#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wnm h GLY 27 N 0.00 0.00 -7.64 3.38 0.00 -2.05 -3.37 103.07 93.39 2wnm h GLY 27 Ca 0.00 0.00 -0.76 0.00 0.00 0.00 0.00 47.33 46.57 2wnm h GLY 27 CO 0.00 0.00 0.66 -0.56 0.00 0.00 0.00 176.54 176.64 2wnm s SER 28 N -6.61 6.97 0.00 0.19 0.01 -1.26 -4.76 113.70 108.24 2wnm s SER 28 Ca 0.00 -2.88 0.22 0.00 1.31 0.00 0.00 55.95 54.60 2wnm s SER 28 Cb 0.11 -2.30 -0.13 0.00 0.21 0.00 0.00 66.02 63.91 2wnm s SER 28 CO 0.74 -0.64 0.97 -0.11 0.41 0.00 0.00 173.24 174.61 2wnm n LEU 29 N 4.58 1.15 -1.47 2.44 7.94 -1.22 -4.39 117.00 126.03 2wnm n LEU 29 Ca 0.24 -0.51 -0.02 0.00 -1.11 0.00 0.00 56.01 54.62 2wnm n LEU 29 Cb 0.44 -0.02 0.00 0.00 0.53 0.00 0.00 43.42 44.38 2wnm n LEU 29 CO 0.48 0.26 0.95 -1.20 -1.11 0.00 0.00 177.39 176.77 2wnm n SER 30 N -1.23 5.11 -4.57 1.96 7.64 -1.18 -4.83 113.62 116.52 2wnm n SER 30 Ca 0.05 -2.42 -0.33 0.00 1.01 0.00 0.00 58.87 57.18 2wnm n SER 30 Cb 0.35 -1.03 -0.04 0.00 -1.01 0.00 0.00 64.21 62.48 2wnm n SER 30 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2wnm s VAL 31 N -0.24 3.70 0.00 0.44 -7.23 -1.26 -4.27 120.40 111.55 2wnm s VAL 31 Ca 0.03 -0.87 0.00 0.00 -1.81 0.00 0.00 61.98 59.33 2wnm s VAL 31 Cb 0.03 -4.61 0.00 0.00 0.56 0.00 0.00 36.38 32.35 2wnm s VAL 31 CO 0.00 -1.39 0.00 0.47 -0.31 0.00 0.00 175.10 173.87 2wnm n ASP 32 N 11.86 0.00 -4.77 4.85 8.00 -1.26 -4.92 116.55 130.30 2wnm n ASP 32 Ca 0.41 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.54 2wnm n ASP 32 Cb 0.48 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.57 2wnm n ASP 32 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2wnm s ASN 33 N 0.00 6.09 -1.06 -2.24 3.84 -1.26 -4.89 114.94 115.42 2wnm s ASN 33 Ca 0.00 2.39 -0.23 0.00 0.21 0.00 0.00 52.86 55.24 2wnm s ASN 33 Cb 0.00 -2.61 -0.02 0.00 -0.55 0.00 0.00 41.25 38.07 2wnm s ASN 33 CO 0.00 -0.98 1.80 -0.54 -2.79 0.00 0.00 177.10 174.59 2wnm s LYS 34 N -2.66 3.00 0.03 0.43 -0.14 -1.26 -4.85 119.74 114.28 2wnm s LYS 34 Ca 0.64 -0.96 -0.30 0.00 -1.36 0.00 0.00 55.97 53.98 2wnm s LYS 34 Cb -0.31 -5.25 -0.04 0.00 -1.68 0.00 0.00 37.83 30.55 2wnm s LYS 34 CO 0.38 -3.09 1.10 0.21 -0.76 0.00 0.00 175.35 173.18 2wnm s LYS 35 N 5.98 4.49 0.22 1.68 2.20 -1.26 -3.00 119.74 130.05 2wnm s LYS 35 Ca 0.62 1.60 0.10 0.00 -0.36 0.00 0.00 55.97 57.92 2wnm s LYS 35 Cb -0.02 -3.41 -0.05 0.00 -1.51 0.00 0.00 37.83 32.84 2wnm s LYS 35 CO 0.02 -0.17 -0.18 -0.06 -0.36 0.00 0.00 175.35 174.60 2wnm s PHE 36 N 1.11 2.00 -0.29 4.03 0.08 0.16 -0.41 117.98 124.66 2wnm s PHE 36 Ca 0.55 -0.44 0.03 0.00 0.12 0.00 0.00 56.93 57.19 2wnm s PHE 36 Cb -0.25 -0.92 0.07 0.00 -0.57 0.00 0.00 43.02 41.35 2wnm s PHE 36 CO 0.28 0.50 -0.05 -1.58 -0.10 0.00 0.00 175.22 174.27 2wnm s TRP 37 N -2.51 3.42 -0.35 0.36 0.52 0.22 0.39 118.94 120.99 2wnm s TRP 37 Ca 0.24 -2.50 -0.21 0.00 0.02 0.00 0.00 56.10 53.65 2wnm s TRP 37 Cb -0.04 -2.26 0.00 0.00 -1.15 0.00 0.00 33.47 30.02 2wnm s TRP 37 CO 0.10 -0.90 0.69 0.00 0.02 0.00 0.00 176.95 176.86 2wnm s ALA 38 N 1.05 3.46 -0.70 0.98 0.00 -0.91 -0.43 121.76 125.21 2wnm s ALA 38 Ca -0.03 -0.76 -0.26 0.00 0.00 0.00 0.00 51.96 50.92 2wnm s ALA 38 Cb -0.20 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 2wnm s ALA 38 CO -0.06 -1.35 1.80 0.99 0.00 0.00 0.00 175.76 177.14 2wnm s THR 39 N 2.83 3.44 -0.60 0.00 2.01 0.25 -2.48 115.64 121.08 2wnm s THR 39 Ca 0.27 0.07 -0.22 0.00 0.31 0.00 0.00 61.69 62.12 2wnm s THR 39 Cb -0.14 -4.11 0.07 0.00 0.01 0.00 0.00 72.50 68.33 2wnm s THR 39 CO 0.15 -1.06 0.87 -0.69 -0.69 0.00 0.00 174.62 173.20 2wnm s VAL 40 N 8.77 4.49 0.04 3.82 1.01 0.48 0.24 120.40 139.25 2wnm s VAL 40 Ca 0.63 -0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.31 2wnm s VAL 40 Cb -0.10 -4.56 -0.04 0.00 0.00 0.00 0.00 36.38 31.68 2wnm s VAL 40 CO 0.14 -1.23 0.10 -0.70 0.00 0.00 0.00 175.10 173.42 2wnm s GLU 41 N 3.63 3.06 0.31 2.72 2.12 0.31 0.29 118.70 131.15 2wnm s GLU 41 Ca 0.22 -0.55 0.04 0.00 0.36 0.00 0.00 54.97 55.04 2wnm s GLU 41 Cb -0.17 -2.85 -0.02 0.00 0.26 0.00 0.00 34.13 31.36 2wnm s GLU 41 CO 0.12 0.61 0.15 -1.13 -0.54 0.00 0.00 175.26 174.47 2wnm n SER 42 N 0.78 0.68 -0.29 -1.70 3.41 -0.10 -0.52 113.62 115.88 2wnm n SER 42 Ca -0.10 -2.75 -0.05 0.00 -0.26 0.00 0.00 58.87 55.71 2wnm n SER 42 Cb 0.52 0.97 0.07 0.00 -0.26 0.00 0.00 64.21 65.51 2wnm n SER 42 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2wnm h SER 43 N 1.40 1.01 0.14 4.04 0.02 -2.00 -3.25 113.55 114.91 2wnm h SER 43 Ca -0.24 -0.12 -0.19 0.00 -0.84 0.00 0.00 61.79 60.40 2wnm h SER 43 Cb 0.97 -0.26 0.02 0.00 0.14 0.00 0.00 62.40 63.28 2wnm h SER 43 CO 0.37 0.84 -0.83 -0.33 -1.14 0.00 0.00 176.83 175.74 2wnm h GLU 44 N 1.10 0.31 -2.86 3.45 3.07 -2.03 -3.47 114.58 114.15 2wnm h GLU 44 Ca 0.27 -0.53 -0.12 0.00 -0.50 0.00 0.00 59.36 58.49 2wnm h GLU 44 Cb 0.09 0.20 -0.21 0.00 -0.84 0.00 0.00 28.75 27.98 2wnm h GLU 44 CO -0.04 1.25 -0.23 -3.38 -1.40 0.00 0.00 179.01 175.21 2wnm s HIS 45 N -2.44 -0.31 -0.23 4.33 -3.43 -1.23 -5.14 115.29 106.84 2wnm s HIS 45 Ca -0.13 0.63 -0.09 0.00 -0.80 0.00 0.00 55.06 54.66 2wnm s HIS 45 Cb 0.01 0.14 -0.04 0.00 -1.43 0.00 0.00 32.58 31.26 2wnm s HIS 45 CO 0.84 -0.34 0.12 -1.54 -2.00 0.00 0.00 174.74 171.82 2wnm s SER 46 N -0.75 5.80 0.55 7.38 1.04 -1.26 -0.92 113.70 125.54 2wnm s SER 46 Ca -0.08 0.03 0.08 0.00 0.48 0.00 0.00 55.95 56.46 2wnm s SER 46 Cb -0.04 -2.04 0.06 0.00 0.10 0.00 0.00 66.02 64.11 2wnm s SER 46 CO 0.03 0.07 0.63 0.12 0.98 0.00 0.00 173.24 175.07 2wnm s PHE 47 N 1.04 1.58 -0.16 5.02 5.36 0.15 -4.92 117.98 126.05 2wnm s PHE 47 Ca 0.06 -0.74 -0.09 0.00 -0.96 0.00 0.00 56.93 55.19 2wnm s PHE 47 Cb -0.14 -2.11 0.05 0.00 -0.34 0.00 0.00 43.02 40.49 2wnm s PHE 47 CO 0.04 -0.85 0.39 -1.21 -1.46 0.00 0.00 175.22 172.12 2wnm s GLU 48 N -4.50 0.38 -0.02 10.12 2.02 -1.26 -0.38 118.70 125.06 2wnm s GLU 48 Ca 0.51 0.73 0.05 0.00 0.02 0.00 0.00 54.97 56.28 2wnm s GLU 48 Cb -0.05 -0.00 -0.01 0.00 0.10 0.00 0.00 34.13 34.17 2wnm s GLU 48 CO 0.32 -0.15 -0.16 0.08 0.02 0.00 0.00 175.26 175.37 2wnm s VAL 49 N 1.23 1.32 -0.21 2.63 1.01 -1.04 -4.93 120.40 120.41 2wnm s VAL 49 Ca -0.08 -0.70 -0.29 0.00 0.00 0.00 0.00 61.98 60.91 2wnm s VAL 49 Cb -0.08 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 2wnm s VAL 49 CO -0.11 0.38 1.94 -2.16 0.00 0.00 0.00 175.10 175.15 2wnm s PRO 50 N -0.27 3.48 0.11 2.72 0.04 -1.26 -2.15 135.00 137.67 2wnm s PRO 50 Ca 0.04 1.89 -0.15 0.00 0.04 0.00 0.00 61.00 62.82 2wnm s PRO 50 Cb -0.08 -4.22 -0.07 0.00 0.04 0.00 0.00 34.50 30.18 2wnm s PRO 50 CO 0.00 -1.69 0.52 0.42 0.04 0.00 0.00 177.00 176.29 2wnm s ILE 51 N 6.68 4.88 -0.19 0.56 -1.09 0.16 -4.89 121.20 127.31 2wnm s ILE 51 Ca 0.87 0.87 0.00 0.00 -2.23 0.00 0.00 60.65 60.16 2wnm s ILE 51 Cb -0.30 -3.76 0.05 0.00 -1.58 0.00 0.00 42.46 36.87 2wnm s ILE 51 CO 0.34 0.35 -0.07 -0.31 -1.23 0.00 0.00 174.94 174.02 2wnm s TYR 52 N -1.34 2.06 0.11 3.97 2.02 -1.26 0.40 117.35 123.31 2wnm s TYR 52 Ca 0.34 -1.38 -0.00 0.00 -0.37 0.00 0.00 57.07 55.66 2wnm s TYR 52 Cb -0.16 -1.47 0.00 0.00 -0.40 0.00 0.00 41.96 39.93 2wnm s TYR 52 CO 0.18 -0.69 0.15 0.00 -1.57 0.00 0.00 175.55 173.62 2wnm n ALA 53 N 4.77 -0.09 -0.09 3.71 0.00 -1.16 -4.94 120.51 122.72 2wnm n ALA 53 Ca -0.13 -0.52 -0.10 0.00 0.00 0.00 0.00 53.44 52.69 2wnm n ALA 53 Cb 0.47 0.42 -0.04 0.00 0.00 0.00 0.00 19.45 20.29 2wnm n ALA 53 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2wnm n GLU 54 N -0.18 0.50 -2.81 0.00 2.13 -1.26 -4.15 120.64 114.86 2wnm n GLU 54 Ca 0.00 0.44 -0.18 0.00 0.66 0.00 0.00 57.16 58.08 2wnm n GLU 54 Cb 0.19 -1.62 0.06 0.00 0.27 0.00 0.00 31.44 30.33 2wnm n GLU 54 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2wnm n THR 55 N -4.52 0.00 0.04 6.31 -2.24 -1.26 -4.95 114.28 107.65 2wnm n THR 55 Ca -0.16 -1.74 -0.10 0.00 -2.27 0.00 0.00 64.05 59.77 2wnm n THR 55 Cb 0.44 -0.54 -0.13 0.00 -2.10 0.00 0.00 70.33 68.00 2wnm n THR 55 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2wnm h LEU 56 N 0.00 0.11 -0.82 3.22 7.12 -1.98 -2.02 115.31 120.94 2wnm h LEU 56 Ca -0.25 -0.16 -0.08 0.00 0.13 0.00 0.00 57.88 57.53 2wnm h LEU 56 Cb 1.12 -0.04 -0.02 0.00 -0.53 0.00 0.00 40.66 41.19 2wnm h LEU 56 CO 0.35 1.13 -0.02 -0.78 -0.13 0.00 0.00 178.44 178.99 2wnm h ASP 57 N 0.02 0.84 -0.16 1.25 3.58 -1.98 0.39 116.42 120.35 2wnm h ASP 57 Ca -0.16 -0.22 -0.04 0.00 0.42 0.00 0.00 57.03 57.03 2wnm h ASP 57 Cb 1.91 -0.22 -0.00 0.00 1.72 0.00 0.00 39.33 42.73 2wnm h ASP 57 CO 0.12 0.91 -0.06 -0.08 -2.88 0.00 0.00 179.24 177.26 2wnm h GLU 58 N 0.80 0.33 -0.92 0.28 4.81 -1.95 -0.96 114.58 116.97 2wnm h GLU 58 Ca 0.15 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.29 2wnm h GLU 58 Cb 0.51 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.82 2wnm h GLU 58 CO 0.03 0.62 0.60 0.00 -0.73 0.00 0.00 179.01 179.53 2wnm h ALA 59 N 0.70 1.43 -0.05 2.92 0.00 -1.09 0.23 119.26 123.39 2wnm h ALA 59 Ca 0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2wnm h ALA 59 Cb 0.51 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2wnm h ALA 59 CO 0.02 0.46 0.01 1.25 0.00 0.00 0.00 179.25 180.99 2wnm h LEU 60 N 1.13 0.08 -0.86 0.00 6.46 -0.01 -1.37 115.31 120.75 2wnm h LEU 60 Ca 0.37 -0.25 -0.10 0.00 -0.12 0.00 0.00 57.88 57.79 2wnm h LEU 60 Cb 0.06 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 39.95 2wnm h LEU 60 CO -0.12 0.31 -0.20 1.05 -0.62 0.00 0.00 178.44 178.86 2wnm h GLU 61 N -0.15 0.63 -0.39 1.25 4.11 -0.91 -2.81 114.58 116.31 2wnm h GLU 61 Ca 0.02 -0.23 0.07 0.00 0.07 0.00 0.00 59.36 59.29 2wnm h GLU 61 Cb 0.26 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.40 2wnm h GLU 61 CO 0.00 0.79 -0.00 1.25 0.07 0.00 0.00 179.01 181.12 2wnm h LEU 62 N 0.56 -0.16 0.31 3.06 7.12 -0.29 0.29 115.31 126.19 2wnm h LEU 62 Ca 0.09 0.09 -0.01 0.00 0.13 0.00 0.00 57.88 58.18 2wnm h LEU 62 Cb 0.65 0.16 -0.01 0.00 -0.53 0.00 0.00 40.66 40.93 2wnm h LEU 62 CO 0.05 -0.05 -0.27 0.00 -0.13 0.00 0.00 178.44 178.04 2wnm h ALA 63 N 1.34 -1.00 0.00 1.25 0.00 -1.06 0.42 119.26 120.20 2wnm h ALA 63 Ca 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2wnm h ALA 63 Cb 0.27 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2wnm h ALA 63 CO -0.32 -1.01 0.05 0.93 0.00 0.00 0.00 179.25 178.90 2wnm h GLU 64 N -0.57 0.00 0.03 0.00 5.08 -1.23 0.27 114.58 118.17 2wnm h GLU 64 Ca -0.04 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.04 2wnm h GLU 64 Cb 0.48 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 2wnm h GLU 64 CO -0.01 0.00 -1.56 1.87 -1.00 0.00 0.00 179.01 178.31 2wnm n TRP 65 N -2.37 1.01 0.00 4.33 -0.00 0.98 -4.53 117.44 116.85 2wnm n TRP 65 Ca -0.02 0.36 -0.01 0.00 -0.00 0.00 0.00 57.50 57.84 2wnm n TRP 65 Cb 0.09 -1.11 -0.11 0.00 -0.00 0.00 0.00 31.31 30.18 2wnm n TRP 65 CO 0.00 0.00 0.00 0.94 -0.00 0.00 0.00 177.69 178.63 2wnm n GLN 66 N -4.16 0.64 -0.66 5.87 -0.06 0.14 -4.31 117.38 114.85 2wnm n GLN 66 Ca -0.34 0.14 0.01 0.00 -2.00 0.00 0.00 57.00 54.81 2wnm n GLN 66 Cb 0.80 -1.73 0.25 0.00 -4.06 0.00 0.00 30.24 25.50 2wnm n GLN 66 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 2wnm n TYR 67 N -2.80 1.54 0.20 3.69 0.53 0.91 -4.31 117.16 116.92 2wnm n TYR 67 Ca -0.13 -0.65 -0.14 0.00 -1.02 0.00 0.00 57.90 55.95 2wnm n TYR 67 Cb 0.87 -0.44 -0.08 0.00 -1.03 0.00 0.00 39.34 38.65 2wnm n TYR 67 CO 0.00 0.00 0.00 0.28 -1.02 0.00 0.00 176.86 176.12 2wnm h VAL 68 N 2.39 0.64 0.00 -0.72 2.07 -1.77 -2.89 116.25 115.96 2wnm h VAL 68 Ca 0.07 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2wnm h VAL 68 Cb 1.65 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 2wnm h VAL 68 CO 0.41 0.07 0.00 -2.65 0.02 0.00 0.00 177.57 175.42 2wnm n PRO 69 N -5.22 0.78 0.13 1.57 -0.02 -1.26 -3.10 135.00 127.88 2wnm n PRO 69 Ca -0.10 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.50 2wnm n PRO 69 Cb 0.26 -1.05 0.34 0.00 -0.02 0.00 0.00 33.50 33.04 2wnm n PRO 69 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wnm h ALA 70 N 2.66 0.98 0.00 3.55 0.00 -1.79 -3.47 119.26 121.19 2wnm h ALA 70 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2wnm h ALA 70 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2wnm h ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2wnm n GLY 71 N 1.26 2.15 3.77 0.00 0.00 -1.18 -4.97 105.19 106.23 2wnm n GLY 71 Ca 0.05 -0.36 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 2wnm n GLY 71 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wnm s PHE 72 N -0.04 1.31 -0.18 1.61 0.08 -1.26 -5.05 117.98 114.45 2wnm s PHE 72 Ca 0.00 0.48 -0.02 0.00 0.12 0.00 0.00 56.93 57.51 2wnm s PHE 72 Cb 0.00 -3.72 -0.01 0.00 -0.57 0.00 0.00 43.02 38.72 2wnm s PHE 72 CO 0.00 -3.09 -0.08 -2.00 -0.10 0.00 0.00 175.22 169.95 2wnm s GLU 73 N -5.59 3.40 -0.48 0.44 2.56 0.32 -4.82 118.70 114.52 2wnm s GLU 73 Ca 0.71 -0.64 -0.28 0.00 0.00 0.00 0.00 54.97 54.76 2wnm s GLU 73 Cb -0.08 -2.86 -0.01 0.00 2.00 0.00 0.00 34.13 33.18 2wnm s GLU 73 CO 0.54 -0.01 1.65 0.54 -0.56 0.00 0.00 175.26 177.42 2wnm s VAL 74 N 0.98 3.60 -0.12 3.70 0.11 -1.26 0.12 120.40 127.51 2wnm s VAL 74 Ca -0.01 0.53 0.18 0.00 -2.93 0.00 0.00 61.98 59.75 2wnm s VAL 74 Cb -0.15 -4.04 -0.20 0.00 -1.53 0.00 0.00 36.38 30.47 2wnm s VAL 74 CO -0.00 -0.82 0.59 0.35 -3.33 0.00 0.00 175.10 171.89 2wnm n THR 75 N 7.15 1.05 -3.85 5.04 -2.24 0.14 -4.91 114.28 116.66 2wnm n THR 75 Ca 0.18 -0.70 -0.09 0.00 -2.27 0.00 0.00 64.05 61.17 2wnm n THR 75 Cb 0.49 -0.56 -0.07 0.00 -2.10 0.00 0.00 70.33 68.08 2wnm n THR 75 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2wnm s ARG 76 N -2.91 0.81 -0.07 -0.78 0.52 -1.05 -4.98 118.95 110.48 2wnm s ARG 76 Ca -0.05 -0.87 -0.03 0.00 -0.52 0.00 0.00 55.73 54.25 2wnm s ARG 76 Cb 0.09 0.33 0.04 0.00 0.52 0.00 0.00 34.95 35.93 2wnm s ARG 76 CO 0.83 -0.25 0.14 0.08 0.02 0.00 0.00 175.30 176.12 2wnm s VAL 77 N -3.55 -0.16 0.12 3.52 1.01 -1.26 0.85 120.40 120.93 2wnm s VAL 77 Ca 0.02 0.29 0.09 0.00 0.00 0.00 0.00 61.98 62.38 2wnm s VAL 77 Cb 0.03 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 2wnm s VAL 77 CO -0.09 0.12 -0.21 0.00 0.00 0.00 0.00 175.10 174.91 2wnm s ARG 78 N 1.80 1.19 -0.09 2.72 1.70 0.43 -4.94 118.95 121.76 2wnm s ARG 78 Ca -0.02 -1.23 -0.28 0.00 -0.47 0.00 0.00 55.73 53.73 2wnm s ARG 78 Cb -0.12 -1.47 -0.02 0.00 -0.57 0.00 0.00 34.95 32.77 2wnm s ARG 78 CO -0.06 0.34 0.92 -2.14 -1.08 0.00 0.00 175.30 173.28 2wnm s PRO 79 N -2.07 4.43 0.09 3.89 0.02 -1.26 0.72 135.00 140.81 2wnm s PRO 79 Ca 0.09 1.24 -0.11 0.00 0.02 0.00 0.00 61.00 62.24 2wnm s PRO 79 Cb -0.09 -3.52 -0.19 0.00 0.02 0.00 0.00 34.50 30.72 2wnm s PRO 79 CO 0.05 -0.21 1.23 0.00 -0.33 0.00 0.00 177.00 177.74 2wnm n VAL 81 N -3.83 -1.21 -4.29 0.00 0.24 -1.20 -4.92 118.33 103.11 2wnm n VAL 81 Ca -0.10 -0.35 -0.19 0.00 -2.04 0.00 0.00 64.34 61.66 2wnm n VAL 81 Cb 0.86 -1.07 -0.13 0.00 -1.47 0.00 0.00 33.84 32.03 2wnm n VAL 81 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wnm s ALA 82 N -3.98 1.02 -1.35 2.33 0.00 -1.26 -5.02 121.76 113.50 2wnm s ALA 82 Ca 0.18 -0.77 0.26 0.00 0.00 0.00 0.00 51.96 51.63 2wnm s ALA 82 Cb -0.10 -0.14 1.26 0.00 0.00 0.00 0.00 23.12 24.14 2wnm s ALA 82 CO 0.64 0.17 1.86 -0.35 0.00 0.00 0.00 175.76 178.08 2wnm n PRO 83 N 1.91 0.30 0.00 0.00 -0.04 -1.26 -4.54 135.00 131.37 2wnm n PRO 83 Ca -0.18 0.05 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 2wnm n PRO 83 Cb 0.55 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 2wnm n PRO 83 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09