#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 6.67 -0.08 1.61 0.01 -1.26 -5.03 113.70 115.62 1v5l s SER 2 Ca 0.00 1.02 -0.15 0.00 1.31 0.00 0.00 55.95 58.13 1v5l s SER 2 Cb 0.00 -2.27 -0.11 0.00 0.21 0.00 0.00 66.02 63.85 1v5l s SER 2 CO 0.00 -0.10 0.55 0.28 0.41 0.00 0.00 173.24 174.38 1v5l h SER 3 N 2.49 -0.15 0.00 2.44 0.02 -1.98 -3.46 113.55 112.91 1v5l h SER 3 Ca -0.47 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.20 1v5l h SER 3 Cb 1.17 0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1v5l h SER 3 CO 0.68 0.43 0.00 0.61 -1.14 0.00 0.00 176.83 177.41 1v5l n GLY 4 N 1.07 1.13 2.68 -3.77 0.00 -1.26 -3.34 105.19 101.70 1v5l n GLY 4 Ca -0.06 -0.24 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 1v5l n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v5l s SER 5 N 2.00 3.53 -0.27 1.61 0.01 0.57 -4.94 113.70 116.20 1v5l s SER 5 Ca 0.00 -2.66 -0.12 0.00 1.31 0.00 0.00 55.95 54.48 1v5l s SER 5 Cb 0.00 -0.97 -0.05 0.00 0.21 0.00 0.00 66.02 65.21 1v5l s SER 5 CO 0.00 -0.26 0.24 -0.94 0.41 0.00 0.00 173.24 172.70 1v5l s SER 6 N 0.33 6.10 -0.54 2.44 1.04 -1.26 -4.59 113.70 117.22 1v5l s SER 6 Ca 0.19 0.10 -0.16 0.00 0.48 0.00 0.00 55.95 56.55 1v5l s SER 6 Cb -0.22 -2.15 0.12 0.00 0.10 0.00 0.00 66.02 63.88 1v5l s SER 6 CO -0.01 -0.08 0.51 -0.83 0.98 0.00 0.00 173.24 173.81 1v5l s GLY 7 N 1.65 2.06 0.30 7.32 0.00 -1.11 -5.01 107.32 112.53 1v5l s GLY 7 Ca 0.10 -2.49 -0.28 0.00 0.00 0.00 0.00 44.72 42.04 1v5l s GLY 7 CO 0.10 1.22 1.05 0.54 0.00 0.00 0.00 173.10 176.01 1v5l s ASN 8 N 3.53 7.26 -0.17 1.64 6.03 -1.26 -1.15 114.94 130.82 1v5l s ASN 8 Ca 0.04 2.14 -0.04 0.00 -1.03 0.00 0.00 52.86 53.96 1v5l s ASN 8 Cb -0.29 -2.61 0.07 0.00 -3.03 0.00 0.00 41.25 35.38 1v5l s ASN 8 CO 0.03 -0.14 0.13 -0.69 -2.03 0.00 0.00 177.10 174.41 1v5l s VAL 9 N -1.28 -0.17 -0.38 3.54 1.01 -1.07 -4.95 120.40 117.10 1v5l s VAL 9 Ca 0.46 -0.07 -0.00 0.00 0.00 0.00 0.00 61.98 62.37 1v5l s VAL 9 Cb -0.28 -0.56 0.11 0.00 0.00 0.00 0.00 36.38 35.65 1v5l s VAL 9 CO 0.36 -0.20 0.15 -0.69 0.00 0.00 0.00 175.10 174.72 1v5l s VAL 10 N 2.21 2.90 0.05 2.92 1.01 -1.26 -0.94 120.40 127.29 1v5l s VAL 10 Ca 0.04 -2.18 -0.23 0.00 0.00 0.00 0.00 61.98 59.60 1v5l s VAL 10 Cb -0.15 -3.04 -0.06 0.00 0.00 0.00 0.00 36.38 33.13 1v5l s VAL 10 CO -0.09 -0.66 0.70 -0.76 0.00 0.00 0.00 175.10 174.29 1v5l s LEU 11 N 1.04 4.46 0.01 3.92 1.43 -0.48 -4.91 118.68 124.14 1v5l s LEU 11 Ca 0.09 1.37 -0.30 0.00 -1.03 0.00 0.00 54.13 54.26 1v5l s LEU 11 Cb -0.21 -3.12 -0.06 0.00 0.03 0.00 0.00 46.19 42.82 1v5l s LEU 11 CO -0.06 0.08 1.44 -2.16 0.23 0.00 0.00 176.35 175.89 1v5l s PRO 12 N -0.30 4.27 0.00 1.29 0.04 -1.26 -1.83 135.00 137.21 1v5l s PRO 12 Ca 0.35 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.41 1v5l s PRO 12 Cb -0.20 -3.59 0.00 0.00 0.04 0.00 0.00 34.50 30.75 1v5l s PRO 12 CO 0.21 -0.61 0.00 0.41 0.04 0.00 0.00 177.00 177.06 1v5l n GLY 13 N 3.71 7.57 3.60 0.56 0.00 0.19 -4.83 105.19 115.98 1v5l n GLY 13 Ca 0.14 -2.02 -0.30 0.00 0.00 0.00 0.00 46.02 43.84 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 1.10 -1.10 1.05 1.61 0.04 -1.19 -4.81 135.00 131.70 1v5l s PRO 14 Ca 0.00 -0.02 -0.21 0.00 0.04 0.00 0.00 61.00 60.81 1v5l s PRO 14 Cb 0.00 -1.61 -0.03 0.00 0.04 0.00 0.00 34.50 32.91 1v5l s PRO 14 CO 0.00 -3.64 -0.53 0.00 0.04 0.00 0.00 177.00 172.87 1v5l n ALA 15 N -4.72 -4.64 -1.11 8.56 0.00 -1.26 -4.80 120.51 112.53 1v5l n ALA 15 Ca 0.12 -1.18 -0.29 0.00 0.00 0.00 0.00 53.44 52.09 1v5l n ALA 15 Cb 0.59 -1.28 0.22 0.00 0.00 0.00 0.00 19.45 18.98 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 -2.86 -0.63 -0.11 0.00 0.04 -1.26 -5.15 135.00 125.02 1v5l s PRO 16 Ca 0.48 0.14 -0.09 0.00 0.04 0.00 0.00 61.00 61.57 1v5l s PRO 16 Cb -0.06 -1.65 -0.05 0.00 0.04 0.00 0.00 34.50 32.78 1v5l s PRO 16 CO 0.68 -3.36 -0.20 0.91 0.04 0.00 0.00 177.00 175.07 1v5l n TRP 17 N -4.55 0.00 0.00 0.56 7.02 -1.26 -4.90 117.44 114.31 1v5l n TRP 17 Ca 0.10 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.58 1v5l n TRP 17 Cb 0.59 -0.44 0.00 0.00 -2.42 0.00 0.00 31.31 29.04 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 2.16 1.18 3.25 6.99 0.00 -1.26 -3.23 105.19 114.28 1v5l n GLY 18 Ca -0.20 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.38 0.50 1.61 -0.71 -1.26 -0.57 117.98 115.17 1v5l s PHE 19 Ca 0.00 0.91 0.09 0.00 -1.04 0.00 0.00 56.93 56.89 1v5l s PHE 19 Cb 0.00 0.13 0.05 0.00 -1.21 0.00 0.00 43.02 41.99 1v5l s PHE 19 CO 0.00 -0.20 0.69 1.03 -1.34 0.00 0.00 175.22 175.40 1v5l s ARG 20 N 0.09 2.54 0.09 1.99 1.81 0.80 -4.95 118.95 121.31 1v5l s ARG 20 Ca -0.01 -1.46 -0.11 0.00 -1.72 0.00 0.00 55.73 52.43 1v5l s ARG 20 Cb -0.03 -2.70 0.01 0.00 -0.45 0.00 0.00 34.95 31.79 1v5l s ARG 20 CO 0.01 -0.59 0.26 -0.48 -0.68 0.00 0.00 175.30 173.81 1v5l s LEU 21 N -4.52 1.10 0.14 2.53 0.05 -1.26 -2.57 118.68 114.14 1v5l s LEU 21 Ca 0.59 -0.48 -0.16 0.00 0.05 0.00 0.00 54.13 54.12 1v5l s LEU 21 Cb -0.08 1.27 0.03 0.00 -2.05 0.00 0.00 46.19 45.36 1v5l s LEU 21 CO 0.36 -0.73 0.41 -0.55 -0.55 0.00 0.00 176.35 175.30 1v5l s SER 22 N -2.67 -0.23 0.00 1.48 0.15 0.69 -4.58 113.70 108.54 1v5l s SER 22 Ca 0.02 -0.36 0.00 0.00 0.70 0.00 0.00 55.95 56.32 1v5l s SER 22 Cb 0.03 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.83 1v5l s SER 22 CO -0.10 -0.88 0.00 0.61 1.20 0.00 0.00 173.24 174.07 1v5l n GLY 23 N -0.24 -1.29 0.00 9.45 0.00 -1.26 -1.98 105.19 109.87 1v5l n GLY 23 Ca -0.15 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.24 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 4.53 0.40 -0.02 0.00 0.21 -4.36 105.19 105.95 1v5l n GLY 24 Ca 0.00 -0.77 0.21 0.00 0.00 0.00 0.00 46.02 45.46 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 1.46 0.71 -0.12 -0.61 3.07 -1.69 0.22 117.51 120.54 1v5l h ILE 25 Ca 0.00 -0.04 -0.12 0.00 1.55 0.00 0.00 64.86 66.24 1v5l h ILE 25 Cb 0.00 0.58 -0.01 0.00 -0.27 0.00 0.00 36.82 37.12 1v5l h ILE 25 CO 0.00 0.02 -0.47 -0.78 -1.05 0.00 0.00 178.15 175.87 1v5l h ASP 26 N 0.12 0.33 -0.47 2.16 3.58 -1.87 -2.75 116.42 117.52 1v5l h ASP 26 Ca 0.33 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.62 1v5l h ASP 26 Cb 1.13 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.09 1v5l h ASP 26 CO -0.04 0.76 0.00 0.49 -2.88 0.00 0.00 179.24 177.57 1v5l n PHE 27 N -3.98 1.54 -3.99 0.28 3.72 0.66 -4.91 117.46 110.78 1v5l n PHE 27 Ca -0.02 -0.55 -0.31 0.00 -0.05 0.00 0.00 57.45 56.52 1v5l n PHE 27 Cb 0.53 -0.38 0.01 0.00 -0.94 0.00 0.00 39.48 38.71 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 0.57 -4.11 -3.84 4.37 4.13 -0.83 -4.83 115.26 110.72 1v5l n ASN 28 Ca 0.21 -0.85 -0.12 0.00 1.68 0.00 0.00 54.58 55.51 1v5l n ASN 28 Cb 0.94 -3.57 -0.12 0.00 -1.54 0.00 0.00 39.78 35.48 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 -6.67 0.24 0.33 3.52 -1.52 -0.53 -4.98 119.66 110.05 1v5l s GLN 29 Ca 0.63 0.01 -0.28 0.00 -1.95 0.00 0.00 55.36 53.77 1v5l s GLN 29 Cb -0.32 0.11 -0.10 0.00 -0.22 0.00 0.00 33.01 32.48 1v5l s GLN 29 CO 0.86 -0.04 1.22 -1.25 -0.25 0.00 0.00 175.29 175.82 1v5l s PRO 30 N -0.35 4.38 -0.82 2.91 0.04 -1.26 0.65 135.00 140.55 1v5l s PRO 30 Ca -0.04 2.02 -0.25 0.00 0.04 0.00 0.00 61.00 62.77 1v5l s PRO 30 Cb -0.03 -3.03 0.02 0.00 0.04 0.00 0.00 34.50 31.49 1v5l s PRO 30 CO 0.00 -0.09 1.51 -0.51 0.04 0.00 0.00 177.00 177.95 1v5l s LEU 31 N -1.82 3.28 0.39 -3.56 1.43 -1.26 -4.20 118.68 112.94 1v5l s LEU 31 Ca 0.49 -0.62 0.08 0.00 -1.03 0.00 0.00 54.13 53.04 1v5l s LEU 31 Cb -0.36 -2.56 -0.05 0.00 0.03 0.00 0.00 46.19 43.26 1v5l s LEU 31 CO 0.47 -1.95 0.16 0.68 0.23 0.00 0.00 176.35 175.94 1v5l s VAL 32 N 6.64 2.52 0.26 -1.59 -7.23 -0.84 0.34 120.40 120.50 1v5l s VAL 32 Ca 0.48 -1.71 -0.30 0.00 -1.81 0.00 0.00 61.98 58.64 1v5l s VAL 32 Cb -0.06 -2.97 -0.09 0.00 0.56 0.00 0.00 36.38 33.82 1v5l s VAL 32 CO 0.07 -0.07 1.02 -0.63 -0.31 0.00 0.00 175.10 175.19 1v5l s ILE 33 N -2.55 3.77 -0.14 -0.62 1.01 -1.08 -0.22 121.20 121.37 1v5l s ILE 33 Ca 0.40 1.77 0.18 0.00 0.00 0.00 0.00 60.65 63.00 1v5l s ILE 33 Cb 0.02 -4.12 -0.25 0.00 0.01 0.00 0.00 42.46 38.11 1v5l s ILE 33 CO 0.22 0.41 0.16 0.35 0.00 0.00 0.00 174.94 176.09 1v5l n THR 34 N 1.29 0.94 -3.47 2.92 -2.24 -1.06 -1.38 114.28 111.27 1v5l n THR 34 Ca -0.01 -0.70 -0.12 0.00 -2.27 0.00 0.00 64.05 60.95 1v5l n THR 34 Cb 0.46 -0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 68.30 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 -2.70 1.04 0.04 -0.78 0.52 -1.26 -4.80 118.95 111.02 1v5l s ARG 35 Ca -0.09 -0.25 0.03 0.00 -0.52 0.00 0.00 55.73 54.90 1v5l s ARG 35 Cb 0.07 0.48 -0.02 0.00 0.52 0.00 0.00 34.95 36.01 1v5l s ARG 35 CO 0.78 -0.43 -0.10 0.42 0.02 0.00 0.00 175.30 176.00 1v5l s ILE 36 N -2.93 0.73 -0.40 1.52 -1.09 -1.26 -0.14 121.20 117.63 1v5l s ILE 36 Ca 0.00 -1.00 -0.29 0.00 -2.23 0.00 0.00 60.65 57.13 1v5l s ILE 36 Cb -0.01 -0.73 0.01 0.00 -1.58 0.00 0.00 42.46 40.15 1v5l s ILE 36 CO -0.07 -0.22 1.31 -0.89 -1.23 0.00 0.00 174.94 173.84 1v5l s THR 37 N -1.11 4.05 -0.80 2.92 2.01 0.26 -4.95 115.64 118.02 1v5l s THR 37 Ca -0.05 1.10 -0.25 0.00 0.31 0.00 0.00 61.69 62.80 1v5l s THR 37 Cb -0.09 -4.30 -0.04 0.00 0.01 0.00 0.00 72.50 68.09 1v5l s THR 37 CO 0.01 -0.75 1.92 -2.16 -0.69 0.00 0.00 174.62 172.95 1v5l s PRO 38 N 4.62 2.58 0.00 4.92 0.04 -1.26 -3.31 135.00 142.59 1v5l s PRO 38 Ca 0.56 0.02 0.00 0.00 0.04 0.00 0.00 61.00 61.63 1v5l s PRO 38 Cb -0.13 -4.83 0.00 0.00 0.04 0.00 0.00 34.50 29.58 1v5l s PRO 38 CO 0.30 -3.15 0.00 0.41 0.04 0.00 0.00 177.00 174.59 1v5l n GLY 39 N 6.45 0.79 3.70 0.56 0.00 -1.26 -5.08 105.19 110.35 1v5l n GLY 39 Ca 0.33 -0.80 -0.01 0.00 0.00 0.00 0.00 46.02 45.54 1v5l n GLY 39 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v5l s SER 40 N -1.57 -0.12 0.60 1.61 1.04 -1.23 -4.99 113.70 109.02 1v5l s SER 40 Ca 0.00 -0.30 0.29 0.00 0.48 0.00 0.00 55.95 56.43 1v5l s SER 40 Cb 0.00 0.35 1.25 0.00 0.10 0.00 0.00 66.02 67.72 1v5l s SER 40 CO 0.00 -0.65 1.62 0.11 0.98 0.00 0.00 173.24 175.29 1v5l h LYS 41 N 2.00 0.00 0.15 4.02 1.57 -1.90 0.18 116.57 122.60 1v5l h LYS 41 Ca -0.27 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.50 1v5l h LYS 41 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1v5l h LYS 41 CO 0.27 0.00 -0.07 0.00 -0.57 0.00 0.00 179.45 179.07 1v5l h ALA 42 N 1.02 -0.91 -0.52 3.86 0.00 -1.81 -2.65 119.26 118.26 1v5l h ALA 42 Ca 0.38 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 55.14 1v5l h ALA 42 Cb 2.11 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.96 1v5l h ALA 42 CO -0.00 -0.89 -0.10 0.00 0.00 0.00 0.00 179.25 178.26 1v5l h ALA 43 N -1.88 0.85 0.00 0.00 0.00 -1.31 -2.44 119.26 114.49 1v5l h ALA 43 Ca -0.02 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1v5l h ALA 43 Cb 0.16 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1v5l h ALA 43 CO 0.03 0.65 0.13 0.00 0.00 0.00 0.00 179.25 180.07 1v5l h ALA 44 N 1.03 1.10 -0.51 0.00 0.00 -0.76 0.42 119.26 120.54 1v5l h ALA 44 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1v5l h ALA 44 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1v5l h ALA 44 CO 0.04 -0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.19 1v5l n ALA 45 N -1.78 2.74 -1.80 0.00 0.00 -0.92 -4.89 120.51 113.87 1v5l n ALA 45 Ca -0.02 -1.09 -0.08 0.00 0.00 0.00 0.00 53.44 52.26 1v5l n ALA 45 Cb 0.17 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.61 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 0.91 -3.21 -4.75 0.00 4.13 0.15 -4.92 115.26 107.56 1v5l n ASN 46 Ca 0.19 0.07 -0.40 0.00 1.68 0.00 0.00 54.58 56.12 1v5l n ASN 46 Cb 0.61 -2.10 -0.06 0.00 -1.54 0.00 0.00 39.78 36.69 1v5l n ASN 46 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1v5l s LEU 47 N -2.01 4.58 -0.05 3.41 1.43 -1.19 -5.05 118.68 119.80 1v5l s LEU 47 Ca 0.00 1.76 -0.08 0.00 -1.03 0.00 0.00 54.13 54.78 1v5l s LEU 47 Cb 0.00 -3.46 0.01 0.00 0.03 0.00 0.00 46.19 42.77 1v5l s LEU 47 CO 0.00 0.11 0.20 0.00 0.23 0.00 0.00 176.35 176.89 1v5l s PRO 49 N -0.53 2.55 0.00 0.00 0.04 -1.26 -2.86 135.00 132.94 1v5l s PRO 49 Ca -0.06 -0.47 0.00 0.00 0.04 0.00 0.00 61.00 60.51 1v5l s PRO 49 Cb -0.04 -5.10 0.00 0.00 0.04 0.00 0.00 34.50 29.40 1v5l s PRO 49 CO 0.01 -3.49 0.00 0.41 0.04 0.00 0.00 177.00 173.97 1v5l n GLY 50 N 6.64 0.42 3.53 0.56 0.00 -0.48 -4.82 105.19 111.05 1v5l n GLY 50 Ca 0.41 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.06 1v5l n GLY 50 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1v5l n ASP 51 N 0.00 -0.36 -4.68 1.61 -0.08 -1.14 -4.58 116.55 107.33 1v5l n ASP 51 Ca 0.00 0.68 -0.37 0.00 -1.51 0.00 0.00 54.79 53.59 1v5l n ASP 51 Cb 0.00 -1.29 -0.08 0.00 2.34 0.00 0.00 41.12 42.09 1v5l n ASP 51 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1v5l s VAL 52 N -1.78 5.30 -0.50 5.18 1.01 -1.26 -2.63 120.40 125.72 1v5l s VAL 52 Ca 0.70 0.42 -0.24 0.00 0.00 0.00 0.00 61.98 62.86 1v5l s VAL 52 Cb -0.38 -3.60 0.03 0.00 0.00 0.00 0.00 36.38 32.44 1v5l s VAL 52 CO 0.53 0.32 0.90 -0.63 0.00 0.00 0.00 175.10 176.23 1v5l s ILE 53 N 1.02 4.47 -0.04 2.22 -1.09 0.15 -2.23 121.20 125.71 1v5l s ILE 53 Ca 0.13 0.49 -0.15 0.00 -2.23 0.00 0.00 60.65 58.89 1v5l s ILE 53 Cb -0.14 -4.46 -0.32 0.00 -1.58 0.00 0.00 42.46 35.97 1v5l s ILE 53 CO 0.05 -0.93 0.78 -0.07 -1.23 0.00 0.00 174.94 173.54 1v5l h LEU 54 N 10.65 0.62 -7.50 2.97 3.38 -0.41 -3.41 115.31 121.62 1v5l h LEU 54 Ca -0.25 -0.92 -0.17 0.00 0.09 0.00 0.00 57.88 56.63 1v5l h LEU 54 Cb 1.08 -0.20 -0.26 0.00 0.09 0.00 0.00 40.66 41.37 1v5l h LEU 54 CO 1.04 1.68 -0.45 0.00 0.09 0.00 0.00 178.44 180.80 1v5l s ALA 55 N -2.54 -0.57 -0.18 1.53 0.00 -1.09 -0.96 121.76 117.95 1v5l s ALA 55 Ca -0.14 0.64 -0.04 0.00 0.00 0.00 0.00 51.96 52.42 1v5l s ALA 55 Cb 0.04 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 22.77 1v5l s ALA 55 CO 0.86 -0.11 -0.04 0.42 0.00 0.00 0.00 175.76 176.89 1v5l s ILE 56 N 0.11 3.66 -1.69 0.00 1.01 -0.55 -1.14 121.20 122.59 1v5l s ILE 56 Ca -0.00 -0.42 -0.12 0.00 0.00 0.00 0.00 60.65 60.10 1v5l s ILE 56 Cb -0.02 -2.62 0.12 0.00 0.01 0.00 0.00 42.46 39.95 1v5l s ILE 56 CO 0.00 0.46 0.42 -0.67 0.00 0.00 0.00 174.94 175.16 1v5l n ASP 57 N 4.03 -1.04 -0.80 3.58 2.03 0.50 0.17 116.55 125.00 1v5l n ASP 57 Ca -0.18 -1.18 -0.08 0.00 0.52 0.00 0.00 54.79 53.87 1v5l n ASP 57 Cb 0.52 -2.00 -0.01 0.00 -0.72 0.00 0.00 41.12 38.91 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 -1.72 0.32 2.81 0.27 0.00 -1.23 -4.89 105.19 100.75 1v5l n GLY 58 Ca -0.08 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.36 2.43 0.29 1.61 0.08 0.44 -5.10 117.98 115.37 1v5l s PHE 59 Ca 0.00 -2.51 -0.25 0.00 0.12 0.00 0.00 56.93 54.28 1v5l s PHE 59 Cb 0.00 -2.19 -0.16 0.00 -0.57 0.00 0.00 43.02 40.09 1v5l s PHE 59 CO 0.00 -0.82 0.35 0.41 -0.10 0.00 0.00 175.22 175.05 1v5l n GLY 60 N 3.85 -2.14 2.14 4.36 0.00 -1.26 -1.49 105.19 110.66 1v5l n GLY 60 Ca 0.05 0.19 -0.26 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 -0.42 3.18 0.03 2.61 -2.24 -0.14 -4.35 114.28 112.95 1v5l n THR 61 Ca 0.15 -2.16 -0.08 0.00 -2.27 0.00 0.00 64.05 59.70 1v5l n THR 61 Cb 0.31 -0.90 -0.13 0.00 -2.10 0.00 0.00 70.33 67.52 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 1.40 0.00 0.00 -0.78 9.09 -1.88 -3.37 114.58 119.03 1v5l h GLU 62 Ca 0.54 -0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.94 1v5l h GLU 62 Cb 1.67 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.76 1v5l h GLU 62 CO 1.18 0.80 -0.35 -1.13 0.05 0.00 0.00 179.01 179.56 1v5l n SER 63 N -3.23 0.81 -4.44 3.06 3.41 -1.26 -5.02 113.62 106.96 1v5l n SER 63 Ca -0.07 -2.38 -0.36 0.00 -0.26 0.00 0.00 58.87 55.80 1v5l n SER 63 Cb 0.99 -0.28 -0.13 0.00 -0.26 0.00 0.00 64.21 64.53 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 -0.98 3.63 0.50 4.33 0.00 -1.26 -5.09 119.30 120.43 1v5l s MET 64 Ca 0.12 -0.50 -0.04 0.00 0.00 0.00 0.00 55.69 55.27 1v5l s MET 64 Cb 0.10 -3.24 -0.01 0.00 0.00 0.00 0.00 34.83 31.68 1v5l s MET 64 CO 0.01 -0.13 0.78 0.95 0.00 0.00 0.00 175.02 176.62 1v5l s THR 65 N 1.44 4.30 0.21 10.11 -4.23 -1.26 -4.07 115.64 122.12 1v5l s THR 65 Ca 0.05 -0.08 -0.19 0.00 -1.18 0.00 0.00 61.69 60.29 1v5l s THR 65 Cb -0.15 -3.64 0.18 0.00 1.34 0.00 0.00 72.50 70.23 1v5l s THR 65 CO 0.02 -0.58 1.46 1.57 -0.54 0.00 0.00 174.62 176.56 1v5l n HIS 66 N -2.29 -0.05 -0.21 3.99 -0.00 -1.26 0.71 115.22 116.11 1v5l n HIS 66 Ca 0.02 1.17 -0.01 0.00 0.46 0.00 0.00 57.72 59.36 1v5l n HIS 66 Cb 0.57 -0.80 0.10 0.00 -0.12 0.00 0.00 29.99 29.73 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 1.16 0.83 0.13 1.57 0.00 -1.93 -2.45 119.26 118.56 1v5l h ALA 67 Ca 0.30 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.27 1v5l h ALA 67 Cb 0.53 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1v5l h ALA 67 CO -0.93 -0.09 -0.19 -0.44 0.00 0.00 0.00 179.25 177.60 1v5l h ASP 68 N 0.52 -0.52 -1.00 0.00 5.19 -0.07 -1.99 116.42 118.56 1v5l h ASP 68 Ca 0.30 0.06 0.23 0.00 -0.62 0.00 0.00 57.03 57.00 1v5l h ASP 68 Cb 0.30 0.19 -0.09 0.00 0.18 0.00 0.00 39.33 39.90 1v5l h ASP 68 CO -0.25 -0.27 0.64 0.00 -3.12 0.00 0.00 179.24 176.24 1v5l h ALA 69 N 0.43 2.07 -0.86 3.45 0.00 -0.61 0.16 119.26 123.90 1v5l h ALA 69 Ca 0.02 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1v5l h ALA 69 Cb 0.38 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1v5l h ALA 69 CO -0.09 -0.44 0.45 1.96 0.00 0.00 0.00 179.25 181.13 1v5l h GLN 70 N 0.50 1.21 0.00 0.00 1.08 -0.92 -0.37 115.11 116.60 1v5l h GLN 70 Ca 0.57 -0.15 0.00 0.00 -1.45 0.00 0.00 58.65 57.61 1v5l h GLN 70 Cb 1.27 -0.23 0.00 0.00 -0.05 0.00 0.00 27.48 28.47 1v5l h GLN 70 CO -0.30 0.90 0.00 -0.44 -0.95 0.00 0.00 178.83 178.04 1v5l h ASP 71 N 1.20 0.00 0.12 1.46 5.19 -0.43 -0.22 116.42 123.74 1v5l h ASP 71 Ca 0.30 0.00 -0.36 0.00 -0.62 0.00 0.00 57.03 56.35 1v5l h ASP 71 Cb 0.06 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.51 1v5l h ASP 71 CO -0.05 0.00 -2.21 0.54 -3.12 0.00 0.00 179.24 174.41 1v5l n ARG 72 N -2.37 0.68 0.03 3.56 3.00 -0.44 -3.37 116.66 117.75 1v5l n ARG 72 Ca 0.00 0.15 -0.18 0.00 -0.01 0.00 0.00 57.85 57.82 1v5l n ARG 72 Cb 0.15 -1.61 -0.08 0.00 0.00 0.00 0.00 32.46 30.92 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 1.30 -0.19 0.55 2.04 -0.71 -1.00 117.51 119.52 1v5l h ILE 73 Ca -0.48 -2.20 -0.20 0.00 1.00 0.00 0.00 64.86 62.97 1v5l h ILE 73 Cb 2.05 2.28 0.01 0.00 -0.74 0.00 0.00 36.82 40.42 1v5l h ILE 73 CO 0.01 0.68 -0.68 0.07 0.00 0.00 0.00 178.15 178.24 1v5l h LYS 74 N 0.41 0.79 -0.67 2.37 2.10 -1.25 -3.10 116.57 117.22 1v5l h LYS 74 Ca -0.10 -0.60 0.00 0.00 -2.00 0.00 0.00 60.65 57.95 1v5l h LYS 74 Cb 1.60 0.11 0.00 0.00 -0.90 0.00 0.00 32.23 33.04 1v5l h LYS 74 CO 0.19 1.22 0.00 0.00 -2.00 0.00 0.00 179.45 178.85 1v5l n ALA 75 N -2.59 3.57 -0.71 0.07 0.00 -1.22 -4.97 120.51 114.65 1v5l n ALA 75 Ca -0.07 -1.51 -0.05 0.00 0.00 0.00 0.00 53.44 51.81 1v5l n ALA 75 Cb 0.69 -1.10 0.09 0.00 0.00 0.00 0.00 19.45 19.14 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 0.53 -1.61 -2.68 0.00 0.00 -0.38 -4.95 120.51 111.41 1v5l n ALA 76 Ca 0.22 -0.47 -0.31 0.00 0.00 0.00 0.00 53.44 52.88 1v5l n ALA 76 Cb 0.99 -0.04 -0.07 0.00 0.00 0.00 0.00 19.45 20.33 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 -1.92 4.19 0.37 0.00 0.01 -1.26 -4.98 113.70 110.11 1v5l s SER 77 Ca 0.20 -1.55 0.29 0.00 1.31 0.00 0.00 55.95 56.20 1v5l s SER 77 Cb -0.04 0.38 1.25 0.00 0.21 0.00 0.00 66.02 67.82 1v5l s SER 77 CO 0.17 -0.83 1.28 0.00 0.41 0.00 0.00 173.24 174.26 1v5l n TYR 78 N -1.30 0.49 -4.10 2.43 9.36 -1.26 -3.95 117.16 118.83 1v5l n TYR 78 Ca -0.15 0.50 -0.19 0.00 3.32 0.00 0.00 57.90 61.38 1v5l n TYR 78 Cb 0.67 -0.91 -0.16 0.00 -0.63 0.00 0.00 39.34 38.30 1v5l n TYR 78 CO 0.00 0.00 0.00 1.14 0.22 0.00 0.00 176.86 178.22 1v5l s GLN 79 N -4.88 0.70 -0.05 2.98 -2.07 -1.26 0.53 119.66 115.61 1v5l s GLN 79 Ca -0.06 -0.06 -0.19 0.00 -1.82 0.00 0.00 55.36 53.24 1v5l s GLN 79 Cb 0.25 -0.76 -0.05 0.00 -1.09 0.00 0.00 33.01 31.36 1v5l s GLN 79 CO 0.68 -0.10 0.52 -1.17 -1.32 0.00 0.00 175.29 173.90 1v5l s LEU 80 N 0.96 4.37 -0.29 2.60 2.96 -0.76 -4.94 118.68 123.58 1v5l s LEU 80 Ca -0.11 1.00 -0.01 0.00 -0.22 0.00 0.00 54.13 54.79 1v5l s LEU 80 Cb -0.14 -2.78 0.05 0.00 0.50 0.00 0.00 46.19 43.81 1v5l s LEU 80 CO -0.00 0.10 -0.02 0.00 -1.32 0.00 0.00 176.35 175.10 1v5l s LEU 82 N 1.24 3.02 -0.40 0.00 1.43 -0.12 0.19 118.68 124.04 1v5l s LEU 82 Ca -0.05 -1.03 -0.24 0.00 -1.03 0.00 0.00 54.13 51.78 1v5l s LEU 82 Cb -0.19 -1.57 0.02 0.00 0.03 0.00 0.00 46.19 44.47 1v5l s LEU 82 CO -0.02 -0.12 0.81 -0.75 0.23 0.00 0.00 176.35 176.50 1v5l s LYS 83 N 1.22 3.62 0.51 1.70 2.20 -0.29 -2.60 119.74 126.10 1v5l s LYS 83 Ca -0.02 0.18 -0.00 0.00 -0.36 0.00 0.00 55.97 55.76 1v5l s LYS 83 Cb -0.17 -3.86 0.01 0.00 -1.51 0.00 0.00 37.83 32.30 1v5l s LYS 83 CO -0.07 -0.98 0.74 0.96 -0.36 0.00 0.00 175.35 175.64 1v5l s ILE 84 N 3.26 3.46 -0.07 5.43 -4.36 -0.30 0.34 121.20 128.95 1v5l s ILE 84 Ca 0.32 -0.49 0.14 0.00 -0.26 0.00 0.00 60.65 60.36 1v5l s ILE 84 Cb -0.12 -3.30 -0.20 0.00 1.25 0.00 0.00 42.46 40.08 1v5l s ILE 84 CO 0.20 -0.23 0.71 -0.90 0.24 0.00 0.00 174.94 174.96 1v5l n ASP 85 N -2.25 0.87 -3.13 4.36 5.75 -0.95 -2.74 116.55 118.45 1v5l n ASP 85 Ca 0.04 0.40 -0.18 0.00 -0.01 0.00 0.00 54.79 55.04 1v5l n ASP 85 Cb 0.58 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.75 1v5l n ASP 85 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1v5l n ARG 86 N -3.00 -6.41 -2.39 0.11 3.00 -1.26 -4.67 116.66 102.04 1v5l n ARG 86 Ca -0.15 0.72 -0.43 0.00 -0.00 0.00 0.00 57.85 57.99 1v5l n ARG 86 Cb 0.99 -5.40 -0.02 0.00 0.00 0.00 0.00 32.46 28.03 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 -3.29 3.22 0.22 5.13 0.00 -1.26 -4.90 121.76 120.88 1v5l s ALA 87 Ca 0.31 -0.02 -0.08 0.00 0.00 0.00 0.00 51.96 52.17 1v5l s ALA 87 Cb -0.14 -3.85 0.17 0.00 0.00 0.00 0.00 23.12 19.30 1v5l s ALA 87 CO 0.63 -2.06 1.82 1.05 0.00 0.00 0.00 175.76 177.19 1v5l h GLU 88 N 9.92 1.18 0.00 0.00 4.11 -1.98 -3.31 114.58 124.50 1v5l h GLU 88 Ca -0.27 -0.17 0.00 0.00 0.07 0.00 0.00 59.36 59.00 1v5l h GLU 88 Cb 1.10 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1v5l h GLU 88 CO 1.06 0.90 -0.99 2.41 0.07 0.00 0.00 179.01 182.46 1v5l n THR 89 N -4.35 0.00 -3.36 -1.06 -1.04 -1.26 -5.04 114.28 98.18 1v5l n THR 89 Ca 0.08 -0.05 -0.17 0.00 -2.04 0.00 0.00 64.05 61.87 1v5l n THR 89 Cb 0.13 0.50 0.08 0.00 -1.82 0.00 0.00 70.33 69.22 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 -1.51 -6.41 0.00 -2.82 1.74 -1.25 -4.90 116.66 101.52 1v5l n ARG 90 Ca -0.00 0.76 0.00 0.00 -0.77 0.00 0.00 57.85 57.84 1v5l n ARG 90 Cb 0.02 -5.56 0.00 0.00 -1.02 0.00 0.00 32.46 25.91 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 -4.08 0.44 -4.57 0.55 7.94 -1.26 -4.84 117.00 111.17 1v5l n LEU 91 Ca -0.18 0.00 -0.43 0.00 -1.11 0.00 0.00 56.01 54.30 1v5l n LEU 91 Cb 0.62 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.54 1v5l n LEU 91 CO 0.56 -0.10 0.93 0.86 -1.11 0.00 0.00 177.39 178.53 1v5l s TRP 92 N -1.62 2.77 -1.03 1.96 -0.11 -1.26 -4.28 118.94 115.37 1v5l s TRP 92 Ca 0.00 0.41 -0.09 0.00 1.22 0.00 0.00 56.10 57.63 1v5l s TRP 92 Cb 0.00 -4.29 0.01 0.00 -1.50 0.00 0.00 33.47 27.70 1v5l s TRP 92 CO 0.00 -1.35 0.17 -1.13 -4.62 0.00 0.00 176.95 170.03 1v5l n SER 93 N 7.80 -0.58 0.08 5.86 3.41 -1.26 -4.75 113.62 124.18 1v5l n SER 93 Ca 0.08 -0.93 0.10 0.00 -0.26 0.00 0.00 58.87 57.86 1v5l n SER 93 Cb 0.49 -1.14 0.41 0.00 -0.26 0.00 0.00 64.21 63.71 1v5l n SER 93 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1v5l n PRO 94 N -3.70 0.11 -0.72 4.33 -0.04 -1.26 -3.08 135.00 130.64 1v5l n PRO 94 Ca -0.18 0.36 -0.13 0.00 -0.04 0.00 0.00 63.50 63.50 1v5l n PRO 94 Cb 0.47 -1.72 0.05 0.00 -0.04 0.00 0.00 33.50 32.26 1v5l n PRO 94 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1v5l n GLN 95 N -1.93 1.65 -3.64 0.54 6.02 -1.26 -4.81 117.38 113.94 1v5l n GLN 95 Ca 0.03 -1.38 -0.05 0.00 -0.01 0.00 0.00 57.00 55.59 1v5l n GLN 95 Cb 0.20 -1.54 -0.07 0.00 1.02 0.00 0.00 30.24 29.86 1v5l n GLN 95 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1v5l s VAL 96 N -1.81 0.00 -0.24 5.09 0.11 -1.18 -5.07 120.40 117.30 1v5l s VAL 96 Ca 0.27 0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 59.26 1v5l s VAL 96 Cb 0.22 -1.00 -0.17 0.00 -1.53 0.00 0.00 36.38 33.89 1v5l s VAL 96 CO 0.02 0.00 -0.14 -1.54 -3.33 0.00 0.00 175.10 170.11 1v5l n SER 97 N 1.62 1.99 -3.96 3.54 3.41 -1.26 -4.95 113.62 114.00 1v5l n SER 97 Ca -0.10 0.08 -0.20 0.00 -0.26 0.00 0.00 58.87 58.40 1v5l n SER 97 Cb 0.57 -0.63 -0.16 0.00 -0.26 0.00 0.00 64.21 63.73 1v5l n SER 97 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1v5l s SER 98 N -6.89 1.10 0.00 4.04 0.01 -1.26 -0.32 113.70 110.38 1v5l s SER 98 Ca -0.34 -0.17 0.00 0.00 1.31 0.00 0.00 55.95 56.76 1v5l s SER 98 Cb 0.10 -0.37 0.00 0.00 0.21 0.00 0.00 66.02 65.96 1v5l s SER 98 CO 0.60 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.88 1v5l n GLY 99 N 3.53 5.12 3.75 3.44 0.00 -1.21 -4.98 105.19 114.85 1v5l n GLY 99 Ca -0.20 -1.27 -0.41 0.00 0.00 0.00 0.00 46.02 44.14 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 1.37 4.43 -0.05 1.61 0.04 -1.26 -4.86 135.00 136.29 1v5l s PRO 100 Ca 0.00 2.05 0.02 0.00 0.04 0.00 0.00 61.00 63.11 1v5l s PRO 100 Cb 0.00 -3.15 0.01 0.00 0.04 0.00 0.00 34.50 31.40 1v5l s PRO 100 CO 0.00 -0.13 -0.10 -1.54 0.04 0.00 0.00 177.00 175.27 1v5l s SER 101 N -0.19 1.47 -1.00 6.66 1.04 -1.26 -4.79 113.70 115.64 1v5l s SER 101 Ca 0.51 -0.24 -0.05 0.00 0.48 0.00 0.00 55.95 56.65 1v5l s SER 101 Cb -0.36 -0.65 0.01 0.00 0.10 0.00 0.00 66.02 65.11 1v5l s SER 101 CO 0.44 0.02 0.86 -0.24 0.98 0.00 0.00 173.24 175.30 1v5l n SER 102 N 3.78 -4.66 0.00 7.02 2.88 -1.26 -5.10 113.62 116.27 1v5l n SER 102 Ca -0.23 -0.42 0.00 0.00 -1.33 0.00 0.00 58.87 56.89 1v5l n SER 102 Cb 0.52 -3.91 0.00 0.00 -0.75 0.00 0.00 64.21 60.06 1v5l n SER 102 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42