#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 1.86 -0.18 1.61 1.04 -1.26 -5.15 113.70 111.63 2ee2 s SER 2 Ca 0.00 -0.57 -0.11 0.00 0.48 0.00 0.00 55.95 55.76 2ee2 s SER 2 Cb 0.00 -0.09 0.06 0.00 0.10 0.00 0.00 66.02 66.08 2ee2 s SER 2 CO 0.00 -0.00 0.43 -0.94 0.98 0.00 0.00 173.24 173.71 2ee2 s SER 3 N -1.52 -0.53 -0.21 7.02 1.04 -1.26 -5.14 113.70 113.10 2ee2 s SER 3 Ca 0.01 0.93 -0.03 0.00 0.48 0.00 0.00 55.95 57.35 2ee2 s SER 3 Cb -0.09 0.83 0.06 0.00 0.10 0.00 0.00 66.02 66.93 2ee2 s SER 3 CO 0.02 -0.19 0.04 -0.83 0.98 0.00 0.00 173.24 173.27 2ee2 s GLY 4 N 1.21 0.74 -0.13 7.32 0.00 -1.26 -5.02 107.32 110.18 2ee2 s GLY 4 Ca -0.08 -0.80 -0.07 0.00 0.00 0.00 0.00 44.72 43.77 2ee2 s GLY 4 CO -0.11 1.46 -0.11 0.23 0.00 0.00 0.00 173.10 174.57 2ee2 h SER 5 N 8.23 0.00 -5.53 1.64 0.87 -2.05 -3.49 113.55 113.22 2ee2 h SER 5 Ca -0.16 -0.02 -0.35 0.00 -1.23 0.00 0.00 61.79 60.04 2ee2 h SER 5 Cb 1.11 0.00 0.15 0.00 -0.44 0.00 0.00 62.40 63.21 2ee2 h SER 5 CO 0.35 0.70 -0.69 -0.24 -0.53 0.00 0.00 176.83 176.42 2ee2 n SER 6 N -4.66 -4.04 -2.13 6.23 2.88 -1.26 -4.15 113.62 106.49 2ee2 n SER 6 Ca -0.06 -0.55 -0.03 0.00 -1.33 0.00 0.00 58.87 56.90 2ee2 n SER 6 Cb 0.20 -4.86 0.00 0.00 -0.75 0.00 0.00 64.21 58.80 2ee2 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ee2 n GLY 7 N -1.52 -1.67 2.57 0.46 0.00 -1.26 -4.82 105.19 98.95 2ee2 n GLY 7 Ca -0.14 0.43 -0.46 0.00 0.00 0.00 0.00 46.02 45.85 2ee2 n GLY 7 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2ee2 n VAL 8 N -0.21 0.00 -3.87 1.61 0.24 -1.26 -4.89 118.33 109.95 2ee2 n VAL 8 Ca 0.04 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.05 2ee2 n VAL 8 Cb 0.16 -0.24 -0.13 0.00 -1.47 0.00 0.00 33.84 32.16 2ee2 n VAL 8 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ee2 s ALA 9 N 1.42 3.15 -0.05 2.33 0.00 -1.26 -5.08 121.76 122.27 2ee2 s ALA 9 Ca 0.70 -3.26 0.07 0.00 0.00 0.00 0.00 51.96 49.47 2ee2 s ALA 9 Cb -1.00 -2.09 -0.01 0.00 0.00 0.00 0.00 23.12 20.02 2ee2 s ALA 9 CO 0.52 -2.05 -0.25 0.14 0.00 0.00 0.00 175.76 174.12 2ee2 s VAL 10 N -0.46 2.04 -0.38 0.00 -7.23 -1.26 -5.11 120.40 108.01 2ee2 s VAL 10 Ca 0.20 -1.07 -0.12 0.00 -1.81 0.00 0.00 61.98 59.17 2ee2 s VAL 10 Cb -0.19 -1.72 0.02 0.00 0.56 0.00 0.00 36.38 35.05 2ee2 s VAL 10 CO -0.05 0.57 0.24 -0.63 -0.31 0.00 0.00 175.10 174.92 2ee2 s ILE 11 N -0.28 4.91 0.23 -0.62 1.01 -1.26 -5.07 121.20 120.11 2ee2 s ILE 11 Ca -0.00 -0.66 0.10 0.00 0.00 0.00 0.00 60.65 60.09 2ee2 s ILE 11 Cb -0.13 -3.68 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 2ee2 s ILE 11 CO 0.02 -0.20 -0.12 0.20 0.00 0.00 0.00 174.94 174.84 2ee2 s ASN 12 N 1.63 4.03 -0.05 3.58 -0.87 -1.26 -5.13 114.94 116.86 2ee2 s ASN 12 Ca 0.04 -0.75 -0.01 0.00 -1.57 0.00 0.00 52.86 50.57 2ee2 s ASN 12 Cb -0.19 -0.58 0.03 0.00 -0.02 0.00 0.00 41.25 40.50 2ee2 s ASN 12 CO 0.08 0.07 0.03 -0.44 -2.57 0.00 0.00 177.10 174.27 2ee2 s SER 13 N -3.17 1.25 0.07 -1.22 0.01 -1.26 -5.14 113.70 104.24 2ee2 s SER 13 Ca 0.27 -0.00 -0.10 0.00 1.31 0.00 0.00 55.95 57.43 2ee2 s SER 13 Cb -0.07 -0.28 0.00 0.00 0.21 0.00 0.00 66.02 65.88 2ee2 s SER 13 CO 0.15 -0.21 0.21 0.00 0.41 0.00 0.00 173.24 173.81 2ee2 s ALA 14 N 1.95 -0.34 -0.09 1.44 0.00 -1.26 -5.01 121.76 118.45 2ee2 s ALA 14 Ca 0.03 -0.43 -0.15 0.00 0.00 0.00 0.00 51.96 51.41 2ee2 s ALA 14 Cb -0.12 0.41 -0.28 0.00 0.00 0.00 0.00 23.12 23.13 2ee2 s ALA 14 CO -0.04 -0.46 0.59 -0.56 0.00 0.00 0.00 175.76 175.29 2ee2 h GLN 15 N 3.00 0.28 -4.31 0.00 3.07 -1.99 -3.49 115.11 111.67 2ee2 h GLN 15 Ca -0.33 -0.47 -0.23 0.00 0.09 0.00 0.00 58.65 57.71 2ee2 h GLN 15 Cb 1.20 0.18 -0.12 0.00 0.08 0.00 0.00 27.48 28.81 2ee2 h GLN 15 CO 0.52 1.23 -0.40 0.16 0.09 0.00 0.00 178.83 180.43 2ee2 s ASP 16 N -7.08 0.39 -0.17 0.06 1.47 -1.26 -5.12 116.67 104.96 2ee2 s ASP 16 Ca -0.19 -1.33 -0.24 0.00 1.18 0.00 0.00 52.55 51.97 2ee2 s ASP 16 Cb 0.04 0.50 0.06 0.00 -0.34 0.00 0.00 42.92 43.19 2ee2 s ASP 16 CO 0.79 -1.02 0.63 0.00 0.68 0.00 0.00 175.17 176.25 2ee2 s ALA 17 N -3.86 -1.59 0.22 2.11 0.00 -1.26 -2.93 121.76 114.44 2ee2 s ALA 17 Ca 0.34 1.57 -0.30 0.00 0.00 0.00 0.00 51.96 53.56 2ee2 s ALA 17 Cb 0.03 -0.67 -0.09 0.00 0.00 0.00 0.00 23.12 22.40 2ee2 s ALA 17 CO 0.14 -0.32 1.29 -1.25 0.00 0.00 0.00 175.76 175.62 2ee2 s PRO 18 N -0.23 4.41 0.00 0.00 0.04 -1.26 -4.92 135.00 133.04 2ee2 s PRO 18 Ca -0.04 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.05 2ee2 s PRO 18 Cb -0.03 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.33 2ee2 s PRO 18 CO 0.04 -0.20 0.00 -1.13 0.04 0.00 0.00 177.00 175.74 2ee2 n SER 19 N 2.28 4.23 -4.72 6.66 3.41 -1.26 -4.67 113.62 119.55 2ee2 n SER 19 Ca 0.05 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.32 2ee2 n SER 19 Cb 0.43 0.84 -0.08 0.00 -0.26 0.00 0.00 64.21 65.13 2ee2 n SER 19 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2ee2 s GLU 20 N -1.69 2.95 0.06 4.33 2.56 -1.26 -5.00 118.70 120.65 2ee2 s GLU 20 Ca 0.00 -0.49 0.02 0.00 0.00 0.00 0.00 54.97 54.50 2ee2 s GLU 20 Cb 0.00 -2.78 -0.04 0.00 2.00 0.00 0.00 34.13 33.31 2ee2 s GLU 20 CO 0.00 0.66 0.07 0.00 -0.56 0.00 0.00 175.26 175.43 2ee2 s ALA 21 N -1.06 3.53 -0.46 6.30 0.00 -1.26 -4.90 121.76 123.92 2ee2 s ALA 21 Ca 0.19 -0.99 -0.28 0.00 0.00 0.00 0.00 51.96 50.88 2ee2 s ALA 21 Cb -0.12 -1.44 -0.02 0.00 0.00 0.00 0.00 23.12 21.55 2ee2 s ALA 21 CO 0.09 0.73 1.77 -1.25 0.00 0.00 0.00 175.76 177.09 2ee2 s PRO 22 N -2.21 3.09 0.78 0.00 0.04 -1.26 -4.92 135.00 130.51 2ee2 s PRO 22 Ca 0.27 1.02 -0.06 0.00 0.04 0.00 0.00 61.00 62.27 2ee2 s PRO 22 Cb -0.12 -4.25 0.13 0.00 0.04 0.00 0.00 34.50 30.30 2ee2 s PRO 22 CO 0.20 -2.17 1.08 0.99 0.04 0.00 0.00 177.00 177.14 2ee2 s THR 23 N 7.55 2.14 -1.46 1.26 2.01 -1.26 -4.39 115.64 121.48 2ee2 s THR 23 Ca 0.72 -0.37 -0.11 0.00 0.31 0.00 0.00 61.69 62.24 2ee2 s THR 23 Cb -0.17 -2.76 0.06 0.00 0.01 0.00 0.00 72.50 69.63 2ee2 s THR 23 CO 0.28 0.00 1.00 -0.62 -0.69 0.00 0.00 174.62 174.59 2ee2 n GLU 24 N -3.10 -6.02 -3.29 4.92 1.02 -1.26 -3.26 120.64 109.66 2ee2 n GLU 24 Ca 0.14 0.66 -0.38 0.00 -0.02 0.00 0.00 57.16 57.55 2ee2 n GLU 24 Cb 0.60 -5.55 -0.06 0.00 -0.02 0.00 0.00 31.44 26.41 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 -3.35 5.17 -0.00 2.62 0.11 -1.26 -4.43 120.40 119.26 2ee2 s VAL 25 Ca 0.56 0.99 -0.05 0.00 -2.93 0.00 0.00 61.98 60.55 2ee2 s VAL 25 Cb -0.27 -3.84 -0.00 0.00 -1.53 0.00 0.00 36.38 30.74 2ee2 s VAL 25 CO 0.80 0.30 0.10 -0.83 -3.33 0.00 0.00 175.10 172.14 2ee2 s GLY 26 N 0.70 0.06 -0.08 6.54 0.00 -1.13 -5.03 107.32 108.39 2ee2 s GLY 26 Ca 0.27 -0.15 0.01 0.00 0.00 0.00 0.00 44.72 44.85 2ee2 s GLY 26 CO 0.11 -0.25 -0.10 -1.34 0.00 0.00 0.00 173.10 171.51 2ee2 s VAL 27 N -1.12 3.37 -0.15 1.40 -7.23 -1.26 -1.91 120.40 113.50 2ee2 s VAL 27 Ca -0.12 -0.59 -0.01 0.00 -1.81 0.00 0.00 61.98 59.45 2ee2 s VAL 27 Cb -0.07 -2.38 -0.01 0.00 0.56 0.00 0.00 36.38 34.49 2ee2 s VAL 27 CO 0.01 0.57 -0.12 -0.75 -0.31 0.00 0.00 175.10 174.50 2ee2 s LYS 28 N -0.46 3.36 -0.70 4.82 2.36 0.34 -4.97 119.74 124.50 2ee2 s LYS 28 Ca 0.06 -0.68 -0.26 0.00 -2.55 0.00 0.00 55.97 52.54 2ee2 s LYS 28 Cb -0.12 -2.70 0.04 0.00 -1.05 0.00 0.00 37.83 33.99 2ee2 s LYS 28 CO 0.02 0.11 1.20 0.08 1.55 0.00 0.00 175.35 178.31 2ee2 s VAL 29 N 0.63 3.88 -0.05 4.02 1.01 -1.26 -0.36 120.40 128.28 2ee2 s VAL 29 Ca -0.07 0.37 -0.13 0.00 0.00 0.00 0.00 61.98 62.15 2ee2 s VAL 29 Cb -0.15 -4.84 -0.08 0.00 0.00 0.00 0.00 36.38 31.31 2ee2 s VAL 29 CO 0.03 -1.69 0.54 -0.07 0.00 0.00 0.00 175.10 173.91 2ee2 h LEU 30 N 12.52 -0.35 -9.06 3.92 3.38 -1.62 -3.49 115.31 120.62 2ee2 h LEU 30 Ca -0.28 -0.03 -0.51 0.00 0.09 0.00 0.00 57.88 57.15 2ee2 h LEU 30 Cb 1.05 0.09 -0.13 0.00 0.09 0.00 0.00 40.66 41.76 2ee2 h LEU 30 CO 1.24 0.11 -0.48 -0.55 0.09 0.00 0.00 178.44 178.85 2ee2 s SER 31 N -5.11 2.05 0.28 -0.43 0.15 0.38 -4.94 113.70 106.09 2ee2 s SER 31 Ca -0.07 -1.78 0.02 0.00 0.70 0.00 0.00 55.95 54.82 2ee2 s SER 31 Cb 0.01 0.58 0.59 0.00 -1.71 0.00 0.00 66.02 65.49 2ee2 s SER 31 CO 0.22 -1.06 1.81 0.77 1.20 0.00 0.00 173.24 176.19 2ee2 h SER 32 N 2.01 0.86 -0.05 5.45 4.64 -1.91 -2.03 113.55 122.52 2ee2 h SER 32 Ca -0.26 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 2ee2 h SER 32 Cb 1.24 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2ee2 h SER 32 CO 0.39 0.41 0.00 -1.20 -0.87 0.00 0.00 176.83 175.57 2ee2 n SER 33 N -4.68 2.59 -4.08 4.97 7.64 -1.26 -4.05 113.62 114.76 2ee2 n SER 33 Ca 0.20 -2.92 -0.24 0.00 1.01 0.00 0.00 58.87 56.91 2ee2 n SER 33 Cb 0.41 -0.40 -0.16 0.00 -1.01 0.00 0.00 64.21 63.06 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 -2.61 1.58 -0.15 1.43 0.41 -0.76 -3.51 118.70 115.09 2ee2 s GLU 34 Ca 0.30 -0.49 -0.17 0.00 -0.41 0.00 0.00 54.97 54.20 2ee2 s GLU 34 Cb 0.25 -1.37 0.04 0.00 -1.78 0.00 0.00 34.13 31.28 2ee2 s GLU 34 CO 0.04 0.16 0.45 0.42 -0.49 0.00 0.00 175.26 175.84 2ee2 s ILE 35 N 0.22 0.01 -0.07 -1.63 1.01 -1.07 -0.47 121.20 119.20 2ee2 s ILE 35 Ca -0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 60.65 60.52 2ee2 s ILE 35 Cb -0.12 -0.66 -0.03 0.00 0.01 0.00 0.00 42.46 41.66 2ee2 s ILE 35 CO 0.02 -0.03 -0.03 -0.55 0.00 0.00 0.00 174.94 174.35 2ee2 s SER 36 N -0.04 4.99 -0.27 3.58 0.15 0.52 0.04 113.70 122.67 2ee2 s SER 36 Ca -0.02 0.07 0.03 0.00 0.70 0.00 0.00 55.95 56.72 2ee2 s SER 36 Cb -0.03 -1.34 0.07 0.00 -1.71 0.00 0.00 66.02 63.01 2ee2 s SER 36 CO 0.02 0.37 -0.07 -0.69 1.20 0.00 0.00 173.24 174.07 2ee2 s VAL 37 N -0.87 2.09 0.26 4.45 1.01 -0.41 -0.50 120.40 126.44 2ee2 s VAL 37 Ca 0.13 -1.73 0.06 0.00 0.00 0.00 0.00 61.98 60.44 2ee2 s VAL 37 Cb -0.11 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 2ee2 s VAL 37 CO 0.02 -0.17 0.33 -1.00 0.00 0.00 0.00 175.10 174.29 2ee2 s HIS 38 N 1.10 3.30 -0.02 5.22 3.76 -0.80 0.21 115.29 128.06 2ee2 s HIS 38 Ca -0.04 -0.08 -0.29 0.00 -0.15 0.00 0.00 55.06 54.50 2ee2 s HIS 38 Cb -0.20 -1.58 0.11 0.00 1.11 0.00 0.00 32.58 32.02 2ee2 s HIS 38 CO -0.06 0.40 0.91 1.67 -0.85 0.00 0.00 174.74 176.81 2ee2 s TRP 39 N -2.06 -0.33 -0.10 1.40 -2.14 -0.98 -2.83 118.94 111.91 2ee2 s TRP 39 Ca 0.35 0.21 -0.20 0.00 2.66 0.00 0.00 56.10 59.12 2ee2 s TRP 39 Cb -0.09 0.54 -0.04 0.00 -3.10 0.00 0.00 33.47 30.78 2ee2 s TRP 39 CO 0.28 -0.52 0.56 -2.00 -2.66 0.00 0.00 176.95 172.61 2ee2 s GLU 40 N -3.06 4.38 0.15 3.25 2.12 -1.20 -4.76 118.70 119.57 2ee2 s GLU 40 Ca 0.05 0.60 -0.32 0.00 0.36 0.00 0.00 54.97 55.66 2ee2 s GLU 40 Cb -0.01 -3.44 -0.12 0.00 0.26 0.00 0.00 34.13 30.82 2ee2 s GLU 40 CO -0.09 0.12 1.75 0.72 -0.54 0.00 0.00 175.26 177.22 2ee2 n HIS 41 N 3.72 2.57 -1.64 5.30 8.25 -1.26 -4.45 115.22 127.71 2ee2 n HIS 41 Ca -0.05 0.02 -0.33 0.00 -0.26 0.00 0.00 57.72 57.09 2ee2 n HIS 41 Cb 0.51 -2.67 0.06 0.00 1.12 0.00 0.00 29.99 29.02 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 1.89 2.91 -1.36 1.59 -7.23 -1.26 -4.88 120.40 112.05 2ee2 s VAL 42 Ca 0.80 0.43 0.11 0.00 -1.81 0.00 0.00 61.98 61.51 2ee2 s VAL 42 Cb -0.55 -2.96 0.18 0.00 0.56 0.00 0.00 36.38 33.61 2ee2 s VAL 42 CO 0.37 -0.25 1.27 0.00 -0.31 0.00 0.00 175.10 176.18 2ee2 n LEU 43 N -2.52 0.00 -4.44 1.32 -0.00 -1.26 -4.46 117.00 105.65 2ee2 n LEU 43 Ca 0.11 0.32 -0.44 0.00 -0.00 0.00 0.00 56.01 56.01 2ee2 n LEU 43 Cb 0.51 -0.32 -0.06 0.00 -0.00 0.00 0.00 43.42 43.55 2ee2 n LEU 43 CO 0.48 -0.20 0.30 -1.61 -0.00 0.00 0.00 177.39 176.36 2ee2 s GLU 44 N -2.64 3.11 0.00 1.47 0.41 -1.26 -4.89 118.70 114.89 2ee2 s GLU 44 Ca 0.10 -0.94 0.14 0.00 -0.41 0.00 0.00 54.97 53.85 2ee2 s GLU 44 Cb 0.07 -4.10 0.81 0.00 -1.78 0.00 0.00 34.13 29.13 2ee2 s GLU 44 CO 0.18 -1.20 1.51 1.17 -0.49 0.00 0.00 175.26 176.43 2ee2 n LYS 45 N 6.07 0.99 0.13 1.61 3.00 -1.26 -3.18 118.16 125.52 2ee2 n LYS 45 Ca -0.07 0.00 0.05 0.00 -0.00 0.00 0.00 58.31 58.29 2ee2 n LYS 45 Cb 0.45 -1.22 0.03 0.00 0.00 0.00 0.00 35.03 34.30 2ee2 n LYS 45 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.40 176.56 2ee2 h ILE 46 N 0.00 0.49 -2.43 3.15 3.07 -1.95 -3.46 117.51 116.38 2ee2 h ILE 46 Ca 0.00 -1.74 -0.55 0.00 1.55 0.00 0.00 64.86 64.11 2ee2 h ILE 46 Cb 0.00 2.14 0.05 0.00 -0.27 0.00 0.00 36.82 38.74 2ee2 h ILE 46 CO 0.00 0.28 0.93 1.33 -1.05 0.00 0.00 178.15 179.64 2ee2 n VAL 47 N -3.06 0.07 -0.04 0.16 0.24 -1.19 -4.63 118.33 109.88 2ee2 n VAL 47 Ca 0.00 -0.01 -0.14 0.00 -2.04 0.00 0.00 64.34 62.15 2ee2 n VAL 47 Cb 0.68 -1.80 -0.11 0.00 -1.47 0.00 0.00 33.84 31.15 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 6.72 0.03 0.00 7.34 4.39 -1.86 -3.47 114.58 127.74 2ee2 h GLU 48 Ca -0.45 -0.03 -0.09 0.00 0.34 0.00 0.00 59.36 59.14 2ee2 h GLU 48 Cb 1.23 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.88 2ee2 h GLU 48 CO 0.93 0.75 0.18 0.43 -1.16 0.00 0.00 179.01 180.13 2ee2 n SER 49 N -4.71 -2.09 -4.26 1.42 7.64 -1.18 -3.20 113.62 107.24 2ee2 n SER 49 Ca -0.09 -2.67 -0.33 0.00 1.01 0.00 0.00 58.87 56.79 2ee2 n SER 49 Cb 0.37 3.55 -0.15 0.00 -1.01 0.00 0.00 64.21 66.97 2ee2 n SER 49 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2ee2 s TYR 50 N -2.34 2.80 -0.36 1.43 1.51 -1.16 -2.15 117.35 117.08 2ee2 s TYR 50 Ca 0.19 -1.09 -0.20 0.00 -1.01 0.00 0.00 57.07 54.96 2ee2 s TYR 50 Cb -0.04 -1.91 0.00 0.00 -0.11 0.00 0.00 41.96 39.90 2ee2 s TYR 50 CO 0.14 -0.51 0.61 -0.65 -1.11 0.00 0.00 175.55 174.03 2ee2 s GLN 51 N 0.92 3.64 -0.50 -0.62 -1.52 -0.01 -3.04 119.66 118.53 2ee2 s GLN 51 Ca -0.03 -0.01 -0.11 0.00 -1.95 0.00 0.00 55.36 53.25 2ee2 s GLN 51 Cb -0.15 -3.82 0.13 0.00 -0.22 0.00 0.00 33.01 28.95 2ee2 s GLN 51 CO -0.02 -0.74 0.41 0.42 -0.25 0.00 0.00 175.29 175.12 2ee2 s ILE 52 N 2.66 4.57 0.27 1.08 1.09 -0.20 -2.07 121.20 128.60 2ee2 s ILE 52 Ca 0.23 -1.72 -0.19 0.00 -1.10 0.00 0.00 60.65 57.87 2ee2 s ILE 52 Cb -0.15 -3.98 -0.09 0.00 -1.06 0.00 0.00 42.46 37.19 2ee2 s ILE 52 CO 0.15 -0.82 0.76 -0.13 -0.10 0.00 0.00 174.94 174.80 2ee2 s ARG 53 N 1.40 4.20 -0.19 2.79 0.52 -0.76 -2.15 118.95 124.76 2ee2 s ARG 53 Ca 0.05 0.86 -0.13 0.00 -0.52 0.00 0.00 55.73 55.99 2ee2 s ARG 53 Cb -0.27 -2.71 0.06 0.00 0.52 0.00 0.00 34.95 32.55 2ee2 s ARG 53 CO 0.00 0.29 0.47 1.52 0.02 0.00 0.00 175.30 177.61 2ee2 s TYR 54 N -1.70 -0.63 0.21 -0.53 1.13 -1.23 -1.92 117.35 112.68 2ee2 s TYR 54 Ca 0.48 1.40 -0.20 0.00 -1.41 0.00 0.00 57.07 57.34 2ee2 s TYR 54 Cb -0.15 0.28 0.04 0.00 -1.10 0.00 0.00 41.96 41.03 2ee2 s TYR 54 CO 0.20 -0.33 0.59 1.67 -2.51 0.00 0.00 175.55 175.17 2ee2 s TRP 55 N 0.98 -0.24 0.63 -3.49 -2.14 -1.16 -2.64 118.94 110.87 2ee2 s TRP 55 Ca -0.06 -0.09 -0.13 0.00 2.66 0.00 0.00 56.10 58.48 2ee2 s TRP 55 Cb -0.06 0.51 -0.02 0.00 -3.10 0.00 0.00 33.47 30.80 2ee2 s TRP 55 CO -0.08 -0.98 1.05 0.00 -2.66 0.00 0.00 176.95 174.28 2ee2 s ALA 56 N -3.85 2.80 0.33 2.67 0.00 -1.26 -0.60 121.76 121.84 2ee2 s ALA 56 Ca 0.08 0.18 0.09 0.00 0.00 0.00 0.00 51.96 52.31 2ee2 s ALA 56 Cb -0.02 -3.18 0.86 0.00 0.00 0.00 0.00 23.12 20.78 2ee2 s ALA 56 CO -0.03 -0.90 1.77 0.00 0.00 0.00 0.00 175.76 176.60 2ee2 h ALA 57 N -0.09 1.82 -0.11 0.00 0.00 -1.85 -0.73 119.26 118.30 2ee2 h ALA 57 Ca -0.45 0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 2ee2 h ALA 57 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2ee2 h ALA 57 CO 0.58 -0.22 -0.40 1.12 0.00 0.00 0.00 179.25 180.33 2ee2 h HIS 58 N 0.64 0.62 -2.86 0.00 -0.00 -1.92 -3.46 115.15 108.18 2ee2 h HIS 58 Ca 0.59 -0.26 -0.49 0.00 -0.00 0.00 0.00 60.37 60.21 2ee2 h HIS 58 Cb 1.09 -0.10 0.23 0.00 -0.00 0.00 0.00 27.41 28.62 2ee2 h HIS 58 CO -0.00 1.00 -0.83 -0.25 -0.00 0.00 0.00 177.93 177.85 2ee2 n ASP 59 N -4.32 -2.25 -4.65 3.10 8.00 -0.28 -5.01 116.55 111.14 2ee2 n ASP 59 Ca -0.08 0.10 -0.28 0.00 0.71 0.00 0.00 54.79 55.24 2ee2 n ASP 59 Cb 0.54 -1.08 -0.08 0.00 -0.02 0.00 0.00 41.12 40.48 2ee2 n ASP 59 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2ee2 s LYS 60 N -3.54 2.38 0.56 -1.24 1.02 -1.26 -4.79 119.74 112.87 2ee2 s LYS 60 Ca 0.56 -1.03 0.26 0.00 0.02 0.00 0.00 55.97 55.78 2ee2 s LYS 60 Cb -0.16 -2.39 1.50 0.00 -0.52 0.00 0.00 37.83 36.26 2ee2 s LYS 60 CO 0.67 0.48 2.04 1.05 -0.92 0.00 0.00 175.35 178.68 2ee2 h GLU 61 N 3.04 0.00 0.00 1.68 4.11 -1.95 0.21 114.58 121.67 2ee2 h GLU 61 Ca -0.48 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 58.82 2ee2 h GLU 61 Cb 1.19 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 2ee2 h GLU 61 CO 0.57 0.00 -0.64 1.05 0.07 0.00 0.00 179.01 180.06 2ee2 h GLU 62 N 0.00 0.00 -0.67 1.06 4.11 -2.01 -3.02 114.58 114.06 2ee2 h GLU 62 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.58 2ee2 h GLU 62 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2ee2 h GLU 62 CO -0.00 0.64 0.00 0.00 0.07 0.00 0.00 179.01 179.72 2ee2 n ALA 63 N -2.37 2.53 -2.26 1.06 0.00 0.58 -4.96 120.51 115.09 2ee2 n ALA 63 Ca -0.01 -1.38 -0.41 0.00 0.00 0.00 0.00 53.44 51.65 2ee2 n ALA 63 Cb 0.66 -0.89 -0.04 0.00 0.00 0.00 0.00 19.45 19.18 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 -1.23 3.26 1.29 0.00 0.00 -0.32 -4.82 121.76 119.94 2ee2 s ALA 64 Ca 0.47 0.61 -0.18 0.00 0.00 0.00 0.00 51.96 52.86 2ee2 s ALA 64 Cb 0.26 -3.29 0.31 0.00 0.00 0.00 0.00 23.12 20.40 2ee2 s ALA 64 CO 0.29 -0.06 0.81 0.09 0.00 0.00 0.00 175.76 176.89 2ee2 n ASN 65 N 2.80 -2.93 -3.76 0.00 3.02 -1.08 -4.80 115.26 108.51 2ee2 n ASN 65 Ca 0.03 -0.48 -0.14 0.00 -0.03 0.00 0.00 54.58 53.96 2ee2 n ASN 65 Cb 0.49 -1.09 -0.15 0.00 -0.61 0.00 0.00 39.78 38.42 2ee2 n ASN 65 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2ee2 s ARG 66 N -4.48 0.02 -0.32 3.52 0.52 -1.26 -3.48 118.95 113.47 2ee2 s ARG 66 Ca 0.65 0.27 0.03 0.00 -0.52 0.00 0.00 55.73 56.16 2ee2 s ARG 66 Cb -0.18 -0.22 0.09 0.00 0.52 0.00 0.00 34.95 35.16 2ee2 s ARG 66 CO 0.60 -0.17 0.03 0.08 0.02 0.00 0.00 175.30 175.86 2ee2 s VAL 67 N 1.13 1.97 -0.43 3.52 1.01 -0.91 -4.94 120.40 121.74 2ee2 s VAL 67 Ca -0.09 -2.00 -0.16 0.00 0.00 0.00 0.00 61.98 59.73 2ee2 s VAL 67 Cb -0.12 -2.39 0.03 0.00 0.00 0.00 0.00 36.38 33.90 2ee2 s VAL 67 CO -0.04 -0.50 0.37 -1.58 0.00 0.00 0.00 175.10 173.35 2ee2 s GLN 68 N 1.09 3.01 0.12 2.72 0.74 -1.26 -1.03 119.66 125.05 2ee2 s GLN 68 Ca 0.07 -1.00 0.07 0.00 0.05 0.00 0.00 55.36 54.55 2ee2 s GLN 68 Cb -0.19 -4.01 -0.04 0.00 1.10 0.00 0.00 33.01 29.87 2ee2 s GLN 68 CO -0.10 -0.85 -0.08 0.14 -0.55 0.00 0.00 175.29 173.84 2ee2 s VAL 69 N 1.85 3.42 0.18 1.34 -7.23 -1.17 -4.96 120.40 113.83 2ee2 s VAL 69 Ca 0.07 -1.31 -0.32 0.00 -1.81 0.00 0.00 61.98 58.62 2ee2 s VAL 69 Cb -0.19 -2.63 -0.16 0.00 0.56 0.00 0.00 36.38 33.96 2ee2 s VAL 69 CO 0.11 0.07 0.95 0.35 -0.31 0.00 0.00 175.10 176.26 2ee2 n THR 70 N 0.54 1.26 0.11 5.32 -2.24 -1.26 -2.96 114.28 115.05 2ee2 n THR 70 Ca -0.13 -0.32 0.06 0.00 -2.27 0.00 0.00 64.05 61.40 2ee2 n THR 70 Cb 0.53 -0.53 0.32 0.00 -2.10 0.00 0.00 70.33 68.55 2ee2 n THR 70 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2ee2 n SER 71 N 1.80 0.31 0.08 3.42 2.88 -1.19 -0.51 113.62 120.40 2ee2 n SER 71 Ca 0.16 0.59 -0.10 0.00 -1.33 0.00 0.00 58.87 58.19 2ee2 n SER 71 Cb 0.24 -0.61 -0.02 0.00 -0.75 0.00 0.00 64.21 63.07 2ee2 n SER 71 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 2ee2 h GLN 72 N 0.00 0.23 -6.07 -1.46 4.20 -1.88 -3.42 115.11 106.71 2ee2 h GLN 72 Ca 0.00 -0.26 -0.52 0.00 0.06 0.00 0.00 58.65 57.94 2ee2 h GLN 72 Cb 0.21 0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.03 2ee2 h GLN 72 CO 0.00 0.99 1.32 -1.21 -0.67 0.00 0.00 178.83 179.26 2ee2 s GLU 73 N -3.19 2.81 0.56 1.46 0.41 0.33 -4.82 118.70 116.27 2ee2 s GLU 73 Ca -0.03 0.78 0.32 0.00 -0.41 0.00 0.00 54.97 55.62 2ee2 s GLU 73 Cb 0.10 -4.33 1.75 0.00 -1.78 0.00 0.00 34.13 29.87 2ee2 s GLU 73 CO 0.84 -2.50 1.97 1.88 -0.49 0.00 0.00 175.26 176.96 2ee2 h TYR 74 N 14.31 0.00 -4.10 1.61 0.05 -1.85 -3.43 116.97 123.55 2ee2 h TYR 74 Ca -0.27 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.36 2ee2 h TYR 74 Cb 1.16 0.00 -0.12 0.00 1.01 0.00 0.00 36.73 38.78 2ee2 h TYR 74 CO 1.02 0.00 -0.36 -1.54 -1.05 0.00 0.00 178.16 176.24 2ee2 s SER 75 N -4.51 0.04 0.41 3.88 1.04 -1.26 -2.31 113.70 110.98 2ee2 s SER 75 Ca -0.04 -1.15 0.04 0.00 0.48 0.00 0.00 55.95 55.28 2ee2 s SER 75 Cb 0.09 0.49 -0.02 0.00 0.10 0.00 0.00 66.02 66.68 2ee2 s SER 75 CO 0.29 -1.00 0.15 0.00 0.98 0.00 0.00 173.24 173.66 2ee2 s ALA 76 N -4.07 2.86 -0.00 5.32 0.00 0.13 -4.95 121.76 121.04 2ee2 s ALA 76 Ca 0.30 -1.28 0.02 0.00 0.00 0.00 0.00 51.96 51.01 2ee2 s ALA 76 Cb 0.03 0.83 -0.01 0.00 0.00 0.00 0.00 23.12 23.97 2ee2 s ALA 76 CO 0.11 -0.37 -0.07 0.50 0.00 0.00 0.00 175.76 175.92 2ee2 s ARG 77 N -3.67 0.57 -0.04 0.00 3.52 -1.26 -1.28 118.95 116.78 2ee2 s ARG 77 Ca 0.25 -0.28 0.05 0.00 -0.13 0.00 0.00 55.73 55.61 2ee2 s ARG 77 Cb 0.02 -0.54 -0.02 0.00 -1.56 0.00 0.00 34.95 32.85 2ee2 s ARG 77 CO 0.16 0.15 -0.17 -0.51 -0.81 0.00 0.00 175.30 174.12 2ee2 s LEU 78 N -0.25 2.58 0.19 -0.88 1.43 0.11 -4.98 118.68 116.87 2ee2 s LEU 78 Ca 0.02 -0.26 -0.01 0.00 -1.03 0.00 0.00 54.13 52.85 2ee2 s LEU 78 Cb -0.03 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.64 2ee2 s LEU 78 CO -0.00 0.34 0.10 -1.61 0.23 0.00 0.00 176.35 175.41 2ee2 s GLU 79 N -0.68 1.16 -0.86 1.70 2.02 -1.26 -2.59 118.70 118.19 2ee2 s GLU 79 Ca 0.11 -1.60 -0.02 0.00 0.02 0.00 0.00 54.97 53.48 2ee2 s GLU 79 Cb -0.11 0.16 0.00 0.00 0.10 0.00 0.00 34.13 34.29 2ee2 s GLU 79 CO 0.00 -0.33 0.73 0.09 0.02 0.00 0.00 175.26 175.77 2ee2 n ASN 80 N -0.25 -3.17 -4.93 -0.19 5.03 -1.23 -5.03 115.26 105.49 2ee2 n ASN 80 Ca -0.01 -0.40 -0.24 0.00 0.87 0.00 0.00 54.58 54.81 2ee2 n ASN 80 Cb 0.65 -3.62 0.01 0.00 -1.02 0.00 0.00 39.78 35.81 2ee2 n ASN 80 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2ee2 s LEU 81 N -5.08 2.88 -0.04 3.41 1.43 -1.25 -5.12 118.68 114.91 2ee2 s LEU 81 Ca 0.15 -1.09 -0.02 0.00 -1.03 0.00 0.00 54.13 52.15 2ee2 s LEU 81 Cb -0.07 -1.40 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 2ee2 s LEU 81 CO 0.49 -1.11 0.09 -0.76 0.23 0.00 0.00 176.35 175.29 2ee2 s LEU 82 N -4.36 3.97 0.44 1.79 1.43 -1.26 -4.65 118.68 116.04 2ee2 s LEU 82 Ca 0.43 0.22 -0.24 0.00 -1.03 0.00 0.00 54.13 53.51 2ee2 s LEU 82 Cb -0.03 -2.20 -0.08 0.00 0.03 0.00 0.00 46.19 43.91 2ee2 s LEU 82 CO 0.26 0.31 1.17 -2.16 0.23 0.00 0.00 176.35 176.17 2ee2 s PRO 83 N -1.50 3.84 -1.39 1.29 0.04 -1.26 -3.65 135.00 132.37 2ee2 s PRO 83 Ca 0.20 1.80 -0.17 0.00 0.04 0.00 0.00 61.00 62.88 2ee2 s PRO 83 Cb -0.12 -2.49 0.02 0.00 0.04 0.00 0.00 34.50 31.96 2ee2 s PRO 83 CO 0.11 -0.49 0.33 -3.47 0.04 0.00 0.00 177.00 173.51 2ee2 n ASP 84 N -0.32 -1.45 -3.91 6.66 -0.08 0.92 -4.87 116.55 113.50 2ee2 n ASP 84 Ca 0.06 -1.29 -0.18 0.00 -1.51 0.00 0.00 54.79 51.87 2ee2 n ASP 84 Cb 0.47 -1.61 -0.15 0.00 2.34 0.00 0.00 41.12 42.17 2ee2 n ASP 84 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 2ee2 s THR 85 N -3.98 0.42 0.06 5.18 2.01 -1.24 -4.91 115.64 113.18 2ee2 s THR 85 Ca 0.24 -0.13 -0.31 0.00 0.31 0.00 0.00 61.69 61.80 2ee2 s THR 85 Cb -0.13 -0.42 -0.06 0.00 0.01 0.00 0.00 72.50 71.89 2ee2 s THR 85 CO 0.99 0.17 1.35 -1.58 -0.69 0.00 0.00 174.62 174.85 2ee2 s GLN 86 N 0.48 4.33 -0.12 4.92 0.74 -1.26 -3.44 119.66 125.32 2ee2 s GLN 86 Ca -0.06 1.96 -0.01 0.00 0.05 0.00 0.00 55.36 57.31 2ee2 s GLN 86 Cb -0.09 -3.40 0.03 0.00 1.10 0.00 0.00 33.01 30.65 2ee2 s GLN 86 CO -0.00 -0.45 -0.07 0.71 -0.55 0.00 0.00 175.29 174.93 2ee2 s TYR 87 N 1.61 1.44 -0.46 1.67 1.51 -0.47 -2.30 117.35 120.36 2ee2 s TYR 87 Ca 0.63 -0.73 -0.28 0.00 -1.01 0.00 0.00 57.07 55.68 2ee2 s TYR 87 Cb -0.33 -1.21 0.03 0.00 -0.11 0.00 0.00 41.96 40.34 2ee2 s TYR 87 CO 0.28 -0.51 1.08 -0.06 -1.11 0.00 0.00 175.55 175.23 2ee2 s PHE 88 N 1.72 2.87 0.17 2.71 0.08 0.23 -0.95 117.98 124.81 2ee2 s PHE 88 Ca 0.05 0.67 0.04 0.00 0.12 0.00 0.00 56.93 57.81 2ee2 s PHE 88 Cb -0.13 -4.25 -0.04 0.00 -0.57 0.00 0.00 43.02 38.04 2ee2 s PHE 88 CO -0.08 -1.18 0.22 0.42 -0.10 0.00 0.00 175.22 174.50 2ee2 s ILE 89 N 4.20 4.87 -0.28 0.64 1.01 -0.49 -3.01 121.20 128.15 2ee2 s ILE 89 Ca 0.45 -0.94 -0.13 0.00 0.00 0.00 0.00 60.65 60.03 2ee2 s ILE 89 Cb -0.08 -3.52 0.10 0.00 0.01 0.00 0.00 42.46 38.96 2ee2 s ILE 89 CO 0.29 -0.13 0.64 -0.70 0.00 0.00 0.00 174.94 175.04 2ee2 s GLU 90 N -3.27 0.62 -0.25 2.79 2.12 -0.81 -2.85 118.70 117.05 2ee2 s GLU 90 Ca 0.33 1.27 -0.08 0.00 0.36 0.00 0.00 54.97 56.85 2ee2 s GLU 90 Cb -0.10 0.40 -0.03 0.00 0.26 0.00 0.00 34.13 34.66 2ee2 s GLU 90 CO 0.26 -0.17 0.08 0.08 -0.54 0.00 0.00 175.26 174.97 2ee2 s VAL 91 N 2.12 4.36 -0.05 3.70 1.01 -1.26 -1.83 120.40 128.44 2ee2 s VAL 91 Ca -0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 61.98 61.71 2ee2 s VAL 91 Cb -0.08 -3.06 0.03 0.00 0.00 0.00 0.00 36.38 33.27 2ee2 s VAL 91 CO -0.19 0.32 0.01 -0.83 0.00 0.00 0.00 175.10 174.40 2ee2 s GLY 92 N 1.62 0.38 0.31 4.51 0.00 -0.88 -3.16 107.32 110.09 2ee2 s GLY 92 Ca 0.06 -0.00 -0.16 0.00 0.00 0.00 0.00 44.72 44.62 2ee2 s GLY 92 CO 0.04 1.00 0.74 0.00 0.00 0.00 0.00 173.10 174.88 2ee2 s ALA 93 N 1.70 3.33 -0.19 3.20 0.00 -1.26 -0.83 121.76 127.70 2ee2 s ALA 93 Ca 0.00 0.07 -0.30 0.00 0.00 0.00 0.00 51.96 51.74 2ee2 s ALA 93 Cb -0.13 -2.79 0.14 0.00 0.00 0.00 0.00 23.12 20.35 2ee2 s ALA 93 CO -0.04 0.33 1.09 0.00 0.00 0.00 0.00 175.76 177.14 2ee2 s ASN 95 N -1.13 4.82 0.14 0.00 2.20 -1.18 -2.85 114.94 116.94 2ee2 s ASN 95 Ca 0.01 -0.93 0.17 0.00 -0.94 0.00 0.00 52.86 51.18 2ee2 s ASN 95 Cb -0.01 -0.33 0.76 0.00 -2.00 0.00 0.00 41.25 39.68 2ee2 s ASN 95 CO -0.01 -0.73 1.54 -0.24 -2.94 0.00 0.00 177.10 174.71 2ee2 n SER 96 N -1.53 0.34 0.00 3.54 2.88 -1.26 -3.70 113.62 113.88 2ee2 n SER 96 Ca 0.02 0.60 0.00 0.00 -1.33 0.00 0.00 58.87 58.15 2ee2 n SER 96 Cb 0.63 -0.66 0.00 0.00 -0.75 0.00 0.00 64.21 63.43 2ee2 n SER 96 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ee2 n ALA 97 N -1.64 0.00 -2.41 -1.46 0.00 -1.26 -4.98 120.51 108.76 2ee2 n ALA 97 Ca 0.02 -0.02 -0.29 0.00 0.00 0.00 0.00 53.44 53.14 2ee2 n ALA 97 Cb 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.48 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 -1.74 1.58 0.23 0.00 0.00 -1.15 -4.80 107.32 101.44 2ee2 s GLY 98 Ca 0.00 -1.41 -0.17 0.00 0.00 0.00 0.00 44.72 43.15 2ee2 s GLY 98 CO 0.00 -1.37 0.68 0.00 0.00 0.00 0.00 173.10 172.41 2ee2 s GLY 100 N -1.85 1.69 0.40 0.00 0.00 -1.26 -4.60 107.32 101.70 2ee2 s GLY 100 Ca 0.45 -1.59 -0.25 0.00 0.00 0.00 0.00 44.72 43.33 2ee2 s GLY 100 CO 0.20 -1.64 1.19 2.56 0.00 0.00 0.00 173.10 175.41 2ee2 s PRO 101 N -3.39 4.02 0.66 2.90 0.04 -1.26 -4.89 135.00 133.08 2ee2 s PRO 101 Ca 0.29 1.88 -0.15 0.00 0.04 0.00 0.00 61.00 63.06 2ee2 s PRO 101 Cb -0.07 -2.67 0.00 0.00 0.04 0.00 0.00 34.50 31.80 2ee2 s PRO 101 CO 0.18 -0.36 1.11 -1.25 0.04 0.00 0.00 177.00 176.73 2ee2 s PRO 102 N -2.31 2.79 0.95 0.56 0.04 -1.26 -4.70 135.00 131.07 2ee2 s PRO 102 Ca 0.57 1.38 -0.14 0.00 0.04 0.00 0.00 61.00 62.86 2ee2 s PRO 102 Cb -0.32 -1.95 0.21 0.00 0.04 0.00 0.00 34.50 32.49 2ee2 s PRO 102 CO 0.40 -1.26 1.30 -1.54 0.04 0.00 0.00 177.00 175.94 2ee2 s SER 103 N -2.61 3.03 0.50 6.66 1.04 -1.19 -5.00 113.70 116.13 2ee2 s SER 103 Ca 0.67 0.02 -0.21 0.00 0.48 0.00 0.00 55.95 56.91 2ee2 s SER 103 Cb -0.20 -0.02 -0.08 0.00 0.10 0.00 0.00 66.02 65.82 2ee2 s SER 103 CO 0.42 -2.77 0.93 -0.67 0.98 0.00 0.00 173.24 172.13 2ee2 n ASP 104 N -3.70 0.79 -4.60 7.02 2.03 -1.26 -4.83 116.55 112.00 2ee2 n ASP 104 Ca 0.17 0.92 -0.43 0.00 0.52 0.00 0.00 54.79 55.97 2ee2 n ASP 104 Cb 0.59 -1.34 -0.04 0.00 -0.72 0.00 0.00 41.12 39.61 2ee2 n ASP 104 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 2ee2 s MET 105 N -2.28 3.78 0.13 -0.67 -2.45 -1.26 -4.73 119.30 111.82 2ee2 s MET 105 Ca 0.68 0.51 0.07 0.00 -1.25 0.00 0.00 55.69 55.70 2ee2 s MET 105 Cb -0.49 -3.83 -0.04 0.00 1.25 0.00 0.00 34.83 31.72 2ee2 s MET 105 CO 0.53 -1.02 -0.07 0.42 1.05 0.00 0.00 175.02 175.93 2ee2 s ILE 106 N 3.57 3.47 -0.03 10.11 1.01 -1.13 -5.03 121.20 133.17 2ee2 s ILE 106 Ca 0.38 -1.32 0.05 0.00 0.00 0.00 0.00 60.65 59.76 2ee2 s ILE 106 Cb -0.11 -2.66 -0.03 0.00 0.01 0.00 0.00 42.46 39.67 2ee2 s ILE 106 CO 0.21 0.04 -0.18 -1.83 0.00 0.00 0.00 174.94 173.18 2ee2 s GLU 107 N -2.44 2.33 0.18 2.79 1.03 -1.26 -1.39 118.70 119.95 2ee2 s GLU 107 Ca 0.23 -0.80 0.10 0.00 0.03 0.00 0.00 54.97 54.54 2ee2 s GLU 107 Cb -0.11 -2.27 -0.04 0.00 -0.80 0.00 0.00 34.13 30.92 2ee2 s GLU 107 CO 0.15 0.59 -0.19 0.00 -1.33 0.00 0.00 175.26 174.48 2ee2 s ALA 108 N -0.74 2.67 -0.29 -0.84 0.00 -0.13 -4.96 121.76 117.47 2ee2 s ALA 108 Ca 0.12 -1.57 -0.01 0.00 0.00 0.00 0.00 51.96 50.50 2ee2 s ALA 108 Cb -0.10 -0.48 0.09 0.00 0.00 0.00 0.00 23.12 22.63 2ee2 s ALA 108 CO 0.01 0.46 0.09 -0.06 0.00 0.00 0.00 175.76 176.25 2ee2 s PHE 109 N -1.63 1.56 1.12 0.00 0.40 -1.26 -1.37 117.98 116.80 2ee2 s PHE 109 Ca 0.22 -1.58 -0.13 0.00 -0.60 0.00 0.00 56.93 54.84 2ee2 s PHE 109 Cb -0.08 -1.58 0.26 0.00 0.51 0.00 0.00 43.02 42.12 2ee2 s PHE 109 CO 0.11 -0.84 1.05 0.95 0.70 0.00 0.00 175.22 177.19 2ee2 s THR 110 N 1.67 2.03 0.59 0.64 -4.23 -1.22 -4.91 115.64 110.21 2ee2 s THR 110 Ca 0.08 0.01 -0.00 0.00 -1.18 0.00 0.00 61.69 60.60 2ee2 s THR 110 Cb -0.17 -2.19 0.04 0.00 1.34 0.00 0.00 72.50 71.52 2ee2 s THR 110 CO -0.24 -0.01 0.83 -0.54 -0.54 0.00 0.00 174.62 174.12 2ee2 s LYS 111 N -4.61 2.44 0.00 3.99 -0.14 -1.26 -3.29 119.74 116.87 2ee2 s LYS 111 Ca 0.68 -0.70 -0.30 0.00 -1.36 0.00 0.00 55.97 54.29 2ee2 s LYS 111 Cb -0.23 -2.42 -0.04 0.00 -1.68 0.00 0.00 37.83 33.46 2ee2 s LYS 111 CO 0.62 -0.84 1.12 0.15 -0.76 0.00 0.00 175.35 175.64 2ee2 s LYS 112 N -4.87 4.45 -0.15 1.68 1.02 -1.26 -0.06 119.74 120.54 2ee2 s LYS 112 Ca 0.58 1.62 -0.29 0.00 0.02 0.00 0.00 55.97 57.90 2ee2 s LYS 112 Cb -0.10 -3.45 -0.01 0.00 -0.52 0.00 0.00 37.83 33.75 2ee2 s LYS 112 CO 0.40 -0.25 1.18 0.00 -0.92 0.00 0.00 175.35 175.76 2ee2 s ALA 113 N 1.42 3.62 0.37 5.17 0.00 -1.26 -4.91 121.76 126.17 2ee2 s ALA 113 Ca 0.55 0.42 0.01 0.00 0.00 0.00 0.00 51.96 52.94 2ee2 s ALA 113 Cb -0.25 -3.57 -0.03 0.00 0.00 0.00 0.00 23.12 19.27 2ee2 s ALA 113 CO 0.26 -1.03 0.57 0.45 0.00 0.00 0.00 175.76 176.02 2ee2 s SER 114 N 1.64 6.18 0.12 0.00 0.15 -1.26 -5.11 113.70 115.42 2ee2 s SER 114 Ca 0.52 0.40 0.02 0.00 0.70 0.00 0.00 55.95 57.58 2ee2 s SER 114 Cb -0.20 -1.90 -0.01 0.00 -1.71 0.00 0.00 66.02 62.20 2ee2 s SER 114 CO 0.14 -0.39 0.12 0.61 1.20 0.00 0.00 173.24 174.92 2ee2 n GLY 115 N -1.85 3.38 0.00 9.45 0.00 -1.26 -5.02 105.19 109.89 2ee2 n GLY 115 Ca -0.03 -1.65 0.07 0.00 0.00 0.00 0.00 46.02 44.40 2ee2 n GLY 115 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2ee2 n PRO 116 N -0.21 0.14 -1.08 1.61 -0.04 -1.26 -4.84 135.00 129.32 2ee2 n PRO 116 Ca 0.02 0.18 -0.51 0.00 -0.04 0.00 0.00 63.50 63.15 2ee2 n PRO 116 Cb 0.21 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.07 2ee2 n PRO 116 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2ee2 n SER 117 N -1.35 0.66 -0.10 3.54 7.64 -1.26 -4.81 113.62 117.94 2ee2 n SER 117 Ca 0.06 0.60 -0.24 0.00 1.01 0.00 0.00 58.87 60.30 2ee2 n SER 117 Cb 0.13 -0.76 -0.12 0.00 -1.01 0.00 0.00 64.21 62.45 2ee2 n SER 117 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2ee2 n SER 118 N 6.19 1.94 0.00 6.43 2.88 -1.26 -5.24 113.62 124.57 2ee2 n SER 118 Ca 0.45 0.32 0.00 0.00 -1.33 0.00 0.00 58.87 58.31 2ee2 n SER 118 Cb -0.03 -0.86 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 2ee2 n SER 118 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42