#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 -1.66 -4.28 1.61 3.41 -1.26 -4.92 113.62 106.52 2ysx n SER 2 Ca 0.00 -1.18 -0.20 0.00 -0.26 0.00 0.00 58.87 57.23 2ysx n SER 2 Cb 0.00 -1.97 -0.11 0.00 -0.26 0.00 0.00 64.21 61.86 2ysx n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2ysx s SER 3 N -3.51 2.33 0.00 4.04 0.01 -1.26 -5.08 113.70 110.23 2ysx s SER 3 Ca 0.63 -0.81 0.00 0.00 1.31 0.00 0.00 55.95 57.07 2ysx s SER 3 Cb -0.36 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 65.76 2ysx s SER 3 CO 0.99 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 175.17 2ysx n GLY 4 N 0.51 0.50 2.94 3.44 0.00 -1.26 -5.06 105.19 106.26 2ysx n GLY 4 Ca -0.15 -1.24 -0.28 0.00 0.00 0.00 0.00 46.02 44.35 2ysx n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ysx s SER 5 N -4.00 2.36 0.13 1.61 0.01 -1.26 -5.12 113.70 107.42 2ysx s SER 5 Ca 0.00 -0.37 -0.19 0.00 1.31 0.00 0.00 55.95 56.70 2ysx s SER 5 Cb 0.00 -0.96 0.05 0.00 0.21 0.00 0.00 66.02 65.32 2ysx s SER 5 CO 0.00 -0.10 0.49 -0.94 0.41 0.00 0.00 173.24 173.10 2ysx s SER 6 N 1.63 -0.39 0.00 2.44 1.04 -1.26 -5.15 113.70 112.02 2ysx s SER 6 Ca 0.05 -0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.35 2ysx s SER 6 Cb -0.13 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.52 2ysx s SER 6 CO -0.09 -0.87 0.00 0.61 0.98 0.00 0.00 173.24 173.86 2ysx n GLY 7 N -0.19 -0.96 3.66 7.32 0.00 -1.26 -4.84 105.19 108.93 2ysx n GLY 7 Ca -0.17 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 2ysx n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ysx s MET 8 N -1.15 4.14 0.05 1.61 1.00 -1.26 -4.98 119.30 118.71 2ysx s MET 8 Ca 0.00 2.59 0.05 0.00 0.00 0.00 0.00 55.69 58.33 2ysx s MET 8 Cb 0.00 -4.09 -0.02 0.00 0.00 0.00 0.00 34.83 30.72 2ysx s MET 8 CO 0.00 -0.94 -0.15 0.14 0.00 0.00 0.00 175.02 174.07 2ysx s VAL 9 N 4.24 1.19 -0.41 -6.03 -7.23 -1.26 -5.10 120.40 105.81 2ysx s VAL 9 Ca 0.87 -1.12 -0.28 0.00 -1.81 0.00 0.00 61.98 59.64 2ysx s VAL 9 Cb -0.42 -1.09 -0.01 0.00 0.56 0.00 0.00 36.38 35.41 2ysx s VAL 9 CO 0.40 -0.04 1.73 -2.16 -0.31 0.00 0.00 175.10 174.73 2ysx s PRO 10 N -1.33 3.24 -0.37 4.82 0.04 -1.26 -4.86 135.00 135.27 2ysx s PRO 10 Ca 0.01 1.16 0.06 0.00 0.04 0.00 0.00 61.00 62.27 2ysx s PRO 10 Cb -0.09 -4.20 0.47 0.00 0.04 0.00 0.00 34.50 30.72 2ysx s PRO 10 CO 0.02 -1.98 1.43 0.00 0.04 0.00 0.00 177.00 176.50 2ysx n TRP 12 N -0.85 0.00 -2.52 0.00 4.27 -1.26 -2.85 117.44 114.23 2ysx n TRP 12 Ca 0.45 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.63 2ysx n TRP 12 Cb 0.90 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.85 2ysx n TRP 12 CO 0.00 0.00 0.00 -1.71 -2.29 0.00 0.00 177.69 173.69 2ysx n ASN 13 N -0.61 4.85 0.22 -0.67 2.85 -1.25 -0.26 115.26 120.39 2ysx n ASN 13 Ca 0.03 -2.92 -0.14 0.00 -0.11 0.00 0.00 54.58 51.44 2ysx n ASN 13 Cb 0.18 -1.70 -0.08 0.00 1.24 0.00 0.00 39.78 39.42 2ysx n ASN 13 CO 0.00 0.00 0.00 0.45 -2.11 0.00 0.00 177.26 175.60 2ysx h HIS 14 N 7.24 -0.52 0.00 1.20 3.86 -1.49 -3.49 115.15 121.95 2ysx h HIS 14 Ca 0.44 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.64 2ysx h HIS 14 Cb 0.83 0.17 0.00 0.00 1.06 0.00 0.00 27.41 29.48 2ysx h HIS 14 CO 1.38 -0.20 0.00 0.41 0.86 0.00 0.00 177.93 180.37 2ysx n GLY 15 N -0.47 0.25 3.55 2.45 0.00 -1.24 -4.91 105.19 104.82 2ysx n GLY 15 Ca -0.10 -1.90 -0.39 0.00 0.00 0.00 0.00 46.02 43.62 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 5.83 0.11 1.61 4.22 -1.26 -0.65 114.94 120.79 2ysx s ASN 16 Ca 0.00 -0.28 0.06 0.00 -2.14 0.00 0.00 52.86 50.50 2ysx s ASN 16 Cb 0.00 -2.55 -0.04 0.00 1.28 0.00 0.00 41.25 39.94 2ysx s ASN 16 CO 0.00 -2.04 -0.14 0.27 -2.04 0.00 0.00 177.10 173.14 2ysx s ILE 17 N 7.04 1.28 0.57 0.54 -4.36 -1.26 -5.01 121.20 120.01 2ysx s ILE 17 Ca 0.49 -1.60 -0.21 0.00 -0.26 0.00 0.00 60.65 59.07 2ysx s ILE 17 Cb -0.09 -1.41 -0.04 0.00 1.25 0.00 0.00 42.46 42.17 2ysx s ILE 17 CO 0.14 -0.35 1.35 0.28 0.24 0.00 0.00 174.94 176.60 2ysx s THR 18 N -1.87 2.03 0.06 8.37 -1.32 -1.26 -4.85 115.64 116.79 2ysx s THR 18 Ca 0.06 0.02 -0.15 0.00 -1.21 0.00 0.00 61.69 60.41 2ysx s THR 18 Cb -0.06 -3.01 -0.05 0.00 -1.51 0.00 0.00 72.50 67.86 2ysx s THR 18 CO 0.03 -0.00 1.24 -0.09 -2.21 0.00 0.00 174.62 173.59 2ysx h ARG 19 N 1.26 -0.20 -0.40 7.08 9.65 -2.01 -2.66 114.38 127.09 2ysx h ARG 19 Ca -0.51 0.01 0.04 0.00 -1.10 0.00 0.00 59.98 58.42 2ysx h ARG 19 Cb 1.31 0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 29.89 2ysx h ARG 19 CO 0.56 -0.13 -0.24 0.43 2.80 0.00 0.00 179.97 183.39 2ysx n SER 20 N -3.86 -0.43 -0.20 -3.80 7.64 -1.26 -0.94 113.62 110.77 2ysx n SER 20 Ca -0.02 1.12 -0.05 0.00 1.01 0.00 0.00 58.87 60.92 2ysx n SER 20 Cb 0.16 -0.29 -0.05 0.00 -1.01 0.00 0.00 64.21 63.02 2ysx n SER 20 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2ysx n LYS 21 N -3.91 -0.21 -0.30 1.43 3.00 -1.02 0.60 118.16 117.75 2ysx n LYS 21 Ca 0.01 1.04 0.07 0.00 -0.00 0.00 0.00 58.31 59.43 2ysx n LYS 21 Cb 0.11 -1.53 0.16 0.00 0.00 0.00 0.00 35.03 33.76 2ysx n LYS 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2ysx n ALA 22 N -3.15 0.27 -0.03 3.14 0.00 -0.12 0.27 120.51 120.89 2ysx n ALA 22 Ca 0.01 0.93 -0.13 0.00 0.00 0.00 0.00 53.44 54.25 2ysx n ALA 22 Cb 0.12 -0.59 -0.09 0.00 0.00 0.00 0.00 19.45 18.89 2ysx n ALA 22 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2ysx h GLU 23 N 0.00 0.12 -0.24 0.00 5.08 0.37 -3.29 114.58 116.62 2ysx h GLU 23 Ca 0.44 -0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.80 2ysx h GLU 23 Cb 0.75 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.93 2ysx h GLU 23 CO -0.86 0.59 -0.30 1.49 -1.00 0.00 0.00 179.01 178.93 2ysx h GLU 24 N -0.35 -0.30 -0.99 2.33 4.57 0.29 0.40 114.58 120.53 2ysx h GLU 24 Ca 0.01 0.02 0.37 0.00 -1.18 0.00 0.00 59.36 58.58 2ysx h GLU 24 Cb 0.57 0.07 -0.17 0.00 -0.16 0.00 0.00 28.75 29.05 2ysx h GLU 24 CO 0.01 -0.20 0.47 -0.07 -1.18 0.00 0.00 179.01 178.04 2ysx h LEU 25 N -0.31 0.25 0.01 1.64 3.38 -0.68 0.40 115.31 119.99 2ysx h LEU 25 Ca 0.13 0.25 -0.03 0.00 0.09 0.00 0.00 57.88 58.32 2ysx h LEU 25 Cb 0.52 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2ysx h LEU 25 CO -0.42 -0.36 -0.11 -0.07 0.09 0.00 0.00 178.44 177.58 2ysx h LEU 26 N 0.08 0.08 0.38 1.67 4.07 -1.17 -3.14 115.31 117.28 2ysx h LEU 26 Ca 0.78 -0.88 -0.01 0.00 0.08 0.00 0.00 57.88 57.85 2ysx h LEU 26 Cb 1.96 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 43.65 2ysx h LEU 26 CO -0.75 0.95 -0.45 -1.28 -1.08 0.00 0.00 178.44 175.84 2ysx h SER 27 N -0.79 -1.25 -0.95 -0.43 0.87 0.13 -2.07 113.55 109.06 2ysx h SER 27 Ca -0.02 0.11 0.26 0.00 -1.23 0.00 0.00 61.79 60.91 2ysx h SER 27 Cb 0.98 0.42 -0.14 0.00 -0.44 0.00 0.00 62.40 63.22 2ysx h SER 27 CO 0.02 -0.57 0.47 0.08 -0.53 0.00 0.00 176.83 176.30 2ysx h ARG 28 N -0.85 0.37 -0.35 2.24 0.11 -0.54 0.13 114.38 115.50 2ysx h ARG 28 Ca -0.05 -0.02 0.04 0.00 0.10 0.00 0.00 59.98 60.05 2ysx h ARG 28 Cb 0.75 -0.08 -0.04 0.00 1.11 0.00 0.00 29.97 31.71 2ysx h ARG 28 CO -0.09 0.25 0.13 1.15 0.10 0.00 0.00 179.97 181.51 2ysx h THR 29 N 0.39 0.91 -5.80 0.08 2.02 -1.34 -3.47 112.91 105.69 2ysx h THR 29 Ca 0.64 -0.10 -0.36 0.00 0.77 0.00 0.00 66.41 67.36 2ysx h THR 29 Cb 1.31 0.60 0.13 0.00 -1.74 0.00 0.00 68.15 68.46 2ysx h THR 29 CO -0.56 0.05 -0.79 0.61 0.37 0.00 0.00 175.52 175.20 2ysx n GLY 30 N -1.21 -0.34 3.07 2.16 0.00 0.46 -5.01 105.19 104.31 2ysx n GLY 30 Ca 0.01 0.11 -0.17 0.00 0.00 0.00 0.00 46.02 45.97 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 -5.58 0.68 -1.19 1.61 1.02 -1.26 -5.08 119.74 109.94 2ysx s LYS 31 Ca 0.01 -0.59 -0.17 0.00 0.02 0.00 0.00 55.97 55.24 2ysx s LYS 31 Cb -0.00 -0.60 0.11 0.00 -0.52 0.00 0.00 37.83 36.81 2ysx s LYS 31 CO 0.76 0.15 1.52 0.16 -0.92 0.00 0.00 175.35 177.02 2ysx s ASP 32 N -0.95 6.85 0.00 2.83 -4.77 -1.26 -3.76 116.67 115.61 2ysx s ASP 32 Ca -0.02 -2.46 0.00 0.00 -3.30 0.00 0.00 52.55 46.78 2ysx s ASP 32 Cb -0.07 -2.49 0.00 0.00 -1.09 0.00 0.00 42.92 39.27 2ysx s ASP 32 CO 0.01 -1.06 0.00 0.61 0.70 0.00 0.00 175.17 175.43 2ysx n GLY 33 N 5.16 0.00 3.86 2.12 0.00 -1.05 -5.00 105.19 110.29 2ysx n GLY 33 Ca 0.40 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 6.57 0.25 1.61 0.01 -1.21 -2.07 113.70 118.86 2ysx s SER 34 Ca 0.00 0.68 -0.15 0.00 1.31 0.00 0.00 55.95 57.79 2ysx s SER 34 Cb 0.00 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 64.09 2ysx s SER 34 CO 0.00 0.35 0.54 0.72 0.41 0.00 0.00 173.24 175.26 2ysx s PHE 35 N -1.09 0.18 0.06 2.43 -0.71 -1.24 -0.05 117.98 117.56 2ysx s PHE 35 Ca 0.20 -0.56 -0.28 0.00 -1.04 0.00 0.00 56.93 55.25 2ysx s PHE 35 Cb -0.14 0.33 0.10 0.00 -1.21 0.00 0.00 43.02 42.10 2ysx s PHE 35 CO 0.09 -1.04 1.15 -0.48 -1.34 0.00 0.00 175.22 173.60 2ysx s LEU 36 N -2.98 -0.11 -0.10 -1.99 0.05 -1.08 -2.22 118.68 110.25 2ysx s LEU 36 Ca 0.18 -0.25 -0.01 0.00 0.05 0.00 0.00 54.13 54.10 2ysx s LEU 36 Cb -0.02 1.71 0.03 0.00 -2.05 0.00 0.00 46.19 45.86 2ysx s LEU 36 CO 0.07 -0.55 -0.05 -0.69 -0.55 0.00 0.00 176.35 174.57 2ysx s VAL 37 N -2.79 0.82 0.23 1.48 1.01 0.64 -1.72 120.40 120.08 2ysx s VAL 37 Ca 0.13 -0.16 0.10 0.00 0.00 0.00 0.00 61.98 62.05 2ysx s VAL 37 Cb 0.02 -0.89 -0.05 0.00 0.00 0.00 0.00 36.38 35.47 2ysx s VAL 37 CO -0.01 0.33 -0.18 0.00 0.00 0.00 0.00 175.10 175.24 2ysx s ARG 38 N 1.79 1.49 0.43 2.72 1.70 -0.32 -1.24 118.95 125.51 2ysx s ARG 38 Ca 0.05 -1.64 -0.22 0.00 -0.47 0.00 0.00 55.73 53.44 2ysx s ARG 38 Cb -0.12 -1.47 -0.09 0.00 -0.57 0.00 0.00 34.95 32.69 2ysx s ARG 38 CO -0.07 0.27 1.04 0.00 -1.08 0.00 0.00 175.30 175.46 2ysx s ALA 39 N -2.58 3.00 0.92 7.88 0.00 0.17 0.42 121.76 131.58 2ysx s ALA 39 Ca 0.25 0.65 -0.12 0.00 0.00 0.00 0.00 51.96 52.74 2ysx s ALA 39 Cb -0.04 -3.26 0.14 0.00 0.00 0.00 0.00 23.12 19.97 2ysx s ALA 39 CO 0.10 -0.24 1.11 0.45 0.00 0.00 0.00 175.76 177.18 2ysx s SER 40 N -1.75 3.32 -0.29 0.00 0.15 -0.90 -4.63 113.70 109.61 2ysx s SER 40 Ca 0.62 1.18 -0.28 0.00 0.70 0.00 0.00 55.95 58.17 2ysx s SER 40 Cb -0.19 -1.83 -0.05 0.00 -1.71 0.00 0.00 66.02 62.24 2ysx s SER 40 CO 0.24 -2.69 2.21 -1.61 1.20 0.00 0.00 173.24 172.58 2ysx s GLU 41 N -5.09 2.94 -1.20 5.44 2.02 -1.26 -2.19 118.70 119.36 2ysx s GLU 41 Ca 0.64 1.82 -0.05 0.00 0.02 0.00 0.00 54.97 57.40 2ysx s GLU 41 Cb -0.17 -4.40 0.04 0.00 0.10 0.00 0.00 34.13 29.71 2ysx s GLU 41 CO 0.56 -2.32 0.32 0.45 0.02 0.00 0.00 175.26 174.28 2ysx n SER 42 N 12.38 -3.93 -3.47 -0.19 2.88 -1.26 -4.92 113.62 115.11 2ysx n SER 42 Ca 0.30 -0.15 -0.19 0.00 -1.33 0.00 0.00 58.87 57.50 2ysx n SER 42 Cb 0.47 -3.28 -0.12 0.00 -0.75 0.00 0.00 64.21 60.53 2ysx n SER 42 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2ysx s ILE 43 N -2.82 -0.32 -0.10 2.46 1.01 -0.93 -5.03 121.20 115.46 2ysx s ILE 43 Ca 0.24 -0.32 -0.20 0.00 0.00 0.00 0.00 60.65 60.37 2ysx s ILE 43 Cb -0.12 -0.82 -0.17 0.00 0.01 0.00 0.00 42.46 41.36 2ysx s ILE 43 CO 0.30 -0.36 0.63 0.28 0.00 0.00 0.00 174.94 175.78 2ysx h SER 44 N 8.31 -0.04 -1.30 3.58 0.02 -1.91 -2.38 113.55 119.82 2ysx h SER 44 Ca -0.16 -0.58 0.43 0.00 -0.84 0.00 0.00 61.79 60.64 2ysx h SER 44 Cb 1.11 0.01 -0.11 0.00 0.14 0.00 0.00 62.40 63.55 2ysx h SER 44 CO 0.32 0.71 0.86 0.54 -1.14 0.00 0.00 176.83 178.12 2ysx n ARG 45 N -4.73 -0.03 -3.46 3.45 1.74 -1.26 -4.30 116.66 108.06 2ysx n ARG 45 Ca -0.07 1.06 -0.19 0.00 -0.77 0.00 0.00 57.85 57.88 2ysx n ARG 45 Cb 0.30 -2.15 -0.00 0.00 -1.02 0.00 0.00 32.46 29.59 2ysx n ARG 45 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ysx s ALA 46 N -4.95 4.24 0.28 7.54 0.00 -1.24 -4.21 121.76 123.42 2ysx s ALA 46 Ca -0.06 -1.48 -0.03 0.00 0.00 0.00 0.00 51.96 50.39 2ysx s ALA 46 Cb 0.26 -1.66 -0.02 0.00 0.00 0.00 0.00 23.12 21.71 2ysx s ALA 46 CO 0.72 -0.04 0.35 0.71 0.00 0.00 0.00 175.76 177.51 2ysx s TYR 47 N -2.19 1.03 -0.12 0.00 2.02 -0.93 -3.42 117.35 113.75 2ysx s TYR 47 Ca 0.45 -1.24 -0.02 0.00 -0.37 0.00 0.00 57.07 55.89 2ysx s TYR 47 Cb -0.09 -0.24 0.04 0.00 -0.40 0.00 0.00 41.96 41.26 2ysx s TYR 47 CO 0.31 -0.93 0.01 0.00 -1.57 0.00 0.00 175.55 173.37 2ysx s ALA 48 N -3.64 0.85 -0.49 3.71 0.00 0.17 -0.17 121.76 122.19 2ysx s ALA 48 Ca 0.32 -0.36 -0.14 0.00 0.00 0.00 0.00 51.96 51.78 2ysx s ALA 48 Cb 0.02 -0.92 0.10 0.00 0.00 0.00 0.00 23.12 22.32 2ysx s ALA 48 CO 0.16 -0.72 0.42 -1.17 0.00 0.00 0.00 175.76 174.45 2ysx s LEU 49 N 1.92 5.81 0.51 0.00 2.96 -1.16 -1.18 118.68 127.54 2ysx s LEU 49 Ca 0.03 -1.59 -0.06 0.00 -0.22 0.00 0.00 54.13 52.28 2ysx s LEU 49 Cb -0.14 -2.16 -0.04 0.00 0.50 0.00 0.00 46.19 44.36 2ysx s LEU 49 CO -0.06 -0.73 0.83 0.00 -1.32 0.00 0.00 176.35 175.07 2ysx s VAL 51 N -2.83 -0.00 -0.25 0.00 1.01 -1.22 -2.65 120.40 114.46 2ysx s VAL 51 Ca 0.49 0.02 -0.04 0.00 0.00 0.00 0.00 61.98 62.45 2ysx s VAL 51 Cb -0.10 -0.83 0.01 0.00 0.00 0.00 0.00 36.38 35.46 2ysx s VAL 51 CO 0.46 0.01 -0.01 -0.22 0.00 0.00 0.00 175.10 175.34 2ysx s LEU 52 N 0.82 3.30 0.04 3.92 2.96 0.93 -2.05 118.68 128.59 2ysx s LEU 52 Ca -0.04 -0.69 0.00 0.00 -0.22 0.00 0.00 54.13 53.18 2ysx s LEU 52 Cb -0.05 -1.75 0.00 0.00 0.50 0.00 0.00 46.19 44.89 2ysx s LEU 52 CO -0.07 -0.12 0.00 0.00 -1.32 0.00 0.00 176.35 174.85 2ysx n TYR 53 N 4.76 -0.22 -3.70 5.38 9.36 -1.24 -2.52 117.16 128.98 2ysx n TYR 53 Ca -0.16 0.04 -0.28 0.00 3.32 0.00 0.00 57.90 60.82 2ysx n TYR 53 Cb 0.48 0.23 -0.12 0.00 -0.63 0.00 0.00 39.34 39.31 2ysx n TYR 53 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2ysx s ARG 54 N -2.00 1.72 -0.67 2.98 1.81 -1.26 -4.88 118.95 116.65 2ysx s ARG 54 Ca 0.00 -2.68 -0.09 0.00 -1.72 0.00 0.00 55.73 51.25 2ysx s ARG 54 Cb 0.00 -2.56 0.09 0.00 -0.45 0.00 0.00 34.95 32.02 2ysx s ARG 54 CO 0.00 -1.29 0.21 0.09 -0.68 0.00 0.00 175.30 173.63 2ysx n ASN 55 N 2.58 -1.09 -3.92 0.23 4.13 -1.26 -4.83 115.26 111.10 2ysx n ASN 55 Ca 0.21 -0.23 -0.09 0.00 1.68 0.00 0.00 54.58 56.15 2ysx n ASN 55 Cb 0.39 -1.01 -0.08 0.00 -1.54 0.00 0.00 39.78 37.54 2ysx n ASN 55 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2ysx s VAL 57 N -3.43 2.39 -0.78 0.00 1.01 -1.26 -3.68 120.40 114.66 2ysx s VAL 57 Ca 0.02 -2.31 -0.22 0.00 0.00 0.00 0.00 61.98 59.47 2ysx s VAL 57 Cb 0.03 -2.75 0.08 0.00 0.00 0.00 0.00 36.38 33.74 2ysx s VAL 57 CO -0.08 -0.61 1.10 -0.31 0.00 0.00 0.00 175.10 175.20 2ysx s TYR 58 N 0.93 2.73 0.45 5.22 2.02 -0.87 -4.81 117.35 123.01 2ysx s TYR 58 Ca 0.11 -0.75 -0.22 0.00 -0.37 0.00 0.00 57.07 55.84 2ysx s TYR 58 Cb -0.19 -4.38 -0.09 0.00 -0.40 0.00 0.00 41.96 36.90 2ysx s TYR 58 CO -0.08 -1.69 1.04 0.95 -1.57 0.00 0.00 175.55 174.20 2ysx s THR 59 N 4.01 3.77 -0.51 -0.71 -4.23 -1.26 -3.39 115.64 113.31 2ysx s THR 59 Ca 0.29 1.21 0.04 0.00 -1.18 0.00 0.00 61.69 62.05 2ysx s THR 59 Cb -0.11 -3.55 0.17 0.00 1.34 0.00 0.00 72.50 70.35 2ysx s THR 59 CO 0.03 -0.13 0.39 -0.31 -0.54 0.00 0.00 174.62 174.06 2ysx s TYR 60 N -1.84 1.96 -0.16 3.99 2.02 -0.02 -4.91 117.35 118.39 2ysx s TYR 60 Ca 0.63 -2.67 -0.38 0.00 -0.37 0.00 0.00 57.07 54.28 2ysx s TYR 60 Cb -0.19 -1.55 -0.14 0.00 -0.40 0.00 0.00 41.96 39.68 2ysx s TYR 60 CO 0.23 -0.73 1.73 2.89 -1.57 0.00 0.00 175.55 178.10 2ysx n ARG 61 N 2.57 1.51 -3.22 -0.62 1.85 -1.26 -2.98 116.66 114.51 2ysx n ARG 61 Ca 0.26 0.55 -0.45 0.00 -1.00 0.00 0.00 57.85 57.21 2ysx n ARG 61 Cb 0.43 -2.28 -0.05 0.00 -1.05 0.00 0.00 32.46 29.51 2ysx n ARG 61 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 2ysx s ILE 62 N 3.20 5.03 0.32 8.89 1.09 0.76 -2.50 121.20 137.99 2ysx s ILE 62 Ca 0.94 -1.22 -0.25 0.00 -1.10 0.00 0.00 60.65 59.01 2ysx s ILE 62 Cb -0.92 -4.40 -0.10 0.00 -1.06 0.00 0.00 42.46 35.98 2ysx s ILE 62 CO 0.58 -0.97 0.93 -0.76 -0.10 0.00 0.00 174.94 174.62 2ysx s LEU 63 N 2.11 4.32 0.69 2.97 2.01 -1.23 -2.18 118.68 127.37 2ysx s LEU 63 Ca 0.07 1.80 -0.14 0.00 0.01 0.00 0.00 54.13 55.88 2ysx s LEU 63 Cb -0.27 -4.02 0.02 0.00 0.01 0.00 0.00 46.19 41.93 2ysx s LEU 63 CO 0.05 -0.08 1.10 -2.16 1.01 0.00 0.00 176.35 176.28 2ysx s PRO 64 N -2.11 2.65 0.41 1.29 0.04 -1.26 -3.90 135.00 132.12 2ysx s PRO 64 Ca 0.50 1.32 0.08 0.00 0.04 0.00 0.00 61.00 62.94 2ysx s PRO 64 Cb -0.18 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.40 2ysx s PRO 64 CO 0.23 -1.36 0.35 1.21 0.04 0.00 0.00 177.00 177.47 2ysx s ASN 65 N -2.82 5.02 0.51 6.66 2.47 -1.03 -4.91 114.94 120.82 2ysx s ASN 65 Ca 0.65 -0.75 0.27 0.00 0.42 0.00 0.00 52.86 53.46 2ysx s ASN 65 Cb -0.19 -0.61 1.37 0.00 -1.45 0.00 0.00 41.25 40.36 2ysx s ASN 65 CO 0.46 -0.61 1.90 -0.08 -3.72 0.00 0.00 177.10 175.05 2ysx h GLU 66 N 1.09 0.10 -0.83 0.43 4.57 -1.97 0.65 114.58 118.62 2ysx h GLU 66 Ca -0.42 -0.01 -0.18 0.00 -1.18 0.00 0.00 59.36 57.58 2ysx h GLU 66 Cb 1.26 -0.02 -0.10 0.00 -0.16 0.00 0.00 28.75 29.73 2ysx h GLU 66 CO 0.59 0.07 0.22 -0.25 -1.18 0.00 0.00 179.01 178.46 2ysx n ASP 67 N -4.35 4.08 -2.88 1.04 9.92 -1.26 -4.87 116.55 118.23 2ysx n ASP 67 Ca 0.17 -2.92 -0.18 0.00 -0.53 0.00 0.00 54.79 51.34 2ysx n ASP 67 Cb 0.84 -0.69 0.00 0.00 -0.64 0.00 0.00 41.12 40.63 2ysx n ASP 67 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 2ysx n ASP 68 N -0.08 -4.18 -4.67 -2.24 8.00 0.23 -4.95 116.55 108.65 2ysx n ASP 68 Ca 0.31 -0.10 -0.24 0.00 0.71 0.00 0.00 54.79 55.47 2ysx n ASP 68 Cb 1.14 -3.49 0.11 0.00 -0.02 0.00 0.00 41.12 38.86 2ysx n ASP 68 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2ysx s LYS 69 N -5.50 1.68 -0.15 -1.24 -0.14 -1.25 -4.77 119.74 108.36 2ysx s LYS 69 Ca 0.20 -1.07 0.00 0.00 -1.36 0.00 0.00 55.97 53.74 2ysx s LYS 69 Cb -0.10 -2.32 -0.00 0.00 -1.68 0.00 0.00 37.83 33.73 2ysx s LYS 69 CO 0.24 -1.45 -0.15 -0.06 -0.76 0.00 0.00 175.35 173.17 2ysx s PHE 70 N -3.16 2.78 -0.20 3.18 0.08 -0.60 -2.47 117.98 117.59 2ysx s PHE 70 Ca 0.66 -1.01 -0.08 0.00 0.12 0.00 0.00 56.93 56.62 2ysx s PHE 70 Cb -0.05 -1.89 0.08 0.00 -0.57 0.00 0.00 43.02 40.59 2ysx s PHE 70 CO 0.44 -0.46 0.45 -0.08 -0.10 0.00 0.00 175.22 175.47 2ysx s THR 71 N 0.79 -0.47 0.27 0.64 -1.32 -1.25 -3.14 115.64 111.16 2ysx s THR 71 Ca -0.06 0.13 -0.30 0.00 -1.21 0.00 0.00 61.69 60.25 2ysx s THR 71 Cb -0.15 -0.69 -0.13 0.00 -1.51 0.00 0.00 72.50 70.02 2ysx s THR 71 CO 0.00 0.05 1.43 0.52 -2.21 0.00 0.00 174.62 174.42 2ysx n VAL 72 N 5.03 1.11 -3.41 5.08 0.31 -1.26 -3.56 118.33 121.63 2ysx n VAL 72 Ca -0.13 -0.28 -0.41 0.00 -0.01 0.00 0.00 64.34 63.51 2ysx n VAL 72 Cb 0.51 -1.59 -0.03 0.00 -0.91 0.00 0.00 33.84 31.83 2ysx n VAL 72 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2ysx n GLN 73 N 1.85 3.29 -2.66 5.55 7.27 -1.04 -4.84 117.38 126.79 2ysx n GLN 73 Ca 0.10 -4.49 -0.27 0.00 0.07 0.00 0.00 57.00 52.41 2ysx n GLN 73 Cb 0.33 -2.48 -0.02 0.00 2.41 0.00 0.00 30.24 30.48 2ysx n GLN 73 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2ysx n ALA 74 N 2.30 4.94 -3.90 1.69 0.00 -1.26 -4.71 120.51 119.57 2ysx n ALA 74 Ca 0.24 -4.48 -0.25 0.00 0.00 0.00 0.00 53.44 48.95 2ysx n ALA 74 Cb 0.38 -0.64 -0.01 0.00 0.00 0.00 0.00 19.45 19.18 2ysx n ALA 74 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2ysx n SER 75 N -0.39 -0.67 -4.28 0.00 7.64 -1.26 -4.97 113.62 109.70 2ysx n SER 75 Ca 0.36 -0.96 -0.32 0.00 1.01 0.00 0.00 58.87 58.96 2ysx n SER 75 Cb 0.55 -3.30 -0.16 0.00 -1.01 0.00 0.00 64.21 60.28 2ysx n SER 75 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2ysx s GLU 76 N -6.43 2.94 0.00 1.43 -1.05 -1.26 -5.07 118.70 109.27 2ysx s GLU 76 Ca 0.04 -0.84 0.00 0.00 -0.15 0.00 0.00 54.97 54.02 2ysx s GLU 76 Cb -0.02 -2.33 0.00 0.00 -0.44 0.00 0.00 34.13 31.34 2ysx s GLU 76 CO 0.87 0.27 0.00 0.41 0.95 0.00 0.00 175.26 177.76 2ysx n GLY 77 N 3.28 0.48 0.34 -3.83 0.00 -1.26 -4.82 105.19 99.37 2ysx n GLY 77 Ca -0.18 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.97 2ysx n GLY 77 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2ysx h VAL 78 N 0.00 0.06 -2.11 1.61 2.07 -2.05 -2.94 116.25 112.88 2ysx h VAL 78 Ca 0.00 -0.01 -0.72 0.00 0.82 0.00 0.00 66.70 66.79 2ysx h VAL 78 Cb 0.00 0.03 -0.17 0.00 -1.52 0.00 0.00 31.29 29.63 2ysx h VAL 78 CO 0.00 0.00 1.29 -0.44 0.02 0.00 0.00 177.57 178.44 2ysx s SER 79 N -5.04 6.93 -0.28 0.57 0.01 -1.26 -4.90 113.70 109.73 2ysx s SER 79 Ca -0.13 -2.67 -0.19 0.00 1.31 0.00 0.00 55.95 54.27 2ysx s SER 79 Cb 0.28 -2.42 0.12 0.00 0.21 0.00 0.00 66.02 64.22 2ysx s SER 79 CO 0.78 -0.88 0.93 -0.32 0.41 0.00 0.00 173.24 174.16 2ysx s MET 80 N 2.14 0.50 0.30 12.44 1.75 -1.11 -4.87 119.30 130.45 2ysx s MET 80 Ca 0.41 0.76 0.01 0.00 -1.25 0.00 0.00 55.69 55.62 2ysx s MET 80 Cb -0.03 0.15 -0.00 0.00 2.84 0.00 0.00 34.83 37.79 2ysx s MET 80 CO -0.02 -0.09 0.05 0.54 -0.65 0.00 0.00 175.02 174.85 2ysx n ARG 81 N 3.35 0.96 -3.74 4.11 1.74 -1.26 -5.07 116.66 116.75 2ysx n ARG 81 Ca -0.17 -2.33 -0.25 0.00 -0.77 0.00 0.00 57.85 54.33 2ysx n ARG 81 Cb 0.57 0.93 -0.17 0.00 -1.02 0.00 0.00 32.46 32.77 2ysx n ARG 81 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2ysx s PHE 82 N -2.37 0.76 -0.05 -1.55 0.40 -1.26 -4.62 117.98 109.28 2ysx s PHE 82 Ca 0.07 -0.45 0.03 0.00 -0.60 0.00 0.00 56.93 55.98 2ysx s PHE 82 Cb 0.00 -0.88 -0.03 0.00 0.51 0.00 0.00 43.02 42.63 2ysx s PHE 82 CO 0.05 -0.46 -0.14 -0.06 0.70 0.00 0.00 175.22 175.31 2ysx s PHE 83 N 1.95 2.72 0.01 0.36 0.40 -1.19 -4.90 117.98 117.33 2ysx s PHE 83 Ca 0.02 -0.15 -0.26 0.00 -0.60 0.00 0.00 56.93 55.95 2ysx s PHE 83 Cb -0.15 -1.64 -0.14 0.00 0.51 0.00 0.00 43.02 41.60 2ysx s PHE 83 CO -0.07 0.19 1.07 1.15 0.70 0.00 0.00 175.22 178.27 2ysx h THR 84 N 4.35 0.05 -3.64 0.64 2.02 -1.93 -1.59 112.91 112.81 2ysx h THR 84 Ca -0.46 -0.34 -0.51 0.00 0.77 0.00 0.00 66.41 65.87 2ysx h THR 84 Cb 1.15 0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 2ysx h THR 84 CO 0.50 0.01 0.38 -0.54 0.37 0.00 0.00 175.52 176.24 2ysx s LYS 85 N -4.56 4.74 0.35 6.66 -0.14 -1.26 -4.60 119.74 120.93 2ysx s LYS 85 Ca -0.14 1.51 0.07 0.00 -1.36 0.00 0.00 55.97 56.06 2ysx s LYS 85 Cb 0.01 -3.32 0.77 0.00 -1.68 0.00 0.00 37.83 33.61 2ysx s LYS 85 CO 0.42 0.31 1.91 1.25 -0.76 0.00 0.00 175.35 178.47 2ysx h LEU 86 N 4.94 0.68 0.28 3.17 7.12 -1.97 -2.46 115.31 127.06 2ysx h LEU 86 Ca -0.44 0.02 -0.01 0.00 0.13 0.00 0.00 57.88 57.58 2ysx h LEU 86 Cb 1.21 -0.12 0.00 0.00 -0.53 0.00 0.00 40.66 41.22 2ysx h LEU 86 CO 0.70 0.39 -0.14 -2.24 -0.13 0.00 0.00 178.44 177.03 2ysx h ASP 87 N 0.74 -0.32 -1.54 1.25 2.03 -1.97 -2.38 116.42 114.23 2ysx h ASP 87 Ca 0.39 -0.16 0.45 0.00 -0.73 0.00 0.00 57.03 56.97 2ysx h ASP 87 Cb 0.49 0.08 -0.06 0.00 -0.83 0.00 0.00 39.33 39.02 2ysx h ASP 87 CO -0.16 -0.00 1.26 1.56 -1.03 0.00 0.00 179.24 180.88 2ysx h GLN 88 N -0.67 0.00 0.00 4.15 1.08 -1.84 0.19 115.11 118.02 2ysx h GLN 88 Ca -0.04 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.14 2ysx h GLN 88 Cb 0.47 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.89 2ysx h GLN 88 CO 0.06 0.00 -0.31 1.25 -0.95 0.00 0.00 178.83 178.89 2ysx h LEU 89 N 0.00 0.00 -0.80 1.46 6.46 -1.45 -3.24 115.31 117.74 2ysx h LEU 89 Ca 0.73 -0.15 0.17 0.00 -0.12 0.00 0.00 57.88 58.51 2ysx h LEU 89 Cb 3.25 0.00 -0.11 0.00 -0.73 0.00 0.00 40.66 43.08 2ysx h LEU 89 CO -0.01 0.74 0.30 0.40 -0.62 0.00 0.00 178.44 179.25 2ysx h ILE 90 N -1.00 0.56 0.16 4.05 1.08 -0.37 -1.32 117.51 120.67 2ysx h ILE 90 Ca -0.03 -0.13 0.01 0.00 -0.39 0.00 0.00 64.86 64.31 2ysx h ILE 90 Cb 0.41 0.14 -0.02 0.00 -3.07 0.00 0.00 36.82 34.28 2ysx h ILE 90 CO -0.02 0.07 -0.20 -0.33 -0.69 0.00 0.00 178.15 176.98 2ysx h GLU 91 N 0.39 -0.40 -0.72 2.37 4.39 -0.92 -1.45 114.58 118.24 2ysx h GLU 91 Ca 0.46 0.03 0.15 0.00 0.34 0.00 0.00 59.36 60.34 2ysx h GLU 91 Cb 0.78 0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 29.48 2ysx h GLU 91 CO -0.47 -0.27 0.48 0.35 -1.16 0.00 0.00 179.01 177.94 2ysx h PHE 92 N -0.41 0.42 0.00 4.33 3.57 -1.30 0.18 116.94 123.73 2ysx h PHE 92 Ca 0.01 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.42 2ysx h PHE 92 Cb 0.41 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 2ysx h PHE 92 CO -0.17 0.16 -0.51 1.88 -2.23 0.00 0.00 178.31 177.44 2ysx h TYR 93 N 0.37 0.00 -1.02 0.41 -1.99 -0.46 -3.18 116.97 111.10 2ysx h TYR 93 Ca 0.35 0.00 0.37 0.00 2.00 0.00 0.00 58.73 61.45 2ysx h TYR 93 Cb 0.85 0.00 -0.16 0.00 2.00 0.00 0.00 36.73 39.42 2ysx h TYR 93 CO -0.00 0.51 0.57 0.87 -0.00 0.00 0.00 178.16 180.11 2ysx h LYS 94 N 0.00 0.16 -7.01 4.88 1.79 0.36 -3.40 116.57 113.35 2ysx h LYS 94 Ca -0.01 -0.01 -0.53 0.00 -2.18 0.00 0.00 60.65 57.93 2ysx h LYS 94 Cb 0.99 -0.04 0.10 0.00 -1.58 0.00 0.00 32.23 31.70 2ysx h LYS 94 CO 0.07 0.11 0.58 0.15 -1.08 0.00 0.00 179.45 179.27 2ysx s LYS 95 N -5.58 3.57 0.12 3.15 1.02 -1.20 -4.10 119.74 116.72 2ysx s LYS 95 Ca -0.09 2.08 -0.35 0.00 0.02 0.00 0.00 55.97 57.63 2ysx s LYS 95 Cb 0.32 -2.45 -0.17 0.00 -0.52 0.00 0.00 37.83 35.01 2ysx s LYS 95 CO 0.79 -0.80 1.16 -0.85 -0.92 0.00 0.00 175.35 174.73 2ysx n GLU 96 N -0.53 0.91 -3.63 1.68 0.28 -1.26 -4.88 120.64 113.22 2ysx n GLU 96 Ca 0.07 0.33 -0.05 0.00 -0.16 0.00 0.00 57.16 57.35 2ysx n GLU 96 Cb 0.45 -1.84 -0.07 0.00 1.43 0.00 0.00 31.44 31.42 2ysx n GLU 96 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 2ysx s ASN 97 N 0.07 -0.68 0.48 -1.84 3.84 -1.26 -5.02 114.94 110.53 2ysx s ASN 97 Ca 0.78 1.23 0.30 0.00 0.21 0.00 0.00 52.86 55.39 2ysx s ASN 97 Cb -0.95 1.81 1.39 0.00 -0.55 0.00 0.00 41.25 42.95 2ysx s ASN 97 CO 0.52 -0.23 1.75 -0.03 -2.79 0.00 0.00 177.10 176.31 2ysx h MET 98 N 8.09 0.15 0.00 0.43 1.85 -1.98 -3.23 114.93 120.23 2ysx h MET 98 Ca -0.17 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 58.91 2ysx h MET 98 Cb 1.11 -0.03 0.00 0.00 0.43 0.00 0.00 31.60 33.10 2ysx h MET 98 CO 0.12 0.10 0.00 0.41 -0.40 0.00 0.00 176.91 177.14 2ysx n GLY 99 N -1.64 -0.17 3.23 1.39 0.00 -1.26 -4.63 105.19 102.11 2ysx n GLY 99 Ca 0.29 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.96 2ysx n GLY 99 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ysx n LEU 100 N 0.00 -2.76 -0.23 0.99 4.77 -1.22 -4.86 117.00 113.69 2ysx n LEU 100 Ca 0.00 0.23 -0.04 0.00 -0.03 0.00 0.00 56.01 56.17 2ysx n LEU 100 Cb 0.00 -0.98 0.13 0.00 -2.33 0.00 0.00 43.42 40.24 2ysx n LEU 100 CO 0.00 -4.49 1.05 1.62 -1.33 0.00 0.00 177.39 174.24 2ysx h VAL 101 N -1.35 1.24 -2.78 4.08 3.04 -1.87 -3.45 116.25 115.16 2ysx h VAL 101 Ca -0.44 -0.76 -0.11 0.00 -1.01 0.00 0.00 66.70 64.37 2ysx h VAL 101 Cb 1.30 0.40 -0.22 0.00 -2.01 0.00 0.00 31.29 30.76 2ysx h VAL 101 CO 0.29 0.31 -0.21 0.28 -1.01 0.00 0.00 177.57 177.24 2ysx s THR 102 N -5.47 0.02 0.14 3.17 -1.32 -1.26 -5.08 115.64 105.84 2ysx s THR 102 Ca -0.11 -0.19 -0.31 0.00 -1.21 0.00 0.00 61.69 59.86 2ysx s THR 102 Cb 0.16 -0.64 -0.10 0.00 -1.51 0.00 0.00 72.50 70.42 2ysx s THR 102 CO 0.82 -0.10 1.63 -1.38 -2.21 0.00 0.00 174.62 173.37 2ysx s HIS 103 N -0.53 2.81 0.23 9.09 -3.43 -1.26 -4.90 115.29 117.29 2ysx s HIS 103 Ca -0.06 0.47 -0.30 0.00 -0.80 0.00 0.00 55.06 54.36 2ysx s HIS 103 Cb -0.04 -3.98 -0.15 0.00 -1.43 0.00 0.00 32.58 26.98 2ysx s HIS 103 CO 0.03 -3.74 1.01 1.28 -2.00 0.00 0.00 174.74 171.32 2ysx n LEU 104 N 4.51 1.29 0.12 5.38 4.77 -1.26 -4.89 117.00 126.92 2ysx n LEU 104 Ca 0.15 1.16 0.00 0.00 -0.03 0.00 0.00 56.01 57.29 2ysx n LEU 104 Cb 0.39 -1.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.26 2ysx n LEU 104 CO 0.62 -1.56 0.00 0.00 -1.33 0.00 0.00 177.39 175.12 2ysx n GLN 105 N 1.19 0.00 -3.87 3.23 6.02 -1.22 -4.89 117.38 117.84 2ysx n GLN 105 Ca 0.13 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.79 2ysx n GLN 105 Cb 0.28 -0.16 -0.13 0.00 1.02 0.00 0.00 30.24 31.25 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 -1.98 3.52 -0.98 1.08 2.02 -0.88 -5.04 117.35 115.09 2ysx s TYR 106 Ca 0.00 -2.81 -0.24 0.00 -0.37 0.00 0.00 57.07 53.65 2ysx s TYR 106 Cb 0.00 -3.05 -0.06 0.00 -0.40 0.00 0.00 41.96 38.45 2ysx s TYR 106 CO 0.00 -0.89 1.94 -1.25 -1.57 0.00 0.00 175.55 173.78 2ysx s PRO 107 N 0.52 2.54 -0.22 -1.71 0.04 -1.26 -3.58 135.00 131.33 2ysx s PRO 107 Ca 0.13 -0.53 -0.32 0.00 0.04 0.00 0.00 61.00 60.31 2ysx s PRO 107 Cb -0.22 -5.11 -0.15 0.00 0.04 0.00 0.00 34.50 29.06 2ysx s PRO 107 CO -0.04 -3.55 1.02 0.28 0.04 0.00 0.00 177.00 174.75 2ysx n VAL 108 N 7.86 0.00 -1.19 -0.36 0.31 -0.94 -4.60 118.33 119.41 2ysx n VAL 108 Ca 0.41 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.45 2ysx n VAL 108 Cb 0.47 -0.22 0.15 0.00 -0.91 0.00 0.00 33.84 33.34 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 1.30 0.89 0.83 5.55 0.04 -1.25 -4.23 135.00 138.15 2ysx s PRO 109 Ca 0.73 0.69 -0.11 0.00 0.04 0.00 0.00 61.00 62.35 2ysx s PRO 109 Cb -1.03 -1.78 0.09 0.00 0.04 0.00 0.00 34.50 31.82 2ysx s PRO 109 CO 0.53 -2.46 1.09 -0.51 0.04 0.00 0.00 177.00 175.69 2ysx s LEU 110 N -6.33 2.72 -0.42 -3.56 1.43 -1.13 -4.95 118.68 106.44 2ysx s LEU 110 Ca 0.64 1.74 0.05 0.00 -1.03 0.00 0.00 54.13 55.53 2ysx s LEU 110 Cb -0.18 -4.30 0.56 0.00 0.03 0.00 0.00 46.19 42.29 2ysx s LEU 110 CO 0.57 -2.37 1.73 -0.62 0.23 0.00 0.00 176.35 175.89 2ysx n GLU 111 N -3.73 2.28 -1.55 1.70 -0.58 -1.26 -5.03 120.64 112.46 2ysx n GLU 111 Ca 0.08 -3.21 -0.58 0.00 -0.42 0.00 0.00 57.16 53.04 2ysx n GLU 111 Cb 0.54 -2.08 -0.08 0.00 -0.57 0.00 0.00 31.44 29.25 2ysx n GLU 111 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2ysx n GLU 112 N -1.07 0.38 -4.87 3.49 1.02 -1.26 -4.95 120.64 113.37 2ysx n GLU 112 Ca 0.50 0.14 -0.26 0.00 -0.02 0.00 0.00 57.16 57.52 2ysx n GLU 112 Cb 1.23 -1.69 -0.16 0.00 -0.02 0.00 0.00 31.44 30.80 2ysx n GLU 112 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2ysx s GLU 113 N 0.49 1.72 0.30 3.49 -1.05 -1.26 -5.14 118.70 117.24 2ysx s GLU 113 Ca 0.90 -0.64 0.05 0.00 -0.15 0.00 0.00 54.97 55.13 2ysx s GLU 113 Cb -1.19 -1.54 -0.02 0.00 -0.44 0.00 0.00 34.13 30.94 2ysx s GLU 113 CO 0.56 0.30 0.43 0.34 0.95 0.00 0.00 175.26 177.85 2ysx s ASP 114 N -0.13 6.17 -0.13 0.83 2.15 -1.26 -5.11 116.67 119.18 2ysx s ASP 114 Ca -0.00 0.03 0.01 0.00 0.43 0.00 0.00 52.55 53.01 2ysx s ASP 114 Cb -0.10 -1.63 -0.01 0.00 -0.30 0.00 0.00 42.92 40.88 2ysx s ASP 114 CO 0.01 -0.26 -0.17 -0.89 -0.17 0.00 0.00 175.17 173.70 2ysx s THR 115 N -2.11 2.67 0.00 1.71 2.01 -1.26 -5.07 115.64 113.58 2ysx s THR 115 Ca 0.39 -0.79 0.00 0.00 0.31 0.00 0.00 61.69 61.60 2ysx s THR 115 Cb -0.09 -2.10 0.00 0.00 0.01 0.00 0.00 72.50 70.32 2ysx s THR 115 CO 0.31 0.53 0.00 0.61 -0.69 0.00 0.00 174.62 175.38 2ysx n GLY 116 N 3.69 0.69 3.44 4.40 0.00 -1.26 -5.09 105.19 111.07 2ysx n GLY 116 Ca -0.19 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.75 2ysx n GLY 116 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ysx s ASP 117 N -1.00 -0.71 -0.04 1.61 -1.08 -1.26 -5.16 116.67 109.03 2ysx s ASP 117 Ca 0.00 1.20 -0.09 0.00 -0.52 0.00 0.00 52.55 53.14 2ysx s ASP 117 Cb 0.00 1.18 -0.05 0.00 -1.46 0.00 0.00 42.92 42.59 2ysx s ASP 117 CO 0.00 -0.22 0.25 1.51 0.52 0.00 0.00 175.17 177.23 2ysx s ASP 118 N 1.71 6.53 0.00 -0.34 -4.77 -1.26 -5.35 116.67 113.19 2ysx s ASP 118 Ca -0.09 0.62 0.16 0.00 -3.30 0.00 0.00 52.55 49.94 2ysx s ASP 118 Cb -0.08 -2.12 0.93 0.00 -1.09 0.00 0.00 42.92 40.56 2ysx s ASP 118 CO -0.16 0.33 1.34 -0.81 0.70 0.00 0.00 175.17 176.57