#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 4.21 -0.29 1.61 0.15 -1.26 -5.09 113.70 113.03 1v5l s SER 2 Ca 0.00 -1.55 -0.02 0.00 0.70 0.00 0.00 55.95 55.07 1v5l s SER 2 Cb 0.00 -1.30 0.04 0.00 -1.71 0.00 0.00 66.02 63.05 1v5l s SER 2 CO 0.00 -0.30 -0.00 -0.44 1.20 0.00 0.00 173.24 173.70 1v5l s SER 3 N 1.26 4.81 0.00 5.45 0.01 -1.26 -5.02 113.70 118.95 1v5l s SER 3 Ca 0.01 -1.17 0.00 0.00 1.31 0.00 0.00 55.95 56.10 1v5l s SER 3 Cb -0.19 -1.72 0.00 0.00 0.21 0.00 0.00 66.02 64.32 1v5l s SER 3 CO -0.10 -0.24 0.00 0.61 0.41 0.00 0.00 173.24 173.93 1v5l n GLY 4 N 4.65 0.62 3.57 3.44 0.00 -1.26 -4.74 105.19 111.47 1v5l n GLY 4 Ca -0.14 -1.86 -0.23 0.00 0.00 0.00 0.00 46.02 43.79 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 -1.19 4.58 -0.47 1.61 0.15 -1.26 -4.89 113.70 112.23 1v5l s SER 5 Ca 0.00 -1.13 -0.18 0.00 0.70 0.00 0.00 55.95 55.34 1v5l s SER 5 Cb 0.00 -2.58 0.05 0.00 -1.71 0.00 0.00 66.02 61.78 1v5l s SER 5 CO 0.00 -3.47 0.53 -0.94 1.20 0.00 0.00 173.24 170.56 1v5l s SER 6 N 7.72 6.21 -1.08 5.45 1.04 -1.26 -4.36 113.70 127.41 1v5l s SER 6 Ca 0.74 -0.90 -0.22 0.00 0.48 0.00 0.00 55.95 56.05 1v5l s SER 6 Cb -0.04 -2.25 0.02 0.00 0.10 0.00 0.00 66.02 63.85 1v5l s SER 6 CO 0.11 -0.75 1.66 -0.83 0.98 0.00 0.00 173.24 174.41 1v5l s GLY 7 N 2.39 1.04 0.30 7.32 0.00 -1.07 -4.97 107.32 112.32 1v5l s GLY 7 Ca 0.12 -2.27 -0.29 0.00 0.00 0.00 0.00 44.72 42.28 1v5l s GLY 7 CO 0.12 2.94 1.18 0.54 0.00 0.00 0.00 173.10 177.87 1v5l s ASN 8 N 5.53 7.09 -0.24 1.64 4.22 -1.26 -1.69 114.94 130.21 1v5l s ASN 8 Ca 0.55 2.42 -0.03 0.00 -2.14 0.00 0.00 52.86 53.66 1v5l s ASN 8 Cb -0.00 -2.63 0.11 0.00 1.28 0.00 0.00 41.25 40.00 1v5l s ASN 8 CO -0.01 -0.29 0.22 -0.69 -2.04 0.00 0.00 177.10 174.29 1v5l s VAL 9 N -1.13 -0.29 -0.45 3.54 1.01 -1.04 -4.97 120.40 117.07 1v5l s VAL 9 Ca 0.46 -0.36 -0.08 0.00 0.00 0.00 0.00 61.98 62.01 1v5l s VAL 9 Cb -0.35 -0.83 0.11 0.00 0.00 0.00 0.00 36.38 35.32 1v5l s VAL 9 CO 0.45 -0.39 0.30 -0.69 0.00 0.00 0.00 175.10 174.77 1v5l s VAL 10 N 2.28 4.02 0.06 2.92 1.01 -1.26 -1.56 120.40 127.86 1v5l s VAL 10 Ca 0.08 -1.78 -0.20 0.00 0.00 0.00 0.00 61.98 60.07 1v5l s VAL 10 Cb -0.15 -3.63 -0.06 0.00 0.00 0.00 0.00 36.38 32.53 1v5l s VAL 10 CO -0.23 -0.71 0.60 -0.76 0.00 0.00 0.00 175.10 174.00 1v5l s LEU 11 N 1.33 4.50 0.25 3.92 1.43 -0.77 -4.94 118.68 124.40 1v5l s LEU 11 Ca 0.06 1.27 -0.30 0.00 -1.03 0.00 0.00 54.13 54.13 1v5l s LEU 11 Cb -0.25 -2.95 -0.09 0.00 0.03 0.00 0.00 46.19 42.93 1v5l s LEU 11 CO -0.01 0.21 1.27 -2.16 0.23 0.00 0.00 176.35 175.89 1v5l s PRO 12 N -0.81 4.43 0.00 1.29 0.04 -1.26 -2.21 135.00 136.48 1v5l s PRO 12 Ca 0.30 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.39 1v5l s PRO 12 Cb -0.19 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.19 1v5l s PRO 12 CO 0.19 -0.14 0.00 0.41 0.04 0.00 0.00 177.00 177.50 1v5l n GLY 13 N 1.68 6.29 0.08 0.56 0.00 0.34 -4.84 105.19 109.31 1v5l n GLY 13 Ca 0.03 -1.78 -0.01 0.00 0.00 0.00 0.00 46.02 44.26 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 -1.07 -0.85 1.61 -0.04 -1.21 -4.82 135.00 128.63 1v5l n PRO 14 Ca 0.00 -0.04 -0.29 0.00 -0.04 0.00 0.00 63.50 63.13 1v5l n PRO 14 Cb 0.00 -0.04 0.19 0.00 -0.04 0.00 0.00 33.50 33.61 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 0.78 0.86 0.55 0.00 -1.26 -4.66 121.76 115.05 1v5l s ALA 15 Ca 0.02 0.06 -0.11 0.00 0.00 0.00 0.00 51.96 51.92 1v5l s ALA 15 Cb -0.00 -3.27 0.11 0.00 0.00 0.00 0.00 23.12 19.96 1v5l s ALA 15 CO 0.01 -3.01 1.09 -1.25 0.00 0.00 0.00 175.76 172.60 1v5l s PRO 16 N -4.70 1.52 -0.27 0.00 0.04 -1.26 -5.14 135.00 125.19 1v5l s PRO 16 Ca 0.66 0.91 -0.13 0.00 0.04 0.00 0.00 61.00 62.49 1v5l s PRO 16 Cb -0.22 -1.83 -0.12 0.00 0.04 0.00 0.00 34.50 32.37 1v5l s PRO 16 CO 0.60 -2.09 -0.34 0.91 0.04 0.00 0.00 177.00 176.12 1v5l n TRP 17 N -3.79 0.00 0.00 0.56 7.02 -1.26 -4.93 117.44 115.03 1v5l n TRP 17 Ca 0.08 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.56 1v5l n TRP 17 Cb 0.55 -0.96 0.00 0.00 -2.42 0.00 0.00 31.31 28.48 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 1.38 1.30 3.64 6.99 0.00 -1.26 -3.17 105.19 114.07 1v5l n GLY 18 Ca -0.52 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.21 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 -1.36 2.84 0.50 1.61 -0.12 -1.26 -2.26 117.98 117.93 1v5l s PHE 19 Ca 0.00 -0.12 0.07 0.00 -0.05 0.00 0.00 56.93 56.83 1v5l s PHE 19 Cb 0.00 -1.44 0.02 0.00 -0.63 0.00 0.00 43.02 40.98 1v5l s PHE 19 CO 0.00 0.48 0.42 1.03 -0.05 0.00 0.00 175.22 177.10 1v5l s ARG 20 N -2.52 2.33 0.09 1.99 1.81 -0.98 -5.01 118.95 116.66 1v5l s ARG 20 Ca 0.25 -1.84 0.05 0.00 -1.72 0.00 0.00 55.73 52.47 1v5l s ARG 20 Cb -0.11 -2.23 -0.03 0.00 -0.45 0.00 0.00 34.95 32.14 1v5l s ARG 20 CO 0.17 -0.50 -0.12 -0.48 -0.68 0.00 0.00 175.30 173.69 1v5l s LEU 21 N -4.26 2.35 0.31 2.53 0.05 -1.26 -3.51 118.68 114.89 1v5l s LEU 21 Ca 0.41 -0.72 -0.01 0.00 0.05 0.00 0.00 54.13 53.86 1v5l s LEU 21 Cb -0.02 -0.43 -0.01 0.00 -2.05 0.00 0.00 46.19 43.67 1v5l s LEU 21 CO 0.25 -0.16 0.38 -0.55 -0.55 0.00 0.00 176.35 175.72 1v5l s SER 22 N -2.12 0.85 0.97 1.48 0.15 0.63 -4.41 113.70 111.24 1v5l s SER 22 Ca 0.02 -1.47 0.00 0.00 0.70 0.00 0.00 55.95 55.21 1v5l s SER 22 Cb -0.07 0.59 0.00 0.00 -1.71 0.00 0.00 66.02 64.83 1v5l s SER 22 CO 0.02 -1.16 0.00 0.61 1.20 0.00 0.00 173.24 173.91 1v5l n GLY 23 N -0.51 0.93 0.00 9.45 0.00 -1.26 -2.59 105.19 111.21 1v5l n GLY 23 Ca 0.02 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.31 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 4.29 0.14 -0.02 0.00 -0.50 -4.48 105.19 104.61 1v5l n GLY 24 Ca 0.00 -0.84 0.09 0.00 0.00 0.00 0.00 46.02 45.27 1v5l n GLY 24 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1v5l n ILE 25 N -1.55 1.20 -0.00 -0.61 -5.35 -1.24 -0.80 119.36 111.01 1v5l n ILE 25 Ca 0.00 0.70 -0.06 0.00 -0.27 0.00 0.00 62.75 63.12 1v5l n ILE 25 Cb 0.00 -1.70 -0.12 0.00 -1.74 0.00 0.00 39.64 36.08 1v5l n ILE 25 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 1v5l h ASP 26 N 0.00 0.00 -0.45 7.28 1.82 -1.87 -3.32 116.42 119.87 1v5l h ASP 26 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1v5l h ASP 26 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 1v5l h ASP 26 CO 0.00 0.89 0.00 0.49 -1.61 0.00 0.00 179.24 179.01 1v5l n PHE 27 N -3.02 0.60 -3.54 0.28 3.72 0.02 -4.92 117.46 110.60 1v5l n PHE 27 Ca -0.14 -0.30 -0.22 0.00 -0.05 0.00 0.00 57.45 56.74 1v5l n PHE 27 Cb 0.99 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.62 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 0.91 -5.26 -3.75 4.37 3.02 -0.94 -4.88 115.26 108.72 1v5l n ASN 28 Ca 0.17 -0.55 -0.12 0.00 -0.03 0.00 0.00 54.58 54.05 1v5l n ASN 28 Cb 0.42 -4.99 -0.07 0.00 -0.61 0.00 0.00 39.78 34.52 1v5l n ASN 28 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1v5l s GLN 29 N -6.06 0.80 0.38 3.52 -0.21 -0.93 -5.00 119.66 112.16 1v5l s GLN 29 Ca 0.44 -0.45 -0.26 0.00 0.02 0.00 0.00 55.36 55.10 1v5l s GLN 29 Cb -0.19 0.35 -0.09 0.00 1.00 0.00 0.00 33.01 34.08 1v5l s GLN 29 CO 0.72 -0.25 1.20 -1.25 -2.12 0.00 0.00 175.29 173.58 1v5l s PRO 30 N -2.39 4.16 -0.61 2.91 0.04 -1.26 -1.42 135.00 136.43 1v5l s PRO 30 Ca -0.06 1.93 -0.28 0.00 0.04 0.00 0.00 61.00 62.64 1v5l s PRO 30 Cb -0.01 -2.81 0.02 0.00 0.04 0.00 0.00 34.50 31.74 1v5l s PRO 30 CO -0.02 -0.26 1.34 -0.51 0.04 0.00 0.00 177.00 177.59 1v5l s LEU 31 N -2.26 3.36 0.37 -3.56 1.43 -1.26 -4.08 118.68 112.68 1v5l s LEU 31 Ca 0.54 0.08 0.06 0.00 -1.03 0.00 0.00 54.13 53.78 1v5l s LEU 31 Cb -0.33 -2.96 -0.07 0.00 0.03 0.00 0.00 46.19 42.86 1v5l s LEU 31 CO 0.42 -1.70 0.03 0.68 0.23 0.00 0.00 176.35 176.01 1v5l s VAL 32 N 5.82 1.66 0.26 -1.59 -7.23 -1.07 0.02 120.40 118.26 1v5l s VAL 32 Ca 0.47 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.35 1v5l s VAL 32 Cb -0.09 -2.91 -0.09 0.00 0.56 0.00 0.00 36.38 33.85 1v5l s VAL 32 CO 0.23 -0.00 0.93 -0.63 -0.31 0.00 0.00 175.10 175.31 1v5l s ILE 33 N -2.96 4.13 -0.08 -0.62 1.01 -1.19 0.23 121.20 121.72 1v5l s ILE 33 Ca 0.36 2.00 -0.05 0.00 0.00 0.00 0.00 60.65 62.95 1v5l s ILE 33 Cb 0.09 -4.24 -0.27 0.00 0.01 0.00 0.00 42.46 38.06 1v5l s ILE 33 CO 0.17 0.41 0.53 0.71 0.00 0.00 0.00 174.94 176.76 1v5l h THR 34 N 3.03 0.78 -2.67 2.92 1.35 -1.77 -3.13 112.91 113.42 1v5l h THR 34 Ca -0.46 -2.48 -0.04 0.00 -0.55 0.00 0.00 66.41 62.89 1v5l h THR 34 Cb 1.20 2.59 -0.15 0.00 -1.73 0.00 0.00 68.15 70.06 1v5l h THR 34 CO 0.67 0.84 0.19 -0.60 -0.25 0.00 0.00 175.52 176.36 1v5l s ARG 35 N -2.57 1.19 0.00 4.72 6.06 -1.26 -4.83 118.95 122.26 1v5l s ARG 35 Ca -0.17 -0.22 0.06 0.00 -2.50 0.00 0.00 55.73 52.89 1v5l s ARG 35 Cb 0.06 0.55 -0.02 0.00 0.06 0.00 0.00 34.95 35.61 1v5l s ARG 35 CO 0.81 -0.47 -0.19 0.42 -2.50 0.00 0.00 175.30 173.37 1v5l s ILE 36 N -2.84 1.50 -0.25 4.11 -1.09 -1.26 -2.32 121.20 119.05 1v5l s ILE 36 Ca -0.03 -0.90 -0.29 0.00 -2.23 0.00 0.00 60.65 57.20 1v5l s ILE 36 Cb -0.01 -1.27 0.00 0.00 -1.58 0.00 0.00 42.46 39.61 1v5l s ILE 36 CO -0.05 0.35 1.17 -0.89 -1.23 0.00 0.00 174.94 174.29 1v5l s THR 37 N -0.54 4.41 -0.68 2.92 2.01 -0.96 -4.92 115.64 117.88 1v5l s THR 37 Ca 0.07 1.66 -0.26 0.00 0.31 0.00 0.00 61.69 63.47 1v5l s THR 37 Cb -0.08 -4.22 -0.03 0.00 0.01 0.00 0.00 72.50 68.19 1v5l s THR 37 CO -0.00 -0.31 1.88 -2.16 -0.69 0.00 0.00 174.62 173.34 1v5l s PRO 38 N 3.61 2.60 0.00 4.92 0.04 -1.26 -3.05 135.00 141.87 1v5l s PRO 38 Ca 0.50 0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.95 1v5l s PRO 38 Cb -0.16 -4.54 0.00 0.00 0.04 0.00 0.00 34.50 29.84 1v5l s PRO 38 CO 0.15 -2.88 0.00 0.41 0.04 0.00 0.00 177.00 174.71 1v5l n GLY 39 N 5.96 0.91 1.94 0.56 0.00 -1.26 -5.06 105.19 108.24 1v5l n GLY 39 Ca 0.25 -0.73 -0.05 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.26 -1.15 0.29 1.61 3.41 -1.23 -4.96 113.62 111.33 1v5l n SER 40 Ca 0.00 -1.85 0.19 0.00 -0.26 0.00 0.00 58.87 56.95 1v5l n SER 40 Cb 0.09 1.93 0.98 0.00 -0.26 0.00 0.00 64.21 66.95 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 -1.90 0.24 116.57 120.81 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 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 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 -2.16 0.00 -0.27 3.86 0.00 -1.19 -3.13 120.51 117.62 1v5l n ALA 42 Ca -0.01 -0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.46 1v5l n ALA 42 Cb 0.21 0.00 0.17 0.00 0.00 0.00 0.00 19.45 19.83 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 1.11 0.00 0.00 0.00 -1.51 0.25 119.26 117.10 1v5l h ALA 43 Ca 0.00 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1v5l h ALA 43 Cb 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1v5l h ALA 43 CO 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 179.25 179.18 1v5l h ALA 44 N 1.49 1.06 -0.40 0.00 0.00 -0.71 0.07 119.26 120.77 1v5l h ALA 44 Ca 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1v5l h ALA 44 Cb 0.48 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1v5l h ALA 44 CO -0.31 0.01 0.00 0.00 0.00 0.00 0.00 179.25 178.95 1v5l n ALA 45 N -2.11 2.72 -2.63 0.00 0.00 0.85 -4.88 120.51 114.45 1v5l n ALA 45 Ca -0.02 -0.87 -0.11 0.00 0.00 0.00 0.00 53.44 52.43 1v5l n ALA 45 Cb 0.12 -1.00 0.02 0.00 0.00 0.00 0.00 19.45 18.59 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 0.63 -3.75 -4.85 0.00 3.02 0.01 -5.02 115.26 105.31 1v5l n ASN 46 Ca 0.15 -0.14 -0.38 0.00 -0.03 0.00 0.00 54.58 54.18 1v5l n ASN 46 Cb 0.51 -2.65 -0.06 0.00 -0.61 0.00 0.00 39.78 36.97 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 -3.48 4.46 -0.00 3.41 1.43 -1.03 -5.02 118.68 118.44 1v5l s LEU 47 Ca 0.15 0.86 -0.10 0.00 -1.03 0.00 0.00 54.13 54.02 1v5l s LEU 47 Cb -0.07 -2.48 0.01 0.00 0.03 0.00 0.00 46.19 43.68 1v5l s LEU 47 CO 0.18 0.34 0.19 0.00 0.23 0.00 0.00 176.35 177.30 1v5l s PRO 49 N -1.33 2.58 0.00 0.00 0.04 -1.26 -3.02 135.00 132.01 1v5l s PRO 49 Ca -0.14 0.13 0.00 0.00 0.04 0.00 0.00 61.00 61.03 1v5l s PRO 49 Cb -0.07 -4.75 0.00 0.00 0.04 0.00 0.00 34.50 29.72 1v5l s PRO 49 CO 0.02 -3.08 0.00 0.41 0.04 0.00 0.00 177.00 174.39 1v5l n GLY 50 N 6.32 0.19 3.77 0.56 0.00 -1.18 -4.89 105.19 109.95 1v5l n GLY 50 Ca 0.31 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.93 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 6.54 0.13 1.61 1.01 -1.17 -4.75 116.67 120.05 1v5l s ASP 51 Ca 0.00 2.65 -0.17 0.00 0.71 0.00 0.00 52.55 55.74 1v5l s ASP 51 Cb 0.00 -2.64 -0.07 0.00 1.01 0.00 0.00 42.92 41.22 1v5l s ASP 51 CO 0.00 -0.69 0.58 -0.69 0.21 0.00 0.00 175.17 174.58 1v5l s VAL 52 N -1.21 4.78 -0.77 -1.27 1.01 -1.26 -3.14 120.40 118.54 1v5l s VAL 52 Ca 0.53 1.02 -0.13 0.00 0.00 0.00 0.00 61.98 63.40 1v5l s VAL 52 Cb -0.38 -3.80 0.20 0.00 0.00 0.00 0.00 36.38 32.39 1v5l s VAL 52 CO 0.50 0.34 0.69 -0.63 0.00 0.00 0.00 175.10 176.00 1v5l s ILE 53 N -1.36 5.30 0.11 2.22 -1.09 0.10 -3.69 121.20 122.79 1v5l s ILE 53 Ca 0.36 -2.43 -0.20 0.00 -2.23 0.00 0.00 60.65 56.15 1v5l s ILE 53 Cb -0.17 -4.31 -0.08 0.00 -1.58 0.00 0.00 42.46 36.32 1v5l s ILE 53 CO 0.19 -0.99 1.74 -0.07 -1.23 0.00 0.00 174.94 174.58 1v5l h LEU 54 N 7.80 0.20 -8.14 2.97 3.38 -0.48 -3.43 115.31 117.61 1v5l h LEU 54 Ca 0.05 -0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1v5l h LEU 54 Cb 1.04 -0.05 -0.16 0.00 0.09 0.00 0.00 40.66 41.57 1v5l h LEU 54 CO 0.78 0.18 -0.65 0.00 0.09 0.00 0.00 178.44 178.84 1v5l s ALA 55 N -6.04 0.36 -0.11 1.53 0.00 -1.23 -1.98 121.76 114.30 1v5l s ALA 55 Ca -0.13 -1.02 0.03 0.00 0.00 0.00 0.00 51.96 50.84 1v5l s ALA 55 Cb 0.08 0.26 0.01 0.00 0.00 0.00 0.00 23.12 23.47 1v5l s ALA 55 CO 0.69 -0.34 -0.20 0.42 0.00 0.00 0.00 175.76 176.33 1v5l s ILE 56 N -3.39 1.82 -0.55 0.00 1.01 -0.25 -2.61 121.20 117.22 1v5l s ILE 56 Ca 0.02 -0.86 -0.07 0.00 0.00 0.00 0.00 60.65 59.74 1v5l s ILE 56 Cb 0.04 -1.61 0.07 0.00 0.01 0.00 0.00 42.46 40.97 1v5l s ILE 56 CO -0.08 0.50 0.18 -0.67 0.00 0.00 0.00 174.94 174.87 1v5l n ASP 57 N 3.87 -1.12 -0.30 3.58 -0.08 0.53 0.20 116.55 123.23 1v5l n ASP 57 Ca -0.20 -0.07 0.00 0.00 -1.51 0.00 0.00 54.79 53.01 1v5l n ASP 57 Cb 0.52 -1.05 0.00 0.00 2.34 0.00 0.00 41.12 42.93 1v5l n ASP 57 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1v5l n GLY 58 N -0.62 0.90 2.60 0.27 0.00 -1.25 -4.87 105.19 102.22 1v5l n GLY 58 Ca 0.04 -0.58 -0.27 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.60 0.29 0.15 1.61 0.08 0.54 -5.12 117.98 112.94 1v5l s PHE 59 Ca 0.00 -0.50 -0.32 0.00 0.12 0.00 0.00 56.93 56.23 1v5l s PHE 59 Cb 0.00 -0.77 -0.17 0.00 -0.57 0.00 0.00 43.02 41.50 1v5l s PHE 59 CO 0.00 -0.60 0.80 0.41 -0.10 0.00 0.00 175.22 175.73 1v5l n GLY 60 N 5.25 -0.97 1.83 4.36 0.00 -1.26 -1.09 105.19 113.31 1v5l n GLY 60 Ca -0.07 0.47 -0.12 0.00 0.00 0.00 0.00 46.02 46.31 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 0.63 2.52 0.03 2.61 -2.24 -0.84 -4.23 114.28 112.77 1v5l n THR 61 Ca 0.17 -1.34 -0.22 0.00 -2.27 0.00 0.00 64.05 60.39 1v5l n THR 61 Cb 0.21 -0.53 -0.14 0.00 -2.10 0.00 0.00 70.33 67.77 1v5l n THR 61 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1v5l h GLU 62 N 1.36 0.31 -0.47 -0.78 4.57 -1.88 -3.37 114.58 114.33 1v5l h GLU 62 Ca 0.35 -0.53 0.00 0.00 -1.18 0.00 0.00 59.36 58.00 1v5l h GLU 62 Cb 2.21 0.20 0.00 0.00 -0.16 0.00 0.00 28.75 31.00 1v5l h GLU 62 CO 0.71 1.24 0.00 0.43 -1.18 0.00 0.00 179.01 180.22 1v5l n SER 63 N -3.52 3.79 -4.31 1.04 7.64 -1.26 -4.90 113.62 112.11 1v5l n SER 63 Ca -0.29 -2.33 -0.36 0.00 1.01 0.00 0.00 58.87 56.90 1v5l n SER 63 Cb 1.06 -0.43 -0.13 0.00 -1.01 0.00 0.00 64.21 63.70 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 -1.60 3.02 0.75 1.43 -2.45 -1.26 -5.10 119.30 114.09 1v5l s MET 64 Ca 0.38 -0.89 -0.11 0.00 -1.25 0.00 0.00 55.69 53.82 1v5l s MET 64 Cb 0.24 -3.27 0.05 0.00 1.25 0.00 0.00 34.83 33.10 1v5l s MET 64 CO 0.19 -0.44 1.13 0.95 1.05 0.00 0.00 175.02 177.91 1v5l s THR 65 N 1.45 2.70 0.16 10.11 -4.23 -1.26 -4.22 115.64 120.35 1v5l s THR 65 Ca 0.02 0.19 -0.23 0.00 -1.18 0.00 0.00 61.69 60.49 1v5l s THR 65 Cb -0.17 -3.22 0.04 0.00 1.34 0.00 0.00 72.50 70.49 1v5l s THR 65 CO 0.01 -0.28 1.61 -0.74 -0.54 0.00 0.00 174.62 174.67 1v5l h HIS 66 N -0.84 -0.85 -0.97 3.99 2.76 -1.89 0.72 115.15 118.08 1v5l h HIS 66 Ca -0.45 0.05 0.18 0.00 -2.20 0.00 0.00 60.37 57.95 1v5l h HIS 66 Cb 1.29 0.42 -0.09 0.00 1.55 0.00 0.00 27.41 30.59 1v5l h HIS 66 CO 0.40 -0.37 0.61 0.00 -1.30 0.00 0.00 177.93 177.26 1v5l h ALA 67 N 0.72 1.83 -0.06 5.26 0.00 -1.93 -1.32 119.26 123.76 1v5l h ALA 67 Ca 0.16 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1v5l h ALA 67 Cb 0.53 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1v5l h ALA 67 CO -0.48 -0.15 0.01 -0.44 0.00 0.00 0.00 179.25 178.18 1v5l h ASP 68 N 0.68 0.10 -0.84 0.00 3.32 -1.27 -2.87 116.42 115.54 1v5l h ASP 68 Ca 0.53 -0.28 0.19 0.00 0.02 0.00 0.00 57.03 57.48 1v5l h ASP 68 Cb 0.91 -0.03 -0.06 0.00 0.22 0.00 0.00 39.33 40.38 1v5l h ASP 68 CO -0.29 0.36 0.57 0.00 -1.72 0.00 0.00 179.24 178.15 1v5l h ALA 69 N 0.75 2.25 0.00 3.45 0.00 -0.04 0.38 119.26 126.05 1v5l h ALA 69 Ca 0.02 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 1v5l h ALA 69 Cb 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1v5l h ALA 69 CO 0.00 -0.51 -0.30 1.96 0.00 0.00 0.00 179.25 180.41 1v5l h GLN 70 N 0.35 0.00 0.00 0.00 1.08 -1.20 0.02 115.11 115.35 1v5l h GLN 70 Ca 0.43 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.63 1v5l h GLN 70 Cb 1.12 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.55 1v5l h GLN 70 CO -0.14 0.30 -0.79 -3.47 -0.95 0.00 0.00 178.83 173.78 1v5l n ASP 71 N -3.98 0.65 -0.04 1.46 2.03 0.11 -3.28 116.55 113.50 1v5l n ASP 71 Ca -0.02 -0.35 -0.12 0.00 0.52 0.00 0.00 54.79 54.82 1v5l n ASP 71 Cb 0.36 0.58 -0.14 0.00 -0.72 0.00 0.00 41.12 41.19 1v5l n ASP 71 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1v5l n ARG 72 N -1.70 0.67 0.05 -0.67 5.12 -0.09 -3.05 116.66 116.99 1v5l n ARG 72 Ca 0.04 0.22 -0.20 0.00 -1.93 0.00 0.00 57.85 55.97 1v5l n ARG 72 Cb 0.38 -1.70 -0.14 0.00 -1.16 0.00 0.00 32.46 29.83 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 1.50 -0.19 0.55 2.04 -1.16 -2.08 117.51 118.18 1v5l h ILE 73 Ca -0.39 -2.50 -0.16 0.00 1.00 0.00 0.00 64.86 62.81 1v5l h ILE 73 Cb 2.06 3.14 -0.01 0.00 -0.74 0.00 0.00 36.82 41.28 1v5l h ILE 73 CO 0.06 0.71 -0.55 0.07 0.00 0.00 0.00 178.15 178.44 1v5l h LYS 74 N -0.33 0.57 -0.62 2.37 2.10 -1.75 -2.91 116.57 115.99 1v5l h LYS 74 Ca -0.14 -0.36 0.00 0.00 -2.00 0.00 0.00 60.65 58.15 1v5l h LYS 74 Cb 1.63 0.04 0.00 0.00 -0.90 0.00 0.00 32.23 33.00 1v5l h LYS 74 CO 0.15 0.97 0.00 0.00 -2.00 0.00 0.00 179.45 178.57 1v5l n ALA 75 N -2.52 3.00 -0.90 0.07 0.00 -1.17 -4.85 120.51 114.13 1v5l n ALA 75 Ca -0.03 -1.21 -0.10 0.00 0.00 0.00 0.00 53.44 52.10 1v5l n ALA 75 Cb 0.60 -1.03 0.13 0.00 0.00 0.00 0.00 19.45 19.16 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 0.79 -2.03 -2.01 0.00 0.00 -0.78 -4.95 120.51 111.52 1v5l n ALA 76 Ca 0.20 -0.81 -0.21 0.00 0.00 0.00 0.00 53.44 52.62 1v5l n ALA 76 Cb 0.72 -0.06 0.08 0.00 0.00 0.00 0.00 19.45 20.19 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 -2.85 4.80 0.64 0.00 0.01 -1.26 -4.93 113.70 110.11 1v5l s SER 77 Ca 0.35 -0.57 0.21 0.00 1.31 0.00 0.00 55.95 57.25 1v5l s SER 77 Cb -0.04 0.04 1.01 0.00 0.21 0.00 0.00 66.02 67.24 1v5l s SER 77 CO 0.28 -1.53 1.55 0.10 0.41 0.00 0.00 173.24 174.04 1v5l h TYR 78 N -0.11 0.00 -3.73 2.43 -0.00 -1.97 -3.37 116.97 110.22 1v5l h TYR 78 Ca -0.34 0.00 -0.42 0.00 0.00 0.00 0.00 58.73 57.97 1v5l h TYR 78 Cb 1.28 0.00 -0.31 0.00 0.00 0.00 0.00 36.73 37.69 1v5l h TYR 78 CO 0.14 0.00 -0.78 1.14 -0.00 0.00 0.00 178.16 178.66 1v5l s GLN 79 N -4.24 0.92 -0.26 0.10 1.03 -1.26 0.13 119.66 116.07 1v5l s GLN 79 Ca -0.02 -0.25 -0.06 0.00 0.04 0.00 0.00 55.36 55.06 1v5l s GLN 79 Cb 0.09 -0.86 -0.01 0.00 0.03 0.00 0.00 33.01 32.26 1v5l s GLN 79 CO 0.29 0.07 0.05 -1.17 -2.54 0.00 0.00 175.29 171.99 1v5l s LEU 80 N 0.34 3.49 -0.29 2.60 2.96 -0.94 -4.97 118.68 121.87 1v5l s LEU 80 Ca -0.05 -0.44 -0.09 0.00 -0.22 0.00 0.00 54.13 53.32 1v5l s LEU 80 Cb -0.10 -1.87 -0.02 0.00 0.50 0.00 0.00 46.19 44.70 1v5l s LEU 80 CO 0.01 -0.09 0.14 0.00 -1.32 0.00 0.00 176.35 175.08 1v5l s LEU 82 N 1.65 1.78 -0.30 0.00 1.43 -0.60 0.20 118.68 122.83 1v5l s LEU 82 Ca 0.06 -0.43 -0.16 0.00 -1.03 0.00 0.00 54.13 52.56 1v5l s LEU 82 Cb -0.16 -1.10 -0.02 0.00 0.03 0.00 0.00 46.19 44.93 1v5l s LEU 82 CO 0.07 0.04 0.42 -0.75 0.23 0.00 0.00 176.35 176.36 1v5l s LYS 83 N 0.84 3.85 0.02 1.70 2.20 -1.07 -2.49 119.74 124.80 1v5l s LYS 83 Ca -0.10 -0.05 -0.01 0.00 -0.36 0.00 0.00 55.97 55.45 1v5l s LYS 83 Cb -0.15 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.41 1v5l s LYS 83 CO 0.01 -0.41 0.19 0.96 -0.36 0.00 0.00 175.35 175.73 1v5l s ILE 84 N 2.16 5.35 -0.18 5.43 -4.36 -0.68 0.29 121.20 129.21 1v5l s ILE 84 Ca 0.16 -0.29 0.01 0.00 -0.26 0.00 0.00 60.65 60.27 1v5l s ILE 84 Cb -0.16 -3.55 0.21 0.00 1.25 0.00 0.00 42.46 40.22 1v5l s ILE 84 CO 0.11 0.24 1.51 -0.67 0.24 0.00 0.00 174.94 176.37 1v5l n ASP 85 N 0.66 4.06 -2.48 4.36 -0.08 -1.24 -2.61 116.55 119.23 1v5l n ASP 85 Ca -0.08 -2.65 -0.08 0.00 -1.51 0.00 0.00 54.79 50.47 1v5l n ASP 85 Cb 0.52 -0.74 -0.01 0.00 2.34 0.00 0.00 41.12 43.22 1v5l n ASP 85 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 1v5l n ARG 86 N 0.13 -2.11 -3.35 -0.67 0.63 -1.26 -4.80 116.66 105.23 1v5l n ARG 86 Ca 0.21 0.03 -0.46 0.00 -0.92 0.00 0.00 57.85 56.71 1v5l n ARG 86 Cb 0.81 -3.51 -0.04 0.00 0.45 0.00 0.00 32.46 30.17 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 -1.83 3.81 -0.09 5.13 0.00 -1.26 -4.88 121.76 122.64 1v5l s ALA 87 Ca 0.16 -2.88 -0.16 0.00 0.00 0.00 0.00 51.96 49.07 1v5l s ALA 87 Cb -0.09 -3.32 -0.28 0.00 0.00 0.00 0.00 23.12 19.43 1v5l s ALA 87 CO 0.19 -2.12 0.60 1.05 0.00 0.00 0.00 175.76 175.48 1v5l h GLU 88 N 8.35 0.26 0.00 0.00 4.11 -1.89 -3.35 114.58 122.06 1v5l h GLU 88 Ca -0.12 -0.45 0.00 0.00 0.07 0.00 0.00 59.36 58.86 1v5l h GLU 88 Cb 1.07 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.49 1v5l h GLU 88 CO 0.90 1.22 -0.38 1.79 0.07 0.00 0.00 179.01 182.61 1v5l h THR 89 N -0.27 0.00 -6.24 -1.06 1.35 -1.94 -3.47 112.91 101.29 1v5l h THR 89 Ca -0.29 -0.60 -0.44 0.00 -0.55 0.00 0.00 66.41 64.53 1v5l h THR 89 Cb 1.78 1.36 -0.20 0.00 -1.73 0.00 0.00 68.15 69.36 1v5l h THR 89 CO 0.08 0.00 -0.66 0.54 -0.25 0.00 0.00 175.52 175.23 1v5l n ARG 90 N -2.33 -0.89 -0.00 4.72 1.74 -1.26 -4.76 116.66 113.88 1v5l n ARG 90 Ca 0.04 0.08 -0.01 0.00 -0.77 0.00 0.00 57.85 57.19 1v5l n ARG 90 Cb 0.46 -2.85 -0.00 0.00 -1.02 0.00 0.00 32.46 29.05 1v5l n ARG 90 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1v5l n LEU 91 N -3.28 0.28 -4.44 0.55 7.94 -1.26 -5.00 117.00 111.78 1v5l n LEU 91 Ca -0.09 0.04 -0.37 0.00 -1.11 0.00 0.00 56.01 54.48 1v5l n LEU 91 Cb 0.41 -0.26 -0.12 0.00 0.53 0.00 0.00 43.42 43.98 1v5l n LEU 91 CO 0.63 -0.51 -0.26 0.26 -1.11 0.00 0.00 177.39 176.40 1v5l s TRP 92 N -1.26 3.12 -0.71 1.96 0.51 -1.26 -5.03 118.94 116.27 1v5l s TRP 92 Ca -0.02 -0.47 0.05 0.00 -2.12 0.00 0.00 56.10 53.54 1v5l s TRP 92 Cb 0.00 -2.27 0.22 0.00 -0.81 0.00 0.00 33.47 30.61 1v5l s TRP 92 CO 0.03 -0.38 0.69 0.43 -0.51 0.00 0.00 176.95 177.21 1v5l n SER 93 N 4.94 3.64 -0.09 2.95 7.64 -1.26 -4.90 113.62 126.54 1v5l n SER 93 Ca -0.15 -3.33 -0.13 0.00 1.01 0.00 0.00 58.87 56.26 1v5l n SER 93 Cb 0.51 -0.76 -0.04 0.00 -1.01 0.00 0.00 64.21 62.90 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 4.84 0.69 -1.39 1.43 0.13 -2.05 -3.45 132.00 132.19 1v5l h PRO 94 Ca 0.18 -0.36 0.13 0.00 -0.87 0.00 0.00 66.00 65.08 1v5l h PRO 94 Cb 0.70 0.01 -0.22 0.00 0.13 0.00 0.00 31.00 31.63 1v5l h PRO 94 CO 0.82 0.97 0.05 1.14 -0.23 0.00 0.00 178.00 180.75 1v5l s GLN 95 N -4.36 0.42 0.35 0.86 -2.07 -1.26 -5.18 119.66 108.41 1v5l s GLN 95 Ca -0.12 1.03 -0.03 0.00 -1.82 0.00 0.00 55.36 54.42 1v5l s GLN 95 Cb 0.09 0.62 0.00 0.00 -1.09 0.00 0.00 33.01 32.63 1v5l s GLN 95 CO 0.83 -0.17 0.49 0.14 -1.32 0.00 0.00 175.29 175.25 1v5l s VAL 96 N 2.67 0.00 0.14 3.63 -7.23 -1.26 -5.09 120.40 113.25 1v5l s VAL 96 Ca -0.03 -1.58 -0.34 0.00 -1.81 0.00 0.00 61.98 58.22 1v5l s VAL 96 Cb -0.09 -2.65 -0.14 0.00 0.56 0.00 0.00 36.38 34.06 1v5l s VAL 96 CO -0.18 0.00 1.54 -0.24 -0.31 0.00 0.00 175.10 175.91 1v5l n SER 97 N -1.43 2.82 -4.82 4.85 2.88 -1.26 -4.97 113.62 111.69 1v5l n SER 97 Ca 0.01 1.09 -0.28 0.00 -1.33 0.00 0.00 58.87 58.35 1v5l n SER 97 Cb 0.61 -1.38 -0.05 0.00 -0.75 0.00 0.00 64.21 62.64 1v5l n SER 97 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v5l s SER 98 N 0.93 5.70 0.65 -3.46 0.15 -1.26 -4.98 113.70 111.43 1v5l s SER 98 Ca 0.80 -0.02 -0.11 0.00 0.70 0.00 0.00 55.95 57.33 1v5l s SER 98 Cb -0.73 -1.56 -0.02 0.00 -1.71 0.00 0.00 66.02 62.00 1v5l s SER 98 CO 0.40 0.11 1.05 -0.83 1.20 0.00 0.00 173.24 175.17 1v5l s GLY 99 N -2.82 1.65 0.23 9.45 0.00 -1.26 -4.98 107.32 109.59 1v5l s GLY 99 Ca 0.31 -0.11 -0.00 0.00 0.00 0.00 0.00 44.72 44.92 1v5l s GLY 99 CO 0.24 0.19 1.59 -0.56 0.00 0.00 0.00 173.10 174.57 1v5l h PRO 100 N -0.47 0.51 -0.69 2.90 0.13 -1.99 -3.18 132.00 129.21 1v5l h PRO 100 Ca -0.44 -0.27 0.12 0.00 -0.87 0.00 0.00 66.00 64.55 1v5l h PRO 100 Cb 1.21 0.01 -0.09 0.00 0.13 0.00 0.00 31.00 32.26 1v5l h PRO 100 CO 0.61 0.84 0.24 1.03 -0.23 0.00 0.00 178.00 180.50 1v5l h SER 101 N 0.41 0.20 -2.97 1.44 0.87 -2.02 -3.39 113.55 108.09 1v5l h SER 101 Ca 0.03 0.10 -0.53 0.00 -1.23 0.00 0.00 61.79 60.16 1v5l h SER 101 Cb 0.92 0.10 0.02 0.00 -0.44 0.00 0.00 62.40 63.00 1v5l h SER 101 CO 0.08 0.09 0.76 -0.94 -0.53 0.00 0.00 176.83 176.29 1v5l s SER 102 N -5.34 6.81 0.00 6.23 1.04 -1.20 -5.25 113.70 115.98 1v5l s SER 102 Ca -0.13 2.31 0.00 0.00 0.48 0.00 0.00 55.95 58.62 1v5l s SER 102 Cb 0.19 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.73 1v5l s SER 102 CO 0.75 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 174.90