#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pbi s SER 6 N 0.00 3.18 -0.22 4.39 0.01 -1.26 -4.91 113.70 114.88 1pbi s SER 6 Ca 0.00 -0.51 -0.28 0.00 1.31 0.00 0.00 55.95 56.46 1pbi s SER 6 Cb 0.00 -1.19 -0.04 0.00 0.21 0.00 0.00 66.02 65.00 1pbi s SER 6 CO 0.00 0.20 2.07 0.00 0.41 0.00 0.00 173.24 175.91 1pbi s ALA 7 N 0.12 2.87 0.07 1.44 0.00 -1.26 -4.60 121.76 120.39 1pbi s ALA 7 Ca -0.12 0.69 -0.07 0.00 0.00 0.00 0.00 51.96 52.47 1pbi s ALA 7 Cb -0.16 -4.03 -0.01 0.00 0.00 0.00 0.00 23.12 18.92 1pbi s ALA 7 CO 0.06 -2.60 0.14 0.00 0.00 0.00 0.00 175.76 173.36 1pbi h ASP 10 N 8.22 0.86 -3.83 0.00 3.32 -1.91 -3.29 116.42 119.79 1pbi h ASP 10 Ca -0.17 -0.69 -0.64 0.00 0.02 0.00 0.00 57.03 55.54 1pbi h ASP 10 Cb 1.12 -0.26 -0.40 0.00 0.22 0.00 0.00 39.33 40.01 1pbi h ASP 10 CO 0.18 1.43 -0.70 -0.89 -1.72 0.00 0.00 179.24 177.54 1pbi s THR 11 N -3.49 2.13 -0.22 0.35 2.01 -1.26 -4.88 115.64 110.28 1pbi s THR 11 Ca -0.11 -2.57 -0.13 0.00 0.31 0.00 0.00 61.69 59.19 1pbi s THR 11 Cb 0.07 -2.54 -0.04 0.00 0.01 0.00 0.00 72.50 70.00 1pbi s THR 11 CO 0.90 -0.70 0.28 0.00 -0.69 0.00 0.00 174.62 174.40 1pbi s LEU 13 N 1.23 3.10 0.07 0.00 1.02 -0.51 -4.97 118.68 118.62 1pbi s LEU 13 Ca 0.13 -0.24 0.08 0.00 0.02 0.00 0.00 54.13 54.12 1pbi s LEU 13 Cb -0.14 -1.77 -0.03 0.00 0.02 0.00 0.00 46.19 44.27 1pbi s LEU 13 CO 0.06 0.08 -0.22 0.00 0.02 0.00 0.00 176.35 176.30 1pbi s THR 15 N -0.92 3.09 -1.68 0.00 -4.23 -0.79 -4.93 115.64 106.18 1pbi s THR 15 Ca 0.08 0.35 0.29 0.00 -1.18 0.00 0.00 61.69 61.24 1pbi s THR 15 Cb -0.09 -3.12 0.50 0.00 1.34 0.00 0.00 72.50 71.12 1pbi s THR 15 CO 0.03 -0.46 1.90 0.29 -0.54 0.00 0.00 174.62 175.84 1pbi n LYS 16 N -3.40 0.72 -0.31 3.99 4.76 -1.26 -4.54 118.16 118.11 1pbi n LYS 16 Ca 0.07 -0.22 -0.27 0.00 -2.87 0.00 0.00 58.31 55.01 1pbi n LYS 16 Cb 0.56 -1.50 0.26 0.00 -1.84 0.00 0.00 35.03 32.52 1pbi n LYS 16 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1pbi n SER 17 N -0.95 -3.74 -3.44 4.39 3.41 -1.26 -4.88 113.62 107.15 1pbi n SER 17 Ca 0.15 -0.71 -0.12 0.00 -0.26 0.00 0.00 58.87 57.94 1pbi n SER 17 Cb 0.26 -0.97 -0.10 0.00 -0.26 0.00 0.00 64.21 63.15 1pbi n SER 17 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1pbi s ASN 18 N -2.77 0.47 0.52 4.04 0.02 -1.26 -2.67 114.94 113.29 1pbi s ASN 18 Ca 0.60 0.23 -0.20 0.00 -1.02 0.00 0.00 52.86 52.47 1pbi s ASN 18 Cb -0.12 0.93 -0.06 0.00 0.02 0.00 0.00 41.25 42.01 1pbi s ASN 18 CO 0.52 -0.29 1.12 -2.16 0.02 0.00 0.00 177.10 176.31 1pbi s PRO 19 N 2.49 3.48 0.63 -0.60 0.04 -1.26 -5.13 135.00 134.64 1pbi s PRO 19 Ca 0.09 1.60 -0.13 0.00 0.04 0.00 0.00 61.00 62.59 1pbi s PRO 19 Cb -0.15 -2.08 -0.02 0.00 0.04 0.00 0.00 34.50 32.29 1pbi s PRO 19 CO -0.14 -0.74 1.05 -2.14 0.04 0.00 0.00 177.00 175.06 1pbi s PRO 20 N -3.19 3.28 -0.11 0.56 0.02 -1.09 -5.04 135.00 129.43 1pbi s PRO 20 Ca 0.71 1.02 0.02 0.00 0.02 0.00 0.00 61.00 62.76 1pbi s PRO 20 Cb -0.23 -2.03 -0.01 0.00 0.02 0.00 0.00 34.50 32.24 1pbi s PRO 20 CO 0.27 -0.83 -0.16 0.99 -0.33 0.00 0.00 177.00 176.94 1pbi s THR 21 N -2.80 2.79 0.23 0.99 2.01 -1.26 -4.61 115.64 112.99 1pbi s THR 21 Ca 0.60 -0.77 0.10 0.00 0.31 0.00 0.00 61.69 61.93 1pbi s THR 21 Cb -0.14 -2.14 -0.05 0.00 0.01 0.00 0.00 72.50 70.19 1pbi s THR 21 CO 0.45 0.54 -0.18 0.00 -0.69 0.00 0.00 174.62 174.75 1pbi s ARG 23 N -3.43 1.22 -0.23 0.00 1.70 -0.60 0.56 118.95 118.17 1pbi s ARG 23 Ca 0.25 -1.04 -0.05 0.00 -0.47 0.00 0.00 55.73 54.41 1pbi s ARG 23 Cb -0.03 0.43 -0.02 0.00 -0.57 0.00 0.00 34.95 34.76 1pbi s ARG 23 CO 0.10 -0.47 0.01 0.00 -1.08 0.00 0.00 175.30 173.86 1pbi n VAL 25 N 4.74 2.43 -1.94 0.00 0.24 -0.79 -4.17 118.33 118.84 1pbi n VAL 25 Ca -0.17 -1.32 -0.39 0.00 -2.04 0.00 0.00 64.34 60.42 1pbi n VAL 25 Cb 0.51 -0.14 0.01 0.00 -1.47 0.00 0.00 33.84 32.76 1pbi n VAL 25 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1pbi s ASP 26 N -0.81 5.90 0.02 -1.34 1.01 -1.26 -4.97 116.67 115.21 1pbi s ASP 26 Ca 0.53 2.70 0.06 0.00 0.71 0.00 0.00 52.55 56.56 1pbi s ASP 26 Cb 0.39 -2.64 -0.02 0.00 1.01 0.00 0.00 42.92 41.66 1pbi s ASP 26 CO 0.19 -1.14 -0.18 0.54 0.21 0.00 0.00 175.17 174.79 1pbi s VAL 27 N -1.30 1.47 -0.01 -1.27 0.11 -1.26 -4.28 120.40 113.86 1pbi s VAL 27 Ca 0.63 -1.00 -0.04 0.00 -2.93 0.00 0.00 61.98 58.63 1pbi s VAL 27 Cb -0.39 -1.27 0.01 0.00 -1.53 0.00 0.00 36.38 33.21 1pbi s VAL 27 CO 0.48 0.24 0.19 0.61 -3.33 0.00 0.00 175.10 173.30 1pbi n GLY 28 N 2.15 0.36 0.31 6.54 0.00 -0.67 -4.89 105.19 108.98 1pbi n GLY 28 Ca -0.16 -0.83 0.19 0.00 0.00 0.00 0.00 46.02 45.22 1pbi n GLY 28 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1pbi h GLU 30 N 0.00 0.00 -3.58 1.61 5.08 -1.88 0.57 114.58 116.39 1pbi h GLU 30 Ca -0.03 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.27 1pbi h GLU 30 Cb 0.16 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.34 1pbi h GLU 30 CO 0.04 0.02 -0.06 0.95 -1.00 0.00 0.00 179.01 178.97 1pbi s THR 31 N -4.09 0.00 0.32 1.13 -4.23 -1.26 -4.77 115.64 102.74 1pbi s THR 31 Ca -0.03 -1.35 0.07 0.00 -1.18 0.00 0.00 61.69 59.19 1pbi s THR 31 Cb 0.12 -2.28 -0.02 0.00 1.34 0.00 0.00 72.50 71.67 1pbi s THR 31 CO 0.48 0.00 0.40 0.00 -0.54 0.00 0.00 174.62 174.96 1pbi s HIS 33 N -2.18 2.30 0.57 0.00 -3.43 -1.26 -4.89 115.29 106.40 1pbi s HIS 33 Ca 0.42 1.60 0.31 0.00 -0.80 0.00 0.00 55.06 56.59 1pbi s HIS 33 Cb -0.08 -3.29 1.43 0.00 -1.43 0.00 0.00 32.58 29.21 1pbi s HIS 33 CO 0.29 -2.16 1.80 0.66 -2.00 0.00 0.00 174.74 173.33 1pbi h SER 34 N -0.40 0.00 -0.23 7.38 4.64 -1.91 -1.63 113.55 121.39 1pbi h SER 34 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1pbi h SER 34 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1pbi h SER 34 CO 0.51 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.47 1pbi n ALA 35 N -2.50 2.48 -2.41 5.18 0.00 -1.26 -4.94 120.51 117.06 1pbi n ALA 35 Ca 0.16 -0.68 -0.43 0.00 0.00 0.00 0.00 53.44 52.49 1pbi n ALA 35 Cb 0.97 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.39 1pbi n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pbi h LEU 37 N 8.91 0.20 -7.74 0.00 -0.00 -1.92 -3.43 115.31 111.33 1pbi h LEU 37 Ca -0.31 -0.86 -0.71 0.00 -0.00 0.00 0.00 57.88 56.00 1pbi h LEU 37 Cb 1.14 -0.07 -0.33 0.00 -0.00 0.00 0.00 40.66 41.40 1pbi h LEU 37 CO 0.92 1.34 -0.40 -0.55 -0.00 0.00 0.00 178.44 179.75 1pbi s SER 38 N -6.71 5.44 -0.36 -0.43 0.15 -1.26 -5.06 113.70 105.47 1pbi s SER 38 Ca -0.20 -2.40 -0.12 0.00 0.70 0.00 0.00 55.95 53.93 1pbi s SER 38 Cb 0.01 -1.90 0.01 0.00 -1.71 0.00 0.00 66.02 62.43 1pbi s SER 38 CO 0.72 -0.50 0.22 0.00 1.20 0.00 0.00 173.24 174.88 1pbi s ILE 40 N 1.63 4.75 0.22 0.00 -1.09 -0.04 -4.91 121.20 121.75 1pbi s ILE 40 Ca 0.04 -0.04 0.10 0.00 -2.23 0.00 0.00 60.65 58.52 1pbi s ILE 40 Cb -0.18 -3.15 -0.05 0.00 -1.58 0.00 0.00 42.46 37.50 1pbi s ILE 40 CO 0.08 0.45 -0.20 0.00 -1.23 0.00 0.00 174.94 174.04 1pbi s ALA 42 N -2.26 3.80 -1.26 0.00 0.00 0.44 -4.97 121.76 117.51 1pbi s ALA 42 Ca 0.23 -0.58 -0.06 0.00 0.00 0.00 0.00 51.96 51.55 1pbi s ALA 42 Cb -0.05 -2.11 0.05 0.00 0.00 0.00 0.00 23.12 21.00 1pbi s ALA 42 CO 0.10 0.68 2.61 0.66 0.00 0.00 0.00 175.76 179.82 1pbi n TYR 43 N 0.09 2.36 -4.60 0.00 0.53 -1.26 -3.93 117.16 110.34 1pbi n TYR 43 Ca -0.02 -2.75 -0.27 0.00 -1.02 0.00 0.00 57.90 53.83 1pbi n TYR 43 Cb 0.52 -1.94 -0.11 0.00 -1.03 0.00 0.00 39.34 36.77 1pbi n TYR 43 CO 0.00 0.00 0.00 -1.54 -1.02 0.00 0.00 176.86 174.30 1pbi s SER 44 N 0.87 3.79 -0.18 7.72 1.04 -1.26 -5.07 113.70 120.61 1pbi s SER 44 Ca 0.59 -1.36 0.01 0.00 0.48 0.00 0.00 55.95 55.67 1pbi s SER 44 Cb 0.21 -0.38 0.02 0.00 0.10 0.00 0.00 66.02 65.97 1pbi s SER 44 CO -0.10 -0.44 -0.18 0.21 0.98 0.00 0.00 173.24 173.71 1pbi s ASN 45 N -3.69 3.08 0.75 7.02 2.47 -1.26 -1.78 114.94 121.53 1pbi s ASN 45 Ca 0.35 -0.64 -0.11 0.00 0.42 0.00 0.00 52.86 52.88 1pbi s ASN 45 Cb 0.09 -1.42 0.04 0.00 -1.45 0.00 0.00 41.25 38.52 1pbi s ASN 45 CO 0.18 -0.02 1.08 -2.16 -3.72 0.00 0.00 177.10 172.46 1pbi s PRO 46 N 1.33 2.47 0.90 0.43 0.04 -1.26 -5.12 135.00 133.79 1pbi s PRO 46 Ca 0.05 0.80 -0.11 0.00 0.04 0.00 0.00 61.00 61.78 1pbi s PRO 46 Cb -0.13 -1.95 0.14 0.00 0.04 0.00 0.00 34.50 32.59 1pbi s PRO 46 CO -0.12 -1.39 1.10 -1.25 0.04 0.00 0.00 177.00 175.38 1pbi s PRO 47 N -5.09 1.16 -0.16 0.56 0.04 -0.73 -5.04 135.00 125.73 1pbi s PRO 47 Ca 0.60 1.18 -0.01 0.00 0.04 0.00 0.00 61.00 62.81 1pbi s PRO 47 Cb -0.14 -1.77 0.04 0.00 0.04 0.00 0.00 34.50 32.67 1pbi s PRO 47 CO 0.55 -2.41 -0.04 0.15 0.04 0.00 0.00 177.00 175.29 1pbi s LYS 48 N -4.76 1.26 0.11 4.56 1.02 -1.25 -4.09 119.74 116.58 1pbi s LYS 48 Ca 0.65 -0.46 0.09 0.00 0.02 0.00 0.00 55.97 56.26 1pbi s LYS 48 Cb -0.20 -1.95 -0.04 0.00 -0.52 0.00 0.00 37.83 35.12 1pbi s LYS 48 CO 0.58 -0.45 -0.22 0.00 -0.92 0.00 0.00 175.35 174.33 1pbi s GLN 50 N -1.96 0.28 -0.25 0.00 0.74 0.10 -1.68 119.66 116.89 1pbi s GLN 50 Ca 0.08 -0.54 -0.20 0.00 0.05 0.00 0.00 55.36 54.76 1pbi s GLN 50 Cb -0.10 0.10 -0.02 0.00 1.10 0.00 0.00 33.01 34.09 1pbi s GLN 50 CO 0.05 -0.04 0.62 0.00 -0.55 0.00 0.00 175.29 175.36 1pbi n PHE 52 N 5.69 0.41 -2.25 0.00 3.01 -0.00 -4.47 117.46 119.85 1pbi n PHE 52 Ca -0.01 -0.21 -0.34 0.00 1.01 0.00 0.00 57.45 57.90 1pbi n PHE 52 Cb 0.49 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.96 1pbi n PHE 52 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1pbi s ASP 53 N -1.16 5.82 -0.01 4.37 1.01 -1.26 -4.98 116.67 120.46 1pbi s ASP 53 Ca 0.27 2.04 0.05 0.00 0.71 0.00 0.00 52.55 55.62 1pbi s ASP 53 Cb 0.14 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.49 1pbi s ASP 53 CO 0.19 -1.14 -0.15 0.42 0.21 0.00 0.00 175.17 174.70 1pbi s THR 54 N -1.98 1.17 0.28 -1.27 -4.23 -1.26 -4.33 115.64 104.03 1pbi s THR 54 Ca 0.69 -0.63 -0.02 0.00 -1.18 0.00 0.00 61.69 60.55 1pbi s THR 54 Cb -0.20 -0.98 -0.02 0.00 1.34 0.00 0.00 72.50 72.64 1pbi s THR 54 CO 0.28 0.33 0.33 -1.10 -0.54 0.00 0.00 174.62 173.92 1pbi s GLN 55 N -0.33 1.60 -0.14 3.99 1.11 0.19 -4.91 119.66 121.17 1pbi s GLN 55 Ca 0.05 -1.69 0.11 0.00 0.01 0.00 0.00 55.36 53.85 1pbi s GLN 55 Cb -0.06 0.37 0.57 0.00 -1.01 0.00 0.00 33.01 32.88 1pbi s GLN 55 CO -0.00 -0.61 1.39 0.36 0.01 0.00 0.00 175.29 176.43 1pbi n LYS 56 N -0.46 3.53 -3.87 2.91 -0.00 -1.26 0.16 118.16 119.17 1pbi n LYS 56 Ca 0.02 -2.19 -0.09 0.00 -0.00 0.00 0.00 58.31 56.05 1pbi n LYS 56 Cb 0.63 -1.95 -0.06 0.00 -0.00 0.00 0.00 35.03 33.66 1pbi n LYS 56 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.40 176.81 1pbi s PHE 57 N -2.10 0.18 -0.03 5.58 -0.12 -1.26 -4.89 117.98 115.35 1pbi s PHE 57 Ca 0.38 -0.54 0.01 0.00 -0.05 0.00 0.00 56.93 56.74 1pbi s PHE 57 Cb 0.28 0.14 -0.03 0.00 -0.63 0.00 0.00 43.02 42.77 1pbi s PHE 57 CO 0.13 -0.81 -0.03 0.00 -0.05 0.00 0.00 175.22 174.47 1pbi s TYR 59 N -0.98 3.20 0.56 0.00 2.02 -1.26 -5.02 117.35 115.88 1pbi s TYR 59 Ca 0.16 1.17 -0.17 0.00 -0.37 0.00 0.00 57.07 57.86 1pbi s TYR 59 Cb -0.11 -3.00 -0.05 0.00 -0.40 0.00 0.00 41.96 38.39 1pbi s TYR 59 CO 0.06 -1.28 1.04 0.21 -1.57 0.00 0.00 175.55 174.01 1pbi s LYS 60 N -5.23 3.54 0.92 -0.62 2.36 -1.26 -4.37 119.74 115.08 1pbi s LYS 60 Ca 0.58 1.18 -0.11 0.00 -2.55 0.00 0.00 55.97 55.08 1pbi s LYS 60 Cb -0.12 -2.07 0.12 0.00 -1.05 0.00 0.00 37.83 34.71 1pbi s LYS 60 CO 0.53 -0.63 1.01 0.00 1.55 0.00 0.00 175.35 177.81 1pbi n GLN 61 N -1.74 -0.40 -0.05 4.03 10.64 -1.24 -0.19 117.38 128.43 1pbi n GLN 61 Ca 0.08 -0.05 -0.12 0.00 -1.83 0.00 0.00 57.00 55.08 1pbi n GLN 61 Cb 0.53 -2.28 -0.14 0.00 -0.86 0.00 0.00 30.24 27.48 1pbi n GLN 61 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1pbi n HIS 63 N -3.04 0.00 -2.92 0.00 8.25 -1.26 -5.01 115.22 111.23 1pbi n HIS 63 Ca -0.27 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 56.97 1pbi n HIS 63 Cb 1.08 0.00 0.02 0.00 1.12 0.00 0.00 29.99 32.21 1pbi n HIS 63 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1pbi n ASN 64 N -0.36 -5.55 -3.74 0.41 0.23 -1.26 -4.96 115.26 100.03 1pbi n ASN 64 Ca 0.00 -0.22 -0.27 0.00 -0.53 0.00 0.00 54.58 53.56 1pbi n ASN 64 Cb 0.04 -4.53 -0.17 0.00 -2.08 0.00 0.00 39.78 33.04 1pbi n ASN 64 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1pbi s SER 65 N -2.54 2.84 -0.42 0.53 1.04 -1.26 -5.08 113.70 108.81 1pbi s SER 65 Ca 0.24 -0.78 -0.27 0.00 0.48 0.00 0.00 55.95 55.62 1pbi s SER 65 Cb -0.11 -0.59 -0.07 0.00 0.10 0.00 0.00 66.02 65.35 1pbi s SER 65 CO 0.30 -0.30 2.36 -0.62 0.98 0.00 0.00 173.24 175.96 1pbi n GLU 66 N 5.05 1.30 0.01 4.02 -0.58 -1.26 -4.79 120.64 124.40 1pbi n GLU 66 Ca -0.09 0.17 0.11 0.00 -0.42 0.00 0.00 57.16 56.94 1pbi n GLU 66 Cb 0.47 -3.29 0.05 0.00 -0.57 0.00 0.00 31.44 28.11 1pbi n GLU 66 CO 0.00 0.00 0.00 1.47 -0.48 0.00 0.00 177.13 178.12 1pbi n LEU 67 N 14.22 0.66 -3.93 -4.62 -0.00 -1.26 -4.94 117.00 117.13 1pbi n LEU 67 Ca 0.36 -0.12 -0.10 0.00 -0.00 0.00 0.00 56.01 56.15 1pbi n LEU 67 Cb 0.49 -0.12 -0.10 0.00 -0.00 0.00 0.00 43.42 43.68 1pbi n LEU 67 CO 0.70 0.11 -0.27 -1.61 -0.00 0.00 0.00 177.39 176.33 1pbi s GLU 68 N -3.10 0.39 0.04 1.47 2.02 -1.26 -5.16 118.70 113.10 1pbi s GLU 68 Ca 0.07 -0.51 0.00 0.00 0.02 0.00 0.00 54.97 54.55 1pbi s GLU 68 Cb 0.16 0.15 -0.03 0.00 0.10 0.00 0.00 34.13 34.51 1pbi s GLU 68 CO 0.79 -0.08 -0.04 -1.83 0.02 0.00 0.00 175.26 174.11 1pbi s GLU 69 N -1.43 0.47 -0.30 1.61 -1.05 -1.26 -5.07 118.70 111.66 1pbi s GLU 69 Ca -0.15 -0.84 -0.24 0.00 -0.15 0.00 0.00 54.97 53.58 1pbi s GLU 69 Cb -0.09 0.03 0.00 0.00 -0.44 0.00 0.00 34.13 33.63 1pbi s GLU 69 CO 0.00 -0.04 0.84 0.08 0.95 0.00 0.00 175.26 177.09 1pbi s VAL 70 N -2.19 4.75 -0.31 1.83 1.01 -1.26 -5.02 120.40 119.21 1pbi s VAL 70 Ca -0.07 1.32 -0.21 0.00 0.00 0.00 0.00 61.98 63.01 1pbi s VAL 70 Cb -0.05 -4.19 -0.01 0.00 0.00 0.00 0.00 36.38 32.14 1pbi s VAL 70 CO -0.03 -0.27 0.67 -0.63 0.00 0.00 0.00 175.10 174.84 1pbi s ILE 71 N 3.06 4.90 -1.12 2.22 -1.09 -1.26 -4.96 121.20 122.95 1pbi s ILE 71 Ca 0.35 0.92 -0.24 0.00 -2.23 0.00 0.00 60.65 59.44 1pbi s ILE 71 Cb -0.14 -4.04 -0.14 0.00 -1.58 0.00 0.00 42.46 36.56 1pbi s ILE 71 CO 0.12 -0.18 2.02 -1.59 -1.23 0.00 0.00 174.94 174.08 1pbi s LYS 72 N 2.70 1.97 0.00 2.79 -2.85 -1.26 -5.37 119.74 117.73 1pbi s LYS 72 Ca 0.27 -0.79 0.31 0.00 -1.00 0.00 0.00 55.97 54.76 1pbi s LYS 72 Cb -0.15 -5.12 1.73 0.00 -2.06 0.00 0.00 37.83 32.23 1pbi s LYS 72 CO 0.12 -4.54 2.13 0.27 0.10 0.00 0.00 175.35 173.43