#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b4v s LEU 2 N 0.00 3.73 -0.03 0.99 1.43 -1.26 -4.98 118.68 118.55 3b4v s LEU 2 Ca 0.00 -0.39 0.03 0.00 -1.03 0.00 0.00 54.13 52.74 3b4v s LEU 2 Cb 0.00 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.65 3b4v s LEU 2 CO 0.00 -0.59 -0.12 -1.83 0.23 0.00 0.00 176.35 174.04 3b4v s GLU 3 N -4.23 1.25 1.16 1.70 4.04 -1.26 -3.13 118.70 118.23 3b4v s GLU 3 Ca 0.49 -0.41 -0.19 0.00 0.04 0.00 0.00 54.97 54.91 3b4v s GLU 3 Cb -0.09 -1.13 0.27 0.00 0.02 0.00 0.00 34.13 33.21 3b4v s GLU 3 CO 0.31 0.15 1.14 0.00 -1.84 0.00 0.00 175.26 175.02 3b4v n GLY 6 N -1.37 0.00 3.84 0.00 0.00 -1.26 -5.01 105.19 101.39 3b4v n GLY 6 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3b4v n GLY 6 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3b4v n LYS 7 N 0.00 -0.10 -3.25 1.61 5.02 -1.26 -4.89 118.16 115.29 3b4v n LYS 7 Ca 0.00 0.03 -0.42 0.00 -2.02 0.00 0.00 58.31 55.89 3b4v n LYS 7 Cb 0.00 -4.33 -0.01 0.00 -0.02 0.00 0.00 35.03 30.68 3b4v n LYS 7 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3b4v n VAL 8 N -2.01 4.59 1.74 -0.18 0.31 -1.26 -4.81 118.33 116.72 3b4v n VAL 8 Ca 0.00 -5.57 0.04 0.00 -0.01 0.00 0.00 64.34 58.80 3b4v n VAL 8 Cb 0.03 -2.34 0.25 0.00 -0.91 0.00 0.00 33.84 30.87 3b4v n VAL 8 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3b4v n ASN 9 N 1.99 0.00 -4.86 4.52 6.94 -1.26 -4.82 115.26 117.77 3b4v n ASN 9 Ca 0.25 -1.48 -0.33 0.00 -0.02 0.00 0.00 54.58 53.00 3b4v n ASN 9 Cb 0.36 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.73 3b4v n ASN 9 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3b4v s ILE 10 N -2.00 4.85 -0.45 1.53 1.09 -1.26 -1.00 121.20 123.96 3b4v s ILE 10 Ca 0.13 0.67 -0.40 0.00 -1.10 0.00 0.00 60.65 59.95 3b4v s ILE 10 Cb 0.06 -3.64 -0.17 0.00 -1.06 0.00 0.00 42.46 37.64 3b4v s ILE 10 CO 0.10 -0.04 1.90 0.00 -0.10 0.00 0.00 174.94 176.79 3b4v s LYS 13 N -3.88 4.05 -0.15 0.00 2.20 -1.18 -1.73 119.74 119.03 3b4v s LYS 13 Ca 0.09 0.89 -0.08 0.00 -0.36 0.00 0.00 55.97 56.50 3b4v s LYS 13 Cb 0.03 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.59 3b4v s LYS 13 CO -0.07 -0.76 0.14 0.21 -0.36 0.00 0.00 175.35 174.51 3b4v s LYS 14 N 3.27 3.76 0.21 4.03 2.47 0.12 -3.06 119.74 130.54 3b4v s LYS 14 Ca 0.39 -0.16 -0.30 0.00 -1.56 0.00 0.00 55.97 54.34 3b4v s LYS 14 Cb -0.13 -3.29 -0.08 0.00 -1.46 0.00 0.00 37.83 32.86 3b4v s LYS 14 CO 0.13 0.57 1.18 -0.65 0.16 0.00 0.00 175.35 176.74 3b4v s GLN 15 N -0.44 4.51 -0.22 4.03 -1.52 -1.26 -1.08 119.66 123.68 3b4v s GLN 15 Ca 0.12 1.87 -0.08 0.00 -1.95 0.00 0.00 55.36 55.33 3b4v s GLN 15 Cb -0.12 -3.22 0.10 0.00 -0.22 0.00 0.00 33.01 29.55 3b4v s GLN 15 CO 0.02 -0.03 0.47 0.12 -0.25 0.00 0.00 175.29 175.62 3b4v s PHE 16 N -0.31 -0.92 0.04 0.91 5.36 -1.26 -4.85 117.98 116.94 3b4v s PHE 16 Ca 0.51 1.71 -0.22 0.00 -0.96 0.00 0.00 56.93 57.98 3b4v s PHE 16 Cb -0.33 0.42 -0.06 0.00 -0.34 0.00 0.00 43.02 42.72 3b4v s PHE 16 CO 0.38 -0.52 0.64 0.12 -1.46 0.00 0.00 175.22 174.38 3b4v s PHE 17 N 2.66 3.74 -0.07 10.12 5.36 -1.26 -1.35 117.98 137.18 3b4v s PHE 17 Ca -0.03 1.31 0.04 0.00 -0.96 0.00 0.00 56.93 57.29 3b4v s PHE 17 Cb -0.12 -2.64 -0.02 0.00 -0.34 0.00 0.00 43.02 39.90 3b4v s PHE 17 CO -0.14 0.40 -0.19 0.08 -1.46 0.00 0.00 175.22 173.91 3b4v s VAL 18 N -0.45 2.63 -0.24 3.12 1.01 0.22 -4.92 120.40 121.77 3b4v s VAL 18 Ca 0.32 -0.86 -0.05 0.00 0.00 0.00 0.00 61.98 61.40 3b4v s VAL 18 Cb -0.19 -2.02 -0.00 0.00 0.00 0.00 0.00 36.38 34.17 3b4v s VAL 18 CO 0.20 0.57 -0.01 -0.55 0.00 0.00 0.00 175.10 175.31 3b4v s SER 19 N -0.30 4.56 0.54 3.32 0.15 -1.26 -0.75 113.70 119.96 3b4v s SER 19 Ca 0.01 -0.50 0.29 0.00 0.70 0.00 0.00 55.95 56.45 3b4v s SER 19 Cb -0.13 -1.78 1.57 0.00 -1.71 0.00 0.00 66.02 63.98 3b4v s SER 19 CO 0.03 -0.07 2.12 -0.26 1.20 0.00 0.00 173.24 176.26 3b4v h PHE 20 N 8.14 0.00 -0.23 3.44 0.05 -1.71 -1.00 116.94 125.63 3b4v h PHE 20 Ca -0.38 0.00 -0.03 0.00 3.82 0.00 0.00 57.97 61.38 3b4v h PHE 20 Cb 1.15 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 39.09 3b4v h PHE 20 CO 0.60 0.08 0.03 -0.22 -0.18 0.00 0.00 178.31 178.63 3b4v h LYS 21 N 0.00 0.38 -0.56 1.51 3.64 -1.93 0.30 116.57 119.91 3b4v h LYS 21 Ca -0.00 -0.10 0.01 0.00 -1.27 0.00 0.00 60.65 59.29 3b4v h LYS 21 Cb 0.25 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 3b4v h LYS 21 CO 0.01 0.52 0.36 -0.44 -2.27 0.00 0.00 179.45 177.63 3b4v h ASP 22 N 0.18 0.61 0.56 4.20 3.32 -1.59 -2.39 116.42 121.31 3b4v h ASP 22 Ca 0.07 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.05 3b4v h ASP 22 Cb 0.33 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3b4v h ASP 22 CO 0.00 0.44 -0.29 0.40 -1.72 0.00 0.00 179.24 178.07 3b4v h ILE 23 N 0.73 0.89 0.00 0.35 2.04 -1.38 -3.47 117.51 116.67 3b4v h ILE 23 Ca 0.21 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.94 3b4v h ILE 23 Cb -0.06 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.70 3b4v h ILE 23 CO -0.06 0.28 0.00 0.61 0.00 0.00 0.00 178.15 178.98 3b4v n GLY 24 N -0.26 1.06 0.52 5.37 0.00 -0.51 -5.00 105.19 106.37 3b4v n GLY 24 Ca -0.01 -0.27 0.05 0.00 0.00 0.00 0.00 46.02 45.79 3b4v n GLY 24 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3b4v n TRP 25 N -2.12 0.24 0.99 1.61 8.01 0.92 -4.70 117.44 122.39 3b4v n TRP 25 Ca 0.00 -0.28 0.12 0.00 -1.31 0.00 0.00 57.50 56.03 3b4v n TRP 25 Cb 0.04 -0.02 0.56 0.00 -2.01 0.00 0.00 31.31 29.88 3b4v n TRP 25 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.69 176.95 3b4v n ASN 26 N 0.52 0.00 0.06 -0.99 6.94 -1.06 -2.16 115.26 118.58 3b4v n ASN 26 Ca 0.09 0.18 -0.16 0.00 -0.02 0.00 0.00 54.58 54.67 3b4v n ASN 26 Cb 0.35 -0.38 -0.14 0.00 -2.36 0.00 0.00 39.78 37.25 3b4v n ASN 26 CO 0.00 0.00 0.00 -2.24 -1.03 0.00 0.00 177.26 173.99 3b4v h ASP 27 N 0.00 0.35 0.45 0.53 2.03 -1.90 -3.36 116.42 114.51 3b4v h ASP 27 Ca 0.00 -0.47 -0.31 0.00 -0.73 0.00 0.00 57.03 55.52 3b4v h ASP 27 Cb 0.30 -0.11 0.01 0.00 -0.83 0.00 0.00 39.33 38.70 3b4v h ASP 27 CO 0.00 1.39 -1.42 -0.50 -1.03 0.00 0.00 179.24 177.69 3b4v h TRP 28 N 0.06 0.66 -3.56 4.15 4.06 -1.87 -3.44 115.95 116.01 3b4v h TRP 28 Ca -0.22 -0.48 -0.68 0.00 2.06 0.00 0.00 58.89 59.56 3b4v h TRP 28 Cb 2.00 -0.03 -0.18 0.00 -1.00 0.00 0.00 29.16 29.95 3b4v h TRP 28 CO 0.06 1.42 -0.16 0.42 -3.56 0.00 0.00 178.44 176.62 3b4v s ILE 29 N -2.62 5.05 0.02 1.49 1.01 -0.92 -1.03 121.20 124.20 3b4v s ILE 29 Ca -0.07 -0.21 -0.21 0.00 0.00 0.00 0.00 60.65 60.15 3b4v s ILE 29 Cb 0.06 -4.04 -0.17 0.00 0.01 0.00 0.00 42.46 38.32 3b4v s ILE 29 CO 0.90 -0.41 1.26 0.40 0.00 0.00 0.00 174.94 177.08 3b4v h ILE 30 N 5.73 1.39 -2.20 2.92 2.04 -0.88 -3.43 117.51 123.08 3b4v h ILE 30 Ca -0.27 -1.53 -0.06 0.00 1.00 0.00 0.00 64.86 64.00 3b4v h ILE 30 Cb 1.11 2.12 -0.21 0.00 -0.74 0.00 0.00 36.82 39.10 3b4v h ILE 30 CO 0.80 0.44 0.05 0.00 0.00 0.00 0.00 178.15 179.44 3b4v s ALA 31 N -3.95 -1.58 0.86 1.87 0.00 -1.04 -4.61 121.76 113.30 3b4v s ALA 31 Ca -0.14 1.61 -0.13 0.00 0.00 0.00 0.00 51.96 53.30 3b4v s ALA 31 Cb 0.04 -0.75 0.12 0.00 0.00 0.00 0.00 23.12 22.54 3b4v s ALA 31 CO 0.76 -0.32 1.22 -1.25 0.00 0.00 0.00 175.76 176.18 3b4v s PRO 32 N -0.11 1.50 0.35 0.00 0.04 -1.26 -0.39 135.00 135.14 3b4v s PRO 32 Ca -0.03 -0.04 0.27 0.00 0.04 0.00 0.00 61.00 61.24 3b4v s PRO 32 Cb -0.03 -1.91 1.00 0.00 0.04 0.00 0.00 34.50 33.59 3b4v s PRO 32 CO 0.03 -1.89 1.79 0.66 0.04 0.00 0.00 177.00 177.64 3b4v h SER 33 N -1.27 0.00 0.00 6.66 4.64 -1.91 -3.48 113.55 118.20 3b4v h SER 33 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3b4v h SER 33 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 3b4v h SER 33 CO 0.57 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.14 3b4v n GLY 34 N 0.35 -1.36 3.64 -0.77 0.00 -1.26 -1.78 105.19 104.00 3b4v n GLY 34 Ca 0.02 -1.05 -0.06 0.00 0.00 0.00 0.00 46.02 44.93 3b4v n GLY 34 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3b4v s TYR 35 N -2.02 -0.24 -0.77 1.61 1.13 0.07 -4.95 117.35 112.19 3b4v s TYR 35 Ca 0.00 -0.00 -0.23 0.00 -1.41 0.00 0.00 57.07 55.43 3b4v s TYR 35 Cb 0.00 0.60 0.07 0.00 -1.10 0.00 0.00 41.96 41.53 3b4v s TYR 35 CO 0.00 -0.73 1.10 -1.01 -2.51 0.00 0.00 175.55 172.40 3b4v s HIS 36 N -3.27 2.69 0.10 -3.49 3.76 -1.26 0.68 115.29 114.51 3b4v s HIS 36 Ca 0.09 -0.68 0.07 0.00 -0.15 0.00 0.00 55.06 54.40 3b4v s HIS 36 Cb -0.01 -4.39 -0.21 0.00 1.11 0.00 0.00 32.58 29.08 3b4v s HIS 36 CO -0.03 -1.72 1.21 0.00 -0.85 0.00 0.00 174.74 173.36 3b4v h ALA 37 N 9.51 0.39 -3.32 -1.40 0.00 -1.50 -3.45 119.26 119.50 3b4v h ALA 37 Ca -0.14 -0.97 0.36 0.00 0.00 0.00 0.00 54.91 54.16 3b4v h ALA 37 Cb 1.05 -0.09 -0.14 0.00 0.00 0.00 0.00 17.79 18.61 3b4v h ALA 37 CO 1.21 1.28 -0.87 0.09 0.00 0.00 0.00 179.25 180.97 3b4v n ASN 38 N -3.32 -8.45 -3.75 0.00 3.02 -0.83 -2.04 115.26 99.89 3b4v n ASN 38 Ca -0.02 0.99 -0.10 0.00 -0.03 0.00 0.00 54.58 55.42 3b4v n ASN 38 Cb 0.95 -4.61 -0.05 0.00 -0.61 0.00 0.00 39.78 35.47 3b4v n ASN 38 CO 0.00 0.00 0.00 -0.72 -2.62 0.00 0.00 177.26 173.92 3b4v s TYR 39 N -3.23 -0.03 -0.14 3.10 -0.85 -0.24 -4.68 117.35 111.29 3b4v s TYR 39 Ca 0.00 -0.32 -0.12 0.00 -0.52 0.00 0.00 57.07 56.11 3b4v s TYR 39 Cb 0.00 0.23 -0.05 0.00 0.38 0.00 0.00 41.96 42.52 3b4v s TYR 39 CO 0.00 -0.78 0.26 0.00 -1.52 0.00 0.00 175.55 173.51 3b4v s GLU 41 N -0.03 0.67 0.00 0.00 2.12 -0.71 -4.82 118.70 115.93 3b4v s GLU 41 Ca 0.16 0.04 0.00 0.00 0.36 0.00 0.00 54.97 55.53 3b4v s GLU 41 Cb -0.13 0.31 0.00 0.00 0.26 0.00 0.00 34.13 34.57 3b4v s GLU 41 CO 0.04 -0.17 0.00 0.41 -0.54 0.00 0.00 175.26 175.00 3b4v n GLY 42 N 1.60 2.56 3.73 -1.50 0.00 -1.26 -0.58 105.19 109.75 3b4v n GLY 42 Ca -0.19 -1.85 -0.41 0.00 0.00 0.00 0.00 46.02 43.57 3b4v n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3b4v s GLU 43 N -1.73 4.60 0.35 1.61 8.01 -0.17 -4.23 118.70 127.14 3b4v s GLU 43 Ca 0.00 1.66 0.08 0.00 0.01 0.00 0.00 54.97 56.72 3b4v s GLU 43 Cb 0.00 -3.31 -0.04 0.00 -4.31 0.00 0.00 34.13 26.48 3b4v s GLU 43 CO 0.00 0.08 0.20 0.00 0.01 0.00 0.00 175.26 175.54 3b4v s PRO 45 N -3.91 4.27 0.00 0.00 0.02 -1.26 -4.97 135.00 129.15 3b4v s PRO 45 Ca 0.39 2.16 0.00 0.00 0.02 0.00 0.00 61.00 63.57 3b4v s PRO 45 Cb -0.03 -2.98 0.00 0.00 0.02 0.00 0.00 34.50 31.51 3b4v s PRO 45 CO 0.24 -0.24 0.00 -1.13 -0.33 0.00 0.00 177.00 175.54 3b4v n SER 46 N 0.62 0.49 0.24 2.53 3.41 -1.26 -4.56 113.62 115.09 3b4v n SER 46 Ca 0.01 -0.21 0.11 0.00 -0.26 0.00 0.00 58.87 58.52 3b4v n SER 46 Cb 0.43 0.00 0.62 0.00 -0.26 0.00 0.00 64.21 65.00 3b4v n SER 46 CO 0.00 0.00 0.00 1.12 -0.16 0.00 0.00 175.04 176.00 3b4v h HIS 47 N 0.21 0.00 -2.75 7.33 2.07 -2.02 -3.43 115.15 116.57 3b4v h HIS 47 Ca 0.00 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.99 3b4v h HIS 47 Cb 0.00 0.00 0.03 0.00 2.57 0.00 0.00 27.41 30.01 3b4v h HIS 47 CO 0.00 0.17 0.95 0.42 -3.07 0.00 0.00 177.93 176.40 3b4v s ILE 48 N -4.06 2.99 -0.01 6.12 1.01 -1.26 -4.93 121.20 121.05 3b4v s ILE 48 Ca -0.02 0.53 -0.30 0.00 0.00 0.00 0.00 60.65 60.86 3b4v s ILE 48 Cb 0.13 -3.34 -0.06 0.00 0.01 0.00 0.00 42.46 39.19 3b4v s ILE 48 CO 0.61 0.01 1.64 0.00 0.00 0.00 0.00 174.94 177.20 3b4v s ALA 49 N 2.20 3.63 0.27 9.38 0.00 -1.26 -5.01 121.76 130.97 3b4v s ALA 49 Ca 0.72 1.02 0.12 0.00 0.00 0.00 0.00 51.96 53.82 3b4v s ALA 49 Cb -0.40 -3.72 -0.05 0.00 0.00 0.00 0.00 23.12 18.95 3b4v s ALA 49 CO 0.32 -1.26 -0.20 0.20 0.00 0.00 0.00 175.76 174.82 3b4v s GLY 50 N 2.94 1.85 -0.01 0.00 0.00 -1.26 -5.10 107.32 105.73 3b4v s GLY 50 Ca 0.73 -1.86 0.03 0.00 0.00 0.00 0.00 44.72 43.63 3b4v s GLY 50 CO 0.30 -1.94 1.02 -0.37 0.00 0.00 0.00 173.10 172.11 3b4v n THR 51 N -0.57 0.21 0.00 0.90 5.66 -1.26 -5.09 114.28 114.12 3b4v n THR 51 Ca -0.05 -0.30 0.00 0.00 -3.05 0.00 0.00 64.05 60.65 3b4v n THR 51 Cb 0.60 0.44 0.00 0.00 -1.55 0.00 0.00 70.33 69.82 3b4v n THR 51 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3b4v n GLY 53 N -0.13 2.51 3.85 1.09 0.00 -1.26 -5.14 105.19 106.11 3b4v n GLY 53 Ca 0.02 -2.07 -0.37 0.00 0.00 0.00 0.00 46.02 43.60 3b4v n GLY 53 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3b4v s SER 54 N 0.00 6.73 -0.58 1.61 0.15 -1.26 -5.04 113.70 115.32 3b4v s SER 54 Ca 0.00 0.88 -0.25 0.00 0.70 0.00 0.00 55.95 57.28 3b4v s SER 54 Cb 0.00 -2.22 0.04 0.00 -1.71 0.00 0.00 66.02 62.14 3b4v s SER 54 CO 0.00 0.31 0.99 -0.55 1.20 0.00 0.00 173.24 175.20 3b4v s SER 55 N -1.17 6.33 0.39 5.45 0.15 -1.26 -4.86 113.70 118.72 3b4v s SER 55 Ca 0.24 -0.37 -0.24 0.00 0.70 0.00 0.00 55.95 56.29 3b4v s SER 55 Cb -0.16 -2.46 -0.09 0.00 -1.71 0.00 0.00 66.02 61.60 3b4v s SER 55 CO 0.13 -1.31 1.01 -0.76 1.20 0.00 0.00 173.24 173.51 3b4v s LEU 56 N 4.18 4.13 1.18 3.45 1.43 -1.26 -4.76 118.68 127.02 3b4v s LEU 56 Ca 0.31 1.94 -0.16 0.00 -1.03 0.00 0.00 54.13 55.19 3b4v s LEU 56 Cb -0.12 -4.22 0.27 0.00 0.03 0.00 0.00 46.19 42.15 3b4v s LEU 56 CO 0.19 -0.41 1.05 -0.94 0.23 0.00 0.00 176.35 176.47 3b4v s SER 57 N -1.69 1.04 0.15 2.29 1.04 -1.26 -4.78 113.70 110.50 3b4v s SER 57 Ca 0.57 1.03 -0.19 0.00 0.48 0.00 0.00 55.95 57.85 3b4v s SER 57 Cb -0.19 -1.56 0.04 0.00 0.10 0.00 0.00 66.02 64.42 3b4v s SER 57 CO 0.24 -4.09 1.68 0.15 0.98 0.00 0.00 173.24 172.20 3b4v h PHE 58 N -2.55 -0.20 -0.51 5.02 3.57 -1.99 -1.35 116.94 118.93 3b4v h PHE 58 Ca -0.52 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 60.92 3b4v h PHE 58 Cb 1.33 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 40.18 3b4v h PHE 58 CO -1.02 -0.15 -0.03 1.25 -2.23 0.00 0.00 178.31 176.13 3b4v h HIS 59 N -0.02 0.95 0.00 0.41 2.76 -1.99 -1.20 115.15 116.06 3b4v h HIS 59 Ca 0.15 -0.15 -0.09 0.00 -2.20 0.00 0.00 60.37 58.07 3b4v h HIS 59 Cb 0.25 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 28.95 3b4v h HIS 59 CO -0.30 0.88 -0.45 0.77 -1.30 0.00 0.00 177.93 177.52 3b4v h SER 60 N 0.80 0.00 -0.35 3.26 0.02 -1.82 -1.51 113.55 113.96 3b4v h SER 60 Ca 0.15 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.96 3b4v h SER 60 Cb 0.53 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 3b4v h SER 60 CO 0.03 0.45 -0.31 0.74 -1.14 0.00 0.00 176.83 176.60 3b4v h THR 61 N 0.00 1.29 -0.12 -2.27 2.02 -0.41 0.12 112.91 113.53 3b4v h THR 61 Ca -0.00 -1.47 0.01 0.00 0.77 0.00 0.00 66.41 65.71 3b4v h THR 61 Cb 0.88 1.45 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 3b4v h THR 61 CO 0.06 0.48 0.06 0.58 0.37 0.00 0.00 175.52 177.07 3b4v h VAL 62 N 0.60 1.00 0.10 3.16 2.07 -1.04 -1.18 116.25 120.96 3b4v h VAL 62 Ca 0.06 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 3b4v h VAL 62 Cb 0.88 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 3b4v h VAL 62 CO 0.08 0.02 -0.05 0.40 0.02 0.00 0.00 177.57 178.05 3b4v h ILE 63 N 0.13 0.91 -0.96 4.57 1.08 -1.06 -2.58 117.51 119.61 3b4v h ILE 63 Ca 0.05 -0.01 0.14 0.00 -0.39 0.00 0.00 64.86 64.65 3b4v h ILE 63 Cb 0.00 0.92 -0.08 0.00 -3.07 0.00 0.00 36.82 34.59 3b4v h ILE 63 CO -0.03 0.00 0.61 -1.13 -0.69 0.00 0.00 178.15 176.91 3b4v h ASN 64 N -0.13 0.79 -0.74 1.72 -1.24 -0.61 0.18 115.58 115.55 3b4v h ASN 64 Ca -0.01 0.05 0.14 0.00 0.71 0.00 0.00 56.30 57.19 3b4v h ASN 64 Cb 0.10 -0.10 -0.10 0.00 0.73 0.00 0.00 38.32 38.95 3b4v h ASN 64 CO 0.02 0.39 0.26 -0.74 -1.29 0.00 0.00 177.43 176.07 3b4v h HIS 65 N 0.83 0.43 0.11 0.67 2.76 -0.80 -1.23 115.15 117.92 3b4v h HIS 65 Ca 0.49 0.04 -0.27 0.00 -2.20 0.00 0.00 60.37 58.43 3b4v h HIS 65 Cb 0.65 -0.08 0.01 0.00 1.55 0.00 0.00 27.41 29.54 3b4v h HIS 65 CO -0.00 0.02 -1.19 1.88 -1.30 0.00 0.00 177.93 177.34 3b4v h TYR 66 N 0.38 0.60 -0.49 5.26 -1.99 -0.67 -3.17 116.97 116.90 3b4v h TYR 66 Ca 0.41 -0.40 0.08 0.00 2.00 0.00 0.00 58.73 60.81 3b4v h TYR 66 Cb 0.64 -0.04 -0.07 0.00 2.00 0.00 0.00 36.73 39.27 3b4v h TYR 66 CO -0.19 1.28 0.11 -0.09 -0.00 0.00 0.00 178.16 179.27 3b4v h ARG 67 N 0.13 0.24 0.00 4.88 2.43 -0.62 -2.12 114.38 119.32 3b4v h ARG 67 Ca -0.14 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 3b4v h ARG 67 Cb 1.88 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 31.38 3b4v h ARG 67 CO 0.20 0.16 0.00 -1.33 -1.51 0.00 0.00 179.97 177.49 3b4v n MET 68 N -5.09 0.11 -0.53 0.20 2.81 -0.51 -3.25 117.12 110.86 3b4v n MET 68 Ca 0.05 0.11 0.05 0.00 -1.81 0.00 0.00 57.70 56.09 3b4v n MET 68 Cb 0.23 -1.50 0.20 0.00 -0.71 0.00 0.00 33.22 31.44 3b4v n MET 68 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3b4v n ARG 69 N -1.42 1.69 -1.59 0.03 1.74 -0.82 -4.97 116.66 111.31 3b4v n ARG 69 Ca 0.07 -3.09 -0.15 0.00 -0.77 0.00 0.00 57.85 53.91 3b4v n ARG 69 Cb 0.23 -1.66 -0.05 0.00 -1.02 0.00 0.00 32.46 29.95 3b4v n ARG 69 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3b4v n GLY 70 N -1.14 1.22 3.73 -0.13 0.00 -1.20 -4.98 105.19 102.68 3b4v n GLY 70 Ca 0.22 -0.30 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 3b4v n GLY 70 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3b4v s HIS 71 N -2.60 3.60 0.24 1.61 5.04 -1.10 -4.89 115.29 117.19 3b4v s HIS 71 Ca 0.00 1.21 -0.05 0.00 -1.54 0.00 0.00 55.06 54.68 3b4v s HIS 71 Cb 0.00 -2.74 -0.05 0.00 0.04 0.00 0.00 32.58 29.83 3b4v s HIS 71 CO 0.00 0.15 0.49 -1.12 -2.34 0.00 0.00 174.74 171.92 3b4v s SER 72 N 0.56 6.47 0.00 9.88 0.01 -1.26 -0.35 113.70 129.00 3b4v s SER 72 Ca 0.35 0.65 0.30 0.00 1.31 0.00 0.00 55.95 58.56 3b4v s SER 72 Cb -0.18 -2.12 1.40 0.00 0.21 0.00 0.00 66.02 65.34 3b4v s SER 72 CO 0.17 -0.10 1.97 -0.81 0.41 0.00 0.00 173.24 174.89 3b4v n PRO 73 N -0.58 0.51 -0.35 12.44 -0.04 -1.26 -4.88 135.00 140.84 3b4v n PRO 73 Ca -0.02 -0.08 0.13 0.00 -0.04 0.00 0.00 63.50 63.49 3b4v n PRO 73 Cb 0.53 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.82 3b4v n PRO 73 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3b4v h PHE 74 N 0.20 1.05 -1.08 0.54 0.04 -1.86 -2.09 116.94 113.74 3b4v h PHE 74 Ca 0.00 0.03 0.31 0.00 2.80 0.00 0.00 57.97 61.12 3b4v h PHE 74 Cb 0.31 -0.31 -0.04 0.00 2.20 0.00 0.00 35.95 38.11 3b4v h PHE 74 CO 0.00 0.21 0.78 0.00 -0.60 0.00 0.00 178.31 178.70 3b4v h ALA 75 N 1.65 3.02 0.00 2.45 0.00 -0.85 -2.24 119.26 123.30 3b4v h ALA 75 Ca 0.58 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.45 3b4v h ALA 75 Cb 0.92 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3b4v h ALA 75 CO -0.39 -1.33 -0.15 0.09 0.00 0.00 0.00 179.25 177.47 3b4v n ASN 76 N -4.21 1.40 -4.19 0.00 3.02 -0.80 -4.87 115.26 105.61 3b4v n ASN 76 Ca 0.23 -2.42 -0.40 0.00 -0.03 0.00 0.00 54.58 51.96 3b4v n ASN 76 Cb 1.14 -0.26 -0.08 0.00 -0.61 0.00 0.00 39.78 39.97 3b4v n ASN 76 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3b4v s LEU 77 N -1.50 5.67 0.88 3.41 1.43 -0.84 -5.10 118.68 122.63 3b4v s LEU 77 Ca 0.15 -2.16 -0.11 0.00 -1.03 0.00 0.00 54.13 50.98 3b4v s LEU 77 Cb 0.13 -1.98 0.13 0.00 0.03 0.00 0.00 46.19 44.49 3b4v s LEU 77 CO 0.01 -0.61 1.17 -0.75 0.23 0.00 0.00 176.35 176.40 3b4v s LYS 78 N 0.99 1.21 -0.11 1.70 2.20 -1.26 -4.92 119.74 119.54 3b4v s LYS 78 Ca 0.09 1.63 -0.28 0.00 -0.36 0.00 0.00 55.97 57.04 3b4v s LYS 78 Cb -0.23 -1.74 -0.01 0.00 -1.51 0.00 0.00 37.83 34.33 3b4v s LYS 78 CO -0.02 -2.51 0.95 0.45 -0.36 0.00 0.00 175.35 173.86 3b4v s SER 79 N -2.49 7.18 0.04 1.43 0.15 -1.26 -4.99 113.70 113.75 3b4v s SER 79 Ca 0.69 1.44 0.01 0.00 0.70 0.00 0.00 55.95 58.80 3b4v s SER 79 Cb -0.25 -2.53 -0.04 0.00 -1.71 0.00 0.00 66.02 61.50 3b4v s SER 79 CO 0.55 -0.41 0.09 0.00 1.20 0.00 0.00 173.24 174.67 3b4v s VAL 82 N 2.98 0.11 0.28 0.00 -7.23 -0.55 -4.69 120.40 111.31 3b4v s VAL 82 Ca 0.39 -1.61 -0.30 0.00 -1.81 0.00 0.00 61.98 58.65 3b4v s VAL 82 Cb -0.15 -1.81 -0.12 0.00 0.56 0.00 0.00 36.38 34.86 3b4v s VAL 82 CO 0.07 -0.50 1.59 -2.65 -0.31 0.00 0.00 175.10 173.30 3b4v n PRO 83 N -0.11 2.65 -0.01 4.82 -0.02 -1.26 -1.32 135.00 139.76 3b4v n PRO 83 Ca -0.09 0.94 0.08 0.00 -2.02 0.00 0.00 63.50 62.42 3b4v n PRO 83 Cb 0.63 -2.72 -0.12 0.00 -0.02 0.00 0.00 33.50 31.27 3b4v n PRO 83 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3b4v n THR 84 N 2.27 0.00 -3.76 3.45 -2.24 0.23 -4.81 114.28 109.42 3b4v n THR 84 Ca 0.09 -0.35 -0.13 0.00 -2.27 0.00 0.00 64.05 61.39 3b4v n THR 84 Cb 0.36 0.18 -0.14 0.00 -2.10 0.00 0.00 70.33 68.63 3b4v n THR 84 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3b4v s LYS 85 N -3.07 0.11 0.35 -0.78 2.20 -1.15 -4.95 119.74 112.45 3b4v s LYS 85 Ca -0.05 0.35 0.09 0.00 -0.36 0.00 0.00 55.97 56.00 3b4v s LYS 85 Cb 0.10 -0.14 -0.07 0.00 -1.51 0.00 0.00 37.83 36.22 3b4v s LYS 85 CO 0.66 -0.14 -0.08 -0.51 -0.36 0.00 0.00 175.35 174.92 3b4v s LEU 86 N 1.02 2.75 0.07 5.43 1.43 -1.26 0.02 118.68 128.13 3b4v s LEU 86 Ca -0.08 -1.23 -0.07 0.00 -1.03 0.00 0.00 54.13 51.73 3b4v s LEU 86 Cb -0.10 -0.98 -0.01 0.00 0.03 0.00 0.00 46.19 45.14 3b4v s LEU 86 CO -0.05 -0.25 0.14 0.00 0.23 0.00 0.00 176.35 176.42 3b4v s ARG 87 N -3.63 0.74 0.89 1.70 1.70 -0.33 -4.81 118.95 115.21 3b4v s ARG 87 Ca 0.33 -0.92 -0.14 0.00 -0.47 0.00 0.00 55.73 54.53 3b4v s ARG 87 Cb 0.04 0.29 0.15 0.00 -0.57 0.00 0.00 34.95 34.86 3b4v s ARG 87 CO 0.17 -0.21 1.25 -1.25 -1.08 0.00 0.00 175.30 174.18 3b4v s PRO 88 N -3.45 1.16 0.00 3.89 0.04 -1.26 -2.17 135.00 133.21 3b4v s PRO 88 Ca 0.02 -0.26 -0.08 0.00 0.04 0.00 0.00 61.00 60.72 3b4v s PRO 88 Cb 0.03 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.67 3b4v s PRO 88 CO -0.09 -2.07 0.15 1.41 0.04 0.00 0.00 177.00 176.44 3b4v s MET 89 N -5.74 0.51 -0.04 4.56 1.75 -0.50 -4.81 119.30 115.03 3b4v s MET 89 Ca 0.69 -0.39 -0.30 0.00 -1.25 0.00 0.00 55.69 54.44 3b4v s MET 89 Cb -0.06 0.21 -0.03 0.00 2.84 0.00 0.00 34.83 37.79 3b4v s MET 89 CO 0.51 -0.12 1.07 0.45 -0.65 0.00 0.00 175.02 176.27 3b4v s SER 90 N -1.40 7.22 0.04 1.11 0.15 -1.26 0.14 113.70 119.70 3b4v s SER 90 Ca -0.15 1.70 0.07 0.00 0.70 0.00 0.00 55.95 58.27 3b4v s SER 90 Cb -0.07 -2.56 -0.02 0.00 -1.71 0.00 0.00 66.02 61.65 3b4v s SER 90 CO 0.02 -0.42 -0.19 -0.04 1.20 0.00 0.00 173.24 173.81 3b4v s MET 91 N 1.58 1.30 -0.21 5.44 -1.94 0.27 -4.73 119.30 121.00 3b4v s MET 91 Ca 0.53 -0.89 -0.06 0.00 -1.71 0.00 0.00 55.69 53.56 3b4v s MET 91 Cb -0.22 -1.39 -0.03 0.00 2.01 0.00 0.00 34.83 35.21 3b4v s MET 91 CO 0.24 0.35 0.03 -1.17 -0.01 0.00 0.00 175.02 174.46 3b4v s LEU 92 N -1.13 3.37 0.17 -0.03 2.96 0.47 -1.33 118.68 123.16 3b4v s LEU 92 Ca 0.06 -0.18 -0.14 0.00 -0.22 0.00 0.00 54.13 53.66 3b4v s LEU 92 Cb -0.09 -1.87 0.01 0.00 0.50 0.00 0.00 46.19 44.75 3b4v s LEU 92 CO 0.02 0.04 0.40 -0.72 -1.32 0.00 0.00 176.35 174.77 3b4v s TYR 93 N 1.14 0.08 0.02 5.38 -0.85 0.44 -0.25 117.35 123.31 3b4v s TYR 93 Ca 0.03 -0.43 -0.22 0.00 -0.52 0.00 0.00 57.07 55.93 3b4v s TYR 93 Cb -0.14 0.18 -0.06 0.00 0.38 0.00 0.00 41.96 42.32 3b4v s TYR 93 CO 0.02 -0.80 0.64 0.71 -1.52 0.00 0.00 175.55 174.60 3b4v s TYR 94 N -3.90 3.71 0.00 -3.49 1.51 -0.20 -0.44 117.35 114.54 3b4v s TYR 94 Ca 0.11 1.28 0.00 0.00 -1.01 0.00 0.00 57.07 57.45 3b4v s TYR 94 Cb 0.01 -2.66 0.00 0.00 -0.11 0.00 0.00 41.96 39.21 3b4v s TYR 94 CO -0.03 0.35 0.00 -0.40 -1.11 0.00 0.00 175.55 174.36 3b4v n ASP 95 N 2.65 0.00 0.13 2.29 5.68 -0.69 -4.87 116.55 121.75 3b4v n ASP 95 Ca -0.06 -0.43 0.13 0.00 -0.50 0.00 0.00 54.79 53.92 3b4v n ASP 95 Cb 0.51 0.00 0.33 0.00 -1.14 0.00 0.00 41.12 40.82 3b4v n ASP 95 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 3b4v h ASP 96 N 0.00 0.00 -0.75 -1.12 3.04 -1.98 -2.40 116.42 113.21 3b4v h ASP 96 Ca 0.00 -0.01 -0.26 0.00 -3.24 0.00 0.00 57.03 53.52 3b4v h ASP 96 Cb 0.00 0.00 -0.16 0.00 -1.04 0.00 0.00 39.33 38.13 3b4v h ASP 96 CO 0.00 0.00 0.33 0.61 -2.04 0.00 0.00 179.24 178.15 3b4v n GLY 97 N 1.25 3.67 3.00 7.15 0.00 -1.26 -4.95 105.19 114.05 3b4v n GLY 97 Ca 0.05 -0.94 -0.18 0.00 0.00 0.00 0.00 46.02 44.94 3b4v n GLY 97 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3b4v n GLN 98 N -0.29 -3.05 -3.42 1.61 1.13 -0.90 -4.96 117.38 107.49 3b4v n GLN 98 Ca 0.42 0.51 -0.33 0.00 -1.94 0.00 0.00 57.00 55.66 3b4v n GLN 98 Cb 1.39 -5.18 -0.05 0.00 0.11 0.00 0.00 30.24 26.50 3b4v n GLN 98 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 3b4v s ASN 99 N -2.46 6.69 -0.31 1.08 0.01 -1.26 -4.74 114.94 113.95 3b4v s ASN 99 Ca 0.24 0.95 -0.29 0.00 -0.71 0.00 0.00 52.86 53.05 3b4v s ASN 99 Cb -0.13 -2.24 0.00 0.00 0.41 0.00 0.00 41.25 39.30 3b4v s ASN 99 CO 0.30 0.02 1.27 -0.63 -1.51 0.00 0.00 177.10 176.55 3b4v s ILE 100 N -1.64 4.19 -0.10 0.60 1.01 -1.26 -1.70 121.20 122.30 3b4v s ILE 100 Ca 0.42 1.34 0.04 0.00 0.00 0.00 0.00 60.65 62.45 3b4v s ILE 100 Cb -0.13 -4.20 0.00 0.00 0.01 0.00 0.00 42.46 38.14 3b4v s ILE 100 CO 0.20 -0.49 -0.23 -0.63 0.00 0.00 0.00 174.94 173.79 3b4v s ILE 101 N 4.28 2.02 -0.21 2.92 -1.09 0.41 -4.97 121.20 124.55 3b4v s ILE 101 Ca 0.55 -0.99 -0.05 0.00 -2.23 0.00 0.00 60.65 57.93 3b4v s ILE 101 Cb -0.16 -1.75 -0.02 0.00 -1.58 0.00 0.00 42.46 38.95 3b4v s ILE 101 CO 0.22 0.55 -0.01 -0.75 -1.23 0.00 0.00 174.94 173.73 3b4v s LYS 102 N 0.41 3.53 -0.04 2.79 2.20 -1.26 -0.42 119.74 126.96 3b4v s LYS 102 Ca -0.17 -0.55 -0.14 0.00 -0.36 0.00 0.00 55.97 54.74 3b4v s LYS 102 Cb -0.18 -3.09 0.02 0.00 -1.51 0.00 0.00 37.83 33.08 3b4v s LYS 102 CO 0.08 -0.09 0.31 0.21 -0.36 0.00 0.00 175.35 175.50 3b4v s LYS 103 N 1.26 0.61 -0.00 4.03 2.20 -0.44 -4.97 119.74 122.43 3b4v s LYS 103 Ca 0.04 -0.06 -0.30 0.00 -0.36 0.00 0.00 55.97 55.28 3b4v s LYS 103 Cb -0.15 0.27 -0.05 0.00 -1.51 0.00 0.00 37.83 36.40 3b4v s LYS 103 CO 0.00 -0.15 1.23 -0.51 -0.36 0.00 0.00 175.35 175.56 3b4v s ASP 104 N -1.02 7.03 -0.22 1.43 1.11 -1.26 -0.56 116.67 123.18 3b4v s ASP 104 Ca -0.11 1.94 -0.03 0.00 0.18 0.00 0.00 52.55 54.53 3b4v s ASP 104 Cb -0.05 -2.57 -0.00 0.00 1.07 0.00 0.00 42.92 41.37 3b4v s ASP 104 CO 0.03 -0.56 -0.06 -0.63 1.18 0.00 0.00 175.17 175.14 3b4v s ILE 105 N 1.80 3.24 0.89 0.77 -1.09 0.12 -4.91 121.20 122.03 3b4v s ILE 105 Ca 0.58 -0.54 -0.12 0.00 -2.23 0.00 0.00 60.65 58.34 3b4v s ILE 105 Cb -0.28 -2.47 0.13 0.00 -1.58 0.00 0.00 42.46 38.26 3b4v s ILE 105 CO 0.25 0.43 1.14 -1.10 -1.23 0.00 0.00 174.94 174.44 3b4v s GLN 106 N 1.46 1.30 -1.46 2.79 -1.52 -1.26 -1.41 119.66 119.56 3b4v s GLN 106 Ca 0.06 0.27 -0.07 0.00 -1.95 0.00 0.00 55.36 53.66 3b4v s GLN 106 Cb -0.14 -1.86 0.02 0.00 -0.22 0.00 0.00 33.01 30.81 3b4v s GLN 106 CO -0.04 -2.09 0.89 0.09 -0.25 0.00 0.00 175.29 173.89 3b4v n ASN 107 N -3.69 -6.10 -0.13 5.90 3.02 -1.24 -4.86 115.26 108.17 3b4v n ASN 107 Ca 0.07 -0.44 -0.21 0.00 -0.03 0.00 0.00 54.58 53.97 3b4v n ASN 107 Cb 0.59 -4.86 -0.12 0.00 -0.61 0.00 0.00 39.78 34.79 3b4v n ASN 107 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 3b4v n MET 108 N -4.51 0.64 -4.89 3.52 2.81 -0.92 -4.93 117.12 108.84 3b4v n MET 108 Ca -0.04 0.19 -0.30 0.00 -1.81 0.00 0.00 57.70 55.73 3b4v n MET 108 Cb 0.58 -1.53 -0.17 0.00 -0.71 0.00 0.00 33.22 31.40 3b4v n MET 108 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3b4v s ILE 109 N -2.52 1.78 -0.01 2.02 1.01 -1.08 -4.70 121.20 117.71 3b4v s ILE 109 Ca -0.35 -0.85 -0.30 0.00 0.00 0.00 0.00 60.65 59.15 3b4v s ILE 109 Cb 0.10 -1.57 -0.07 0.00 0.01 0.00 0.00 42.46 40.93 3b4v s ILE 109 CO 0.58 0.50 1.69 -0.69 0.00 0.00 0.00 174.94 177.02 3b4v s VAL 110 N 0.58 3.37 -0.18 2.92 1.01 -0.87 -1.18 120.40 126.05 3b4v s VAL 110 Ca -0.14 0.56 -0.06 0.00 0.00 0.00 0.00 61.98 62.34 3b4v s VAL 110 Cb -0.17 -3.36 -0.22 0.00 0.00 0.00 0.00 36.38 32.63 3b4v s VAL 110 CO 0.05 -0.04 0.13 1.21 0.00 0.00 0.00 175.10 176.45 3b4v n GLU 111 N 6.75 0.70 -3.99 2.72 4.07 0.10 -4.88 120.64 126.11 3b4v n GLU 111 Ca 0.17 0.26 -0.11 0.00 -0.06 0.00 0.00 57.16 57.42 3b4v n GLU 111 Cb 0.42 -1.64 -0.12 0.00 -0.06 0.00 0.00 31.44 30.03 3b4v n GLU 111 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 3b4v s GLU 112 N -2.52 0.30 0.10 5.31 2.02 -1.06 -4.90 118.70 117.95 3b4v s GLU 112 Ca -0.28 -0.47 0.09 0.00 0.02 0.00 0.00 54.97 54.33 3b4v s GLU 112 Cb 0.08 -0.06 -0.04 0.00 0.10 0.00 0.00 34.13 34.21 3b4v s GLU 112 CO 0.68 -0.00 -0.20 0.00 0.02 0.00 0.00 175.26 175.76 3b4v s GLY 114 N -1.93 -0.29 0.16 0.00 0.00 -0.43 -4.28 107.32 100.54 3b4v s GLY 114 Ca 0.16 0.21 -0.18 0.00 0.00 0.00 0.00 44.72 44.91 3b4v s GLY 114 CO 0.08 0.06 0.63 0.00 0.00 0.00 0.00 173.10 173.86