#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2clv s GLN 2 N 0.00 4.02 -0.22 0.38 -0.21 -1.26 -4.97 119.66 117.40 2clv s GLN 2 Ca 0.00 0.53 -0.09 0.00 0.02 0.00 0.00 55.36 55.82 2clv s GLN 2 Cb 0.00 -3.11 -0.04 0.00 1.00 0.00 0.00 33.01 30.86 2clv s GLN 2 CO 0.00 0.59 0.10 0.15 -2.12 0.00 0.00 175.29 174.01 2clv s LYS 3 N -1.45 3.95 0.11 2.91 1.02 -0.58 -4.96 119.74 120.74 2clv s LYS 3 Ca 0.31 -0.34 -0.30 0.00 0.02 0.00 0.00 55.97 55.66 2clv s LYS 3 Cb -0.17 -3.35 -0.06 0.00 -0.52 0.00 0.00 37.83 33.73 2clv s LYS 3 CO 0.18 0.11 1.07 -0.08 -0.92 0.00 0.00 175.35 175.70 2clv s THR 4 N 0.86 4.20 0.31 2.17 -1.32 -1.25 -2.44 115.64 118.17 2clv s THR 4 Ca 0.05 1.76 -0.29 0.00 -1.21 0.00 0.00 61.69 62.00 2clv s THR 4 Cb -0.13 -4.13 -0.10 0.00 -1.51 0.00 0.00 72.50 66.63 2clv s THR 4 CO 0.03 0.24 1.41 -2.84 -2.21 0.00 0.00 174.62 171.25 2clv s PRO 5 N 0.20 4.25 -0.03 7.08 0.02 -1.26 -4.45 135.00 140.81 2clv s PRO 5 Ca 0.51 2.35 -0.07 0.00 0.02 0.00 0.00 61.00 63.81 2clv s PRO 5 Cb -0.27 -3.06 -0.05 0.00 0.02 0.00 0.00 34.50 31.15 2clv s PRO 5 CO 0.31 -0.37 0.24 -0.65 -0.33 0.00 0.00 177.00 176.20 2clv s GLN 6 N -1.27 3.56 -0.03 5.54 -0.21 0.55 -4.92 119.66 122.88 2clv s GLN 6 Ca 0.54 -0.06 0.03 0.00 0.02 0.00 0.00 55.36 55.90 2clv s GLN 6 Cb -0.43 -3.13 0.00 0.00 1.00 0.00 0.00 33.01 30.46 2clv s GLN 6 CO 0.51 0.70 -0.12 0.42 -2.12 0.00 0.00 175.29 174.68 2clv s ILE 7 N -1.19 1.03 -0.06 1.08 1.01 -1.26 -0.76 121.20 121.04 2clv s ILE 7 Ca 0.23 -0.49 0.03 0.00 0.00 0.00 0.00 60.65 60.43 2clv s ILE 7 Cb -0.13 -0.90 0.00 0.00 0.01 0.00 0.00 42.46 41.44 2clv s ILE 7 CO 0.12 0.31 -0.15 -1.10 0.00 0.00 0.00 174.94 174.13 2clv s GLN 8 N 0.19 1.78 -0.15 2.79 -0.21 -0.26 -4.98 119.66 118.81 2clv s GLN 8 Ca -0.04 -0.52 -0.00 0.00 0.02 0.00 0.00 55.36 54.81 2clv s GLN 8 Cb -0.10 -1.49 -0.01 0.00 1.00 0.00 0.00 33.01 32.41 2clv s GLN 8 CO 0.01 0.13 -0.13 0.08 -2.12 0.00 0.00 175.29 173.27 2clv s VAL 9 N 0.34 2.91 -0.08 1.09 1.01 -1.26 -0.74 120.40 123.67 2clv s VAL 9 Ca -0.10 -0.69 -0.30 0.00 0.00 0.00 0.00 61.98 60.89 2clv s VAL 9 Cb -0.14 -2.24 0.11 0.00 0.00 0.00 0.00 36.38 34.12 2clv s VAL 9 CO 0.03 0.51 0.95 -0.72 0.00 0.00 0.00 175.10 175.87 2clv s TYR 10 N 0.67 -0.35 0.31 5.22 -0.85 -0.61 -4.53 117.35 117.21 2clv s TYR 10 Ca -0.07 0.39 -0.09 0.00 -0.52 0.00 0.00 57.07 56.77 2clv s TYR 10 Cb -0.15 0.50 -0.07 0.00 0.38 0.00 0.00 41.96 42.62 2clv s TYR 10 CO 0.02 -0.44 0.64 -1.54 -1.52 0.00 0.00 175.55 172.71 2clv s SER 11 N -1.90 6.57 0.08 -0.18 1.04 -1.26 0.51 113.70 118.56 2clv s SER 11 Ca 0.02 0.98 -0.18 0.00 0.48 0.00 0.00 55.95 57.26 2clv s SER 11 Cb -0.01 -2.25 -0.08 0.00 0.10 0.00 0.00 66.02 63.77 2clv s SER 11 CO -0.04 -0.22 1.47 -0.09 0.98 0.00 0.00 173.24 175.34 2clv h ARG 12 N 1.91 0.52 -6.36 4.02 2.43 -1.38 -3.45 114.38 112.07 2clv h ARG 12 Ca -0.47 -0.21 -0.60 0.00 -0.81 0.00 0.00 59.98 57.89 2clv h ARG 12 Cb 1.18 -0.03 -0.12 0.00 -0.42 0.00 0.00 29.97 30.58 2clv h ARG 12 CO 0.66 0.74 -0.69 -1.01 -1.51 0.00 0.00 179.97 178.17 2clv s HIS 13 N -4.71 2.70 0.08 2.20 3.76 -1.26 -5.05 115.29 113.00 2clv s HIS 13 Ca -0.13 -0.20 -0.35 0.00 -0.15 0.00 0.00 55.06 54.23 2clv s HIS 13 Cb 0.08 -1.29 -0.14 0.00 1.11 0.00 0.00 32.58 32.34 2clv s HIS 13 CO 0.77 0.54 1.58 -2.30 -0.85 0.00 0.00 174.74 174.48 2clv n PRO 14 N -0.22 1.86 -2.29 8.40 -0.02 -1.26 -4.87 135.00 136.59 2clv n PRO 14 Ca -0.09 0.67 -0.42 0.00 -2.02 0.00 0.00 63.50 61.64 2clv n PRO 14 Cb 0.56 -2.42 -0.03 0.00 -0.02 0.00 0.00 33.50 31.59 2clv n PRO 14 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2clv s PRO 15 N 1.46 4.40 -0.11 0.52 0.04 -1.26 -5.02 135.00 135.02 2clv s PRO 15 Ca 0.83 1.94 0.01 0.00 0.04 0.00 0.00 61.00 63.82 2clv s PRO 15 Cb -0.77 -3.27 0.02 0.00 0.04 0.00 0.00 34.50 30.53 2clv s PRO 15 CO 0.44 -0.28 -0.11 -1.21 0.04 0.00 0.00 177.00 175.88 2clv s GLU 16 N 0.61 1.78 0.21 4.56 2.02 -1.26 -5.11 118.70 121.50 2clv s GLU 16 Ca 0.59 -0.38 -0.32 0.00 0.02 0.00 0.00 54.97 54.89 2clv s GLU 16 Cb -0.34 -1.67 -0.14 0.00 0.10 0.00 0.00 34.13 32.08 2clv s GLU 16 CO 0.33 -0.17 1.33 0.09 0.02 0.00 0.00 175.26 176.85 2clv n ASN 17 N 4.58 2.26 0.00 -0.19 5.03 -1.26 -1.65 115.26 124.04 2clv n ASN 17 Ca -0.16 1.14 0.00 0.00 0.87 0.00 0.00 54.58 56.43 2clv n ASN 17 Cb 0.51 -1.35 0.00 0.00 -1.02 0.00 0.00 39.78 37.91 2clv n ASN 17 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2clv n GLY 18 N 2.15 1.80 3.50 7.41 0.00 -0.67 -5.00 105.19 114.38 2clv n GLY 18 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2clv n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2clv s LYS 19 N -0.39 3.71 0.44 1.61 -0.14 -0.66 -4.99 119.74 119.33 2clv s LYS 19 Ca 0.00 -0.48 -0.24 0.00 -1.36 0.00 0.00 55.97 53.89 2clv s LYS 19 Cb 0.00 -3.07 -0.10 0.00 -1.68 0.00 0.00 37.83 32.98 2clv s LYS 19 CO 0.00 0.13 1.12 -2.30 -0.76 0.00 0.00 175.35 173.54 2clv n PRO 20 N 3.90 1.55 -2.57 -1.68 -0.02 -1.26 -4.27 135.00 130.65 2clv n PRO 20 Ca -0.17 0.56 -0.06 0.00 -2.02 0.00 0.00 63.50 61.81 2clv n PRO 20 Cb 0.52 -2.20 -0.00 0.00 -0.02 0.00 0.00 33.50 31.80 2clv n PRO 20 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2clv n ASN 21 N 0.24 -0.83 -4.02 2.55 2.85 0.60 -4.99 115.26 111.66 2clv n ASN 21 Ca 0.09 -1.86 -0.26 0.00 -0.11 0.00 0.00 54.58 52.44 2clv n ASN 21 Cb 0.40 1.46 -0.17 0.00 1.24 0.00 0.00 39.78 42.71 2clv n ASN 21 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2clv s ILE 22 N -2.60 1.20 -0.15 -1.44 -1.09 -1.26 -1.64 121.20 114.22 2clv s ILE 22 Ca 0.12 -0.50 -0.13 0.00 -2.23 0.00 0.00 60.65 57.91 2clv s ILE 22 Cb -0.01 -1.11 -0.05 0.00 -1.58 0.00 0.00 42.46 39.71 2clv s ILE 22 CO 0.08 0.38 0.28 -0.22 -1.23 0.00 0.00 174.94 174.23 2clv s LEU 23 N 0.83 4.26 0.01 2.97 2.96 0.44 -0.87 118.68 129.28 2clv s LEU 23 Ca -0.11 0.51 0.02 0.00 -0.22 0.00 0.00 54.13 54.33 2clv s LEU 23 Cb -0.15 -2.36 -0.04 0.00 0.50 0.00 0.00 46.19 44.14 2clv s LEU 23 CO 0.02 0.13 -0.01 0.20 -1.32 0.00 0.00 176.35 175.36 2clv s ASN 24 N 0.32 5.01 -0.28 3.68 0.01 0.18 -1.44 114.94 122.42 2clv s ASN 24 Ca 0.16 -0.05 0.01 0.00 -0.71 0.00 0.00 52.86 52.27 2clv s ASN 24 Cb -0.13 -1.27 0.08 0.00 0.41 0.00 0.00 41.25 40.34 2clv s ASN 24 CO 0.04 0.27 0.02 0.00 -1.51 0.00 0.00 177.10 175.92 2clv s TYR 26 N 1.35 3.22 -0.13 0.00 5.04 0.08 -0.76 117.35 126.16 2clv s TYR 26 Ca 0.04 -0.04 0.01 0.00 -2.44 0.00 0.00 57.07 54.64 2clv s TYR 26 Cb -0.18 -2.47 -0.00 0.00 0.35 0.00 0.00 41.96 39.65 2clv s TYR 26 CO -0.13 -0.29 -0.18 0.08 -1.34 0.00 0.00 175.55 173.69 2clv s VAL 27 N 1.79 2.50 0.25 3.14 1.01 -0.49 -1.10 120.40 127.50 2clv s VAL 27 Ca 0.08 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.23 2clv s VAL 27 Cb -0.17 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 2clv s VAL 27 CO 0.11 0.53 0.15 0.42 0.00 0.00 0.00 175.10 176.32 2clv s THR 28 N 0.59 0.13 -1.53 3.92 -4.23 0.06 -1.28 115.64 113.31 2clv s THR 28 Ca -0.10 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.41 2clv s THR 28 Cb -0.16 -2.52 0.00 0.00 1.34 0.00 0.00 72.50 71.16 2clv s THR 28 CO 0.03 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.11 2clv n GLN 29 N -0.41 -1.35 -4.15 3.99 1.13 -0.93 -0.33 117.38 115.33 2clv n GLN 29 Ca 0.02 0.88 -0.30 0.00 -1.94 0.00 0.00 57.00 55.66 2clv n GLN 29 Cb 0.65 -5.30 -0.08 0.00 0.11 0.00 0.00 30.24 25.62 2clv n GLN 29 CO 0.00 0.00 0.00 -0.59 -1.44 0.00 0.00 177.06 175.03 2clv s PHE 30 N -2.83 2.93 -0.28 1.08 -0.71 -1.14 -3.92 117.98 113.11 2clv s PHE 30 Ca 0.00 -0.06 -0.16 0.00 -1.04 0.00 0.00 56.93 55.67 2clv s PHE 30 Cb 0.00 -1.51 0.10 0.00 -1.21 0.00 0.00 43.02 40.40 2clv s PHE 30 CO 0.00 0.47 0.75 -1.58 -1.34 0.00 0.00 175.22 173.52 2clv s HIS 31 N -1.30 -0.96 0.96 3.49 2.46 -1.02 -0.80 115.29 118.11 2clv s HIS 31 Ca 0.25 1.92 -0.12 0.00 0.47 0.00 0.00 55.06 57.57 2clv s HIS 31 Cb -0.11 0.57 0.16 0.00 -0.13 0.00 0.00 32.58 33.07 2clv s HIS 31 CO 0.17 -0.48 1.10 -1.25 -2.47 0.00 0.00 174.74 171.82 2clv s PRO 32 N 1.59 0.78 0.50 2.88 0.04 -1.26 -1.53 135.00 138.01 2clv s PRO 32 Ca -0.10 0.54 0.28 0.00 0.04 0.00 0.00 61.00 61.76 2clv s PRO 32 Cb -0.05 -1.78 1.31 0.00 0.04 0.00 0.00 34.50 34.03 2clv s PRO 32 CO -0.19 -2.50 1.99 -1.00 0.04 0.00 0.00 177.00 175.35 2clv h PRO 33 N -1.72 0.00 -6.50 0.56 0.13 -1.98 -3.44 132.00 119.04 2clv h PRO 33 Ca -0.53 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.07 2clv h PRO 33 Cb 1.32 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.48 2clv h PRO 33 CO 0.58 0.14 0.97 -1.58 -0.23 0.00 0.00 178.00 177.88 2clv s HIS 34 N -3.96 2.61 0.00 1.56 5.65 -1.26 -4.98 115.29 114.92 2clv s HIS 34 Ca -0.01 0.40 -0.19 0.00 0.25 0.00 0.00 55.06 55.50 2clv s HIS 34 Cb 0.12 -3.96 0.04 0.00 -1.18 0.00 0.00 32.58 27.59 2clv s HIS 34 CO 0.59 -3.78 0.41 -1.50 -0.65 0.00 0.00 174.74 169.81 2clv s ILE 35 N 2.17 0.05 -0.11 0.89 2.07 -1.26 -4.69 121.20 120.31 2clv s ILE 35 Ca 0.73 -0.39 0.02 0.00 -1.41 0.00 0.00 60.65 59.59 2clv s ILE 35 Cb -0.41 -0.81 0.02 0.00 0.13 0.00 0.00 42.46 41.38 2clv s ILE 35 CO 0.32 -0.22 -0.15 -1.61 -1.91 0.00 0.00 174.94 171.37 2clv s GLU 36 N -1.75 2.25 -0.12 3.50 2.02 -0.72 -5.01 118.70 118.87 2clv s GLU 36 Ca -0.10 -0.57 0.01 0.00 0.02 0.00 0.00 54.97 54.34 2clv s GLU 36 Cb -0.03 -1.93 0.02 0.00 0.10 0.00 0.00 34.13 32.29 2clv s GLU 36 CO 0.03 -0.09 -0.15 0.42 0.02 0.00 0.00 175.26 175.49 2clv s ILE 37 N 1.05 1.55 0.12 -1.63 1.01 -1.26 -1.14 121.20 120.90 2clv s ILE 37 Ca -0.05 -0.66 0.09 0.00 0.00 0.00 0.00 60.65 60.02 2clv s ILE 37 Cb -0.15 -1.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.86 2clv s ILE 37 CO -0.03 0.45 -0.21 0.00 0.00 0.00 0.00 174.94 175.15 2clv s GLN 38 N 1.09 1.18 0.08 2.79 -2.07 -0.50 -5.00 119.66 117.23 2clv s GLN 38 Ca -0.04 -1.23 0.06 0.00 -1.82 0.00 0.00 55.36 52.33 2clv s GLN 38 Cb -0.14 -1.44 -0.04 0.00 -1.09 0.00 0.00 33.01 30.30 2clv s GLN 38 CO -0.04 0.33 -0.08 -1.64 -1.32 0.00 0.00 175.29 172.54 2clv s MET 39 N -2.09 2.26 -0.01 9.60 -1.94 -1.26 -0.43 119.30 125.42 2clv s MET 39 Ca 0.09 -0.94 0.03 0.00 -1.71 0.00 0.00 55.69 53.16 2clv s MET 39 Cb -0.09 -2.37 -0.01 0.00 2.01 0.00 0.00 34.83 34.37 2clv s MET 39 CO 0.05 0.53 -0.12 -0.51 -0.01 0.00 0.00 175.02 174.96 2clv s LEU 40 N -2.05 1.98 -0.21 -0.03 1.43 0.72 -0.35 118.68 120.17 2clv s LEU 40 Ca 0.21 -0.22 0.02 0.00 -1.03 0.00 0.00 54.13 53.11 2clv s LEU 40 Cb -0.11 -0.62 0.04 0.00 0.03 0.00 0.00 46.19 45.53 2clv s LEU 40 CO 0.13 0.13 -0.14 -0.75 0.23 0.00 0.00 176.35 175.95 2clv s LYS 41 N -0.19 2.46 -1.42 1.70 2.20 0.43 -1.27 119.74 123.66 2clv s LYS 41 Ca 0.03 -0.98 -0.08 0.00 -0.36 0.00 0.00 55.97 54.58 2clv s LYS 41 Cb -0.06 -2.61 0.04 0.00 -1.51 0.00 0.00 37.83 33.70 2clv s LYS 41 CO -0.00 -0.38 0.58 0.09 -0.36 0.00 0.00 175.35 175.28 2clv n ASN 42 N 4.59 -4.88 0.00 1.43 3.02 0.67 -1.36 115.26 118.72 2clv n ASN 42 Ca -0.17 -0.37 0.00 0.00 -0.03 0.00 0.00 54.58 54.01 2clv n ASN 42 Cb 0.47 -3.98 0.00 0.00 -0.61 0.00 0.00 39.78 35.66 2clv n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2clv n GLY 43 N -1.37 1.04 3.56 7.41 0.00 -1.26 -5.04 105.19 109.52 2clv n GLY 43 Ca -0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 2clv n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2clv s LYS 44 N -0.44 3.03 0.21 1.61 3.01 -0.46 -5.04 119.74 121.66 2clv s LYS 44 Ca 0.00 -0.53 -0.32 0.00 -1.01 0.00 0.00 55.97 54.10 2clv s LYS 44 Cb 0.00 -2.69 -0.13 0.00 -1.01 0.00 0.00 37.83 34.00 2clv s LYS 44 CO 0.00 0.54 1.54 1.17 0.51 0.00 0.00 175.35 179.12 2clv n LYS 45 N 2.60 2.26 -3.02 1.68 4.81 -1.26 -0.43 118.16 124.80 2clv n LYS 45 Ca -0.18 0.81 -0.41 0.00 -0.87 0.00 0.00 58.31 57.66 2clv n LYS 45 Cb 0.53 -2.55 -0.05 0.00 0.02 0.00 0.00 35.03 32.97 2clv n LYS 45 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2clv s ILE 46 N 0.53 4.92 0.11 3.15 1.01 0.53 -4.82 121.20 126.62 2clv s ILE 46 Ca 0.73 1.29 -0.25 0.00 0.00 0.00 0.00 60.65 62.43 2clv s ILE 46 Cb -0.63 -4.01 -0.09 0.00 0.01 0.00 0.00 42.46 37.75 2clv s ILE 46 CO 0.42 -0.02 1.68 -0.65 0.00 0.00 0.00 174.94 176.36 2clv h PRO 47 N 7.83 -0.27 -3.75 2.79 0.11 -1.92 -3.39 132.00 133.39 2clv h PRO 47 Ca -0.25 0.02 -0.78 0.00 0.11 0.00 0.00 66.00 65.10 2clv h PRO 47 Cb 1.11 0.06 -0.28 0.00 0.11 0.00 0.00 31.00 32.01 2clv h PRO 47 CO 0.82 -0.18 0.09 0.21 -0.21 0.00 0.00 178.00 178.72 2clv s LYS 48 N -6.13 3.56 -0.19 1.05 2.47 -1.26 -5.00 119.74 114.23 2clv s LYS 48 Ca -0.15 -2.60 -0.02 0.00 -1.56 0.00 0.00 55.97 51.64 2clv s LYS 48 Cb 0.08 -4.35 -0.00 0.00 -1.46 0.00 0.00 37.83 32.10 2clv s LYS 48 CO 0.66 -1.27 -0.10 0.08 0.16 0.00 0.00 175.35 174.88 2clv s VAL 49 N -0.11 2.92 0.25 4.02 1.01 -1.26 -4.60 120.40 122.63 2clv s VAL 49 Ca 0.20 -0.66 -0.12 0.00 0.00 0.00 0.00 61.98 61.40 2clv s VAL 49 Cb -0.11 -2.29 -0.08 0.00 0.00 0.00 0.00 36.38 33.90 2clv s VAL 49 CO -0.08 0.47 0.61 -1.61 0.00 0.00 0.00 175.10 174.49 2clv s GLU 50 N 1.26 3.90 -0.07 2.72 0.41 0.63 -4.91 118.70 122.64 2clv s GLU 50 Ca 0.03 0.44 0.04 0.00 -0.41 0.00 0.00 54.97 55.07 2clv s GLU 50 Cb -0.14 -2.62 0.00 0.00 -1.78 0.00 0.00 34.13 29.59 2clv s GLU 50 CO -0.05 0.29 -0.18 -1.64 -0.49 0.00 0.00 175.26 173.19 2clv s MET 51 N -2.73 2.17 0.99 1.61 -1.94 -1.26 -0.91 119.30 117.23 2clv s MET 51 Ca 0.48 -0.64 -0.12 0.00 -1.71 0.00 0.00 55.69 53.70 2clv s MET 51 Cb -0.12 -1.76 0.18 0.00 2.01 0.00 0.00 34.83 35.15 2clv s MET 51 CO 0.20 0.16 1.08 -1.54 -0.01 0.00 0.00 175.02 174.91 2clv s SER 52 N 0.33 2.59 0.63 3.03 1.04 0.50 -5.00 113.70 116.82 2clv s SER 52 Ca -0.12 1.46 -0.19 0.00 0.48 0.00 0.00 55.95 57.58 2clv s SER 52 Cb -0.15 -2.14 -0.02 0.00 0.10 0.00 0.00 66.02 63.81 2clv s SER 52 CO 0.05 -3.19 1.31 -1.81 0.98 0.00 0.00 173.24 170.58 2clv s ASP 53 N -3.17 4.73 0.13 7.02 -0.00 -1.26 -4.73 116.67 119.38 2clv s ASP 53 Ca 0.65 2.66 -0.21 0.00 -0.00 0.00 0.00 52.55 55.65 2clv s ASP 53 Cb -0.20 -2.62 -0.07 0.00 -0.00 0.00 0.00 42.92 40.02 2clv s ASP 53 CO 0.59 -1.93 0.66 -0.32 -0.00 0.00 0.00 175.17 174.18 2clv s MET 54 N -3.28 4.34 0.37 8.23 -2.45 -1.26 -4.65 119.30 120.59 2clv s MET 54 Ca 0.81 0.90 0.04 0.00 -1.25 0.00 0.00 55.69 56.18 2clv s MET 54 Cb -0.38 -3.20 -0.04 0.00 1.25 0.00 0.00 34.83 32.45 2clv s MET 54 CO 0.41 0.58 0.09 -1.12 1.05 0.00 0.00 175.02 176.03 2clv s SER 55 N -1.20 2.63 0.15 1.11 0.01 -0.73 -4.99 113.70 110.69 2clv s SER 55 Ca 0.33 -1.52 0.03 0.00 1.31 0.00 0.00 55.95 56.10 2clv s SER 55 Cb -0.20 0.21 -0.05 0.00 0.21 0.00 0.00 66.02 66.20 2clv s SER 55 CO 0.22 -0.77 -0.04 0.72 0.41 0.00 0.00 173.24 173.78 2clv s PHE 56 N -3.24 1.18 0.55 2.43 -0.12 -1.26 -0.97 117.98 116.56 2clv s PHE 56 Ca 0.29 -0.92 0.04 0.00 -0.05 0.00 0.00 56.93 56.29 2clv s PHE 56 Cb 0.06 -0.66 0.04 0.00 -0.63 0.00 0.00 43.02 41.82 2clv s PHE 56 CO 0.14 -0.11 0.32 -1.54 -0.05 0.00 0.00 175.22 173.99 2clv s SER 57 N -3.15 4.51 0.58 1.98 1.04 0.08 -4.97 113.70 113.76 2clv s SER 57 Ca 0.20 -1.39 0.28 0.00 0.48 0.00 0.00 55.95 55.51 2clv s SER 57 Cb 0.05 0.58 1.67 0.00 0.10 0.00 0.00 66.02 68.42 2clv s SER 57 CO 0.02 -1.12 2.15 0.50 0.98 0.00 0.00 173.24 175.76 2clv h LYS 58 N 0.82 0.00 -0.26 4.02 1.63 -2.02 0.32 116.57 121.07 2clv h LYS 58 Ca -0.38 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.42 2clv h LYS 58 Cb 1.31 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.94 2clv h LYS 58 CO 0.60 0.00 0.00 -0.40 -3.45 0.00 0.00 179.45 176.20 2clv n ASP 59 N -3.90 1.63 0.00 4.20 5.68 -1.26 -4.91 116.55 117.98 2clv n ASP 59 Ca 0.00 -1.90 0.00 0.00 -0.50 0.00 0.00 54.79 52.39 2clv n ASP 59 Cb 0.25 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 2clv n ASP 59 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 2clv n TRP 60 N 0.35 0.00 -2.34 2.11 7.02 0.11 -5.02 117.44 119.67 2clv n TRP 60 Ca 0.12 0.00 -0.37 0.00 -1.02 0.00 0.00 57.50 56.23 2clv n TRP 60 Cb 0.28 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.15 2clv n TRP 60 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 2clv s SER 61 N -2.97 6.40 0.36 -0.99 1.04 -1.26 -4.66 113.70 111.62 2clv s SER 61 Ca 0.00 2.24 -0.05 0.00 0.48 0.00 0.00 55.95 58.61 2clv s SER 61 Cb 0.00 -2.60 -0.05 0.00 0.10 0.00 0.00 66.02 63.47 2clv s SER 61 CO 0.00 -0.75 0.64 -0.36 0.98 0.00 0.00 173.24 173.75 2clv s PHE 62 N -1.55 3.49 0.04 5.02 0.40 0.02 -0.74 117.98 124.66 2clv s PHE 62 Ca 0.61 0.72 -0.10 0.00 -0.60 0.00 0.00 56.93 57.56 2clv s PHE 62 Cb -0.27 -2.19 0.01 0.00 0.51 0.00 0.00 43.02 41.08 2clv s PHE 62 CO 0.33 0.02 0.21 1.52 0.70 0.00 0.00 175.22 178.01 2clv s TYR 63 N -2.30 0.02 -0.01 0.36 -0.85 -0.14 -2.20 117.35 112.23 2clv s TYR 63 Ca 0.46 -0.20 -0.28 0.00 -0.52 0.00 0.00 57.07 56.52 2clv s TYR 63 Cb -0.10 -0.00 0.07 0.00 0.38 0.00 0.00 41.96 42.30 2clv s TYR 63 CO 0.34 -0.43 0.63 -1.50 -1.52 0.00 0.00 175.55 173.07 2clv s ILE 64 N -2.44 0.01 -0.19 -3.49 2.07 -0.40 -1.77 121.20 114.98 2clv s ILE 64 Ca -0.06 -0.06 0.00 0.00 -1.41 0.00 0.00 60.65 59.13 2clv s ILE 64 Cb -0.02 -0.97 0.02 0.00 0.13 0.00 0.00 42.46 41.62 2clv s ILE 64 CO -0.03 -0.03 -0.16 -0.22 -1.91 0.00 0.00 174.94 172.59 2clv s LEU 65 N -1.46 2.38 -0.08 8.50 2.96 -1.26 -1.39 118.68 128.32 2clv s LEU 65 Ca -0.09 -0.64 -0.09 0.00 -0.22 0.00 0.00 54.13 53.09 2clv s LEU 65 Cb -0.01 -1.54 -0.04 0.00 0.50 0.00 0.00 46.19 45.10 2clv s LEU 65 CO 0.06 -0.02 0.21 0.00 -1.32 0.00 0.00 176.35 175.28 2clv s ALA 66 N 1.32 3.83 0.06 5.97 0.00 0.07 -0.37 121.76 132.64 2clv s ALA 66 Ca 0.04 -0.53 -0.08 0.00 0.00 0.00 0.00 51.96 51.39 2clv s ALA 66 Cb -0.14 -2.08 -0.00 0.00 0.00 0.00 0.00 23.12 20.90 2clv s ALA 66 CO -0.10 0.59 0.17 -3.38 0.00 0.00 0.00 175.76 173.04 2clv s HIS 67 N -1.06 0.13 -0.05 0.00 -3.43 -0.09 0.34 115.29 111.14 2clv s HIS 67 Ca 0.18 -0.47 -0.10 0.00 -0.80 0.00 0.00 55.06 53.86 2clv s HIS 67 Cb -0.13 -0.07 0.02 0.00 -1.43 0.00 0.00 32.58 30.97 2clv s HIS 67 CO 0.07 -0.47 0.24 -0.08 -2.00 0.00 0.00 174.74 172.50 2clv s THR 68 N -3.21 0.04 0.32 -5.38 -1.32 -0.52 -0.27 115.64 105.29 2clv s THR 68 Ca -0.00 -0.31 -0.27 0.00 -1.21 0.00 0.00 61.69 59.89 2clv s THR 68 Cb 0.02 -0.46 -0.09 0.00 -1.51 0.00 0.00 72.50 70.46 2clv s THR 68 CO -0.07 -0.17 1.03 -1.83 -2.21 0.00 0.00 174.62 171.36 2clv s GLU 69 N -0.67 4.52 0.11 7.08 -1.05 -1.26 -0.42 118.70 127.01 2clv s GLU 69 Ca -0.08 1.57 -0.21 0.00 -0.15 0.00 0.00 54.97 56.11 2clv s GLU 69 Cb -0.04 -2.94 0.05 0.00 -0.44 0.00 0.00 34.13 30.76 2clv s GLU 69 CO 0.02 0.17 0.51 -0.59 0.95 0.00 0.00 175.26 176.32 2clv s PHE 70 N -1.40 -0.39 -0.25 4.83 -0.71 -0.65 -4.87 117.98 114.54 2clv s PHE 70 Ca 0.49 0.23 0.02 0.00 -1.04 0.00 0.00 56.93 56.64 2clv s PHE 70 Cb -0.25 0.39 0.06 0.00 -1.21 0.00 0.00 43.02 42.00 2clv s PHE 70 CO 0.32 -0.73 -0.10 0.99 -1.34 0.00 0.00 175.22 174.36 2clv s THR 71 N -3.33 2.03 0.62 -4.49 2.01 -1.26 -0.29 115.64 110.92 2clv s THR 71 Ca -0.00 -1.55 -0.18 0.00 0.31 0.00 0.00 61.69 60.27 2clv s THR 71 Cb 0.00 -2.17 -0.02 0.00 0.01 0.00 0.00 72.50 70.32 2clv s THR 71 CO -0.09 -0.05 1.18 -2.84 -0.69 0.00 0.00 174.62 172.14 2clv s PRO 72 N 1.17 2.86 0.34 4.92 0.02 -1.26 -4.81 135.00 138.23 2clv s PRO 72 Ca -0.08 1.73 0.03 0.00 0.02 0.00 0.00 61.00 62.70 2clv s PRO 72 Cb -0.20 -1.93 -0.04 0.00 0.02 0.00 0.00 34.50 32.36 2clv s PRO 72 CO -0.05 -1.27 0.11 0.95 -0.33 0.00 0.00 177.00 176.41 2clv s THR 73 N -1.78 0.67 0.30 0.99 -4.23 -1.26 -1.68 115.64 108.65 2clv s THR 73 Ca 0.75 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.27 2clv s THR 73 Cb -0.28 -2.54 0.28 0.00 1.34 0.00 0.00 72.50 71.30 2clv s THR 73 CO 0.35 0.00 1.89 -0.08 -0.54 0.00 0.00 174.62 176.25 2clv h GLU 74 N 2.06 1.00 0.00 3.99 4.81 -1.98 -3.34 114.58 121.12 2clv h GLU 74 Ca -0.37 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 2clv h GLU 74 Cb 1.26 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.41 2clv h GLU 74 CO 0.59 0.66 -0.66 0.25 -0.73 0.00 0.00 179.01 179.13 2clv n THR 75 N -4.51 0.00 -1.97 0.32 -2.24 -1.26 -5.01 114.28 99.60 2clv n THR 75 Ca 0.15 -0.24 -0.42 0.00 -2.27 0.00 0.00 64.05 61.27 2clv n THR 75 Cb 0.23 0.71 -0.02 0.00 -2.10 0.00 0.00 70.33 69.15 2clv n THR 75 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2clv s ASP 76 N -1.83 6.61 -0.15 3.42 1.01 -1.26 -5.01 116.67 119.46 2clv s ASP 76 Ca -0.00 2.67 -0.06 0.00 0.71 0.00 0.00 52.55 55.86 2clv s ASP 76 Cb 0.02 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 2clv s ASP 76 CO 0.12 -0.75 0.07 -0.89 0.21 0.00 0.00 175.17 173.92 2clv s THR 77 N 0.36 4.84 0.07 -1.27 2.01 -1.26 -4.77 115.64 115.63 2clv s THR 77 Ca 0.63 -0.03 0.10 0.00 0.31 0.00 0.00 61.69 62.70 2clv s THR 77 Cb -0.43 -3.14 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 2clv s THR 77 CO 0.40 0.52 -0.26 -0.31 -0.69 0.00 0.00 174.62 174.28 2clv s TYR 78 N -0.14 2.26 0.14 4.92 1.51 -1.26 -0.24 117.35 124.54 2clv s TYR 78 Ca 0.07 -0.40 -0.09 0.00 -1.01 0.00 0.00 57.07 55.64 2clv s TYR 78 Cb -0.12 -1.31 -0.00 0.00 -0.11 0.00 0.00 41.96 40.42 2clv s TYR 78 CO 0.01 0.20 0.26 0.00 -1.11 0.00 0.00 175.55 174.90 2clv s ALA 79 N -0.90 -0.12 -0.09 3.71 0.00 -0.40 -0.37 121.76 123.59 2clv s ALA 79 Ca 0.12 -0.76 0.03 0.00 0.00 0.00 0.00 51.96 51.36 2clv s ALA 79 Cb -0.10 0.73 0.00 0.00 0.00 0.00 0.00 23.12 23.75 2clv s ALA 79 CO 0.03 -0.60 -0.20 0.00 0.00 0.00 0.00 175.76 174.99 2clv s ARG 81 N 0.44 3.18 -0.13 0.00 3.52 0.43 -0.49 118.95 125.89 2clv s ARG 81 Ca -0.17 -0.79 0.02 0.00 -0.13 0.00 0.00 55.73 54.66 2clv s ARG 81 Cb -0.17 -2.50 0.01 0.00 -1.56 0.00 0.00 34.95 30.73 2clv s ARG 81 CO 0.07 0.11 -0.19 0.08 -0.81 0.00 0.00 175.30 174.56 2clv s VAL 82 N 0.56 1.79 -0.23 7.11 1.01 0.85 -1.41 120.40 130.08 2clv s VAL 82 Ca -0.11 -0.81 -0.05 0.00 0.00 0.00 0.00 61.98 61.00 2clv s VAL 82 Cb -0.16 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 2clv s VAL 82 CO 0.04 0.50 0.01 -0.75 0.00 0.00 0.00 175.10 174.90 2clv s LYS 83 N 0.94 3.54 -0.04 2.72 2.20 -0.29 -0.76 119.74 128.05 2clv s LYS 83 Ca -0.06 -0.54 -0.09 0.00 -0.36 0.00 0.00 55.97 54.92 2clv s LYS 83 Cb -0.15 -3.15 0.02 0.00 -1.51 0.00 0.00 37.83 33.04 2clv s LYS 83 CO -0.03 -0.14 0.22 -1.58 -0.36 0.00 0.00 175.35 173.46 2clv s HIS 84 N 1.41 -0.13 0.58 4.03 2.46 -1.26 -1.75 115.29 120.62 2clv s HIS 84 Ca 0.05 0.27 0.43 0.00 0.47 0.00 0.00 55.06 56.28 2clv s HIS 84 Cb -0.15 0.04 2.31 0.00 -0.13 0.00 0.00 32.58 34.65 2clv s HIS 84 CO 0.01 -0.24 2.31 -0.44 -2.47 0.00 0.00 174.74 173.90 2clv h ASP 85 N 4.80 0.00 0.69 9.88 3.32 -1.94 -1.39 116.42 131.78 2clv h ASP 85 Ca -0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.77 2clv h ASP 85 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 2clv h ASP 85 CO 0.38 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.36 2clv n SER 86 N -3.03 0.03 -4.22 6.45 3.41 -1.26 -4.76 113.62 110.25 2clv n SER 86 Ca -0.03 0.51 -0.28 0.00 -0.26 0.00 0.00 58.87 58.81 2clv n SER 86 Cb 0.08 -0.51 -0.16 0.00 -0.26 0.00 0.00 64.21 63.36 2clv n SER 86 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2clv s MET 87 N -3.01 1.81 0.41 4.33 -1.94 -0.53 -4.85 119.30 115.53 2clv s MET 87 Ca 0.09 -0.75 0.12 0.00 -1.71 0.00 0.00 55.69 53.44 2clv s MET 87 Cb 0.13 -1.70 0.87 0.00 2.01 0.00 0.00 34.83 36.14 2clv s MET 87 CO 0.37 0.42 1.94 0.00 -0.01 0.00 0.00 175.02 177.73 2clv h ALA 88 N 5.75 1.58 -2.41 3.03 0.00 -1.85 -3.44 119.26 121.91 2clv h ALA 88 Ca -0.38 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.23 2clv h ALA 88 Cb 1.15 -0.06 -0.15 0.00 0.00 0.00 0.00 17.79 18.73 2clv h ALA 88 CO 0.48 0.31 -0.51 -1.21 0.00 0.00 0.00 179.25 178.31 2clv s GLU 89 N -4.63 0.71 0.50 0.00 2.02 -1.26 -5.12 118.70 110.93 2clv s GLU 89 Ca -0.04 -1.03 -0.23 0.00 0.02 0.00 0.00 54.97 53.68 2clv s GLU 89 Cb 0.15 0.27 -0.06 0.00 0.10 0.00 0.00 34.13 34.59 2clv s GLU 89 CO 0.72 -0.19 1.41 -2.30 0.02 0.00 0.00 175.26 174.91 2clv n PRO 90 N 0.13 1.97 -3.64 0.39 -0.02 -1.26 -4.89 135.00 127.68 2clv n PRO 90 Ca -0.15 0.71 -0.36 0.00 -2.02 0.00 0.00 63.50 61.68 2clv n PRO 90 Cb 0.61 -2.62 -0.09 0.00 -0.02 0.00 0.00 33.50 31.38 2clv n PRO 90 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2clv s LYS 91 N -2.70 4.10 -0.22 -0.52 2.36 0.06 -4.88 119.74 117.95 2clv s LYS 91 Ca 0.67 -0.20 -0.06 0.00 -2.55 0.00 0.00 55.97 53.82 2clv s LYS 91 Cb -0.43 -3.52 -0.03 0.00 -1.05 0.00 0.00 37.83 32.80 2clv s LYS 91 CO 0.53 0.09 0.04 0.99 1.55 0.00 0.00 175.35 178.55 2clv s THR 92 N 0.97 4.25 -0.14 3.43 2.01 -1.26 -0.10 115.64 124.80 2clv s THR 92 Ca 0.09 -0.20 0.01 0.00 0.31 0.00 0.00 61.69 61.89 2clv s THR 92 Cb -0.13 -2.95 -0.01 0.00 0.01 0.00 0.00 72.50 69.42 2clv s THR 92 CO 0.04 0.40 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.52 2clv s VAL 93 N 1.14 2.70 0.07 3.82 1.01 0.35 -4.95 120.40 124.54 2clv s VAL 93 Ca 0.04 -0.77 -0.19 0.00 0.00 0.00 0.00 61.98 61.05 2clv s VAL 93 Cb -0.14 -2.13 -0.07 0.00 0.00 0.00 0.00 36.38 34.04 2clv s VAL 93 CO 0.03 0.52 0.57 -0.31 0.00 0.00 0.00 175.10 175.90 2clv s TYR 94 N 0.59 3.81 0.15 5.22 2.02 -1.26 -0.59 117.35 127.28 2clv s TYR 94 Ca -0.09 1.27 -0.31 0.00 -0.37 0.00 0.00 57.07 57.56 2clv s TYR 94 Cb -0.16 -2.49 -0.09 0.00 -0.40 0.00 0.00 41.96 38.82 2clv s TYR 94 CO 0.03 0.59 1.47 -0.46 -1.57 0.00 0.00 175.55 175.61 2clv s TRP 95 N -1.10 3.15 -0.18 2.71 -0.00 0.50 -4.85 118.94 119.17 2clv s TRP 95 Ca 0.29 0.81 0.01 0.00 -0.00 0.00 0.00 56.10 57.21 2clv s TRP 95 Cb -0.19 -3.80 0.03 0.00 -0.00 0.00 0.00 33.47 29.50 2clv s TRP 95 CO 0.19 -2.87 -0.16 0.34 -0.00 0.00 0.00 176.95 174.44 2clv s ASP 96 N 1.05 3.11 0.00 5.86 -1.08 -1.26 -4.76 116.67 119.59 2clv s ASP 96 Ca 0.67 -0.68 0.08 0.00 -0.52 0.00 0.00 52.55 52.09 2clv s ASP 96 Cb -0.40 -1.36 0.32 0.00 -1.46 0.00 0.00 42.92 40.02 2clv s ASP 96 CO 0.32 -0.05 1.24 -2.11 0.52 0.00 0.00 175.17 175.09 2clv n ARG 97 N 4.66 0.00 -0.17 4.34 1.85 -1.26 -1.14 116.66 124.94 2clv n ARG 97 Ca -0.18 0.37 0.12 0.00 -1.00 0.00 0.00 57.85 57.15 2clv n ARG 97 Cb 0.49 -1.50 0.22 0.00 -1.05 0.00 0.00 32.46 30.62 2clv n ARG 97 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2clv n ASP 98 N -1.50 3.32 0.00 2.89 8.00 -1.26 -4.84 116.55 123.17 2clv n ASP 98 Ca 0.02 -1.98 0.00 0.00 0.71 0.00 0.00 54.79 53.54 2clv n ASP 98 Cb 0.09 -0.22 0.00 0.00 -0.02 0.00 0.00 41.12 40.96 2clv n ASP 98 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04