#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 0.06 0.40 1.61 0.15 -1.26 -5.18 113.70 109.48 2ee2 s SER 2 Ca 0.00 -1.14 0.08 0.00 0.70 0.00 0.00 55.95 55.58 2ee2 s SER 2 Cb 0.00 0.45 -0.04 0.00 -1.71 0.00 0.00 66.02 64.72 2ee2 s SER 2 CO 0.00 -0.95 0.23 -0.44 1.20 0.00 0.00 173.24 173.28 2ee2 s SER 3 N -3.08 4.66 -0.16 5.45 0.01 -1.26 -5.12 113.70 114.20 2ee2 s SER 3 Ca 0.29 -0.92 -0.11 0.00 1.31 0.00 0.00 55.95 56.52 2ee2 s SER 3 Cb 0.04 -0.56 -0.05 0.00 0.21 0.00 0.00 66.02 65.66 2ee2 s SER 3 CO 0.09 -0.52 0.21 -0.83 0.41 0.00 0.00 173.24 172.60 2ee2 s GLY 4 N -3.95 2.16 -0.17 3.44 0.00 -1.26 -5.08 107.32 102.46 2ee2 s GLY 4 Ca 0.42 -0.56 -0.14 0.00 0.00 0.00 0.00 44.72 44.44 2ee2 s GLY 4 CO 0.24 0.17 0.43 -0.45 0.00 0.00 0.00 173.10 173.50 2ee2 s SER 5 N 0.08 -0.47 -0.14 1.64 0.15 -1.26 -5.17 113.70 108.53 2ee2 s SER 5 Ca 0.14 0.89 -0.27 0.00 0.70 0.00 0.00 55.95 57.40 2ee2 s SER 5 Cb -0.12 0.88 0.07 0.00 -1.71 0.00 0.00 66.02 65.13 2ee2 s SER 5 CO 0.02 -0.16 0.67 -0.94 1.20 0.00 0.00 173.24 174.04 2ee2 s SER 6 N 0.45 -0.67 -1.01 5.45 1.04 -1.26 -5.07 113.70 112.63 2ee2 s SER 6 Ca -0.02 1.01 -0.20 0.00 0.48 0.00 0.00 55.95 57.21 2ee2 s SER 6 Cb -0.04 0.93 -0.09 0.00 0.10 0.00 0.00 66.02 66.92 2ee2 s SER 6 CO -0.02 -0.44 1.97 0.61 0.98 0.00 0.00 173.24 176.34 2ee2 n GLY 7 N 1.73 2.64 0.30 7.32 0.00 -1.26 -4.75 105.19 111.18 2ee2 n GLY 7 Ca -0.17 -1.24 0.28 0.00 0.00 0.00 0.00 46.02 44.89 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 6.18 -0.39 -1.51 1.61 3.14 -1.26 -4.29 118.33 121.81 2ee2 n VAL 8 Ca 0.49 1.92 -0.36 0.00 -2.96 0.00 0.00 64.34 63.43 2ee2 n VAL 8 Cb 0.42 -3.08 -0.13 0.00 -1.06 0.00 0.00 33.84 29.99 2ee2 n VAL 8 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2ee2 n ALA 9 N -2.40 0.51 -1.76 1.55 0.00 -1.26 -4.86 120.51 112.28 2ee2 n ALA 9 Ca 0.34 -0.55 -0.39 0.00 0.00 0.00 0.00 53.44 52.84 2ee2 n ALA 9 Cb 1.15 -2.54 -0.06 0.00 0.00 0.00 0.00 19.45 18.01 2ee2 n ALA 9 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2ee2 s VAL 10 N 8.77 3.97 -0.23 0.00 -7.23 -1.26 -5.04 120.40 119.38 2ee2 s VAL 10 Ca 1.25 1.84 -0.08 0.00 -1.81 0.00 0.00 61.98 63.19 2ee2 s VAL 10 Cb -0.92 -4.11 -0.03 0.00 0.56 0.00 0.00 36.38 31.87 2ee2 s VAL 10 CO 0.43 0.33 0.08 -0.63 -0.31 0.00 0.00 175.10 175.00 2ee2 s ILE 11 N -1.34 4.55 -0.23 -0.62 1.01 -1.26 -5.08 121.20 118.23 2ee2 s ILE 11 Ca 0.46 -0.10 -0.04 0.00 0.00 0.00 0.00 60.65 60.97 2ee2 s ILE 11 Cb -0.25 -3.10 -0.00 0.00 0.01 0.00 0.00 42.46 39.12 2ee2 s ILE 11 CO 0.31 0.37 -0.04 0.20 0.00 0.00 0.00 174.94 175.78 2ee2 s ASN 12 N 1.20 4.33 -0.90 3.58 -0.87 -1.26 -5.06 114.94 115.97 2ee2 s ASN 12 Ca 0.05 -0.49 -0.15 0.00 -1.57 0.00 0.00 52.86 50.69 2ee2 s ASN 12 Cb -0.14 -1.73 0.19 0.00 -0.02 0.00 0.00 41.25 39.54 2ee2 s ASN 12 CO 0.04 -0.05 0.95 -0.55 -2.57 0.00 0.00 177.10 174.92 2ee2 s SER 13 N 1.45 6.76 -0.17 -1.22 0.15 -1.26 -4.96 113.70 114.45 2ee2 s SER 13 Ca 0.05 -2.52 -0.30 0.00 0.70 0.00 0.00 55.95 53.88 2ee2 s SER 13 Cb -0.15 -2.29 0.14 0.00 -1.71 0.00 0.00 66.02 62.01 2ee2 s SER 13 CO -0.03 -0.74 1.06 0.00 1.20 0.00 0.00 173.24 174.72 2ee2 s ALA 14 N 1.07 -1.96 -0.15 5.45 0.00 -1.26 -5.05 121.76 119.86 2ee2 s ALA 14 Ca 0.25 1.60 -0.21 0.00 0.00 0.00 0.00 51.96 53.60 2ee2 s ALA 14 Cb -0.08 -0.74 -0.24 0.00 0.00 0.00 0.00 23.12 22.06 2ee2 s ALA 14 CO -0.09 -0.34 0.50 -0.56 0.00 0.00 0.00 175.76 175.28 2ee2 h GLN 15 N 2.41 0.10 -2.78 0.00 3.07 -1.92 -3.50 115.11 112.49 2ee2 h GLN 15 Ca -0.16 -0.16 0.07 0.00 0.09 0.00 0.00 58.65 58.48 2ee2 h GLN 15 Cb 1.17 0.06 -0.02 0.00 0.08 0.00 0.00 27.48 28.77 2ee2 h GLN 15 CO 0.29 1.08 0.39 -0.51 0.09 0.00 0.00 178.83 180.17 2ee2 s ASP 16 N -6.75 -0.04 -0.16 0.06 1.01 -1.26 -5.12 116.67 104.41 2ee2 s ASP 16 Ca -0.23 -0.86 -0.12 0.00 0.71 0.00 0.00 52.55 52.06 2ee2 s ASP 16 Cb 0.03 0.69 0.05 0.00 1.01 0.00 0.00 42.92 44.69 2ee2 s ASP 16 CO 0.69 -1.35 0.40 0.00 0.21 0.00 0.00 175.17 175.12 2ee2 s ALA 17 N -2.55 -1.00 0.21 5.23 0.00 -1.26 -2.52 121.76 119.87 2ee2 s ALA 17 Ca 0.17 1.26 -0.30 0.00 0.00 0.00 0.00 51.96 53.08 2ee2 s ALA 17 Cb -0.04 -0.74 -0.09 0.00 0.00 0.00 0.00 23.12 22.25 2ee2 s ALA 17 CO 0.08 -0.21 1.30 -1.25 0.00 0.00 0.00 175.76 175.67 2ee2 s PRO 18 N 0.63 4.40 0.00 0.00 0.04 -1.26 -4.92 135.00 133.88 2ee2 s PRO 18 Ca -0.03 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.05 2ee2 s PRO 18 Cb -0.05 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.30 2ee2 s PRO 18 CO -0.04 -0.23 0.00 0.45 0.04 0.00 0.00 177.00 177.22 2ee2 n SER 19 N 2.50 4.84 -4.83 6.66 2.88 -1.26 -4.28 113.62 120.13 2ee2 n SER 19 Ca 0.06 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.22 2ee2 n SER 19 Cb 0.43 0.85 -0.06 0.00 -0.75 0.00 0.00 64.21 64.68 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 -1.94 3.89 0.07 -1.46 2.12 -1.26 -4.90 118.70 115.21 2ee2 s GLU 20 Ca 0.00 0.30 0.03 0.00 0.36 0.00 0.00 54.97 55.67 2ee2 s GLU 20 Cb 0.00 -3.24 -0.04 0.00 0.26 0.00 0.00 34.13 31.11 2ee2 s GLU 20 CO 0.00 0.64 0.03 0.00 -0.54 0.00 0.00 175.26 175.39 2ee2 s ALA 21 N -0.85 3.40 -0.24 6.30 0.00 -1.26 -4.85 121.76 124.25 2ee2 s ALA 21 Ca 0.22 -1.04 -0.29 0.00 0.00 0.00 0.00 51.96 50.85 2ee2 s ALA 21 Cb -0.16 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.62 2ee2 s ALA 21 CO 0.11 0.71 1.62 -1.25 0.00 0.00 0.00 175.76 176.95 2ee2 s PRO 22 N -2.17 3.73 0.54 0.00 0.04 -1.26 -4.96 135.00 130.91 2ee2 s PRO 22 Ca 0.26 1.59 0.03 0.00 0.04 0.00 0.00 61.00 62.92 2ee2 s PRO 22 Cb -0.12 -4.05 0.04 0.00 0.04 0.00 0.00 34.50 30.41 2ee2 s PRO 22 CO 0.18 -1.37 0.75 0.99 0.04 0.00 0.00 177.00 177.59 2ee2 s THR 23 N 5.40 2.66 -1.54 1.26 2.01 -1.26 -4.44 115.64 119.73 2ee2 s THR 23 Ca 0.72 -0.75 -0.03 0.00 0.31 0.00 0.00 61.69 61.94 2ee2 s THR 23 Cb -0.24 -2.92 0.00 0.00 0.01 0.00 0.00 72.50 69.36 2ee2 s THR 23 CO 0.30 0.00 0.43 -0.62 -0.69 0.00 0.00 174.62 174.04 2ee2 n GLU 24 N -2.28 -3.90 -3.14 4.92 1.02 -1.26 -3.30 120.64 112.70 2ee2 n GLU 24 Ca 0.09 0.90 -0.39 0.00 -0.02 0.00 0.00 57.16 57.73 2ee2 n GLU 24 Cb 0.60 -5.62 -0.06 0.00 -0.02 0.00 0.00 31.44 26.34 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 -3.11 5.06 0.35 2.62 0.11 -1.26 -4.44 120.40 119.72 2ee2 s VAL 25 Ca 0.22 1.21 0.03 0.00 -2.93 0.00 0.00 61.98 60.50 2ee2 s VAL 25 Cb -0.10 -3.94 -0.01 0.00 -1.53 0.00 0.00 36.38 30.80 2ee2 s VAL 25 CO 0.27 0.19 0.10 0.61 -3.33 0.00 0.00 175.10 172.94 2ee2 n GLY 26 N 3.49 3.43 2.99 6.54 0.00 0.12 -5.00 105.19 116.76 2ee2 n GLY 26 Ca -0.02 -2.12 -0.14 0.00 0.00 0.00 0.00 46.02 43.74 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 -2.77 -0.18 -0.17 1.61 -7.23 -1.26 -2.49 120.40 107.91 2ee2 s VAL 27 Ca 0.15 0.22 -0.02 0.00 -1.81 0.00 0.00 61.98 60.53 2ee2 s VAL 27 Cb 0.01 -0.37 -0.01 0.00 0.56 0.00 0.00 36.38 36.57 2ee2 s VAL 27 CO 0.10 0.09 -0.10 -0.75 -0.31 0.00 0.00 175.10 174.14 2ee2 s LYS 28 N 1.74 3.36 -0.20 4.82 2.36 0.90 -4.98 119.74 127.73 2ee2 s LYS 28 Ca -0.04 -0.67 -0.23 0.00 -2.55 0.00 0.00 55.97 52.47 2ee2 s LYS 28 Cb -0.11 -2.77 -0.02 0.00 -1.05 0.00 0.00 37.83 33.88 2ee2 s LYS 28 CO -0.08 0.03 0.75 0.08 1.55 0.00 0.00 175.35 177.69 2ee2 s VAL 29 N 0.84 4.92 -0.20 4.02 1.01 -1.26 -0.14 120.40 129.58 2ee2 s VAL 29 Ca -0.03 1.44 -0.15 0.00 0.00 0.00 0.00 61.98 63.24 2ee2 s VAL 29 Cb -0.15 -4.06 -0.20 0.00 0.00 0.00 0.00 36.38 31.98 2ee2 s VAL 29 CO 0.01 0.03 0.13 0.18 0.00 0.00 0.00 175.10 175.45 2ee2 n LEU 30 N 5.37 2.17 0.00 3.92 4.77 -0.93 -4.96 117.00 127.33 2ee2 n LEU 30 Ca 0.02 0.31 -0.11 0.00 -0.03 0.00 0.00 56.01 56.20 2ee2 n LEU 30 Cb 0.49 -0.98 -0.02 0.00 -2.33 0.00 0.00 43.42 40.58 2ee2 n LEU 30 CO 0.46 0.53 0.19 -0.24 -1.33 0.00 0.00 177.39 177.00 2ee2 n SER 31 N -4.06 -1.27 -0.15 -1.43 2.88 -0.43 -4.94 113.62 104.22 2ee2 n SER 31 Ca -0.37 -2.54 0.02 0.00 -1.33 0.00 0.00 58.87 54.65 2ee2 n SER 31 Cb 0.84 2.31 0.31 0.00 -0.75 0.00 0.00 64.21 66.91 2ee2 n SER 31 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2ee2 h SER 32 N 1.65 0.73 -0.12 -3.46 0.87 -1.91 -2.54 113.55 108.77 2ee2 h SER 32 Ca -0.24 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.31 2ee2 h SER 32 Cb 1.00 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 2ee2 h SER 32 CO 0.32 0.52 0.00 -0.24 -0.53 0.00 0.00 176.83 176.90 2ee2 n SER 33 N -4.44 2.70 -4.11 6.23 2.88 -1.24 -3.94 113.62 111.69 2ee2 n SER 33 Ca 0.07 -2.56 -0.24 0.00 -1.33 0.00 0.00 58.87 54.81 2ee2 n SER 33 Cb 0.06 -0.30 -0.15 0.00 -0.75 0.00 0.00 64.21 63.07 2ee2 n SER 33 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2ee2 s GLU 34 N -1.99 1.35 -0.04 -1.46 0.41 -0.96 -3.21 118.70 112.80 2ee2 s GLU 34 Ca 0.24 -0.52 -0.25 0.00 -0.41 0.00 0.00 54.97 54.02 2ee2 s GLU 34 Cb 0.18 -1.25 0.05 0.00 -1.78 0.00 0.00 34.13 31.34 2ee2 s GLU 34 CO 0.06 0.27 0.55 0.42 -0.49 0.00 0.00 175.26 176.06 2ee2 s ILE 35 N -0.15 0.02 -0.03 -1.63 1.01 -1.10 -1.31 121.20 118.01 2ee2 s ILE 35 Ca 0.02 -0.17 0.05 0.00 0.00 0.00 0.00 60.65 60.54 2ee2 s ILE 35 Cb -0.08 -0.86 -0.01 0.00 0.01 0.00 0.00 42.46 41.53 2ee2 s ILE 35 CO 0.00 -0.09 -0.17 -0.44 0.00 0.00 0.00 174.94 174.24 2ee2 s SER 36 N -1.21 2.10 -0.23 3.58 0.01 0.80 0.10 113.70 118.84 2ee2 s SER 36 Ca -0.12 -0.34 0.02 0.00 1.31 0.00 0.00 55.95 56.83 2ee2 s SER 36 Cb -0.02 -0.45 0.05 0.00 0.21 0.00 0.00 66.02 65.81 2ee2 s SER 36 CO 0.08 0.17 -0.12 -0.69 0.41 0.00 0.00 173.24 173.10 2ee2 s VAL 37 N -0.13 1.97 -0.11 3.43 1.01 0.56 -0.07 120.40 127.06 2ee2 s VAL 37 Ca 0.00 -1.36 -0.02 0.00 0.00 0.00 0.00 61.98 60.61 2ee2 s VAL 37 Cb -0.10 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 2ee2 s VAL 37 CO 0.01 0.09 -0.03 -1.00 0.00 0.00 0.00 175.10 174.17 2ee2 s HIS 38 N 1.23 3.06 0.30 5.22 3.76 -1.04 -0.07 115.29 127.75 2ee2 s HIS 38 Ca -0.05 -0.01 0.06 0.00 -0.15 0.00 0.00 55.06 54.91 2ee2 s HIS 38 Cb -0.18 -1.83 -0.02 0.00 1.11 0.00 0.00 32.58 31.66 2ee2 s HIS 38 CO -0.07 0.26 0.22 -2.67 -0.85 0.00 0.00 174.74 171.63 2ee2 n TRP 39 N 2.65 -0.55 -4.35 1.40 2.14 -0.75 -0.70 117.44 117.27 2ee2 n TRP 39 Ca -0.18 -2.39 -0.34 0.00 2.07 0.00 0.00 57.50 56.66 2ee2 n TRP 39 Cb 0.53 0.21 -0.11 0.00 -0.81 0.00 0.00 31.31 31.12 2ee2 n TRP 39 CO 0.00 0.00 0.00 -2.00 2.07 0.00 0.00 177.69 177.76 2ee2 s GLU 40 N -3.20 3.57 0.30 -2.67 2.12 -1.21 -4.80 118.70 112.81 2ee2 s GLU 40 Ca 0.32 -0.48 -0.29 0.00 0.36 0.00 0.00 54.97 54.87 2ee2 s GLU 40 Cb 0.02 -2.92 -0.11 0.00 0.26 0.00 0.00 34.13 31.37 2ee2 s GLU 40 CO 0.22 0.34 1.51 -1.01 -0.54 0.00 0.00 175.26 175.79 2ee2 s HIS 41 N 0.11 2.80 0.73 5.30 3.76 -1.26 -4.44 115.29 122.29 2ee2 s HIS 41 Ca 0.00 0.97 -0.08 0.00 -0.15 0.00 0.00 55.06 55.80 2ee2 s HIS 41 Cb -0.13 -3.97 0.06 0.00 1.11 0.00 0.00 32.58 29.65 2ee2 s HIS 41 CO 0.02 -3.11 1.05 0.14 -0.85 0.00 0.00 174.74 172.00 2ee2 s VAL 42 N -0.33 2.33 -1.05 -0.90 -7.23 -1.26 -4.97 120.40 106.99 2ee2 s VAL 42 Ca 0.59 -0.15 0.29 0.00 -1.81 0.00 0.00 61.98 60.90 2ee2 s VAL 42 Cb -0.45 -3.05 0.27 0.00 0.56 0.00 0.00 36.38 33.71 2ee2 s VAL 42 CO 0.50 -0.05 1.94 0.00 -0.31 0.00 0.00 175.10 177.19 2ee2 n LEU 43 N -3.01 0.00 -4.57 1.32 -0.00 -1.26 -4.70 117.00 104.78 2ee2 n LEU 43 Ca 0.08 0.47 -0.43 0.00 -0.00 0.00 0.00 56.01 56.13 2ee2 n LEU 43 Cb 0.60 -0.47 -0.03 0.00 -0.00 0.00 0.00 43.42 43.52 2ee2 n LEU 43 CO 0.54 0.00 0.89 -1.61 -0.00 0.00 0.00 177.39 177.21 2ee2 s GLU 44 N -2.95 3.54 0.21 1.47 8.01 -1.26 -4.87 118.70 122.85 2ee2 s GLU 44 Ca 0.16 0.20 0.26 0.00 0.01 0.00 0.00 54.97 55.59 2ee2 s GLU 44 Cb 0.19 -3.97 0.74 0.00 -4.31 0.00 0.00 34.13 26.79 2ee2 s GLU 44 CO 0.52 -1.42 1.73 -0.22 0.01 0.00 0.00 175.26 175.88 2ee2 h LYS 45 N 9.27 0.00 0.00 1.61 3.11 -2.04 -3.14 116.57 125.38 2ee2 h LYS 45 Ca -0.24 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.60 2ee2 h LYS 45 Cb 1.07 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.30 2ee2 h LYS 45 CO 1.10 0.00 0.00 -0.84 -2.81 0.00 0.00 179.45 176.90 2ee2 h ILE 46 N 0.00 0.00 -1.60 2.00 -0.00 -1.99 -3.45 117.51 112.48 2ee2 h ILE 46 Ca 0.00 -0.49 -0.65 0.00 -0.00 0.00 0.00 64.86 63.72 2ee2 h ILE 46 Cb 0.75 1.41 0.00 0.00 -0.00 0.00 0.00 36.82 38.99 2ee2 h ILE 46 CO 0.00 0.00 1.23 1.33 -0.00 0.00 0.00 178.15 180.71 2ee2 n VAL 47 N -2.49 0.37 0.01 0.16 0.24 -1.19 -4.80 118.33 110.62 2ee2 n VAL 47 Ca 0.04 -0.19 -0.09 0.00 -2.04 0.00 0.00 64.34 62.05 2ee2 n VAL 47 Cb 0.37 -1.77 -0.03 0.00 -1.47 0.00 0.00 33.84 30.94 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 10.75 -0.18 -2.52 7.34 4.39 -1.87 -3.46 114.58 129.03 2ee2 h GLU 48 Ca -0.39 0.01 0.18 0.00 0.34 0.00 0.00 59.36 59.50 2ee2 h GLU 48 Cb 1.29 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.95 2ee2 h GLU 48 CO 0.98 -0.12 0.63 -1.54 -1.16 0.00 0.00 179.01 177.80 2ee2 s SER 49 N -5.06 0.02 -0.38 1.42 1.04 -1.26 -4.14 113.70 105.34 2ee2 s SER 49 Ca -0.14 -0.64 -0.04 0.00 0.48 0.00 0.00 55.95 55.60 2ee2 s SER 49 Cb 0.10 0.46 0.08 0.00 0.10 0.00 0.00 66.02 66.77 2ee2 s SER 49 CO 0.67 -0.92 0.16 -0.31 0.98 0.00 0.00 173.24 173.82 2ee2 s TYR 50 N -2.08 3.43 0.33 5.02 2.02 -1.18 -3.15 117.35 121.75 2ee2 s TYR 50 Ca 0.24 -2.02 -0.26 0.00 -0.37 0.00 0.00 57.07 54.66 2ee2 s TYR 50 Cb -0.03 -2.84 -0.10 0.00 -0.40 0.00 0.00 41.96 38.60 2ee2 s TYR 50 CO 0.05 -0.89 0.94 1.14 -1.57 0.00 0.00 175.55 175.22 2ee2 s GLN 51 N 1.25 4.56 -0.50 -0.62 0.00 -1.25 -3.63 119.66 119.46 2ee2 s GLN 51 Ca 0.03 1.31 0.04 0.00 -0.00 0.00 0.00 55.36 56.73 2ee2 s GLN 51 Cb -0.22 -2.77 0.13 0.00 0.00 0.00 0.00 33.01 30.16 2ee2 s GLN 51 CO -0.02 0.27 0.26 0.42 0.00 0.00 0.00 175.29 176.22 2ee2 s ILE 52 N -1.65 2.26 -0.03 3.63 1.09 0.21 -2.94 121.20 123.77 2ee2 s ILE 52 Ca 0.51 -3.15 -0.30 0.00 -1.10 0.00 0.00 60.65 56.61 2ee2 s ILE 52 Cb -0.18 -2.57 -0.04 0.00 -1.06 0.00 0.00 42.46 38.62 2ee2 s ILE 52 CO 0.23 -0.84 1.20 -0.60 -0.10 0.00 0.00 174.94 174.84 2ee2 s ARG 53 N -0.16 4.37 -0.02 2.79 3.52 -0.60 -2.91 118.95 125.95 2ee2 s ARG 53 Ca 0.18 1.69 -0.01 0.00 -0.13 0.00 0.00 55.73 57.46 2ee2 s ARG 53 Cb -0.24 -3.52 0.01 0.00 -1.56 0.00 0.00 34.95 29.64 2ee2 s ARG 53 CO -0.01 -0.41 0.04 1.52 -0.81 0.00 0.00 175.30 175.63 2ee2 s TYR 54 N 1.99 -0.03 -0.10 5.12 1.13 -1.24 -1.38 117.35 122.83 2ee2 s TYR 54 Ca 0.57 0.12 -0.24 0.00 -1.41 0.00 0.00 57.07 56.10 2ee2 s TYR 54 Cb -0.26 -0.04 0.06 0.00 -1.10 0.00 0.00 41.96 40.62 2ee2 s TYR 54 CO 0.24 -0.04 0.58 1.67 -2.51 0.00 0.00 175.55 175.48 2ee2 s TRP 55 N 0.29 -0.56 0.54 -3.49 -2.14 -1.24 -3.34 118.94 109.00 2ee2 s TRP 55 Ca -0.02 1.12 -0.22 0.00 2.66 0.00 0.00 56.10 59.64 2ee2 s TRP 55 Cb -0.03 0.28 -0.05 0.00 -3.10 0.00 0.00 33.47 30.57 2ee2 s TRP 55 CO -0.01 -0.46 1.35 0.00 -2.66 0.00 0.00 176.95 175.16 2ee2 s ALA 56 N -0.70 2.82 0.28 2.67 0.00 -1.26 -2.50 121.76 123.06 2ee2 s ALA 56 Ca -0.08 1.31 0.02 0.00 0.00 0.00 0.00 51.96 53.21 2ee2 s ALA 56 Cb -0.03 -3.56 0.62 0.00 0.00 0.00 0.00 23.12 20.15 2ee2 s ALA 56 CO 0.06 -1.34 1.76 0.00 0.00 0.00 0.00 175.76 176.23 2ee2 h ALA 57 N 1.47 1.42 -0.51 0.00 0.00 -1.62 -0.46 119.26 119.56 2ee2 h ALA 57 Ca -0.51 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.40 2ee2 h ALA 57 Cb 1.30 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 2ee2 h ALA 57 CO 0.57 -0.09 -0.05 1.12 0.00 0.00 0.00 179.25 180.80 2ee2 h HIS 58 N 0.65 1.03 -2.15 0.00 -0.00 -1.90 -3.45 115.15 109.34 2ee2 h HIS 58 Ca 0.51 -0.20 -0.34 0.00 -0.00 0.00 0.00 60.37 60.35 2ee2 h HIS 58 Cb 0.77 -0.26 0.18 0.00 -0.00 0.00 0.00 27.41 28.10 2ee2 h HIS 58 CO -0.07 0.97 -0.66 -0.25 -0.00 0.00 0.00 177.93 177.92 2ee2 n ASP 59 N -4.25 -2.83 -4.91 3.10 8.00 -0.18 -5.02 116.55 110.45 2ee2 n ASP 59 Ca 0.01 -0.31 -0.21 0.00 0.71 0.00 0.00 54.79 54.99 2ee2 n ASP 59 Cb 0.36 -0.86 -0.02 0.00 -0.02 0.00 0.00 41.12 40.58 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 -3.56 2.51 -0.01 -1.24 1.02 -1.26 -4.91 119.74 112.29 2ee2 s LYS 60 Ca 0.47 -1.57 0.04 0.00 0.02 0.00 0.00 55.97 54.93 2ee2 s LYS 60 Cb -0.08 -2.41 0.14 0.00 -0.52 0.00 0.00 37.83 34.95 2ee2 s LYS 60 CO 0.50 -0.31 0.99 0.39 -0.92 0.00 0.00 175.35 175.99 2ee2 n GLU 61 N -1.67 1.46 -0.03 1.68 1.02 -1.26 -3.40 120.64 118.44 2ee2 n GLU 61 Ca 0.04 -0.54 -0.04 0.00 -0.02 0.00 0.00 57.16 56.61 2ee2 n GLU 61 Cb 0.62 -1.28 -0.05 0.00 -0.02 0.00 0.00 31.44 30.70 2ee2 n GLU 61 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2ee2 n GLU 62 N -0.02 2.74 -0.55 3.49 -0.00 -1.26 -4.55 120.64 120.49 2ee2 n GLU 62 Ca 0.05 -0.00 0.06 0.00 -0.00 0.00 0.00 57.16 57.27 2ee2 n GLU 62 Cb 0.22 -1.18 0.28 0.00 -0.00 0.00 0.00 31.44 30.76 2ee2 n GLU 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2ee2 n ALA 63 N -2.28 3.21 -2.32 -1.84 0.00 -1.22 -4.93 120.51 111.13 2ee2 n ALA 63 Ca -0.12 -1.27 -0.41 0.00 0.00 0.00 0.00 53.44 51.64 2ee2 n ALA 63 Cb 0.72 -1.06 -0.04 0.00 0.00 0.00 0.00 19.45 19.08 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 -2.01 3.31 0.99 0.00 0.00 -1.25 -4.93 121.76 117.87 2ee2 s ALA 64 Ca 0.39 0.73 -0.13 0.00 0.00 0.00 0.00 51.96 52.95 2ee2 s ALA 64 Cb 0.27 -3.36 0.18 0.00 0.00 0.00 0.00 23.12 20.21 2ee2 s ALA 64 CO 0.15 -0.24 1.06 0.09 0.00 0.00 0.00 175.76 176.82 2ee2 n ASN 65 N 3.17 0.12 -3.47 0.00 3.02 -1.21 -4.94 115.26 111.94 2ee2 n ASN 65 Ca 0.05 -1.41 -0.05 0.00 -0.03 0.00 0.00 54.58 53.15 2ee2 n ASN 65 Cb 0.48 -0.81 -0.06 0.00 -0.61 0.00 0.00 39.78 38.78 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 -5.31 0.43 -0.37 3.52 0.52 -1.26 -3.64 118.95 112.84 2ee2 s ARG 66 Ca 0.60 0.98 -0.15 0.00 -0.52 0.00 0.00 55.73 56.65 2ee2 s ARG 66 Cb -0.02 0.27 0.00 0.00 0.52 0.00 0.00 34.95 35.72 2ee2 s ARG 66 CO 0.42 -0.42 0.31 0.08 0.02 0.00 0.00 175.30 175.71 2ee2 s VAL 67 N 2.70 5.23 -0.24 3.52 1.01 -1.14 -4.86 120.40 126.61 2ee2 s VAL 67 Ca 0.06 -0.32 -0.10 0.00 0.00 0.00 0.00 61.98 61.62 2ee2 s VAL 67 Cb -0.14 -3.85 -0.05 0.00 0.00 0.00 0.00 36.38 32.35 2ee2 s VAL 67 CO -0.16 -0.18 0.14 -1.58 0.00 0.00 0.00 175.10 173.32 2ee2 s GLN 68 N 1.82 3.96 0.14 2.72 -0.44 -1.26 -0.62 119.66 125.98 2ee2 s GLN 68 Ca 0.08 -0.33 0.07 0.00 -2.50 0.00 0.00 55.36 52.68 2ee2 s GLN 68 Cb -0.18 -3.50 -0.04 0.00 -1.64 0.00 0.00 33.01 27.66 2ee2 s GLN 68 CO 0.11 -0.02 -0.15 0.14 0.50 0.00 0.00 175.29 175.87 2ee2 s VAL 69 N 1.25 1.48 0.19 1.34 -7.23 -1.24 -5.01 120.40 111.18 2ee2 s VAL 69 Ca 0.07 -1.82 -0.31 0.00 -1.81 0.00 0.00 61.98 58.11 2ee2 s VAL 69 Cb -0.14 -1.66 -0.16 0.00 0.56 0.00 0.00 36.38 34.97 2ee2 s VAL 69 CO 0.06 -0.41 0.92 1.07 -0.31 0.00 0.00 175.10 176.42 2ee2 n THR 70 N 0.38 1.37 -0.23 5.32 5.66 -1.26 -3.10 114.28 122.42 2ee2 n THR 70 Ca -0.14 -0.34 0.17 0.00 -3.05 0.00 0.00 64.05 60.69 2ee2 n THR 70 Cb 0.57 -0.51 0.49 0.00 -1.55 0.00 0.00 70.33 69.33 2ee2 n THR 70 CO 0.00 0.00 0.00 -1.28 -3.05 0.00 0.00 175.07 170.74 2ee2 h SER 71 N 2.28 0.45 -0.75 1.09 0.87 -1.89 -0.27 113.55 115.33 2ee2 h SER 71 Ca -0.39 0.04 0.09 0.00 -1.23 0.00 0.00 61.79 60.30 2ee2 h SER 71 Cb 1.38 -0.04 -0.07 0.00 -0.44 0.00 0.00 62.40 63.23 2ee2 h SER 71 CO 0.63 0.19 0.40 1.56 -0.53 0.00 0.00 176.83 179.08 2ee2 h GLN 72 N 0.45 0.66 -6.08 2.24 4.20 -1.93 -3.41 115.11 111.24 2ee2 h GLN 72 Ca 0.45 -0.04 -0.64 0.00 0.06 0.00 0.00 58.65 58.49 2ee2 h GLN 72 Cb 1.05 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.68 2ee2 h GLN 72 CO -0.18 0.43 1.33 0.39 -0.67 0.00 0.00 178.83 180.14 2ee2 n GLU 73 N -4.81 1.64 0.06 1.46 -0.58 -0.11 -4.81 120.64 113.48 2ee2 n GLU 73 Ca 0.12 0.51 0.13 0.00 -0.42 0.00 0.00 57.16 57.50 2ee2 n GLU 73 Cb 0.27 -2.71 0.49 0.00 -0.57 0.00 0.00 31.44 28.92 2ee2 n GLU 73 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2ee2 n TYR 74 N 9.25 0.51 -3.94 -0.32 4.02 -1.26 -4.87 117.16 120.55 2ee2 n TYR 74 Ca 0.32 0.15 -0.10 0.00 -0.01 0.00 0.00 57.90 58.27 2ee2 n TYR 74 Cb 0.30 -0.75 -0.07 0.00 -0.02 0.00 0.00 39.34 38.81 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 -3.83 0.00 0.28 7.72 1.04 -1.26 -1.82 113.70 115.84 2ee2 s SER 75 Ca 0.11 -0.84 0.02 0.00 0.48 0.00 0.00 55.95 55.72 2ee2 s SER 75 Cb 0.15 0.46 -0.04 0.00 0.10 0.00 0.00 66.02 66.68 2ee2 s SER 75 CO 0.54 -0.92 0.13 0.00 0.98 0.00 0.00 173.24 173.96 2ee2 s ALA 76 N -3.96 1.88 0.07 5.32 0.00 0.91 -4.95 121.76 121.02 2ee2 s ALA 76 Ca 0.17 -1.79 0.04 0.00 0.00 0.00 0.00 51.96 50.38 2ee2 s ALA 76 Cb 0.03 1.08 -0.03 0.00 0.00 0.00 0.00 23.12 24.20 2ee2 s ALA 76 CO 0.01 -0.48 -0.12 0.50 0.00 0.00 0.00 175.76 175.67 2ee2 s ARG 77 N -3.92 0.75 0.08 0.00 3.52 -1.26 -0.32 118.95 117.79 2ee2 s ARG 77 Ca 0.36 -0.92 0.10 0.00 -0.13 0.00 0.00 55.73 55.14 2ee2 s ARG 77 Cb 0.06 -0.67 -0.03 0.00 -1.56 0.00 0.00 34.95 32.75 2ee2 s ARG 77 CO 0.15 0.14 -0.25 -0.51 -0.81 0.00 0.00 175.30 174.02 2ee2 s LEU 78 N -1.76 2.31 0.16 -0.88 1.43 0.11 -4.97 118.68 115.09 2ee2 s LEU 78 Ca -0.03 -0.63 -0.00 0.00 -1.03 0.00 0.00 54.13 52.43 2ee2 s LEU 78 Cb -0.09 -1.30 -0.04 0.00 0.03 0.00 0.00 46.19 44.78 2ee2 s LEU 78 CO 0.02 0.22 0.06 -1.61 0.23 0.00 0.00 176.35 175.27 2ee2 s GLU 79 N -1.63 1.06 -1.11 1.70 2.02 -1.26 -2.70 118.70 116.79 2ee2 s GLU 79 Ca 0.13 -1.52 -0.02 0.00 0.02 0.00 0.00 54.97 53.58 2ee2 s GLU 79 Cb -0.10 0.06 -0.02 0.00 0.10 0.00 0.00 34.13 34.17 2ee2 s GLU 79 CO 0.04 -0.25 0.94 0.09 0.02 0.00 0.00 175.26 176.10 2ee2 n ASN 80 N -0.19 -3.56 -4.42 -0.19 3.02 -1.20 -5.00 115.26 103.73 2ee2 n ASN 80 Ca -0.04 -0.63 -0.30 0.00 -0.03 0.00 0.00 54.58 53.58 2ee2 n ASN 80 Cb 0.64 -4.98 -0.13 0.00 -0.61 0.00 0.00 39.78 34.70 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 -5.89 2.45 0.43 3.41 1.43 -1.26 -5.07 118.68 114.19 2ee2 s LEU 81 Ca 0.15 -0.52 -0.22 0.00 -1.03 0.00 0.00 54.13 52.51 2ee2 s LEU 81 Cb -0.02 -1.42 -0.09 0.00 0.03 0.00 0.00 46.19 44.69 2ee2 s LEU 81 CO 0.71 0.24 1.01 -0.76 0.23 0.00 0.00 176.35 177.77 2ee2 s LEU 82 N -1.51 4.01 0.56 1.79 1.43 -1.26 -3.66 118.68 120.04 2ee2 s LEU 82 Ca 0.14 1.88 -0.19 0.00 -1.03 0.00 0.00 54.13 54.94 2ee2 s LEU 82 Cb -0.10 -4.38 -0.05 0.00 0.03 0.00 0.00 46.19 41.68 2ee2 s LEU 82 CO 0.05 -0.50 1.13 -2.16 0.23 0.00 0.00 176.35 175.09 2ee2 s PRO 83 N -2.87 3.26 -1.39 1.29 0.04 -1.25 -3.70 135.00 130.37 2ee2 s PRO 83 Ca 0.61 1.58 -0.14 0.00 0.04 0.00 0.00 61.00 63.08 2ee2 s PRO 83 Cb -0.16 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.40 2ee2 s PRO 83 CO 0.21 -0.92 0.34 -3.47 0.04 0.00 0.00 177.00 173.20 2ee2 n ASP 84 N -1.48 -1.39 -3.95 6.66 2.03 0.53 -4.88 116.55 114.06 2ee2 n ASP 84 Ca 0.11 -1.25 -0.26 0.00 0.52 0.00 0.00 54.79 53.91 2ee2 n ASP 84 Cb 0.51 -1.84 -0.17 0.00 -0.72 0.00 0.00 41.12 38.90 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 -3.98 1.07 -0.15 5.18 2.01 -1.24 -4.89 115.64 113.63 2ee2 s THR 85 Ca 0.21 -0.36 -0.29 0.00 0.31 0.00 0.00 61.69 61.56 2ee2 s THR 85 Cb -0.11 -1.04 -0.04 0.00 0.01 0.00 0.00 72.50 71.32 2ee2 s THR 85 CO 0.97 0.36 1.60 -1.58 -0.69 0.00 0.00 174.62 175.29 2ee2 s GLN 86 N 1.34 3.98 -0.19 4.92 0.74 -1.26 -3.64 119.66 125.55 2ee2 s GLN 86 Ca -0.02 1.86 0.01 0.00 0.05 0.00 0.00 55.36 57.27 2ee2 s GLN 86 Cb -0.14 -3.99 0.02 0.00 1.10 0.00 0.00 33.01 30.01 2ee2 s GLN 86 CO -0.04 -1.07 -0.19 0.71 -0.55 0.00 0.00 175.29 174.14 2ee2 s TYR 87 N 4.63 2.84 -0.68 1.67 2.02 -0.63 -1.41 117.35 125.77 2ee2 s TYR 87 Ca 0.71 -1.72 -0.27 0.00 -0.37 0.00 0.00 57.07 55.41 2ee2 s TYR 87 Cb -0.28 -1.92 0.03 0.00 -0.40 0.00 0.00 41.96 39.39 2ee2 s TYR 87 CO 0.28 -0.82 1.27 -0.06 -1.57 0.00 0.00 175.55 174.65 2ee2 s PHE 88 N 1.27 2.37 -0.06 2.71 0.08 -1.04 -1.53 117.98 121.77 2ee2 s PHE 88 Ca 0.03 0.12 -0.14 0.00 0.12 0.00 0.00 56.93 57.07 2ee2 s PHE 88 Cb -0.14 -4.58 -0.05 0.00 -0.57 0.00 0.00 43.02 37.68 2ee2 s PHE 88 CO -0.12 -1.93 0.36 0.42 -0.10 0.00 0.00 175.22 173.84 2ee2 s ILE 89 N 5.57 5.17 -0.05 0.64 1.01 -0.71 -3.61 121.20 129.23 2ee2 s ILE 89 Ca 0.38 0.71 -0.02 0.00 0.00 0.00 0.00 60.65 61.73 2ee2 s ILE 89 Cb -0.08 -3.67 0.03 0.00 0.01 0.00 0.00 42.46 38.76 2ee2 s ILE 89 CO 0.19 0.51 0.08 -1.61 0.00 0.00 0.00 174.94 174.11 2ee2 s GLU 90 N -0.54 -0.03 -0.26 2.79 8.01 -0.48 -2.97 118.70 125.22 2ee2 s GLU 90 Ca 0.21 0.37 -0.01 0.00 0.01 0.00 0.00 54.97 55.55 2ee2 s GLU 90 Cb -0.15 -0.36 0.04 0.00 -4.31 0.00 0.00 34.13 29.34 2ee2 s GLU 90 CO 0.10 -0.27 -0.06 0.08 0.01 0.00 0.00 175.26 175.12 2ee2 s VAL 91 N 1.81 2.73 -0.03 2.63 1.01 -1.26 -1.55 120.40 125.74 2ee2 s VAL 91 Ca -0.00 -1.21 -0.01 0.00 0.00 0.00 0.00 61.98 60.76 2ee2 s VAL 91 Cb -0.12 -2.45 0.03 0.00 0.00 0.00 0.00 36.38 33.84 2ee2 s VAL 91 CO -0.04 0.11 0.05 -0.83 0.00 0.00 0.00 175.10 174.39 2ee2 s GLY 92 N 1.27 0.15 0.22 4.51 0.00 -1.15 -3.80 107.32 108.52 2ee2 s GLY 92 Ca -0.02 0.26 -0.30 0.00 0.00 0.00 0.00 44.72 44.65 2ee2 s GLY 92 CO -0.04 1.05 1.47 0.00 0.00 0.00 0.00 173.10 175.57 2ee2 s ALA 93 N 1.62 3.66 -0.26 3.20 0.00 -1.26 -3.85 121.76 124.87 2ee2 s ALA 93 Ca -0.02 1.33 -0.18 0.00 0.00 0.00 0.00 51.96 53.09 2ee2 s ALA 93 Cb -0.12 -3.57 0.07 0.00 0.00 0.00 0.00 23.12 19.50 2ee2 s ALA 93 CO -0.03 -0.75 0.65 0.00 0.00 0.00 0.00 175.76 175.63 2ee2 s ASN 95 N 1.16 5.12 0.33 0.00 4.22 -1.17 -4.08 114.94 120.51 2ee2 s ASN 95 Ca -0.06 -0.17 0.11 0.00 -2.14 0.00 0.00 52.86 50.59 2ee2 s ASN 95 Cb -0.05 -1.24 0.93 0.00 1.28 0.00 0.00 41.25 42.17 2ee2 s ASN 95 CO -0.12 0.16 1.72 -1.28 -2.04 0.00 0.00 177.10 175.54 2ee2 h SER 96 N 3.25 0.64 0.00 3.54 0.87 -1.97 -2.78 113.55 117.11 2ee2 h SER 96 Ca -0.47 0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 2ee2 h SER 96 Cb 1.17 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 2ee2 h SER 96 CO 0.61 0.06 0.00 0.00 -0.53 0.00 0.00 176.83 176.97 2ee2 n ALA 97 N -2.31 -0.21 -2.68 6.23 0.00 -1.26 -4.79 120.51 115.49 2ee2 n ALA 97 Ca 0.28 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.44 2ee2 n ALA 97 Cb 0.79 0.09 -0.08 0.00 0.00 0.00 0.00 19.45 20.26 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 -0.56 1.78 -0.22 0.00 0.00 -1.05 -4.95 107.32 102.32 2ee2 s GLY 98 Ca 0.00 -1.28 -0.09 0.00 0.00 0.00 0.00 44.72 43.35 2ee2 s GLY 98 CO 0.00 -1.29 0.10 0.00 0.00 0.00 0.00 173.10 171.92 2ee2 s GLY 100 N 0.94 1.45 0.32 0.00 0.00 -1.26 -4.79 107.32 103.97 2ee2 s GLY 100 Ca 0.05 -1.45 -0.29 0.00 0.00 0.00 0.00 44.72 43.03 2ee2 s GLY 100 CO 0.03 -1.49 1.22 2.56 0.00 0.00 0.00 173.10 175.42 2ee2 s PRO 101 N -3.83 4.43 0.89 2.90 0.04 -1.26 -4.92 135.00 133.25 2ee2 s PRO 101 Ca 0.33 2.05 -0.11 0.00 0.04 0.00 0.00 61.00 63.30 2ee2 s PRO 101 Cb -0.08 -3.08 0.12 0.00 0.04 0.00 0.00 34.50 31.51 2ee2 s PRO 101 CO 0.24 -0.06 1.09 -1.25 0.04 0.00 0.00 177.00 177.07 2ee2 s PRO 102 N -1.71 1.31 1.01 0.56 0.04 -1.26 -4.76 135.00 130.18 2ee2 s PRO 102 Ca 0.48 0.84 -0.17 0.00 0.04 0.00 0.00 61.00 62.19 2ee2 s PRO 102 Cb -0.36 -1.81 0.22 0.00 0.04 0.00 0.00 34.50 32.58 2ee2 s PRO 102 CO 0.48 -2.21 1.27 -1.54 0.04 0.00 0.00 177.00 175.04 2ee2 s SER 103 N -3.42 2.67 0.47 6.66 1.04 -1.25 -4.97 113.70 114.91 2ee2 s SER 103 Ca 0.63 0.36 -0.24 0.00 0.48 0.00 0.00 55.95 57.19 2ee2 s SER 103 Cb -0.18 -0.46 -0.08 0.00 0.10 0.00 0.00 66.02 65.40 2ee2 s SER 103 CO 0.57 -3.02 1.23 -0.67 0.98 0.00 0.00 173.24 172.33 2ee2 n ASP 104 N -3.97 2.24 -4.57 7.02 2.03 -1.26 -4.85 116.55 113.19 2ee2 n ASP 104 Ca 0.15 1.03 -0.40 0.00 0.52 0.00 0.00 54.79 56.08 2ee2 n ASP 104 Cb 0.59 -1.49 -0.03 0.00 -0.72 0.00 0.00 41.12 39.48 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 -2.42 2.97 0.09 -0.67 -2.45 -1.26 -4.81 119.30 110.75 2ee2 s MET 105 Ca 0.65 0.80 0.01 0.00 -1.25 0.00 0.00 55.69 55.90 2ee2 s MET 105 Cb -0.48 -4.28 -0.04 0.00 1.25 0.00 0.00 34.83 31.29 2ee2 s MET 105 CO 0.54 -2.32 0.22 0.42 1.05 0.00 0.00 175.02 174.94 2ee2 s ILE 106 N 7.82 5.33 -0.04 10.11 1.01 -1.16 -5.03 121.20 139.25 2ee2 s ILE 106 Ca 0.67 -0.49 0.05 0.00 0.00 0.00 0.00 60.65 60.88 2ee2 s ILE 106 Cb -0.15 -3.64 -0.01 0.00 0.01 0.00 0.00 42.46 38.68 2ee2 s ILE 106 CO 0.25 0.07 -0.18 -1.83 0.00 0.00 0.00 174.94 173.25 2ee2 s GLU 107 N -2.71 1.78 0.19 2.79 1.03 -1.26 -1.73 118.70 118.80 2ee2 s GLU 107 Ca 0.35 -0.64 0.11 0.00 0.03 0.00 0.00 54.97 54.82 2ee2 s GLU 107 Cb -0.12 -1.58 -0.04 0.00 -0.80 0.00 0.00 34.13 31.58 2ee2 s GLU 107 CO 0.28 0.29 -0.24 0.00 -1.33 0.00 0.00 175.26 174.26 2ee2 s ALA 108 N -0.08 2.54 -0.29 -0.84 0.00 -0.58 -4.96 121.76 117.55 2ee2 s ALA 108 Ca -0.01 -1.64 -0.00 0.00 0.00 0.00 0.00 51.96 50.30 2ee2 s ALA 108 Cb -0.11 -0.34 0.09 0.00 0.00 0.00 0.00 23.12 22.77 2ee2 s ALA 108 CO 0.02 0.43 0.06 -0.06 0.00 0.00 0.00 175.76 176.21 2ee2 s PHE 109 N -1.66 1.92 0.71 0.00 0.40 -1.26 -1.61 117.98 116.48 2ee2 s PHE 109 Ca 0.21 -1.75 -0.11 0.00 -0.60 0.00 0.00 56.93 54.67 2ee2 s PHE 109 Cb -0.08 -1.73 0.18 0.00 0.51 0.00 0.00 43.02 41.89 2ee2 s PHE 109 CO 0.10 -0.84 0.40 0.25 0.70 0.00 0.00 175.22 175.83 2ee2 n THR 110 N 4.79 0.00 -3.47 0.64 -2.24 -1.24 -4.90 114.28 107.86 2ee2 n THR 110 Ca -0.04 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.55 2ee2 n THR 110 Cb 0.43 -0.45 -0.02 0.00 -2.10 0.00 0.00 70.33 68.20 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 -3.67 2.82 -0.20 -0.78 -0.14 -1.26 -3.87 119.74 112.63 2ee2 s LYS 111 Ca 0.31 -1.26 -0.28 0.00 -1.36 0.00 0.00 55.97 53.38 2ee2 s LYS 111 Cb -0.05 -2.62 0.00 0.00 -1.68 0.00 0.00 37.83 33.48 2ee2 s LYS 111 CO 0.26 -0.06 0.98 0.15 -0.76 0.00 0.00 175.35 175.91 2ee2 s LYS 112 N -4.16 4.28 0.07 1.68 1.02 -1.26 -0.35 119.74 121.02 2ee2 s LYS 112 Ca 0.47 1.26 -0.28 0.00 0.02 0.00 0.00 55.97 57.44 2ee2 s LYS 112 Cb -0.07 -3.62 -0.13 0.00 -0.52 0.00 0.00 37.83 33.49 2ee2 s LYS 112 CO 0.30 -0.52 1.44 0.00 -0.92 0.00 0.00 175.35 175.64 2ee2 h ALA 113 N 7.41 -1.01 -2.64 5.17 0.00 -1.97 -3.41 119.26 122.81 2ee2 h ALA 113 Ca -0.23 -0.13 -0.54 0.00 0.00 0.00 0.00 54.91 54.01 2ee2 h ALA 113 Cb 1.09 0.70 -0.04 0.00 0.00 0.00 0.00 17.79 19.54 2ee2 h ALA 113 CO 0.92 -1.07 0.19 0.45 0.00 0.00 0.00 179.25 179.74 2ee2 s SER 114 N -4.00 7.22 0.00 0.00 0.15 -1.26 -4.94 113.70 110.88 2ee2 s SER 114 Ca -0.14 1.46 0.00 0.00 0.70 0.00 0.00 55.95 57.98 2ee2 s SER 114 Cb 0.04 -2.48 0.00 0.00 -1.71 0.00 0.00 66.02 61.87 2ee2 s SER 114 CO 0.47 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.49 2ee2 n GLY 115 N 2.50 3.73 3.77 9.45 0.00 -1.26 -5.09 105.19 118.29 2ee2 n GLY 115 Ca -0.01 -1.49 -0.38 0.00 0.00 0.00 0.00 46.02 44.13 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 -4.75 4.05 -0.11 1.61 0.04 -1.26 -5.02 135.00 129.55 2ee2 s PRO 116 Ca 0.00 1.89 -0.28 0.00 0.04 0.00 0.00 61.00 62.65 2ee2 s PRO 116 Cb 0.00 -2.70 0.07 0.00 0.04 0.00 0.00 34.50 31.91 2ee2 s PRO 116 CO 0.00 -0.34 0.67 -1.12 0.04 0.00 0.00 177.00 176.25 2ee2 s SER 117 N -1.06 -0.66 -1.05 6.66 0.01 -1.26 -5.09 113.70 111.24 2ee2 s SER 117 Ca 0.57 0.89 -0.22 0.00 1.31 0.00 0.00 55.95 58.49 2ee2 s SER 117 Cb -0.32 0.79 0.05 0.00 0.21 0.00 0.00 66.02 66.75 2ee2 s SER 117 CO 0.40 -0.49 1.51 -0.94 0.41 0.00 0.00 173.24 174.13 2ee2 s SER 118 N -0.74 6.48 0.00 2.44 1.04 -1.26 -5.26 113.70 116.40 2ee2 s SER 118 Ca -0.08 -1.55 0.00 0.00 0.48 0.00 0.00 55.95 54.80 2ee2 s SER 118 Cb -0.02 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2ee2 s SER 118 CO 0.07 -1.53 0.48 0.61 0.98 0.00 0.00 173.24 173.86