#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 0.76 -0.16 1.61 0.01 -1.26 -5.14 113.70 109.52 2ee2 s SER 2 Ca 0.00 -0.14 -0.15 0.00 1.31 0.00 0.00 55.95 56.97 2ee2 s SER 2 Cb 0.00 -0.08 -0.04 0.00 0.21 0.00 0.00 66.02 66.11 2ee2 s SER 2 CO 0.00 0.06 0.35 -0.55 0.41 0.00 0.00 173.24 173.52 2ee2 s SER 3 N -0.22 6.49 0.00 2.44 0.15 -1.26 -4.97 113.70 116.33 2ee2 s SER 3 Ca 0.02 0.58 0.00 0.00 0.70 0.00 0.00 55.95 57.24 2ee2 s SER 3 Cb -0.03 -2.21 0.00 0.00 -1.71 0.00 0.00 66.02 62.07 2ee2 s SER 3 CO -0.00 0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.09 2ee2 n GLY 4 N 3.46 -2.03 3.64 9.45 0.00 -1.26 -5.16 105.19 113.28 2ee2 n GLY 4 Ca -0.10 0.98 -0.09 0.00 0.00 0.00 0.00 46.02 46.80 2ee2 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ee2 s SER 5 N 0.00 -0.65 0.30 1.61 0.01 -1.26 -5.18 113.70 108.53 2ee2 s SER 5 Ca 0.00 1.16 0.04 0.00 1.31 0.00 0.00 55.95 58.46 2ee2 s SER 5 Cb 0.00 1.21 -0.03 0.00 0.21 0.00 0.00 66.02 67.41 2ee2 s SER 5 CO 0.00 -0.19 0.20 -0.94 0.41 0.00 0.00 173.24 172.72 2ee2 s SER 6 N 0.71 1.33 0.02 2.44 1.04 -1.26 -5.07 113.70 112.91 2ee2 s SER 6 Ca -0.02 -1.61 0.00 0.00 0.48 0.00 0.00 55.95 54.80 2ee2 s SER 6 Cb -0.05 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.53 2ee2 s SER 6 CO -0.08 -0.95 0.00 0.61 0.98 0.00 0.00 173.24 173.80 2ee2 n GLY 7 N -0.54 -1.89 3.69 7.32 0.00 -1.26 -5.12 105.19 107.39 2ee2 n GLY 7 Ca 0.04 0.66 -0.42 0.00 0.00 0.00 0.00 46.02 46.30 2ee2 n GLY 7 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ee2 s VAL 8 N -1.37 2.70 -0.16 1.61 -7.23 -1.26 -4.98 120.40 109.71 2ee2 s VAL 8 Ca 0.00 0.12 -0.09 0.00 -1.81 0.00 0.00 61.98 60.20 2ee2 s VAL 8 Cb 0.00 -3.08 0.06 0.00 0.56 0.00 0.00 36.38 33.92 2ee2 s VAL 8 CO 0.00 -0.00 0.38 0.00 -0.31 0.00 0.00 175.10 175.17 2ee2 s ALA 9 N 3.02 -0.95 -0.03 1.32 0.00 -1.26 -5.14 121.76 118.71 2ee2 s ALA 9 Ca 0.81 1.42 -0.30 0.00 0.00 0.00 0.00 51.96 53.89 2ee2 s ALA 9 Cb -0.44 -0.86 -0.03 0.00 0.00 0.00 0.00 23.12 21.78 2ee2 s ALA 9 CO 0.36 -0.25 1.07 0.08 0.00 0.00 0.00 175.76 177.02 2ee2 s VAL 10 N 1.34 4.58 -0.26 0.00 1.01 -1.26 -5.02 120.40 120.79 2ee2 s VAL 10 Ca -0.09 1.86 0.03 0.00 0.00 0.00 0.00 61.98 63.77 2ee2 s VAL 10 Cb -0.09 -4.19 0.06 0.00 0.00 0.00 0.00 36.38 32.16 2ee2 s VAL 10 CO -0.12 0.07 -0.11 -0.63 0.00 0.00 0.00 175.10 174.32 2ee2 s ILE 11 N 1.58 2.19 0.05 2.22 -1.09 -1.26 -5.09 121.20 119.81 2ee2 s ILE 11 Ca 0.53 -1.61 -0.37 0.00 -2.23 0.00 0.00 60.65 56.97 2ee2 s ILE 11 Cb -0.22 -2.28 -0.16 0.00 -1.58 0.00 0.00 42.46 38.21 2ee2 s ILE 11 CO 0.24 -0.01 1.40 0.59 -1.23 0.00 0.00 174.94 175.92 2ee2 n ASN 12 N 4.44 1.79 -4.71 3.58 4.13 -1.26 -4.97 115.26 118.26 2ee2 n ASN 12 Ca -0.14 1.11 -0.25 0.00 1.68 0.00 0.00 54.58 56.98 2ee2 n ASN 12 Cb 0.42 -1.19 -0.08 0.00 -1.54 0.00 0.00 39.78 37.39 2ee2 n ASN 12 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2ee2 s SER 13 N 0.85 4.33 0.08 6.41 0.01 -1.26 -5.16 113.70 118.96 2ee2 s SER 13 Ca 0.86 -1.11 0.03 0.00 1.31 0.00 0.00 55.95 57.03 2ee2 s SER 13 Cb -0.96 -0.48 -0.03 0.00 0.21 0.00 0.00 66.02 64.77 2ee2 s SER 13 CO 0.48 -0.51 -0.08 0.00 0.41 0.00 0.00 173.24 173.54 2ee2 s ALA 14 N -2.61 0.88 0.04 1.44 0.00 -1.26 -5.06 121.76 115.19 2ee2 s ALA 14 Ca 0.40 -1.08 -0.22 0.00 0.00 0.00 0.00 51.96 51.05 2ee2 s ALA 14 Cb 0.04 0.07 -0.15 0.00 0.00 0.00 0.00 23.12 23.09 2ee2 s ALA 14 CO 0.22 -0.09 1.45 -0.56 0.00 0.00 0.00 175.76 176.78 2ee2 h GLN 15 N 3.73 0.19 0.00 0.00 3.07 -2.00 -3.48 115.11 116.61 2ee2 h GLN 15 Ca -0.36 -0.07 -0.08 0.00 0.09 0.00 0.00 58.65 58.23 2ee2 h GLN 15 Cb 1.19 -0.01 -0.01 0.00 0.08 0.00 0.00 27.48 28.72 2ee2 h GLN 15 CO 0.52 0.47 0.10 -0.25 0.09 0.00 0.00 178.83 179.75 2ee2 n ASP 16 N -4.79 -1.46 -3.59 0.06 8.00 -1.26 -5.12 116.55 108.39 2ee2 n ASP 16 Ca -0.06 -2.24 -0.13 0.00 0.71 0.00 0.00 54.79 53.07 2ee2 n ASP 16 Cb 0.22 2.49 -0.06 0.00 -0.02 0.00 0.00 41.12 43.75 2ee2 n ASP 16 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ee2 s ALA 17 N -2.00 -1.88 0.15 2.24 0.00 -1.26 -2.77 121.76 116.24 2ee2 s ALA 17 Ca 0.15 1.66 -0.31 0.00 0.00 0.00 0.00 51.96 53.46 2ee2 s ALA 17 Cb -0.03 -0.78 -0.08 0.00 0.00 0.00 0.00 23.12 22.23 2ee2 s ALA 17 CO 0.11 -0.31 1.33 -1.25 0.00 0.00 0.00 175.76 175.64 2ee2 s PRO 18 N -0.57 4.36 0.00 0.00 0.04 -1.26 -4.91 135.00 132.66 2ee2 s PRO 18 Ca -0.03 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.05 2ee2 s PRO 18 Cb -0.02 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.29 2ee2 s PRO 18 CO 0.02 -0.33 0.34 -1.13 0.04 0.00 0.00 177.00 175.94 2ee2 n SER 19 N 3.27 0.68 -4.29 6.66 3.41 -1.26 -4.54 113.62 117.55 2ee2 n SER 19 Ca 0.09 -0.93 -0.27 0.00 -0.26 0.00 0.00 58.87 57.49 2ee2 n SER 19 Cb 0.43 0.08 -0.14 0.00 -0.26 0.00 0.00 64.21 64.32 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 -0.08 1.51 0.05 4.33 2.56 -1.26 -5.05 118.70 120.76 2ee2 s GLU 20 Ca 0.00 -1.04 0.05 0.00 0.00 0.00 0.00 54.97 53.98 2ee2 s GLU 20 Cb 0.00 -1.68 -0.04 0.00 2.00 0.00 0.00 34.13 34.41 2ee2 s GLU 20 CO 0.00 0.43 -0.06 0.00 -0.56 0.00 0.00 175.26 175.07 2ee2 s ALA 21 N -0.84 3.06 -0.14 6.30 0.00 -1.26 -4.86 121.76 124.01 2ee2 s ALA 21 Ca 0.09 -1.10 -0.29 0.00 0.00 0.00 0.00 51.96 50.66 2ee2 s ALA 21 Cb -0.09 -1.08 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 2ee2 s ALA 21 CO 0.02 0.64 1.55 -1.25 0.00 0.00 0.00 175.76 176.73 2ee2 s PRO 22 N -1.81 4.04 0.60 0.00 0.04 -1.26 -4.92 135.00 131.69 2ee2 s PRO 22 Ca 0.20 1.87 0.00 0.00 0.04 0.00 0.00 61.00 63.11 2ee2 s PRO 22 Cb -0.11 -3.96 0.06 0.00 0.04 0.00 0.00 34.50 30.53 2ee2 s PRO 22 CO 0.11 -0.99 0.84 0.99 0.04 0.00 0.00 177.00 177.99 2ee2 s THR 23 N 4.37 2.52 -1.41 1.26 2.01 -1.26 -4.45 115.64 118.67 2ee2 s THR 23 Ca 0.69 -0.63 -0.09 0.00 0.31 0.00 0.00 61.69 61.96 2ee2 s THR 23 Cb -0.27 -2.89 0.04 0.00 0.01 0.00 0.00 72.50 69.39 2ee2 s THR 23 CO 0.26 0.00 1.06 -0.62 -0.69 0.00 0.00 174.62 174.63 2ee2 n GLU 24 N -2.48 -6.76 -3.43 4.92 1.02 -1.26 -3.02 120.64 109.63 2ee2 n GLU 24 Ca 0.10 0.73 -0.38 0.00 -0.02 0.00 0.00 57.16 57.59 2ee2 n GLU 24 Cb 0.60 -5.69 -0.08 0.00 -0.02 0.00 0.00 31.44 26.25 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 -3.34 5.22 0.40 2.62 0.11 -1.26 -4.49 120.40 119.66 2ee2 s VAL 25 Ca 0.53 0.63 0.05 0.00 -2.93 0.00 0.00 61.98 60.25 2ee2 s VAL 25 Cb -0.25 -3.69 -0.02 0.00 -1.53 0.00 0.00 36.38 30.89 2ee2 s VAL 25 CO 0.77 0.27 0.18 0.61 -3.33 0.00 0.00 175.10 173.60 2ee2 n GLY 26 N 3.98 3.15 2.73 6.54 0.00 -0.84 -5.01 105.19 115.74 2ee2 n GLY 26 Ca -0.09 -2.07 -0.22 0.00 0.00 0.00 0.00 46.02 43.64 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 -3.16 0.20 -0.21 1.61 -7.23 -1.26 -2.45 120.40 107.89 2ee2 s VAL 27 Ca 0.25 0.23 -0.08 0.00 -1.81 0.00 0.00 61.98 60.57 2ee2 s VAL 27 Cb 0.01 -0.40 -0.04 0.00 0.56 0.00 0.00 36.38 36.52 2ee2 s VAL 27 CO 0.18 0.22 0.08 -0.75 -0.31 0.00 0.00 175.10 174.52 2ee2 s LYS 28 N 2.04 3.87 -0.06 4.82 2.20 0.36 -4.97 119.74 128.00 2ee2 s LYS 28 Ca 0.05 -0.39 -0.26 0.00 -0.36 0.00 0.00 55.97 55.02 2ee2 s LYS 28 Cb -0.12 -3.30 -0.03 0.00 -1.51 0.00 0.00 37.83 32.87 2ee2 s LYS 28 CO -0.04 0.07 0.80 0.08 -0.36 0.00 0.00 175.35 175.90 2ee2 s VAL 29 N 0.93 4.97 -0.18 4.02 1.01 -1.26 -0.82 120.40 129.07 2ee2 s VAL 29 Ca 0.04 1.65 -0.05 0.00 0.00 0.00 0.00 61.98 63.62 2ee2 s VAL 29 Cb -0.14 -4.14 -0.09 0.00 0.00 0.00 0.00 36.38 32.01 2ee2 s VAL 29 CO 0.03 0.20 -0.21 0.18 0.00 0.00 0.00 175.10 175.29 2ee2 n LEU 30 N 4.00 1.95 0.00 3.92 4.77 -0.91 -4.96 117.00 125.76 2ee2 n LEU 30 Ca 0.02 0.11 -0.08 0.00 -0.03 0.00 0.00 56.01 56.02 2ee2 n LEU 30 Cb 0.51 -0.57 -0.02 0.00 -2.33 0.00 0.00 43.42 41.00 2ee2 n LEU 30 CO 0.49 0.54 0.07 -1.20 -1.33 0.00 0.00 177.39 175.96 2ee2 n SER 31 N -3.53 -0.67 0.23 -1.43 7.64 -0.87 -4.98 113.62 110.01 2ee2 n SER 31 Ca -0.35 -2.02 0.15 0.00 1.01 0.00 0.00 58.87 57.66 2ee2 n SER 31 Cb 0.79 1.28 0.58 0.00 -1.01 0.00 0.00 64.21 65.86 2ee2 n SER 31 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2ee2 h SER 32 N 1.05 0.00 -0.18 6.43 4.64 -1.94 -3.14 113.55 120.41 2ee2 h SER 32 Ca -0.14 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.98 2ee2 h SER 32 Cb 0.63 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 62.41 2ee2 h SER 32 CO 0.19 0.00 -0.92 -1.54 -0.87 0.00 0.00 176.83 173.69 2ee2 n SER 33 N -2.82 1.69 -3.68 4.97 3.41 -1.26 -3.87 113.62 112.07 2ee2 n SER 33 Ca 0.01 -2.60 -0.09 0.00 -0.26 0.00 0.00 58.87 55.93 2ee2 n SER 33 Cb 0.31 -0.39 -0.10 0.00 -0.26 0.00 0.00 64.21 63.76 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 -1.93 0.43 -0.08 4.33 2.02 -1.19 -3.53 118.70 118.75 2ee2 s GLU 34 Ca 0.35 0.92 -0.03 0.00 0.02 0.00 0.00 54.97 56.23 2ee2 s GLU 34 Cb 0.37 0.10 0.04 0.00 0.10 0.00 0.00 34.13 34.74 2ee2 s GLU 34 CO -0.10 -0.18 0.16 0.42 0.02 0.00 0.00 175.26 175.59 2ee2 s ILE 35 N 1.73 -0.16 0.04 -1.63 1.01 -1.10 -2.04 121.20 119.05 2ee2 s ILE 35 Ca -0.08 0.26 -0.06 0.00 0.00 0.00 0.00 60.65 60.77 2ee2 s ILE 35 Cb -0.09 -0.28 -0.05 0.00 0.01 0.00 0.00 42.46 42.05 2ee2 s ILE 35 CO -0.14 0.11 0.29 -0.44 0.00 0.00 0.00 174.94 174.75 2ee2 s SER 36 N 1.72 6.49 -0.06 3.58 0.01 0.00 -0.27 113.70 125.17 2ee2 s SER 36 Ca -0.03 0.55 0.03 0.00 1.31 0.00 0.00 55.95 57.81 2ee2 s SER 36 Cb -0.12 -2.08 0.00 0.00 0.21 0.00 0.00 66.02 64.03 2ee2 s SER 36 CO -0.06 0.21 -0.15 -0.69 0.41 0.00 0.00 173.24 172.96 2ee2 s VAL 37 N -1.38 1.32 0.11 3.43 1.01 -0.68 -0.49 120.40 123.74 2ee2 s VAL 37 Ca 0.30 -0.62 0.10 0.00 0.00 0.00 0.00 61.98 61.76 2ee2 s VAL 37 Cb -0.13 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 2ee2 s VAL 37 CO 0.19 0.39 -0.26 -1.00 0.00 0.00 0.00 175.10 174.42 2ee2 s HIS 38 N 0.32 2.34 0.17 5.22 3.76 -1.02 0.58 115.29 126.66 2ee2 s HIS 38 Ca -0.09 -0.37 -0.22 0.00 -0.15 0.00 0.00 55.06 54.23 2ee2 s HIS 38 Cb -0.14 -1.29 0.06 0.00 1.11 0.00 0.00 32.58 32.32 2ee2 s HIS 38 CO 0.03 0.31 0.59 1.67 -0.85 0.00 0.00 174.74 176.49 2ee2 s TRP 39 N -1.02 -0.45 0.06 1.40 -2.14 -0.91 -1.99 118.94 113.89 2ee2 s TRP 39 Ca 0.14 0.20 -0.12 0.00 2.66 0.00 0.00 56.10 58.98 2ee2 s TRP 39 Cb -0.10 0.53 -0.06 0.00 -3.10 0.00 0.00 33.47 30.74 2ee2 s TRP 39 CO 0.06 -0.87 0.43 -2.00 -2.66 0.00 0.00 176.95 171.90 2ee2 s GLU 40 N -3.78 3.85 0.14 3.25 2.56 -1.17 -4.70 118.70 118.86 2ee2 s GLU 40 Ca 0.02 0.31 -0.31 0.00 0.00 0.00 0.00 54.97 55.00 2ee2 s GLU 40 Cb -0.01 -3.07 -0.09 0.00 2.00 0.00 0.00 34.13 32.97 2ee2 s GLU 40 CO -0.11 0.59 1.45 -1.01 -0.56 0.00 0.00 175.26 175.63 2ee2 s HIS 41 N -1.30 3.17 0.75 5.30 3.76 -1.26 -4.45 115.29 121.27 2ee2 s HIS 41 Ca 0.31 0.85 -0.11 0.00 -0.15 0.00 0.00 55.06 55.96 2ee2 s HIS 41 Cb -0.15 -3.77 0.04 0.00 1.11 0.00 0.00 32.58 29.81 2ee2 s HIS 41 CO 0.17 -2.75 1.08 0.14 -0.85 0.00 0.00 174.74 172.53 2ee2 s VAL 42 N 1.04 3.51 -0.33 -0.90 -7.23 -1.26 -4.92 120.40 110.32 2ee2 s VAL 42 Ca 0.66 0.49 0.26 0.00 -1.81 0.00 0.00 61.98 61.58 2ee2 s VAL 42 Cb -0.39 -3.05 0.28 0.00 0.56 0.00 0.00 36.38 33.77 2ee2 s VAL 42 CO 0.31 -0.64 1.77 0.17 -0.31 0.00 0.00 175.10 176.40 2ee2 h LEU 43 N -1.02 0.00 -8.76 1.32 8.10 -1.94 -3.41 115.31 109.60 2ee2 h LEU 43 Ca -0.44 0.00 -0.61 0.00 0.11 0.00 0.00 57.88 56.94 2ee2 h LEU 43 Cb 1.23 0.00 -0.11 0.00 -0.44 0.00 0.00 40.66 41.33 2ee2 h LEU 43 CO 0.53 0.00 0.42 -1.61 -4.11 0.00 0.00 178.44 173.67 2ee2 s GLU 44 N -3.42 3.67 0.00 0.17 0.41 -1.26 -4.89 118.70 113.38 2ee2 s GLU 44 Ca 0.03 0.24 0.24 0.00 -0.41 0.00 0.00 54.97 55.07 2ee2 s GLU 44 Cb 0.09 -3.85 1.07 0.00 -1.78 0.00 0.00 34.13 29.67 2ee2 s GLU 44 CO 0.40 -0.95 1.74 1.17 -0.49 0.00 0.00 175.26 177.13 2ee2 n LYS 45 N 6.59 1.47 0.18 1.61 3.00 -1.26 -3.66 118.16 126.09 2ee2 n LYS 45 Ca 0.04 -0.70 0.06 0.00 -0.00 0.00 0.00 58.31 57.71 2ee2 n LYS 45 Cb 0.48 -1.42 0.19 0.00 0.00 0.00 0.00 35.03 34.29 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 1.54 0.63 -2.15 3.15 3.07 -1.96 -3.45 117.51 118.34 2ee2 h ILE 46 Ca 0.00 -1.67 -0.60 0.00 1.55 0.00 0.00 64.86 64.14 2ee2 h ILE 46 Cb 0.33 2.14 0.04 0.00 -0.27 0.00 0.00 36.82 39.06 2ee2 h ILE 46 CO 0.00 0.33 0.95 1.33 -1.05 0.00 0.00 178.15 179.70 2ee2 n VAL 47 N -3.26 0.29 0.04 0.16 0.24 -1.24 -4.53 118.33 110.02 2ee2 n VAL 47 Ca 0.02 -0.05 -0.19 0.00 -2.04 0.00 0.00 64.34 62.07 2ee2 n VAL 47 Cb 0.60 -1.70 -0.12 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 7.55 0.47 -2.48 7.34 4.39 -1.79 -3.46 114.58 126.60 2ee2 h GLU 48 Ca -0.47 -0.58 0.11 0.00 0.34 0.00 0.00 59.36 58.76 2ee2 h GLU 48 Cb 1.26 0.19 -0.11 0.00 -0.10 0.00 0.00 28.75 29.98 2ee2 h GLU 48 CO 0.92 1.22 0.42 -1.54 -1.16 0.00 0.00 179.01 178.87 2ee2 s SER 49 N -7.02 -0.33 -0.11 1.42 1.04 -1.11 -3.58 113.70 104.01 2ee2 s SER 49 Ca -0.12 -0.18 -0.05 0.00 0.48 0.00 0.00 55.95 56.08 2ee2 s SER 49 Cb 0.04 0.48 -0.04 0.00 0.10 0.00 0.00 66.02 66.60 2ee2 s SER 49 CO 0.86 -0.83 0.08 -0.31 0.98 0.00 0.00 173.24 174.02 2ee2 s TYR 50 N -3.35 3.40 -0.17 5.02 1.51 -0.98 -2.53 117.35 120.25 2ee2 s TYR 50 Ca 0.07 0.37 -0.05 0.00 -1.01 0.00 0.00 57.07 56.45 2ee2 s TYR 50 Cb -0.02 -1.88 -0.03 0.00 -0.11 0.00 0.00 41.96 39.92 2ee2 s TYR 50 CO -0.05 0.60 -0.01 1.14 -1.11 0.00 0.00 175.55 176.12 2ee2 s GLN 51 N -0.90 3.71 -0.64 -0.62 -2.07 -0.44 -2.00 119.66 116.70 2ee2 s GLN 51 Ca 0.14 -0.49 -0.06 0.00 -1.82 0.00 0.00 55.36 53.13 2ee2 s GLN 51 Cb -0.12 -3.01 0.17 0.00 -1.09 0.00 0.00 33.01 28.95 2ee2 s GLN 51 CO 0.03 0.18 0.48 0.42 -1.32 0.00 0.00 175.29 175.08 2ee2 s ILE 52 N 0.56 4.10 -0.23 3.63 1.09 -0.67 -1.66 121.20 128.02 2ee2 s ILE 52 Ca -0.01 -2.72 -0.29 0.00 -1.10 0.00 0.00 60.65 56.53 2ee2 s ILE 52 Cb -0.14 -3.64 -0.01 0.00 -1.06 0.00 0.00 42.46 37.61 2ee2 s ILE 52 CO 0.02 -0.89 1.32 -0.60 -0.10 0.00 0.00 174.94 174.69 2ee2 s ARG 53 N 0.16 4.04 -0.03 2.79 3.52 -1.00 -2.42 118.95 126.01 2ee2 s ARG 53 Ca 0.16 1.47 0.05 0.00 -0.13 0.00 0.00 55.73 57.27 2ee2 s ARG 53 Cb -0.19 -3.85 -0.01 0.00 -1.56 0.00 0.00 34.95 29.34 2ee2 s ARG 53 CO -0.04 -0.96 -0.18 1.52 -0.81 0.00 0.00 175.30 174.83 2ee2 s TYR 54 N 4.08 1.70 -0.29 5.12 1.13 -0.99 -2.44 117.35 125.67 2ee2 s TYR 54 Ca 0.57 -0.41 -0.22 0.00 -1.41 0.00 0.00 57.07 55.60 2ee2 s TYR 54 Cb -0.20 -1.12 0.14 0.00 -1.10 0.00 0.00 41.96 39.67 2ee2 s TYR 54 CO 0.20 -0.10 1.05 1.67 -2.51 0.00 0.00 175.55 175.86 2ee2 s TRP 55 N -0.18 -0.47 0.78 -3.49 -2.14 -1.15 -2.94 118.94 109.34 2ee2 s TRP 55 Ca 0.01 1.07 -0.15 0.00 2.66 0.00 0.00 56.10 59.69 2ee2 s TRP 55 Cb -0.10 0.37 -0.00 0.00 -3.10 0.00 0.00 33.47 30.64 2ee2 s TRP 55 CO 0.01 -0.23 0.66 0.00 -2.66 0.00 0.00 176.95 174.73 2ee2 n ALA 56 N 2.65 -1.33 -0.13 2.67 0.00 -1.26 -1.67 120.51 121.44 2ee2 n ALA 56 Ca -0.14 -0.31 -0.04 0.00 0.00 0.00 0.00 53.44 52.94 2ee2 n ALA 56 Cb 0.56 -1.94 0.04 0.00 0.00 0.00 0.00 19.45 18.12 2ee2 n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ee2 h ALA 57 N -0.65 0.46 -0.79 0.00 0.00 -1.24 -1.99 119.26 115.05 2ee2 h ALA 57 Ca -0.45 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 2ee2 h ALA 57 Cb 1.33 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.17 2ee2 h ALA 57 CO 0.42 -0.31 0.44 1.12 0.00 0.00 0.00 179.25 180.92 2ee2 h HIS 58 N 0.23 1.08 -2.33 0.00 2.07 -1.90 -3.44 115.15 110.86 2ee2 h HIS 58 Ca 0.20 -0.02 -0.38 0.00 -2.85 0.00 0.00 60.37 57.32 2ee2 h HIS 58 Cb 0.24 -0.35 0.20 0.00 2.57 0.00 0.00 27.41 30.08 2ee2 h HIS 58 CO -0.19 0.75 -0.72 -0.25 -3.07 0.00 0.00 177.93 174.45 2ee2 n ASP 59 N -4.43 -2.69 -4.37 3.10 8.00 -0.75 -5.03 116.55 110.38 2ee2 n ASP 59 Ca 0.07 -0.28 -0.25 0.00 0.71 0.00 0.00 54.79 55.04 2ee2 n ASP 59 Cb 0.09 -0.93 -0.12 0.00 -0.02 0.00 0.00 41.12 40.14 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 -3.68 1.36 0.44 -1.24 -0.14 -1.26 -4.90 119.74 110.32 2ee2 s LYS 60 Ca 0.53 -1.42 0.22 0.00 -1.36 0.00 0.00 55.97 53.93 2ee2 s LYS 60 Cb -0.11 -1.59 1.19 0.00 -1.68 0.00 0.00 37.83 35.64 2ee2 s LYS 60 CO 0.57 0.34 1.84 1.05 -0.76 0.00 0.00 175.35 178.38 2ee2 h GLU 61 N 3.37 0.30 -0.89 1.68 9.09 -1.95 0.21 114.58 126.38 2ee2 h GLU 61 Ca -0.45 -0.02 -0.02 0.00 0.05 0.00 0.00 59.36 58.92 2ee2 h GLU 61 Cb 1.20 -0.07 -0.04 0.00 -1.65 0.00 0.00 28.75 28.19 2ee2 h GLU 61 CO 0.47 0.20 0.49 1.05 0.05 0.00 0.00 179.01 181.27 2ee2 h GLU 62 N 0.30 1.25 -0.61 1.06 -0.00 -2.03 -1.72 114.58 112.83 2ee2 h GLU 62 Ca 0.50 -0.15 0.00 0.00 -0.00 0.00 0.00 59.36 59.71 2ee2 h GLU 62 Cb 1.43 -0.24 0.00 0.00 -0.00 0.00 0.00 28.75 29.94 2ee2 h GLU 62 CO -0.17 0.91 0.00 0.00 -0.00 0.00 0.00 179.01 179.76 2ee2 n ALA 63 N -2.40 2.88 -2.40 1.06 0.00 0.63 -4.92 120.51 115.36 2ee2 n ALA 63 Ca 0.09 -1.14 -0.40 0.00 0.00 0.00 0.00 53.44 51.99 2ee2 n ALA 63 Cb 0.10 -1.01 -0.05 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.71 3.31 0.57 0.00 0.00 -0.58 -4.84 121.76 118.52 2ee2 s ALA 64 Ca 0.38 0.39 -0.01 0.00 0.00 0.00 0.00 51.96 52.72 2ee2 s ALA 64 Cb 0.24 -3.11 0.03 0.00 0.00 0.00 0.00 23.12 20.28 2ee2 s ALA 64 CO 0.19 0.00 0.82 -0.80 0.00 0.00 0.00 175.76 175.97 2ee2 s ASN 65 N 0.09 5.27 -0.01 0.00 0.01 -1.15 -4.95 114.94 114.20 2ee2 s ASN 65 Ca 0.42 0.17 0.01 0.00 -0.71 0.00 0.00 52.86 52.75 2ee2 s ASN 65 Cb -0.21 -1.05 0.01 0.00 0.41 0.00 0.00 41.25 40.40 2ee2 s ASN 65 CO 0.25 -1.18 -0.02 -0.13 -1.51 0.00 0.00 177.10 174.51 2ee2 s ARG 66 N -4.85 0.28 -0.38 -0.60 0.52 -1.26 -2.35 118.95 110.32 2ee2 s ARG 66 Ca 0.56 -0.06 -0.01 0.00 -0.52 0.00 0.00 55.73 55.70 2ee2 s ARG 66 Cb -0.10 -0.32 0.10 0.00 0.52 0.00 0.00 34.95 35.14 2ee2 s ARG 66 CO 0.40 0.01 0.14 0.08 0.02 0.00 0.00 175.30 175.95 2ee2 s VAL 67 N 0.24 3.01 -0.10 3.52 1.01 -1.02 -4.88 120.40 122.17 2ee2 s VAL 67 Ca -0.02 -2.02 -0.21 0.00 0.00 0.00 0.00 61.98 59.73 2ee2 s VAL 67 Cb -0.05 -3.04 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 2ee2 s VAL 67 CO -0.01 -0.58 0.61 -1.58 0.00 0.00 0.00 175.10 173.54 2ee2 s GLN 68 N 1.10 4.37 0.09 2.72 -0.44 -1.26 -1.66 119.66 124.57 2ee2 s GLN 68 Ca 0.07 0.68 0.03 0.00 -2.50 0.00 0.00 55.36 53.64 2ee2 s GLN 68 Cb -0.21 -3.46 -0.03 0.00 -1.64 0.00 0.00 33.01 27.66 2ee2 s GLN 68 CO -0.05 0.05 -0.09 0.14 0.50 0.00 0.00 175.29 175.85 2ee2 s VAL 69 N 0.90 0.82 0.47 1.34 -7.23 -0.84 -4.98 120.40 110.88 2ee2 s VAL 69 Ca 0.32 -1.58 -0.22 0.00 -1.81 0.00 0.00 61.98 58.69 2ee2 s VAL 69 Cb -0.16 -1.27 -0.10 0.00 0.56 0.00 0.00 36.38 35.41 2ee2 s VAL 69 CO 0.14 -0.57 0.77 1.07 -0.31 0.00 0.00 175.10 176.20 2ee2 n THR 70 N 0.64 2.36 0.67 5.32 5.66 -1.26 -2.32 114.28 125.34 2ee2 n THR 70 Ca -0.17 -0.50 0.06 0.00 -3.05 0.00 0.00 64.05 60.39 2ee2 n THR 70 Cb 0.58 -0.87 0.33 0.00 -1.55 0.00 0.00 70.33 68.82 2ee2 n THR 70 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2ee2 n SER 71 N 0.59 0.00 -0.05 1.09 2.88 -1.24 -1.53 113.62 115.37 2ee2 n SER 71 Ca 0.11 -0.12 0.12 0.00 -1.33 0.00 0.00 58.87 57.65 2ee2 n SER 71 Cb 0.42 -0.15 0.31 0.00 -0.75 0.00 0.00 64.21 64.04 2ee2 n SER 71 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ee2 n GLN 72 N -1.15 0.17 -3.14 -1.46 6.02 -1.26 -4.80 117.38 111.76 2ee2 n GLN 72 Ca 0.07 -0.10 -0.41 0.00 -0.01 0.00 0.00 57.00 56.56 2ee2 n GLN 72 Cb 0.07 -1.50 -0.07 0.00 1.02 0.00 0.00 30.24 29.77 2ee2 n GLN 72 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2ee2 s GLU 73 N -2.89 3.81 0.00 -1.09 0.41 -0.58 -4.92 118.70 113.44 2ee2 s GLU 73 Ca 0.14 0.16 0.07 0.00 -0.41 0.00 0.00 54.97 54.93 2ee2 s GLU 73 Cb 0.18 -3.76 0.41 0.00 -1.78 0.00 0.00 34.13 29.18 2ee2 s GLU 73 CO 0.65 -0.61 1.27 0.66 -0.49 0.00 0.00 175.26 176.73 2ee2 n TYR 74 N 5.88 0.01 -3.84 1.61 4.02 -1.26 -4.86 117.16 118.72 2ee2 n TYR 74 Ca -0.02 -0.01 -0.05 0.00 -0.01 0.00 0.00 57.90 57.81 2ee2 n TYR 74 Cb 0.49 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.82 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 -1.21 -0.02 0.20 7.72 1.04 -1.26 -2.15 113.70 118.03 2ee2 s SER 75 Ca 0.11 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.71 2ee2 s SER 75 Cb 0.05 0.64 -0.00 0.00 0.10 0.00 0.00 66.02 66.81 2ee2 s SER 75 CO 0.08 -1.26 0.26 0.00 0.98 0.00 0.00 173.24 173.30 2ee2 n ALA 76 N -0.61 -0.05 -3.18 5.32 0.00 0.20 -4.94 120.51 117.24 2ee2 n ALA 76 Ca -0.05 -0.99 -0.13 0.00 0.00 0.00 0.00 53.44 52.27 2ee2 n ALA 76 Cb 0.60 0.80 -0.10 0.00 0.00 0.00 0.00 19.45 20.74 2ee2 n ALA 76 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2ee2 s ARG 77 N -2.54 0.49 0.18 0.00 3.52 -1.26 -1.68 118.95 117.65 2ee2 s ARG 77 Ca 0.18 0.01 0.11 0.00 -0.13 0.00 0.00 55.73 55.90 2ee2 s ARG 77 Cb -0.00 0.22 -0.04 0.00 -1.56 0.00 0.00 34.95 33.56 2ee2 s ARG 77 CO 0.13 -0.11 -0.25 -0.51 -0.81 0.00 0.00 175.30 173.76 2ee2 s LEU 78 N -0.72 2.41 0.28 -0.88 1.43 0.63 -4.96 118.68 116.86 2ee2 s LEU 78 Ca -0.08 -0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 52.15 2ee2 s LEU 78 Cb -0.04 -1.17 -0.02 0.00 0.03 0.00 0.00 46.19 44.99 2ee2 s LEU 78 CO 0.02 0.13 0.32 -1.61 0.23 0.00 0.00 176.35 175.44 2ee2 s GLU 79 N -2.54 1.58 -1.24 1.70 2.02 -1.26 -2.70 118.70 116.25 2ee2 s GLU 79 Ca 0.19 -1.67 -0.01 0.00 0.02 0.00 0.00 54.97 53.50 2ee2 s GLU 79 Cb -0.08 0.37 -0.01 0.00 0.10 0.00 0.00 34.13 34.51 2ee2 s GLU 79 CO 0.09 -0.60 0.83 0.09 0.02 0.00 0.00 175.26 175.69 2ee2 n ASN 80 N -0.86 -2.03 -4.70 -0.19 3.02 -1.23 -4.96 115.26 104.30 2ee2 n ASN 80 Ca 0.02 -0.74 -0.23 0.00 -0.03 0.00 0.00 54.58 53.59 2ee2 n ASN 80 Cb 0.63 -4.52 -0.06 0.00 -0.61 0.00 0.00 39.78 35.22 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 -6.46 3.41 0.21 3.41 1.43 -1.26 -5.10 118.68 114.32 2ee2 s LEU 81 Ca 0.05 -0.49 -0.25 0.00 -1.03 0.00 0.00 54.13 52.42 2ee2 s LEU 81 Cb -0.01 -1.95 -0.08 0.00 0.03 0.00 0.00 46.19 44.18 2ee2 s LEU 81 CO 0.78 0.00 0.81 -0.76 0.23 0.00 0.00 176.35 177.41 2ee2 s LEU 82 N -3.61 4.51 0.31 1.79 1.43 -1.26 -4.46 118.68 117.38 2ee2 s LEU 82 Ca 0.31 1.66 -0.29 0.00 -1.03 0.00 0.00 54.13 54.78 2ee2 s LEU 82 Cb -0.07 -3.50 -0.10 0.00 0.03 0.00 0.00 46.19 42.54 2ee2 s LEU 82 CO 0.21 0.12 1.23 -2.16 0.23 0.00 0.00 176.35 175.99 2ee2 s PRO 83 N -1.47 4.46 -1.32 1.29 0.04 -1.25 -3.49 135.00 133.27 2ee2 s PRO 83 Ca 0.40 2.06 -0.01 0.00 0.04 0.00 0.00 61.00 63.49 2ee2 s PRO 83 Cb -0.21 -3.12 -0.00 0.00 0.04 0.00 0.00 34.50 31.21 2ee2 s PRO 83 CO 0.25 -0.04 0.63 -3.47 0.04 0.00 0.00 177.00 174.42 2ee2 n ASP 84 N 1.02 -1.12 -3.85 6.66 2.03 0.54 -4.84 116.55 116.99 2ee2 n ASP 84 Ca -0.00 -0.87 -0.16 0.00 0.52 0.00 0.00 54.79 54.27 2ee2 n ASP 84 Cb 0.43 -3.80 -0.16 0.00 -0.72 0.00 0.00 41.12 36.87 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 -3.73 0.22 -0.12 5.18 2.01 -1.23 -4.90 115.64 113.07 2ee2 s THR 85 Ca 0.02 0.01 -0.29 0.00 0.31 0.00 0.00 61.69 61.74 2ee2 s THR 85 Cb -0.01 -0.28 -0.03 0.00 0.01 0.00 0.00 72.50 72.20 2ee2 s THR 85 CO 0.83 0.13 1.34 -1.58 -0.69 0.00 0.00 174.62 174.66 2ee2 s GLN 86 N 0.72 4.23 -0.33 4.92 0.74 -1.26 -3.66 119.66 125.03 2ee2 s GLN 86 Ca -0.07 1.79 -0.02 0.00 0.05 0.00 0.00 55.36 57.10 2ee2 s GLN 86 Cb -0.11 -3.78 0.06 0.00 1.10 0.00 0.00 33.01 30.29 2ee2 s GLN 86 CO -0.01 -0.71 0.05 0.71 -0.55 0.00 0.00 175.29 174.79 2ee2 s TYR 87 N 3.43 3.35 -0.16 1.67 1.51 -0.31 -0.62 117.35 126.22 2ee2 s TYR 87 Ca 0.59 -2.00 -0.29 0.00 -1.01 0.00 0.00 57.07 54.36 2ee2 s TYR 87 Cb -0.25 -2.39 -0.04 0.00 -0.11 0.00 0.00 41.96 39.17 2ee2 s TYR 87 CO 0.19 -0.84 1.73 -0.06 -1.11 0.00 0.00 175.55 175.46 2ee2 s PHE 88 N 1.23 1.88 -0.03 2.71 0.08 -0.67 -2.52 117.98 120.65 2ee2 s PHE 88 Ca -0.01 0.37 0.03 0.00 0.12 0.00 0.00 56.93 57.44 2ee2 s PHE 88 Cb -0.20 -3.99 -0.03 0.00 -0.57 0.00 0.00 43.02 38.22 2ee2 s PHE 88 CO -0.02 -3.52 -0.12 0.42 -0.10 0.00 0.00 175.22 171.89 2ee2 s ILE 89 N 5.30 3.28 -0.15 0.64 1.01 0.76 -2.95 121.20 129.09 2ee2 s ILE 89 Ca 0.77 -0.74 -0.05 0.00 0.00 0.00 0.00 60.65 60.63 2ee2 s ILE 89 Cb -0.29 -2.34 0.07 0.00 0.01 0.00 0.00 42.46 39.92 2ee2 s ILE 89 CO 0.31 0.52 0.29 -1.61 0.00 0.00 0.00 174.94 174.45 2ee2 s GLU 90 N -0.98 0.18 -0.27 2.79 2.02 -1.02 -2.33 118.70 119.10 2ee2 s GLU 90 Ca 0.13 0.73 -0.16 0.00 0.02 0.00 0.00 54.97 55.69 2ee2 s GLU 90 Cb -0.11 -0.11 -0.03 0.00 0.10 0.00 0.00 34.13 33.97 2ee2 s GLU 90 CO 0.03 -0.33 0.41 0.08 0.02 0.00 0.00 175.26 175.46 2ee2 s VAL 91 N 2.44 5.15 -0.09 2.63 1.01 -1.26 -2.38 120.40 127.90 2ee2 s VAL 91 Ca 0.02 0.65 -0.01 0.00 0.00 0.00 0.00 61.98 62.64 2ee2 s VAL 91 Cb -0.13 -3.73 0.03 0.00 0.00 0.00 0.00 36.38 32.55 2ee2 s VAL 91 CO -0.10 0.14 -0.05 -0.83 0.00 0.00 0.00 175.10 174.26 2ee2 s GLY 92 N 1.61 0.70 0.06 4.51 0.00 -0.66 -3.37 107.32 110.16 2ee2 s GLY 92 Ca 0.17 -0.38 -0.22 0.00 0.00 0.00 0.00 44.72 44.28 2ee2 s GLY 92 CO 0.10 0.86 0.67 0.00 0.00 0.00 0.00 173.10 174.73 2ee2 s ALA 93 N 1.70 3.47 0.00 3.20 0.00 -1.26 -1.33 121.76 127.54 2ee2 s ALA 93 Ca 0.03 0.16 -0.28 0.00 0.00 0.00 0.00 51.96 51.87 2ee2 s ALA 93 Cb -0.13 -2.83 0.10 0.00 0.00 0.00 0.00 23.12 20.27 2ee2 s ALA 93 CO -0.06 0.21 0.86 0.00 0.00 0.00 0.00 175.76 176.77 2ee2 s ASN 95 N -2.40 4.71 0.58 0.00 4.22 -1.10 -2.38 114.94 118.58 2ee2 s ASN 95 Ca 0.04 -0.84 0.28 0.00 -2.14 0.00 0.00 52.86 50.19 2ee2 s ASN 95 Cb -0.01 -0.64 1.74 0.00 1.28 0.00 0.00 41.25 43.62 2ee2 s ASN 95 CO -0.08 -0.45 2.22 -1.28 -2.04 0.00 0.00 177.10 175.47 2ee2 h SER 96 N 1.39 0.00 0.00 3.54 0.87 -1.97 -3.16 113.55 114.22 2ee2 h SER 96 Ca -0.43 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 2ee2 h SER 96 Cb 1.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 2ee2 h SER 96 CO 0.64 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.94 2ee2 n ALA 97 N -2.35 -0.25 -2.45 6.23 0.00 -1.26 -4.92 120.51 115.51 2ee2 n ALA 97 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.17 2ee2 n ALA 97 Cb 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.46 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 -1.29 1.80 0.13 0.00 0.00 -1.12 -4.94 107.32 101.91 2ee2 s GLY 98 Ca 0.00 -1.78 0.03 0.00 0.00 0.00 0.00 44.72 42.97 2ee2 s GLY 98 CO 0.00 -1.84 0.24 0.00 0.00 0.00 0.00 173.10 171.50 2ee2 s GLY 100 N -3.06 1.98 0.42 0.00 0.00 -1.26 -4.46 107.32 100.94 2ee2 s GLY 100 Ca 0.34 -1.96 -0.25 0.00 0.00 0.00 0.00 44.72 42.85 2ee2 s GLY 100 CO 0.27 -1.97 1.18 2.56 0.00 0.00 0.00 173.10 175.15 2ee2 s PRO 101 N -3.59 3.97 0.75 2.90 0.04 -1.26 -4.92 135.00 132.89 2ee2 s PRO 101 Ca 0.30 1.86 -0.11 0.00 0.04 0.00 0.00 61.00 63.09 2ee2 s PRO 101 Cb -0.00 -2.62 0.04 0.00 0.04 0.00 0.00 34.50 31.96 2ee2 s PRO 101 CO 0.15 -0.40 1.10 -1.25 0.04 0.00 0.00 177.00 176.64 2ee2 s PRO 102 N -2.39 2.37 0.82 0.56 0.04 -1.26 -4.75 135.00 130.39 2ee2 s PRO 102 Ca 0.59 1.22 -0.10 0.00 0.04 0.00 0.00 61.00 62.75 2ee2 s PRO 102 Cb -0.31 -1.91 0.13 0.00 0.04 0.00 0.00 34.50 32.45 2ee2 s PRO 102 CO 0.39 -1.57 1.15 -1.54 0.04 0.00 0.00 177.00 175.47 2ee2 s SER 103 N -3.21 4.05 0.04 6.66 1.04 -1.22 -4.96 113.70 116.11 2ee2 s SER 103 Ca 0.62 0.29 -0.37 0.00 0.48 0.00 0.00 55.95 56.97 2ee2 s SER 103 Cb -0.18 -0.65 -0.17 0.00 0.10 0.00 0.00 66.02 65.13 2ee2 s SER 103 CO 0.53 -2.11 1.36 -0.90 0.98 0.00 0.00 173.24 173.09 2ee2 n ASP 104 N -3.28 1.57 -4.59 7.02 5.75 -1.26 -4.79 116.55 116.96 2ee2 n ASP 104 Ca 0.12 1.12 -0.42 0.00 -0.01 0.00 0.00 54.79 55.60 2ee2 n ASP 104 Cb 0.60 -1.16 -0.03 0.00 -1.03 0.00 0.00 41.12 39.50 2ee2 n ASP 104 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 2ee2 s MET 105 N 0.77 3.07 0.02 0.11 -2.45 -1.26 -4.82 119.30 114.73 2ee2 s MET 105 Ca 0.87 1.73 0.01 0.00 -1.25 0.00 0.00 55.69 57.05 2ee2 s MET 105 Cb -1.00 -4.34 -0.04 0.00 1.25 0.00 0.00 34.83 30.70 2ee2 s MET 105 CO 0.50 -2.18 0.05 0.42 1.05 0.00 0.00 175.02 174.86 2ee2 s ILE 106 N 8.32 4.46 -0.11 10.11 1.01 -0.98 -5.00 121.20 139.01 2ee2 s ILE 106 Ca 0.93 -0.57 0.03 0.00 0.00 0.00 0.00 60.65 61.03 2ee2 s ILE 106 Cb -0.27 -3.05 0.01 0.00 0.01 0.00 0.00 42.46 39.16 2ee2 s ILE 106 CO 0.33 0.30 -0.19 -1.83 0.00 0.00 0.00 174.94 173.55 2ee2 s GLU 107 N -1.83 2.60 0.08 2.79 1.03 -1.26 -0.17 118.70 121.93 2ee2 s GLU 107 Ca 0.23 -0.71 0.05 0.00 0.03 0.00 0.00 54.97 54.57 2ee2 s GLU 107 Cb -0.12 -2.07 -0.04 0.00 -0.80 0.00 0.00 34.13 31.10 2ee2 s GLU 107 CO 0.14 0.04 -0.04 0.00 -1.33 0.00 0.00 175.26 174.08 2ee2 s ALA 108 N 0.69 3.16 -0.13 -0.84 0.00 -1.05 -4.93 121.76 118.66 2ee2 s ALA 108 Ca -0.12 -1.13 0.01 0.00 0.00 0.00 0.00 51.96 50.73 2ee2 s ALA 108 Cb -0.16 -1.11 -0.00 0.00 0.00 0.00 0.00 23.12 21.84 2ee2 s ALA 108 CO 0.03 0.67 -0.18 -0.06 0.00 0.00 0.00 175.76 176.22 2ee2 s PHE 109 N -1.23 2.72 0.58 0.00 0.40 -1.26 -1.17 117.98 118.01 2ee2 s PHE 109 Ca 0.23 -0.95 -0.02 0.00 -0.60 0.00 0.00 56.93 55.59 2ee2 s PHE 109 Cb -0.11 -1.82 0.03 0.00 0.51 0.00 0.00 43.02 41.63 2ee2 s PHE 109 CO 0.15 -0.39 0.84 0.95 0.70 0.00 0.00 175.22 177.47 2ee2 s THR 110 N 0.54 3.05 0.76 0.64 -4.23 -1.24 -4.85 115.64 110.31 2ee2 s THR 110 Ca -0.11 -0.39 -0.09 0.00 -1.18 0.00 0.00 61.69 59.91 2ee2 s THR 110 Cb -0.16 -3.19 0.07 0.00 1.34 0.00 0.00 72.50 70.55 2ee2 s THR 110 CO 0.04 -0.17 1.10 -0.54 -0.54 0.00 0.00 174.62 174.51 2ee2 s LYS 111 N -4.89 2.09 -0.69 3.99 -0.14 -1.26 -3.49 119.74 115.36 2ee2 s LYS 111 Ca 0.55 -0.06 -0.23 0.00 -1.36 0.00 0.00 55.97 54.88 2ee2 s LYS 111 Cb -0.10 -2.06 0.07 0.00 -1.68 0.00 0.00 37.83 34.06 2ee2 s LYS 111 CO 0.41 -1.41 1.01 0.15 -0.76 0.00 0.00 175.35 174.75 2ee2 s LYS 112 N -5.41 3.15 0.17 1.68 -0.14 -1.26 -0.34 119.74 117.60 2ee2 s LYS 112 Ca 0.61 -0.83 -0.21 0.00 -1.36 0.00 0.00 55.97 54.18 2ee2 s LYS 112 Cb -0.11 -4.28 -0.13 0.00 -1.68 0.00 0.00 37.83 31.63 2ee2 s LYS 112 CO 0.47 -1.85 0.36 0.00 -0.76 0.00 0.00 175.35 173.57 2ee2 n ALA 113 N 7.83 -2.47 -3.60 5.17 0.00 -1.26 -4.96 120.51 121.22 2ee2 n ALA 113 Ca -0.01 0.31 -0.07 0.00 0.00 0.00 0.00 53.44 53.67 2ee2 n ALA 113 Cb 0.46 -1.22 -0.04 0.00 0.00 0.00 0.00 19.45 18.64 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 -0.77 -0.23 0.00 0.00 1.04 -1.26 -4.95 113.70 107.53 2ee2 s SER 114 Ca 0.49 0.23 0.00 0.00 0.48 0.00 0.00 55.95 57.15 2ee2 s SER 114 Cb -0.69 0.20 0.00 0.00 0.10 0.00 0.00 66.02 65.63 2ee2 s SER 114 CO 0.44 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 175.03 2ee2 n GLY 115 N 0.56 3.89 0.23 7.32 0.00 -1.17 -4.69 105.19 111.32 2ee2 n GLY 115 Ca -0.06 -1.62 0.10 0.00 0.00 0.00 0.00 46.02 44.44 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 0.00 0.03 1.61 0.13 -2.03 -3.24 132.00 128.50 2ee2 h PRO 116 Ca 0.00 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.00 2ee2 h PRO 116 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2ee2 h PRO 116 CO 0.00 0.21 -0.67 1.03 -0.23 0.00 0.00 178.00 178.35 2ee2 h SER 117 N 0.00 0.09 -2.82 1.44 0.87 -2.07 -3.47 113.55 107.59 2ee2 h SER 117 Ca -0.00 -0.81 -0.63 0.00 -1.23 0.00 0.00 61.79 59.11 2ee2 h SER 117 Cb 0.65 -0.03 -0.16 0.00 -0.44 0.00 0.00 62.40 62.43 2ee2 h SER 117 CO 0.03 1.27 -0.77 -0.94 -0.53 0.00 0.00 176.83 175.89 2ee2 s SER 118 N -6.59 3.75 0.00 6.23 1.04 -1.22 -5.19 113.70 111.72 2ee2 s SER 118 Ca -0.22 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.38 2ee2 s SER 118 Cb 0.01 -0.42 0.00 0.00 0.10 0.00 0.00 66.02 65.71 2ee2 s SER 118 CO 0.68 0.09 0.00 0.61 0.98 0.00 0.00 173.24 175.59