#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 6.28 0.06 1.61 0.01 -1.26 -4.91 113.70 115.49 2ee2 s SER 2 Ca 0.00 1.09 -0.34 0.00 1.31 0.00 0.00 55.95 58.01 2ee2 s SER 2 Cb 0.00 -2.54 -0.19 0.00 0.21 0.00 0.00 66.02 63.50 2ee2 s SER 2 CO 0.00 -1.43 1.52 0.28 0.41 0.00 0.00 173.24 174.03 2ee2 h SER 3 N 11.02 -0.89 0.00 2.44 0.02 -2.14 -3.48 113.55 120.52 2ee2 h SER 3 Ca -0.30 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 2ee2 h SER 3 Cb 1.12 0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.89 2ee2 h SER 3 CO 1.06 -0.60 0.00 0.61 -1.14 0.00 0.00 176.83 176.75 2ee2 n GLY 4 N -1.39 3.09 3.69 -3.77 0.00 -1.26 -5.19 105.19 100.35 2ee2 n GLY 4 Ca -0.14 -0.25 -0.06 0.00 0.00 0.00 0.00 46.02 45.57 2ee2 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ee2 s SER 5 N 0.00 -0.28 -0.00 1.61 1.04 -1.26 -5.19 113.70 109.62 2ee2 s SER 5 Ca 0.00 -0.33 -0.28 0.00 0.48 0.00 0.00 55.95 55.82 2ee2 s SER 5 Cb 0.00 0.54 0.09 0.00 0.10 0.00 0.00 66.02 66.75 2ee2 s SER 5 CO 0.00 -0.96 0.76 -0.94 0.98 0.00 0.00 173.24 173.08 2ee2 s SER 6 N -2.83 -0.52 0.03 7.02 1.04 -1.26 -5.18 113.70 112.01 2ee2 s SER 6 Ca 0.09 0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.83 2ee2 s SER 6 Cb -0.02 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.57 2ee2 s SER 6 CO -0.01 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.16 2ee2 n GLY 7 N 0.27 1.54 3.66 7.32 0.00 -1.26 -5.00 105.19 111.72 2ee2 n GLY 7 Ca -0.15 -2.00 -0.49 0.00 0.00 0.00 0.00 46.02 43.38 2ee2 n GLY 7 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2ee2 n VAL 8 N -0.26 0.18 -3.65 1.61 3.14 -1.26 -4.94 118.33 113.15 2ee2 n VAL 8 Ca 0.00 -0.03 -0.07 0.00 -2.96 0.00 0.00 64.34 61.28 2ee2 n VAL 8 Cb 0.00 -1.42 -0.02 0.00 -1.06 0.00 0.00 33.84 31.34 2ee2 n VAL 8 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2ee2 s ALA 9 N 1.89 -1.63 -0.28 1.55 0.00 -1.26 -5.18 121.76 116.84 2ee2 s ALA 9 Ca 0.86 0.37 -0.23 0.00 0.00 0.00 0.00 51.96 52.96 2ee2 s ALA 9 Cb -0.79 0.64 0.11 0.00 0.00 0.00 0.00 23.12 23.08 2ee2 s ALA 9 CO 0.46 -0.90 0.95 0.54 0.00 0.00 0.00 175.76 176.81 2ee2 s VAL 10 N -3.39 0.00 -0.81 0.00 0.11 -1.26 -5.11 120.40 109.93 2ee2 s VAL 10 Ca 0.08 0.00 -0.17 0.00 -2.93 0.00 0.00 61.98 58.97 2ee2 s VAL 10 Cb -0.02 -1.00 0.16 0.00 -1.53 0.00 0.00 36.38 34.00 2ee2 s VAL 10 CO -0.02 0.00 0.88 -0.63 -3.33 0.00 0.00 175.10 171.99 2ee2 s ILE 11 N 0.51 5.14 0.07 7.04 1.01 -1.26 -5.02 121.20 128.69 2ee2 s ILE 11 Ca 0.00 -1.86 -0.35 0.00 0.00 0.00 0.00 60.65 58.44 2ee2 s ILE 11 Cb -0.05 -4.58 -0.18 0.00 0.01 0.00 0.00 42.46 37.66 2ee2 s ILE 11 CO -0.07 -1.21 0.85 -3.20 0.00 0.00 0.00 174.94 171.31 2ee2 n ASN 12 N 5.35 -0.44 -3.74 3.58 5.15 -1.26 -4.94 115.26 118.95 2ee2 n ASN 12 Ca 0.12 1.12 -0.07 0.00 -0.60 0.00 0.00 54.58 55.15 2ee2 n ASN 12 Cb 0.47 -0.91 -0.01 0.00 -0.53 0.00 0.00 39.78 38.80 2ee2 n ASN 12 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2ee2 s SER 13 N -0.35 -0.23 -0.00 1.20 1.04 -1.26 -5.18 113.70 108.93 2ee2 s SER 13 Ca 0.79 -0.68 0.03 0.00 0.48 0.00 0.00 55.95 56.57 2ee2 s SER 13 Cb -1.12 0.74 -0.01 0.00 0.10 0.00 0.00 66.02 65.74 2ee2 s SER 13 CO 0.55 -1.39 -0.09 0.00 0.98 0.00 0.00 173.24 173.29 2ee2 s ALA 14 N -3.71 0.78 0.10 5.32 0.00 -1.26 -5.06 121.76 117.93 2ee2 s ALA 14 Ca 0.12 -0.44 -0.26 0.00 0.00 0.00 0.00 51.96 51.38 2ee2 s ALA 14 Cb -0.06 -0.18 -0.10 0.00 0.00 0.00 0.00 23.12 22.78 2ee2 s ALA 14 CO 0.08 0.18 1.66 -0.56 0.00 0.00 0.00 175.76 177.11 2ee2 h GLN 15 N 5.79 -0.39 0.00 0.00 3.07 -2.00 -3.47 115.11 118.10 2ee2 h GLN 15 Ca -0.31 0.03 -0.01 0.00 0.09 0.00 0.00 58.65 58.44 2ee2 h GLN 15 Cb 1.18 0.09 0.01 0.00 0.08 0.00 0.00 27.48 28.83 2ee2 h GLN 15 CO 0.49 -0.26 0.20 -3.47 0.09 0.00 0.00 178.83 175.88 2ee2 n ASP 16 N -5.33 -1.56 -3.56 0.06 -0.08 -1.26 -5.13 116.55 99.70 2ee2 n ASP 16 Ca -0.07 -2.07 -0.17 0.00 -1.51 0.00 0.00 54.79 50.97 2ee2 n ASP 16 Cb 0.24 2.59 -0.06 0.00 2.34 0.00 0.00 41.12 46.23 2ee2 n ASP 16 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2ee2 s ALA 17 N -1.74 -1.69 0.28 -1.67 0.00 -1.26 -2.84 121.76 112.84 2ee2 s ALA 17 Ca 0.11 1.35 -0.29 0.00 0.00 0.00 0.00 51.96 53.13 2ee2 s ALA 17 Cb -0.03 -0.17 -0.10 0.00 0.00 0.00 0.00 23.12 22.82 2ee2 s ALA 17 CO 0.08 -0.36 1.25 -1.25 0.00 0.00 0.00 175.76 175.48 2ee2 s PRO 18 N -0.95 4.44 0.00 0.00 0.04 -1.26 -4.93 135.00 132.34 2ee2 s PRO 18 Ca -0.09 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.00 2ee2 s PRO 18 Cb -0.01 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.39 2ee2 s PRO 18 CO 0.08 -0.09 0.00 0.43 0.04 0.00 0.00 177.00 177.46 2ee2 n SER 19 N 1.39 2.81 -4.87 6.66 7.64 -1.26 -4.57 113.62 121.41 2ee2 n SER 19 Ca 0.01 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.55 2ee2 n SER 19 Cb 0.43 0.11 -0.05 0.00 -1.01 0.00 0.00 64.21 63.68 2ee2 n SER 19 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2ee2 s GLU 20 N -1.65 3.75 -0.02 1.43 2.56 -1.26 -4.93 118.70 118.58 2ee2 s GLU 20 Ca 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 54.97 55.11 2ee2 s GLU 20 Cb 0.00 -2.96 -0.04 0.00 2.00 0.00 0.00 34.13 33.14 2ee2 s GLU 20 CO 0.00 0.53 0.07 0.00 -0.56 0.00 0.00 175.26 175.30 2ee2 s ALA 21 N -1.46 3.55 -0.68 6.30 0.00 -1.26 -4.89 121.76 123.32 2ee2 s ALA 21 Ca 0.35 -0.86 -0.26 0.00 0.00 0.00 0.00 51.96 51.19 2ee2 s ALA 21 Cb -0.14 -1.57 -0.03 0.00 0.00 0.00 0.00 23.12 21.38 2ee2 s ALA 21 CO 0.19 0.67 1.88 -1.25 0.00 0.00 0.00 175.76 177.26 2ee2 s PRO 22 N -1.60 2.61 0.93 0.00 0.04 -1.26 -4.91 135.00 130.80 2ee2 s PRO 22 Ca 0.21 0.39 -0.16 0.00 0.04 0.00 0.00 61.00 61.49 2ee2 s PRO 22 Cb -0.12 -4.55 0.21 0.00 0.04 0.00 0.00 34.50 30.09 2ee2 s PRO 22 CO 0.12 -2.89 1.26 2.41 0.04 0.00 0.00 177.00 177.94 2ee2 n THR 23 N 7.37 0.00 -3.91 1.26 -1.04 -1.26 -4.29 114.28 112.40 2ee2 n THR 23 Ca 0.25 -0.92 -0.30 0.00 -2.04 0.00 0.00 64.05 61.04 2ee2 n THR 23 Cb 0.51 -1.54 0.03 0.00 -1.82 0.00 0.00 70.33 67.51 2ee2 n THR 23 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2ee2 n GLU 24 N -3.67 -5.58 -3.20 -2.82 1.02 -1.26 -2.70 120.64 102.43 2ee2 n GLU 24 Ca 0.16 0.60 -0.44 0.00 -0.02 0.00 0.00 57.16 57.46 2ee2 n GLU 24 Cb 0.55 -5.50 -0.07 0.00 -0.02 0.00 0.00 31.44 26.40 2ee2 n GLU 24 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2ee2 s VAL 25 N -3.30 4.93 0.51 2.62 0.11 -1.26 -4.08 120.40 119.93 2ee2 s VAL 25 Ca 0.67 -0.46 0.06 0.00 -2.93 0.00 0.00 61.98 59.32 2ee2 s VAL 25 Cb -0.33 -4.24 0.02 0.00 -1.53 0.00 0.00 36.38 30.30 2ee2 s VAL 25 CO 0.83 -0.71 0.36 -0.83 -3.33 0.00 0.00 175.10 171.42 2ee2 s GLY 26 N 2.49 2.37 -0.03 6.54 0.00 -0.43 -4.98 107.32 113.27 2ee2 s GLY 26 Ca 0.14 -1.40 -0.01 0.00 0.00 0.00 0.00 44.72 43.45 2ee2 s GLY 26 CO 0.12 -1.92 0.05 -1.34 0.00 0.00 0.00 173.10 170.02 2ee2 s VAL 27 N -2.72 -0.10 -0.13 1.40 -7.23 -1.26 -1.90 120.40 108.47 2ee2 s VAL 27 Ca 0.35 0.37 -0.03 0.00 -1.81 0.00 0.00 61.98 60.87 2ee2 s VAL 27 Cb -0.01 -0.13 -0.03 0.00 0.56 0.00 0.00 36.38 36.76 2ee2 s VAL 27 CO 0.21 0.16 -0.03 -0.75 -0.31 0.00 0.00 175.10 174.39 2ee2 s LYS 28 N 1.89 3.37 -0.37 4.82 2.20 0.63 -4.98 119.74 127.30 2ee2 s LYS 28 Ca 0.01 -0.48 -0.24 0.00 -0.36 0.00 0.00 55.97 54.91 2ee2 s LYS 28 Cb -0.12 -2.85 0.01 0.00 -1.51 0.00 0.00 37.83 33.36 2ee2 s LYS 28 CO -0.03 0.43 0.81 0.08 -0.36 0.00 0.00 175.35 176.28 2ee2 s VAL 29 N -0.15 4.70 -0.08 4.02 1.01 -1.26 -0.49 120.40 128.15 2ee2 s VAL 29 Ca 0.03 0.89 -0.19 0.00 0.00 0.00 0.00 61.98 62.72 2ee2 s VAL 29 Cb -0.13 -4.24 -0.29 0.00 0.00 0.00 0.00 36.38 31.72 2ee2 s VAL 29 CO 0.02 -0.48 0.70 -0.07 0.00 0.00 0.00 175.10 175.26 2ee2 h LEU 30 N 9.85 0.41 0.00 3.92 3.38 -0.83 -3.48 115.31 128.55 2ee2 h LEU 30 Ca -0.24 -0.89 0.04 0.00 0.09 0.00 0.00 57.88 56.88 2ee2 h LEU 30 Cb 1.09 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 2ee2 h LEU 30 CO 0.93 1.52 0.39 -1.20 0.09 0.00 0.00 178.44 180.17 2ee2 n SER 31 N -4.02 -2.03 -0.34 -0.43 7.64 0.35 -4.92 113.62 109.85 2ee2 n SER 31 Ca -0.20 -2.29 0.15 0.00 1.01 0.00 0.00 58.87 57.54 2ee2 n SER 31 Cb 0.86 3.36 0.35 0.00 -1.01 0.00 0.00 64.21 67.77 2ee2 n SER 31 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2ee2 h SER 32 N 1.93 0.69 -0.80 6.43 4.64 -1.91 -1.68 113.55 122.85 2ee2 h SER 32 Ca -0.30 0.12 -0.51 0.00 -0.47 0.00 0.00 61.79 60.63 2ee2 h SER 32 Cb 1.19 0.01 -0.42 0.00 -0.31 0.00 0.00 62.40 62.87 2ee2 h SER 32 CO 0.39 0.16 -0.86 -1.54 -0.87 0.00 0.00 176.83 174.12 2ee2 n SER 33 N -4.85 4.39 -3.67 4.97 3.41 -1.26 -4.07 113.62 112.54 2ee2 n SER 33 Ca 0.25 -3.50 -0.08 0.00 -0.26 0.00 0.00 58.87 55.28 2ee2 n SER 33 Cb 0.67 -0.38 -0.09 0.00 -0.26 0.00 0.00 64.21 64.15 2ee2 n SER 33 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2ee2 s GLU 34 N -3.61 0.37 -0.10 4.33 2.02 -0.63 -3.70 118.70 117.37 2ee2 s GLU 34 Ca 0.47 1.02 -0.05 0.00 0.02 0.00 0.00 54.97 56.43 2ee2 s GLU 34 Cb 0.40 0.28 0.05 0.00 0.10 0.00 0.00 34.13 34.96 2ee2 s GLU 34 CO 0.00 -0.22 0.23 0.42 0.02 0.00 0.00 175.26 175.71 2ee2 s ILE 35 N 2.31 -0.16 -0.17 -1.63 1.01 -0.83 -0.06 121.20 121.66 2ee2 s ILE 35 Ca -0.04 0.21 -0.09 0.00 0.00 0.00 0.00 60.65 60.73 2ee2 s ILE 35 Cb -0.11 -0.37 -0.05 0.00 0.01 0.00 0.00 42.46 41.94 2ee2 s ILE 35 CO -0.14 0.09 0.12 -0.55 0.00 0.00 0.00 174.94 174.46 2ee2 s SER 36 N 1.65 6.19 -0.32 3.58 0.15 0.36 0.59 113.70 125.90 2ee2 s SER 36 Ca -0.05 0.28 -0.03 0.00 0.70 0.00 0.00 55.95 56.85 2ee2 s SER 36 Cb -0.11 -2.06 0.05 0.00 -1.71 0.00 0.00 66.02 62.19 2ee2 s SER 36 CO -0.08 0.25 0.04 -0.69 1.20 0.00 0.00 173.24 173.95 2ee2 s VAL 37 N -0.05 3.17 0.14 4.45 1.01 -0.38 -0.27 120.40 128.47 2ee2 s VAL 37 Ca 0.10 -1.39 -0.02 0.00 0.00 0.00 0.00 61.98 60.67 2ee2 s VAL 37 Cb -0.11 -2.85 -0.05 0.00 0.00 0.00 0.00 36.38 33.37 2ee2 s VAL 37 CO -0.00 -0.17 0.33 -1.00 0.00 0.00 0.00 175.10 174.26 2ee2 s HIS 38 N 1.27 3.49 0.16 5.22 3.76 -0.80 -0.69 115.29 127.70 2ee2 s HIS 38 Ca -0.03 0.36 -0.18 0.00 -0.15 0.00 0.00 55.06 55.06 2ee2 s HIS 38 Cb -0.20 -1.86 0.04 0.00 1.11 0.00 0.00 32.58 31.67 2ee2 s HIS 38 CO -0.01 0.47 0.49 1.67 -0.85 0.00 0.00 174.74 176.51 2ee2 s TRP 39 N -1.69 -0.24 0.34 1.40 -2.14 -0.75 -1.31 118.94 114.56 2ee2 s TRP 39 Ca 0.38 -0.07 -0.09 0.00 2.66 0.00 0.00 56.10 58.98 2ee2 s TRP 39 Cb -0.12 0.37 -0.06 0.00 -3.10 0.00 0.00 33.47 30.56 2ee2 s TRP 39 CO 0.27 -0.82 0.68 -2.00 -2.66 0.00 0.00 176.95 172.42 2ee2 s GLU 40 N -3.82 3.75 -0.03 3.25 -6.30 -1.10 -4.72 118.70 109.74 2ee2 s GLU 40 Ca 0.05 0.32 -0.30 0.00 -2.50 0.00 0.00 54.97 52.54 2ee2 s GLU 40 Cb 0.00 -2.50 -0.03 0.00 0.00 0.00 0.00 34.13 31.60 2ee2 s GLU 40 CO -0.08 0.10 0.98 -1.01 0.02 0.00 0.00 175.26 175.26 2ee2 s HIS 41 N -2.19 3.62 1.00 5.30 3.76 -1.26 -4.59 115.29 120.93 2ee2 s HIS 41 Ca 0.49 1.65 -0.12 0.00 -0.15 0.00 0.00 55.06 56.93 2ee2 s HIS 41 Cb -0.10 -3.13 0.19 0.00 1.11 0.00 0.00 32.58 30.65 2ee2 s HIS 41 CO 0.29 -0.06 1.09 0.14 -0.85 0.00 0.00 174.74 175.34 2ee2 s VAL 42 N 1.27 2.07 0.08 -0.90 -7.23 -1.26 -4.96 120.40 109.47 2ee2 s VAL 42 Ca 0.50 0.02 0.13 0.00 -1.81 0.00 0.00 61.98 60.83 2ee2 s VAL 42 Cb -0.20 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.23 2ee2 s VAL 42 CO 0.25 -0.03 1.52 0.17 -0.31 0.00 0.00 175.10 176.70 2ee2 h LEU 43 N -1.92 0.00 -8.83 1.32 8.10 -1.94 -3.42 115.31 108.62 2ee2 h LEU 43 Ca -0.55 0.00 -0.62 0.00 0.11 0.00 0.00 57.88 56.83 2ee2 h LEU 43 Cb 1.33 0.00 -0.12 0.00 -0.44 0.00 0.00 40.66 41.43 2ee2 h LEU 43 CO 0.57 0.61 0.29 -1.61 -4.11 0.00 0.00 178.44 174.20 2ee2 s GLU 44 N -3.20 3.79 0.00 0.17 2.02 -1.26 -4.91 118.70 115.31 2ee2 s GLU 44 Ca 0.01 0.29 0.16 0.00 0.02 0.00 0.00 54.97 55.46 2ee2 s GLU 44 Cb 0.10 -3.78 0.58 0.00 0.10 0.00 0.00 34.13 31.12 2ee2 s GLU 44 CO 0.75 -0.76 1.43 1.63 0.02 0.00 0.00 175.26 178.33 2ee2 n LYS 45 N 6.22 1.71 0.23 1.61 4.01 -1.26 -3.80 118.16 126.87 2ee2 n LYS 45 Ca 0.02 -1.08 0.13 0.00 -0.51 0.00 0.00 58.31 56.86 2ee2 n LYS 45 Cb 0.48 -1.33 0.31 0.00 -0.51 0.00 0.00 35.03 33.98 2ee2 n LYS 45 CO 0.00 0.00 0.00 -0.84 -1.11 0.00 0.00 177.40 175.45 2ee2 h ILE 46 N 1.99 0.09 -2.94 -0.18 -0.00 -1.98 -3.46 117.51 111.04 2ee2 h ILE 46 Ca 0.00 -0.96 -0.58 0.00 -0.00 0.00 0.00 64.86 63.31 2ee2 h ILE 46 Cb 0.44 1.89 0.11 0.00 -0.00 0.00 0.00 36.82 39.26 2ee2 h ILE 46 CO 0.00 0.04 0.39 1.33 -0.00 0.00 0.00 178.15 179.91 2ee2 n VAL 47 N -3.12 1.87 -0.05 0.16 0.24 -1.25 -4.57 118.33 111.61 2ee2 n VAL 47 Ca 0.03 -0.47 -0.13 0.00 -2.04 0.00 0.00 64.34 61.73 2ee2 n VAL 47 Cb 0.48 -1.35 -0.11 0.00 -1.47 0.00 0.00 33.84 31.38 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 2.55 -0.01 -2.40 7.34 4.39 -1.37 -3.46 114.58 121.62 2ee2 h GLU 48 Ca -0.44 0.00 0.17 0.00 0.34 0.00 0.00 59.36 59.44 2ee2 h GLU 48 Cb 1.30 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.90 2ee2 h GLU 48 CO 0.63 0.78 0.54 -1.54 -1.16 0.00 0.00 179.01 178.26 2ee2 s SER 49 N -6.01 -0.08 -0.38 1.42 1.04 -1.18 -4.05 113.70 104.46 2ee2 s SER 49 Ca -0.17 -0.53 -0.12 0.00 0.48 0.00 0.00 55.95 55.61 2ee2 s SER 49 Cb -0.01 0.49 0.02 0.00 0.10 0.00 0.00 66.02 66.62 2ee2 s SER 49 CO 0.65 -0.94 0.23 -0.31 0.98 0.00 0.00 173.24 173.85 2ee2 s TYR 50 N -2.72 3.24 -0.22 5.02 1.51 -1.25 -3.15 117.35 119.78 2ee2 s TYR 50 Ca 0.17 -0.83 -0.26 0.00 -1.01 0.00 0.00 57.07 55.14 2ee2 s TYR 50 Cb -0.02 -2.47 -0.01 0.00 -0.11 0.00 0.00 41.96 39.35 2ee2 s TYR 50 CO 0.04 -0.61 0.87 -1.14 -1.11 0.00 0.00 175.55 173.59 2ee2 s GLN 51 N 1.59 4.23 -0.32 -0.62 0.74 -0.83 -3.88 119.66 120.57 2ee2 s GLN 51 Ca 0.03 1.04 -0.09 0.00 0.05 0.00 0.00 55.36 56.39 2ee2 s GLN 51 Cb -0.19 -3.62 0.00 0.00 1.10 0.00 0.00 33.01 30.30 2ee2 s GLN 51 CO 0.08 -0.48 0.15 0.42 -0.55 0.00 0.00 175.29 174.90 2ee2 s ILE 52 N 2.69 4.44 -0.29 -2.34 1.09 -0.87 -2.64 121.20 123.29 2ee2 s ILE 52 Ca 0.38 -0.58 -0.09 0.00 -1.10 0.00 0.00 60.65 59.25 2ee2 s ILE 52 Cb -0.16 -3.32 -0.02 0.00 -1.06 0.00 0.00 42.46 37.90 2ee2 s ILE 52 CO 0.09 0.00 0.13 -0.60 -0.10 0.00 0.00 174.94 174.47 2ee2 s ARG 53 N 1.57 3.54 -0.02 2.79 3.52 -0.75 -1.49 118.95 128.12 2ee2 s ARG 53 Ca 0.03 -0.58 0.03 0.00 -0.13 0.00 0.00 55.73 55.09 2ee2 s ARG 53 Cb -0.18 -3.51 -0.00 0.00 -1.56 0.00 0.00 34.95 29.70 2ee2 s ARG 53 CO 0.05 -0.31 -0.10 1.52 -0.81 0.00 0.00 175.30 175.66 2ee2 s TYR 54 N 1.64 0.99 -0.01 5.12 1.13 -1.17 -2.37 117.35 122.68 2ee2 s TYR 54 Ca 0.06 -0.22 -0.26 0.00 -1.41 0.00 0.00 57.07 55.24 2ee2 s TYR 54 Cb -0.16 -0.67 0.06 0.00 -1.10 0.00 0.00 41.96 40.09 2ee2 s TYR 54 CO 0.06 -0.06 0.57 1.67 -2.51 0.00 0.00 175.55 175.29 2ee2 s TRP 55 N -0.05 -0.51 0.33 -3.49 -2.14 -1.23 -2.80 118.94 109.06 2ee2 s TRP 55 Ca 0.01 0.77 -0.28 0.00 2.66 0.00 0.00 56.10 59.26 2ee2 s TRP 55 Cb -0.06 0.35 -0.10 0.00 -3.10 0.00 0.00 33.47 30.56 2ee2 s TRP 55 CO 0.00 -0.60 1.21 0.00 -2.66 0.00 0.00 176.95 174.91 2ee2 s ALA 56 N -1.69 3.38 0.57 2.67 0.00 -1.26 -2.56 121.76 122.86 2ee2 s ALA 56 Ca -0.09 1.08 0.36 0.00 0.00 0.00 0.00 51.96 53.32 2ee2 s ALA 56 Cb -0.01 -3.41 1.45 0.00 0.00 0.00 0.00 23.12 21.15 2ee2 s ALA 56 CO 0.05 -0.48 1.67 0.00 0.00 0.00 0.00 175.76 177.00 2ee2 h ALA 57 N 3.31 3.09 0.06 0.00 0.00 -1.92 1.26 119.26 125.06 2ee2 h ALA 57 Ca -0.48 -0.04 -0.23 0.00 0.00 0.00 0.00 54.91 54.15 2ee2 h ALA 57 Cb 1.22 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 2ee2 h ALA 57 CO 0.65 -1.60 -1.07 1.12 0.00 0.00 0.00 179.25 178.34 2ee2 h HIS 58 N 0.00 0.30 -3.63 0.00 2.07 -1.89 -3.46 115.15 108.54 2ee2 h HIS 58 Ca 0.57 -0.20 -0.43 0.00 -2.85 0.00 0.00 60.37 57.45 2ee2 h HIS 58 Cb 2.54 -0.02 0.18 0.00 2.57 0.00 0.00 27.41 32.68 2ee2 h HIS 58 CO 0.00 1.12 0.14 0.34 -3.07 0.00 0.00 177.93 176.45 2ee2 s ASP 59 N -6.96 1.57 0.34 3.10 2.15 0.43 -5.07 116.67 112.24 2ee2 s ASP 59 Ca -0.02 0.95 0.08 0.00 0.43 0.00 0.00 52.55 53.99 2ee2 s ASP 59 Cb 0.09 -1.45 -0.03 0.00 -0.30 0.00 0.00 42.92 41.23 2ee2 s ASP 59 CO 0.85 -3.76 0.23 -0.54 -0.17 0.00 0.00 175.17 171.78 2ee2 s LYS 60 N -5.11 2.56 0.51 4.34 -0.14 -1.26 -4.84 119.74 115.80 2ee2 s LYS 60 Ca 0.68 -1.42 0.34 0.00 -1.36 0.00 0.00 55.97 54.21 2ee2 s LYS 60 Cb -0.15 -2.33 1.64 0.00 -1.68 0.00 0.00 37.83 35.30 2ee2 s LYS 60 CO 0.58 0.09 2.03 1.49 -0.76 0.00 0.00 175.35 178.77 2ee2 h GLU 61 N 1.38 0.00 0.00 1.68 4.81 -1.97 -1.31 114.58 119.17 2ee2 h GLU 61 Ca -0.44 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 2ee2 h GLU 61 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 2ee2 h GLU 61 CO 0.61 0.00 -0.84 1.05 -0.73 0.00 0.00 179.01 179.10 2ee2 h GLU 62 N 0.00 0.00 -0.68 1.92 4.11 -2.04 -3.30 114.58 114.60 2ee2 h GLU 62 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2ee2 h GLU 62 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2ee2 h GLU 62 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 179.01 179.08 2ee2 n ALA 63 N -2.13 2.73 -2.28 1.06 0.00 -0.52 -4.96 120.51 114.42 2ee2 n ALA 63 Ca 0.01 -1.46 -0.41 0.00 0.00 0.00 0.00 53.44 51.58 2ee2 n ALA 63 Cb 0.53 -0.95 -0.04 0.00 0.00 0.00 0.00 19.45 18.99 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 -1.44 3.26 0.61 0.00 0.00 -1.07 -4.83 121.76 118.30 2ee2 s ALA 64 Ca 0.49 0.54 -0.13 0.00 0.00 0.00 0.00 51.96 52.87 2ee2 s ALA 64 Cb 0.29 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 20.13 2ee2 s ALA 64 CO 0.28 -0.01 1.03 -0.80 0.00 0.00 0.00 175.76 176.26 2ee2 s ASN 65 N -0.02 6.11 -0.08 0.00 0.01 -1.12 -4.89 114.94 114.94 2ee2 s ASN 65 Ca 0.46 1.52 0.04 0.00 -0.71 0.00 0.00 52.86 54.17 2ee2 s ASN 65 Cb -0.23 -2.49 0.00 0.00 0.41 0.00 0.00 41.25 38.94 2ee2 s ASN 65 CO 0.29 -0.94 -0.20 -0.13 -1.51 0.00 0.00 177.10 174.60 2ee2 s ARG 66 N -4.82 2.55 -0.33 -0.60 3.00 -1.26 -3.03 118.95 114.47 2ee2 s ARG 66 Ca 0.57 -0.73 0.03 0.00 0.00 0.00 0.00 55.73 55.60 2ee2 s ARG 66 Cb -0.12 -1.98 0.09 0.00 0.00 0.00 0.00 34.95 32.94 2ee2 s ARG 66 CO 0.48 0.15 0.02 0.08 0.00 0.00 0.00 175.30 176.03 2ee2 s VAL 67 N 0.38 2.34 -0.21 3.52 1.01 -0.56 -4.94 120.40 121.95 2ee2 s VAL 67 Ca -0.16 -2.14 -0.13 0.00 0.00 0.00 0.00 61.98 59.55 2ee2 s VAL 67 Cb -0.17 -2.63 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 2ee2 s VAL 67 CO 0.07 -0.46 0.25 -1.58 0.00 0.00 0.00 175.10 173.37 2ee2 s GLN 68 N 0.97 4.16 0.40 2.72 0.74 -1.26 -2.05 119.66 125.34 2ee2 s GLN 68 Ca 0.06 -0.05 0.03 0.00 0.05 0.00 0.00 55.36 55.45 2ee2 s GLN 68 Cb -0.19 -3.50 -0.04 0.00 1.10 0.00 0.00 33.01 30.38 2ee2 s GLN 68 CO -0.07 0.11 0.08 0.14 -0.55 0.00 0.00 175.29 175.00 2ee2 s VAL 69 N 0.90 0.94 0.26 1.34 -7.23 -1.25 -5.03 120.40 110.32 2ee2 s VAL 69 Ca 0.13 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.00 2ee2 s VAL 69 Cb -0.13 -2.48 -0.10 0.00 0.56 0.00 0.00 36.38 34.23 2ee2 s VAL 69 CO 0.04 0.00 1.36 0.42 -0.31 0.00 0.00 175.10 176.61 2ee2 s THR 70 N -3.15 2.84 0.27 5.32 -4.23 -1.26 -3.97 115.64 111.46 2ee2 s THR 70 Ca 0.25 0.74 0.22 0.00 -1.18 0.00 0.00 61.69 61.72 2ee2 s THR 70 Cb 0.05 -3.47 0.22 0.00 1.34 0.00 0.00 72.50 70.63 2ee2 s THR 70 CO 0.13 0.14 1.63 0.77 -0.54 0.00 0.00 174.62 176.75 2ee2 h SER 71 N 4.58 0.00 0.71 3.99 4.64 -1.93 0.36 113.55 125.90 2ee2 h SER 71 Ca -0.47 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.64 2ee2 h SER 71 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 2ee2 h SER 71 CO 0.73 0.00 -0.97 1.56 -0.87 0.00 0.00 176.83 177.28 2ee2 h GLN 72 N 0.00 0.15 -5.74 4.77 1.08 -1.93 -3.43 115.11 110.02 2ee2 h GLN 72 Ca 0.00 -0.20 -0.45 0.00 -1.45 0.00 0.00 58.65 56.55 2ee2 h GLN 72 Cb 0.53 0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 28.02 2ee2 h GLN 72 CO 0.00 1.00 1.43 -1.21 -0.95 0.00 0.00 178.83 179.11 2ee2 s GLU 73 N -2.98 2.27 0.23 1.46 0.41 0.13 -4.78 118.70 115.45 2ee2 s GLU 73 Ca -0.02 1.03 0.17 0.00 -0.41 0.00 0.00 54.97 55.73 2ee2 s GLU 73 Cb 0.10 -4.54 0.87 0.00 -1.78 0.00 0.00 34.13 28.78 2ee2 s GLU 73 CO 0.83 -3.15 1.51 0.66 -0.49 0.00 0.00 175.26 174.63 2ee2 n TYR 74 N 14.87 0.55 -3.84 1.61 4.02 -1.26 -4.69 117.16 128.43 2ee2 n TYR 74 Ca 0.31 0.28 -0.10 0.00 -0.01 0.00 0.00 57.90 58.39 2ee2 n TYR 74 Cb 0.53 -0.95 -0.06 0.00 -0.02 0.00 0.00 39.34 38.85 2ee2 n TYR 74 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2ee2 s SER 75 N -3.79 -0.05 0.42 7.72 1.04 -1.26 -1.80 113.70 115.98 2ee2 s SER 75 Ca -0.01 -0.66 0.03 0.00 0.48 0.00 0.00 55.95 55.80 2ee2 s SER 75 Cb 0.05 0.45 -0.03 0.00 0.10 0.00 0.00 66.02 66.59 2ee2 s SER 75 CO 0.17 -0.89 0.07 0.00 0.98 0.00 0.00 173.24 173.58 2ee2 s ALA 76 N -3.90 3.18 -0.01 5.32 0.00 0.13 -4.96 121.76 121.52 2ee2 s ALA 76 Ca 0.11 -1.21 0.03 0.00 0.00 0.00 0.00 51.96 50.88 2ee2 s ALA 76 Cb 0.03 0.50 -0.00 0.00 0.00 0.00 0.00 23.12 23.64 2ee2 s ALA 76 CO -0.05 -0.23 -0.09 0.50 0.00 0.00 0.00 175.76 175.89 2ee2 s ARG 77 N -3.79 0.77 -0.02 0.00 3.52 -1.26 -1.25 118.95 116.92 2ee2 s ARG 77 Ca 0.22 -0.30 0.04 0.00 -0.13 0.00 0.00 55.73 55.56 2ee2 s ARG 77 Cb 0.04 -0.74 -0.03 0.00 -1.56 0.00 0.00 34.95 32.66 2ee2 s ARG 77 CO 0.12 0.16 -0.14 -0.51 -0.81 0.00 0.00 175.30 174.12 2ee2 s LEU 78 N -0.08 2.79 0.26 -0.88 1.43 0.20 -4.97 118.68 117.43 2ee2 s LEU 78 Ca 0.01 -0.24 0.03 0.00 -1.03 0.00 0.00 54.13 52.90 2ee2 s LEU 78 Cb -0.05 -1.60 -0.04 0.00 0.03 0.00 0.00 46.19 44.54 2ee2 s LEU 78 CO -0.00 0.31 0.20 -1.61 0.23 0.00 0.00 176.35 175.48 2ee2 s GLU 79 N -1.05 1.45 -1.29 1.70 2.02 -1.26 -1.96 118.70 118.31 2ee2 s GLU 79 Ca 0.13 -1.80 -0.03 0.00 0.02 0.00 0.00 54.97 53.30 2ee2 s GLU 79 Cb -0.11 0.30 0.00 0.00 0.10 0.00 0.00 34.13 34.42 2ee2 s GLU 79 CO 0.03 -0.51 0.35 0.09 0.02 0.00 0.00 175.26 175.24 2ee2 n ASN 80 N -0.84 -5.11 -4.91 -0.19 3.02 -1.24 -4.98 115.26 101.01 2ee2 n ASN 80 Ca 0.04 -0.17 -0.30 0.00 -0.03 0.00 0.00 54.58 54.13 2ee2 n ASN 80 Cb 0.64 -4.03 -0.04 0.00 -0.61 0.00 0.00 39.78 35.74 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 -5.21 4.29 0.32 3.41 1.43 -1.26 -5.09 118.68 116.57 2ee2 s LEU 81 Ca 0.17 0.43 -0.23 0.00 -1.03 0.00 0.00 54.13 53.47 2ee2 s LEU 81 Cb -0.08 -3.16 -0.10 0.00 0.03 0.00 0.00 46.19 42.89 2ee2 s LEU 81 CO 0.21 0.07 0.89 -0.76 0.23 0.00 0.00 176.35 176.99 2ee2 s LEU 82 N -2.79 4.27 0.51 1.79 1.43 -1.26 -4.21 118.68 118.42 2ee2 s LEU 82 Ca 0.38 1.70 -0.21 0.00 -1.03 0.00 0.00 54.13 54.97 2ee2 s LEU 82 Cb -0.12 -4.00 -0.06 0.00 0.03 0.00 0.00 46.19 42.03 2ee2 s LEU 82 CO 0.27 -0.10 1.14 -2.16 0.23 0.00 0.00 176.35 175.73 2ee2 s PRO 83 N -2.25 3.52 -1.57 1.29 0.04 -1.26 -3.54 135.00 131.23 2ee2 s PRO 83 Ca 0.51 1.68 -0.03 0.00 0.04 0.00 0.00 61.00 63.20 2ee2 s PRO 83 Cb -0.16 -2.17 0.03 0.00 0.04 0.00 0.00 34.50 32.23 2ee2 s PRO 83 CO 0.21 -0.73 0.06 -3.47 0.04 0.00 0.00 177.00 173.12 2ee2 n ASP 84 N -0.97 0.66 -3.91 6.66 2.03 0.17 -4.88 116.55 116.30 2ee2 n ASP 84 Ca 0.10 -1.27 -0.23 0.00 0.52 0.00 0.00 54.79 53.91 2ee2 n ASP 84 Cb 0.50 -1.58 -0.17 0.00 -0.72 0.00 0.00 41.12 39.15 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 -4.26 0.77 0.44 5.18 2.01 -1.23 -4.92 115.64 113.64 2ee2 s THR 85 Ca 0.09 -0.22 -0.25 0.00 0.31 0.00 0.00 61.69 61.62 2ee2 s THR 85 Cb -0.05 -0.78 -0.09 0.00 0.01 0.00 0.00 72.50 71.58 2ee2 s THR 85 CO 0.99 0.29 1.37 1.67 -0.69 0.00 0.00 174.62 178.25 2ee2 n GLN 86 N 4.31 2.13 -3.64 4.92 7.27 -1.26 -3.69 117.38 127.41 2ee2 n GLN 86 Ca -0.19 0.76 -0.15 0.00 0.07 0.00 0.00 57.00 57.48 2ee2 n GLN 86 Cb 0.51 -2.53 -0.14 0.00 2.41 0.00 0.00 30.24 30.49 2ee2 n GLN 86 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 2ee2 s TYR 87 N -1.19 -0.35 -0.45 3.69 2.02 -0.53 -3.05 117.35 117.49 2ee2 s TYR 87 Ca 0.61 0.81 -0.22 0.00 -0.37 0.00 0.00 57.07 57.89 2ee2 s TYR 87 Cb -0.47 -0.13 0.03 0.00 -0.40 0.00 0.00 41.96 40.99 2ee2 s TYR 87 CO 0.58 -0.36 0.74 -0.06 -1.57 0.00 0.00 175.55 174.88 2ee2 s PHE 88 N 2.38 3.01 0.02 2.71 0.08 -1.06 -0.84 117.98 124.28 2ee2 s PHE 88 Ca 0.02 0.08 0.00 0.00 0.12 0.00 0.00 56.93 57.15 2ee2 s PHE 88 Cb -0.12 -3.58 -0.04 0.00 -0.57 0.00 0.00 43.02 38.71 2ee2 s PHE 88 CO -0.08 -0.96 0.10 0.42 -0.10 0.00 0.00 175.22 174.59 2ee2 s ILE 89 N 3.16 4.79 -0.16 0.64 1.01 0.03 -3.46 121.20 127.19 2ee2 s ILE 89 Ca 0.27 -0.48 -0.11 0.00 0.00 0.00 0.00 60.65 60.34 2ee2 s ILE 89 Cb -0.13 -3.23 0.05 0.00 0.01 0.00 0.00 42.46 39.16 2ee2 s ILE 89 CO 0.21 0.28 0.41 -1.83 0.00 0.00 0.00 174.94 174.01 2ee2 s GLU 90 N -1.97 0.42 -0.06 2.79 4.04 -1.00 -2.20 118.70 120.71 2ee2 s GLU 90 Ca 0.26 0.71 0.03 0.00 0.04 0.00 0.00 54.97 56.00 2ee2 s GLU 90 Cb -0.12 0.06 -0.03 0.00 0.02 0.00 0.00 34.13 34.07 2ee2 s GLU 90 CO 0.17 -0.12 -0.13 0.08 -1.84 0.00 0.00 175.26 173.42 2ee2 s VAL 91 N 0.98 3.19 -0.11 1.83 1.01 -1.26 -1.81 120.40 124.23 2ee2 s VAL 91 Ca -0.06 -0.67 -0.05 0.00 0.00 0.00 0.00 61.98 61.20 2ee2 s VAL 91 Cb -0.06 -2.27 0.05 0.00 0.00 0.00 0.00 36.38 34.09 2ee2 s VAL 91 CO -0.08 0.58 0.25 -0.83 0.00 0.00 0.00 175.10 175.02 2ee2 s GLY 92 N -0.60 -0.13 -0.08 4.51 0.00 -1.08 -2.02 107.32 107.91 2ee2 s GLY 92 Ca 0.09 0.99 -0.16 0.00 0.00 0.00 0.00 44.72 45.63 2ee2 s GLY 92 CO 0.01 1.34 0.41 0.00 0.00 0.00 0.00 173.10 174.87 2ee2 s ALA 93 N 1.41 3.58 -0.03 3.20 0.00 -1.26 -1.97 121.76 126.69 2ee2 s ALA 93 Ca -0.08 -0.26 -0.29 0.00 0.00 0.00 0.00 51.96 51.33 2ee2 s ALA 93 Cb -0.11 -2.50 0.11 0.00 0.00 0.00 0.00 23.12 20.62 2ee2 s ALA 93 CO -0.08 0.20 0.91 0.00 0.00 0.00 0.00 175.76 176.78 2ee2 s ASN 95 N -2.23 4.64 0.47 0.00 2.20 -1.16 -0.94 114.94 117.92 2ee2 s ASN 95 Ca 0.04 -1.10 0.23 0.00 -0.94 0.00 0.00 52.86 51.09 2ee2 s ASN 95 Cb -0.01 -0.07 1.14 0.00 -2.00 0.00 0.00 41.25 40.31 2ee2 s ASN 95 CO -0.07 -0.82 1.95 -1.28 -2.94 0.00 0.00 177.10 173.94 2ee2 h SER 96 N 1.04 0.00 0.00 3.54 0.87 -1.95 -3.29 113.55 113.76 2ee2 h SER 96 Ca -0.40 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.16 2ee2 h SER 96 Cb 1.28 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 2ee2 h SER 96 CO 0.62 0.21 0.00 0.00 -0.53 0.00 0.00 176.83 177.12 2ee2 n ALA 97 N -2.31 -0.29 -2.54 6.23 0.00 -1.26 -4.92 120.51 115.43 2ee2 n ALA 97 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.19 2ee2 n ALA 97 Cb 0.33 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.69 2ee2 n ALA 97 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2ee2 s GLY 98 N -1.40 1.80 0.12 0.00 0.00 -1.13 -4.99 107.32 101.72 2ee2 s GLY 98 Ca 0.00 -1.79 0.03 0.00 0.00 0.00 0.00 44.72 42.96 2ee2 s GLY 98 CO 0.00 -1.87 0.18 0.00 0.00 0.00 0.00 173.10 171.41 2ee2 s GLY 100 N -2.87 1.62 0.29 0.00 0.00 -1.26 -4.48 107.32 100.62 2ee2 s GLY 100 Ca 0.32 -1.76 -0.29 0.00 0.00 0.00 0.00 44.72 42.99 2ee2 s GLY 100 CO 0.26 -1.82 1.24 2.56 0.00 0.00 0.00 173.10 175.33 2ee2 s PRO 101 N -3.64 4.45 0.62 2.90 0.04 -1.26 -4.93 135.00 133.18 2ee2 s PRO 101 Ca 0.26 2.06 -0.17 0.00 0.04 0.00 0.00 61.00 63.19 2ee2 s PRO 101 Cb -0.01 -3.13 -0.02 0.00 0.04 0.00 0.00 34.50 31.38 2ee2 s PRO 101 CO 0.10 -0.07 1.12 -1.25 0.04 0.00 0.00 177.00 176.94 2ee2 s PRO 102 N -1.42 3.01 0.86 0.56 0.04 -1.26 -4.74 135.00 132.05 2ee2 s PRO 102 Ca 0.49 1.47 -0.12 0.00 0.04 0.00 0.00 61.00 62.88 2ee2 s PRO 102 Cb -0.37 -1.97 0.11 0.00 0.04 0.00 0.00 34.50 32.31 2ee2 s PRO 102 CO 0.47 -1.10 1.10 -1.54 0.04 0.00 0.00 177.00 175.97 2ee2 s SER 103 N -2.28 3.90 0.51 6.66 1.04 -0.86 -4.96 113.70 117.71 2ee2 s SER 103 Ca 0.69 1.27 -0.19 0.00 0.48 0.00 0.00 55.95 58.20 2ee2 s SER 103 Cb -0.22 -1.96 -0.10 0.00 0.10 0.00 0.00 66.02 63.84 2ee2 s SER 103 CO 0.36 -2.34 0.49 0.47 0.98 0.00 0.00 173.24 173.19 2ee2 n ASP 104 N -3.67 -1.16 -4.64 7.02 9.92 -1.26 -4.75 116.55 118.01 2ee2 n ASP 104 Ca 0.07 0.79 -0.43 0.00 -0.53 0.00 0.00 54.79 54.69 2ee2 n ASP 104 Cb 0.57 -1.13 -0.02 0.00 -0.64 0.00 0.00 41.12 39.89 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 -1.83 4.03 -0.08 -1.24 -2.45 -1.26 -4.77 119.30 111.71 2ee2 s MET 105 Ca 0.66 1.50 -0.02 0.00 -1.25 0.00 0.00 55.69 56.58 2ee2 s MET 105 Cb -0.50 -3.86 -0.03 0.00 1.25 0.00 0.00 34.83 31.69 2ee2 s MET 105 CO 0.57 -0.98 0.01 0.42 1.05 0.00 0.00 175.02 176.09 2ee2 s ILE 106 N 4.14 4.34 -0.06 10.11 1.01 -0.94 -5.02 121.20 134.78 2ee2 s ILE 106 Ca 0.58 -0.27 0.03 0.00 0.00 0.00 0.00 60.65 61.00 2ee2 s ILE 106 Cb -0.20 -2.84 -0.02 0.00 0.01 0.00 0.00 42.46 39.40 2ee2 s ILE 106 CO 0.21 0.58 -0.14 -1.83 0.00 0.00 0.00 174.94 173.75 2ee2 s GLU 107 N -0.97 2.60 0.17 2.79 4.04 -1.26 -0.79 118.70 125.27 2ee2 s GLU 107 Ca 0.14 -0.70 0.07 0.00 0.04 0.00 0.00 54.97 54.52 2ee2 s GLU 107 Cb -0.11 -2.40 -0.04 0.00 0.02 0.00 0.00 34.13 31.59 2ee2 s GLU 107 CO 0.03 0.58 -0.15 0.00 -1.84 0.00 0.00 175.26 173.88 2ee2 s ALA 108 N -0.60 1.84 -0.29 -0.84 0.00 -0.02 -4.96 121.76 116.90 2ee2 s ALA 108 Ca 0.09 -1.52 -0.02 0.00 0.00 0.00 0.00 51.96 50.51 2ee2 s ALA 108 Cb -0.11 -0.10 0.09 0.00 0.00 0.00 0.00 23.12 23.01 2ee2 s ALA 108 CO 0.01 0.10 0.10 -0.06 0.00 0.00 0.00 175.76 175.91 2ee2 s PHE 109 N -2.59 1.17 1.26 0.00 0.40 -1.26 -1.45 117.98 115.50 2ee2 s PHE 109 Ca 0.17 -1.34 -0.18 0.00 -0.60 0.00 0.00 56.93 54.98 2ee2 s PHE 109 Cb -0.03 -1.36 0.28 0.00 0.51 0.00 0.00 43.02 42.42 2ee2 s PHE 109 CO 0.05 -0.83 0.70 0.25 0.70 0.00 0.00 175.22 176.10 2ee2 n THR 110 N 5.00 0.00 -2.81 0.64 -2.24 -1.24 -4.92 114.28 108.71 2ee2 n THR 110 Ca -0.04 -0.26 -0.20 0.00 -2.27 0.00 0.00 64.05 61.28 2ee2 n THR 110 Cb 0.43 -0.87 0.04 0.00 -2.10 0.00 0.00 70.33 67.83 2ee2 n THR 110 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ee2 s LYS 111 N -4.31 2.54 0.11 -0.78 -0.14 -1.26 -3.75 119.74 112.14 2ee2 s LYS 111 Ca 0.62 -1.07 -0.30 0.00 -1.36 0.00 0.00 55.97 53.87 2ee2 s LYS 111 Cb -0.17 -2.59 -0.06 0.00 -1.68 0.00 0.00 37.83 33.34 2ee2 s LYS 111 CO 0.59 -0.64 0.99 0.15 -0.76 0.00 0.00 175.35 175.68 2ee2 s LYS 112 N -4.64 4.67 0.00 1.68 1.02 -1.26 0.45 119.74 121.66 2ee2 s LYS 112 Ca 0.58 1.50 -0.13 0.00 0.02 0.00 0.00 55.97 57.94 2ee2 s LYS 112 Cb -0.09 -3.36 -0.07 0.00 -0.52 0.00 0.00 37.83 33.78 2ee2 s LYS 112 CO 0.37 0.17 0.86 0.00 -0.92 0.00 0.00 175.35 175.83 2ee2 h ALA 113 N 5.59 -0.79 -1.47 5.17 0.00 -1.97 -3.46 119.26 122.33 2ee2 h ALA 113 Ca -0.43 -0.10 -0.25 0.00 0.00 0.00 0.00 54.91 54.13 2ee2 h ALA 113 Cb 1.21 0.18 0.14 0.00 0.00 0.00 0.00 17.79 19.32 2ee2 h ALA 113 CO 0.72 -0.76 -0.44 -1.13 0.00 0.00 0.00 179.25 177.64 2ee2 n SER 114 N -3.71 -2.93 0.00 0.00 3.41 -1.26 -4.90 113.62 104.24 2ee2 n SER 114 Ca -0.06 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.21 2ee2 n SER 114 Cb 0.18 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 2ee2 n SER 114 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ee2 n GLY 115 N 2.44 -2.23 3.55 5.00 0.00 -1.26 -4.90 105.19 107.79 2ee2 n GLY 115 Ca 0.05 -2.19 -0.35 0.00 0.00 0.00 0.00 46.02 43.53 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 -0.82 2.60 0.57 1.61 0.04 -1.26 -4.97 135.00 132.78 2ee2 s PRO 116 Ca 0.00 0.34 -0.20 0.00 0.04 0.00 0.00 61.00 61.18 2ee2 s PRO 116 Cb 0.00 -4.59 -0.04 0.00 0.04 0.00 0.00 34.50 29.91 2ee2 s PRO 116 CO 0.00 -2.93 1.24 0.45 0.04 0.00 0.00 177.00 175.80 2ee2 s SER 117 N 8.09 5.25 0.21 6.66 0.15 -1.26 -4.92 113.70 127.89 2ee2 s SER 117 Ca 0.68 2.47 -0.09 0.00 0.70 0.00 0.00 55.95 59.72 2ee2 s SER 117 Cb -0.11 -2.61 0.29 0.00 -1.71 0.00 0.00 66.02 61.89 2ee2 s SER 117 CO 0.14 -1.56 1.77 0.77 1.20 0.00 0.00 173.24 175.56 2ee2 h SER 118 N 1.09 0.36 0.00 5.45 4.64 -2.00 -3.56 113.55 119.53 2ee2 h SER 118 Ca -0.50 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2ee2 h SER 118 Cb 1.30 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 2ee2 h SER 118 CO 0.56 0.21 0.00 0.61 -0.87 0.00 0.00 176.83 177.34