#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ee2 s SER 2 N 0.00 4.15 0.07 1.61 0.15 -1.26 -5.12 113.70 113.31 2ee2 s SER 2 Ca 0.00 -1.13 -0.26 0.00 0.70 0.00 0.00 55.95 55.25 2ee2 s SER 2 Cb 0.00 -0.47 -0.06 0.00 -1.71 0.00 0.00 66.02 63.78 2ee2 s SER 2 CO 0.00 -0.39 0.82 -0.94 1.20 0.00 0.00 173.24 173.93 2ee2 s SER 3 N -3.77 7.30 0.51 5.45 1.04 -1.26 -5.07 113.70 117.91 2ee2 s SER 3 Ca 0.37 1.56 0.05 0.00 0.48 0.00 0.00 55.95 58.40 2ee2 s SER 3 Cb 0.04 -2.50 0.01 0.00 0.10 0.00 0.00 66.02 63.67 2ee2 s SER 3 CO 0.20 0.01 0.25 -0.83 0.98 0.00 0.00 173.24 173.85 2ee2 s GLY 4 N -0.13 2.55 0.54 7.32 0.00 -1.26 -5.15 107.32 111.20 2ee2 s GLY 4 Ca 0.41 -1.15 0.02 0.00 0.00 0.00 0.00 44.72 43.99 2ee2 s GLY 4 CO 0.25 -2.01 0.76 -1.35 0.00 0.00 0.00 173.10 170.76 2ee2 s SER 5 N -4.10 5.28 -0.06 1.64 1.04 -1.26 -5.12 113.70 111.11 2ee2 s SER 5 Ca 0.27 -0.05 -0.08 0.00 0.48 0.00 0.00 55.95 56.57 2ee2 s SER 5 Cb -0.00 -0.84 0.02 0.00 0.10 0.00 0.00 66.02 65.30 2ee2 s SER 5 CO 0.16 -1.13 0.22 -0.55 0.98 0.00 0.00 173.24 172.92 2ee2 s SER 6 N -4.43 -0.19 0.00 7.02 0.15 -1.26 -5.10 113.70 109.90 2ee2 s SER 6 Ca 0.57 0.31 0.00 0.00 0.70 0.00 0.00 55.95 57.53 2ee2 s SER 6 Cb -0.10 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.61 2ee2 s SER 6 CO 0.38 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.28 2ee2 n GLY 7 N 2.58 -2.07 3.82 9.45 0.00 -1.26 -5.16 105.19 112.54 2ee2 n GLY 7 Ca -0.15 0.99 -0.36 0.00 0.00 0.00 0.00 46.02 46.51 2ee2 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ee2 s VAL 8 N 0.00 5.08 -0.30 1.61 0.11 -1.26 -5.07 120.40 120.57 2ee2 s VAL 8 Ca 0.00 -0.03 -0.14 0.00 -2.93 0.00 0.00 61.98 58.88 2ee2 s VAL 8 Cb 0.00 -3.22 0.18 0.00 -1.53 0.00 0.00 36.38 31.80 2ee2 s VAL 8 CO 0.00 0.55 1.10 0.00 -3.33 0.00 0.00 175.10 173.42 2ee2 s ALA 9 N -1.04 -3.60 -0.01 1.54 0.00 -1.26 -5.13 121.76 112.26 2ee2 s ALA 9 Ca 0.17 1.39 -0.30 0.00 0.00 0.00 0.00 51.96 53.22 2ee2 s ALA 9 Cb -0.12 -2.55 -0.08 0.00 0.00 0.00 0.00 23.12 20.37 2ee2 s ALA 9 CO 0.06 -1.51 1.90 0.14 0.00 0.00 0.00 175.76 176.35 2ee2 s VAL 10 N 2.96 3.18 0.99 0.00 -7.23 -1.26 -4.96 120.40 114.08 2ee2 s VAL 10 Ca -0.02 0.21 -0.11 0.00 -1.81 0.00 0.00 61.98 60.26 2ee2 s VAL 10 Cb -0.09 -3.15 0.19 0.00 0.56 0.00 0.00 36.38 33.89 2ee2 s VAL 10 CO -0.11 -0.03 1.10 0.27 -0.31 0.00 0.00 175.10 176.02 2ee2 s ILE 11 N 4.66 2.19 0.10 -0.62 -4.36 -1.26 -5.06 121.20 116.86 2ee2 s ILE 11 Ca 0.85 0.06 -0.09 0.00 -0.26 0.00 0.00 60.65 61.21 2ee2 s ILE 11 Cb -0.39 -2.17 -0.00 0.00 1.25 0.00 0.00 42.46 41.14 2ee2 s ILE 11 CO 0.38 -0.08 0.21 0.20 0.24 0.00 0.00 174.94 175.89 2ee2 s ASN 12 N -2.74 0.10 -0.19 4.36 -0.87 -1.26 -5.16 114.94 109.17 2ee2 s ASN 12 Ca 0.67 -0.68 -0.04 0.00 -1.57 0.00 0.00 52.86 51.23 2ee2 s ASN 12 Cb -0.23 0.36 0.10 0.00 -0.02 0.00 0.00 41.25 41.46 2ee2 s ASN 12 CO 0.60 -0.76 0.31 -0.55 -2.57 0.00 0.00 177.10 174.13 2ee2 s SER 13 N -2.88 0.45 0.13 -1.22 0.15 -1.26 -5.15 113.70 103.93 2ee2 s SER 13 Ca 0.07 0.36 -0.24 0.00 0.70 0.00 0.00 55.95 56.83 2ee2 s SER 13 Cb 0.05 0.86 0.07 0.00 -1.71 0.00 0.00 66.02 65.29 2ee2 s SER 13 CO -0.09 -0.28 0.71 0.00 1.20 0.00 0.00 173.24 174.79 2ee2 s ALA 14 N 2.47 -1.61 -0.12 5.45 0.00 -1.26 -5.01 121.76 121.67 2ee2 s ALA 14 Ca 0.06 0.49 -0.21 0.00 0.00 0.00 0.00 51.96 52.30 2ee2 s ALA 14 Cb -0.14 0.75 -0.26 0.00 0.00 0.00 0.00 23.12 23.47 2ee2 s ALA 14 CO -0.12 -0.80 0.60 -0.56 0.00 0.00 0.00 175.76 174.87 2ee2 h GLN 15 N 2.00 0.14 -4.33 0.00 3.07 -1.99 -3.49 115.11 110.52 2ee2 h GLN 15 Ca -0.28 -0.24 -0.19 0.00 0.09 0.00 0.00 58.65 58.03 2ee2 h GLN 15 Cb 1.28 0.09 -0.14 0.00 0.08 0.00 0.00 27.48 28.79 2ee2 h GLN 15 CO 0.33 1.12 -0.50 -0.51 0.09 0.00 0.00 178.83 179.36 2ee2 s ASP 16 N -6.78 0.11 -0.16 0.06 1.01 -1.26 -5.09 116.67 104.56 2ee2 s ASP 16 Ca -0.20 -1.23 -0.25 0.00 0.71 0.00 0.00 52.55 51.58 2ee2 s ASP 16 Cb 0.02 0.42 0.06 0.00 1.01 0.00 0.00 42.92 44.43 2ee2 s ASP 16 CO 0.72 -0.89 0.63 0.00 0.21 0.00 0.00 175.17 175.84 2ee2 s ALA 17 N -4.10 -1.59 0.09 5.23 0.00 -1.26 -1.73 121.76 118.40 2ee2 s ALA 17 Ca 0.32 1.54 -0.31 0.00 0.00 0.00 0.00 51.96 53.51 2ee2 s ALA 17 Cb 0.05 -0.62 -0.07 0.00 0.00 0.00 0.00 23.12 22.48 2ee2 s ALA 17 CO 0.09 -0.32 1.38 -1.25 0.00 0.00 0.00 175.76 175.66 2ee2 s PRO 18 N -0.30 4.32 -0.02 0.00 0.04 -1.26 -4.91 135.00 132.87 2ee2 s PRO 18 Ca -0.05 2.03 0.07 0.00 0.04 0.00 0.00 61.00 63.10 2ee2 s PRO 18 Cb -0.03 -3.31 -0.11 0.00 0.04 0.00 0.00 34.50 31.09 2ee2 s PRO 18 CO 0.04 -0.44 0.13 0.45 0.04 0.00 0.00 177.00 177.21 2ee2 n SER 19 N 4.18 3.32 -4.67 6.66 2.88 -1.26 -4.36 113.62 120.38 2ee2 n SER 19 Ca 0.12 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.40 2ee2 n SER 19 Cb 0.43 1.16 -0.07 0.00 -0.75 0.00 0.00 64.21 64.98 2ee2 n SER 19 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 2ee2 s GLU 20 N -2.42 2.41 0.05 -1.46 2.56 -1.26 -4.92 118.70 113.66 2ee2 s GLU 20 Ca -0.03 -1.18 0.05 0.00 0.00 0.00 0.00 54.97 53.81 2ee2 s GLU 20 Cb 0.04 -2.32 -0.02 0.00 2.00 0.00 0.00 34.13 33.82 2ee2 s GLU 20 CO 0.30 0.43 -0.14 0.00 -0.56 0.00 0.00 175.26 175.29 2ee2 s ALA 21 N -1.91 1.12 -0.62 6.30 0.00 -1.26 -4.84 121.76 120.55 2ee2 s ALA 21 Ca 0.29 -0.88 -0.26 0.00 0.00 0.00 0.00 51.96 51.10 2ee2 s ALA 21 Cb -0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 22.88 2ee2 s ALA 21 CO 0.19 0.18 1.86 -1.25 0.00 0.00 0.00 175.76 176.75 2ee2 s PRO 22 N -1.39 2.62 0.46 0.00 0.04 -1.26 -4.97 135.00 130.50 2ee2 s PRO 22 Ca -0.01 0.57 0.05 0.00 0.04 0.00 0.00 61.00 61.66 2ee2 s PRO 22 Cb -0.09 -4.41 0.02 0.00 0.04 0.00 0.00 34.50 30.06 2ee2 s PRO 22 CO 0.02 -2.76 0.64 0.99 0.04 0.00 0.00 177.00 175.93 2ee2 s THR 23 N 9.12 3.00 -1.45 1.26 2.01 -1.26 -4.44 115.64 123.88 2ee2 s THR 23 Ca 0.67 -0.85 -0.11 0.00 0.31 0.00 0.00 61.69 61.70 2ee2 s THR 23 Cb -0.12 -3.05 0.05 0.00 0.01 0.00 0.00 72.50 69.38 2ee2 s THR 23 CO 0.20 -0.03 1.08 -0.62 -0.69 0.00 0.00 174.62 174.56 2ee2 n GLU 24 N -2.03 -6.76 -1.56 4.92 1.02 -1.26 -4.47 120.64 110.50 2ee2 n GLU 24 Ca 0.07 0.72 -0.32 0.00 -0.02 0.00 0.00 57.16 57.61 2ee2 n GLU 24 Cb 0.59 -5.70 0.06 0.00 -0.02 0.00 0.00 31.44 26.38 2ee2 n GLU 24 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2ee2 s VAL 25 N -3.30 3.33 0.17 2.62 1.01 -1.26 -4.82 120.40 118.14 2ee2 s VAL 25 Ca 0.62 0.53 0.09 0.00 0.00 0.00 0.00 61.98 63.23 2ee2 s VAL 25 Cb -0.29 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 2ee2 s VAL 25 CO 0.77 -0.46 -0.20 -0.83 0.00 0.00 0.00 175.10 174.37 2ee2 s GLY 26 N -2.96 1.47 -0.05 4.51 0.00 0.10 -5.00 107.32 105.39 2ee2 s GLY 26 Ca 0.64 -1.51 -0.01 0.00 0.00 0.00 0.00 44.72 43.84 2ee2 s GLY 26 CO 0.48 -1.55 0.01 -1.34 0.00 0.00 0.00 173.10 170.70 2ee2 s VAL 27 N -1.85 0.21 -0.14 1.40 -7.23 -1.26 -0.96 120.40 110.56 2ee2 s VAL 27 Ca 0.16 0.17 -0.03 0.00 -1.81 0.00 0.00 61.98 60.47 2ee2 s VAL 27 Cb -0.07 -0.36 -0.02 0.00 0.56 0.00 0.00 36.38 36.49 2ee2 s VAL 27 CO 0.07 0.20 -0.06 -0.75 -0.31 0.00 0.00 175.10 174.25 2ee2 s LYS 28 N 1.64 3.55 -0.47 4.82 2.20 0.80 -4.96 119.74 127.32 2ee2 s LYS 28 Ca -0.01 -0.56 -0.20 0.00 -0.36 0.00 0.00 55.97 54.84 2ee2 s LYS 28 Cb -0.13 -2.83 0.04 0.00 -1.51 0.00 0.00 37.83 33.40 2ee2 s LYS 28 CO -0.03 0.27 0.65 0.08 -0.36 0.00 0.00 175.35 175.95 2ee2 s VAL 29 N 0.27 4.82 -0.17 4.02 1.01 -1.26 -0.11 120.40 128.98 2ee2 s VAL 29 Ca -0.05 -0.08 -0.24 0.00 0.00 0.00 0.00 61.98 61.61 2ee2 s VAL 29 Cb -0.14 -4.25 -0.23 0.00 0.00 0.00 0.00 36.38 31.76 2ee2 s VAL 29 CO 0.04 -0.69 0.48 -0.07 0.00 0.00 0.00 175.10 174.85 2ee2 h LEU 30 N 9.76 0.03 -8.47 3.92 3.38 -0.95 -3.49 115.31 119.50 2ee2 h LEU 30 Ca -0.26 -0.75 -0.24 0.00 0.09 0.00 0.00 57.88 56.72 2ee2 h LEU 30 Cb 1.09 -0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.76 2ee2 h LEU 30 CO 0.92 1.29 -0.16 -0.55 0.09 0.00 0.00 178.44 180.03 2ee2 s SER 31 N -6.60 0.78 0.60 -0.43 0.15 0.10 -4.94 113.70 103.35 2ee2 s SER 31 Ca -0.24 -1.42 0.30 0.00 0.70 0.00 0.00 55.95 55.28 2ee2 s SER 31 Cb 0.02 0.67 1.70 0.00 -1.71 0.00 0.00 66.02 66.70 2ee2 s SER 31 CO 0.65 -1.31 2.11 0.77 1.20 0.00 0.00 173.24 176.66 2ee2 h SER 32 N 2.12 0.00 -0.30 5.45 4.64 -1.94 -2.02 113.55 121.50 2ee2 h SER 32 Ca -0.28 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 60.79 2ee2 h SER 32 Cb 1.24 0.00 -0.33 0.00 -0.31 0.00 0.00 62.40 63.01 2ee2 h SER 32 CO 0.39 0.00 -0.91 -1.20 -0.87 0.00 0.00 176.83 174.24 2ee2 n SER 33 N -3.73 2.17 -3.56 4.97 7.64 -1.26 -4.06 113.62 115.79 2ee2 n SER 33 Ca 0.01 -2.76 -0.09 0.00 1.01 0.00 0.00 58.87 57.04 2ee2 n SER 33 Cb 0.31 -0.41 -0.09 0.00 -1.01 0.00 0.00 64.21 63.01 2ee2 n SER 33 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2ee2 s GLU 34 N -2.59 0.32 -0.07 1.43 2.02 -0.76 -3.43 118.70 115.63 2ee2 s GLU 34 Ca 0.36 0.87 -0.03 0.00 0.02 0.00 0.00 54.97 56.19 2ee2 s GLU 34 Cb 0.37 0.07 0.04 0.00 0.10 0.00 0.00 34.13 34.70 2ee2 s GLU 34 CO -0.06 -0.38 0.14 0.42 0.02 0.00 0.00 175.26 175.40 2ee2 s ILE 35 N 2.58 -0.08 0.04 -1.63 1.01 -1.09 -0.19 121.20 121.85 2ee2 s ILE 35 Ca 0.03 0.21 -0.10 0.00 0.00 0.00 0.00 60.65 60.79 2ee2 s ILE 35 Cb -0.13 -0.24 -0.06 0.00 0.01 0.00 0.00 42.46 42.04 2ee2 s ILE 35 CO -0.13 0.09 0.37 -0.55 0.00 0.00 0.00 174.94 174.71 2ee2 s SER 36 N 1.34 6.65 -0.27 3.58 0.15 0.84 -0.31 113.70 125.69 2ee2 s SER 36 Ca -0.07 0.78 0.02 0.00 0.70 0.00 0.00 55.95 57.38 2ee2 s SER 36 Cb -0.12 -2.18 0.07 0.00 -1.71 0.00 0.00 66.02 62.09 2ee2 s SER 36 CO -0.06 0.23 -0.05 -0.69 1.20 0.00 0.00 173.24 173.87 2ee2 s VAL 37 N -1.29 1.95 -0.31 4.45 1.01 -0.60 -0.14 120.40 125.46 2ee2 s VAL 37 Ca 0.29 -1.65 -0.09 0.00 0.00 0.00 0.00 61.98 60.53 2ee2 s VAL 37 Cb -0.14 -2.20 -0.00 0.00 0.00 0.00 0.00 36.38 34.04 2ee2 s VAL 37 CO 0.16 -0.19 0.14 -1.00 0.00 0.00 0.00 175.10 174.22 2ee2 s HIS 38 N 1.17 3.18 0.35 5.22 3.76 -0.13 -1.17 115.29 127.66 2ee2 s HIS 38 Ca -0.03 -0.65 0.02 0.00 -0.15 0.00 0.00 55.06 54.24 2ee2 s HIS 38 Cb -0.19 -2.34 0.02 0.00 1.11 0.00 0.00 32.58 31.17 2ee2 s HIS 38 CO -0.07 -0.48 0.16 -2.67 -0.85 0.00 0.00 174.74 170.83 2ee2 n TRP 39 N 4.97 -0.22 -3.96 1.40 2.14 -1.08 0.01 117.44 120.69 2ee2 n TRP 39 Ca -0.14 -1.57 -0.35 0.00 2.07 0.00 0.00 57.50 57.51 2ee2 n TRP 39 Cb 0.49 -0.26 -0.12 0.00 -0.81 0.00 0.00 31.31 30.61 2ee2 n TRP 39 CO 0.00 0.00 0.00 -2.00 2.07 0.00 0.00 177.69 177.76 2ee2 s GLU 40 N -3.36 3.76 0.21 -2.67 2.12 -1.26 -4.83 118.70 112.67 2ee2 s GLU 40 Ca 0.12 -0.44 -0.32 0.00 0.36 0.00 0.00 54.97 54.69 2ee2 s GLU 40 Cb -0.01 -3.21 -0.13 0.00 0.26 0.00 0.00 34.13 31.04 2ee2 s GLU 40 CO 0.08 0.04 1.59 0.72 -0.54 0.00 0.00 175.26 177.14 2ee2 n HIS 41 N 4.22 2.50 -2.92 5.30 8.25 -1.26 -4.44 115.22 126.86 2ee2 n HIS 41 Ca -0.16 0.23 -0.40 0.00 -0.26 0.00 0.00 57.72 57.13 2ee2 n HIS 41 Cb 0.52 -2.57 -0.05 0.00 1.12 0.00 0.00 29.99 29.00 2ee2 n HIS 41 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2ee2 s VAL 42 N 0.63 4.59 0.64 1.59 -7.23 -1.26 -4.91 120.40 114.46 2ee2 s VAL 42 Ca 0.73 1.75 0.20 0.00 -1.81 0.00 0.00 61.98 62.85 2ee2 s VAL 42 Cb -0.59 -4.17 0.24 0.00 0.56 0.00 0.00 36.38 32.42 2ee2 s VAL 42 CO 0.40 0.39 1.56 0.17 -0.31 0.00 0.00 175.10 177.31 2ee2 h LEU 43 N 5.34 0.00 -8.72 1.32 8.10 -1.94 -3.37 115.31 116.04 2ee2 h LEU 43 Ca -0.44 0.00 -0.55 0.00 0.11 0.00 0.00 57.88 57.00 2ee2 h LEU 43 Cb 1.21 0.00 -0.04 0.00 -0.44 0.00 0.00 40.66 41.39 2ee2 h LEU 43 CO 0.70 0.00 1.24 -1.61 -4.11 0.00 0.00 178.44 174.66 2ee2 s GLU 44 N -4.21 3.18 0.00 0.17 0.41 -1.26 -4.83 118.70 112.16 2ee2 s GLU 44 Ca -0.02 1.00 0.13 0.00 -0.41 0.00 0.00 54.97 55.67 2ee2 s GLU 44 Cb 0.08 -4.21 0.41 0.00 -1.78 0.00 0.00 34.13 28.63 2ee2 s GLU 44 CO 0.27 -2.05 1.33 1.17 -0.49 0.00 0.00 175.26 175.49 2ee2 n LYS 45 N 8.60 1.86 0.08 1.61 4.81 -1.26 -3.73 118.16 130.13 2ee2 n LYS 45 Ca 0.20 -1.34 0.11 0.00 -0.87 0.00 0.00 58.31 56.41 2ee2 n LYS 45 Cb 0.49 -1.32 -0.03 0.00 0.02 0.00 0.00 35.03 34.19 2ee2 n LYS 45 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 2ee2 n ILE 46 N 0.58 0.55 -1.62 3.15 -6.64 -1.26 -4.94 119.36 109.18 2ee2 n ILE 46 Ca 0.13 -0.55 -0.40 0.00 -1.77 0.00 0.00 62.75 60.16 2ee2 n ILE 46 Cb 0.33 -0.30 0.02 0.00 -1.44 0.00 0.00 39.64 38.24 2ee2 n ILE 46 CO 0.00 0.00 0.00 1.33 -1.77 0.00 0.00 176.55 176.11 2ee2 n VAL 47 N -2.62 2.74 -0.08 7.28 0.24 -1.24 -4.61 118.33 120.04 2ee2 n VAL 47 Ca -0.01 -0.50 -0.15 0.00 -2.04 0.00 0.00 64.34 61.63 2ee2 n VAL 47 Cb 0.57 -1.20 -0.11 0.00 -1.47 0.00 0.00 33.84 31.64 2ee2 n VAL 47 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 2ee2 h GLU 48 N 1.33 0.00 0.00 7.34 4.39 -1.80 -3.46 114.58 122.38 2ee2 h GLU 48 Ca -0.46 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.17 2ee2 h GLU 48 Cb 1.34 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.98 2ee2 h GLU 48 CO 0.55 0.85 0.14 -1.13 -1.16 0.00 0.00 179.01 178.26 2ee2 n SER 49 N -4.56 -1.63 -4.12 1.42 3.41 -1.22 -3.96 113.62 102.97 2ee2 n SER 49 Ca -0.18 -2.31 -0.34 0.00 -0.26 0.00 0.00 58.87 55.79 2ee2 n SER 49 Cb 0.50 2.76 -0.14 0.00 -0.26 0.00 0.00 64.21 67.07 2ee2 n SER 49 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 2ee2 s TYR 50 N -3.60 3.29 -0.52 7.33 1.51 -1.19 -2.68 117.35 121.49 2ee2 s TYR 50 Ca 0.15 -2.12 -0.27 0.00 -1.01 0.00 0.00 57.07 53.82 2ee2 s TYR 50 Cb -0.03 -2.07 0.03 0.00 -0.11 0.00 0.00 41.96 39.78 2ee2 s TYR 50 CO 0.11 -0.85 1.05 -1.14 -1.11 0.00 0.00 175.55 173.61 2ee2 s GLN 51 N 1.17 3.53 -0.68 -0.62 0.74 0.17 -3.55 119.66 120.41 2ee2 s GLN 51 Ca -0.06 0.18 -0.21 0.00 0.05 0.00 0.00 55.36 55.32 2ee2 s GLN 51 Cb -0.20 -3.97 0.09 0.00 1.10 0.00 0.00 33.01 30.02 2ee2 s GLN 51 CO -0.03 -1.44 0.92 0.42 -0.55 0.00 0.00 175.29 174.61 2ee2 s ILE 52 N 4.29 4.51 -0.03 -2.34 1.09 -0.41 -1.99 121.20 126.31 2ee2 s ILE 52 Ca 0.40 -0.70 -0.23 0.00 -1.10 0.00 0.00 60.65 59.02 2ee2 s ILE 52 Cb -0.09 -4.65 -0.05 0.00 -1.06 0.00 0.00 42.46 36.61 2ee2 s ILE 52 CO 0.26 -1.38 0.67 -0.60 -0.10 0.00 0.00 174.94 173.79 2ee2 s ARG 53 N 3.51 4.41 -0.07 2.79 3.52 0.12 -1.85 118.95 131.38 2ee2 s ARG 53 Ca 0.21 0.86 -0.04 0.00 -0.13 0.00 0.00 55.73 56.63 2ee2 s ARG 53 Cb -0.17 -3.40 0.04 0.00 -1.56 0.00 0.00 34.95 29.86 2ee2 s ARG 53 CO 0.06 0.20 0.17 1.52 -0.81 0.00 0.00 175.30 176.43 2ee2 s TYR 54 N 0.35 -0.20 -0.13 5.12 1.13 -0.85 0.42 117.35 123.20 2ee2 s TYR 54 Ca 0.35 0.53 -0.10 0.00 -1.41 0.00 0.00 57.07 56.44 2ee2 s TYR 54 Cb -0.18 -0.03 0.04 0.00 -1.10 0.00 0.00 41.96 40.68 2ee2 s TYR 54 CO 0.18 -0.16 0.32 1.67 -2.51 0.00 0.00 175.55 175.05 2ee2 s TRP 55 N 0.99 -0.39 0.44 -3.49 -2.14 -1.17 -2.55 118.94 110.63 2ee2 s TRP 55 Ca -0.08 0.93 -0.25 0.00 2.66 0.00 0.00 56.10 59.36 2ee2 s TRP 55 Cb -0.09 0.13 -0.08 0.00 -3.10 0.00 0.00 33.47 30.33 2ee2 s TRP 55 CO -0.05 -0.21 1.33 0.00 -2.66 0.00 0.00 176.95 175.35 2ee2 s ALA 56 N 0.60 3.18 0.24 2.67 0.00 -1.26 -0.95 121.76 126.25 2ee2 s ALA 56 Ca -0.04 1.28 -0.10 0.00 0.00 0.00 0.00 51.96 53.11 2ee2 s ALA 56 Cb -0.05 -3.51 0.37 0.00 0.00 0.00 0.00 23.12 19.93 2ee2 s ALA 56 CO -0.04 -0.97 1.61 0.00 0.00 0.00 0.00 175.76 176.36 2ee2 h ALA 57 N 2.39 0.61 -0.15 0.00 0.00 -1.58 0.70 119.26 121.24 2ee2 h ALA 57 Ca -0.50 0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 2ee2 h ALA 57 Cb 1.26 0.54 -0.01 0.00 0.00 0.00 0.00 17.79 19.58 2ee2 h ALA 57 CO 0.61 -0.42 -0.07 1.12 0.00 0.00 0.00 179.25 180.49 2ee2 h HIS 58 N 0.03 0.23 -3.80 0.00 -0.00 -1.91 -3.43 115.15 106.27 2ee2 h HIS 58 Ca 0.39 -0.02 -0.44 0.00 -0.00 0.00 0.00 60.37 60.30 2ee2 h HIS 58 Cb 0.64 -0.07 0.17 0.00 -0.00 0.00 0.00 27.41 28.15 2ee2 h HIS 58 CO -0.55 0.30 0.19 -0.51 -0.00 0.00 0.00 177.93 177.36 2ee2 s ASP 59 N -6.89 2.16 0.12 3.10 1.01 0.24 -5.06 116.67 111.34 2ee2 s ASP 59 Ca -0.06 0.95 0.07 0.00 0.71 0.00 0.00 52.55 54.22 2ee2 s ASP 59 Cb 0.16 -1.47 -0.04 0.00 1.01 0.00 0.00 42.92 42.58 2ee2 s ASP 59 CO 0.72 -3.39 -0.06 -0.54 0.21 0.00 0.00 175.17 172.11 2ee2 s LYS 60 N -5.16 2.27 0.44 8.23 -0.14 -1.26 -4.80 119.74 119.32 2ee2 s LYS 60 Ca 0.67 -1.00 0.16 0.00 -1.36 0.00 0.00 55.97 54.44 2ee2 s LYS 60 Cb -0.15 -2.37 1.09 0.00 -1.68 0.00 0.00 37.83 34.72 2ee2 s LYS 60 CO 0.57 0.50 1.95 0.93 -0.76 0.00 0.00 175.35 178.54 2ee2 h GLU 61 N 3.39 0.35 -0.53 1.68 3.07 -1.96 0.32 114.58 120.89 2ee2 h GLU 61 Ca -0.48 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.36 58.36 2ee2 h GLU 61 Cb 1.17 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.98 2ee2 h GLU 61 CO 0.55 0.23 0.33 1.05 -1.40 0.00 0.00 179.01 179.77 2ee2 h GLU 62 N 0.36 0.72 -0.63 2.33 -0.00 -2.03 -0.85 114.58 114.48 2ee2 h GLU 62 Ca 0.32 -0.06 0.00 0.00 -0.00 0.00 0.00 59.36 59.63 2ee2 h GLU 62 Cb 0.76 -0.15 0.00 0.00 -0.00 0.00 0.00 28.75 29.36 2ee2 h GLU 62 CO -0.09 0.50 0.00 0.00 -0.00 0.00 0.00 179.01 179.42 2ee2 n ALA 63 N -2.46 2.82 -2.28 1.06 0.00 0.05 -4.93 120.51 114.79 2ee2 n ALA 63 Ca 0.05 -1.26 -0.43 0.00 0.00 0.00 0.00 53.44 51.80 2ee2 n ALA 63 Cb 0.07 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.49 2ee2 n ALA 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ee2 s ALA 64 N -1.60 3.65 1.02 0.00 0.00 -0.33 -4.89 121.76 119.61 2ee2 s ALA 64 Ca 0.43 0.63 -0.15 0.00 0.00 0.00 0.00 51.96 52.87 2ee2 s ALA 64 Cb 0.26 -3.67 0.20 0.00 0.00 0.00 0.00 23.12 19.92 2ee2 s ALA 64 CO 0.23 -1.25 1.16 -0.80 0.00 0.00 0.00 175.76 175.10 2ee2 s ASN 65 N 2.46 2.53 -0.26 0.00 0.01 -1.06 -4.82 114.94 113.81 2ee2 s ASN 65 Ca 0.61 0.77 -0.19 0.00 -0.71 0.00 0.00 52.86 53.34 2ee2 s ASN 65 Cb -0.26 -1.16 0.07 0.00 0.41 0.00 0.00 41.25 40.31 2ee2 s ASN 65 CO 0.20 -3.14 0.66 0.00 -1.51 0.00 0.00 177.10 173.31 2ee2 s ARG 66 N -5.38 0.72 -0.15 -0.60 1.70 -1.26 -2.00 118.95 111.98 2ee2 s ARG 66 Ca 0.68 1.06 -0.00 0.00 -0.47 0.00 0.00 55.73 57.00 2ee2 s ARG 66 Cb -0.12 0.24 -0.01 0.00 -0.57 0.00 0.00 34.95 34.49 2ee2 s ARG 66 CO 0.55 -0.12 -0.13 0.08 -1.08 0.00 0.00 175.30 174.59 2ee2 s VAL 67 N 1.02 2.96 -0.27 4.99 1.01 -0.77 -4.88 120.40 124.46 2ee2 s VAL 67 Ca -0.05 -0.68 -0.10 0.00 0.00 0.00 0.00 61.98 61.15 2ee2 s VAL 67 Cb -0.05 -2.26 -0.05 0.00 0.00 0.00 0.00 36.38 34.03 2ee2 s VAL 67 CO -0.10 0.51 0.16 -1.58 0.00 0.00 0.00 175.10 174.09 2ee2 s GLN 68 N 0.64 3.90 0.04 2.72 0.74 -1.26 -1.29 119.66 125.14 2ee2 s GLN 68 Ca -0.07 -0.35 0.06 0.00 0.05 0.00 0.00 55.36 55.06 2ee2 s GLN 68 Cb -0.15 -3.57 -0.02 0.00 1.10 0.00 0.00 33.01 30.37 2ee2 s GLN 68 CO 0.03 -0.15 -0.18 0.14 -0.55 0.00 0.00 175.29 174.57 2ee2 s VAL 69 N 1.63 1.48 0.21 1.34 -7.23 -1.23 -4.99 120.40 111.60 2ee2 s VAL 69 Ca 0.07 -1.10 -0.28 0.00 -1.81 0.00 0.00 61.98 58.86 2ee2 s VAL 69 Cb -0.15 -1.29 -0.17 0.00 0.56 0.00 0.00 36.38 35.33 2ee2 s VAL 69 CO 0.09 0.16 0.60 1.07 -0.31 0.00 0.00 175.10 176.70 2ee2 n THR 70 N 1.93 1.98 0.19 5.32 5.66 -1.26 -3.17 114.28 124.94 2ee2 n THR 70 Ca -0.17 -0.49 0.16 0.00 -3.05 0.00 0.00 64.05 60.49 2ee2 n THR 70 Cb 0.54 -0.14 0.79 0.00 -1.55 0.00 0.00 70.33 69.97 2ee2 n THR 70 CO 0.00 0.00 0.00 -1.28 -3.05 0.00 0.00 175.07 170.74 2ee2 h SER 71 N 1.16 0.00 0.38 1.09 0.87 -1.92 0.13 113.55 115.26 2ee2 h SER 71 Ca -0.30 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 2ee2 h SER 71 Cb 1.43 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.39 2ee2 h SER 71 CO 0.58 0.00 0.00 1.56 -0.53 0.00 0.00 176.83 178.44 2ee2 h GLN 72 N 0.00 0.00 -6.16 2.24 1.08 -1.92 -3.40 115.11 106.95 2ee2 h GLN 72 Ca 0.09 0.00 -0.60 0.00 -1.45 0.00 0.00 58.65 56.69 2ee2 h GLN 72 Cb 0.43 0.00 -0.10 0.00 -0.05 0.00 0.00 27.48 27.76 2ee2 h GLN 72 CO -0.00 0.00 0.59 -1.21 -0.95 0.00 0.00 178.83 177.26 2ee2 s GLU 73 N -3.74 3.54 0.50 1.46 0.41 0.46 -4.90 118.70 116.44 2ee2 s GLU 73 Ca -0.01 0.18 0.26 0.00 -0.41 0.00 0.00 54.97 54.98 2ee2 s GLU 73 Cb 0.10 -3.92 1.33 0.00 -1.78 0.00 0.00 34.13 29.85 2ee2 s GLU 73 CO 0.39 -1.22 2.03 1.88 -0.49 0.00 0.00 175.26 177.84 2ee2 h TYR 74 N 9.06 0.00 -4.27 1.61 0.05 -1.86 -3.45 116.97 118.12 2ee2 h TYR 74 Ca -0.24 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.37 2ee2 h TYR 74 Cb 1.08 0.00 -0.14 0.00 1.01 0.00 0.00 36.73 38.68 2ee2 h TYR 74 CO 0.87 0.15 -0.52 -1.54 -1.05 0.00 0.00 178.16 176.07 2ee2 s SER 75 N -6.23 0.18 0.34 3.88 1.04 -1.26 -2.64 113.70 109.01 2ee2 s SER 75 Ca -0.02 -1.14 0.02 0.00 0.48 0.00 0.00 55.95 55.29 2ee2 s SER 75 Cb 0.13 0.37 -0.01 0.00 0.10 0.00 0.00 66.02 66.61 2ee2 s SER 75 CO 0.60 -0.82 0.08 0.00 0.98 0.00 0.00 173.24 174.08 2ee2 n ALA 76 N -0.18 0.42 -3.33 5.32 0.00 -0.32 -4.94 120.51 117.48 2ee2 n ALA 76 Ca -0.04 -1.65 -0.17 0.00 0.00 0.00 0.00 53.44 51.58 2ee2 n ALA 76 Cb 0.64 1.05 -0.15 0.00 0.00 0.00 0.00 19.45 20.99 2ee2 n ALA 76 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2ee2 s ARG 77 N -3.26 0.47 -0.01 0.00 3.52 -1.26 -1.56 118.95 116.85 2ee2 s ARG 77 Ca 0.12 -0.07 -0.01 0.00 -0.13 0.00 0.00 55.73 55.64 2ee2 s ARG 77 Cb 0.01 -0.53 -0.04 0.00 -1.56 0.00 0.00 34.95 32.83 2ee2 s ARG 77 CO 0.08 -0.03 0.08 -0.51 -0.81 0.00 0.00 175.30 174.12 2ee2 s LEU 78 N 0.54 3.92 0.07 -0.88 1.43 0.58 -4.96 118.68 119.38 2ee2 s LEU 78 Ca -0.06 0.16 -0.04 0.00 -1.03 0.00 0.00 54.13 53.16 2ee2 s LEU 78 Cb -0.09 -2.28 -0.03 0.00 0.03 0.00 0.00 46.19 43.82 2ee2 s LEU 78 CO -0.01 0.28 0.05 -1.61 0.23 0.00 0.00 176.35 175.29 2ee2 s GLU 79 N -1.72 0.72 -0.61 1.70 2.02 -1.26 -2.67 118.70 116.88 2ee2 s GLU 79 Ca 0.23 -1.16 -0.00 0.00 0.02 0.00 0.00 54.97 54.06 2ee2 s GLU 79 Cb -0.12 0.26 -0.00 0.00 0.10 0.00 0.00 34.13 34.36 2ee2 s GLU 79 CO 0.14 -0.18 0.51 0.09 0.02 0.00 0.00 175.26 175.84 2ee2 n ASN 80 N 0.04 -2.17 -4.69 -0.19 3.02 -1.22 -5.00 115.26 105.05 2ee2 n ASN 80 Ca -0.14 -0.32 -0.24 0.00 -0.03 0.00 0.00 54.58 53.86 2ee2 n ASN 80 Cb 0.62 -2.87 -0.07 0.00 -0.61 0.00 0.00 39.78 36.85 2ee2 n ASN 80 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2ee2 s LEU 81 N -4.23 3.36 0.22 3.41 1.43 -1.26 -5.08 118.68 116.53 2ee2 s LEU 81 Ca 0.01 -0.49 -0.22 0.00 -1.03 0.00 0.00 54.13 52.40 2ee2 s LEU 81 Cb -0.00 -1.92 -0.08 0.00 0.03 0.00 0.00 46.19 44.21 2ee2 s LEU 81 CO 0.37 0.02 0.77 -0.76 0.23 0.00 0.00 176.35 176.98 2ee2 s LEU 82 N -3.51 4.41 0.41 1.79 1.43 -1.26 -4.35 118.68 117.61 2ee2 s LEU 82 Ca 0.31 1.54 -0.25 0.00 -1.03 0.00 0.00 54.13 54.70 2ee2 s LEU 82 Cb -0.07 -3.57 -0.08 0.00 0.03 0.00 0.00 46.19 42.50 2ee2 s LEU 82 CO 0.21 0.07 1.19 -2.16 0.23 0.00 0.00 176.35 175.88 2ee2 s PRO 83 N -1.75 3.98 -1.44 1.29 0.04 -1.26 -3.55 135.00 132.31 2ee2 s PRO 83 Ca 0.42 1.87 -0.03 0.00 0.04 0.00 0.00 61.00 63.30 2ee2 s PRO 83 Cb -0.19 -2.63 0.00 0.00 0.04 0.00 0.00 34.50 31.73 2ee2 s PRO 83 CO 0.23 -0.39 0.29 -3.47 0.04 0.00 0.00 177.00 173.69 2ee2 n ASP 84 N -0.04 -0.24 -3.84 6.66 2.03 -0.50 -4.87 116.55 115.76 2ee2 n ASP 84 Ca 0.05 -1.13 -0.25 0.00 0.52 0.00 0.00 54.79 53.98 2ee2 n ASP 84 Cb 0.46 -2.43 -0.17 0.00 -0.72 0.00 0.00 41.12 38.26 2ee2 n ASP 84 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2ee2 s THR 85 N -4.08 0.71 0.19 5.18 2.01 -1.23 -4.91 115.64 113.51 2ee2 s THR 85 Ca 0.05 -0.11 -0.32 0.00 0.31 0.00 0.00 61.69 61.62 2ee2 s THR 85 Cb -0.02 -0.81 -0.11 0.00 0.01 0.00 0.00 72.50 71.57 2ee2 s THR 85 CO 0.93 0.30 1.68 -1.58 -0.69 0.00 0.00 174.62 175.27 2ee2 s GLN 86 N 1.84 4.15 0.00 4.92 0.74 -1.26 -3.90 119.66 126.14 2ee2 s GLN 86 Ca 0.05 2.54 0.05 0.00 0.05 0.00 0.00 55.36 58.05 2ee2 s GLN 86 Cb -0.13 -3.11 -0.02 0.00 1.10 0.00 0.00 33.01 30.86 2ee2 s GLN 86 CO -0.07 -0.72 -0.17 0.71 -0.55 0.00 0.00 175.29 174.50 2ee2 s TYR 87 N 1.20 1.52 -0.80 1.67 2.02 -0.24 -1.35 117.35 121.38 2ee2 s TYR 87 Ca 0.74 -0.31 -0.11 0.00 -0.37 0.00 0.00 57.07 57.02 2ee2 s TYR 87 Cb -0.48 -0.96 0.21 0.00 -0.40 0.00 0.00 41.96 40.33 2ee2 s TYR 87 CO 0.32 -0.00 0.71 -0.06 -1.57 0.00 0.00 175.55 174.94 2ee2 s PHE 88 N -0.50 3.70 0.21 2.71 0.08 -0.12 -1.06 117.98 123.00 2ee2 s PHE 88 Ca 0.06 -2.19 -0.21 0.00 0.12 0.00 0.00 56.93 54.71 2ee2 s PHE 88 Cb -0.07 -3.67 -0.08 0.00 -0.57 0.00 0.00 43.02 38.62 2ee2 s PHE 88 CO -0.00 -0.95 0.74 0.42 -0.10 0.00 0.00 175.22 175.32 2ee2 s ILE 89 N 0.03 4.53 -0.17 0.64 1.01 -0.59 -3.04 121.20 123.61 2ee2 s ILE 89 Ca 0.18 1.36 -0.15 0.00 0.00 0.00 0.00 60.65 62.05 2ee2 s ILE 89 Cb -0.12 -3.91 0.05 0.00 0.01 0.00 0.00 42.46 38.49 2ee2 s ILE 89 CO -0.08 0.26 0.45 -1.61 0.00 0.00 0.00 174.94 173.97 2ee2 s GLU 90 N -1.83 0.51 -0.09 2.79 8.01 0.17 -2.26 118.70 126.00 2ee2 s GLU 90 Ca 0.42 0.67 -0.02 0.00 0.01 0.00 0.00 54.97 56.04 2ee2 s GLU 90 Cb -0.18 0.22 -0.03 0.00 -4.31 0.00 0.00 34.13 29.82 2ee2 s GLU 90 CO 0.22 -0.08 0.02 0.08 0.01 0.00 0.00 175.26 175.51 2ee2 s VAL 91 N 0.44 4.46 -0.10 2.63 1.01 -1.26 0.10 120.40 127.68 2ee2 s VAL 91 Ca -0.02 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.73 2ee2 s VAL 91 Cb -0.04 -2.88 0.05 0.00 0.00 0.00 0.00 36.38 33.51 2ee2 s VAL 91 CO -0.02 0.61 0.21 -0.83 0.00 0.00 0.00 175.10 175.06 2ee2 s GLY 92 N -0.88 -0.06 -0.15 4.51 0.00 -0.84 -2.03 107.32 107.87 2ee2 s GLY 92 Ca 0.13 0.80 -0.06 0.00 0.00 0.00 0.00 44.72 45.59 2ee2 s GLY 92 CO 0.02 1.50 0.06 0.00 0.00 0.00 0.00 173.10 174.69 2ee2 s ALA 93 N 1.83 3.47 -0.08 3.20 0.00 -1.26 0.44 121.76 129.36 2ee2 s ALA 93 Ca -0.03 -0.74 -0.30 0.00 0.00 0.00 0.00 51.96 50.89 2ee2 s ALA 93 Cb -0.12 -1.84 0.11 0.00 0.00 0.00 0.00 23.12 21.28 2ee2 s ALA 93 CO -0.07 0.35 0.94 0.00 0.00 0.00 0.00 175.76 176.97 2ee2 s ASN 95 N -1.79 4.79 0.34 0.00 4.22 -1.19 -2.25 114.94 119.08 2ee2 s ASN 95 Ca 0.01 -0.60 0.21 0.00 -2.14 0.00 0.00 52.86 50.34 2ee2 s ASN 95 Cb -0.01 -0.92 1.15 0.00 1.28 0.00 0.00 41.25 42.75 2ee2 s ASN 95 CO -0.03 -0.10 1.63 -1.28 -2.04 0.00 0.00 177.10 175.27 2ee2 h SER 96 N 1.69 0.00 0.00 3.54 0.87 -1.95 -3.01 113.55 114.70 2ee2 h SER 96 Ca -0.45 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.11 2ee2 h SER 96 Cb 1.25 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 2ee2 h SER 96 CO 0.61 0.00 -0.00 0.00 -0.53 0.00 0.00 176.83 176.91 2ee2 h ALA 97 N 1.83 -0.17 -2.60 6.23 0.00 -1.94 -3.48 119.26 119.13 2ee2 h ALA 97 Ca 0.00 -0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 2ee2 h ALA 97 Cb 0.13 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 17.77 2ee2 h ALA 97 CO 0.00 -0.17 -0.77 0.20 0.00 0.00 0.00 179.25 178.51 2ee2 s GLY 98 N -1.87 1.80 0.16 0.00 0.00 -0.70 -4.79 107.32 101.91 2ee2 s GLY 98 Ca -0.00 -1.75 0.02 0.00 0.00 0.00 0.00 44.72 42.99 2ee2 s GLY 98 CO 0.00 -1.81 0.30 0.00 0.00 0.00 0.00 173.10 171.59 2ee2 s GLY 100 N -3.22 0.81 0.38 0.00 0.00 -1.26 -4.28 107.32 99.74 2ee2 s GLY 100 Ca 0.35 -1.37 -0.26 0.00 0.00 0.00 0.00 44.72 43.44 2ee2 s GLY 100 CO 0.29 -1.46 1.20 2.56 0.00 0.00 0.00 173.10 175.68 2ee2 s PRO 101 N -3.84 4.13 1.18 2.90 0.04 -1.26 -4.94 135.00 133.21 2ee2 s PRO 101 Ca 0.13 1.93 -0.18 0.00 0.04 0.00 0.00 61.00 62.91 2ee2 s PRO 101 Cb 0.05 -2.79 0.28 0.00 0.04 0.00 0.00 34.50 32.08 2ee2 s PRO 101 CO -0.04 -0.28 1.11 -1.25 0.04 0.00 0.00 177.00 176.58 2ee2 s PRO 102 N -2.14 -1.05 0.49 0.56 0.04 -1.26 -4.66 135.00 126.97 2ee2 s PRO 102 Ca 0.55 -0.00 0.02 0.00 0.04 0.00 0.00 61.00 61.61 2ee2 s PRO 102 Cb -0.33 -1.61 0.02 0.00 0.04 0.00 0.00 34.50 32.62 2ee2 s PRO 102 CO 0.42 -3.61 0.70 -1.54 0.04 0.00 0.00 177.00 173.00 2ee2 s SER 103 N -3.84 5.52 0.36 6.66 1.04 -0.86 -4.86 113.70 117.72 2ee2 s SER 103 Ca 0.70 -0.02 -0.26 0.00 0.48 0.00 0.00 55.95 56.85 2ee2 s SER 103 Cb -0.11 -1.02 -0.12 0.00 0.10 0.00 0.00 66.02 64.87 2ee2 s SER 103 CO 0.56 -0.93 1.06 0.47 0.98 0.00 0.00 173.24 175.39 2ee2 n ASP 104 N -2.15 1.57 -4.58 7.02 9.92 -1.26 -4.77 116.55 122.29 2ee2 n ASP 104 Ca 0.06 1.12 -0.42 0.00 -0.53 0.00 0.00 54.79 55.02 2ee2 n ASP 104 Cb 0.59 -1.36 -0.03 0.00 -0.64 0.00 0.00 41.12 39.69 2ee2 n ASP 104 CO 0.00 0.00 0.00 -0.32 0.13 0.00 0.00 177.20 177.01 2ee2 s MET 105 N -1.82 3.25 0.09 -1.24 -2.45 -1.26 -4.75 119.30 111.11 2ee2 s MET 105 Ca 0.60 0.76 -0.06 0.00 -1.25 0.00 0.00 55.69 55.74 2ee2 s MET 105 Cb -0.61 -4.16 -0.05 0.00 1.25 0.00 0.00 34.83 31.25 2ee2 s MET 105 CO 0.59 -1.98 0.35 0.42 1.05 0.00 0.00 175.02 175.45 2ee2 s ILE 106 N 6.61 5.19 -0.02 10.11 1.01 -0.96 -4.99 121.20 138.14 2ee2 s ILE 106 Ca 0.62 0.17 0.05 0.00 0.00 0.00 0.00 60.65 61.49 2ee2 s ILE 106 Cb -0.14 -3.62 -0.03 0.00 0.01 0.00 0.00 42.46 38.69 2ee2 s ILE 106 CO 0.27 0.19 -0.18 -1.83 0.00 0.00 0.00 174.94 173.40 2ee2 s GLU 107 N -2.22 2.32 0.04 2.79 4.04 -1.26 -1.55 118.70 122.85 2ee2 s GLU 107 Ca 0.35 -0.81 0.02 0.00 0.04 0.00 0.00 54.97 54.57 2ee2 s GLU 107 Cb -0.13 -2.26 -0.02 0.00 0.02 0.00 0.00 34.13 31.74 2ee2 s GLU 107 CO 0.21 0.59 -0.06 0.00 -1.84 0.00 0.00 175.26 174.15 2ee2 s ALA 108 N -0.75 0.47 -0.27 -0.84 0.00 -0.22 -4.97 121.76 115.18 2ee2 s ALA 108 Ca 0.12 -0.75 0.02 0.00 0.00 0.00 0.00 51.96 51.35 2ee2 s ALA 108 Cb -0.10 0.08 0.07 0.00 0.00 0.00 0.00 23.12 23.16 2ee2 s ALA 108 CO 0.01 -0.07 -0.05 -0.06 0.00 0.00 0.00 175.76 175.59 2ee2 s PHE 109 N -1.52 3.01 0.94 0.00 0.40 -1.26 -1.08 117.98 118.47 2ee2 s PHE 109 Ca -0.11 -2.24 -0.11 0.00 -0.60 0.00 0.00 56.93 53.87 2ee2 s PHE 109 Cb -0.09 -1.99 0.16 0.00 0.51 0.00 0.00 43.02 41.61 2ee2 s PHE 109 CO -0.00 -0.86 1.10 0.95 0.70 0.00 0.00 175.22 177.11 2ee2 s THR 110 N 1.18 2.42 0.69 0.64 -4.23 -1.25 -4.93 115.64 110.16 2ee2 s THR 110 Ca -0.04 0.14 -0.11 0.00 -1.18 0.00 0.00 61.69 60.50 2ee2 s THR 110 Cb -0.19 -2.37 0.00 0.00 1.34 0.00 0.00 72.50 71.28 2ee2 s THR 110 CO -0.07 -0.18 1.08 -0.54 -0.54 0.00 0.00 174.62 174.37 2ee2 s LYS 111 N -4.73 2.99 -0.15 3.99 -0.14 -1.26 -3.15 119.74 117.29 2ee2 s LYS 111 Ca 0.65 0.55 -0.29 0.00 -1.36 0.00 0.00 55.97 55.53 2ee2 s LYS 111 Cb -0.21 -2.03 -0.01 0.00 -1.68 0.00 0.00 37.83 33.91 2ee2 s LYS 111 CO 0.59 -0.96 0.99 0.15 -0.76 0.00 0.00 175.35 175.35 2ee2 s LYS 112 N -5.30 4.36 0.23 1.68 1.02 -1.26 -1.41 119.74 119.07 2ee2 s LYS 112 Ca 0.58 1.33 -0.32 0.00 0.02 0.00 0.00 55.97 57.57 2ee2 s LYS 112 Cb -0.11 -3.57 -0.13 0.00 -0.52 0.00 0.00 37.83 33.49 2ee2 s LYS 112 CO 0.53 -0.39 1.49 0.00 -0.92 0.00 0.00 175.35 176.05 2ee2 n ALA 113 N 5.37 1.49 -3.74 5.17 0.00 -1.26 -4.96 120.51 122.57 2ee2 n ALA 113 Ca 0.09 0.41 -0.30 0.00 0.00 0.00 0.00 53.44 53.64 2ee2 n ALA 113 Cb 0.48 -2.34 -0.14 0.00 0.00 0.00 0.00 19.45 17.46 2ee2 n ALA 113 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2ee2 s SER 114 N 0.51 3.84 0.06 0.00 0.15 -1.26 -5.09 113.70 111.92 2ee2 s SER 114 Ca 0.70 -2.34 0.00 0.00 0.70 0.00 0.00 55.95 55.01 2ee2 s SER 114 Cb -0.62 -1.04 0.00 0.00 -1.71 0.00 0.00 66.02 62.64 2ee2 s SER 114 CO 0.46 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 175.19 2ee2 n GLY 115 N 3.93 -2.17 3.77 9.45 0.00 -1.26 -4.89 105.19 114.02 2ee2 n GLY 115 Ca 0.05 -1.47 -0.38 0.00 0.00 0.00 0.00 46.02 44.23 2ee2 n GLY 115 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ee2 s PRO 116 N -0.90 3.87 -0.36 1.61 0.04 -1.26 -4.99 135.00 133.02 2ee2 s PRO 116 Ca 0.00 1.82 -0.26 0.00 0.04 0.00 0.00 61.00 62.60 2ee2 s PRO 116 Cb 0.00 -2.52 0.01 0.00 0.04 0.00 0.00 34.50 32.03 2ee2 s PRO 116 CO 0.00 -0.47 0.93 -1.54 0.04 0.00 0.00 177.00 175.96 2ee2 s SER 117 N -1.25 6.70 -0.31 6.66 1.04 -1.26 -5.01 113.70 120.28 2ee2 s SER 117 Ca 0.61 0.63 0.02 0.00 0.48 0.00 0.00 55.95 57.69 2ee2 s SER 117 Cb -0.30 -2.47 0.09 0.00 0.10 0.00 0.00 66.02 63.44 2ee2 s SER 117 CO 0.37 -0.84 0.02 -0.55 0.98 0.00 0.00 173.24 173.23 2ee2 s SER 118 N 1.83 4.41 0.00 7.02 0.15 -1.26 -5.27 113.70 120.58 2ee2 s SER 118 Ca 0.38 -1.79 0.00 0.00 0.70 0.00 0.00 55.95 55.24 2ee2 s SER 118 Cb -0.12 -1.37 0.00 0.00 -1.71 0.00 0.00 66.02 62.81 2ee2 s SER 118 CO 0.18 -0.34 0.00 0.61 1.20 0.00 0.00 173.24 174.89