#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sdo s ARG 2 N 0.00 0.68 -0.11 0.03 1.70 -0.25 -3.56 118.95 117.44 1sdo s ARG 2 Ca 0.00 -0.88 -0.20 0.00 -0.47 0.00 0.00 55.73 54.18 1sdo s ARG 2 Cb 0.00 -0.53 -0.04 0.00 -0.57 0.00 0.00 34.95 33.81 1sdo s ARG 2 CO 0.00 0.11 0.53 0.42 -1.08 0.00 0.00 175.30 175.28 1sdo s ILE 3 N -1.47 5.15 -0.17 4.99 1.01 -1.26 -1.47 121.20 127.98 1sdo s ILE 3 Ca -0.05 1.08 0.01 0.00 0.00 0.00 0.00 60.65 61.69 1sdo s ILE 3 Cb -0.09 -3.87 -0.11 0.00 0.01 0.00 0.00 42.46 38.40 1sdo s ILE 3 CO 0.01 0.30 -0.15 0.52 0.00 0.00 0.00 174.94 175.62 1sdo n VAL 4 N 3.72 0.97 -4.10 2.92 0.31 -0.02 -4.96 118.33 117.17 1sdo n VAL 4 Ca -0.05 -0.37 -0.14 0.00 -0.01 0.00 0.00 64.34 63.77 1sdo n VAL 4 Cb 0.51 -1.12 -0.12 0.00 -0.91 0.00 0.00 33.84 32.20 1sdo n VAL 4 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1sdo s GLU 5 N -2.34 0.56 -0.02 5.55 0.41 -1.10 -5.01 118.70 116.76 1sdo s GLU 5 Ca -0.23 -0.70 0.00 0.00 -0.41 0.00 0.00 54.97 53.64 1sdo s GLU 5 Cb 0.06 -0.40 0.03 0.00 -1.78 0.00 0.00 34.13 32.04 1sdo s GLU 5 CO 0.39 0.08 0.02 0.08 -0.49 0.00 0.00 175.26 175.34 1sdo s VAL 6 N -1.16 0.03 -0.14 2.63 1.01 -1.26 -0.77 120.40 120.73 1sdo s VAL 6 Ca -0.07 0.17 0.01 0.00 0.00 0.00 0.00 61.98 62.09 1sdo s VAL 6 Cb -0.09 -0.15 0.02 0.00 0.00 0.00 0.00 36.38 36.16 1sdo s VAL 6 CO 0.01 0.11 -0.16 -0.47 0.00 0.00 0.00 175.10 174.58 1sdo s TYR 7 N 1.03 2.26 -0.39 5.22 5.04 0.37 -4.96 117.35 125.93 1sdo s TYR 7 Ca -0.09 -1.20 -0.17 0.00 -2.44 0.00 0.00 57.07 53.16 1sdo s TYR 7 Cb -0.13 -1.62 0.01 0.00 0.35 0.00 0.00 41.96 40.57 1sdo s TYR 7 CO -0.02 -0.62 0.46 0.45 -1.34 0.00 0.00 175.55 174.48 1sdo s SER 8 N 1.21 6.23 -0.26 4.32 0.15 -1.26 -0.78 113.70 123.31 1sdo s SER 8 Ca -0.00 -0.38 -0.14 0.00 0.70 0.00 0.00 55.95 56.12 1sdo s SER 8 Cb -0.14 -2.24 -0.04 0.00 -1.71 0.00 0.00 66.02 61.89 1sdo s SER 8 CO -0.07 -0.52 0.33 -2.28 1.20 0.00 0.00 173.24 171.90 1sdo s HIS 9 N 2.25 3.27 -1.58 3.44 2.46 0.62 -4.04 115.29 121.71 1sdo s HIS 9 Ca 0.15 0.39 -0.04 0.00 0.47 0.00 0.00 55.06 56.02 1sdo s HIS 9 Cb -0.16 -2.51 0.01 0.00 -0.13 0.00 0.00 32.58 29.79 1sdo s HIS 9 CO 0.14 -0.16 0.57 1.28 -2.47 0.00 0.00 174.74 174.10 1sdo n LEU 10 N 5.06 -2.63 -2.92 8.88 4.77 -1.26 -1.73 117.00 127.16 1sdo n LEU 10 Ca -0.10 -0.27 -0.21 0.00 -0.03 0.00 0.00 56.01 55.40 1sdo n LEU 10 Cb 0.51 -2.98 0.01 0.00 -2.33 0.00 0.00 43.42 38.64 1sdo n LEU 10 CO 0.37 0.20 -0.08 0.59 -1.33 0.00 0.00 177.39 177.14 1sdo n ASN 11 N -2.50 -5.14 -0.32 -1.43 3.02 -1.26 -4.85 115.26 102.79 1sdo n ASN 11 Ca -0.12 -0.19 -0.04 0.00 -0.03 0.00 0.00 54.58 54.20 1sdo n ASN 11 Cb 0.63 -4.22 0.08 0.00 -0.61 0.00 0.00 39.78 35.65 1sdo n ASN 11 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1sdo h GLY 12 N -0.85 1.22 0.97 7.41 0.00 -1.47 -2.00 103.07 108.35 1sdo h GLY 12 Ca -0.46 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 46.38 1sdo h GLY 12 CO 0.53 0.46 0.23 -2.00 0.00 0.00 0.00 176.54 175.76 1sdo h LEU 13 N 1.17 0.51 -1.32 3.11 5.85 -1.85 -2.29 115.31 120.48 1sdo h LEU 13 Ca 0.31 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 1sdo h LEU 13 Cb -0.10 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1sdo h LEU 13 CO -0.06 0.45 0.09 -0.33 -0.34 0.00 0.00 178.44 178.25 1sdo h GLU 14 N 0.53 0.55 -0.48 1.25 3.07 -1.89 -0.25 114.58 117.37 1sdo h GLU 14 Ca 0.14 -0.09 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1sdo h GLU 14 Cb 0.05 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.85 1sdo h GLU 14 CO -0.02 0.51 0.30 -0.92 -1.40 0.00 0.00 179.01 177.48 1sdo h TYR 15 N 0.54 0.62 -0.40 4.33 3.20 -0.93 -1.17 116.97 123.16 1sdo h TYR 15 Ca 0.13 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 1sdo h TYR 15 Cb 0.21 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 1sdo h TYR 15 CO 0.01 0.42 0.10 0.82 -1.64 0.00 0.00 178.16 177.87 1sdo h ILE 16 N 0.65 1.23 -0.38 1.81 2.04 -0.83 -1.39 117.51 120.64 1sdo h ILE 16 Ca 0.17 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.26 1sdo h ILE 16 Cb -0.04 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1sdo h ILE 16 CO -0.03 0.27 0.24 1.56 0.00 0.00 0.00 178.15 180.19 1sdo h GLN 17 N 0.51 0.50 0.00 2.37 4.20 -0.65 0.89 115.11 122.93 1sdo h GLN 17 Ca 0.13 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.77 1sdo h GLN 17 Cb 0.30 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.97 1sdo h GLN 17 CO 0.00 0.33 -0.20 0.28 -0.67 0.00 0.00 178.83 178.58 1sdo h VAL 18 N 0.51 1.14 0.00 -0.54 2.07 -1.10 -3.32 116.25 115.01 1sdo h VAL 18 Ca 0.14 -1.92 -0.21 0.00 0.82 0.00 0.00 66.70 65.52 1sdo h VAL 18 Cb -0.05 2.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 1sdo h VAL 18 CO -0.03 0.39 -1.30 0.45 0.02 0.00 0.00 177.57 177.10 1sdo h HIS 19 N -1.00 0.00 -1.81 1.57 3.86 -1.21 -3.41 115.15 113.16 1sdo h HIS 19 Ca -0.05 0.00 -0.46 0.00 -1.16 0.00 0.00 60.37 58.71 1sdo h HIS 19 Cb 0.77 0.00 -0.40 0.00 1.06 0.00 0.00 27.41 28.84 1sdo h HIS 19 CO 0.16 0.82 -1.20 1.28 0.86 0.00 0.00 177.93 179.85 1sdo n LEU 20 N -3.10 0.95 -0.22 2.43 4.77 0.30 -4.97 117.00 117.17 1sdo n LEU 20 Ca -0.08 -4.76 0.15 0.00 -0.03 0.00 0.00 56.01 51.29 1sdo n LEU 20 Cb 0.92 0.66 0.46 0.00 -2.33 0.00 0.00 43.42 43.14 1sdo n LEU 20 CO 0.44 2.15 1.22 1.55 -1.33 0.00 0.00 177.39 181.42 1sdo h PRO 21 N 3.00 0.49 -0.07 3.23 0.13 -1.46 -0.85 132.00 136.47 1sdo h PRO 21 Ca 0.06 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 65.14 1sdo h PRO 21 Cb 1.01 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 1sdo h PRO 21 CO 0.50 0.33 -0.05 1.12 -0.23 0.00 0.00 178.00 179.66 1sdo h HIS 22 N 0.51 0.10 -0.20 1.56 2.07 -1.92 -2.72 115.15 114.55 1sdo h HIS 22 Ca 0.42 -0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.89 1sdo h HIS 22 Cb 0.89 -0.03 -0.01 0.00 2.57 0.00 0.00 27.41 30.83 1sdo h HIS 22 CO -0.00 0.16 -0.05 0.82 -3.07 0.00 0.00 177.93 175.79 1sdo h ILE 23 N 0.10 1.29 -0.73 6.12 1.08 -1.49 -1.51 117.51 122.37 1sdo h ILE 23 Ca 0.02 -1.05 -0.01 0.00 -0.39 0.00 0.00 64.86 63.44 1sdo h ILE 23 Cb 0.17 1.56 -0.03 0.00 -3.07 0.00 0.00 36.82 35.44 1sdo h ILE 23 CO 0.01 0.32 0.41 -0.25 -0.69 0.00 0.00 178.15 177.94 1sdo h TRP 24 N 0.11 1.00 -0.41 1.37 -0.00 -1.53 0.45 115.95 116.94 1sdo h TRP 24 Ca 0.05 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 58.91 1sdo h TRP 24 Cb 0.51 -0.32 -0.02 0.00 -0.00 0.00 0.00 29.16 29.33 1sdo h TRP 24 CO 0.05 0.70 0.20 0.93 -0.00 0.00 0.00 178.44 180.33 1sdo h GLU 25 N 1.01 0.58 -0.25 2.65 4.39 -1.44 -2.15 114.58 119.37 1sdo h GLU 25 Ca 0.26 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 59.86 1sdo h GLU 25 Cb 0.02 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.56 1sdo h GLU 25 CO -0.04 0.50 0.10 1.49 -1.16 0.00 0.00 179.01 179.90 1sdo h GLU 26 N 0.52 0.38 -0.72 2.33 4.81 -0.86 -1.59 114.58 119.45 1sdo h GLU 26 Ca 0.14 -0.07 0.06 0.00 -0.13 0.00 0.00 59.36 59.36 1sdo h GLU 26 Cb 0.10 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.37 1sdo h GLU 26 CO -0.02 0.41 0.42 0.82 -0.73 0.00 0.00 179.01 179.91 1sdo h ILE 27 N 0.26 1.00 -0.67 2.32 2.04 -0.83 0.63 117.51 122.25 1sdo h ILE 27 Ca 0.09 -0.27 -0.05 0.00 1.00 0.00 0.00 64.86 65.63 1sdo h ILE 27 Cb 0.17 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.38 1sdo h ILE 27 CO -0.01 0.14 0.24 1.56 0.00 0.00 0.00 178.15 180.08 1sdo h GLN 28 N 0.77 1.03 -0.49 2.37 4.20 -1.16 -2.38 115.11 119.46 1sdo h GLN 28 Ca 0.32 -0.20 -0.13 0.00 0.06 0.00 0.00 58.65 58.70 1sdo h GLN 28 Cb 0.17 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 1sdo h GLN 28 CO -0.17 0.87 -0.19 0.93 -0.67 0.00 0.00 178.83 179.60 1sdo h GLU 29 N 0.97 0.98 -0.28 1.46 5.08 -0.55 -2.50 114.58 119.73 1sdo h GLU 29 Ca 0.22 -0.40 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1sdo h GLU 29 Cb 0.25 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1sdo h GLU 29 CO -0.01 1.08 0.18 0.82 -1.00 0.00 0.00 179.01 180.08 1sdo h ILE 30 N 0.85 1.07 -0.31 3.13 2.04 -0.76 -1.01 117.51 122.53 1sdo h ILE 30 Ca 0.12 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.86 1sdo h ILE 30 Cb 0.77 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 1sdo h ILE 30 CO 0.06 0.07 0.16 0.40 0.00 0.00 0.00 178.15 178.85 1sdo h ILE 31 N 0.38 1.01 -0.93 -0.67 2.04 -1.34 -2.28 117.51 115.72 1sdo h ILE 31 Ca 0.10 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.89 1sdo h ILE 31 Cb -0.04 0.64 -0.06 0.00 -0.74 0.00 0.00 36.82 36.62 1sdo h ILE 31 CO -0.02 0.06 0.61 0.58 0.00 0.00 0.00 178.15 179.38 1sdo h VAL 32 N 0.34 1.13 0.00 1.67 2.07 -1.18 -1.12 116.25 119.16 1sdo h VAL 32 Ca 0.13 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1sdo h VAL 32 Cb 0.02 -0.11 -0.00 0.00 -1.52 0.00 0.00 31.29 29.68 1sdo h VAL 32 CO -0.07 0.21 -0.10 0.77 0.02 0.00 0.00 177.57 178.39 1sdo h SER 33 N 1.13 0.00 -2.78 0.57 4.64 -0.62 -2.35 113.55 114.14 1sdo h SER 33 Ca 0.38 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 61.17 1sdo h SER 33 Cb 0.08 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.19 1sdo h SER 33 CO -0.13 0.10 0.92 -0.63 -0.87 0.00 0.00 176.83 176.22 1sdo s ILE 34 N -3.79 3.11 -0.84 0.95 -1.09 -0.94 -4.77 121.20 113.84 1sdo s ILE 34 Ca -0.00 0.64 -0.18 0.00 -2.23 0.00 0.00 60.65 58.88 1sdo s ILE 34 Cb 0.10 -3.41 0.15 0.00 -1.58 0.00 0.00 42.46 37.73 1sdo s ILE 34 CO 0.58 0.01 0.96 -0.62 -1.23 0.00 0.00 174.94 174.64 1sdo s ASP 35 N 1.96 6.59 0.46 3.58 -1.08 -1.26 0.06 116.67 126.98 1sdo s ASP 35 Ca 0.70 -2.10 0.13 0.00 -0.52 0.00 0.00 52.55 50.76 1sdo s ASP 35 Cb -0.39 -2.33 1.05 0.00 -1.46 0.00 0.00 42.92 39.79 1sdo s ASP 35 CO 0.31 -0.95 2.05 0.00 0.52 0.00 0.00 175.17 177.10 1sdo h ALA 36 N 8.61 1.78 -0.47 3.66 0.00 -1.92 -2.77 119.26 128.16 1sdo h ALA 36 Ca 0.06 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1sdo h ALA 36 Cb 1.04 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 1sdo h ALA 36 CO 1.01 0.17 0.15 0.93 0.00 0.00 0.00 179.25 181.51 1sdo h GLU 37 N 0.11 0.31 0.00 0.00 5.08 -1.94 -0.27 114.58 117.87 1sdo h GLU 37 Ca 0.03 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1sdo h GLU 37 Cb 0.16 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1sdo h GLU 37 CO 0.01 0.21 0.00 0.00 -1.00 0.00 0.00 179.01 178.22 1sdo n ALA 38 N -2.42 1.36 0.60 3.43 0.00 -1.04 -1.15 120.51 121.30 1sdo n ALA 38 Ca 0.04 -0.03 0.09 0.00 0.00 0.00 0.00 53.44 53.55 1sdo n ALA 38 Cb 0.19 -1.11 0.11 0.00 0.00 0.00 0.00 19.45 18.63 1sdo n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sdo n ARG 40 N 1.06 1.91 -2.10 0.00 0.63 -0.30 -0.80 116.66 117.07 1sdo n ARG 40 Ca 0.12 -0.93 -0.41 0.00 -0.92 0.00 0.00 57.85 55.71 1sdo n ARG 40 Cb 0.48 -1.94 -0.00 0.00 0.45 0.00 0.00 32.46 31.45 1sdo n ARG 40 CO 0.00 0.00 0.00 -2.37 -2.51 0.00 0.00 177.63 172.75 1sdo n THR 41 N 2.45 4.96 -2.30 5.15 5.66 -1.26 -4.67 114.28 124.27 1sdo n THR 41 Ca 0.40 -4.35 -0.42 0.00 -3.05 0.00 0.00 64.05 56.63 1sdo n THR 41 Cb 0.88 -2.17 0.00 0.00 -1.55 0.00 0.00 70.33 67.49 1sdo n THR 41 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 175.07 174.32 1sdo n ILE 53 N 2.24 4.51 -1.89 1.09 -5.35 -1.26 -4.79 119.36 113.90 1sdo n ILE 53 Ca 0.55 -4.43 -0.29 0.00 -0.27 0.00 0.00 62.75 58.31 1sdo n ILE 53 Cb 0.28 -2.31 0.08 0.00 -1.74 0.00 0.00 39.64 35.95 1sdo n ILE 53 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1sdo s LEU 54 N -0.52 2.63 -0.09 7.28 1.43 -1.26 -5.03 118.68 123.11 1sdo s LEU 54 Ca 0.41 0.90 -0.06 0.00 -1.03 0.00 0.00 54.13 54.35 1sdo s LEU 54 Cb 0.11 -3.49 -0.04 0.00 0.03 0.00 0.00 46.19 42.80 1sdo s LEU 54 CO -0.01 -1.72 0.15 -0.31 0.23 0.00 0.00 176.35 174.69 1sdo s TYR 55 N -3.51 3.57 -0.20 0.29 1.51 -0.55 -4.41 117.35 114.05 1sdo s TYR 55 Ca 0.61 0.47 -0.19 0.00 -1.01 0.00 0.00 57.07 56.96 1sdo s TYR 55 Cb -0.11 -1.91 -0.03 0.00 -0.11 0.00 0.00 41.96 39.80 1sdo s TYR 55 CO 0.50 0.71 0.53 0.45 -1.11 0.00 0.00 175.55 176.62 1sdo s SER 56 N -1.26 6.56 0.34 2.29 0.15 0.02 -4.55 113.70 117.25 1sdo s SER 56 Ca 0.18 0.68 0.04 0.00 0.70 0.00 0.00 55.95 57.55 1sdo s SER 56 Cb -0.12 -2.30 0.61 0.00 -1.71 0.00 0.00 66.02 62.50 1sdo s SER 56 CO 0.08 -0.20 1.88 -0.65 1.20 0.00 0.00 173.24 175.55 1sdo h PRO 57 N 7.50 0.53 -0.23 5.44 0.11 -1.89 0.10 132.00 143.57 1sdo h PRO 57 Ca -0.33 -0.11 -0.07 0.00 0.11 0.00 0.00 66.00 65.60 1sdo h PRO 57 Cb 1.15 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1sdo h PRO 57 CO 0.74 0.55 -0.12 0.28 -0.21 0.00 0.00 178.00 179.24 1sdo h VAL 58 N 0.51 1.31 -0.37 3.15 2.07 -1.93 -0.40 116.25 120.59 1sdo h VAL 58 Ca 0.11 -1.20 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 1sdo h VAL 58 Cb 0.32 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1sdo h VAL 58 CO 0.01 0.37 0.19 0.00 0.02 0.00 0.00 177.57 178.15 1sdo h ALA 59 N 0.71 0.48 -0.72 1.67 0.00 -1.80 -0.64 119.26 118.96 1sdo h ALA 59 Ca 0.05 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1sdo h ALA 59 Cb 0.62 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1sdo h ALA 59 CO 0.03 0.02 0.38 -0.07 0.00 0.00 0.00 179.25 179.62 1sdo h LEU 60 N 0.46 0.90 -0.95 0.00 3.38 -0.93 -1.48 115.31 116.70 1sdo h LEU 60 Ca 0.13 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1sdo h LEU 60 Cb 0.10 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1sdo h LEU 60 CO -0.02 0.75 -0.14 0.78 0.09 0.00 0.00 178.44 179.90 1sdo h ASN 61 N 0.99 0.60 -0.45 -0.43 2.35 -0.80 -2.07 115.58 115.77 1sdo h ASN 61 Ca 0.25 -0.17 -0.09 0.00 -0.55 0.00 0.00 56.30 55.74 1sdo h ASN 61 Cb 0.05 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 1sdo h ASN 61 CO -0.04 0.76 -0.07 -0.33 -1.65 0.00 0.00 177.43 176.11 1sdo h GLU 62 N 0.56 0.85 -0.36 0.81 5.08 -0.75 -0.86 114.58 119.91 1sdo h GLU 62 Ca 0.10 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.14 1sdo h GLU 62 Cb 0.56 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1sdo h GLU 62 CO 0.04 0.93 0.18 0.00 -1.00 0.00 0.00 179.01 179.16 1sdo h ALA 63 N 0.89 0.46 -0.44 3.43 0.00 -1.08 -1.73 119.26 120.80 1sdo h ALA 63 Ca 0.12 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1sdo h ALA 63 Cb 0.59 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1sdo h ALA 63 CO 0.04 0.01 -0.01 0.74 0.00 0.00 0.00 179.25 180.02 1sdo h PHE 64 N 0.45 0.86 -0.36 0.00 -1.00 -1.34 -2.79 116.94 112.76 1sdo h PHE 64 Ca 0.12 -0.15 0.06 0.00 2.81 0.00 0.00 57.97 60.81 1sdo h PHE 64 Cb 0.09 -0.22 -0.05 0.00 3.61 0.00 0.00 35.95 39.38 1sdo h PHE 64 CO -0.02 0.84 0.04 -0.22 -1.61 0.00 0.00 178.31 177.35 1sdo h LYS 65 N 0.62 0.15 -0.24 1.51 3.64 -0.94 0.20 116.57 121.51 1sdo h LYS 65 Ca 0.12 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1sdo h LYS 65 Cb 0.51 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 1sdo h LYS 65 CO 0.03 0.10 0.14 1.49 -2.27 0.00 0.00 179.45 178.93 1sdo h GLU 66 N 0.15 0.28 -0.58 1.90 4.81 -1.28 0.31 114.58 120.17 1sdo h GLU 66 Ca 0.18 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.29 1sdo h GLU 66 Cb 0.22 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 1sdo h GLU 66 CO -0.26 0.18 -0.02 0.87 -0.73 0.00 0.00 179.01 179.06 1sdo h LYS 67 N 0.29 1.04 -0.04 1.92 6.56 -1.20 -0.02 116.57 125.12 1sdo h LYS 67 Ca 0.09 -0.34 -0.01 0.00 -1.06 0.00 0.00 60.65 59.33 1sdo h LYS 67 Cb -0.00 -0.09 -0.00 0.00 -0.57 0.00 0.00 32.23 31.57 1sdo h LYS 67 CO -0.05 1.03 -0.01 -0.07 -2.06 0.00 0.00 179.45 178.30 1sdo h LEU 68 N 0.93 0.08 -1.24 2.94 3.38 -0.43 -2.85 115.31 118.11 1sdo h LEU 68 Ca 0.16 -0.37 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 1sdo h LEU 68 Cb 0.58 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1sdo h LEU 68 CO 0.03 0.44 -0.38 -0.33 0.09 0.00 0.00 178.44 178.29 1sdo h GLU 69 N -0.27 0.00 0.00 1.13 5.08 -0.94 -1.04 114.58 118.54 1sdo h GLU 69 Ca 0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1sdo h GLU 69 Cb 0.40 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 1sdo h GLU 69 CO 0.00 0.38 -0.10 0.00 -1.00 0.00 0.00 179.01 178.29 1sdo h ALA 70 N 1.62 1.47 -0.58 3.43 0.00 -0.91 -1.93 119.26 122.36 1sdo h ALA 70 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1sdo h ALA 70 Cb 0.67 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1sdo h ALA 70 CO 0.05 0.13 0.00 1.63 0.00 0.00 0.00 179.25 181.06 1sdo n LYS 71 N -3.89 4.38 -0.88 0.00 4.76 -0.47 -4.94 118.16 117.13 1sdo n LYS 71 Ca -0.02 -3.05 0.00 0.00 -2.87 0.00 0.00 58.31 52.36 1sdo n LYS 71 Cb 0.20 -2.11 0.00 0.00 -1.84 0.00 0.00 35.03 31.27 1sdo n LYS 71 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1sdo n GLY 72 N 0.71 0.50 3.66 0.72 0.00 -0.73 -5.02 105.19 105.03 1sdo n GLY 72 Ca 0.27 -0.59 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 1sdo n GLY 72 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1sdo s TRP 73 N -2.00 3.37 0.25 1.61 0.52 -0.76 -4.76 118.94 117.18 1sdo s TRP 73 Ca 0.00 1.24 0.08 0.00 0.02 0.00 0.00 56.10 57.44 1sdo s TRP 73 Cb 0.00 -3.06 -0.05 0.00 -1.15 0.00 0.00 33.47 29.20 1sdo s TRP 73 CO 0.00 -0.33 -0.11 0.15 0.02 0.00 0.00 176.95 176.68 1sdo s LYS 74 N 2.55 1.50 0.65 4.98 1.02 -0.49 -4.07 119.74 125.88 1sdo s LYS 74 Ca 0.38 -1.72 -0.17 0.00 0.02 0.00 0.00 55.97 54.48 1sdo s LYS 74 Cb -0.16 -1.24 -0.00 0.00 -0.52 0.00 0.00 37.83 35.91 1sdo s LYS 74 CO 0.10 0.13 1.21 -1.83 -0.92 0.00 0.00 175.35 174.03 1sdo s GLU 75 N -3.67 2.61 0.01 1.68 -1.05 -0.66 -0.21 118.70 117.41 1sdo s GLU 75 Ca 0.27 1.79 -0.02 0.00 -0.15 0.00 0.00 54.97 56.85 1sdo s GLU 75 Cb 0.01 -1.89 -0.01 0.00 -0.44 0.00 0.00 34.13 31.80 1sdo s GLU 75 CO 0.11 -1.48 0.03 0.45 0.95 0.00 0.00 175.26 175.32 1sdo s SER 76 N -1.83 0.12 -0.01 0.83 0.15 0.27 -4.84 113.70 108.39 1sdo s SER 76 Ca 0.76 -0.28 0.01 0.00 0.70 0.00 0.00 55.95 57.14 1sdo s SER 76 Cb -0.30 0.13 -0.00 0.00 -1.71 0.00 0.00 66.02 64.14 1sdo s SER 76 CO 0.39 -0.25 -0.04 -0.60 1.20 0.00 0.00 173.24 173.94 1sdo s ARG 77 N -1.07 0.40 -0.07 5.44 3.52 -1.26 -0.99 118.95 124.91 1sdo s ARG 77 Ca -0.12 -0.15 0.02 0.00 -0.13 0.00 0.00 55.73 55.35 1sdo s ARG 77 Cb -0.07 -0.40 0.01 0.00 -1.56 0.00 0.00 34.95 32.94 1sdo s ARG 77 CO -0.00 0.08 -0.14 -0.08 -0.81 0.00 0.00 175.30 174.35 1sdo s THR 78 N -0.01 1.30 0.10 4.11 -1.32 -0.37 -5.00 115.64 114.44 1sdo s THR 78 Ca 0.01 -0.57 0.04 0.00 -1.21 0.00 0.00 61.69 59.95 1sdo s THR 78 Cb -0.03 -1.17 -0.04 0.00 -1.51 0.00 0.00 72.50 69.75 1sdo s THR 78 CO -0.00 0.39 0.05 0.20 -2.21 0.00 0.00 174.62 173.05 1sdo s ASN 79 N 0.64 5.32 0.23 8.08 0.01 -1.26 -1.55 114.94 126.41 1sdo s ASN 79 Ca -0.15 -0.09 -0.22 0.00 -0.71 0.00 0.00 52.86 51.69 1sdo s ASN 79 Cb -0.16 -1.36 0.04 0.00 0.41 0.00 0.00 41.25 40.18 1sdo s ASN 79 CO 0.04 0.16 0.72 -0.72 -1.51 0.00 0.00 177.10 175.79 1sdo s TYR 80 N -1.41 -0.28 -0.18 2.20 -0.85 -0.72 -4.56 117.35 111.54 1sdo s TYR 80 Ca 0.28 -0.09 -0.01 0.00 -0.52 0.00 0.00 57.07 56.74 1sdo s TYR 80 Cb -0.12 0.66 0.00 0.00 0.38 0.00 0.00 41.96 42.88 1sdo s TYR 80 CO 0.21 -1.07 -0.13 0.71 -1.52 0.00 0.00 175.55 173.74 1sdo s TYR 81 N -3.79 2.84 0.46 -3.49 1.51 -1.26 -1.00 117.35 112.62 1sdo s TYR 81 Ca 0.08 -1.18 0.04 0.00 -1.01 0.00 0.00 57.07 55.00 1sdo s TYR 81 Cb -0.04 -1.96 0.01 0.00 -0.11 0.00 0.00 41.96 39.86 1sdo s TYR 81 CO 0.01 -0.59 0.65 0.14 -1.11 0.00 0.00 175.55 174.64 1sdo s VAL 82 N 1.15 3.29 0.20 0.71 -7.23 0.08 -4.80 120.40 113.80 1sdo s VAL 82 Ca 0.01 -0.77 -0.22 0.00 -1.81 0.00 0.00 61.98 59.19 1sdo s VAL 82 Cb -0.14 -3.18 0.05 0.00 0.56 0.00 0.00 36.38 33.67 1sdo s VAL 82 CO -0.05 -0.10 0.68 0.28 -0.31 0.00 0.00 175.10 175.60 1sdo s THR 83 N -2.51 0.00 -0.44 5.32 -1.32 -1.26 -0.56 115.64 114.87 1sdo s THR 83 Ca 0.53 -0.45 0.24 0.00 -1.21 0.00 0.00 61.69 60.79 1sdo s THR 83 Cb -0.10 -1.47 0.34 0.00 -1.51 0.00 0.00 72.50 69.76 1sdo s THR 83 CO 0.36 0.00 1.64 0.00 -2.21 0.00 0.00 174.62 174.41 1sdo h ALA 84 N 2.00 1.00 -1.79 11.08 0.00 -2.00 -3.45 119.26 126.10 1sdo h ALA 84 Ca -0.27 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.07 1sdo h ALA 84 Cb 1.28 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.99 1sdo h ALA 84 CO 0.31 0.00 0.83 0.34 0.00 0.00 0.00 179.25 180.73 1sdo s ASP 85 N -6.01 6.62 0.26 0.00 -1.08 -1.26 -4.94 116.67 110.25 1sdo s ASP 85 Ca 0.07 0.42 -0.03 0.00 -0.52 0.00 0.00 52.55 52.49 1sdo s ASP 85 Cb 0.06 -2.52 0.43 0.00 -1.46 0.00 0.00 42.92 39.43 1sdo s ASP 85 CO 0.66 -1.17 1.84 -0.65 0.52 0.00 0.00 175.17 176.36 1sdo h PRO 86 N 9.10 0.91 -0.33 4.34 0.11 -2.00 -1.55 132.00 142.59 1sdo h PRO 86 Ca -0.23 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.80 1sdo h PRO 86 Cb 1.06 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.95 1sdo h PRO 86 CO 1.09 0.60 0.10 -0.22 -0.21 0.00 0.00 178.00 179.36 1sdo h LYS 87 N 0.94 0.52 -0.17 1.05 3.64 -1.99 -2.12 116.57 118.43 1sdo h LYS 87 Ca 0.43 -0.11 -0.08 0.00 -1.27 0.00 0.00 60.65 59.61 1sdo h LYS 87 Cb 0.34 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1sdo h LYS 87 CO -0.23 0.56 -0.25 -0.07 -2.27 0.00 0.00 179.45 177.18 1sdo h LEU 88 N 0.38 0.30 0.21 5.20 3.38 -1.89 -1.75 115.31 121.13 1sdo h LEU 88 Ca 0.11 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1sdo h LEU 88 Cb 0.26 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1sdo h LEU 88 CO -0.00 0.56 -0.10 0.40 0.09 0.00 0.00 178.44 179.39 1sdo h ILE 89 N 0.27 0.85 -0.53 1.22 2.04 -1.05 -1.67 117.51 118.64 1sdo h ILE 89 Ca 0.04 -0.32 0.05 0.00 1.00 0.00 0.00 64.86 65.62 1sdo h ILE 89 Cb 0.60 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 1sdo h ILE 89 CO 0.04 0.07 0.35 0.03 0.00 0.00 0.00 178.15 178.65 1sdo h ARG 90 N -0.45 0.53 0.00 2.37 3.08 -1.18 -1.31 114.38 117.42 1sdo h ARG 90 Ca -0.03 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1sdo h ARG 90 Cb 0.34 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.27 1sdo h ARG 90 CO 0.05 0.35 0.00 0.93 -1.07 0.00 0.00 179.97 180.23 1sdo h GLU 91 N 0.54 0.00 -0.01 0.04 5.08 -1.09 -3.34 114.58 115.81 1sdo h GLU 91 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1sdo h GLU 91 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1sdo h GLU 91 CO -0.06 0.00 -0.25 0.25 -1.00 0.00 0.00 179.01 177.95 1sdo n THR 92 N -2.91 0.00 -0.27 1.13 -2.24 -0.65 -4.74 114.28 104.61 1sdo n THR 92 Ca 0.04 -0.37 0.03 0.00 -2.27 0.00 0.00 64.05 61.48 1sdo n THR 92 Cb 0.50 1.11 0.11 0.00 -2.10 0.00 0.00 70.33 69.95 1sdo n THR 92 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1sdo h LEU 93 N 1.08 -0.62 -0.65 3.22 3.38 -1.39 -1.51 115.31 118.82 1sdo h LEU 93 Ca 0.00 0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1sdo h LEU 93 Cb 0.35 0.45 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1sdo h LEU 93 CO 0.00 -0.24 0.00 -1.20 0.09 0.00 0.00 178.44 177.09 1sdo n SER 94 N -5.47 1.00 -4.90 -0.43 7.64 -1.26 -4.76 113.62 105.45 1sdo n SER 94 Ca 0.12 -1.37 -0.29 0.00 1.01 0.00 0.00 58.87 58.35 1sdo n SER 94 Cb 0.42 -0.01 0.02 0.00 -1.01 0.00 0.00 64.21 63.64 1sdo n SER 94 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1sdo s LEU 95 N -1.94 3.26 0.54 -3.43 1.43 -0.57 -5.01 118.68 112.95 1sdo s LEU 95 Ca 0.40 1.01 -0.19 0.00 -1.03 0.00 0.00 54.13 54.32 1sdo s LEU 95 Cb 0.21 -3.92 -0.06 0.00 0.03 0.00 0.00 46.19 42.45 1sdo s LEU 95 CO 0.33 -0.96 1.12 -1.61 0.23 0.00 0.00 176.35 175.46 1sdo s GLU 96 N -5.05 3.39 0.19 1.70 0.41 -1.26 -4.76 118.70 113.32 1sdo s GLU 96 Ca 0.53 1.57 -0.23 0.00 -0.41 0.00 0.00 54.97 56.44 1sdo s GLU 96 Cb -0.11 -2.01 0.10 0.00 -1.78 0.00 0.00 34.13 30.33 1sdo s GLU 96 CO 0.48 -0.81 1.56 -1.35 -0.49 0.00 0.00 175.26 174.66 1sdo h PRO 97 N 1.21 -0.11 -0.10 0.39 0.11 -1.96 -0.14 132.00 131.40 1sdo h PRO 97 Ca -0.50 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 1sdo h PRO 97 Cb 1.26 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 1sdo h PRO 97 CO 0.57 -0.07 -0.01 0.93 -0.21 0.00 0.00 178.00 179.21 1sdo h GLU 98 N -0.11 0.15 -0.02 1.05 4.39 -1.96 -1.34 114.58 116.74 1sdo h GLU 98 Ca 0.24 -0.02 -0.18 0.00 0.34 0.00 0.00 59.36 59.74 1sdo h GLU 98 Cb 0.55 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 1sdo h GLU 98 CO -0.83 0.17 -0.79 1.49 -1.16 0.00 0.00 179.01 177.90 1sdo h GLU 99 N 0.15 0.19 0.04 2.33 4.57 -1.46 -2.21 114.58 118.19 1sdo h GLU 99 Ca 0.04 -0.18 -0.00 0.00 -1.18 0.00 0.00 59.36 58.03 1sdo h GLU 99 Cb 0.12 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 1sdo h GLU 99 CO 0.00 0.89 -0.02 1.96 -1.18 0.00 0.00 179.01 180.66 1sdo h GLN 100 N 0.12 -0.05 -0.53 1.92 4.20 -0.03 -0.88 115.11 119.85 1sdo h GLN 100 Ca -0.03 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.71 1sdo h GLN 100 Cb 1.38 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 29.14 1sdo h GLN 100 CO 0.12 0.12 0.32 -0.22 -0.67 0.00 0.00 178.83 178.49 1sdo h LYS 101 N -0.22 0.61 -0.22 1.46 3.64 -1.37 -0.77 116.57 119.70 1sdo h LYS 101 Ca -0.01 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.37 1sdo h LYS 101 Cb 0.20 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 1sdo h LYS 101 CO 0.01 0.40 0.04 -0.22 -2.27 0.00 0.00 179.45 177.41 1sdo h LYS 102 N 0.62 0.12 -0.33 1.90 3.64 -1.20 -0.15 116.57 121.17 1sdo h LYS 102 Ca 0.22 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.56 1sdo h LYS 102 Cb 0.03 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1sdo h LYS 102 CO -0.10 0.08 0.08 0.28 -2.27 0.00 0.00 179.45 177.51 1sdo h VAL 103 N 0.12 1.22 0.13 2.00 2.07 -0.94 -0.11 116.25 120.75 1sdo h VAL 103 Ca 0.10 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 1sdo h VAL 103 Cb 0.10 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1sdo h VAL 103 CO -0.13 0.25 -0.06 0.40 0.02 0.00 0.00 177.57 178.05 1sdo h ILE 104 N 0.37 0.92 -0.08 4.57 2.04 -0.93 -2.76 117.51 121.65 1sdo h ILE 104 Ca 0.10 -0.16 -0.06 0.00 1.00 0.00 0.00 64.86 65.75 1sdo h ILE 104 Cb 0.30 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1sdo h ILE 104 CO 0.00 0.04 -0.21 -0.33 0.00 0.00 0.00 178.15 177.65 1sdo h GLU 105 N -0.24 0.13 0.00 2.37 5.08 -1.00 -2.03 114.58 118.89 1sdo h GLU 105 Ca -0.02 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1sdo h GLU 105 Cb 0.19 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 1sdo h GLU 105 CO 0.03 0.34 -0.12 0.00 -1.00 0.00 0.00 179.01 178.26 1sdo h ALA 106 N 1.67 1.18 -0.23 3.43 0.00 -0.79 -0.29 119.26 124.23 1sdo h ALA 106 Ca 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1sdo h ALA 106 Cb 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1sdo h ALA 106 CO 0.03 0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.43 1sdo n ALA 107 N -2.24 2.49 -1.51 0.00 0.00 -0.80 -4.90 120.51 113.56 1sdo n ALA 107 Ca -0.01 -0.57 -0.03 0.00 0.00 0.00 0.00 53.44 52.83 1sdo n ALA 107 Cb 0.27 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 18.67 1sdo n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sdo n GLY 108 N 1.12 0.46 3.52 0.00 0.00 -0.12 -5.05 105.19 105.13 1sdo n GLY 108 Ca 0.15 -0.86 -0.26 0.00 0.00 0.00 0.00 46.02 45.05 1sdo n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sdo s LYS 109 N -3.08 1.86 0.09 1.61 -0.14 -0.98 -5.02 119.74 114.08 1sdo s LYS 109 Ca 0.00 -1.44 -0.29 0.00 -1.36 0.00 0.00 55.97 52.88 1sdo s LYS 109 Cb 0.00 -2.00 -0.06 0.00 -1.68 0.00 0.00 37.83 34.09 1sdo s LYS 109 CO 0.00 0.40 0.91 -2.00 -0.76 0.00 0.00 175.35 173.90 1sdo s GLU 110 N -2.97 4.64 -0.14 1.68 2.12 -1.26 -3.51 118.70 119.25 1sdo s GLU 110 Ca 0.25 1.35 -0.05 0.00 0.36 0.00 0.00 54.97 56.88 1sdo s GLU 110 Cb -0.08 -3.37 -0.04 0.00 0.26 0.00 0.00 34.13 30.90 1sdo s GLU 110 CO 0.14 0.23 0.03 0.00 -0.54 0.00 0.00 175.26 175.12 1sdo s ALA 111 N 0.00 3.35 -0.12 6.30 0.00 -1.26 -4.42 121.76 125.61 1sdo s ALA 111 Ca 0.45 -0.76 0.03 0.00 0.00 0.00 0.00 51.96 51.68 1sdo s ALA 111 Cb -0.23 -1.73 0.00 0.00 0.00 0.00 0.00 23.12 21.17 1sdo s ALA 111 CO 0.28 0.35 -0.23 -0.51 0.00 0.00 0.00 175.76 175.66 1sdo s LEU 112 N -0.14 2.08 0.20 0.00 1.43 0.28 -4.94 118.68 117.59 1sdo s LEU 112 Ca 0.06 -0.57 -0.30 0.00 -1.03 0.00 0.00 54.13 52.29 1sdo s LEU 112 Cb -0.12 -1.40 -0.09 0.00 0.03 0.00 0.00 46.19 44.61 1sdo s LEU 112 CO 0.02 0.12 1.33 -0.54 0.23 0.00 0.00 176.35 177.51 1sdo s LYS 113 N 0.56 4.37 0.33 1.70 1.02 -1.26 -0.75 119.74 125.71 1sdo s LYS 113 Ca -0.14 2.10 -0.07 0.00 0.02 0.00 0.00 55.97 57.88 1sdo s LYS 113 Cb -0.17 -3.18 0.01 0.00 -0.52 0.00 0.00 37.83 33.97 1sdo s LYS 113 CO 0.04 -0.29 0.53 0.45 -0.92 0.00 0.00 175.35 175.16 1sdo s SER 114 N 0.37 0.56 0.09 2.83 0.15 -0.17 -4.91 113.70 112.62 1sdo s SER 114 Ca 0.57 -1.32 -0.26 0.00 0.70 0.00 0.00 55.95 55.64 1sdo s SER 114 Cb -0.37 0.68 0.09 0.00 -1.71 0.00 0.00 66.02 64.71 1sdo s SER 114 CO 0.39 -1.34 1.12 -0.72 1.20 0.00 0.00 173.24 173.88 1sdo s TYR 115 N -3.10 -0.04 0.01 3.44 -0.85 -1.26 -1.75 117.35 113.80 1sdo s TYR 115 Ca 0.26 -0.21 0.00 0.00 -0.52 0.00 0.00 57.07 56.60 1sdo s TYR 115 Cb -0.01 0.62 -0.01 0.00 0.38 0.00 0.00 41.96 42.93 1sdo s TYR 115 CO 0.17 -0.62 -0.02 -0.80 -1.52 0.00 0.00 175.55 172.75 1sdo s ASN 116 N -3.16 0.17 0.02 -0.18 -0.87 -0.59 -5.00 114.94 105.33 1sdo s ASN 116 Ca 0.17 -0.35 0.02 0.00 -1.57 0.00 0.00 52.86 51.13 1sdo s ASN 116 Cb 0.00 0.07 -0.01 0.00 -0.02 0.00 0.00 41.25 41.29 1sdo s ASN 116 CO 0.01 -0.21 -0.07 -1.58 -2.57 0.00 0.00 177.10 172.68 1sdo s GLN 117 N -1.03 0.51 0.01 -0.60 0.74 -1.26 -1.24 119.66 116.79 1sdo s GLN 117 Ca -0.11 -0.45 -0.02 0.00 0.05 0.00 0.00 55.36 54.82 1sdo s GLN 117 Cb -0.07 -0.41 -0.01 0.00 1.10 0.00 0.00 33.01 33.62 1sdo s GLN 117 CO -0.01 0.10 0.03 -0.08 -0.55 0.00 0.00 175.29 174.78 1sdo s THR 118 N -0.66 0.09 0.15 -0.34 -1.32 -0.16 -4.99 115.64 108.41 1sdo s THR 118 Ca -0.03 -0.74 0.03 0.00 -1.21 0.00 0.00 61.69 59.75 1sdo s THR 118 Cb -0.06 -0.29 -0.17 0.00 -1.51 0.00 0.00 72.50 70.48 1sdo s THR 118 CO 0.00 -0.41 1.35 0.44 -2.21 0.00 0.00 174.62 173.80 1sdo h ASP 119 N 4.71 0.20 -3.49 8.08 3.32 -1.86 0.79 116.42 128.17 1sdo h ASP 119 Ca -0.31 -0.17 -0.63 0.00 0.02 0.00 0.00 57.03 55.94 1sdo h ASP 119 Cb 1.20 -0.06 -0.40 0.00 0.22 0.00 0.00 39.33 40.29 1sdo h ASP 119 CO 0.42 1.01 -0.74 -0.36 -1.72 0.00 0.00 179.24 177.85 1sdo s PHE 120 N -3.08 2.95 -0.01 4.55 0.40 -1.25 -1.65 117.98 119.88 1sdo s PHE 120 Ca -0.02 -2.48 0.03 0.00 -0.60 0.00 0.00 56.93 53.85 1sdo s PHE 120 Cb 0.10 -2.42 -0.01 0.00 0.51 0.00 0.00 43.02 41.20 1sdo s PHE 120 CO 0.83 -0.92 -0.10 0.08 0.70 0.00 0.00 175.22 175.81 1sdo s VAL 121 N 1.19 0.80 -0.28 -0.44 1.01 0.70 -0.73 120.40 122.65 1sdo s VAL 121 Ca 0.10 -0.42 -0.20 0.00 0.00 0.00 0.00 61.98 61.46 1sdo s VAL 121 Cb -0.18 -0.68 0.10 0.00 0.00 0.00 0.00 36.38 35.62 1sdo s VAL 121 CO -0.14 0.23 0.83 -0.75 0.00 0.00 0.00 175.10 175.27 1sdo s LYS 122 N -0.14 0.63 -1.52 2.72 2.20 -0.70 -1.40 119.74 121.54 1sdo s LYS 122 Ca 0.02 0.92 -0.14 0.00 -0.36 0.00 0.00 55.97 56.41 1sdo s LYS 122 Cb -0.05 0.22 0.10 0.00 -1.51 0.00 0.00 37.83 36.59 1sdo s LYS 122 CO -0.00 -0.10 0.79 -0.25 -0.36 0.00 0.00 175.35 175.43 1sdo n ASP 123 N 3.32 -4.20 -2.77 1.43 8.00 -1.26 -1.57 116.55 119.50 1sdo n ASP 123 Ca -0.17 -0.72 -0.20 0.00 0.71 0.00 0.00 54.79 54.41 1sdo n ASP 123 Cb 0.57 -3.40 0.04 0.00 -0.02 0.00 0.00 41.12 38.31 1sdo n ASP 123 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1sdo n ARG 124 N -4.33 -4.89 -4.40 -1.24 1.74 -1.26 -4.90 116.66 97.37 1sdo n ARG 124 Ca 0.03 0.78 -0.23 0.00 -0.77 0.00 0.00 57.85 57.67 1sdo n ARG 124 Cb 0.52 -5.42 -0.16 0.00 -1.02 0.00 0.00 32.46 26.38 1sdo n ARG 124 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1sdo s VAL 125 N -3.14 0.87 -0.06 1.55 1.01 -0.61 -0.50 120.40 119.52 1sdo s VAL 125 Ca 0.32 -0.32 -0.00 0.00 0.00 0.00 0.00 61.98 61.98 1sdo s VAL 125 Cb -0.14 -0.83 -0.03 0.00 0.00 0.00 0.00 36.38 35.38 1sdo s VAL 125 CO 0.40 0.30 -0.02 0.00 0.00 0.00 0.00 175.10 175.77 1sdo s ALA 126 N 0.77 3.18 -0.10 5.51 0.00 -1.04 -1.72 121.76 128.36 1sdo s ALA 126 Ca -0.13 -0.87 0.02 0.00 0.00 0.00 0.00 51.96 50.98 1sdo s ALA 126 Cb -0.15 -1.36 0.01 0.00 0.00 0.00 0.00 23.12 21.62 1sdo s ALA 126 CO 0.02 0.59 -0.16 0.42 0.00 0.00 0.00 175.76 176.64 1sdo s ILE 127 N -0.90 1.49 -0.16 0.00 1.01 0.10 -0.21 121.20 122.53 1sdo s ILE 127 Ca 0.14 -0.65 -0.02 0.00 0.00 0.00 0.00 60.65 60.12 1sdo s ILE 127 Cb -0.11 -1.35 -0.01 0.00 0.01 0.00 0.00 42.46 40.99 1sdo s ILE 127 CO 0.04 0.44 -0.09 -1.61 0.00 0.00 0.00 174.94 173.71 1sdo s GLU 128 N 0.85 3.43 -0.35 2.79 0.41 0.08 -4.14 118.70 121.77 1sdo s GLU 128 Ca -0.10 -0.64 -0.10 0.00 -0.41 0.00 0.00 54.97 53.72 1sdo s GLU 128 Cb -0.15 -2.77 0.02 0.00 -1.78 0.00 0.00 34.13 29.45 1sdo s GLU 128 CO 0.01 0.11 0.17 0.08 -0.49 0.00 0.00 175.26 175.14 1sdo s VAL 129 N 0.64 4.40 -0.26 2.63 1.01 -1.26 -0.65 120.40 126.89 1sdo s VAL 129 Ca -0.05 -0.82 -0.00 0.00 0.00 0.00 0.00 61.98 61.11 1sdo s VAL 129 Cb -0.15 -3.41 0.04 0.00 0.00 0.00 0.00 36.38 32.86 1sdo s VAL 129 CO 0.03 -0.15 -0.07 -1.10 0.00 0.00 0.00 175.10 173.81 1sdo s GLN 130 N 1.53 2.53 -0.24 2.72 -1.52 -0.65 -4.91 119.66 119.13 1sdo s GLN 130 Ca 0.02 -1.18 0.12 0.00 -1.95 0.00 0.00 55.36 52.37 1sdo s GLN 130 Cb -0.19 -2.99 0.45 0.00 -0.22 0.00 0.00 33.01 30.06 1sdo s GLN 130 CO 0.06 -0.51 1.19 1.19 -0.25 0.00 0.00 175.29 176.96 1sdo n PHE 131 N 4.58 1.44 -3.15 0.91 3.01 -1.26 -4.45 117.46 118.53 1sdo n PHE 131 Ca -0.15 -1.83 0.00 0.00 1.01 0.00 0.00 57.45 56.48 1sdo n PHE 131 Cb 0.44 -0.28 0.00 0.00 -0.01 0.00 0.00 39.48 39.63 1sdo n PHE 131 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1sdo n GLY 132 N -0.72 2.28 3.78 1.37 0.00 -1.26 -4.85 105.19 105.79 1sdo n GLY 132 Ca 0.28 -2.14 -0.31 0.00 0.00 0.00 0.00 46.02 43.84 1sdo n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sdo s LYS 133 N -1.98 2.54 0.54 1.61 1.02 -1.26 -2.62 119.74 119.59 1sdo s LYS 133 Ca 0.00 1.16 0.45 0.00 0.02 0.00 0.00 55.97 57.60 1sdo s LYS 133 Cb 0.00 -1.93 1.67 0.00 -0.52 0.00 0.00 37.83 37.04 1sdo s LYS 133 CO 0.00 -1.42 1.62 0.10 -0.92 0.00 0.00 175.35 174.73 1sdo h TYR 134 N -0.78 0.08 0.00 3.18 -0.00 -1.78 -1.89 116.97 115.78 1sdo h TYR 134 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.29 1sdo h TYR 134 Cb 1.23 -0.02 0.00 0.00 0.00 0.00 0.00 36.73 37.94 1sdo h TYR 134 CO 0.58 -0.03 -0.45 0.66 -0.00 0.00 0.00 178.16 178.92 1sdo h SER 135 N 0.01 0.00 0.63 0.10 4.64 -1.91 -3.38 113.55 113.64 1sdo h SER 135 Ca 0.86 -0.05 -0.13 0.00 -0.47 0.00 0.00 61.79 61.99 1sdo h SER 135 Cb 3.35 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 65.42 1sdo h SER 135 CO -0.07 0.03 -0.64 -0.26 -0.87 0.00 0.00 176.83 175.01 1sdo h PHE 136 N 0.00 0.01 -0.22 4.77 -1.00 -1.70 -2.92 116.94 115.88 1sdo h PHE 136 Ca 0.00 -0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.68 1sdo h PHE 136 Cb 0.90 -0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.45 1sdo h PHE 136 CO 0.00 0.64 -0.24 0.28 -1.61 0.00 0.00 178.31 177.39 1sdo h VAL 137 N 0.01 1.32 -0.65 -0.55 2.07 -1.75 -1.11 116.25 115.59 1sdo h VAL 137 Ca -0.01 -1.41 0.08 0.00 0.82 0.00 0.00 66.70 66.18 1sdo h VAL 137 Cb 1.13 1.72 -0.06 0.00 -1.52 0.00 0.00 31.29 32.56 1sdo h VAL 137 CO 0.08 0.44 0.32 0.00 0.02 0.00 0.00 177.57 178.43 1sdo h ALA 138 N 0.66 0.88 -0.57 1.67 0.00 -1.77 0.12 119.26 120.24 1sdo h ALA 138 Ca 0.03 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1sdo h ALA 138 Cb 0.79 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 1sdo h ALA 138 CO 0.06 -0.05 0.22 -0.92 0.00 0.00 0.00 179.25 178.56 1sdo h TYR 139 N 0.58 0.89 -0.12 0.00 3.20 -1.36 -1.28 116.97 118.87 1sdo h TYR 139 Ca 0.31 -0.07 0.01 0.00 3.14 0.00 0.00 58.73 62.12 1sdo h TYR 139 Cb 0.28 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.28 1sdo h TYR 139 CO -0.11 0.72 0.03 -0.44 -1.64 0.00 0.00 178.16 176.73 1sdo h ASP 140 N 0.79 0.03 0.22 -2.11 3.32 -0.03 -0.52 116.42 118.13 1sdo h ASP 140 Ca 0.19 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 1sdo h ASP 140 Cb 0.22 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1sdo h ASP 140 CO -0.01 0.04 -0.11 -0.07 -1.72 0.00 0.00 179.24 177.37 1sdo h LEU 141 N 0.09 -0.25 0.00 1.55 3.38 -0.88 0.90 115.31 120.10 1sdo h LEU 141 Ca 0.05 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1sdo h LEU 141 Cb 0.04 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1sdo h LEU 141 CO -0.06 0.16 -0.48 -0.26 0.09 0.00 0.00 178.44 177.88 1sdo h PHE 142 N -0.72 0.00 0.00 1.13 -1.00 -1.32 -3.32 116.94 111.70 1sdo h PHE 142 Ca -0.03 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.71 1sdo h PHE 142 Cb 0.49 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.05 1sdo h PHE 142 CO 0.04 0.00 -0.60 0.28 -1.61 0.00 0.00 178.31 176.42 1sdo n VAL 143 N -2.79 1.04 0.28 -0.55 0.31 -0.32 -4.54 118.33 111.75 1sdo n VAL 143 Ca 0.02 0.21 -0.11 0.00 -0.01 0.00 0.00 64.34 64.45 1sdo n VAL 143 Cb 0.53 -1.73 -0.05 0.00 -0.91 0.00 0.00 33.84 31.67 1sdo n VAL 143 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1sdo h LYS 144 N -0.26 -0.68 -0.80 5.55 1.57 -1.15 0.15 116.57 120.95 1sdo h LYS 144 Ca -0.06 0.05 0.09 0.00 -1.87 0.00 0.00 60.65 58.86 1sdo h LYS 144 Cb 0.53 0.16 -0.07 0.00 0.08 0.00 0.00 32.23 32.93 1sdo h LYS 144 CO -0.03 -0.46 0.45 0.45 -0.57 0.00 0.00 179.45 179.29 1sdo h HIS 145 N -0.71 0.82 -0.77 -1.35 3.86 -0.99 -1.60 115.15 114.41 1sdo h HIS 145 Ca -0.07 0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.13 1sdo h HIS 145 Cb 0.55 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 28.73 1sdo h HIS 145 CO 0.09 0.35 0.32 0.52 0.86 0.00 0.00 177.93 180.07 1sdo h MET 146 N 0.78 1.14 -0.05 2.45 2.86 -1.65 -1.21 114.93 119.25 1sdo h MET 146 Ca 0.38 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 1sdo h MET 146 Cb 0.32 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.78 1sdo h MET 146 CO -0.23 0.91 0.03 0.00 1.06 0.00 0.00 176.91 178.68 1sdo h ALA 147 N 1.23 0.06 -0.15 6.32 0.00 0.24 0.55 119.26 127.51 1sdo h ALA 147 Ca 0.26 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 1sdo h ALA 147 Cb 0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1sdo h ALA 147 CO -0.02 -0.43 -0.22 0.74 0.00 0.00 0.00 179.25 179.32 1sdo h PHE 148 N 0.04 0.28 0.17 0.00 -1.00 -1.26 -1.05 116.94 114.12 1sdo h PHE 148 Ca 0.02 -0.04 -0.01 0.00 2.81 0.00 0.00 57.97 60.74 1sdo h PHE 148 Cb 0.02 -0.07 0.00 0.00 3.61 0.00 0.00 35.95 39.51 1sdo h PHE 148 CO -0.07 0.46 -0.08 -0.92 -1.61 0.00 0.00 178.31 176.10 1sdo h TYR 149 N 0.23 -0.21 -0.02 -0.55 3.20 -0.89 0.16 116.97 118.89 1sdo h TYR 149 Ca 0.04 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 1sdo h TYR 149 Cb 0.52 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.86 1sdo h TYR 149 CO 0.01 0.19 -0.17 0.28 -1.64 0.00 0.00 178.16 176.82 1sdo h VAL 150 N -0.69 1.14 -0.09 1.81 2.07 -0.85 -1.31 116.25 118.32 1sdo h VAL 150 Ca -0.02 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1sdo h VAL 150 Cb 0.49 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 1sdo h VAL 150 CO 0.04 0.18 0.00 -1.20 0.02 0.00 0.00 177.57 176.61 1sdo n SER 151 N -4.32 0.74 -2.59 0.57 7.64 -0.40 -4.66 113.62 110.60 1sdo n SER 151 Ca -0.02 -1.64 -0.17 0.00 1.01 0.00 0.00 58.87 58.04 1sdo n SER 151 Cb 0.25 -0.06 0.05 0.00 -1.01 0.00 0.00 64.21 63.44 1sdo n SER 151 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1sdo n ASP 152 N -0.26 -5.10 -0.06 6.43 2.03 -0.50 -4.93 116.55 114.16 1sdo n ASP 152 Ca 0.13 -0.33 -0.04 0.00 0.52 0.00 0.00 54.79 55.07 1sdo n ASP 152 Cb 0.17 -3.79 -0.12 0.00 -0.72 0.00 0.00 41.12 36.66 1sdo n ASP 152 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1sdo n LYS 153 N -3.57 1.29 -4.09 -0.67 4.76 0.54 -5.02 118.16 111.41 1sdo n LYS 153 Ca -0.02 -0.04 -0.09 0.00 -2.87 0.00 0.00 58.31 55.29 1sdo n LYS 153 Cb 0.56 -1.39 -0.10 0.00 -1.84 0.00 0.00 35.03 32.25 1sdo n LYS 153 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 1sdo s ILE 154 N -2.54 0.34 -0.03 -0.18 -4.36 -1.10 -4.40 121.20 108.94 1sdo s ILE 154 Ca -0.07 -1.61 0.11 0.00 -0.26 0.00 0.00 60.65 58.81 1sdo s ILE 154 Cb 0.06 -1.25 -0.16 0.00 1.25 0.00 0.00 42.46 42.35 1sdo s ILE 154 CO 0.64 -0.82 0.24 0.47 0.24 0.00 0.00 174.94 175.71 1sdo n ASP 155 N 0.46 2.49 -3.72 4.36 10.43 0.34 -4.37 116.55 126.54 1sdo n ASP 155 Ca -0.16 -0.02 -0.14 0.00 2.57 0.00 0.00 54.79 57.04 1sdo n ASP 155 Cb 0.59 1.47 -0.09 0.00 1.84 0.00 0.00 41.12 44.94 1sdo n ASP 155 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1sdo s VAL 156 N -2.72 0.04 0.17 2.53 1.01 -1.23 -4.33 120.40 115.87 1sdo s VAL 156 Ca -0.04 -0.31 0.10 0.00 0.00 0.00 0.00 61.98 61.74 1sdo s VAL 156 Cb 0.07 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 1sdo s VAL 156 CO 0.45 -0.17 -0.21 -0.83 0.00 0.00 0.00 175.10 174.34 1sdo s GLY 157 N -0.98 1.69 -0.03 4.51 0.00 -0.48 -2.49 107.32 109.54 1sdo s GLY 157 Ca -0.10 -1.54 0.04 0.00 0.00 0.00 0.00 44.72 43.11 1sdo s GLY 157 CO 0.04 -1.56 -0.13 0.14 0.00 0.00 0.00 173.10 171.59 1sdo s VAL 158 N -1.53 1.11 -0.18 1.40 1.01 0.71 -1.20 120.40 121.73 1sdo s VAL 158 Ca 0.20 -0.55 0.01 0.00 0.00 0.00 0.00 61.98 61.64 1sdo s VAL 158 Cb -0.09 -0.96 0.03 0.00 0.00 0.00 0.00 36.38 35.37 1sdo s VAL 158 CO 0.10 0.33 -0.12 -0.70 0.00 0.00 0.00 175.10 174.71 1sdo s GLU 159 N 0.05 2.19 -0.28 2.72 2.56 -0.55 -0.74 118.70 124.66 1sdo s GLU 159 Ca -0.02 -0.73 -0.10 0.00 0.00 0.00 0.00 54.97 54.12 1sdo s GLU 159 Cb -0.09 -2.30 -0.04 0.00 2.00 0.00 0.00 34.13 33.70 1sdo s GLU 159 CO 0.01 -0.34 0.17 0.42 -0.56 0.00 0.00 175.26 174.97 1sdo s ILE 160 N 1.43 5.14 0.11 -3.70 1.01 0.17 -0.83 121.20 124.53 1sdo s ILE 160 Ca 0.02 0.09 0.05 0.00 0.00 0.00 0.00 60.65 60.80 1sdo s ILE 160 Cb -0.15 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.83 1sdo s ILE 160 CO -0.09 0.25 -0.12 -0.76 0.00 0.00 0.00 174.94 174.22 1sdo s LEU 161 N 1.73 2.40 0.25 2.97 1.43 0.65 -1.64 118.68 126.48 1sdo s LEU 161 Ca 0.07 -0.81 -0.26 0.00 -1.03 0.00 0.00 54.13 52.10 1sdo s LEU 161 Cb -0.16 -0.42 -0.09 0.00 0.03 0.00 0.00 46.19 45.55 1sdo s LEU 161 CO 0.10 -0.21 0.87 -2.16 0.23 0.00 0.00 176.35 175.18 1sdo s PRO 162 N -2.71 4.61 0.85 1.29 0.04 -1.26 0.05 135.00 137.86 1sdo s PRO 162 Ca 0.07 1.27 -0.11 0.00 0.04 0.00 0.00 61.00 62.26 1sdo s PRO 162 Cb -0.04 -3.05 0.10 0.00 0.04 0.00 0.00 34.50 31.55 1sdo s PRO 162 CO 0.01 0.43 1.09 -1.64 0.04 0.00 0.00 177.00 176.94 1sdo s MET 163 N -1.59 1.65 0.33 4.56 -1.94 0.01 -0.48 119.30 121.85 1sdo s MET 163 Ca 0.43 0.87 0.06 0.00 -1.71 0.00 0.00 55.69 55.34 1sdo s MET 163 Cb -0.21 -1.85 0.71 0.00 2.01 0.00 0.00 34.83 35.48 1sdo s MET 163 CO 0.26 -1.98 1.88 -0.22 -0.01 0.00 0.00 175.02 174.95 1sdo h LYS 164 N -1.36 0.79 -0.03 2.03 1.63 -1.91 0.24 116.57 117.96 1sdo h LYS 164 Ca -0.48 -0.05 0.01 0.00 -0.85 0.00 0.00 60.65 59.29 1sdo h LYS 164 Cb 1.27 -0.18 -0.00 0.00 -0.60 0.00 0.00 32.23 32.72 1sdo h LYS 164 CO 0.55 0.53 0.05 1.05 -3.45 0.00 0.00 179.45 178.18 1sdo h GLU 165 N 0.82 0.00 0.04 1.90 4.11 -1.93 0.25 114.58 119.76 1sdo h GLU 165 Ca 0.43 0.00 -0.38 0.00 0.07 0.00 0.00 59.36 59.48 1sdo h GLU 165 Cb 0.52 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.72 1sdo h GLU 165 CO -0.19 0.00 -2.21 -0.11 0.07 0.00 0.00 179.01 176.57 1sdo n LEU 166 N -3.56 2.56 0.24 3.06 7.94 -0.09 -4.28 117.00 122.86 1sdo n LEU 166 Ca -0.02 0.12 0.07 0.00 -1.11 0.00 0.00 56.01 55.07 1sdo n LEU 166 Cb 0.14 -0.96 0.59 0.00 0.53 0.00 0.00 43.42 43.72 1sdo n LEU 166 CO 0.24 0.77 0.98 0.77 -1.11 0.00 0.00 177.39 179.05 1sdo h SER 167 N -0.29 0.00 0.77 1.96 4.64 -0.66 0.52 113.55 120.49 1sdo h SER 167 Ca -0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 1sdo h SER 167 Cb 1.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.90 1sdo h SER 167 CO -0.12 0.10 0.00 2.29 -0.87 0.00 0.00 176.83 178.23 1sdo n LYS 168 N -4.35 0.12 -0.79 4.77 2.85 0.04 -1.78 118.16 119.02 1sdo n LYS 168 Ca -0.03 0.30 0.02 0.00 -1.05 0.00 0.00 58.31 57.55 1sdo n LYS 168 Cb 0.17 -1.70 0.31 0.00 -0.65 0.00 0.00 35.03 33.17 1sdo n LYS 168 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1sdo n GLU 169 N -1.91 3.64 -4.37 -1.58 -0.58 0.17 -4.93 120.64 111.07 1sdo n GLU 169 Ca 0.03 -3.05 -0.19 0.00 -0.42 0.00 0.00 57.16 53.54 1sdo n GLU 169 Cb 0.25 -2.08 -0.09 0.00 -0.57 0.00 0.00 31.44 28.94 1sdo n GLU 169 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 1sdo s MET 170 N -2.91 1.61 0.38 3.49 -1.94 -0.73 -1.48 119.30 117.73 1sdo s MET 170 Ca 0.50 -1.92 -0.25 0.00 -1.71 0.00 0.00 55.69 52.31 1sdo s MET 170 Cb 0.40 -0.26 -0.12 0.00 2.01 0.00 0.00 34.83 36.87 1sdo s MET 170 CO 0.12 -0.41 0.94 0.45 -0.01 0.00 0.00 175.02 176.11 1sdo n SER 171 N -0.88 0.96 -4.75 3.03 2.88 -1.26 -4.90 113.62 108.69 1sdo n SER 171 Ca -0.00 1.06 -0.38 0.00 -1.33 0.00 0.00 58.87 58.22 1sdo n SER 171 Cb 0.65 -1.30 0.03 0.00 -0.75 0.00 0.00 64.21 62.84 1sdo n SER 171 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1sdo s SER 172 N -0.72 5.41 0.00 -3.46 0.01 -1.26 -3.39 113.70 110.29 1sdo s SER 172 Ca 0.62 2.63 0.00 0.00 1.31 0.00 0.00 55.95 60.51 1sdo s SER 172 Cb -0.60 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.00 1sdo s SER 172 CO 0.58 -1.46 0.00 0.61 0.41 0.00 0.00 173.24 173.37 1sdo n GLY 173 N 0.66 0.29 3.70 3.44 0.00 -1.26 -5.06 105.19 106.95 1sdo n GLY 173 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1sdo n GLY 173 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sdo s ILE 174 N -2.00 4.93 0.63 -0.61 1.01 -1.22 -2.18 121.20 121.77 1sdo s ILE 174 Ca 0.00 1.71 -0.16 0.00 0.00 0.00 0.00 60.65 62.19 1sdo s ILE 174 Cb 0.00 -4.16 -0.01 0.00 0.01 0.00 0.00 42.46 38.29 1sdo s ILE 174 CO 0.00 0.15 1.13 -0.94 0.00 0.00 0.00 174.94 175.28 1sdo s SER 175 N 0.98 5.17 0.20 3.58 1.04 -1.08 -4.90 113.70 118.70 1sdo s SER 175 Ca 0.42 2.11 0.05 0.00 0.48 0.00 0.00 55.95 59.02 1sdo s SER 175 Cb -0.18 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.32 1sdo s SER 175 CO 0.19 -1.59 -0.08 -0.72 0.98 0.00 0.00 173.24 172.02 1sdo s TYR 176 N -2.11 1.55 0.17 5.02 -0.85 -1.26 -4.58 117.35 115.29 1sdo s TYR 176 Ca 0.70 -0.75 -0.23 0.00 -0.52 0.00 0.00 57.07 56.27 1sdo s TYR 176 Cb -0.23 -0.82 0.07 0.00 0.38 0.00 0.00 41.96 41.37 1sdo s TYR 176 CO 0.38 0.14 1.59 -0.92 -1.52 0.00 0.00 175.55 175.21 1sdo h TYR 177 N 2.57 -1.01 -0.94 -3.49 3.20 -1.05 -1.72 116.97 114.54 1sdo h TYR 177 Ca -0.38 0.07 0.06 0.00 3.14 0.00 0.00 58.73 61.62 1sdo h TYR 177 Cb 1.21 0.51 -0.06 0.00 1.54 0.00 0.00 36.73 39.93 1sdo h TYR 177 CO 0.65 -0.40 0.60 0.93 -1.64 0.00 0.00 178.16 178.30 1sdo h GLU 178 N -0.23 1.06 -0.47 1.82 3.07 -1.96 0.25 114.58 118.13 1sdo h GLU 178 Ca 0.19 -0.06 -0.13 0.00 -0.50 0.00 0.00 59.36 58.86 1sdo h GLU 178 Cb 0.55 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 1sdo h GLU 178 CO -0.62 0.70 -0.22 0.78 -1.40 0.00 0.00 179.01 178.26 1sdo h GLY 179 N 1.09 1.07 1.71 -3.84 0.00 -1.82 -2.48 103.07 98.79 1sdo h GLY 179 Ca 0.40 -0.95 -0.19 0.00 0.00 0.00 0.00 47.33 46.59 1sdo h GLY 179 CO -0.17 0.87 -0.82 0.83 0.00 0.00 0.00 176.54 177.24 1sdo h GLU 180 N 0.83 0.27 -0.84 4.80 4.39 -0.90 -1.91 114.58 121.23 1sdo h GLU 180 Ca 0.11 -0.26 -0.03 0.00 0.34 0.00 0.00 59.36 59.51 1sdo h GLU 180 Cb 0.80 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.48 1sdo h GLU 180 CO 0.07 0.95 0.40 1.25 -1.16 0.00 0.00 179.01 180.53 1sdo h LEU 181 N 0.17 1.10 -0.32 1.33 5.85 -0.95 -1.98 115.31 120.50 1sdo h LEU 181 Ca -0.04 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1sdo h LEU 181 Cb 1.43 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 42.16 1sdo h LEU 181 CO 0.13 0.92 0.17 0.22 -0.34 0.00 0.00 178.44 179.55 1sdo h TYR 182 N 1.19 0.45 -0.12 1.25 3.20 -1.30 -1.31 116.97 120.34 1sdo h TYR 182 Ca 0.29 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.16 1sdo h TYR 182 Cb 0.12 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1sdo h TYR 182 CO 0.01 0.37 0.08 -0.91 -1.64 0.00 0.00 178.16 176.08 1sdo h ASN 183 N 0.40 0.08 0.02 -2.11 2.35 -0.84 0.27 115.58 115.74 1sdo h ASN 183 Ca 0.11 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.86 1sdo h ASN 183 Cb 0.08 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1sdo h ASN 183 CO -0.02 0.06 -0.01 0.58 -1.65 0.00 0.00 177.43 176.39 1sdo h VAL 184 N 0.09 1.43 0.00 2.81 2.07 -0.97 -3.32 116.25 118.36 1sdo h VAL 184 Ca 0.05 -1.91 -0.05 0.00 0.82 0.00 0.00 66.70 65.61 1sdo h VAL 184 Cb 0.10 2.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.49 1sdo h VAL 184 CO -0.01 0.46 -0.24 0.40 0.02 0.00 0.00 177.57 178.20 1sdo h ILE 185 N -0.92 1.03 0.00 4.57 2.04 -1.07 -2.09 117.51 121.07 1sdo h ILE 185 Ca -0.00 -0.84 -0.00 0.00 1.00 0.00 0.00 64.86 65.01 1sdo h ILE 185 Cb 0.77 1.47 -0.00 0.00 -0.74 0.00 0.00 36.82 38.32 1sdo h ILE 185 CO 0.00 0.23 -0.00 -0.09 0.00 0.00 0.00 178.15 178.29 1sdo h ARG 186 N 0.00 0.00 0.00 2.37 2.43 -1.05 -2.08 114.38 116.04 1sdo h ARG 186 Ca -0.00 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1sdo h ARG 186 Cb 0.45 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 1sdo h ARG 186 CO 0.03 0.00 -0.19 1.96 -1.51 0.00 0.00 179.97 180.27 1sdo h GLN 187 N 0.00 0.00 0.00 0.20 1.08 -1.47 -3.49 115.11 111.43 1sdo h GLN 187 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1sdo h GLN 187 Cb 0.21 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.64 1sdo h GLN 187 CO 0.00 0.19 0.00 0.41 -0.95 0.00 0.00 178.83 178.48 1sdo n GLY 188 N -0.28 0.93 3.74 3.46 0.00 -0.78 -4.91 105.19 107.35 1sdo n GLY 188 Ca -0.01 -2.17 -0.42 0.00 0.00 0.00 0.00 46.02 43.42 1sdo n GLY 188 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1sdo s ARG 189 N -1.25 4.12 -1.34 1.61 6.06 -1.26 -3.79 118.95 123.10 1sdo s ARG 189 Ca 0.00 2.58 -0.07 0.00 -2.50 0.00 0.00 55.73 55.74 1sdo s ARG 189 Cb 0.00 -3.03 0.01 0.00 0.06 0.00 0.00 34.95 31.98 1sdo s ARG 189 CO 0.00 -0.65 0.95 0.41 -2.50 0.00 0.00 175.30 173.51 1sdo n GLY 190 N 2.50 -0.46 2.99 8.12 0.00 -1.26 -5.03 105.19 112.05 1sdo n GLY 190 Ca 0.10 0.16 -0.25 0.00 0.00 0.00 0.00 46.02 46.03 1sdo n GLY 190 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sdo s VAL 191 N -3.25 1.08 0.96 1.61 1.01 -1.25 -3.75 120.40 116.82 1sdo s VAL 191 Ca 0.47 -0.41 -0.12 0.00 0.00 0.00 0.00 61.98 61.92 1sdo s VAL 191 Cb -0.21 -1.02 0.17 0.00 0.00 0.00 0.00 36.38 35.32 1sdo s VAL 191 CO 0.58 0.35 1.09 -2.16 0.00 0.00 0.00 175.10 174.97 1sdo s PRO 192 N 0.96 0.71 0.34 2.72 0.04 -1.26 -4.80 135.00 133.71 1sdo s PRO 192 Ca -0.09 0.66 0.26 0.00 0.04 0.00 0.00 61.00 61.87 1sdo s PRO 192 Cb -0.15 -1.76 1.17 0.00 0.04 0.00 0.00 34.50 33.80 1sdo s PRO 192 CO 0.00 -2.57 1.78 0.00 0.04 0.00 0.00 177.00 176.25 1sdo h ALA 193 N -1.78 1.00 -2.46 8.56 0.00 -1.96 -3.43 119.26 119.18 1sdo h ALA 193 Ca -0.53 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 53.83 1sdo h ALA 193 Cb 1.31 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.06 1sdo h ALA 193 CO 0.56 0.00 0.32 0.54 0.00 0.00 0.00 179.25 180.67 1sdo s VAL 194 N -3.47 4.91 0.42 0.00 0.11 -1.26 -5.01 120.40 116.10 1sdo s VAL 194 Ca 0.02 1.85 -0.26 0.00 -2.93 0.00 0.00 61.98 60.66 1sdo s VAL 194 Cb 0.09 -4.23 -0.09 0.00 -1.53 0.00 0.00 36.38 30.63 1sdo s VAL 194 CO 0.38 0.15 1.37 -2.84 -3.33 0.00 0.00 175.10 170.83 1sdo s PRO 195 N 1.20 3.86 0.11 1.54 0.02 -1.26 -4.88 135.00 135.59 1sdo s PRO 195 Ca 0.46 2.31 -0.02 0.00 0.02 0.00 0.00 61.00 63.77 1sdo s PRO 195 Cb -0.19 -2.73 -0.04 0.00 0.02 0.00 0.00 34.50 31.56 1sdo s PRO 195 CO 0.22 -0.64 0.06 -0.51 -0.33 0.00 0.00 177.00 175.80 1sdo s LEU 196 N -2.52 1.90 -0.13 -5.54 1.43 -0.76 -1.38 118.68 111.68 1sdo s LEU 196 Ca 0.58 -1.10 -0.01 0.00 -1.03 0.00 0.00 54.13 52.58 1sdo s LEU 196 Cb -0.41 0.37 0.03 0.00 0.03 0.00 0.00 46.19 46.21 1sdo s LEU 196 CO 0.53 -0.70 -0.06 -0.69 0.23 0.00 0.00 176.35 175.66 1sdo s VAL 197 N -4.00 1.00 -0.20 -1.59 1.01 -0.34 -0.28 120.40 116.00 1sdo s VAL 197 Ca 0.18 -0.41 -0.10 0.00 0.00 0.00 0.00 61.98 61.65 1sdo s VAL 197 Cb 0.07 -1.11 -0.05 0.00 0.00 0.00 0.00 36.38 35.30 1sdo s VAL 197 CO -0.02 0.25 0.13 -0.76 0.00 0.00 0.00 175.10 174.69 1sdo s LEU 198 N 1.70 4.18 -0.14 3.92 1.43 0.04 -1.47 118.68 128.34 1sdo s LEU 198 Ca 0.03 0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.35 1sdo s LEU 198 Cb -0.14 -2.09 0.02 0.00 0.03 0.00 0.00 46.19 44.02 1sdo s LEU 198 CO -0.08 0.17 -0.15 -0.63 0.23 0.00 0.00 176.35 175.89 1sdo s ILE 199 N 0.44 1.56 -0.22 -0.59 1.01 -0.01 -0.48 121.20 122.92 1sdo s ILE 199 Ca 0.08 -0.64 -0.10 0.00 0.00 0.00 0.00 60.65 59.98 1sdo s ILE 199 Cb -0.11 -1.45 -0.05 0.00 0.01 0.00 0.00 42.46 40.85 1sdo s ILE 199 CO -0.01 0.46 0.14 -0.83 0.00 0.00 0.00 174.94 174.69 1sdo s GLY 200 N 1.33 2.00 0.32 6.18 0.00 0.05 -0.25 107.32 116.94 1sdo s GLY 200 Ca 0.01 -0.79 0.08 0.00 0.00 0.00 0.00 44.72 44.02 1sdo s GLY 200 CO -0.08 0.25 -0.07 -0.26 0.00 0.00 0.00 173.10 172.94 1sdo s ILE 201 N 0.70 1.98 0.19 0.90 -4.36 0.11 -0.84 121.20 119.87 1sdo s ILE 201 Ca 0.07 -2.16 -0.10 0.00 -0.26 0.00 0.00 60.65 58.20 1sdo s ILE 201 Cb -0.12 -2.58 -0.01 0.00 1.25 0.00 0.00 42.46 41.00 1sdo s ILE 201 CO 0.01 -0.23 0.33 0.00 0.24 0.00 0.00 174.94 175.29 1sdo s ALA 202 N -2.79 -0.03 -1.89 2.27 0.00 -0.54 -0.80 121.76 117.98 1sdo s ALA 202 Ca 0.31 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1sdo s ALA 202 Cb 0.03 0.94 0.00 0.00 0.00 0.00 0.00 23.12 24.10 1sdo s ALA 202 CO 0.15 -0.70 0.47 -2.30 0.00 0.00 0.00 175.76 173.38