#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 -1.09 0.12 1.61 0.01 -1.26 -5.17 113.70 107.93 2ee2 s SER 2 Ca 0.00 1.55 0.07 0.00 1.31 0.00 0.00 55.95 58.88 2ee2 s SER 2 Cb 0.00 2.09 -0.04 0.00 0.21 0.00 0.00 66.02 68.28 2ee2 s SER 2 CO 0.00 -0.22 -0.16 -0.55 0.41 0.00 0.00 173.24 172.72 2ee2 s SER 3 N 2.62 2.14 -0.06 2.44 0.15 -1.26 -5.16 113.70 114.57 2ee2 s SER 3 Ca -0.07 -0.79 -0.21 0.00 0.70 0.00 0.00 55.95 55.59 2ee2 s SER 3 Cb -0.10 -0.09 0.04 0.00 -1.71 0.00 0.00 66.02 64.16 2ee2 s SER 3 CO -0.19 -0.10 0.48 -0.83 1.20 0.00 0.00 173.24 173.80 2ee2 s GLY 4 N -2.36 -0.35 0.01 9.45 0.00 -1.26 -5.16 107.32 107.65 2ee2 s GLY 4 Ca 0.09 0.90 0.01 0.00 0.00 0.00 0.00 44.72 45.71 2ee2 s GLY 4 CO 0.04 0.64 0.06 -1.35 0.00 0.00 0.00 173.10 172.49 2ee2 s SER 5 N -0.94 5.50 -0.60 1.64 1.04 -1.26 -5.02 113.70 114.06 2ee2 s SER 5 Ca -0.10 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.41 2ee2 s SER 5 Cb -0.03 -1.52 0.44 0.00 0.10 0.00 0.00 66.02 65.00 2ee2 s SER 5 CO 0.05 0.26 1.81 -1.20 0.98 0.00 0.00 173.24 175.14 2ee2 n SER 6 N 1.11 6.94 -2.85 7.02 7.64 -1.26 -4.75 113.62 127.46 2ee2 n SER 6 Ca -0.13 -3.79 -0.03 0.00 1.01 0.00 0.00 58.87 55.94 2ee2 n SER 6 Cb 0.52 -0.83 0.01 0.00 -1.01 0.00 0.00 64.21 62.90 2ee2 n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2ee2 s GLY 7 N -2.19 -1.31 -0.02 0.23 0.00 -1.26 -5.13 107.32 97.63 2ee2 s GLY 7 Ca 0.59 -0.17 -0.30 0.00 0.00 0.00 0.00 44.72 44.84 2ee2 s GLY 7 CO -0.07 3.72 1.00 0.14 0.00 0.00 0.00 173.10 177.89 2ee2 s VAL 8 N 1.12 4.79 -0.06 1.40 1.01 -1.26 -5.04 120.40 122.36 2ee2 s VAL 8 Ca 0.26 2.01 -0.04 0.00 0.00 0.00 0.00 61.98 64.22 2ee2 s VAL 8 Cb 0.00 -4.29 0.03 0.00 0.00 0.00 0.00 36.38 32.12 2ee2 s VAL 8 CO -0.06 0.12 0.14 0.00 0.00 0.00 0.00 175.10 175.30 2ee2 s ALA 9 N 1.24 -0.29 0.42 5.51 0.00 -1.26 -5.16 121.76 122.22 2ee2 s ALA 9 Ca 0.52 0.53 -0.13 0.00 0.00 0.00 0.00 51.96 52.88 2ee2 s ALA 9 Cb -0.21 -0.34 -0.07 0.00 0.00 0.00 0.00 23.12 22.49 2ee2 s ALA 9 CO 0.26 -0.11 0.83 0.14 0.00 0.00 0.00 175.76 176.87 2ee2 s VAL 10 N 0.67 4.68 -0.18 0.00 -7.23 -1.26 -5.07 120.40 112.01 2ee2 s VAL 10 Ca -0.05 0.87 0.01 0.00 -1.81 0.00 0.00 61.98 61.00 2ee2 s VAL 10 Cb -0.07 -3.70 0.02 0.00 0.56 0.00 0.00 36.38 33.20 2ee2 s VAL 10 CO -0.03 -0.49 -0.19 -0.63 -0.31 0.00 0.00 175.10 173.45 2ee2 s ILE 11 N -2.35 2.02 -0.13 -0.62 1.01 -1.26 -5.11 121.20 114.76 2ee2 s ILE 11 Ca 0.54 -0.94 -0.04 0.00 0.00 0.00 0.00 60.65 60.21 2ee2 s ILE 11 Cb -0.10 -1.84 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 2ee2 s ILE 11 CO 0.28 0.51 0.01 0.20 0.00 0.00 0.00 174.94 175.94 2ee2 s ASN 12 N 1.30 5.28 -0.61 3.58 0.01 -1.26 -5.07 114.94 118.17 2ee2 s ASN 12 Ca 0.04 0.07 -0.17 0.00 -0.71 0.00 0.00 52.86 52.10 2ee2 s ASN 12 Cb -0.13 -1.71 0.13 0.00 0.41 0.00 0.00 41.25 39.95 2ee2 s ASN 12 CO -0.12 0.27 0.64 -0.55 -1.51 0.00 0.00 177.10 175.82 2ee2 s SER 13 N -0.24 6.28 -0.27 -1.22 0.15 -1.26 -4.99 113.70 112.15 2ee2 s SER 13 Ca 0.06 -1.80 -0.25 0.00 0.70 0.00 0.00 55.95 54.66 2ee2 s SER 13 Cb -0.12 -2.25 0.09 0.00 -1.71 0.00 0.00 66.02 62.03 2ee2 s SER 13 CO 0.02 -0.92 0.86 0.00 1.20 0.00 0.00 173.24 174.39 2ee2 s ALA 14 N 1.84 -1.86 0.05 5.45 0.00 -1.26 -5.01 121.76 120.97 2ee2 s ALA 14 Ca 0.09 1.94 -0.06 0.00 0.00 0.00 0.00 51.96 53.93 2ee2 s ALA 14 Cb -0.24 -1.25 -0.30 0.00 0.00 0.00 0.00 23.12 21.33 2ee2 s ALA 14 CO 0.02 -0.30 1.06 -0.56 0.00 0.00 0.00 175.76 175.98 2ee2 h GLN 15 N 4.56 0.32 -1.83 0.00 3.07 -1.94 -3.49 115.11 115.80 2ee2 h GLN 15 Ca -0.28 -0.55 0.28 0.00 0.09 0.00 0.00 58.65 58.19 2ee2 h GLN 15 Cb 1.17 0.21 -0.10 0.00 0.08 0.00 0.00 27.48 28.84 2ee2 h GLN 15 CO 0.09 1.25 0.75 0.34 0.09 0.00 0.00 178.83 181.34 2ee2 s ASP 16 N -7.21 -0.06 -0.12 0.06 2.15 -1.26 -5.16 116.67 105.07 2ee2 s ASP 16 Ca -0.06 -0.26 -0.17 0.00 0.43 0.00 0.00 52.55 52.49 2ee2 s ASP 16 Cb 0.06 0.26 0.04 0.00 -0.30 0.00 0.00 42.92 42.99 2ee2 s ASP 16 CO 0.89 -0.49 0.45 0.00 -0.17 0.00 0.00 175.17 175.85 2ee2 s ALA 17 N -2.51 -1.12 0.36 3.66 0.00 -1.26 -3.56 121.76 117.33 2ee2 s ALA 17 Ca 0.17 1.06 -0.27 0.00 0.00 0.00 0.00 51.96 52.92 2ee2 s ALA 17 Cb 0.02 -0.47 -0.09 0.00 0.00 0.00 0.00 23.12 22.58 2ee2 s ALA 17 CO -0.01 -0.24 1.21 -1.25 0.00 0.00 0.00 175.76 175.46 2ee2 s PRO 18 N -0.30 4.26 0.00 0.00 0.04 -1.26 -4.95 135.00 132.79 2ee2 s PRO 18 Ca -0.05 1.97 0.00 0.00 0.04 0.00 0.00 61.00 62.97 2ee2 s PRO 18 Cb -0.03 -2.91 0.00 0.00 0.04 0.00 0.00 34.50 31.60 2ee2 s PRO 18 CO 0.03 -0.19 0.00 0.45 0.04 0.00 0.00 177.00 177.33 2ee2 n SER 19 N 0.52 4.39 -4.88 6.66 2.88 -1.26 -4.69 113.62 117.25 2ee2 n SER 19 Ca 0.02 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.22 2ee2 n SER 19 Cb 0.44 0.53 -0.05 0.00 -0.75 0.00 0.00 64.21 64.38 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 -1.85 3.71 0.06 -1.46 2.56 -1.26 -4.96 118.70 115.49 2ee2 s GLU 20 Ca 0.00 0.09 0.03 0.00 0.00 0.00 0.00 54.97 55.09 2ee2 s GLU 20 Cb 0.00 -2.97 -0.04 0.00 2.00 0.00 0.00 34.13 33.12 2ee2 s GLU 20 CO 0.00 0.55 0.05 0.00 -0.56 0.00 0.00 175.26 175.30 2ee2 s ALA 21 N -1.45 3.47 -0.16 6.30 0.00 -1.26 -4.82 121.76 123.85 2ee2 s ALA 21 Ca 0.34 -1.02 -0.29 0.00 0.00 0.00 0.00 51.96 50.99 2ee2 s ALA 21 Cb -0.13 -1.38 -0.03 0.00 0.00 0.00 0.00 23.12 21.57 2ee2 s ALA 21 CO 0.19 0.72 1.57 -1.25 0.00 0.00 0.00 175.76 176.99 2ee2 s PRO 22 N -2.21 3.99 0.63 0.00 0.04 -1.26 -4.97 135.00 131.22 2ee2 s PRO 22 Ca 0.27 1.83 0.07 0.00 0.04 0.00 0.00 61.00 63.20 2ee2 s PRO 22 Cb -0.12 -3.97 0.11 0.00 0.04 0.00 0.00 34.50 30.56 2ee2 s PRO 22 CO 0.19 -1.05 0.87 2.41 0.04 0.00 0.00 177.00 179.46 2ee2 n THR 23 N 5.94 0.00 -3.74 1.26 -1.04 -1.26 -4.53 114.28 110.91 2ee2 n THR 23 Ca 0.17 -1.83 -0.29 0.00 -2.04 0.00 0.00 64.05 60.06 2ee2 n THR 23 Cb 0.44 -0.63 0.01 0.00 -1.82 0.00 0.00 70.33 68.33 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 -2.47 -4.29 -3.58 -2.82 1.02 -1.26 -2.82 120.64 104.44 2ee2 n GLU 24 Ca 0.17 0.53 -0.36 0.00 -0.02 0.00 0.00 57.16 57.47 2ee2 n GLU 24 Cb 0.60 -5.33 -0.08 0.00 -0.02 0.00 0.00 31.44 26.62 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 -3.16 5.32 0.34 2.62 0.11 -1.26 -4.09 120.40 120.28 2ee2 s VAL 25 Ca 0.57 0.43 0.06 0.00 -2.93 0.00 0.00 61.98 60.11 2ee2 s VAL 25 Cb -0.30 -3.59 -0.02 0.00 -1.53 0.00 0.00 36.38 30.94 2ee2 s VAL 25 CO 0.71 0.37 0.22 0.61 -3.33 0.00 0.00 175.10 173.68 2ee2 n GLY 26 N 3.68 3.07 2.81 6.54 0.00 -0.72 -4.99 105.19 115.59 2ee2 n GLY 26 Ca -0.13 -1.95 -0.16 0.00 0.00 0.00 0.00 46.02 43.78 2ee2 n GLY 26 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ee2 s VAL 27 N -3.19 0.11 -0.16 1.61 -7.23 -1.26 -2.00 120.40 108.29 2ee2 s VAL 27 Ca 0.32 0.10 -0.02 0.00 -1.81 0.00 0.00 61.98 60.57 2ee2 s VAL 27 Cb 0.02 -0.21 -0.02 0.00 0.56 0.00 0.00 36.38 36.73 2ee2 s VAL 27 CO 0.22 0.12 -0.08 -0.75 -0.31 0.00 0.00 175.10 174.30 2ee2 s LYS 28 N 0.93 3.48 -0.38 4.82 2.20 0.29 -4.99 119.74 126.10 2ee2 s LYS 28 Ca -0.09 -0.62 -0.24 0.00 -0.36 0.00 0.00 55.97 54.66 2ee2 s LYS 28 Cb -0.12 -2.80 0.01 0.00 -1.51 0.00 0.00 37.83 33.41 2ee2 s LYS 28 CO -0.02 0.15 0.85 0.08 -0.36 0.00 0.00 175.35 176.05 2ee2 s VAL 29 N 0.56 4.65 -0.12 4.02 1.01 -1.26 -0.95 120.40 128.30 2ee2 s VAL 29 Ca -0.06 0.96 -0.06 0.00 0.00 0.00 0.00 61.98 62.82 2ee2 s VAL 29 Cb -0.15 -4.28 -0.02 0.00 0.00 0.00 0.00 36.38 31.93 2ee2 s VAL 29 CO 0.03 -0.52 -0.12 -0.07 0.00 0.00 0.00 175.10 174.41 2ee2 h LEU 30 N 9.96 0.00 -9.17 3.92 3.38 -1.70 -3.49 115.31 118.21 2ee2 h LEU 30 Ca -0.24 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.24 2ee2 h LEU 30 Cb 1.09 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.70 2ee2 h LEU 30 CO 0.95 0.64 -0.53 -0.44 0.09 0.00 0.00 178.44 179.14 2ee2 s SER 31 N -5.50 2.12 0.60 -0.43 0.01 -0.60 -4.96 113.70 104.96 2ee2 s SER 31 Ca -0.10 -1.63 0.32 0.00 1.31 0.00 0.00 55.95 55.84 2ee2 s SER 31 Cb 0.01 0.44 1.86 0.00 0.21 0.00 0.00 66.02 68.54 2ee2 s SER 31 CO 0.15 -0.92 2.22 0.77 0.41 0.00 0.00 173.24 175.87 2ee2 h SER 32 N 2.02 0.00 0.00 2.44 4.64 -1.94 -2.00 113.55 118.72 2ee2 h SER 32 Ca -0.33 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.91 2ee2 h SER 32 Cb 1.26 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.18 2ee2 h SER 32 CO 0.52 0.00 -0.73 -1.20 -0.87 0.00 0.00 176.83 174.55 2ee2 n SER 33 N -3.69 1.40 -3.73 4.97 7.64 -1.26 -3.80 113.62 115.14 2ee2 n SER 33 Ca -0.02 -3.07 -0.12 0.00 1.01 0.00 0.00 58.87 56.67 2ee2 n SER 33 Cb 0.16 -0.43 -0.13 0.00 -1.01 0.00 0.00 64.21 62.81 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 -1.82 0.22 -0.17 1.43 2.02 -0.75 -2.83 118.70 116.80 2ee2 s GLU 34 Ca 0.36 0.52 -0.08 0.00 0.02 0.00 0.00 54.97 55.79 2ee2 s GLU 34 Cb 0.38 -0.09 0.07 0.00 0.10 0.00 0.00 34.13 34.59 2ee2 s GLU 34 CO -0.11 -0.15 0.38 0.42 0.02 0.00 0.00 175.26 175.82 2ee2 s ILE 35 N 1.14 -0.28 -0.14 -1.63 1.01 -1.01 -1.55 121.20 118.74 2ee2 s ILE 35 Ca -0.08 0.14 -0.13 0.00 0.00 0.00 0.00 60.65 60.58 2ee2 s ILE 35 Cb -0.09 -0.59 -0.05 0.00 0.01 0.00 0.00 42.46 41.74 2ee2 s ILE 35 CO -0.08 0.06 0.29 -0.55 0.00 0.00 0.00 174.94 174.66 2ee2 s SER 36 N 1.90 6.46 -0.40 3.58 0.15 -0.13 0.27 113.70 125.54 2ee2 s SER 36 Ca -0.06 0.54 -0.04 0.00 0.70 0.00 0.00 55.95 57.09 2ee2 s SER 36 Cb -0.10 -2.18 0.10 0.00 -1.71 0.00 0.00 66.02 62.13 2ee2 s SER 36 CO -0.12 0.14 0.19 -0.69 1.20 0.00 0.00 173.24 173.96 2ee2 s VAL 37 N 0.22 3.45 0.28 4.45 1.01 -0.28 -0.55 120.40 128.98 2ee2 s VAL 37 Ca 0.17 -1.83 -0.01 0.00 0.00 0.00 0.00 61.98 60.31 2ee2 s VAL 37 Cb -0.13 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 2ee2 s VAL 37 CO 0.05 -0.58 0.48 -1.00 0.00 0.00 0.00 175.10 174.05 2ee2 s HIS 38 N 1.22 3.49 0.18 5.22 3.76 -0.85 -0.42 115.29 127.89 2ee2 s HIS 38 Ca 0.05 0.38 -0.23 0.00 -0.15 0.00 0.00 55.06 55.11 2ee2 s HIS 38 Cb -0.23 -1.90 0.06 0.00 1.11 0.00 0.00 32.58 31.63 2ee2 s HIS 38 CO -0.02 0.24 0.66 1.67 -0.85 0.00 0.00 174.74 176.44 2ee2 s TRP 39 N -2.09 -0.42 0.27 1.40 -2.14 -0.85 -1.75 118.94 113.35 2ee2 s TRP 39 Ca 0.40 0.15 -0.14 0.00 2.66 0.00 0.00 56.10 59.17 2ee2 s TRP 39 Cb -0.10 0.60 -0.08 0.00 -3.10 0.00 0.00 33.47 30.79 2ee2 s TRP 39 CO 0.32 -0.93 0.66 -2.00 -2.66 0.00 0.00 176.95 172.34 2ee2 s GLU 40 N -3.73 3.96 0.20 3.25 2.12 -1.13 -4.69 118.70 118.68 2ee2 s GLU 40 Ca 0.04 0.55 -0.30 0.00 0.36 0.00 0.00 54.97 55.62 2ee2 s GLU 40 Cb -0.02 -2.59 -0.08 0.00 0.26 0.00 0.00 34.13 31.69 2ee2 s GLU 40 CO -0.07 0.26 1.14 -1.01 -0.54 0.00 0.00 175.26 175.04 2ee2 s HIS 41 N -1.83 3.52 0.92 5.30 3.76 -1.26 -4.55 115.29 121.14 2ee2 s HIS 41 Ca 0.49 1.54 -0.13 0.00 -0.15 0.00 0.00 55.06 56.81 2ee2 s HIS 41 Cb -0.12 -3.34 0.15 0.00 1.11 0.00 0.00 32.58 30.38 2ee2 s HIS 41 CO 0.19 -0.85 1.18 0.14 -0.85 0.00 0.00 174.74 174.55 2ee2 s VAL 42 N -0.30 1.97 -0.18 -0.90 -7.23 -1.26 -4.95 120.40 107.54 2ee2 s VAL 42 Ca 0.50 0.00 0.17 0.00 -1.81 0.00 0.00 61.98 60.84 2ee2 s VAL 42 Cb -0.31 -2.83 0.03 0.00 0.56 0.00 0.00 36.38 33.82 2ee2 s VAL 42 CO 0.37 0.00 1.24 0.17 -0.31 0.00 0.00 175.10 176.57 2ee2 h LEU 43 N -1.51 0.00 -9.50 1.32 8.10 -1.95 -3.45 115.31 108.33 2ee2 h LEU 43 Ca -0.48 0.00 -0.54 0.00 0.11 0.00 0.00 57.88 56.98 2ee2 h LEU 43 Cb 1.31 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 41.50 2ee2 h LEU 43 CO 0.56 0.42 0.27 -1.83 -4.11 0.00 0.00 178.44 173.75 2ee2 s GLU 44 N -3.02 4.57 0.00 0.17 1.03 -1.26 -4.94 118.70 115.25 2ee2 s GLU 44 Ca 0.02 1.25 0.20 0.00 0.03 0.00 0.00 54.97 56.47 2ee2 s GLU 44 Cb 0.08 -3.40 0.28 0.00 -0.80 0.00 0.00 34.13 30.29 2ee2 s GLU 44 CO 0.76 0.16 1.24 1.63 -1.33 0.00 0.00 175.26 177.73 2ee2 n LYS 45 N 3.16 2.12 0.23 -4.83 4.76 -1.26 -4.28 118.16 118.05 2ee2 n LYS 45 Ca 0.01 -1.96 0.13 0.00 -2.87 0.00 0.00 58.31 53.62 2ee2 n LYS 45 Cb 0.50 -1.42 0.33 0.00 -1.84 0.00 0.00 35.03 32.60 2ee2 n LYS 45 CO 0.00 0.00 0.00 -0.84 -1.37 0.00 0.00 177.40 175.19 2ee2 h ILE 46 N 3.91 0.09 -3.62 -0.18 3.07 -1.99 -3.46 117.51 115.33 2ee2 h ILE 46 Ca 0.00 -0.94 -0.53 0.00 1.55 0.00 0.00 64.86 64.94 2ee2 h ILE 46 Cb 0.87 1.87 0.21 0.00 -0.27 0.00 0.00 36.82 39.50 2ee2 h ILE 46 CO 0.00 0.04 -0.32 1.33 -1.05 0.00 0.00 178.15 178.15 2ee2 n VAL 47 N -3.12 0.38 -0.06 0.16 0.24 -1.26 -4.86 118.33 109.80 2ee2 n VAL 47 Ca 0.03 -0.18 -0.10 0.00 -2.04 0.00 0.00 64.34 62.05 2ee2 n VAL 47 Cb 0.47 -0.76 -0.05 0.00 -1.47 0.00 0.00 33.84 32.03 2ee2 n VAL 47 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2ee2 n GLU 48 N -2.22 0.30 -3.57 7.34 4.71 -1.26 -4.98 120.64 120.96 2ee2 n GLU 48 Ca 0.09 0.09 -0.07 0.00 -0.01 0.00 0.00 57.16 57.26 2ee2 n GLU 48 Cb 0.53 -1.15 -0.02 0.00 -1.01 0.00 0.00 31.44 29.78 2ee2 n GLU 48 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 2ee2 s SER 49 N -5.50 -0.30 -0.41 1.62 0.01 -1.26 -3.42 113.70 104.44 2ee2 s SER 49 Ca -0.17 -0.11 -0.16 0.00 1.31 0.00 0.00 55.95 56.82 2ee2 s SER 49 Cb 0.05 0.39 0.02 0.00 0.21 0.00 0.00 66.02 66.70 2ee2 s SER 49 CO 0.27 -0.67 0.35 -0.31 0.41 0.00 0.00 173.24 173.29 2ee2 s TYR 50 N -3.11 3.21 -0.70 2.43 1.51 -1.23 -3.67 117.35 115.79 2ee2 s TYR 50 Ca 0.07 -0.50 -0.27 0.00 -1.01 0.00 0.00 57.07 55.37 2ee2 s TYR 50 Cb -0.01 -2.71 0.03 0.00 -0.11 0.00 0.00 41.96 39.16 2ee2 s TYR 50 CO -0.06 -0.63 1.29 -1.14 -1.11 0.00 0.00 175.55 173.90 2ee2 s GLN 51 N 1.86 3.24 -0.80 -0.62 0.74 -1.26 -3.72 119.66 119.11 2ee2 s GLN 51 Ca 0.08 -0.09 -0.21 0.00 0.05 0.00 0.00 55.36 55.19 2ee2 s GLN 51 Cb -0.18 -4.15 0.09 0.00 1.10 0.00 0.00 33.01 29.86 2ee2 s GLN 51 CO 0.11 -2.07 1.09 0.42 -0.55 0.00 0.00 175.29 174.29 2ee2 s ILE 52 N 5.71 4.40 0.01 -2.34 1.09 -1.21 -4.13 121.20 124.74 2ee2 s ILE 52 Ca 0.38 -0.81 -0.27 0.00 -1.10 0.00 0.00 60.65 58.85 2ee2 s ILE 52 Cb -0.08 -4.77 -0.04 0.00 -1.06 0.00 0.00 42.46 36.51 2ee2 s ILE 52 CO 0.18 -1.54 0.87 -0.60 -0.10 0.00 0.00 174.94 173.74 2ee2 s ARG 53 N 3.73 4.54 -0.07 2.79 3.52 -1.00 -2.00 118.95 130.47 2ee2 s ARG 53 Ca 0.29 1.23 -0.06 0.00 -0.13 0.00 0.00 55.73 57.06 2ee2 s ARG 53 Cb -0.10 -3.42 0.02 0.00 -1.56 0.00 0.00 34.95 29.89 2ee2 s ARG 53 CO 0.01 0.09 0.18 1.52 -0.81 0.00 0.00 175.30 176.29 2ee2 s TYR 54 N 0.56 -0.20 0.17 5.12 1.13 0.14 -1.99 117.35 122.28 2ee2 s TYR 54 Ca 0.45 0.50 -0.23 0.00 -1.41 0.00 0.00 57.07 56.38 2ee2 s TYR 54 Cb -0.21 0.05 0.06 0.00 -1.10 0.00 0.00 41.96 40.77 2ee2 s TYR 54 CO 0.25 -0.11 0.60 1.67 -2.51 0.00 0.00 175.55 175.45 2ee2 s TRP 55 N 0.31 -0.50 0.31 -3.49 -2.14 -1.22 -2.65 118.94 109.56 2ee2 s TRP 55 Ca -0.02 0.27 -0.28 0.00 2.66 0.00 0.00 56.10 58.73 2ee2 s TRP 55 Cb -0.03 0.56 -0.09 0.00 -3.10 0.00 0.00 33.47 30.80 2ee2 s TRP 55 CO -0.01 -0.87 1.05 0.00 -2.66 0.00 0.00 176.95 174.46 2ee2 s ALA 56 N -3.77 3.30 0.37 2.67 0.00 -1.26 -1.30 121.76 121.77 2ee2 s ALA 56 Ca 0.02 0.78 0.21 0.00 0.00 0.00 0.00 51.96 52.97 2ee2 s ALA 56 Cb -0.01 -3.29 1.33 0.00 0.00 0.00 0.00 23.12 21.15 2ee2 s ALA 56 CO -0.11 -0.10 1.54 0.00 0.00 0.00 0.00 175.76 177.09 2ee2 n ALA 57 N 0.86 1.03 -0.04 0.00 0.00 -0.39 0.11 120.51 122.08 2ee2 n ALA 57 Ca 0.01 0.98 -0.15 0.00 0.00 0.00 0.00 53.44 54.28 2ee2 n ALA 57 Cb 0.47 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.84 2ee2 n ALA 57 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.50 178.62 2ee2 h HIS 58 N 0.00 0.55 -3.54 0.00 -0.00 -1.91 -3.45 115.15 106.81 2ee2 h HIS 58 Ca 0.83 -0.22 -0.54 0.00 -0.00 0.00 0.00 60.37 60.45 2ee2 h HIS 58 Cb 2.24 -0.10 0.20 0.00 -0.00 0.00 0.00 27.41 29.76 2ee2 h HIS 58 CO -0.01 0.94 -0.33 -0.25 -0.00 0.00 0.00 177.93 178.28 2ee2 n ASP 59 N -4.39 -1.19 -4.89 3.10 8.00 0.29 -5.01 116.55 112.47 2ee2 n ASP 59 Ca -0.07 0.44 -0.21 0.00 0.71 0.00 0.00 54.79 55.66 2ee2 n ASP 59 Cb 0.49 -1.28 -0.03 0.00 -0.02 0.00 0.00 41.12 40.29 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 -3.55 3.10 0.45 -1.24 1.02 -1.26 -4.74 119.74 113.52 2ee2 s LYS 60 Ca 0.62 -0.97 0.16 0.00 0.02 0.00 0.00 55.97 55.81 2ee2 s LYS 60 Cb -0.26 -2.69 1.11 0.00 -0.52 0.00 0.00 37.83 35.47 2ee2 s LYS 60 CO 0.62 0.36 1.98 1.05 -0.92 0.00 0.00 175.35 178.44 2ee2 h GLU 61 N 1.32 0.31 -0.17 1.68 -0.00 -1.96 -1.53 114.58 114.23 2ee2 h GLU 61 Ca -0.49 -0.02 -0.01 0.00 -0.00 0.00 0.00 59.36 58.83 2ee2 h GLU 61 Cb 1.24 -0.07 -0.01 0.00 -0.00 0.00 0.00 28.75 29.91 2ee2 h GLU 61 CO 0.60 0.20 0.05 1.05 -0.00 0.00 0.00 179.01 180.91 2ee2 h GLU 62 N 0.32 0.27 -0.73 1.06 4.11 -2.03 -2.49 114.58 115.08 2ee2 h GLU 62 Ca 0.27 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.64 2ee2 h GLU 62 Cb 0.64 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2ee2 h GLU 62 CO -0.07 0.39 0.00 0.00 0.07 0.00 0.00 179.01 179.41 2ee2 n ALA 63 N -2.26 2.87 -2.60 1.06 0.00 -0.67 -4.88 120.51 114.03 2ee2 n ALA 63 Ca -0.05 -0.61 -0.41 0.00 0.00 0.00 0.00 53.44 52.38 2ee2 n ALA 63 Cb 0.15 -1.03 -0.04 0.00 0.00 0.00 0.00 19.45 18.53 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 -1.61 3.24 -0.04 0.00 0.00 -0.67 -4.81 121.76 117.88 2ee2 s ALA 64 Ca 0.18 0.41 -0.04 0.00 0.00 0.00 0.00 51.96 52.51 2ee2 s ALA 64 Cb 0.13 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 20.02 2ee2 s ALA 64 CO 0.07 -0.13 0.17 -0.80 0.00 0.00 0.00 175.76 175.07 2ee2 s ASN 65 N 0.66 6.34 0.33 0.00 0.01 -1.08 -4.90 114.94 116.30 2ee2 s ASN 65 Ca 0.46 0.37 0.03 0.00 -0.71 0.00 0.00 52.86 53.01 2ee2 s ASN 65 Cb -0.20 -2.00 -0.05 0.00 0.41 0.00 0.00 41.25 39.40 2ee2 s ASN 65 CO 0.25 0.30 0.08 0.00 -1.51 0.00 0.00 177.10 176.22 2ee2 s ARG 66 N -1.72 1.66 -0.28 -0.60 1.04 -1.26 -0.68 118.95 117.11 2ee2 s ARG 66 Ca 0.24 -1.94 -0.02 0.00 -1.04 0.00 0.00 55.73 52.98 2ee2 s ARG 66 Cb -0.12 -0.70 0.09 0.00 -2.04 0.00 0.00 34.95 32.18 2ee2 s ARG 66 CO 0.15 -0.26 0.09 0.08 -0.04 0.00 0.00 175.30 175.31 2ee2 s VAL 67 N -3.37 0.69 -0.71 4.99 1.01 -0.85 -4.93 120.40 117.23 2ee2 s VAL 67 Ca 0.34 -1.14 -0.27 0.00 0.00 0.00 0.00 61.98 60.91 2ee2 s VAL 67 Cb 0.07 -1.45 0.03 0.00 0.00 0.00 0.00 36.38 35.04 2ee2 s VAL 67 CO 0.15 -0.58 1.27 -1.58 0.00 0.00 0.00 175.10 174.36 2ee2 s GLN 68 N 1.73 3.24 0.37 2.72 0.74 -1.26 -3.30 119.66 123.90 2ee2 s GLN 68 Ca 0.07 -0.14 0.07 0.00 0.05 0.00 0.00 55.36 55.42 2ee2 s GLN 68 Cb -0.17 -4.15 -0.00 0.00 1.10 0.00 0.00 33.01 29.78 2ee2 s GLN 68 CO -0.23 -2.07 0.50 0.14 -0.55 0.00 0.00 175.29 173.08 2ee2 s VAL 69 N 5.63 3.66 0.27 1.34 -7.23 -1.24 -4.97 120.40 117.86 2ee2 s VAL 69 Ca 0.37 -1.02 -0.30 0.00 -1.81 0.00 0.00 61.98 59.22 2ee2 s VAL 69 Cb -0.08 -3.25 -0.11 0.00 0.56 0.00 0.00 36.38 33.50 2ee2 s VAL 69 CO 0.17 -0.10 1.59 0.42 -0.31 0.00 0.00 175.10 176.87 2ee2 s THR 70 N -2.24 2.17 0.58 5.32 -4.23 -1.26 -3.49 115.64 112.48 2ee2 s THR 70 Ca 0.48 0.14 0.29 0.00 -1.18 0.00 0.00 61.69 61.42 2ee2 s THR 70 Cb -0.09 -3.09 0.40 0.00 1.34 0.00 0.00 72.50 71.06 2ee2 s THR 70 CO 0.32 0.02 1.85 0.77 -0.54 0.00 0.00 174.62 177.04 2ee2 h SER 71 N 5.25 0.00 -0.06 3.99 4.64 -1.92 0.41 113.55 125.87 2ee2 h SER 71 Ca -0.46 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.78 2ee2 h SER 71 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 2ee2 h SER 71 CO 0.82 0.00 -0.17 1.56 -0.87 0.00 0.00 176.83 178.17 2ee2 h GLN 72 N 0.00 0.43 -6.19 4.77 4.20 -1.89 -3.42 115.11 113.01 2ee2 h GLN 72 Ca 0.27 -0.13 -0.58 0.00 0.06 0.00 0.00 58.65 58.27 2ee2 h GLN 72 Cb 1.40 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 29.12 2ee2 h GLN 72 CO -0.00 0.59 1.33 -1.21 -0.67 0.00 0.00 178.83 178.87 2ee2 s GLU 73 N -4.64 3.36 0.38 1.46 0.41 0.14 -4.83 118.70 114.99 2ee2 s GLU 73 Ca -0.07 1.71 0.28 0.00 -0.41 0.00 0.00 54.97 56.48 2ee2 s GLU 73 Cb 0.14 -4.23 1.22 0.00 -1.78 0.00 0.00 34.13 29.48 2ee2 s GLU 73 CO 0.77 -1.83 1.83 1.88 -0.49 0.00 0.00 175.26 177.43 2ee2 h TYR 74 N 13.21 0.00 -4.11 1.61 -1.99 -1.85 -3.45 116.97 120.39 2ee2 h TYR 74 Ca -0.37 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.18 2ee2 h TYR 74 Cb 1.19 0.00 -0.11 0.00 2.00 0.00 0.00 36.73 39.81 2ee2 h TYR 74 CO 0.95 0.00 -0.32 -1.12 -0.00 0.00 0.00 178.16 177.67 2ee2 s SER 75 N -4.71 0.27 0.29 3.88 0.01 -1.26 -2.01 113.70 110.17 2ee2 s SER 75 Ca 0.02 -1.23 0.03 0.00 1.31 0.00 0.00 55.95 56.08 2ee2 s SER 75 Cb 0.09 0.53 -0.06 0.00 0.21 0.00 0.00 66.02 66.80 2ee2 s SER 75 CO 0.42 -1.07 0.05 0.00 0.41 0.00 0.00 173.24 173.05 2ee2 s ALA 76 N -3.84 2.11 -0.08 1.44 0.00 0.44 -4.96 121.76 116.87 2ee2 s ALA 76 Ca 0.30 -1.96 0.01 0.00 0.00 0.00 0.00 51.96 50.31 2ee2 s ALA 76 Cb 0.02 0.72 0.02 0.00 0.00 0.00 0.00 23.12 23.88 2ee2 s ALA 76 CO 0.13 -0.33 -0.10 0.50 0.00 0.00 0.00 175.76 175.96 2ee2 s ARG 77 N -3.92 1.57 0.10 0.00 3.52 -1.26 -1.13 118.95 117.83 2ee2 s ARG 77 Ca 0.35 -0.33 0.02 0.00 -0.13 0.00 0.00 55.73 55.65 2ee2 s ARG 77 Cb 0.08 -1.44 -0.04 0.00 -1.56 0.00 0.00 34.95 31.99 2ee2 s ARG 77 CO 0.14 -0.10 0.16 -0.51 -0.81 0.00 0.00 175.30 174.18 2ee2 s LEU 78 N 1.10 4.04 0.34 -0.88 1.43 0.14 -4.97 118.68 119.88 2ee2 s LEU 78 Ca -0.06 0.08 -0.09 0.00 -1.03 0.00 0.00 54.13 53.03 2ee2 s LEU 78 Cb -0.14 -2.67 0.02 0.00 0.03 0.00 0.00 46.19 43.42 2ee2 s LEU 78 CO -0.01 0.14 0.57 -1.61 0.23 0.00 0.00 176.35 175.66 2ee2 s GLU 79 N -2.67 1.93 -1.32 1.70 2.02 -1.26 -2.39 118.70 116.71 2ee2 s GLU 79 Ca 0.32 -1.55 -0.02 0.00 0.02 0.00 0.00 54.97 53.74 2ee2 s GLU 79 Cb -0.12 0.51 0.01 0.00 0.10 0.00 0.00 34.13 34.63 2ee2 s GLU 79 CO 0.25 -0.84 0.82 0.09 0.02 0.00 0.00 175.26 175.60 2ee2 n ASN 80 N -1.19 -2.11 -4.86 -0.19 3.02 -1.13 -4.94 115.26 103.86 2ee2 n ASN 80 Ca -0.02 -0.76 -0.21 0.00 -0.03 0.00 0.00 54.58 53.56 2ee2 n ASN 80 Cb 0.61 -4.29 -0.03 0.00 -0.61 0.00 0.00 39.78 35.45 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 -6.74 3.39 0.06 3.41 1.43 -1.25 -5.09 118.68 113.89 2ee2 s LEU 81 Ca 0.12 -0.74 -0.11 0.00 -1.03 0.00 0.00 54.13 52.37 2ee2 s LEU 81 Cb -0.06 -2.02 -0.06 0.00 0.03 0.00 0.00 46.19 44.08 2ee2 s LEU 81 CO 0.79 -0.61 0.40 -0.76 0.23 0.00 0.00 176.35 176.40 2ee2 s LEU 82 N -4.10 4.38 0.46 1.79 1.43 -1.26 -4.50 118.68 116.88 2ee2 s LEU 82 Ca 0.47 0.84 -0.23 0.00 -1.03 0.00 0.00 54.13 54.17 2ee2 s LEU 82 Cb -0.03 -2.87 -0.07 0.00 0.03 0.00 0.00 46.19 43.25 2ee2 s LEU 82 CO 0.27 0.21 1.17 -2.16 0.23 0.00 0.00 176.35 176.07 2ee2 s PRO 83 N -1.68 3.76 -1.47 1.29 0.04 -1.25 -3.56 135.00 132.13 2ee2 s PRO 83 Ca 0.30 1.78 -0.02 0.00 0.04 0.00 0.00 61.00 63.10 2ee2 s PRO 83 Cb -0.15 -2.41 0.00 0.00 0.04 0.00 0.00 34.50 31.99 2ee2 s PRO 83 CO 0.17 -0.55 0.21 -3.47 0.04 0.00 0.00 177.00 173.39 2ee2 n ASP 84 N -0.48 0.09 -4.00 6.66 2.03 0.23 -4.85 116.55 116.23 2ee2 n ASP 84 Ca 0.07 -1.17 -0.24 0.00 0.52 0.00 0.00 54.79 53.97 2ee2 n ASP 84 Cb 0.48 -2.19 -0.17 0.00 -0.72 0.00 0.00 41.12 38.53 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 -4.16 1.01 -0.10 5.18 2.01 -1.23 -4.91 115.64 113.44 2ee2 s THR 85 Ca 0.04 -0.41 -0.30 0.00 0.31 0.00 0.00 61.69 61.33 2ee2 s THR 85 Cb -0.02 -0.94 -0.03 0.00 0.01 0.00 0.00 72.50 71.52 2ee2 s THR 85 CO 0.95 0.33 1.31 -1.58 -0.69 0.00 0.00 174.62 174.94 2ee2 s GLN 86 N 0.70 4.27 -0.14 4.92 0.74 -1.26 -3.56 119.66 125.34 2ee2 s GLN 86 Ca -0.14 1.77 0.02 0.00 0.05 0.00 0.00 55.36 57.07 2ee2 s GLN 86 Cb -0.16 -3.70 0.01 0.00 1.10 0.00 0.00 33.01 30.26 2ee2 s GLN 86 CO 0.03 -0.63 -0.21 0.71 -0.55 0.00 0.00 175.29 174.64 2ee2 s TYR 87 N 3.04 2.55 -0.59 1.67 1.51 -0.71 -1.26 117.35 123.57 2ee2 s TYR 87 Ca 0.59 -1.29 -0.24 0.00 -1.01 0.00 0.00 57.07 55.12 2ee2 s TYR 87 Cb -0.25 -1.75 0.05 0.00 -0.11 0.00 0.00 41.96 39.90 2ee2 s TYR 87 CO 0.20 -0.60 0.95 -0.06 -1.11 0.00 0.00 175.55 174.93 2ee2 s PHE 88 N 0.88 2.75 0.23 2.71 0.08 -0.42 -1.15 117.98 123.06 2ee2 s PHE 88 Ca -0.06 -0.21 0.01 0.00 0.12 0.00 0.00 56.93 56.79 2ee2 s PHE 88 Cb -0.15 -4.14 -0.04 0.00 -0.57 0.00 0.00 43.02 38.12 2ee2 s PHE 88 CO -0.03 -1.46 0.40 0.42 -0.10 0.00 0.00 175.22 174.46 2ee2 s ILE 89 N 3.99 5.21 -0.26 0.64 1.01 0.92 -3.45 121.20 129.27 2ee2 s ILE 89 Ca 0.27 -0.54 -0.25 0.00 0.00 0.00 0.00 60.65 60.13 2ee2 s ILE 89 Cb -0.14 -3.78 0.07 0.00 0.01 0.00 0.00 42.46 38.62 2ee2 s ILE 89 CO 0.16 -0.26 0.72 -1.83 0.00 0.00 0.00 174.94 173.73 2ee2 s GLU 90 N -3.62 0.85 -0.25 2.79 -1.05 -0.84 -1.89 118.70 114.69 2ee2 s GLU 90 Ca 0.37 0.95 -0.00 0.00 -0.15 0.00 0.00 54.97 56.14 2ee2 s GLU 90 Cb -0.10 0.41 0.07 0.00 -0.44 0.00 0.00 34.13 34.07 2ee2 s GLU 90 CO 0.30 -0.11 0.01 0.08 0.95 0.00 0.00 175.26 176.49 2ee2 s VAL 91 N 0.28 1.21 -0.09 1.83 1.01 -1.26 -2.37 120.40 121.01 2ee2 s VAL 91 Ca -0.01 -1.19 0.00 0.00 0.00 0.00 0.00 61.98 60.78 2ee2 s VAL 91 Cb -0.05 -1.66 0.02 0.00 0.00 0.00 0.00 36.38 34.70 2ee2 s VAL 91 CO 0.02 -0.29 -0.07 -0.83 0.00 0.00 0.00 175.10 173.92 2ee2 s GLY 92 N 1.51 0.75 0.13 4.51 0.00 -1.26 -3.99 107.32 108.97 2ee2 s GLY 92 Ca 0.00 -0.43 -0.31 0.00 0.00 0.00 0.00 44.72 43.98 2ee2 s GLY 92 CO -0.11 0.71 1.84 0.00 0.00 0.00 0.00 173.10 175.54 2ee2 s ALA 93 N 1.51 3.77 -0.16 3.20 0.00 -1.26 -4.03 121.76 124.79 2ee2 s ALA 93 Ca 0.00 1.47 -0.12 0.00 0.00 0.00 0.00 51.96 53.32 2ee2 s ALA 93 Cb -0.13 -3.77 0.05 0.00 0.00 0.00 0.00 23.12 19.27 2ee2 s ALA 93 CO -0.05 -1.23 0.41 0.00 0.00 0.00 0.00 175.76 174.89 2ee2 s ASN 95 N 0.82 4.67 0.32 0.00 4.22 -1.14 -4.03 114.94 119.79 2ee2 s ASN 95 Ca -0.05 -1.11 0.10 0.00 -2.14 0.00 0.00 52.86 49.67 2ee2 s ASN 95 Cb -0.06 0.00 0.53 0.00 1.28 0.00 0.00 41.25 43.01 2ee2 s ASN 95 CO -0.06 -0.87 1.72 -1.28 -2.04 0.00 0.00 177.10 174.57 2ee2 h SER 96 N 0.98 0.06 0.44 3.54 0.87 -1.95 -3.29 113.55 114.19 2ee2 h SER 96 Ca -0.39 -0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.12 2ee2 h SER 96 Cb 1.28 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 2ee2 h SER 96 CO 0.60 0.52 -0.21 0.00 -0.53 0.00 0.00 176.83 177.21 2ee2 h ALA 97 N 1.48 -0.91 -2.05 6.23 0.00 -1.95 -3.46 119.26 118.61 2ee2 h ALA 97 Ca -0.00 -0.13 -0.61 0.00 0.00 0.00 0.00 54.91 54.17 2ee2 h ALA 97 Cb 0.84 0.23 -0.14 0.00 0.00 0.00 0.00 17.79 18.73 2ee2 h ALA 97 CO 0.06 -0.86 -0.71 0.20 0.00 0.00 0.00 179.25 177.94 2ee2 s GLY 98 N -1.92 2.06 -0.33 0.00 0.00 -1.23 -4.91 107.32 101.00 2ee2 s GLY 98 Ca -0.09 -2.00 -0.12 0.00 0.00 0.00 0.00 44.72 42.52 2ee2 s GLY 98 CO 0.26 -2.00 0.21 0.00 0.00 0.00 0.00 173.10 171.57 2ee2 s GLY 100 N 1.68 2.29 0.46 0.00 0.00 -1.26 -4.92 107.32 105.59 2ee2 s GLY 100 Ca 0.06 0.09 -0.23 0.00 0.00 0.00 0.00 44.72 44.64 2ee2 s GLY 100 CO 0.09 0.31 1.16 2.56 0.00 0.00 0.00 173.10 177.23 2ee2 s PRO 101 N -3.15 3.73 0.54 2.90 0.04 -1.26 -4.85 135.00 132.95 2ee2 s PRO 101 Ca 0.56 1.76 -0.20 0.00 0.04 0.00 0.00 61.00 63.16 2ee2 s PRO 101 Cb -0.10 -2.38 -0.06 0.00 0.04 0.00 0.00 34.50 32.00 2ee2 s PRO 101 CO 0.18 -0.57 1.13 -1.25 0.04 0.00 0.00 177.00 176.54 2ee2 s PRO 102 N -2.73 3.39 0.63 0.56 0.04 -1.26 -4.59 135.00 131.03 2ee2 s PRO 102 Ca 0.64 1.62 -0.08 0.00 0.04 0.00 0.00 61.00 63.22 2ee2 s PRO 102 Cb -0.28 -2.03 0.14 0.00 0.04 0.00 0.00 34.50 32.36 2ee2 s PRO 102 CO 0.34 -0.82 0.85 -1.13 0.04 0.00 0.00 177.00 176.28 2ee2 n SER 103 N -1.24 0.31 -4.62 6.66 3.41 -1.26 -4.94 113.62 111.95 2ee2 n SER 103 Ca 0.11 -1.46 -0.49 0.00 -0.26 0.00 0.00 58.87 56.78 2ee2 n SER 103 Cb 0.51 -0.63 -0.05 0.00 -0.26 0.00 0.00 64.21 63.78 2ee2 n SER 103 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2ee2 n ASP 104 N -3.41 3.11 -4.56 4.04 8.00 -1.26 -4.82 116.55 117.66 2ee2 n ASP 104 Ca 0.11 0.75 -0.39 0.00 0.71 0.00 0.00 54.79 55.98 2ee2 n ASP 104 Cb 0.40 -1.36 -0.04 0.00 -0.02 0.00 0.00 41.12 40.10 2ee2 n ASP 104 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 2ee2 n MET 105 N 7.23 1.27 -3.81 -1.24 0.00 -1.26 -4.81 117.12 114.48 2ee2 n MET 105 Ca 0.28 0.17 -0.37 0.00 -0.00 0.00 0.00 57.70 57.78 2ee2 n MET 105 Cb 0.29 -3.24 -0.06 0.00 0.00 0.00 0.00 33.22 30.21 2ee2 n MET 105 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 2ee2 s ILE 106 N 10.66 5.43 0.08 1.12 1.01 -0.79 -4.99 121.20 133.72 2ee2 s ILE 106 Ca 1.01 0.31 0.06 0.00 0.00 0.00 0.00 60.65 62.03 2ee2 s ILE 106 Cb -0.31 -3.45 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 2ee2 s ILE 106 CO 0.31 0.61 -0.06 -1.83 0.00 0.00 0.00 174.94 173.97 2ee2 s GLU 107 N -0.98 2.35 0.11 2.79 1.03 -1.26 -0.06 118.70 122.67 2ee2 s GLU 107 Ca 0.16 -0.90 0.07 0.00 0.03 0.00 0.00 54.97 54.32 2ee2 s GLU 107 Cb -0.13 -2.42 -0.04 0.00 -0.80 0.00 0.00 34.13 30.75 2ee2 s GLU 107 CO 0.05 0.54 -0.16 0.00 -1.33 0.00 0.00 175.26 174.36 2ee2 s ALA 108 N -1.20 1.54 -0.29 -0.84 0.00 -0.30 -4.93 121.76 115.74 2ee2 s ALA 108 Ca 0.22 -1.23 0.01 0.00 0.00 0.00 0.00 51.96 50.96 2ee2 s ALA 108 Cb -0.11 -0.13 0.09 0.00 0.00 0.00 0.00 23.12 22.96 2ee2 s ALA 108 CO 0.14 0.20 0.04 -0.06 0.00 0.00 0.00 175.76 176.07 2ee2 s PHE 109 N -1.66 2.43 1.09 0.00 0.40 -1.26 -1.73 117.98 117.25 2ee2 s PHE 109 Ca 0.06 -2.04 -0.13 0.00 -0.60 0.00 0.00 56.93 54.22 2ee2 s PHE 109 Cb -0.08 -1.97 0.24 0.00 0.51 0.00 0.00 43.02 41.73 2ee2 s PHE 109 CO 0.04 -0.85 1.06 0.95 0.70 0.00 0.00 175.22 177.12 2ee2 s THR 110 N 1.37 1.98 0.60 0.64 -4.23 -1.23 -4.94 115.64 109.83 2ee2 s THR 110 Ca 0.05 0.00 -0.01 0.00 -1.18 0.00 0.00 61.69 60.55 2ee2 s THR 110 Cb -0.18 -2.32 0.04 0.00 1.34 0.00 0.00 72.50 71.38 2ee2 s THR 110 CO -0.14 0.00 0.85 -0.54 -0.54 0.00 0.00 174.62 174.25 2ee2 s LYS 111 N -4.78 2.41 -0.03 3.99 -0.14 -1.26 -3.54 119.74 116.39 2ee2 s LYS 111 Ca 0.67 -0.64 -0.27 0.00 -1.36 0.00 0.00 55.97 54.37 2ee2 s LYS 111 Cb -0.21 -2.39 -0.03 0.00 -1.68 0.00 0.00 37.83 33.52 2ee2 s LYS 111 CO 0.60 -0.89 0.87 0.15 -0.76 0.00 0.00 175.35 175.32 2ee2 s LYS 112 N -4.92 4.50 0.19 1.68 1.02 -1.26 0.75 119.74 121.70 2ee2 s LYS 112 Ca 0.58 1.20 -0.32 0.00 0.02 0.00 0.00 55.97 57.45 2ee2 s LYS 112 Cb -0.10 -3.46 -0.12 0.00 -0.52 0.00 0.00 37.83 33.63 2ee2 s LYS 112 CO 0.40 -0.02 1.75 0.00 -0.92 0.00 0.00 175.35 176.57 2ee2 n ALA 113 N 3.92 2.67 -2.53 5.17 0.00 -1.26 -4.93 120.51 123.54 2ee2 n ALA 113 Ca 0.03 0.38 -0.27 0.00 0.00 0.00 0.00 53.44 53.58 2ee2 n ALA 113 Cb 0.51 -2.54 -0.10 0.00 0.00 0.00 0.00 19.45 17.32 2ee2 n ALA 113 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2ee2 s SER 114 N 1.55 4.07 0.00 0.00 1.04 -1.26 -5.05 113.70 114.04 2ee2 s SER 114 Ca 0.77 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 56.59 2ee2 s SER 114 Cb -0.50 -0.62 0.00 0.00 0.10 0.00 0.00 66.02 65.00 2ee2 s SER 114 CO 0.33 0.12 0.00 0.61 0.98 0.00 0.00 173.24 175.29 2ee2 n GLY 115 N 0.25 0.78 0.26 7.32 0.00 -1.26 -4.82 105.19 107.71 2ee2 n GLY 115 Ca -0.12 -1.51 -0.12 0.00 0.00 0.00 0.00 46.02 44.27 2ee2 n GLY 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ee2 h PRO 116 N 0.00 0.84 -4.08 1.61 0.13 -2.07 -3.39 132.00 125.05 2ee2 h PRO 116 Ca 0.00 -0.44 -0.73 0.00 -0.87 0.00 0.00 66.00 63.96 2ee2 h PRO 116 Cb 0.00 0.02 -0.31 0.00 0.13 0.00 0.00 31.00 30.84 2ee2 h PRO 116 CO 0.00 1.08 -0.32 -1.54 -0.23 0.00 0.00 178.00 176.99 2ee2 s SER 117 N -6.85 5.73 0.25 1.44 1.04 -1.26 -5.07 113.70 108.99 2ee2 s SER 117 Ca -0.10 -2.25 0.08 0.00 0.48 0.00 0.00 55.95 54.17 2ee2 s SER 117 Cb 0.11 -2.00 -0.04 0.00 0.10 0.00 0.00 66.02 64.20 2ee2 s SER 117 CO 0.87 -0.60 0.07 -0.94 0.98 0.00 0.00 173.24 173.62 2ee2 s SER 118 N 2.11 4.91 0.00 7.02 1.04 -1.26 -5.14 113.70 122.39 2ee2 s SER 118 Ca 0.10 -0.49 0.22 0.00 0.48 0.00 0.00 55.95 56.27 2ee2 s SER 118 Cb -0.22 -1.06 0.18 0.00 0.10 0.00 0.00 66.02 65.01 2ee2 s SER 118 CO -0.03 -0.01 1.21 0.61 0.98 0.00 0.00 173.24 176.00