#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 4.76 0.16 1.61 1.04 -1.26 -5.15 113.70 114.86 2ysx s SER 2 Ca 0.00 -0.91 -0.08 0.00 0.48 0.00 0.00 55.95 55.44 2ysx s SER 2 Cb 0.00 -0.50 -0.01 0.00 0.10 0.00 0.00 66.02 65.61 2ysx s SER 2 CO 0.00 -0.62 0.26 -0.44 0.98 0.00 0.00 173.24 173.42 2ysx s SER 3 N -4.04 0.07 0.00 7.02 0.01 -1.26 -5.10 113.70 110.40 2ysx s SER 3 Ca 0.45 -0.90 0.00 0.00 1.31 0.00 0.00 55.95 56.81 2ysx s SER 3 Cb -0.00 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.65 2ysx s SER 3 CO 0.25 -0.88 0.00 0.61 0.41 0.00 0.00 173.24 173.64 2ysx n GLY 4 N -0.20 -1.78 3.51 3.44 0.00 -1.26 -5.18 105.19 103.71 2ysx n GLY 4 Ca -0.07 0.65 -0.12 0.00 0.00 0.00 0.00 46.02 46.48 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 0.00 -0.47 0.32 1.61 0.15 -1.26 -5.19 113.70 108.86 2ysx s SER 5 Ca 0.00 0.25 0.07 0.00 0.70 0.00 0.00 55.95 56.97 2ysx s SER 5 Cb 0.00 0.45 -0.06 0.00 -1.71 0.00 0.00 66.02 64.69 2ysx s SER 5 CO 0.00 -0.63 -0.04 -0.44 1.20 0.00 0.00 173.24 173.33 2ysx s SER 6 N -1.94 3.10 0.00 5.45 0.01 -1.26 -5.01 113.70 114.05 2ysx s SER 6 Ca -0.01 -1.24 0.00 0.00 1.31 0.00 0.00 55.95 56.01 2ysx s SER 6 Cb -0.01 -0.23 0.00 0.00 0.21 0.00 0.00 66.02 65.99 2ysx s SER 6 CO -0.03 -0.36 0.00 0.61 0.41 0.00 0.00 173.24 173.87 2ysx n GLY 7 N -0.70 0.33 3.84 3.44 0.00 -1.26 -5.14 105.19 105.70 2ysx n GLY 7 Ca -0.05 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 44.91 2ysx n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2ysx s MET 8 N 0.00 4.01 0.14 1.61 -2.45 -1.26 -5.09 119.30 116.25 2ysx s MET 8 Ca 0.00 0.51 0.08 0.00 -1.25 0.00 0.00 55.69 55.03 2ysx s MET 8 Cb 0.00 -3.08 -0.04 0.00 1.25 0.00 0.00 34.83 32.95 2ysx s MET 8 CO 0.00 0.58 -0.11 0.14 1.05 0.00 0.00 175.02 176.68 2ysx s VAL 9 N -1.28 3.21 0.21 10.11 -7.23 -1.26 -5.11 120.40 119.06 2ysx s VAL 9 Ca 0.32 -1.47 -0.30 0.00 -1.81 0.00 0.00 61.98 58.72 2ysx s VAL 9 Cb -0.17 -2.53 -0.09 0.00 0.56 0.00 0.00 36.38 34.15 2ysx s VAL 9 CO 0.18 0.02 1.29 -2.16 -0.31 0.00 0.00 175.10 174.12 2ysx s PRO 10 N -2.45 4.40 -0.05 4.82 0.04 -1.26 -4.95 135.00 135.54 2ysx s PRO 10 Ca 0.22 2.04 -0.01 0.00 0.04 0.00 0.00 61.00 63.29 2ysx s PRO 10 Cb -0.10 -3.19 -0.26 0.00 0.04 0.00 0.00 34.50 30.99 2ysx s PRO 10 CO 0.14 -0.21 0.63 0.00 0.04 0.00 0.00 177.00 177.59 2ysx n TRP 12 N -3.38 0.08 -3.93 0.00 4.27 -1.25 -3.66 117.44 109.58 2ysx n TRP 12 Ca -0.22 0.04 -0.35 0.00 -3.89 0.00 0.00 57.50 53.07 2ysx n TRP 12 Cb 1.05 -0.56 -0.14 0.00 -1.36 0.00 0.00 31.31 30.30 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 -3.11 4.23 -0.21 -0.67 3.84 -1.25 -0.56 114.94 117.21 2ysx s ASN 13 Ca 0.02 -0.57 -0.16 0.00 0.21 0.00 0.00 52.86 52.36 2ysx s ASN 13 Cb 0.03 -1.70 -0.19 0.00 -0.55 0.00 0.00 41.25 38.84 2ysx s ASN 13 CO 0.10 -0.06 0.11 1.41 -2.79 0.00 0.00 177.10 175.87 2ysx n HIS 14 N 4.75 0.81 -1.63 0.43 8.25 0.36 -4.86 115.22 123.33 2ysx n HIS 14 Ca -0.18 0.30 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 2ysx n HIS 14 Cb 0.50 -1.09 0.00 0.00 1.12 0.00 0.00 29.99 30.52 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 1.56 -4.57 3.37 -1.41 0.00 -1.05 -4.83 105.19 98.27 2ysx n GLY 15 Ca -0.37 -0.72 -0.17 0.00 0.00 0.00 0.00 46.02 44.76 2ysx n GLY 15 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ysx n ASN 16 N -1.24 -2.18 -4.12 1.61 5.15 -1.26 -4.70 115.26 108.52 2ysx n ASN 16 Ca 0.00 -0.61 -0.18 0.00 -0.60 0.00 0.00 54.58 53.19 2ysx n ASN 16 Cb 0.10 -5.03 -0.13 0.00 -0.53 0.00 0.00 39.78 34.19 2ysx n ASN 16 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2ysx s ILE 17 N -3.35 0.98 0.55 -1.44 -4.36 -1.26 -4.98 121.20 107.33 2ysx s ILE 17 Ca 0.01 -1.00 -0.12 0.00 -0.26 0.00 0.00 60.65 59.28 2ysx s ILE 17 Cb -0.00 -0.92 -0.05 0.00 1.25 0.00 0.00 42.46 42.74 2ysx s ILE 17 CO 0.71 -0.08 0.95 0.28 0.24 0.00 0.00 174.94 177.05 2ysx s THR 18 N -0.94 4.70 0.19 8.37 -1.32 -1.26 -4.78 115.64 120.60 2ysx s THR 18 Ca -0.01 0.84 -0.22 0.00 -1.21 0.00 0.00 61.69 61.09 2ysx s THR 18 Cb -0.08 -3.82 0.11 0.00 -1.51 0.00 0.00 72.50 67.20 2ysx s THR 18 CO 0.01 -0.92 1.57 -0.09 -2.21 0.00 0.00 174.62 172.98 2ysx h ARG 19 N 0.26 -0.14 0.05 7.08 2.43 -2.00 -0.69 114.38 121.37 2ysx h ARG 19 Ca -0.46 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 58.74 2ysx h ARG 19 Cb 1.19 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.73 2ysx h ARG 19 CO 0.62 -0.09 -0.48 1.03 -1.51 0.00 0.00 179.97 179.54 2ysx h SER 20 N -0.14 -1.46 -1.08 -3.80 0.87 -1.99 -0.15 113.55 105.80 2ysx h SER 20 Ca 0.23 0.16 0.31 0.00 -1.23 0.00 0.00 61.79 61.26 2ysx h SER 20 Cb 0.56 0.55 -0.12 0.00 -0.44 0.00 0.00 62.40 62.95 2ysx h SER 20 CO -0.76 -0.48 0.67 0.50 -0.53 0.00 0.00 176.83 176.22 2ysx h LYS 21 N -0.64 0.33 -0.41 2.24 1.63 -1.70 0.69 116.57 118.71 2ysx h LYS 21 Ca 0.00 -0.02 -0.13 0.00 -0.85 0.00 0.00 60.65 59.65 2ysx h LYS 21 Cb 0.66 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.21 2ysx h LYS 21 CO -0.29 0.22 -0.26 0.00 -3.45 0.00 0.00 179.45 175.67 2ysx h ALA 22 N 1.69 0.77 0.09 5.00 0.00 0.35 -3.05 119.26 124.11 2ysx h ALA 22 Ca 0.68 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2ysx h ALA 22 Cb 1.73 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2ysx h ALA 22 CO -0.43 0.65 -0.04 0.93 0.00 0.00 0.00 179.25 180.37 2ysx h GLU 23 N 0.73 -0.11 -1.04 0.00 5.08 0.18 -3.22 114.58 116.19 2ysx h GLU 23 Ca 0.09 0.01 0.39 0.00 -1.00 0.00 0.00 59.36 58.85 2ysx h GLU 23 Cb 0.80 0.03 -0.13 0.00 0.50 0.00 0.00 28.75 29.94 2ysx h GLU 23 CO 0.07 -0.08 0.63 -0.85 -1.00 0.00 0.00 179.01 177.78 2ysx n GLU 24 N -4.61 -0.04 -0.07 2.33 0.28 0.16 0.19 120.64 118.88 2ysx n GLU 24 Ca -0.01 1.12 -0.12 0.00 -0.16 0.00 0.00 57.16 57.99 2ysx n GLU 24 Cb 0.05 -2.12 -0.05 0.00 1.43 0.00 0.00 31.44 30.74 2ysx n GLU 24 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2ysx h LEU 25 N 0.00 0.37 0.56 -1.84 3.38 -1.63 -2.88 115.31 113.27 2ysx h LEU 25 Ca 0.74 -0.34 -0.03 0.00 0.09 0.00 0.00 57.88 58.34 2ysx h LEU 25 Cb 2.21 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 42.87 2ysx h LEU 25 CO -0.51 0.62 -0.27 -0.07 0.09 0.00 0.00 178.44 178.30 2ysx h LEU 26 N 0.10 -0.63 -0.94 1.67 3.38 0.21 -2.86 115.31 116.24 2ysx h LEU 26 Ca 0.05 0.02 0.39 0.00 0.09 0.00 0.00 57.88 58.43 2ysx h LEU 26 Cb 0.45 0.16 -0.17 0.00 0.09 0.00 0.00 40.66 41.20 2ysx h LEU 26 CO 0.02 -0.28 0.47 -1.54 0.09 0.00 0.00 178.44 177.20 2ysx n SER 27 N -4.94 0.30 0.24 -0.43 3.41 -0.02 0.27 113.62 112.45 2ysx n SER 27 Ca -0.09 1.56 -0.15 0.00 -0.26 0.00 0.00 58.87 59.93 2ysx n SER 27 Cb 0.29 -0.75 -0.08 0.00 -0.26 0.00 0.00 64.21 63.42 2ysx n SER 27 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 2ysx h ARG 28 N 0.00 -0.57 0.00 4.33 3.08 -1.47 -3.25 114.38 116.50 2ysx h ARG 28 Ca 0.78 0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.90 2ysx h ARG 28 Cb 2.05 0.13 -0.04 0.00 0.08 0.00 0.00 29.97 32.19 2ysx h ARG 28 CO -0.73 -0.29 -0.22 1.15 -1.07 0.00 0.00 179.97 178.81 2ysx h THR 29 N -0.81 0.49 -5.78 2.04 2.02 0.06 -3.47 112.91 107.46 2ysx h THR 29 Ca -0.06 0.00 -0.33 0.00 0.77 0.00 0.00 66.41 66.79 2ysx h THR 29 Cb 0.55 0.49 0.14 0.00 -1.74 0.00 0.00 68.15 67.60 2ysx h THR 29 CO 0.10 0.00 -0.87 0.61 0.37 0.00 0.00 175.52 175.73 2ysx n GLY 30 N -1.34 -0.92 2.71 2.16 0.00 -0.08 -4.98 105.19 102.73 2ysx n GLY 30 Ca -0.05 0.44 -0.29 0.00 0.00 0.00 0.00 46.02 46.12 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 -5.16 1.42 -0.73 1.61 1.02 -1.26 -5.05 119.74 111.58 2ysx s LYS 31 Ca 0.36 -2.22 -0.15 0.00 0.02 0.00 0.00 55.97 53.98 2ysx s LYS 31 Cb -0.08 -2.40 -0.20 0.00 -0.52 0.00 0.00 37.83 34.63 2ysx s LYS 31 CO 0.78 -1.20 1.77 -0.25 -0.92 0.00 0.00 175.35 175.53 2ysx n ASP 32 N 3.23 -0.43 0.00 2.83 9.92 -1.26 -0.47 116.55 130.37 2ysx n ASP 32 Ca 0.13 -0.13 0.00 0.00 -0.53 0.00 0.00 54.79 54.25 2ysx n ASP 32 Cb 0.36 -0.53 0.00 0.00 -0.64 0.00 0.00 41.12 40.31 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 4.39 0.72 3.43 0.44 0.00 -0.82 -4.92 105.19 108.44 2ysx n GLY 33 Ca 0.49 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.19 2ysx n GLY 33 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ysx n SER 34 N 0.00 -1.77 -3.60 1.61 7.64 0.39 -2.62 113.62 115.27 2ysx n SER 34 Ca 0.00 0.23 -0.11 0.00 1.01 0.00 0.00 58.87 59.99 2ysx n SER 34 Cb 0.00 -1.20 -0.06 0.00 -1.01 0.00 0.00 64.21 61.94 2ysx n SER 34 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2ysx s PHE 35 N -2.40 -0.49 0.20 1.43 -0.71 -1.25 -1.78 117.98 112.97 2ysx s PHE 35 Ca 0.59 1.04 -0.10 0.00 -1.04 0.00 0.00 56.93 57.42 2ysx s PHE 35 Cb -0.20 0.39 -0.01 0.00 -1.21 0.00 0.00 43.02 41.99 2ysx s PHE 35 CO 0.66 -0.34 0.35 -0.48 -1.34 0.00 0.00 175.22 174.07 2ysx s LEU 36 N -0.44 0.69 0.10 -1.99 0.05 -0.52 -3.43 118.68 113.13 2ysx s LEU 36 Ca -0.01 -0.92 0.08 0.00 0.05 0.00 0.00 54.13 53.33 2ysx s LEU 36 Cb -0.03 1.38 -0.03 0.00 -2.05 0.00 0.00 46.19 45.45 2ysx s LEU 36 CO -0.00 -0.99 -0.22 -0.69 -0.55 0.00 0.00 176.35 173.90 2ysx s VAL 37 N -4.00 1.77 0.14 1.48 1.01 0.27 -0.76 120.40 120.31 2ysx s VAL 37 Ca 0.21 -1.55 -0.10 0.00 0.00 0.00 0.00 61.98 60.54 2ysx s VAL 37 Cb 0.02 -1.60 -0.00 0.00 0.00 0.00 0.00 36.38 34.80 2ysx s VAL 37 CO 0.04 -0.03 0.28 0.00 0.00 0.00 0.00 175.10 175.39 2ysx s ARG 38 N -1.89 1.08 -0.42 2.72 1.70 -0.57 -0.49 118.95 121.08 2ysx s ARG 38 Ca 0.07 -1.08 -0.24 0.00 -0.47 0.00 0.00 55.73 54.02 2ysx s ARG 38 Cb -0.10 0.38 0.02 0.00 -0.57 0.00 0.00 34.95 34.68 2ysx s ARG 38 CO 0.04 -0.39 0.81 0.00 -1.08 0.00 0.00 175.30 174.68 2ysx s ALA 39 N -3.93 3.33 0.68 7.88 0.00 -1.26 -1.02 121.76 127.44 2ysx s ALA 39 Ca 0.13 -0.84 -0.17 0.00 0.00 0.00 0.00 51.96 51.08 2ysx s ALA 39 Cb 0.03 -3.46 -0.00 0.00 0.00 0.00 0.00 23.12 19.69 2ysx s ALA 39 CO -0.04 -1.79 1.15 0.43 0.00 0.00 0.00 175.76 175.51 2ysx n SER 40 N 6.69 1.35 -0.09 0.00 7.64 -1.25 -4.44 113.62 123.52 2ysx n SER 40 Ca 0.03 0.76 -0.10 0.00 1.01 0.00 0.00 58.87 60.57 2ysx n SER 40 Cb 0.48 -1.49 -0.04 0.00 -1.01 0.00 0.00 64.21 62.16 2ysx n SER 40 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2ysx n GLU 41 N -1.90 0.51 -0.19 1.43 2.13 -1.26 -4.59 120.64 116.77 2ysx n GLU 41 Ca 0.15 0.38 -0.05 0.00 0.66 0.00 0.00 57.16 58.30 2ysx n GLU 41 Cb 0.49 -1.58 -0.05 0.00 0.27 0.00 0.00 31.44 30.57 2ysx n GLU 41 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2ysx n SER 42 N -4.50 -0.49 -4.78 4.31 7.64 -1.26 -4.33 113.62 110.21 2ysx n SER 42 Ca -0.17 1.13 -0.33 0.00 1.01 0.00 0.00 58.87 60.50 2ysx n SER 42 Cb 0.47 -0.26 -0.07 0.00 -1.01 0.00 0.00 64.21 63.33 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 -4.42 4.76 -0.02 0.44 1.09 -1.26 -5.05 121.20 116.73 2ysx s ILE 43 Ca -0.05 -0.35 -0.06 0.00 -1.10 0.00 0.00 60.65 59.09 2ysx s ILE 43 Cb 0.05 -3.16 -0.03 0.00 -1.06 0.00 0.00 42.46 38.26 2ysx s ILE 43 CO 0.28 0.39 0.43 -1.28 -0.10 0.00 0.00 174.94 174.66 2ysx h SER 44 N 4.24 -0.18 0.00 3.58 0.87 -1.84 -3.37 113.55 116.85 2ysx h SER 44 Ca -0.50 0.01 -0.67 0.00 -1.23 0.00 0.00 61.79 59.40 2ysx h SER 44 Cb 1.19 0.05 0.01 0.00 -0.44 0.00 0.00 62.40 63.21 2ysx h SER 44 CO 0.61 0.02 2.68 0.54 -0.53 0.00 0.00 176.83 180.15 2ysx n ARG 45 N -3.44 2.10 -3.81 2.24 3.00 -1.26 -4.79 116.66 110.70 2ysx n ARG 45 Ca -0.03 -2.15 -0.08 0.00 -0.01 0.00 0.00 57.85 55.57 2ysx n ARG 45 Cb 0.09 -3.06 0.03 0.00 0.00 0.00 0.00 32.46 29.51 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 4.18 -0.80 0.36 7.54 0.00 -1.26 -4.12 121.76 127.67 2ysx s ALA 46 Ca 0.53 -0.74 -0.09 0.00 0.00 0.00 0.00 51.96 51.66 2ysx s ALA 46 Cb 0.14 0.67 0.03 0.00 0.00 0.00 0.00 23.12 23.97 2ysx s ALA 46 CO 0.03 -0.99 0.64 0.71 0.00 0.00 0.00 175.76 176.14 2ysx s TYR 47 N -2.22 0.58 -0.15 0.00 1.51 -1.04 -3.90 117.35 112.13 2ysx s TYR 47 Ca 0.16 -1.03 -0.04 0.00 -1.01 0.00 0.00 57.07 55.15 2ysx s TYR 47 Cb -0.05 0.39 0.06 0.00 -0.11 0.00 0.00 41.96 42.25 2ysx s TYR 47 CO 0.11 -1.36 0.11 0.00 -1.11 0.00 0.00 175.55 173.30 2ysx s ALA 48 N -2.69 0.25 -0.75 3.71 0.00 -0.19 -1.18 121.76 120.93 2ysx s ALA 48 Ca 0.23 -0.08 -0.16 0.00 0.00 0.00 0.00 51.96 51.95 2ysx s ALA 48 Cb -0.03 -0.98 0.17 0.00 0.00 0.00 0.00 23.12 22.28 2ysx s ALA 48 CO 0.16 -1.01 0.76 -1.17 0.00 0.00 0.00 175.76 174.49 2ysx s LEU 49 N 2.18 6.15 0.40 0.00 2.96 0.11 -1.51 118.68 128.96 2ysx s LEU 49 Ca 0.03 -2.20 -0.24 0.00 -0.22 0.00 0.00 54.13 51.51 2ysx s LEU 49 Cb -0.15 -2.26 -0.09 0.00 0.50 0.00 0.00 46.19 44.19 2ysx s LEU 49 CO -0.08 -0.80 1.03 0.00 -1.32 0.00 0.00 176.35 175.18 2ysx s VAL 51 N -1.70 -0.18 -0.02 0.00 1.01 -1.10 -1.44 120.40 116.97 2ysx s VAL 51 Ca 0.58 0.38 -0.30 0.00 0.00 0.00 0.00 61.98 62.64 2ysx s VAL 51 Cb -0.21 -0.22 -0.03 0.00 0.00 0.00 0.00 36.38 35.93 2ysx s VAL 51 CO 0.26 0.16 1.00 -0.22 0.00 0.00 0.00 175.10 176.30 2ysx s LEU 52 N 2.18 4.35 -0.26 3.92 2.96 -0.73 -1.04 118.68 130.06 2ysx s LEU 52 Ca 0.03 1.65 -0.10 0.00 -0.22 0.00 0.00 54.13 55.50 2ysx s LEU 52 Cb -0.12 -3.57 0.11 0.00 0.50 0.00 0.00 46.19 43.11 2ysx s LEU 52 CO -0.04 -0.31 0.56 -0.47 -1.32 0.00 0.00 176.35 174.77 2ysx s TYR 53 N 1.21 -1.09 -1.45 5.38 5.04 0.61 -1.94 117.35 125.11 2ysx s TYR 53 Ca 0.52 1.98 -0.06 0.00 -2.44 0.00 0.00 57.07 57.07 2ysx s TYR 53 Cb -0.21 0.59 0.04 0.00 0.35 0.00 0.00 41.96 42.73 2ysx s TYR 53 CO 0.26 -0.57 0.69 0.54 -1.34 0.00 0.00 175.55 175.13 2ysx n ARG 54 N 5.23 -4.29 -3.31 4.97 1.74 -1.26 -0.72 116.66 119.02 2ysx n ARG 54 Ca -0.12 0.51 -0.21 0.00 -0.77 0.00 0.00 57.85 57.25 2ysx n ARG 54 Cb 0.51 -5.03 0.06 0.00 -1.02 0.00 0.00 32.46 26.97 2ysx n ARG 54 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2ysx n ASN 55 N -2.92 -5.94 -3.93 0.55 2.85 -1.26 -5.00 115.26 99.60 2ysx n ASN 55 Ca -0.17 -0.41 -0.12 0.00 -0.11 0.00 0.00 54.58 53.77 2ysx n ASN 55 Cb 0.62 -4.63 -0.13 0.00 1.24 0.00 0.00 39.78 36.88 2ysx n ASN 55 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2ysx s VAL 57 N -0.52 4.18 -0.99 0.00 1.01 -1.26 -0.28 120.40 122.53 2ysx s VAL 57 Ca -0.05 -1.88 -0.23 0.00 0.00 0.00 0.00 61.98 59.82 2ysx s VAL 57 Cb -0.04 -3.75 0.05 0.00 0.00 0.00 0.00 36.38 32.64 2ysx s VAL 57 CO -0.00 -0.79 1.43 -0.31 0.00 0.00 0.00 175.10 175.43 2ysx s TYR 58 N 1.25 2.51 -0.21 5.22 1.51 -0.20 -4.81 117.35 122.61 2ysx s TYR 58 Ca 0.07 -0.77 -0.29 0.00 -1.01 0.00 0.00 57.07 55.07 2ysx s TYR 58 Cb -0.25 -4.69 -0.02 0.00 -0.11 0.00 0.00 41.96 36.89 2ysx s TYR 58 CO -0.01 -1.95 1.44 0.99 -1.11 0.00 0.00 175.55 174.91 2ysx s THR 59 N 5.02 3.96 -0.24 -0.71 2.01 -1.26 -2.72 115.64 121.70 2ysx s THR 59 Ca 0.45 1.11 -0.06 0.00 0.31 0.00 0.00 61.69 63.50 2ysx s THR 59 Cb -0.01 -3.89 -0.02 0.00 0.01 0.00 0.00 72.50 68.60 2ysx s THR 59 CO -0.08 -0.28 0.02 -0.31 -0.69 0.00 0.00 174.62 173.28 2ysx s TYR 60 N 4.40 3.03 -0.25 4.92 2.02 -1.01 -4.94 117.35 125.52 2ysx s TYR 60 Ca 0.63 -0.69 -0.24 0.00 -0.37 0.00 0.00 57.07 56.40 2ysx s TYR 60 Cb -0.23 -2.18 -0.01 0.00 -0.40 0.00 0.00 41.96 39.15 2ysx s TYR 60 CO 0.24 -0.46 0.80 -0.98 -1.57 0.00 0.00 175.55 173.58 2ysx s ARG 61 N 1.55 4.15 -0.51 -0.62 1.70 -1.26 0.05 118.95 124.01 2ysx s ARG 61 Ca 0.06 0.86 -0.19 0.00 -0.47 0.00 0.00 55.73 55.99 2ysx s ARG 61 Cb -0.15 -3.66 0.07 0.00 -0.57 0.00 0.00 34.95 30.64 2ysx s ARG 61 CO 0.00 -0.53 0.60 0.42 -1.08 0.00 0.00 175.30 174.71 2ysx s ILE 62 N 2.83 4.92 -0.14 4.99 1.09 -0.32 -4.64 121.20 129.93 2ysx s ILE 62 Ca 0.34 -0.63 -0.11 0.00 -1.10 0.00 0.00 60.65 59.15 2ysx s ILE 62 Cb -0.15 -4.29 -0.05 0.00 -1.06 0.00 0.00 42.46 36.91 2ysx s ILE 62 CO 0.08 -0.80 0.21 -0.76 -0.10 0.00 0.00 174.94 173.57 2ysx s LEU 63 N 2.48 4.30 0.51 2.97 2.01 -0.89 -2.51 118.68 127.56 2ysx s LEU 63 Ca 0.13 0.46 -0.21 0.00 0.01 0.00 0.00 54.13 54.53 2ysx s LEU 63 Cb -0.20 -2.22 -0.06 0.00 0.01 0.00 0.00 46.19 43.71 2ysx s LEU 63 CO 0.11 0.24 1.14 -2.16 1.01 0.00 0.00 176.35 176.69 2ysx s PRO 64 N -0.20 3.52 0.35 1.29 0.04 -1.26 -3.85 135.00 134.89 2ysx s PRO 64 Ca 0.14 1.67 0.02 0.00 0.04 0.00 0.00 61.00 62.88 2ysx s PRO 64 Cb -0.12 -2.16 0.06 0.00 0.04 0.00 0.00 34.50 32.32 2ysx s PRO 64 CO 0.03 -0.73 0.48 0.27 0.04 0.00 0.00 177.00 177.09 2ysx n ASN 65 N -0.98 0.90 0.26 6.66 6.94 -1.24 -4.85 115.26 122.95 2ysx n ASN 65 Ca 0.10 -1.70 0.18 0.00 -0.02 0.00 0.00 54.58 53.14 2ysx n ASN 65 Cb 0.50 -0.28 0.87 0.00 -2.36 0.00 0.00 39.78 38.51 2ysx n ASN 65 CO 0.00 0.00 0.00 1.05 -1.03 0.00 0.00 177.26 177.28 2ysx h GLU 66 N 0.00 0.00 -0.70 -3.83 4.11 -1.97 0.40 114.58 112.59 2ysx h GLU 66 Ca -0.16 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 59.05 2ysx h GLU 66 Cb 0.65 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.77 2ysx h GLU 66 CO 0.19 0.00 0.26 -0.25 0.07 0.00 0.00 179.01 179.29 2ysx n ASP 67 N -3.28 4.52 -3.32 3.06 8.00 -1.26 -4.91 116.55 119.35 2ysx n ASP 67 Ca 0.00 -3.29 -0.21 0.00 0.71 0.00 0.00 54.79 52.00 2ysx n ASP 67 Cb 0.36 -0.73 -0.01 0.00 -0.02 0.00 0.00 41.12 40.71 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 -0.34 -3.01 -2.99 -2.24 9.92 0.14 -4.92 116.55 113.11 2ysx n ASP 68 Ca 0.41 -0.32 -0.14 0.00 -0.53 0.00 0.00 54.79 54.20 2ysx n ASP 68 Cb 1.36 -2.54 0.10 0.00 -0.64 0.00 0.00 41.12 39.40 2ysx n ASP 68 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2ysx n LYS 69 N -3.50 -0.52 -3.99 -1.24 4.76 -1.26 -4.77 118.16 107.64 2ysx n LYS 69 Ca -0.00 -1.07 -0.31 0.00 -2.87 0.00 0.00 58.31 54.06 2ysx n LYS 69 Cb 0.53 -0.63 -0.15 0.00 -1.84 0.00 0.00 35.03 32.93 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 -2.31 3.23 0.02 2.13 0.08 -0.23 -3.68 117.98 117.22 2ysx s PHE 70 Ca 0.37 -2.54 0.02 0.00 0.12 0.00 0.00 56.93 54.90 2ysx s PHE 70 Cb -0.01 -2.39 -0.01 0.00 -0.57 0.00 0.00 43.02 40.04 2ysx s PHE 70 CO 0.26 -0.90 -0.07 -0.08 -0.10 0.00 0.00 175.22 174.32 2ysx s THR 71 N 1.09 0.52 -0.15 0.64 -1.32 -1.25 -3.66 115.64 111.51 2ysx s THR 71 Ca 0.04 -0.64 0.29 0.00 -1.21 0.00 0.00 61.69 60.18 2ysx s THR 71 Cb -0.19 -0.51 0.36 0.00 -1.51 0.00 0.00 72.50 70.66 2ysx s THR 71 CO -0.09 -0.10 1.83 0.58 -2.21 0.00 0.00 174.62 174.63 2ysx h VAL 72 N 4.76 0.00 -2.52 5.08 2.07 -1.85 -2.36 116.25 121.43 2ysx h VAL 72 Ca -0.32 -0.66 -0.36 0.00 0.82 0.00 0.00 66.70 66.18 2ysx h VAL 72 Cb 1.20 1.65 -0.06 0.00 -1.52 0.00 0.00 31.29 32.55 2ysx h VAL 72 CO 0.46 0.00 -0.41 0.00 0.02 0.00 0.00 177.57 177.63 2ysx n GLN 73 N -3.01 -1.70 -0.74 1.57 1.13 -1.26 -4.62 117.38 108.75 2ysx n GLN 73 Ca 0.02 0.94 -0.33 0.00 -1.94 0.00 0.00 57.00 55.69 2ysx n GLN 73 Cb 0.38 -5.47 0.15 0.00 0.11 0.00 0.00 30.24 25.41 2ysx n GLN 73 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2ysx n ALA 74 N -0.96 -3.92 -0.08 -1.58 0.00 -1.26 -4.97 120.51 107.74 2ysx n ALA 74 Ca -0.20 -1.10 -0.11 0.00 0.00 0.00 0.00 53.44 52.03 2ysx n ALA 74 Cb 0.63 -1.53 -0.06 0.00 0.00 0.00 0.00 19.45 18.49 2ysx n ALA 74 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2ysx h SER 75 N -1.83 0.00 -1.69 0.00 0.02 -2.00 -3.47 113.55 104.58 2ysx h SER 75 Ca -0.50 -0.31 -0.64 0.00 -0.84 0.00 0.00 61.79 59.51 2ysx h SER 75 Cb 1.34 0.00 0.11 0.00 0.14 0.00 0.00 62.40 63.99 2ysx h SER 75 CO 0.36 1.01 -0.22 -1.84 -1.14 0.00 0.00 176.83 175.00 2ysx n GLU 76 N -4.58 0.63 -0.98 3.45 -0.00 -1.26 -4.53 120.64 113.38 2ysx n GLU 76 Ca -0.15 0.22 0.00 0.00 -0.00 0.00 0.00 57.16 57.23 2ysx n GLU 76 Cb 0.40 -1.40 0.00 0.00 -0.00 0.00 0.00 31.44 30.44 2ysx n GLU 76 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2ysx n GLY 77 N 1.64 -4.23 0.13 -1.84 0.00 -1.26 -4.91 105.19 94.72 2ysx n GLY 77 Ca 0.14 -0.69 -0.22 0.00 0.00 0.00 0.00 46.02 45.25 2ysx n GLY 77 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2ysx h VAL 78 N 1.59 1.41 -1.26 1.61 3.04 -1.97 -3.46 116.25 117.21 2ysx h VAL 78 Ca 0.00 -2.59 -0.72 0.00 -1.01 0.00 0.00 66.70 62.39 2ysx h VAL 78 Cb 0.00 3.10 0.08 0.00 -2.01 0.00 0.00 31.29 32.46 2ysx h VAL 78 CO 0.00 0.75 -0.06 -1.54 -1.01 0.00 0.00 177.57 175.72 2ysx n SER 79 N -3.95 -0.01 -4.37 3.17 3.41 -1.26 -4.95 113.62 105.66 2ysx n SER 79 Ca -0.15 1.15 -0.32 0.00 -0.26 0.00 0.00 58.87 59.28 2ysx n SER 79 Cb 0.94 -1.01 -0.15 0.00 -0.26 0.00 0.00 64.21 63.74 2ysx n SER 79 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 2ysx s MET 80 N -0.40 2.85 0.18 4.33 1.75 -1.26 -5.10 119.30 121.65 2ysx s MET 80 Ca 0.78 -0.76 0.03 0.00 -1.25 0.00 0.00 55.69 54.49 2ysx s MET 80 Cb -1.05 -2.40 -0.05 0.00 2.84 0.00 0.00 34.83 34.17 2ysx s MET 80 CO 0.55 0.39 -0.04 1.03 -0.65 0.00 0.00 175.02 176.30 2ysx s ARG 81 N -0.14 1.16 -0.11 4.11 0.52 -1.26 -5.16 118.95 118.07 2ysx s ARG 81 Ca -0.02 -1.55 -0.07 0.00 -0.52 0.00 0.00 55.73 53.58 2ysx s ARG 81 Cb -0.14 -0.53 0.04 0.00 0.52 0.00 0.00 34.95 34.85 2ysx s ARG 81 CO 0.04 -0.04 0.27 -0.06 0.02 0.00 0.00 175.30 175.53 2ysx s PHE 82 N -3.44 -0.36 0.25 -0.53 0.08 -1.26 -4.79 117.98 107.93 2ysx s PHE 82 Ca 0.22 0.83 0.10 0.00 0.12 0.00 0.00 56.93 58.20 2ysx s PHE 82 Cb 0.05 0.09 -0.04 0.00 -0.57 0.00 0.00 43.02 42.54 2ysx s PHE 82 CO 0.04 -0.23 -0.07 -0.06 -0.10 0.00 0.00 175.22 174.80 2ysx s PHE 83 N 1.05 2.59 -0.17 0.36 0.40 -1.24 -4.93 117.98 116.04 2ysx s PHE 83 Ca -0.07 -0.25 -0.16 0.00 -0.60 0.00 0.00 56.93 55.85 2ysx s PHE 83 Cb -0.08 -1.17 -0.12 0.00 0.51 0.00 0.00 43.02 42.15 2ysx s PHE 83 CO -0.07 0.61 0.08 1.15 0.70 0.00 0.00 175.22 177.69 2ysx h THR 84 N 2.21 0.56 -3.15 0.64 2.02 -1.95 -0.58 112.91 112.65 2ysx h THR 84 Ca -0.44 -1.67 -0.60 0.00 0.77 0.00 0.00 66.41 64.48 2ysx h THR 84 Cb 1.24 1.30 -0.07 0.00 -1.74 0.00 0.00 68.15 68.88 2ysx h THR 84 CO 0.58 0.19 -0.21 -0.54 0.37 0.00 0.00 175.52 175.91 2ysx s LYS 85 N -2.27 4.10 0.19 6.66 1.02 -1.26 -4.67 119.74 123.51 2ysx s LYS 85 Ca -0.21 0.36 -0.13 0.00 0.02 0.00 0.00 55.97 56.00 2ysx s LYS 85 Cb 0.04 -3.32 0.20 0.00 -0.52 0.00 0.00 37.83 34.23 2ysx s LYS 85 CO 0.42 0.45 1.68 1.25 -0.92 0.00 0.00 175.35 178.23 2ysx h LEU 86 N 5.68 -0.24 0.11 3.17 7.12 -1.95 -2.20 115.31 127.02 2ysx h LEU 86 Ca -0.47 0.13 0.02 0.00 0.13 0.00 0.00 57.88 57.69 2ysx h LEU 86 Cb 1.20 0.23 -0.04 0.00 -0.53 0.00 0.00 40.66 41.51 2ysx h LEU 86 CO 0.68 -0.08 -0.31 -0.78 -0.13 0.00 0.00 178.44 177.82 2ysx h ASP 87 N 0.11 -0.90 -1.27 1.25 3.58 -2.00 -1.38 116.42 115.80 2ysx h ASP 87 Ca 0.26 0.10 0.45 0.00 0.42 0.00 0.00 57.03 58.26 2ysx h ASP 87 Cb 0.40 0.34 -0.14 0.00 1.72 0.00 0.00 39.33 41.65 2ysx h ASP 87 CO -0.44 -0.40 0.80 1.56 -2.88 0.00 0.00 179.24 177.88 2ysx h GLN 88 N -0.53 0.04 -0.15 0.28 4.20 -1.81 0.89 115.11 118.02 2ysx h GLN 88 Ca 0.03 -0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.64 2ysx h GLN 88 Cb 0.57 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.34 2ysx h GLN 88 CO -0.19 0.03 -0.28 1.25 -0.67 0.00 0.00 178.83 178.97 2ysx h LEU 89 N 0.04 0.51 -1.10 1.46 6.46 -1.11 -3.06 115.31 118.52 2ysx h LEU 89 Ca 0.85 -0.55 0.21 0.00 -0.12 0.00 0.00 57.88 58.27 2ysx h LEU 89 Cb 2.60 -0.15 -0.10 0.00 -0.73 0.00 0.00 40.66 42.28 2ysx h LEU 89 CO -0.52 0.96 0.61 0.40 -0.62 0.00 0.00 178.44 179.28 2ysx h ILE 90 N 0.08 0.67 -0.46 4.05 1.08 0.12 0.13 117.51 123.18 2ysx h ILE 90 Ca 0.01 -0.23 -0.12 0.00 -0.39 0.00 0.00 64.86 64.13 2ysx h ILE 90 Cb 0.87 -0.06 -0.01 0.00 -3.07 0.00 0.00 36.82 34.54 2ysx h ILE 90 CO 0.06 0.12 -0.19 -0.33 -0.69 0.00 0.00 178.15 177.13 2ysx h GLU 91 N 0.67 0.91 -0.46 2.37 5.08 -1.40 -2.96 114.58 118.79 2ysx h GLU 91 Ca 0.58 -0.36 -0.07 0.00 -1.00 0.00 0.00 59.36 58.50 2ysx h GLU 91 Cb 1.02 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.21 2ysx h GLU 91 CO -0.36 1.02 0.00 0.35 -1.00 0.00 0.00 179.01 179.01 2ysx h PHE 92 N 0.79 0.79 -0.45 4.33 3.04 -0.70 -2.65 116.94 122.09 2ysx h PHE 92 Ca 0.11 -0.11 -0.28 0.00 3.98 0.00 0.00 57.97 61.68 2ysx h PHE 92 Cb 0.74 -0.22 -0.13 0.00 2.56 0.00 0.00 35.95 38.89 2ysx h PHE 92 CO 0.04 0.74 0.36 0.66 -2.02 0.00 0.00 178.31 178.09 2ysx n TYR 93 N -4.22 1.44 -0.05 0.41 4.02 -0.46 -4.06 117.16 114.24 2ysx n TYR 93 Ca 0.02 -1.61 -0.13 0.00 -0.01 0.00 0.00 57.90 56.18 2ysx n TYR 93 Cb 0.29 -0.79 -0.14 0.00 -0.02 0.00 0.00 39.34 38.68 2ysx n TYR 93 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 2ysx n LYS 94 N 0.15 0.68 -0.50 -0.72 4.76 -1.00 -4.03 118.16 117.50 2ysx n LYS 94 Ca 0.28 0.20 -0.28 0.00 -2.87 0.00 0.00 58.31 55.64 2ysx n LYS 94 Cb 0.75 -1.68 0.22 0.00 -1.84 0.00 0.00 35.03 32.48 2ysx n LYS 94 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2ysx n LYS 95 N -3.09 -2.70 -0.00 1.97 4.76 -1.26 -3.97 118.16 113.88 2ysx n LYS 95 Ca -0.27 -0.78 -0.00 0.00 -2.87 0.00 0.00 58.31 54.39 2ysx n LYS 95 Cb 1.07 -1.83 -0.00 0.00 -1.84 0.00 0.00 35.03 32.43 2ysx n LYS 95 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 2ysx n GLU 96 N -3.62 2.01 -0.14 1.97 0.28 -1.26 -4.35 120.64 115.52 2ysx n GLU 96 Ca 0.04 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.94 2ysx n GLU 96 Cb 0.55 -1.01 -0.01 0.00 1.43 0.00 0.00 31.44 32.40 2ysx n GLU 96 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 2ysx h ASN 97 N 0.00 0.68 -3.86 -1.84 4.21 -1.96 -3.38 115.58 109.43 2ysx h ASN 97 Ca -0.01 -0.28 -0.62 0.00 1.21 0.00 0.00 56.30 56.60 2ysx h ASN 97 Cb 1.01 -0.18 -0.40 0.00 -1.12 0.00 0.00 38.32 37.63 2ysx h ASN 97 CO -0.00 0.79 -0.69 -0.32 -1.29 0.00 0.00 177.43 175.92 2ysx s MET 98 N -5.11 1.61 0.00 0.81 1.75 -1.26 -5.03 119.30 112.06 2ysx s MET 98 Ca -0.13 -2.31 0.00 0.00 -1.25 0.00 0.00 55.69 52.01 2ysx s MET 98 Cb 0.10 -2.78 0.00 0.00 2.84 0.00 0.00 34.83 34.99 2ysx s MET 98 CO 0.79 -1.14 0.00 0.41 -0.65 0.00 0.00 175.02 174.42 2ysx n GLY 99 N 3.31 2.58 3.11 2.11 0.00 -1.26 -4.72 105.19 110.32 2ysx n GLY 99 Ca 0.07 0.02 -0.16 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 0.00 -0.26 0.99 4.77 -1.26 -4.96 117.00 116.28 2ysx n LEU 100 Ca 0.00 -2.01 0.09 0.00 -0.03 0.00 0.00 56.01 54.06 2ysx n LEU 100 Cb 0.00 -0.32 0.19 0.00 -2.33 0.00 0.00 43.42 40.95 2ysx n LEU 100 CO 0.00 -0.66 0.56 0.55 -1.33 0.00 0.00 177.39 176.51 2ysx n VAL 101 N -1.98 -0.31 -3.94 4.08 3.14 -1.26 -4.40 118.33 113.66 2ysx n VAL 101 Ca 0.12 1.62 -0.10 0.00 -2.96 0.00 0.00 64.34 63.02 2ysx n VAL 101 Cb 0.48 -2.34 -0.11 0.00 -1.06 0.00 0.00 33.84 30.81 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 -5.71 0.09 0.39 1.55 -1.32 -1.26 -5.15 115.64 104.23 2ysx s THR 102 Ca -0.10 -0.71 -0.25 0.00 -1.21 0.00 0.00 61.69 59.42 2ysx s THR 102 Cb 0.21 -0.26 -0.09 0.00 -1.51 0.00 0.00 72.50 70.86 2ysx s THR 102 CO 0.57 -0.39 1.15 -1.38 -2.21 0.00 0.00 174.62 172.36 2ysx s HIS 103 N -1.19 3.13 -0.26 9.09 0.00 -1.26 -4.93 115.29 119.88 2ysx s HIS 103 Ca -0.13 1.58 -0.28 0.00 -3.00 0.00 0.00 55.06 53.22 2ysx s HIS 103 Cb -0.08 -3.35 -0.04 0.00 -4.00 0.00 0.00 32.58 25.12 2ysx s HIS 103 CO -0.00 -1.17 1.99 -0.51 -1.00 0.00 0.00 174.74 174.05 2ysx s LEU 104 N -2.43 3.53 -0.03 5.38 1.43 -1.25 -4.78 118.68 120.53 2ysx s LEU 104 Ca 0.56 1.65 -0.01 0.00 -1.03 0.00 0.00 54.13 55.30 2ysx s LEU 104 Cb -0.29 -3.52 -0.00 0.00 0.03 0.00 0.00 46.19 42.40 2ysx s LEU 104 CO 0.37 -1.78 -0.02 1.56 0.23 0.00 0.00 176.35 176.71 2ysx h GLN 105 N 13.70 0.00 -4.49 1.70 4.20 -1.84 -3.48 115.11 124.90 2ysx h GLN 105 Ca -0.38 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 57.77 2ysx h GLN 105 Cb 1.20 0.00 -0.36 0.00 0.30 0.00 0.00 27.48 28.63 2ysx h GLN 105 CO 0.99 0.00 -0.82 0.71 -0.67 0.00 0.00 178.83 179.04 2ysx s TYR 106 N -1.20 1.76 -1.12 2.96 2.02 -1.26 -5.05 117.35 115.46 2ysx s TYR 106 Ca -0.02 -0.88 -0.23 0.00 -0.37 0.00 0.00 57.07 55.57 2ysx s TYR 106 Cb 0.00 -1.35 -0.08 0.00 -0.40 0.00 0.00 41.96 40.14 2ysx s TYR 106 CO 0.03 -0.52 1.94 -1.25 -1.57 0.00 0.00 175.55 174.17 2ysx s PRO 107 N 1.38 2.52 -0.29 -1.71 0.04 -1.26 -3.90 135.00 131.77 2ysx s PRO 107 Ca 0.00 -0.98 -0.37 0.00 0.04 0.00 0.00 61.00 59.69 2ysx s PRO 107 Cb -0.13 -5.21 -0.16 0.00 0.04 0.00 0.00 34.50 29.04 2ysx s PRO 107 CO -0.06 -3.84 1.19 1.33 0.04 0.00 0.00 177.00 175.65 2ysx n VAL 108 N 7.81 0.00 -0.82 -0.36 0.24 -1.22 -4.42 118.33 119.56 2ysx n VAL 108 Ca 0.44 0.00 -0.18 0.00 -2.04 0.00 0.00 64.34 62.56 2ysx n VAL 108 Cb 0.47 -0.29 0.15 0.00 -1.47 0.00 0.00 33.84 32.69 2ysx n VAL 108 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2ysx n PRO 109 N 2.69 -2.30 -2.28 7.34 -0.04 -1.26 -3.77 135.00 135.38 2ysx n PRO 109 Ca 0.23 -1.05 -0.26 0.00 -0.04 0.00 0.00 63.50 62.38 2ysx n PRO 109 Cb -0.02 -0.98 0.13 0.00 -0.04 0.00 0.00 33.50 32.60 2ysx n PRO 109 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2ysx s LEU 110 N 0.00 2.85 -0.53 1.53 1.43 -1.24 -4.85 118.68 117.88 2ysx s LEU 110 Ca 0.42 -0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.54 2ysx s LEU 110 Cb -0.04 -2.24 0.42 0.00 0.03 0.00 0.00 46.19 44.36 2ysx s LEU 110 CO 0.33 -2.18 1.44 1.21 0.23 0.00 0.00 176.35 177.38 2ysx n GLU 111 N -3.22 3.23 -4.39 1.70 2.13 -1.26 -5.02 120.64 113.82 2ysx n GLU 111 Ca 0.14 -4.07 -0.30 0.00 0.66 0.00 0.00 57.16 53.59 2ysx n GLU 111 Cb 0.60 -2.27 -0.11 0.00 0.27 0.00 0.00 31.44 29.93 2ysx n GLU 111 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2ysx s GLU 112 N -3.71 2.08 0.20 5.31 2.02 -1.26 -5.14 118.70 118.21 2ysx s GLU 112 Ca 0.52 -1.01 0.09 0.00 0.02 0.00 0.00 54.97 54.59 2ysx s GLU 112 Cb 0.42 -2.25 -0.04 0.00 0.10 0.00 0.00 34.13 32.36 2ysx s GLU 112 CO -0.17 0.52 -0.07 -1.21 0.02 0.00 0.00 175.26 174.35 2ysx s GLU 113 N -1.88 2.12 -0.29 1.61 2.02 -1.26 -5.11 118.70 115.91 2ysx s GLU 113 Ca 0.18 -1.31 -0.17 0.00 0.02 0.00 0.00 54.97 53.69 2ysx s GLU 113 Cb -0.11 -2.16 -0.02 0.00 0.10 0.00 0.00 34.13 31.94 2ysx s GLU 113 CO 0.10 0.42 0.49 0.34 0.02 0.00 0.00 175.26 176.63 2ysx s ASP 114 N -3.04 6.37 0.01 -0.19 -1.08 -1.26 -4.96 116.67 112.51 2ysx s ASP 114 Ca 0.27 0.32 -0.22 0.00 -0.52 0.00 0.00 52.55 52.40 2ysx s ASP 114 Cb -0.08 -2.27 -0.18 0.00 -1.46 0.00 0.00 42.92 38.93 2ysx s ASP 114 CO 0.16 -0.33 1.23 0.71 0.52 0.00 0.00 175.17 177.46 2ysx h THR 115 N 5.46 1.41 0.00 1.71 1.35 -2.08 -3.49 112.91 117.27 2ysx h THR 115 Ca -0.29 -1.53 0.00 0.00 -0.55 0.00 0.00 66.41 64.04 2ysx h THR 115 Cb 1.14 2.21 0.00 0.00 -1.73 0.00 0.00 68.15 69.77 2ysx h THR 115 CO 0.72 0.43 0.00 0.61 -0.25 0.00 0.00 175.52 177.04 2ysx n GLY 116 N 0.50 1.32 2.97 5.82 0.00 -1.26 -5.11 105.19 109.43 2ysx n GLY 116 Ca -0.08 0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 2.00 4.61 0.38 1.61 2.15 -1.26 -5.10 116.67 121.06 2ysx s ASP 117 Ca 0.00 -2.03 -0.24 0.00 0.43 0.00 0.00 52.55 50.71 2ysx s ASP 117 Cb 0.00 -1.48 -0.12 0.00 -0.30 0.00 0.00 42.92 41.02 2ysx s ASP 117 CO 0.00 -0.38 0.79 -0.67 -0.17 0.00 0.00 175.17 174.74 2ysx n ASP 118 N 4.37 0.24 0.00 -0.34 -0.08 -1.26 -5.33 116.55 114.15 2ysx n ASP 118 Ca 0.02 1.02 0.08 0.00 -1.51 0.00 0.00 54.79 54.40 2ysx n ASP 118 Cb 0.42 -1.22 0.46 0.00 2.34 0.00 0.00 41.12 43.12 2ysx n ASP 118 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51