#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ee2 h SER 2 N 0.00 -0.91 -2.38 1.61 4.64 -2.12 -3.43 113.55 110.96 2ee2 h SER 2 Ca 0.00 0.07 -0.61 0.00 -0.47 0.00 0.00 61.79 60.77 2ee2 h SER 2 Cb 0.00 0.29 0.10 0.00 -0.31 0.00 0.00 62.40 62.48 2ee2 h SER 2 CO 0.00 -0.47 0.21 -1.20 -0.87 0.00 0.00 176.83 174.50 2ee2 n SER 3 N -4.46 1.47 -1.09 4.97 7.64 -1.26 -4.65 113.62 116.25 2ee2 n SER 3 Ca -0.09 1.17 0.04 0.00 1.01 0.00 0.00 58.87 61.01 2ee2 n SER 3 Cb 0.32 -1.29 -0.01 0.00 -1.01 0.00 0.00 64.21 62.22 2ee2 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ee2 n GLY 4 N 1.48 -1.12 2.87 0.23 0.00 -1.26 -5.01 105.19 102.37 2ee2 n GLY 4 Ca 0.11 -1.01 -0.11 0.00 0.00 0.00 0.00 46.02 45.01 2ee2 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ee2 n SER 5 N -3.30 -1.33 -1.38 1.61 7.64 -1.26 -4.92 113.62 110.68 2ee2 n SER 5 Ca 0.00 -2.50 0.08 0.00 1.01 0.00 0.00 58.87 57.47 2ee2 n SER 5 Cb 0.15 2.38 0.32 0.00 -1.01 0.00 0.00 64.21 66.05 2ee2 n SER 5 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2ee2 n SER 6 N -1.63 4.58 -0.69 6.43 3.41 -1.26 -4.93 113.62 119.53 2ee2 n SER 6 Ca -0.02 -2.65 0.00 0.00 -0.26 0.00 0.00 58.87 55.94 2ee2 n SER 6 Cb 0.49 -0.56 0.00 0.00 -0.26 0.00 0.00 64.21 63.88 2ee2 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2ee2 n GLY 7 N 0.53 0.81 3.89 5.00 0.00 -1.26 -5.09 105.19 109.07 2ee2 n GLY 7 Ca 0.24 -0.48 -0.36 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.38 5.49 -0.08 1.61 0.11 -1.26 -5.09 120.40 118.79 2ee2 s VAL 8 Ca 0.00 0.13 -0.30 0.00 -2.93 0.00 0.00 61.98 58.89 2ee2 s VAL 8 Cb 0.00 -3.43 0.11 0.00 -1.53 0.00 0.00 36.38 31.53 2ee2 s VAL 8 CO 0.00 0.56 0.89 0.00 -3.33 0.00 0.00 175.10 173.22 2ee2 s ALA 9 N -1.09 -1.86 0.25 1.54 0.00 -1.26 -5.15 121.76 114.19 2ee2 s ALA 9 Ca 0.18 1.33 -0.30 0.00 0.00 0.00 0.00 51.96 53.17 2ee2 s ALA 9 Cb -0.12 -0.19 -0.10 0.00 0.00 0.00 0.00 23.12 22.71 2ee2 s ALA 9 CO 0.07 -0.45 1.36 0.14 0.00 0.00 0.00 175.76 176.89 2ee2 s VAL 10 N -1.80 2.87 0.55 0.00 -7.23 -1.26 -4.93 120.40 108.60 2ee2 s VAL 10 Ca -0.01 0.76 -0.16 0.00 -1.81 0.00 0.00 61.98 60.75 2ee2 s VAL 10 Cb -0.01 -3.48 -0.14 0.00 0.56 0.00 0.00 36.38 33.31 2ee2 s VAL 10 CO -0.00 0.13 -0.23 2.30 -0.31 0.00 0.00 175.10 176.98 2ee2 n ILE 11 N 2.10 0.00 -3.40 -0.62 -6.64 -1.26 -4.88 119.36 104.65 2ee2 n ILE 11 Ca 0.05 -0.46 -0.41 0.00 -1.77 0.00 0.00 62.75 60.16 2ee2 n ILE 11 Cb 0.41 0.00 -0.09 0.00 -1.44 0.00 0.00 39.64 38.52 2ee2 n ILE 11 CO 0.00 0.00 0.00 0.20 -1.77 0.00 0.00 176.55 174.98 2ee2 s ASN 12 N -0.92 6.17 -0.31 7.28 0.01 -1.26 -5.02 114.94 120.88 2ee2 s ASN 12 Ca 0.50 -0.37 -0.28 0.00 -0.71 0.00 0.00 52.86 52.00 2ee2 s ASN 12 Cb -0.40 -2.19 -0.03 0.00 0.41 0.00 0.00 41.25 39.03 2ee2 s ASN 12 CO 0.64 -0.38 2.02 -0.44 -1.51 0.00 0.00 177.10 177.43 2ee2 s SER 13 N 1.74 5.58 -0.27 -1.22 0.01 -1.26 -4.92 113.70 113.35 2ee2 s SER 13 Ca 0.11 1.48 -0.23 0.00 1.31 0.00 0.00 55.95 58.62 2ee2 s SER 13 Cb -0.17 -2.52 0.09 0.00 0.21 0.00 0.00 66.02 63.63 2ee2 s SER 13 CO 0.12 -1.93 0.79 0.00 0.41 0.00 0.00 173.24 172.62 2ee2 s ALA 14 N 7.96 -1.86 0.15 1.44 0.00 -1.26 -5.00 121.76 123.19 2ee2 s ALA 14 Ca 0.89 2.08 -0.16 0.00 0.00 0.00 0.00 51.96 54.77 2ee2 s ALA 14 Cb -0.26 -1.30 0.02 0.00 0.00 0.00 0.00 23.12 21.59 2ee2 s ALA 14 CO 0.33 -0.33 1.80 -0.56 0.00 0.00 0.00 175.76 177.00 2ee2 h GLN 15 N 5.25 0.44 -2.77 0.00 3.07 -1.93 -3.47 115.11 115.71 2ee2 h GLN 15 Ca -0.29 -0.03 0.10 0.00 0.09 0.00 0.00 58.65 58.52 2ee2 h GLN 15 Cb 1.18 -0.10 -0.07 0.00 0.08 0.00 0.00 27.48 28.57 2ee2 h GLN 15 CO 0.09 0.29 0.32 -0.51 0.09 0.00 0.00 178.83 179.11 2ee2 s ASP 16 N -5.49 -0.27 0.01 0.06 1.01 -1.26 -5.14 116.67 105.60 2ee2 s ASP 16 Ca -0.13 -0.47 0.01 0.00 0.71 0.00 0.00 52.55 52.67 2ee2 s ASP 16 Cb 0.11 0.63 -0.01 0.00 1.01 0.00 0.00 42.92 44.66 2ee2 s ASP 16 CO 0.72 -1.15 -0.03 0.00 0.21 0.00 0.00 175.17 174.92 2ee2 s ALA 17 N -3.68 0.18 0.01 5.23 0.00 -1.26 -3.28 121.76 118.96 2ee2 s ALA 17 Ca 0.10 -0.30 -0.30 0.00 0.00 0.00 0.00 51.96 51.46 2ee2 s ALA 17 Cb -0.04 0.03 -0.06 0.00 0.00 0.00 0.00 23.12 23.05 2ee2 s ALA 17 CO 0.03 -0.03 1.45 -1.25 0.00 0.00 0.00 175.76 175.96 2ee2 s PRO 18 N -0.63 4.26 0.00 0.00 0.04 -1.26 -4.89 135.00 132.52 2ee2 s PRO 18 Ca -0.05 2.02 0.07 0.00 0.04 0.00 0.00 61.00 63.08 2ee2 s PRO 18 Cb -0.04 -3.60 0.05 0.00 0.04 0.00 0.00 34.50 30.95 2ee2 s PRO 18 CO -0.00 -0.61 0.70 0.45 0.04 0.00 0.00 177.00 177.58 2ee2 n SER 19 N 5.49 1.52 -4.72 6.66 2.88 -1.26 -4.49 113.62 119.71 2ee2 n SER 19 Ca 0.14 -1.26 -0.29 0.00 -1.33 0.00 0.00 58.87 56.13 2ee2 n SER 19 Cb 0.43 0.04 -0.08 0.00 -0.75 0.00 0.00 64.21 63.85 2ee2 n SER 19 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 2ee2 s GLU 20 N -0.62 2.12 0.04 -1.46 1.03 -1.26 -5.01 118.70 113.54 2ee2 s GLU 20 Ca 0.08 -2.14 0.02 0.00 0.03 0.00 0.00 54.97 52.96 2ee2 s GLU 20 Cb 0.06 -1.72 -0.02 0.00 -0.80 0.00 0.00 34.13 31.64 2ee2 s GLU 20 CO 0.09 -0.22 -0.07 0.00 -1.33 0.00 0.00 175.26 173.73 2ee2 s ALA 21 N -2.75 0.52 -0.46 -0.84 0.00 -1.26 -4.73 121.76 112.25 2ee2 s ALA 21 Ca 0.27 -0.70 -0.28 0.00 0.00 0.00 0.00 51.96 51.25 2ee2 s ALA 21 Cb 0.05 0.04 -0.02 0.00 0.00 0.00 0.00 23.12 23.19 2ee2 s ALA 21 CO 0.14 -0.02 1.77 -1.25 0.00 0.00 0.00 175.76 176.41 2ee2 s PRO 22 N -1.43 3.06 0.87 0.00 0.04 -1.26 -4.92 135.00 131.37 2ee2 s PRO 22 Ca -0.09 1.00 -0.10 0.00 0.04 0.00 0.00 61.00 61.85 2ee2 s PRO 22 Cb -0.09 -4.26 0.18 0.00 0.04 0.00 0.00 34.50 30.37 2ee2 s PRO 22 CO 0.00 -2.19 1.20 0.99 0.04 0.00 0.00 177.00 177.04 2ee2 s THR 23 N 7.62 2.04 -1.46 1.26 2.01 -1.26 -4.39 115.64 121.45 2ee2 s THR 23 Ca 0.72 -0.25 -0.03 0.00 0.31 0.00 0.00 61.69 62.44 2ee2 s THR 23 Cb -0.17 -2.79 0.02 0.00 0.01 0.00 0.00 72.50 69.58 2ee2 s THR 23 CO 0.28 0.00 0.45 -0.62 -0.69 0.00 0.00 174.62 174.03 2ee2 n GLU 24 N -3.41 -3.14 -3.64 4.92 1.02 -1.26 -3.34 120.64 111.79 2ee2 n GLU 24 Ca 0.16 0.38 -0.37 0.00 -0.02 0.00 0.00 57.16 57.31 2ee2 n GLU 24 Cb 0.60 -4.55 -0.06 0.00 -0.02 0.00 0.00 31.44 27.40 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 -3.89 5.28 0.15 2.62 0.11 -1.26 -4.19 120.40 119.22 2ee2 s VAL 25 Ca 0.12 0.53 -0.07 0.00 -2.93 0.00 0.00 61.98 59.62 2ee2 s VAL 25 Cb -0.06 -3.58 -0.01 0.00 -1.53 0.00 0.00 36.38 31.19 2ee2 s VAL 25 CO 0.90 0.53 0.22 -0.83 -3.33 0.00 0.00 175.10 172.59 2ee2 s GLY 26 N -0.51 0.52 -0.11 6.54 0.00 -0.52 -5.03 107.32 108.21 2ee2 s GLY 26 Ca 0.18 -0.96 0.01 0.00 0.00 0.00 0.00 44.72 43.95 2ee2 s GLY 26 CO 0.07 -0.93 -0.13 -1.34 0.00 0.00 0.00 173.10 170.77 2ee2 s VAL 27 N -3.97 1.32 -0.23 1.40 -7.23 -1.26 -1.59 120.40 108.85 2ee2 s VAL 27 Ca 0.17 -0.52 -0.09 0.00 -1.81 0.00 0.00 61.98 59.72 2ee2 s VAL 27 Cb 0.04 -1.24 -0.05 0.00 0.56 0.00 0.00 36.38 35.69 2ee2 s VAL 27 CO -0.01 0.41 0.13 -0.75 -0.31 0.00 0.00 175.10 174.56 2ee2 s LYS 28 N 1.19 3.99 -0.29 4.82 2.20 0.20 -4.96 119.74 126.90 2ee2 s LYS 28 Ca -0.03 -0.31 -0.28 0.00 -0.36 0.00 0.00 55.97 54.98 2ee2 s LYS 28 Cb -0.14 -3.44 0.01 0.00 -1.51 0.00 0.00 37.83 32.75 2ee2 s LYS 28 CO -0.04 0.08 1.01 0.08 -0.36 0.00 0.00 175.35 176.12 2ee2 s VAL 29 N 0.98 4.62 -0.23 4.02 1.01 -1.26 -0.81 120.40 128.72 2ee2 s VAL 29 Ca 0.06 1.75 -0.19 0.00 0.00 0.00 0.00 61.98 63.60 2ee2 s VAL 29 Cb -0.13 -4.33 -0.17 0.00 0.00 0.00 0.00 36.38 31.74 2ee2 s VAL 29 CO 0.03 -0.34 0.04 0.18 0.00 0.00 0.00 175.10 175.02 2ee2 n LEU 30 N 6.57 1.89 -3.96 3.92 4.77 -0.62 -4.98 117.00 124.59 2ee2 n LEU 30 Ca 0.11 0.40 -0.11 0.00 -0.03 0.00 0.00 56.01 56.37 2ee2 n LEU 30 Cb 0.47 -0.92 -0.02 0.00 -2.33 0.00 0.00 43.42 40.61 2ee2 n LEU 30 CO 0.55 0.37 0.29 -0.44 -1.33 0.00 0.00 177.39 176.84 2ee2 s SER 31 N -7.05 0.33 0.51 -1.43 0.01 -0.44 -4.93 113.70 100.68 2ee2 s SER 31 Ca -0.32 -1.20 0.25 0.00 1.31 0.00 0.00 55.95 56.00 2ee2 s SER 31 Cb 0.09 0.71 1.35 0.00 0.21 0.00 0.00 66.02 68.38 2ee2 s SER 31 CO 0.56 -1.39 1.94 0.77 0.41 0.00 0.00 173.24 175.53 2ee2 h SER 32 N 2.10 0.09 -0.21 2.44 4.64 -1.87 -1.19 113.55 119.54 2ee2 h SER 32 Ca -0.28 0.01 -0.18 0.00 -0.47 0.00 0.00 61.79 60.86 2ee2 h SER 32 Cb 1.25 -0.01 -0.21 0.00 -0.31 0.00 0.00 62.40 63.11 2ee2 h SER 32 CO 0.37 0.04 -0.74 -1.54 -0.87 0.00 0.00 176.83 174.10 2ee2 n SER 33 N -4.37 2.31 -3.74 4.97 3.41 -1.26 -4.03 113.62 110.91 2ee2 n SER 33 Ca 0.14 -3.33 -0.12 0.00 -0.26 0.00 0.00 58.87 55.30 2ee2 n SER 33 Cb 0.73 -0.44 -0.12 0.00 -0.26 0.00 0.00 64.21 64.12 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 -2.75 0.27 -0.24 4.33 2.02 -0.45 -3.21 118.70 118.66 2ee2 s GLU 34 Ca 0.39 0.51 -0.13 0.00 0.02 0.00 0.00 54.97 55.76 2ee2 s GLU 34 Cb 0.38 -0.01 0.07 0.00 0.10 0.00 0.00 34.13 34.67 2ee2 s GLU 34 CO -0.06 -0.12 0.58 0.42 0.02 0.00 0.00 175.26 176.11 2ee2 s ILE 35 N 0.88 -0.06 -0.12 -1.63 1.01 -0.79 -1.33 121.20 119.16 2ee2 s ILE 35 Ca -0.06 0.04 -0.08 0.00 0.00 0.00 0.00 60.65 60.55 2ee2 s ILE 35 Cb -0.07 -0.86 -0.04 0.00 0.01 0.00 0.00 42.46 41.50 2ee2 s ILE 35 CO -0.06 0.01 0.16 -0.55 0.00 0.00 0.00 174.94 174.51 2ee2 s SER 36 N 1.63 6.40 -0.43 3.58 0.15 0.01 0.10 113.70 125.14 2ee2 s SER 36 Ca -0.10 0.48 -0.03 0.00 0.70 0.00 0.00 55.95 57.00 2ee2 s SER 36 Cb -0.07 -2.09 0.12 0.00 -1.71 0.00 0.00 66.02 62.27 2ee2 s SER 36 CO -0.17 0.38 0.23 -0.69 1.20 0.00 0.00 173.24 174.19 2ee2 s VAL 37 N -0.87 3.39 0.05 4.45 1.01 0.36 -0.63 120.40 128.16 2ee2 s VAL 37 Ca 0.15 -2.11 -0.11 0.00 0.00 0.00 0.00 61.98 59.91 2ee2 s VAL 37 Cb -0.12 -3.31 -0.06 0.00 0.00 0.00 0.00 36.38 32.89 2ee2 s VAL 37 CO 0.04 -0.71 0.40 -1.00 0.00 0.00 0.00 175.10 173.83 2ee2 s HIS 38 N 1.06 3.62 0.25 5.22 3.76 -0.62 -0.59 115.29 127.99 2ee2 s HIS 38 Ca 0.09 0.84 -0.11 0.00 -0.15 0.00 0.00 55.06 55.72 2ee2 s HIS 38 Cb -0.23 -2.19 -0.01 0.00 1.11 0.00 0.00 32.58 31.27 2ee2 s HIS 38 CO -0.04 0.56 0.46 1.67 -0.85 0.00 0.00 174.74 176.54 2ee2 s TRP 39 N -1.31 0.45 -0.13 1.40 -2.14 -1.00 -1.44 118.94 114.78 2ee2 s TRP 39 Ca 0.30 -0.80 -0.06 0.00 2.66 0.00 0.00 56.10 58.20 2ee2 s TRP 39 Cb -0.15 0.14 -0.04 0.00 -3.10 0.00 0.00 33.47 30.32 2ee2 s TRP 39 CO 0.16 -0.99 0.10 -2.00 -2.66 0.00 0.00 176.95 171.56 2ee2 s GLU 40 N -3.94 3.51 0.35 3.25 2.12 -1.21 -4.77 118.70 118.01 2ee2 s GLU 40 Ca 0.24 -0.23 -0.28 0.00 0.36 0.00 0.00 54.97 55.05 2ee2 s GLU 40 Cb -0.00 -3.13 -0.12 0.00 0.26 0.00 0.00 34.13 31.14 2ee2 s GLU 40 CO 0.10 0.63 1.41 0.72 -0.54 0.00 0.00 175.26 177.58 2ee2 n HIS 41 N 2.42 2.65 -2.86 5.30 8.25 -1.26 -4.44 115.22 125.29 2ee2 n HIS 41 Ca -0.19 0.48 -0.36 0.00 -0.26 0.00 0.00 57.72 57.40 2ee2 n HIS 41 Cb 0.54 -2.48 -0.06 0.00 1.12 0.00 0.00 29.99 29.10 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 -1.00 4.33 0.64 1.59 -7.23 -1.26 -4.92 120.40 112.55 2ee2 s VAL 42 Ca 0.55 1.62 0.29 0.00 -1.81 0.00 0.00 61.98 62.63 2ee2 s VAL 42 Cb -0.52 -3.87 0.33 0.00 0.56 0.00 0.00 36.38 32.87 2ee2 s VAL 42 CO 0.62 0.02 1.91 0.17 -0.31 0.00 0.00 175.10 177.51 2ee2 h LEU 43 N 2.86 0.00 -9.20 1.32 8.10 -1.93 -3.38 115.31 113.08 2ee2 h LEU 43 Ca -0.48 0.00 -0.59 0.00 0.11 0.00 0.00 57.88 56.92 2ee2 h LEU 43 Cb 1.19 0.00 -0.10 0.00 -0.44 0.00 0.00 40.66 41.31 2ee2 h LEU 43 CO 0.64 0.00 -0.10 -1.61 -4.11 0.00 0.00 178.44 173.26 2ee2 s GLU 44 N -4.29 4.24 0.00 0.17 0.41 -1.26 -4.94 118.70 113.02 2ee2 s GLU 44 Ca -0.04 0.38 0.23 0.00 -0.41 0.00 0.00 54.97 55.13 2ee2 s GLU 44 Cb 0.11 -3.51 0.63 0.00 -1.78 0.00 0.00 34.13 29.58 2ee2 s GLU 44 CO 0.37 -0.02 1.53 1.63 -0.49 0.00 0.00 175.26 178.28 2ee2 n LYS 45 N 4.35 2.68 0.15 1.61 4.01 -1.26 -4.22 118.16 125.48 2ee2 n LYS 45 Ca -0.06 -2.61 0.03 0.00 -0.51 0.00 0.00 58.31 55.16 2ee2 n LYS 45 Cb 0.51 -1.56 0.09 0.00 -0.51 0.00 0.00 35.03 33.55 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 4.30 0.88 -3.18 -0.18 3.07 -1.94 -3.46 117.51 116.99 2ee2 h ILE 46 Ca 0.00 -2.11 -0.53 0.00 1.55 0.00 0.00 64.86 63.77 2ee2 h ILE 46 Cb 0.98 2.34 0.22 0.00 -0.27 0.00 0.00 36.82 40.09 2ee2 h ILE 46 CO 0.00 0.48 -0.74 1.33 -1.05 0.00 0.00 178.15 178.17 2ee2 n VAL 47 N -3.28 0.00 -0.06 0.16 0.24 -1.26 -4.75 118.33 109.38 2ee2 n VAL 47 Ca 0.02 -0.22 -0.13 0.00 -2.04 0.00 0.00 64.34 61.97 2ee2 n VAL 47 Cb 0.70 -0.57 -0.04 0.00 -1.47 0.00 0.00 33.84 32.46 2ee2 n VAL 47 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2ee2 n GLU 48 N -1.37 0.35 -3.85 7.34 0.00 -1.23 -4.86 120.64 117.01 2ee2 n GLU 48 Ca 0.05 0.15 -0.09 0.00 0.00 0.00 0.00 57.16 57.27 2ee2 n GLU 48 Cb 0.55 -1.09 -0.06 0.00 0.00 0.00 0.00 31.44 30.83 2ee2 n GLU 48 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 2ee2 s SER 49 N -6.27 0.00 -0.46 4.31 1.04 -1.23 -3.37 113.70 107.72 2ee2 s SER 49 Ca -0.21 -0.67 -0.15 0.00 0.48 0.00 0.00 55.95 55.39 2ee2 s SER 49 Cb 0.06 0.42 0.06 0.00 0.10 0.00 0.00 66.02 66.66 2ee2 s SER 49 CO 0.29 -0.84 0.38 -0.31 0.98 0.00 0.00 173.24 173.74 2ee2 s TYR 50 N -3.89 3.24 -0.17 5.02 1.51 -1.07 -3.05 117.35 118.94 2ee2 s TYR 50 Ca 0.10 -0.84 -0.29 0.00 -1.01 0.00 0.00 57.07 55.03 2ee2 s TYR 50 Cb 0.03 -3.05 -0.00 0.00 -0.11 0.00 0.00 41.96 38.83 2ee2 s TYR 50 CO -0.06 -0.76 1.08 -1.14 -1.11 0.00 0.00 175.55 173.56 2ee2 s GLN 51 N 1.68 4.31 -0.47 -0.62 2.00 -1.14 -3.47 119.66 121.95 2ee2 s GLN 51 Ca 0.05 1.44 -0.04 0.00 -2.00 0.00 0.00 55.36 54.81 2ee2 s GLN 51 Cb -0.23 -3.63 0.12 0.00 0.80 0.00 0.00 33.01 30.08 2ee2 s GLN 51 CO 0.08 -0.54 0.28 0.42 -0.50 0.00 0.00 175.29 175.03 2ee2 s ILE 52 N 2.85 3.54 -0.29 -2.34 1.09 -1.20 -1.91 121.20 122.94 2ee2 s ILE 52 Ca 0.48 -2.22 -0.22 0.00 -1.10 0.00 0.00 60.65 57.58 2ee2 s ILE 52 Cb -0.18 -3.38 -0.01 0.00 -1.06 0.00 0.00 42.46 37.83 2ee2 s ILE 52 CO 0.12 -0.75 0.72 -0.60 -0.10 0.00 0.00 174.94 174.33 2ee2 s ARG 53 N 0.89 3.98 0.07 2.79 3.52 0.09 -2.57 118.95 127.73 2ee2 s ARG 53 Ca 0.10 0.52 0.07 0.00 -0.13 0.00 0.00 55.73 56.29 2ee2 s ARG 53 Cb -0.23 -3.71 -0.03 0.00 -1.56 0.00 0.00 34.95 29.43 2ee2 s ARG 53 CO -0.04 -0.59 -0.18 1.52 -0.81 0.00 0.00 175.30 175.20 2ee2 s TYR 54 N 2.78 1.59 -0.13 5.12 1.13 -1.18 -0.67 117.35 125.97 2ee2 s TYR 54 Ca 0.29 -0.40 -0.30 0.00 -1.41 0.00 0.00 57.07 55.25 2ee2 s TYR 54 Cb -0.15 -0.90 0.12 0.00 -1.10 0.00 0.00 41.96 39.93 2ee2 s TYR 54 CO 0.11 0.12 0.95 1.67 -2.51 0.00 0.00 175.55 175.89 2ee2 s TRP 55 N -1.04 -0.40 0.47 -3.49 -2.14 -1.17 -2.51 118.94 108.65 2ee2 s TRP 55 Ca 0.04 0.66 -0.24 0.00 2.66 0.00 0.00 56.10 59.22 2ee2 s TRP 55 Cb -0.09 0.45 -0.07 0.00 -3.10 0.00 0.00 33.47 30.66 2ee2 s TRP 55 CO 0.03 -0.39 1.32 0.00 -2.66 0.00 0.00 176.95 175.24 2ee2 s ALA 56 N -1.28 3.07 0.54 2.67 0.00 -1.26 -0.88 121.76 124.62 2ee2 s ALA 56 Ca -0.02 1.25 0.34 0.00 0.00 0.00 0.00 51.96 53.53 2ee2 s ALA 56 Cb -0.00 -3.51 1.52 0.00 0.00 0.00 0.00 23.12 21.12 2ee2 s ALA 56 CO 0.02 -1.03 1.84 0.00 0.00 0.00 0.00 175.76 176.59 2ee2 h ALA 57 N 2.13 2.98 0.25 0.00 0.00 -1.90 0.20 119.26 122.92 2ee2 h ALA 57 Ca -0.50 -0.04 -0.34 0.00 0.00 0.00 0.00 54.91 54.03 2ee2 h ALA 57 Cb 1.27 0.08 0.04 0.00 0.00 0.00 0.00 17.79 19.17 2ee2 h ALA 57 CO 0.60 -1.29 -1.52 1.12 0.00 0.00 0.00 179.25 178.16 2ee2 h HIS 58 N 0.00 0.97 -4.18 0.00 2.07 -1.89 -3.46 115.15 108.66 2ee2 h HIS 58 Ca 0.49 -0.71 -0.53 0.00 -2.85 0.00 0.00 60.37 56.77 2ee2 h HIS 58 Cb 2.01 -0.04 0.16 0.00 2.57 0.00 0.00 27.41 32.10 2ee2 h HIS 58 CO 0.00 1.58 0.39 -0.51 -3.07 0.00 0.00 177.93 176.32 2ee2 s ASP 59 N -7.57 4.19 0.74 3.10 1.01 0.69 -5.02 116.67 113.82 2ee2 s ASP 59 Ca -0.10 2.34 -0.07 0.00 0.71 0.00 0.00 52.55 55.43 2ee2 s ASP 59 Cb 0.04 -2.59 0.09 0.00 1.01 0.00 0.00 42.92 41.47 2ee2 s ASP 59 CO 0.94 -2.26 1.05 -0.54 0.21 0.00 0.00 175.17 174.57 2ee2 s LYS 60 N -3.94 1.94 0.04 8.23 3.01 -1.26 -4.72 119.74 123.04 2ee2 s LYS 60 Ca 0.74 -0.37 0.27 0.00 -1.01 0.00 0.00 55.97 55.60 2ee2 s LYS 60 Cb -0.29 -2.15 1.09 0.00 -1.01 0.00 0.00 37.83 35.48 2ee2 s LYS 60 CO 0.46 -1.41 1.85 0.39 0.51 0.00 0.00 175.35 177.14 2ee2 n GLU 61 N -3.02 0.05 0.05 1.68 1.02 -1.26 -2.97 120.64 116.20 2ee2 n GLU 61 Ca 0.10 0.08 -0.12 0.00 -0.02 0.00 0.00 57.16 57.19 2ee2 n GLU 61 Cb 0.60 -1.56 -0.13 0.00 -0.02 0.00 0.00 31.44 30.32 2ee2 n GLU 61 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 2ee2 h GLU 62 N 0.00 0.14 -0.01 3.49 -0.00 -2.02 -3.28 114.58 112.89 2ee2 h GLU 62 Ca 0.00 -0.24 0.00 0.00 -0.00 0.00 0.00 59.36 59.12 2ee2 h GLU 62 Cb 0.51 0.09 0.00 0.00 -0.00 0.00 0.00 28.75 29.35 2ee2 h GLU 62 CO 0.00 1.00 -0.09 0.00 -0.00 0.00 0.00 179.01 179.92 2ee2 n ALA 63 N -2.53 2.74 -1.89 1.06 0.00 -1.20 -4.92 120.51 113.77 2ee2 n ALA 63 Ca -0.10 -0.46 -0.41 0.00 0.00 0.00 0.00 53.44 52.46 2ee2 n ALA 63 Cb 1.01 -1.11 -0.02 0.00 0.00 0.00 0.00 19.45 19.33 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 -2.15 3.65 0.96 0.00 0.00 -1.16 -4.98 121.76 118.08 2ee2 s ALA 64 Ca 0.33 1.34 -0.09 0.00 0.00 0.00 0.00 51.96 53.54 2ee2 s ALA 64 Cb 0.20 -3.57 0.13 0.00 0.00 0.00 0.00 23.12 19.88 2ee2 s ALA 64 CO 0.39 -0.76 0.78 0.09 0.00 0.00 0.00 175.76 176.26 2ee2 n ASN 65 N 2.58 0.13 -3.64 0.00 3.02 -1.05 -4.89 115.26 111.42 2ee2 n ASN 65 Ca 0.08 -1.33 -0.06 0.00 -0.03 0.00 0.00 54.58 53.24 2ee2 n ASN 65 Cb 0.40 -0.59 -0.07 0.00 -0.61 0.00 0.00 39.78 38.91 2ee2 n ASN 65 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ee2 s ARG 66 N -4.67 0.65 -0.35 3.52 1.70 -1.26 -3.10 118.95 115.43 2ee2 s ARG 66 Ca 0.45 1.15 0.02 0.00 -0.47 0.00 0.00 55.73 56.87 2ee2 s ARG 66 Cb -0.01 0.16 0.10 0.00 -0.57 0.00 0.00 34.95 34.63 2ee2 s ARG 66 CO 0.31 -0.14 0.09 0.08 -1.08 0.00 0.00 175.30 174.57 2ee2 s VAL 67 N 1.64 1.74 -0.06 4.99 1.01 -1.06 -4.91 120.40 123.75 2ee2 s VAL 67 Ca -0.10 -2.09 -0.16 0.00 0.00 0.00 0.00 61.98 59.63 2ee2 s VAL 67 Cb -0.05 -2.28 -0.05 0.00 0.00 0.00 0.00 36.38 34.00 2ee2 s VAL 67 CO -0.19 -0.66 0.42 0.00 0.00 0.00 0.00 175.10 174.67 2ee2 s GLN 68 N 1.04 4.13 0.32 2.72 -2.07 -1.26 -3.21 119.66 121.32 2ee2 s GLN 68 Ca 0.11 0.39 0.06 0.00 -1.82 0.00 0.00 55.36 54.10 2ee2 s GLN 68 Cb -0.19 -3.33 -0.06 0.00 -1.09 0.00 0.00 33.01 28.34 2ee2 s GLN 68 CO -0.13 0.43 -0.01 0.14 -1.32 0.00 0.00 175.29 174.40 2ee2 s VAL 69 N -0.24 1.60 0.74 3.63 -7.23 -1.23 -4.91 120.40 112.76 2ee2 s VAL 69 Ca 0.24 -2.07 -0.15 0.00 -1.81 0.00 0.00 61.98 58.19 2ee2 s VAL 69 Cb -0.16 -2.66 0.04 0.00 0.56 0.00 0.00 36.38 34.17 2ee2 s VAL 69 CO 0.11 -0.15 1.21 0.42 -0.31 0.00 0.00 175.10 176.38 2ee2 s THR 70 N -3.02 2.27 0.57 5.32 -4.23 -1.26 -2.59 115.64 112.69 2ee2 s THR 70 Ca 0.33 0.13 0.26 0.00 -1.18 0.00 0.00 61.69 61.23 2ee2 s THR 70 Cb 0.06 -2.69 0.33 0.00 1.34 0.00 0.00 72.50 71.54 2ee2 s THR 70 CO 0.14 -0.07 2.23 0.77 -0.54 0.00 0.00 174.62 177.15 2ee2 h SER 71 N -0.36 0.00 -0.03 3.99 4.64 -1.93 -0.91 113.55 118.95 2ee2 h SER 71 Ca -0.48 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.85 2ee2 h SER 71 Cb 1.30 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2ee2 h SER 71 CO 0.49 0.00 0.05 1.56 -0.87 0.00 0.00 176.83 178.06 2ee2 h GLN 72 N 0.00 0.00 -5.46 4.77 1.08 -1.91 -3.39 115.11 110.20 2ee2 h GLN 72 Ca -0.00 0.00 -0.62 0.00 -1.45 0.00 0.00 58.65 56.58 2ee2 h GLN 72 Cb 0.01 0.00 -0.13 0.00 -0.05 0.00 0.00 27.48 27.31 2ee2 h GLN 72 CO 0.00 0.00 0.12 -1.21 -0.95 0.00 0.00 178.83 176.79 2ee2 s GLU 73 N -4.47 3.84 0.36 1.46 8.01 -0.35 -4.92 118.70 122.63 2ee2 s GLU 73 Ca -0.05 0.21 0.24 0.00 0.01 0.00 0.00 54.97 55.39 2ee2 s GLU 73 Cb 0.14 -3.75 0.53 0.00 -4.31 0.00 0.00 34.13 26.74 2ee2 s GLU 73 CO 0.50 -0.59 1.68 1.88 0.01 0.00 0.00 175.26 178.73 2ee2 h TYR 74 N 8.25 0.00 -4.30 1.61 -1.99 -1.86 -3.47 116.97 115.23 2ee2 h TYR 74 Ca -0.27 0.00 -0.16 0.00 2.00 0.00 0.00 58.73 60.31 2ee2 h TYR 74 Cb 1.12 0.00 -0.15 0.00 2.00 0.00 0.00 36.73 39.70 2ee2 h TYR 74 CO 0.75 0.00 -0.61 -1.54 -0.00 0.00 0.00 178.16 176.77 2ee2 s SER 75 N -5.59 0.31 0.40 3.88 1.04 -1.26 -2.37 113.70 110.11 2ee2 s SER 75 Ca 0.08 -1.10 0.04 0.00 0.48 0.00 0.00 55.95 55.46 2ee2 s SER 75 Cb 0.08 0.29 -0.05 0.00 0.10 0.00 0.00 66.02 66.44 2ee2 s SER 75 CO 0.64 -0.72 0.04 0.00 0.98 0.00 0.00 173.24 174.18 2ee2 s ALA 76 N -4.00 3.07 -0.02 5.32 0.00 0.24 -4.92 121.76 121.45 2ee2 s ALA 76 Ca 0.19 -1.68 0.05 0.00 0.00 0.00 0.00 51.96 50.51 2ee2 s ALA 76 Cb 0.07 0.38 -0.01 0.00 0.00 0.00 0.00 23.12 23.56 2ee2 s ALA 76 CO -0.02 -0.19 -0.16 0.50 0.00 0.00 0.00 175.76 175.89 2ee2 s ARG 77 N -3.80 1.35 -0.06 0.00 6.06 -1.26 -0.49 118.95 120.75 2ee2 s ARG 77 Ca 0.28 -0.57 0.04 0.00 -2.50 0.00 0.00 55.73 52.98 2ee2 s ARG 77 Cb 0.07 -1.28 -0.02 0.00 0.06 0.00 0.00 34.95 33.78 2ee2 s ARG 77 CO 0.14 0.32 -0.17 -0.51 -2.50 0.00 0.00 175.30 172.58 2ee2 s LEU 78 N -0.31 2.55 0.08 -0.88 1.43 0.29 -4.97 118.68 116.88 2ee2 s LEU 78 Ca 0.05 -0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 52.85 2ee2 s LEU 78 Cb -0.07 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 2ee2 s LEU 78 CO -0.00 0.30 -0.01 -1.61 0.23 0.00 0.00 176.35 175.27 2ee2 s GLU 79 N -0.48 0.74 -0.60 1.70 2.02 -1.26 -1.89 118.70 118.94 2ee2 s GLU 79 Ca 0.06 -1.31 -0.03 0.00 0.02 0.00 0.00 54.97 53.71 2ee2 s GLU 79 Cb -0.12 0.17 0.00 0.00 0.10 0.00 0.00 34.13 34.29 2ee2 s GLU 79 CO 0.01 -0.15 0.51 0.09 0.02 0.00 0.00 175.26 175.75 2ee2 n ASN 80 N 0.02 -3.42 -4.83 -0.19 3.02 -1.20 -4.99 115.26 103.68 2ee2 n ASN 80 Ca -0.11 -0.26 -0.29 0.00 -0.03 0.00 0.00 54.58 53.89 2ee2 n ASN 80 Cb 0.62 -2.57 -0.05 0.00 -0.61 0.00 0.00 39.78 37.17 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 -3.90 3.98 0.36 3.41 1.43 -1.26 -5.08 118.68 117.62 2ee2 s LEU 81 Ca 0.19 0.05 -0.26 0.00 -1.03 0.00 0.00 54.13 53.08 2ee2 s LEU 81 Cb -0.08 -2.62 -0.09 0.00 0.03 0.00 0.00 46.19 43.43 2ee2 s LEU 81 CO 0.33 0.14 1.07 -0.76 0.23 0.00 0.00 176.35 177.37 2ee2 s LEU 82 N -2.64 4.26 0.57 1.79 1.43 -1.26 -4.23 118.68 118.60 2ee2 s LEU 82 Ca 0.31 2.14 -0.18 0.00 -1.03 0.00 0.00 54.13 55.36 2ee2 s LEU 82 Cb -0.12 -4.01 -0.05 0.00 0.03 0.00 0.00 46.19 42.05 2ee2 s LEU 82 CO 0.24 -0.41 1.13 -2.16 0.23 0.00 0.00 176.35 175.37 2ee2 s PRO 83 N -2.17 3.23 -1.31 1.29 0.04 -1.26 -3.59 135.00 131.23 2ee2 s PRO 83 Ca 0.54 1.56 -0.01 0.00 0.04 0.00 0.00 61.00 63.14 2ee2 s PRO 83 Cb -0.26 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.30 2ee2 s PRO 83 CO 0.33 -0.94 0.02 -3.47 0.04 0.00 0.00 177.00 172.97 2ee2 n ASP 84 N -1.55 0.74 -3.86 6.66 2.03 -0.64 -4.91 116.55 115.02 2ee2 n ASP 84 Ca 0.11 -1.08 -0.18 0.00 0.52 0.00 0.00 54.79 54.17 2ee2 n ASP 84 Cb 0.51 -1.34 -0.16 0.00 -0.72 0.00 0.00 41.12 39.41 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 -4.13 0.33 0.39 5.18 2.01 -1.24 -4.93 115.64 113.25 2ee2 s THR 85 Ca 0.02 -0.03 -0.25 0.00 0.31 0.00 0.00 61.69 61.74 2ee2 s THR 85 Cb -0.01 -0.38 -0.09 0.00 0.01 0.00 0.00 72.50 72.03 2ee2 s THR 85 CO 0.84 0.17 1.18 -1.58 -0.69 0.00 0.00 174.62 174.54 2ee2 s GLN 86 N 0.82 4.07 -0.13 4.92 0.74 -1.26 -3.42 119.66 125.41 2ee2 s GLN 86 Ca -0.09 1.87 -0.03 0.00 0.05 0.00 0.00 55.36 57.16 2ee2 s GLN 86 Cb -0.12 -2.71 0.04 0.00 1.10 0.00 0.00 33.01 31.32 2ee2 s GLN 86 CO -0.01 -0.31 0.03 0.71 -0.55 0.00 0.00 175.29 175.16 2ee2 s TYR 87 N -1.39 0.65 -0.68 1.67 2.02 0.25 -2.74 117.35 117.13 2ee2 s TYR 87 Ca 0.56 -0.39 -0.27 0.00 -0.37 0.00 0.00 57.07 56.61 2ee2 s TYR 87 Cb -0.31 -0.83 0.01 0.00 -0.40 0.00 0.00 41.96 40.43 2ee2 s TYR 87 CO 0.40 -0.44 1.50 -0.06 -1.57 0.00 0.00 175.55 175.37 2ee2 s PHE 88 N 1.98 2.06 -0.02 2.71 0.08 -0.06 -1.12 117.98 123.61 2ee2 s PHE 88 Ca 0.02 0.28 -0.14 0.00 0.12 0.00 0.00 56.93 57.21 2ee2 s PHE 88 Cb -0.14 -4.42 -0.05 0.00 -0.57 0.00 0.00 43.02 37.83 2ee2 s PHE 88 CO -0.07 -2.16 0.39 0.42 -0.10 0.00 0.00 175.22 173.71 2ee2 s ILE 89 N 6.96 5.08 -0.06 0.64 1.01 0.22 -3.06 121.20 131.98 2ee2 s ILE 89 Ca 0.48 0.79 -0.02 0.00 0.00 0.00 0.00 60.65 61.90 2ee2 s ILE 89 Cb -0.10 -3.69 0.03 0.00 0.01 0.00 0.00 42.46 38.71 2ee2 s ILE 89 CO 0.18 0.57 0.03 -1.61 0.00 0.00 0.00 174.94 174.11 2ee2 s GLU 90 N -0.96 0.26 -0.26 2.79 2.02 0.15 -2.99 118.70 119.71 2ee2 s GLU 90 Ca 0.23 0.21 -0.05 0.00 0.02 0.00 0.00 54.97 55.38 2ee2 s GLU 90 Cb -0.16 -0.82 -0.00 0.00 0.10 0.00 0.00 34.13 33.24 2ee2 s GLU 90 CO 0.12 -0.34 0.02 0.08 0.02 0.00 0.00 175.26 175.17 2ee2 s VAL 91 N 2.07 3.74 -0.06 2.63 1.01 -1.26 -0.73 120.40 127.80 2ee2 s VAL 91 Ca 0.05 -0.54 -0.01 0.00 0.00 0.00 0.00 61.98 61.47 2ee2 s VAL 91 Cb -0.12 -2.81 0.03 0.00 0.00 0.00 0.00 36.38 33.47 2ee2 s VAL 91 CO -0.04 0.26 0.00 -0.83 0.00 0.00 0.00 175.10 174.49 2ee2 s GLY 92 N 1.50 0.41 0.24 4.51 0.00 -0.80 -3.48 107.32 109.71 2ee2 s GLY 92 Ca 0.04 -0.05 -0.30 0.00 0.00 0.00 0.00 44.72 44.42 2ee2 s GLY 92 CO 0.00 1.04 1.19 0.00 0.00 0.00 0.00 173.10 175.34 2ee2 s ALA 93 N 1.79 3.45 -0.28 3.20 0.00 -1.26 -2.88 121.76 125.77 2ee2 s ALA 93 Ca 0.02 1.00 -0.24 0.00 0.00 0.00 0.00 51.96 52.73 2ee2 s ALA 93 Cb -0.13 -3.40 0.12 0.00 0.00 0.00 0.00 23.12 19.71 2ee2 s ALA 93 CO -0.04 -0.36 0.99 0.00 0.00 0.00 0.00 175.76 176.35 2ee2 s ASN 95 N 0.33 5.20 0.55 0.00 2.20 -1.21 -3.48 114.94 118.54 2ee2 s ASN 95 Ca 0.02 -0.75 0.35 0.00 -0.94 0.00 0.00 52.86 51.54 2ee2 s ASN 95 Cb -0.05 -0.13 1.57 0.00 -2.00 0.00 0.00 41.25 40.64 2ee2 s ASN 95 CO -0.06 -1.01 2.04 -1.28 -2.94 0.00 0.00 177.10 173.84 2ee2 h SER 96 N 0.54 0.00 0.00 3.54 0.87 -1.96 -3.31 113.55 113.23 2ee2 h SER 96 Ca -0.36 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 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 0.47 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.77 2ee2 n ALA 97 N -2.05 -0.11 -2.49 6.23 0.00 -1.26 -4.96 120.51 115.87 2ee2 n ALA 97 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 2ee2 n ALA 97 Cb 0.24 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.59 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 -1.08 1.94 0.07 0.00 0.00 -1.20 -4.87 107.32 102.17 2ee2 s GLY 98 Ca 0.00 -1.91 -0.04 0.00 0.00 0.00 0.00 44.72 42.77 2ee2 s GLY 98 CO 0.00 -1.97 0.29 0.00 0.00 0.00 0.00 173.10 171.42 2ee2 s GLY 100 N -2.19 2.08 0.30 0.00 0.00 -1.26 -4.57 107.32 101.69 2ee2 s GLY 100 Ca 0.35 -2.00 -0.29 0.00 0.00 0.00 0.00 44.72 42.77 2ee2 s GLY 100 CO 0.23 -1.98 1.23 2.56 0.00 0.00 0.00 173.10 175.14 2ee2 s PRO 101 N -3.62 4.46 0.62 2.90 0.04 -1.26 -4.95 135.00 133.19 2ee2 s PRO 101 Ca 0.32 2.05 -0.17 0.00 0.04 0.00 0.00 61.00 63.25 2ee2 s PRO 101 Cb 0.00 -3.12 -0.02 0.00 0.04 0.00 0.00 34.50 31.40 2ee2 s PRO 101 CO 0.17 -0.04 1.12 -1.25 0.04 0.00 0.00 177.00 177.04 2ee2 s PRO 102 N -1.57 2.99 1.04 0.56 0.04 -1.26 -4.73 135.00 132.06 2ee2 s PRO 102 Ca 0.48 1.47 -0.16 0.00 0.04 0.00 0.00 61.00 62.82 2ee2 s PRO 102 Cb -0.37 -1.97 0.22 0.00 0.04 0.00 0.00 34.50 32.42 2ee2 s PRO 102 CO 0.48 -1.11 1.21 -1.54 0.04 0.00 0.00 177.00 176.07 2ee2 s SER 103 N -2.29 2.42 0.82 6.66 1.04 -1.23 -5.00 113.70 116.13 2ee2 s SER 103 Ca 0.69 0.53 -0.14 0.00 0.48 0.00 0.00 55.95 57.51 2ee2 s SER 103 Cb -0.22 -0.75 0.02 0.00 0.10 0.00 0.00 66.02 65.17 2ee2 s SER 103 CO 0.36 -3.18 0.68 0.47 0.98 0.00 0.00 173.24 172.55 2ee2 n ASP 104 N -4.12 -0.84 -4.55 7.02 9.92 -1.26 -4.84 116.55 117.87 2ee2 n ASP 104 Ca 0.13 0.51 -0.41 0.00 -0.53 0.00 0.00 54.79 54.49 2ee2 n ASP 104 Cb 0.59 -1.30 -0.03 0.00 -0.64 0.00 0.00 41.12 39.75 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 -3.42 3.32 0.01 -1.24 -2.45 -1.26 -4.77 119.30 109.49 2ee2 s MET 105 Ca 0.65 -0.55 -0.11 0.00 -1.25 0.00 0.00 55.69 54.43 2ee2 s MET 105 Cb -0.29 -4.63 -0.05 0.00 1.25 0.00 0.00 34.83 31.11 2ee2 s MET 105 CO 0.59 -2.20 0.34 0.42 1.05 0.00 0.00 175.02 175.23 2ee2 s ILE 106 N 5.57 5.16 -0.08 10.11 1.01 -1.16 -5.01 121.20 136.81 2ee2 s ILE 106 Ca 0.40 0.51 0.04 0.00 0.00 0.00 0.00 60.65 61.61 2ee2 s ILE 106 Cb -0.05 -3.62 -0.00 0.00 0.01 0.00 0.00 42.46 38.80 2ee2 s ILE 106 CO 0.06 0.45 -0.22 -1.83 0.00 0.00 0.00 174.94 173.40 2ee2 s GLU 107 N -1.46 2.64 0.11 2.79 1.03 -1.26 -0.61 118.70 121.94 2ee2 s GLU 107 Ca 0.26 -0.81 0.07 0.00 0.03 0.00 0.00 54.97 54.52 2ee2 s GLU 107 Cb -0.15 -2.09 -0.04 0.00 -0.80 0.00 0.00 34.13 31.06 2ee2 s GLU 107 CO 0.14 0.22 -0.08 0.00 -1.33 0.00 0.00 175.26 174.21 2ee2 s ALA 108 N 0.21 3.02 -0.21 -0.84 0.00 -0.28 -4.92 121.76 118.74 2ee2 s ALA 108 Ca -0.13 -1.26 0.02 0.00 0.00 0.00 0.00 51.96 50.59 2ee2 s ALA 108 Cb -0.16 -0.93 0.04 0.00 0.00 0.00 0.00 23.12 22.07 2ee2 s ALA 108 CO 0.06 0.62 -0.14 -0.06 0.00 0.00 0.00 175.76 176.25 2ee2 s PHE 109 N -1.31 2.81 0.77 0.00 0.40 -1.26 -0.58 117.98 118.80 2ee2 s PHE 109 Ca 0.23 -1.85 -0.11 0.00 -0.60 0.00 0.00 56.93 54.60 2ee2 s PHE 109 Cb -0.11 -1.82 0.05 0.00 0.51 0.00 0.00 43.02 41.65 2ee2 s PHE 109 CO 0.15 -0.81 1.08 0.95 0.70 0.00 0.00 175.22 177.29 2ee2 s THR 110 N 1.27 3.40 0.70 0.64 -4.23 -1.22 -4.88 115.64 111.31 2ee2 s THR 110 Ca -0.02 0.45 -0.05 0.00 -1.18 0.00 0.00 61.69 60.90 2ee2 s THR 110 Cb -0.16 -3.17 0.08 0.00 1.34 0.00 0.00 72.50 70.58 2ee2 s THR 110 CO -0.09 -0.59 0.99 -0.54 -0.54 0.00 0.00 174.62 173.85 2ee2 s LYS 111 N -5.10 2.02 0.07 3.99 1.02 -1.26 -3.79 119.74 116.70 2ee2 s LYS 111 Ca 0.60 -0.53 -0.30 0.00 0.02 0.00 0.00 55.97 55.76 2ee2 s LYS 111 Cb -0.15 -2.23 -0.06 0.00 -0.52 0.00 0.00 37.83 34.88 2ee2 s LYS 111 CO 0.55 -1.28 1.17 0.15 -0.92 0.00 0.00 175.35 175.01 2ee2 s LYS 112 N -5.19 4.46 -0.34 1.68 1.02 -1.26 -1.63 119.74 118.48 2ee2 s LYS 112 Ca 0.62 1.74 -0.42 0.00 0.02 0.00 0.00 55.97 57.93 2ee2 s LYS 112 Cb -0.09 -3.35 -0.19 0.00 -0.52 0.00 0.00 37.83 33.69 2ee2 s LYS 112 CO 0.44 -0.20 1.35 0.00 -0.92 0.00 0.00 175.35 176.02 2ee2 n ALA 113 N 3.72 -1.85 -0.92 5.17 0.00 -1.26 -4.80 120.51 120.57 2ee2 n ALA 113 Ca 0.08 0.49 -0.34 0.00 0.00 0.00 0.00 53.44 53.66 2ee2 n ALA 113 Cb 0.47 -1.74 0.09 0.00 0.00 0.00 0.00 19.45 18.26 2ee2 n ALA 113 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2ee2 n SER 114 N 3.08 -3.17 0.00 0.00 2.88 -1.26 -4.88 113.62 110.27 2ee2 n SER 114 Ca 0.26 0.32 0.00 0.00 -1.33 0.00 0.00 58.87 58.12 2ee2 n SER 114 Cb -0.02 -1.07 0.00 0.00 -0.75 0.00 0.00 64.21 62.37 2ee2 n SER 114 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ee2 n GLY 115 N 2.11 2.42 3.55 0.46 0.00 -1.26 -4.93 105.19 107.54 2ee2 n GLY 115 Ca 0.05 -1.49 -0.33 0.00 0.00 0.00 0.00 46.02 44.24 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 -5.09 2.59 0.30 1.61 0.04 -1.26 -4.97 135.00 128.22 2ee2 s PRO 116 Ca 0.00 0.22 -0.19 0.00 0.04 0.00 0.00 61.00 61.07 2ee2 s PRO 116 Cb 0.00 -4.69 -0.09 0.00 0.04 0.00 0.00 34.50 29.76 2ee2 s PRO 116 CO 0.00 -3.02 0.79 -1.54 0.04 0.00 0.00 177.00 173.26 2ee2 s SER 117 N 8.10 6.96 -0.14 6.66 1.04 -1.26 -5.07 113.70 129.99 2ee2 s SER 117 Ca 0.69 1.45 -0.01 0.00 0.48 0.00 0.00 55.95 58.56 2ee2 s SER 117 Cb -0.10 -2.44 0.03 0.00 0.10 0.00 0.00 66.02 63.62 2ee2 s SER 117 CO 0.11 -0.13 -0.06 -0.55 0.98 0.00 0.00 173.24 173.59 2ee2 s SER 118 N -1.97 2.46 0.00 7.02 0.15 -1.26 -5.29 113.70 114.81 2ee2 s SER 118 Ca 0.51 -0.46 0.00 0.00 0.70 0.00 0.00 55.95 56.70 2ee2 s SER 118 Cb -0.13 -0.86 0.00 0.00 -1.71 0.00 0.00 66.02 63.32 2ee2 s SER 118 CO 0.19 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.09