#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j55 s ASP 8 N 0.00 6.45 0.37 8.00 2.15 -1.26 -4.98 116.67 127.40 2j55 s ASP 8 Ca 0.00 0.30 0.05 0.00 0.43 0.00 0.00 52.55 53.33 2j55 s ASP 8 Cb 0.00 -2.32 0.71 0.00 -0.30 0.00 0.00 42.92 41.01 2j55 s ASP 8 CO 0.00 -0.51 1.99 1.55 -0.17 0.00 0.00 175.17 178.04 2j55 h PRO 9 N 8.29 0.64 0.00 4.34 0.13 -2.06 -3.20 132.00 140.15 2j55 h PRO 9 Ca -0.27 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2j55 h PRO 9 Cb 1.12 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2j55 h PRO 9 CO 0.81 0.48 -0.40 0.54 -0.23 0.00 0.00 178.00 179.19 2j55 n ARG 10 N -4.41 0.10 -2.54 0.86 1.74 -1.26 -4.93 116.66 106.22 2j55 n ARG 10 Ca 0.04 0.04 -0.34 0.00 -0.77 0.00 0.00 57.85 56.81 2j55 n ARG 10 Cb 0.10 -1.57 -0.03 0.00 -1.02 0.00 0.00 32.46 29.93 2j55 n ARG 10 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2j55 s ALA 11 N -3.05 2.90 0.08 7.54 0.00 -1.21 -4.96 121.76 123.06 2j55 s ALA 11 Ca 0.10 0.63 -0.35 0.00 0.00 0.00 0.00 51.96 52.35 2j55 s ALA 11 Cb 0.16 -3.26 -0.19 0.00 0.00 0.00 0.00 23.12 19.84 2j55 s ALA 11 CO 0.66 -0.31 0.83 1.17 0.00 0.00 0.00 175.76 178.12 2j55 n LYS 12 N -0.84 0.00 -2.67 0.00 4.81 -1.26 -4.88 118.16 113.32 2j55 n LYS 12 Ca 0.09 0.00 -0.40 0.00 -0.87 0.00 0.00 58.31 57.13 2j55 n LYS 12 Cb 0.52 -1.28 -0.05 0.00 0.02 0.00 0.00 35.03 34.24 2j55 n LYS 12 CO 0.00 0.00 0.00 -0.46 1.17 0.00 0.00 177.40 178.11 2j55 s TRP 13 N -0.41 3.86 -0.24 5.64 -0.00 -1.26 -5.02 118.94 121.51 2j55 s TRP 13 Ca 0.79 1.85 0.01 0.00 -0.00 0.00 0.00 56.10 58.75 2j55 s TRP 13 Cb -1.12 -3.07 0.06 0.00 -0.00 0.00 0.00 33.47 29.34 2j55 s TRP 13 CO 0.56 0.16 -0.06 0.08 -0.00 0.00 0.00 176.95 177.68 2j55 s VAL 14 N -1.18 1.64 0.52 5.86 1.01 -1.26 -5.12 120.40 121.87 2j55 s VAL 14 Ca 0.42 -1.28 -0.22 0.00 0.00 0.00 0.00 61.98 60.90 2j55 s VAL 14 Cb -0.28 -1.87 -0.06 0.00 0.00 0.00 0.00 36.38 34.17 2j55 s VAL 14 CO 0.35 -0.08 1.26 -2.16 0.00 0.00 0.00 175.10 174.46 2j55 s PRO 15 N 1.35 3.34 0.20 2.72 0.04 -1.26 -4.84 135.00 136.54 2j55 s PRO 15 Ca -0.06 1.98 0.08 0.00 0.04 0.00 0.00 61.00 63.04 2j55 s PRO 15 Cb -0.19 -2.25 -0.05 0.00 0.04 0.00 0.00 34.50 32.06 2j55 s PRO 15 CO -0.06 -0.96 -0.15 1.14 0.04 0.00 0.00 177.00 177.02 2j55 s GLN 16 N -2.91 1.33 -0.25 4.56 1.03 0.05 -4.88 119.66 118.60 2j55 s GLN 16 Ca 0.70 -1.59 0.10 0.00 0.04 0.00 0.00 55.36 54.61 2j55 s GLN 16 Cb -0.34 -1.13 0.45 0.00 0.03 0.00 0.00 33.01 32.02 2j55 s GLN 16 CO 0.40 0.19 1.19 -3.47 -2.54 0.00 0.00 175.29 171.06 2j55 n ASP 17 N -0.37 3.37 -0.00 12.60 2.03 -1.26 -0.81 116.55 132.11 2j55 n ASP 17 Ca -0.08 -3.62 0.01 0.00 0.52 0.00 0.00 54.79 51.62 2j55 n ASP 17 Cb 0.60 -0.42 -0.01 0.00 -0.72 0.00 0.00 41.12 40.57 2j55 n ASP 17 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2j55 n ASN 18 N -0.80 0.45 -3.18 1.67 2.04 -1.26 -5.03 115.26 109.16 2j55 n ASN 18 Ca 0.31 -0.51 0.02 0.00 -0.44 0.00 0.00 54.58 53.96 2j55 n ASN 18 Cb 0.87 1.01 -0.02 0.00 -2.53 0.00 0.00 39.78 39.11 2j55 n ASN 18 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 2j55 s ASP 19 N -1.29 -1.18 0.30 0.53 2.15 -1.26 -5.05 116.67 110.88 2j55 s ASP 19 Ca 0.01 0.61 0.26 0.00 0.43 0.00 0.00 52.55 53.86 2j55 s ASP 19 Cb 0.02 1.98 0.80 0.00 -0.30 0.00 0.00 42.92 45.41 2j55 s ASP 19 CO 0.09 -0.28 1.75 0.16 -0.17 0.00 0.00 175.17 176.72 2j55 h ILE 20 N 6.03 0.00 -0.00 4.11 3.07 -1.96 -2.97 117.51 125.78 2j55 h ILE 20 Ca -0.18 -0.55 0.00 0.00 1.55 0.00 0.00 64.86 65.69 2j55 h ILE 20 Cb 1.16 1.49 0.00 0.00 -0.27 0.00 0.00 36.82 39.21 2j55 h ILE 20 CO 0.24 0.00 -0.11 0.00 -1.05 0.00 0.00 178.15 177.23 2j55 n GLN 21 N -2.53 0.54 -3.40 0.16 6.02 -1.26 -4.86 117.38 112.06 2j55 n GLN 21 Ca 0.04 -0.16 -0.34 0.00 -0.01 0.00 0.00 57.00 56.53 2j55 n GLN 21 Cb 0.40 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 30.11 2j55 n GLN 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2j55 s ALA 22 N -2.56 3.59 -0.45 -1.58 0.00 -1.12 -4.94 121.76 114.70 2j55 s ALA 22 Ca 0.27 -0.20 0.24 0.00 0.00 0.00 0.00 51.96 52.26 2j55 s ALA 22 Cb 0.20 -2.47 1.00 0.00 0.00 0.00 0.00 23.12 21.85 2j55 s ALA 22 CO 0.49 0.48 1.71 0.00 0.00 0.00 0.00 175.76 178.44 2j55 n ASP 24 N -2.25 4.13 -4.75 0.00 5.68 -1.26 -4.86 116.55 113.24 2j55 n ASP 24 Ca 0.02 -2.21 -0.41 0.00 -0.50 0.00 0.00 54.79 51.68 2j55 n ASP 24 Cb 0.22 -0.52 -0.02 0.00 -1.14 0.00 0.00 41.12 39.66 2j55 n ASP 24 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 2j55 s TYR 25 N -1.46 2.86 0.27 2.11 5.04 -0.95 -0.77 117.35 124.45 2j55 s TYR 25 Ca 0.47 0.85 -0.02 0.00 -2.44 0.00 0.00 57.07 55.93 2j55 s TYR 25 Cb 0.28 -3.98 0.41 0.00 0.35 0.00 0.00 41.96 39.02 2j55 s TYR 25 CO 0.27 -3.28 1.88 0.11 -1.34 0.00 0.00 175.55 173.20 2j55 h TRP 26 N 5.03 1.19 0.00 4.97 5.08 -1.31 0.11 115.95 131.02 2j55 h TRP 26 Ca -0.46 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.54 2j55 h TRP 26 Cb 1.22 -0.39 0.00 0.00 -3.00 0.00 0.00 29.16 26.99 2j55 h TRP 26 CO 0.59 0.61 0.00 0.54 -1.28 0.00 0.00 178.44 178.90 2j55 n ARG 27 N -4.51 0.05 -0.57 0.12 1.74 -1.26 -2.95 116.66 109.28 2j55 n ARG 27 Ca 0.16 0.36 0.05 0.00 -0.77 0.00 0.00 57.85 57.64 2j55 n ARG 27 Cb 0.19 -1.62 0.28 0.00 -1.02 0.00 0.00 32.46 30.29 2j55 n ARG 27 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2j55 n HIS 28 N -1.72 1.34 0.23 -1.55 8.25 0.37 -4.58 115.22 117.57 2j55 n HIS 28 Ca 0.02 -0.48 0.12 0.00 -0.26 0.00 0.00 57.72 57.12 2j55 n HIS 28 Cb 0.15 -0.33 0.73 0.00 1.12 0.00 0.00 29.99 31.65 2j55 n HIS 28 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2j55 n SER 30 N -4.29 2.00 -4.77 0.00 2.88 -1.26 -2.00 113.62 106.18 2j55 n SER 30 Ca -0.01 -2.75 -0.40 0.00 -1.33 0.00 0.00 58.87 54.38 2j55 n SER 30 Cb 0.17 -0.41 -0.03 0.00 -0.75 0.00 0.00 64.21 63.20 2j55 n SER 30 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 2j55 s ILE 31 N -2.54 2.95 -0.24 2.46 2.07 -0.74 -4.79 121.20 120.37 2j55 s ILE 31 Ca 0.36 0.94 0.00 0.00 -1.41 0.00 0.00 60.65 60.54 2j55 s ILE 31 Cb 0.37 -3.59 0.07 0.00 0.13 0.00 0.00 42.46 39.44 2j55 s ILE 31 CO -0.08 0.20 -0.02 -0.62 -1.91 0.00 0.00 174.94 172.52 2j55 s ASP 32 N -0.68 3.76 0.00 4.50 2.15 -1.26 -1.44 116.67 123.69 2j55 s ASP 32 Ca 0.49 -1.22 0.00 0.00 0.43 0.00 0.00 52.55 52.25 2j55 s ASP 32 Cb -0.37 -1.07 0.00 0.00 -0.30 0.00 0.00 42.92 41.19 2j55 s ASP 32 CO 0.48 -0.28 0.00 0.61 -0.17 0.00 0.00 175.17 175.81 2j55 n GLY 33 N 4.73 0.70 2.96 2.66 0.00 -0.51 -4.88 105.19 110.86 2j55 n GLY 33 Ca -0.09 -0.51 -0.11 0.00 0.00 0.00 0.00 46.02 45.30 2j55 n GLY 33 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2j55 s ASN 34 N -4.00 0.01 -0.20 1.61 0.01 -1.26 -1.07 114.94 110.04 2j55 s ASN 34 Ca 0.00 -0.03 -0.29 0.00 -0.71 0.00 0.00 52.86 51.82 2j55 s ASN 34 Cb 0.00 0.13 -0.01 0.00 0.41 0.00 0.00 41.25 41.78 2j55 s ASN 34 CO 0.00 -0.11 1.29 -0.63 -1.51 0.00 0.00 177.10 176.14 2j55 s ILE 35 N -0.41 4.21 0.49 0.60 1.01 -0.96 -0.80 121.20 125.35 2j55 s ILE 35 Ca -0.05 1.44 0.17 0.00 0.00 0.00 0.00 60.65 62.21 2j55 s ILE 35 Cb -0.03 -4.02 0.31 0.00 0.01 0.00 0.00 42.46 38.73 2j55 s ILE 35 CO 0.00 -0.22 2.07 0.00 0.00 0.00 0.00 174.94 176.79 2j55 h ASP 37 N 0.14 0.00 0.32 0.00 3.58 -1.76 -1.79 116.42 116.92 2j55 h ASP 37 Ca 0.13 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.58 2j55 h ASP 37 Cb 0.34 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.39 2j55 h ASP 37 CO -0.02 0.00 -0.12 0.00 -2.88 0.00 0.00 179.24 176.22 2j55 n SER 39 N -0.88 1.63 0.00 0.00 3.41 -0.72 -4.90 113.62 112.17 2j55 n SER 39 Ca 0.15 -3.14 0.00 0.00 -0.26 0.00 0.00 58.87 55.61 2j55 n SER 39 Cb 0.28 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 2j55 n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2j55 n GLY 40 N -0.87 0.58 0.00 5.00 0.00 -1.23 -4.79 105.19 103.87 2j55 n GLY 40 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2j55 n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j55 n GLY 41 N -2.01 -0.35 0.67 -0.02 0.00 -0.92 -4.29 105.19 98.27 2j55 n GLY 41 Ca 0.00 -1.70 -0.04 0.00 0.00 0.00 0.00 46.02 44.28 2j55 n GLY 41 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2j55 n SER 42 N -0.25 -0.15 -0.30 1.61 3.41 -0.32 -4.35 113.62 113.25 2j55 n SER 42 Ca 0.00 -1.45 0.08 0.00 -0.26 0.00 0.00 58.87 57.23 2j55 n SER 42 Cb 0.00 0.36 0.24 0.00 -0.26 0.00 0.00 64.21 64.54 2j55 n SER 42 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2j55 h LEU 43 N 0.00 0.57 -2.23 1.04 5.85 -1.94 -3.17 115.31 115.44 2j55 h LEU 43 Ca -0.05 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2j55 h LEU 43 Cb 0.25 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.28 2j55 h LEU 43 CO 0.07 0.24 0.00 0.35 -0.34 0.00 0.00 178.44 178.76 2j55 n THR 44 N -4.85 0.61 -4.38 1.05 -2.24 -1.26 -0.55 114.28 102.65 2j55 n THR 44 Ca 0.18 -0.80 -0.24 0.00 -2.27 0.00 0.00 64.05 60.92 2j55 n THR 44 Cb 0.45 0.71 -0.13 0.00 -2.10 0.00 0.00 70.33 69.25 2j55 n THR 44 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2j55 s ASN 45 N -0.65 2.39 0.38 3.42 0.01 -1.20 -4.82 114.94 114.48 2j55 s ASN 45 Ca 0.02 -0.62 -0.24 0.00 -0.71 0.00 0.00 52.86 51.31 2j55 s ASN 45 Cb 0.01 -0.15 -0.10 0.00 0.41 0.00 0.00 41.25 41.43 2j55 s ASN 45 CO 0.02 0.07 1.00 0.00 -1.51 0.00 0.00 177.10 176.68 2j55 n PRO 47 N -0.02 0.30 -1.66 0.00 -0.02 -1.26 -4.56 135.00 127.78 2j55 n PRO 47 Ca 0.05 0.18 -0.40 0.00 -2.02 0.00 0.00 63.50 61.30 2j55 n PRO 47 Cb 0.51 -2.41 0.03 0.00 -0.02 0.00 0.00 33.50 31.61 2j55 n PRO 47 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2j55 n PRO 48 N -2.94 1.44 0.00 0.52 -0.02 -1.26 -2.52 135.00 130.22 2j55 n PRO 48 Ca 0.14 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 2j55 n PRO 48 Cb 0.50 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 2j55 n PRO 48 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2j55 n GLY 49 N 1.03 2.88 4.00 -1.23 0.00 -1.26 -5.03 105.19 105.58 2j55 n GLY 49 Ca 0.10 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.94 2j55 n GLY 49 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2j55 s THR 50 N -2.16 2.86 -0.06 2.61 -4.23 -1.05 -4.93 115.64 108.68 2j55 s THR 50 Ca 0.00 -0.89 0.05 0.00 -1.18 0.00 0.00 61.69 59.68 2j55 s THR 50 Cb 0.00 -2.97 -0.01 0.00 1.34 0.00 0.00 72.50 70.85 2j55 s THR 50 CO 0.00 0.00 -0.22 -0.54 -0.54 0.00 0.00 174.62 173.32 2j55 s LYS 51 N -4.50 2.60 -0.38 3.99 -0.14 -0.06 -4.86 119.74 116.39 2j55 s LYS 51 Ca 0.56 -0.85 -0.21 0.00 -1.36 0.00 0.00 55.97 54.11 2j55 s LYS 51 Cb -0.10 -2.23 0.01 0.00 -1.68 0.00 0.00 37.83 33.82 2j55 s LYS 51 CO 0.35 0.41 0.65 -1.17 -0.76 0.00 0.00 175.35 174.84 2j55 s LEU 52 N -0.23 4.29 0.55 3.17 2.96 -1.26 -0.84 118.68 127.33 2j55 s LEU 52 Ca -0.01 0.06 -0.21 0.00 -0.22 0.00 0.00 54.13 53.75 2j55 s LEU 52 Cb -0.13 -2.80 -0.06 0.00 0.50 0.00 0.00 46.19 43.70 2j55 s LEU 52 CO 0.03 -0.65 1.13 0.00 -1.32 0.00 0.00 176.35 175.54 2j55 n ALA 53 N 6.14 0.73 0.23 5.97 0.00 -0.47 -3.65 120.51 129.47 2j55 n ALA 53 Ca -0.01 0.09 0.10 0.00 0.00 0.00 0.00 53.44 53.62 2j55 n ALA 53 Cb 0.48 -2.20 -0.14 0.00 0.00 0.00 0.00 19.45 17.59 2j55 n ALA 53 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2j55 n THR 54 N -1.29 0.00 -3.96 0.00 -2.24 -0.77 -4.73 114.28 101.29 2j55 n THR 54 Ca 0.12 -0.35 -0.26 0.00 -2.27 0.00 0.00 64.05 61.28 2j55 n THR 54 Cb 0.45 0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.93 2j55 n THR 54 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j55 s ALA 55 N -3.25 3.91 0.00 6.98 0.00 -1.04 -5.03 121.76 123.33 2j55 s ALA 55 Ca -0.04 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 50.88 2j55 s ALA 55 Cb 0.13 -1.72 0.00 0.00 0.00 0.00 0.00 23.12 21.53 2j55 s ALA 55 CO 0.82 0.55 0.00 -1.13 0.00 0.00 0.00 175.76 176.00 2j55 n SER 56 N -0.46 1.15 -3.49 0.00 3.41 -1.26 -4.43 113.62 108.54 2j55 n SER 56 Ca -0.07 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.46 2j55 n SER 56 Cb 0.54 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.49 2j55 n SER 56 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2j55 s VAL 58 N 0.80 0.00 -0.24 -3.33 -7.23 -0.78 -4.90 120.40 104.72 2j55 s VAL 58 Ca 0.00 -1.00 -0.26 0.00 -1.81 0.00 0.00 61.98 58.91 2j55 s VAL 58 Cb 0.00 -2.35 0.09 0.00 0.56 0.00 0.00 36.38 34.68 2j55 s VAL 58 CO 0.00 0.00 0.83 0.00 -0.31 0.00 0.00 175.10 175.62 2j55 s ALA 59 N -3.28 -1.85 -0.08 1.32 0.00 -1.04 -4.59 121.76 112.23 2j55 s ALA 59 Ca 0.13 1.87 -0.30 0.00 0.00 0.00 0.00 51.96 53.66 2j55 s ALA 59 Cb -0.06 -1.08 -0.02 0.00 0.00 0.00 0.00 23.12 21.96 2j55 s ALA 59 CO 0.09 -0.31 1.09 -1.54 0.00 0.00 0.00 175.76 175.09 2j55 s SER 60 N 0.04 7.16 0.06 0.00 1.04 -1.26 -0.76 113.70 119.98 2j55 s SER 60 Ca -0.01 1.66 0.08 0.00 0.48 0.00 0.00 55.95 58.16 2j55 s SER 60 Cb -0.04 -2.56 -0.03 0.00 0.10 0.00 0.00 66.02 63.49 2j55 s SER 60 CO -0.00 -0.50 -0.19 0.00 0.98 0.00 0.00 173.24 173.52 2j55 s TYR 62 N -0.95 3.20 -0.45 0.00 5.04 -1.26 -0.84 117.35 122.09 2j55 s TYR 62 Ca 0.15 1.33 -0.22 0.00 -2.44 0.00 0.00 57.07 55.89 2j55 s TYR 62 Cb -0.10 -3.34 0.03 0.00 0.35 0.00 0.00 41.96 38.89 2j55 s TYR 62 CO 0.06 -0.86 0.70 1.21 -1.34 0.00 0.00 175.55 175.32 2j55 s ASN 63 N 1.43 6.35 0.19 4.32 2.47 0.27 -4.87 114.94 125.10 2j55 s ASN 63 Ca 0.48 -0.28 0.18 0.00 0.42 0.00 0.00 52.86 53.66 2j55 s ASN 63 Cb -0.18 -2.35 0.82 0.00 -1.45 0.00 0.00 41.25 38.10 2j55 s ASN 63 CO 0.10 -0.85 1.55 -0.81 -3.72 0.00 0.00 177.10 173.38 2j55 n PRO 64 N 6.46 0.12 -0.03 0.43 -0.04 -1.26 -1.66 135.00 139.02 2j55 n PRO 64 Ca -0.00 0.45 -0.17 0.00 -0.04 0.00 0.00 63.50 63.74 2j55 n PRO 64 Cb 0.48 -1.77 -0.07 0.00 -0.04 0.00 0.00 33.50 32.10 2j55 n PRO 64 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2j55 h THR 65 N 0.00 1.29 0.00 0.52 2.02 -1.95 -3.35 112.91 111.44 2j55 h THR 65 Ca 0.00 -1.93 0.00 0.00 0.77 0.00 0.00 66.41 65.25 2j55 h THR 65 Cb 0.20 1.99 0.00 0.00 -1.74 0.00 0.00 68.15 68.60 2j55 h THR 65 CO 0.00 0.61 0.00 -0.90 0.37 0.00 0.00 175.52 175.60 2j55 n ASP 66 N -3.99 1.19 0.00 4.18 5.68 -1.08 -4.99 116.55 117.54 2j55 n ASP 66 Ca -0.07 -1.24 0.00 0.00 -0.50 0.00 0.00 54.79 52.97 2j55 n ASP 66 Cb 0.72 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.70 2j55 n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2j55 n GLY 67 N -0.12 1.29 3.87 6.12 0.00 -0.67 -5.02 105.19 110.67 2j55 n GLY 67 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2j55 n GLY 67 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2j55 s GLN 68 N -0.14 3.81 -0.11 1.61 -1.52 -1.25 -4.80 119.66 117.26 2j55 s GLN 68 Ca 0.00 0.43 -0.13 0.00 -1.95 0.00 0.00 55.36 53.71 2j55 s GLN 68 Cb 0.00 -2.46 -0.05 0.00 -0.22 0.00 0.00 33.01 30.29 2j55 s GLN 68 CO 0.00 0.07 0.31 -1.12 -0.25 0.00 0.00 175.29 174.30 2j55 s SER 69 N -2.89 6.53 0.08 5.90 0.01 -1.26 -0.57 113.70 121.51 2j55 s SER 69 Ca 0.51 0.62 0.10 0.00 1.31 0.00 0.00 55.95 58.49 2j55 s SER 69 Cb -0.10 -2.19 -0.03 0.00 0.21 0.00 0.00 66.02 63.91 2j55 s SER 69 CO 0.27 0.20 -0.26 -0.31 0.41 0.00 0.00 173.24 173.54 2j55 s TYR 70 N -0.12 2.28 -0.25 2.43 1.51 -0.02 0.17 117.35 123.35 2j55 s TYR 70 Ca 0.18 -0.40 -0.27 0.00 -1.01 0.00 0.00 57.07 55.58 2j55 s TYR 70 Cb -0.14 -1.31 0.00 0.00 -0.11 0.00 0.00 41.96 40.41 2j55 s TYR 70 CO 0.06 0.22 0.95 -1.17 -1.11 0.00 0.00 175.55 174.50 2j55 s LEU 71 N -1.62 4.07 -0.19 -1.29 2.96 0.11 -0.29 118.68 122.42 2j55 s LEU 71 Ca 0.12 1.14 -0.11 0.00 -0.22 0.00 0.00 54.13 55.07 2j55 s LEU 71 Cb -0.10 -3.37 -0.05 0.00 0.50 0.00 0.00 46.19 43.17 2j55 s LEU 71 CO 0.04 -0.64 0.15 -0.63 -1.32 0.00 0.00 176.35 173.95 2j55 s ILE 72 N 3.12 5.40 -0.45 6.68 -1.09 0.06 -0.23 121.20 134.68 2j55 s ILE 72 Ca 0.40 0.24 -0.17 0.00 -2.23 0.00 0.00 60.65 58.89 2j55 s ILE 72 Cb -0.15 -3.49 0.04 0.00 -1.58 0.00 0.00 42.46 37.28 2j55 s ILE 72 CO 0.08 0.43 0.44 0.00 -1.23 0.00 0.00 174.94 174.67 2j55 s ALA 73 N 0.37 3.46 -1.34 9.38 0.00 -0.63 -2.51 121.76 130.49 2j55 s ALA 73 Ca 0.09 -1.73 -0.13 0.00 0.00 0.00 0.00 51.96 50.20 2j55 s ALA 73 Cb -0.11 -3.08 -0.05 0.00 0.00 0.00 0.00 23.12 19.88 2j55 s ALA 73 CO -0.01 -1.68 2.42 0.66 0.00 0.00 0.00 175.76 177.15 2j55 n TYR 74 N 5.53 2.61 -2.36 0.00 4.01 -1.26 -3.93 117.16 121.76 2j55 n TYR 74 Ca -0.09 -2.71 -0.41 0.00 -0.16 0.00 0.00 57.90 54.53 2j55 n TYR 74 Cb 0.46 -2.29 -0.04 0.00 -0.31 0.00 0.00 39.34 37.16 2j55 n TYR 74 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2j55 s ARG 75 N 3.14 4.52 0.32 -0.72 0.52 -1.26 -4.66 118.95 120.81 2j55 s ARG 75 Ca 0.55 1.91 -0.02 0.00 -0.52 0.00 0.00 55.73 57.66 2j55 s ARG 75 Cb 0.15 -3.19 -0.04 0.00 0.52 0.00 0.00 34.95 32.39 2j55 s ARG 75 CO -0.04 0.01 0.54 -0.51 0.02 0.00 0.00 175.30 175.31 2j55 s ASP 76 N -0.36 6.35 -0.13 0.23 1.01 -0.85 -1.61 116.67 121.30 2j55 s ASP 76 Ca 0.49 0.54 -0.02 0.00 0.71 0.00 0.00 52.55 54.27 2j55 s ASP 76 Cb -0.34 -2.07 -0.03 0.00 1.01 0.00 0.00 42.92 41.49 2j55 s ASP 76 CO 0.41 -0.24 -0.05 0.00 0.21 0.00 0.00 175.17 175.49 2j55 n GLY 79 N -0.29 0.71 3.07 0.00 0.00 -0.60 -0.88 105.19 107.20 2j55 n GLY 79 Ca -0.06 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 2j55 n GLY 79 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2j55 s TYR 80 N -2.00 0.69 0.61 1.61 1.51 -1.26 -4.95 117.35 113.56 2j55 s TYR 80 Ca 0.00 -0.52 -0.19 0.00 -1.01 0.00 0.00 57.07 55.35 2j55 s TYR 80 Cb 0.00 -0.41 -0.03 0.00 -0.11 0.00 0.00 41.96 41.41 2j55 s TYR 80 CO 0.00 -0.09 1.29 1.21 -1.11 0.00 0.00 175.55 176.86 2j55 s ASN 81 N -1.66 4.91 0.13 2.29 2.47 -1.26 -3.57 114.94 118.24 2j55 s ASN 81 Ca -0.09 2.61 -0.35 0.00 0.42 0.00 0.00 52.86 55.46 2j55 s ASN 81 Cb -0.09 -2.62 -0.17 0.00 -1.45 0.00 0.00 41.25 36.92 2j55 s ASN 81 CO 0.00 -1.80 1.17 0.55 -3.72 0.00 0.00 177.10 173.30 2j55 n VAL 82 N -1.60 0.58 -0.35 -5.21 3.14 -0.79 -4.53 118.33 109.58 2j55 n VAL 82 Ca 0.14 -0.15 0.05 0.00 -2.96 0.00 0.00 64.34 61.42 2j55 n VAL 82 Cb 0.48 -0.69 0.22 0.00 -1.06 0.00 0.00 33.84 32.78 2j55 n VAL 82 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 2j55 h SER 83 N 3.55 0.96 0.00 6.55 4.64 -1.67 -3.46 113.55 124.13 2j55 h SER 83 Ca -0.45 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 2j55 h SER 83 Cb 1.36 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2j55 h SER 83 CO 0.71 0.58 0.00 0.61 -0.87 0.00 0.00 176.83 177.86 2j55 n GLY 84 N -1.37 0.40 3.61 -0.77 0.00 -1.26 -5.02 105.19 100.79 2j55 n GLY 84 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2j55 n GLY 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2j55 s ARG 85 N -0.60 2.40 -1.02 1.61 0.52 -1.26 -4.76 118.95 115.83 2j55 s ARG 85 Ca 0.00 -0.86 -0.18 0.00 -0.52 0.00 0.00 55.73 54.17 2j55 s ARG 85 Cb 0.00 -2.44 0.02 0.00 0.52 0.00 0.00 34.95 33.05 2j55 s ARG 85 CO 0.00 0.55 0.65 0.00 0.02 0.00 0.00 175.30 176.52 2j55 s PRO 87 N -6.16 4.63 0.02 0.00 0.04 -1.26 -2.27 135.00 130.00 2j55 s PRO 87 Ca 0.26 1.63 0.00 0.00 0.04 0.00 0.00 61.00 62.93 2j55 s PRO 87 Cb -0.14 -3.31 -0.02 0.00 0.04 0.00 0.00 34.50 31.07 2j55 s PRO 87 CO 0.93 0.12 -0.03 0.00 0.04 0.00 0.00 177.00 178.06 2j55 s LEU 89 N -1.60 0.10 0.37 0.00 2.96 -1.26 -1.42 118.68 117.83 2j55 s LEU 89 Ca -0.13 -1.21 0.08 0.00 -0.22 0.00 0.00 54.13 52.65 2j55 s LEU 89 Cb -0.08 0.23 -0.03 0.00 0.50 0.00 0.00 46.19 46.81 2j55 s LEU 89 CO -0.02 -0.36 0.29 0.20 -1.32 0.00 0.00 176.35 175.14 2j55 s ASN 90 N 1.96 5.03 0.00 3.68 0.01 -0.52 -5.02 114.94 120.08 2j55 s ASN 90 Ca 0.12 -0.68 0.05 0.00 -0.71 0.00 0.00 52.86 51.63 2j55 s ASN 90 Cb -0.16 -0.74 0.08 0.00 0.41 0.00 0.00 41.25 40.84 2j55 s ASN 90 CO -0.24 -0.47 0.91 0.35 -1.51 0.00 0.00 177.10 176.14 2j55 n THR 91 N -1.39 0.00 -1.64 1.60 -2.24 -0.85 -4.02 114.28 105.74 2j55 n THR 91 Ca 0.00 -0.18 -0.40 0.00 -2.27 0.00 0.00 64.05 61.20 2j55 n THR 91 Cb 0.61 0.47 -0.03 0.00 -2.10 0.00 0.00 70.33 69.28 2j55 n THR 91 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2j55 s GLU 92 N 0.00 2.76 0.00 -0.78 0.41 -0.93 -1.11 118.70 119.05 2j55 s GLU 92 Ca 0.06 1.70 0.00 0.00 -0.41 0.00 0.00 54.97 56.32 2j55 s GLU 92 Cb 0.07 -4.43 0.00 0.00 -1.78 0.00 0.00 34.13 27.99 2j55 s GLU 92 CO -0.03 -2.53 0.00 0.41 -0.49 0.00 0.00 175.26 172.62 2j55 n GLY 93 N 5.82 0.59 3.70 -1.39 0.00 -1.26 -4.70 105.19 107.94 2j55 n GLY 93 Ca 0.31 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.91 2j55 n GLY 93 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2j55 s GLU 94 N -0.05 4.37 0.33 1.61 -6.30 -0.27 -4.96 118.70 113.43 2j55 s GLU 94 Ca 0.00 1.74 0.07 0.00 -2.50 0.00 0.00 54.97 54.28 2j55 s GLU 94 Cb 0.00 -3.49 -0.03 0.00 0.00 0.00 0.00 34.13 30.61 2j55 s GLU 94 CO 0.00 -0.40 0.30 -0.51 0.02 0.00 0.00 175.26 174.67 2j55 s LEU 95 N 1.87 3.64 1.24 2.70 1.43 -0.86 -4.98 118.68 123.72 2j55 s LEU 95 Ca 0.58 -0.46 -0.18 0.00 -1.03 0.00 0.00 54.13 53.04 2j55 s LEU 95 Cb -0.27 -2.27 0.30 0.00 0.03 0.00 0.00 46.19 43.98 2j55 s LEU 95 CO 0.25 -0.35 1.03 -2.84 0.23 0.00 0.00 176.35 174.67 2j55 s PRO 96 N -4.00 -1.48 0.53 1.29 0.02 -1.26 -3.81 135.00 126.29 2j55 s PRO 96 Ca 0.41 0.29 0.29 0.00 0.02 0.00 0.00 61.00 62.01 2j55 s PRO 96 Cb -0.06 -1.53 1.47 0.00 0.02 0.00 0.00 34.50 34.40 2j55 s PRO 96 CO 0.27 -3.95 2.06 -0.24 -0.33 0.00 0.00 177.00 174.81 2j55 h VAL 97 N -2.77 0.44 0.00 3.83 3.04 -1.97 -0.20 116.25 118.63 2j55 h VAL 97 Ca -0.50 -0.55 0.00 0.00 -1.01 0.00 0.00 66.70 64.64 2j55 h VAL 97 Cb 1.33 1.38 0.00 0.00 -2.01 0.00 0.00 31.29 31.99 2j55 h VAL 97 CO 0.40 0.10 0.00 0.00 -1.01 0.00 0.00 177.57 177.07 2j55 n TYR 98 N -3.49 0.00 -2.83 3.17 4.11 -1.26 -2.37 117.16 114.49 2j55 n TYR 98 Ca -0.01 0.00 -0.33 0.00 -0.00 0.00 0.00 57.90 57.55 2j55 n TYR 98 Cb 0.25 -0.43 -0.01 0.00 -0.00 0.00 0.00 39.34 39.15 2j55 n TYR 98 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 2j55 n ARG 99 N -1.43 4.20 -0.13 -3.48 5.12 -0.09 -4.92 116.66 115.94 2j55 n ARG 99 Ca 0.08 -4.77 0.21 0.00 -1.93 0.00 0.00 57.85 51.44 2j55 n ARG 99 Cb 0.26 -2.35 0.63 0.00 -1.16 0.00 0.00 32.46 29.84 2j55 n ARG 99 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2j55 h PRO 100 N 3.60 0.15 0.00 5.56 0.13 -1.63 0.92 132.00 140.73 2j55 h PRO 100 Ca 0.31 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.43 2j55 h PRO 100 Cb 0.43 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.53 2j55 h PRO 100 CO 0.99 0.10 0.21 1.05 -0.23 0.00 0.00 178.00 180.11 2j55 h GLU 101 N 0.15 0.00 0.00 0.86 9.09 -1.90 -0.95 114.58 121.83 2j55 h GLU 101 Ca 0.36 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.77 2j55 h GLU 101 Cb 1.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.31 2j55 h GLU 101 CO -0.06 0.00 0.00 1.19 0.05 0.00 0.00 179.01 180.19 2j55 n PHE 102 N -2.76 0.00 -3.47 2.06 3.72 0.30 -1.86 117.46 115.46 2j55 n PHE 102 Ca -0.02 -0.18 -0.37 0.00 -0.05 0.00 0.00 57.45 56.82 2j55 n PHE 102 Cb 0.25 -0.02 -0.08 0.00 -0.94 0.00 0.00 39.48 38.70 2j55 n PHE 102 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2j55 s ALA 103 N -0.37 3.57 -1.10 4.37 0.00 -0.36 -2.03 121.76 125.85 2j55 s ALA 103 Ca 0.00 -0.55 0.12 0.00 0.00 0.00 0.00 51.96 51.53 2j55 s ALA 103 Cb 0.00 -2.52 0.32 0.00 0.00 0.00 0.00 23.12 20.93 2j55 s ALA 103 CO 0.00 -0.16 1.25 0.27 0.00 0.00 0.00 175.76 177.12 2j55 n ASN 104 N 4.15 2.95 0.04 0.00 0.23 -1.26 -4.31 115.26 117.05 2j55 n ASN 104 Ca -0.10 -1.95 0.12 0.00 -0.53 0.00 0.00 54.58 52.12 2j55 n ASN 104 Cb 0.51 -0.24 0.27 0.00 -2.08 0.00 0.00 39.78 38.25 2j55 n ASN 104 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2j55 n ASP 105 N 0.65 0.55 -4.72 0.53 8.00 -1.26 -4.65 116.55 115.65 2j55 n ASP 105 Ca 0.13 0.08 -0.42 0.00 0.71 0.00 0.00 54.79 55.29 2j55 n ASP 105 Cb 0.44 0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.54 2j55 n ASP 105 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2j55 s ILE 106 N -3.08 3.38 -0.66 0.53 1.01 -1.26 -4.98 121.20 116.13 2j55 s ILE 106 Ca 0.09 1.03 -0.26 0.00 0.00 0.00 0.00 60.65 61.51 2j55 s ILE 106 Cb 0.15 -3.66 -0.03 0.00 0.01 0.00 0.00 42.46 38.94 2j55 s ILE 106 CO 0.68 0.10 1.90 -0.63 0.00 0.00 0.00 174.94 176.99 2j55 s ILE 107 N 0.81 3.36 -1.47 2.92 -1.09 -1.26 -4.91 121.20 119.55 2j55 s ILE 107 Ca 0.61 0.09 -0.13 0.00 -2.23 0.00 0.00 60.65 58.99 2j55 s ILE 107 Cb -0.36 -3.92 0.03 0.00 -1.58 0.00 0.00 42.46 36.63 2j55 s ILE 107 CO 0.32 -0.89 2.35 0.79 -1.23 0.00 0.00 174.94 176.29 2j55 n TRP 108 N 13.12 3.24 0.57 3.97 7.02 -1.26 -4.45 117.44 139.65 2j55 n TRP 108 Ca 0.25 -2.98 0.06 0.00 -1.02 0.00 0.00 57.50 53.80 2j55 n TRP 108 Cb 0.51 -2.48 -0.03 0.00 -2.42 0.00 0.00 31.31 26.89 2j55 n TRP 108 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2j55 n PHE 110 N -0.70 2.38 0.00 0.00 3.72 -1.26 -1.27 117.46 120.32 2j55 n PHE 110 Ca 0.04 0.49 0.00 0.00 -0.05 0.00 0.00 57.45 57.93 2j55 n PHE 110 Cb 0.23 -2.42 0.00 0.00 -0.94 0.00 0.00 39.48 36.35 2j55 n PHE 110 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2j55 n GLY 111 N 0.71 3.17 3.55 1.37 0.00 -1.26 -1.85 105.19 110.88 2j55 n GLY 111 Ca 0.05 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.61 2j55 n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j55 n ALA 112 N -0.83 -0.91 -1.55 4.61 0.00 -0.40 -4.37 120.51 117.06 2j55 n ALA 112 Ca 0.00 0.42 -0.43 0.00 0.00 0.00 0.00 53.44 53.43 2j55 n ALA 112 Cb 0.00 -1.94 -0.00 0.00 0.00 0.00 0.00 19.45 17.51 2j55 n ALA 112 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2j55 n GLU 113 N 1.04 1.06 -1.28 0.00 4.71 -1.26 -2.84 120.64 122.05 2j55 n GLU 113 Ca 0.13 0.38 -0.10 0.00 -0.01 0.00 0.00 57.16 57.55 2j55 n GLU 113 Cb 0.28 -1.76 -0.04 0.00 -1.01 0.00 0.00 31.44 28.91 2j55 n GLU 113 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2j55 n ASP 114 N 1.07 -4.46 -2.18 1.62 8.00 -1.26 -2.76 116.55 116.58 2j55 n ASP 114 Ca 0.11 0.24 -0.20 0.00 0.71 0.00 0.00 54.79 55.65 2j55 n ASP 114 Cb 0.36 -2.82 -0.03 0.00 -0.02 0.00 0.00 41.12 38.60 2j55 n ASP 114 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2j55 n ASP 115 N -0.00 -5.68 -4.71 -2.24 8.00 -1.13 -4.91 116.55 105.87 2j55 n ASP 115 Ca -0.10 0.13 -0.42 0.00 0.71 0.00 0.00 54.79 55.12 2j55 n ASP 115 Cb 0.37 -4.81 -0.03 0.00 -0.02 0.00 0.00 41.12 36.63 2j55 n ASP 115 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j55 s ALA 116 N -2.94 3.82 0.00 2.24 0.00 -1.11 -4.85 121.76 118.92 2j55 s ALA 116 Ca 0.00 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.40 2j55 s ALA 116 Cb 0.00 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.44 2j55 s ALA 116 CO 0.00 -0.95 0.16 -1.33 0.00 0.00 0.00 175.76 173.63 2j55 n MET 117 N 4.50 0.12 -2.85 0.00 2.81 -1.26 -4.61 117.12 115.82 2j55 n MET 117 Ca 0.16 -0.16 -0.35 0.00 -1.81 0.00 0.00 57.70 55.54 2j55 n MET 117 Cb 0.38 -0.60 -0.07 0.00 -0.71 0.00 0.00 33.22 32.22 2j55 n MET 117 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2j55 s THR 118 N -0.06 4.34 -0.21 2.03 -4.23 -1.26 -4.87 115.64 111.38 2j55 s THR 118 Ca 0.00 1.60 -0.22 0.00 -1.18 0.00 0.00 61.69 61.89 2j55 s THR 118 Cb 0.00 -3.84 -0.02 0.00 1.34 0.00 0.00 72.50 69.98 2j55 s THR 118 CO 0.00 -0.02 0.69 -0.47 -0.54 0.00 0.00 174.62 174.28 2j55 s TYR 119 N -1.81 3.36 -0.14 3.99 5.04 -1.25 -1.56 117.35 124.98 2j55 s TYR 119 Ca 0.53 0.99 -0.09 0.00 -2.44 0.00 0.00 57.07 56.06 2j55 s TYR 119 Cb -0.15 -2.87 -0.06 0.00 0.35 0.00 0.00 41.96 39.23 2j55 s TYR 119 CO 0.20 -0.23 -0.21 1.58 -1.34 0.00 0.00 175.55 175.54 2j55 n HIS 120 N 5.29 0.00 -3.64 4.97 -0.00 -0.72 -1.88 115.22 119.24 2j55 n HIS 120 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.72 57.71 2j55 n HIS 120 Cb 0.49 -0.51 -0.01 0.00 -0.00 0.00 0.00 29.99 29.96 2j55 n HIS 120 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2j55 s THR 122 N -2.68 1.86 0.37 0.00 2.01 0.02 -0.30 115.64 116.92 2j55 s THR 122 Ca 0.12 -1.14 0.08 0.00 0.31 0.00 0.00 61.69 61.06 2j55 s THR 122 Cb 0.02 -1.57 -0.02 0.00 0.01 0.00 0.00 72.50 70.94 2j55 s THR 122 CO -0.03 0.40 0.36 0.27 -0.69 0.00 0.00 174.62 174.93 2j55 s ILE 123 N -0.67 3.21 -0.43 1.82 -4.36 -0.64 -2.67 121.20 117.46 2j55 s ILE 123 Ca 0.09 -1.31 0.10 0.00 -0.26 0.00 0.00 60.65 59.28 2j55 s ILE 123 Cb -0.09 -3.12 0.38 0.00 1.25 0.00 0.00 42.46 40.88 2j55 s ILE 123 CO 0.01 -0.10 0.90 -1.20 0.24 0.00 0.00 174.94 174.79 2j55 n SER 124 N -1.49 2.63 -4.78 4.36 7.64 0.28 -4.00 113.62 118.26 2j55 n SER 124 Ca 0.01 -3.26 -0.36 0.00 1.01 0.00 0.00 58.87 56.27 2j55 n SER 124 Cb 0.60 -0.56 -0.05 0.00 -1.01 0.00 0.00 64.21 63.20 2j55 n SER 124 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2j55 s PRO 125 N -3.05 4.30 -0.07 1.43 0.04 -1.25 -4.80 135.00 131.59 2j55 s PRO 125 Ca 0.41 1.44 -0.30 0.00 0.04 0.00 0.00 61.00 62.60 2j55 s PRO 125 Cb 0.36 -2.60 -0.03 0.00 0.04 0.00 0.00 34.50 32.27 2j55 s PRO 125 CO -0.09 -0.01 1.20 0.42 0.04 0.00 0.00 177.00 178.56 2j55 s ILE 126 N -1.67 4.28 0.00 0.56 1.01 -1.26 -1.61 121.20 122.50 2j55 s ILE 126 Ca 0.56 1.59 0.00 0.00 0.00 0.00 0.00 60.65 62.80 2j55 s ILE 126 Cb -0.20 -4.02 0.00 0.00 0.01 0.00 0.00 42.46 38.24 2j55 s ILE 126 CO 0.26 -0.02 0.12 1.33 0.00 0.00 0.00 174.94 176.63 2j55 n VAL 127 N 4.69 0.00 0.00 2.92 0.24 0.68 -4.92 118.33 121.94 2j55 n VAL 127 Ca 0.11 0.34 0.00 0.00 -2.04 0.00 0.00 64.34 62.76 2j55 n VAL 127 Cb 0.46 -0.80 0.00 0.00 -1.47 0.00 0.00 33.84 32.03 2j55 n VAL 127 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2j55 n GLY 128 N 1.81 4.20 1.89 7.63 0.00 -1.25 -5.02 105.19 114.45 2j55 n GLY 128 Ca 0.00 -0.37 -0.11 0.00 0.00 0.00 0.00 46.02 45.54 2j55 n GLY 128 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2j55 n LYS 129 N 0.00 0.91 0.00 1.61 4.76 -1.26 0.07 118.16 124.25 2j55 n LYS 129 Ca 0.00 -1.59 0.00 0.00 -2.87 0.00 0.00 58.31 53.85 2j55 n LYS 129 Cb 0.00 -0.01 0.00 0.00 -1.84 0.00 0.00 35.03 33.18 2j55 n LYS 129 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2j55 n ALA 130 N -2.59 0.00 -0.15 7.82 0.00 0.45 -3.98 120.51 122.06 2j55 n ALA 130 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2j55 n ALA 130 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.75 2j55 n ALA 130 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37