#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wvd n SER 9 N 0.00 2.01 -4.79 -1.12 3.41 -1.26 -4.95 113.62 106.92 2wvd n SER 9 Ca 0.00 -1.51 -0.36 0.00 -0.26 0.00 0.00 58.87 56.74 2wvd n SER 9 Cb 0.00 0.49 -0.07 0.00 -0.26 0.00 0.00 64.21 64.37 2wvd n SER 9 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 2wvd s ILE 10 N -2.49 5.32 -0.11 -1.33 2.07 -1.26 -5.10 121.20 118.30 2wvd s ILE 10 Ca 0.18 0.15 -0.05 0.00 -1.41 0.00 0.00 60.65 59.52 2wvd s ILE 10 Cb 0.18 -3.36 -0.04 0.00 0.13 0.00 0.00 42.46 39.37 2wvd s ILE 10 CO 0.58 0.54 0.06 -0.63 -1.91 0.00 0.00 174.94 173.59 2wvd s ILE 11 N -0.39 4.85 -0.13 2.00 1.01 -1.26 -5.11 121.20 122.17 2wvd s ILE 11 Ca 0.11 -0.04 0.01 0.00 0.00 0.00 0.00 60.65 60.74 2wvd s ILE 11 Cb -0.12 -3.09 -0.01 0.00 0.01 0.00 0.00 42.46 39.26 2wvd s ILE 11 CO 0.01 0.59 -0.18 -0.13 0.00 0.00 0.00 174.94 175.24 2wvd s ARG 12 N -0.79 3.21 0.16 2.79 0.52 -1.26 -5.12 118.95 118.45 2wvd s ARG 12 Ca 0.13 -0.78 0.04 0.00 -0.52 0.00 0.00 55.73 54.60 2wvd s ARG 12 Cb -0.12 -2.51 -0.05 0.00 0.52 0.00 0.00 34.95 32.80 2wvd s ARG 12 CO 0.03 0.14 -0.09 -0.59 0.02 0.00 0.00 175.30 174.81 2wvd s PHE 13 N 0.49 1.29 -0.13 -0.53 -0.12 -1.26 -5.16 117.98 112.56 2wvd s PHE 13 Ca -0.12 -0.78 -0.07 0.00 -0.05 0.00 0.00 56.93 55.91 2wvd s PHE 13 Cb -0.16 -0.67 -0.04 0.00 -0.63 0.00 0.00 43.02 41.52 2wvd s PHE 13 CO 0.05 0.06 0.13 0.45 -0.05 0.00 0.00 175.22 175.86 2wvd s SER 14 N -3.18 6.26 -0.22 1.98 0.15 -1.26 -5.09 113.70 112.34 2wvd s SER 14 Ca 0.18 0.41 0.01 0.00 0.70 0.00 0.00 55.95 57.24 2wvd s SER 14 Cb 0.03 -2.02 0.03 0.00 -1.71 0.00 0.00 66.02 62.35 2wvd s SER 14 CO 0.01 0.37 -0.14 -0.69 1.20 0.00 0.00 173.24 174.00 2wvd s VAL 15 N -0.82 2.34 0.25 4.45 1.01 -1.26 -5.11 120.40 121.26 2wvd s VAL 15 Ca 0.14 -1.14 -0.24 0.00 0.00 0.00 0.00 61.98 60.73 2wvd s VAL 15 Cb -0.12 -2.15 -0.09 0.00 0.00 0.00 0.00 36.38 34.02 2wvd s VAL 15 CO 0.03 0.29 0.84 -0.44 0.00 0.00 0.00 175.10 175.83 2wvd s SER 16 N 1.25 7.30 -0.05 3.32 0.01 -1.26 -5.04 113.70 119.23 2wvd s SER 16 Ca -0.00 1.68 -0.29 0.00 1.31 0.00 0.00 55.95 58.65 2wvd s SER 16 Cb -0.16 -2.52 0.10 0.00 0.21 0.00 0.00 66.02 63.66 2wvd s SER 16 CO -0.08 0.05 0.88 -0.22 0.41 0.00 0.00 173.24 174.27 2wvd s LEU 17 N -1.74 -0.42 0.31 2.44 2.96 -1.26 -5.16 118.68 115.81 2wvd s LEU 17 Ca 0.44 0.23 -0.28 0.00 -0.22 0.00 0.00 54.13 54.29 2wvd s LEU 17 Cb -0.20 2.07 -0.09 0.00 0.50 0.00 0.00 46.19 48.47 2wvd s LEU 17 CO 0.24 -0.55 1.12 -1.10 -1.32 0.00 0.00 176.35 174.75 2wvd s GLN 18 N -2.24 4.50 0.33 1.98 -1.52 -1.26 -4.91 119.66 116.54 2wvd s GLN 18 Ca 0.00 1.82 0.01 0.00 -1.95 0.00 0.00 55.36 55.24 2wvd s GLN 18 Cb -0.01 -3.05 0.57 0.00 -0.22 0.00 0.00 33.01 30.30 2wvd s GLN 18 CO -0.03 0.08 1.98 0.37 -0.25 0.00 0.00 175.29 177.43 2wvd h GLN 19 N 3.51 0.86 -0.66 2.91 5.75 -2.01 0.11 115.11 125.58 2wvd h GLN 19 Ca -0.47 -0.07 0.10 0.00 -0.15 0.00 0.00 58.65 58.05 2wvd h GLN 19 Cb 1.22 -0.18 -0.07 0.00 1.07 0.00 0.00 27.48 29.51 2wvd h GLN 19 CO 0.66 0.60 0.29 -0.91 -2.65 0.00 0.00 178.83 176.82 2wvd h ASN 20 N 0.88 0.33 0.18 -0.69 2.35 -2.00 -0.93 115.58 115.69 2wvd h ASN 20 Ca 0.23 0.07 -0.23 0.00 -0.55 0.00 0.00 56.30 55.82 2wvd h ASN 20 Cb -0.04 0.03 0.01 0.00 0.05 0.00 0.00 38.32 38.37 2wvd h ASN 20 CO -0.04 0.19 -0.91 0.25 -1.65 0.00 0.00 177.43 175.26 2wvd h LEU 21 N 0.49 0.68 -1.07 1.61 5.85 -1.46 -3.04 115.31 118.37 2wvd h LEU 21 Ca 0.33 -0.51 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 2wvd h LEU 21 Cb 0.39 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 2wvd h LEU 21 CO -0.30 1.30 0.47 0.25 -0.34 0.00 0.00 178.44 179.83 2wvd h LEU 22 N 0.32 0.99 -0.57 2.25 5.85 -0.60 -2.45 115.31 121.10 2wvd h LEU 22 Ca -0.08 -0.07 -0.15 0.00 0.84 0.00 0.00 57.88 58.42 2wvd h LEU 22 Cb 1.54 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 2wvd h LEU 22 CO 0.17 0.78 -0.43 0.44 -0.34 0.00 0.00 178.44 179.06 2wvd h ASP 23 N 1.13 0.71 -0.38 1.25 3.32 -1.14 -0.14 116.42 121.17 2wvd h ASP 23 Ca 0.29 -0.33 -0.11 0.00 0.02 0.00 0.00 57.03 56.90 2wvd h ASP 23 Cb -0.01 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 2wvd h ASP 23 CO -0.05 1.05 -0.17 -0.33 -1.72 0.00 0.00 179.24 178.01 2wvd h GLU 24 N 0.54 0.85 -0.28 3.56 5.08 -1.40 -1.34 114.58 121.59 2wvd h GLU 24 Ca 0.04 -0.33 -0.05 0.00 -1.00 0.00 0.00 59.36 58.02 2wvd h GLU 24 Cb 0.96 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 2wvd h GLU 24 CO 0.09 0.96 -0.01 1.25 -1.00 0.00 0.00 179.01 180.30 2wvd h LEU 25 N 0.75 0.49 -2.01 1.33 5.85 -1.26 -2.81 115.31 117.66 2wvd h LEU 25 Ca 0.11 -0.32 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 2wvd h LEU 25 Cb 0.70 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 2wvd h LEU 25 CO 0.05 0.69 -0.10 0.44 -0.34 0.00 0.00 178.44 179.18 2wvd h ASP 26 N 0.28 0.00 -0.29 1.25 3.32 -0.88 -2.59 116.42 117.51 2wvd h ASP 26 Ca 0.08 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.96 2wvd h ASP 26 Cb 0.44 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.99 2wvd h ASP 26 CO 0.02 0.10 -0.48 -1.13 -1.72 0.00 0.00 179.24 176.03 2wvd h ASN 27 N 0.00 0.95 0.08 6.45 -0.73 -0.98 -2.79 115.58 118.55 2wvd h ASN 27 Ca -0.00 -0.47 -0.16 0.00 1.87 0.00 0.00 56.30 57.54 2wvd h ASN 27 Cb 0.26 -0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.57 2wvd h ASN 27 CO 0.01 1.26 -0.56 0.03 -0.37 0.00 0.00 177.43 177.81 2wvd h ARG 28 N 0.68 0.50 -0.16 6.67 2.47 -1.34 0.37 114.38 123.58 2wvd h ARG 28 Ca 0.03 -0.32 0.01 0.00 -1.26 0.00 0.00 59.98 58.44 2wvd h ARG 28 Cb 1.07 0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 29.41 2wvd h ARG 28 CO 0.11 0.93 0.06 0.82 0.56 0.00 0.00 179.97 182.45 2wvd h ILE 29 N 0.39 0.98 -0.11 2.04 2.04 -1.48 0.54 117.51 121.90 2wvd h ILE 29 Ca 0.01 -0.05 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 2wvd h ILE 29 Cb 1.09 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 2wvd h ILE 29 CO 0.10 0.03 -0.08 0.40 0.00 0.00 0.00 178.15 178.60 2wvd h ILE 30 N 0.15 1.34 -0.38 -0.67 2.04 -1.42 0.40 117.51 118.98 2wvd h ILE 30 Ca 0.07 -1.18 -0.04 0.00 1.00 0.00 0.00 64.86 64.71 2wvd h ILE 30 Cb 0.03 1.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.96 2wvd h ILE 30 CO -0.06 0.34 0.06 0.11 0.00 0.00 0.00 178.15 178.60 2wvd h LYS 31 N -0.12 0.56 -0.01 2.37 1.57 -0.12 -3.23 116.57 117.58 2wvd h LYS 31 Ca 0.02 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2wvd h LYS 31 Cb 0.57 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.79 2wvd h LYS 31 CO 0.02 0.54 -0.03 0.09 -0.57 0.00 0.00 179.45 179.51 2wvd n ASN 32 N -4.31 1.97 -0.55 0.86 4.13 0.19 -5.00 115.26 112.54 2wvd n ASN 32 Ca 0.02 -1.49 -0.04 0.00 1.68 0.00 0.00 54.58 54.76 2wvd n ASN 32 Cb 0.21 0.05 0.00 0.00 -1.54 0.00 0.00 39.78 38.50 2wvd n ASN 32 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wvd n GLY 33 N 0.74 0.30 3.78 7.41 0.00 -0.11 -5.01 105.19 112.30 2wvd n GLY 33 Ca 0.07 -0.69 -0.37 0.00 0.00 0.00 0.00 46.02 45.03 2wvd n GLY 33 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wvd s TYR 34 N -2.35 3.25 0.20 1.61 2.02 -0.06 -4.96 117.35 117.06 2wvd s TYR 34 Ca 0.02 1.63 0.02 0.00 -0.37 0.00 0.00 57.07 58.37 2wvd s TYR 34 Cb -0.01 -3.20 0.14 0.00 -0.40 0.00 0.00 41.96 38.49 2wvd s TYR 34 CO 0.02 -0.79 1.49 0.66 -1.57 0.00 0.00 175.55 175.37 2wvd h SER 35 N 2.65 0.35 -5.02 2.29 4.64 -1.95 -3.44 113.55 113.06 2wvd h SER 35 Ca -0.48 -0.22 0.05 0.00 -0.47 0.00 0.00 61.79 60.67 2wvd h SER 35 Cb 1.22 -0.10 -0.05 0.00 -0.31 0.00 0.00 62.40 63.16 2wvd h SER 35 CO 0.63 0.93 0.22 -0.94 -0.87 0.00 0.00 176.83 176.79 2wvd s SER 36 N -6.93 -0.21 0.16 4.97 1.04 -1.26 -5.04 113.70 106.43 2wvd s SER 36 Ca -0.04 -0.70 -0.11 0.00 0.48 0.00 0.00 55.95 55.57 2wvd s SER 36 Cb 0.11 0.74 0.01 0.00 0.10 0.00 0.00 66.02 66.98 2wvd s SER 36 CO 0.82 -1.39 1.57 0.03 0.98 0.00 0.00 173.24 175.25 2wvd h ARG 37 N 2.01 0.96 -0.75 4.02 3.08 -1.98 -3.08 114.38 118.65 2wvd h ARG 37 Ca -0.21 -0.37 -0.00 0.00 0.07 0.00 0.00 59.98 59.47 2wvd h ARG 37 Cb 1.25 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 31.21 2wvd h ARG 37 CO 0.26 1.03 0.47 0.77 -1.07 0.00 0.00 179.97 181.43 2wvd h SER 38 N 0.82 0.89 -0.40 7.04 0.02 -1.98 0.72 113.55 120.68 2wvd h SER 38 Ca 0.13 -0.05 -0.13 0.00 -0.84 0.00 0.00 61.79 60.90 2wvd h SER 38 Cb 0.67 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 2wvd h SER 38 CO 0.05 0.68 -0.24 1.05 -1.14 0.00 0.00 176.83 177.23 2wvd h GLU 39 N 1.02 0.91 -0.08 3.45 4.11 -1.96 0.51 114.58 122.54 2wvd h GLU 39 Ca 0.27 -0.39 -0.03 0.00 0.07 0.00 0.00 59.36 59.29 2wvd h GLU 39 Cb -0.06 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 2wvd h GLU 39 CO -0.05 1.04 -0.05 1.25 0.07 0.00 0.00 179.01 181.27 2wvd h LEU 40 N 0.78 0.19 -0.49 3.06 5.85 -1.41 -2.12 115.31 121.17 2wvd h LEU 40 Ca 0.10 -0.43 -0.02 0.00 0.84 0.00 0.00 57.88 58.37 2wvd h LEU 40 Cb 0.79 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 2wvd h LEU 40 CO 0.07 0.58 0.23 0.58 -0.34 0.00 0.00 178.44 179.56 2wvd h VAL 41 N -0.21 1.19 -0.61 1.05 2.07 -0.77 -1.83 116.25 117.14 2wvd h VAL 41 Ca 0.02 -0.55 0.11 0.00 0.82 0.00 0.00 66.70 67.10 2wvd h VAL 41 Cb 0.51 0.65 -0.08 0.00 -1.52 0.00 0.00 31.29 30.85 2wvd h VAL 41 CO 0.01 0.21 0.16 0.03 0.02 0.00 0.00 177.57 178.01 2wvd h ARG 42 N 0.65 0.29 -0.55 1.57 3.08 -0.01 -1.29 114.38 118.12 2wvd h ARG 42 Ca 0.17 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 60.08 2wvd h ARG 42 Cb 0.12 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2wvd h ARG 42 CO -0.02 0.19 -0.10 -0.44 -1.07 0.00 0.00 179.97 178.53 2wvd h ASP 43 N 0.30 1.05 -0.20 7.04 3.32 -0.88 -0.48 116.42 126.57 2wvd h ASP 43 Ca 0.32 -0.35 -0.04 0.00 0.02 0.00 0.00 57.03 56.98 2wvd h ASP 43 Cb 0.46 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2wvd h ASP 43 CO -0.38 1.15 -0.03 0.24 -1.72 0.00 0.00 179.24 178.50 2wvd h MET 44 N 0.93 0.36 -0.14 3.56 2.86 -1.12 -2.12 114.93 119.27 2wvd h MET 44 Ca 0.14 -0.13 0.02 0.00 -2.06 0.00 0.00 59.70 57.67 2wvd h MET 44 Cb 0.68 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.29 2wvd h MET 44 CO 0.05 0.60 -0.01 0.82 1.06 0.00 0.00 176.91 179.43 2wvd h ILE 45 N 0.10 0.90 -0.47 -1.22 2.04 -1.13 -1.70 117.51 116.02 2wvd h ILE 45 Ca 0.05 -0.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.85 2wvd h ILE 45 Cb 0.46 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 2wvd h ILE 45 CO 0.02 0.01 0.10 -0.09 0.00 0.00 0.00 178.15 178.18 2wvd h ARG 46 N 0.04 0.72 -0.16 2.37 2.43 -1.07 0.13 114.38 118.84 2wvd h ARG 46 Ca 0.06 -0.14 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 2wvd h ARG 46 Cb 0.08 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.51 2wvd h ARG 46 CO -0.11 0.67 -0.00 1.49 -1.51 0.00 0.00 179.97 180.50 2wvd h GLU 47 N 0.70 0.29 -0.35 0.20 4.81 -1.15 -2.39 114.58 116.69 2wvd h GLU 47 Ca 0.16 -0.09 -0.14 0.00 -0.13 0.00 0.00 59.36 59.16 2wvd h GLU 47 Cb 0.28 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 2wvd h GLU 47 CO -0.00 0.51 -0.31 -0.22 -0.73 0.00 0.00 179.01 178.26 2wvd h LYS 48 N 0.04 0.83 -0.90 1.92 1.63 -0.94 -2.32 116.57 116.82 2wvd h LYS 48 Ca 0.05 -0.43 -0.01 0.00 -0.85 0.00 0.00 60.65 59.41 2wvd h LYS 48 Cb 0.38 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.98 2wvd h LYS 48 CO 0.01 1.06 0.51 -0.07 -3.45 0.00 0.00 179.45 177.51 2wvd h LEU 49 N 0.62 1.11 -0.19 5.20 3.38 -0.78 0.39 115.31 125.03 2wvd h LEU 49 Ca 0.06 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2wvd h LEU 49 Cb 0.89 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2wvd h LEU 49 CO 0.08 0.88 0.03 0.58 0.09 0.00 0.00 178.44 180.09 2wvd h VAL 50 N 1.25 1.23 -0.47 1.22 2.07 -1.36 -2.13 116.25 118.05 2wvd h VAL 50 Ca 0.32 -0.74 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 2wvd h VAL 50 Cb -0.00 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 2wvd h VAL 50 CO -0.05 0.23 0.22 -0.33 0.02 0.00 0.00 177.57 177.65 2wvd h GLU 51 N 0.11 0.65 0.55 1.57 5.08 -1.14 -1.56 114.58 119.84 2wvd h GLU 51 Ca 0.06 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2wvd h GLU 51 Cb 0.32 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 29.44 2wvd h GLU 51 CO 0.00 0.51 -0.27 -0.44 -1.00 0.00 0.00 179.01 177.82 2wvd h ASP 52 N 0.65 -0.63 -0.73 1.42 3.32 -0.74 -2.93 116.42 116.78 2wvd h ASP 52 Ca 0.16 -0.00 0.12 0.00 0.02 0.00 0.00 57.03 57.33 2wvd h ASP 52 Cb 0.07 0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.74 2wvd h ASP 52 CO -0.02 -0.41 0.48 0.78 -1.72 0.00 0.00 179.24 178.35 2wvd h ASN 53 N -0.80 0.49 -0.72 6.45 2.35 -1.04 -1.48 115.58 120.82 2wvd h ASN 53 Ca -0.08 0.02 0.11 0.00 -0.55 0.00 0.00 56.30 55.80 2wvd h ASN 53 Cb 0.59 -0.08 -0.08 0.00 0.05 0.00 0.00 38.32 38.80 2wvd h ASN 53 CO 0.12 0.28 0.35 -0.25 -1.65 0.00 0.00 177.43 176.28 2wvd h TRP 54 N 0.53 0.61 0.00 1.19 7.01 -1.11 -2.15 115.95 122.04 2wvd h TRP 54 Ca 0.35 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.38 2wvd h TRP 54 Cb 0.62 -0.17 0.00 0.00 -2.10 0.00 0.00 29.16 27.52 2wvd h TRP 54 CO -0.00 0.19 -0.60 0.00 -2.79 0.00 0.00 178.44 175.24 2wvd n ALA 55 N -2.43 3.61 0.13 2.65 0.00 -0.60 -4.37 120.51 119.50 2wvd n ALA 55 Ca 0.12 -0.37 0.01 0.00 0.00 0.00 0.00 53.44 53.20 2wvd n ALA 55 Cb 0.31 -1.08 -0.01 0.00 0.00 0.00 0.00 19.45 18.67 2wvd n ALA 55 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2wvd n GLU 56 N -1.59 4.99 -4.65 0.00 1.02 -0.94 -4.72 120.64 114.75 2wvd n GLU 56 Ca 0.05 -0.11 -0.33 0.00 -0.02 0.00 0.00 57.16 56.74 2wvd n GLU 56 Cb 0.35 -0.70 -0.14 0.00 -0.02 0.00 0.00 31.44 30.93 2wvd n GLU 56 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2wvd s ASP 57 N -1.11 4.29 -1.27 1.62 -0.00 -0.84 -4.59 116.67 114.78 2wvd s ASP 57 Ca 0.02 -0.26 -0.10 0.00 -0.00 0.00 0.00 52.55 52.21 2wvd s ASP 57 Cb 0.02 -1.67 -0.00 0.00 -0.00 0.00 0.00 42.92 41.27 2wvd s ASP 57 CO 0.10 0.17 0.63 0.59 -0.00 0.00 0.00 175.17 176.66 2wvd n ASN 58 N 3.51 -2.78 -0.02 0.27 3.02 -1.26 -4.80 115.26 113.20 2wvd n ASN 58 Ca -0.18 -1.00 0.12 0.00 -0.03 0.00 0.00 54.58 53.50 2wvd n ASN 58 Cb 0.53 -3.29 0.55 0.00 -0.61 0.00 0.00 39.78 36.95 2wvd n ASN 58 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2wvd h PRO 59 N -1.88 0.29 -0.18 3.52 0.11 -1.84 0.13 132.00 132.14 2wvd h PRO 59 Ca -0.65 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.45 2wvd h PRO 59 Cb 1.37 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2wvd h PRO 59 CO 0.55 0.19 0.00 0.09 -0.21 0.00 0.00 178.00 178.62 2wvd n ASN 60 N -4.46 1.69 -4.71 -2.05 4.13 -1.26 -3.37 115.26 105.21 2wvd n ASN 60 Ca 0.08 -1.74 -0.42 0.00 1.68 0.00 0.00 54.58 54.18 2wvd n ASN 60 Cb 0.35 -0.12 -0.03 0.00 -1.54 0.00 0.00 39.78 38.44 2wvd n ASN 60 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2wvd s ASP 61 N -1.51 6.50 0.00 6.41 3.68 0.46 -4.82 116.67 127.39 2wvd s ASP 61 Ca 0.31 2.70 0.28 0.00 2.13 0.00 0.00 52.55 57.97 2wvd s ASP 61 Cb 0.17 -2.59 1.01 0.00 -1.45 0.00 0.00 42.92 40.06 2wvd s ASP 61 CO 0.25 -0.90 1.72 -0.62 0.13 0.00 0.00 175.17 175.75 2wvd n GLU 62 N 4.31 1.44 -0.20 4.34 -0.58 -1.26 -3.41 120.64 125.28 2wvd n GLU 62 Ca 0.15 -0.82 0.11 0.00 -0.42 0.00 0.00 57.16 56.18 2wvd n GLU 62 Cb 0.38 -1.48 0.21 0.00 -0.57 0.00 0.00 31.44 29.97 2wvd n GLU 62 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2wvd n SER 63 N -0.06 3.40 -4.74 1.62 3.41 -1.26 -2.66 113.62 113.32 2wvd n SER 63 Ca 0.17 -1.96 -0.40 0.00 -0.26 0.00 0.00 58.87 56.42 2wvd n SER 63 Cb 0.35 -0.26 0.02 0.00 -0.26 0.00 0.00 64.21 64.06 2wvd n SER 63 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2wvd n LYS 64 N 1.39 2.08 -5.07 4.33 5.02 -1.19 -4.81 118.16 119.91 2wvd n LYS 64 Ca 0.19 0.74 -0.28 0.00 -2.02 0.00 0.00 58.31 56.94 2wvd n LYS 64 Cb 0.58 -2.54 -0.16 0.00 -0.02 0.00 0.00 35.03 32.89 2wvd n LYS 64 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2wvd s ILE 65 N -1.21 1.71 0.08 -0.18 1.01 -1.24 -2.20 121.20 119.18 2wvd s ILE 65 Ca 0.62 -0.92 -0.05 0.00 0.00 0.00 0.00 60.65 60.30 2wvd s ILE 65 Cb -0.46 -1.43 -0.02 0.00 0.01 0.00 0.00 42.46 40.56 2wvd s ILE 65 CO 0.57 0.48 0.10 0.00 0.00 0.00 0.00 174.94 176.09 2wvd s ALA 66 N -0.45 0.10 -0.14 9.38 0.00 -1.10 -1.28 121.76 128.28 2wvd s ALA 66 Ca 0.07 -0.88 0.02 0.00 0.00 0.00 0.00 51.96 51.17 2wvd s ALA 66 Cb -0.09 0.42 0.00 0.00 0.00 0.00 0.00 23.12 23.46 2wvd s ALA 66 CO -0.00 -0.46 -0.21 0.08 0.00 0.00 0.00 175.76 175.17 2wvd s VAL 67 N -3.89 2.23 -0.23 0.00 1.01 0.11 -0.36 120.40 119.26 2wvd s VAL 67 Ca 0.07 -0.93 -0.08 0.00 0.00 0.00 0.00 61.98 61.04 2wvd s VAL 67 Cb 0.06 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 2wvd s VAL 67 CO -0.10 0.54 0.08 -0.22 0.00 0.00 0.00 175.10 175.40 2wvd s LEU 68 N 0.72 3.61 -0.24 3.92 2.96 0.13 -0.62 118.68 129.15 2wvd s LEU 68 Ca -0.09 -0.10 -0.08 0.00 -0.22 0.00 0.00 54.13 53.64 2wvd s LEU 68 Cb -0.16 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 2wvd s LEU 68 CO 0.01 0.03 0.09 -0.69 -1.32 0.00 0.00 176.35 174.46 2wvd s VAL 69 N 1.26 4.54 -0.02 1.68 1.01 0.26 -0.28 120.40 128.86 2wvd s VAL 69 Ca 0.05 -0.10 0.05 0.00 0.00 0.00 0.00 61.98 61.98 2wvd s VAL 69 Cb -0.14 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.10 2wvd s VAL 69 CO 0.04 0.34 -0.17 -0.69 0.00 0.00 0.00 175.10 174.62 2wvd s VAL 70 N 1.46 1.35 -0.14 2.92 1.01 -0.35 -1.02 120.40 125.63 2wvd s VAL 70 Ca 0.06 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.33 2wvd s VAL 70 Cb -0.15 -1.13 -0.00 0.00 0.00 0.00 0.00 36.38 35.10 2wvd s VAL 70 CO 0.05 0.38 -0.17 -0.63 0.00 0.00 0.00 175.10 174.73 2wvd s ILE 71 N -0.29 2.59 0.19 2.22 1.01 -0.27 -1.20 121.20 125.45 2wvd s ILE 71 Ca 0.04 -0.81 -0.09 0.00 0.00 0.00 0.00 60.65 59.80 2wvd s ILE 71 Cb -0.08 -2.07 -0.01 0.00 0.01 0.00 0.00 42.46 40.31 2wvd s ILE 71 CO -0.00 0.53 0.31 -0.72 0.00 0.00 0.00 174.94 175.06 2wvd s TYR 72 N 0.62 0.52 -0.40 3.97 -0.85 -0.69 -1.32 117.35 119.21 2wvd s TYR 72 Ca -0.09 -0.86 -0.20 0.00 -0.52 0.00 0.00 57.07 55.40 2wvd s TYR 72 Cb -0.16 -0.08 0.01 0.00 0.38 0.00 0.00 41.96 42.12 2wvd s TYR 72 CO 0.03 -0.78 0.59 0.34 -1.52 0.00 0.00 175.55 174.21 2wvd s ASP 73 N -3.02 6.34 0.00 -0.18 -1.08 -1.02 -0.48 116.67 117.23 2wvd s ASP 73 Ca 0.22 -0.17 0.28 0.00 -0.52 0.00 0.00 52.55 52.36 2wvd s ASP 73 Cb 0.03 -2.30 0.99 0.00 -1.46 0.00 0.00 42.92 40.18 2wvd s ASP 73 CO 0.05 -0.65 1.72 0.00 0.52 0.00 0.00 175.17 176.81 2wvd n HIS 74 N 6.04 0.00 -0.34 -5.34 1.44 -1.26 -3.37 115.22 112.38 2wvd n HIS 74 Ca -0.03 0.00 0.09 0.00 -2.01 0.00 0.00 57.72 55.78 2wvd n HIS 74 Cb 0.48 -0.19 0.26 0.00 0.12 0.00 0.00 29.99 30.67 2wvd n HIS 74 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2wvd n HIS 75 N -0.94 0.84 -3.42 -1.40 8.25 -1.26 -4.90 115.22 112.38 2wvd n HIS 75 Ca 0.12 -0.52 -0.38 0.00 -0.26 0.00 0.00 57.72 56.68 2wvd n HIS 75 Cb 0.31 -0.04 -0.06 0.00 1.12 0.00 0.00 29.99 31.32 2wvd n HIS 75 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2wvd s GLN 76 N -1.11 4.07 0.16 -0.41 0.74 -1.22 -5.04 119.66 116.85 2wvd s GLN 76 Ca 0.40 0.47 -0.30 0.00 0.05 0.00 0.00 55.36 55.97 2wvd s GLN 76 Cb 0.21 -3.28 -0.08 0.00 1.10 0.00 0.00 33.01 30.97 2wvd s GLN 76 CO 0.26 0.55 1.31 -0.98 -0.55 0.00 0.00 175.29 175.88 2wvd s ARG 77 N -0.67 4.38 0.00 1.67 1.04 -1.26 -3.38 118.95 120.74 2wvd s ARG 77 Ca 0.25 2.02 0.00 0.00 -1.04 0.00 0.00 55.73 56.96 2wvd s ARG 77 Cb -0.17 -3.23 0.00 0.00 -2.04 0.00 0.00 34.95 29.52 2wvd s ARG 77 CO 0.13 -0.29 0.00 0.39 -0.04 0.00 0.00 175.30 175.49 2wvd n GLU 78 N 3.12 0.00 -0.08 3.89 -0.58 -1.26 -4.89 120.64 120.85 2wvd n GLU 78 Ca 0.08 0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 56.73 2wvd n GLU 78 Cb 0.43 -1.67 -0.02 0.00 -0.57 0.00 0.00 31.44 29.62 2wvd n GLU 78 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2wvd h LEU 79 N 0.00 0.28 -0.25 -4.62 5.85 -1.91 0.23 115.31 114.90 2wvd h LEU 79 Ca 0.00 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2wvd h LEU 79 Cb 0.00 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 2wvd h LEU 79 CO 0.00 0.21 0.09 -1.13 -0.34 0.00 0.00 178.44 177.27 2wvd h ASN 80 N 0.35 0.35 -0.43 1.25 -0.00 -1.90 -1.21 115.58 113.99 2wvd h ASN 80 Ca 0.11 -0.18 0.01 0.00 -0.00 0.00 0.00 56.30 56.23 2wvd h ASN 80 Cb -0.01 -0.09 -0.02 0.00 -0.00 0.00 0.00 38.32 38.19 2wvd h ASN 80 CO -0.04 0.44 0.28 -0.61 -0.00 0.00 0.00 177.43 177.49 2wvd h GLN 81 N 0.24 0.55 -0.86 6.67 5.75 -1.92 -0.01 115.11 125.53 2wvd h GLN 81 Ca 0.08 -0.03 0.12 0.00 -0.15 0.00 0.00 58.65 58.67 2wvd h GLN 81 Cb 0.20 -0.12 -0.08 0.00 1.07 0.00 0.00 27.48 28.55 2wvd h GLN 81 CO -0.00 0.36 0.48 -0.09 -2.65 0.00 0.00 178.83 176.92 2wvd h ARG 82 N 0.56 0.72 -0.25 1.69 9.65 -0.40 0.21 114.38 126.56 2wvd h ARG 82 Ca 0.16 -0.04 -0.12 0.00 -1.10 0.00 0.00 59.98 58.88 2wvd h ARG 82 Cb -0.05 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.36 2wvd h ARG 82 CO -0.05 0.48 -0.34 0.52 2.80 0.00 0.00 179.97 183.38 2wvd h MET 83 N 0.75 0.54 -0.22 0.20 2.86 -0.27 -1.70 114.93 117.08 2wvd h MET 83 Ca 0.44 -0.24 -0.17 0.00 -2.06 0.00 0.00 59.70 57.66 2wvd h MET 83 Cb 0.50 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.15 2wvd h MET 83 CO -0.30 0.81 -0.54 0.82 1.06 0.00 0.00 176.91 178.76 2wvd h ILE 84 N 0.46 1.30 -0.35 -1.22 2.04 -0.15 -2.05 117.51 117.53 2wvd h ILE 84 Ca 0.05 -1.75 0.08 0.00 1.00 0.00 0.00 64.86 64.24 2wvd h ILE 84 Cb 0.81 1.81 -0.08 0.00 -0.74 0.00 0.00 36.82 38.62 2wvd h ILE 84 CO 0.07 0.56 -0.19 0.44 0.00 0.00 0.00 178.15 179.02 2wvd h ASP 85 N 0.49 -0.64 -0.41 1.72 3.32 -0.49 -1.01 116.42 119.40 2wvd h ASP 85 Ca -0.00 0.14 0.02 0.00 0.02 0.00 0.00 57.03 57.20 2wvd h ASP 85 Cb 1.16 0.34 -0.03 0.00 0.22 0.00 0.00 39.33 41.02 2wvd h ASP 85 CO 0.12 -0.22 0.24 0.40 -1.72 0.00 0.00 179.24 178.06 2wvd h ILE 86 N -0.14 1.05 -0.52 0.35 2.04 -1.22 -2.42 117.51 116.66 2wvd h ILE 86 Ca 0.18 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 65.83 2wvd h ILE 86 Cb 0.41 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 2wvd h ILE 86 CO -0.44 0.09 0.15 -0.61 0.00 0.00 0.00 178.15 177.34 2wvd h GLN 87 N 0.49 0.78 0.00 2.37 -0.00 -1.07 -2.42 115.11 115.27 2wvd h GLN 87 Ca 0.16 -0.14 -0.03 0.00 -0.00 0.00 0.00 58.65 58.63 2wvd h GLN 87 Cb -0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 27.48 27.35 2wvd h GLN 87 CO -0.07 0.69 -0.17 0.45 0.00 0.00 0.00 178.83 179.73 2wvd h HIS 88 N 0.76 0.00 -0.02 3.99 3.86 -0.71 -2.70 115.15 120.33 2wvd h HIS 88 Ca 0.17 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.38 2wvd h HIS 88 Cb 0.24 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.71 2wvd h HIS 88 CO 0.01 0.17 -0.43 0.00 0.86 0.00 0.00 177.93 178.54 2wvd n ALA 89 N -2.22 3.45 0.02 2.45 0.00 -1.01 -4.44 120.51 118.77 2wvd n ALA 89 Ca -0.00 -0.62 -0.12 0.00 0.00 0.00 0.00 53.44 52.70 2wvd n ALA 89 Cb 0.36 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 18.98 2wvd n ALA 89 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2wvd h SER 90 N 2.42 0.63 0.00 0.00 4.64 -1.09 -3.47 113.55 116.67 2wvd h SER 90 Ca 0.00 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2wvd h SER 90 Cb 0.74 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 2wvd h SER 90 CO 0.00 1.16 0.00 0.61 -0.87 0.00 0.00 176.83 177.73 2wvd n GLY 91 N 0.56 0.61 3.93 -0.77 0.00 -1.26 -4.79 105.19 103.47 2wvd n GLY 91 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 2wvd n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wvd s THR 92 N -2.39 3.47 -0.06 2.61 -4.23 -1.26 -4.88 115.64 108.91 2wvd s THR 92 Ca 0.00 -0.16 0.05 0.00 -1.18 0.00 0.00 61.69 60.40 2wvd s THR 92 Cb 0.00 -3.37 -0.02 0.00 1.34 0.00 0.00 72.50 70.45 2wvd s THR 92 CO 0.00 -0.35 -0.20 -1.00 -0.54 0.00 0.00 174.62 172.53 2wvd s HIS 93 N -2.93 2.56 -0.19 3.99 0.09 0.87 -4.94 115.29 114.74 2wvd s HIS 93 Ca 0.54 -0.46 -0.20 0.00 -0.00 0.00 0.00 55.06 54.93 2wvd s HIS 93 Cb -0.10 -1.62 -0.03 0.00 -0.00 0.00 0.00 32.58 30.83 2wvd s HIS 93 CO 0.43 -0.04 0.60 0.08 -0.00 0.00 0.00 174.74 175.81 2wvd s VAL 94 N -0.38 5.04 -0.12 -0.90 1.01 -1.26 -0.69 120.40 123.10 2wvd s VAL 94 Ca 0.03 1.13 -0.11 0.00 0.00 0.00 0.00 61.98 63.03 2wvd s VAL 94 Cb -0.12 -3.92 -0.26 0.00 0.00 0.00 0.00 36.38 32.08 2wvd s VAL 94 CO 0.02 0.13 0.42 -0.07 0.00 0.00 0.00 175.10 175.60 2wvd h LEU 95 N 8.08 0.38 -7.06 3.92 3.38 -1.14 -3.49 115.31 119.38 2wvd h LEU 95 Ca -0.32 -0.88 -0.05 0.00 0.09 0.00 0.00 57.88 56.72 2wvd h LEU 95 Cb 1.15 -0.13 -0.16 0.00 0.09 0.00 0.00 40.66 41.61 2wvd h LEU 95 CO 0.76 1.76 0.15 -0.55 0.09 0.00 0.00 178.44 180.65 2wvd s SER 96 N -7.06 -0.57 -0.02 -0.43 0.15 -1.24 -5.01 113.70 99.53 2wvd s SER 96 Ca -0.22 0.35 -0.02 0.00 0.70 0.00 0.00 55.95 56.77 2wvd s SER 96 Cb 0.06 0.54 0.00 0.00 -1.71 0.00 0.00 66.02 64.91 2wvd s SER 96 CO 0.76 -0.74 0.05 -0.89 1.20 0.00 0.00 173.24 173.62 2wvd s THR 97 N -2.28 0.02 -0.05 6.45 2.01 -1.26 -1.36 115.64 119.17 2wvd s THR 97 Ca -0.06 -0.13 0.02 0.00 0.31 0.00 0.00 61.69 61.82 2wvd s THR 97 Cb -0.01 -0.12 0.02 0.00 0.01 0.00 0.00 72.50 72.40 2wvd s THR 97 CO 0.00 -0.07 -0.08 -0.89 -0.69 0.00 0.00 174.62 172.89 2wvd s THR 98 N -0.20 0.75 -0.17 -0.82 2.01 -0.74 -4.98 115.64 111.49 2wvd s THR 98 Ca -0.02 -0.27 -0.02 0.00 0.31 0.00 0.00 61.69 61.68 2wvd s THR 98 Cb -0.02 -0.72 -0.01 0.00 0.01 0.00 0.00 72.50 71.76 2wvd s THR 98 CO 0.00 0.26 -0.09 -1.00 -0.69 0.00 0.00 174.62 173.11 2wvd s HIS 99 N 0.69 2.90 -0.24 4.92 3.76 -1.26 -1.41 115.29 124.65 2wvd s HIS 99 Ca -0.11 -0.72 -0.02 0.00 -0.15 0.00 0.00 55.06 54.05 2wvd s HIS 99 Cb -0.14 -1.96 0.01 0.00 1.11 0.00 0.00 32.58 31.61 2wvd s HIS 99 CO 0.01 -0.32 -0.06 0.42 -0.85 0.00 0.00 174.74 173.95 2wvd s ILE 100 N 0.78 3.02 -0.56 0.60 -1.09 0.13 -4.98 121.20 119.10 2wvd s ILE 100 Ca -0.03 -0.84 -0.28 0.00 -2.23 0.00 0.00 60.65 57.26 2wvd s ILE 100 Cb -0.15 -2.47 0.03 0.00 -1.58 0.00 0.00 42.46 38.29 2wvd s ILE 100 CO 0.01 0.29 1.23 -1.00 -1.23 0.00 0.00 174.94 174.24 2wvd s HIS 101 N 1.38 2.58 -0.09 3.97 3.76 -1.26 -0.84 115.29 124.78 2wvd s HIS 101 Ca 0.02 0.47 -0.22 0.00 -0.15 0.00 0.00 55.06 55.18 2wvd s HIS 101 Cb -0.16 -4.48 -0.19 0.00 1.11 0.00 0.00 32.58 28.86 2wvd s HIS 101 CO -0.04 -1.62 0.76 0.52 -0.85 0.00 0.00 174.74 173.50 2wvd h MET 102 N 9.76 -0.06 0.00 1.40 0.00 -1.69 -3.49 114.93 120.85 2wvd h MET 102 Ca -0.25 0.00 -0.03 0.00 0.00 0.00 0.00 59.70 59.42 2wvd h MET 102 Cb 1.06 0.01 -0.01 0.00 0.00 0.00 0.00 31.60 32.67 2wvd h MET 102 CO 1.17 0.57 0.00 -0.40 0.00 0.00 0.00 176.91 178.26 2wvd n ASP 103 N -4.76 -0.30 -0.24 1.22 3.85 -1.02 -5.00 116.55 110.31 2wvd n ASP 103 Ca -0.08 -1.31 0.07 0.00 -0.71 0.00 0.00 54.79 52.77 2wvd n ASP 103 Cb 0.32 0.53 0.33 0.00 -1.35 0.00 0.00 41.12 40.95 2wvd n ASP 103 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 2wvd h GLU 104 N 0.00 0.79 -0.01 0.11 4.39 -2.02 -2.89 114.58 114.94 2wvd h GLU 104 Ca -0.05 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.60 2wvd h GLU 104 Cb 0.21 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 2wvd h GLU 104 CO 0.07 0.52 -0.52 0.72 -1.16 0.00 0.00 179.01 178.64 2wvd n HIS 105 N -4.50 0.00 -4.76 4.33 8.25 -1.26 -4.44 115.22 112.83 2wvd n HIS 105 Ca 0.13 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.29 2wvd n HIS 105 Cb 0.28 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.22 2wvd n HIS 105 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 2wvd s ASN 106 N -2.25 2.66 -0.03 0.41 0.01 -1.09 -3.57 114.94 111.07 2wvd s ASN 106 Ca 0.12 -0.48 0.05 0.00 -0.71 0.00 0.00 52.86 51.84 2wvd s ASN 106 Cb 0.14 -1.22 -0.01 0.00 0.41 0.00 0.00 41.25 40.58 2wvd s ASN 106 CO 0.54 0.08 -0.20 0.00 -1.51 0.00 0.00 177.10 176.01 2wvd s LEU 108 N -0.19 2.72 0.01 0.00 0.20 -0.02 -1.71 118.68 119.69 2wvd s LEU 108 Ca 0.01 -0.42 0.05 0.00 0.69 0.00 0.00 54.13 54.46 2wvd s LEU 108 Cb -0.10 -1.66 -0.02 0.00 -0.43 0.00 0.00 46.19 43.98 2wvd s LEU 108 CO 0.01 0.04 -0.16 -1.83 -0.29 0.00 0.00 176.35 174.12 2wvd s GLU 109 N 1.13 1.16 -0.16 1.98 -1.05 -0.34 0.22 118.70 121.65 2wvd s GLU 109 Ca 0.01 -0.65 -0.05 0.00 -0.15 0.00 0.00 54.97 54.13 2wvd s GLU 109 Cb -0.14 -1.16 -0.03 0.00 -0.44 0.00 0.00 34.13 32.35 2wvd s GLU 109 CO -0.02 0.31 0.01 0.95 0.95 0.00 0.00 175.26 177.46 2wvd s THR 110 N -0.55 4.36 -0.13 1.83 -4.23 -0.50 -1.21 115.64 115.21 2wvd s THR 110 Ca 0.05 -0.19 0.02 0.00 -1.18 0.00 0.00 61.69 60.39 2wvd s THR 110 Cb -0.07 -2.93 0.01 0.00 1.34 0.00 0.00 72.50 70.86 2wvd s THR 110 CO 0.00 0.50 -0.20 -0.63 -0.54 0.00 0.00 174.62 173.75 2wvd s ILE 111 N 0.15 1.89 -0.28 2.99 1.01 0.61 -1.79 121.20 125.78 2wvd s ILE 111 Ca 0.02 -0.88 -0.13 0.00 0.00 0.00 0.00 60.65 59.66 2wvd s ILE 111 Cb -0.13 -1.68 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 2wvd s ILE 111 CO 0.02 0.52 0.27 -0.63 0.00 0.00 0.00 174.94 175.11 2wvd s ILE 112 N 0.88 5.25 0.32 2.92 1.01 -0.46 0.17 121.20 131.29 2wvd s ILE 112 Ca -0.07 0.28 0.09 0.00 0.00 0.00 0.00 60.65 60.95 2wvd s ILE 112 Cb -0.15 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 2wvd s ILE 112 CO -0.02 0.18 0.09 -0.76 0.00 0.00 0.00 174.94 174.44 2wvd s LEU 113 N 1.88 3.22 -0.12 2.97 1.43 0.51 -0.52 118.68 128.04 2wvd s LEU 113 Ca 0.10 -0.76 -0.07 0.00 -1.03 0.00 0.00 54.13 52.37 2wvd s LEU 113 Cb -0.16 -1.69 0.05 0.00 0.03 0.00 0.00 46.19 44.42 2wvd s LEU 113 CO 0.11 -0.22 0.29 -1.58 0.23 0.00 0.00 176.35 175.18 2wvd s GLN 114 N -3.79 0.27 0.00 1.70 0.74 0.13 -2.69 119.66 116.02 2wvd s GLN 114 Ca 0.36 0.59 0.00 0.00 0.05 0.00 0.00 55.36 56.36 2wvd s GLN 114 Cb -0.03 -0.07 0.00 0.00 1.10 0.00 0.00 33.01 34.01 2wvd s GLN 114 CO 0.22 -0.15 0.00 0.41 -0.55 0.00 0.00 175.29 175.21 2wvd n GLY 115 N 4.14 -1.63 3.85 2.59 0.00 -0.93 -0.09 105.19 113.12 2wvd n GLY 115 Ca -0.24 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.39 2wvd n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wvd s ASN 116 N -2.40 4.75 0.30 1.61 2.20 -1.22 -3.14 114.94 117.04 2wvd s ASN 116 Ca 0.00 1.11 -0.02 0.00 -0.94 0.00 0.00 52.86 53.01 2wvd s ASN 116 Cb 0.00 -1.81 0.45 0.00 -2.00 0.00 0.00 41.25 37.89 2wvd s ASN 116 CO 0.00 -1.78 1.95 0.77 -2.94 0.00 0.00 177.10 175.10 2wvd h SER 117 N -0.96 0.96 0.48 3.54 4.64 -1.77 -2.42 113.55 118.01 2wvd h SER 117 Ca -0.46 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 60.81 2wvd h SER 117 Cb 1.28 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2wvd h SER 117 CO 0.62 0.68 -0.23 -0.26 -0.87 0.00 0.00 176.83 176.77 2wvd h PHE 118 N 1.12 -0.60 -0.41 4.77 0.04 -1.93 -0.94 116.94 119.00 2wvd h PHE 118 Ca 0.33 -0.01 0.07 0.00 2.80 0.00 0.00 57.97 61.15 2wvd h PHE 118 Cb -0.05 0.20 -0.06 0.00 2.20 0.00 0.00 35.95 38.24 2wvd h PHE 118 CO -0.00 -0.31 0.06 0.93 -0.60 0.00 0.00 178.31 178.38 2wvd h GLU 119 N -0.77 0.17 -0.48 1.51 5.08 -1.82 0.13 114.58 118.39 2wvd h GLU 119 Ca -0.07 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2wvd h GLU 119 Cb 0.55 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 2wvd h GLU 119 CO 0.11 0.11 0.29 0.82 -1.00 0.00 0.00 179.01 179.34 2wvd h ILE 120 N 0.18 1.15 0.00 3.13 2.04 -1.43 -0.33 117.51 122.24 2wvd h ILE 120 Ca 0.20 -0.34 -0.10 0.00 1.00 0.00 0.00 64.86 65.62 2wvd h ILE 120 Cb 0.25 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 2wvd h ILE 120 CO -0.28 0.15 -0.49 1.56 0.00 0.00 0.00 178.15 179.09 2wvd h GLN 121 N 0.64 0.00 0.01 2.37 4.20 -0.53 -2.06 115.11 119.74 2wvd h GLN 121 Ca 0.17 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.63 2wvd h GLN 121 Cb -0.01 0.00 0.02 0.00 0.30 0.00 0.00 27.48 27.79 2wvd h GLN 121 CO -0.03 0.49 -1.02 0.00 -0.67 0.00 0.00 178.83 177.59 2wvd h ARG 122 N 0.00 0.61 -0.07 1.46 3.08 -0.51 -2.73 114.38 116.22 2wvd h ARG 122 Ca -0.00 -0.66 0.02 0.00 0.07 0.00 0.00 59.98 59.41 2wvd h ARG 122 Cb 0.87 0.19 -0.02 0.00 0.08 0.00 0.00 29.97 31.08 2wvd h ARG 122 CO 0.06 1.26 -0.07 1.25 -1.07 0.00 0.00 179.97 181.40 2wvd h LEU 123 N 0.34 -0.22 -1.33 3.04 5.85 -0.92 -0.80 115.31 121.27 2wvd h LEU 123 Ca -0.12 0.04 0.10 0.00 0.84 0.00 0.00 57.88 58.75 2wvd h LEU 123 Cb 1.67 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.75 2wvd h LEU 123 CO 0.19 -0.10 0.53 -0.61 -0.34 0.00 0.00 178.44 178.12 2wvd h GLN 124 N -0.09 0.71 -0.09 1.25 4.15 -1.42 -1.89 115.11 117.73 2wvd h GLN 124 Ca 0.05 -0.04 -0.11 0.00 0.77 0.00 0.00 58.65 59.32 2wvd h GLN 124 Cb 0.17 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.70 2wvd h GLN 124 CO -0.12 0.47 -0.36 1.25 -1.93 0.00 0.00 178.83 178.13 2wvd h LEU 125 N 0.74 0.47 -0.93 -2.39 5.85 -1.08 -1.76 115.31 116.20 2wvd h LEU 125 Ca 0.38 -0.64 -0.05 0.00 0.84 0.00 0.00 57.88 58.41 2wvd h LEU 125 Cb 0.49 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 2wvd h LEU 125 CO -0.15 1.03 0.18 -0.33 -0.34 0.00 0.00 178.44 178.82 2wvd h GLU 126 N -0.06 0.96 -0.04 1.25 5.08 -0.93 -2.57 114.58 118.28 2wvd h GLU 126 Ca -0.02 -0.20 -0.19 0.00 -1.00 0.00 0.00 59.36 57.95 2wvd h GLU 126 Cb 1.01 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 2wvd h GLU 126 CO 0.08 0.84 -0.80 0.82 -1.00 0.00 0.00 179.01 178.94 2wvd h ILE 127 N 0.92 1.42 -0.14 3.13 2.04 -1.38 -3.17 117.51 120.33 2wvd h ILE 127 Ca 0.20 -2.33 -0.08 0.00 1.00 0.00 0.00 64.86 63.66 2wvd h ILE 127 Cb 0.29 2.27 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 2wvd h ILE 127 CO -0.00 0.69 -0.25 1.23 0.00 0.00 0.00 178.15 179.81 2wvd h GLY 128 N 1.47 0.28 2.00 5.37 0.00 -1.14 -2.92 103.07 108.13 2wvd h GLY 128 Ca -0.04 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2wvd h GLY 128 CO 0.13 0.19 0.00 0.61 0.00 0.00 0.00 176.54 177.48 2wvd n GLY 129 N -0.55 -1.47 3.77 4.60 0.00 -0.98 -4.88 105.19 105.68 2wvd n GLY 129 Ca -0.01 -0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 2wvd n GLY 129 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wvd s LEU 130 N -3.19 4.36 -0.13 0.99 1.43 -1.10 -4.95 118.68 116.08 2wvd s LEU 130 Ca 0.13 2.90 -0.29 0.00 -1.03 0.00 0.00 54.13 55.84 2wvd s LEU 130 Cb 0.17 -3.66 -0.02 0.00 0.03 0.00 0.00 46.19 42.71 2wvd s LEU 130 CO 0.51 -0.76 1.33 -0.60 0.23 0.00 0.00 176.35 177.06 2wvd s ARG 131 N -1.69 4.23 0.00 1.70 3.00 -1.26 -2.31 118.95 122.62 2wvd s ARG 131 Ca 0.53 1.77 0.00 0.00 -1.00 0.00 0.00 55.73 57.03 2wvd s ARG 131 Cb -0.44 -3.78 0.00 0.00 0.00 0.00 0.00 34.95 30.73 2wvd s ARG 131 CO 0.57 -0.71 0.00 0.41 0.00 0.00 0.00 175.30 175.57 2wvd n GLY 132 N 3.69 2.90 3.53 8.12 0.00 -1.26 -5.02 105.19 117.16 2wvd n GLY 132 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 2wvd n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wvd s VAL 133 N -2.58 4.25 -0.31 1.61 1.01 -0.98 -2.42 120.40 120.97 2wvd s VAL 133 Ca 0.00 0.41 0.20 0.00 0.00 0.00 0.00 61.98 62.58 2wvd s VAL 133 Cb 0.00 -4.62 0.20 0.00 0.00 0.00 0.00 36.38 31.96 2wvd s VAL 133 CO 0.00 -1.24 1.48 0.11 0.00 0.00 0.00 175.10 175.46 2wvd h LYS 134 N 9.43 0.00 -1.94 2.72 1.57 -1.51 -3.45 116.57 123.39 2wvd h LYS 134 Ca -0.26 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.53 2wvd h LYS 134 Cb 1.07 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 33.16 2wvd h LYS 134 CO 1.13 0.20 0.12 0.12 -0.57 0.00 0.00 179.45 180.45 2wvd s PHE 135 N -3.12 -0.89 -0.28 -1.35 5.36 -1.07 -4.99 117.98 111.65 2wvd s PHE 135 Ca 0.05 1.92 0.00 0.00 -0.96 0.00 0.00 56.93 57.95 2wvd s PHE 135 Cb 0.06 0.46 0.16 0.00 -0.34 0.00 0.00 43.02 43.36 2wvd s PHE 135 CO 0.71 -0.44 0.46 0.00 -1.46 0.00 0.00 175.22 174.49 2wvd s ALA 136 N 1.05 -1.51 -0.05 11.12 0.00 -1.26 -1.12 121.76 129.99 2wvd s ALA 136 Ca -0.05 0.86 0.02 0.00 0.00 0.00 0.00 51.96 52.79 2wvd s ALA 136 Cb -0.05 -2.02 0.01 0.00 0.00 0.00 0.00 23.12 21.07 2wvd s ALA 136 CO -0.11 -1.52 -0.10 0.21 0.00 0.00 0.00 175.76 174.24 2wvd s LYS 137 N 2.64 1.36 -0.11 0.00 2.47 -0.19 -4.96 119.74 120.94 2wvd s LYS 137 Ca 0.13 -0.32 -0.01 0.00 -1.56 0.00 0.00 55.97 54.21 2wvd s LYS 137 Cb -0.14 -1.18 -0.02 0.00 -1.46 0.00 0.00 37.83 35.03 2wvd s LYS 137 CO -0.23 0.02 -0.08 -1.17 0.16 0.00 0.00 175.35 174.05 2wvd s LEU 138 N 0.63 3.05 -0.16 5.43 2.96 -1.26 -0.57 118.68 128.76 2wvd s LEU 138 Ca -0.12 -0.15 -0.03 0.00 -0.22 0.00 0.00 54.13 53.61 2wvd s LEU 138 Cb -0.14 -1.69 -0.02 0.00 0.50 0.00 0.00 46.19 44.83 2wvd s LEU 138 CO 0.02 0.25 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.36 2wvd s THR 139 N -0.11 3.68 -0.29 3.68 2.01 0.21 -4.99 115.64 119.83 2wvd s THR 139 Ca 0.01 -0.43 -0.19 0.00 0.31 0.00 0.00 61.69 61.39 2wvd s THR 139 Cb -0.13 -2.61 -0.01 0.00 0.01 0.00 0.00 72.50 69.75 2wvd s THR 139 CO 0.03 0.48 0.58 -0.54 -0.69 0.00 0.00 174.62 174.49 2wvd s LYS 140 N 0.55 3.93 -0.26 4.92 1.02 -1.26 -0.71 119.74 127.93 2wvd s LYS 140 Ca -0.04 0.27 -0.09 0.00 0.02 0.00 0.00 55.97 56.13 2wvd s LYS 140 Cb -0.15 -3.71 -0.04 0.00 -0.52 0.00 0.00 37.83 33.41 2wvd s LYS 140 CO 0.03 -0.50 0.14 0.00 -0.92 0.00 0.00 175.35 174.09 2wvd s ALA 141 N 2.49 3.38 0.13 5.17 0.00 -0.40 -4.89 121.76 127.63 2wvd s ALA 141 Ca 0.23 -1.09 0.11 0.00 0.00 0.00 0.00 51.96 51.21 2wvd s ALA 141 Cb -0.15 -2.29 -0.04 0.00 0.00 0.00 0.00 23.12 20.64 2wvd s ALA 141 CO 0.11 -0.49 -0.26 -1.54 0.00 0.00 0.00 175.76 173.58 2wvd s SER 142 N 1.63 3.36 0.04 0.00 1.04 -1.26 -3.66 113.70 114.85 2wvd s SER 142 Ca 0.07 -0.74 -0.26 0.00 0.48 0.00 0.00 55.95 55.50 2wvd s SER 142 Cb -0.15 -0.24 -0.05 0.00 0.10 0.00 0.00 66.02 65.67 2wvd s SER 142 CO 0.07 0.18 0.80 -0.55 0.98 0.00 0.00 173.24 174.72 2wvd s SER 143 N -2.06 7.24 0.11 7.02 0.15 -1.26 -5.06 113.70 119.84 2wvd s SER 143 Ca 0.14 1.49 0.04 0.00 0.70 0.00 0.00 55.95 58.32 2wvd s SER 143 Cb -0.10 -2.49 -0.04 0.00 -1.71 0.00 0.00 66.02 61.68 2wvd s SER 143 CO 0.06 -0.02 0.10 -0.36 1.20 0.00 0.00 173.24 174.22 2wvd s PHE 144 N 0.05 3.17 -2.34 3.44 0.08 -1.26 -5.19 117.98 115.93 2wvd s PHE 144 Ca 0.40 0.04 0.19 0.00 0.12 0.00 0.00 56.93 57.68 2wvd s PHE 144 Cb -0.21 -1.58 0.15 0.00 -0.57 0.00 0.00 43.02 40.81 2wvd s PHE 144 CO 0.24 0.52 1.09 -0.85 -0.10 0.00 0.00 175.22 176.12