#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ysx s SER 2 N 0.00 6.24 0.02 1.61 0.01 -1.26 -4.92 113.70 115.39 2ysx s SER 2 Ca 0.00 -2.54 -0.26 0.00 1.31 0.00 0.00 55.95 54.47 2ysx s SER 2 Cb 0.00 -2.11 -0.17 0.00 0.21 0.00 0.00 66.02 63.96 2ysx s SER 2 CO 0.00 -0.57 1.28 -1.28 0.41 0.00 0.00 173.24 173.08 2ysx h SER 3 N 7.82 -0.37 -1.69 2.44 0.87 -2.10 -3.35 113.55 117.17 2ysx h SER 3 Ca -0.00 -0.15 -0.71 0.00 -1.23 0.00 0.00 61.79 59.70 2ysx h SER 3 Cb 1.03 0.10 -0.14 0.00 -0.44 0.00 0.00 62.40 62.95 2ysx h SER 3 CO 0.79 -0.03 1.60 -0.83 -0.53 0.00 0.00 176.83 177.83 2ysx s GLY 4 N -2.65 2.04 -0.47 5.77 0.00 -1.26 -4.91 107.32 105.83 2ysx s GLY 4 Ca -0.14 -3.10 0.02 0.00 0.00 0.00 0.00 44.72 41.50 2ysx s GLY 4 CO 0.55 2.31 0.23 -0.56 0.00 0.00 0.00 173.10 175.64 2ysx s SER 5 N 3.50 4.78 -0.67 1.64 0.01 -1.26 -4.97 113.70 116.73 2ysx s SER 5 Ca 0.46 -2.59 0.03 0.00 1.31 0.00 0.00 55.95 55.16 2ysx s SER 5 Cb -0.01 -1.71 0.36 0.00 0.21 0.00 0.00 66.02 64.87 2ysx s SER 5 CO 0.01 -0.35 1.30 -1.20 0.41 0.00 0.00 173.24 173.41 2ysx n SER 6 N 3.74 5.50 0.00 2.44 7.64 -1.26 -4.99 113.62 126.69 2ysx n SER 6 Ca 0.04 -3.72 0.00 0.00 1.01 0.00 0.00 58.87 56.21 2ysx n SER 6 Cb 0.37 -0.72 0.00 0.00 -1.01 0.00 0.00 64.21 62.86 2ysx n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ysx n GLY 7 N -0.31 4.53 3.47 0.23 0.00 -1.26 -5.10 105.19 106.75 2ysx n GLY 7 Ca 0.39 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 2ysx n GLY 7 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2ysx n MET 8 N -1.35 0.64 -3.89 1.61 0.00 -1.26 -5.00 117.12 107.87 2ysx n MET 8 Ca 0.00 0.23 -0.11 0.00 -0.00 0.00 0.00 57.70 57.82 2ysx n MET 8 Cb 0.00 -1.60 -0.13 0.00 0.00 0.00 0.00 33.22 31.49 2ysx n MET 8 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 175.97 176.11 2ysx s VAL 9 N -1.51 0.02 0.40 1.12 -7.23 -1.26 -5.15 120.40 106.80 2ysx s VAL 9 Ca 0.64 -0.20 -0.25 0.00 -1.81 0.00 0.00 61.98 60.36 2ysx s VAL 9 Cb -0.56 -0.08 -0.08 0.00 0.56 0.00 0.00 36.38 36.21 2ysx s VAL 9 CO 0.57 -0.11 1.19 -2.16 -0.31 0.00 0.00 175.10 174.28 2ysx s PRO 10 N -0.32 4.04 0.00 4.82 0.04 -1.26 -4.95 135.00 137.37 2ysx s PRO 10 Ca -0.04 1.88 0.23 0.00 0.04 0.00 0.00 61.00 63.12 2ysx s PRO 10 Cb -0.02 -2.69 0.16 0.00 0.04 0.00 0.00 34.50 32.00 2ysx s PRO 10 CO -0.00 -0.34 1.19 0.00 0.04 0.00 0.00 177.00 177.88 2ysx n TRP 12 N -0.63 0.08 -3.36 0.00 4.27 -1.26 -2.55 117.44 114.00 2ysx n TRP 12 Ca 0.08 0.02 -0.39 0.00 -3.89 0.00 0.00 57.50 53.33 2ysx n TRP 12 Cb 0.40 -0.23 -0.08 0.00 -1.36 0.00 0.00 31.31 30.04 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 -3.36 6.40 -0.62 -0.67 3.84 -1.26 -1.19 114.94 118.07 2ysx s ASN 13 Ca 0.07 0.47 -0.01 0.00 0.21 0.00 0.00 52.86 53.60 2ysx s ASN 13 Cb 0.16 -2.24 0.48 0.00 -0.55 0.00 0.00 41.25 39.10 2ysx s ASN 13 CO 0.81 -0.14 2.02 1.41 -2.79 0.00 0.00 177.10 178.41 2ysx n HIS 14 N 4.84 3.17 0.00 0.43 8.25 -0.31 -4.96 115.22 126.64 2ysx n HIS 14 Ca -0.08 -2.82 0.00 0.00 -0.26 0.00 0.00 57.72 54.57 2ysx n HIS 14 Cb 0.51 -1.36 0.00 0.00 1.12 0.00 0.00 29.99 30.25 2ysx n HIS 14 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2ysx n GLY 15 N -0.93 0.78 2.86 -1.41 0.00 -1.26 -3.74 105.19 101.50 2ysx n GLY 15 Ca 0.62 0.83 -0.28 0.00 0.00 0.00 0.00 46.02 47.18 2ysx n GLY 15 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ysx s ASN 16 N -4.00 2.84 0.07 1.61 0.01 -1.26 -0.69 114.94 113.52 2ysx s ASN 16 Ca 0.00 -0.69 -0.02 0.00 -0.71 0.00 0.00 52.86 51.44 2ysx s ASN 16 Cb 0.00 -0.85 -0.04 0.00 0.41 0.00 0.00 41.25 40.77 2ysx s ASN 16 CO 0.00 -0.21 0.01 0.27 -1.51 0.00 0.00 177.10 175.66 2ysx s ILE 17 N 1.67 0.18 0.45 0.60 -4.36 -1.25 -4.99 121.20 113.51 2ysx s ILE 17 Ca 0.00 -1.78 -0.23 0.00 -0.26 0.00 0.00 60.65 58.39 2ysx s ILE 17 Cb -0.16 -1.63 -0.08 0.00 1.25 0.00 0.00 42.46 41.84 2ysx s ILE 17 CO -0.07 -0.84 1.14 0.28 0.24 0.00 0.00 174.94 175.69 2ysx s THR 18 N -3.95 3.22 0.10 8.37 -1.32 -1.26 -4.86 115.64 115.94 2ysx s THR 18 Ca 0.11 0.91 -0.19 0.00 -1.21 0.00 0.00 61.69 61.31 2ysx s THR 18 Cb 0.08 -3.46 -0.04 0.00 -1.51 0.00 0.00 72.50 67.57 2ysx s THR 18 CO -0.07 -0.02 1.29 -1.14 -2.21 0.00 0.00 174.62 172.46 2ysx n ARG 19 N -0.46 -0.26 -0.37 7.08 0.63 -1.26 -1.04 116.66 120.97 2ysx n ARG 19 Ca 0.07 1.27 -0.10 0.00 -0.92 0.00 0.00 57.85 58.17 2ysx n ARG 19 Cb 0.48 -1.87 -0.09 0.00 0.45 0.00 0.00 32.46 31.43 2ysx n ARG 19 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2ysx n SER 20 N -4.36 -0.93 -0.33 6.15 7.64 -1.26 0.05 113.62 120.58 2ysx n SER 20 Ca 0.01 1.56 0.00 0.00 1.01 0.00 0.00 58.87 61.45 2ysx n SER 20 Cb 0.16 -0.20 0.05 0.00 -1.01 0.00 0.00 64.21 63.21 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 -5.09 -0.18 -0.11 1.43 3.00 -0.21 0.24 118.16 117.25 2ysx n LYS 21 Ca 0.02 1.34 -0.09 0.00 -0.00 0.00 0.00 58.31 59.57 2ysx n LYS 21 Cb 0.23 -1.98 -0.03 0.00 0.00 0.00 0.00 35.03 33.24 2ysx n LYS 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2ysx h ALA 22 N 1.29 -0.33 0.52 3.14 0.00 -0.25 0.20 119.26 123.84 2ysx h ALA 22 Ca 0.32 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.28 2ysx h ALA 22 Cb 0.54 0.79 0.01 0.00 0.00 0.00 0.00 17.79 19.12 2ysx h ALA 22 CO -0.87 -0.81 -0.25 0.93 0.00 0.00 0.00 179.25 178.26 2ysx h GLU 23 N -0.31 -0.68 -0.97 0.00 5.08 -0.20 -2.86 114.58 114.63 2ysx h GLU 23 Ca 0.15 0.05 0.28 0.00 -1.00 0.00 0.00 59.36 58.84 2ysx h GLU 23 Cb 0.57 0.15 -0.18 0.00 0.50 0.00 0.00 28.75 29.79 2ysx h GLU 23 CO -0.53 -0.45 0.08 -1.91 -1.00 0.00 0.00 179.01 175.19 2ysx n GLU 24 N -4.68 -0.08 0.16 2.33 4.07 0.14 -1.15 120.64 121.44 2ysx n GLU 24 Ca -0.09 1.45 -0.07 0.00 -0.06 0.00 0.00 57.16 58.39 2ysx n GLU 24 Cb 0.28 -2.33 -0.04 0.00 -0.06 0.00 0.00 31.44 29.29 2ysx n GLU 24 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2ysx h LEU 25 N 0.00 -0.48 -0.74 4.31 3.38 -0.61 -3.09 115.31 118.08 2ysx h LEU 25 Ca 0.62 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.68 2ysx h LEU 25 Cb 1.33 0.14 -0.09 0.00 0.09 0.00 0.00 40.66 42.13 2ysx h LEU 25 CO -0.90 -0.29 -0.43 0.18 0.09 0.00 0.00 178.44 177.09 2ysx n LEU 26 N -3.43 -0.78 -0.29 1.67 4.77 -0.30 0.12 117.00 118.76 2ysx n LEU 26 Ca -0.06 1.43 0.27 0.00 -0.03 0.00 0.00 56.01 57.63 2ysx n LEU 26 Cb 0.19 -0.23 0.50 0.00 -2.33 0.00 0.00 43.42 41.55 2ysx n LEU 26 CO 0.13 -1.13 0.93 -0.24 -1.33 0.00 0.00 177.39 175.75 2ysx n SER 27 N -4.76 0.27 -0.01 -1.43 2.88 -0.89 -0.55 113.62 109.13 2ysx n SER 27 Ca 0.01 1.50 -0.09 0.00 -1.33 0.00 0.00 58.87 58.97 2ysx n SER 27 Cb 0.19 -0.71 -0.06 0.00 -0.75 0.00 0.00 64.21 62.88 2ysx n SER 27 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2ysx h ARG 28 N 0.00 -0.33 -0.40 -1.46 2.47 0.11 -2.72 114.38 112.05 2ysx h ARG 28 Ca 0.74 0.02 0.05 0.00 -1.26 0.00 0.00 59.98 59.54 2ysx h ARG 28 Cb 1.93 0.07 -0.08 0.00 -1.65 0.00 0.00 29.97 30.24 2ysx h ARG 28 CO -0.71 -0.22 -0.53 1.15 0.56 0.00 0.00 179.97 180.22 2ysx h THR 29 N -0.34 0.02 -3.35 2.04 2.02 -0.87 -3.46 112.91 108.97 2ysx h THR 29 Ca 0.02 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 67.04 2ysx h THR 29 Cb 0.40 0.02 0.07 0.00 -1.74 0.00 0.00 68.15 66.90 2ysx h THR 29 CO -0.26 0.00 -0.31 0.61 0.37 0.00 0.00 175.52 175.92 2ysx n GLY 30 N -1.39 0.19 3.36 2.16 0.00 -1.03 -5.05 105.19 103.43 2ysx n GLY 30 Ca -0.03 -0.25 -0.24 0.00 0.00 0.00 0.00 46.02 45.50 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 -5.04 1.33 -1.38 1.61 1.02 -1.26 -5.05 119.74 110.96 2ysx s LYS 31 Ca 0.12 -1.40 -0.10 0.00 0.02 0.00 0.00 55.97 54.61 2ysx s LYS 31 Cb -0.05 -1.54 0.09 0.00 -0.52 0.00 0.00 37.83 35.81 2ysx s LYS 31 CO 0.31 0.33 2.19 -0.25 -0.92 0.00 0.00 175.35 177.01 2ysx n ASP 32 N 0.46 5.58 0.00 2.83 9.92 -1.26 -3.71 116.55 130.37 2ysx n ASP 32 Ca -0.14 -2.97 0.00 0.00 -0.53 0.00 0.00 54.79 51.15 2ysx n ASP 32 Cb 0.56 -1.53 0.00 0.00 -0.64 0.00 0.00 41.12 39.51 2ysx n ASP 32 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2ysx n GLY 33 N 3.12 0.00 3.85 0.44 0.00 -1.20 -4.93 105.19 106.48 2ysx n GLY 33 Ca 0.51 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.18 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 6.76 0.04 1.61 0.01 -1.12 -2.09 113.70 118.91 2ysx s SER 34 Ca 0.00 0.96 -0.17 0.00 1.31 0.00 0.00 55.95 58.05 2ysx s SER 34 Cb 0.00 -2.24 0.03 0.00 0.21 0.00 0.00 66.02 64.02 2ysx s SER 34 CO 0.00 0.16 0.37 0.72 0.41 0.00 0.00 173.24 174.90 2ysx s PHE 35 N -1.38 -0.21 0.24 2.43 -0.71 -1.25 -0.33 117.98 116.76 2ysx s PHE 35 Ca 0.34 0.17 -0.19 0.00 -1.04 0.00 0.00 56.93 56.21 2ysx s PHE 35 Cb -0.15 0.17 0.02 0.00 -1.21 0.00 0.00 43.02 41.85 2ysx s PHE 35 CO 0.18 -0.53 0.63 -0.48 -1.34 0.00 0.00 175.22 173.68 2ysx s LEU 36 N -1.93 -0.13 0.10 -1.99 0.05 -0.19 -2.97 118.68 111.61 2ysx s LEU 36 Ca -0.06 -0.56 0.06 0.00 0.05 0.00 0.00 54.13 53.61 2ysx s LEU 36 Cb -0.01 2.44 -0.03 0.00 -2.05 0.00 0.00 46.19 46.53 2ysx s LEU 36 CO -0.02 -1.21 -0.14 -0.69 -0.55 0.00 0.00 176.35 173.74 2ysx s VAL 37 N -3.91 1.23 0.09 1.48 1.01 -0.34 -0.62 120.40 119.35 2ysx s VAL 37 Ca 0.11 -1.52 -0.20 0.00 0.00 0.00 0.00 61.98 60.38 2ysx s VAL 37 Cb -0.04 -1.31 0.05 0.00 0.00 0.00 0.00 36.38 35.08 2ysx s VAL 37 CO 0.03 -0.32 0.49 0.00 0.00 0.00 0.00 175.10 175.30 2ysx s ARG 38 N -2.21 1.08 -0.11 2.72 1.70 0.53 -1.16 118.95 121.50 2ysx s ARG 38 Ca 0.04 -0.43 -0.30 0.00 -0.47 0.00 0.00 55.73 54.57 2ysx s ARG 38 Cb -0.07 0.49 -0.02 0.00 -0.57 0.00 0.00 34.95 34.77 2ysx s ARG 38 CO 0.03 -0.41 1.16 0.00 -1.08 0.00 0.00 175.30 174.99 2ysx s ALA 39 N -3.10 3.54 1.34 7.88 0.00 0.13 -0.89 121.76 130.66 2ysx s ALA 39 Ca -0.02 0.49 -0.19 0.00 0.00 0.00 0.00 51.96 52.24 2ysx s ALA 39 Cb 0.00 -3.53 0.34 0.00 0.00 0.00 0.00 23.12 19.93 2ysx s ALA 39 CO -0.07 -0.86 0.96 -1.54 0.00 0.00 0.00 175.76 174.25 2ysx s SER 40 N 1.50 -0.43 0.00 0.00 1.04 -1.25 -4.63 113.70 109.93 2ysx s SER 40 Ca 0.53 1.07 0.00 0.00 0.48 0.00 0.00 55.95 58.03 2ysx s SER 40 Cb -0.22 -1.59 0.00 0.00 0.10 0.00 0.00 66.02 64.32 2ysx s SER 40 CO 0.18 -5.01 0.00 1.21 0.98 0.00 0.00 173.24 170.60 2ysx n GLU 41 N -5.42 0.00 -0.14 4.02 2.13 -1.26 -4.84 120.64 115.14 2ysx n GLU 41 Ca 0.09 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.83 2ysx n GLU 41 Cb 0.58 -0.49 -0.06 0.00 0.27 0.00 0.00 31.44 31.74 2ysx n GLU 41 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 2ysx h SER 42 N 0.00 -1.19 -3.47 4.31 0.02 -2.00 -3.39 113.55 107.82 2ysx h SER 42 Ca 0.00 0.16 -0.67 0.00 -0.84 0.00 0.00 61.79 60.45 2ysx h SER 42 Cb 0.95 0.50 -0.20 0.00 0.14 0.00 0.00 62.40 63.80 2ysx h SER 42 CO 0.00 -0.21 -0.68 -0.63 -1.14 0.00 0.00 176.83 174.17 2ysx s ILE 43 N -4.58 3.80 0.04 3.27 1.09 -1.26 -5.03 121.20 118.53 2ysx s ILE 43 Ca -0.08 -0.42 -0.28 0.00 -1.10 0.00 0.00 60.65 58.77 2ysx s ILE 43 Cb 0.06 -2.60 -0.17 0.00 -1.06 0.00 0.00 42.46 38.68 2ysx s ILE 43 CO 0.37 0.56 1.40 -1.28 -0.10 0.00 0.00 174.94 175.90 2ysx h SER 44 N 5.85 -0.52 0.00 3.58 0.87 -1.90 -3.29 113.55 118.14 2ysx h SER 44 Ca -0.41 -0.07 -0.65 0.00 -1.23 0.00 0.00 61.79 59.43 2ysx h SER 44 Cb 1.18 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.28 2ysx h SER 44 CO 0.57 -0.24 3.00 0.54 -0.53 0.00 0.00 176.83 180.17 2ysx n ARG 45 N -5.28 2.58 -3.80 2.24 1.74 -1.26 -4.80 116.66 108.08 2ysx n ARG 45 Ca -0.11 -2.21 -0.05 0.00 -0.77 0.00 0.00 57.85 54.72 2ysx n ARG 45 Cb 0.29 -3.01 -0.01 0.00 -1.02 0.00 0.00 32.46 28.71 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 3.49 -1.46 0.18 7.54 0.00 -1.24 -4.15 121.76 126.11 2ysx s ALA 46 Ca 0.53 -0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.39 2ysx s ALA 46 Cb 0.14 0.71 -0.01 0.00 0.00 0.00 0.00 23.12 23.96 2ysx s ALA 46 CO -0.03 -1.04 0.18 0.66 0.00 0.00 0.00 175.76 175.53 2ysx n TYR 47 N -0.50 -0.59 -3.72 0.00 4.01 -1.05 -3.87 117.16 111.45 2ysx n TYR 47 Ca -0.05 -1.39 -0.12 0.00 -0.16 0.00 0.00 57.90 56.18 2ysx n TYR 47 Cb 0.60 0.19 -0.10 0.00 -0.31 0.00 0.00 39.34 39.72 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 -2.55 -1.02 -0.29 -0.72 0.00 -0.07 -1.96 121.76 115.16 2ysx s ALA 48 Ca 0.19 1.33 0.02 0.00 0.00 0.00 0.00 51.96 53.50 2ysx s ALA 48 Cb 0.01 -0.79 0.08 0.00 0.00 0.00 0.00 23.12 22.41 2ysx s ALA 48 CO 0.14 -0.23 0.00 -1.17 0.00 0.00 0.00 175.76 174.50 2ysx s LEU 49 N 0.82 3.34 0.31 0.00 2.96 -1.12 -0.35 118.68 124.64 2ysx s LEU 49 Ca -0.05 -1.62 -0.18 0.00 -0.22 0.00 0.00 54.13 52.06 2ysx s LEU 49 Cb -0.06 -1.31 -0.09 0.00 0.50 0.00 0.00 46.19 45.23 2ysx s LEU 49 CO -0.06 -0.31 0.79 0.00 -1.32 0.00 0.00 176.35 175.44 2ysx s VAL 51 N -1.84 -0.07 -0.31 0.00 1.01 -0.83 -1.03 120.40 117.34 2ysx s VAL 51 Ca 0.52 0.23 -0.09 0.00 0.00 0.00 0.00 61.98 62.64 2ysx s VAL 51 Cb -0.13 -0.12 -0.01 0.00 0.00 0.00 0.00 36.38 36.12 2ysx s VAL 51 CO 0.18 0.10 0.14 -0.22 0.00 0.00 0.00 175.10 175.30 2ysx s LEU 52 N 1.22 4.05 0.07 3.92 2.96 0.55 -1.14 118.68 130.31 2ysx s LEU 52 Ca -0.08 -0.52 -0.00 0.00 -0.22 0.00 0.00 54.13 53.31 2ysx s LEU 52 Cb -0.13 -1.99 -0.00 0.00 0.50 0.00 0.00 46.19 44.57 2ysx s LEU 52 CO -0.04 -0.19 -0.00 0.00 -1.32 0.00 0.00 176.35 174.80 2ysx n TYR 53 N 4.97 0.00 -3.77 5.38 9.36 -1.20 -2.77 117.16 129.13 2ysx n TYR 53 Ca -0.14 0.00 -0.28 0.00 3.32 0.00 0.00 57.90 60.80 2ysx n TYR 53 Cb 0.49 -0.01 -0.11 0.00 -0.63 0.00 0.00 39.34 39.08 2ysx n TYR 53 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2ysx n ARG 54 N -3.25 1.56 -2.25 2.98 5.12 -1.26 -4.70 116.66 114.87 2ysx n ARG 54 Ca -0.00 -4.25 -0.06 0.00 -1.93 0.00 0.00 57.85 51.61 2ysx n ARG 54 Cb 0.01 -2.16 -0.01 0.00 -1.16 0.00 0.00 32.46 29.14 2ysx n ARG 54 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2ysx n ASN 55 N 2.04 -2.35 -4.03 0.55 5.15 -1.26 -4.89 115.26 110.47 2ysx n ASN 55 Ca 0.22 0.31 -0.11 0.00 -0.60 0.00 0.00 54.58 54.41 2ysx n ASN 55 Cb 0.38 -2.13 -0.11 0.00 -0.53 0.00 0.00 39.78 37.39 2ysx n ASN 55 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ysx s VAL 57 N -1.73 3.20 -0.44 0.00 1.01 -1.26 -3.24 120.40 117.96 2ysx s VAL 57 Ca -0.10 -0.81 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 2ysx s VAL 57 Cb -0.08 -2.58 0.07 0.00 0.00 0.00 0.00 36.38 33.79 2ysx s VAL 57 CO -0.01 0.25 0.31 -0.31 0.00 0.00 0.00 175.10 175.33 2ysx s TYR 58 N 1.40 3.29 0.22 5.22 2.02 -0.29 -4.83 117.35 124.37 2ysx s TYR 58 Ca 0.02 -1.19 -0.27 0.00 -0.37 0.00 0.00 57.07 55.27 2ysx s TYR 58 Cb -0.16 -2.97 -0.09 0.00 -0.40 0.00 0.00 41.96 38.34 2ysx s TYR 58 CO -0.03 -0.80 0.85 0.95 -1.57 0.00 0.00 175.55 174.96 2ysx s THR 59 N 1.54 4.26 -0.50 -0.71 -4.23 -1.26 -1.95 115.64 112.78 2ysx s THR 59 Ca 0.03 1.82 0.03 0.00 -1.18 0.00 0.00 61.69 62.39 2ysx s THR 59 Cb -0.23 -4.16 0.15 0.00 1.34 0.00 0.00 72.50 69.60 2ysx s THR 59 CO 0.05 0.43 0.32 -0.31 -0.54 0.00 0.00 174.62 174.57 2ysx s TYR 60 N -1.26 2.28 0.10 3.99 2.02 -0.05 -4.88 117.35 119.55 2ysx s TYR 60 Ca 0.40 -2.68 -0.34 0.00 -0.37 0.00 0.00 57.07 54.08 2ysx s TYR 60 Cb -0.23 -1.97 -0.13 0.00 -0.40 0.00 0.00 41.96 39.22 2ysx s TYR 60 CO 0.27 -0.73 1.65 2.89 -1.57 0.00 0.00 175.55 178.06 2ysx n ARG 61 N 3.01 2.13 -3.41 -0.62 1.85 -1.26 -2.79 116.66 115.58 2ysx n ARG 61 Ca 0.15 0.77 -0.44 0.00 -1.00 0.00 0.00 57.85 57.33 2ysx n ARG 61 Cb 0.37 -2.56 -0.06 0.00 -1.05 0.00 0.00 32.46 29.16 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 1.71 4.86 0.17 8.89 1.09 -0.83 -3.93 121.20 133.16 2ysx s ILE 62 Ca 0.82 -1.74 -0.24 0.00 -1.10 0.00 0.00 60.65 58.39 2ysx s ILE 62 Cb -0.69 -4.13 -0.08 0.00 -1.06 0.00 0.00 42.46 36.50 2ysx s ILE 62 CO 0.42 -0.85 0.75 -0.76 -0.10 0.00 0.00 174.94 174.39 2ysx s LEU 63 N 1.32 4.54 0.68 2.97 2.01 -1.22 -2.52 118.68 126.47 2ysx s LEU 63 Ca 0.06 1.58 -0.14 0.00 0.01 0.00 0.00 54.13 55.64 2ysx s LEU 63 Cb -0.26 -3.32 0.01 0.00 0.01 0.00 0.00 46.19 42.63 2ysx s LEU 63 CO 0.00 0.18 1.11 -2.16 1.01 0.00 0.00 176.35 176.49 2ysx s PRO 64 N -1.30 2.68 0.52 1.29 0.04 -1.26 -4.09 135.00 132.89 2ysx s PRO 64 Ca 0.37 1.34 0.03 0.00 0.04 0.00 0.00 61.00 62.78 2ysx s PRO 64 Cb -0.22 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.39 2ysx s PRO 64 CO 0.25 -1.34 0.17 0.54 0.04 0.00 0.00 177.00 176.66 2ysx s ASN 65 N -2.76 4.34 0.25 6.66 4.22 -1.21 -4.89 114.94 121.55 2ysx s ASN 65 Ca 0.66 -1.49 -0.12 0.00 -2.14 0.00 0.00 52.86 49.77 2ysx s ASN 65 Cb -0.20 0.48 0.35 0.00 1.28 0.00 0.00 41.25 43.17 2ysx s ASN 65 CO 0.45 -0.96 1.57 -0.33 -2.04 0.00 0.00 177.10 175.79 2ysx h GLU 66 N 1.10 -0.01 -1.54 3.55 3.07 -1.97 1.06 114.58 119.83 2ysx h GLU 66 Ca -0.41 0.00 -0.13 0.00 -0.50 0.00 0.00 59.36 58.32 2ysx h GLU 66 Cb 1.31 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 29.16 2ysx h GLU 66 CO 0.67 -0.01 0.17 -0.25 -1.40 0.00 0.00 179.01 178.19 2ysx n ASP 67 N -5.55 4.98 -3.82 1.42 8.00 -1.26 -4.80 116.55 115.51 2ysx n ASP 67 Ca 0.13 -2.58 -0.31 0.00 0.71 0.00 0.00 54.79 52.74 2ysx n ASP 67 Cb 0.44 -0.93 -0.06 0.00 -0.02 0.00 0.00 41.12 40.55 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 0.74 -0.97 -4.46 -2.24 8.00 0.37 -4.87 116.55 113.11 2ysx n ASP 68 Ca 0.13 -0.95 -0.27 0.00 0.71 0.00 0.00 54.79 54.41 2ysx n ASP 68 Cb 0.60 -1.21 0.14 0.00 -0.02 0.00 0.00 41.12 40.63 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 -5.84 1.27 -0.34 -1.24 -0.14 -1.25 -4.76 119.74 107.45 2ysx s LYS 69 Ca 0.51 -0.67 0.03 0.00 -1.36 0.00 0.00 55.97 54.48 2ysx s LYS 69 Cb -0.30 -2.09 0.10 0.00 -1.68 0.00 0.00 37.83 33.86 2ysx s LYS 69 CO 0.77 -1.86 0.06 -0.06 -0.76 0.00 0.00 175.35 173.50 2ysx s PHE 70 N -3.50 3.45 0.16 3.18 0.08 0.22 -3.31 117.98 118.26 2ysx s PHE 70 Ca 0.69 -2.81 0.06 0.00 0.12 0.00 0.00 56.93 54.99 2ysx s PHE 70 Cb -0.05 -2.74 -0.04 0.00 -0.57 0.00 0.00 43.02 39.61 2ysx s PHE 70 CO 0.48 -0.94 -0.14 -0.08 -0.10 0.00 0.00 175.22 174.45 2ysx s THR 71 N 1.01 1.47 -0.07 0.64 -1.32 -1.26 -3.13 115.64 112.98 2ysx s THR 71 Ca 0.11 -1.97 -0.08 0.00 -1.21 0.00 0.00 61.69 58.54 2ysx s THR 71 Cb -0.19 -1.79 -0.04 0.00 -1.51 0.00 0.00 72.50 68.96 2ysx s THR 71 CO -0.11 -0.54 0.21 -0.69 -2.21 0.00 0.00 174.62 171.29 2ysx s VAL 72 N -2.65 5.39 -0.74 5.08 1.01 -1.26 -3.45 120.40 123.78 2ysx s VAL 72 Ca 0.16 0.30 -0.18 0.00 0.00 0.00 0.00 61.98 62.26 2ysx s VAL 72 Cb -0.02 -3.49 0.14 0.00 0.00 0.00 0.00 36.38 33.01 2ysx s VAL 72 CO 0.04 0.56 0.83 -1.10 0.00 0.00 0.00 175.10 175.43 2ysx s GLN 73 N -1.20 3.33 0.35 2.72 1.11 -1.25 -5.01 119.66 119.71 2ysx s GLN 73 Ca 0.19 -1.73 0.04 0.00 0.01 0.00 0.00 55.36 53.87 2ysx s GLN 73 Cb -0.13 -4.48 -0.04 0.00 -1.01 0.00 0.00 33.01 27.36 2ysx s GLN 73 CO 0.08 -1.54 0.14 0.00 0.01 0.00 0.00 175.29 173.98 2ysx s ALA 74 N 2.05 2.37 -0.64 6.09 0.00 -1.26 -4.94 121.76 125.43 2ysx s ALA 74 Ca 0.19 -1.61 -0.16 0.00 0.00 0.00 0.00 51.96 50.38 2ysx s ALA 74 Cb -0.16 0.95 0.15 0.00 0.00 0.00 0.00 23.12 24.07 2ysx s ALA 74 CO -0.02 -0.42 0.62 -1.54 0.00 0.00 0.00 175.76 174.40 2ysx s SER 75 N -3.48 6.37 -0.10 0.00 1.04 -1.26 -4.82 113.70 111.44 2ysx s SER 75 Ca 0.31 -2.02 -0.07 0.00 0.48 0.00 0.00 55.95 54.65 2ysx s SER 75 Cb 0.04 -2.23 -0.05 0.00 0.10 0.00 0.00 66.02 63.89 2ysx s SER 75 CO 0.17 -0.81 -0.17 1.21 0.98 0.00 0.00 173.24 174.61 2ysx n GLU 76 N 5.04 0.27 0.00 4.02 4.07 -1.26 -5.04 120.64 127.74 2ysx n GLU 76 Ca -0.04 0.12 0.00 0.00 -0.06 0.00 0.00 57.16 57.17 2ysx n GLU 76 Cb 0.43 -0.97 0.00 0.00 -0.06 0.00 0.00 31.44 30.84 2ysx n GLU 76 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2ysx n GLY 77 N 2.27 -0.07 1.41 8.31 0.00 -1.26 -4.88 105.19 110.98 2ysx n GLY 77 Ca -0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 46.02 45.68 2ysx n GLY 77 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2ysx n VAL 78 N 0.00 2.62 -4.34 1.61 0.24 -1.26 -4.97 118.33 112.24 2ysx n VAL 78 Ca 0.00 -1.99 -0.26 0.00 -2.04 0.00 0.00 64.34 60.05 2ysx n VAL 78 Cb 0.00 -0.31 -0.13 0.00 -1.47 0.00 0.00 33.84 31.93 2ysx n VAL 78 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2ysx s SER 79 N -1.71 2.91 -0.05 -1.34 0.15 -1.26 -5.14 113.70 107.26 2ysx s SER 79 Ca 0.48 -0.72 -0.30 0.00 0.70 0.00 0.00 55.95 56.12 2ysx s SER 79 Cb 0.40 -0.18 0.08 0.00 -1.71 0.00 0.00 66.02 64.61 2ysx s SER 79 CO 0.09 0.12 0.74 -0.04 1.20 0.00 0.00 173.24 175.34 2ysx s MET 80 N -1.97 0.98 0.14 5.44 -1.94 -1.26 -4.86 119.30 115.83 2ysx s MET 80 Ca 0.10 0.14 0.04 0.00 -1.71 0.00 0.00 55.69 54.25 2ysx s MET 80 Cb -0.10 0.46 -0.04 0.00 2.01 0.00 0.00 34.83 37.16 2ysx s MET 80 CO 0.05 -0.33 -0.09 1.03 -0.01 0.00 0.00 175.02 175.67 2ysx s ARG 81 N -1.53 1.02 -0.10 2.03 1.81 -1.26 -5.15 118.95 115.77 2ysx s ARG 81 Ca -0.07 -1.44 -0.04 0.00 -1.72 0.00 0.00 55.73 52.46 2ysx s ARG 81 Cb -0.00 -0.53 0.05 0.00 -0.45 0.00 0.00 34.95 34.02 2ysx s ARG 81 CO 0.05 0.05 0.20 -0.06 -0.68 0.00 0.00 175.30 174.86 2ysx s PHE 82 N -3.40 -0.26 -0.08 -0.53 0.08 -1.26 -4.66 117.98 107.87 2ysx s PHE 82 Ca 0.16 0.71 0.04 0.00 0.12 0.00 0.00 56.93 57.96 2ysx s PHE 82 Cb 0.03 -0.13 0.00 0.00 -0.57 0.00 0.00 43.02 42.36 2ysx s PHE 82 CO -0.00 -0.27 -0.20 -0.06 -0.10 0.00 0.00 175.22 174.59 2ysx s PHE 83 N 1.98 2.13 0.04 0.36 0.40 -1.18 -4.89 117.98 116.82 2ysx s PHE 83 Ca -0.01 -0.79 0.33 0.00 -0.60 0.00 0.00 56.93 55.86 2ysx s PHE 83 Cb -0.12 -1.44 1.38 0.00 0.51 0.00 0.00 43.02 43.35 2ysx s PHE 83 CO -0.07 -0.31 1.96 0.00 0.70 0.00 0.00 175.22 177.50 2ysx h THR 84 N 5.61 0.00 -3.88 0.64 1.03 -1.90 0.64 112.91 115.05 2ysx h THR 84 Ca -0.26 -0.42 -0.56 0.00 -0.01 0.00 0.00 66.41 65.16 2ysx h THR 84 Cb 1.21 1.37 -0.31 0.00 -1.07 0.00 0.00 68.15 69.34 2ysx h THR 84 CO 0.47 0.00 -0.84 -0.54 -0.01 0.00 0.00 175.52 174.61 2ysx s LYS 85 N -3.64 1.78 0.19 0.00 1.02 -1.26 -4.71 119.74 113.11 2ysx s LYS 85 Ca 0.01 -0.60 -0.17 0.00 0.02 0.00 0.00 55.97 55.23 2ysx s LYS 85 Cb 0.09 -1.54 0.15 0.00 -0.52 0.00 0.00 37.83 36.01 2ysx s LYS 85 CO 0.50 0.24 1.63 -0.07 -0.92 0.00 0.00 175.35 176.73 2ysx h LEU 86 N 6.27 -0.65 -0.68 3.17 -0.00 -1.91 -0.25 115.31 121.27 2ysx h LEU 86 Ca -0.32 0.17 0.12 0.00 -0.00 0.00 0.00 57.88 57.85 2ysx h LEU 86 Cb 1.17 0.38 -0.09 0.00 -0.00 0.00 0.00 40.66 42.13 2ysx h LEU 86 CO 0.48 -0.22 0.24 -0.78 -0.00 0.00 0.00 178.44 178.16 2ysx h ASP 87 N -0.07 0.20 0.00 -0.43 1.82 -1.97 0.50 116.42 116.47 2ysx h ASP 87 Ca 0.24 0.10 0.00 0.00 -0.39 0.00 0.00 57.03 56.98 2ysx h ASP 87 Cb 0.44 0.09 0.00 0.00 0.68 0.00 0.00 39.33 40.54 2ysx h ASP 87 CO -0.55 0.09 0.01 1.56 -1.61 0.00 0.00 179.24 178.74 2ysx h GLN 88 N 0.40 0.00 0.03 0.28 1.08 -1.45 -0.84 115.11 114.61 2ysx h GLN 88 Ca 0.36 0.00 -0.38 0.00 -1.45 0.00 0.00 58.65 57.18 2ysx h GLN 88 Cb 0.51 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.89 2ysx h GLN 88 CO -0.37 0.00 -2.34 -0.11 -0.95 0.00 0.00 178.83 175.05 2ysx n LEU 89 N -2.60 2.68 -0.03 1.46 0.00 0.15 -4.01 117.00 114.65 2ysx n LEU 89 Ca -0.02 -0.04 -0.12 0.00 0.00 0.00 0.00 56.01 55.84 2ysx n LEU 89 Cb 0.05 -0.85 -0.06 0.00 0.00 0.00 0.00 43.42 42.56 2ysx n LEU 89 CO 0.14 0.88 0.79 0.40 0.00 0.00 0.00 177.39 179.60 2ysx h ILE 90 N 0.02 1.20 -0.10 1.96 1.08 -0.08 -0.07 117.51 121.51 2ysx h ILE 90 Ca -0.54 -0.61 0.02 0.00 -0.39 0.00 0.00 64.86 63.35 2ysx h ILE 90 Cb 1.96 1.39 -0.00 0.00 -3.07 0.00 0.00 36.82 37.09 2ysx h ILE 90 CO -0.04 0.18 0.07 -0.33 -0.69 0.00 0.00 178.15 177.34 2ysx h GLU 91 N -0.03 0.03 0.06 2.37 5.08 -1.41 0.14 114.58 120.83 2ysx h GLU 91 Ca 0.03 -0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.15 2ysx h GLU 91 Cb 0.25 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2ysx h GLU 91 CO 0.00 0.02 -1.17 0.35 -1.00 0.00 0.00 179.01 177.21 2ysx h PHE 92 N 0.03 0.22 0.00 4.33 3.57 -1.62 -3.25 116.94 120.23 2ysx h PHE 92 Ca 0.05 -0.16 0.00 0.00 3.53 0.00 0.00 57.97 61.39 2ysx h PHE 92 Cb 0.15 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.88 2ysx h PHE 92 CO -0.00 1.14 -0.12 1.88 -2.23 0.00 0.00 178.31 178.98 2ysx h TYR 93 N 0.03 0.00 -0.80 0.41 -1.99 0.12 -3.28 116.97 111.46 2ysx h TYR 93 Ca -0.09 0.00 0.12 0.00 2.00 0.00 0.00 58.73 60.76 2ysx h TYR 93 Cb 1.88 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 40.55 2ysx h TYR 93 CO 0.03 0.00 0.52 0.87 -0.00 0.00 0.00 178.16 179.58 2ysx h LYS 94 N 0.00 0.62 -6.77 4.88 1.57 -0.80 -3.40 116.57 112.67 2ysx h LYS 94 Ca 0.00 -0.04 -0.54 0.00 -1.87 0.00 0.00 60.65 58.20 2ysx h LYS 94 Cb 0.79 -0.14 0.21 0.00 0.08 0.00 0.00 32.23 33.17 2ysx h LYS 94 CO 0.00 0.41 -0.50 1.63 -0.57 0.00 0.00 179.45 180.42 2ysx n LYS 95 N -4.51 -0.12 -1.97 3.15 4.76 -1.24 -3.91 118.16 114.31 2ysx n LYS 95 Ca 0.14 0.01 -0.29 0.00 -2.87 0.00 0.00 58.31 55.30 2ysx n LYS 95 Cb 0.41 -1.87 0.16 0.00 -1.84 0.00 0.00 35.03 31.89 2ysx n LYS 95 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2ysx s GLU 96 N -3.43 1.03 -1.77 1.97 -1.05 -1.26 -4.14 118.70 110.05 2ysx s GLU 96 Ca 0.59 -0.34 -0.18 0.00 -0.15 0.00 0.00 54.97 54.90 2ysx s GLU 96 Cb -0.25 -1.91 0.17 0.00 -0.44 0.00 0.00 34.13 31.70 2ysx s GLU 96 CO 0.65 -2.15 0.52 -1.71 0.95 0.00 0.00 175.26 173.52 2ysx n ASN 97 N -3.59 -1.55 -0.03 0.83 2.85 -1.26 -4.85 115.26 107.67 2ysx n ASN 97 Ca 0.13 -1.20 -0.01 0.00 -0.11 0.00 0.00 54.58 53.40 2ysx n ASN 97 Cb 0.60 -1.89 -0.00 0.00 1.24 0.00 0.00 39.78 39.73 2ysx n ASN 97 CO 0.00 0.00 0.00 -0.03 -2.11 0.00 0.00 177.26 175.12 2ysx h MET 98 N -1.20 0.00 0.00 1.20 4.05 -1.89 -3.50 114.93 113.59 2ysx h MET 98 Ca -0.61 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.81 2ysx h MET 98 Cb 1.39 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.19 2ysx h MET 98 CO 0.83 0.00 0.00 0.41 0.23 0.00 0.00 176.91 178.38 2ysx n GLY 99 N 1.79 0.68 3.35 1.39 0.00 -1.26 -5.00 105.19 106.13 2ysx n GLY 99 Ca -0.02 -0.05 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.39 -0.30 0.99 4.77 -1.26 -4.78 117.00 115.03 2ysx n LEU 100 Ca 0.00 0.04 0.35 0.00 -0.03 0.00 0.00 56.01 56.36 2ysx n LEU 100 Cb 0.00 -1.08 0.75 0.00 -2.33 0.00 0.00 43.42 40.76 2ysx n LEU 100 CO 0.00 -3.26 1.32 1.62 -1.33 0.00 0.00 177.39 175.74 2ysx h VAL 101 N -1.96 0.41 -1.91 4.08 3.04 -1.98 -3.42 116.25 114.51 2ysx h VAL 101 Ca -0.51 0.00 0.08 0.00 -1.01 0.00 0.00 66.70 65.26 2ysx h VAL 101 Cb 1.33 0.41 -0.19 0.00 -2.01 0.00 0.00 31.29 30.83 2ysx h VAL 101 CO 0.38 0.00 0.49 0.28 -1.01 0.00 0.00 177.57 177.71 2ysx s THR 102 N -4.93 0.00 0.23 3.17 -1.32 -1.26 -5.07 115.64 106.46 2ysx s THR 102 Ca -0.05 0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.13 2ysx s THR 102 Cb 0.23 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 70.12 2ysx s THR 102 CO 0.79 0.00 1.28 -1.38 -2.21 0.00 0.00 174.62 173.10 2ysx s HIS 103 N -1.98 3.26 0.04 9.09 0.00 -1.26 -4.93 115.29 119.51 2ysx s HIS 103 Ca 0.00 1.32 -0.32 0.00 -3.00 0.00 0.00 55.06 53.07 2ysx s HIS 103 Cb -0.01 -3.57 -0.10 0.00 -4.00 0.00 0.00 32.58 24.90 2ysx s HIS 103 CO -0.02 -1.69 1.89 1.28 -1.00 0.00 0.00 174.74 175.20 2ysx n LEU 104 N 2.11 3.91 -0.09 5.38 4.77 -1.25 -4.85 117.00 126.97 2ysx n LEU 104 Ca 0.04 0.95 -0.17 0.00 -0.03 0.00 0.00 56.01 56.81 2ysx n LEU 104 Cb 0.43 -1.49 -0.06 0.00 -2.33 0.00 0.00 43.42 39.97 2ysx n LEU 104 CO 0.58 0.11 -0.95 0.00 -1.33 0.00 0.00 177.39 175.79 2ysx n GLN 105 N 6.54 0.47 -4.13 3.23 6.02 -0.89 -4.89 117.38 123.73 2ysx n GLN 105 Ca 0.20 0.20 -0.26 0.00 -0.01 0.00 0.00 57.00 57.12 2ysx n GLN 105 Cb 0.36 -1.30 -0.17 0.00 1.02 0.00 0.00 30.24 30.16 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 -2.58 1.51 -1.19 1.08 1.51 -1.06 -5.06 117.35 111.56 2ysx s TYR 106 Ca -0.28 -0.70 -0.23 0.00 -1.01 0.00 0.00 57.07 54.85 2ysx s TYR 106 Cb 0.08 -1.20 -0.09 0.00 -0.11 0.00 0.00 41.96 40.65 2ysx s TYR 106 CO 0.38 -0.45 1.93 -1.25 -1.11 0.00 0.00 175.55 175.06 2ysx s PRO 107 N 1.36 2.49 -0.61 -1.71 0.04 -1.26 -3.83 135.00 131.48 2ysx s PRO 107 Ca -0.01 -1.18 -0.13 0.00 0.04 0.00 0.00 61.00 59.72 2ysx s PRO 107 Cb -0.14 -5.25 -0.17 0.00 0.04 0.00 0.00 34.50 28.99 2ysx s PRO 107 CO -0.05 -4.00 1.51 0.28 0.04 0.00 0.00 177.00 174.78 2ysx n VAL 108 N 7.80 0.00 -2.22 -0.36 0.31 -1.16 -4.65 118.33 118.06 2ysx n VAL 108 Ca 0.45 -0.13 -0.35 0.00 -0.01 0.00 0.00 64.34 64.30 2ysx n VAL 108 Cb 0.47 -0.17 0.01 0.00 -0.91 0.00 0.00 33.84 33.23 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 4.97 3.32 0.99 5.55 0.04 -1.26 -4.42 135.00 144.19 2ysx s PRO 109 Ca 0.82 1.60 -0.15 0.00 0.04 0.00 0.00 61.00 63.31 2ysx s PRO 109 Cb -0.66 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 31.88 2ysx s PRO 109 CO 0.32 -0.88 0.04 1.28 0.04 0.00 0.00 177.00 177.81 2ysx n LEU 110 N -1.38 -1.72 -4.70 -3.56 4.77 -1.06 -4.83 117.00 104.52 2ysx n LEU 110 Ca 0.12 0.22 -0.42 0.00 -0.03 0.00 0.00 56.01 55.89 2ysx n LEU 110 Cb 0.51 -1.06 -0.03 0.00 -2.33 0.00 0.00 43.42 40.51 2ysx n LEU 110 CO 0.43 -3.94 1.28 -1.61 -1.33 0.00 0.00 177.39 172.21 2ysx s GLU 111 N -3.25 4.21 -0.86 3.23 2.02 -1.26 -4.94 118.70 117.86 2ysx s GLU 111 Ca 0.53 2.31 -0.21 0.00 0.02 0.00 0.00 54.97 57.62 2ysx s GLU 111 Cb -0.18 -3.47 0.10 0.00 0.10 0.00 0.00 34.13 30.68 2ysx s GLU 111 CO 0.70 -0.68 1.14 -2.00 0.02 0.00 0.00 175.26 174.43 2ysx s GLU 112 N 2.19 3.45 -0.43 1.61 2.12 -1.26 -4.97 118.70 121.40 2ysx s GLU 112 Ca 0.72 -1.36 -0.30 0.00 0.36 0.00 0.00 54.97 54.39 2ysx s GLU 112 Cb -0.40 -4.77 -0.10 0.00 0.26 0.00 0.00 34.13 29.12 2ysx s GLU 112 CO 0.32 -1.86 2.33 0.39 -0.54 0.00 0.00 175.26 175.89 2ysx n GLU 113 N 7.32 1.15 -1.47 4.30 1.02 -1.26 -4.78 120.64 126.91 2ysx n GLU 113 Ca 0.17 0.22 -0.44 0.00 -0.02 0.00 0.00 57.16 57.09 2ysx n GLU 113 Cb 0.48 -2.83 -0.10 0.00 -0.02 0.00 0.00 31.44 28.97 2ysx n GLU 113 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2ysx n ASP 114 N 12.21 1.29 -4.86 1.62 8.00 -1.26 -4.90 116.55 128.64 2ysx n ASP 114 Ca 0.40 0.11 -0.32 0.00 0.71 0.00 0.00 54.79 55.70 2ysx n ASP 114 Cb 0.35 -1.17 -0.05 0.00 -0.02 0.00 0.00 41.12 40.23 2ysx n ASP 114 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2ysx s THR 115 N 9.10 4.78 -0.89 -3.53 2.01 -1.26 -4.99 115.64 120.85 2ysx s THR 115 Ca 1.18 0.71 -0.25 0.00 0.31 0.00 0.00 61.69 63.65 2ysx s THR 115 Cb -0.92 -3.64 0.01 0.00 0.01 0.00 0.00 72.50 67.97 2ysx s THR 115 CO 0.45 -0.23 1.59 -0.83 -0.69 0.00 0.00 174.62 174.91 2ysx s GLY 116 N -2.52 0.79 -0.35 4.40 0.00 -1.26 -4.93 107.32 103.45 2ysx s GLY 116 Ca 0.51 -1.73 0.00 0.00 0.00 0.00 0.00 44.72 43.51 2ysx s GLY 116 CO 0.22 2.97 0.08 0.99 0.00 0.00 0.00 173.10 177.36 2ysx s ASP 117 N 5.90 4.94 0.12 1.64 1.11 -1.26 -5.00 116.67 124.11 2ysx s ASP 117 Ca 0.53 -1.83 -0.33 0.00 0.18 0.00 0.00 52.55 51.09 2ysx s ASP 117 Cb -0.05 -1.71 -0.12 0.00 1.07 0.00 0.00 42.92 42.12 2ysx s ASP 117 CO 0.00 -0.39 1.54 0.44 1.18 0.00 0.00 175.17 177.94 2ysx h ASP 118 N 7.87 -1.79 0.00 0.27 3.32 -2.07 -3.56 116.42 120.46 2ysx h ASP 118 Ca -0.13 0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.15 2ysx h ASP 118 Cb 1.04 0.72 0.00 0.00 0.22 0.00 0.00 39.33 41.31 2ysx h ASP 118 CO 0.58 -0.43 0.00 -0.81 -1.72 0.00 0.00 179.24 176.86