#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ysx n SER 2 N 0.00 3.40 -0.08 1.61 3.41 -1.26 -4.92 113.62 115.78 2ysx n SER 2 Ca 0.00 1.08 -0.16 0.00 -0.26 0.00 0.00 58.87 59.53 2ysx n SER 2 Cb 0.00 -1.48 -0.12 0.00 -0.26 0.00 0.00 64.21 62.35 2ysx n SER 2 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2ysx h SER 3 N 6.10 0.00 0.00 4.04 0.87 -2.08 -3.49 113.55 118.99 2ysx h SER 3 Ca -0.44 -0.77 0.00 0.00 -1.23 0.00 0.00 61.79 59.35 2ysx h SER 3 Cb 1.24 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 2ysx h SER 3 CO 0.90 1.16 0.00 0.61 -0.53 0.00 0.00 176.83 178.97 2ysx n GLY 4 N 1.55 0.83 3.15 5.77 0.00 -1.26 -5.15 105.19 110.08 2ysx n GLY 4 Ca -0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 2ysx n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ysx s SER 5 N -1.30 2.49 -0.69 1.61 0.15 -1.26 -5.06 113.70 109.65 2ysx s SER 5 Ca 0.00 -0.43 -0.26 0.00 0.70 0.00 0.00 55.95 55.96 2ysx s SER 5 Cb 0.00 -1.00 -0.11 0.00 -1.71 0.00 0.00 66.02 63.20 2ysx s SER 5 CO 0.00 0.13 2.40 -0.94 1.20 0.00 0.00 173.24 176.03 2ysx s SER 6 N 0.32 4.08 0.00 5.45 1.04 -1.26 -4.67 113.70 118.65 2ysx s SER 6 Ca -0.13 0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.70 2ysx s SER 6 Cb -0.15 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.43 2ysx s SER 6 CO 0.05 -3.54 0.00 0.61 0.98 0.00 0.00 173.24 171.35 2ysx n GLY 7 N 6.54 -2.04 3.64 7.32 0.00 -1.26 -4.98 105.19 114.40 2ysx n GLY 7 Ca 0.43 -1.44 -0.27 0.00 0.00 0.00 0.00 46.02 44.74 2ysx n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2ysx s MET 8 N 0.00 2.01 -0.03 1.61 0.00 -1.26 -5.08 119.30 116.56 2ysx s MET 8 Ca 0.00 -2.05 0.04 0.00 0.00 0.00 0.00 55.69 53.68 2ysx s MET 8 Cb 0.00 -1.71 -0.00 0.00 0.00 0.00 0.00 34.83 33.11 2ysx s MET 8 CO 0.00 -0.06 -0.13 0.14 0.00 0.00 0.00 175.02 174.97 2ysx s VAL 9 N -2.68 1.11 -0.67 5.16 -7.23 -1.26 -5.09 120.40 109.75 2ysx s VAL 9 Ca 0.36 -0.56 -0.26 0.00 -1.81 0.00 0.00 61.98 59.71 2ysx s VAL 9 Cb 0.08 -0.96 -0.03 0.00 0.56 0.00 0.00 36.38 36.04 2ysx s VAL 9 CO 0.19 0.33 1.88 -2.16 -0.31 0.00 0.00 175.10 175.02 2ysx s PRO 10 N -0.03 2.61 -0.56 4.82 0.04 -1.26 -4.84 135.00 135.79 2ysx s PRO 10 Ca -0.01 0.44 0.01 0.00 0.04 0.00 0.00 61.00 61.48 2ysx s PRO 10 Cb -0.09 -4.52 0.45 0.00 0.04 0.00 0.00 34.50 30.38 2ysx s PRO 10 CO 0.01 -2.86 1.74 0.00 0.04 0.00 0.00 177.00 175.93 2ysx n TRP 12 N -0.81 0.00 -3.74 0.00 4.27 -1.26 -3.10 117.44 112.80 2ysx n TRP 12 Ca 0.56 -0.79 -0.36 0.00 -3.89 0.00 0.00 57.50 53.02 2ysx n TRP 12 Cb 0.73 -0.12 -0.10 0.00 -1.36 0.00 0.00 31.31 30.46 2ysx n TRP 12 CO 0.00 0.00 0.00 1.21 -2.29 0.00 0.00 177.69 176.61 2ysx s ASN 13 N -2.31 5.16 -0.00 -0.67 3.84 -1.26 -1.40 114.94 118.30 2ysx s ASN 13 Ca 0.23 -2.93 -0.25 0.00 0.21 0.00 0.00 52.86 50.12 2ysx s ASN 13 Cb 0.20 -1.83 -0.17 0.00 -0.55 0.00 0.00 41.25 38.89 2ysx s ASN 13 CO 0.02 -0.34 1.24 0.45 -2.79 0.00 0.00 177.10 175.68 2ysx h HIS 14 N 6.90 -0.23 0.00 0.43 3.86 -1.86 -3.50 115.15 120.75 2ysx h HIS 14 Ca -0.01 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 2ysx h HIS 14 Cb 0.94 0.08 0.00 0.00 1.06 0.00 0.00 27.41 29.48 2ysx h HIS 14 CO 0.70 0.13 0.00 0.41 0.86 0.00 0.00 177.93 180.03 2ysx n GLY 15 N -0.11 0.28 3.56 2.45 0.00 -1.26 -4.89 105.19 105.22 2ysx n GLY 15 Ca -0.09 -1.88 -0.29 0.00 0.00 0.00 0.00 46.02 43.77 2ysx n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ysx s ASN 16 N -4.00 5.23 0.05 1.61 2.20 -1.26 -1.54 114.94 117.23 2ysx s ASN 16 Ca 0.00 -0.62 0.08 0.00 -0.94 0.00 0.00 52.86 51.39 2ysx s ASN 16 Cb 0.00 -2.56 -0.03 0.00 -2.00 0.00 0.00 41.25 36.67 2ysx s ASN 16 CO 0.00 -2.64 -0.23 0.27 -2.94 0.00 0.00 177.10 171.56 2ysx s ILE 17 N 9.71 1.87 0.48 0.54 -4.36 -1.26 -5.02 121.20 123.16 2ysx s ILE 17 Ca 0.68 -1.30 -0.24 0.00 -0.26 0.00 0.00 60.65 59.53 2ysx s ILE 17 Cb -0.07 -1.62 -0.07 0.00 1.25 0.00 0.00 42.46 41.95 2ysx s ILE 17 CO 0.01 0.25 1.34 0.28 0.24 0.00 0.00 174.94 177.06 2ysx s THR 18 N -0.82 2.33 0.19 8.37 -1.32 -1.26 -4.81 115.64 118.32 2ysx s THR 18 Ca 0.09 0.27 -0.22 0.00 -1.21 0.00 0.00 61.69 60.62 2ysx s THR 18 Cb -0.09 -3.15 0.11 0.00 -1.51 0.00 0.00 72.50 67.86 2ysx s THR 18 CO 0.02 0.02 1.57 -0.09 -2.21 0.00 0.00 174.62 173.93 2ysx h ARG 19 N 2.03 -0.14 -0.99 7.08 2.43 -2.00 0.34 114.38 123.13 2ysx h ARG 19 Ca -0.50 0.01 0.37 0.00 -0.81 0.00 0.00 59.98 59.05 2ysx h ARG 19 Cb 1.27 0.03 -0.17 0.00 -0.42 0.00 0.00 29.97 30.68 2ysx h ARG 19 CO 0.60 -0.09 0.49 0.77 -1.51 0.00 0.00 179.97 180.22 2ysx h SER 20 N -0.14 0.29 0.04 -3.80 0.02 -2.00 0.42 113.55 108.38 2ysx h SER 20 Ca 0.24 0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 61.42 2ysx h SER 20 Cb 0.56 0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.35 2ysx h SER 20 CO -0.77 -0.33 -0.02 0.50 -1.14 0.00 0.00 176.83 175.06 2ysx h LYS 21 N 0.10 -0.05 -0.36 3.45 1.63 -0.66 0.35 116.57 121.03 2ysx h LYS 21 Ca 0.78 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 60.63 2ysx h LYS 21 Cb 1.94 0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 33.51 2ysx h LYS 21 CO -0.73 0.17 -0.52 0.00 -3.45 0.00 0.00 179.45 174.92 2ysx h ALA 22 N 0.68 -0.76 -0.08 5.00 0.00 0.13 -1.28 119.26 122.95 2ysx h ALA 22 Ca -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2ysx h ALA 22 Cb 0.25 1.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 2ysx h ALA 22 CO 0.01 -1.00 -0.01 0.93 0.00 0.00 0.00 179.25 179.18 2ysx h GLU 23 N -0.38 0.16 -0.70 0.00 5.08 -1.50 -3.22 114.58 114.02 2ysx h GLU 23 Ca 0.06 -0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 2ysx h GLU 23 Cb 0.56 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.71 2ysx h GLU 23 CO -0.54 0.46 -0.41 -1.91 -1.00 0.00 0.00 179.01 175.61 2ysx n GLU 24 N -4.80 -0.31 -0.16 2.33 2.13 0.12 -0.21 120.64 119.74 2ysx n GLU 24 Ca -0.07 1.27 -0.06 0.00 0.66 0.00 0.00 57.16 58.96 2ysx n GLU 24 Cb 0.22 -1.87 0.00 0.00 0.27 0.00 0.00 31.44 30.07 2ysx n GLU 24 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 2ysx h LEU 25 N 0.00 -1.02 0.21 4.31 3.38 -1.31 0.33 115.31 121.22 2ysx h LEU 25 Ca 0.11 0.20 0.01 0.00 0.09 0.00 0.00 57.88 58.29 2ysx h LEU 25 Cb 0.29 0.50 -0.04 0.00 0.09 0.00 0.00 40.66 41.50 2ysx h LEU 25 CO -0.66 -0.30 -0.39 -0.07 0.09 0.00 0.00 178.44 177.12 2ysx h LEU 26 N -0.19 -1.11 -0.37 1.67 3.38 -0.69 -0.89 115.31 117.11 2ysx h LEU 26 Ca 0.21 0.11 0.08 0.00 0.09 0.00 0.00 57.88 58.37 2ysx h LEU 26 Cb 0.53 0.40 -0.09 0.00 0.09 0.00 0.00 40.66 41.59 2ysx h LEU 26 CO -0.59 -0.49 -0.30 -1.28 0.09 0.00 0.00 178.44 175.87 2ysx h SER 27 N -0.68 -0.99 0.11 -0.43 0.87 0.15 -2.14 113.55 110.45 2ysx h SER 27 Ca 0.00 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 2ysx h SER 27 Cb 0.67 0.47 -0.02 0.00 -0.44 0.00 0.00 62.40 63.08 2ysx h SER 27 CO -0.17 -0.31 -0.23 0.03 -0.53 0.00 0.00 176.83 175.63 2ysx h ARG 28 N -0.24 -0.35 -0.84 2.24 3.08 -0.66 -2.35 114.38 115.26 2ysx h ARG 28 Ca 0.17 0.02 0.22 0.00 0.07 0.00 0.00 59.98 60.47 2ysx h ARG 28 Cb 0.52 0.08 -0.16 0.00 0.08 0.00 0.00 29.97 30.49 2ysx h ARG 28 CO -0.50 -0.23 -0.02 2.41 -1.07 0.00 0.00 179.97 180.55 2ysx n THR 29 N -3.73 -0.35 -3.78 2.04 -1.04 -0.37 -4.78 114.28 102.28 2ysx n THR 29 Ca -0.04 1.86 -0.26 0.00 -2.04 0.00 0.00 64.05 63.57 2ysx n THR 29 Cb 0.19 -2.70 0.04 0.00 -1.82 0.00 0.00 70.33 66.04 2ysx n THR 29 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ysx n GLY 30 N -1.44 -0.43 3.54 3.41 0.00 -0.83 -4.99 105.19 104.45 2ysx n GLY 30 Ca 0.19 0.18 -0.25 0.00 0.00 0.00 0.00 46.02 46.14 2ysx n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ysx s LYS 31 N -6.32 1.86 -0.68 1.61 1.02 -1.26 -5.10 119.74 110.87 2ysx s LYS 31 Ca 0.42 -1.79 -0.15 0.00 0.02 0.00 0.00 55.97 54.47 2ysx s LYS 31 Cb -0.20 -1.81 0.17 0.00 -0.52 0.00 0.00 37.83 35.47 2ysx s LYS 31 CO 0.81 0.23 0.63 -0.51 -0.92 0.00 0.00 175.35 175.59 2ysx s ASP 32 N -3.60 6.47 0.00 2.83 1.01 -1.26 -4.30 116.67 117.83 2ysx s ASP 32 Ca 0.32 -2.23 0.00 0.00 0.71 0.00 0.00 52.55 51.34 2ysx s ASP 32 Cb -0.02 -2.21 0.00 0.00 1.01 0.00 0.00 42.92 41.70 2ysx s ASP 32 CO 0.17 -0.72 0.00 0.61 0.21 0.00 0.00 175.17 175.44 2ysx n GLY 33 N 4.62 1.14 3.87 0.21 0.00 -1.26 -4.89 105.19 108.88 2ysx n GLY 33 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 2ysx n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ysx s SER 34 N -1.44 6.59 0.20 1.61 0.01 -1.26 -1.21 113.70 118.21 2ysx s SER 34 Ca 0.00 0.72 -0.19 0.00 1.31 0.00 0.00 55.95 57.79 2ysx s SER 34 Cb 0.00 -2.15 0.04 0.00 0.21 0.00 0.00 66.02 64.12 2ysx s SER 34 CO 0.00 0.18 0.56 0.72 0.41 0.00 0.00 173.24 175.11 2ysx s PHE 35 N -1.39 -0.22 0.13 2.43 -0.71 -1.18 -1.27 117.98 115.77 2ysx s PHE 35 Ca 0.32 -0.11 -0.24 0.00 -1.04 0.00 0.00 56.93 55.86 2ysx s PHE 35 Cb -0.14 0.46 0.07 0.00 -1.21 0.00 0.00 43.02 42.21 2ysx s PHE 35 CO 0.18 -0.93 0.68 -0.48 -1.34 0.00 0.00 175.22 173.32 2ysx s LEU 36 N -2.85 -0.50 -0.25 -1.99 0.05 0.31 -0.91 118.68 112.55 2ysx s LEU 36 Ca 0.07 -0.04 0.03 0.00 0.05 0.00 0.00 54.13 54.24 2ysx s LEU 36 Cb -0.02 2.47 0.06 0.00 -2.05 0.00 0.00 46.19 46.65 2ysx s LEU 36 CO -0.04 -0.91 -0.11 -0.69 -0.55 0.00 0.00 176.35 174.04 2ysx s VAL 37 N -3.61 2.09 0.35 1.48 1.01 -0.49 -0.51 120.40 120.72 2ysx s VAL 37 Ca 0.03 -1.54 0.08 0.00 0.00 0.00 0.00 61.98 60.55 2ysx s VAL 37 Cb -0.01 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 2ysx s VAL 37 CO -0.11 0.01 0.15 0.00 0.00 0.00 0.00 175.10 175.15 2ysx s ARG 38 N 1.15 2.35 0.84 2.72 1.70 0.74 -2.68 118.95 125.77 2ysx s ARG 38 Ca -0.08 -1.59 -0.12 0.00 -0.47 0.00 0.00 55.73 53.47 2ysx s ARG 38 Cb -0.19 -2.15 0.18 0.00 -0.57 0.00 0.00 34.95 32.22 2ysx s ARG 38 CO -0.06 0.07 0.41 0.00 -1.08 0.00 0.00 175.30 174.65 2ysx n ALA 39 N -1.17 -2.52 -3.53 7.88 0.00 -0.59 0.20 120.51 120.79 2ysx n ALA 39 Ca -0.03 -0.73 -0.16 0.00 0.00 0.00 0.00 53.44 52.53 2ysx n ALA 39 Cb 0.62 -0.07 0.01 0.00 0.00 0.00 0.00 19.45 20.01 2ysx n ALA 39 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2ysx n SER 40 N -2.42 1.78 -4.26 0.00 3.41 -1.25 -2.96 113.62 107.93 2ysx n SER 40 Ca 0.07 -2.02 -0.35 0.00 -0.26 0.00 0.00 58.87 56.30 2ysx n SER 40 Cb 0.29 -0.08 -0.14 0.00 -0.26 0.00 0.00 64.21 64.02 2ysx n SER 40 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2ysx s GLU 41 N -3.34 3.03 -1.79 4.33 2.56 -1.26 -4.56 118.70 117.67 2ysx s GLU 41 Ca 0.22 -0.86 0.00 0.00 0.00 0.00 0.00 54.97 54.33 2ysx s GLU 41 Cb -0.02 -3.06 0.00 0.00 2.00 0.00 0.00 34.13 33.05 2ysx s GLU 41 CO 0.14 -0.35 0.00 0.43 -0.56 0.00 0.00 175.26 174.92 2ysx n SER 42 N 4.74 -5.57 -3.83 -1.70 7.64 -1.26 -4.97 113.62 108.68 2ysx n SER 42 Ca -0.17 0.12 -0.12 0.00 1.01 0.00 0.00 58.87 59.71 2ysx n SER 42 Cb 0.48 -4.66 -0.10 0.00 -1.01 0.00 0.00 64.21 58.93 2ysx n SER 42 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2ysx s ILE 43 N -2.91 0.07 -0.15 0.44 1.01 -1.26 -5.06 121.20 113.33 2ysx s ILE 43 Ca 0.00 -0.55 0.06 0.00 0.00 0.00 0.00 60.65 60.16 2ysx s ILE 43 Cb 0.00 -0.48 -0.13 0.00 0.01 0.00 0.00 42.46 41.86 2ysx s ILE 43 CO 0.00 -0.30 -0.06 -0.24 0.00 0.00 0.00 174.94 174.34 2ysx n SER 44 N 1.56 2.33 -1.85 3.58 2.88 -1.26 -4.40 113.62 116.46 2ysx n SER 44 Ca -0.21 -0.05 -0.17 0.00 -1.33 0.00 0.00 58.87 57.11 2ysx n SER 44 Cb 0.56 0.20 0.10 0.00 -0.75 0.00 0.00 64.21 64.33 2ysx n SER 44 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2ysx n ARG 45 N -2.77 1.87 -4.38 -1.46 3.00 -1.26 -4.90 116.66 106.76 2ysx n ARG 45 Ca -0.26 -2.00 -0.21 0.00 -0.00 0.00 0.00 57.85 55.38 2ysx n ARG 45 Cb 0.86 -1.78 -0.09 0.00 0.00 0.00 0.00 32.46 31.45 2ysx n ARG 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2ysx s ALA 46 N -2.22 2.26 0.26 5.13 0.00 -1.26 -2.45 121.76 123.49 2ysx s ALA 46 Ca 0.38 -1.66 -0.06 0.00 0.00 0.00 0.00 51.96 50.62 2ysx s ALA 46 Cb 0.32 1.10 0.03 0.00 0.00 0.00 0.00 23.12 24.56 2ysx s ALA 46 CO 0.06 -0.49 0.46 0.66 0.00 0.00 0.00 175.76 176.45 2ysx n TYR 47 N -0.70 -1.59 -3.57 0.00 4.01 0.24 -3.90 117.16 111.64 2ysx n TYR 47 Ca 0.00 -1.48 -0.14 0.00 -0.16 0.00 0.00 57.90 56.13 2ysx n TYR 47 Cb 0.64 0.53 -0.12 0.00 -0.31 0.00 0.00 39.34 40.09 2ysx n TYR 47 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2ysx s ALA 48 N -2.07 -0.61 -0.49 -0.72 0.00 0.13 -0.22 121.76 117.78 2ysx s ALA 48 Ca 0.16 0.79 -0.18 0.00 0.00 0.00 0.00 51.96 52.73 2ysx s ALA 48 Cb -0.02 -1.23 0.06 0.00 0.00 0.00 0.00 23.12 21.93 2ysx s ALA 48 CO 0.11 -0.90 0.54 -1.17 0.00 0.00 0.00 175.76 174.34 2ysx s LEU 49 N 2.43 5.19 -0.08 0.00 2.96 -1.10 -0.19 118.68 127.89 2ysx s LEU 49 Ca 0.04 -1.04 -0.19 0.00 -0.22 0.00 0.00 54.13 52.73 2ysx s LEU 49 Cb -0.14 -2.35 -0.05 0.00 0.50 0.00 0.00 46.19 44.16 2ysx s LEU 49 CO -0.11 -0.79 0.51 0.00 -1.32 0.00 0.00 176.35 174.64 2ysx s VAL 51 N 0.26 1.07 -0.09 0.00 1.01 -1.09 -0.53 120.40 121.03 2ysx s VAL 51 Ca 0.28 -1.22 -0.00 0.00 0.00 0.00 0.00 61.98 61.04 2ysx s VAL 51 Cb -0.16 -1.02 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 2ysx s VAL 51 CO 0.13 -0.18 -0.06 -0.22 0.00 0.00 0.00 175.10 174.77 2ysx s LEU 52 N -1.58 3.20 -0.29 3.92 2.96 -0.40 -0.21 118.68 126.28 2ysx s LEU 52 Ca -0.02 -0.04 -0.20 0.00 -0.22 0.00 0.00 54.13 53.65 2ysx s LEU 52 Cb -0.09 -1.72 0.14 0.00 0.50 0.00 0.00 46.19 45.02 2ysx s LEU 52 CO 0.02 0.31 1.01 -0.47 -1.32 0.00 0.00 176.35 175.90 2ysx s TYR 53 N -0.51 -0.52 -1.50 5.38 5.04 -0.48 -4.20 117.35 120.56 2ysx s TYR 53 Ca 0.08 1.12 -0.09 0.00 -2.44 0.00 0.00 57.07 55.74 2ysx s TYR 53 Cb -0.12 0.36 0.07 0.00 0.35 0.00 0.00 41.96 42.62 2ysx s TYR 53 CO 0.02 -0.25 0.74 0.54 -1.34 0.00 0.00 175.55 175.25 2ysx n ARG 54 N 3.05 -4.25 -3.36 4.97 5.12 -1.26 -0.35 116.66 120.57 2ysx n ARG 54 Ca -0.16 0.50 -0.24 0.00 -1.93 0.00 0.00 57.85 56.01 2ysx n ARG 54 Cb 0.57 -5.08 0.04 0.00 -1.16 0.00 0.00 32.46 26.82 2ysx n ARG 54 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2ysx n ASN 55 N -2.87 -5.57 -4.17 0.55 3.02 -1.26 -4.98 115.26 99.98 2ysx n ASN 55 Ca -0.10 -0.44 -0.11 0.00 -0.03 0.00 0.00 54.58 53.89 2ysx n ASN 55 Cb 0.59 -4.48 -0.10 0.00 -0.61 0.00 0.00 39.78 35.18 2ysx n ASN 55 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ysx s VAL 57 N -3.36 2.36 -1.05 0.00 1.01 -1.26 -1.38 120.40 116.71 2ysx s VAL 57 Ca 0.10 -1.21 -0.11 0.00 0.00 0.00 0.00 61.98 60.77 2ysx s VAL 57 Cb 0.03 -2.20 0.26 0.00 0.00 0.00 0.00 36.38 34.48 2ysx s VAL 57 CO -0.04 0.24 1.05 -0.31 0.00 0.00 0.00 175.10 176.04 2ysx s TYR 58 N 1.24 4.11 -0.45 5.22 1.51 0.70 -4.91 117.35 124.77 2ysx s TYR 58 Ca -0.01 -2.50 -0.29 0.00 -1.01 0.00 0.00 57.07 53.26 2ysx s TYR 58 Cb -0.17 -3.86 0.01 0.00 -0.11 0.00 0.00 41.96 37.83 2ysx s TYR 58 CO -0.08 -0.99 1.41 0.99 -1.11 0.00 0.00 175.55 175.77 2ysx s THR 59 N -0.77 3.89 0.65 -0.71 2.01 -1.26 -2.67 115.64 116.77 2ysx s THR 59 Ca 0.28 0.88 -0.04 0.00 0.31 0.00 0.00 61.69 63.13 2ysx s THR 59 Cb -0.10 -4.26 0.05 0.00 0.01 0.00 0.00 72.50 68.20 2ysx s THR 59 CO -0.08 -0.85 0.93 -0.31 -0.69 0.00 0.00 174.62 173.62 2ysx s TYR 60 N 5.55 2.90 -0.23 4.92 2.02 0.34 -4.91 117.35 127.95 2ysx s TYR 60 Ca 0.59 0.28 -0.02 0.00 -0.37 0.00 0.00 57.07 57.56 2ysx s TYR 60 Cb -0.13 -3.03 0.07 0.00 -0.40 0.00 0.00 41.96 38.47 2ysx s TYR 60 CO 0.31 -1.21 0.03 1.03 -1.57 0.00 0.00 175.55 174.14 2ysx s ARG 61 N -5.07 0.89 -0.65 -0.62 0.52 -1.26 -2.72 118.95 110.04 2ysx s ARG 61 Ca 0.59 -0.71 -0.18 0.00 -0.52 0.00 0.00 55.73 54.90 2ysx s ARG 61 Cb -0.11 -2.20 0.12 0.00 0.52 0.00 0.00 34.95 33.29 2ysx s ARG 61 CO 0.42 -0.71 0.74 0.42 0.02 0.00 0.00 175.30 176.19 2ysx s ILE 62 N 1.69 4.91 0.43 1.52 1.09 0.70 -3.45 121.20 128.09 2ysx s ILE 62 Ca 0.00 -1.23 -0.01 0.00 -1.10 0.00 0.00 60.65 58.31 2ysx s ILE 62 Cb -0.18 -4.51 -0.02 0.00 -1.06 0.00 0.00 42.46 36.69 2ysx s ILE 62 CO -0.12 -1.15 0.67 -0.76 -0.10 0.00 0.00 174.94 173.49 2ysx s LEU 63 N 2.38 3.75 0.68 2.97 1.02 -1.24 0.80 118.68 129.05 2ysx s LEU 63 Ca 0.14 0.53 -0.14 0.00 0.02 0.00 0.00 54.13 54.68 2ysx s LEU 63 Cb -0.21 -3.42 0.01 0.00 0.02 0.00 0.00 46.19 42.59 2ysx s LEU 63 CO 0.03 -0.54 1.11 -2.16 0.02 0.00 0.00 176.35 174.80 2ysx s PRO 64 N -4.54 2.69 0.33 1.29 0.04 -1.03 -4.08 135.00 129.71 2ysx s PRO 64 Ca 0.45 1.34 0.01 0.00 0.04 0.00 0.00 61.00 62.85 2ysx s PRO 64 Cb -0.10 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.51 2ysx s PRO 64 CO 0.39 -1.33 0.10 0.09 0.04 0.00 0.00 177.00 176.30 2ysx n ASN 65 N -2.64 2.58 0.13 6.66 3.02 -1.15 -4.95 115.26 118.92 2ysx n ASN 65 Ca 0.10 -2.32 -0.16 0.00 -0.03 0.00 0.00 54.58 52.17 2ysx n ASN 65 Cb 0.52 0.13 -0.09 0.00 -0.61 0.00 0.00 39.78 39.72 2ysx n ASN 65 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2ysx h GLU 66 N 0.00 -0.73 -1.76 3.52 4.57 -1.98 -1.15 114.58 117.04 2ysx h GLU 66 Ca -0.25 0.05 -0.09 0.00 -1.18 0.00 0.00 59.36 57.89 2ysx h GLU 66 Cb 0.80 0.17 -0.04 0.00 -0.16 0.00 0.00 28.75 29.52 2ysx h GLU 66 CO 0.40 -0.49 0.12 -0.25 -1.18 0.00 0.00 179.01 177.61 2ysx n ASP 67 N -5.49 5.37 -1.93 1.04 8.00 -1.26 -4.75 116.55 117.53 2ysx n ASP 67 Ca -0.09 -2.55 -0.06 0.00 0.71 0.00 0.00 54.79 52.80 2ysx n ASP 67 Cb 0.41 -1.04 -0.01 0.00 -0.02 0.00 0.00 41.12 40.46 2ysx n ASP 67 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2ysx n ASP 68 N 1.07 -2.04 -3.22 -2.24 8.00 -0.43 -4.89 116.55 112.79 2ysx n ASP 68 Ca 0.08 0.27 -0.19 0.00 0.71 0.00 0.00 54.79 55.66 2ysx n ASP 68 Cb 0.54 -1.95 0.15 0.00 -0.02 0.00 0.00 41.12 39.83 2ysx n ASP 68 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2ysx n LYS 69 N -2.13 -1.57 -4.69 -1.24 4.76 -1.26 -4.69 118.16 107.35 2ysx n LYS 69 Ca -0.07 -1.25 -0.27 0.00 -2.87 0.00 0.00 58.31 53.85 2ysx n LYS 69 Cb 0.40 -0.98 -0.17 0.00 -1.84 0.00 0.00 35.03 32.45 2ysx n LYS 69 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2ysx s PHE 70 N -2.63 1.75 -0.17 2.13 0.08 0.42 -2.92 117.98 116.64 2ysx s PHE 70 Ca 0.48 -0.69 -0.28 0.00 0.12 0.00 0.00 56.93 56.56 2ysx s PHE 70 Cb -0.03 -1.25 0.07 0.00 -0.57 0.00 0.00 43.02 41.25 2ysx s PHE 70 CO 0.35 -0.33 0.72 -0.08 -0.10 0.00 0.00 175.22 175.78 2ysx s THR 71 N 0.65 0.00 -0.59 0.64 -1.32 -1.26 -0.73 115.64 113.04 2ysx s THR 71 Ca -0.14 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.06 2ysx s THR 71 Cb -0.16 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 69.86 2ysx s THR 71 CO 0.04 0.00 1.17 -0.69 -2.21 0.00 0.00 174.62 172.93 2ysx s VAL 72 N -0.37 4.04 0.00 5.08 1.01 -1.26 -3.70 120.40 125.20 2ysx s VAL 72 Ca -0.05 0.81 -0.04 0.00 0.00 0.00 0.00 61.98 62.69 2ysx s VAL 72 Cb -0.03 -4.72 -0.20 0.00 0.00 0.00 0.00 36.38 31.44 2ysx s VAL 72 CO 0.05 -1.34 2.89 0.00 0.00 0.00 0.00 175.10 176.70 2ysx n GLN 73 N 8.38 1.53 -0.22 2.72 -0.00 -1.22 -4.53 117.38 124.04 2ysx n GLN 73 Ca 0.07 -0.74 0.01 0.00 -0.00 0.00 0.00 57.00 56.34 2ysx n GLN 73 Cb 0.49 -1.85 0.12 0.00 -0.00 0.00 0.00 30.24 29.00 2ysx n GLN 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2ysx h ALA 74 N 3.52 0.86 -1.88 2.61 0.00 -1.90 -3.45 119.26 119.01 2ysx h ALA 74 Ca 0.14 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 2ysx h ALA 74 Cb 1.18 0.04 -0.20 0.00 0.00 0.00 0.00 17.79 18.80 2ysx h ALA 74 CO 0.27 -0.16 0.29 -1.12 0.00 0.00 0.00 179.25 178.53 2ysx s SER 75 N -5.41 -0.58 -0.36 0.00 0.01 -1.26 -5.12 113.70 100.98 2ysx s SER 75 Ca -0.13 0.62 -0.12 0.00 1.31 0.00 0.00 55.95 57.64 2ysx s SER 75 Cb 0.18 0.47 0.01 0.00 0.21 0.00 0.00 66.02 66.88 2ysx s SER 75 CO 0.75 -0.54 0.23 -0.70 0.41 0.00 0.00 173.24 173.39 2ysx s GLU 76 N -1.19 3.16 0.00 12.44 2.12 -1.26 -4.62 118.70 129.34 2ysx s GLU 76 Ca -0.08 -0.87 0.00 0.00 0.36 0.00 0.00 54.97 54.38 2ysx s GLU 76 Cb -0.00 -3.77 0.00 0.00 0.26 0.00 0.00 34.13 30.62 2ysx s GLU 76 CO 0.07 -0.58 0.00 0.41 -0.54 0.00 0.00 175.26 174.63 2ysx n GLY 77 N 5.06 -0.14 3.93 -1.50 0.00 -1.26 -5.15 105.19 106.13 2ysx n GLY 77 Ca -0.12 0.15 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 2ysx n GLY 77 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ysx s VAL 78 N 0.00 2.30 0.73 1.61 -7.23 -1.26 -5.01 120.40 111.53 2ysx s VAL 78 Ca 0.00 -0.30 -0.17 0.00 -1.81 0.00 0.00 61.98 59.70 2ysx s VAL 78 Cb 0.00 -2.99 -0.14 0.00 0.56 0.00 0.00 36.38 33.80 2ysx s VAL 78 CO 0.00 0.00 -0.46 -1.20 -0.31 0.00 0.00 175.10 173.13 2ysx n SER 79 N -2.89 -4.71 -3.94 4.85 7.64 -1.26 -4.97 113.62 108.34 2ysx n SER 79 Ca 0.08 0.39 -0.29 0.00 1.01 0.00 0.00 58.87 60.07 2ysx n SER 79 Cb 0.60 -0.77 -0.17 0.00 -1.01 0.00 0.00 64.21 62.87 2ysx n SER 79 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2ysx s MET 80 N -1.46 1.78 -0.28 1.43 1.00 -1.26 -5.11 119.30 115.39 2ysx s MET 80 Ca 0.46 -0.49 -0.09 0.00 0.00 0.00 0.00 55.69 55.58 2ysx s MET 80 Cb -0.32 -1.95 -0.02 0.00 0.00 0.00 0.00 34.83 32.54 2ysx s MET 80 CO 0.72 -0.33 0.12 1.03 0.00 0.00 0.00 175.02 176.57 2ysx s ARG 81 N 1.59 3.53 -0.26 2.03 1.81 -1.26 -5.08 118.95 121.31 2ysx s ARG 81 Ca 0.03 -0.58 -0.10 0.00 -1.72 0.00 0.00 55.73 53.35 2ysx s ARG 81 Cb -0.14 -3.48 -0.05 0.00 -0.45 0.00 0.00 34.95 30.83 2ysx s ARG 81 CO -0.09 -0.30 0.16 -0.06 -0.68 0.00 0.00 175.30 174.33 2ysx s PHE 82 N 1.63 3.23 -0.18 -0.53 0.08 -1.26 -4.66 117.98 116.29 2ysx s PHE 82 Ca 0.05 0.08 -0.03 0.00 0.12 0.00 0.00 56.93 57.16 2ysx s PHE 82 Cb -0.16 -2.32 -0.01 0.00 -0.57 0.00 0.00 43.02 39.96 2ysx s PHE 82 CO 0.06 -0.11 -0.07 -0.06 -0.10 0.00 0.00 175.22 174.94 2ysx s PHE 83 N 1.49 2.93 0.03 0.36 0.40 0.09 -4.87 117.98 118.40 2ysx s PHE 83 Ca 0.07 -0.74 -0.22 0.00 -0.60 0.00 0.00 56.93 55.44 2ysx s PHE 83 Cb -0.15 -2.00 -0.15 0.00 0.51 0.00 0.00 43.02 41.23 2ysx s PHE 83 CO 0.08 -0.36 1.38 1.15 0.70 0.00 0.00 175.22 178.17 2ysx h THR 84 N 5.52 1.32 -3.38 0.64 2.02 -1.94 0.12 112.91 117.21 2ysx h THR 84 Ca -0.35 -1.06 -0.59 0.00 0.77 0.00 0.00 66.41 65.18 2ysx h THR 84 Cb 1.18 1.80 -0.08 0.00 -1.74 0.00 0.00 68.15 69.31 2ysx h THR 84 CO 0.59 0.30 0.19 -0.54 0.37 0.00 0.00 175.52 176.44 2ysx s LYS 85 N -4.58 4.26 0.16 6.66 -0.14 -1.26 -4.61 119.74 120.24 2ysx s LYS 85 Ca -0.15 0.75 -0.19 0.00 -1.36 0.00 0.00 55.97 55.03 2ysx s LYS 85 Cb 0.04 -3.56 0.08 0.00 -1.68 0.00 0.00 37.83 32.71 2ysx s LYS 85 CO 0.72 -0.23 1.65 1.25 -0.76 0.00 0.00 175.35 177.97 2ysx h LEU 86 N 8.07 -0.58 -0.48 3.17 7.12 -1.96 -1.70 115.31 128.96 2ysx h LEU 86 Ca -0.32 0.14 0.10 0.00 0.13 0.00 0.00 57.88 57.92 2ysx h LEU 86 Cb 1.15 0.32 -0.09 0.00 -0.53 0.00 0.00 40.66 41.50 2ysx h LEU 86 CO 0.79 -0.20 -0.11 0.44 -0.13 0.00 0.00 178.44 179.22 2ysx h ASP 87 N -0.11 -0.43 -0.31 1.25 3.32 -1.97 -2.05 116.42 116.11 2ysx h ASP 87 Ca 0.18 0.14 0.07 0.00 0.02 0.00 0.00 57.03 57.43 2ysx h ASP 87 Cb 0.38 0.29 -0.08 0.00 0.22 0.00 0.00 39.33 40.14 2ysx h ASP 87 CO -0.42 -0.15 -0.37 1.56 -1.72 0.00 0.00 179.24 178.14 2ysx h GLN 88 N 0.01 -0.32 -0.74 3.56 1.08 -1.73 -1.43 115.11 115.54 2ysx h GLN 88 Ca 0.23 0.02 0.14 0.00 -1.45 0.00 0.00 58.65 57.59 2ysx h GLN 88 Cb 0.35 0.07 -0.14 0.00 -0.05 0.00 0.00 27.48 27.71 2ysx h GLN 88 CO -0.48 -0.22 -0.27 1.25 -0.95 0.00 0.00 178.83 178.16 2ysx h LEU 89 N -0.34 -0.96 0.27 1.46 6.46 -1.03 -0.18 115.31 120.98 2ysx h LEU 89 Ca 0.14 0.24 0.00 0.00 -0.12 0.00 0.00 57.88 58.14 2ysx h LEU 89 Cb 0.57 0.55 -0.03 0.00 -0.73 0.00 0.00 40.66 41.01 2ysx h LEU 89 CO -0.50 -0.28 -0.48 0.40 -0.62 0.00 0.00 178.44 176.97 2ysx h ILE 90 N -0.06 0.00 -0.86 4.05 1.08 -1.07 -2.01 117.51 118.64 2ysx h ILE 90 Ca 0.32 0.00 0.21 0.00 -0.39 0.00 0.00 64.86 65.00 2ysx h ILE 90 Cb 0.57 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 34.19 2ysx h ILE 90 CO -0.78 0.00 0.32 -0.33 -0.69 0.00 0.00 178.15 176.67 2ysx h GLU 91 N -0.79 0.33 -0.93 2.37 5.08 -0.72 0.34 114.58 120.25 2ysx h GLU 91 Ca -0.03 -0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.42 2ysx h GLU 91 Cb 0.74 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.85 2ysx h GLU 91 CO -0.17 0.22 0.60 0.35 -1.00 0.00 0.00 179.01 179.00 2ysx h PHE 92 N 0.34 1.01 -0.32 4.33 3.04 -0.38 -1.39 116.94 123.57 2ysx h PHE 92 Ca 0.53 0.03 -0.22 0.00 3.98 0.00 0.00 57.97 62.29 2ysx h PHE 92 Cb 1.00 -0.33 -0.09 0.00 2.56 0.00 0.00 35.95 39.09 2ysx h PHE 92 CO -0.19 0.45 0.25 0.66 -2.02 0.00 0.00 178.31 177.46 2ysx n TYR 93 N -4.55 0.98 -0.12 0.41 4.01 0.12 -3.97 117.16 114.04 2ysx n TYR 93 Ca 0.16 -1.63 -0.15 0.00 -0.16 0.00 0.00 57.90 56.13 2ysx n TYR 93 Cb 0.33 -0.84 -0.13 0.00 -0.31 0.00 0.00 39.34 38.39 2ysx n TYR 93 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2ysx n LYS 94 N 0.82 0.69 -0.78 -0.72 4.76 -0.52 -3.94 118.16 118.46 2ysx n LYS 94 Ca 0.21 0.09 -0.30 0.00 -2.87 0.00 0.00 58.31 55.44 2ysx n LYS 94 Cb 0.56 -1.50 0.17 0.00 -1.84 0.00 0.00 35.03 32.42 2ysx n LYS 94 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2ysx s LYS 95 N -2.49 0.80 0.00 1.97 1.02 -1.25 -4.17 119.74 115.62 2ysx s LYS 95 Ca -0.26 1.31 0.23 0.00 0.02 0.00 0.00 55.97 57.27 2ysx s LYS 95 Cb 0.08 -1.72 0.49 0.00 -0.52 0.00 0.00 37.83 36.16 2ysx s LYS 95 CO 0.65 -2.70 1.44 -0.85 -0.92 0.00 0.00 175.35 172.97 2ysx n GLU 96 N -4.26 2.49 -1.08 1.68 0.28 -1.26 -4.38 120.64 114.11 2ysx n GLU 96 Ca 0.09 -2.26 -0.38 0.00 -0.16 0.00 0.00 57.16 54.45 2ysx n GLU 96 Cb 0.53 -1.51 -0.05 0.00 1.43 0.00 0.00 31.44 31.84 2ysx n GLU 96 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2ysx n ASN 97 N 1.43 3.11 -3.68 -1.84 4.13 -1.26 -4.28 115.26 112.87 2ysx n ASN 97 Ca 0.20 -2.60 -0.25 0.00 1.68 0.00 0.00 54.58 53.61 2ysx n ASN 97 Cb 0.59 -1.13 0.03 0.00 -1.54 0.00 0.00 39.78 37.73 2ysx n ASN 97 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 2ysx n MET 98 N 6.33 -2.96 0.00 3.52 2.81 -1.26 -4.96 117.12 120.59 2ysx n MET 98 Ca 0.48 0.56 0.00 0.00 -1.81 0.00 0.00 57.70 56.93 2ysx n MET 98 Cb 0.34 -4.76 0.00 0.00 -0.71 0.00 0.00 33.22 28.09 2ysx n MET 98 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ysx n GLY 99 N -1.63 0.12 3.43 3.03 0.00 -1.26 -5.08 105.19 103.80 2ysx n GLY 99 Ca -0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.61 2ysx n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ysx s LEU 100 N -2.99 2.01 0.56 0.99 1.43 -1.26 -4.99 118.68 114.43 2ysx s LEU 100 Ca 0.00 -1.45 0.31 0.00 -1.03 0.00 0.00 54.13 51.97 2ysx s LEU 100 Cb 0.00 -0.23 1.07 0.00 0.03 0.00 0.00 46.19 47.07 2ysx s LEU 100 CO 0.00 -0.71 1.29 0.55 0.23 0.00 0.00 176.35 177.71 2ysx n VAL 101 N -0.68 0.00 -3.64 -1.59 3.14 -1.26 -4.27 118.33 110.03 2ysx n VAL 101 Ca -0.02 1.24 -0.07 0.00 -2.96 0.00 0.00 64.34 62.53 2ysx n VAL 101 Cb 0.66 -2.18 -0.07 0.00 -1.06 0.00 0.00 33.84 31.19 2ysx n VAL 101 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 2ysx s THR 102 N -4.42 0.00 -0.08 1.55 -1.32 -1.26 -5.04 115.64 105.07 2ysx s THR 102 Ca -0.03 0.00 -0.34 0.00 -1.21 0.00 0.00 61.69 60.11 2ysx s THR 102 Cb 0.17 -1.00 -0.12 0.00 -1.51 0.00 0.00 72.50 70.04 2ysx s THR 102 CO 0.55 0.00 1.89 0.00 -2.21 0.00 0.00 174.62 174.85 2ysx n HIS 103 N 3.15 2.35 -1.66 9.09 -0.00 -1.26 -4.87 115.22 122.01 2ysx n HIS 103 Ca -0.16 -0.03 -0.45 0.00 -0.00 0.00 0.00 57.72 57.07 2ysx n HIS 103 Cb 0.57 -2.68 -0.03 0.00 -0.00 0.00 0.00 29.99 27.86 2ysx n HIS 103 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 2ysx n LEU 104 N 6.70 2.93 0.01 2.39 4.77 -1.25 -4.83 117.00 127.73 2ysx n LEU 104 Ca 0.22 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.35 2ysx n LEU 104 Cb 0.30 -1.40 0.00 0.00 -2.33 0.00 0.00 43.42 39.99 2ysx n LEU 104 CO 0.73 -0.59 -0.14 0.00 -1.33 0.00 0.00 177.39 176.06 2ysx n GLN 105 N 1.94 0.00 -3.98 3.23 6.02 -1.03 -4.90 117.38 118.66 2ysx n GLN 105 Ca 0.12 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.79 2ysx n GLN 105 Cb 0.31 -0.16 -0.14 0.00 1.02 0.00 0.00 30.24 31.27 2ysx n GLN 105 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 2ysx s TYR 106 N -2.00 3.73 -0.97 1.08 2.02 -0.35 -5.05 117.35 115.81 2ysx s TYR 106 Ca 0.00 -2.90 -0.24 0.00 -0.37 0.00 0.00 57.07 53.56 2ysx s TYR 106 Cb 0.00 -2.97 -0.06 0.00 -0.40 0.00 0.00 41.96 38.53 2ysx s TYR 106 CO 0.00 -0.95 1.94 -1.25 -1.57 0.00 0.00 175.55 173.72 2ysx s PRO 107 N 0.95 2.54 -0.77 -1.71 0.04 -1.26 -3.09 135.00 131.69 2ysx s PRO 107 Ca 0.10 -0.51 -0.21 0.00 0.04 0.00 0.00 61.00 60.42 2ysx s PRO 107 Cb -0.20 -5.11 -0.19 0.00 0.04 0.00 0.00 34.50 29.05 2ysx s PRO 107 CO -0.07 -3.54 2.00 0.28 0.04 0.00 0.00 177.00 175.71 2ysx n VAL 108 N 7.86 0.00 -1.25 -0.36 0.31 -0.08 -4.82 118.33 119.99 2ysx n VAL 108 Ca 0.41 -0.08 -0.31 0.00 -0.01 0.00 0.00 64.34 64.36 2ysx n VAL 108 Cb 0.47 -0.31 0.10 0.00 -0.91 0.00 0.00 33.84 33.19 2ysx n VAL 108 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2ysx s PRO 109 N 6.65 2.03 1.08 5.55 0.04 -1.26 -4.72 135.00 144.37 2ysx s PRO 109 Ca 1.05 1.09 -0.19 0.00 0.04 0.00 0.00 61.00 62.98 2ysx s PRO 109 Cb -0.91 -1.88 0.05 0.00 0.04 0.00 0.00 34.50 31.80 2ysx s PRO 109 CO 0.39 -1.78 -0.19 1.28 0.04 0.00 0.00 177.00 176.75 2ysx n LEU 110 N -3.60 -2.27 -3.83 -3.56 4.77 -1.18 -5.03 117.00 102.30 2ysx n LEU 110 Ca 0.09 -0.04 -0.14 0.00 -0.03 0.00 0.00 56.01 55.89 2ysx n LEU 110 Cb 0.53 -0.92 -0.15 0.00 -2.33 0.00 0.00 43.42 40.56 2ysx n LEU 110 CO 0.54 -3.17 -0.36 -0.70 -1.33 0.00 0.00 177.39 172.37 2ysx s GLU 111 N -3.23 0.03 -0.23 3.23 2.12 -1.26 -5.13 118.70 114.23 2ysx s GLU 111 Ca 0.53 0.06 0.02 0.00 0.36 0.00 0.00 54.97 55.94 2ysx s GLU 111 Cb -0.10 -0.15 0.06 0.00 0.26 0.00 0.00 34.13 34.20 2ysx s GLU 111 CO 0.67 -0.07 -0.09 -1.21 -0.54 0.00 0.00 175.26 174.02 2ysx s GLU 112 N 0.46 1.98 0.67 4.30 8.01 -1.26 -5.12 118.70 127.74 2ysx s GLU 112 Ca -0.04 -1.09 -0.13 0.00 0.01 0.00 0.00 54.97 53.72 2ysx s GLU 112 Cb -0.06 -2.66 0.00 0.00 -4.31 0.00 0.00 34.13 27.10 2ysx s GLU 112 CO -0.01 -0.54 1.08 -1.83 0.01 0.00 0.00 175.26 173.97 2ysx s GLU 113 N 1.28 2.88 0.39 1.61 -1.05 -1.26 -5.07 118.70 117.48 2ysx s GLU 113 Ca -0.06 1.19 0.04 0.00 -0.15 0.00 0.00 54.97 55.99 2ysx s GLU 113 Cb -0.19 -1.97 -0.04 0.00 -0.44 0.00 0.00 34.13 31.49 2ysx s GLU 113 CO -0.06 -1.16 0.08 0.16 0.95 0.00 0.00 175.26 175.22 2ysx s ASP 114 N -3.07 2.92 0.07 0.83 1.47 -1.26 -5.16 116.67 112.46 2ysx s ASP 114 Ca 0.63 -1.55 0.10 0.00 1.18 0.00 0.00 52.55 52.91 2ysx s ASP 114 Cb -0.17 0.24 -0.03 0.00 -0.34 0.00 0.00 42.92 42.62 2ysx s ASP 114 CO 0.46 -0.77 -0.26 0.28 0.68 0.00 0.00 175.17 175.55 2ysx s THR 115 N -3.16 2.19 0.00 2.11 -1.32 -1.26 -5.12 115.64 109.08 2ysx s THR 115 Ca 0.26 -1.48 0.00 0.00 -1.21 0.00 0.00 61.69 59.26 2ysx s THR 115 Cb 0.05 -1.88 0.00 0.00 -1.51 0.00 0.00 72.50 69.16 2ysx s THR 115 CO 0.13 0.29 0.00 0.61 -2.21 0.00 0.00 174.62 173.45 2ysx n GLY 116 N 1.54 2.66 4.03 6.08 0.00 -1.26 -5.18 105.19 113.07 2ysx n GLY 116 Ca -0.17 -0.50 -0.20 0.00 0.00 0.00 0.00 46.02 45.15 2ysx n GLY 116 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ysx s ASP 117 N 0.00 5.07 -0.19 1.61 1.11 -1.26 -5.14 116.67 117.87 2ysx s ASP 117 Ca 0.00 -0.74 -0.29 0.00 0.18 0.00 0.00 52.55 51.70 2ysx s ASP 117 Cb 0.00 0.15 0.14 0.00 1.07 0.00 0.00 42.92 44.28 2ysx s ASP 117 CO 0.00 -1.34 1.06 1.51 1.18 0.00 0.00 175.17 177.58 2ysx s ASP 118 N -4.64 -0.32 0.00 0.27 1.47 -1.26 -5.33 116.67 106.86 2ysx s ASP 118 Ca 0.62 0.39 0.16 0.00 1.18 0.00 0.00 52.55 54.89 2ysx s ASP 118 Cb -0.06 0.32 0.93 0.00 -0.34 0.00 0.00 42.92 43.77 2ysx s ASP 118 CO 0.39 -0.27 1.35 -0.81 0.68 0.00 0.00 175.17 176.51