 -4.66 1.43 0.13 -1.92 -3.45 132.00 122.87 1v5l h PRO 94 Ca -0.41 0.01 -0.19 0.00 -0.87 0.00 0.00 66.00 64.53 1v5l h PRO 94 Cb 0.85 0.02 -0.12 0.00 0.13 0.00 0.00 31.00 31.88 1v5l h PRO 94 CO 0.39 0.36 -0.28 1.04 -0.23 0.00 0.00 178.00 179.27 1v5l n GLN 95 N -4.91 -1.62 -3.83 0.86 6.02 -1.26 -4.82 117.38 107.82 1v5l n GLN 95 Ca -0.08 0.04 -0.13 0.00 -0.01 0.00 0.00 57.00 56.82 1v5l n GLN 95 Cb 0.25 -3.06 -0.14 0.00 1.02 0.00 0.00 30.24 28.31 1v5l n GLN 95 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1v5l s VAL 96 N -1.87 -0.01 -0.30 5.09 1.01 -1.26 -4.92 120.40 118.13 1v5l s VAL 96 Ca 0.26 0.05 -0.14 0.00 0.00 0.00 0.00 61.98 62.15 1v5l s VAL 96 Cb -0.15 -0.11 0.17 0.00 0.00 0.00 0.00 36.38 36.29 1v5l s VAL 96 CO 0.32 0.02 1.01 -0.44 0.00 0.00 0.00 175.10 176.01 1v5l s SER 97 N 0.31 -0.54 -1.20 3.32 0.01 -1.26 -4.82 113.70 109.52 1v5l s SER 97 Ca -0.02 0.58 -0.19 0.00 1.31 0.00 0.00 55.95 57.63 1v5l s SER 97 Cb -0.03 1.55 0.07 0.00 0.21 0.00 0.00 66.02 67.82 1v5l s SER 97 CO -0.01 -0.10 1.62 -0.55 0.41 0.00 0.00 173.24 174.60 1v5l s SER 98 N 2.59 6.74 0.51 2.44 0.15 -1.26 -4.86 113.70 120.01 1v5l s SER 98 Ca -0.00 -2.17 -0.22 0.00 0.70 0.00 0.00 55.95 54.25 1v5l s SER 98 Cb -0.07 -2.56 -0.06 0.00 -1.71 0.00 0.00 66.02 61.62 1v5l s SER 98 CO -0.16 -1.24 1.30 -0.83 1.20 0.00 0.00 173.24 173.51 1v5l s GLY 99 N 4.35 2.86 -0.60 9.45 0.00 -1.26 -4.88 107.32 117.24 1v5l s GLY 99 Ca 0.50 1.21 -0.27 0.00 0.00 0.00 0.00 44.72 46.17 1v5l s GLY 99 CO 0.02 1.72 1.86 2.56 0.00 0.00 0.00 173.10 179.25 1v5l s PRO 100 N -2.81 2.66 -1.37 2.90 0.04 -1.26 -3.90 135.00 131.26 1v5l s PRO 100 Ca 0.68 0.65 -0.09 0.00 0.04 0.00 0.00 61.00 62.29 1v5l s PRO 100 Cb -0.37 -4.38 0.09 0.00 0.04 0.00 0.00 34.50 29.88 1v5l s PRO 100 CO 0.44 -2.69 0.22 -1.13 0.04 0.00 0.00 177.00 173.89 1v5l n SER 101 N 12.62 -0.27 -0.31 6.66 3.41 -1.26 -4.72 113.62 129.74 1v5l n SER 101 Ca 0.20 -1.01 0.09 0.00 -0.26 0.00 0.00 58.87 57.90 1v5l n SER 101 Cb 0.52 -1.28 0.20 0.00 -0.26 0.00 0.00 64.21 63.39 1v5l n SER 101 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1v5l n SER 102 N -2.05 -0.21 0.00 4.04 2.88 -1.25 -5.20 113.62 111.84 1v5l n SER 102 Ca -0.10 1.52 0.00 0.00 -1.33 0.00 0.00 58.87 58.96 1v5l n SER 102 Cb 0.47 -0.51 0.00 0.00 -0.75 0.00 0.00 64.21 63.42 1v5l n SER 102 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42