#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yz0 s SER 2 N 0.00 5.84 0.17 3.17 0.15 -1.26 -4.34 113.70 117.43 2yz0 s SER 2 Ca 0.00 -0.01 0.00 0.00 0.70 0.00 0.00 55.95 56.64 2yz0 s SER 2 Cb 0.00 -1.63 0.00 0.00 -1.71 0.00 0.00 66.02 62.68 2yz0 s SER 2 CO 0.00 0.06 0.00 -0.11 1.20 0.00 0.00 173.24 174.39 2yz0 n LEU 3 N -0.44 0.31 0.00 3.45 -0.00 -1.26 -5.10 117.00 113.96 2yz0 n LEU 3 Ca -0.08 0.28 0.00 0.00 -0.00 0.00 0.00 56.01 56.21 2yz0 n LEU 3 Cb 0.54 0.07 0.00 0.00 -0.00 0.00 0.00 43.42 44.04 2yz0 n LEU 3 CO 0.45 -0.72 0.00 -0.24 -0.00 0.00 0.00 177.39 176.88 2yz0 n SER 4 N -3.30 0.00 -1.29 1.96 2.88 -1.26 -5.15 113.62 107.46 2yz0 n SER 4 Ca 0.00 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.69 2yz0 n SER 4 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 2yz0 n SER 4 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2yz0 n HIS 5 N 0.00 -3.17 -3.26 0.66 8.25 -1.26 -4.89 115.22 111.55 2yz0 n HIS 5 Ca 0.00 1.71 -0.14 0.00 -0.26 0.00 0.00 57.72 59.04 2yz0 n HIS 5 Cb 0.00 -2.88 0.01 0.00 1.12 0.00 0.00 29.99 28.24 2yz0 n HIS 5 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2yz0 n LEU 6 N -4.04 -3.62 -3.65 2.41 4.32 -1.26 -4.99 117.00 106.18 2yz0 n LEU 6 Ca -0.06 0.28 0.03 0.00 -0.02 0.00 0.00 56.01 56.24 2yz0 n LEU 6 Cb 0.61 -1.75 0.00 0.00 -1.62 0.00 0.00 43.42 40.66 2yz0 n LEU 6 CO 0.03 -1.08 1.18 0.28 -1.22 0.00 0.00 177.39 176.58 2yz0 s THR 7 N -1.25 0.00 0.57 -5.08 -1.32 -1.26 -4.99 115.64 102.31 2yz0 s THR 7 Ca 0.14 -0.06 0.29 0.00 -1.21 0.00 0.00 61.69 60.84 2yz0 s THR 7 Cb -0.02 -2.16 0.40 0.00 -1.51 0.00 0.00 72.50 69.21 2yz0 s THR 7 CO 0.37 0.00 1.93 -0.07 -2.21 0.00 0.00 174.62 174.64 2yz0 h LEU 8 N 2.00 0.00 -2.01 9.08 3.38 -1.90 0.10 115.31 125.96 2yz0 h LEU 8 Ca -0.31 0.00 0.16 0.00 0.09 0.00 0.00 57.88 57.82 2yz0 h LEU 8 Cb 1.19 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 2yz0 h LEU 8 CO 0.30 0.00 0.44 -0.78 0.09 0.00 0.00 178.44 178.49 2yz0 h ASP 9 N 0.00 0.00 -0.37 -0.43 3.58 -1.95 0.95 116.42 118.20 2yz0 h ASP 9 Ca 0.25 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.57 2yz0 h ASP 9 Cb 1.18 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.22 2yz0 h ASP 9 CO -0.00 0.00 -0.23 1.56 -2.88 0.00 0.00 179.24 177.68 2yz0 h GLN 10 N 0.00 0.88 0.00 0.28 1.08 -1.19 -2.70 115.11 113.45 2yz0 h GLN 10 Ca 0.26 -0.37 -0.02 0.00 -1.45 0.00 0.00 58.65 57.07 2yz0 h GLN 10 Cb 1.13 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 28.53 2yz0 h GLN 10 CO -0.00 1.02 -0.10 1.88 -0.95 0.00 0.00 178.83 180.68 2yz0 h TYR 11 N 0.76 0.00 -0.91 2.96 0.05 -0.96 -3.04 116.97 115.83 2yz0 h TYR 11 Ca 0.10 0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.94 2yz0 h TYR 11 Cb 0.78 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 38.46 2yz0 h TYR 11 CO 0.05 0.10 0.57 1.88 -1.05 0.00 0.00 178.16 179.70 2yz0 h TYR 12 N 0.00 1.06 -0.59 4.88 0.05 -1.17 0.73 116.97 121.92 2yz0 h TYR 12 Ca -0.00 0.03 -0.10 0.00 0.05 0.00 0.00 58.73 58.71 2yz0 h TYR 12 Cb 0.59 -0.34 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 2yz0 h TYR 12 CO 0.00 0.54 -0.01 1.05 -1.05 0.00 0.00 178.16 178.69 2yz0 h GLU 13 N 1.04 1.06 -0.51 4.88 4.11 -1.64 -1.81 114.58 121.71 2yz0 h GLU 13 Ca 0.39 -0.34 -0.13 0.00 0.07 0.00 0.00 59.36 59.35 2yz0 h GLU 13 Cb 0.17 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 2yz0 h GLU 13 CO -0.17 1.04 -0.17 0.82 0.07 0.00 0.00 179.01 180.60 2yz0 h ILE 14 N 0.95 1.27 -0.12 -1.06 5.03 -1.45 -1.35 117.51 120.78 2yz0 h ILE 14 Ca 0.17 -1.34 -0.01 0.00 -0.12 0.00 0.00 64.86 63.56 2yz0 h ILE 14 Cb 0.57 1.05 -0.01 0.00 -3.03 0.00 0.00 36.82 35.41 2yz0 h ILE 14 CO 0.03 0.47 0.04 1.56 -0.68 0.00 0.00 178.15 179.57 2yz0 h GLN 15 N 0.88 0.19 -0.52 2.37 4.20 -0.75 -2.83 115.11 118.65 2yz0 h GLN 15 Ca 0.12 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 2yz0 h GLN 15 Cb 0.75 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 2yz0 h GLN 15 CO 0.06 0.33 0.11 0.00 -0.67 0.00 0.00 178.83 178.66 2yz0 h ASN 17 N 0.78 0.42 -0.46 0.00 -1.24 -1.06 -1.26 115.58 112.76 2yz0 h ASN 17 Ca 0.17 -0.00 -0.09 0.00 0.71 0.00 0.00 56.30 57.09 2yz0 h ASN 17 Cb 0.31 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 39.25 2yz0 h ASN 17 CO 0.00 0.28 -0.04 -0.33 -1.29 0.00 0.00 177.43 176.05 2yz0 h GLU 18 N 0.48 0.89 0.09 6.67 3.07 -1.19 0.27 114.58 124.86 2yz0 h GLU 18 Ca 0.22 -0.28 -0.00 0.00 -0.50 0.00 0.00 59.36 58.80 2yz0 h GLU 18 Cb 0.26 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 2yz0 h GLU 18 CO -0.06 0.92 -0.05 -0.07 -1.40 0.00 0.00 179.01 178.35 2yz0 h LEU 19 N 0.82 -0.11 -0.76 1.33 4.07 -1.23 0.70 115.31 120.13 2yz0 h LEU 19 Ca 0.15 -0.24 -0.12 0.00 0.08 0.00 0.00 57.88 57.75 2yz0 h LEU 19 Cb 0.54 0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.30 2yz0 h LEU 19 CO 0.03 0.19 -0.34 1.05 -1.08 0.00 0.00 178.44 178.29 2yz0 h GLU 20 N -0.41 0.55 0.04 1.13 4.11 -1.40 0.37 114.58 118.98 2yz0 h GLU 20 Ca -0.01 -0.25 -0.00 0.00 0.07 0.00 0.00 59.36 59.16 2yz0 h GLU 20 Cb 0.34 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2yz0 h GLU 20 CO 0.02 0.82 -0.02 0.00 0.07 0.00 0.00 179.01 179.90 2yz0 h ALA 21 N 1.17 -0.05 -0.05 1.06 0.00 -0.41 -3.06 119.26 117.90 2yz0 h ALA 21 Ca 0.05 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 2yz0 h ALA 21 Cb 0.81 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2yz0 h ALA 21 CO 0.07 -0.36 -0.75 0.82 0.00 0.00 0.00 179.25 179.03 2yz0 h ILE 22 N -0.38 1.40 -0.90 0.00 5.03 -0.85 -3.16 117.51 118.66 2yz0 h ILE 22 Ca -0.01 -2.22 0.19 0.00 -0.12 0.00 0.00 64.86 62.71 2yz0 h ILE 22 Cb 0.35 2.18 -0.07 0.00 -3.03 0.00 0.00 36.82 36.25 2yz0 h ILE 22 CO 0.01 0.66 0.59 0.03 -0.68 0.00 0.00 178.15 178.76 2yz0 h ARG 23 N 0.22 0.45 -0.28 2.37 3.08 -0.25 0.26 114.38 120.23 2yz0 h ARG 23 Ca -0.03 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.90 2yz0 h ARG 23 Cb 1.32 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.26 2yz0 h ARG 23 CO 0.12 0.30 -0.23 0.77 -1.07 0.00 0.00 179.97 179.86 2yz0 h SER 24 N 0.47 0.53 0.07 7.04 0.02 -1.49 0.45 113.55 120.64 2yz0 h SER 24 Ca 0.47 -0.18 -0.15 0.00 -0.84 0.00 0.00 61.79 61.10 2yz0 h SER 24 Cb 1.09 -0.14 0.02 0.00 0.14 0.00 0.00 62.40 63.50 2yz0 h SER 24 CO -0.20 0.76 -0.61 0.40 -1.14 0.00 0.00 176.83 176.04 2yz0 h ILE 25 N 0.47 1.51 -1.17 3.27 2.04 -0.75 -3.34 117.51 119.55 2yz0 h ILE 25 Ca 0.07 -2.30 -0.64 0.00 1.00 0.00 0.00 64.86 62.99 2yz0 h ILE 25 Cb 0.66 2.97 -0.35 0.00 -0.74 0.00 0.00 36.82 39.35 2yz0 h ILE 25 CO 0.05 0.65 0.09 -1.22 0.00 0.00 0.00 178.15 177.71 2yz0 n TYR 26 N -4.24 3.06 -0.37 1.37 4.01 0.38 -4.83 117.16 116.55 2yz0 n TYR 26 Ca -0.12 -2.66 -0.04 0.00 -0.16 0.00 0.00 57.90 54.92 2yz0 n TYR 26 Cb 0.71 -0.82 0.00 0.00 -0.31 0.00 0.00 39.34 38.92 2yz0 n TYR 26 CO 0.00 0.00 0.00 0.52 -0.46 0.00 0.00 176.86 176.92 2yz0 h MET 27 N 2.32 -0.03 0.00 -0.72 2.86 -0.21 0.57 114.93 119.72 2yz0 h MET 27 Ca 0.47 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.96 2yz0 h MET 27 Cb 0.94 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.58 2yz0 h MET 27 CO 1.17 -0.02 -1.14 0.22 1.06 0.00 0.00 176.91 178.20 2yz0 h ASP 28 N -0.03 0.00 -0.64 1.22 1.82 -1.88 -3.31 116.42 113.60 2yz0 h ASP 28 Ca 0.29 0.00 -0.34 0.00 -0.39 0.00 0.00 57.03 56.58 2yz0 h ASP 28 Cb 0.55 0.00 -0.20 0.00 0.68 0.00 0.00 39.33 40.36 2yz0 h ASP 28 CO -0.94 0.58 0.44 0.47 -1.61 0.00 0.00 179.24 178.18 2yz0 n ASP 29 N -3.00 3.89 -4.34 2.28 9.92 0.15 -4.87 116.55 120.57 2yz0 n ASP 29 Ca -0.06 -3.06 -0.33 0.00 -0.53 0.00 0.00 54.79 50.81 2yz0 n ASP 29 Cb 0.82 -0.76 -0.15 0.00 -0.64 0.00 0.00 41.12 40.39 2yz0 n ASP 29 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 2yz0 s PHE 30 N -2.15 2.74 -0.14 1.24 2.19 0.18 -2.89 117.98 119.15 2yz0 s PHE 30 Ca 0.37 -0.72 0.01 0.00 0.33 0.00 0.00 56.93 56.93 2yz0 s PHE 30 Cb 0.31 -1.80 -0.00 0.00 -1.31 0.00 0.00 43.02 40.22 2yz0 s PHE 30 CO 0.06 -0.24 -0.18 0.99 1.83 0.00 0.00 175.22 177.68 2yz0 s THR 31 N 0.29 2.48 -0.34 0.12 2.01 -0.62 -4.98 115.64 114.60 2yz0 s THR 31 Ca -0.12 -0.84 -0.12 0.00 0.31 0.00 0.00 61.69 60.92 2yz0 s THR 31 Cb -0.16 -2.02 -0.01 0.00 0.01 0.00 0.00 72.50 70.32 2yz0 s THR 31 CO 0.06 0.53 0.23 -0.62 -0.69 0.00 0.00 174.62 174.13 2yz0 s ASP 32 N 0.71 5.95 0.00 3.53 2.15 -1.26 -1.50 116.67 126.25 2yz0 s ASP 32 Ca -0.08 -0.50 0.01 0.00 0.43 0.00 0.00 52.55 52.41 2yz0 s ASP 32 Cb -0.16 -2.11 0.02 0.00 -0.30 0.00 0.00 42.92 40.37 2yz0 s ASP 32 CO 0.01 -0.25 0.82 0.00 -0.17 0.00 0.00 175.17 175.58 2yz0 n LEU 33 N 5.08 1.66 -4.45 -1.34 -0.00 -1.26 -4.95 117.00 111.74 2yz0 n LEU 33 Ca -0.13 -1.59 -0.29 0.00 -0.00 0.00 0.00 56.01 54.00 2yz0 n LEU 33 Cb 0.49 -0.01 0.26 0.00 -0.00 0.00 0.00 43.42 44.16 2yz0 n LEU 33 CO 0.36 0.41 0.50 -0.89 -0.00 0.00 0.00 177.39 177.78 2yz0 s THR 34 N -0.62 1.62 -0.89 1.47 2.01 -1.22 -4.81 115.64 113.20 2yz0 s THR 34 Ca 0.02 0.00 -0.07 0.00 0.31 0.00 0.00 61.69 61.95 2yz0 s THR 34 Cb 0.01 -2.19 -0.11 0.00 0.01 0.00 0.00 72.50 70.22 2yz0 s THR 34 CO 0.01 0.00 2.59 0.29 -0.69 0.00 0.00 174.62 176.82 2yz0 n LYS 35 N -5.11 2.44 -4.01 4.92 4.01 -1.26 -4.87 118.16 114.27 2yz0 n LYS 35 Ca 0.09 -1.50 -0.35 0.00 -0.51 0.00 0.00 58.31 56.04 2yz0 n LYS 35 Cb 0.58 -2.40 -0.07 0.00 -0.51 0.00 0.00 35.03 32.63 2yz0 n LYS 35 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 2yz0 s ARG 36 N 2.48 3.28 -1.31 1.97 1.81 -1.26 -3.87 118.95 122.05 2yz0 s ARG 36 Ca 0.52 -0.29 -0.12 0.00 -1.72 0.00 0.00 55.73 54.13 2yz0 s ARG 36 Cb 0.17 -3.03 0.10 0.00 -0.45 0.00 0.00 34.95 31.73 2yz0 s ARG 36 CO -0.03 0.72 0.51 1.63 -0.68 0.00 0.00 175.30 177.45 2yz0 n LYS 37 N 1.62 -3.07 0.00 3.54 4.76 -1.26 -4.59 118.16 119.15 2yz0 n LYS 37 Ca -0.16 0.39 0.00 0.00 -2.87 0.00 0.00 58.31 55.66 2yz0 n LYS 37 Cb 0.54 -5.07 0.00 0.00 -1.84 0.00 0.00 35.03 28.65 2yz0 n LYS 37 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2yz0 n SER 38 N -2.30 0.00 -4.86 4.39 7.64 -1.26 -5.17 113.62 112.05 2yz0 n SER 38 Ca 0.02 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.59 2yz0 n SER 38 Cb 0.52 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.70 2yz0 n SER 38 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yz0 s SER 39 N 0.00 6.46 -0.09 6.43 0.01 -1.25 -4.84 113.70 120.42 2yz0 s SER 39 Ca 0.00 1.35 0.18 0.00 1.31 0.00 0.00 55.95 58.79 2yz0 s SER 39 Cb 0.00 -2.42 -0.27 0.00 0.21 0.00 0.00 66.02 63.54 2yz0 s SER 39 CO 0.00 -0.61 0.28 1.87 0.41 0.00 0.00 173.24 175.19 2yz0 n TRP 40 N -1.88 0.00 -2.70 2.43 -0.00 -1.26 -4.78 117.44 109.25 2yz0 n TRP 40 Ca 0.05 0.00 -0.07 0.00 -0.00 0.00 0.00 57.50 57.48 2yz0 n TRP 40 Cb 0.54 -0.61 0.09 0.00 -0.00 0.00 0.00 31.31 31.33 2yz0 n TRP 40 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 177.69 174.22 2yz0 n ASP 41 N -2.36 -1.86 -2.69 5.87 2.03 -1.26 -5.03 116.55 111.25 2yz0 n ASP 41 Ca -0.14 -2.70 -0.02 0.00 0.52 0.00 0.00 54.79 52.46 2yz0 n ASP 41 Cb 0.73 1.36 0.00 0.00 -0.72 0.00 0.00 41.12 42.49 2yz0 n ASP 41 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 2yz0 n LYS 42 N -0.10 -0.18 -2.75 -0.67 -0.00 -1.26 -4.81 118.16 108.39 2yz0 n LYS 42 Ca -0.04 -0.01 -0.09 0.00 -0.00 0.00 0.00 58.31 58.17 2yz0 n LYS 42 Cb 0.76 -0.03 0.08 0.00 -0.00 0.00 0.00 35.03 35.83 2yz0 n LYS 42 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2yz0 n GLN 43 N -0.67 0.97 -2.10 -1.58 6.02 -1.26 -5.12 117.38 113.64 2yz0 n GLN 43 Ca -0.02 -1.96 -0.43 0.00 -0.01 0.00 0.00 57.00 54.58 2yz0 n GLN 43 Cb 0.04 -1.13 -0.03 0.00 1.02 0.00 0.00 30.24 30.14 2yz0 n GLN 43 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2yz0 s PRO 44 N 0.23 3.55 0.00 -1.09 0.04 -1.26 -4.85 135.00 131.62 2yz0 s PRO 44 Ca 0.24 1.44 0.12 0.00 0.04 0.00 0.00 61.00 62.85 2yz0 s PRO 44 Cb 0.28 -4.11 0.66 0.00 0.04 0.00 0.00 34.50 31.37 2yz0 s PRO 44 CO -0.09 -1.59 1.23 0.94 0.04 0.00 0.00 177.00 177.53 2yz0 n GLN 45 N 8.08 0.26 0.00 4.56 7.27 -1.26 -4.82 117.38 131.47 2yz0 n GLN 45 Ca 0.20 0.10 0.00 0.00 0.07 0.00 0.00 57.00 57.37 2yz0 n GLN 45 Cb 0.46 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.61 2yz0 n GLN 45 CO 0.00 0.00 0.00 1.51 0.07 0.00 0.00 177.06 178.64 2yz0 n ILE 46 N -1.16 0.00 -0.73 1.69 0.13 -1.26 -4.62 119.36 113.40 2yz0 n ILE 46 Ca 0.07 0.00 -0.24 0.00 -1.10 0.00 0.00 62.75 61.49 2yz0 n ILE 46 Cb 0.07 0.00 -0.00 0.00 -0.84 0.00 0.00 39.64 38.87 2yz0 n ILE 46 CO 0.00 0.00 0.00 2.30 2.80 0.00 0.00 176.55 181.65 2yz0 n ILE 47 N -0.05 0.33 -3.72 9.51 -0.00 -1.26 -4.76 119.36 119.41 2yz0 n ILE 47 Ca 0.00 -0.28 -0.09 0.00 -0.00 0.00 0.00 62.75 62.38 2yz0 n ILE 47 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 39.64 39.62 2yz0 n ILE 47 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.55 177.27 2yz0 s PHE 48 N -0.97 -0.25 0.27 4.28 -0.71 -1.20 -3.43 117.98 115.98 2yz0 s PHE 48 Ca 0.33 -0.12 0.08 0.00 -1.04 0.00 0.00 56.93 56.19 2yz0 s PHE 48 Cb -0.36 0.59 -0.04 0.00 -1.21 0.00 0.00 43.02 42.01 2yz0 s PHE 48 CO 0.36 -1.07 0.13 -1.21 -1.34 0.00 0.00 175.22 172.09 2yz0 s GLU 49 N -3.87 2.64 -0.04 1.99 2.02 -0.56 -2.92 118.70 117.95 2yz0 s GLU 49 Ca 0.08 -1.25 -0.03 0.00 0.02 0.00 0.00 54.97 53.79 2yz0 s GLU 49 Cb -0.04 -2.38 0.01 0.00 0.10 0.00 0.00 34.13 31.83 2yz0 s GLU 49 CO -0.00 0.33 0.11 0.42 0.02 0.00 0.00 175.26 176.13 2yz0 s ILE 50 N -2.25 -0.01 -0.13 -1.63 -1.09 -0.77 -1.59 121.20 113.74 2yz0 s ILE 50 Ca 0.34 0.03 -0.19 0.00 -2.23 0.00 0.00 60.65 58.60 2yz0 s ILE 50 Cb -0.07 -0.16 -0.04 0.00 -1.58 0.00 0.00 42.46 40.61 2yz0 s ILE 50 CO 0.23 0.01 0.52 -0.89 -1.23 0.00 0.00 174.94 173.58 2yz0 s THR 51 N 0.24 5.15 0.25 2.92 2.01 -1.14 -0.72 115.64 124.35 2yz0 s THR 51 Ca -0.02 1.02 0.04 0.00 0.31 0.00 0.00 61.69 63.05 2yz0 s THR 51 Cb -0.03 -3.85 -0.05 0.00 0.01 0.00 0.00 72.50 68.58 2yz0 s THR 51 CO -0.01 0.29 -0.00 -0.76 -0.69 0.00 0.00 174.62 173.45 2yz0 s LEU 52 N 0.83 2.21 -0.05 4.42 1.43 -0.74 -4.91 118.68 121.87 2yz0 s LEU 52 Ca 0.27 -1.23 -0.31 0.00 -1.03 0.00 0.00 54.13 51.83 2yz0 s LEU 52 Cb -0.15 -0.32 0.13 0.00 0.03 0.00 0.00 46.19 45.88 2yz0 s LEU 52 CO 0.11 -0.51 1.35 0.00 0.23 0.00 0.00 176.35 177.54 2yz0 s ARG 53 N -3.85 0.23 0.82 1.70 1.70 -1.26 -1.90 118.95 116.40 2yz0 s ARG 53 Ca 0.30 -0.13 -0.14 0.00 -0.47 0.00 0.00 55.73 55.29 2yz0 s ARG 53 Cb 0.06 0.08 0.21 0.00 -0.57 0.00 0.00 34.95 34.73 2yz0 s ARG 53 CO 0.10 -0.11 0.56 -1.13 -1.08 0.00 0.00 175.30 173.64 2yz0 n SER 54 N -0.56 -2.76 0.05 -2.89 3.41 -0.89 -4.91 113.62 105.07 2yz0 n SER 54 Ca -0.08 -0.64 0.05 0.00 -0.26 0.00 0.00 58.87 57.95 2yz0 n SER 54 Cb 0.63 -0.59 -0.06 0.00 -0.26 0.00 0.00 64.21 63.93 2yz0 n SER 54 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2yz0 n VAL 55 N -4.43 0.84 -4.15 -3.33 0.24 -1.26 -4.96 118.33 101.29 2yz0 n VAL 55 Ca 0.08 -0.62 -0.10 0.00 -2.04 0.00 0.00 64.34 61.67 2yz0 n VAL 55 Cb 0.35 -0.49 -0.02 0.00 -1.47 0.00 0.00 33.84 32.22 2yz0 n VAL 55 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2yz0 n ASP 56 N -2.73 2.31 -0.03 -1.34 2.03 -1.26 -5.06 116.55 110.46 2yz0 n ASP 56 Ca -0.06 -1.67 0.01 0.00 0.52 0.00 0.00 54.79 53.59 2yz0 n ASP 56 Cb 0.70 0.09 0.00 0.00 -0.72 0.00 0.00 41.12 41.20 2yz0 n ASP 56 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2yz0 n LYS 57 N -0.46 2.19 -4.06 -0.67 4.76 -1.24 -4.51 118.16 114.17 2yz0 n LYS 57 Ca -0.06 -0.35 -0.13 0.00 -2.87 0.00 0.00 58.31 54.91 2yz0 n LYS 57 Cb 0.20 -0.84 -0.11 0.00 -1.84 0.00 0.00 35.03 32.44 2yz0 n LYS 57 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2yz0 s GLU 58 N -0.52 0.52 0.00 1.97 0.41 -1.26 -3.08 118.70 116.74 2yz0 s GLU 58 Ca 0.01 -0.76 0.15 0.00 -0.41 0.00 0.00 54.97 53.96 2yz0 s GLU 58 Cb 0.01 -0.26 0.87 0.00 -1.78 0.00 0.00 34.13 32.97 2yz0 s GLU 58 CO 0.03 0.04 1.36 -0.35 -0.49 0.00 0.00 175.26 175.85 2yz0 n PRO 59 N 1.43 0.40 -4.09 0.39 -0.04 -1.26 -4.94 135.00 126.88 2yz0 n PRO 59 Ca -0.23 0.05 -0.10 0.00 -0.04 0.00 0.00 63.50 63.18 2yz0 n PRO 59 Cb 0.55 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.43 2yz0 n PRO 59 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2yz0 s VAL 60 N -2.19 0.02 -0.19 0.52 -7.23 -1.18 -5.06 120.40 105.10 2yz0 s VAL 60 Ca 0.20 -1.70 0.18 0.00 -1.81 0.00 0.00 61.98 58.85 2yz0 s VAL 60 Cb 0.10 -2.24 -0.26 0.00 0.56 0.00 0.00 36.38 34.55 2yz0 s VAL 60 CO 0.19 -0.11 0.11 1.21 -0.31 0.00 0.00 175.10 176.19 2yz0 n GLU 61 N -0.27 0.69 -2.64 4.82 2.13 -1.21 -3.64 120.64 120.51 2yz0 n GLU 61 Ca -0.02 -0.03 -0.02 0.00 0.66 0.00 0.00 57.16 57.75 2yz0 n GLU 61 Cb 0.64 -1.52 -0.02 0.00 0.27 0.00 0.00 31.44 30.81 2yz0 n GLU 61 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2yz0 n SER 62 N -2.71 -4.10 -3.93 4.31 3.41 -1.26 -2.62 113.62 106.71 2yz0 n SER 62 Ca -0.30 1.26 -0.26 0.00 -0.26 0.00 0.00 58.87 59.31 2yz0 n SER 62 Cb 1.11 -3.55 -0.17 0.00 -0.26 0.00 0.00 64.21 61.34 2yz0 n SER 62 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2yz0 s SER 63 N -0.35 2.02 -0.07 4.04 1.04 -1.26 -2.09 113.70 117.04 2yz0 s SER 63 Ca -0.11 -0.29 -0.04 0.00 0.48 0.00 0.00 55.95 55.99 2yz0 s SER 63 Cb 0.01 -0.82 0.03 0.00 0.10 0.00 0.00 66.02 65.34 2yz0 s SER 63 CO 0.31 -0.08 0.16 -0.63 0.98 0.00 0.00 173.24 173.98 2yz0 s ILE 64 N 1.41 -0.04 -0.27 -1.02 1.01 -0.80 -2.69 121.20 118.81 2yz0 s ILE 64 Ca -0.01 0.14 -0.18 0.00 0.00 0.00 0.00 60.65 60.61 2yz0 s ILE 64 Cb -0.13 -0.25 -0.03 0.00 0.01 0.00 0.00 42.46 42.06 2yz0 s ILE 64 CO -0.05 0.06 0.50 -0.89 0.00 0.00 0.00 174.94 174.56 2yz0 s THR 65 N 0.96 5.07 -0.42 2.92 2.01 -1.20 -1.79 115.64 123.20 2yz0 s THR 65 Ca -0.07 0.77 -0.17 0.00 0.31 0.00 0.00 61.69 62.53 2yz0 s THR 65 Cb -0.09 -3.83 0.02 0.00 0.01 0.00 0.00 72.50 68.61 2yz0 s THR 65 CO -0.05 0.05 0.41 -0.76 -0.69 0.00 0.00 174.62 173.59 2yz0 s LEU 66 N 2.30 4.93 -0.40 4.42 1.02 0.10 -2.50 118.68 128.55 2yz0 s LEU 66 Ca 0.20 -0.74 -0.13 0.00 0.02 0.00 0.00 54.13 53.48 2yz0 s LEU 66 Cb -0.16 -2.34 0.03 0.00 0.02 0.00 0.00 46.19 43.74 2yz0 s LEU 66 CO 0.10 -0.56 0.26 -2.28 0.02 0.00 0.00 176.35 173.89 2yz0 s HIS 67 N 2.05 3.24 -0.10 0.29 5.65 -1.11 -1.84 115.29 123.46 2yz0 s HIS 67 Ca 0.11 -0.79 -0.04 0.00 0.25 0.00 0.00 55.06 54.59 2yz0 s HIS 67 Cb -0.18 -2.56 -0.04 0.00 -1.18 0.00 0.00 32.58 28.63 2yz0 s HIS 67 CO 0.13 -0.63 0.06 -0.06 -0.65 0.00 0.00 174.74 173.58 2yz0 s PHE 68 N 1.62 3.34 -0.17 3.88 0.40 -1.15 -2.94 117.98 122.96 2yz0 s PHE 68 Ca 0.04 0.33 0.01 0.00 -0.60 0.00 0.00 56.93 56.71 2yz0 s PHE 68 Cb -0.19 -1.85 0.02 0.00 0.51 0.00 0.00 43.02 41.50 2yz0 s PHE 68 CO 0.08 0.58 -0.19 0.00 0.70 0.00 0.00 175.22 176.39 2yz0 s ALA 69 N -0.93 2.19 -0.97 5.36 0.00 -0.65 -3.24 121.76 123.52 2yz0 s ALA 69 Ca 0.14 -1.12 -0.21 0.00 0.00 0.00 0.00 51.96 50.77 2yz0 s ALA 69 Cb -0.12 -1.12 0.10 0.00 0.00 0.00 0.00 23.12 21.98 2yz0 s ALA 69 CO 0.03 -0.32 1.27 -1.64 0.00 0.00 0.00 175.76 175.10 2yz0 s MET 70 N 1.29 3.60 1.00 0.00 -1.94 -1.26 -2.73 119.30 119.25 2yz0 s MET 70 Ca 0.04 -1.48 -0.17 0.00 -1.71 0.00 0.00 55.69 52.36 2yz0 s MET 70 Cb -0.13 -5.11 -0.13 0.00 2.01 0.00 0.00 34.83 31.46 2yz0 s MET 70 CO -0.11 -1.96 -0.71 0.25 -0.01 0.00 0.00 175.02 172.47 2yz0 n THR 71 N 6.10 0.00 0.98 2.05 -2.24 -1.26 -4.74 114.28 115.17 2yz0 n THR 71 Ca 0.28 -0.45 0.05 0.00 -2.27 0.00 0.00 64.05 61.66 2yz0 n THR 71 Cb 0.50 -0.06 0.33 0.00 -2.10 0.00 0.00 70.33 68.99 2yz0 n THR 71 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2yz0 n PRO 72 N 2.07 0.49 0.00 -0.78 -0.04 -1.26 -2.42 135.00 133.06 2yz0 n PRO 72 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 2yz0 n PRO 72 Cb 0.56 -1.35 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 2yz0 n PRO 72 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2yz0 n MET 73 N -0.85 2.15 -1.42 0.54 2.81 -1.26 -4.89 117.12 114.20 2yz0 n MET 73 Ca 0.08 0.00 -0.38 0.00 -1.81 0.00 0.00 57.70 55.59 2yz0 n MET 73 Cb 0.04 -0.96 0.03 0.00 -0.71 0.00 0.00 33.22 31.61 2yz0 n MET 73 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46 2yz0 n TYR 74 N -1.65 -1.17 0.47 2.03 4.19 -1.01 -0.80 117.16 119.21 2yz0 n TYR 74 Ca 0.00 0.45 0.08 0.00 3.31 0.00 0.00 57.90 61.74 2yz0 n TYR 74 Cb 0.24 -1.90 0.33 0.00 0.49 0.00 0.00 39.34 38.51 2yz0 n TYR 74 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 2yz0 n PRO 75 N 0.32 0.03 -0.24 2.98 -0.04 -1.26 -4.81 135.00 131.99 2yz0 n PRO 75 Ca 0.11 0.29 0.12 0.00 -0.04 0.00 0.00 63.50 63.98 2yz0 n PRO 75 Cb 0.47 -1.56 0.24 0.00 -0.04 0.00 0.00 33.50 32.60 2yz0 n PRO 75 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 2yz0 n TYR 76 N -1.63 0.50 -4.04 0.54 9.36 0.02 -4.45 117.16 117.47 2yz0 n TYR 76 Ca 0.03 0.83 -0.15 0.00 3.32 0.00 0.00 57.90 61.93 2yz0 n TYR 76 Cb 0.18 -1.06 -0.02 0.00 -0.63 0.00 0.00 39.34 37.81 2yz0 n TYR 76 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 2yz0 n THR 77 N -4.87 0.00 -3.77 2.97 -2.24 -1.25 -5.10 114.28 100.02 2yz0 n THR 77 Ca 0.18 -1.19 -0.36 0.00 -2.27 0.00 0.00 64.05 60.41 2yz0 n THR 77 Cb 0.59 -0.01 -0.07 0.00 -2.10 0.00 0.00 70.33 68.74 2yz0 n THR 77 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2yz0 s ALA 78 N -2.43 3.74 1.00 6.98 0.00 -1.26 -4.46 121.76 125.33 2yz0 s ALA 78 Ca 0.08 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.37 2yz0 s ALA 78 Cb -0.01 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 21.00 2yz0 s ALA 78 CO 0.05 0.30 0.00 -0.35 0.00 0.00 0.00 175.76 175.76 2yz0 n PRO 79 N 3.06 0.15 -4.33 0.00 -0.04 -1.26 -4.80 135.00 127.79 2yz0 n PRO 79 Ca -0.17 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.07 2yz0 n PRO 79 Cb 0.53 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.82 2yz0 n PRO 79 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2yz0 s GLU 80 N -1.26 1.23 0.06 0.54 2.12 -1.10 -4.92 118.70 115.37 2yz0 s GLU 80 Ca 0.00 -0.24 0.09 0.00 0.36 0.00 0.00 54.97 55.18 2yz0 s GLU 80 Cb 0.00 -1.12 -0.03 0.00 0.26 0.00 0.00 34.13 33.24 2yz0 s GLU 80 CO 0.00 -0.05 -0.26 0.42 -0.54 0.00 0.00 175.26 174.84 2yz0 s ILE 81 N 0.86 2.10 -0.13 -3.70 -1.09 -1.25 -1.64 121.20 116.35 2yz0 s ILE 81 Ca -0.12 -1.44 -0.10 0.00 -2.23 0.00 0.00 60.65 56.76 2yz0 s ILE 81 Cb -0.15 -1.81 0.04 0.00 -1.58 0.00 0.00 42.46 38.96 2yz0 s ILE 81 CO 0.01 0.29 0.33 -1.83 -1.23 0.00 0.00 174.94 172.51 2yz0 s GLU 82 N -1.40 0.35 -0.01 2.79 -1.05 -1.15 -4.98 118.70 113.25 2yz0 s GLU 82 Ca 0.12 0.52 -0.15 0.00 -0.15 0.00 0.00 54.97 55.31 2yz0 s GLU 82 Cb -0.10 0.09 -0.06 0.00 -0.44 0.00 0.00 34.13 33.63 2yz0 s GLU 82 CO 0.03 -0.09 0.42 -0.06 0.95 0.00 0.00 175.26 176.51 2yz0 s PHE 83 N 0.58 3.70 0.38 4.83 0.08 -1.26 -2.77 117.98 123.53 2yz0 s PHE 83 Ca -0.03 0.98 0.04 0.00 0.12 0.00 0.00 56.93 58.04 2yz0 s PHE 83 Cb -0.05 -2.33 -0.06 0.00 -0.57 0.00 0.00 43.02 40.02 2yz0 s PHE 83 CO -0.03 0.58 0.05 0.15 -0.10 0.00 0.00 175.22 175.86 2yz0 s LYS 84 N -0.85 1.84 0.00 0.44 -0.14 -1.04 -4.90 119.74 115.08 2yz0 s LYS 84 Ca 0.24 -2.06 0.00 0.00 -1.36 0.00 0.00 55.97 52.79 2yz0 s LYS 84 Cb -0.17 -1.15 0.00 0.00 -1.68 0.00 0.00 37.83 34.84 2yz0 s LYS 84 CO 0.13 -0.20 0.00 0.09 -0.76 0.00 0.00 175.35 174.61 2yz0 n ASN 85 N -0.91 0.00 -3.32 2.83 3.02 -1.26 -3.23 115.26 112.38 2yz0 n ASN 85 Ca -0.05 0.00 -0.20 0.00 -0.03 0.00 0.00 54.58 54.29 2yz0 n ASN 85 Cb 0.67 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.86 2yz0 n ASN 85 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2yz0 n VAL 86 N 0.00 -3.68 0.00 2.41 0.24 -1.09 -4.98 118.33 111.22 2yz0 n VAL 86 Ca 0.00 0.35 0.00 0.00 -2.04 0.00 0.00 64.34 62.65 2yz0 n VAL 86 Cb 0.00 -3.58 0.00 0.00 -1.47 0.00 0.00 33.84 28.79 2yz0 n VAL 86 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2yz0 n GLN 87 N 0.47 0.00 -0.24 7.34 10.64 -1.24 -4.64 117.38 129.70 2yz0 n GLN 87 Ca -0.04 0.01 0.01 0.00 -1.83 0.00 0.00 57.00 55.15 2yz0 n GLN 87 Cb 0.57 -0.19 0.14 0.00 -0.86 0.00 0.00 30.24 29.90 2yz0 n GLN 87 CO 0.00 0.00 0.00 -0.97 -1.83 0.00 0.00 177.06 174.26 2yz0 h ASN 88 N 0.00 0.43 -4.14 2.61 -1.24 -1.94 -3.42 115.58 107.89 2yz0 h ASN 88 Ca 0.00 0.06 -0.54 0.00 0.71 0.00 0.00 56.30 56.53 2yz0 h ASN 88 Cb 0.00 -0.01 0.15 0.00 0.73 0.00 0.00 38.32 39.19 2yz0 h ASN 88 CO 0.00 0.24 0.46 -0.69 -1.29 0.00 0.00 177.43 176.15 2yz0 s VAL 89 N -6.06 2.27 0.00 2.57 1.01 -1.26 -5.00 120.40 113.93 2yz0 s VAL 89 Ca -0.13 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.01 2yz0 s VAL 89 Cb 0.18 -2.92 0.00 0.00 0.00 0.00 0.00 36.38 33.64 2yz0 s VAL 89 CO 0.76 -0.05 0.00 0.23 0.00 0.00 0.00 175.10 176.04 2yz0 n MET 90 N -2.18 0.00 0.00 2.72 2.81 -1.26 -4.95 117.12 114.25 2yz0 n MET 90 Ca 0.14 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.03 2yz0 n MET 90 Cb 0.49 -0.43 0.00 0.00 -0.71 0.00 0.00 33.22 32.57 2yz0 n MET 90 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 2yz0 n ASP 91 N -2.46 0.00 -0.32 7.83 5.75 -1.26 -4.95 116.55 121.14 2yz0 n ASP 91 Ca 0.00 0.00 0.06 0.00 -0.01 0.00 0.00 54.79 54.84 2yz0 n ASP 91 Cb 0.00 0.00 0.21 0.00 -1.03 0.00 0.00 41.12 40.30 2yz0 n ASP 91 CO 0.00 0.00 0.00 -1.28 -0.11 0.00 0.00 177.20 175.81 2yz0 h SER 92 N 0.00 0.74 -0.35 -1.12 0.87 -1.99 -0.34 113.55 111.37 2yz0 h SER 92 Ca 0.00 0.06 -0.12 0.00 -1.23 0.00 0.00 61.79 60.50 2yz0 h SER 92 Cb 0.00 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 2yz0 h SER 92 CO 0.00 0.39 -0.24 1.56 -0.53 0.00 0.00 176.83 178.00 2yz0 h GLN 93 N 0.83 0.78 -0.13 2.24 4.20 -1.98 -1.37 115.11 119.68 2yz0 h GLN 93 Ca 0.45 -0.37 0.01 0.00 0.06 0.00 0.00 58.65 58.80 2yz0 h GLN 93 Cb 0.48 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 2yz0 h GLN 93 CO -0.28 1.00 0.06 -0.07 -0.67 0.00 0.00 178.83 178.87 2yz0 h LEU 94 N 0.56 0.08 -0.93 1.46 3.38 -1.66 -1.67 115.31 116.54 2yz0 h LEU 94 Ca 0.07 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 2yz0 h LEU 94 Cb 0.81 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.53 2yz0 h LEU 94 CO 0.07 0.07 -0.10 1.56 0.09 0.00 0.00 178.44 180.12 2yz0 h GLN 95 N 0.13 0.67 -0.82 1.13 1.08 -1.11 -2.78 115.11 113.42 2yz0 h GLN 95 Ca 0.05 -0.21 -0.01 0.00 -1.45 0.00 0.00 58.65 57.04 2yz0 h GLN 95 Cb 0.01 -0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 27.34 2yz0 h GLN 95 CO -0.04 0.76 0.49 1.98 -0.95 0.00 0.00 178.83 181.07 2yz0 h MET 96 N 0.62 1.11 -0.31 1.46 4.05 -0.82 -2.65 114.93 118.38 2yz0 h MET 96 Ca 0.11 -0.10 -0.00 0.00 -0.28 0.00 0.00 59.70 59.43 2yz0 h MET 96 Cb 0.54 -0.23 -0.02 0.00 -0.80 0.00 0.00 31.60 31.09 2yz0 h MET 96 CO 0.03 0.78 0.19 -0.07 0.23 0.00 0.00 176.91 178.08 2yz0 h LEU 97 N 1.13 0.37 -1.54 3.39 3.38 -1.03 -2.13 115.31 118.88 2yz0 h LEU 97 Ca 0.29 -0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.33 2yz0 h LEU 97 Cb -0.04 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 2yz0 h LEU 97 CO -0.05 0.30 0.46 0.11 0.09 0.00 0.00 178.44 179.35 2yz0 h LYS 98 N 0.41 0.49 -0.19 1.13 1.79 -1.41 0.53 116.57 119.31 2yz0 h LYS 98 Ca 0.11 -0.03 -0.06 0.00 -2.18 0.00 0.00 60.65 58.49 2yz0 h LYS 98 Cb -0.01 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 30.53 2yz0 h LYS 98 CO -0.02 0.32 -0.12 0.77 -1.08 0.00 0.00 179.45 179.33 2yz0 h SER 99 N 0.50 0.44 1.25 0.86 0.02 -1.20 -3.06 113.55 112.37 2yz0 h SER 99 Ca 0.33 -0.43 -0.06 0.00 -0.84 0.00 0.00 61.79 60.79 2yz0 h SER 99 Cb 0.59 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 2yz0 h SER 99 CO -0.11 0.77 -0.26 1.05 -1.14 0.00 0.00 176.83 177.14 2yz0 h GLU 100 N 0.11 0.00 -0.49 3.45 4.11 -0.76 -3.14 114.58 117.86 2yz0 h GLU 100 Ca 0.04 0.00 0.03 0.00 0.07 0.00 0.00 59.36 59.50 2yz0 h GLU 100 Cb 0.62 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 2yz0 h GLU 100 CO 0.03 0.26 0.33 0.74 0.07 0.00 0.00 179.01 180.44 2yz0 h PHE 101 N 0.00 0.55 -0.57 2.06 -1.00 0.14 -1.93 116.94 116.18 2yz0 h PHE 101 Ca -0.00 0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.76 2yz0 h PHE 101 Cb 0.96 -0.18 -0.03 0.00 3.61 0.00 0.00 35.95 40.31 2yz0 h PHE 101 CO 0.00 0.32 0.22 -0.22 -1.61 0.00 0.00 178.31 177.03 2yz0 h LYS 102 N 0.57 0.86 -0.55 1.51 1.63 -1.56 -1.64 116.57 117.39 2yz0 h LYS 102 Ca 0.20 -0.16 -0.07 0.00 -0.85 0.00 0.00 60.65 59.76 2yz0 h LYS 102 Cb 0.08 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.54 2yz0 h LYS 102 CO -0.05 0.75 0.06 0.87 -3.45 0.00 0.00 179.45 177.62 2yz0 h LYS 103 N 0.79 0.89 -0.17 1.90 1.57 -1.52 -1.36 116.57 118.67 2yz0 h LYS 103 Ca 0.19 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2yz0 h LYS 103 Cb 0.21 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 2yz0 h LYS 103 CO -0.01 0.85 0.03 0.82 -0.57 0.00 0.00 179.45 180.57 2yz0 h ILE 104 N 0.84 1.22 -0.70 1.86 2.04 -1.13 -1.86 117.51 119.78 2yz0 h ILE 104 Ca 0.17 -0.70 -0.04 0.00 1.00 0.00 0.00 64.86 65.30 2yz0 h ILE 104 Cb 0.42 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 2yz0 h ILE 104 CO 0.01 0.21 0.30 -0.74 0.00 0.00 0.00 178.15 177.93 2yz0 h HIS 105 N 0.07 1.05 -0.65 1.37 2.76 -1.19 0.49 115.15 119.05 2yz0 h HIS 105 Ca 0.05 -0.07 -0.00 0.00 -2.20 0.00 0.00 60.37 58.15 2yz0 h HIS 105 Cb 0.29 -0.32 -0.03 0.00 1.55 0.00 0.00 27.41 28.91 2yz0 h HIS 105 CO 0.02 0.80 0.40 -0.91 -1.30 0.00 0.00 177.93 176.94 2yz0 h ASN 106 N 0.99 0.77 1.07 3.26 2.35 -1.15 0.73 115.58 123.59 2yz0 h ASN 106 Ca 0.24 -0.05 -0.17 0.00 -0.55 0.00 0.00 56.30 55.76 2yz0 h ASN 106 Cb 0.18 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 2yz0 h ASN 106 CO -0.02 0.59 -0.83 0.00 -1.65 0.00 0.00 177.43 175.52 2yz0 h THR 107 N 0.88 1.47 -0.85 2.81 1.03 -1.07 -3.29 112.91 113.89 2yz0 h THR 107 Ca 0.23 -2.96 -0.59 0.00 -0.01 0.00 0.00 66.41 63.09 2yz0 h THR 107 Cb -0.05 2.65 -0.39 0.00 -1.07 0.00 0.00 68.15 69.29 2yz0 h THR 107 CO -0.05 0.81 -0.37 -1.20 -0.01 0.00 0.00 175.52 174.70 2yz0 n SER 108 N -3.37 5.65 -4.50 0.00 7.64 0.17 -4.96 113.62 114.24 2yz0 n SER 108 Ca 0.00 -3.76 -0.42 0.00 1.01 0.00 0.00 58.87 55.70 2yz0 n SER 108 Cb 0.85 -0.51 -0.03 0.00 -1.01 0.00 0.00 64.21 63.51 2yz0 n SER 108 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 2yz0 s ARG 109 N -3.66 3.58 0.00 1.43 3.52 0.25 -3.83 118.95 120.24 2yz0 s ARG 109 Ca 0.54 -1.42 0.00 0.00 -0.13 0.00 0.00 55.73 54.73 2yz0 s ARG 109 Cb 0.44 -5.11 0.00 0.00 -1.56 0.00 0.00 34.95 28.72 2yz0 s ARG 109 CO 0.02 -1.99 0.00 0.41 -0.81 0.00 0.00 175.30 172.93 2yz0 n GLY 110 N 6.16 0.87 0.57 8.12 0.00 -1.26 -5.02 105.19 114.63 2yz0 n GLY 110 Ca 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.28 2yz0 n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yz0 n GLN 111 N 0.00 0.00 -0.18 1.61 10.64 -1.25 -5.07 117.38 123.13 2yz0 n GLN 111 Ca 0.00 -0.24 0.00 0.00 -1.83 0.00 0.00 57.00 54.93 2yz0 n GLN 111 Cb 0.00 0.43 0.00 0.00 -0.86 0.00 0.00 30.24 29.81 2yz0 n GLN 111 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 2yz0 n GLU 112 N 0.00 -0.50 0.00 2.61 1.02 -1.26 -5.00 120.64 117.51 2yz0 n GLU 112 Ca -0.07 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.44 2yz0 n GLU 112 Cb 0.34 -0.41 0.00 0.00 -0.02 0.00 0.00 31.44 31.35 2yz0 n GLU 112 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2yz0 n ILE 113 N -0.74 0.00 -0.12 -3.67 -5.35 -1.26 -4.77 119.36 103.45 2yz0 n ILE 113 Ca 0.00 -0.16 -0.09 0.00 -0.27 0.00 0.00 62.75 62.22 2yz0 n ILE 113 Cb 0.00 1.65 -0.01 0.00 -1.74 0.00 0.00 39.64 39.54 2yz0 n ILE 113 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 2yz0 h ILE 114 N 0.65 1.19 -0.10 7.28 1.08 -1.97 0.92 117.51 126.57 2yz0 h ILE 114 Ca 0.00 -0.60 -0.17 0.00 -0.39 0.00 0.00 64.86 63.70 2yz0 h ILE 114 Cb 0.33 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 34.98 2yz0 h ILE 114 CO 0.00 0.21 -0.66 0.15 -0.69 0.00 0.00 178.15 177.16 2yz0 h PHE 115 N 0.44 0.51 -0.12 1.37 3.57 -1.95 -2.30 116.94 118.46 2yz0 h PHE 115 Ca 0.12 -0.21 -0.03 0.00 3.53 0.00 0.00 57.97 61.38 2yz0 h PHE 115 Cb 0.20 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 38.85 2yz0 h PHE 115 CO -0.00 0.94 -0.04 0.93 -2.23 0.00 0.00 178.31 177.90 2yz0 h GLU 116 N 0.28 0.24 -0.74 1.11 4.39 -1.82 -0.25 114.58 117.79 2yz0 h GLU 116 Ca -0.02 -0.10 -0.05 0.00 0.34 0.00 0.00 59.36 59.54 2yz0 h GLU 116 Cb 1.21 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.82 2yz0 h GLU 116 CO 0.11 0.56 0.28 0.97 -1.16 0.00 0.00 179.01 179.77 2yz0 h ILE 117 N -0.09 1.26 -0.36 3.13 2.10 -0.85 0.10 117.51 122.80 2yz0 h ILE 117 Ca 0.03 -0.83 -0.09 0.00 1.08 0.00 0.00 64.86 65.05 2yz0 h ILE 117 Cb 0.48 0.40 -0.01 0.00 -1.09 0.00 0.00 36.82 36.60 2yz0 h ILE 117 CO 0.01 0.33 -0.15 0.71 -1.08 0.00 0.00 178.15 177.98 2yz0 h THR 118 N 1.08 1.28 -0.29 2.19 1.35 -1.38 -1.56 112.91 115.58 2yz0 h THR 118 Ca 0.24 -1.25 -0.07 0.00 -0.55 0.00 0.00 66.41 64.78 2yz0 h THR 118 Cb 0.24 1.34 -0.01 0.00 -1.73 0.00 0.00 68.15 67.99 2yz0 h THR 118 CO -0.02 0.41 -0.10 0.28 -0.25 0.00 0.00 175.52 175.84 2yz0 h SER 119 N 0.52 0.60 0.03 5.36 0.02 -0.86 0.39 113.55 119.60 2yz0 h SER 119 Ca 0.08 -0.39 -0.00 0.00 -0.84 0.00 0.00 61.79 60.65 2yz0 h SER 119 Cb 0.68 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.05 2yz0 h SER 119 CO 0.05 0.85 -0.01 -0.26 -1.14 0.00 0.00 176.83 176.31 2yz0 h PHE 120 N 0.34 -0.03 -0.61 3.45 -1.00 -0.79 0.10 116.94 118.40 2yz0 h PHE 120 Ca 0.07 -0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.77 2yz0 h PHE 120 Cb 0.61 0.01 -0.02 0.00 3.61 0.00 0.00 35.95 40.15 2yz0 h PHE 120 CO 0.06 0.02 0.07 1.79 -1.61 0.00 0.00 178.31 178.63 2yz0 h THR 121 N -0.07 1.26 -0.66 -1.55 1.35 -1.29 0.29 112.91 112.24 2yz0 h THR 121 Ca -0.00 -1.06 -0.06 0.00 -0.55 0.00 0.00 66.41 64.74 2yz0 h THR 121 Cb 0.06 0.75 -0.03 0.00 -1.73 0.00 0.00 68.15 67.20 2yz0 h THR 121 CO 0.01 0.39 0.16 -0.61 -0.25 0.00 0.00 175.52 175.22 2yz0 h GLN 122 N 0.94 1.03 0.10 4.72 -0.00 -0.73 0.34 115.11 121.51 2yz0 h GLN 122 Ca 0.18 -0.23 -0.28 0.00 -0.00 0.00 0.00 58.65 58.32 2yz0 h GLN 122 Cb 0.47 -0.14 0.03 0.00 0.00 0.00 0.00 27.48 27.84 2yz0 h GLN 122 CO 0.02 0.91 -1.16 1.05 0.00 0.00 0.00 178.83 179.65 2yz0 h GLU 123 N 0.98 0.62 -0.42 1.69 4.11 -0.59 -2.36 114.58 118.61 2yz0 h GLU 123 Ca 0.21 -0.79 -0.13 0.00 0.07 0.00 0.00 59.36 58.72 2yz0 h GLU 123 Cb 0.34 0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 2yz0 h GLU 123 CO -0.00 1.35 -0.23 -0.22 0.07 0.00 0.00 179.01 179.99 2yz0 h LYS 124 N 0.25 0.89 -0.39 1.06 1.63 -0.30 -2.48 116.57 117.22 2yz0 h LYS 124 Ca -0.17 -0.40 -0.13 0.00 -0.85 0.00 0.00 60.65 59.10 2yz0 h LYS 124 Cb 1.84 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 33.44 2yz0 h LYS 124 CO 0.22 1.05 -0.27 1.25 -3.45 0.00 0.00 179.45 178.26 2yz0 h LEU 125 N 0.71 0.85 -0.40 5.20 6.46 -0.40 -1.60 115.31 126.14 2yz0 h LEU 125 Ca 0.09 -0.33 -0.01 0.00 -0.12 0.00 0.00 57.88 57.51 2yz0 h LEU 125 Cb 0.80 -0.24 -0.02 0.00 -0.73 0.00 0.00 40.66 40.47 2yz0 h LEU 125 CO 0.07 1.07 0.21 -0.78 -0.62 0.00 0.00 178.44 178.39 2yz0 h ASP 126 N 0.71 0.50 0.38 1.25 3.58 -1.35 -0.59 116.42 120.91 2yz0 h ASP 126 Ca 0.09 -0.10 -0.11 0.00 0.42 0.00 0.00 57.03 57.33 2yz0 h ASP 126 Cb 0.81 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.72 2yz0 h ASP 126 CO 0.07 0.45 -0.47 1.05 -2.88 0.00 0.00 179.24 177.46 2yz0 h GLU 127 N 0.51 0.11 -0.25 0.28 4.11 -1.38 -2.95 114.58 115.00 2yz0 h GLU 127 Ca 0.14 -0.06 -0.09 0.00 0.07 0.00 0.00 59.36 59.42 2yz0 h GLU 127 Cb 0.07 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2yz0 h GLU 127 CO -0.02 0.56 -0.18 0.74 0.07 0.00 0.00 179.01 180.18 2yz0 h PHE 128 N 0.09 0.66 -0.57 2.06 -1.00 -0.88 -1.01 116.94 116.30 2yz0 h PHE 128 Ca 0.00 -0.18 0.03 0.00 2.81 0.00 0.00 57.97 60.63 2yz0 h PHE 128 Cb 0.87 -0.15 -0.04 0.00 3.61 0.00 0.00 35.95 40.25 2yz0 h PHE 128 CO 0.01 0.86 0.34 0.37 -1.61 0.00 0.00 178.31 178.27 2yz0 h GLN 129 N 0.27 0.64 0.00 1.51 -0.00 -1.05 -3.35 115.11 113.14 2yz0 h GLN 129 Ca 0.05 -0.04 0.00 0.00 -0.00 0.00 0.00 58.65 58.66 2yz0 h GLN 129 Cb 0.72 -0.14 0.00 0.00 0.00 0.00 0.00 27.48 28.05 2yz0 h GLN 129 CO 0.05 0.42 0.00 0.09 0.00 0.00 0.00 178.83 179.39 2yz0 n ASN 130 N -4.78 0.00 0.03 -0.69 3.02 -1.12 -4.87 115.26 106.86 2yz0 n ASN 130 Ca 0.05 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.71 2yz0 n ASN 130 Cb 0.09 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 2yz0 n ASN 130 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2yz0 n VAL 131 N -0.49 0.00 -3.87 2.41 0.24 -0.39 -5.11 118.33 111.13 2yz0 n VAL 131 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.19 2yz0 n VAL 131 Cb 0.00 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.26 2yz0 n VAL 131 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2yz0 s VAL 132 N -2.00 0.06 -0.30 3.34 1.01 -1.22 -4.73 120.40 116.55 2yz0 s VAL 132 Ca 0.00 -0.48 -0.14 0.00 0.00 0.00 0.00 61.98 61.36 2yz0 s VAL 132 Cb 0.00 -0.34 0.19 0.00 0.00 0.00 0.00 36.38 36.23 2yz0 s VAL 132 CO 0.00 -0.26 1.15 0.21 0.00 0.00 0.00 175.10 176.20 2yz0 s ASN 133 N -0.90 -0.02 0.01 3.32 3.04 -1.26 -4.94 114.94 114.20 2yz0 s ASN 133 Ca -0.10 -0.01 -0.01 0.00 0.04 0.00 0.00 52.86 52.78 2yz0 s ASN 133 Cb -0.06 0.04 -0.04 0.00 -1.54 0.00 0.00 41.25 39.65 2yz0 s ASN 133 CO 0.01 -0.00 0.17 -0.89 -3.04 0.00 0.00 177.10 173.35 2yz0 s THR 134 N 2.01 5.27 -0.16 -5.21 2.01 -1.26 -4.83 115.64 113.48 2yz0 s THR 134 Ca 0.14 -0.29 -0.08 0.00 0.31 0.00 0.00 61.69 61.77 2yz0 s THR 134 Cb 0.05 -3.49 0.06 0.00 0.01 0.00 0.00 72.50 69.12 2yz0 s THR 134 CO -0.17 0.27 0.38 -1.58 -0.69 0.00 0.00 174.62 172.83 2yz0 s GLN 135 N -2.09 0.35 -0.37 4.92 2.00 -1.26 -5.11 119.66 118.10 2yz0 s GLN 135 Ca 0.29 0.75 0.03 0.00 -2.00 0.00 0.00 55.36 54.43 2yz0 s GLN 135 Cb -0.13 -0.03 0.16 0.00 0.80 0.00 0.00 33.01 33.81 2yz0 s GLN 135 CO 0.21 -0.16 0.39 -1.54 -0.50 0.00 0.00 175.29 173.69 2yz0 s SER 136 N 1.44 0.97 -0.32 6.67 1.04 -1.26 -5.11 113.70 117.13 2yz0 s SER 136 Ca -0.09 -1.47 -0.29 0.00 0.48 0.00 0.00 55.95 54.58 2yz0 s SER 136 Cb -0.09 0.67 -0.01 0.00 0.10 0.00 0.00 66.02 66.69 2yz0 s SER 136 CO -0.12 -0.26 1.62 -0.22 0.98 0.00 0.00 173.24 175.24 2yz0 s LEU 137 N 1.52 3.65 0.00 2.42 1.98 -1.26 -5.39 118.68 121.60 2yz0 s LEU 137 Ca 0.16 1.27 0.29 0.00 -2.89 0.00 0.00 54.13 52.97 2yz0 s LEU 137 Cb -0.14 -3.53 1.76 0.00 0.66 0.00 0.00 46.19 44.93 2yz0 s LEU 137 CO -0.05 -1.48 2.09 -1.84 -1.89 0.00 0.00 176.35 173.18