#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ee1 s SER 2 N 0.00 -0.65 0.08 1.61 0.15 -1.26 -5.06 113.70 108.57 2ee1 s SER 2 Ca 0.00 0.95 -0.27 0.00 0.70 0.00 0.00 55.95 57.33 2ee1 s SER 2 Cb 0.00 1.55 -0.17 0.00 -1.71 0.00 0.00 66.02 65.70 2ee1 s SER 2 CO 0.00 -0.14 1.68 -1.28 1.20 0.00 0.00 173.24 174.70 2ee1 h SER 3 N 7.00 -0.28 -0.44 5.45 0.87 -2.08 -3.45 113.55 120.62 2ee1 h SER 3 Ca -0.21 -0.00 -0.62 0.00 -1.23 0.00 0.00 61.79 59.72 2ee1 h SER 3 Cb 1.15 0.07 -0.08 0.00 -0.44 0.00 0.00 62.40 63.11 2ee1 h SER 3 CO 0.13 -0.18 -0.37 -0.83 -0.53 0.00 0.00 176.83 175.05 2ee1 s GLY 4 N -2.18 2.60 -0.73 5.77 0.00 -1.26 -5.08 107.32 106.44 2ee1 s GLY 4 Ca -0.15 -0.91 -0.15 0.00 0.00 0.00 0.00 44.72 43.52 2ee1 s GLY 4 CO 0.64 -2.03 0.69 -0.56 0.00 0.00 0.00 173.10 171.85 2ee1 s SER 5 N -4.16 6.56 -0.33 1.64 0.01 -1.26 -4.86 113.70 111.30 2ee1 s SER 5 Ca 0.24 -2.35 0.11 0.00 1.31 0.00 0.00 55.95 55.25 2ee1 s SER 5 Cb -0.01 -2.22 0.46 0.00 0.21 0.00 0.00 66.02 64.46 2ee1 s SER 5 CO 0.15 -0.70 1.12 -1.20 0.41 0.00 0.00 173.24 173.02 2ee1 n SER 6 N 4.53 3.83 0.00 2.44 7.64 -1.26 -5.06 113.62 125.74 2ee1 n SER 6 Ca 0.05 -3.31 0.00 0.00 1.01 0.00 0.00 58.87 56.62 2ee1 n SER 6 Cb 0.45 -0.42 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 2ee1 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ee1 n GLY 7 N -0.54 1.19 3.36 0.23 0.00 -1.26 -5.15 105.19 103.03 2ee1 n GLY 7 Ca 0.32 -0.46 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 2ee1 n GLY 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ee1 n LYS 8 N 0.00 0.26 -1.12 1.61 4.76 -1.26 -4.95 118.16 117.46 2ee1 n LYS 8 Ca 0.00 0.11 -0.29 0.00 -2.87 0.00 0.00 58.31 55.25 2ee1 n LYS 8 Cb 0.00 -1.43 0.21 0.00 -1.84 0.00 0.00 35.03 31.97 2ee1 n LYS 8 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2ee1 s PRO 9 N -1.81 -0.50 -0.22 1.97 0.04 -1.26 -5.03 135.00 128.19 2ee1 s PRO 9 Ca 0.62 0.19 -0.04 0.00 0.04 0.00 0.00 61.00 61.82 2ee1 s PRO 9 Cb -0.43 -1.66 -0.12 0.00 0.04 0.00 0.00 34.50 32.33 2ee1 s PRO 9 CO 0.61 -3.28 -0.23 -0.85 0.04 0.00 0.00 177.00 173.28 2ee1 n GLU 10 N -4.51 0.51 -0.31 4.56 0.28 -1.26 -4.45 120.64 115.46 2ee1 n GLU 10 Ca 0.09 0.16 0.32 0.00 -0.16 0.00 0.00 57.16 57.57 2ee1 n GLU 10 Cb 0.58 -1.38 0.70 0.00 1.43 0.00 0.00 31.44 32.77 2ee1 n GLU 10 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 177.13 177.08 2ee1 h TRP 11 N -0.34 0.14 -2.88 -1.84 5.08 -2.04 -3.40 115.95 110.67 2ee1 h TRP 11 Ca -0.52 0.01 -0.53 0.00 1.08 0.00 0.00 58.89 58.93 2ee1 h TRP 11 Cb 1.64 -0.04 0.03 0.00 -3.00 0.00 0.00 29.16 27.80 2ee1 h TRP 11 CO -0.02 0.01 0.83 -1.64 -1.28 0.00 0.00 178.44 176.34 2ee1 s MET 12 N -5.07 4.25 0.45 0.12 -1.94 -1.26 -5.01 119.30 110.85 2ee1 s MET 12 Ca -0.06 2.25 0.03 0.00 -1.71 0.00 0.00 55.69 56.20 2ee1 s MET 12 Cb 0.23 -3.21 -0.02 0.00 2.01 0.00 0.00 34.83 33.84 2ee1 s MET 12 CO 0.80 -0.55 0.08 -1.64 -0.01 0.00 0.00 175.02 173.70 2ee1 s MET 13 N 1.21 2.05 -0.27 2.03 -1.94 -1.26 -4.73 119.30 116.39 2ee1 s MET 13 Ca 0.68 -2.28 0.02 0.00 -1.71 0.00 0.00 55.69 52.41 2ee1 s MET 13 Cb -0.41 -0.99 0.07 0.00 2.01 0.00 0.00 34.83 35.51 2ee1 s MET 13 CO 0.31 -0.43 -0.05 0.42 -0.01 0.00 0.00 175.02 175.25 2ee1 s ILE 14 N -3.07 1.89 0.06 2.53 1.01 -1.26 -3.82 121.20 118.54 2ee1 s ILE 14 Ca 0.16 -1.58 -0.37 0.00 0.00 0.00 0.00 60.65 58.86 2ee1 s ILE 14 Cb 0.02 -2.13 -0.21 0.00 0.01 0.00 0.00 42.46 40.15 2ee1 s ILE 14 CO 0.10 -0.18 1.55 -0.74 0.00 0.00 0.00 174.94 175.68 2ee1 h HIS 15 N 7.83 -1.24 -1.36 3.97 -0.00 -1.63 -3.46 115.15 119.25 2ee1 h HIS 15 Ca -0.16 -0.03 0.14 0.00 -0.00 0.00 0.00 60.37 60.32 2ee1 h HIS 15 Cb 1.05 0.41 -0.25 0.00 -0.00 0.00 0.00 27.41 28.62 2ee1 h HIS 15 CO 0.55 -0.77 0.70 -0.98 -0.00 0.00 0.00 177.93 177.43 2ee1 s ARG 16 N -5.94 0.37 -0.60 5.26 1.70 -1.26 -5.02 118.95 113.46 2ee1 s ARG 16 Ca -0.20 0.12 -0.27 0.00 -0.47 0.00 0.00 55.73 54.92 2ee1 s ARG 16 Cb 0.02 0.18 -0.01 0.00 -0.57 0.00 0.00 34.95 34.57 2ee1 s ARG 16 CO 0.59 -0.11 1.71 0.42 -1.08 0.00 0.00 175.30 176.83 2ee1 s ILE 17 N -0.94 3.48 0.09 4.99 1.01 -1.26 -3.40 121.20 125.17 2ee1 s ILE 17 Ca 0.03 0.33 -0.24 0.00 0.00 0.00 0.00 60.65 60.77 2ee1 s ILE 17 Cb -0.01 -4.12 -0.14 0.00 0.01 0.00 0.00 42.46 38.20 2ee1 s ILE 17 CO -0.03 -1.03 1.72 -0.07 0.00 0.00 0.00 174.94 175.53 2ee1 h LEU 18 N 15.20 -0.10 0.00 2.97 3.38 -1.48 -3.48 115.31 131.80 2ee1 h LEU 18 Ca -0.27 0.01 0.08 0.00 0.09 0.00 0.00 57.88 57.79 2ee1 h LEU 18 Cb 1.14 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 2ee1 h LEU 18 CO 1.20 -0.06 0.34 -3.20 0.09 0.00 0.00 178.44 176.81 2ee1 n ASN 19 N -5.14 -1.23 -4.01 -0.43 5.15 -1.25 -4.99 115.26 103.35 2ee1 n ASN 19 Ca -0.07 -1.70 -0.10 0.00 -0.60 0.00 0.00 54.58 52.11 2ee1 n ASN 19 Cb 0.07 2.01 -0.11 0.00 -0.53 0.00 0.00 39.78 41.22 2ee1 n ASN 19 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 2ee1 s HIS 20 N -3.67 0.42 -0.19 1.20 -3.43 -1.26 -0.07 115.29 108.28 2ee1 s HIS 20 Ca 0.14 -0.55 -0.11 0.00 -0.80 0.00 0.00 55.06 53.75 2ee1 s HIS 20 Cb -0.02 -0.27 0.06 0.00 -1.43 0.00 0.00 32.58 30.92 2ee1 s HIS 20 CO 0.05 -0.16 0.46 0.45 -2.00 0.00 0.00 174.74 173.54 2ee1 s SER 21 N -1.59 -0.60 -0.57 7.38 0.15 0.23 -4.98 113.70 113.73 2ee1 s SER 21 Ca -0.13 1.01 -0.18 0.00 0.70 0.00 0.00 55.95 57.36 2ee1 s SER 21 Cb -0.09 0.89 0.11 0.00 -1.71 0.00 0.00 66.02 65.22 2ee1 s SER 21 CO -0.01 -0.20 0.61 -0.69 1.20 0.00 0.00 173.24 174.15 2ee1 s VAL 22 N 1.41 5.00 1.02 4.45 1.01 -1.26 -0.23 120.40 131.79 2ee1 s VAL 22 Ca -0.09 -1.21 -0.15 0.00 0.00 0.00 0.00 61.98 60.52 2ee1 s VAL 22 Cb -0.08 -4.41 0.13 0.00 0.00 0.00 0.00 36.38 32.02 2ee1 s VAL 22 CO -0.14 -1.00 0.11 -0.90 0.00 0.00 0.00 175.10 173.17 2ee1 n ASP 23 N 5.83 -2.84 -0.06 3.32 5.75 -1.18 -4.74 116.55 122.63 2ee1 n ASP 23 Ca -0.12 -0.29 -0.10 0.00 -0.01 0.00 0.00 54.79 54.27 2ee1 n ASP 23 Cb 0.41 -0.78 -0.03 0.00 -1.03 0.00 0.00 41.12 39.69 2ee1 n ASP 23 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 2ee1 h LYS 24 N -2.42 0.30 -0.88 0.11 1.63 -1.97 -2.29 116.57 111.06 2ee1 h LYS 24 Ca -0.31 -0.03 0.22 0.00 -0.85 0.00 0.00 60.65 59.68 2ee1 h LYS 24 Cb 0.92 -0.06 -0.06 0.00 -0.60 0.00 0.00 32.23 32.43 2ee1 h LYS 24 CO 0.20 0.25 0.60 0.87 -3.45 0.00 0.00 179.45 177.92 2ee1 h LYS 25 N 0.27 0.27 0.00 1.90 1.57 -2.04 -3.45 116.57 115.09 2ee1 h LYS 25 Ca 0.08 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 2ee1 h LYS 25 Cb 0.03 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.28 2ee1 h LYS 25 CO -0.01 0.18 0.00 0.41 -0.57 0.00 0.00 179.45 179.46 2ee1 n GLY 26 N -1.57 2.31 3.62 3.86 0.00 -0.86 -5.07 105.19 107.48 2ee1 n GLY 26 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 2ee1 n GLY 26 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2ee1 n HIS 27 N -0.19 2.17 -2.03 1.61 8.25 -1.26 -4.68 115.22 119.09 2ee1 n HIS 27 Ca 0.00 -0.19 -0.42 0.00 -0.26 0.00 0.00 57.72 56.85 2ee1 n HIS 27 Cb 0.00 -2.74 -0.03 0.00 1.12 0.00 0.00 29.99 28.34 2ee1 n HIS 27 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2ee1 s VAL 28 N 6.58 2.83 0.08 1.59 1.01 -1.26 -3.12 120.40 128.11 2ee1 s VAL 28 Ca 0.96 0.62 0.08 0.00 0.00 0.00 0.00 61.98 63.65 2ee1 s VAL 28 Cb -0.42 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 2ee1 s VAL 28 CO 0.40 0.06 -0.17 -1.00 0.00 0.00 0.00 175.10 174.39 2ee1 s HIS 29 N 0.78 2.56 -0.13 5.22 3.76 0.67 -1.84 115.29 126.31 2ee1 s HIS 29 Ca 0.65 -0.25 -0.01 0.00 -0.15 0.00 0.00 55.06 55.31 2ee1 s HIS 29 Cb -0.41 -1.40 0.03 0.00 1.11 0.00 0.00 32.58 31.91 2ee1 s HIS 29 CO 0.34 0.34 -0.06 0.71 -0.85 0.00 0.00 174.74 175.22 2ee1 s TYR 30 N -1.06 1.51 -0.72 1.40 2.02 -0.88 -0.61 117.35 119.02 2ee1 s TYR 30 Ca 0.17 -0.85 -0.26 0.00 -0.37 0.00 0.00 57.07 55.76 2ee1 s TYR 30 Cb -0.11 -1.23 -0.07 0.00 -0.40 0.00 0.00 41.96 40.15 2ee1 s TYR 30 CO 0.08 -0.55 2.16 -1.17 -1.57 0.00 0.00 175.55 174.50 2ee1 s LEU 31 N 1.70 3.16 -0.01 -1.29 2.96 0.89 -2.91 118.68 123.19 2ee1 s LEU 31 Ca 0.03 0.14 -0.24 0.00 -0.22 0.00 0.00 54.13 53.84 2ee1 s LEU 31 Cb -0.14 -2.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.97 2ee1 s LEU 31 CO -0.08 -3.01 0.72 -0.63 -1.32 0.00 0.00 176.35 172.03 2ee1 s ILE 32 N 11.63 4.89 -0.59 6.68 1.01 -1.14 -1.08 121.20 142.61 2ee1 s ILE 32 Ca 0.82 1.51 -0.14 0.00 0.00 0.00 0.00 60.65 62.84 2ee1 s ILE 32 Cb -0.12 -4.06 0.15 0.00 0.01 0.00 0.00 42.46 38.43 2ee1 s ILE 32 CO 0.12 0.32 0.52 -0.75 0.00 0.00 0.00 174.94 175.16 2ee1 s LYS 33 N 0.31 3.01 -0.55 2.79 2.20 -1.22 -2.72 119.74 123.57 2ee1 s LYS 33 Ca 0.37 -1.89 -0.31 0.00 -0.36 0.00 0.00 55.97 53.79 2ee1 s LYS 33 Cb -0.19 -4.25 -0.12 0.00 -1.51 0.00 0.00 37.83 31.76 2ee1 s LYS 33 CO 0.20 -1.30 2.40 0.91 -0.36 0.00 0.00 175.35 177.20 2ee1 n TRP 34 N 4.90 1.29 -0.26 4.03 5.03 -1.26 -1.61 117.44 129.56 2ee1 n TRP 34 Ca -0.07 0.24 0.00 0.00 3.03 0.00 0.00 57.50 60.70 2ee1 n TRP 34 Cb 0.41 -2.54 0.04 0.00 -1.03 0.00 0.00 31.31 28.20 2ee1 n TRP 34 CO 0.00 0.00 0.00 0.54 -0.03 0.00 0.00 177.69 178.20 2ee1 n ARG 35 N 8.57 -0.14 -0.25 -0.99 1.74 -1.25 0.23 116.66 124.57 2ee1 n ARG 35 Ca 0.46 1.06 0.05 0.00 -0.77 0.00 0.00 57.85 58.64 2ee1 n ARG 35 Cb 0.30 -1.57 0.19 0.00 -1.02 0.00 0.00 32.46 30.36 2ee1 n ARG 35 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 2ee1 h ASP 36 N 0.00 0.22 -3.43 0.55 1.82 -1.89 -3.41 116.42 110.29 2ee1 h ASP 36 Ca 0.25 0.12 -0.52 0.00 -0.39 0.00 0.00 57.03 56.49 2ee1 h ASP 36 Cb 0.42 0.11 -0.02 0.00 0.68 0.00 0.00 39.33 40.53 2ee1 h ASP 36 CO -0.68 0.07 -0.07 -0.76 -1.61 0.00 0.00 179.24 176.19 2ee1 s LEU 37 N -10.47 4.06 0.00 2.28 1.43 0.64 -5.09 118.68 111.52 2ee1 s LEU 37 Ca -0.12 0.92 0.00 0.00 -1.03 0.00 0.00 54.13 53.89 2ee1 s LEU 37 Cb 0.21 -3.72 0.00 0.00 0.03 0.00 0.00 46.19 42.71 2ee1 s LEU 37 CO 0.76 -0.18 0.00 -0.81 0.23 0.00 0.00 176.35 176.35 2ee1 n PRO 38 N -0.64 -1.01 0.07 1.29 -0.04 -1.26 -4.47 135.00 128.94 2ee1 n PRO 38 Ca 0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.41 2ee1 n PRO 38 Cb 0.53 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.90 2ee1 n PRO 38 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 2ee1 h TYR 39 N -1.51 0.00 -0.00 0.54 3.20 -1.96 -3.03 116.97 114.22 2ee1 h TYR 39 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2ee1 h TYR 39 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 2ee1 h TYR 39 CO 0.00 0.91 0.00 -0.25 -1.64 0.00 0.00 178.16 177.18 2ee1 n ASP 40 N -3.31 0.10 -0.05 -2.11 8.00 -1.26 -2.98 116.55 114.94 2ee1 n ASP 40 Ca -0.00 -1.07 0.01 0.00 0.71 0.00 0.00 54.79 54.43 2ee1 n ASP 40 Cb 0.91 -0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 42.01 2ee1 n ASP 40 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ee1 n GLN 41 N -0.90 2.85 -1.26 -1.24 6.02 -1.19 -5.06 117.38 116.59 2ee1 n GLN 41 Ca 0.23 -0.32 -0.38 0.00 -0.01 0.00 0.00 57.00 56.52 2ee1 n GLN 41 Cb 0.12 -0.82 0.04 0.00 1.02 0.00 0.00 30.24 30.60 2ee1 n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ee1 n ALA 42 N -0.46 -2.53 -2.61 -1.58 0.00 -1.15 -4.91 120.51 107.27 2ee1 n ALA 42 Ca 0.01 -0.18 -0.21 0.00 0.00 0.00 0.00 53.44 53.06 2ee1 n ALA 42 Cb 0.05 -1.59 -0.14 0.00 0.00 0.00 0.00 19.45 17.76 2ee1 n ALA 42 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2ee1 s SER 43 N -1.18 1.61 -0.07 0.00 0.15 -1.10 -5.03 113.70 108.08 2ee1 s SER 43 Ca 0.60 -0.32 -0.30 0.00 0.70 0.00 0.00 55.95 56.62 2ee1 s SER 43 Cb -0.40 -0.15 -0.03 0.00 -1.71 0.00 0.00 66.02 63.73 2ee1 s SER 43 CO 0.63 0.11 1.20 0.26 1.20 0.00 0.00 173.24 176.65 2ee1 s TRP 44 N -0.52 3.15 -0.15 3.44 0.52 -1.26 -2.89 118.94 121.23 2ee1 s TRP 44 Ca 0.04 1.19 -0.00 0.00 0.02 0.00 0.00 56.10 57.35 2ee1 s TRP 44 Cb -0.06 -3.43 0.03 0.00 -1.15 0.00 0.00 33.47 28.86 2ee1 s TRP 44 CO 0.00 -1.34 -0.09 -1.21 0.02 0.00 0.00 176.95 174.33 2ee1 s GLU 45 N 2.41 1.74 0.87 4.98 0.41 -1.14 -4.94 118.70 123.03 2ee1 s GLU 45 Ca 0.55 -0.48 -0.13 0.00 -0.41 0.00 0.00 54.97 54.51 2ee1 s GLU 45 Cb -0.24 -1.94 0.20 0.00 -1.78 0.00 0.00 34.13 30.37 2ee1 s GLU 45 CO 0.21 -0.33 0.45 0.45 -0.49 0.00 0.00 175.26 175.54 2ee1 n SER 46 N 4.85 -2.97 -1.16 -0.19 2.88 -1.26 -2.07 113.62 113.69 2ee1 n SER 46 Ca -0.14 -0.45 0.09 0.00 -1.33 0.00 0.00 58.87 57.04 2ee1 n SER 46 Cb 0.49 -0.63 0.27 0.00 -0.75 0.00 0.00 64.21 63.59 2ee1 n SER 46 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2ee1 n GLU 47 N -2.66 2.64 -0.05 -1.46 0.28 -0.77 -4.00 120.64 114.63 2ee1 n GLU 47 Ca 0.07 -2.17 -0.03 0.00 -0.16 0.00 0.00 57.16 54.88 2ee1 n GLU 47 Cb 0.31 -1.56 -0.14 0.00 1.43 0.00 0.00 31.44 31.47 2ee1 n GLU 47 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2ee1 n ASP 48 N 1.09 0.25 -4.77 -1.84 2.03 -1.26 -4.95 116.55 107.09 2ee1 n ASP 48 Ca 0.20 0.11 -0.40 0.00 0.52 0.00 0.00 54.79 55.22 2ee1 n ASP 48 Cb 0.58 0.97 -0.00 0.00 -0.72 0.00 0.00 41.12 41.95 2ee1 n ASP 48 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2ee1 s VAL 49 N -2.83 2.27 -0.38 5.18 -7.23 -1.26 -4.97 120.40 111.18 2ee1 s VAL 49 Ca -0.08 0.26 -0.17 0.00 -1.81 0.00 0.00 61.98 60.19 2ee1 s VAL 49 Cb 0.09 -3.16 0.01 0.00 0.56 0.00 0.00 36.38 33.87 2ee1 s VAL 49 CO 0.84 0.06 0.45 -1.83 -0.31 0.00 0.00 175.10 174.31 2ee1 s GLU 50 N -2.12 3.36 0.03 4.82 -1.05 -1.26 -5.04 118.70 117.43 2ee1 s GLU 50 Ca 0.54 -0.50 0.04 0.00 -0.15 0.00 0.00 54.97 54.90 2ee1 s GLU 50 Cb -0.43 -3.89 -0.02 0.00 -0.44 0.00 0.00 34.13 29.35 2ee1 s GLU 50 CO 0.58 -0.73 -0.12 0.42 0.95 0.00 0.00 175.26 176.36 2ee1 s ILE 51 N 2.22 0.94 -0.09 1.83 1.01 -1.26 -4.64 121.20 121.20 2ee1 s ILE 51 Ca 0.14 -0.83 -0.36 0.00 0.00 0.00 0.00 60.65 59.60 2ee1 s ILE 51 Cb -0.16 -0.85 -0.14 0.00 0.01 0.00 0.00 42.46 41.32 2ee1 s ILE 51 CO 0.13 0.03 1.74 1.67 0.00 0.00 0.00 174.94 178.51 2ee1 n GLN 52 N 2.14 1.76 -3.80 2.79 7.27 -1.26 -0.86 117.38 125.41 2ee1 n GLN 52 Ca -0.17 0.64 -0.27 0.00 0.07 0.00 0.00 57.00 57.27 2ee1 n GLN 52 Cb 0.55 -2.41 0.04 0.00 2.41 0.00 0.00 30.24 30.84 2ee1 n GLN 52 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2ee1 n ASP 53 N 5.36 -4.62 -0.07 1.69 9.92 -1.26 -4.80 116.55 122.77 2ee1 n ASP 53 Ca 0.22 -0.73 -0.15 0.00 -0.53 0.00 0.00 54.79 53.61 2ee1 n ASP 53 Cb 0.23 -4.20 -0.05 0.00 -0.64 0.00 0.00 41.12 36.47 2ee1 n ASP 53 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 2ee1 h TYR 54 N -2.20 0.99 -0.51 1.24 3.20 -1.41 -3.20 116.97 115.09 2ee1 h TYR 54 Ca -0.58 -0.36 -0.12 0.00 3.14 0.00 0.00 58.73 60.81 2ee1 h TYR 54 Cb 1.37 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.44 2ee1 h TYR 54 CO 0.54 1.16 -0.15 -0.44 -1.64 0.00 0.00 178.16 177.63 2ee1 h ASP 55 N 0.54 0.99 -0.22 -2.11 3.32 -1.90 -3.09 116.42 113.95 2ee1 h ASP 55 Ca 0.01 -0.34 0.05 0.00 0.02 0.00 0.00 57.03 56.77 2ee1 h ASP 55 Cb 1.10 -0.27 -0.07 0.00 0.22 0.00 0.00 39.33 40.31 2ee1 h ASP 55 CO 0.11 1.12 -0.40 -0.07 -1.72 0.00 0.00 179.24 178.28 2ee1 h LEU 56 N 0.86 -1.29 0.35 1.55 -0.00 -1.94 0.40 115.31 115.24 2ee1 h LEU 56 Ca 0.13 0.18 -0.01 0.00 -0.00 0.00 0.00 57.88 58.19 2ee1 h LEU 56 Cb 0.71 0.54 -0.03 0.00 -0.00 0.00 0.00 40.66 41.88 2ee1 h LEU 56 CO 0.05 -0.40 -0.47 -0.26 -0.00 0.00 0.00 178.44 177.36 2ee1 h PHE 57 N -0.42 -1.34 -0.99 1.13 -1.00 -1.56 -1.01 116.94 111.75 2ee1 h PHE 57 Ca 0.10 0.02 0.21 0.00 2.81 0.00 0.00 57.97 61.11 2ee1 h PHE 57 Cb 0.60 0.54 -0.10 0.00 3.61 0.00 0.00 35.95 40.60 2ee1 h PHE 57 CO -0.52 -0.60 0.62 0.87 -1.61 0.00 0.00 178.31 177.08 2ee1 h LYS 58 N -0.86 0.57 -0.20 1.51 1.57 -1.40 0.77 116.57 118.54 2ee1 h LYS 58 Ca -0.04 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2ee1 h LYS 58 Cb 0.77 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 2ee1 h LYS 58 CO -0.12 0.38 0.12 0.37 -0.57 0.00 0.00 179.45 179.62 2ee1 h GLN 59 N 0.59 0.28 0.37 3.15 -0.00 0.62 -2.44 115.11 117.69 2ee1 h GLN 59 Ca 0.56 -0.03 -0.02 0.00 -0.00 0.00 0.00 58.65 59.17 2ee1 h GLN 59 Cb 1.12 -0.06 0.00 0.00 0.00 0.00 0.00 27.48 28.55 2ee1 h GLN 59 CO -0.33 0.25 -0.18 1.03 0.00 0.00 0.00 178.83 179.60 2ee1 h SER 60 N 0.23 -0.43 -0.80 -0.69 0.87 0.22 -3.12 113.55 109.83 2ee1 h SER 60 Ca 0.07 0.01 0.17 0.00 -1.23 0.00 0.00 61.79 60.81 2ee1 h SER 60 Cb 0.05 0.11 -0.15 0.00 -0.44 0.00 0.00 62.40 61.97 2ee1 h SER 60 CO -0.01 -0.17 -0.18 0.00 -0.53 0.00 0.00 176.83 175.94 2ee1 n TYR 61 N -4.12 0.31 0.06 2.24 4.19 0.09 0.50 117.16 120.41 2ee1 n TYR 61 Ca -0.06 0.98 -0.12 0.00 3.31 0.00 0.00 57.90 62.00 2ee1 n TYR 61 Cb 0.20 -0.98 -0.05 0.00 0.49 0.00 0.00 39.34 39.00 2ee1 n TYR 61 CO 0.00 0.00 0.00 -1.49 0.91 0.00 0.00 176.86 176.28 2ee1 h TRP 62 N 0.00 -0.96 0.55 2.98 -0.00 -1.49 -3.18 115.95 113.86 2ee1 h TRP 62 Ca 0.39 0.03 -0.03 0.00 -0.00 0.00 0.00 58.89 59.29 2ee1 h TRP 62 Cb 0.62 0.43 0.01 0.00 -0.00 0.00 0.00 29.16 30.21 2ee1 h TRP 62 CO -0.60 -0.44 -0.27 -0.91 -0.00 0.00 0.00 178.44 176.23 2ee1 h ASN 63 N -0.50 -0.63 0.00 -3.49 2.35 0.11 -3.52 115.58 109.90 2ee1 h ASN 63 Ca 0.06 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2ee1 h ASN 63 Cb 0.59 0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.12 2ee1 h ASN 63 CO -0.29 -0.33 0.00 1.41 -1.65 0.00 0.00 177.43 176.57