#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d42 s ILE 3 N 0.00 3.93 -0.12 0.00 -1.09 -1.26 -0.87 121.20 121.78 2d42 s ILE 3 Ca 0.00 -0.31 -0.29 0.00 -2.23 0.00 0.00 60.65 57.82 2d42 s ILE 3 Cb 0.00 -2.80 -0.03 0.00 -1.58 0.00 0.00 42.46 38.05 2d42 s ILE 3 CO 0.00 0.40 1.34 -0.63 -1.23 0.00 0.00 174.94 174.82 2d42 s ILE 4 N 1.34 4.10 -0.43 2.92 -1.09 0.37 -4.88 121.20 123.53 2d42 s ILE 4 Ca 0.04 1.35 -0.20 0.00 -2.23 0.00 0.00 60.65 59.62 2d42 s ILE 4 Cb -0.15 -3.87 0.02 0.00 -1.58 0.00 0.00 42.46 36.88 2d42 s ILE 4 CO 0.01 -0.10 0.60 0.21 -1.23 0.00 0.00 174.94 174.43 2d42 s ASN 5 N 2.19 6.29 0.40 3.58 2.47 -1.26 -1.15 114.94 127.46 2d42 s ASN 5 Ca 0.59 -0.42 0.06 0.00 0.42 0.00 0.00 52.86 53.51 2d42 s ASN 5 Cb -0.25 -2.30 0.81 0.00 -1.45 0.00 0.00 41.25 38.07 2d42 s ASN 5 CO 0.19 -0.74 2.04 -0.07 -3.72 0.00 0.00 177.10 174.81 2d42 h LEU 6 N 9.55 0.53 -0.75 3.21 3.38 -1.39 -1.72 115.31 128.12 2d42 h LEU 6 Ca -0.26 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.58 2d42 h LEU 6 Cb 1.10 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 2d42 h LEU 6 CO 0.87 0.38 -0.40 -0.07 0.09 0.00 0.00 178.44 179.31 2d42 h LEU 7 N 0.62 0.50 -0.52 1.67 3.38 -1.87 -1.71 115.31 117.38 2d42 h LEU 7 Ca 0.18 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 2d42 h LEU 7 Cb -0.04 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2d42 h LEU 7 CO -0.04 0.85 0.07 -0.09 0.09 0.00 0.00 178.44 179.32 2d42 h ARG 8 N 0.40 0.88 -0.79 1.13 9.65 -1.74 -1.08 114.38 122.82 2d42 h ARG 8 Ca 0.04 -0.24 -0.03 0.00 -1.10 0.00 0.00 59.98 58.64 2d42 h ARG 8 Cb 0.88 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 29.32 2d42 h ARG 8 CO 0.07 0.87 0.39 0.93 2.80 0.00 0.00 179.97 185.03 2d42 h GLU 9 N 0.76 1.13 -0.42 0.20 4.39 -1.11 0.11 114.58 119.65 2d42 h GLU 9 Ca 0.16 -0.16 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 2d42 h GLU 9 Cb 0.43 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 2d42 h GLU 9 CO 0.01 0.86 0.20 1.25 -1.16 0.00 0.00 179.01 180.17 2d42 h LEU 10 N 1.12 0.55 -0.44 1.33 5.85 -0.92 0.33 115.31 123.14 2d42 h LEU 10 Ca 0.27 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 2d42 h LEU 10 Cb 0.10 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 2d42 h LEU 10 CO -0.04 0.53 0.26 -0.08 -0.34 0.00 0.00 178.44 178.77 2d42 h GLU 11 N 0.53 0.60 -0.48 1.25 4.81 -0.69 -0.09 114.58 120.51 2d42 h GLU 11 Ca 0.14 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2d42 h GLU 11 Cb 0.13 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2d42 h GLU 11 CO -0.02 0.46 0.31 0.82 -0.73 0.00 0.00 179.01 179.85 2d42 h ILE 12 N 0.58 1.14 -0.45 2.32 2.04 -0.64 0.24 117.51 122.73 2d42 h ILE 12 Ca 0.16 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2d42 h ILE 12 Cb 0.02 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 2d42 h ILE 12 CO -0.03 0.14 0.29 0.22 0.00 0.00 0.00 178.15 178.77 2d42 h TYR 13 N 0.65 0.58 -0.64 1.37 3.20 -0.61 -2.25 116.97 119.27 2d42 h TYR 13 Ca 0.18 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.98 2d42 h TYR 13 Cb -0.04 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.01 2d42 h TYR 13 CO -0.03 0.38 0.12 0.78 -1.64 0.00 0.00 178.16 177.76 2d42 h GLY 14 N 0.61 1.12 1.21 1.82 0.00 -0.57 -0.71 103.07 106.54 2d42 h GLY 14 Ca 0.16 -0.72 -0.08 0.00 0.00 0.00 0.00 47.33 46.69 2d42 h GLY 14 CO -0.03 0.67 0.02 -0.33 0.00 0.00 0.00 176.54 176.86 2d42 h MET 15 N 0.98 0.95 -0.08 4.80 2.86 -0.77 -0.56 114.93 123.11 2d42 h MET 15 Ca 0.20 -0.27 -0.22 0.00 -2.06 0.00 0.00 59.70 57.35 2d42 h MET 15 Cb 0.40 -0.10 0.01 0.00 0.06 0.00 0.00 31.60 31.97 2d42 h MET 15 CO 0.01 0.93 -0.84 -0.56 1.06 0.00 0.00 176.91 177.51 2d42 h GLN 16 N 0.88 0.60 -0.74 1.72 -0.00 -1.26 -2.71 115.11 113.60 2d42 h GLN 16 Ca 0.17 -0.54 -0.03 0.00 -0.00 0.00 0.00 58.65 58.24 2d42 h GLN 16 Cb 0.49 0.13 -0.03 0.00 -0.00 0.00 0.00 27.48 28.07 2d42 h GLN 16 CO 0.02 1.16 0.32 -0.92 -0.00 0.00 0.00 178.83 179.42 2d42 h TYR 17 N 0.39 1.09 0.35 0.06 3.20 -0.96 -0.70 116.97 120.40 2d42 h TYR 17 Ca -0.06 -0.07 -0.02 0.00 3.14 0.00 0.00 58.73 61.72 2d42 h TYR 17 Cb 1.46 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 39.40 2d42 h TYR 17 CO 0.07 0.82 -0.17 0.00 -1.64 0.00 0.00 178.16 177.24 2d42 h ALA 18 N 1.16 -0.47 -1.00 1.82 0.00 -1.07 0.46 119.26 120.16 2d42 h ALA 18 Ca 0.25 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.09 2d42 h ALA 18 Cb 0.17 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 2d42 h ALA 18 CO -0.03 -0.75 0.65 -0.97 0.00 0.00 0.00 179.25 178.16 2d42 h ASN 19 N -0.50 1.09 0.18 0.00 -1.24 -1.38 0.17 115.58 113.90 2d42 h ASN 19 Ca -0.05 -0.01 -0.07 0.00 0.71 0.00 0.00 56.30 56.89 2d42 h ASN 19 Cb 0.38 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 39.17 2d42 h ASN 19 CO 0.08 0.74 -0.26 -1.28 -1.29 0.00 0.00 177.43 175.42 2d42 h SER 20 N 1.26 0.14 -0.43 1.15 0.87 -0.73 -3.05 113.55 112.76 2d42 h SER 20 Ca 0.40 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.92 2d42 h SER 20 Cb 0.02 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2d42 h SER 20 CO -0.13 0.41 0.00 1.41 -0.53 0.00 0.00 176.83 177.99 2d42 n HIS 21 N -4.18 0.77 -2.41 2.24 8.25 0.12 -4.97 115.22 115.04 2d42 n HIS 21 Ca -0.01 -0.59 -0.19 0.00 -0.26 0.00 0.00 57.72 56.67 2d42 n HIS 21 Cb 0.35 -0.11 -0.00 0.00 1.12 0.00 0.00 29.99 31.34 2d42 n HIS 21 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2d42 n GLN 22 N 0.56 -1.77 -3.43 -0.41 1.13 -0.10 -5.01 117.38 108.36 2d42 n GLN 22 Ca 0.17 0.89 -0.20 0.00 -1.94 0.00 0.00 57.00 55.92 2d42 n GLN 22 Cb 0.61 -5.42 -0.02 0.00 0.11 0.00 0.00 30.24 25.52 2d42 n GLN 22 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 2d42 s TYR 23 N -2.94 2.62 -0.21 1.08 2.02 0.40 -4.94 117.35 115.38 2d42 s TYR 23 Ca 0.03 -0.50 -0.06 0.00 -0.37 0.00 0.00 57.07 56.17 2d42 s TYR 23 Cb -0.01 -2.21 -0.03 0.00 -0.40 0.00 0.00 41.96 39.31 2d42 s TYR 23 CO 0.03 -0.25 0.03 0.99 -1.57 0.00 0.00 175.55 174.78 2d42 s THR 24 N -2.47 4.16 -0.01 -0.71 2.01 -0.65 -4.22 115.64 113.75 2d42 s THR 24 Ca 0.50 -0.24 -0.30 0.00 0.31 0.00 0.00 61.69 61.96 2d42 s THR 24 Cb -0.05 -2.90 -0.06 0.00 0.01 0.00 0.00 72.50 69.50 2d42 s THR 24 CO 0.29 0.41 1.56 -0.47 -0.69 0.00 0.00 174.62 175.71 2d42 s TYR 25 N 1.10 2.41 -0.11 4.92 5.04 -1.26 -2.21 117.35 127.24 2d42 s TYR 25 Ca 0.03 0.46 -0.09 0.00 -2.44 0.00 0.00 57.07 55.03 2d42 s TYR 25 Cb -0.14 -3.83 -0.03 0.00 0.35 0.00 0.00 41.96 38.31 2d42 s TYR 25 CO 0.02 -3.31 -0.17 0.41 -1.34 0.00 0.00 175.55 171.16 2d42 n GLY 26 N 3.92 -0.69 3.82 8.97 0.00 0.11 -4.97 105.19 116.34 2d42 n GLY 26 Ca 0.15 -0.16 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 2d42 n GLY 26 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d42 s SER 27 N -5.13 -0.07 -0.01 1.61 1.04 -1.03 -4.99 113.70 105.13 2d42 s SER 27 Ca -0.14 -0.58 -0.26 0.00 0.48 0.00 0.00 55.95 55.45 2d42 s SER 27 Cb 0.02 0.50 0.06 0.00 0.10 0.00 0.00 66.02 66.70 2d42 s SER 27 CO 0.21 -0.97 0.59 -0.94 0.98 0.00 0.00 173.24 173.11 2d42 s SER 28 N -3.19 -0.54 0.22 7.02 1.04 -1.26 0.21 113.70 117.20 2d42 s SER 28 Ca 0.17 0.46 -0.23 0.00 0.48 0.00 0.00 55.95 56.83 2d42 s SER 28 Cb -0.02 0.50 0.04 0.00 0.10 0.00 0.00 66.02 66.65 2d42 s SER 28 CO 0.04 -0.64 0.85 -0.72 0.98 0.00 0.00 173.24 173.75 2d42 s TYR 29 N -1.70 -0.14 0.40 5.02 -0.85 0.24 -4.96 117.35 115.34 2d42 s TYR 29 Ca -0.09 -0.25 -0.25 0.00 -0.52 0.00 0.00 57.07 55.96 2d42 s TYR 29 Cb -0.01 0.68 -0.09 0.00 0.38 0.00 0.00 41.96 42.93 2d42 s TYR 29 CO 0.05 -1.04 1.14 0.45 -1.52 0.00 0.00 175.55 174.62 2d42 s SER 30 N -2.95 6.60 -0.44 -0.18 0.15 -1.26 0.11 113.70 115.72 2d42 s SER 30 Ca 0.12 2.27 -0.28 0.00 0.70 0.00 0.00 55.95 58.76 2d42 s SER 30 Cb -0.04 -2.61 0.03 0.00 -1.71 0.00 0.00 66.02 61.69 2d42 s SER 30 CO 0.05 -0.62 1.07 -0.62 1.20 0.00 0.00 173.24 174.32 2d42 s ASP 31 N -1.23 6.65 0.56 5.45 2.15 -0.34 -4.71 116.67 125.20 2d42 s ASP 31 Ca 0.57 0.49 0.28 0.00 0.43 0.00 0.00 52.55 54.31 2d42 s ASP 31 Cb -0.29 -2.52 1.48 0.00 -0.30 0.00 0.00 42.92 41.30 2d42 s ASP 31 CO 0.36 -1.13 1.98 0.44 -0.17 0.00 0.00 175.17 176.65 2d42 h ASP 32 N 8.98 0.00 0.56 -0.34 5.19 -1.94 0.46 116.42 129.33 2d42 h ASP 32 Ca -0.23 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.18 2d42 h ASP 32 Cb 1.06 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.57 2d42 h ASP 32 CO 1.08 0.00 -0.25 0.41 -3.12 0.00 0.00 179.24 177.36 2d42 n THR 33 N -4.03 0.00 -2.72 0.35 -1.04 -1.26 -4.35 114.28 101.24 2d42 n THR 33 Ca 0.08 -0.03 -0.07 0.00 -2.04 0.00 0.00 64.05 62.00 2d42 n THR 33 Cb 0.59 -0.01 0.06 0.00 -1.82 0.00 0.00 70.33 69.16 2d42 n THR 33 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2d42 n ASN 34 N -1.27 -2.28 -4.71 8.00 4.05 -0.36 -5.10 115.26 113.59 2d42 n ASN 34 Ca 0.09 -2.76 -0.35 0.00 0.45 0.00 0.00 54.58 52.01 2d42 n ASN 34 Cb 0.32 1.44 0.10 0.00 1.23 0.00 0.00 39.78 42.87 2d42 n ASN 34 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 2d42 s PRO 35 N 0.46 2.06 0.11 1.20 0.04 0.15 -0.03 135.00 138.98 2d42 s PRO 35 Ca 0.29 1.88 -0.31 0.00 0.04 0.00 0.00 61.00 62.90 2d42 s PRO 35 Cb 0.23 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.86 2d42 s PRO 35 CO -0.18 -1.92 1.71 0.42 0.04 0.00 0.00 177.00 177.06 2d42 s ILE 36 N -1.83 2.76 0.10 0.56 1.01 -1.23 -4.12 121.20 118.45 2d42 s ILE 36 Ca 0.77 0.30 -0.01 0.00 0.00 0.00 0.00 60.65 61.72 2d42 s ILE 36 Cb -0.32 -3.20 -0.04 0.00 0.01 0.00 0.00 42.46 38.91 2d42 s ILE 36 CO 0.45 0.00 0.02 0.00 0.00 0.00 0.00 174.94 175.42 2d42 s ARG 37 N 2.42 0.82 -0.13 2.79 1.70 0.10 -4.93 118.95 121.72 2d42 s ARG 37 Ca 0.76 -1.36 0.02 0.00 -0.47 0.00 0.00 55.73 54.68 2d42 s ARG 37 Cb -0.43 0.21 0.00 0.00 -0.57 0.00 0.00 34.95 34.16 2d42 s ARG 37 CO 0.34 -0.20 -0.21 0.42 -1.08 0.00 0.00 175.30 174.57 2d42 s ILE 38 N -3.98 2.27 0.18 4.99 1.01 -1.26 -2.29 121.20 122.12 2d42 s ILE 38 Ca 0.18 -0.92 -0.04 0.00 0.00 0.00 0.00 60.65 59.86 2d42 s ILE 38 Cb 0.08 -1.91 -0.03 0.00 0.01 0.00 0.00 42.46 40.61 2d42 s ILE 38 CO -0.03 0.54 0.19 0.00 0.00 0.00 0.00 174.94 175.65 2d42 s ALA 39 N 0.61 0.62 -1.28 9.38 0.00 0.03 -4.92 121.76 126.18 2d42 s ALA 39 Ca -0.11 -1.34 -0.08 0.00 0.00 0.00 0.00 51.96 50.43 2d42 s ALA 39 Cb -0.16 1.08 0.01 0.00 0.00 0.00 0.00 23.12 24.04 2d42 s ALA 39 CO 0.03 -0.61 1.12 0.41 0.00 0.00 0.00 175.76 176.71 2d42 n GLY 40 N -0.22 -0.47 3.67 0.00 0.00 -1.26 0.65 105.19 107.55 2d42 n GLY 40 Ca -0.03 0.20 -0.47 0.00 0.00 0.00 0.00 46.02 45.73 2d42 n GLY 40 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2d42 n LEU 41 N -4.73 3.03 -3.89 0.99 4.32 -1.26 -4.20 117.00 111.25 2d42 n LEU 41 Ca -0.02 1.06 -0.11 0.00 -0.02 0.00 0.00 56.01 56.92 2d42 n LEU 41 Cb 0.57 -1.39 -0.12 0.00 -1.62 0.00 0.00 43.42 40.86 2d42 n LEU 41 CO 0.62 -0.31 -0.26 -0.62 -1.22 0.00 0.00 177.39 175.60 2d42 s ASP 42 N 1.54 0.04 -0.16 -1.43 -1.08 0.58 -4.98 116.67 111.18 2d42 s ASP 42 Ca 0.82 -0.13 -0.05 0.00 -0.52 0.00 0.00 52.55 52.68 2d42 s ASP 42 Cb -0.71 0.16 0.06 0.00 -1.46 0.00 0.00 42.92 40.97 2d42 s ASP 42 CO 0.42 -0.21 0.10 0.00 0.52 0.00 0.00 175.17 176.00 2d42 s ALA 43 N -0.81 0.33 0.28 3.66 0.00 -1.26 -0.17 121.76 123.79 2d42 s ALA 43 Ca -0.09 -0.20 0.10 0.00 0.00 0.00 0.00 51.96 51.77 2d42 s ALA 43 Cb -0.05 -1.02 -0.05 0.00 0.00 0.00 0.00 23.12 22.00 2d42 s ALA 43 CO 0.00 -1.11 -0.03 -0.98 0.00 0.00 0.00 175.76 173.64 2d42 s ARG 44 N 2.16 2.17 -0.37 0.00 1.70 -0.73 -4.72 118.95 119.17 2d42 s ARG 44 Ca 0.03 -1.51 -0.03 0.00 -0.47 0.00 0.00 55.73 53.75 2d42 s ARG 44 Cb -0.16 -2.07 0.09 0.00 -0.57 0.00 0.00 34.95 32.24 2d42 s ARG 44 CO -0.09 0.33 0.13 0.42 -1.08 0.00 0.00 175.30 175.01 2d42 s ILE 45 N -2.38 3.19 0.56 4.99 1.01 -1.26 -0.59 121.20 126.72 2d42 s ILE 45 Ca 0.32 -1.81 0.24 0.00 0.00 0.00 0.00 60.65 59.40 2d42 s ILE 45 Cb -0.06 -3.07 0.34 0.00 0.01 0.00 0.00 42.46 39.69 2d42 s ILE 45 CO 0.19 -0.48 2.12 1.55 0.00 0.00 0.00 174.94 178.32 2d42 h PRO 46 N 8.03 0.00 -3.24 2.79 0.13 -1.96 -3.29 132.00 134.46 2d42 h PRO 46 Ca -0.16 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.34 2d42 h PRO 46 Cb 1.05 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.77 2d42 h PRO 46 CO 0.64 0.00 -0.62 0.34 -0.23 0.00 0.00 178.00 178.12 2d42 s ASP 47 N -6.31 4.38 0.00 1.44 2.15 -1.26 -4.94 116.67 112.13 2d42 s ASP 47 Ca -0.05 -3.27 0.21 0.00 0.43 0.00 0.00 52.55 49.87 2d42 s ASP 47 Cb 0.17 -1.57 1.26 0.00 -0.30 0.00 0.00 42.92 42.47 2d42 s ASP 47 CO 0.62 -0.18 1.77 -0.81 -0.17 0.00 0.00 175.17 176.40 2d42 n PRO 48 N 2.75 0.94 -3.00 4.34 -0.04 -1.24 -4.72 135.00 134.03 2d42 n PRO 48 Ca 0.11 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.13 2d42 n PRO 48 Cb 0.33 -1.35 -0.05 0.00 -0.04 0.00 0.00 33.50 32.39 2d42 n PRO 48 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2d42 s ILE 49 N -2.00 4.63 -0.09 0.52 -1.09 -1.26 -0.98 121.20 120.93 2d42 s ILE 49 Ca 0.32 -0.14 -0.24 0.00 -2.23 0.00 0.00 60.65 58.36 2d42 s ILE 49 Cb 0.14 -4.42 -0.03 0.00 -1.58 0.00 0.00 42.46 36.57 2d42 s ILE 49 CO 0.24 -0.97 0.73 -0.69 -1.23 0.00 0.00 174.94 173.02 2d42 s VAL 50 N 3.28 5.01 -1.75 2.92 1.01 0.11 -4.94 120.40 126.03 2d42 s VAL 50 Ca 0.22 1.49 0.17 0.00 0.00 0.00 0.00 61.98 63.86 2d42 s VAL 50 Cb -0.16 -4.06 0.04 0.00 0.00 0.00 0.00 36.38 32.20 2d42 s VAL 50 CO 0.15 0.19 0.94 0.35 0.00 0.00 0.00 175.10 176.73 2d42 n THR 51 N 4.03 0.00 -1.78 3.92 -2.24 -1.26 -1.52 114.28 115.44 2d42 n THR 51 Ca 0.00 -0.38 -0.37 0.00 -2.27 0.00 0.00 64.05 61.03 2d42 n THR 51 Cb 0.51 1.25 0.06 0.00 -2.10 0.00 0.00 70.33 70.05 2d42 n THR 51 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2d42 s ASP 52 N -1.80 4.71 0.69 3.42 -0.00 -1.26 -4.73 116.67 117.70 2d42 s ASP 52 Ca 0.16 2.61 -0.12 0.00 -0.00 0.00 0.00 52.55 55.21 2d42 s ASP 52 Cb 0.14 -2.62 0.01 0.00 -0.00 0.00 0.00 42.92 40.45 2d42 s ASP 52 CO 0.36 -1.93 1.07 -2.16 -0.00 0.00 0.00 175.17 172.50 2d42 s PRO 53 N -3.34 2.88 0.25 8.23 0.04 -1.26 -4.65 135.00 137.14 2d42 s PRO 53 Ca 0.81 1.05 0.07 0.00 0.04 0.00 0.00 61.00 62.97 2d42 s PRO 53 Cb -0.37 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.16 2d42 s PRO 53 CO 0.39 -1.15 0.21 0.14 0.04 0.00 0.00 177.00 176.64 2d42 s VAL 54 N -2.90 4.56 -0.02 -0.36 -7.23 -1.26 -4.37 120.40 108.81 2d42 s VAL 54 Ca 0.60 -1.33 0.04 0.00 -1.81 0.00 0.00 61.98 59.47 2d42 s VAL 54 Cb -0.15 -3.46 -0.03 0.00 0.56 0.00 0.00 36.38 33.30 2d42 s VAL 54 CO 0.52 -0.34 -0.12 0.20 -0.31 0.00 0.00 175.10 175.05 2d42 s ASN 55 N -3.82 4.21 -0.44 4.85 0.01 -0.38 -4.95 114.94 114.42 2d42 s ASN 55 Ca 0.33 -0.20 -0.14 0.00 -0.71 0.00 0.00 52.86 52.14 2d42 s ASN 55 Cb -0.08 -0.90 0.05 0.00 0.41 0.00 0.00 41.25 40.73 2d42 s ASN 55 CO 0.25 0.32 0.34 -1.00 -1.51 0.00 0.00 177.10 175.50 2d42 s HIS 56 N -0.84 3.25 -0.23 2.20 3.76 -1.26 -0.76 115.29 121.41 2d42 s HIS 56 Ca 0.13 -0.89 -0.12 0.00 -0.15 0.00 0.00 55.06 54.04 2d42 s HIS 56 Cb -0.11 -2.93 -0.05 0.00 1.11 0.00 0.00 32.58 30.61 2d42 s HIS 56 CO 0.03 -0.73 0.21 0.42 -0.85 0.00 0.00 174.74 173.82 2d42 s ILE 57 N 1.62 5.33 -0.58 0.60 1.01 0.74 -4.91 121.20 125.01 2d42 s ILE 57 Ca 0.04 0.30 -0.28 0.00 0.00 0.00 0.00 60.65 60.71 2d42 s ILE 57 Cb -0.22 -3.55 0.03 0.00 0.01 0.00 0.00 42.46 38.73 2d42 s ILE 57 CO 0.07 0.33 1.16 -0.69 0.00 0.00 0.00 174.94 175.81 2d42 s VAL 58 N 1.10 4.06 0.12 2.92 1.01 -1.26 0.64 120.40 128.99 2d42 s VAL 58 Ca 0.10 0.78 -0.00 0.00 0.00 0.00 0.00 61.98 62.86 2d42 s VAL 58 Cb -0.14 -4.71 -0.21 0.00 0.00 0.00 0.00 36.38 31.32 2d42 s VAL 58 CO 0.05 -1.34 1.27 -0.07 0.00 0.00 0.00 175.10 175.02 2d42 h LEU 59 N 11.84 0.31 -7.37 3.92 3.38 -0.57 -3.49 115.31 123.34 2d42 h LEU 59 Ca -0.25 -0.29 0.09 0.00 0.09 0.00 0.00 57.88 57.52 2d42 h LEU 59 Cb 1.06 -0.10 -0.11 0.00 0.09 0.00 0.00 40.66 41.61 2d42 h LEU 59 CO 1.18 1.15 0.38 -0.62 0.09 0.00 0.00 178.44 180.62 2d42 s ASP 60 N -6.99 -0.34 -0.19 -0.43 -1.08 -1.06 -5.00 116.67 101.58 2d42 s ASP 60 Ca -0.03 -0.22 -0.09 0.00 -0.52 0.00 0.00 52.55 51.69 2d42 s ASP 60 Cb 0.09 0.52 0.08 0.00 -1.46 0.00 0.00 42.92 42.15 2d42 s ASP 60 CO 0.85 -0.91 0.44 -0.60 0.52 0.00 0.00 175.17 175.47 2d42 s ARG 61 N -3.45 0.39 0.15 4.34 3.52 -1.26 -0.46 118.95 122.18 2d42 s ARG 61 Ca 0.07 0.94 0.04 0.00 -0.13 0.00 0.00 55.73 56.65 2d42 s ARG 61 Cb -0.02 0.16 -0.04 0.00 -1.56 0.00 0.00 34.95 33.48 2d42 s ARG 61 CO -0.04 -0.20 -0.07 1.03 -0.81 0.00 0.00 175.30 175.21 2d42 s ARG 62 N 1.96 1.05 -0.03 5.12 1.81 0.01 -4.99 118.95 123.87 2d42 s ARG 62 Ca -0.06 -1.46 0.03 0.00 -1.72 0.00 0.00 55.73 52.52 2d42 s ARG 62 Cb -0.10 -0.50 0.00 0.00 -0.45 0.00 0.00 34.95 33.91 2d42 s ARG 62 CO -0.13 0.01 -0.13 0.42 -0.68 0.00 0.00 175.30 174.79 2d42 s ILE 63 N -3.43 1.06 -0.22 1.52 1.01 -1.26 -0.84 121.20 119.04 2d42 s ILE 63 Ca 0.18 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.33 2d42 s ILE 63 Cb 0.04 -0.93 0.05 0.00 0.01 0.00 0.00 42.46 41.62 2d42 s ILE 63 CO 0.01 0.32 -0.13 -0.63 0.00 0.00 0.00 174.94 174.51 2d42 s ILE 64 N 0.14 1.97 -0.17 2.92 1.01 -0.25 -4.99 121.20 121.83 2d42 s ILE 64 Ca -0.04 -1.27 -0.06 0.00 0.00 0.00 0.00 60.65 59.28 2d42 s ILE 64 Cb -0.10 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 2d42 s ILE 64 CO 0.01 0.16 0.03 -0.89 0.00 0.00 0.00 174.94 174.26 2d42 s THR 65 N 1.24 4.53 -0.43 2.92 2.01 -1.26 -0.56 115.64 124.09 2d42 s THR 65 Ca -0.03 -0.13 -0.08 0.00 0.31 0.00 0.00 61.69 61.76 2d42 s THR 65 Cb -0.17 -3.02 0.10 0.00 0.01 0.00 0.00 72.50 69.42 2d42 s THR 65 CO -0.08 0.48 0.27 0.21 -0.69 0.00 0.00 174.62 174.81 2d42 s ASN 66 N 0.28 5.57 -0.17 3.53 2.47 0.01 -4.92 114.94 121.71 2d42 s ASN 66 Ca 0.02 -1.73 0.11 0.00 0.42 0.00 0.00 52.86 51.68 2d42 s ASN 66 Cb -0.13 -1.96 0.62 0.00 -1.45 0.00 0.00 41.25 38.33 2d42 s ASN 66 CO 0.01 -0.58 1.45 0.35 -3.72 0.00 0.00 177.10 174.61 2d42 n THR 67 N 4.85 2.04 -3.34 -5.21 -2.24 -1.26 -2.02 114.28 107.09 2d42 n THR 67 Ca -0.08 -1.05 -0.21 0.00 -2.27 0.00 0.00 64.05 60.44 2d42 n THR 67 Cb 0.42 -0.30 0.02 0.00 -2.10 0.00 0.00 70.33 68.37 2d42 n THR 67 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2d42 s THR 68 N -2.29 2.23 -2.35 4.28 -4.23 -1.26 -4.79 115.64 107.23 2d42 s THR 68 Ca 0.41 -1.18 0.26 0.00 -1.18 0.00 0.00 61.69 60.00 2d42 s THR 68 Cb 0.31 -2.41 0.35 0.00 1.34 0.00 0.00 72.50 72.09 2d42 s THR 68 CO 0.13 0.00 1.54 -1.54 -0.54 0.00 0.00 174.62 174.21 2d42 n SER 69 N -1.95 1.71 -4.42 3.99 3.41 -1.26 -1.75 113.62 113.35 2d42 n SER 69 Ca 0.08 -1.43 -0.31 0.00 -0.26 0.00 0.00 58.87 56.95 2d42 n SER 69 Cb 0.62 0.09 -0.13 0.00 -0.26 0.00 0.00 64.21 64.52 2d42 n SER 69 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2d42 s ASN 70 N -2.18 3.63 0.53 4.04 0.01 -1.26 -4.74 114.94 114.97 2d42 s ASN 70 Ca 0.30 -0.45 -0.20 0.00 -0.71 0.00 0.00 52.86 51.80 2d42 s ASN 70 Cb 0.20 -0.54 -0.06 0.00 0.41 0.00 0.00 41.25 41.26 2d42 s ASN 70 CO 0.40 0.27 1.17 -0.55 -1.51 0.00 0.00 177.10 176.88 2d42 s SER 71 N -1.29 5.69 0.03 -1.22 0.15 -1.26 -4.34 113.70 111.46 2d42 s SER 71 Ca 0.13 2.31 -0.06 0.00 0.70 0.00 0.00 55.95 59.03 2d42 s SER 71 Cb -0.10 -2.60 -0.01 0.00 -1.71 0.00 0.00 66.02 61.60 2d42 s SER 71 CO 0.04 -1.24 0.10 -1.48 1.20 0.00 0.00 173.24 171.85 2d42 s LEU 72 N -3.62 1.77 -0.01 3.45 0.05 -0.92 -4.98 118.68 114.42 2d42 s LEU 72 Ca 0.71 -0.44 -0.20 0.00 0.05 0.00 0.00 54.13 54.25 2d42 s LEU 72 Cb -0.28 0.58 -0.05 0.00 -2.05 0.00 0.00 46.19 44.39 2d42 s LEU 72 CO 0.32 -0.45 0.59 -1.61 -0.55 0.00 0.00 176.35 174.65 2d42 s GLU 73 N -2.15 4.31 0.17 1.48 0.41 -1.26 -0.65 118.70 121.02 2d42 s GLU 73 Ca -0.09 0.73 0.10 0.00 -0.41 0.00 0.00 54.97 55.30 2d42 s GLU 73 Cb -0.04 -3.34 -0.04 0.00 -1.78 0.00 0.00 34.13 28.93 2d42 s GLU 73 CO -0.02 0.36 -0.21 0.20 -0.49 0.00 0.00 175.26 175.10 2d42 s GLY 74 N -0.17 1.53 -0.04 -1.39 0.00 0.15 -4.94 107.32 102.46 2d42 s GLY 74 Ca 0.31 -1.53 -0.01 0.00 0.00 0.00 0.00 44.72 43.48 2d42 s GLY 74 CO 0.17 -1.57 0.07 0.14 0.00 0.00 0.00 173.10 171.91 2d42 s VAL 75 N -1.76 -0.10 -0.30 1.40 1.01 -1.26 -0.29 120.40 119.10 2d42 s VAL 75 Ca 0.17 0.31 -0.12 0.00 0.00 0.00 0.00 61.98 62.34 2d42 s VAL 75 Cb -0.07 -0.15 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 2d42 s VAL 75 CO 0.08 0.13 0.23 -0.36 0.00 0.00 0.00 175.10 175.17 2d42 s PHE 76 N 1.65 3.22 -0.29 5.22 0.08 -0.00 -4.93 117.98 122.93 2d42 s PHE 76 Ca -0.02 0.05 -0.03 0.00 0.12 0.00 0.00 56.93 57.05 2d42 s PHE 76 Cb -0.12 -2.43 0.03 0.00 -0.57 0.00 0.00 43.02 39.93 2d42 s PHE 76 CO -0.04 -0.23 0.01 0.45 -0.10 0.00 0.00 175.22 175.32 2d42 s SER 77 N 1.74 4.84 0.00 1.36 0.15 -1.26 -0.77 113.70 119.76 2d42 s SER 77 Ca 0.08 -1.05 0.02 0.00 0.70 0.00 0.00 55.95 55.70 2d42 s SER 77 Cb -0.16 -1.75 -0.04 0.00 -1.71 0.00 0.00 66.02 62.36 2d42 s SER 77 CO 0.11 -0.22 -0.00 -0.36 1.20 0.00 0.00 173.24 173.96 2d42 s PHE 78 N 1.34 3.07 -0.22 3.44 0.08 0.17 -5.00 117.98 120.85 2d42 s PHE 78 Ca -0.02 0.07 -0.04 0.00 0.12 0.00 0.00 56.93 57.07 2d42 s PHE 78 Cb -0.18 -1.66 0.11 0.00 -0.57 0.00 0.00 43.02 40.72 2d42 s PHE 78 CO -0.01 0.46 0.32 0.45 -0.10 0.00 0.00 175.22 176.34 2d42 s SER 79 N -1.58 0.58 -0.04 1.36 0.15 -1.26 -1.38 113.70 111.53 2d42 s SER 79 Ca 0.20 0.17 -0.01 0.00 0.70 0.00 0.00 55.95 57.01 2d42 s SER 79 Cb -0.11 0.86 0.03 0.00 -1.71 0.00 0.00 66.02 65.08 2d42 s SER 79 CO 0.10 -0.30 0.03 0.20 1.20 0.00 0.00 173.24 174.47 2d42 s ASN 80 N 2.47 0.81 -0.58 5.45 0.01 0.45 -5.00 114.94 118.55 2d42 s ASN 80 Ca 0.09 0.01 -0.19 0.00 -0.71 0.00 0.00 52.86 52.06 2d42 s ASN 80 Cb -0.15 -0.20 0.09 0.00 0.41 0.00 0.00 41.25 41.40 2d42 s ASN 80 CO -0.14 -0.18 0.71 0.00 -1.51 0.00 0.00 177.10 175.99 2d42 s ALA 81 N 1.60 3.38 -0.09 0.60 0.00 -1.26 -1.30 121.76 124.69 2d42 s ALA 81 Ca -0.02 -2.06 -0.12 0.00 0.00 0.00 0.00 51.96 49.76 2d42 s ALA 81 Cb -0.13 -3.52 -0.05 0.00 0.00 0.00 0.00 23.12 19.43 2d42 s ALA 81 CO -0.03 -2.31 0.28 -0.47 0.00 0.00 0.00 175.76 173.24 2d42 s TYR 82 N 2.81 3.60 -0.24 0.00 5.04 -0.34 -4.89 117.35 123.34 2d42 s TYR 82 Ca 0.14 0.71 -0.06 0.00 -2.44 0.00 0.00 57.07 55.41 2d42 s TYR 82 Cb -0.22 -2.20 -0.02 0.00 0.35 0.00 0.00 41.96 39.87 2d42 s TYR 82 CO 0.08 0.53 0.04 0.99 -1.34 0.00 0.00 175.55 175.85 2d42 s THR 83 N -0.53 4.09 0.03 4.34 2.01 -1.26 -0.75 115.64 123.58 2d42 s THR 83 Ca 0.18 -0.25 0.06 0.00 0.31 0.00 0.00 61.69 62.00 2d42 s THR 83 Cb -0.14 -2.90 -0.03 0.00 0.01 0.00 0.00 72.50 69.44 2d42 s THR 83 CO 0.07 0.37 -0.17 -0.44 -0.69 0.00 0.00 174.62 173.76 2d42 s SER 84 N 1.48 3.89 0.07 3.53 0.01 -0.73 -4.95 113.70 117.00 2d42 s SER 84 Ca 0.06 -0.38 0.05 0.00 1.31 0.00 0.00 55.95 56.99 2d42 s SER 84 Cb -0.15 -0.67 -0.04 0.00 0.21 0.00 0.00 66.02 65.37 2d42 s SER 84 CO 0.02 0.27 -0.05 -0.60 0.41 0.00 0.00 173.24 173.28 2d42 s ARG 85 N -1.35 2.40 0.00 12.44 3.52 -1.26 -1.70 118.95 133.00 2d42 s ARG 85 Ca 0.14 -0.87 0.03 0.00 -0.13 0.00 0.00 55.73 54.90 2d42 s ARG 85 Cb -0.11 -2.45 -0.01 0.00 -1.56 0.00 0.00 34.95 30.83 2d42 s ARG 85 CO 0.05 0.55 -0.09 0.95 -0.81 0.00 0.00 175.30 175.95 2d42 s THR 86 N -1.19 0.69 0.00 4.11 -4.23 -0.95 -1.11 115.64 112.96 2d42 s THR 86 Ca 0.22 -0.48 0.04 0.00 -1.18 0.00 0.00 61.69 60.29 2d42 s THR 86 Cb -0.11 -0.60 -0.01 0.00 1.34 0.00 0.00 72.50 73.11 2d42 s THR 86 CO 0.14 0.11 -0.13 -0.55 -0.54 0.00 0.00 174.62 173.65 2d42 s SER 87 N -0.42 1.55 0.20 3.99 0.15 0.28 -1.31 113.70 118.14 2d42 s SER 87 Ca 0.02 -0.30 0.06 0.00 0.70 0.00 0.00 55.95 56.43 2d42 s SER 87 Cb -0.04 -0.15 -0.05 0.00 -1.71 0.00 0.00 66.02 64.07 2d42 s SER 87 CO -0.00 0.12 -0.11 -0.94 1.20 0.00 0.00 173.24 173.51 2d42 s SER 88 N -0.55 2.31 -0.29 5.45 1.04 -0.36 -0.18 113.70 121.11 2d42 s SER 88 Ca 0.04 -1.05 -0.11 0.00 0.48 0.00 0.00 55.95 55.31 2d42 s SER 88 Cb -0.06 -0.09 0.12 0.00 0.10 0.00 0.00 66.02 66.09 2d42 s SER 88 CO 0.00 -0.26 0.64 -1.58 0.98 0.00 0.00 173.24 173.02 2d42 s GLN 89 N -3.70 0.59 0.28 4.02 0.74 -0.37 -1.58 119.66 119.64 2d42 s GLN 89 Ca 0.22 1.38 -0.29 0.00 0.05 0.00 0.00 55.36 56.72 2d42 s GLN 89 Cb 0.01 0.70 -0.09 0.00 1.10 0.00 0.00 33.01 34.72 2d42 s GLN 89 CO 0.06 -0.19 1.07 0.99 -0.55 0.00 0.00 175.29 176.66 2d42 s THR 90 N 2.63 3.61 -0.13 -0.34 2.01 -1.26 -1.82 115.64 120.34 2d42 s THR 90 Ca -0.07 1.59 -0.12 0.00 0.31 0.00 0.00 61.69 63.40 2d42 s THR 90 Cb -0.11 -4.00 -0.06 0.00 0.01 0.00 0.00 72.50 68.35 2d42 s THR 90 CO -0.19 0.35 -0.25 -1.14 -0.69 0.00 0.00 174.62 172.71 2d42 n ARG 91 N 1.14 0.39 -3.95 4.92 0.63 0.19 -4.43 116.66 115.55 2d42 n ARG 91 Ca -0.01 0.16 -0.34 0.00 -0.92 0.00 0.00 57.85 56.74 2d42 n ARG 91 Cb 0.46 -1.18 -0.14 0.00 0.45 0.00 0.00 32.46 32.05 2d42 n ARG 91 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2d42 s ASP 92 N -6.20 4.78 0.00 6.15 1.01 -0.36 -0.63 116.67 121.42 2d42 s ASP 92 Ca -0.23 -1.41 0.00 0.00 0.71 0.00 0.00 52.55 51.62 2d42 s ASP 92 Cb 0.05 -1.67 0.00 0.00 1.01 0.00 0.00 42.92 42.32 2d42 s ASP 92 CO 0.32 -0.26 0.00 0.61 0.21 0.00 0.00 175.17 176.05 2d42 n GLY 93 N 4.54 5.58 3.30 0.21 0.00 -0.05 -1.77 105.19 117.00 2d42 n GLY 93 Ca -0.12 -1.73 -0.12 0.00 0.00 0.00 0.00 46.02 44.05 2d42 n GLY 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d42 s VAL 94 N -0.64 0.07 -0.02 1.61 0.11 -0.37 -0.48 120.40 120.69 2d42 s VAL 94 Ca 0.00 -0.56 -0.23 0.00 -2.93 0.00 0.00 61.98 58.26 2d42 s VAL 94 Cb 0.00 -0.99 0.05 0.00 -1.53 0.00 0.00 36.38 33.91 2d42 s VAL 94 CO 0.00 -0.31 0.49 0.28 -3.33 0.00 0.00 175.10 172.23 2d42 s THR 95 N -2.71 0.03 -0.82 5.04 -1.32 -0.30 -3.40 115.64 112.15 2d42 s THR 95 Ca -0.04 -0.25 0.16 0.00 -1.21 0.00 0.00 61.69 60.35 2d42 s THR 95 Cb -0.00 -0.83 0.54 0.00 -1.51 0.00 0.00 72.50 70.70 2d42 s THR 95 CO -0.04 -0.14 1.46 0.00 -2.21 0.00 0.00 174.62 173.69 2d42 n ALA 96 N 1.01 2.77 0.00 11.08 0.00 -1.26 -0.91 120.51 133.20 2d42 n ALA 96 Ca -0.20 -1.65 0.00 0.00 0.00 0.00 0.00 53.44 51.59 2d42 n ALA 96 Cb 0.57 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.27 2d42 n ALA 96 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d42 n GLY 97 N 0.51 0.50 3.08 0.00 0.00 -1.26 -4.81 105.19 103.21 2d42 n GLY 97 Ca 0.20 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.97 2d42 n GLY 97 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d42 s THR 98 N -2.00 1.27 0.24 2.61 2.01 -1.26 -5.12 115.64 113.39 2d42 s THR 98 Ca 0.00 -0.60 -0.30 0.00 0.31 0.00 0.00 61.69 61.11 2d42 s THR 98 Cb 0.00 -1.12 -0.09 0.00 0.01 0.00 0.00 72.50 71.30 2d42 s THR 98 CO 0.00 0.38 1.11 0.20 -0.69 0.00 0.00 174.62 175.62 2d42 s ASN 99 N 0.34 7.25 -0.10 3.53 0.01 -1.26 -4.93 114.94 119.78 2d42 s ASN 99 Ca -0.09 2.20 0.00 0.00 -0.71 0.00 0.00 52.86 54.26 2d42 s ASN 99 Cb -0.13 -2.62 0.02 0.00 0.41 0.00 0.00 41.25 38.93 2d42 s ASN 99 CO 0.03 -0.19 -0.09 -0.63 -1.51 0.00 0.00 177.10 174.72 2d42 s ILE 100 N -0.74 1.06 -0.23 0.60 1.01 -1.26 -5.09 121.20 116.54 2d42 s ILE 100 Ca 0.47 -0.33 -0.15 0.00 0.00 0.00 0.00 60.65 60.64 2d42 s ILE 100 Cb -0.31 -1.05 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 2d42 s ILE 100 CO 0.38 0.37 0.38 -0.89 0.00 0.00 0.00 174.94 175.18 2d42 s THR 101 N 1.49 5.20 0.17 2.92 2.01 -1.26 -4.17 115.64 121.99 2d42 s THR 101 Ca 0.01 0.62 0.05 0.00 0.31 0.00 0.00 61.69 62.68 2d42 s THR 101 Cb -0.13 -3.70 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 2d42 s THR 101 CO -0.06 0.21 0.12 -0.83 -0.69 0.00 0.00 174.62 173.38 2d42 s GLY 102 N 1.30 1.70 -0.15 4.40 0.00 0.12 -4.92 107.32 109.77 2d42 s GLY 102 Ca 0.17 -1.24 -0.04 0.00 0.00 0.00 0.00 44.72 43.60 2d42 s GLY 102 CO 0.08 -1.25 0.00 1.25 0.00 0.00 0.00 173.10 173.19 2d42 s LYS 103 N -3.12 3.63 0.23 2.90 2.36 -1.26 -1.84 119.74 122.64 2d42 s LYS 103 Ca 0.31 -0.44 0.02 0.00 -2.55 0.00 0.00 55.97 53.31 2d42 s LYS 103 Cb -0.10 -2.98 -0.05 0.00 -1.05 0.00 0.00 37.83 33.65 2d42 s LYS 103 CO 0.23 0.35 0.04 0.71 1.55 0.00 0.00 175.35 178.24 2d42 s TYR 104 N 0.09 1.49 0.10 4.03 2.02 0.12 -5.00 117.35 120.21 2d42 s TYR 104 Ca 0.02 -1.06 -0.05 0.00 -0.37 0.00 0.00 57.07 55.60 2d42 s TYR 104 Cb -0.13 -0.87 -0.02 0.00 -0.40 0.00 0.00 41.96 40.54 2d42 s TYR 104 CO 0.02 -0.21 0.13 -0.06 -1.57 0.00 0.00 175.55 173.86 2d42 s PHE 105 N -3.61 0.41 -0.28 2.71 0.08 -1.26 -1.51 117.98 114.51 2d42 s PHE 105 Ca 0.32 -0.85 -0.19 0.00 0.12 0.00 0.00 56.93 56.33 2d42 s PHE 105 Cb 0.07 -0.21 0.09 0.00 -0.57 0.00 0.00 43.02 42.40 2d42 s PHE 105 CO 0.10 -0.53 0.77 0.00 -0.10 0.00 0.00 175.22 175.46 2d42 s ALA 106 N -3.93 -1.93 -0.87 5.36 0.00 -0.87 -4.93 121.76 114.60 2d42 s ALA 106 Ca 0.11 2.25 -0.17 0.00 0.00 0.00 0.00 51.96 54.15 2d42 s ALA 106 Cb 0.06 -1.42 0.16 0.00 0.00 0.00 0.00 23.12 21.92 2d42 s ALA 106 CO -0.06 -0.35 0.98 -0.80 0.00 0.00 0.00 175.76 175.52 2d42 s ASN 107 N 1.16 6.64 0.39 0.00 0.01 -1.26 -0.59 114.94 121.29 2d42 s ASN 107 Ca -0.06 -2.20 -0.13 0.00 -0.71 0.00 0.00 52.86 49.76 2d42 s ASN 107 Cb -0.05 -2.33 -0.08 0.00 0.41 0.00 0.00 41.25 39.21 2d42 s ASN 107 CO -0.13 -0.91 0.79 -0.76 -1.51 0.00 0.00 177.10 174.58 2d42 s LEU 108 N 1.88 3.88 -0.17 0.60 1.43 -0.09 -4.87 118.68 121.33 2d42 s LEU 108 Ca 0.26 1.26 -0.01 0.00 -1.03 0.00 0.00 54.13 54.61 2d42 s LEU 108 Cb -0.08 -4.12 -0.00 0.00 0.03 0.00 0.00 46.19 42.02 2d42 s LEU 108 CO -0.08 -0.36 -0.13 0.12 0.23 0.00 0.00 176.35 176.13 2d42 s PHE 109 N -2.28 2.83 -0.91 0.29 5.36 -0.15 -0.21 117.98 122.91 2d42 s PHE 109 Ca 0.54 -1.08 -0.15 0.00 -0.96 0.00 0.00 56.93 55.28 2d42 s PHE 109 Cb -0.10 -1.94 0.20 0.00 -0.34 0.00 0.00 43.02 40.84 2d42 s PHE 109 CO 0.26 -0.52 0.93 -0.06 -1.46 0.00 0.00 175.22 174.37 2d42 s PHE 110 N 1.01 3.65 0.39 10.12 0.08 0.40 0.07 117.98 133.70 2d42 s PHE 110 Ca -0.01 -1.93 0.20 0.00 0.12 0.00 0.00 56.93 55.30 2d42 s PHE 110 Cb -0.15 -3.97 1.16 0.00 -0.57 0.00 0.00 43.02 39.50 2d42 s PHE 110 CO -0.03 -1.13 1.71 1.49 -0.10 0.00 0.00 175.22 177.16 2d42 h GLU 111 N 7.88 0.31 0.00 0.44 4.81 -1.55 0.30 114.58 126.79 2d42 h GLU 111 Ca 0.14 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2d42 h GLU 111 Cb 1.01 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.32 2d42 h GLU 111 CO 0.90 0.21 0.00 1.96 -0.73 0.00 0.00 179.01 181.34 2d42 h GLN 112 N 0.32 0.00 0.00 1.92 4.20 -1.83 -3.06 115.11 116.67 2d42 h GLN 112 Ca 0.68 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.39 2d42 h GLN 112 Cb 1.77 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.55 2d42 h GLN 112 CO -0.39 0.00 0.00 1.33 -0.67 0.00 0.00 178.83 179.10 2d42 n VAL 113 N -2.89 0.00 -3.36 -0.54 0.24 -0.44 -5.02 118.33 106.32 2d42 n VAL 113 Ca -0.00 -0.38 -0.21 0.00 -2.04 0.00 0.00 64.34 61.71 2d42 n VAL 113 Cb 0.22 1.24 0.06 0.00 -1.47 0.00 0.00 33.84 33.90 2d42 n VAL 113 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2d42 n GLY 114 N 0.03 -0.40 2.99 7.63 0.00 -0.03 -5.01 105.19 110.39 2d42 n GLY 114 Ca 0.00 0.14 -0.18 0.00 0.00 0.00 0.00 46.02 45.98 2d42 n GLY 114 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2d42 s LEU 115 N -6.55 1.93 0.36 0.99 2.96 -1.16 -4.97 118.68 112.25 2d42 s LEU 115 Ca 0.47 -0.14 -0.11 0.00 -0.22 0.00 0.00 54.13 54.13 2d42 s LEU 115 Cb -0.21 -0.41 -0.07 0.00 0.50 0.00 0.00 46.19 46.00 2d42 s LEU 115 CO 0.58 0.08 0.72 -0.44 -1.32 0.00 0.00 176.35 175.97 2d42 s SER 116 N -0.05 6.57 -0.08 3.68 0.01 -1.26 -0.45 113.70 122.12 2d42 s SER 116 Ca 0.01 1.09 -0.03 0.00 1.31 0.00 0.00 55.95 58.33 2d42 s SER 116 Cb -0.05 -2.30 0.04 0.00 0.21 0.00 0.00 66.02 63.92 2d42 s SER 116 CO -0.00 -0.31 0.16 -0.83 0.41 0.00 0.00 173.24 172.67 2d42 s GLY 117 N -2.93 -0.03 -0.30 3.44 0.00 0.70 -4.91 107.32 103.30 2d42 s GLY 117 Ca 0.51 0.70 -0.19 0.00 0.00 0.00 0.00 44.72 45.73 2d42 s GLY 117 CO 0.28 1.22 0.58 -1.60 0.00 0.00 0.00 173.10 173.58 2d42 s ARG 118 N 1.50 3.91 0.29 2.90 3.52 -1.26 -0.91 118.95 128.90 2d42 s ARG 118 Ca -0.06 0.24 0.05 0.00 -0.13 0.00 0.00 55.73 55.84 2d42 s ARG 118 Cb -0.12 -3.72 -0.02 0.00 -1.56 0.00 0.00 34.95 29.54 2d42 s ARG 118 CO -0.06 -0.52 0.43 0.96 -0.81 0.00 0.00 175.30 175.30 2d42 s ILE 119 N 2.49 4.72 0.00 4.11 -4.36 0.24 -4.93 121.20 123.48 2d42 s ILE 119 Ca 0.23 -0.94 0.03 0.00 -0.26 0.00 0.00 60.65 59.71 2d42 s ILE 119 Cb -0.15 -3.66 -0.01 0.00 1.25 0.00 0.00 42.46 39.89 2d42 s ILE 119 CO 0.11 -0.27 -0.09 0.00 0.24 0.00 0.00 174.94 174.93 2d42 s ALA 120 N -2.10 0.78 0.16 2.27 0.00 -1.26 -2.05 121.76 119.55 2d42 s ALA 120 Ca 0.39 -0.48 -0.15 0.00 0.00 0.00 0.00 51.96 51.73 2d42 s ALA 120 Cb -0.09 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 22.88 2d42 s ALA 120 CO 0.31 0.17 0.42 -0.59 0.00 0.00 0.00 175.76 176.06 2d42 s PHE 121 N -0.40 -0.04 0.17 0.00 -0.12 -0.57 -4.79 117.98 112.23 2d42 s PHE 121 Ca 0.02 -0.30 0.10 0.00 -0.05 0.00 0.00 56.93 56.69 2d42 s PHE 121 Cb -0.05 0.24 -0.04 0.00 -0.63 0.00 0.00 43.02 42.54 2d42 s PHE 121 CO -0.00 -0.78 -0.20 -1.21 -0.05 0.00 0.00 175.22 172.97 2d42 s GLU 122 N -3.86 1.36 -0.03 1.99 2.02 -1.26 0.16 118.70 119.08 2d42 s GLU 122 Ca 0.08 -1.45 -0.30 0.00 0.02 0.00 0.00 54.97 53.32 2d42 s GLU 122 Cb 0.01 -1.52 0.11 0.00 0.10 0.00 0.00 34.13 32.83 2d42 s GLU 122 CO -0.06 0.32 1.13 0.20 0.02 0.00 0.00 175.26 176.87 2d42 s GLY 123 N -2.65 -0.35 -0.10 -1.39 0.00 -0.77 -4.31 107.32 97.75 2d42 s GLY 123 Ca 0.17 0.91 0.02 0.00 0.00 0.00 0.00 44.72 45.82 2d42 s GLY 123 CO 0.08 0.26 -0.14 0.00 0.00 0.00 0.00 173.10 173.30 2d42 s ALA 124 N -2.71 1.58 -1.41 3.20 0.00 -1.26 0.12 121.76 121.28 2d42 s ALA 124 Ca 0.11 -0.65 0.30 0.00 0.00 0.00 0.00 51.96 51.71 2d42 s ALA 124 Cb 0.01 -0.78 1.37 0.00 0.00 0.00 0.00 23.12 23.73 2d42 s ALA 124 CO -0.04 -0.05 1.97 1.55 0.00 0.00 0.00 175.76 179.19 2d42 n VAL 125 N 4.15 0.00 1.26 0.00 3.14 -1.26 -3.70 118.33 121.93 2d42 n VAL 125 Ca -0.19 -0.01 0.13 0.00 -2.96 0.00 0.00 64.34 61.31 2d42 n VAL 125 Cb 0.51 -0.37 0.48 0.00 -1.06 0.00 0.00 33.84 33.40 2d42 n VAL 125 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 2d42 n THR 126 N -1.24 0.00 -3.90 1.55 -2.24 -1.22 -1.23 114.28 105.99 2d42 n THR 126 Ca 0.13 -0.07 -0.08 0.00 -2.27 0.00 0.00 64.05 61.76 2d42 n THR 126 Cb 0.27 0.10 -0.02 0.00 -2.10 0.00 0.00 70.33 68.57 2d42 n THR 126 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2d42 s ASN 127 N -2.59 -0.15 -0.26 3.42 2.20 -1.24 -4.72 114.94 111.59 2d42 s ASN 127 Ca 0.24 -0.79 0.13 0.00 -0.94 0.00 0.00 52.86 51.50 2d42 s ASN 127 Cb 0.19 0.70 0.72 0.00 -2.00 0.00 0.00 41.25 40.86 2d42 s ASN 127 CO 0.53 -1.33 1.69 -0.62 -2.94 0.00 0.00 177.10 174.42 2d42 n GLU 128 N -0.45 3.87 -1.87 3.55 1.02 -1.26 -4.16 120.64 121.34 2d42 n GLU 128 Ca -0.04 -3.08 -0.31 0.00 -0.02 0.00 0.00 57.16 53.72 2d42 n GLU 128 Cb 0.60 -2.14 0.02 0.00 -0.02 0.00 0.00 31.44 29.90 2d42 n GLU 128 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2d42 s ASN 129 N -1.23 6.03 -0.01 1.62 0.01 -1.26 -4.66 114.94 115.44 2d42 s ASN 129 Ca 0.52 1.36 -0.23 0.00 -0.71 0.00 0.00 52.86 53.79 2d42 s ASN 129 Cb 0.41 -2.35 -0.05 0.00 0.41 0.00 0.00 41.25 39.68 2d42 s ASN 129 CO 0.13 -0.99 0.70 -0.75 -1.51 0.00 0.00 177.10 174.67 2d42 s LYS 130 N -5.22 4.43 -0.15 -0.60 2.20 -1.26 -4.38 119.74 114.76 2d42 s LYS 130 Ca 0.56 0.92 0.02 0.00 -0.36 0.00 0.00 55.97 57.10 2d42 s LYS 130 Cb -0.11 -3.39 0.01 0.00 -1.51 0.00 0.00 37.83 32.83 2d42 s LYS 130 CO 0.54 0.21 -0.21 0.71 -0.36 0.00 0.00 175.35 176.24 2d42 s TYR 131 N 0.26 2.62 0.08 4.03 2.02 -0.62 -4.98 117.35 120.76 2d42 s TYR 131 Ca 0.36 -1.39 0.06 0.00 -0.37 0.00 0.00 57.07 55.73 2d42 s TYR 131 Cb -0.19 -1.80 -0.04 0.00 -0.40 0.00 0.00 41.96 39.53 2d42 s TYR 131 CO 0.20 -0.66 -0.06 0.95 -1.57 0.00 0.00 175.55 174.41 2d42 s THR 132 N 0.98 3.66 -0.05 -0.71 -4.23 -1.26 -1.23 115.64 112.80 2d42 s THR 132 Ca -0.03 -1.08 -0.02 0.00 -1.18 0.00 0.00 61.69 59.38 2d42 s THR 132 Cb -0.15 -2.70 0.03 0.00 1.34 0.00 0.00 72.50 71.02 2d42 s THR 132 CO -0.05 0.16 0.05 -0.22 -0.54 0.00 0.00 174.62 174.02 2d42 s LEU 133 N -2.11 0.26 -0.25 4.79 2.96 -0.43 -4.90 118.68 118.99 2d42 s LEU 133 Ca 0.22 0.04 -0.15 0.00 -0.22 0.00 0.00 54.13 54.03 2d42 s LEU 133 Cb -0.11 -0.20 -0.04 0.00 0.50 0.00 0.00 46.19 46.34 2d42 s LEU 133 CO 0.14 -0.24 0.35 -1.81 -1.32 0.00 0.00 176.35 173.48 2d42 s ASP 134 N 2.10 6.27 -0.10 3.68 1.01 -1.26 -2.24 116.67 126.13 2d42 s ASP 134 Ca 0.05 0.31 0.00 0.00 0.71 0.00 0.00 52.55 53.62 2d42 s ASP 134 Cb -0.12 -2.20 -0.02 0.00 1.01 0.00 0.00 42.92 41.58 2d42 s ASP 134 CO -0.03 -0.13 -0.09 0.00 0.21 0.00 0.00 175.17 175.12 2d42 s ALA 135 N 1.81 2.82 -0.25 5.23 0.00 -0.69 -4.98 121.76 125.71 2d42 s ALA 135 Ca 0.15 -0.89 -0.09 0.00 0.00 0.00 0.00 51.96 51.13 2d42 s ALA 135 Cb -0.15 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.70 2d42 s ALA 135 CO 0.09 0.42 0.11 0.99 0.00 0.00 0.00 175.76 177.37 2d42 s THR 136 N -0.27 4.73 -0.16 0.00 2.01 -1.26 -1.77 115.64 118.91 2d42 s THR 136 Ca 0.03 -0.04 -0.07 0.00 0.31 0.00 0.00 61.69 61.92 2d42 s THR 136 Cb -0.13 -3.21 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 2d42 s THR 136 CO 0.03 0.34 0.08 -1.10 -0.69 0.00 0.00 174.62 173.27 2d42 s GLN 137 N 1.41 3.81 -0.73 4.92 -0.21 0.08 -4.96 119.66 123.98 2d42 s GLN 137 Ca 0.06 -0.30 -0.14 0.00 0.02 0.00 0.00 55.36 55.00 2d42 s GLN 137 Cb -0.15 -3.19 0.19 0.00 1.00 0.00 0.00 33.01 30.86 2d42 s GLN 137 CO 0.05 0.41 0.67 -0.51 -2.12 0.00 0.00 175.29 173.79 2d42 s ASP 138 N 0.00 6.51 -0.21 5.90 1.01 -1.26 -1.20 116.67 127.43 2d42 s ASP 138 Ca 0.07 -2.44 -0.26 0.00 0.71 0.00 0.00 52.55 50.63 2d42 s ASP 138 Cb -0.12 -2.19 -0.01 0.00 1.01 0.00 0.00 42.92 41.62 2d42 s ASP 138 CO 0.01 -0.64 0.87 -0.36 0.21 0.00 0.00 175.17 175.25 2d42 s PHE 139 N 0.56 3.36 -0.08 4.23 0.08 -0.42 -4.92 117.98 120.79 2d42 s PHE 139 Ca 0.14 1.24 0.01 0.00 0.12 0.00 0.00 56.93 58.44 2d42 s PHE 139 Cb -0.16 -3.08 0.02 0.00 -0.57 0.00 0.00 43.02 39.23 2d42 s PHE 139 CO -0.05 -0.35 -0.10 1.03 -0.10 0.00 0.00 175.22 175.64 2d42 s ARG 140 N 2.63 1.62 0.08 0.44 0.52 -1.26 -0.41 118.95 122.56 2d42 s ARG 140 Ca 0.38 -0.35 -0.16 0.00 -0.52 0.00 0.00 55.73 55.08 2d42 s ARG 140 Cb -0.16 -1.46 0.03 0.00 0.52 0.00 0.00 34.95 33.88 2d42 s ARG 140 CO 0.09 -0.08 0.37 -0.51 0.02 0.00 0.00 175.30 175.18 2d42 s ASP 141 N 1.05 -0.20 0.10 0.23 1.01 -0.48 -5.01 116.67 113.38 2d42 s ASP 141 Ca -0.07 -0.22 -0.01 0.00 0.71 0.00 0.00 52.55 52.96 2d42 s ASP 141 Cb -0.15 0.42 -0.04 0.00 1.01 0.00 0.00 42.92 44.17 2d42 s ASP 141 CO -0.01 -0.73 0.02 -0.94 0.21 0.00 0.00 175.17 173.72 2d42 s SER 142 N -2.40 0.38 -0.20 0.27 1.04 -1.26 0.42 113.70 111.95 2d42 s SER 142 Ca -0.01 -1.12 -0.09 0.00 0.48 0.00 0.00 55.95 55.21 2d42 s SER 142 Cb 0.01 0.26 0.08 0.00 0.10 0.00 0.00 66.02 66.46 2d42 s SER 142 CO -0.07 -0.68 0.46 -1.58 0.98 0.00 0.00 173.24 172.35 2d42 s GLN 143 N -4.00 0.41 0.06 4.02 2.00 0.05 -4.96 119.66 117.24 2d42 s GLN 143 Ca 0.17 0.97 -0.10 0.00 -2.00 0.00 0.00 55.36 54.40 2d42 s GLN 143 Cb 0.08 0.18 -0.06 0.00 0.80 0.00 0.00 33.01 34.01 2d42 s GLN 143 CO -0.03 -0.20 0.39 0.99 -0.50 0.00 0.00 175.29 175.94 2d42 s THR 144 N 1.99 5.10 -0.00 -0.34 2.01 -1.26 -0.82 115.64 122.31 2d42 s THR 144 Ca -0.06 0.50 -0.11 0.00 0.31 0.00 0.00 61.69 62.32 2d42 s THR 144 Cb -0.10 -3.65 0.01 0.00 0.01 0.00 0.00 72.50 68.78 2d42 s THR 144 CO -0.14 0.35 0.22 -0.51 -0.69 0.00 0.00 174.62 173.86 2d42 s ILE 145 N -1.33 0.07 -0.32 1.82 1.10 0.61 -4.98 121.20 118.17 2d42 s ILE 145 Ca 0.31 -0.58 -0.10 0.00 -0.51 0.00 0.00 60.65 59.76 2d42 s ILE 145 Cb -0.14 -0.53 -0.01 0.00 0.15 0.00 0.00 42.46 41.93 2d42 s ILE 145 CO 0.17 -0.32 0.17 -0.60 -2.11 0.00 0.00 174.94 172.25 2d42 s ARG 146 N -1.37 3.38 -0.41 3.50 3.52 -1.26 0.32 118.95 126.63 2d42 s ARG 146 Ca -0.14 -0.69 -0.16 0.00 -0.13 0.00 0.00 55.73 54.60 2d42 s ARG 146 Cb -0.06 -3.62 0.02 0.00 -1.56 0.00 0.00 34.95 29.73 2d42 s ARG 146 CO 0.03 -0.42 0.39 0.08 -0.81 0.00 0.00 175.30 174.57 2d42 s VAL 147 N 1.64 5.15 0.78 7.11 1.01 0.18 -4.96 120.40 131.31 2d42 s VAL 147 Ca 0.05 -0.42 -0.14 0.00 0.00 0.00 0.00 61.98 61.47 2d42 s VAL 147 Cb -0.17 -3.99 0.07 0.00 0.00 0.00 0.00 36.38 32.29 2d42 s VAL 147 CO 0.07 -0.37 1.20 -2.84 0.00 0.00 0.00 175.10 173.16 2d42 s PRO 148 N 1.99 1.84 0.33 2.72 0.02 -1.26 -2.18 135.00 138.45 2d42 s PRO 148 Ca 0.10 1.72 -0.27 0.00 0.02 0.00 0.00 61.00 62.57 2d42 s PRO 148 Cb -0.18 -1.80 -0.13 0.00 0.02 0.00 0.00 34.50 32.41 2d42 s PRO 148 CO 0.12 -2.06 1.02 -2.30 -0.33 0.00 0.00 177.00 173.46 2d42 n PRO 149 N -3.12 1.41 -3.95 5.54 -0.02 -1.26 -2.25 135.00 131.35 2d42 n PRO 149 Ca 0.13 0.50 -0.30 0.00 -2.02 0.00 0.00 63.50 61.81 2d42 n PRO 149 Cb 0.51 -1.93 0.02 0.00 -0.02 0.00 0.00 33.50 32.07 2d42 n PRO 149 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2d42 n PHE 150 N 0.04 -2.17 -4.31 6.00 3.72 -0.71 -4.91 117.46 115.11 2d42 n PHE 150 Ca 0.09 0.88 -0.16 0.00 -0.05 0.00 0.00 57.45 58.21 2d42 n PHE 150 Cb 0.34 -3.85 -0.10 0.00 -0.94 0.00 0.00 39.48 34.93 2d42 n PHE 150 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 2d42 s HIS 151 N -3.35 1.49 0.03 1.38 3.76 -0.95 -0.16 115.29 117.47 2d42 s HIS 151 Ca 0.60 -0.84 0.05 0.00 -0.15 0.00 0.00 55.06 54.72 2d42 s HIS 151 Cb -0.31 -0.82 -0.02 0.00 1.11 0.00 0.00 32.58 32.54 2d42 s HIS 151 CO 0.85 0.03 -0.16 -0.98 -0.85 0.00 0.00 174.74 173.63 2d42 s ARG 152 N -3.81 1.10 -0.16 1.40 1.70 0.57 -0.81 118.95 118.94 2d42 s ARG 152 Ca 0.24 -0.74 -0.01 0.00 -0.47 0.00 0.00 55.73 54.75 2d42 s ARG 152 Cb 0.04 -1.12 -0.01 0.00 -0.57 0.00 0.00 34.95 33.29 2d42 s ARG 152 CO 0.06 0.29 -0.11 0.00 -1.08 0.00 0.00 175.30 174.45 2d42 s ALA 153 N -0.71 2.64 -0.31 7.88 0.00 0.27 -1.48 121.76 130.06 2d42 s ALA 153 Ca 0.04 -0.99 -0.03 0.00 0.00 0.00 0.00 51.96 50.98 2d42 s ALA 153 Cb -0.07 -1.34 0.05 0.00 0.00 0.00 0.00 23.12 21.75 2d42 s ALA 153 CO 0.01 0.02 0.02 0.99 0.00 0.00 0.00 175.76 176.80 2d42 s THR 154 N 0.73 3.19 -0.25 0.00 2.01 -0.17 -1.09 115.64 120.07 2d42 s THR 154 Ca -0.05 -1.30 -0.13 0.00 0.31 0.00 0.00 61.69 60.52 2d42 s THR 154 Cb -0.15 -2.82 -0.04 0.00 0.01 0.00 0.00 72.50 69.50 2d42 s THR 154 CO 0.02 -0.11 0.28 -0.83 -0.69 0.00 0.00 174.62 173.29 2d42 s GLY 155 N 1.30 1.97 -0.18 4.40 0.00 -0.02 -1.43 107.32 113.36 2d42 s GLY 155 Ca -0.04 -0.82 -0.03 0.00 0.00 0.00 0.00 44.72 43.83 2d42 s GLY 155 CO -0.00 0.70 -0.08 0.14 0.00 0.00 0.00 173.10 173.86 2d42 s VAL 156 N 1.51 3.28 -0.33 1.40 1.01 -0.02 -0.81 120.40 126.44 2d42 s VAL 156 Ca 0.12 -0.55 -0.15 0.00 0.00 0.00 0.00 61.98 61.40 2d42 s VAL 156 Cb -0.15 -2.45 -0.02 0.00 0.00 0.00 0.00 36.38 33.77 2d42 s VAL 156 CO 0.08 0.47 0.37 -0.47 0.00 0.00 0.00 175.10 175.55 2d42 s TYR 157 N 1.01 3.21 -0.05 5.22 5.04 0.39 -1.42 117.35 130.75 2d42 s TYR 157 Ca -0.00 0.05 0.05 0.00 -2.44 0.00 0.00 57.07 54.73 2d42 s TYR 157 Cb -0.15 -2.67 -0.02 0.00 0.35 0.00 0.00 41.96 39.47 2d42 s TYR 157 CO -0.00 -0.41 -0.18 0.99 -1.34 0.00 0.00 175.55 174.61 2d42 s THR 158 N 2.05 2.72 -0.14 4.34 2.01 0.50 0.24 115.64 127.35 2d42 s THR 158 Ca 0.13 -0.85 -0.02 0.00 0.31 0.00 0.00 61.69 61.26 2d42 s THR 158 Cb -0.16 -2.03 -0.02 0.00 0.01 0.00 0.00 72.50 70.29 2d42 s THR 158 CO 0.12 0.58 -0.08 -0.22 -0.69 0.00 0.00 174.62 174.32 2d42 s LEU 159 N -0.60 2.98 -0.41 4.42 2.96 0.21 -0.55 118.68 127.69 2d42 s LEU 159 Ca 0.09 -0.23 -0.19 0.00 -0.22 0.00 0.00 54.13 53.58 2d42 s LEU 159 Cb -0.11 -1.70 0.01 0.00 0.50 0.00 0.00 46.19 44.90 2d42 s LEU 159 CO 0.01 0.17 0.57 -0.70 -1.32 0.00 0.00 176.35 175.08 2d42 s GLU 160 N 0.34 3.37 -0.23 1.98 2.12 -0.07 -0.18 118.70 126.03 2d42 s GLU 160 Ca -0.08 -0.35 -0.07 0.00 0.36 0.00 0.00 54.97 54.83 2d42 s GLU 160 Cb -0.15 -3.91 -0.03 0.00 0.26 0.00 0.00 34.13 30.30 2d42 s GLU 160 CO 0.04 -0.87 0.07 -1.14 -0.54 0.00 0.00 175.26 172.83 2d42 s GLN 161 N 2.58 3.76 0.44 4.30 0.74 0.06 -0.17 119.66 131.37 2d42 s GLN 161 Ca 0.20 -0.43 -0.01 0.00 0.05 0.00 0.00 55.36 55.16 2d42 s GLN 161 Cb -0.15 -3.29 -0.02 0.00 1.10 0.00 0.00 33.01 30.66 2d42 s GLN 161 CO 0.16 -0.03 0.68 0.20 -0.55 0.00 0.00 175.29 175.76 2d42 s GLY 162 N 1.19 1.49 0.03 2.59 0.00 0.85 -1.25 107.32 112.21 2d42 s GLY 162 Ca 0.05 -0.86 -0.02 0.00 0.00 0.00 0.00 44.72 43.88 2d42 s GLY 162 CO 0.03 -0.71 0.01 0.00 0.00 0.00 0.00 173.10 172.44 2d42 s ALA 163 N -2.57 0.11 0.19 3.20 0.00 -1.26 -1.38 121.76 120.05 2d42 s ALA 163 Ca 0.46 -0.66 -0.19 0.00 0.00 0.00 0.00 51.96 51.57 2d42 s ALA 163 Cb -0.10 0.19 0.04 0.00 0.00 0.00 0.00 23.12 23.25 2d42 s ALA 163 CO 0.40 -0.24 0.55 -0.59 0.00 0.00 0.00 175.76 175.88 2d42 s PHE 164 N -2.18 -0.24 -0.22 0.00 -0.12 -0.38 -4.57 117.98 110.26 2d42 s PHE 164 Ca -0.09 -0.07 -0.04 0.00 -0.05 0.00 0.00 56.93 56.68 2d42 s PHE 164 Cb -0.04 0.45 0.11 0.00 -0.63 0.00 0.00 43.02 42.91 2d42 s PHE 164 CO -0.03 -0.91 0.36 -2.00 -0.05 0.00 0.00 175.22 172.59 2d42 s GLU 165 N -3.84 0.31 0.07 1.99 2.12 -1.26 -1.75 118.70 116.34 2d42 s GLU 165 Ca 0.07 0.63 0.02 0.00 0.36 0.00 0.00 54.97 56.05 2d42 s GLU 165 Cb -0.01 -0.34 -0.03 0.00 0.26 0.00 0.00 34.13 34.01 2d42 s GLU 165 CO -0.05 -0.53 -0.08 0.15 -0.54 0.00 0.00 175.26 174.21 2d42 s LYS 166 N 2.53 0.71 0.32 4.30 -0.14 0.36 -4.99 119.74 122.84 2d42 s LYS 166 Ca 0.08 -1.05 -0.19 0.00 -1.36 0.00 0.00 55.97 53.45 2d42 s LYS 166 Cb -0.14 -0.33 -0.09 0.00 -1.68 0.00 0.00 37.83 35.58 2d42 s LYS 166 CO -0.14 0.04 0.81 1.41 -0.76 0.00 0.00 175.35 176.71 2d42 s MET 167 N -2.62 4.19 0.13 1.68 -2.45 -1.26 -0.55 119.30 118.41 2d42 s MET 167 Ca 0.01 0.90 0.09 0.00 -1.25 0.00 0.00 55.69 55.44 2d42 s MET 167 Cb -0.03 -2.52 -0.04 0.00 1.25 0.00 0.00 34.83 33.49 2d42 s MET 167 CO -0.01 0.18 -0.20 0.95 1.05 0.00 0.00 175.02 176.99 2d42 s THR 168 N -1.88 1.80 -0.25 10.11 -4.23 -0.13 -4.36 115.64 116.70 2d42 s THR 168 Ca 0.53 -1.71 -0.07 0.00 -1.18 0.00 0.00 61.69 59.26 2d42 s THR 168 Cb -0.12 -1.71 -0.02 0.00 1.34 0.00 0.00 72.50 71.99 2d42 s THR 168 CO 0.18 -0.15 0.06 -0.69 -0.54 0.00 0.00 174.62 173.47 2d42 s VAL 169 N -1.52 4.16 -0.17 2.29 1.01 0.24 -1.42 120.40 124.99 2d42 s VAL 169 Ca 0.11 -0.27 -0.09 0.00 0.00 0.00 0.00 61.98 61.73 2d42 s VAL 169 Cb -0.08 -2.96 -0.05 0.00 0.00 0.00 0.00 36.38 33.29 2d42 s VAL 169 CO 0.05 0.32 0.13 -0.76 0.00 0.00 0.00 175.10 174.85 2d42 s LEU 170 N 1.59 4.29 0.08 3.92 1.43 -0.26 -1.77 118.68 127.95 2d42 s LEU 170 Ca 0.06 0.33 0.02 0.00 -1.03 0.00 0.00 54.13 53.52 2d42 s LEU 170 Cb -0.15 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 43.95 2d42 s LEU 170 CO 0.03 0.28 -0.08 -1.61 0.23 0.00 0.00 176.35 175.19 2d42 s GLU 171 N -0.24 0.75 -0.05 1.70 2.02 0.76 0.11 118.70 123.76 2d42 s GLU 171 Ca 0.11 -1.12 -0.31 0.00 0.02 0.00 0.00 54.97 53.67 2d42 s GLU 171 Cb -0.11 -0.34 0.12 0.00 0.10 0.00 0.00 34.13 33.90 2d42 s GLU 171 CO 0.01 0.03 1.15 0.00 0.02 0.00 0.00 175.26 176.47 2d42 s VAL 173 N -2.65 4.70 -0.11 0.00 1.01 0.21 -1.25 120.40 122.30 2d42 s VAL 173 Ca 0.11 -0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.03 2d42 s VAL 173 Cb 0.01 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.33 2d42 s VAL 173 CO -0.04 0.54 -0.19 -0.69 0.00 0.00 0.00 175.10 174.72 2d42 s VAL 174 N -0.29 2.54 0.32 2.92 1.01 0.36 -0.79 120.40 126.46 2d42 s VAL 174 Ca 0.08 -0.85 -0.11 0.00 0.00 0.00 0.00 61.98 61.10 2d42 s VAL 174 Cb -0.12 -2.02 0.04 0.00 0.00 0.00 0.00 36.38 34.29 2d42 s VAL 174 CO 0.02 0.54 0.62 -1.54 0.00 0.00 0.00 175.10 174.74 2d42 n SER 175 N 3.48 -1.80 0.00 3.32 3.41 -0.97 -0.85 113.62 120.20 2d42 n SER 175 Ca -0.18 -2.34 0.00 0.00 -0.26 0.00 0.00 58.87 56.09 2d42 n SER 175 Cb 0.53 3.03 0.00 0.00 -0.26 0.00 0.00 64.21 67.51 2d42 n SER 175 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d42 n GLY 176 N -0.44 -1.41 3.39 5.00 0.00 -1.26 0.00 105.19 110.47 2d42 n GLY 176 Ca -0.06 -2.23 -0.26 0.00 0.00 0.00 0.00 46.02 43.47 2d42 n GLY 176 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2d42 s ASN 177 N -0.62 3.21 0.33 1.61 -0.87 0.96 -1.39 114.94 118.16 2d42 s ASN 177 Ca 0.00 -0.83 0.10 0.00 -1.57 0.00 0.00 52.86 50.56 2d42 s ASN 177 Cb 0.00 -0.22 -0.06 0.00 -0.02 0.00 0.00 41.25 40.95 2d42 s ASN 177 CO 0.00 0.10 -0.06 -0.83 -2.57 0.00 0.00 177.10 173.74 2d42 s GLY 178 N -2.50 2.07 -0.08 0.66 0.00 0.33 -1.20 107.32 106.60 2d42 s GLY 178 Ca 0.18 -1.98 0.03 0.00 0.00 0.00 0.00 44.72 42.95 2d42 s GLY 178 CO 0.08 -1.95 -0.17 -0.42 0.00 0.00 0.00 173.10 170.64 2d42 s ILE 179 N -2.54 1.52 -0.08 0.90 -1.09 0.30 -1.41 121.20 118.80 2d42 s ILE 179 Ca 0.33 -0.71 0.03 0.00 -2.23 0.00 0.00 60.65 58.07 2d42 s ILE 179 Cb -0.00 -1.35 0.01 0.00 -1.58 0.00 0.00 42.46 39.54 2d42 s ILE 179 CO 0.18 0.44 -0.18 -0.63 -1.23 0.00 0.00 174.94 173.52 2d42 s ILE 180 N 0.49 1.57 -0.20 2.92 1.01 -0.02 -0.59 121.20 126.37 2d42 s ILE 180 Ca -0.15 -0.74 -0.06 0.00 0.00 0.00 0.00 60.65 59.69 2d42 s ILE 180 Cb -0.16 -1.38 -0.03 0.00 0.01 0.00 0.00 42.46 40.89 2d42 s ILE 180 CO 0.06 0.45 0.04 -0.13 0.00 0.00 0.00 174.94 175.36 2d42 s ARG 181 N 0.47 3.76 0.22 2.79 0.52 0.13 -1.10 118.95 125.75 2d42 s ARG 181 Ca -0.16 -0.45 0.06 0.00 -0.52 0.00 0.00 55.73 54.66 2d42 s ARG 181 Cb -0.17 -3.18 -0.05 0.00 0.52 0.00 0.00 34.95 32.08 2d42 s ARG 181 CO 0.06 0.07 -0.08 0.71 0.02 0.00 0.00 175.30 176.08 2d42 s TYR 182 N 0.89 1.67 0.02 -0.53 2.02 -0.28 0.04 117.35 121.17 2d42 s TYR 182 Ca 0.02 -0.72 -0.18 0.00 -0.37 0.00 0.00 57.07 55.83 2d42 s TYR 182 Cb -0.14 -0.89 0.03 0.00 -0.40 0.00 0.00 41.96 40.57 2d42 s TYR 182 CO 0.02 0.20 0.40 1.52 -1.57 0.00 0.00 175.55 176.12 2d42 s TYR 183 N -3.14 -0.26 -0.21 2.71 1.13 -0.94 0.66 117.35 117.30 2d42 s TYR 183 Ca 0.25 0.28 -0.03 0.00 -1.41 0.00 0.00 57.07 56.16 2d42 s TYR 183 Cb 0.03 0.19 -0.01 0.00 -1.10 0.00 0.00 41.96 41.07 2d42 s TYR 183 CO 0.08 -0.52 -0.06 1.03 -2.51 0.00 0.00 175.55 173.57 2d42 s ARG 184 N -2.08 3.36 0.16 -3.49 0.52 0.75 -1.63 118.95 116.54 2d42 s ARG 184 Ca -0.08 -0.64 -0.30 0.00 -0.52 0.00 0.00 55.73 54.19 2d42 s ARG 184 Cb -0.02 -2.96 -0.08 0.00 0.52 0.00 0.00 34.95 32.42 2d42 s ARG 184 CO 0.00 -0.17 1.21 0.99 0.02 0.00 0.00 175.30 177.35 2d42 s THR 185 N 1.39 3.63 0.45 0.02 2.01 -1.26 -1.26 115.64 120.61 2d42 s THR 185 Ca 0.05 1.33 0.04 0.00 0.31 0.00 0.00 61.69 63.42 2d42 s THR 185 Cb -0.14 -3.85 -0.05 0.00 0.01 0.00 0.00 72.50 68.47 2d42 s THR 185 CO -0.03 0.19 0.01 -0.76 -0.69 0.00 0.00 174.62 173.34 2d42 s LEU 186 N 0.02 2.57 0.79 4.42 1.43 0.89 -4.92 118.68 123.89 2d42 s LEU 186 Ca 0.54 -1.50 -0.12 0.00 -1.03 0.00 0.00 54.13 52.02 2d42 s LEU 186 Cb -0.32 -0.78 0.07 0.00 0.03 0.00 0.00 46.19 45.19 2d42 s LEU 186 CO 0.35 -0.64 1.14 -2.84 0.23 0.00 0.00 176.35 174.59 2d42 s PRO 187 N -3.79 1.89 -1.21 1.29 0.02 -1.26 -3.27 135.00 128.67 2d42 s PRO 187 Ca 0.22 1.47 -0.07 0.00 0.02 0.00 0.00 61.00 62.64 2d42 s PRO 187 Cb 0.06 -1.83 -0.02 0.00 0.02 0.00 0.00 34.50 32.73 2d42 s PRO 187 CO 0.11 -1.96 0.76 -0.25 -0.33 0.00 0.00 177.00 175.33 2d42 n ASP 188 N -3.41 -3.29 -3.90 2.53 8.00 -1.26 -2.92 116.55 112.30 2d42 n ASP 188 Ca 0.11 -0.86 -0.29 0.00 0.71 0.00 0.00 54.79 54.47 2d42 n ASP 188 Cb 0.52 -4.07 0.02 0.00 -0.02 0.00 0.00 41.12 37.57 2d42 n ASP 188 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2d42 n ASN 189 N -2.98 -3.83 -4.58 -2.24 3.02 -1.26 -4.98 115.26 98.40 2d42 n ASN 189 Ca -0.20 -0.81 -0.29 0.00 -0.03 0.00 0.00 54.58 53.24 2d42 n ASN 189 Cb 0.64 -3.79 -0.09 0.00 -0.61 0.00 0.00 39.78 35.93 2d42 n ASN 189 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2d42 s SER 190 N -3.55 3.63 0.08 6.41 1.04 -1.15 -5.02 113.70 115.14 2d42 s SER 190 Ca 0.52 -1.54 -0.27 0.00 0.48 0.00 0.00 55.95 55.14 2d42 s SER 190 Cb -0.26 0.16 0.08 0.00 0.10 0.00 0.00 66.02 66.11 2d42 s SER 190 CO 0.84 -0.71 0.97 -0.72 0.98 0.00 0.00 173.24 174.60 2d42 s TYR 191 N -2.93 -0.19 -0.03 5.02 -0.85 -1.26 -0.07 117.35 117.03 2d42 s TYR 191 Ca 0.21 -0.03 0.03 0.00 -0.52 0.00 0.00 57.07 56.76 2d42 s TYR 191 Cb 0.05 0.59 0.00 0.00 0.38 0.00 0.00 41.96 42.99 2d42 s TYR 191 CO 0.11 -0.67 -0.11 -0.08 -1.52 0.00 0.00 175.55 173.28 2d42 s THR 192 N -3.13 0.94 -0.11 -3.49 -1.32 -0.39 -4.89 115.64 103.25 2d42 s THR 192 Ca 0.10 -0.43 -0.05 0.00 -1.21 0.00 0.00 61.69 60.10 2d42 s THR 192 Cb -0.01 -0.84 -0.04 0.00 -1.51 0.00 0.00 72.50 70.11 2d42 s THR 192 CO -0.02 0.29 0.07 -0.70 -2.21 0.00 0.00 174.62 172.05 2d42 s GLU 193 N 0.26 3.31 -0.29 7.08 2.12 -1.26 -0.18 118.70 129.74 2d42 s GLU 193 Ca -0.05 -0.27 -0.01 0.00 0.36 0.00 0.00 54.97 54.99 2d42 s GLU 193 Cb -0.10 -3.03 0.05 0.00 0.26 0.00 0.00 34.13 31.31 2d42 s GLU 193 CO 0.01 0.69 -0.02 0.42 -0.54 0.00 0.00 175.26 175.82 2d42 s ILE 194 N -0.80 2.92 -0.25 -3.70 1.09 0.21 -4.96 121.20 115.71 2d42 s ILE 194 Ca 0.13 -1.35 -0.11 0.00 -1.10 0.00 0.00 60.65 58.22 2d42 s ILE 194 Cb -0.12 -2.65 -0.05 0.00 -1.06 0.00 0.00 42.46 38.58 2d42 s ILE 194 CO 0.03 -0.06 0.19 -0.69 -0.10 0.00 0.00 174.94 174.31 2d42 s VAL 195 N 1.25 5.33 -0.06 2.92 1.01 -1.26 -1.13 120.40 128.46 2d42 s VAL 195 Ca -0.05 0.22 0.06 0.00 0.00 0.00 0.00 61.98 62.21 2d42 s VAL 195 Cb -0.19 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 2d42 s VAL 195 CO -0.02 0.31 -0.24 -1.58 0.00 0.00 0.00 175.10 173.58 2d42 s GLN 196 N 1.25 2.60 -0.25 2.72 0.74 -0.26 -5.00 119.66 121.47 2d42 s GLN 196 Ca 0.08 -0.88 -0.08 0.00 0.05 0.00 0.00 55.36 54.54 2d42 s GLN 196 Cb -0.14 -2.21 -0.03 0.00 1.10 0.00 0.00 33.01 31.73 2d42 s GLN 196 CO 0.06 0.39 0.08 0.50 -0.55 0.00 0.00 175.29 175.77 2d42 s ARG 197 N -0.17 3.69 0.09 1.67 3.52 -1.26 -0.84 118.95 125.66 2d42 s ARG 197 Ca -0.03 -0.46 0.07 0.00 -0.13 0.00 0.00 55.73 55.18 2d42 s ARG 197 Cb -0.14 -3.36 -0.04 0.00 -1.56 0.00 0.00 34.95 29.85 2d42 s ARG 197 CO 0.04 -0.19 -0.13 0.14 -0.81 0.00 0.00 175.30 174.35 2d42 s VAL 198 N 1.63 3.18 0.05 7.11 -7.23 -0.50 -4.95 120.40 119.69 2d42 s VAL 198 Ca 0.06 -1.28 -0.27 0.00 -1.81 0.00 0.00 61.98 58.69 2d42 s VAL 198 Cb -0.15 -2.46 -0.05 0.00 0.56 0.00 0.00 36.38 34.28 2d42 s VAL 198 CO 0.05 0.16 0.83 0.21 -0.31 0.00 0.00 175.10 176.03 2d42 s ASN 199 N -2.04 7.28 0.58 4.85 3.84 -1.26 -0.51 114.94 127.68 2d42 s ASN 199 Ca 0.19 1.54 0.27 0.00 0.21 0.00 0.00 52.86 55.07 2d42 s ASN 199 Cb -0.11 -2.50 1.68 0.00 -0.55 0.00 0.00 41.25 39.76 2d42 s ASN 199 CO 0.11 -0.04 2.20 -0.29 -2.79 0.00 0.00 177.10 176.30 2d42 h ILE 200 N 4.19 0.61 -0.05 -5.21 6.09 -1.57 -1.30 117.51 120.27 2d42 h ILE 200 Ca -0.43 0.00 -0.10 0.00 -1.37 0.00 0.00 64.86 62.96 2d42 h ILE 200 Cb 1.21 0.96 -0.01 0.00 0.47 0.00 0.00 36.82 39.45 2d42 h ILE 200 CO 0.72 0.00 -0.42 0.16 -3.07 0.00 0.00 178.15 175.53 2d42 h ILE 201 N 0.00 1.31 -0.00 2.19 3.07 -1.89 -1.97 117.51 120.22 2d42 h ILE 201 Ca 0.02 -1.51 -0.16 0.00 1.55 0.00 0.00 64.86 64.76 2d42 h ILE 201 Cb 0.12 1.75 -0.02 0.00 -0.27 0.00 0.00 36.82 38.40 2d42 h ILE 201 CO -0.00 0.44 -0.75 0.44 -1.05 0.00 0.00 178.15 177.23 2d42 h ASP 202 N 0.09 0.05 -0.08 2.16 3.32 -1.64 -1.67 116.42 118.67 2d42 h ASP 202 Ca 0.01 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 2d42 h ASP 202 Cb 0.79 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.32 2d42 h ASP 202 CO 0.06 0.78 -0.01 0.58 -1.72 0.00 0.00 179.24 178.93 2d42 h VAL 203 N 0.03 1.28 -0.73 -1.35 2.07 -1.26 -0.42 116.25 115.86 2d42 h VAL 203 Ca -0.01 -0.90 -0.05 0.00 0.82 0.00 0.00 66.70 66.56 2d42 h VAL 203 Cb 1.32 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 32.80 2d42 h VAL 203 CO 0.10 0.25 0.26 -0.07 0.02 0.00 0.00 177.57 178.13 2d42 h LEU 204 N -0.18 1.04 -0.29 2.57 3.38 -1.36 0.13 115.31 120.60 2d42 h LEU 204 Ca 0.02 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 2d42 h LEU 204 Cb 0.40 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2d42 h LEU 204 CO 0.01 0.95 -0.04 -0.61 0.09 0.00 0.00 178.44 178.83 2d42 h GLN 205 N 1.07 0.54 -0.60 1.13 4.15 -1.27 -0.25 115.11 119.88 2d42 h GLN 205 Ca 0.24 -0.19 -0.07 0.00 0.77 0.00 0.00 58.65 59.40 2d42 h GLN 205 Cb 0.26 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.89 2d42 h GLN 205 CO -0.01 0.72 0.10 0.00 -1.93 0.00 0.00 178.83 177.71 2d42 h ALA 206 N 0.80 0.79 0.00 3.38 0.00 -0.85 -2.80 119.26 120.59 2d42 h ALA 206 Ca 0.08 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2d42 h ALA 206 Cb 0.51 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2d42 h ALA 206 CO 0.02 0.54 0.00 -0.91 0.00 0.00 0.00 179.25 178.90 2d42 h ASN 207 N 0.89 0.00 -0.62 0.00 2.35 -0.68 -3.47 115.58 114.05 2d42 h ASN 207 Ca 0.18 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.73 2d42 h ASN 207 Cb 0.41 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.71 2d42 h ASN 207 CO 0.01 0.00 -0.19 0.61 -1.65 0.00 0.00 177.43 176.21 2d42 n GLY 208 N 0.61 0.93 3.66 2.83 0.00 -0.15 -4.91 105.19 108.17 2d42 n GLY 208 Ca 0.03 -0.57 -0.56 0.00 0.00 0.00 0.00 46.02 44.92 2d42 n GLY 208 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2d42 n THR 209 N -2.94 0.17 -2.07 2.61 -1.04 -0.95 -4.91 114.28 105.16 2d42 n THR 209 Ca -0.10 -0.03 -0.37 0.00 -2.04 0.00 0.00 64.05 61.51 2d42 n THR 209 Cb 0.36 -1.02 0.02 0.00 -1.82 0.00 0.00 70.33 67.87 2d42 n THR 209 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2d42 s PRO 210 N 2.27 3.33 0.00 -2.82 0.02 -1.26 -3.93 135.00 132.61 2d42 s PRO 210 Ca 0.93 1.88 0.00 0.00 0.02 0.00 0.00 61.00 63.83 2d42 s PRO 210 Cb -1.04 -2.19 0.00 0.00 0.02 0.00 0.00 34.50 31.29 2d42 s PRO 210 CO 0.59 -0.93 0.00 0.41 -0.33 0.00 0.00 177.00 176.74 2d42 n GLY 211 N 0.50 0.77 3.22 0.52 0.00 -1.26 -5.02 105.19 103.92 2d42 n GLY 211 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 2d42 n GLY 211 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2d42 s PHE 212 N -2.20 1.54 -0.07 1.61 0.08 -1.25 -1.25 117.98 116.44 2d42 s PHE 212 Ca 0.00 -0.40 0.04 0.00 0.12 0.00 0.00 56.93 56.69 2d42 s PHE 212 Cb 0.00 -0.88 0.00 0.00 -0.57 0.00 0.00 43.02 41.57 2d42 s PHE 212 CO 0.00 0.11 -0.20 0.95 -0.10 0.00 0.00 175.22 175.98 2d42 s THR 213 N -1.01 1.71 -0.09 0.64 -4.23 -0.76 -4.96 115.64 106.94 2d42 s THR 213 Ca 0.04 -0.84 -0.06 0.00 -1.18 0.00 0.00 61.69 59.65 2d42 s THR 213 Cb -0.09 -1.48 -0.04 0.00 1.34 0.00 0.00 72.50 72.23 2d42 s THR 213 CO 0.02 0.48 0.13 -0.63 -0.54 0.00 0.00 174.62 174.09 2d42 s ILE 214 N 0.24 5.35 -0.37 2.99 -1.09 -1.26 -0.61 121.20 126.44 2d42 s ILE 214 Ca -0.12 0.08 0.01 0.00 -2.23 0.00 0.00 60.65 58.40 2d42 s ILE 214 Cb -0.15 -3.36 0.11 0.00 -1.58 0.00 0.00 42.46 37.49 2d42 s ILE 214 CO 0.05 0.56 0.15 -0.55 -1.23 0.00 0.00 174.94 173.92 2d42 s SER 215 N -1.19 3.98 0.21 3.58 0.15 -0.03 -4.95 113.70 115.44 2d42 s SER 215 Ca 0.17 -2.13 -0.10 0.00 0.70 0.00 0.00 55.95 54.59 2d42 s SER 215 Cb -0.12 -1.05 0.20 0.00 -1.71 0.00 0.00 66.02 63.34 2d42 s SER 215 CO 0.07 -0.35 1.84 0.11 1.20 0.00 0.00 173.24 176.11 2d42 h LYS 216 N 7.45 0.80 -0.61 5.44 6.56 -1.96 0.22 116.57 134.46 2d42 h LYS 216 Ca -0.07 -0.05 0.08 0.00 -1.06 0.00 0.00 60.65 59.55 2d42 h LYS 216 Cb 0.98 -0.18 -0.11 0.00 -0.57 0.00 0.00 32.23 32.35 2d42 h LYS 216 CO 0.49 0.53 -0.48 0.93 -2.06 0.00 0.00 179.45 178.86 2d42 h GLU 217 N 0.82 -0.22 -0.12 3.15 3.07 -1.94 0.20 114.58 119.54 2d42 h GLU 217 Ca 0.28 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 2d42 h GLU 217 Cb 0.05 0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 2d42 h GLU 217 CO -0.12 -0.14 0.00 1.04 -1.40 0.00 0.00 179.01 178.39 2d42 n GLN 218 N -5.38 1.70 -3.79 2.33 6.02 -1.01 -4.94 117.38 112.31 2d42 n GLN 218 Ca 0.01 -1.05 -0.23 0.00 -0.01 0.00 0.00 57.00 55.72 2d42 n GLN 218 Cb 0.34 -1.42 0.02 0.00 1.02 0.00 0.00 30.24 30.20 2d42 n GLN 218 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2d42 n ASN 219 N 0.27 -1.04 -3.77 1.08 5.15 0.73 -4.96 115.26 112.71 2d42 n ASN 219 Ca 0.17 -0.88 -0.09 0.00 -0.60 0.00 0.00 54.58 53.18 2d42 n ASN 219 Cb 0.33 -3.74 -0.04 0.00 -0.53 0.00 0.00 39.78 35.81 2d42 n ASN 219 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2d42 s ARG 220 N -6.18 1.44 -0.04 1.20 1.70 -0.92 -4.77 118.95 111.37 2d42 s ARG 220 Ca 0.03 -0.90 0.06 0.00 -0.47 0.00 0.00 55.73 54.45 2d42 s ARG 220 Cb -0.02 0.53 -0.01 0.00 -0.57 0.00 0.00 34.95 34.88 2d42 s ARG 220 CO 0.84 -0.62 -0.23 0.00 -1.08 0.00 0.00 175.30 174.21 2d42 s ALA 221 N -3.89 1.95 -0.25 7.88 0.00 -0.03 -0.85 121.76 126.57 2d42 s ALA 221 Ca 0.10 -0.96 -0.10 0.00 0.00 0.00 0.00 51.96 51.01 2d42 s ALA 221 Cb -0.01 -0.58 -0.05 0.00 0.00 0.00 0.00 23.12 22.48 2d42 s ALA 221 CO -0.01 0.41 0.14 0.71 0.00 0.00 0.00 175.76 177.01 2d42 s TYR 222 N -0.25 3.23 -0.09 0.00 1.51 0.22 -0.49 117.35 121.48 2d42 s TYR 222 Ca 0.00 0.05 -0.10 0.00 -1.01 0.00 0.00 57.07 56.02 2d42 s TYR 222 Cb -0.12 -2.28 -0.05 0.00 -0.11 0.00 0.00 41.96 39.41 2d42 s TYR 222 CO 0.02 -0.08 0.23 0.12 -1.11 0.00 0.00 175.55 174.73 2d42 s PHE 223 N 1.33 3.62 -0.17 2.71 5.36 -0.38 -1.82 117.98 128.62 2d42 s PHE 223 Ca 0.07 0.67 -0.00 0.00 -0.96 0.00 0.00 56.93 56.70 2d42 s PHE 223 Cb -0.15 -2.08 0.04 0.00 -0.34 0.00 0.00 43.02 40.50 2d42 s PHE 223 CO 0.06 0.66 -0.05 0.99 -1.46 0.00 0.00 175.22 175.42 2d42 s THR 224 N -0.88 1.15 0.00 0.12 2.01 -0.38 -2.86 115.64 114.79 2d42 s THR 224 Ca 0.17 -0.68 0.00 0.00 0.31 0.00 0.00 61.69 61.50 2d42 s THR 224 Cb -0.13 -1.33 0.00 0.00 0.01 0.00 0.00 72.50 71.05 2d42 s THR 224 CO 0.07 0.11 0.00 0.61 -0.69 0.00 0.00 174.62 174.72 2d42 n GLY 225 N 4.86 6.33 3.23 4.40 0.00 0.30 -4.77 105.19 119.53 2d42 n GLY 225 Ca -0.12 -2.07 -0.13 0.00 0.00 0.00 0.00 46.02 43.70 2d42 n GLY 225 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2d42 s GLU 226 N -0.19 0.66 0.00 1.61 2.12 -0.73 -1.10 118.70 121.07 2d42 s GLU 226 Ca 0.00 -0.21 0.00 0.00 0.36 0.00 0.00 54.97 55.12 2d42 s GLU 226 Cb 0.00 0.29 0.00 0.00 0.26 0.00 0.00 34.13 34.68 2d42 s GLU 226 CO 0.00 -0.18 0.00 0.41 -0.54 0.00 0.00 175.26 174.95 2d42 n GLY 227 N 1.27 3.59 3.26 -1.50 0.00 -0.51 -0.64 105.19 110.67 2d42 n GLY 227 Ca -0.22 -0.92 -0.10 0.00 0.00 0.00 0.00 46.02 44.78 2d42 n GLY 227 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2d42 s THR 228 N -2.42 0.10 0.02 2.61 -4.23 -0.75 -0.96 115.64 110.01 2d42 s THR 228 Ca 0.00 -0.81 -0.07 0.00 -1.18 0.00 0.00 61.69 59.63 2d42 s THR 228 Cb 0.00 -1.17 -0.00 0.00 1.34 0.00 0.00 72.50 72.67 2d42 s THR 228 CO 0.00 -0.45 0.14 0.27 -0.54 0.00 0.00 174.62 174.04 2d42 s ILE 229 N -3.49 0.10 0.01 2.99 -4.36 0.29 -1.24 121.20 115.49 2d42 s ILE 229 Ca 0.02 -0.82 -0.16 0.00 -0.26 0.00 0.00 60.65 59.42 2d42 s ILE 229 Cb 0.02 -0.62 0.03 0.00 1.25 0.00 0.00 42.46 43.14 2d42 s ILE 229 CO -0.09 -0.45 0.35 -0.94 0.24 0.00 0.00 174.94 174.05 2d42 s SER 230 N -1.68 -0.22 0.00 4.36 1.04 0.74 -0.49 113.70 117.45 2d42 s SER 230 Ca -0.11 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.37 2d42 s SER 230 Cb -0.05 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.43 2d42 s SER 230 CO -0.01 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.28 2d42 n GLY 231 N 0.93 -1.35 3.14 7.32 0.00 -0.72 0.99 105.19 115.52 2d42 n GLY 231 Ca -0.20 -1.02 -0.11 0.00 0.00 0.00 0.00 46.02 44.69 2d42 n GLY 231 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2d42 s GLN 232 N -1.02 0.76 -0.13 1.61 -0.21 -0.27 -1.25 119.66 119.15 2d42 s GLN 232 Ca 0.00 -1.19 -0.22 0.00 0.02 0.00 0.00 55.36 53.96 2d42 s GLN 232 Cb 0.00 -0.24 0.05 0.00 1.00 0.00 0.00 33.01 33.83 2d42 s GLN 232 CO 0.00 0.00 0.56 0.96 -2.12 0.00 0.00 175.29 174.69 2d42 s ILE 233 N -3.05 0.01 0.00 1.08 -4.36 -0.48 -4.04 121.20 110.36 2d42 s ILE 233 Ca 0.06 -0.08 -0.30 0.00 -0.26 0.00 0.00 60.65 60.07 2d42 s ILE 233 Cb 0.01 -0.83 -0.04 0.00 1.25 0.00 0.00 42.46 42.85 2d42 s ILE 233 CO -0.03 -0.04 1.17 -0.83 0.24 0.00 0.00 174.94 175.44 2d42 s GLY 234 N -0.40 2.36 -0.24 6.27 0.00 -1.26 -0.11 107.32 113.93 2d42 s GLY 234 Ca -0.05 0.71 -0.06 0.00 0.00 0.00 0.00 44.72 45.32 2d42 s GLY 234 CO 0.04 2.06 -0.16 1.04 0.00 0.00 0.00 173.10 176.08 2d42 n LEU 235 N 4.44 2.54 -3.72 0.66 4.77 0.76 -4.92 117.00 121.52 2d42 n LEU 235 Ca 0.09 0.09 -0.06 0.00 -0.03 0.00 0.00 56.01 56.11 2d42 n LEU 235 Cb 0.47 -0.91 -0.02 0.00 -2.33 0.00 0.00 43.42 40.63 2d42 n LEU 235 CO 0.55 0.77 0.63 0.00 -1.33 0.00 0.00 177.39 178.01 2d42 s GLN 236 N -2.51 1.29 0.21 3.23 -2.07 -1.23 -5.01 119.66 113.57 2d42 s GLN 236 Ca -0.34 -0.68 0.09 0.00 -1.82 0.00 0.00 55.36 52.61 2d42 s GLN 236 Cb 0.10 0.47 -0.05 0.00 -1.09 0.00 0.00 33.01 32.44 2d42 s GLN 236 CO 0.59 -0.59 -0.17 0.95 -1.32 0.00 0.00 175.29 174.75 2d42 s THR 237 N -3.45 1.92 0.01 3.63 -4.23 -1.26 -0.89 115.64 111.36 2d42 s THR 237 Ca 0.10 -2.16 0.01 0.00 -1.18 0.00 0.00 61.69 58.46 2d42 s THR 237 Cb -0.02 -2.04 -0.01 0.00 1.34 0.00 0.00 72.50 71.77 2d42 s THR 237 CO 0.01 -0.47 -0.04 -0.36 -0.54 0.00 0.00 174.62 173.22 2d42 s PHE 238 N -2.59 0.36 -0.20 3.99 0.40 0.28 -4.99 117.98 115.24 2d42 s PHE 238 Ca 0.22 -0.20 0.01 0.00 -0.60 0.00 0.00 56.93 56.36 2d42 s PHE 238 Cb -0.03 -0.23 0.03 0.00 0.51 0.00 0.00 43.02 43.30 2d42 s PHE 238 CO 0.08 -0.04 -0.18 0.42 0.70 0.00 0.00 175.22 176.20 2d42 s ILE 239 N -0.49 2.13 -0.12 0.64 1.01 -1.26 -0.37 121.20 122.73 2d42 s ILE 239 Ca -0.03 -1.05 0.01 0.00 0.00 0.00 0.00 60.65 59.58 2d42 s ILE 239 Cb -0.04 -1.96 -0.01 0.00 0.01 0.00 0.00 42.46 40.46 2d42 s ILE 239 CO -0.00 0.43 -0.15 -1.81 0.00 0.00 0.00 174.94 173.41 2d42 s ASP 240 N 1.26 3.86 -0.20 3.58 1.01 -0.51 -4.94 116.67 120.74 2d42 s ASP 240 Ca 0.03 -0.36 -0.01 0.00 0.71 0.00 0.00 52.55 52.91 2d42 s ASP 240 Cb -0.14 -1.56 0.00 0.00 1.01 0.00 0.00 42.92 42.23 2d42 s ASP 240 CO -0.11 0.17 -0.12 -0.69 0.21 0.00 0.00 175.17 174.62 2d42 s VAL 241 N 0.32 2.74 -0.28 -1.27 1.01 -1.26 -0.84 120.40 120.82 2d42 s VAL 241 Ca -0.12 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.05 2d42 s VAL 241 Cb -0.16 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 2d42 s VAL 241 CO 0.06 0.48 0.17 -0.69 0.00 0.00 0.00 175.10 175.12 2d42 s VAL 242 N 1.31 5.04 -0.18 2.92 1.01 -0.51 -4.90 120.40 125.09 2d42 s VAL 242 Ca 0.04 -0.00 -0.06 0.00 0.00 0.00 0.00 61.98 61.96 2d42 s VAL 242 Cb -0.14 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 2d42 s VAL 242 CO -0.07 0.22 0.02 -0.63 0.00 0.00 0.00 175.10 174.64 2d42 s ILE 243 N 1.71 4.38 0.03 2.22 1.01 -1.26 -1.00 121.20 128.29 2d42 s ILE 243 Ca 0.07 -0.18 -0.10 0.00 0.00 0.00 0.00 60.65 60.44 2d42 s ILE 243 Cb -0.16 -2.96 0.01 0.00 0.01 0.00 0.00 42.46 39.36 2d42 s ILE 243 CO 0.09 0.46 0.20 -1.83 0.00 0.00 0.00 174.94 173.87 2d42 s GLU 244 N 0.47 0.65 0.49 2.79 -1.05 -0.55 -4.97 118.70 116.54 2d42 s GLU 244 Ca 0.00 -0.52 -0.21 0.00 -0.15 0.00 0.00 54.97 54.09 2d42 s GLU 244 Cb -0.13 0.27 -0.07 0.00 -0.44 0.00 0.00 34.13 33.76 2d42 s GLU 244 CO 0.02 -0.18 1.10 -1.25 0.95 0.00 0.00 175.26 175.89 2d42 s PRO 245 N -2.16 3.69 0.35 -4.83 0.04 -1.26 -0.32 135.00 130.51 2d42 s PRO 245 Ca -0.08 1.55 -0.22 0.00 0.04 0.00 0.00 61.00 62.29 2d42 s PRO 245 Cb -0.03 -2.19 -0.10 0.00 0.04 0.00 0.00 34.50 32.22 2d42 s PRO 245 CO -0.02 -0.56 0.89 -0.51 0.04 0.00 0.00 177.00 176.85 2d42 s LEU 246 N -3.38 4.17 -0.19 -3.56 1.43 0.77 -4.82 118.68 113.10 2d42 s LEU 246 Ca 0.67 1.67 -0.40 0.00 -1.03 0.00 0.00 54.13 55.04 2d42 s LEU 246 Cb -0.22 -4.15 -0.19 0.00 0.03 0.00 0.00 46.19 41.66 2d42 s LEU 246 CO 0.26 -0.17 1.20 -2.65 0.23 0.00 0.00 176.35 175.22 2d42 n PRO 247 N 0.06 0.00 -0.38 1.29 -0.02 -1.26 -1.76 135.00 132.93 2d42 n PRO 247 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 2d42 n PRO 247 Cb 0.52 -1.40 0.00 0.00 -0.02 0.00 0.00 33.50 32.60 2d42 n PRO 247 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2d42 n GLY 248 N 2.34 0.83 3.43 -1.23 0.00 -1.26 -5.07 105.19 104.23 2d42 n GLY 248 Ca 0.23 -0.39 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 2d42 n GLY 248 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2d42 s HIS 249 N -2.00 0.78 0.00 1.61 3.76 -0.72 -5.20 115.29 113.52 2d42 s HIS 249 Ca 0.00 -1.06 0.00 0.00 -0.15 0.00 0.00 55.06 53.85 2d42 s HIS 249 Cb 0.00 -0.13 0.00 0.00 1.11 0.00 0.00 32.58 33.56 2d42 s HIS 249 CO 0.00 -0.90 0.00 0.00 -0.85 0.00 0.00 174.74 172.99