#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5l n SER 2 N 0.00 -2.67 -0.10 1.61 3.41 -1.26 -4.88 113.62 109.73 1v5l n SER 2 Ca 0.00 -0.38 -0.10 0.00 -0.26 0.00 0.00 58.87 58.13 1v5l n SER 2 Cb 0.00 -1.08 -0.04 0.00 -0.26 0.00 0.00 64.21 62.83 1v5l n SER 2 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1v5l h SER 3 N -2.84 -1.30 -3.98 4.04 0.02 -1.97 -3.41 113.55 104.11 1v5l h SER 3 Ca -0.53 0.20 -0.48 0.00 -0.84 0.00 0.00 61.79 60.15 1v5l h SER 3 Cb 1.29 0.57 0.01 0.00 0.14 0.00 0.00 62.40 64.42 1v5l h SER 3 CO 0.38 -0.37 0.40 -0.83 -1.14 0.00 0.00 176.83 175.27 1v5l s GLY 4 N -2.72 2.68 -1.09 -3.77 0.00 -1.25 -4.96 107.32 96.21 1v5l s GLY 4 Ca -0.15 0.65 -0.07 0.00 0.00 0.00 0.00 44.72 45.14 1v5l s GLY 4 CO 0.66 1.05 1.14 -1.26 0.00 0.00 0.00 173.10 174.68 1v5l n SER 5 N -0.18 5.51 -4.50 1.64 2.88 -1.22 -4.59 113.62 113.17 1v5l n SER 5 Ca 0.05 -3.11 -0.42 0.00 -1.33 0.00 0.00 58.87 54.07 1v5l n SER 5 Cb 0.50 -1.32 -0.03 0.00 -0.75 0.00 0.00 64.21 62.61 1v5l n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v5l s SER 6 N 0.67 6.20 -0.56 -3.46 0.15 -1.20 -3.95 113.70 111.55 1v5l s SER 6 Ca 0.31 -0.82 -0.13 0.00 0.70 0.00 0.00 55.95 56.01 1v5l s SER 6 Cb -0.07 -2.48 0.14 0.00 -1.71 0.00 0.00 66.02 61.89 1v5l s SER 6 CO -0.06 -1.60 0.48 -0.83 1.20 0.00 0.00 173.24 172.43 1v5l s GLY 7 N 3.76 2.16 0.46 9.45 0.00 -0.04 -4.97 107.32 118.14 1v5l s GLY 7 Ca 0.29 -2.67 -0.21 0.00 0.00 0.00 0.00 44.72 42.12 1v5l s GLY 7 CO 0.11 1.17 1.06 0.54 0.00 0.00 0.00 173.10 175.98 1v5l s ASN 8 N 2.96 6.38 -0.21 1.64 4.22 -1.26 -0.64 114.94 128.04 1v5l s ASN 8 Ca 0.07 2.02 -0.04 0.00 -2.14 0.00 0.00 52.86 52.77 1v5l s ASN 8 Cb -0.26 -2.57 0.10 0.00 1.28 0.00 0.00 41.25 39.80 1v5l s ASN 8 CO -0.00 -0.75 0.26 -0.69 -2.04 0.00 0.00 177.10 173.87 1v5l s VAL 9 N -1.83 -0.40 -0.33 3.54 1.01 -0.97 -4.90 120.40 116.53 1v5l s VAL 9 Ca 0.65 -0.07 -0.00 0.00 0.00 0.00 0.00 61.98 62.56 1v5l s VAL 9 Cb -0.20 -0.69 0.08 0.00 0.00 0.00 0.00 36.38 35.57 1v5l s VAL 9 CO 0.24 -0.16 0.04 -0.69 0.00 0.00 0.00 175.10 174.54 1v5l s VAL 10 N 2.39 2.78 -0.04 2.92 1.01 -1.26 -1.12 120.40 127.08 1v5l s VAL 10 Ca 0.08 -1.79 -0.13 0.00 0.00 0.00 0.00 61.98 60.14 1v5l s VAL 10 Cb -0.15 -2.77 -0.05 0.00 0.00 0.00 0.00 36.38 33.40 1v5l s VAL 10 CO -0.13 -0.34 0.33 -0.76 0.00 0.00 0.00 175.10 174.20 1v5l s LEU 11 N 1.13 4.45 0.15 3.92 1.43 -0.37 -4.91 118.68 124.47 1v5l s LEU 11 Ca 0.01 0.82 -0.31 0.00 -1.03 0.00 0.00 54.13 53.62 1v5l s LEU 11 Cb -0.20 -2.44 -0.08 0.00 0.03 0.00 0.00 46.19 43.50 1v5l s LEU 11 CO -0.04 0.35 1.33 -2.16 0.23 0.00 0.00 176.35 176.06 1v5l s PRO 12 N -1.04 4.36 0.00 1.29 0.04 -1.26 -0.69 135.00 137.70 1v5l s PRO 12 Ca 0.21 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.29 1v5l s PRO 12 Cb -0.15 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.16 1v5l s PRO 12 CO 0.11 -0.33 0.00 0.41 0.04 0.00 0.00 177.00 177.23 1v5l n GLY 13 N 2.89 6.35 1.90 0.56 0.00 0.57 -4.82 105.19 112.63 1v5l n GLY 13 Ca 0.09 -1.89 -0.16 0.00 0.00 0.00 0.00 46.02 44.05 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 -2.17 -0.67 1.61 -0.04 -1.20 -4.75 135.00 127.77 1v5l n PRO 14 Ca 0.00 -0.95 -0.31 0.00 -0.04 0.00 0.00 63.50 62.20 1v5l n PRO 14 Cb 0.00 -0.89 0.17 0.00 -0.04 0.00 0.00 33.50 32.75 1v5l n PRO 14 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1v5l n ALA 15 N -4.01 -2.71 -1.22 0.55 0.00 -1.26 -4.70 120.51 107.16 1v5l n ALA 15 Ca -0.11 -0.90 -0.30 0.00 0.00 0.00 0.00 53.44 52.13 1v5l n ALA 15 Cb 0.32 -1.85 0.13 0.00 0.00 0.00 0.00 19.45 18.04 1v5l n ALA 15 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1v5l s PRO 16 N -3.95 1.53 -0.27 0.00 0.04 -1.26 -5.14 135.00 125.95 1v5l s PRO 16 Ca 0.61 0.92 -0.08 0.00 0.04 0.00 0.00 61.00 62.49 1v5l s PRO 16 Cb -0.20 -1.83 -0.14 0.00 0.04 0.00 0.00 34.50 32.36 1v5l s PRO 16 CO 0.65 -2.08 -0.28 0.91 0.04 0.00 0.00 177.00 176.24 1v5l n TRP 17 N -3.79 0.06 0.00 0.56 7.02 -1.26 -4.91 117.44 115.13 1v5l n TRP 17 Ca 0.08 0.02 0.00 0.00 -1.02 0.00 0.00 57.50 56.58 1v5l n TRP 17 Cb 0.55 -1.01 0.00 0.00 -2.42 0.00 0.00 31.31 28.43 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 1.66 1.52 3.91 6.99 0.00 -1.26 -3.04 105.19 114.97 1v5l n GLY 18 Ca -0.50 0.00 -0.20 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 -2.02 2.99 0.43 1.61 -0.71 -1.26 -0.82 117.98 118.20 1v5l s PHE 19 Ca 0.00 -0.27 0.04 0.00 -1.04 0.00 0.00 56.93 55.66 1v5l s PHE 19 Cb 0.00 -1.87 -0.04 0.00 -1.21 0.00 0.00 43.02 39.90 1v5l s PHE 19 CO 0.00 0.11 0.04 1.03 -1.34 0.00 0.00 175.22 175.07 1v5l s ARG 20 N -4.06 1.98 0.04 1.99 1.81 -0.96 -4.97 118.95 114.78 1v5l s ARG 20 Ca 0.42 -2.20 0.03 0.00 -1.72 0.00 0.00 55.73 52.26 1v5l s ARG 20 Cb -0.07 -1.22 -0.02 0.00 -0.45 0.00 0.00 34.95 33.19 1v5l s ARG 20 CO 0.28 -0.29 -0.10 -0.48 -0.68 0.00 0.00 175.30 174.04 1v5l s LEU 21 N -3.71 2.21 -0.19 2.53 0.05 -1.26 -3.34 118.68 114.98 1v5l s LEU 21 Ca 0.22 -0.48 -0.12 0.00 0.05 0.00 0.00 54.13 53.79 1v5l s LEU 21 Cb 0.05 -0.31 0.06 0.00 -2.05 0.00 0.00 46.19 43.93 1v5l s LEU 21 CO 0.11 -0.10 0.47 -0.44 -0.55 0.00 0.00 176.35 175.84 1v5l s SER 22 N -1.32 -0.57 0.00 1.48 0.01 0.30 -4.51 113.70 109.09 1v5l s SER 22 Ca -0.05 0.99 0.00 0.00 1.31 0.00 0.00 55.95 58.20 1v5l s SER 22 Cb -0.08 0.91 0.00 0.00 0.21 0.00 0.00 66.02 67.06 1v5l s SER 22 CO 0.01 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.08 1v5l n GLY 23 N 3.82 0.38 0.00 3.44 0.00 -1.26 -0.64 105.19 110.93 1v5l n GLY 23 Ca -0.20 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.70 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 3.76 0.36 -0.02 0.00 0.12 -4.50 105.19 104.91 1v5l n GLY 24 Ca 0.00 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.71 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 0.05 0.14 -0.61 3.07 -1.71 0.93 117.51 119.38 1v5l h ILE 25 Ca 0.00 0.00 -0.30 0.00 1.55 0.00 0.00 64.86 66.11 1v5l h ILE 25 Cb 0.00 0.38 0.00 0.00 -0.27 0.00 0.00 36.82 36.93 1v5l h ILE 25 CO 0.00 0.00 -1.42 -0.78 -1.05 0.00 0.00 178.15 174.90 1v5l h ASP 26 N 0.00 0.48 -0.22 2.16 3.58 -1.88 -3.25 116.42 117.29 1v5l h ASP 26 Ca 0.07 -0.58 0.00 0.00 0.42 0.00 0.00 57.03 56.95 1v5l h ASP 26 Cb 1.39 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 42.28 1v5l h ASP 26 CO -0.00 1.46 0.00 0.49 -2.88 0.00 0.00 179.24 178.31 1v5l n PHE 27 N -3.53 0.33 -3.56 0.28 3.72 0.32 -4.88 117.46 110.14 1v5l n PHE 27 Ca -0.14 -0.15 -0.24 0.00 -0.05 0.00 0.00 57.45 56.87 1v5l n PHE 27 Cb 1.05 -0.02 0.08 0.00 -0.94 0.00 0.00 39.48 39.64 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 0.15 -6.38 -3.79 4.37 4.13 -0.86 -4.89 115.26 107.99 1v5l n ASN 28 Ca 0.07 -0.52 -0.13 0.00 1.68 0.00 0.00 54.58 55.69 1v5l n ASN 28 Cb 0.22 -5.02 -0.11 0.00 -1.54 0.00 0.00 39.78 33.33 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 -6.28 0.33 0.34 3.52 -0.21 -1.08 -5.00 119.66 111.28 1v5l s GLN 29 Ca 0.57 0.25 -0.28 0.00 0.02 0.00 0.00 55.36 55.92 1v5l s GLN 29 Cb -0.25 0.16 -0.10 0.00 1.00 0.00 0.00 33.01 33.82 1v5l s GLN 29 CO 0.70 -0.05 1.22 -1.25 -2.12 0.00 0.00 175.29 173.79 1v5l s PRO 30 N -0.09 4.35 -0.67 2.91 0.04 -1.26 0.12 135.00 140.40 1v5l s PRO 30 Ca -0.02 2.01 -0.26 0.00 0.04 0.00 0.00 61.00 62.77 1v5l s PRO 30 Cb -0.02 -3.00 -0.04 0.00 0.04 0.00 0.00 34.50 31.48 1v5l s PRO 30 CO 0.01 -0.11 1.96 -0.51 0.04 0.00 0.00 177.00 178.38 1v5l s LEU 31 N -1.88 3.26 0.45 -3.56 1.43 -1.26 -4.38 118.68 112.74 1v5l s LEU 31 Ca 0.50 0.19 0.06 0.00 -1.03 0.00 0.00 54.13 53.85 1v5l s LEU 31 Cb -0.35 -2.53 -0.04 0.00 0.03 0.00 0.00 46.19 43.30 1v5l s LEU 31 CO 0.46 -2.57 0.17 0.68 0.23 0.00 0.00 176.35 175.32 1v5l s VAL 32 N 9.85 2.01 0.11 -1.59 -7.23 0.18 0.21 120.40 123.95 1v5l s VAL 32 Ca 0.72 -1.74 -0.26 0.00 -1.81 0.00 0.00 61.98 58.89 1v5l s VAL 32 Cb -0.12 -2.75 -0.07 0.00 0.56 0.00 0.00 36.38 34.01 1v5l s VAL 32 CO 0.16 0.00 0.82 -0.63 -0.31 0.00 0.00 175.10 175.14 1v5l s ILE 33 N -2.68 4.51 -0.12 -0.62 1.01 -1.21 0.11 121.20 122.21 1v5l s ILE 33 Ca 0.34 1.77 -0.15 0.00 0.00 0.00 0.00 60.65 62.61 1v5l s ILE 33 Cb 0.03 -4.18 -0.26 0.00 0.01 0.00 0.00 42.46 38.07 1v5l s ILE 33 CO 0.19 0.42 0.49 0.71 0.00 0.00 0.00 174.94 176.75 1v5l h THR 34 N 3.76 0.95 -3.43 2.92 1.35 -1.78 -3.21 112.91 113.47 1v5l h THR 34 Ca -0.45 -2.36 -0.05 0.00 -0.55 0.00 0.00 66.41 63.00 1v5l h THR 34 Cb 1.21 2.62 -0.12 0.00 -1.73 0.00 0.00 68.15 70.13 1v5l h THR 34 CO 0.69 0.69 -0.07 -0.13 -0.25 0.00 0.00 175.52 176.45 1v5l s ARG 35 N -2.47 1.19 -0.06 4.72 1.81 -1.26 -4.82 118.95 118.05 1v5l s ARG 35 Ca -0.21 -0.83 0.03 0.00 -1.72 0.00 0.00 55.73 53.00 1v5l s ARG 35 Cb 0.05 0.47 0.01 0.00 -0.45 0.00 0.00 34.95 35.03 1v5l s ARG 35 CO 0.74 -0.48 -0.15 0.42 -0.68 0.00 0.00 175.30 175.16 1v5l s ILE 36 N -3.85 1.28 0.20 1.52 -1.09 -1.26 -2.26 121.20 115.74 1v5l s ILE 36 Ca 0.07 -0.59 -0.31 0.00 -2.23 0.00 0.00 60.65 57.59 1v5l s ILE 36 Cb 0.01 -1.13 -0.11 0.00 -1.58 0.00 0.00 42.46 39.65 1v5l s ILE 36 CO -0.07 0.38 1.61 -0.89 -1.23 0.00 0.00 174.94 174.74 1v5l s THR 37 N 0.40 2.34 0.08 2.92 2.01 -0.00 -4.88 115.64 118.52 1v5l s THR 37 Ca -0.11 0.26 -0.31 0.00 0.31 0.00 0.00 61.69 61.84 1v5l s THR 37 Cb -0.14 -3.16 -0.07 0.00 0.01 0.00 0.00 72.50 69.13 1v5l s THR 37 CO 0.03 0.02 1.38 -2.16 -0.69 0.00 0.00 174.62 173.21 1v5l s PRO 38 N 0.79 4.32 -0.77 4.92 0.04 -1.26 -3.02 135.00 140.02 1v5l s PRO 38 Ca 0.70 2.03 -0.05 0.00 0.04 0.00 0.00 61.00 63.72 1v5l s PRO 38 Cb -0.46 -3.33 0.01 0.00 0.04 0.00 0.00 34.50 30.75 1v5l s PRO 38 CO 0.35 -0.46 0.62 0.41 0.04 0.00 0.00 177.00 177.96 1v5l n GLY 39 N 3.51 -1.14 1.88 0.56 0.00 -1.26 -4.97 105.19 103.76 1v5l n GLY 39 Ca 0.12 0.66 -0.05 0.00 0.00 0.00 0.00 46.02 46.75 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 -2.20 -1.09 0.17 1.61 3.41 -1.25 -4.97 113.62 109.29 1v5l n SER 40 Ca -0.24 -1.83 0.18 0.00 -0.26 0.00 0.00 58.87 56.71 1v5l n SER 40 Cb 0.66 1.84 0.80 0.00 -0.26 0.00 0.00 64.21 67.26 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 0.49 116.57 121.06 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 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1v5l h LYS 41 CO 0.21 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 179.09 1v5l n ALA 42 N -2.36 -0.12 -0.37 3.86 0.00 -1.17 -3.04 120.51 117.31 1v5l n ALA 42 Ca 0.03 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.49 1v5l n ALA 42 Cb 0.39 0.00 0.18 0.00 0.00 0.00 0.00 19.45 20.01 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 1.40 0.00 0.00 0.00 -1.45 0.44 119.26 117.65 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 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.48 1v5l h ALA 43 CO 0.00 0.45 0.00 0.00 0.00 0.00 0.00 179.25 179.70 1v5l h ALA 44 N 1.46 1.00 -0.52 0.00 0.00 -0.17 0.27 119.26 121.30 1v5l h ALA 44 Ca 0.43 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.27 1v5l h ALA 44 Cb 0.15 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1v5l h ALA 44 CO -0.17 0.00 0.08 0.00 0.00 0.00 0.00 179.25 179.17 1v5l n ALA 45 N -1.90 3.85 -2.97 0.00 0.00 0.14 -4.88 120.51 114.74 1v5l n ALA 45 Ca -0.02 -1.68 -0.21 0.00 0.00 0.00 0.00 53.44 51.53 1v5l n ALA 45 Cb 0.05 -1.14 0.03 0.00 0.00 0.00 0.00 19.45 18.39 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 0.30 -5.77 -4.83 0.00 3.02 0.08 -4.95 115.26 103.12 1v5l n ASN 46 Ca 0.27 -0.27 -0.36 0.00 -0.03 0.00 0.00 54.58 54.18 1v5l n ASN 46 Cb 1.09 -4.59 -0.06 0.00 -0.61 0.00 0.00 39.78 35.62 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 -6.16 4.38 -0.13 3.41 1.43 -1.19 -5.05 118.68 115.37 1v5l s LEU 47 Ca 0.29 1.21 -0.13 0.00 -1.03 0.00 0.00 54.13 54.46 1v5l s LEU 47 Cb -0.13 -3.28 0.04 0.00 0.03 0.00 0.00 46.19 42.85 1v5l s LEU 47 CO 0.36 0.12 0.37 0.00 0.23 0.00 0.00 176.35 177.43 1v5l s PRO 49 N 0.05 2.61 0.00 0.00 0.04 -1.26 -3.23 135.00 133.21 1v5l s PRO 49 Ca -0.01 0.45 0.00 0.00 0.04 0.00 0.00 61.00 61.48 1v5l s PRO 49 Cb -0.03 -4.51 0.00 0.00 0.04 0.00 0.00 34.50 30.00 1v5l s PRO 49 CO 0.01 -2.86 0.00 0.41 0.04 0.00 0.00 177.00 174.60 1v5l n GLY 50 N 5.91 0.07 3.76 0.56 0.00 -1.21 -4.93 105.19 109.35 1v5l n GLY 50 Ca 0.24 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 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 4.96 -0.37 1.61 1.01 -1.20 -4.83 116.67 117.85 1v5l s ASP 51 Ca 0.00 2.12 -0.10 0.00 0.71 0.00 0.00 52.55 55.28 1v5l s ASP 51 Cb 0.00 -2.57 0.03 0.00 1.01 0.00 0.00 42.92 41.40 1v5l s ASP 51 CO 0.00 -1.74 0.20 -0.69 0.21 0.00 0.00 175.17 173.15 1v5l s VAL 52 N -2.16 4.44 -0.33 -1.27 1.01 -1.26 -3.28 120.40 117.54 1v5l s VAL 52 Ca 0.70 -0.94 -0.28 0.00 0.00 0.00 0.00 61.98 61.45 1v5l s VAL 52 Cb -0.23 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 1v5l s VAL 52 CO 0.40 -0.25 1.97 -0.63 0.00 0.00 0.00 175.10 176.59 1v5l s ILE 53 N 1.52 3.30 -0.13 2.22 -1.09 0.13 -3.42 121.20 123.74 1v5l s ILE 53 Ca 0.01 0.29 -0.22 0.00 -2.23 0.00 0.00 60.65 58.50 1v5l s ILE 53 Cb -0.20 -3.44 -0.20 0.00 -1.58 0.00 0.00 42.46 37.05 1v5l s ILE 53 CO 0.06 -0.31 0.60 -0.07 -1.23 0.00 0.00 174.94 173.99 1v5l h LEU 54 N 14.76 -0.00 -7.66 2.97 3.38 -0.65 -3.42 115.31 124.69 1v5l h LEU 54 Ca -0.34 -0.75 -0.43 0.00 0.09 0.00 0.00 57.88 56.45 1v5l h LEU 54 Cb 1.20 0.00 -0.35 0.00 0.09 0.00 0.00 40.66 41.59 1v5l h LEU 54 CO 1.04 0.87 -0.77 0.00 0.09 0.00 0.00 178.44 179.66 1v5l s ALA 55 N -2.35 0.75 -0.10 1.53 0.00 -1.17 -0.35 121.76 120.07 1v5l s ALA 55 Ca -0.14 -0.13 -0.19 0.00 0.00 0.00 0.00 51.96 51.50 1v5l s ALA 55 Cb -0.02 -0.57 -0.04 0.00 0.00 0.00 0.00 23.12 22.48 1v5l s ALA 55 CO 0.52 -0.19 0.50 0.42 0.00 0.00 0.00 175.76 177.02 1v5l s ILE 56 N 1.31 5.16 -1.71 0.00 1.01 0.31 -2.07 121.20 125.21 1v5l s ILE 56 Ca -0.05 1.01 -0.20 0.00 0.00 0.00 0.00 60.65 61.42 1v5l s ILE 56 Cb -0.14 -3.84 0.18 0.00 0.01 0.00 0.00 42.46 38.67 1v5l s ILE 56 CO -0.02 0.33 0.71 0.47 0.00 0.00 0.00 174.94 176.42 1v5l n ASP 57 N 3.59 -2.87 -0.40 3.58 9.92 0.12 0.74 116.55 131.24 1v5l n ASP 57 Ca -0.07 -1.02 -0.03 0.00 -0.53 0.00 0.00 54.79 53.14 1v5l n ASP 57 Cb 0.52 -2.38 0.00 0.00 -0.64 0.00 0.00 41.12 38.61 1v5l n ASP 57 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1v5l n GLY 58 N -1.26 0.32 2.69 0.44 0.00 -1.22 -4.93 105.19 101.24 1v5l n GLY 58 Ca 0.09 -0.74 -0.25 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.26 0.51 0.37 1.61 0.08 0.23 -5.09 117.98 113.42 1v5l s PHE 59 Ca 0.01 -0.33 -0.27 0.00 0.12 0.00 0.00 56.93 56.46 1v5l s PHE 59 Cb -0.00 -0.77 -0.11 0.00 -0.57 0.00 0.00 43.02 41.56 1v5l s PHE 59 CO 0.01 -0.44 1.32 0.41 -0.10 0.00 0.00 175.22 176.42 1v5l n GLY 60 N 5.19 0.69 2.04 4.36 0.00 -1.26 0.11 105.19 116.32 1v5l n GLY 60 Ca -0.07 0.28 -0.23 0.00 0.00 0.00 0.00 46.02 46.00 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 0.20 3.06 -0.19 2.61 -2.24 0.52 -4.52 114.28 113.72 1v5l n THR 61 Ca 0.05 -2.07 -0.09 0.00 -2.27 0.00 0.00 64.05 59.67 1v5l n THR 61 Cb 0.38 -1.27 0.01 0.00 -2.10 0.00 0.00 70.33 67.35 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 1.64 0.87 -0.12 -0.78 4.11 -1.90 -3.32 114.58 115.08 1v5l h GLU 62 Ca 0.40 -0.22 -0.18 0.00 0.07 0.00 0.00 59.36 59.43 1v5l h GLU 62 Cb 0.90 -0.11 -0.32 0.00 0.50 0.00 0.00 28.75 29.72 1v5l h GLU 62 CO 1.04 0.83 -0.94 -1.13 0.07 0.00 0.00 179.01 178.89 1v5l n SER 63 N -4.40 1.46 -4.54 3.06 3.41 -1.26 -5.06 113.62 106.29 1v5l n SER 63 Ca 0.02 -2.47 -0.35 0.00 -0.26 0.00 0.00 58.87 55.81 1v5l n SER 63 Cb 0.24 -0.38 -0.11 0.00 -0.26 0.00 0.00 64.21 63.70 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 -1.48 3.80 0.49 4.33 0.00 -1.25 -5.10 119.30 120.08 1v5l s MET 64 Ca 0.35 -0.43 -0.03 0.00 0.00 0.00 0.00 55.69 55.58 1v5l s MET 64 Cb 0.38 -3.19 -0.01 0.00 0.00 0.00 0.00 34.83 32.00 1v5l s MET 64 CO -0.12 0.10 0.76 0.95 0.00 0.00 0.00 175.02 176.71 1v5l s THR 65 N 0.82 4.23 0.23 10.11 -4.23 -1.26 -4.12 115.64 121.42 1v5l s THR 65 Ca 0.03 -0.17 -0.15 0.00 -1.18 0.00 0.00 61.69 60.22 1v5l s THR 65 Cb -0.14 -3.61 0.28 0.00 1.34 0.00 0.00 72.50 70.37 1v5l s THR 65 CO 0.02 -0.53 1.50 1.57 -0.54 0.00 0.00 174.62 176.64 1v5l n HIS 66 N -2.25 0.09 0.17 3.99 -0.00 -1.26 -0.93 115.22 115.03 1v5l n HIS 66 Ca 0.01 1.18 -0.15 0.00 0.46 0.00 0.00 57.72 59.23 1v5l n HIS 66 Cb 0.57 -0.90 -0.09 0.00 -0.12 0.00 0.00 29.99 29.45 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 1.45 -1.02 -0.99 1.57 0.00 -1.93 -2.63 119.26 115.71 1v5l h ALA 67 Ca 0.36 -0.13 0.15 0.00 0.00 0.00 0.00 54.91 55.29 1v5l h ALA 67 Cb 0.60 0.78 -0.16 0.00 0.00 0.00 0.00 17.79 19.01 1v5l h ALA 67 CO -0.96 -1.10 -0.39 -0.25 0.00 0.00 0.00 179.25 176.55 1v5l n ASP 68 N -5.14 -0.65 -0.35 0.00 9.92 -0.11 0.13 116.55 120.36 1v5l n ASP 68 Ca -0.09 1.74 0.24 0.00 -0.53 0.00 0.00 54.79 56.15 1v5l n ASP 68 Cb 0.39 -0.40 0.49 0.00 -0.64 0.00 0.00 41.12 40.96 1v5l n ASP 68 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1v5l h ALA 69 N 1.36 2.11 -0.17 2.24 0.00 -1.00 0.15 119.26 123.95 1v5l h ALA 69 Ca 0.34 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.38 1v5l h ALA 69 Cb 0.59 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1v5l h ALA 69 CO -0.99 -0.63 0.11 1.96 0.00 0.00 0.00 179.25 179.70 1v5l h GLN 70 N 0.37 0.23 0.00 0.00 1.08 0.13 0.61 115.11 117.53 1v5l h GLN 70 Ca 0.68 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.86 1v5l h GLN 70 Cb 1.65 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 29.03 1v5l h GLN 70 CO -0.45 0.18 0.04 -0.44 -0.95 0.00 0.00 178.83 177.21 1v5l h ASP 71 N 0.21 0.00 0.06 1.46 5.19 -0.50 0.24 116.42 123.07 1v5l h ASP 71 Ca 0.06 0.00 -0.38 0.00 -0.62 0.00 0.00 57.03 56.10 1v5l h ASP 71 Cb 0.01 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.46 1v5l h ASP 71 CO -0.01 0.00 -2.32 0.54 -3.12 0.00 0.00 179.24 174.33 1v5l n ARG 72 N -2.28 0.68 0.07 3.56 3.00 -0.47 -3.46 116.66 117.76 1v5l n ARG 72 Ca -0.01 0.15 -0.10 0.00 -0.01 0.00 0.00 57.85 57.88 1v5l n ARG 72 Cb 0.08 -1.58 -0.01 0.00 0.00 0.00 0.00 32.46 30.96 1v5l n ARG 72 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 1v5l h ILE 73 N 0.01 1.43 0.01 0.55 2.04 0.17 -1.54 117.51 120.19 1v5l h ILE 73 Ca -0.53 -2.41 -0.20 0.00 1.00 0.00 0.00 64.86 62.73 1v5l h ILE 73 Cb 1.99 2.34 -0.02 0.00 -0.74 0.00 0.00 36.82 40.39 1v5l h ILE 73 CO -0.02 0.71 -0.91 0.07 0.00 0.00 0.00 178.15 178.00 1v5l h LYS 74 N 0.20 0.10 -0.58 2.37 2.10 -0.78 -3.13 116.57 116.85 1v5l h LYS 74 Ca -0.05 -0.13 0.00 0.00 -2.00 0.00 0.00 60.65 58.47 1v5l h LYS 74 Cb 1.46 0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.83 1v5l h LYS 74 CO 0.14 0.94 0.00 0.00 -2.00 0.00 0.00 179.45 178.53 1v5l n ALA 75 N -2.42 2.41 -0.48 0.07 0.00 -1.22 -4.97 120.51 113.90 1v5l n ALA 75 Ca -0.02 -1.03 -0.10 0.00 0.00 0.00 0.00 53.44 52.28 1v5l n ALA 75 Cb 0.84 -0.95 0.17 0.00 0.00 0.00 0.00 19.45 19.52 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 1.25 -3.09 -4.10 0.00 0.00 -0.58 -5.00 120.51 108.98 1v5l n ALA 76 Ca 0.20 -0.90 -0.29 0.00 0.00 0.00 0.00 53.44 52.45 1v5l n ALA 76 Cb 0.51 -0.08 -0.02 0.00 0.00 0.00 0.00 19.45 19.86 1v5l n ALA 76 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1v5l n SER 77 N -2.79 2.91 -0.19 0.00 7.64 -1.26 -4.95 113.62 114.97 1v5l n SER 77 Ca 0.08 -2.96 0.27 0.00 1.01 0.00 0.00 58.87 57.27 1v5l n SER 77 Cb 0.35 0.06 0.43 0.00 -1.01 0.00 0.00 64.21 64.04 1v5l n SER 77 CO 0.00 0.00 0.00 0.10 -3.01 0.00 0.00 175.04 172.13 1v5l h TYR 78 N 0.81 0.00 -3.60 1.43 -0.00 -1.96 -3.35 116.97 110.30 1v5l h TYR 78 Ca -0.36 0.00 -0.35 0.00 -0.00 0.00 0.00 58.73 58.01 1v5l h TYR 78 Cb 1.26 0.00 -0.32 0.00 -0.00 0.00 0.00 36.73 37.67 1v5l h TYR 78 CO 0.00 0.00 -0.76 1.14 -0.00 0.00 0.00 178.16 178.54 1v5l s GLN 79 N -4.43 0.48 0.11 0.10 1.03 -1.26 0.21 119.66 115.90 1v5l s GLN 79 Ca -0.03 -0.05 -0.18 0.00 0.04 0.00 0.00 55.36 55.14 1v5l s GLN 79 Cb 0.14 -0.55 -0.07 0.00 0.03 0.00 0.00 33.01 32.56 1v5l s GLN 79 CO 0.45 -0.05 0.59 -1.17 -2.54 0.00 0.00 175.29 172.57 1v5l s LEU 80 N 0.66 4.46 -0.16 2.60 2.96 0.13 -4.92 118.68 124.42 1v5l s LEU 80 Ca -0.07 1.25 0.00 0.00 -0.22 0.00 0.00 54.13 55.09 1v5l s LEU 80 Cb -0.11 -3.08 0.03 0.00 0.50 0.00 0.00 46.19 43.53 1v5l s LEU 80 CO -0.01 0.20 -0.12 0.00 -1.32 0.00 0.00 176.35 175.10 1v5l s LEU 82 N 1.50 0.98 -0.41 0.00 1.43 -0.28 0.12 118.68 122.03 1v5l s LEU 82 Ca 0.04 -0.22 -0.22 0.00 -1.03 0.00 0.00 54.13 52.70 1v5l s LEU 82 Cb -0.14 -0.68 0.02 0.00 0.03 0.00 0.00 46.19 45.42 1v5l s LEU 82 CO -0.10 -0.14 0.70 -0.75 0.23 0.00 0.00 176.35 176.30 1v5l s LYS 83 N 1.75 3.50 0.24 1.70 2.20 -0.88 -2.28 119.74 125.96 1v5l s LYS 83 Ca 0.04 -0.08 0.06 0.00 -0.36 0.00 0.00 55.97 55.63 1v5l s LYS 83 Cb -0.13 -3.89 -0.03 0.00 -1.51 0.00 0.00 37.83 32.27 1v5l s LYS 83 CO -0.07 -0.94 0.23 0.96 -0.36 0.00 0.00 175.35 175.17 1v5l s ILE 84 N 2.97 4.65 -0.42 5.43 -4.36 0.19 0.09 121.20 129.76 1v5l s ILE 84 Ca 0.26 -1.26 0.01 0.00 -0.26 0.00 0.00 60.65 59.40 1v5l s ILE 84 Cb -0.13 -3.50 0.41 0.00 1.25 0.00 0.00 42.46 40.49 1v5l s ILE 84 CO 0.19 -0.32 1.86 -0.67 0.24 0.00 0.00 174.94 176.24 1v5l n ASP 85 N -1.13 5.40 -2.67 4.36 2.03 -1.22 -0.86 116.55 122.46 1v5l n ASP 85 Ca -0.08 -3.32 -0.10 0.00 0.52 0.00 0.00 54.79 51.80 1v5l n ASP 85 Cb 0.57 -0.89 -0.02 0.00 -0.72 0.00 0.00 41.12 40.06 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 -0.51 -2.08 -2.20 -0.67 0.63 -1.25 -4.73 116.66 105.85 1v5l n ARG 86 Ca 0.46 0.03 -0.33 0.00 -0.92 0.00 0.00 57.85 57.09 1v5l n ARG 86 Cb 0.99 -3.70 -0.04 0.00 0.45 0.00 0.00 32.46 30.15 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 -1.98 2.08 -0.12 5.13 0.00 -1.26 -4.75 121.76 120.86 1v5l s ALA 87 Ca 0.20 -1.49 -0.12 0.00 0.00 0.00 0.00 51.96 50.56 1v5l s ALA 87 Cb -0.12 -4.47 -0.26 0.00 0.00 0.00 0.00 23.12 18.27 1v5l s ALA 87 CO 0.25 -4.25 0.43 1.05 0.00 0.00 0.00 175.76 173.24 1v5l h GLU 88 N 11.60 0.24 0.00 0.00 4.11 -1.92 -3.39 114.58 125.22 1v5l h GLU 88 Ca 0.02 -0.42 0.00 0.00 0.07 0.00 0.00 59.36 59.03 1v5l h GLU 88 Cb 1.04 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.45 1v5l h GLU 88 CO 1.26 1.20 -0.75 -2.37 0.07 0.00 0.00 179.01 178.42 1v5l n THR 89 N -3.74 0.00 -4.16 -1.06 5.66 -1.26 -5.03 114.28 104.69 1v5l n THR 89 Ca -0.29 -0.02 -0.29 0.00 -3.05 0.00 0.00 64.05 60.39 1v5l n THR 89 Cb 0.97 0.43 -0.06 0.00 -1.55 0.00 0.00 70.33 70.11 1v5l n THR 89 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1v5l n ARG 90 N -1.17 -1.86 -0.06 1.09 5.12 -1.26 -4.84 116.66 113.69 1v5l n ARG 90 Ca 0.00 0.22 -0.03 0.00 -1.93 0.00 0.00 57.85 56.11 1v5l n ARG 90 Cb 0.00 -3.93 -0.15 0.00 -1.16 0.00 0.00 32.46 27.22 1v5l n ARG 90 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17 1v5l n LEU 91 N -4.52 0.16 -3.15 0.55 -0.00 -1.26 -4.91 117.00 103.87 1v5l n LEU 91 Ca -0.31 0.07 0.05 0.00 -0.00 0.00 0.00 56.01 55.82 1v5l n LEU 91 Cb 0.69 0.30 -0.01 0.00 -0.00 0.00 0.00 43.42 44.40 1v5l n LEU 91 CO 0.80 0.32 0.31 0.86 -0.00 0.00 0.00 177.39 179.68 1v5l s TRP 92 N -2.81 -1.23 -0.09 1.47 -0.11 -1.26 -5.17 118.94 109.74 1v5l s TRP 92 Ca -0.08 1.14 -0.18 0.00 1.22 0.00 0.00 56.10 58.20 1v5l s TRP 92 Cb 0.08 0.37 0.04 0.00 -1.50 0.00 0.00 33.47 32.47 1v5l s TRP 92 CO 0.85 -0.69 0.45 -1.54 -4.62 0.00 0.00 176.95 171.40 1v5l s SER 93 N 2.89 -0.41 0.98 5.86 1.04 -1.26 -5.16 113.70 117.65 1v5l s SER 93 Ca 0.13 0.58 0.00 0.00 0.48 0.00 0.00 55.95 57.15 1v5l s SER 93 Cb -0.12 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.64 1v5l s SER 93 CO -0.19 -0.35 0.00 -0.81 0.98 0.00 0.00 173.24 172.87 1v5l n PRO 94 N 1.89 -1.00 -2.11 4.02 -0.04 -1.26 -4.96 135.00 131.54 1v5l n PRO 94 Ca -0.17 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 62.93 1v5l n PRO 94 Cb 0.56 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 34.05 1v5l n PRO 94 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1v5l n GLN 95 N -1.49 2.98 -3.67 0.54 -0.06 -1.26 -4.93 117.38 109.49 1v5l n GLN 95 Ca 0.00 -3.86 -0.09 0.00 -2.00 0.00 0.00 57.00 51.06 1v5l n GLN 95 Cb 0.00 -2.26 -0.09 0.00 -4.06 0.00 0.00 30.24 23.83 1v5l n GLN 95 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 1v5l s VAL 96 N -5.23 -0.02 -0.19 1.69 1.01 -1.26 -5.04 120.40 111.36 1v5l s VAL 96 Ca 0.51 0.05 0.13 0.00 0.00 0.00 0.00 61.98 62.67 1v5l s VAL 96 Cb 0.43 -0.79 0.43 0.00 0.00 0.00 0.00 36.38 36.45 1v5l s VAL 96 CO -0.34 0.02 1.21 -1.20 0.00 0.00 0.00 175.10 174.79 1v5l n SER 97 N 4.30 1.93 -3.85 3.32 7.64 -1.26 -3.41 113.62 122.29 1v5l n SER 97 Ca -0.22 -3.59 -0.09 0.00 1.01 0.00 0.00 58.87 55.98 1v5l n SER 97 Cb 0.57 -0.48 -0.05 0.00 -1.01 0.00 0.00 64.21 63.24 1v5l n SER 97 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1v5l s SER 98 N -3.11 -0.12 0.00 6.43 0.15 -1.26 -3.21 113.70 112.58 1v5l s SER 98 Ca 0.39 -0.68 0.00 0.00 0.70 0.00 0.00 55.95 56.36 1v5l s SER 98 Cb 0.38 0.52 0.00 0.00 -1.71 0.00 0.00 66.02 65.21 1v5l s SER 98 CO -0.07 -1.00 0.00 0.61 1.20 0.00 0.00 173.24 173.98 1v5l n GLY 99 N -0.29 3.34 0.18 9.45 0.00 -1.26 -3.89 105.19 112.72 1v5l n GLY 99 Ca -0.08 -0.43 -0.01 0.00 0.00 0.00 0.00 46.02 45.50 1v5l n GLY 99 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v5l h PRO 100 N 0.00 0.14 -0.67 1.61 0.13 -2.02 -3.22 132.00 127.97 1v5l h PRO 100 Ca 0.00 -0.07 0.13 0.00 -0.87 0.00 0.00 66.00 65.19 1v5l h PRO 100 Cb 0.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.01 1v5l h PRO 100 CO 0.00 0.59 -0.17 0.66 -0.23 0.00 0.00 178.00 178.85 1v5l h SER 101 N 0.12 -0.62 -3.44 1.44 4.64 -2.01 -3.36 113.55 110.31 1v5l h SER 101 Ca 0.01 0.20 -0.62 0.00 -0.47 0.00 0.00 61.79 60.90 1v5l h SER 101 Cb 0.88 0.41 -0.17 0.00 -0.31 0.00 0.00 62.40 63.21 1v5l h SER 101 CO 0.07 -0.22 -0.57 -0.55 -0.87 0.00 0.00 176.83 174.69 1v5l s SER 102 N -5.24 5.61 0.00 4.97 0.15 -1.22 -5.27 113.70 112.70 1v5l s SER 102 Ca -0.14 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.53 1v5l s SER 102 Cb 0.20 -1.98 0.00 0.00 -1.71 0.00 0.00 66.02 62.53 1v5l s SER 102 CO 0.74 0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.90