#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wes s SER 2 N 0.00 -0.13 -0.22 1.61 0.15 -1.26 -5.15 113.70 108.70 1wes s SER 2 Ca 0.00 -0.62 -0.04 0.00 0.70 0.00 0.00 55.95 55.99 1wes s SER 2 Cb 0.00 0.60 0.10 0.00 -1.71 0.00 0.00 66.02 65.01 1wes s SER 2 CO 0.00 -1.14 0.21 -0.44 1.20 0.00 0.00 173.24 173.06 1wes s SER 3 N -3.05 1.68 0.00 5.45 0.01 -1.26 -5.09 113.70 111.45 1wes s SER 3 Ca 0.14 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 56.99 1wes s SER 3 Cb -0.03 0.27 0.00 0.00 0.21 0.00 0.00 66.02 66.47 1wes s SER 3 CO 0.05 -0.35 0.00 0.61 0.41 0.00 0.00 173.24 173.97 1wes n GLY 4 N 5.31 1.75 3.05 3.44 0.00 -1.26 -5.17 105.19 112.30 1wes n GLY 4 Ca -0.05 0.29 -0.20 0.00 0.00 0.00 0.00 46.02 46.06 1wes n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wes s SER 5 N 0.00 1.29 0.13 1.61 0.15 -1.26 -5.14 113.70 110.47 1wes s SER 5 Ca 0.00 -0.20 -0.24 0.00 0.70 0.00 0.00 55.95 56.21 1wes s SER 5 Cb 0.00 -0.17 0.08 0.00 -1.71 0.00 0.00 66.02 64.22 1wes s SER 5 CO 0.00 0.13 1.10 -0.94 1.20 0.00 0.00 173.24 174.73 1wes s SER 6 N -0.20 -0.02 0.00 5.45 1.04 -1.26 -5.19 113.70 113.52 1wes s SER 6 Ca 0.03 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 55.95 1wes s SER 6 Cb -0.05 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1wes s SER 6 CO -0.00 -0.79 0.00 0.61 0.98 0.00 0.00 173.24 174.04 1wes n GLY 7 N -0.71 4.04 3.17 7.32 0.00 -1.26 -5.18 105.19 112.58 1wes n GLY 7 Ca -0.02 -1.03 -0.16 0.00 0.00 0.00 0.00 46.02 44.81 1wes n GLY 7 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1wes s GLU 8 N 1.11 0.84 -0.78 1.61 1.03 -1.26 -5.10 118.70 116.15 1wes s GLU 8 Ca 0.00 -1.08 -0.20 0.00 0.03 0.00 0.00 54.97 53.72 1wes s GLU 8 Cb 0.00 -0.65 0.11 0.00 -0.80 0.00 0.00 34.13 32.79 1wes s GLU 8 CO 0.00 0.12 0.98 -0.06 -1.33 0.00 0.00 175.26 174.97 1wes s PHE 9 N -1.99 2.99 -0.13 4.83 0.08 -1.26 -4.98 117.98 117.53 1wes s PHE 9 Ca 0.03 -1.09 -0.09 0.00 0.12 0.00 0.00 56.93 55.90 1wes s PHE 9 Cb -0.06 -4.22 0.04 0.00 -0.57 0.00 0.00 43.02 38.22 1wes s PHE 9 CO 0.01 -1.48 0.32 0.00 -0.10 0.00 0.00 175.22 173.98 1wes s ALA 10 N 2.98 -0.80 -0.42 5.36 0.00 -1.26 -5.12 121.76 122.51 1wes s ALA 10 Ca 0.25 1.07 -0.29 0.00 0.00 0.00 0.00 51.96 53.00 1wes s ALA 10 Cb -0.12 -0.65 0.01 0.00 0.00 0.00 0.00 23.12 22.36 1wes s ALA 10 CO -0.01 -0.19 1.35 0.42 0.00 0.00 0.00 175.76 177.34 1wes s ILE 11 N 0.71 3.97 -0.12 0.00 1.01 -1.26 -5.00 121.20 120.52 1wes s ILE 11 Ca -0.04 1.00 0.01 0.00 0.00 0.00 0.00 60.65 61.62 1wes s ILE 11 Cb -0.06 -4.28 0.02 0.00 0.01 0.00 0.00 42.46 38.15 1wes s ILE 11 CO -0.05 -0.79 -0.15 -1.81 0.00 0.00 0.00 174.94 172.13 1wes s ASP 12 N 3.60 2.55 0.00 3.58 1.11 -1.26 -4.99 116.67 121.26 1wes s ASP 12 Ca 0.58 -0.46 0.04 0.00 0.18 0.00 0.00 52.55 52.90 1wes s ASP 12 Cb -0.12 -1.14 0.24 0.00 1.07 0.00 0.00 42.92 42.97 1wes s ASP 12 CO 0.32 0.00 0.71 -0.81 1.18 0.00 0.00 175.17 176.57 1wes n PRO 13 N 4.35 0.49 -0.09 8.23 -0.04 -1.26 -2.81 135.00 143.87 1wes n PRO 13 Ca -0.18 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.05 1wes n PRO 13 Cb 0.51 -1.13 -0.12 0.00 -0.04 0.00 0.00 33.50 32.72 1wes n PRO 13 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1wes n ASN 14 N -0.63 1.99 -4.66 3.54 2.85 -1.26 -4.94 115.26 112.15 1wes n ASN 14 Ca 0.03 0.21 -0.46 0.00 -0.11 0.00 0.00 54.58 54.26 1wes n ASN 14 Cb 0.01 -0.78 -0.03 0.00 1.24 0.00 0.00 39.78 40.23 1wes n ASN 14 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 1wes n GLU 15 N -3.86 1.95 -1.17 1.20 4.71 -1.12 -4.96 120.64 117.38 1wes n GLU 15 Ca -0.41 0.70 -0.29 0.00 -0.01 0.00 0.00 57.16 57.15 1wes n GLU 15 Cb 0.90 -2.36 0.17 0.00 -1.01 0.00 0.00 31.44 29.14 1wes n GLU 15 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 1wes s PRO 16 N -0.08 0.55 -0.13 3.49 0.04 -1.26 -4.81 135.00 132.79 1wes s PRO 16 Ca 0.72 0.56 -0.03 0.00 0.04 0.00 0.00 61.00 62.29 1wes s PRO 16 Cb -0.69 -1.75 -0.03 0.00 0.04 0.00 0.00 34.50 32.08 1wes s PRO 16 CO 0.47 -2.66 -0.04 0.95 0.04 0.00 0.00 177.00 175.76 1wes s THR 17 N -2.96 3.93 -0.00 1.26 -4.23 -1.26 -4.24 115.64 108.13 1wes s THR 17 Ca 0.65 -0.36 -0.04 0.00 -1.18 0.00 0.00 61.69 60.76 1wes s THR 17 Cb -0.18 -2.70 -0.01 0.00 1.34 0.00 0.00 72.50 70.95 1wes s THR 17 CO 0.57 0.52 -0.08 -1.22 -0.54 0.00 0.00 174.62 173.88 1wes n TYR 18 N 3.14 0.00 -1.13 3.99 4.02 -1.19 -4.85 117.16 121.14 1wes n TYR 18 Ca -0.18 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.35 1wes n TYR 18 Cb 0.53 -0.11 0.04 0.00 -0.02 0.00 0.00 39.34 39.78 1wes n TYR 18 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1wes h LEU 20 N -0.56 0.93 0.00 0.00 3.38 -1.94 0.32 115.31 117.44 1wes h LEU 20 Ca -0.43 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1wes h LEU 20 Cb 1.36 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1wes h LEU 20 CO 0.35 0.49 0.00 0.00 0.09 0.00 0.00 178.44 179.37 1wes n ASN 22 N -1.40 -2.06 -4.33 0.00 3.02 0.11 -5.04 115.26 105.57 1wes n ASN 22 Ca 0.00 -0.49 -0.19 0.00 -0.03 0.00 0.00 54.58 53.87 1wes n ASN 22 Cb 0.01 -4.18 -0.10 0.00 -0.61 0.00 0.00 39.78 34.90 1wes n ASN 22 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1wes s GLN 23 N -5.09 1.27 0.78 3.52 -1.52 -1.26 -4.81 119.66 112.55 1wes s GLN 23 Ca 0.00 -1.49 -0.12 0.00 -1.95 0.00 0.00 55.36 51.80 1wes s GLN 23 Cb -0.00 -1.14 0.06 0.00 -0.22 0.00 0.00 33.01 31.71 1wes s GLN 23 CO 0.58 0.21 1.14 0.14 -0.25 0.00 0.00 175.29 177.10 1wes s VAL 24 N -2.62 2.74 0.04 1.09 -7.23 -1.26 -3.18 120.40 109.98 1wes s VAL 24 Ca 0.19 0.29 -0.29 0.00 -1.81 0.00 0.00 61.98 60.36 1wes s VAL 24 Cb -0.03 -2.68 -0.04 0.00 0.56 0.00 0.00 36.38 34.19 1wes s VAL 24 CO 0.06 -0.27 0.93 -0.55 -0.31 0.00 0.00 175.10 174.96 1wes s SER 25 N -2.72 7.37 0.21 4.85 0.15 -1.26 -4.90 113.70 117.40 1wes s SER 25 Ca 0.67 1.65 0.00 0.00 0.70 0.00 0.00 55.95 58.97 1wes s SER 25 Cb -0.22 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.54 1wes s SER 25 CO 0.51 -0.15 0.00 0.00 1.20 0.00 0.00 173.24 174.80 1wes n TYR 26 N 3.36 -1.70 -1.23 3.44 4.11 -1.26 -5.08 117.16 118.79 1wes n TYR 26 Ca 0.03 0.30 0.00 0.00 -0.00 0.00 0.00 57.90 58.23 1wes n TYR 26 Cb 0.50 0.44 0.00 0.00 -0.00 0.00 0.00 39.34 40.28 1wes n TYR 26 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1wes n GLY 27 N 1.99 0.01 3.72 -7.48 0.00 -1.26 -5.01 105.19 97.15 1wes n GLY 27 Ca 0.00 -1.80 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 1wes n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wes s GLU 28 N -1.04 4.38 0.09 1.61 8.01 -1.26 -5.00 118.70 125.49 1wes s GLU 28 Ca 0.00 1.96 0.06 0.00 0.01 0.00 0.00 54.97 57.00 1wes s GLU 28 Cb 0.00 -3.27 -0.03 0.00 -4.31 0.00 0.00 34.13 26.52 1wes s GLU 28 CO 0.00 -0.33 -0.15 -1.64 0.01 0.00 0.00 175.26 173.15 1wes s MET 29 N 0.82 0.94 0.11 1.61 -1.94 -1.26 -3.11 119.30 116.48 1wes s MET 29 Ca 0.61 -1.08 0.03 0.00 -1.71 0.00 0.00 55.69 53.54 1wes s MET 29 Cb -0.34 -0.96 -0.04 0.00 2.01 0.00 0.00 34.83 35.50 1wes s MET 29 CO 0.31 0.21 0.13 0.96 -0.01 0.00 0.00 175.02 176.62 1wes s ILE 30 N -1.51 4.64 -0.54 2.53 -0.00 -1.00 -4.81 121.20 120.51 1wes s ILE 30 Ca 0.03 -0.85 -0.16 0.00 -0.00 0.00 0.00 60.65 59.67 1wes s ILE 30 Cb -0.08 -3.30 0.13 0.00 -0.00 0.00 0.00 42.46 39.20 1wes s ILE 30 CO 0.03 0.02 0.51 -0.83 -0.00 0.00 0.00 174.94 174.67 1wes s GLY 31 N -2.72 2.07 -0.35 6.27 0.00 -1.25 -2.89 107.32 108.45 1wes s GLY 31 Ca 0.31 -2.51 -0.34 0.00 0.00 0.00 0.00 44.72 42.17 1wes s GLY 31 CO 0.23 1.22 1.16 0.00 0.00 0.00 0.00 173.10 175.71 1wes n ASP 33 N 2.84 0.14 -4.55 0.00 -0.08 0.64 -3.90 116.55 111.64 1wes n ASP 33 Ca 0.22 1.63 -0.35 0.00 -1.51 0.00 0.00 54.79 54.78 1wes n ASP 33 Cb -0.04 -0.71 -0.03 0.00 2.34 0.00 0.00 41.12 42.68 1wes n ASP 33 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 1wes s ASN 34 N -4.74 4.83 0.13 1.67 2.47 -1.26 -4.85 114.94 113.19 1wes s ASN 34 Ca -0.10 0.54 -0.29 0.00 0.42 0.00 0.00 52.86 53.43 1wes s ASN 34 Cb 0.31 -2.52 -0.05 0.00 -1.45 0.00 0.00 41.25 37.54 1wes s ASN 34 CO 0.76 -2.71 1.59 -0.33 -3.72 0.00 0.00 177.10 172.68 1wes h GLU 35 N 16.45 -0.47 -0.70 0.43 5.08 -1.95 -1.06 114.58 132.36 1wes h GLU 35 Ca -0.21 0.03 0.28 0.00 -1.00 0.00 0.00 59.36 58.46 1wes h GLU 35 Cb 1.18 0.11 -0.13 0.00 0.50 0.00 0.00 28.75 30.41 1wes h GLU 35 CO 1.18 -0.31 0.31 1.04 -1.00 0.00 0.00 179.01 180.22 1wes n GLN 36 N -5.43 -0.04 -1.43 2.33 6.02 -1.26 -4.38 117.38 113.18 1wes n GLN 36 Ca -0.04 0.99 -0.59 0.00 -0.01 0.00 0.00 57.00 57.34 1wes n GLN 36 Cb 0.36 -1.73 -0.10 0.00 1.02 0.00 0.00 30.24 29.79 1wes n GLN 36 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1wes n PRO 38 N 6.77 0.49 -0.03 0.00 -0.04 -1.26 -3.49 135.00 137.43 1wes n PRO 38 Ca 0.45 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.85 1wes n PRO 38 Cb 0.03 -1.37 -0.02 0.00 -0.04 0.00 0.00 33.50 32.10 1wes n PRO 38 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1wes n ILE 39 N -0.87 1.39 -4.25 0.52 5.41 -1.26 -4.98 119.36 115.31 1wes n ILE 39 Ca 0.09 0.24 -0.38 0.00 1.00 0.00 0.00 62.75 63.70 1wes n ILE 39 Cb 0.04 -2.04 -0.07 0.00 -0.71 0.00 0.00 39.64 36.86 1wes n ILE 39 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1wes n GLU 40 N -4.07 -0.89 -3.36 0.38 1.02 -1.23 -4.85 120.64 107.65 1wes n GLU 40 Ca -0.09 0.12 0.02 0.00 -0.02 0.00 0.00 57.16 57.19 1wes n GLU 40 Cb 0.32 -4.48 -0.03 0.00 -0.02 0.00 0.00 31.44 27.24 1wes n GLU 40 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1wes s TRP 41 N -3.05 -1.26 -0.03 -0.32 0.52 -1.17 -3.88 118.94 109.75 1wes s TRP 41 Ca 0.74 1.72 -0.09 0.00 0.02 0.00 0.00 56.10 58.50 1wes s TRP 41 Cb -0.43 0.59 0.01 0.00 -1.15 0.00 0.00 33.47 32.49 1wes s TRP 41 CO 0.91 -0.66 0.20 -0.06 0.02 0.00 0.00 176.95 177.36 1wes s PHE 42 N 2.82 -0.11 0.40 -1.98 0.08 -1.14 -2.95 117.98 115.10 1wes s PHE 42 Ca 0.05 0.22 -0.24 0.00 0.12 0.00 0.00 56.93 57.08 1wes s PHE 42 Cb -0.12 0.03 -0.09 0.00 -0.57 0.00 0.00 43.02 42.27 1wes s PHE 42 CO -0.19 -0.24 1.10 -1.01 -0.10 0.00 0.00 175.22 174.79 1wes s HIS 43 N -0.79 3.17 0.04 0.36 3.76 -1.26 -2.37 115.29 118.20 1wes s HIS 43 Ca -0.09 1.61 -0.25 0.00 -0.15 0.00 0.00 55.06 56.17 1wes s HIS 43 Cb -0.05 -3.25 -0.17 0.00 1.11 0.00 0.00 32.58 30.23 1wes s HIS 43 CO 0.02 -0.94 1.50 0.74 -0.85 0.00 0.00 174.74 175.21 1wes h PHE 44 N 2.53 -0.20 -0.73 1.40 -1.00 -1.92 -1.03 116.94 115.99 1wes h PHE 44 Ca -0.48 -0.00 0.10 0.00 2.81 0.00 0.00 57.97 60.39 1wes h PHE 44 Cb 1.23 0.07 -0.08 0.00 3.61 0.00 0.00 35.95 40.78 1wes h PHE 44 CO 0.56 0.03 0.36 1.03 -1.61 0.00 0.00 178.31 178.68 1wes h SER 45 N -0.40 0.46 0.01 2.17 0.87 -1.93 0.24 113.55 114.97 1wes h SER 45 Ca -0.02 0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1wes h SER 45 Cb 0.32 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 1wes h SER 45 CO 0.04 0.25 -0.01 0.00 -0.53 0.00 0.00 176.83 176.58 1wes n VAL 47 N -5.01 1.05 -3.83 0.00 0.24 -0.40 -4.85 118.33 105.52 1wes n VAL 47 Ca -0.08 -0.23 -0.26 0.00 -2.04 0.00 0.00 64.34 61.73 1wes n VAL 47 Cb 0.12 -0.81 -0.03 0.00 -1.47 0.00 0.00 33.84 31.65 1wes n VAL 47 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1wes n SER 48 N 0.23 -1.00 -0.07 -1.34 7.64 -0.51 -4.82 113.62 113.76 1wes n SER 48 Ca 0.07 -0.86 -0.12 0.00 1.01 0.00 0.00 58.87 58.97 1wes n SER 48 Cb 0.58 -1.05 -0.04 0.00 -1.01 0.00 0.00 64.21 62.70 1wes n SER 48 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1wes n LEU 49 N -3.53 1.67 -1.92 -3.43 4.77 0.72 -4.98 117.00 110.30 1wes n LEU 49 Ca -0.15 0.28 -0.14 0.00 -0.03 0.00 0.00 56.01 55.97 1wes n LEU 49 Cb 0.42 -0.64 -0.03 0.00 -2.33 0.00 0.00 43.42 40.83 1wes n LEU 49 CO 0.53 -0.14 -0.16 0.41 -1.33 0.00 0.00 177.39 176.70 1wes n THR 50 N -4.15 -0.34 -3.64 -5.08 -1.04 -1.24 -4.86 114.28 93.94 1wes n THR 50 Ca -0.20 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.79 1wes n THR 50 Cb 0.51 -1.68 -0.03 0.00 -1.82 0.00 0.00 70.33 67.31 1wes n THR 50 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 1wes s TYR 51 N -2.45 -0.04 -0.41 -1.42 -0.85 -1.26 -5.09 117.35 105.82 1wes s TYR 51 Ca 0.00 0.06 -0.29 0.00 -0.52 0.00 0.00 57.07 56.32 1wes s TYR 51 Cb 0.00 0.50 0.02 0.00 0.38 0.00 0.00 41.96 42.86 1wes s TYR 51 CO 0.00 -0.05 1.21 0.21 -1.52 0.00 0.00 175.55 175.40 1wes s LYS 52 N -1.45 3.77 -0.27 -3.49 2.36 -1.26 -4.98 119.74 114.42 1wes s LYS 52 Ca 0.10 0.82 -0.29 0.00 -2.55 0.00 0.00 55.97 54.05 1wes s LYS 52 Cb -0.01 -3.90 -0.02 0.00 -1.05 0.00 0.00 37.83 32.85 1wes s LYS 52 CO -0.06 -1.31 1.65 -1.25 1.55 0.00 0.00 175.35 175.93 1wes s PRO 53 N 4.40 3.63 0.16 4.03 0.04 -1.26 -4.98 135.00 141.02 1wes s PRO 53 Ca 0.52 1.51 -0.30 0.00 0.04 0.00 0.00 61.00 62.77 1wes s PRO 53 Cb -0.11 -4.08 -0.07 0.00 0.04 0.00 0.00 34.50 30.28 1wes s PRO 53 CO 0.28 -1.50 1.14 0.15 0.04 0.00 0.00 177.00 177.11 1wes s LYS 54 N 5.01 4.54 0.00 4.56 -0.14 -1.26 -4.66 119.74 127.79 1wes s LYS 54 Ca 0.73 1.76 0.00 0.00 -1.36 0.00 0.00 55.97 57.10 1wes s LYS 54 Cb -0.23 -3.28 0.00 0.00 -1.68 0.00 0.00 37.83 32.64 1wes s LYS 54 CO 0.31 -0.02 0.00 0.41 -0.76 0.00 0.00 175.35 175.29 1wes n GLY 55 N 2.28 0.77 3.22 -3.33 0.00 -1.26 -4.93 105.19 101.95 1wes n GLY 55 Ca 0.04 -1.16 -0.30 0.00 0.00 0.00 0.00 46.02 44.60 1wes n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wes s LYS 56 N 0.00 2.49 -0.19 1.61 -2.85 -1.26 -5.08 119.74 114.47 1wes s LYS 56 Ca 0.00 -0.82 -0.01 0.00 -1.00 0.00 0.00 55.97 54.14 1wes s LYS 56 Cb 0.00 -2.05 0.05 0.00 -2.06 0.00 0.00 37.83 33.77 1wes s LYS 56 CO 0.00 0.29 -0.02 -0.46 0.10 0.00 0.00 175.35 175.26 1wes s TRP 57 N 0.03 1.58 -0.32 1.78 -0.00 -1.26 -5.01 118.94 115.74 1wes s TRP 57 Ca -0.08 -1.12 -0.10 0.00 -0.00 0.00 0.00 56.10 54.80 1wes s TRP 57 Cb -0.14 -1.25 -0.01 0.00 -0.00 0.00 0.00 33.47 32.07 1wes s TRP 57 CO 0.05 -0.64 0.18 0.71 -0.00 0.00 0.00 176.95 177.25 1wes s TYR 58 N 1.67 3.19 0.73 5.86 1.51 -1.26 -0.26 117.35 128.80 1wes s TYR 58 Ca -0.01 -0.50 -0.17 0.00 -1.01 0.00 0.00 57.07 55.38 1wes s TYR 58 Cb -0.17 -2.39 -0.15 0.00 -0.11 0.00 0.00 41.96 39.15 1wes s TYR 58 CO -0.07 -0.44 -0.44 0.00 -1.11 0.00 0.00 175.55 173.48 1wes n PRO 60 N 1.95 0.49 -0.08 0.00 -0.04 -1.26 -2.11 135.00 133.95 1wes n PRO 60 Ca 0.03 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.40 1wes n PRO 60 Cb 0.51 -1.41 -0.15 0.00 -0.04 0.00 0.00 33.50 32.40 1wes n PRO 60 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1wes n LYS 61 N -0.91 0.67 -0.04 0.54 4.76 -1.26 -4.32 118.16 117.60 1wes n LYS 61 Ca 0.10 0.06 -0.12 0.00 -2.87 0.00 0.00 58.31 55.48 1wes n LYS 61 Cb 0.04 -1.59 -0.14 0.00 -1.84 0.00 0.00 35.03 31.50 1wes n LYS 61 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1wes n ARG 63 N -3.09 1.27 0.42 0.00 -4.01 -0.90 -4.36 116.66 105.98 1wes n ARG 63 Ca -0.25 -0.33 -0.16 0.00 -1.04 0.00 0.00 57.85 56.07 1wes n ARG 63 Cb 1.07 -1.33 -0.08 0.00 -3.04 0.00 0.00 32.46 29.08 1wes n ARG 63 CO 0.00 0.00 0.00 0.78 -3.04 0.00 0.00 177.63 175.37 1wes h GLY 64 N 4.22 -1.12 -6.45 2.89 0.00 -1.75 -3.40 103.07 97.46 1wes h GLY 64 Ca 0.04 0.42 -0.57 0.00 0.00 0.00 0.00 47.33 47.22 1wes h GLY 64 CO 0.09 -0.41 1.13 -0.35 0.00 0.00 0.00 176.54 177.01 1wes s ASP 65 N -3.57 6.28 0.11 0.19 -1.08 -1.26 -4.95 116.67 112.39 1wes s ASP 65 Ca -0.16 1.28 -0.31 0.00 -0.52 0.00 0.00 52.55 52.84 1wes s ASP 65 Cb 0.02 -2.53 -0.10 0.00 -1.46 0.00 0.00 42.92 38.84 1wes s ASP 65 CO 0.47 -1.40 1.82 -0.44 0.52 0.00 0.00 175.17 176.14 1wes s SER 66 N 4.46 6.45 0.08 -0.34 0.01 -1.26 -4.73 113.70 118.36 1wes s SER 66 Ca 0.69 2.71 0.00 0.00 1.31 0.00 0.00 55.95 60.66 1wes s SER 66 Cb -0.20 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.47 1wes s SER 66 CO 0.31 -1.00 0.00 0.61 0.41 0.00 0.00 173.24 173.57 1wes n GLY 67 N 4.24 -1.39 0.00 3.44 0.00 -1.26 -4.92 105.19 105.30 1wes n GLY 67 Ca 0.18 0.32 0.07 0.00 0.00 0.00 0.00 46.02 46.58 1wes n GLY 67 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wes n PRO 68 N -2.67 0.08 0.05 1.61 -0.04 -1.26 -3.42 135.00 129.35 1wes n PRO 68 Ca 0.00 0.21 -0.11 0.00 -0.04 0.00 0.00 63.50 63.56 1wes n PRO 68 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 1wes n PRO 68 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1wes h SER 69 N 0.00 -0.45 -2.77 3.54 0.02 -1.94 -3.42 113.55 108.53 1wes h SER 69 Ca 0.00 0.07 -0.58 0.00 -0.84 0.00 0.00 61.79 60.44 1wes h SER 69 Cb 0.20 0.19 0.18 0.00 0.14 0.00 0.00 62.40 63.11 1wes h SER 69 CO 0.00 -0.21 -0.63 -1.54 -1.14 0.00 0.00 176.83 173.31 1wes n SER 70 N -5.29 -1.89 0.00 3.07 3.41 -1.22 -5.25 113.62 106.45 1wes n SER 70 Ca -0.05 0.66 0.00 0.00 -0.26 0.00 0.00 58.87 59.22 1wes n SER 70 Cb 0.20 -1.09 0.00 0.00 -0.26 0.00 0.00 64.21 63.06 1wes n SER 70 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49