#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2c86 s MET 28 N 0.00 1.21 -1.19 1.57 1.00 -1.26 -4.95 119.30 115.68 2c86 s MET 28 Ca 0.00 -2.10 -0.00 0.00 0.00 0.00 0.00 55.69 53.59 2c86 s MET 28 Cb 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 34.83 32.79 2c86 s MET 28 CO 0.00 -1.25 0.01 0.45 0.00 0.00 0.00 175.02 174.23 2c86 n SER 29 N 3.22 -4.30 -1.90 3.03 2.88 -1.26 0.14 113.62 115.43 2c86 n SER 29 Ca 0.17 -0.02 -0.19 0.00 -1.33 0.00 0.00 58.87 57.50 2c86 n SER 29 Cb 0.39 -3.46 -0.04 0.00 -0.75 0.00 0.00 64.21 60.35 2c86 n SER 29 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2c86 n SER 30 N -0.68 -5.45 0.00 -3.46 7.64 -1.26 -4.68 113.62 105.73 2c86 n SER 30 Ca -0.16 0.18 0.00 0.00 1.01 0.00 0.00 58.87 59.90 2c86 n SER 30 Cb 0.62 -4.55 0.00 0.00 -1.01 0.00 0.00 64.21 59.28 2c86 n SER 30 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2c86 n GLY 31 N -0.86 0.00 2.94 0.23 0.00 0.37 -4.82 105.19 103.06 2c86 n GLY 31 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2c86 n GLY 31 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2c86 n ASN 32 N 0.00 0.00 -4.71 1.61 4.13 -1.26 -4.67 115.26 110.37 2c86 n ASN 32 Ca 0.00 0.00 -0.43 0.00 1.68 0.00 0.00 54.58 55.83 2c86 n ASN 32 Cb 0.00 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.21 2c86 n ASN 32 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2c86 n ALA 33 N -0.15 2.43 -1.75 5.41 0.00 -1.16 -4.86 120.51 120.43 2c86 n ALA 33 Ca 0.00 0.41 -0.38 0.00 0.00 0.00 0.00 53.44 53.47 2c86 n ALA 33 Cb 0.00 -2.47 0.04 0.00 0.00 0.00 0.00 19.45 17.01 2c86 n ALA 33 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2c86 s SER 34 N 1.08 5.31 0.35 0.00 0.15 -1.26 0.16 113.70 119.48 2c86 s SER 34 Ca 0.76 2.70 0.04 0.00 0.70 0.00 0.00 55.95 60.16 2c86 s SER 34 Cb -0.55 -2.63 0.63 0.00 -1.71 0.00 0.00 66.02 61.76 2c86 s SER 34 CO 0.34 -1.54 1.91 -0.50 1.20 0.00 0.00 173.24 174.65 2c86 h TRP 35 N 1.44 0.57 -3.82 3.44 4.06 -1.90 -3.40 115.95 116.34 2c86 h TRP 35 Ca -0.51 -0.04 -0.69 0.00 2.06 0.00 0.00 58.89 59.71 2c86 h TRP 35 Cb 1.30 -0.17 -0.21 0.00 -1.00 0.00 0.00 29.16 29.08 2c86 h TRP 35 CO 0.46 0.51 -0.73 -0.06 -3.56 0.00 0.00 178.44 175.06 2c86 s PHE 36 N -5.11 2.82 0.40 0.49 0.40 -1.26 -1.44 117.98 114.28 2c86 s PHE 36 Ca -0.08 -0.07 -0.14 0.00 -0.60 0.00 0.00 56.93 56.04 2c86 s PHE 36 Cb 0.16 -1.66 -0.12 0.00 0.51 0.00 0.00 43.02 41.91 2c86 s PHE 36 CO 0.76 0.27 -0.10 0.00 0.70 0.00 0.00 175.22 176.86 2c86 n GLN 37 N 2.16 0.00 -1.09 0.44 10.64 -0.71 -4.65 117.38 124.17 2c86 n GLN 37 Ca -0.17 0.00 -0.29 0.00 -1.83 0.00 0.00 57.00 54.70 2c86 n GLN 37 Cb 0.53 -0.79 0.17 0.00 -0.86 0.00 0.00 30.24 29.28 2c86 n GLN 37 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2c86 s ALA 38 N -1.58 1.10 -0.38 2.61 0.00 -1.26 -4.81 121.76 117.44 2c86 s ALA 38 Ca 0.45 -0.14 -0.01 0.00 0.00 0.00 0.00 51.96 52.26 2c86 s ALA 38 Cb -0.39 -3.19 0.10 0.00 0.00 0.00 0.00 23.12 19.64 2c86 s ALA 38 CO 0.52 -2.71 0.14 0.96 0.00 0.00 0.00 175.76 174.67 2c86 s ILE 39 N -2.87 2.98 0.76 0.00 -4.36 -0.72 -4.82 121.20 112.17 2c86 s ILE 39 Ca 0.65 -2.07 -0.14 0.00 -0.26 0.00 0.00 60.65 58.83 2c86 s ILE 39 Cb -0.19 -3.05 0.05 0.00 1.25 0.00 0.00 42.46 40.53 2c86 s ILE 39 CO 0.58 -0.61 1.19 -0.54 0.24 0.00 0.00 174.94 175.81 2c86 s LYS 40 N 1.09 1.99 0.02 0.37 3.01 -0.75 -2.38 119.74 123.09 2c86 s LYS 40 Ca 0.08 1.70 -0.00 0.00 -1.01 0.00 0.00 55.97 56.73 2c86 s LYS 40 Cb -0.21 -1.82 -0.04 0.00 -1.01 0.00 0.00 37.83 34.74 2c86 s LYS 40 CO -0.05 -1.94 0.13 0.00 0.51 0.00 0.00 175.35 174.00 2c86 s ALA 41 N -2.12 3.75 0.00 5.17 0.00 -0.95 -1.67 121.76 125.94 2c86 s ALA 41 Ca 0.73 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.82 2c86 s ALA 41 Cb -0.28 -1.67 0.00 0.00 0.00 0.00 0.00 23.12 21.18 2c86 s ALA 41 CO 0.47 0.74 0.29 1.63 0.00 0.00 0.00 175.76 178.90 2c86 n LYS 42 N 0.81 0.00 -0.59 0.00 5.02 -0.11 -4.66 118.16 118.63 2c86 n LYS 42 Ca -0.10 0.29 -0.10 0.00 -2.02 0.00 0.00 58.31 56.37 2c86 n LYS 42 Cb 0.52 -0.97 0.08 0.00 -0.02 0.00 0.00 35.03 34.64 2c86 n LYS 42 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2c86 n LYS 43 N -1.36 -0.85 0.00 1.97 4.76 -1.26 -4.92 118.16 116.51 2c86 n LYS 43 Ca 0.00 -0.70 0.00 0.00 -2.87 0.00 0.00 58.31 54.74 2c86 n LYS 43 Cb 0.00 -0.51 0.00 0.00 -1.84 0.00 0.00 35.03 32.68 2c86 n LYS 43 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2c86 n LEU 44 N 0.00 0.00 -2.34 -0.35 4.77 -1.26 -4.52 117.00 113.30 2c86 n LEU 44 Ca 0.06 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.95 2c86 n LEU 44 Cb 0.21 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.28 2c86 n LEU 44 CO 0.15 -0.39 -0.05 0.59 -1.33 0.00 0.00 177.39 176.36 2c86 n ASN 45 N -1.97 -0.23 -4.76 -1.43 5.03 -1.26 -4.87 115.26 105.77 2c86 n ASN 45 Ca 0.00 -0.27 -0.40 0.00 0.87 0.00 0.00 54.58 54.79 2c86 n ASN 45 Cb 0.00 -0.34 -0.04 0.00 -1.02 0.00 0.00 39.78 38.38 2c86 n ASN 45 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 2c86 s THR 46 N -1.96 3.56 0.91 3.41 -4.23 -1.26 -5.06 115.64 111.02 2c86 s THR 46 Ca 0.13 1.51 -0.14 0.00 -1.18 0.00 0.00 61.69 62.01 2c86 s THR 46 Cb -0.08 -3.94 0.15 0.00 1.34 0.00 0.00 72.50 69.97 2c86 s THR 46 CO 0.22 0.31 1.20 -2.84 -0.54 0.00 0.00 174.62 172.96 2c86 s PRO 47 N -1.60 1.09 0.24 3.99 0.02 -1.26 -4.96 135.00 132.52 2c86 s PRO 47 Ca 0.46 0.03 -0.31 0.00 0.02 0.00 0.00 61.00 61.20 2c86 s PRO 47 Cb -0.30 -1.86 -0.13 0.00 0.02 0.00 0.00 34.50 32.23 2c86 s PRO 47 CO 0.38 -2.18 1.51 -2.30 -0.33 0.00 0.00 177.00 174.08 2c86 n PRO 48 N -3.70 2.29 -1.46 5.54 -0.02 -1.26 -4.89 135.00 131.50 2c86 n PRO 48 Ca 0.10 0.82 -0.46 0.00 -2.02 0.00 0.00 63.50 61.93 2c86 n PRO 48 Cb 0.60 -2.54 -0.02 0.00 -0.02 0.00 0.00 33.50 31.52 2c86 n PRO 48 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2c86 n PRO 49 N 2.43 0.49 -4.50 0.52 -0.02 -1.26 -5.02 135.00 127.64 2c86 n PRO 49 Ca 0.12 0.17 -0.34 0.00 -2.02 0.00 0.00 63.50 61.44 2c86 n PRO 49 Cb 0.33 -1.32 -0.12 0.00 -0.02 0.00 0.00 33.50 32.36 2c86 n PRO 49 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2c86 s LYS 50 N -1.23 3.52 -0.05 -0.52 2.47 -1.26 -4.99 119.74 117.68 2c86 s LYS 50 Ca 0.62 -0.55 0.03 0.00 -1.56 0.00 0.00 55.97 54.50 2c86 s LYS 50 Cb -0.82 -2.82 -0.03 0.00 -1.46 0.00 0.00 37.83 32.70 2c86 s LYS 50 CO 0.58 0.28 -0.11 -0.06 0.16 0.00 0.00 175.35 176.20 2c86 s PHE 51 N 0.23 2.80 -0.51 4.03 0.40 -1.26 -0.18 117.98 123.49 2c86 s PHE 51 Ca -0.04 -0.08 -0.20 0.00 -0.60 0.00 0.00 56.93 56.01 2c86 s PHE 51 Cb -0.14 -1.66 0.05 0.00 0.51 0.00 0.00 43.02 41.78 2c86 s PHE 51 CO 0.03 0.25 0.68 -1.21 0.70 0.00 0.00 175.22 175.67 2c86 s GLU 52 N -0.80 3.17 0.16 0.44 2.02 -0.72 -4.89 118.70 118.08 2c86 s GLU 52 Ca 0.12 -0.73 0.00 0.00 0.02 0.00 0.00 54.97 54.38 2c86 s GLU 52 Cb -0.11 -4.07 0.00 0.00 0.10 0.00 0.00 34.13 30.05 2c86 s GLU 52 CO 0.01 -1.24 0.00 0.41 0.02 0.00 0.00 175.26 174.46 2c86 n GLY 53 N 5.15 0.89 0.33 -1.39 0.00 -1.26 -3.41 105.19 105.50 2c86 n GLY 53 Ca -0.05 -1.63 -0.10 0.00 0.00 0.00 0.00 46.02 44.24 2c86 n GLY 53 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2c86 h SER 54 N 0.37 -0.98 0.00 1.61 4.64 -1.84 -3.47 113.55 113.88 2c86 h SER 54 Ca 0.00 0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2c86 h SER 54 Cb 0.00 0.43 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2c86 h SER 54 CO 0.00 -0.34 0.00 0.61 -0.87 0.00 0.00 176.83 176.23 2c86 n GLY 55 N -1.41 0.58 3.14 -0.77 0.00 -1.26 -2.88 105.19 102.59 2c86 n GLY 55 Ca -0.02 -0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 2c86 n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2c86 s VAL 56 N -2.00 2.43 0.33 1.61 1.01 -1.26 -4.90 120.40 117.62 2c86 s VAL 56 Ca 0.00 -1.14 -0.26 0.00 0.00 0.00 0.00 61.98 60.57 2c86 s VAL 56 Cb 0.00 -2.21 -0.13 0.00 0.00 0.00 0.00 36.38 34.04 2c86 s VAL 56 CO 0.00 0.26 0.92 -0.81 0.00 0.00 0.00 175.10 175.47 2c86 n PRO 57 N 4.59 1.17 -1.99 2.72 -0.04 -1.26 -4.88 135.00 135.32 2c86 n PRO 57 Ca -0.17 0.41 -0.42 0.00 -0.04 0.00 0.00 63.50 63.28 2c86 n PRO 57 Cb 0.47 -1.79 -0.03 0.00 -0.04 0.00 0.00 33.50 32.11 2c86 n PRO 57 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2c86 s ASP 58 N -0.67 6.64 -0.03 3.54 1.01 -1.21 -5.02 116.67 120.92 2c86 s ASP 58 Ca 0.60 2.54 -0.01 0.00 0.71 0.00 0.00 52.55 56.40 2c86 s ASP 58 Cb -0.67 -2.59 0.03 0.00 1.01 0.00 0.00 42.92 40.70 2c86 s ASP 58 CO 0.59 -0.79 0.04 0.21 0.21 0.00 0.00 175.17 175.43 2c86 s ASN 59 N 1.18 0.63 0.15 0.27 3.84 -1.26 -4.83 114.94 114.92 2c86 s ASN 59 Ca 0.69 0.04 -0.07 0.00 0.21 0.00 0.00 52.86 53.73 2c86 s ASN 59 Cb -0.42 -0.14 -0.02 0.00 -0.55 0.00 0.00 41.25 40.12 2c86 s ASN 59 CO 0.31 -0.18 1.40 -0.33 -2.79 0.00 0.00 177.10 175.52 2c86 h GLU 60 N 7.80 0.63 -3.99 0.43 4.39 -2.04 -3.30 114.58 118.50 2c86 h GLU 60 Ca -0.31 -0.47 -0.76 0.00 0.34 0.00 0.00 59.36 58.16 2c86 h GLU 60 Cb 1.12 0.09 -0.20 0.00 -0.10 0.00 0.00 28.75 29.66 2c86 h GLU 60 CO 0.34 1.09 1.34 0.09 -1.16 0.00 0.00 179.01 180.72 2c86 n ASN 61 N -3.92 5.37 -3.63 1.42 4.13 -1.26 -4.88 115.26 112.49 2c86 n ASN 61 Ca -0.05 -3.08 -0.05 0.00 1.68 0.00 0.00 54.58 53.08 2c86 n ASN 61 Cb 0.69 -1.48 -0.05 0.00 -1.54 0.00 0.00 39.78 37.40 2c86 n ASN 61 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 2c86 s ILE 62 N 0.27 0.00 0.08 2.41 1.10 -1.25 -5.04 121.20 118.77 2c86 s ILE 62 Ca 0.39 0.00 -0.21 0.00 -0.51 0.00 0.00 60.65 60.31 2c86 s ILE 62 Cb 0.01 -1.00 -0.07 0.00 0.15 0.00 0.00 42.46 41.55 2c86 s ILE 62 CO 0.00 0.00 0.63 -0.54 -2.11 0.00 0.00 174.94 172.92 2c86 s LYS 63 N -0.62 4.32 0.45 3.50 1.02 -1.26 -4.95 119.74 122.20 2c86 s LYS 63 Ca 0.06 0.85 0.30 0.00 0.02 0.00 0.00 55.97 57.20 2c86 s LYS 63 Cb -0.02 -3.27 1.41 0.00 -0.52 0.00 0.00 37.83 35.42 2c86 s LYS 63 CO -0.08 0.55 1.66 -1.35 -0.92 0.00 0.00 175.35 175.21 2c86 h PRO 64 N 4.78 0.12 -0.13 -1.68 0.11 -1.95 1.15 132.00 134.41 2c86 h PRO 64 Ca -0.48 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2c86 h PRO 64 Cb 1.21 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2c86 h PRO 64 CO 0.66 0.08 -0.11 0.66 -0.21 0.00 0.00 178.00 179.08 2c86 h SER 65 N 0.13 0.18 -0.86 -2.05 4.64 -1.93 -3.18 113.55 110.48 2c86 h SER 65 Ca 0.77 -0.03 -0.51 0.00 -0.47 0.00 0.00 61.79 61.55 2c86 h SER 65 Cb 2.46 -0.05 -0.28 0.00 -0.31 0.00 0.00 62.40 64.23 2c86 h SER 65 CO -0.32 0.32 0.47 0.00 -0.87 0.00 0.00 176.83 176.42 2c86 n GLN 66 N -4.31 2.41 -3.45 4.77 6.02 0.40 -0.72 117.38 122.51 2c86 n GLN 66 Ca -0.01 -3.22 -0.43 0.00 -0.01 0.00 0.00 57.00 53.33 2c86 n GLN 66 Cb 0.24 -2.15 -0.03 0.00 1.02 0.00 0.00 30.24 29.32 2c86 n GLN 66 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2c86 s GLN 67 N -3.48 3.68 -0.05 -1.09 -1.52 -1.11 -4.67 119.66 111.41 2c86 s GLN 67 Ca 0.57 -2.98 -0.31 0.00 -1.95 0.00 0.00 55.36 50.69 2c86 s GLN 67 Cb 0.47 -4.30 0.08 0.00 -0.22 0.00 0.00 33.01 29.03 2c86 s GLN 67 CO 0.05 -1.25 0.71 -3.38 -0.25 0.00 0.00 175.29 171.16 2c86 s HIS 68 N -0.82 -0.63 -1.47 0.91 -3.43 -1.26 -0.20 115.29 108.38 2c86 s HIS 68 Ca 0.25 1.05 0.00 0.00 -0.80 0.00 0.00 55.06 55.57 2c86 s HIS 68 Cb -0.10 0.42 0.00 0.00 -1.43 0.00 0.00 32.58 31.47 2c86 s HIS 68 CO -0.09 -0.60 0.00 0.41 -2.00 0.00 0.00 174.74 172.47 2c86 n GLY 69 N 0.84 -0.65 3.14 -1.38 0.00 -0.84 -3.39 105.19 102.91 2c86 n GLY 69 Ca -0.18 -0.55 -0.08 0.00 0.00 0.00 0.00 46.02 45.21 2c86 n GLY 69 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2c86 s TYR 70 N -3.59 0.31 -0.23 1.61 -0.85 0.19 -2.02 117.35 112.77 2c86 s TYR 70 Ca 0.00 -0.77 -0.05 0.00 -0.52 0.00 0.00 57.07 55.73 2c86 s TYR 70 Cb 0.00 -0.21 -0.02 0.00 0.38 0.00 0.00 41.96 42.12 2c86 s TYR 70 CO 0.00 -0.45 0.01 -1.58 -1.52 0.00 0.00 175.55 172.01 2c86 s TRP 71 N -3.67 3.01 -0.19 -3.49 0.52 -0.11 -1.74 118.94 113.27 2c86 s TRP 71 Ca 0.04 -0.72 -0.10 0.00 0.02 0.00 0.00 56.10 55.34 2c86 s TRP 71 Cb 0.05 -2.16 -0.05 0.00 -1.15 0.00 0.00 33.47 30.16 2c86 s TRP 71 CO -0.10 -0.47 0.14 0.50 0.02 0.00 0.00 176.95 177.04 2c86 s ARG 72 N 1.54 4.11 -0.36 4.98 3.52 -0.19 -1.25 118.95 131.30 2c86 s ARG 72 Ca 0.06 -0.20 -0.25 0.00 -0.13 0.00 0.00 55.73 55.20 2c86 s ARG 72 Cb -0.15 -3.40 0.01 0.00 -1.56 0.00 0.00 34.95 29.86 2c86 s ARG 72 CO -0.00 0.35 0.91 0.50 -0.81 0.00 0.00 175.30 176.24 2c86 s ARG 73 N 0.21 3.84 -0.27 5.12 3.52 0.04 -0.37 118.95 131.04 2c86 s ARG 73 Ca 0.09 0.56 -0.05 0.00 -0.13 0.00 0.00 55.73 56.20 2c86 s ARG 73 Cb -0.11 -3.80 0.01 0.00 -1.56 0.00 0.00 34.95 29.49 2c86 s ARG 73 CO -0.01 -0.92 0.02 -1.14 -0.81 0.00 0.00 175.30 172.44 2c86 s GLN 74 N 3.41 3.09 0.08 5.12 2.00 0.11 -4.97 119.66 128.51 2c86 s GLN 74 Ca 0.37 -0.83 -0.30 0.00 -2.00 0.00 0.00 55.36 52.60 2c86 s GLN 74 Cb -0.12 -3.20 -0.06 0.00 0.80 0.00 0.00 33.01 30.43 2c86 s GLN 74 CO 0.18 -0.38 1.09 0.00 -0.50 0.00 0.00 175.29 175.69 2c86 s ALA 75 N 1.45 3.31 0.30 1.58 0.00 -1.26 -2.59 121.76 124.55 2c86 s ALA 75 Ca 0.03 0.74 0.08 0.00 0.00 0.00 0.00 51.96 52.80 2c86 s ALA 75 Cb -0.16 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 2c86 s ALA 75 CO -0.00 -0.28 0.19 1.03 0.00 0.00 0.00 175.76 176.70 2c86 s ARG 76 N 0.53 2.68 0.04 0.00 3.00 -1.26 -5.01 118.95 118.92 2c86 s ARG 76 Ca 0.53 -1.27 0.00 0.00 0.00 0.00 0.00 55.73 55.00 2c86 s ARG 76 Cb -0.27 -2.41 -0.03 0.00 0.00 0.00 0.00 34.95 32.24 2c86 s ARG 76 CO 0.31 0.24 -0.04 -0.06 0.00 0.00 0.00 175.30 175.75 2c86 s PHE 77 N -2.27 0.43 -0.02 -0.53 0.40 -1.26 -3.08 117.98 111.66 2c86 s PHE 77 Ca 0.36 -0.68 0.02 0.00 -0.60 0.00 0.00 56.93 56.03 2c86 s PHE 77 Cb -0.06 -0.29 -0.03 0.00 0.51 0.00 0.00 43.02 43.14 2c86 s PHE 77 CO 0.24 -0.21 -0.03 0.21 0.70 0.00 0.00 175.22 176.13 2c86 s LYS 78 N -2.21 2.72 0.65 0.44 2.36 0.25 -4.82 119.74 119.13 2c86 s LYS 78 Ca -0.08 -0.62 -0.18 0.00 -2.55 0.00 0.00 55.97 52.55 2c86 s LYS 78 Cb -0.05 -2.61 -0.01 0.00 -1.05 0.00 0.00 37.83 34.12 2c86 s LYS 78 CO -0.03 0.63 1.27 -2.14 1.55 0.00 0.00 175.35 176.63 2c86 s PRO 79 N -1.32 2.55 0.00 4.03 0.02 -1.26 0.01 135.00 139.03 2c86 s PRO 79 Ca 0.17 1.99 0.00 0.00 0.02 0.00 0.00 61.00 63.18 2c86 s PRO 79 Cb -0.11 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.55 2c86 s PRO 79 CO 0.07 -1.58 0.00 0.41 -0.33 0.00 0.00 177.00 175.57 2c86 n GLY 80 N 0.77 -0.70 0.00 0.52 0.00 -1.26 -4.73 105.19 99.79 2c86 n GLY 80 Ca 0.15 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.73 2c86 n GLY 80 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2c86 n LYS 81 N 0.00 0.00 -2.43 1.61 0.00 -1.26 -4.67 118.16 111.41 2c86 n LYS 81 Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 57.92 2c86 n LYS 81 Cb 0.00 -0.55 -0.03 0.00 -0.00 0.00 0.00 35.03 34.45 2c86 n LYS 81 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2c86 s GLY 82 N -0.08 0.80 0.00 2.58 0.00 -1.26 -4.72 107.32 104.64 2c86 s GLY 82 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 44.72 43.26 2c86 s GLY 82 CO 0.00 2.86 0.00 0.61 0.00 0.00 0.00 173.10 176.57 2c86 n GLY 83 N 5.89 0.90 0.00 0.20 0.00 -1.26 -4.62 105.19 106.30 2c86 n GLY 83 Ca 0.16 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.65 2c86 n GLY 83 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2c86 n ARG 84 N 0.00 0.00 -3.93 1.61 3.00 -1.26 -4.58 116.66 111.50 2c86 n ARG 84 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.85 57.56 2c86 n ARG 84 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 32.46 32.29 2c86 n ARG 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2c86 s PRO 86 N 1.64 2.04 1.02 0.00 0.04 -1.26 0.85 135.00 139.32 2c86 s PRO 86 Ca 0.04 -0.22 -0.12 0.00 0.04 0.00 0.00 61.00 60.74 2c86 s PRO 86 Cb -0.13 -5.00 0.20 0.00 0.04 0.00 0.00 34.50 29.61 2c86 s PRO 86 CO -0.09 -4.14 1.08 0.14 0.04 0.00 0.00 177.00 174.04 2c86 s VAL 87 N 12.76 2.16 0.98 -0.36 -7.23 -1.18 -4.96 120.40 122.56 2c86 s VAL 87 Ca 0.78 0.05 -0.11 0.00 -1.81 0.00 0.00 61.98 60.89 2c86 s VAL 87 Cb -0.07 -2.44 0.16 0.00 0.56 0.00 0.00 36.38 34.60 2c86 s VAL 87 CO 0.07 -0.07 1.01 -0.81 -0.31 0.00 0.00 175.10 175.00 2c86 n PRO 88 N -4.30 -0.87 -0.41 4.82 -0.04 -1.26 -4.50 135.00 128.43 2c86 n PRO 88 Ca 0.05 -0.20 -0.21 0.00 -0.04 0.00 0.00 63.50 63.11 2c86 n PRO 88 Cb 0.56 -2.26 0.19 0.00 -0.04 0.00 0.00 33.50 31.95 2c86 n PRO 88 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2c86 n ASP 89 N -4.01 -2.69 -3.48 3.54 8.00 -1.26 -4.35 116.55 112.30 2c86 n ASP 89 Ca 0.09 -0.76 -0.15 0.00 0.71 0.00 0.00 54.79 54.68 2c86 n ASP 89 Cb 0.53 -0.68 -0.04 0.00 -0.02 0.00 0.00 41.12 40.91 2c86 n ASP 89 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2c86 s ALA 90 N -2.51 -1.70 -0.02 2.24 0.00 -1.07 -2.24 121.76 116.46 2c86 s ALA 90 Ca 0.47 0.95 0.02 0.00 0.00 0.00 0.00 51.96 53.40 2c86 s ALA 90 Cb -0.07 0.39 0.00 0.00 0.00 0.00 0.00 23.12 23.45 2c86 s ALA 90 CO 0.38 -0.56 -0.07 -1.58 0.00 0.00 0.00 175.76 173.93 2c86 s TRP 91 N -2.40 0.73 0.29 0.00 0.52 -1.00 0.08 118.94 117.16 2c86 s TRP 91 Ca -0.05 -0.16 0.08 0.00 0.02 0.00 0.00 56.10 55.99 2c86 s TRP 91 Cb -0.01 -0.53 -0.04 0.00 -1.15 0.00 0.00 33.47 31.74 2c86 s TRP 91 CO -0.01 -0.07 0.13 0.71 0.02 0.00 0.00 176.95 177.72 2c86 s TYR 92 N 0.18 2.83 -0.15 -1.98 1.51 0.50 -1.75 117.35 118.49 2c86 s TYR 92 Ca -0.02 -0.26 -0.03 0.00 -1.01 0.00 0.00 57.07 55.75 2c86 s TYR 92 Cb -0.07 -1.46 -0.03 0.00 -0.11 0.00 0.00 41.96 40.29 2c86 s TYR 92 CO 0.00 0.45 -0.05 0.12 -1.11 0.00 0.00 175.55 174.97 2c86 s PHE 93 N -2.31 3.00 -0.00 2.71 5.36 -1.26 -1.02 117.98 124.46 2c86 s PHE 93 Ca 0.35 -0.29 0.01 0.00 -0.96 0.00 0.00 56.93 56.04 2c86 s PHE 93 Cb -0.05 -1.93 -0.00 0.00 -0.34 0.00 0.00 43.02 40.69 2c86 s PHE 93 CO 0.23 -0.01 -0.05 0.71 -1.46 0.00 0.00 175.22 174.64 2c86 s TYR 94 N 0.25 0.42 0.41 10.12 1.51 -0.71 -4.23 117.35 125.10 2c86 s TYR 94 Ca -0.03 -0.10 -0.24 0.00 -1.01 0.00 0.00 57.07 55.69 2c86 s TYR 94 Cb -0.14 -0.27 -0.09 0.00 -0.11 0.00 0.00 41.96 41.36 2c86 s TYR 94 CO 0.03 -0.01 1.07 0.71 -1.11 0.00 0.00 175.55 176.24 2c86 s TYR 95 N -0.18 3.19 -0.26 2.71 1.51 -1.26 0.56 117.35 123.62 2c86 s TYR 95 Ca 0.01 1.62 -0.39 0.00 -1.01 0.00 0.00 57.07 57.31 2c86 s TYR 95 Cb -0.02 -3.17 -0.17 0.00 -0.11 0.00 0.00 41.96 38.48 2c86 s TYR 95 CO -0.00 -0.80 1.21 2.41 -1.11 0.00 0.00 175.55 177.26 2c86 n THR 96 N -0.16 0.00 -0.73 -0.71 -1.04 -1.22 -1.33 114.28 109.09 2c86 n THR 96 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 2c86 n THR 96 Cb 0.49 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 68.74 2c86 n THR 96 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2c86 n GLY 97 N 2.63 0.66 3.06 3.41 0.00 -1.25 -4.59 105.19 109.11 2c86 n GLY 97 Ca 0.23 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.09 2c86 n GLY 97 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2c86 s THR 98 N -2.17 0.70 0.00 2.61 -4.23 -0.44 -4.83 115.64 107.27 2c86 s THR 98 Ca 0.00 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.73 2c86 s THR 98 Cb 0.00 -0.66 0.00 0.00 1.34 0.00 0.00 72.50 73.18 2c86 s THR 98 CO 0.00 -0.09 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 2c86 n GLY 99 N 2.09 -0.27 0.00 3.99 0.00 -1.26 -4.27 105.19 105.47 2c86 n GLY 99 Ca -0.18 -1.87 0.03 0.00 0.00 0.00 0.00 46.02 44.00 2c86 n GLY 99 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2c86 n PRO 100 N -0.37 0.14 -2.42 1.61 -0.04 -1.26 -0.30 135.00 132.36 2c86 n PRO 100 Ca 0.00 0.11 -0.06 0.00 -0.04 0.00 0.00 63.50 63.51 2c86 n PRO 100 Cb 0.00 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.01 2c86 n PRO 100 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2c86 n ALA 101 N -1.13 3.22 0.32 0.55 0.00 -1.26 -4.94 120.51 117.27 2c86 n ALA 101 Ca 0.04 -3.00 0.09 0.00 0.00 0.00 0.00 53.44 50.56 2c86 n ALA 101 Cb 0.03 -0.70 0.39 0.00 0.00 0.00 0.00 19.45 19.17 2c86 n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2c86 n ALA 102 N -0.55 1.44 1.45 0.00 0.00 0.59 -2.00 120.51 121.45 2c86 n ALA 102 Ca 0.17 0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.79 2c86 n ALA 102 Cb 0.87 -1.27 0.49 0.00 0.00 0.00 0.00 19.45 19.54 2c86 n ALA 102 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2c86 n ASP 103 N -1.93 1.33 -4.86 0.00 5.75 -1.26 -3.82 116.55 111.76 2c86 n ASP 103 Ca 0.01 -1.55 -0.36 0.00 -0.01 0.00 0.00 54.79 52.88 2c86 n ASP 103 Cb 0.14 -0.05 -0.06 0.00 -1.03 0.00 0.00 41.12 40.12 2c86 n ASP 103 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2c86 s LEU 104 N -1.75 4.41 0.70 -2.12 1.43 -0.85 -5.08 118.68 115.42 2c86 s LEU 104 Ca 0.35 0.83 -0.12 0.00 -1.03 0.00 0.00 54.13 54.17 2c86 s LEU 104 Cb 0.19 -2.74 0.02 0.00 0.03 0.00 0.00 46.19 43.69 2c86 s LEU 104 CO 0.29 0.26 1.07 0.20 0.23 0.00 0.00 176.35 178.40 2c86 s ASN 105 N -1.42 5.15 0.24 2.29 0.01 -1.26 -4.43 114.94 115.52 2c86 s ASN 105 Ca 0.28 1.73 -0.30 0.00 -0.71 0.00 0.00 52.86 53.85 2c86 s ASN 105 Cb -0.15 -2.51 -0.11 0.00 0.41 0.00 0.00 41.25 38.89 2c86 s ASN 105 CO 0.15 -1.60 1.53 0.86 -1.51 0.00 0.00 177.10 176.53 2c86 s TRP 106 N -2.87 2.94 0.00 2.20 -0.00 -1.26 -2.69 118.94 117.25 2c86 s TRP 106 Ca 0.60 0.83 0.00 0.00 -0.00 0.00 0.00 56.10 57.54 2c86 s TRP 106 Cb -0.16 -3.94 0.00 0.00 -0.00 0.00 0.00 33.47 29.38 2c86 s TRP 106 CO 0.52 -3.20 0.00 0.41 -0.00 0.00 0.00 176.95 174.68 2c86 n GLY 107 N 2.58 2.33 3.64 5.86 0.00 -1.26 -5.06 105.19 113.29 2c86 n GLY 107 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2c86 n GLY 107 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2c86 s ASP 108 N -1.51 6.23 -0.06 1.61 1.11 -1.10 -4.93 116.67 118.02 2c86 s ASP 108 Ca 0.00 2.30 -0.30 0.00 0.18 0.00 0.00 52.55 54.74 2c86 s ASP 108 Cb 0.00 -2.53 -0.05 0.00 1.07 0.00 0.00 42.92 41.41 2c86 s ASP 108 CO 0.00 -1.28 1.56 -0.89 1.18 0.00 0.00 175.17 175.74 2c86 s THR 109 N 5.43 3.69 -0.10 -1.27 2.01 -1.26 -4.99 115.64 119.15 2c86 s THR 109 Ca 0.87 0.88 -0.18 0.00 0.31 0.00 0.00 61.69 63.57 2c86 s THR 109 Cb -0.37 -3.57 0.04 0.00 0.01 0.00 0.00 72.50 68.61 2c86 s THR 109 CO 0.37 -0.07 0.45 -1.58 -0.69 0.00 0.00 174.62 173.10 2c86 s GLN 110 N 3.73 0.67 0.31 4.92 2.00 -1.26 -5.13 119.66 124.89 2c86 s GLN 110 Ca 0.69 0.30 -0.29 0.00 -2.00 0.00 0.00 55.36 54.06 2c86 s GLN 110 Cb -0.31 0.31 -0.12 0.00 0.80 0.00 0.00 33.01 33.69 2c86 s GLN 110 CO 0.27 -0.15 1.41 -3.47 -0.50 0.00 0.00 175.29 172.85 2c86 n ASP 111 N 2.00 3.13 0.00 6.67 -0.08 -1.26 -2.97 116.55 124.04 2c86 n ASP 111 Ca -0.17 1.18 0.00 0.00 -1.51 0.00 0.00 54.79 54.29 2c86 n ASP 111 Cb 0.57 -1.51 0.00 0.00 2.34 0.00 0.00 41.12 42.51 2c86 n ASP 111 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2c86 n GLY 112 N 1.36 0.69 3.11 0.27 0.00 -1.26 -4.98 105.19 104.39 2c86 n GLY 112 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 2c86 n GLY 112 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2c86 s ILE 113 N -2.72 1.42 -0.23 -0.61 -1.09 -1.16 -0.78 121.20 116.02 2c86 s ILE 113 Ca 0.00 -0.68 -0.03 0.00 -2.23 0.00 0.00 60.65 57.71 2c86 s ILE 113 Cb 0.00 -1.24 0.00 0.00 -1.58 0.00 0.00 42.46 39.65 2c86 s ILE 113 CO 0.00 0.41 -0.05 -0.69 -1.23 0.00 0.00 174.94 173.38 2c86 s VAL 114 N 0.26 3.17 -0.18 2.92 1.01 -0.38 -4.73 120.40 122.48 2c86 s VAL 114 Ca -0.09 -0.66 -0.21 0.00 0.00 0.00 0.00 61.98 61.02 2c86 s VAL 114 Cb -0.14 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 2c86 s VAL 114 CO 0.03 0.36 0.63 0.26 0.00 0.00 0.00 175.10 176.38 2c86 s TRP 115 N 1.43 3.40 0.11 5.22 0.52 -1.26 -0.93 118.94 127.43 2c86 s TRP 115 Ca 0.04 0.95 0.05 0.00 0.02 0.00 0.00 56.10 57.17 2c86 s TRP 115 Cb -0.15 -2.78 -0.04 0.00 -1.15 0.00 0.00 33.47 29.35 2c86 s TRP 115 CO -0.04 -0.13 -0.13 0.14 0.02 0.00 0.00 176.95 176.81 2c86 s VAL 116 N 1.72 1.24 -0.25 4.03 -7.23 -0.86 -5.03 120.40 114.02 2c86 s VAL 116 Ca 0.29 -1.67 -0.26 0.00 -1.81 0.00 0.00 61.98 58.53 2c86 s VAL 116 Cb -0.16 -1.46 0.09 0.00 0.56 0.00 0.00 36.38 35.41 2c86 s VAL 116 CO 0.11 -0.43 0.86 0.00 -0.31 0.00 0.00 175.10 175.33 2c86 s ALA 117 N -2.14 -1.87 0.59 1.32 0.00 -1.14 -1.99 121.76 116.53 2c86 s ALA 117 Ca 0.07 1.87 -0.19 0.00 0.00 0.00 0.00 51.96 53.71 2c86 s ALA 117 Cb -0.05 -1.14 -0.04 0.00 0.00 0.00 0.00 23.12 21.89 2c86 s ALA 117 CO 0.02 -0.30 1.22 0.00 0.00 0.00 0.00 175.76 176.70 2c86 s ALA 118 N 0.07 2.57 0.32 0.00 0.00 0.72 -4.60 121.76 120.83 2c86 s ALA 118 Ca 0.00 1.04 -0.29 0.00 0.00 0.00 0.00 51.96 52.70 2c86 s ALA 118 Cb -0.04 -3.46 -0.12 0.00 0.00 0.00 0.00 23.12 19.50 2c86 s ALA 118 CO -0.01 -1.17 1.53 0.36 0.00 0.00 0.00 175.76 176.47 2c86 n LYS 119 N -1.53 2.62 -2.95 0.00 2.85 -1.26 -3.26 118.16 114.63 2c86 n LYS 119 Ca 0.13 0.93 -0.01 0.00 -1.05 0.00 0.00 58.31 58.31 2c86 n LYS 119 Cb 0.49 -2.67 0.00 0.00 -0.65 0.00 0.00 35.03 32.20 2c86 n LYS 119 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2c86 n GLY 120 N 1.50 -1.20 2.82 2.58 0.00 -1.26 -5.03 105.19 104.61 2c86 n GLY 120 Ca 0.06 0.50 -0.14 0.00 0.00 0.00 0.00 46.02 46.44 2c86 n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2c86 s ALA 121 N -2.96 0.06 -0.74 4.61 0.00 -1.20 -4.48 121.76 117.05 2c86 s ALA 121 Ca 0.02 0.15 -0.26 0.00 0.00 0.00 0.00 51.96 51.87 2c86 s ALA 121 Cb -0.01 -0.13 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 2c86 s ALA 121 CO 0.71 -0.05 1.91 0.34 0.00 0.00 0.00 175.76 178.66 2c86 s ASP 122 N 0.54 5.20 0.11 0.00 3.68 0.11 -4.78 116.67 121.53 2c86 s ASP 122 Ca -0.05 -0.12 0.18 0.00 2.13 0.00 0.00 52.55 54.69 2c86 s ASP 122 Cb -0.07 -2.54 0.75 0.00 -1.45 0.00 0.00 42.92 39.61 2c86 s ASP 122 CO -0.01 -2.56 1.54 0.35 0.13 0.00 0.00 175.17 174.62 2c86 n THR 123 N 7.53 0.98 0.96 1.71 -2.24 -1.26 -1.29 114.28 120.66 2c86 n THR 123 Ca 0.30 0.26 0.13 0.00 -2.27 0.00 0.00 64.05 62.47 2c86 n THR 123 Cb 0.50 -1.10 0.41 0.00 -2.10 0.00 0.00 70.33 68.04 2c86 n THR 123 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2c86 n LYS 124 N -1.80 0.03 -1.81 -0.78 3.00 -1.26 -4.64 118.16 110.90 2c86 n LYS 124 Ca 0.03 0.02 -0.29 0.00 -0.00 0.00 0.00 58.31 58.06 2c86 n LYS 124 Cb 0.18 -1.53 0.10 0.00 0.00 0.00 0.00 35.03 33.79 2c86 n LYS 124 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2c86 s SER 125 N -3.15 4.22 -0.10 3.14 1.04 -0.41 -5.10 113.70 113.35 2c86 s SER 125 Ca 0.12 0.81 -0.09 0.00 0.48 0.00 0.00 55.95 57.28 2c86 s SER 125 Cb 0.18 -1.32 0.03 0.00 0.10 0.00 0.00 66.02 65.01 2c86 s SER 125 CO 0.62 -2.09 0.26 -0.13 0.98 0.00 0.00 173.24 172.88 2c86 s ARG 126 N -5.51 0.30 0.65 4.02 1.81 -1.26 -5.01 118.95 113.94 2c86 s ARG 126 Ca 0.63 0.39 -0.08 0.00 -1.72 0.00 0.00 55.73 54.94 2c86 s ARG 126 Cb -0.12 0.12 0.14 0.00 -0.45 0.00 0.00 34.95 34.64 2c86 s ARG 126 CO 0.50 -0.05 0.88 -1.13 -0.68 0.00 0.00 175.30 174.82 2c86 n SER 127 N 3.09 0.37 -2.33 0.23 3.41 -1.26 -5.03 113.62 112.10 2c86 n SER 127 Ca -0.14 -1.50 -0.13 0.00 -0.26 0.00 0.00 58.87 56.84 2c86 n SER 127 Cb 0.58 -0.65 0.04 0.00 -0.26 0.00 0.00 64.21 63.92 2c86 n SER 127 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2c86 n ASN 128 N -3.39 3.36 0.05 4.04 0.23 -1.26 -4.82 115.26 113.47 2c86 n ASN 128 Ca 0.12 -2.98 -0.12 0.00 -0.53 0.00 0.00 54.58 51.06 2c86 n ASN 128 Cb 0.42 -0.40 -0.13 0.00 -2.08 0.00 0.00 39.78 37.58 2c86 n ASN 128 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 2c86 h GLN 129 N 2.32 0.13 0.00 -3.83 1.08 -1.96 -3.49 115.11 109.35 2c86 h GLN 129 Ca 0.13 -0.22 0.00 0.00 -1.45 0.00 0.00 58.65 57.11 2c86 h GLN 129 Cb 1.42 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.93 2c86 h GLN 129 CO 0.48 0.98 0.00 0.41 -0.95 0.00 0.00 178.83 179.76 2c86 n GLY 130 N 1.53 1.88 3.28 3.46 0.00 -1.26 -4.81 105.19 109.27 2c86 n GLY 130 Ca -0.10 -0.58 -0.22 0.00 0.00 0.00 0.00 46.02 45.12 2c86 n GLY 130 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2c86 s THR 131 N 0.00 1.63 0.07 2.61 -4.23 -1.26 -4.81 115.64 109.65 2c86 s THR 131 Ca 0.00 -1.65 -0.31 0.00 -1.18 0.00 0.00 61.69 58.56 2c86 s THR 131 Cb 0.00 -1.58 -0.08 0.00 1.34 0.00 0.00 72.50 72.18 2c86 s THR 131 CO 0.00 -0.19 1.58 -0.60 -0.54 0.00 0.00 174.62 174.87 2c86 s ARG 132 N -2.23 4.22 -0.68 3.99 3.52 0.12 -4.69 118.95 123.20 2c86 s ARG 132 Ca 0.08 2.25 -0.26 0.00 -0.13 0.00 0.00 55.73 57.68 2c86 s ARG 132 Cb -0.08 -3.54 0.04 0.00 -1.56 0.00 0.00 34.95 29.81 2c86 s ARG 132 CO 0.05 -0.68 1.17 0.34 -0.81 0.00 0.00 175.30 175.37 2c86 s ASP 133 N 2.14 6.23 0.00 -2.12 2.15 -1.26 -2.97 116.67 120.84 2c86 s ASP 133 Ca 0.71 -0.45 0.00 0.00 0.43 0.00 0.00 52.55 53.24 2c86 s ASP 133 Cb -0.38 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 39.72 2c86 s ASP 133 CO 0.31 -1.64 0.39 -0.81 -0.17 0.00 0.00 175.17 173.25 2c86 n PRO 134 N 8.70 0.45 -2.62 4.34 -0.04 -1.26 -1.59 135.00 142.98 2c86 n PRO 134 Ca 0.02 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.35 2c86 n PRO 134 Cb 0.48 -1.26 0.02 0.00 -0.04 0.00 0.00 33.50 32.70 2c86 n PRO 134 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2c86 n ASP 135 N 0.65 2.18 -3.68 3.54 -0.08 -1.26 -4.57 116.55 113.33 2c86 n ASP 135 Ca 0.00 -2.94 -0.22 0.00 -1.51 0.00 0.00 54.79 50.11 2c86 n ASP 135 Cb 0.20 -0.51 -0.18 0.00 2.34 0.00 0.00 41.12 42.97 2c86 n ASP 135 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 2c86 s LYS 136 N -3.21 0.12 -0.37 -0.67 -2.85 -1.26 -5.15 119.74 106.34 2c86 s LYS 136 Ca 0.32 0.18 -0.15 0.00 -1.00 0.00 0.00 55.97 55.32 2c86 s LYS 136 Cb 0.45 -0.99 0.00 0.00 -2.06 0.00 0.00 37.83 35.22 2c86 s LYS 136 CO -0.01 -0.42 0.32 -0.06 0.10 0.00 0.00 175.35 175.28 2c86 s PHE 137 N 2.11 3.22 0.92 1.78 0.40 -0.62 -5.09 117.98 120.69 2c86 s PHE 137 Ca 0.04 -0.30 -0.11 0.00 -0.60 0.00 0.00 56.93 55.96 2c86 s PHE 137 Cb -0.13 -2.63 0.14 0.00 0.51 0.00 0.00 43.02 40.91 2c86 s PHE 137 CO -0.05 -0.50 1.10 -0.51 0.70 0.00 0.00 175.22 175.96 2c86 s ASP 138 N 1.73 3.07 0.30 1.36 1.11 -1.26 -4.52 116.67 118.46 2c86 s ASP 138 Ca 0.08 1.85 -0.26 0.00 0.18 0.00 0.00 52.55 54.40 2c86 s ASP 138 Cb -0.18 -2.43 -0.15 0.00 1.07 0.00 0.00 42.92 41.23 2c86 s ASP 138 CO 0.11 -2.95 0.62 1.67 1.18 0.00 0.00 175.17 175.81 2c86 n GLN 139 N -4.12 0.52 -3.74 8.23 7.27 -1.26 -4.95 117.38 119.34 2c86 n GLN 139 Ca 0.09 0.18 -0.36 0.00 0.07 0.00 0.00 57.00 56.99 2c86 n GLN 139 Cb 0.53 -1.36 -0.09 0.00 2.41 0.00 0.00 30.24 31.73 2c86 n GLN 139 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 2c86 s TYR 140 N -1.19 3.35 0.26 3.69 2.02 -0.52 -4.82 117.35 120.13 2c86 s TYR 140 Ca 0.62 0.24 -0.30 0.00 -0.37 0.00 0.00 57.07 57.26 2c86 s TYR 140 Cb -0.76 -2.19 -0.14 0.00 -0.40 0.00 0.00 41.96 38.47 2c86 s TYR 140 CO 0.58 0.17 1.17 -0.35 -1.57 0.00 0.00 175.55 175.56 2c86 n PRO 141 N 3.85 1.57 -3.42 -1.71 -0.04 -1.26 -1.74 135.00 132.25 2c86 n PRO 141 Ca -0.16 0.55 -0.42 0.00 -0.04 0.00 0.00 63.50 63.43 2c86 n PRO 141 Cb 0.52 -2.05 -0.10 0.00 -0.04 0.00 0.00 33.50 31.84 2c86 n PRO 141 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2c86 s LEU 142 N 0.21 4.83 0.31 1.53 1.98 -1.26 -4.89 118.68 121.39 2c86 s LEU 142 Ca 0.64 -0.65 0.09 0.00 -2.89 0.00 0.00 54.13 51.31 2c86 s LEU 142 Cb -0.71 -2.25 -0.04 0.00 0.66 0.00 0.00 46.19 43.85 2c86 s LEU 142 CO 0.56 -0.43 0.08 0.00 -1.89 0.00 0.00 176.35 174.67 2c86 s ARG 143 N 1.87 2.36 -0.39 1.98 1.70 -1.26 -4.98 118.95 120.23 2c86 s ARG 143 Ca 0.08 -1.48 0.10 0.00 -0.47 0.00 0.00 55.73 53.97 2c86 s ARG 143 Cb -0.18 -2.18 0.40 0.00 -0.57 0.00 0.00 34.95 32.42 2c86 s ARG 143 CO 0.11 0.23 1.28 1.19 -1.08 0.00 0.00 175.30 177.03 2c86 n PHE 144 N -1.04 -1.90 -0.56 5.89 3.01 -1.26 -3.36 117.46 118.23 2c86 n PHE 144 Ca -0.05 -2.08 0.45 0.00 1.01 0.00 0.00 57.45 56.78 2c86 n PHE 144 Cb 0.60 1.28 0.76 0.00 -0.01 0.00 0.00 39.48 42.11 2c86 n PHE 144 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 2c86 h SER 145 N 2.20 0.08 -0.12 4.37 0.02 -1.99 0.16 113.55 118.26 2c86 h SER 145 Ca -0.24 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 2c86 h SER 145 Cb 1.27 0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.85 2c86 h SER 145 CO 0.03 -0.06 0.00 -0.90 -1.14 0.00 0.00 176.83 174.77 2c86 n ASP 146 N -4.22 0.98 0.00 3.07 5.75 -1.26 -4.96 116.55 115.90 2c86 n ASP 146 Ca 0.39 -2.04 0.00 0.00 -0.01 0.00 0.00 54.79 53.13 2c86 n ASP 146 Cb 1.69 -0.20 0.00 0.00 -1.03 0.00 0.00 41.12 41.59 2c86 n ASP 146 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2c86 n GLY 147 N 0.56 1.12 0.00 6.12 0.00 0.55 -4.33 105.19 109.21 2c86 n GLY 147 Ca 0.04 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.42 2c86 n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2c86 n GLY 148 N 0.00 0.51 3.60 -0.02 0.00 -1.22 -4.79 105.19 103.27 2c86 n GLY 148 Ca 0.00 -1.79 -0.29 0.00 0.00 0.00 0.00 46.02 43.94 2c86 n GLY 148 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2c86 s PRO 149 N -1.26 0.18 0.04 1.61 0.04 -1.26 -1.75 135.00 132.59 2c86 s PRO 149 Ca 0.00 1.01 -0.01 0.00 0.04 0.00 0.00 61.00 62.04 2c86 s PRO 149 Cb 0.00 -1.67 0.01 0.00 0.04 0.00 0.00 34.50 32.88 2c86 s PRO 149 CO 0.00 -3.03 0.03 -0.40 0.04 0.00 0.00 177.00 173.64 2c86 n ASP 150 N -4.45 -0.95 0.27 6.66 5.75 0.75 -4.85 116.55 119.73 2c86 n ASP 150 Ca 0.06 -0.56 0.18 0.00 -0.01 0.00 0.00 54.79 54.46 2c86 n ASP 150 Cb 0.54 -0.03 0.89 0.00 -1.03 0.00 0.00 41.12 41.49 2c86 n ASP 150 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 2c86 h GLY 151 N -0.53 0.00 -1.98 6.12 0.00 -1.96 -3.15 103.07 101.56 2c86 h GLY 151 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2c86 h GLY 151 CO 0.01 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.25 2c86 n ASN 152 N -2.85 2.94 -4.07 0.19 5.03 -1.26 -4.93 115.26 110.31 2c86 n ASN 152 Ca -0.01 -1.97 -0.12 0.00 0.87 0.00 0.00 54.58 53.35 2c86 n ASN 152 Cb 0.15 -0.33 -0.11 0.00 -1.02 0.00 0.00 39.78 38.46 2c86 n ASN 152 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 2c86 s PHE 153 N -1.33 0.64 0.22 3.10 0.40 -1.19 -0.94 117.98 118.88 2c86 s PHE 153 Ca 0.37 -0.58 -0.08 0.00 -0.60 0.00 0.00 56.93 56.05 2c86 s PHE 153 Cb 0.20 -0.39 -0.02 0.00 0.51 0.00 0.00 43.02 43.32 2c86 s PHE 153 CO 0.27 -0.12 0.32 -0.98 0.70 0.00 0.00 175.22 175.41 2c86 s ARG 154 N -1.96 1.36 -0.24 0.44 1.70 -0.67 -4.88 118.95 114.70 2c86 s ARG 154 Ca -0.07 -1.39 -0.20 0.00 -0.47 0.00 0.00 55.73 53.60 2c86 s ARG 154 Cb -0.07 0.38 0.07 0.00 -0.57 0.00 0.00 34.95 34.75 2c86 s ARG 154 CO -0.01 -0.52 0.63 1.67 -1.08 0.00 0.00 175.30 176.00 2c86 s TRP 155 N -4.07 -0.77 0.55 5.89 -2.14 -1.26 -1.82 118.94 115.33 2c86 s TRP 155 Ca 0.28 1.77 -0.18 0.00 2.66 0.00 0.00 56.10 60.63 2c86 s TRP 155 Cb 0.03 0.32 -0.11 0.00 -3.10 0.00 0.00 33.47 30.61 2c86 s TRP 155 CO 0.09 -0.38 0.21 -0.25 -2.66 0.00 0.00 176.95 173.96 2c86 n ASP 156 N 3.18 -2.31 -4.73 -2.66 9.92 -1.26 -4.95 116.55 113.73 2c86 n ASP 156 Ca -0.16 0.69 -0.41 0.00 -0.53 0.00 0.00 54.79 54.38 2c86 n ASP 156 Cb 0.56 -1.02 -0.03 0.00 -0.64 0.00 0.00 41.12 39.99 2c86 n ASP 156 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 2c86 s PHE 157 N -1.86 3.47 -0.03 1.24 5.36 -1.26 -4.91 117.98 119.99 2c86 s PHE 157 Ca 0.63 1.43 0.05 0.00 -0.96 0.00 0.00 56.93 58.08 2c86 s PHE 157 Cb -0.46 -3.39 -0.01 0.00 -0.34 0.00 0.00 43.02 38.82 2c86 s PHE 157 CO 0.60 -1.07 -0.18 0.42 -1.46 0.00 0.00 175.22 173.53 2c86 s ILE 158 N 0.24 1.50 -0.26 3.12 1.01 -1.26 -5.11 121.20 120.43 2c86 s ILE 158 Ca 0.54 -0.78 -0.40 0.00 0.00 0.00 0.00 60.65 60.00 2c86 s ILE 158 Cb -0.31 -1.27 -0.16 0.00 0.01 0.00 0.00 42.46 40.73 2c86 s ILE 158 CO 0.34 0.43 1.72 -2.65 0.00 0.00 0.00 174.94 174.78 2c86 n PRO 159 N 2.90 1.13 0.00 2.79 -0.02 -1.26 -4.91 135.00 135.63 2c86 n PRO 159 Ca -0.17 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 2c86 n PRO 159 Cb 0.53 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 2c86 n PRO 159 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76