#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yu6 s SER 2 N 0.00 6.93 -0.61 1.61 0.01 -1.26 -4.98 113.70 115.39 2yu6 s SER 2 Ca 0.00 -2.78 -0.19 0.00 1.31 0.00 0.00 55.95 54.29 2yu6 s SER 2 Cb 0.00 -2.31 0.10 0.00 0.21 0.00 0.00 66.02 64.02 2yu6 s SER 2 CO 0.00 -0.69 0.74 -0.44 0.41 0.00 0.00 173.24 173.25 2yu6 s SER 3 N 2.57 6.21 0.00 2.44 0.01 -1.26 -5.02 113.70 118.65 2yu6 s SER 3 Ca 0.31 -1.45 0.00 0.00 1.31 0.00 0.00 55.95 56.12 2yu6 s SER 3 Cb -0.07 -2.31 0.00 0.00 0.21 0.00 0.00 66.02 63.85 2yu6 s SER 3 CO -0.07 -1.13 0.00 0.61 0.41 0.00 0.00 173.24 173.07 2yu6 n GLY 4 N 5.26 -0.99 3.53 3.44 0.00 -1.26 -4.91 105.19 110.26 2yu6 n GLY 4 Ca -0.08 -0.22 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 2yu6 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yu6 s SER 5 N -1.46 6.19 -0.22 1.61 0.15 -1.26 -5.03 113.70 113.68 2yu6 s SER 5 Ca 0.00 -0.34 -0.03 0.00 0.70 0.00 0.00 55.95 56.28 2yu6 s SER 5 Cb 0.00 -2.21 0.12 0.00 -1.71 0.00 0.00 66.02 62.22 2yu6 s SER 5 CO 0.00 -0.41 0.32 -0.55 1.20 0.00 0.00 173.24 173.80 2yu6 s SER 6 N 1.75 0.65 -0.10 5.45 0.15 -1.26 -4.95 113.70 115.39 2yu6 s SER 6 Ca 0.12 0.09 -0.30 0.00 0.70 0.00 0.00 55.95 56.55 2yu6 s SER 6 Cb -0.17 0.84 0.12 0.00 -1.71 0.00 0.00 66.02 65.11 2yu6 s SER 6 CO 0.12 -0.31 1.00 -0.83 1.20 0.00 0.00 173.24 174.42 2yu6 s GLY 7 N 2.46 -0.35 0.33 9.45 0.00 -1.26 -4.92 107.32 113.03 2yu6 s GLY 7 Ca 0.10 1.54 -0.22 0.00 0.00 0.00 0.00 44.72 46.13 2yu6 s GLY 7 CO -0.14 0.65 0.88 0.54 0.00 0.00 0.00 173.10 175.02 2yu6 s VAL 8 N -2.20 4.38 0.44 1.40 0.11 -1.26 -3.85 120.40 119.40 2yu6 s VAL 8 Ca 0.03 1.54 0.06 0.00 -2.93 0.00 0.00 61.98 60.69 2yu6 s VAL 8 Cb -0.01 -3.84 0.06 0.00 -1.53 0.00 0.00 36.38 31.07 2yu6 s VAL 8 CO -0.04 0.01 0.52 0.54 -3.33 0.00 0.00 175.10 172.80 2yu6 n ARG 9 N 0.20 0.75 -3.69 1.54 1.74 -1.17 -4.93 116.66 111.09 2yu6 n ARG 9 Ca 0.02 -2.45 -0.18 0.00 -0.77 0.00 0.00 57.85 54.47 2yu6 n ARG 9 Cb 0.52 -0.04 -0.17 0.00 -1.02 0.00 0.00 32.46 31.74 2yu6 n ARG 9 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2yu6 s TYR 10 N -1.84 -0.03 -0.03 -1.55 1.51 -1.26 -1.82 117.35 112.33 2yu6 s TYR 10 Ca 0.40 0.36 0.05 0.00 -1.01 0.00 0.00 57.07 56.87 2yu6 s TYR 10 Cb -0.03 -0.35 -0.01 0.00 -0.11 0.00 0.00 41.96 41.46 2yu6 s TYR 10 CO 0.25 -0.20 -0.19 -0.06 -1.11 0.00 0.00 175.55 174.25 2yu6 s PHE 11 N 1.96 1.77 -0.35 2.71 0.40 -0.48 -0.61 117.98 123.38 2yu6 s PHE 11 Ca 0.01 -0.40 -0.18 0.00 -0.60 0.00 0.00 56.93 55.76 2yu6 s PHE 11 Cb -0.12 -1.16 -0.00 0.00 0.51 0.00 0.00 43.02 42.24 2yu6 s PHE 11 CO -0.04 -0.08 0.51 0.42 0.70 0.00 0.00 175.22 176.72 2yu6 s ILE 12 N -0.28 5.02 -0.32 0.64 -1.09 -0.97 -1.47 121.20 122.73 2yu6 s ILE 12 Ca 0.03 0.36 -0.06 0.00 -2.23 0.00 0.00 60.65 58.75 2yu6 s ILE 12 Cb -0.09 -3.95 0.03 0.00 -1.58 0.00 0.00 42.46 36.86 2yu6 s ILE 12 CO 0.00 -0.20 0.08 -0.04 -1.23 0.00 0.00 174.94 173.56 2yu6 s MET 13 N 2.38 2.79 0.11 2.79 -1.94 -0.86 -1.26 119.30 123.31 2yu6 s MET 13 Ca 0.19 -1.06 -0.17 0.00 -1.71 0.00 0.00 55.69 52.94 2yu6 s MET 13 Cb -0.15 -3.39 -0.07 0.00 2.01 0.00 0.00 34.83 33.23 2yu6 s MET 13 CO 0.13 -0.57 0.55 0.15 -0.01 0.00 0.00 175.02 175.28 2yu6 s LYS 14 N 1.43 4.08 -0.14 2.03 -0.14 -1.26 -2.32 119.74 123.41 2yu6 s LYS 14 Ca -0.00 0.60 0.02 0.00 -1.36 0.00 0.00 55.97 55.23 2yu6 s LYS 14 Cb -0.18 -3.08 0.01 0.00 -1.68 0.00 0.00 37.83 32.90 2yu6 s LYS 14 CO 0.02 0.56 -0.21 -1.12 -0.76 0.00 0.00 175.35 173.84 2yu6 s SER 15 N -1.41 3.04 0.23 2.83 0.01 -1.10 -4.83 113.70 112.47 2yu6 s SER 15 Ca 0.33 -0.59 -0.07 0.00 1.31 0.00 0.00 55.95 56.94 2yu6 s SER 15 Cb -0.17 -1.41 0.41 0.00 0.21 0.00 0.00 66.02 65.06 2yu6 s SER 15 CO 0.19 0.07 1.68 0.28 0.41 0.00 0.00 173.24 175.87 2yu6 h SER 16 N 7.35 -0.05 -3.82 2.44 0.02 -1.96 -1.87 113.55 115.66 2yu6 h SER 16 Ca -0.33 0.14 -0.51 0.00 -0.84 0.00 0.00 61.79 60.26 2yu6 h SER 16 Cb 1.19 0.21 -0.13 0.00 0.14 0.00 0.00 62.40 63.80 2yu6 h SER 16 CO 0.55 -0.05 -0.53 0.21 -1.14 0.00 0.00 176.83 175.88 2yu6 s ASN 17 N -5.25 2.35 -0.12 3.07 2.47 -1.26 -4.39 114.94 111.81 2yu6 s ASN 17 Ca -0.13 -1.64 -0.23 0.00 0.42 0.00 0.00 52.86 51.28 2yu6 s ASN 17 Cb 0.20 0.45 -0.27 0.00 -1.45 0.00 0.00 41.25 40.19 2yu6 s ASN 17 CO 0.75 -0.92 0.66 0.25 -3.72 0.00 0.00 177.10 174.12 2yu6 h LEU 18 N 1.94 0.22 -0.98 3.21 7.12 -1.98 -3.37 115.31 121.48 2yu6 h LEU 18 Ca -0.34 -0.87 0.18 0.00 0.13 0.00 0.00 57.88 56.97 2yu6 h LEU 18 Cb 1.26 -0.07 -0.17 0.00 -0.53 0.00 0.00 40.66 41.15 2yu6 h LEU 18 CO 0.54 1.34 -0.31 -0.09 -0.13 0.00 0.00 178.44 179.79 2yu6 h ARG 19 N -0.66 -0.00 -1.03 1.25 9.65 -1.99 1.20 114.38 122.79 2yu6 h ARG 19 Ca -0.17 0.00 0.26 0.00 -1.10 0.00 0.00 59.98 58.97 2yu6 h ARG 19 Cb 1.41 0.00 -0.10 0.00 -1.39 0.00 0.00 29.97 29.89 2yu6 h ARG 19 CO 0.02 -0.00 0.65 -0.91 2.80 0.00 0.00 179.97 182.53 2yu6 h ASN 20 N -0.00 0.51 -0.37 -3.80 2.35 -2.00 0.24 115.58 112.49 2yu6 h ASN 20 Ca 0.41 0.09 -0.16 0.00 -0.55 0.00 0.00 56.30 56.10 2yu6 h ASN 20 Cb 0.66 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.04 2yu6 h ASN 20 CO -1.00 0.10 -0.37 0.25 -1.65 0.00 0.00 177.43 174.76 2yu6 h LEU 21 N 0.45 0.98 -0.97 1.61 5.85 0.13 -3.09 115.31 120.27 2yu6 h LEU 21 Ca 0.60 -0.44 0.22 0.00 0.84 0.00 0.00 57.88 59.09 2yu6 h LEU 21 Cb 1.41 -0.28 -0.12 0.00 0.37 0.00 0.00 40.66 42.05 2yu6 h LEU 21 CO -0.33 1.24 0.55 -0.33 -0.34 0.00 0.00 178.44 179.23 2yu6 h GLU 22 N 0.76 0.58 -0.76 1.25 4.39 0.11 0.33 114.58 121.25 2yu6 h GLU 22 Ca 0.06 -0.04 0.15 0.00 0.34 0.00 0.00 59.36 59.88 2yu6 h GLU 22 Cb 0.96 -0.13 -0.05 0.00 -0.10 0.00 0.00 28.75 29.43 2yu6 h GLU 22 CO 0.09 0.39 0.51 0.82 -1.16 0.00 0.00 179.01 179.65 2yu6 h ILE 23 N 0.60 0.79 0.00 3.13 5.03 -1.44 0.45 117.51 126.07 2yu6 h ILE 23 Ca 0.60 -0.14 0.00 0.00 -0.12 0.00 0.00 64.86 65.20 2yu6 h ILE 23 Cb 1.06 0.35 0.00 0.00 -3.03 0.00 0.00 36.82 35.20 2yu6 h ILE 23 CO -0.45 0.07 0.00 -1.28 -0.68 0.00 0.00 178.15 175.81 2yu6 h SER 24 N 0.40 0.00 0.66 1.72 0.87 -0.35 0.68 113.55 117.53 2yu6 h SER 24 Ca 0.37 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.70 2yu6 h SER 24 Cb 0.87 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.79 2yu6 h SER 24 CO -0.12 0.00 -1.49 1.56 -0.53 0.00 0.00 176.83 176.26 2yu6 h GLN 25 N 0.00 0.00 0.00 2.24 4.20 0.06 -3.09 115.11 118.52 2yu6 h GLN 25 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2yu6 h GLN 25 Cb 0.75 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.53 2yu6 h GLN 25 CO 0.00 0.46 -0.83 1.04 -0.67 0.00 0.00 178.83 178.83 2yu6 n GLN 26 N -3.02 0.46 0.01 1.46 1.13 -0.37 -4.58 117.38 112.48 2yu6 n GLN 26 Ca -0.12 0.22 -0.02 0.00 -1.94 0.00 0.00 57.00 55.15 2yu6 n GLN 26 Cb 0.95 -1.36 0.25 0.00 0.11 0.00 0.00 30.24 30.20 2yu6 n GLN 26 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 2yu6 h LYS 27 N -0.88 0.49 -0.26 -1.09 1.79 -1.09 -3.47 116.57 112.05 2yu6 h LYS 27 Ca 0.00 -0.14 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 2yu6 h LYS 27 Cb 0.83 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.43 2yu6 h LYS 27 CO 0.00 0.62 0.00 0.41 -1.08 0.00 0.00 179.45 179.40 2yu6 n GLY 28 N -0.63 0.83 3.32 3.86 0.00 -1.14 -5.02 105.19 106.42 2yu6 n GLY 28 Ca 0.01 -0.62 -0.11 0.00 0.00 0.00 0.00 46.02 45.29 2yu6 n GLY 28 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2yu6 s ILE 29 N -2.26 0.00 -0.13 -0.61 -5.25 -1.25 -2.70 121.20 108.99 2yu6 s ILE 29 Ca 0.00 -1.81 -0.07 0.00 -0.99 0.00 0.00 60.65 57.78 2yu6 s ILE 29 Cb 0.00 -2.41 0.05 0.00 2.95 0.00 0.00 42.46 43.05 2yu6 s ILE 29 CO 0.00 0.00 0.31 0.86 -1.79 0.00 0.00 174.94 174.32 2yu6 s TRP 30 N -4.10 -0.45 -0.33 1.37 -0.11 0.14 -3.37 118.94 112.08 2yu6 s TRP 30 Ca 0.34 1.01 -0.05 0.00 1.22 0.00 0.00 56.10 58.62 2yu6 s TRP 30 Cb 0.05 0.13 0.04 0.00 -1.50 0.00 0.00 33.47 32.18 2yu6 s TRP 30 CO 0.11 -0.29 0.07 0.45 -4.62 0.00 0.00 176.95 172.67 2yu6 s SER 31 N 1.47 5.18 0.43 5.86 0.15 -1.26 -2.76 113.70 122.77 2yu6 s SER 31 Ca -0.08 -1.17 0.07 0.00 0.70 0.00 0.00 55.95 55.47 2yu6 s SER 31 Cb -0.10 -1.82 -0.03 0.00 -1.71 0.00 0.00 66.02 62.36 2yu6 s SER 31 CO -0.10 -0.30 0.28 0.28 1.20 0.00 0.00 173.24 174.59 2yu6 s THR 32 N 1.36 2.34 0.39 6.45 -1.32 -1.26 -4.94 115.64 118.67 2yu6 s THR 32 Ca -0.03 -1.54 -0.27 0.00 -1.21 0.00 0.00 61.69 58.64 2yu6 s THR 32 Cb -0.20 -2.89 -0.10 0.00 -1.51 0.00 0.00 72.50 67.80 2yu6 s THR 32 CO 0.02 0.00 1.39 1.07 -2.21 0.00 0.00 174.62 174.88 2yu6 n THR 33 N -1.42 2.28 0.97 5.08 5.66 -1.26 -4.27 114.28 121.33 2yu6 n THR 33 Ca 0.00 -0.50 0.07 0.00 -3.05 0.00 0.00 64.05 60.57 2yu6 n THR 33 Cb 0.64 -1.77 0.41 0.00 -1.55 0.00 0.00 70.33 68.05 2yu6 n THR 33 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 2yu6 n PRO 34 N 0.25 0.49 0.02 1.09 -0.04 -1.26 -2.03 135.00 133.51 2yu6 n PRO 34 Ca 0.04 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.61 2yu6 n PRO 34 Cb 0.39 -1.44 0.08 0.00 -0.04 0.00 0.00 33.50 32.48 2yu6 n PRO 34 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2yu6 n SER 35 N -0.94 0.64 -0.19 3.54 7.64 -1.26 -4.08 113.62 118.97 2yu6 n SER 35 Ca 0.10 -0.31 0.07 0.00 1.01 0.00 0.00 58.87 59.74 2yu6 n SER 35 Cb 0.05 0.63 0.10 0.00 -1.01 0.00 0.00 64.21 63.97 2yu6 n SER 35 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2yu6 n ASN 36 N -1.78 1.69 -0.10 6.43 3.02 -0.86 -4.77 115.26 118.89 2yu6 n ASN 36 Ca 0.03 -2.79 -0.20 0.00 -0.03 0.00 0.00 54.58 51.60 2yu6 n ASN 36 Cb 0.39 -0.37 -0.10 0.00 -0.61 0.00 0.00 39.78 39.10 2yu6 n ASN 36 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2yu6 n GLU 37 N -1.04 0.55 -0.36 3.52 1.02 -1.20 -3.97 120.64 119.15 2yu6 n GLU 37 Ca 0.12 0.53 0.29 0.00 -0.02 0.00 0.00 57.16 58.08 2yu6 n GLU 37 Cb 0.66 -1.71 0.48 0.00 -0.02 0.00 0.00 31.44 30.85 2yu6 n GLU 37 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 2yu6 n ARG 38 N -4.45 -0.02 -0.03 3.49 1.85 -1.26 0.18 116.66 116.43 2yu6 n ARG 38 Ca -0.30 0.81 -0.12 0.00 -1.00 0.00 0.00 57.85 57.25 2yu6 n ARG 38 Cb 0.63 -1.66 -0.10 0.00 -1.05 0.00 0.00 32.46 30.28 2yu6 n ARG 38 CO 0.00 0.00 0.00 1.57 -0.01 0.00 0.00 177.63 179.19 2yu6 h LYS 39 N 0.00 -0.05 -0.85 2.89 2.10 -1.92 -1.82 116.57 116.91 2yu6 h LYS 39 Ca 0.60 0.00 0.02 0.00 -2.00 0.00 0.00 60.65 59.27 2yu6 h LYS 39 Cb 2.05 0.01 -0.04 0.00 -0.90 0.00 0.00 32.23 33.35 2yu6 h LYS 39 CO -0.24 0.61 0.56 -0.07 -2.00 0.00 0.00 179.45 178.31 2yu6 h LEU 40 N -0.86 0.96 0.43 7.07 3.38 0.18 0.57 115.31 127.04 2yu6 h LEU 40 Ca -0.01 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2yu6 h LEU 40 Cb 0.68 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2yu6 h LEU 40 CO 0.01 0.68 -0.21 -1.13 0.09 0.00 0.00 178.44 177.89 2yu6 h ASN 41 N 1.12 -0.49 0.71 -0.43 -0.73 -0.66 -2.50 115.58 112.60 2yu6 h ASN 41 Ca 0.32 -0.08 -0.03 0.00 1.87 0.00 0.00 56.30 58.37 2yu6 h ASN 41 Cb -0.09 0.13 0.01 0.00 0.27 0.00 0.00 38.32 38.63 2yu6 h ASN 41 CO -0.08 -0.07 -0.34 -0.09 -0.37 0.00 0.00 177.43 176.49 2yu6 h ARG 42 N -1.04 -0.92 -0.91 6.67 9.65 -1.23 -2.94 114.38 123.66 2yu6 h ARG 42 Ca -0.06 0.06 0.25 0.00 -1.10 0.00 0.00 59.98 59.14 2yu6 h ARG 42 Cb 0.54 0.21 -0.14 0.00 -1.39 0.00 0.00 29.97 29.18 2yu6 h ARG 42 CO 0.10 -0.59 0.30 0.00 2.80 0.00 0.00 179.97 182.57 2yu6 h ALA 43 N -0.77 1.42 -1.02 2.80 0.00 0.02 0.52 119.26 122.23 2yu6 h ALA 43 Ca -0.10 0.22 0.26 0.00 0.00 0.00 0.00 54.91 55.29 2yu6 h ALA 43 Cb 0.75 0.29 -0.12 0.00 0.00 0.00 0.00 17.79 18.71 2yu6 h ALA 43 CO 0.16 -0.49 0.61 0.35 0.00 0.00 0.00 179.25 179.88 2yu6 h PHE 44 N 0.23 0.94 0.00 0.00 3.57 -1.26 0.68 116.94 121.10 2yu6 h PHE 44 Ca 0.59 0.03 -0.19 0.00 3.53 0.00 0.00 57.97 61.94 2yu6 h PHE 44 Cb 1.24 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.68 2yu6 h PHE 44 CO -0.22 0.05 -1.08 -1.49 -2.23 0.00 0.00 178.31 173.34 2yu6 h TRP 45 N 0.53 0.00 -0.21 0.41 6.55 -0.15 -3.36 115.95 119.72 2yu6 h TRP 45 Ca 0.64 0.00 0.06 0.00 0.95 0.00 0.00 58.89 60.54 2yu6 h TRP 45 Cb 1.32 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.61 2yu6 h TRP 45 CO -0.01 1.25 0.32 0.93 -1.05 0.00 0.00 178.44 179.89 2yu6 h GLU 46 N -1.00 0.00 -5.68 0.49 5.08 -0.32 -3.41 114.58 109.74 2yu6 h GLU 46 Ca -0.28 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.60 2yu6 h GLU 46 Cb 1.17 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.28 2yu6 h GLU 46 CO -0.17 0.00 -0.74 -1.12 -1.00 0.00 0.00 179.01 175.98 2yu6 s SER 47 N -5.21 2.76 0.04 1.42 0.01 0.24 -4.79 113.70 108.16 2yu6 s SER 47 Ca -0.04 -1.02 -0.30 0.00 1.31 0.00 0.00 55.95 55.90 2yu6 s SER 47 Cb 0.13 -0.17 -0.18 0.00 0.21 0.00 0.00 66.02 66.02 2yu6 s SER 47 CO 0.47 -0.13 1.43 -1.28 0.41 0.00 0.00 173.24 174.13 2yu6 h SER 48 N 2.51 -0.67 -3.38 2.44 0.87 -1.80 -3.42 113.55 110.10 2yu6 h SER 48 Ca -0.38 -0.02 -0.45 0.00 -1.23 0.00 0.00 61.79 59.71 2yu6 h SER 48 Cb 1.23 0.17 -0.14 0.00 -0.44 0.00 0.00 62.40 63.22 2yu6 h SER 48 CO 0.62 -0.38 -0.64 -0.63 -0.53 0.00 0.00 176.83 175.26 2yu6 s ILE 49 N -5.44 1.26 -0.27 2.23 1.01 -1.26 -4.94 121.20 113.79 2yu6 s ILE 49 Ca -0.16 -2.05 -0.02 0.00 0.00 0.00 0.00 60.65 58.42 2yu6 s ILE 49 Cb 0.03 -2.55 0.09 0.00 0.01 0.00 0.00 42.46 40.04 2yu6 s ILE 49 CO 0.56 -0.19 0.08 -0.69 0.00 0.00 0.00 174.94 174.70 2yu6 s VAL 50 N -3.26 0.61 0.01 2.92 1.01 -1.26 -3.07 120.40 117.36 2yu6 s VAL 50 Ca 0.32 -1.01 -0.27 0.00 0.00 0.00 0.00 61.98 61.02 2yu6 s VAL 50 Cb 0.06 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 2yu6 s VAL 50 CO 0.12 -0.52 0.84 -0.31 0.00 0.00 0.00 175.10 175.24 2yu6 s TYR 51 N 1.77 3.68 -0.25 5.22 2.02 -0.76 -0.05 117.35 128.99 2yu6 s TYR 51 Ca 0.06 1.54 -0.00 0.00 -0.37 0.00 0.00 57.07 58.29 2yu6 s TYR 51 Cb -0.17 -2.94 0.07 0.00 -0.40 0.00 0.00 41.96 38.52 2yu6 s TYR 51 CO -0.21 0.13 0.00 -0.51 -1.57 0.00 0.00 175.55 173.39 2yu6 s LEU 52 N 0.49 2.38 -0.51 -1.29 1.43 0.14 -1.39 118.68 119.94 2yu6 s LEU 52 Ca 0.44 -1.26 -0.26 0.00 -1.03 0.00 0.00 54.13 52.01 2yu6 s LEU 52 Cb -0.20 -1.03 0.03 0.00 0.03 0.00 0.00 46.19 45.02 2yu6 s LEU 52 CO 0.24 -0.30 1.01 -0.69 0.23 0.00 0.00 176.35 176.84 2yu6 s VAL 53 N 1.50 4.33 0.09 -1.59 1.01 -0.54 -1.12 120.40 124.09 2yu6 s VAL 53 Ca -0.01 0.71 -0.21 0.00 0.00 0.00 0.00 61.98 62.47 2yu6 s VAL 53 Cb -0.18 -4.54 -0.07 0.00 0.00 0.00 0.00 36.38 31.59 2yu6 s VAL 53 CO -0.10 -1.03 0.64 -0.36 0.00 0.00 0.00 175.10 174.25 2yu6 s PHE 54 N 4.12 3.83 -0.22 5.22 0.40 -0.15 -2.03 117.98 129.15 2yu6 s PHE 54 Ca 0.38 1.39 -0.07 0.00 -0.60 0.00 0.00 56.93 58.02 2yu6 s PHE 54 Cb -0.10 -2.60 0.10 0.00 0.51 0.00 0.00 43.02 40.93 2yu6 s PHE 54 CO 0.25 0.54 0.46 -1.12 0.70 0.00 0.00 175.22 176.05 2yu6 s SER 55 N -1.01 -0.42 0.48 1.36 0.01 -0.98 -2.37 113.70 110.77 2yu6 s SER 55 Ca 0.31 1.09 -0.23 0.00 1.31 0.00 0.00 55.95 58.43 2yu6 s SER 55 Cb -0.21 1.53 -0.07 0.00 0.21 0.00 0.00 66.02 67.49 2yu6 s SER 55 CO 0.21 -0.23 1.22 -0.69 0.41 0.00 0.00 173.24 174.16 2yu6 s VAL 56 N 2.67 2.80 0.63 3.43 1.01 -1.26 -2.72 120.40 126.95 2yu6 s VAL 56 Ca -0.02 0.60 -0.18 0.00 0.00 0.00 0.00 61.98 62.38 2yu6 s VAL 56 Cb -0.12 -3.31 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 2yu6 s VAL 56 CO -0.14 -0.01 1.25 0.00 0.00 0.00 0.00 175.10 176.21 2yu6 s GLN 57 N -2.74 2.73 0.00 2.72 -2.07 -0.70 -3.55 119.66 116.05 2yu6 s GLN 57 Ca 0.66 1.95 0.00 0.00 -1.82 0.00 0.00 55.36 56.14 2yu6 s GLN 57 Cb -0.32 -1.88 0.00 0.00 -1.09 0.00 0.00 33.01 29.72 2yu6 s GLN 57 CO 0.39 -1.43 0.00 0.41 -1.32 0.00 0.00 175.29 173.34 2yu6 n GLY 58 N 0.70 1.33 2.65 2.60 0.00 -1.26 -4.93 105.19 106.28 2yu6 n GLY 58 Ca 0.15 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 2yu6 n GLY 58 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yu6 n SER 59 N 3.13 -0.71 -1.62 1.61 2.88 -1.23 -4.81 113.62 112.87 2yu6 n SER 59 Ca 0.00 0.88 -0.02 0.00 -1.33 0.00 0.00 58.87 58.39 2yu6 n SER 59 Cb 0.00 -0.73 0.23 0.00 -0.75 0.00 0.00 64.21 62.97 2yu6 n SER 59 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yu6 n GLY 60 N 1.44 2.97 3.20 0.46 0.00 -1.26 -4.90 105.19 107.09 2yu6 n GLY 60 Ca 0.14 -0.69 -0.12 0.00 0.00 0.00 0.00 46.02 45.35 2yu6 n GLY 60 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2yu6 s HIS 61 N -2.28 1.02 -0.40 1.61 3.76 -1.26 -2.47 115.29 115.27 2yu6 s HIS 61 Ca 0.39 -1.06 -0.19 0.00 -0.15 0.00 0.00 55.06 54.06 2yu6 s HIS 61 Cb 0.31 -0.59 0.01 0.00 1.11 0.00 0.00 32.58 33.42 2yu6 s HIS 61 CO 0.10 -0.29 0.53 -0.06 -0.85 0.00 0.00 174.74 174.17 2yu6 s PHE 62 N -3.76 3.14 0.49 1.40 0.08 0.88 -4.60 117.98 115.62 2yu6 s PHE 62 Ca 0.21 -0.07 0.22 0.00 0.12 0.00 0.00 56.93 57.40 2yu6 s PHE 62 Cb 0.06 -3.04 1.19 0.00 -0.57 0.00 0.00 43.02 40.67 2yu6 s PHE 62 CO 0.01 -0.69 1.64 1.96 -0.10 0.00 0.00 175.22 178.04 2yu6 h GLN 63 N 8.67 0.00 0.00 0.44 1.08 -1.79 -3.08 115.11 120.43 2yu6 h GLN 63 Ca -0.27 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.93 2yu6 h GLN 63 Cb 1.11 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 2yu6 h GLN 63 CO 0.81 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 179.10 2yu6 n GLY 64 N -1.26 0.74 3.39 3.46 0.00 -1.01 -4.67 105.19 105.83 2yu6 n GLY 64 Ca -0.01 -2.08 -0.15 0.00 0.00 0.00 0.00 46.02 43.78 2yu6 n GLY 64 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2yu6 s PHE 65 N -1.44 -0.42 0.01 1.61 -0.71 -1.24 -0.97 117.98 114.81 2yu6 s PHE 65 Ca 0.00 0.56 -0.06 0.00 -1.04 0.00 0.00 56.93 56.40 2yu6 s PHE 65 Cb 0.00 0.31 -0.00 0.00 -1.21 0.00 0.00 43.02 42.11 2yu6 s PHE 65 CO 0.00 -0.59 0.10 -1.54 -1.34 0.00 0.00 175.22 171.85 2yu6 s SER 66 N -1.69 0.09 -0.24 1.98 1.04 -0.27 -3.23 113.70 111.38 2yu6 s SER 66 Ca -0.08 -0.31 -0.08 0.00 0.48 0.00 0.00 55.95 55.96 2yu6 s SER 66 Cb -0.01 0.19 -0.04 0.00 0.10 0.00 0.00 66.02 66.26 2yu6 s SER 66 CO 0.02 -0.38 0.10 0.00 0.98 0.00 0.00 173.24 173.97 2yu6 s ARG 67 N -1.57 3.85 0.15 4.02 1.70 -1.14 0.28 118.95 126.24 2yu6 s ARG 67 Ca -0.14 -0.39 -0.34 0.00 -0.47 0.00 0.00 55.73 54.40 2yu6 s ARG 67 Cb -0.07 -3.39 -0.16 0.00 -0.57 0.00 0.00 34.95 30.76 2yu6 s ARG 67 CO 0.00 -0.04 1.26 -0.12 -1.08 0.00 0.00 175.30 175.32 2yu6 n MET 68 N 4.53 1.30 -0.02 3.89 0.00 0.93 -0.47 117.12 127.26 2yu6 n MET 68 Ca -0.16 0.46 -0.01 0.00 -0.00 0.00 0.00 57.70 57.99 2yu6 n MET 68 Cb 0.52 -2.04 -0.05 0.00 0.00 0.00 0.00 33.22 31.65 2yu6 n MET 68 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 2yu6 n SER 69 N 2.26 3.49 -4.27 6.12 2.88 -1.22 -4.46 113.62 118.41 2yu6 n SER 69 Ca 0.16 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.54 2yu6 n SER 69 Cb 0.24 0.83 -0.10 0.00 -0.75 0.00 0.00 64.21 64.42 2yu6 n SER 69 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yu6 s SER 70 N -3.49 2.01 0.72 -3.46 0.15 -1.25 -5.01 113.70 103.38 2yu6 s SER 70 Ca -0.03 -0.99 -0.11 0.00 0.70 0.00 0.00 55.95 55.52 2yu6 s SER 70 Cb 0.02 -0.05 0.04 0.00 -1.71 0.00 0.00 66.02 64.32 2yu6 s SER 70 CO 0.26 -0.27 1.10 -1.83 1.20 0.00 0.00 173.24 173.69 2yu6 s GLU 71 N -3.60 2.55 -0.01 5.44 -1.05 -1.26 -4.27 118.70 116.50 2yu6 s GLU 71 Ca 0.17 0.26 -0.22 0.00 -0.15 0.00 0.00 54.97 55.03 2yu6 s GLU 71 Cb 0.01 -2.04 -0.05 0.00 -0.44 0.00 0.00 34.13 31.61 2yu6 s GLU 71 CO 0.02 -1.18 0.64 0.42 0.95 0.00 0.00 175.26 176.11 2yu6 s ILE 72 N -3.38 4.90 0.00 1.83 1.01 -1.26 -4.58 121.20 119.72 2yu6 s ILE 72 Ca 0.59 1.33 0.00 0.00 0.00 0.00 0.00 60.65 62.57 2yu6 s ILE 72 Cb -0.11 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.39 2yu6 s ILE 72 CO 0.50 0.38 0.00 0.61 0.00 0.00 0.00 174.94 176.43 2yu6 n GLY 73 N 2.56 0.19 0.27 6.18 0.00 -1.21 -4.92 105.19 108.25 2yu6 n GLY 73 Ca -0.05 -0.22 0.12 0.00 0.00 0.00 0.00 46.02 45.86 2yu6 n GLY 73 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2yu6 n ARG 74 N 0.00 -0.06 -1.68 1.61 3.00 -1.26 -4.18 116.66 114.09 2yu6 n ARG 74 Ca 0.00 1.17 -0.47 0.00 -0.00 0.00 0.00 57.85 58.55 2yu6 n ARG 74 Cb 0.00 -1.86 -0.04 0.00 0.00 0.00 0.00 32.46 30.56 2yu6 n ARG 74 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2yu6 n GLU 75 N -5.10 2.31 -3.79 -0.14 -0.58 -1.25 -4.93 120.64 107.16 2yu6 n GLU 75 Ca 0.18 0.85 -0.12 0.00 -0.42 0.00 0.00 57.16 57.66 2yu6 n GLU 75 Cb 0.60 -2.71 -0.08 0.00 -0.57 0.00 0.00 31.44 28.68 2yu6 n GLU 75 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2yu6 s LYS 76 N 4.11 0.73 0.24 3.49 -0.14 -1.26 -0.99 119.74 125.91 2yu6 s LYS 76 Ca 0.92 -0.47 0.05 0.00 -1.36 0.00 0.00 55.97 55.11 2yu6 s LYS 76 Cb -0.64 0.31 -0.02 0.00 -1.68 0.00 0.00 37.83 35.80 2yu6 s LYS 76 CO 0.50 -0.22 0.20 0.45 -0.76 0.00 0.00 175.35 175.51 2yu6 n SER 77 N 0.80 -0.43 0.02 2.83 2.88 -1.26 -5.01 113.62 113.44 2yu6 n SER 77 Ca -0.19 -2.55 -0.02 0.00 -1.33 0.00 0.00 58.87 54.78 2yu6 n SER 77 Cb 0.58 1.16 -0.01 0.00 -0.75 0.00 0.00 64.21 65.20 2yu6 n SER 77 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2yu6 n GLN 78 N -0.46 0.09 -1.65 -1.46 7.27 -1.26 -5.00 117.38 114.92 2yu6 n GLN 78 Ca 0.05 0.04 -0.55 0.00 0.07 0.00 0.00 57.00 56.61 2yu6 n GLN 78 Cb 0.43 -0.63 -0.07 0.00 2.41 0.00 0.00 30.24 32.38 2yu6 n GLN 78 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 2yu6 n ASP 79 N -3.59 2.47 -3.60 1.69 9.92 -1.26 -4.91 116.55 117.27 2yu6 n ASP 79 Ca -0.02 0.93 -0.10 0.00 -0.53 0.00 0.00 54.79 55.07 2yu6 n ASP 79 Cb 0.09 -1.19 -0.06 0.00 -0.64 0.00 0.00 41.12 39.32 2yu6 n ASP 79 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 2yu6 s TRP 80 N 4.40 -0.40 0.15 1.24 0.23 -1.26 -5.03 118.94 118.27 2yu6 s TRP 80 Ca 1.00 0.80 0.07 0.00 -2.03 0.00 0.00 56.10 55.95 2yu6 s TRP 80 Cb -0.99 0.42 -0.09 0.00 0.03 0.00 0.00 33.47 32.84 2yu6 s TRP 80 CO 0.61 -0.30 1.35 0.78 0.96 0.00 0.00 176.95 180.35 2yu6 h GLY 81 N 3.12 0.01 -7.32 0.98 0.00 -1.94 -3.42 103.07 94.50 2yu6 h GLY 81 Ca -0.22 -0.03 -0.67 0.00 0.00 0.00 0.00 47.33 46.41 2yu6 h GLY 81 CO 0.24 0.03 -0.78 -1.35 0.00 0.00 0.00 176.54 174.67 2yu6 s SER 82 N -6.76 4.22 0.49 0.19 1.04 -1.26 -4.98 113.70 106.64 2yu6 s SER 82 Ca 0.00 -1.10 0.19 0.00 0.48 0.00 0.00 55.95 55.52 2yu6 s SER 82 Cb 0.10 -1.59 1.21 0.00 0.10 0.00 0.00 66.02 65.85 2yu6 s SER 82 CO 0.81 -0.15 2.05 0.00 0.98 0.00 0.00 173.24 176.93 2yu6 h ALA 83 N 7.90 1.62 0.00 5.32 0.00 -1.98 -3.32 119.26 128.79 2yu6 h ALA 83 Ca -0.28 -0.12 -0.62 0.00 0.00 0.00 0.00 54.91 53.89 2yu6 h ALA 83 Cb 1.08 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.86 2yu6 h ALA 83 CO 0.53 0.17 2.78 0.41 0.00 0.00 0.00 179.25 183.14 2yu6 n GLY 84 N -1.02 3.39 3.57 0.00 0.00 -1.26 -4.85 105.19 105.01 2yu6 n GLY 84 Ca -0.02 -1.30 -0.26 0.00 0.00 0.00 0.00 46.02 44.43 2yu6 n GLY 84 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yu6 s LEU 85 N 1.13 2.30 0.00 0.99 1.43 -1.25 -4.94 118.68 118.34 2yu6 s LEU 85 Ca 0.52 -1.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.11 2yu6 s LEU 85 Cb 0.14 -0.50 0.00 0.00 0.03 0.00 0.00 46.19 45.86 2yu6 s LEU 85 CO 0.01 -0.71 0.00 0.61 0.23 0.00 0.00 176.35 176.49 2yu6 n GLY 86 N -0.93 5.27 3.66 -3.19 0.00 -1.26 -5.02 105.19 103.72 2yu6 n GLY 86 Ca -0.08 -1.47 -0.47 0.00 0.00 0.00 0.00 46.02 44.01 2yu6 n GLY 86 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yu6 n GLY 87 N 2.91 0.99 3.93 -0.02 0.00 -1.26 -4.91 105.19 106.83 2yu6 n GLY 87 Ca 0.00 0.64 -0.28 0.00 0.00 0.00 0.00 46.02 46.38 2yu6 n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2yu6 s VAL 88 N 0.73 5.27 0.05 1.61 1.01 -0.16 -4.62 120.40 124.29 2yu6 s VAL 88 Ca 0.78 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.37 2yu6 s VAL 88 Cb -0.71 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 31.94 2yu6 s VAL 88 CO 0.40 -0.06 -0.07 0.72 0.00 0.00 0.00 175.10 176.09 2yu6 s PHE 89 N -1.74 0.68 0.75 5.22 -0.71 -1.11 -3.36 117.98 117.71 2yu6 s PHE 89 Ca 0.37 -0.62 -0.12 0.00 -1.04 0.00 0.00 56.93 55.52 2yu6 s PHE 89 Cb -0.12 -0.41 0.04 0.00 -1.21 0.00 0.00 43.02 41.33 2yu6 s PHE 89 CO 0.28 -0.12 1.11 0.15 -1.34 0.00 0.00 175.22 175.30 2yu6 s LYS 90 N -2.18 2.45 -0.08 1.99 1.02 -1.26 -0.69 119.74 120.99 2yu6 s LYS 90 Ca -0.05 0.43 -0.09 0.00 0.02 0.00 0.00 55.97 56.28 2yu6 s LYS 90 Cb -0.06 -1.98 0.02 0.00 -0.52 0.00 0.00 37.83 35.30 2yu6 s LYS 90 CO -0.01 -1.32 0.24 0.14 -0.92 0.00 0.00 175.35 173.48 2yu6 s VAL 91 N -3.35 0.01 -1.07 3.17 -7.23 -1.10 -3.44 120.40 107.39 2yu6 s VAL 91 Ca 0.60 -0.08 -0.07 0.00 -1.81 0.00 0.00 61.98 60.62 2yu6 s VAL 91 Cb -0.12 -0.36 0.28 0.00 0.56 0.00 0.00 36.38 36.74 2yu6 s VAL 91 CO 0.52 -0.04 1.16 1.21 -0.31 0.00 0.00 175.10 177.64 2yu6 n GLU 92 N 2.74 3.65 -1.61 4.82 2.13 0.38 -4.79 120.64 127.95 2yu6 n GLU 92 Ca -0.14 -4.49 -0.48 0.00 0.66 0.00 0.00 57.16 52.71 2yu6 n GLU 92 Cb 0.58 -2.52 -0.04 0.00 0.27 0.00 0.00 31.44 29.73 2yu6 n GLU 92 CO 0.00 0.00 0.00 0.91 -0.41 0.00 0.00 177.13 177.63 2yu6 n TRP 93 N 2.24 1.68 -0.05 4.31 7.02 -1.26 -2.88 117.44 128.50 2yu6 n TRP 93 Ca 0.24 0.56 -0.07 0.00 -1.02 0.00 0.00 57.50 57.22 2yu6 n TRP 93 Cb 0.37 -2.37 -0.02 0.00 -2.42 0.00 0.00 31.31 26.87 2yu6 n TRP 93 CO 0.00 0.00 0.00 -0.89 -2.02 0.00 0.00 177.69 174.78 2yu6 n ILE 94 N 2.07 1.39 -5.22 -0.99 -0.00 -1.20 -4.94 119.36 110.47 2yu6 n ILE 94 Ca 0.15 0.21 -0.31 0.00 -0.00 0.00 0.00 62.75 62.80 2yu6 n ILE 94 Cb 0.26 -2.14 -0.17 0.00 -0.00 0.00 0.00 39.64 37.59 2yu6 n ILE 94 CO 0.00 0.00 0.00 -0.13 -0.00 0.00 0.00 176.55 176.42 2yu6 s ARG 95 N -2.64 2.61 -0.18 0.38 1.81 -1.26 -5.01 118.95 114.67 2yu6 s ARG 95 Ca -0.21 -0.87 0.17 0.00 -1.72 0.00 0.00 55.73 53.09 2yu6 s ARG 95 Cb 0.03 -2.15 0.48 0.00 -0.45 0.00 0.00 34.95 32.86 2yu6 s ARG 95 CO 0.32 0.32 1.37 1.63 -0.68 0.00 0.00 175.30 178.25 2yu6 n LYS 96 N 3.11 2.47 -3.13 3.54 5.02 -1.26 -3.73 118.16 124.18 2yu6 n LYS 96 Ca -0.18 -2.82 -0.39 0.00 -2.02 0.00 0.00 58.31 52.90 2yu6 n LYS 96 Cb 0.52 -1.77 -0.06 0.00 -0.02 0.00 0.00 35.03 33.70 2yu6 n LYS 96 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2yu6 s GLU 97 N -2.88 4.38 -0.28 1.97 2.56 -1.26 -4.94 118.70 118.24 2yu6 s GLU 97 Ca 0.40 0.92 -0.29 0.00 0.00 0.00 0.00 54.97 56.00 2yu6 s GLU 97 Cb 0.33 -3.27 0.00 0.00 2.00 0.00 0.00 34.13 33.20 2yu6 s GLU 97 CO 0.07 0.55 1.21 0.45 -0.56 0.00 0.00 175.26 176.98 2yu6 s SER 98 N -0.92 6.82 -0.22 -1.70 0.15 -1.26 -4.47 113.70 112.10 2yu6 s SER 98 Ca 0.33 1.24 -0.09 0.00 0.70 0.00 0.00 55.95 58.13 2yu6 s SER 98 Cb -0.21 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.52 2yu6 s SER 98 CO 0.22 -0.94 0.12 -0.22 1.20 0.00 0.00 173.24 173.61 2yu6 s LEU 99 N 3.94 3.97 0.34 3.45 2.96 -1.16 -4.88 118.68 127.28 2yu6 s LEU 99 Ca 0.52 0.08 -0.28 0.00 -0.22 0.00 0.00 54.13 54.23 2yu6 s LEU 99 Cb -0.16 -2.04 -0.10 0.00 0.50 0.00 0.00 46.19 44.39 2yu6 s LEU 99 CO 0.18 0.10 1.22 -2.16 -1.32 0.00 0.00 176.35 174.37 2yu6 s PRO 100 N 0.81 4.35 0.61 0.98 0.04 -1.26 -0.08 135.00 140.45 2yu6 s PRO 100 Ca 0.06 2.01 0.33 0.00 0.04 0.00 0.00 61.00 63.44 2yu6 s PRO 100 Cb -0.13 -3.00 1.91 0.00 0.04 0.00 0.00 34.50 33.32 2yu6 s PRO 100 CO 0.02 -0.12 2.23 0.74 0.04 0.00 0.00 177.00 179.92 2yu6 h PHE 101 N 3.30 0.00 0.00 0.56 0.04 -1.85 -0.66 116.94 118.33 2yu6 h PHE 101 Ca -0.48 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.29 2yu6 h PHE 101 Cb 1.22 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.37 2yu6 h PHE 101 CO 0.56 0.00 -0.00 0.37 -0.60 0.00 0.00 178.31 178.64 2yu6 h GLN 102 N 0.00 0.00 -0.02 1.51 4.15 -1.91 0.19 115.11 119.03 2yu6 h GLN 102 Ca 0.02 0.00 -0.26 0.00 0.77 0.00 0.00 58.65 59.19 2yu6 h GLN 102 Cb 0.16 0.00 0.02 0.00 0.21 0.00 0.00 27.48 27.87 2yu6 h GLN 102 CO -0.00 0.00 -0.98 0.74 -1.93 0.00 0.00 178.83 176.66 2yu6 h PHE 103 N 0.00 1.03 -0.59 3.99 -1.00 -1.49 -3.21 116.94 115.66 2yu6 h PHE 103 Ca -0.00 -0.55 0.00 0.00 2.81 0.00 0.00 57.97 60.23 2yu6 h PHE 103 Cb 0.01 -0.12 0.00 0.00 3.61 0.00 0.00 35.95 39.44 2yu6 h PHE 103 CO 0.00 1.38 0.00 0.00 -1.61 0.00 0.00 178.31 178.08 2yu6 n ALA 104 N -2.64 3.36 0.18 2.45 0.00 -0.70 -4.36 120.51 118.81 2yu6 n ALA 104 Ca -0.11 -1.62 0.03 0.00 0.00 0.00 0.00 53.44 51.74 2yu6 n ALA 104 Cb 0.85 -1.07 0.38 0.00 0.00 0.00 0.00 19.45 19.61 2yu6 n ALA 104 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2yu6 h HIS 105 N 3.88 0.04 0.00 0.00 6.17 -0.66 -2.37 115.15 122.21 2yu6 h HIS 105 Ca 0.00 -0.01 -0.05 0.00 0.71 0.00 0.00 60.37 61.02 2yu6 h HIS 105 Cb 1.60 -0.01 -0.01 0.00 2.52 0.00 0.00 27.41 31.51 2yu6 h HIS 105 CO 0.86 0.36 -0.28 1.12 0.71 0.00 0.00 177.93 180.69 2yu6 h HIS 106 N 0.04 0.00 -3.64 5.26 2.07 -1.81 -3.45 115.15 113.60 2yu6 h HIS 106 Ca 0.00 0.00 -0.51 0.00 -2.85 0.00 0.00 60.37 57.02 2yu6 h HIS 106 Cb 0.58 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.54 2yu6 h HIS 106 CO 0.00 0.24 0.18 -0.51 -3.07 0.00 0.00 177.93 174.77 2yu6 s LEU 107 N -6.30 4.38 0.00 6.12 1.43 -0.89 -5.07 118.68 118.35 2yu6 s LEU 107 Ca 0.05 1.56 0.03 0.00 -1.03 0.00 0.00 54.13 54.75 2yu6 s LEU 107 Cb 0.06 -3.66 -0.01 0.00 0.03 0.00 0.00 46.19 42.62 2yu6 s LEU 107 CO 0.71 0.03 0.25 0.18 0.23 0.00 0.00 176.35 177.75 2yu6 n LEU 108 N 0.81 0.00 -3.98 1.79 4.77 -1.26 -3.53 117.00 115.59 2yu6 n LEU 108 Ca -0.02 -2.14 -0.31 0.00 -0.03 0.00 0.00 56.01 53.51 2yu6 n LEU 108 Cb 0.50 1.37 -0.15 0.00 -2.33 0.00 0.00 43.42 42.82 2yu6 n LEU 108 CO 0.44 -0.40 -0.35 0.21 -1.33 0.00 0.00 177.39 175.96 2yu6 s ASN 109 N -2.59 4.56 0.20 -1.43 3.84 0.22 -4.57 114.94 115.18 2yu6 s ASN 109 Ca 0.25 -1.92 0.21 0.00 0.21 0.00 0.00 52.86 51.61 2yu6 s ASN 109 Cb 0.01 -1.48 0.90 0.00 -0.55 0.00 0.00 41.25 40.13 2yu6 s ASN 109 CO 0.18 -0.35 1.65 -0.81 -2.79 0.00 0.00 177.10 174.98 2yu6 n PRO 110 N 4.38 0.15 0.07 0.43 -0.04 -1.26 -0.10 135.00 138.63 2yu6 n PRO 110 Ca -0.00 0.39 0.01 0.00 -0.04 0.00 0.00 63.50 63.85 2yu6 n PRO 110 Cb 0.42 -1.79 -0.04 0.00 -0.04 0.00 0.00 33.50 32.05 2yu6 n PRO 110 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2yu6 h TRP 111 N 0.00 0.00 -1.79 0.54 4.06 -1.95 -3.35 115.95 113.47 2yu6 h TRP 111 Ca 0.00 0.00 -0.66 0.00 2.06 0.00 0.00 58.89 60.29 2yu6 h TRP 111 Cb 0.33 0.00 -0.36 0.00 -1.00 0.00 0.00 29.16 28.14 2yu6 h TRP 111 CO 0.00 0.57 0.00 -1.71 -3.56 0.00 0.00 178.44 173.74 2yu6 n ASN 112 N -3.04 5.82 -2.70 -3.49 5.15 -0.99 -4.86 115.26 111.16 2yu6 n ASN 112 Ca -0.05 -3.76 -0.12 0.00 -0.60 0.00 0.00 54.58 50.05 2yu6 n ASN 112 Cb 0.81 -0.72 0.06 0.00 -0.53 0.00 0.00 39.78 39.40 2yu6 n ASN 112 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 2yu6 n ASP 113 N -0.46 -2.16 -3.53 1.20 2.03 -1.24 -2.84 116.55 109.56 2yu6 n ASP 113 Ca 0.44 -0.43 -0.26 0.00 0.52 0.00 0.00 54.79 55.06 2yu6 n ASP 113 Cb 0.47 -3.74 -0.05 0.00 -0.72 0.00 0.00 41.12 37.08 2yu6 n ASP 113 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2yu6 n ASN 114 N -2.46 -1.33 -4.82 1.67 6.94 0.85 -4.85 115.26 111.26 2yu6 n ASN 114 Ca -0.19 -0.65 -0.36 0.00 -0.02 0.00 0.00 54.58 53.35 2yu6 n ASN 114 Cb 0.62 -1.19 -0.06 0.00 -2.36 0.00 0.00 39.78 36.78 2yu6 n ASN 114 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2yu6 s LYS 115 N -5.64 4.21 0.36 -3.83 -0.14 -0.54 -4.47 119.74 109.70 2yu6 s LYS 115 Ca 0.51 0.80 -0.23 0.00 -1.36 0.00 0.00 55.97 55.69 2yu6 s LYS 115 Cb -0.30 -2.92 -0.16 0.00 -1.68 0.00 0.00 37.83 32.78 2yu6 s LYS 115 CO 0.63 0.43 0.26 1.17 -0.76 0.00 0.00 175.35 177.08 2yu6 n LYS 116 N 0.81 0.10 -0.22 1.68 3.00 -1.26 0.70 118.16 122.97 2yu6 n LYS 116 Ca -0.03 0.03 -0.02 0.00 -0.00 0.00 0.00 58.31 58.30 2yu6 n LYS 116 Cb 0.51 -1.08 0.09 0.00 0.00 0.00 0.00 35.03 34.56 2yu6 n LYS 116 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2yu6 h VAL 117 N 0.57 0.93 -0.45 3.15 2.07 -1.80 -1.03 116.25 119.69 2yu6 h VAL 117 Ca -0.35 -0.21 0.04 0.00 0.82 0.00 0.00 66.70 67.00 2yu6 h VAL 117 Cb 1.44 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 2yu6 h VAL 117 CO 0.50 0.11 0.30 0.06 0.02 0.00 0.00 177.57 178.56 2yu6 h GLN 118 N 0.61 0.42 -3.81 1.57 -0.00 -1.89 -3.25 115.11 108.77 2yu6 h GLN 118 Ca 0.29 -0.03 -0.56 0.00 -0.00 0.00 0.00 58.65 58.35 2yu6 h GLN 118 Cb 0.22 -0.10 0.02 0.00 -0.00 0.00 0.00 27.48 27.63 2yu6 h GLN 118 CO -0.20 0.28 2.77 -0.89 -0.00 0.00 0.00 178.83 180.79 2yu6 n ILE 119 N -4.48 2.66 -3.81 1.86 5.41 -0.39 -4.80 119.36 115.81 2yu6 n ILE 119 Ca 0.05 -1.90 -0.19 0.00 1.00 0.00 0.00 62.75 61.71 2yu6 n ILE 119 Cb 0.20 -2.34 -0.17 0.00 -0.71 0.00 0.00 39.64 36.62 2yu6 n ILE 119 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 2yu6 s SER 120 N 3.72 0.87 0.50 4.38 0.01 -1.23 -4.79 113.70 117.17 2yu6 s SER 120 Ca 0.51 -0.01 -0.20 0.00 1.31 0.00 0.00 55.95 57.56 2yu6 s SER 120 Cb 0.13 -0.24 -0.08 0.00 0.21 0.00 0.00 66.02 66.04 2yu6 s SER 120 CO 0.00 -0.16 1.06 -0.13 0.41 0.00 0.00 173.24 174.42 2yu6 s ARG 121 N 1.56 3.69 -0.04 12.44 0.52 -1.26 -4.80 118.95 131.06 2yu6 s ARG 121 Ca -0.02 1.43 -0.38 0.00 -0.52 0.00 0.00 55.73 56.23 2yu6 s ARG 121 Cb -0.13 -2.07 -0.17 0.00 0.52 0.00 0.00 34.95 33.10 2yu6 s ARG 121 CO -0.03 -0.54 1.44 -3.47 0.02 0.00 0.00 175.30 172.72 2yu6 n ASP 122 N -1.05 1.73 -0.27 0.23 2.03 -1.26 -1.80 116.55 116.16 2yu6 n ASP 122 Ca 0.10 1.11 0.00 0.00 0.52 0.00 0.00 54.79 56.52 2yu6 n ASP 122 Cb 0.52 -1.15 0.00 0.00 -0.72 0.00 0.00 41.12 39.77 2yu6 n ASP 122 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2yu6 n GLY 123 N 2.95 0.81 3.47 0.27 0.00 -0.39 -4.91 105.19 107.40 2yu6 n GLY 123 Ca 0.21 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 45.23 2yu6 n GLY 123 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2yu6 s GLN 124 N -4.08 3.47 0.44 1.61 2.00 -0.75 -4.91 119.66 117.44 2yu6 s GLN 124 Ca 0.00 -0.57 -0.25 0.00 -2.00 0.00 0.00 55.36 52.54 2yu6 s GLN 124 Cb 0.00 -2.79 -0.08 0.00 0.80 0.00 0.00 33.01 30.94 2yu6 s GLN 124 CO 0.00 0.29 1.28 -2.00 -0.50 0.00 0.00 175.29 174.36 2yu6 s GLU 125 N 0.19 3.79 -0.11 1.67 2.56 -1.26 -2.30 118.70 123.24 2yu6 s GLU 125 Ca -0.04 2.08 0.00 0.00 0.00 0.00 0.00 54.97 57.02 2yu6 s GLU 125 Cb -0.14 -2.60 0.02 0.00 2.00 0.00 0.00 34.13 33.41 2yu6 s GLU 125 CO 0.04 -0.62 -0.10 -1.17 -0.56 0.00 0.00 175.26 172.85 2yu6 s LEU 126 N -2.74 1.35 0.22 2.70 2.96 0.22 -4.90 118.68 118.49 2yu6 s LEU 126 Ca 0.61 -0.33 -0.29 0.00 -0.22 0.00 0.00 54.13 53.89 2yu6 s LEU 126 Cb -0.36 -0.89 -0.16 0.00 0.50 0.00 0.00 46.19 45.28 2yu6 s LEU 126 CO 0.45 -0.08 0.81 1.21 -1.32 0.00 0.00 176.35 177.42 2yu6 n GLU 127 N 4.71 0.64 0.00 1.98 2.13 -1.26 -4.01 120.64 124.83 2yu6 n GLU 127 Ca -0.15 0.23 0.08 0.00 0.66 0.00 0.00 57.16 57.97 2yu6 n GLU 127 Cb 0.50 -1.45 0.42 0.00 0.27 0.00 0.00 31.44 31.18 2yu6 n GLU 127 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 2yu6 n PRO 128 N 1.02 0.36 -0.06 5.31 -0.04 -1.26 -1.30 135.00 139.02 2yu6 n PRO 128 Ca 0.15 0.07 -0.21 0.00 -0.04 0.00 0.00 63.50 63.46 2yu6 n PRO 128 Cb 0.27 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.10 2yu6 n PRO 128 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2yu6 h GLN 129 N 0.00 0.09 0.00 0.54 -0.00 -1.99 -3.30 115.11 110.46 2yu6 h GLN 129 Ca 0.00 -0.16 -0.16 0.00 -0.00 0.00 0.00 58.65 58.33 2yu6 h GLN 129 Cb 0.06 0.06 -0.03 0.00 0.00 0.00 0.00 27.48 27.58 2yu6 h GLN 129 CO 0.00 1.08 -1.13 -0.39 0.00 0.00 0.00 178.83 178.38 2yu6 h VAL 130 N -0.67 0.75 0.00 2.39 -1.51 -1.82 -3.24 116.25 112.14 2yu6 h VAL 130 Ca -0.34 -2.25 -0.08 0.00 -1.23 0.00 0.00 66.70 62.80 2yu6 h VAL 130 Cb 1.51 2.25 -0.01 0.00 -2.13 0.00 0.00 31.29 32.91 2yu6 h VAL 130 CO -0.10 0.43 -0.36 1.23 -1.23 0.00 0.00 177.57 177.53 2yu6 h GLY 131 N 3.57 0.00 0.65 5.19 0.00 -1.39 -1.76 103.07 109.32 2yu6 h GLY 131 Ca -0.11 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.01 2yu6 h GLY 131 CO 0.06 0.00 -0.98 1.05 0.00 0.00 0.00 176.54 176.67 2yu6 h GLU 132 N 0.00 0.28 0.00 4.80 4.11 -1.66 -3.25 114.58 118.86 2yu6 h GLU 132 Ca -0.00 -0.49 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2yu6 h GLU 132 Cb 0.85 0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.28 2yu6 h GLU 132 CO 0.05 1.23 0.00 0.00 0.07 0.00 0.00 179.01 180.36 2yu6 n GLN 133 N -4.07 0.15 0.11 1.06 10.64 -1.22 -2.89 117.38 121.15 2yu6 n GLN 133 Ca -0.17 0.29 -0.18 0.00 -1.83 0.00 0.00 57.00 55.10 2yu6 n GLN 133 Cb 0.84 -1.74 -0.12 0.00 -0.86 0.00 0.00 30.24 28.36 2yu6 n GLN 133 CO 0.00 0.00 0.00 1.25 -1.83 0.00 0.00 177.06 176.48 2yu6 h LEU 134 N 0.00 0.61 -0.17 2.61 5.85 -1.38 -3.33 115.31 119.49 2yu6 h LEU 134 Ca 0.00 -0.61 -0.11 0.00 0.84 0.00 0.00 57.88 58.00 2yu6 h LEU 134 Cb 0.44 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.28 2yu6 h LEU 134 CO 0.00 1.45 -0.31 -0.07 -0.34 0.00 0.00 178.44 179.17 2yu6 h LEU 135 N 0.15 0.58 -1.52 2.25 3.38 -1.56 -3.06 115.31 115.52 2yu6 h LEU 135 Ca -0.16 -0.54 0.33 0.00 0.09 0.00 0.00 57.88 57.60 2yu6 h LEU 135 Cb 1.94 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 42.48 2yu6 h LEU 135 CO 0.22 1.01 1.09 1.56 0.09 0.00 0.00 178.44 182.41 2yu6 h GLN 136 N 0.16 0.00 -0.77 1.13 1.08 -1.65 0.75 115.11 115.81 2yu6 h GLN 136 Ca 0.01 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.22 2yu6 h GLN 136 Cb 0.90 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.29 2yu6 h GLN 136 CO 0.07 0.00 0.51 -0.07 -0.95 0.00 0.00 178.83 178.39 2yu6 h LEU 137 N 0.00 0.90 -1.39 1.46 3.38 -1.68 -2.05 115.31 115.93 2yu6 h LEU 137 Ca 0.54 -0.03 0.15 0.00 0.09 0.00 0.00 57.88 58.64 2yu6 h LEU 137 Cb 2.71 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 43.18 2yu6 h LEU 137 CO -0.01 0.65 0.56 -0.50 0.09 0.00 0.00 178.44 179.24 2yu6 h TRP 138 N 1.05 0.70 -0.34 1.13 6.55 0.33 0.95 115.95 126.32 2yu6 h TRP 138 Ca 0.28 0.02 -0.04 0.00 0.95 0.00 0.00 58.89 60.10 2yu6 h TRP 138 Cb -0.11 -0.22 -0.02 0.00 -0.86 0.00 0.00 29.16 27.95 2yu6 h TRP 138 CO -0.02 0.25 0.03 0.93 -1.05 0.00 0.00 178.44 178.59 2yu6 h GLU 139 N 0.59 0.52 0.00 0.49 4.39 -1.46 -2.08 114.58 117.02 2yu6 h GLU 139 Ca 0.43 -0.10 -0.08 0.00 0.34 0.00 0.00 59.36 59.95 2yu6 h GLU 139 Cb 0.80 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.36 2yu6 h GLU 139 CO -0.18 0.52 -0.40 0.00 -1.16 0.00 0.00 179.01 177.79 2yu6 h ARG 140 N 0.50 0.00 0.00 2.33 3.08 -0.78 -3.53 114.38 115.98 2yu6 h ARG 140 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2yu6 h ARG 140 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 2yu6 h ARG 140 CO 0.00 0.40 0.00 1.28 -1.07 0.00 0.00 179.97 180.58