#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h92 s ILE 4 N 0.00 0.34 -0.05 0.00 2.07 -1.26 -4.82 121.20 117.48 2h92 s ILE 4 Ca 0.00 -1.28 0.06 0.00 -1.41 0.00 0.00 60.65 58.02 2h92 s ILE 4 Cb 0.00 -0.81 -0.01 0.00 0.13 0.00 0.00 42.46 41.77 2h92 s ILE 4 CO 0.00 -0.62 -0.24 0.20 -1.91 0.00 0.00 174.94 172.38 2h92 s ASN 5 N -2.01 2.88 -0.16 4.50 0.02 -1.26 -0.21 114.94 118.70 2h92 s ASN 5 Ca -0.06 -0.48 0.01 0.00 -1.02 0.00 0.00 52.86 51.32 2h92 s ASN 5 Cb -0.04 -0.75 0.01 0.00 0.02 0.00 0.00 41.25 40.48 2h92 s ASN 5 CO -0.03 0.23 -0.20 -0.63 0.02 0.00 0.00 177.10 176.50 2h92 s ILE 6 N -0.16 2.20 -0.18 0.60 1.01 -0.18 -1.89 121.20 122.60 2h92 s ILE 6 Ca -0.03 -0.92 -0.14 0.00 0.00 0.00 0.00 60.65 59.57 2h92 s ILE 6 Cb -0.13 -1.91 -0.05 0.00 0.01 0.00 0.00 42.46 40.39 2h92 s ILE 6 CO 0.03 0.54 0.29 0.00 0.00 0.00 0.00 174.94 175.79 2h92 s ALA 7 N 1.00 3.59 -0.35 9.38 0.00 0.91 -1.15 121.76 135.14 2h92 s ALA 7 Ca -0.02 -0.54 0.02 0.00 0.00 0.00 0.00 51.96 51.42 2h92 s ALA 7 Cb -0.15 -2.42 0.11 0.00 0.00 0.00 0.00 23.12 20.66 2h92 s ALA 7 CO -0.05 -0.02 0.10 -1.17 0.00 0.00 0.00 175.76 174.62 2h92 s LEU 8 N 0.71 3.45 0.15 0.00 1.98 0.05 -0.00 118.68 125.02 2h92 s LEU 8 Ca 0.15 -2.05 0.05 0.00 -2.89 0.00 0.00 54.13 49.39 2h92 s LEU 8 Cb -0.13 -1.24 -0.04 0.00 0.66 0.00 0.00 46.19 45.44 2h92 s LEU 8 CO 0.04 -0.37 0.14 -1.81 -1.89 0.00 0.00 176.35 172.46 2h92 s ASP 9 N 1.07 5.57 0.00 3.68 1.11 -0.28 -1.25 116.67 126.57 2h92 s ASP 9 Ca 0.12 -0.10 0.00 0.00 0.18 0.00 0.00 52.55 52.75 2h92 s ASP 9 Cb -0.19 -1.47 0.00 0.00 1.07 0.00 0.00 42.92 42.32 2h92 s ASP 9 CO -0.14 0.08 0.00 0.61 1.18 0.00 0.00 175.17 176.90 2h92 n GLY 10 N -0.28 1.24 3.32 0.21 0.00 -1.04 -0.47 105.19 108.18 2h92 n GLY 10 Ca -0.08 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.78 2h92 n GLY 10 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2h92 n PRO 11 N -0.43 -2.49 -2.09 1.61 -0.04 -1.26 -4.69 135.00 125.62 2h92 n PRO 11 Ca 0.00 -1.69 -0.37 0.00 -0.04 0.00 0.00 63.50 61.39 2h92 n PRO 11 Cb 0.00 -1.44 0.01 0.00 -0.04 0.00 0.00 33.50 32.03 2h92 n PRO 11 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2h92 s ALA 12 N -3.28 2.90 -1.28 0.55 0.00 -1.26 -3.29 121.76 116.10 2h92 s ALA 12 Ca 0.67 1.07 -0.04 0.00 0.00 0.00 0.00 51.96 53.66 2h92 s ALA 12 Cb -0.05 -3.45 0.02 0.00 0.00 0.00 0.00 23.12 19.65 2h92 s ALA 12 CO 0.50 -0.92 0.26 0.00 0.00 0.00 0.00 175.76 175.60 2h92 n ALA 13 N -0.72 -0.88 1.25 0.00 0.00 -1.26 -4.84 120.51 114.05 2h92 n ALA 13 Ca 0.09 0.14 0.13 0.00 0.00 0.00 0.00 53.44 53.80 2h92 n ALA 13 Cb 0.47 -2.39 0.48 0.00 0.00 0.00 0.00 19.45 18.01 2h92 n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h92 n ALA 14 N -2.83 2.96 0.00 0.00 0.00 -1.21 -4.68 120.51 114.74 2h92 n ALA 14 Ca -0.11 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.02 2h92 n ALA 14 Cb 0.60 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2h92 n ALA 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h92 n GLY 15 N 1.36 3.32 0.02 0.00 0.00 -1.26 -4.94 105.19 103.69 2h92 n GLY 15 Ca 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.13 2h92 n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2h92 n LYS 16 N -1.69 -0.03 -0.15 1.61 5.02 -1.26 -0.43 118.16 121.23 2h92 n LYS 16 Ca 0.00 0.13 -0.03 0.00 -2.02 0.00 0.00 58.31 56.39 2h92 n LYS 16 Cb 0.00 -0.20 0.06 0.00 -0.02 0.00 0.00 35.03 34.87 2h92 n LYS 16 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2h92 h SER 17 N 0.00 0.02 0.39 4.39 4.64 -1.97 0.54 113.55 121.57 2h92 h SER 17 Ca 0.01 0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 2h92 h SER 17 Cb 0.02 0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 2h92 h SER 17 CO -0.06 0.04 -0.41 0.74 -0.87 0.00 0.00 176.83 176.28 2h92 h THR 18 N 0.24 0.00 -0.46 2.95 2.02 -1.18 -1.47 112.91 115.02 2h92 h THR 18 Ca 0.23 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.49 2h92 h THR 18 Cb 0.30 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.64 2h92 h THR 18 CO -0.30 0.00 0.06 0.40 0.37 0.00 0.00 175.52 176.06 2h92 h ILE 19 N -0.80 0.72 -0.40 3.11 1.08 -1.10 -1.70 117.51 118.42 2h92 h ILE 19 Ca -0.05 -0.06 0.07 0.00 -0.39 0.00 0.00 64.86 64.43 2h92 h ILE 19 Cb 0.70 0.51 -0.02 0.00 -3.07 0.00 0.00 36.82 34.94 2h92 h ILE 19 CO -0.06 0.03 0.27 0.00 -0.69 0.00 0.00 178.15 177.71 2h92 h ALA 20 N 1.37 2.06 0.14 1.87 0.00 0.26 -1.33 119.26 123.64 2h92 h ALA 20 Ca 0.23 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2h92 h ALA 20 Cb 0.31 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2h92 h ALA 20 CO -0.32 -0.15 -0.07 0.87 0.00 0.00 0.00 179.25 179.58 2h92 h LYS 21 N 0.24 -0.18 0.26 0.00 1.57 -0.33 -1.94 116.57 116.20 2h92 h LYS 21 Ca 0.18 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2h92 h LYS 21 Cb 0.40 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.73 2h92 h LYS 21 CO -0.03 0.19 -0.28 0.00 -0.57 0.00 0.00 179.45 178.76 2h92 h ARG 22 N -0.59 -0.56 -0.41 3.15 3.08 -1.17 -0.07 114.38 117.81 2h92 h ARG 22 Ca -0.02 0.04 0.07 0.00 0.07 0.00 0.00 59.98 60.14 2h92 h ARG 22 Cb 0.45 0.13 -0.06 0.00 0.08 0.00 0.00 29.97 30.57 2h92 h ARG 22 CO 0.03 -0.37 0.04 0.28 -1.07 0.00 0.00 179.97 178.88 2h92 h VAL 23 N -0.58 0.73 -0.84 2.04 2.07 -1.33 0.53 116.25 118.88 2h92 h VAL 23 Ca -0.01 -0.05 0.05 0.00 0.82 0.00 0.00 66.70 67.51 2h92 h VAL 23 Cb 0.54 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 30.82 2h92 h VAL 23 CO -0.07 0.03 0.52 0.00 0.02 0.00 0.00 177.57 178.08 2h92 h ALA 24 N 1.34 1.13 0.43 1.67 0.00 -1.05 -1.30 119.26 121.47 2h92 h ALA 24 Ca 0.20 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2h92 h ALA 24 Cb 0.27 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2h92 h ALA 24 CO -0.30 0.30 -0.20 1.03 0.00 0.00 0.00 179.25 180.07 2h92 h SER 25 N 0.98 -0.48 0.14 0.00 0.87 0.27 0.54 113.55 115.87 2h92 h SER 25 Ca 0.35 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.91 2h92 h SER 25 Cb 0.10 0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 62.19 2h92 h SER 25 CO -0.15 -0.34 -0.06 -0.33 -0.53 0.00 0.00 176.83 175.41 2h92 h GLU 26 N -0.57 0.00 -0.58 2.24 5.08 -0.57 -2.03 114.58 118.14 2h92 h GLU 26 Ca -0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2h92 h GLU 26 Cb 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 2h92 h GLU 26 CO 0.10 0.06 0.00 1.28 -1.00 0.00 0.00 179.01 179.45 2h92 n LEU 27 N -3.91 3.97 -3.88 1.33 4.32 -0.52 -4.95 117.00 113.36 2h92 n LEU 27 Ca -0.03 -2.21 -0.27 0.00 -0.02 0.00 0.00 56.01 53.49 2h92 n LEU 27 Cb 0.15 -0.46 0.01 0.00 -1.62 0.00 0.00 43.42 41.51 2h92 n LEU 27 CO 0.30 0.85 -0.04 -1.20 -1.22 0.00 0.00 177.39 176.08 2h92 n SER 28 N 1.06 -2.42 -4.67 -1.43 7.64 -0.32 -4.97 113.62 108.50 2h92 n SER 28 Ca 0.22 -0.86 -0.31 0.00 1.01 0.00 0.00 58.87 58.92 2h92 n SER 28 Cb 0.68 -3.66 -0.09 0.00 -1.01 0.00 0.00 64.21 60.13 2h92 n SER 28 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2h92 s MET 29 N -6.41 2.10 -0.09 1.43 -1.94 0.17 -5.03 119.30 109.53 2h92 s MET 29 Ca 0.30 -2.29 -0.01 0.00 -1.71 0.00 0.00 55.69 51.98 2h92 s MET 29 Cb -0.15 -1.49 -0.03 0.00 2.01 0.00 0.00 34.83 35.17 2h92 s MET 29 CO 0.85 -0.27 -0.04 0.42 -0.01 0.00 0.00 175.02 175.97 2h92 s ILE 30 N -2.86 3.95 -0.19 2.53 1.01 -0.36 -4.35 121.20 120.93 2h92 s ILE 30 Ca 0.16 -0.38 -0.16 0.00 0.00 0.00 0.00 60.65 60.27 2h92 s ILE 30 Cb 0.04 -2.65 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 2h92 s ILE 30 CO 0.08 0.58 0.42 -0.47 0.00 0.00 0.00 174.94 175.55 2h92 s TYR 31 N -0.61 3.39 -0.23 3.97 5.04 -1.26 -0.05 117.35 127.61 2h92 s TYR 31 Ca 0.10 0.66 -0.01 0.00 -2.44 0.00 0.00 57.07 55.38 2h92 s TYR 31 Cb -0.12 -2.54 0.02 0.00 0.35 0.00 0.00 41.96 39.68 2h92 s TYR 31 CO 0.02 0.01 -0.10 0.08 -1.34 0.00 0.00 175.55 174.22 2h92 s VAL 32 N 1.23 2.64 -0.59 3.14 1.01 -0.59 -4.82 120.40 122.40 2h92 s VAL 32 Ca 0.20 -0.98 -0.19 0.00 0.00 0.00 0.00 61.98 61.01 2h92 s VAL 32 Cb -0.15 -2.28 0.10 0.00 0.00 0.00 0.00 36.38 34.06 2h92 s VAL 32 CO 0.08 0.31 0.72 -0.62 0.00 0.00 0.00 175.10 175.59 2h92 s ASP 33 N 1.32 6.18 0.36 3.32 3.68 -1.26 -1.96 116.67 128.31 2h92 s ASP 33 Ca 0.02 -1.39 0.17 0.00 2.13 0.00 0.00 52.55 53.48 2h92 s ASP 33 Cb -0.16 -2.31 0.66 0.00 -1.45 0.00 0.00 42.92 39.67 2h92 s ASP 33 CO -0.07 -1.14 1.73 0.71 0.13 0.00 0.00 175.17 176.54 2h92 h THR 34 N 5.93 0.98 -1.00 1.71 1.35 -1.94 -2.90 112.91 117.04 2h92 h THR 34 Ca -0.29 -1.56 0.07 0.00 -0.55 0.00 0.00 66.41 64.08 2h92 h THR 34 Cb 1.09 1.92 -0.07 0.00 -1.73 0.00 0.00 68.15 69.36 2h92 h THR 34 CO 1.11 0.39 0.65 1.23 -0.25 0.00 0.00 175.52 178.65 2h92 h GLY 35 N 1.91 1.53 1.11 5.82 0.00 -1.91 -1.12 103.07 110.40 2h92 h GLY 35 Ca -0.00 -0.48 0.07 0.00 0.00 0.00 0.00 47.33 46.92 2h92 h GLY 35 CO 0.05 0.34 0.43 0.00 0.00 0.00 0.00 176.54 177.36 2h92 h ALA 36 N 1.46 1.78 -0.06 3.60 0.00 -1.93 0.26 119.26 124.37 2h92 h ALA 36 Ca 0.43 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.32 2h92 h ALA 36 Cb 0.17 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2h92 h ALA 36 CO -0.17 0.11 0.02 0.52 0.00 0.00 0.00 179.25 179.73 2h92 h MET 37 N 0.65 0.10 -0.46 0.00 2.86 -1.33 0.39 114.93 117.14 2h92 h MET 37 Ca 0.29 -0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.83 2h92 h MET 37 Cb 0.29 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 2h92 h MET 37 CO -0.09 0.27 -0.01 1.88 1.06 0.00 0.00 176.91 180.03 2h92 h TYR 38 N -0.09 0.81 -0.54 -0.22 -1.99 -1.13 -1.82 116.97 111.99 2h92 h TYR 38 Ca 0.02 -0.11 -0.08 0.00 2.00 0.00 0.00 58.73 60.55 2h92 h TYR 38 Cb 0.22 -0.22 -0.02 0.00 2.00 0.00 0.00 36.73 38.70 2h92 h TYR 38 CO -0.00 0.76 0.00 0.00 -0.00 0.00 0.00 178.16 178.92 2h92 h ARG 39 N 0.72 0.92 -0.54 4.88 3.08 -0.79 -0.56 114.38 122.10 2h92 h ARG 39 Ca 0.14 -0.27 -0.04 0.00 0.07 0.00 0.00 59.98 59.89 2h92 h ARG 39 Cb 0.45 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 2h92 h ARG 39 CO 0.02 0.91 0.20 0.00 -1.07 0.00 0.00 179.97 180.03 2h92 h ALA 40 N 1.14 0.70 -0.29 0.04 0.00 -0.45 0.15 119.26 120.57 2h92 h ALA 40 Ca 0.16 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2h92 h ALA 40 Cb 0.50 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2h92 h ALA 40 CO 0.02 0.33 -0.12 -0.07 0.00 0.00 0.00 179.25 179.42 2h92 h LEU 41 N 0.74 0.47 -0.79 0.00 4.07 -1.14 -1.33 115.31 117.32 2h92 h LEU 41 Ca 0.18 -0.12 -0.12 0.00 0.08 0.00 0.00 57.88 57.90 2h92 h LEU 41 Cb 0.23 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.83 2h92 h LEU 41 CO -0.01 0.62 -0.38 0.74 -1.08 0.00 0.00 178.44 178.33 2h92 h THR 42 N 0.45 1.30 -0.57 0.22 2.02 -0.38 -0.43 112.91 115.52 2h92 h THR 42 Ca 0.08 -1.51 -0.02 0.00 0.77 0.00 0.00 66.41 65.73 2h92 h THR 42 Cb 0.48 1.56 -0.03 0.00 -1.74 0.00 0.00 68.15 68.42 2h92 h THR 42 CO 0.03 0.47 0.26 0.22 0.37 0.00 0.00 175.52 176.87 2h92 h TYR 43 N 0.38 0.83 -0.58 3.16 3.20 0.20 -0.61 116.97 123.55 2h92 h TYR 43 Ca 0.04 -0.05 -0.07 0.00 3.14 0.00 0.00 58.73 61.79 2h92 h TYR 43 Cb 0.84 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.83 2h92 h TYR 43 CO 0.03 0.65 0.08 -0.22 -1.64 0.00 0.00 178.16 177.06 2h92 h LYS 44 N 0.77 0.97 -0.44 1.82 1.63 -0.93 -1.54 116.57 118.85 2h92 h LYS 44 Ca 0.19 -0.27 0.05 0.00 -0.85 0.00 0.00 60.65 59.78 2h92 h LYS 44 Cb 0.14 -0.11 -0.05 0.00 -0.60 0.00 0.00 32.23 31.62 2h92 h LYS 44 CO -0.02 0.93 0.16 -0.92 -3.45 0.00 0.00 179.45 176.15 2h92 h TYR 45 N 0.86 0.29 -0.53 1.91 3.20 -0.63 -0.01 116.97 122.07 2h92 h TYR 45 Ca 0.17 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.01 2h92 h TYR 45 Cb 0.44 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 2h92 h TYR 45 CO 0.03 0.11 0.12 -0.07 -1.64 0.00 0.00 178.16 176.72 2h92 h LEU 46 N 0.34 0.81 -1.38 2.82 3.38 -0.86 -0.16 115.31 120.26 2h92 h LEU 46 Ca 0.20 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.95 2h92 h LEU 46 Cb 0.19 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2h92 h LEU 46 CO -0.20 0.84 0.42 0.50 0.09 0.00 0.00 178.44 180.10 2h92 h LYS 47 N 0.75 0.81 -1.04 1.13 3.64 -0.75 -2.08 116.57 119.04 2h92 h LYS 47 Ca 0.17 -0.05 -0.21 0.00 -1.27 0.00 0.00 60.65 59.28 2h92 h LYS 47 Cb 0.35 -0.18 -0.12 0.00 -0.41 0.00 0.00 32.23 31.86 2h92 h LYS 47 CO 0.00 0.54 0.27 1.28 -2.27 0.00 0.00 179.45 179.28 2h92 n LEU 48 N -4.45 4.64 -3.72 5.20 4.77 -0.06 -4.85 117.00 118.53 2h92 n LEU 48 Ca 0.07 -2.41 -0.26 0.00 -0.03 0.00 0.00 56.01 53.38 2h92 n LEU 48 Cb 0.07 -0.67 0.06 0.00 -2.33 0.00 0.00 43.42 40.54 2h92 n LEU 48 CO 0.36 0.76 0.16 0.59 -1.33 0.00 0.00 177.39 177.92 2h92 n ASN 49 N -0.12 -5.02 -3.88 -1.43 3.02 -0.78 -2.64 115.26 104.40 2h92 n ASN 49 Ca 0.24 -0.66 -0.26 0.00 -0.03 0.00 0.00 54.58 53.87 2h92 n ASN 49 Cb 0.95 -4.51 -0.00 0.00 -0.61 0.00 0.00 39.78 35.60 2h92 n ASN 49 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2h92 n LYS 50 N -4.76 -3.13 -1.69 3.52 5.02 -0.13 -4.89 118.16 112.10 2h92 n LYS 50 Ca -0.03 0.43 -0.40 0.00 -2.02 0.00 0.00 58.31 56.30 2h92 n LYS 50 Cb 0.56 -4.51 0.03 0.00 -0.02 0.00 0.00 35.03 31.09 2h92 n LYS 50 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 2h92 n THR 51 N -4.36 3.09 1.16 -0.18 5.66 -1.08 -4.90 114.28 113.66 2h92 n THR 51 Ca -0.28 -0.50 0.12 0.00 -3.05 0.00 0.00 64.05 60.35 2h92 n THR 51 Cb 0.67 -1.49 0.21 0.00 -1.55 0.00 0.00 70.33 68.18 2h92 n THR 51 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2h92 n GLU 52 N -0.42 1.45 -3.09 1.09 -0.58 -1.26 -4.63 120.64 113.20 2h92 n GLU 52 Ca 0.09 -1.07 -0.44 0.00 -0.42 0.00 0.00 57.16 55.31 2h92 n GLU 52 Cb 0.42 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.81 2h92 n GLU 52 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2h92 n ASP 53 N 0.16 5.35 0.20 1.62 4.64 -1.26 -4.82 116.55 122.44 2h92 n ASP 53 Ca 0.13 -3.00 0.05 0.00 -1.38 0.00 0.00 54.79 50.59 2h92 n ASP 53 Cb 0.45 -1.50 0.43 0.00 -1.04 0.00 0.00 41.12 39.46 2h92 n ASP 53 CO 0.00 0.00 0.00 -0.26 -0.82 0.00 0.00 177.20 176.12 2h92 h PHE 54 N 6.92 0.00 -0.28 -0.67 0.04 -1.99 -1.66 116.94 119.30 2h92 h PHE 54 Ca 0.27 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.01 2h92 h PHE 54 Cb 0.87 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.01 2h92 h PHE 54 CO 0.97 0.32 0.09 0.00 -0.60 0.00 0.00 178.31 179.09 2h92 h ALA 55 N 1.68 0.37 -0.55 2.45 0.00 -1.94 -1.04 119.26 120.24 2h92 h ALA 55 Ca -0.00 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 2h92 h ALA 55 Cb 0.65 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2h92 h ALA 55 CO 0.04 0.01 -0.06 -0.22 0.00 0.00 0.00 179.25 179.02 2h92 h LYS 56 N 0.30 1.01 -0.25 0.00 3.64 -1.92 -1.05 116.57 118.30 2h92 h LYS 56 Ca 0.09 -0.35 0.03 0.00 -1.27 0.00 0.00 60.65 59.15 2h92 h LYS 56 Cb 0.24 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 2h92 h LYS 56 CO -0.00 1.04 0.06 1.25 -2.27 0.00 0.00 179.45 179.52 2h92 h LEU 57 N 0.89 0.03 -0.66 5.20 6.46 -1.06 -1.24 115.31 124.93 2h92 h LEU 57 Ca 0.15 0.04 -0.10 0.00 -0.12 0.00 0.00 57.88 57.84 2h92 h LEU 57 Cb 0.62 0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.58 2h92 h LEU 57 CO 0.04 0.05 -0.08 0.58 -0.62 0.00 0.00 178.44 178.41 2h92 h VAL 58 N 0.16 1.26 -0.47 1.05 2.07 -1.06 -3.05 116.25 116.20 2h92 h VAL 58 Ca 0.12 -1.21 0.03 0.00 0.82 0.00 0.00 66.70 66.45 2h92 h VAL 58 Cb 0.11 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 2h92 h VAL 58 CO -0.15 0.43 0.27 0.44 0.02 0.00 0.00 177.57 178.58 2h92 h ASP 59 N 0.86 0.43 -0.64 0.57 3.32 -0.74 -2.74 116.42 117.48 2h92 h ASP 59 Ca 0.14 0.01 -0.36 0.00 0.02 0.00 0.00 57.03 56.84 2h92 h ASP 59 Cb 0.62 -0.08 -0.20 0.00 0.22 0.00 0.00 39.33 39.89 2h92 h ASP 59 CO 0.04 0.31 0.46 0.00 -1.72 0.00 0.00 179.24 178.33 2h92 n GLN 60 N -4.84 1.88 -4.00 3.56 6.02 -0.51 -4.90 117.38 114.59 2h92 n GLN 60 Ca 0.03 -1.98 -0.13 0.00 -0.01 0.00 0.00 57.00 54.90 2h92 n GLN 60 Cb 0.08 -1.78 -0.14 0.00 1.02 0.00 0.00 30.24 29.43 2h92 n GLN 60 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2h92 s THR 61 N -2.40 0.20 -0.03 5.09 2.01 -1.04 -5.01 115.64 114.46 2h92 s THR 61 Ca 0.38 -0.25 0.06 0.00 0.31 0.00 0.00 61.69 62.19 2h92 s THR 61 Cb 0.31 -0.20 -0.02 0.00 0.01 0.00 0.00 72.50 72.60 2h92 s THR 61 CO 0.05 -0.03 -0.21 0.42 -0.69 0.00 0.00 174.62 174.16 2h92 s THR 62 N -0.29 2.52 -0.12 -0.82 -4.23 -1.26 -4.96 115.64 106.48 2h92 s THR 62 Ca -0.02 -0.93 -0.05 0.00 -1.18 0.00 0.00 61.69 59.51 2h92 s THR 62 Cb -0.02 -1.93 0.06 0.00 1.34 0.00 0.00 72.50 71.94 2h92 s THR 62 CO -0.00 0.58 0.27 -0.22 -0.54 0.00 0.00 174.62 174.71 2h92 s LEU 63 N -0.67 -0.04 0.02 4.79 0.20 -1.26 -0.59 118.68 121.13 2h92 s LEU 63 Ca 0.11 0.59 0.03 0.00 0.69 0.00 0.00 54.13 55.54 2h92 s LEU 63 Cb -0.10 0.75 -0.01 0.00 -0.43 0.00 0.00 46.19 46.40 2h92 s LEU 63 CO -0.00 -0.21 -0.08 -1.81 -0.29 0.00 0.00 176.35 173.96 2h92 s ASP 64 N 1.95 0.94 -0.17 3.68 -0.00 -0.39 -5.00 116.67 117.69 2h92 s ASP 64 Ca -0.03 -0.29 -0.08 0.00 -0.00 0.00 0.00 52.55 52.15 2h92 s ASP 64 Cb -0.11 -0.06 -0.04 0.00 -0.00 0.00 0.00 42.92 42.71 2h92 s ASP 64 CO -0.09 -0.01 0.09 -0.76 -0.00 0.00 0.00 175.17 174.41 2h92 s LEU 65 N -0.70 4.04 0.18 1.23 1.02 -1.26 -0.36 118.68 122.82 2h92 s LEU 65 Ca -0.01 0.22 0.02 0.00 0.02 0.00 0.00 54.13 54.38 2h92 s LEU 65 Cb -0.05 -2.01 -0.05 0.00 0.02 0.00 0.00 46.19 44.09 2h92 s LEU 65 CO 0.00 0.24 -0.01 0.42 0.02 0.00 0.00 176.35 177.02 2h92 s THR 66 N -0.04 0.79 -0.02 5.49 -4.23 0.63 -4.96 115.64 113.30 2h92 s THR 66 Ca 0.08 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.64 2h92 s THR 66 Cb -0.12 -2.11 -0.01 0.00 1.34 0.00 0.00 72.50 71.61 2h92 s THR 66 CO 0.00 -0.50 -0.14 -0.31 -0.54 0.00 0.00 174.62 173.14 2h92 s TYR 67 N -3.58 1.32 0.00 3.99 1.51 -1.26 0.12 117.35 119.45 2h92 s TYR 67 Ca 0.23 -0.30 0.00 0.00 -1.01 0.00 0.00 57.07 56.00 2h92 s TYR 67 Cb 0.06 -0.87 0.00 0.00 -0.11 0.00 0.00 41.96 41.03 2h92 s TYR 67 CO 0.04 -0.07 0.00 1.63 -1.11 0.00 0.00 175.55 176.04 2h92 n LYS 68 N 2.93 0.89 0.10 -0.62 5.02 -0.26 -4.88 118.16 121.34 2h92 n LYS 68 Ca -0.16 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.00 2h92 n LYS 68 Cb 0.54 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 35.47 2h92 n LYS 68 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2h92 h ALA 69 N -1.88 -0.26 0.00 7.82 0.00 -2.01 -2.45 119.26 120.48 2h92 h ALA 69 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2h92 h ALA 69 Cb 0.00 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2h92 h ALA 69 CO 0.00 -0.49 0.00 -0.40 0.00 0.00 0.00 179.25 178.36 2h92 n ASP 70 N -5.07 0.00 -0.09 0.00 5.68 -1.26 -4.78 116.55 111.03 2h92 n ASP 70 Ca -0.09 -1.10 -0.01 0.00 -0.50 0.00 0.00 54.79 53.09 2h92 n ASP 70 Cb 0.22 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.20 2h92 n ASP 70 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2h92 n LYS 71 N -0.51 -1.19 -2.17 0.11 4.76 -0.92 -4.97 118.16 113.27 2h92 n LYS 71 Ca 0.00 0.36 -0.40 0.00 -2.87 0.00 0.00 58.31 55.41 2h92 n LYS 71 Cb 0.00 -4.29 -0.02 0.00 -1.84 0.00 0.00 35.03 28.89 2h92 n LYS 71 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2h92 s GLY 72 N -2.08 2.96 0.15 0.72 0.00 -1.26 -4.61 107.32 103.20 2h92 s GLY 72 Ca 0.00 1.16 -0.30 0.00 0.00 0.00 0.00 44.72 45.58 2h92 s GLY 72 CO 0.00 1.76 0.95 1.62 0.00 0.00 0.00 173.10 177.43 2h92 s GLN 73 N -1.98 4.74 -0.05 2.90 0.74 -1.26 -1.10 119.66 123.65 2h92 s GLN 73 Ca 0.52 1.45 0.06 0.00 0.05 0.00 0.00 55.36 57.44 2h92 s GLN 73 Cb -0.37 -3.34 -0.01 0.00 1.10 0.00 0.00 33.01 30.39 2h92 s GLN 73 CO 0.48 0.32 -0.24 0.00 -0.55 0.00 0.00 175.29 175.29 2h92 s VAL 75 N -0.26 4.21 -0.42 0.00 1.01 -1.26 -0.27 120.40 123.42 2h92 s VAL 75 Ca -0.01 -0.40 -0.11 0.00 0.00 0.00 0.00 61.98 61.46 2h92 s VAL 75 Cb -0.13 -3.07 0.06 0.00 0.00 0.00 0.00 36.38 33.25 2h92 s VAL 75 CO 0.03 0.21 0.28 -0.63 0.00 0.00 0.00 175.10 174.98 2h92 s ILE 76 N 1.57 4.56 -0.23 2.22 -1.09 0.51 -1.47 121.20 127.28 2h92 s ILE 76 Ca 0.05 -1.18 -0.06 0.00 -2.23 0.00 0.00 60.65 57.23 2h92 s ILE 76 Cb -0.16 -3.71 -0.02 0.00 -1.58 0.00 0.00 42.46 36.98 2h92 s ILE 76 CO 0.03 -0.46 0.02 -0.22 -1.23 0.00 0.00 174.94 173.08 2h92 s LEU 77 N 1.51 3.24 -1.55 2.97 2.96 0.67 -1.26 118.68 127.23 2h92 s LEU 77 Ca 0.03 -0.25 -0.09 0.00 -0.22 0.00 0.00 54.13 53.60 2h92 s LEU 77 Cb -0.22 -1.84 0.07 0.00 0.50 0.00 0.00 46.19 44.70 2h92 s LEU 77 CO 0.04 0.00 0.60 0.47 -1.32 0.00 0.00 176.35 176.15 2h92 n ASP 78 N 4.66 -1.87 -0.37 3.68 8.00 0.24 -0.73 116.55 130.17 2h92 n ASP 78 Ca -0.17 -1.00 -0.05 0.00 0.71 0.00 0.00 54.79 54.28 2h92 n ASP 78 Cb 0.51 -2.95 -0.02 0.00 -0.02 0.00 0.00 41.12 38.64 2h92 n ASP 78 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2h92 n ASN 79 N -2.83 -4.51 -4.31 -2.24 3.02 -1.26 -5.00 115.26 98.11 2h92 n ASN 79 Ca -0.12 0.12 -0.31 0.00 -0.03 0.00 0.00 54.58 54.24 2h92 n ASN 79 Cb 0.59 -2.44 -0.16 0.00 -0.61 0.00 0.00 39.78 37.16 2h92 n ASN 79 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2h92 s GLU 80 N -1.89 2.07 -0.60 3.52 2.12 0.09 -5.07 118.70 118.94 2h92 s GLU 80 Ca 0.00 -0.95 -0.26 0.00 0.36 0.00 0.00 54.97 54.13 2h92 s GLU 80 Cb 0.00 -2.03 0.04 0.00 0.26 0.00 0.00 34.13 32.40 2h92 s GLU 80 CO 0.00 0.55 1.08 0.34 -0.54 0.00 0.00 175.26 176.69 2h92 s ASP 81 N -0.67 6.34 -0.06 -1.70 -1.08 -1.26 -0.24 116.67 118.00 2h92 s ASP 81 Ca 0.10 -0.25 0.17 0.00 -0.52 0.00 0.00 52.55 52.05 2h92 s ASP 81 Cb -0.10 -2.49 0.56 0.00 -1.46 0.00 0.00 42.92 39.43 2h92 s ASP 81 CO -0.01 -1.42 1.48 1.33 0.52 0.00 0.00 175.17 177.07 2h92 n VAL 82 N 6.37 1.43 -0.32 1.11 0.24 -0.54 -4.70 118.33 121.92 2h92 n VAL 82 Ca 0.04 -1.16 0.19 0.00 -2.04 0.00 0.00 64.34 61.37 2h92 n VAL 82 Cb 0.48 0.29 0.38 0.00 -1.47 0.00 0.00 33.84 33.53 2h92 n VAL 82 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 2h92 h THR 83 N 3.32 0.22 -0.20 3.34 2.02 -1.89 -0.48 112.91 119.25 2h92 h THR 83 Ca 0.00 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.12 2h92 h THR 83 Cb 1.13 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.56 2h92 h THR 83 CO 0.10 0.03 0.00 -0.67 0.37 0.00 0.00 175.52 175.36 2h92 n ASP 84 N -5.22 1.44 -0.35 4.18 4.64 -1.26 -4.06 116.55 115.92 2h92 n ASP 84 Ca 0.27 -1.79 0.08 0.00 -1.38 0.00 0.00 54.79 51.97 2h92 n ASP 84 Cb 0.86 -0.13 0.18 0.00 -1.04 0.00 0.00 41.12 40.99 2h92 n ASP 84 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 2h92 n PHE 85 N 0.21 0.00 0.30 -0.67 3.01 -0.19 -4.75 117.46 115.38 2h92 n PHE 85 Ca 0.13 -1.25 0.08 0.00 1.01 0.00 0.00 57.45 57.43 2h92 n PHE 85 Cb 0.27 -0.20 0.14 0.00 -0.01 0.00 0.00 39.48 39.68 2h92 n PHE 85 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2h92 n LEU 86 N -1.27 2.83 -4.03 4.37 4.77 -1.25 -4.89 117.00 117.53 2h92 n LEU 86 Ca 0.17 -1.42 -0.11 0.00 -0.03 0.00 0.00 56.01 54.63 2h92 n LEU 86 Cb 0.67 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.56 2h92 n LEU 86 CO -0.02 0.60 0.14 0.00 -1.33 0.00 0.00 177.39 176.79 2h92 s ARG 87 N -1.24 1.64 -1.47 3.23 3.03 -1.26 -4.52 118.95 118.36 2h92 s ARG 87 Ca 0.26 -1.42 -0.12 0.00 2.03 0.00 0.00 55.73 56.48 2h92 s ARG 87 Cb 0.16 0.45 0.08 0.00 -1.03 0.00 0.00 34.95 34.61 2h92 s ARG 87 CO 0.22 -0.67 0.77 0.09 -1.13 0.00 0.00 175.30 174.58 2h92 n ASN 88 N -0.68 -4.56 -0.64 -2.89 4.13 -1.26 -4.90 115.26 104.46 2h92 n ASN 88 Ca -0.01 -0.60 0.00 0.00 1.68 0.00 0.00 54.58 55.65 2h92 n ASN 88 Cb 0.62 -3.69 0.00 0.00 -1.54 0.00 0.00 39.78 35.17 2h92 n ASN 88 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 2h92 n ASN 89 N -2.60 0.00 0.33 6.41 2.04 -1.26 -5.03 115.26 115.14 2h92 n ASN 89 Ca 0.01 -0.64 0.21 0.00 -0.44 0.00 0.00 54.58 53.72 2h92 n ASN 89 Cb 0.54 0.00 1.14 0.00 -2.53 0.00 0.00 39.78 38.92 2h92 n ASN 89 CO 0.00 0.00 0.00 0.44 -0.44 0.00 0.00 177.26 177.26 2h92 h ASP 90 N 0.00 0.00 -0.56 0.53 3.32 -1.96 -2.55 116.42 115.20 2h92 h ASP 90 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2h92 h ASP 90 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2h92 h ASP 90 CO 0.00 0.00 0.35 0.58 -1.72 0.00 0.00 179.24 178.45 2h92 h VAL 91 N 0.00 1.16 -0.95 -1.35 2.07 -1.90 -2.54 116.25 112.74 2h92 h VAL 91 Ca -0.00 -0.34 0.10 0.00 0.82 0.00 0.00 66.70 67.28 2h92 h VAL 91 Cb 0.05 0.38 -0.07 0.00 -1.52 0.00 0.00 31.29 30.12 2h92 h VAL 91 CO 0.00 0.16 0.61 0.74 0.02 0.00 0.00 177.57 179.10 2h92 h THR 92 N 0.76 0.96 0.00 2.57 2.02 -1.69 0.63 112.91 118.17 2h92 h THR 92 Ca 0.20 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 67.05 2h92 h THR 92 Cb -0.04 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.29 2h92 h THR 92 CO -0.04 0.18 0.00 0.00 0.37 0.00 0.00 175.52 176.03 2h92 n GLN 93 N -4.56 0.19 0.00 6.66 1.13 -0.97 -3.77 117.38 116.06 2h92 n GLN 93 Ca 0.17 0.31 0.00 0.00 -1.94 0.00 0.00 57.00 55.54 2h92 n GLN 93 Cb 0.31 -1.79 0.00 0.00 0.11 0.00 0.00 30.24 28.87 2h92 n GLN 93 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2h92 n HIS 94 N -2.13 0.00 -0.36 1.08 8.25 -0.64 -4.80 115.22 116.62 2h92 n HIS 94 Ca 0.04 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.51 2h92 n HIS 94 Cb 0.30 0.00 0.16 0.00 1.12 0.00 0.00 29.99 31.56 2h92 n HIS 94 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 2h92 h VAL 95 N 0.00 1.10 -0.75 1.59 3.04 -1.01 -2.19 116.25 118.03 2h92 h VAL 95 Ca 0.00 -0.40 0.03 0.00 -1.01 0.00 0.00 66.70 65.32 2h92 h VAL 95 Cb 0.00 -0.16 -0.05 0.00 -2.01 0.00 0.00 31.29 29.07 2h92 h VAL 95 CO 0.00 0.21 0.48 0.28 -1.01 0.00 0.00 177.57 177.53 2h92 h SER 96 N 1.16 0.79 0.12 3.17 0.02 -1.86 0.19 113.55 117.13 2h92 h SER 96 Ca 0.41 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.35 2h92 h SER 96 Cb 0.13 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2h92 h SER 96 CO -0.16 0.54 -0.06 0.22 -1.14 0.00 0.00 176.83 176.24 2h92 h TYR 97 N 0.93 -0.15 -0.92 3.45 3.20 -1.76 -2.65 116.97 119.07 2h92 h TYR 97 Ca 0.30 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.16 2h92 h TYR 97 Cb 0.01 0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.28 2h92 h TYR 97 CO -0.03 0.09 0.56 0.28 -1.64 0.00 0.00 178.16 177.42 2h92 h VAL 98 N -0.37 1.25 0.00 1.81 2.07 -1.11 -2.28 116.25 117.62 2h92 h VAL 98 Ca -0.02 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 66.97 2h92 h VAL 98 Cb 0.30 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.02 2h92 h VAL 98 CO 0.03 0.26 0.00 0.00 0.02 0.00 0.00 177.57 177.88 2h92 n ALA 99 N -2.38 1.58 0.89 1.67 0.00 0.64 -2.09 120.51 120.81 2h92 n ALA 99 Ca 0.10 0.06 0.13 0.00 0.00 0.00 0.00 53.44 53.73 2h92 n ALA 99 Cb 0.05 -1.33 0.41 0.00 0.00 0.00 0.00 19.45 18.58 2h92 n ALA 99 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2h92 n SER 100 N -2.03 0.36 -4.72 0.00 3.41 -0.86 -4.61 113.62 105.18 2h92 n SER 100 Ca 0.02 0.22 -0.41 0.00 -0.26 0.00 0.00 58.87 58.44 2h92 n SER 100 Cb 0.19 -0.22 -0.04 0.00 -0.26 0.00 0.00 64.21 63.89 2h92 n SER 100 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2h92 s LYS 101 N -3.04 4.53 0.18 4.33 3.01 -0.89 -4.68 119.74 123.19 2h92 s LYS 101 Ca 0.12 1.25 -0.21 0.00 -1.01 0.00 0.00 55.97 56.12 2h92 s LYS 101 Cb 0.17 -3.44 0.10 0.00 -1.01 0.00 0.00 37.83 33.65 2h92 s LYS 101 CO 0.62 0.02 1.60 1.49 0.51 0.00 0.00 175.35 179.60 2h92 h GLU 102 N 6.62 -0.18 -0.40 1.68 4.81 -1.89 -1.28 114.58 123.94 2h92 h GLU 102 Ca -0.41 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 58.85 2h92 h GLU 102 Cb 1.21 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.61 2h92 h GLU 102 CO 0.75 -0.12 0.27 -1.35 -0.73 0.00 0.00 179.01 177.83 2h92 h PRO 103 N -0.18 0.44 0.03 0.92 0.11 -1.94 -0.12 132.00 131.26 2h92 h PRO 103 Ca 0.21 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.29 2h92 h PRO 103 Cb 0.52 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.53 2h92 h PRO 103 CO -0.58 0.29 -0.02 0.28 -0.21 0.00 0.00 178.00 177.77 2h92 h VAL 104 N 0.45 1.26 -0.45 3.15 2.07 -1.56 -2.22 116.25 118.95 2h92 h VAL 104 Ca 0.16 -0.94 -0.07 0.00 0.82 0.00 0.00 66.70 66.67 2h92 h VAL 104 Cb 0.08 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 2h92 h VAL 104 CO -0.04 0.24 -0.01 0.03 0.02 0.00 0.00 177.57 177.81 2h92 h ARG 105 N -0.45 0.75 -0.31 1.57 3.08 -0.94 -1.34 114.38 116.74 2h92 h ARG 105 Ca -0.00 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 59.83 2h92 h ARG 105 Cb 0.42 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 2h92 h ARG 105 CO 0.01 0.76 0.10 0.77 -1.07 0.00 0.00 179.97 180.54 2h92 h SER 106 N 0.70 0.44 0.01 7.04 0.02 -1.04 0.61 113.55 121.34 2h92 h SER 106 Ca 0.14 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2h92 h SER 106 Cb 0.44 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.87 2h92 h SER 106 CO 0.02 0.52 -0.01 0.15 -1.14 0.00 0.00 176.83 176.37 2h92 h PHE 107 N 0.34 -0.02 -0.31 3.45 3.57 -1.20 -2.28 116.94 120.50 2h92 h PHE 107 Ca 0.10 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.55 2h92 h PHE 107 Cb 0.23 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 2h92 h PHE 107 CO 0.00 0.05 0.00 0.00 -2.23 0.00 0.00 178.31 176.14 2h92 h ALA 108 N 0.91 0.42 -0.44 2.41 0.00 -1.16 -2.93 119.26 118.48 2h92 h ALA 108 Ca -0.00 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2h92 h ALA 108 Cb 0.07 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2h92 h ALA 108 CO 0.00 0.17 0.26 0.28 0.00 0.00 0.00 179.25 179.95 2h92 h VAL 109 N 0.35 1.14 -0.87 0.00 2.07 -0.88 -0.37 116.25 117.70 2h92 h VAL 109 Ca 0.09 -0.34 0.05 0.00 0.82 0.00 0.00 66.70 67.32 2h92 h VAL 109 Cb 0.43 0.58 -0.06 0.00 -1.52 0.00 0.00 31.29 30.73 2h92 h VAL 109 CO 0.02 0.15 0.55 0.11 0.02 0.00 0.00 177.57 178.41 2h92 h LYS 110 N 0.58 1.00 -0.37 1.57 6.56 -1.40 0.47 116.57 124.97 2h92 h LYS 110 Ca 0.16 -0.06 -0.10 0.00 -1.06 0.00 0.00 60.65 59.58 2h92 h LYS 110 Cb 0.01 -0.23 -0.02 0.00 -0.57 0.00 0.00 32.23 31.43 2h92 h LYS 110 CO -0.03 0.66 -0.20 0.87 -2.06 0.00 0.00 179.45 178.69 2h92 h LYS 111 N 1.03 0.70 -0.46 3.15 1.57 -1.27 -2.31 116.57 118.97 2h92 h LYS 111 Ca 0.36 -0.26 -0.11 0.00 -1.87 0.00 0.00 60.65 58.77 2h92 h LYS 111 Cb 0.10 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2h92 h LYS 111 CO -0.15 0.85 -0.15 1.96 -0.57 0.00 0.00 179.45 181.39 2h92 h GLN 112 N 0.62 0.88 -0.40 3.15 4.20 0.65 -1.99 115.11 122.22 2h92 h GLN 112 Ca 0.09 -0.32 -0.11 0.00 0.06 0.00 0.00 58.65 58.37 2h92 h GLN 112 Cb 0.68 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 2h92 h GLN 112 CO 0.05 0.96 -0.18 0.87 -0.67 0.00 0.00 178.83 179.87 2h92 h LYS 113 N 0.78 0.82 -0.78 1.46 1.57 -0.86 -2.61 116.57 116.95 2h92 h LYS 113 Ca 0.12 -0.35 0.07 0.00 -1.87 0.00 0.00 60.65 58.62 2h92 h LYS 113 Cb 0.67 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.89 2h92 h LYS 113 CO 0.05 0.98 0.45 0.93 -0.57 0.00 0.00 179.45 181.30 2h92 h GLU 114 N 0.63 0.78 0.00 3.15 5.08 -1.25 0.03 114.58 123.01 2h92 h GLU 114 Ca 0.09 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.37 2h92 h GLU 114 Cb 0.73 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 2h92 h GLU 114 CO 0.06 0.52 -0.16 1.25 -1.00 0.00 0.00 179.01 179.68 2h92 h LEU 115 N 0.81 0.00 -2.53 1.33 5.85 -1.12 -2.94 115.31 116.71 2h92 h LEU 115 Ca 0.36 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.08 2h92 h LEU 115 Cb 0.25 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.28 2h92 h LEU 115 CO -0.20 0.16 0.00 0.00 -0.34 0.00 0.00 178.44 178.06 2h92 n ALA 116 N -2.41 2.31 -0.29 1.25 0.00 -0.26 -4.62 120.51 116.49 2h92 n ALA 116 Ca -0.02 -1.06 0.09 0.00 0.00 0.00 0.00 53.44 52.45 2h92 n ALA 116 Cb 0.24 -0.61 0.33 0.00 0.00 0.00 0.00 19.45 19.41 2h92 n ALA 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2h92 h ALA 117 N 3.00 1.71 -0.49 0.00 0.00 -0.87 0.22 119.26 122.81 2h92 h ALA 117 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2h92 h ALA 117 Cb 0.79 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2h92 h ALA 117 CO 0.00 0.08 0.00 -1.91 0.00 0.00 0.00 179.25 177.42 2h92 n GLU 118 N -4.56 3.04 0.00 0.00 2.13 -1.26 -5.05 120.64 114.94 2h92 n GLU 118 Ca 0.17 -2.15 0.00 0.00 0.66 0.00 0.00 57.16 55.84 2h92 n GLU 118 Cb 0.38 -1.73 0.00 0.00 0.27 0.00 0.00 31.44 30.36 2h92 n GLU 118 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2h92 n LYS 119 N 0.81 0.00 -0.77 5.31 4.76 0.06 -4.90 118.16 123.44 2h92 n LYS 119 Ca 0.19 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.63 2h92 n LYS 119 Cb 0.69 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.88 2h92 n LYS 119 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2h92 n GLY 120 N 0.00 0.60 3.56 0.72 0.00 0.70 -4.89 105.19 105.89 2h92 n GLY 120 Ca 0.00 -0.14 -0.34 0.00 0.00 0.00 0.00 46.02 45.54 2h92 n GLY 120 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h92 s ILE 121 N -2.00 3.75 -0.54 -0.61 -1.09 -1.19 -1.22 121.20 118.30 2h92 s ILE 121 Ca 0.00 -0.45 -0.06 0.00 -2.23 0.00 0.00 60.65 57.91 2h92 s ILE 121 Cb 0.00 -2.56 0.14 0.00 -1.58 0.00 0.00 42.46 38.46 2h92 s ILE 121 CO 0.00 0.58 0.38 -0.69 -1.23 0.00 0.00 174.94 173.97 2h92 s VAL 122 N -0.55 3.94 -0.22 2.92 1.01 0.93 -1.01 120.40 127.41 2h92 s VAL 122 Ca 0.08 -2.29 -0.08 0.00 0.00 0.00 0.00 61.98 59.69 2h92 s VAL 122 Cb -0.12 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 2h92 s VAL 122 CO 0.02 -0.81 0.09 -0.32 0.00 0.00 0.00 175.10 174.08 2h92 s MET 123 N 0.74 3.90 0.28 2.72 1.75 -0.30 -1.54 119.30 126.86 2h92 s MET 123 Ca 0.11 -0.37 0.07 0.00 -1.25 0.00 0.00 55.69 54.25 2h92 s MET 123 Cb -0.22 -3.35 -0.03 0.00 2.84 0.00 0.00 34.83 34.07 2h92 s MET 123 CO -0.03 0.06 0.26 0.16 -0.65 0.00 0.00 175.02 174.81 2h92 s ASP 124 N 0.98 5.53 0.00 1.11 3.84 -0.83 -0.77 116.67 126.53 2h92 s ASP 124 Ca 0.05 -0.30 0.00 0.00 -0.00 0.00 0.00 52.55 52.30 2h92 s ASP 124 Cb -0.14 -1.29 0.00 0.00 -1.38 0.00 0.00 42.92 40.12 2h92 s ASP 124 CO 0.03 -0.17 0.00 0.61 -0.00 0.00 0.00 175.17 175.65 2h92 n GLY 125 N -1.29 -0.59 0.00 2.12 0.00 -0.38 -3.00 105.19 102.05 2h92 n GLY 125 Ca -0.06 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.47 2h92 n GLY 125 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h92 n ARG 126 N 0.00 2.23 -0.76 1.61 5.12 -1.26 -2.48 116.66 121.12 2h92 n ARG 126 Ca 0.00 0.00 0.05 0.00 -1.93 0.00 0.00 57.85 55.97 2h92 n ARG 126 Cb 0.00 -0.97 0.18 0.00 -1.16 0.00 0.00 32.46 30.51 2h92 n ARG 126 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 2h92 n ASP 127 N -2.12 1.69 0.02 0.55 5.75 -1.26 -3.98 116.55 117.20 2h92 n ASP 127 Ca 0.00 -3.65 -0.13 0.00 -0.01 0.00 0.00 54.79 51.01 2h92 n ASP 127 Cb 0.47 -0.49 -0.09 0.00 -1.03 0.00 0.00 41.12 39.97 2h92 n ASP 127 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 2h92 h ILE 128 N 1.84 1.19 0.00 2.12 1.08 -1.92 0.78 117.51 122.60 2h92 h ILE 128 Ca -0.02 -1.15 0.00 0.00 -0.39 0.00 0.00 64.86 63.30 2h92 h ILE 128 Cb 1.13 1.91 0.00 0.00 -3.07 0.00 0.00 36.82 36.80 2h92 h ILE 128 CO 0.03 0.27 0.00 1.23 -0.69 0.00 0.00 178.15 179.00 2h92 h GLY 129 N -0.64 0.00 0.00 5.37 0.00 -1.87 0.26 103.07 106.18 2h92 h GLY 129 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.95 2h92 h GLY 129 CO 0.02 0.00 -2.39 -1.30 0.00 0.00 0.00 176.54 172.87 2h92 n THR 130 N -2.90 1.40 -0.01 4.70 -2.24 -1.22 -4.36 114.28 109.66 2h92 n THR 130 Ca 0.01 -0.65 -0.01 0.00 -2.27 0.00 0.00 64.05 61.13 2h92 n THR 130 Cb 0.32 -1.05 -0.00 0.00 -2.10 0.00 0.00 70.33 67.49 2h92 n THR 130 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2h92 n VAL 131 N -3.04 0.07 0.14 2.28 0.31 0.18 -4.69 118.33 113.57 2h92 n VAL 131 Ca -0.40 -0.02 -0.11 0.00 -0.01 0.00 0.00 64.34 63.80 2h92 n VAL 131 Cb 1.03 -1.38 -0.07 0.00 -0.91 0.00 0.00 33.84 32.51 2h92 n VAL 131 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2h92 h VAL 132 N -0.04 0.57 -2.23 2.52 2.07 -1.23 -3.38 116.25 114.53 2h92 h VAL 132 Ca -0.03 -0.79 -0.60 0.00 0.82 0.00 0.00 66.70 66.10 2h92 h VAL 132 Cb 1.03 0.90 -0.42 0.00 -1.52 0.00 0.00 31.29 31.28 2h92 h VAL 132 CO -0.02 0.13 -0.60 0.18 0.02 0.00 0.00 177.57 177.28 2h92 n LEU 133 N -5.07 4.03 0.34 2.57 4.77 0.90 -4.84 117.00 119.70 2h92 n LEU 133 Ca -0.08 -5.53 0.21 0.00 -0.03 0.00 0.00 56.01 50.58 2h92 n LEU 133 Cb 0.26 -0.63 1.14 0.00 -2.33 0.00 0.00 43.42 41.86 2h92 n LEU 133 CO 0.25 2.16 1.17 1.55 -1.33 0.00 0.00 177.39 181.20 2h92 h PRO 134 N 3.77 0.00 -0.38 3.23 0.13 -1.75 -0.97 132.00 136.03 2h92 h PRO 134 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2h92 h PRO 134 Cb 0.61 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.74 2h92 h PRO 134 CO 0.83 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.35 2h92 n ASP 135 N -3.03 4.38 -4.69 1.44 8.00 -1.26 -4.99 116.55 116.39 2h92 n ASP 135 Ca -0.03 -2.87 -0.41 0.00 0.71 0.00 0.00 54.79 52.19 2h92 n ASP 135 Cb 0.13 -0.56 0.01 0.00 -0.02 0.00 0.00 41.12 40.68 2h92 n ASP 135 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2h92 n ALA 136 N -0.00 1.18 0.20 2.24 0.00 -0.37 -4.87 120.51 118.90 2h92 n ALA 136 Ca 0.23 0.28 0.05 0.00 0.00 0.00 0.00 53.44 54.00 2h92 n ALA 136 Cb 0.94 -2.25 0.44 0.00 0.00 0.00 0.00 19.45 18.58 2h92 n ALA 136 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2h92 h ASP 137 N 2.12 0.00 -3.40 0.00 3.32 -1.73 -3.42 116.42 113.31 2h92 h ASP 137 Ca -0.47 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.34 2h92 h ASP 137 Cb 1.30 0.00 -0.32 0.00 0.22 0.00 0.00 39.33 40.53 2h92 h ASP 137 CO 0.60 0.30 -0.59 -0.22 -1.72 0.00 0.00 179.24 177.60 2h92 s LEU 138 N -8.04 0.65 -0.20 1.55 2.96 -1.17 -5.04 118.68 109.39 2h92 s LEU 138 Ca -0.03 0.31 0.01 0.00 -0.22 0.00 0.00 54.13 54.21 2h92 s LEU 138 Cb 0.14 0.38 0.03 0.00 0.50 0.00 0.00 46.19 47.24 2h92 s LEU 138 CO 0.70 -0.16 -0.15 -0.54 -1.32 0.00 0.00 176.35 174.88 2h92 s LYS 139 N 1.25 2.51 -0.02 1.98 1.02 -1.26 -0.06 119.74 125.16 2h92 s LYS 139 Ca -0.08 -0.91 0.03 0.00 0.02 0.00 0.00 55.97 55.02 2h92 s LYS 139 Cb -0.12 -2.55 -0.03 0.00 -0.52 0.00 0.00 37.83 34.62 2h92 s LYS 139 CO -0.06 -0.34 -0.07 0.08 -0.92 0.00 0.00 175.35 174.03 2h92 s VAL 140 N 1.30 3.64 -0.37 3.17 1.01 0.99 -0.75 120.40 129.40 2h92 s VAL 140 Ca 0.00 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.33 2h92 s VAL 140 Cb -0.15 -2.55 0.11 0.00 0.00 0.00 0.00 36.38 33.78 2h92 s VAL 140 CO -0.10 0.46 0.09 -0.47 0.00 0.00 0.00 175.10 175.09 2h92 s TYR 141 N -0.93 3.49 0.07 5.22 5.04 -0.18 -1.12 117.35 128.94 2h92 s TYR 141 Ca 0.16 -2.94 -0.28 0.00 -2.44 0.00 0.00 57.07 51.56 2h92 s TYR 141 Cb -0.11 -2.81 -0.05 0.00 0.35 0.00 0.00 41.96 39.34 2h92 s TYR 141 CO 0.05 -0.90 0.89 -1.64 -1.34 0.00 0.00 175.55 172.61 2h92 s MET 142 N 0.72 4.61 0.09 4.97 -1.94 0.38 -0.98 119.30 127.16 2h92 s MET 142 Ca 0.12 1.30 -0.02 0.00 -1.71 0.00 0.00 55.69 55.39 2h92 s MET 142 Cb -0.20 -3.38 -0.04 0.00 2.01 0.00 0.00 34.83 33.22 2h92 s MET 142 CO -0.08 0.21 0.04 0.96 -0.01 0.00 0.00 175.02 176.14 2h92 s ILE 143 N 0.09 0.16 -0.15 2.53 -4.36 -0.41 -4.03 121.20 115.04 2h92 s ILE 143 Ca 0.44 -1.79 -0.32 0.00 -0.26 0.00 0.00 60.65 58.72 2h92 s ILE 143 Cb -0.22 -1.75 0.13 0.00 1.25 0.00 0.00 42.46 41.87 2h92 s ILE 143 CO 0.27 -0.71 1.11 0.00 0.24 0.00 0.00 174.94 175.85 2h92 s ALA 144 N -3.97 -1.99 0.67 2.27 0.00 -1.26 -1.07 121.76 116.41 2h92 s ALA 144 Ca 0.15 1.48 -0.16 0.00 0.00 0.00 0.00 51.96 53.42 2h92 s ALA 144 Cb 0.07 -0.18 0.01 0.00 0.00 0.00 0.00 23.12 23.02 2h92 s ALA 144 CO -0.05 -0.55 1.17 -1.54 0.00 0.00 0.00 175.76 174.79 2h92 s SER 145 N -2.01 4.77 0.20 0.00 1.04 -1.26 -4.81 113.70 111.63 2h92 s SER 145 Ca 0.07 2.22 -0.11 0.00 0.48 0.00 0.00 55.95 58.60 2h92 s SER 145 Cb -0.01 -2.58 0.21 0.00 0.10 0.00 0.00 66.02 63.75 2h92 s SER 145 CO -0.05 -1.87 1.77 0.58 0.98 0.00 0.00 173.24 174.65 2h92 h VAL 146 N 0.08 0.87 -0.73 5.02 2.07 -1.98 -0.32 116.25 121.27 2h92 h VAL 146 Ca -0.48 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 2h92 h VAL 146 Cb 1.28 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 2h92 h VAL 146 CO 0.52 0.09 0.41 -0.08 0.02 0.00 0.00 177.57 178.53 2h92 h GLU 147 N 0.48 1.01 0.16 1.57 4.81 -1.96 0.32 114.58 120.97 2h92 h GLU 147 Ca 0.27 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 2h92 h GLU 147 Cb 0.25 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.43 2h92 h GLU 147 CO -0.23 0.74 -0.08 1.49 -0.73 0.00 0.00 179.01 180.21 2h92 h GLU 148 N 1.00 -0.21 -0.78 1.92 4.57 -1.72 -0.61 114.58 118.75 2h92 h GLU 148 Ca 0.26 0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.41 2h92 h GLU 148 Cb 0.02 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.62 2h92 h GLU 148 CO -0.04 -0.12 0.32 0.00 -1.18 0.00 0.00 179.01 177.98 2h92 h ARG 149 N -0.25 1.16 -0.12 1.92 3.08 -0.75 -1.58 114.38 117.84 2h92 h ARG 149 Ca -0.02 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 59.82 2h92 h ARG 149 Cb 0.19 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2h92 h ARG 149 CO 0.04 0.94 0.07 0.00 -1.07 0.00 0.00 179.97 179.95 2h92 h ALA 150 N 1.16 0.15 -0.83 0.04 0.00 -0.19 -0.79 119.26 118.80 2h92 h ALA 150 Ca 0.26 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.17 2h92 h ALA 150 Cb 0.21 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 2h92 h ALA 150 CO -0.02 -0.33 0.54 0.93 0.00 0.00 0.00 179.25 180.36 2h92 h GLU 151 N 0.11 1.01 -0.50 0.00 5.08 -0.89 0.82 114.58 120.21 2h92 h GLU 151 Ca 0.04 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.22 2h92 h GLU 151 Cb 0.04 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 2h92 h GLU 151 CO -0.01 0.67 -0.16 0.07 -1.00 0.00 0.00 179.01 178.58 2h92 h ARG 152 N 1.04 0.99 -0.43 2.33 -0.00 -0.98 -0.97 114.38 116.35 2h92 h ARG 152 Ca 0.33 -0.39 -0.05 0.00 -0.00 0.00 0.00 59.98 59.88 2h92 h ARG 152 Cb 0.01 -0.05 -0.02 0.00 -0.00 0.00 0.00 29.97 29.91 2h92 h ARG 152 CO -0.12 1.06 0.09 -0.09 -0.00 0.00 0.00 179.97 180.91 2h92 h ARG 153 N 0.86 0.69 -0.34 0.08 9.65 -0.64 -1.77 114.38 122.92 2h92 h ARG 153 Ca 0.12 -0.18 0.04 0.00 -1.10 0.00 0.00 59.98 58.87 2h92 h ARG 153 Cb 0.72 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 29.18 2h92 h ARG 153 CO 0.06 0.72 0.12 -0.92 2.80 0.00 0.00 179.97 182.74 2h92 h TYR 154 N 0.56 0.22 0.16 2.20 3.20 -0.64 -0.19 116.97 122.48 2h92 h TYR 154 Ca 0.13 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 2h92 h TYR 154 Cb 0.35 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 2h92 h TYR 154 CO 0.02 0.09 -0.11 -0.22 -1.64 0.00 0.00 178.16 176.30 2h92 h LYS 155 N 0.27 -0.27 -0.23 1.82 1.63 -1.01 -1.07 116.57 117.71 2h92 h LYS 155 Ca 0.15 0.02 0.06 0.00 -0.85 0.00 0.00 60.65 60.03 2h92 h LYS 155 Cb 0.12 0.06 -0.07 0.00 -0.60 0.00 0.00 32.23 31.74 2h92 h LYS 155 CO -0.15 -0.18 -0.25 0.22 -3.45 0.00 0.00 179.45 175.64 2h92 h ASP 156 N -0.28 -0.79 -0.13 4.20 3.58 -1.09 -1.32 116.42 120.59 2h92 h ASP 156 Ca -0.01 0.14 0.04 0.00 0.42 0.00 0.00 57.03 57.62 2h92 h ASP 156 Cb 0.24 0.37 -0.05 0.00 1.72 0.00 0.00 39.33 41.61 2h92 h ASP 156 CO 0.00 -0.29 -0.20 0.78 -2.88 0.00 0.00 179.24 176.65 2h92 h ASN 157 N -0.26 -0.63 -0.90 2.28 -0.26 -0.76 0.14 115.58 115.18 2h92 h ASN 157 Ca 0.13 0.11 0.15 0.00 -0.56 0.00 0.00 56.30 56.13 2h92 h ASN 157 Cb 0.47 0.29 -0.07 0.00 -1.06 0.00 0.00 38.32 37.94 2h92 h ASN 157 CO -0.38 -0.25 0.58 1.56 -1.06 0.00 0.00 177.43 177.88 2h92 h GLN 158 N -0.26 0.67 0.55 0.81 1.08 -0.75 0.33 115.11 117.54 2h92 h GLN 158 Ca 0.10 -0.04 -0.03 0.00 -1.45 0.00 0.00 58.65 57.23 2h92 h GLN 158 Cb 0.40 -0.15 0.01 0.00 -0.05 0.00 0.00 27.48 27.69 2h92 h GLN 158 CO -0.28 0.45 -0.26 -0.07 -0.95 0.00 0.00 178.83 177.71 2h92 h LEU 159 N 0.69 -0.63 0.00 1.46 4.07 -0.04 -3.01 115.31 117.86 2h92 h LEU 159 Ca 0.46 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.37 2h92 h LEU 159 Cb 0.74 0.16 0.00 0.00 1.08 0.00 0.00 40.66 42.65 2h92 h LEU 159 CO -0.22 -0.26 0.02 0.54 -1.08 0.00 0.00 178.44 177.45 2h92 n ARG 160 N -5.30 0.00 -0.94 1.13 1.74 0.35 -4.74 116.66 108.91 2h92 n ARG 160 Ca -0.11 0.14 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 2h92 n ARG 160 Cb 0.33 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 2h92 n ARG 160 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2h92 n GLY 161 N -1.09 0.63 3.24 -0.13 0.00 -0.87 -5.05 105.19 101.91 2h92 n GLY 161 Ca 0.00 -0.75 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 2h92 n GLY 161 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h92 s ILE 162 N -2.00 2.91 0.09 -0.61 1.01 0.11 -5.00 121.20 117.72 2h92 s ILE 162 Ca 0.00 -0.69 -0.28 0.00 0.00 0.00 0.00 60.65 59.68 2h92 s ILE 162 Cb 0.00 -2.32 -0.06 0.00 0.01 0.00 0.00 42.46 40.09 2h92 s ILE 162 CO 0.00 0.44 0.90 -1.61 0.00 0.00 0.00 174.94 174.66 2h92 s GLU 163 N 1.41 4.64 -0.00 2.79 0.41 -1.26 -2.85 118.70 123.83 2h92 s GLU 163 Ca 0.05 1.33 -0.08 0.00 -0.41 0.00 0.00 54.97 55.86 2h92 s GLU 163 Cb -0.14 -3.37 0.00 0.00 -1.78 0.00 0.00 34.13 28.85 2h92 s GLU 163 CO -0.06 0.25 0.15 -1.54 -0.49 0.00 0.00 175.26 173.57 2h92 s SER 164 N -0.07 -0.01 -0.31 -0.19 1.04 -1.26 -5.04 113.70 107.86 2h92 s SER 164 Ca 0.44 -0.14 -0.17 0.00 0.48 0.00 0.00 55.95 56.56 2h92 s SER 164 Cb -0.22 0.23 -0.02 0.00 0.10 0.00 0.00 66.02 66.10 2h92 s SER 164 CO 0.28 -0.35 0.45 0.21 0.98 0.00 0.00 173.24 174.80 2h92 s ASN 165 N -1.27 6.29 0.22 7.02 3.84 -1.26 -4.98 114.94 124.79 2h92 s ASN 165 Ca -0.14 0.10 -0.14 0.00 0.21 0.00 0.00 52.86 52.90 2h92 s ASN 165 Cb -0.07 -2.24 0.25 0.00 -0.55 0.00 0.00 41.25 38.64 2h92 s ASN 165 CO 0.02 -0.34 1.61 0.15 -2.79 0.00 0.00 177.10 175.74 2h92 h PHE 166 N 8.32 -0.49 -0.77 0.43 3.57 -1.99 -0.86 116.94 125.15 2h92 h PHE 166 Ca -0.29 0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.30 2h92 h PHE 166 Cb 1.14 0.32 -0.05 0.00 2.79 0.00 0.00 35.95 40.15 2h92 h PHE 166 CO 0.73 -0.32 0.49 1.05 -2.23 0.00 0.00 178.31 178.03 2h92 h GLU 167 N -0.03 0.93 -0.46 1.11 4.11 -1.99 0.12 114.58 118.37 2h92 h GLU 167 Ca 0.32 -0.06 -0.06 0.00 0.07 0.00 0.00 59.36 59.63 2h92 h GLU 167 Cb 0.52 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2h92 h GLU 167 CO -0.71 0.62 0.06 0.22 0.07 0.00 0.00 179.01 179.27 2h92 h ASP 168 N 0.96 0.74 -0.03 3.06 1.82 -1.74 -0.42 116.42 120.82 2h92 h ASP 168 Ca 0.31 -0.27 0.02 0.00 -0.39 0.00 0.00 57.03 56.70 2h92 h ASP 168 Cb -0.00 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 39.79 2h92 h ASP 168 CO -0.11 0.82 -0.09 0.25 -1.61 0.00 0.00 179.24 178.51 2h92 h LEU 169 N 0.63 -0.25 -0.61 2.28 5.85 -0.65 0.13 115.31 122.68 2h92 h LEU 169 Ca 0.14 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.88 2h92 h LEU 169 Cb 0.40 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 2h92 h LEU 169 CO 0.01 -0.12 0.31 0.50 -0.34 0.00 0.00 178.44 178.80 2h92 h LYS 170 N -0.14 0.87 -0.52 1.25 3.64 -0.88 -1.01 116.57 119.79 2h92 h LYS 170 Ca 0.04 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.24 2h92 h LYS 170 Cb 0.19 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2h92 h LYS 170 CO -0.11 0.68 0.07 0.07 -2.27 0.00 0.00 179.45 177.90 2h92 h ARG 171 N 0.83 0.86 -0.46 1.90 0.11 -0.66 -1.60 114.38 115.37 2h92 h ARG 171 Ca 0.21 -0.24 -0.12 0.00 0.10 0.00 0.00 59.98 59.93 2h92 h ARG 171 Cb 0.09 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 31.06 2h92 h ARG 171 CO -0.03 0.86 -0.19 -0.44 0.10 0.00 0.00 179.97 180.26 2h92 h ASP 172 N 0.74 0.94 -0.63 0.08 3.32 -0.58 -1.17 116.42 119.13 2h92 h ASP 172 Ca 0.16 -0.34 -0.03 0.00 0.02 0.00 0.00 57.03 56.84 2h92 h ASP 172 Cb 0.42 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 2h92 h ASP 172 CO 0.01 1.10 0.27 0.40 -1.72 0.00 0.00 179.24 179.31 2h92 h ILE 173 N 0.80 1.23 -0.36 0.35 2.04 -1.07 -0.40 117.51 120.09 2h92 h ILE 173 Ca 0.11 -0.68 -0.04 0.00 1.00 0.00 0.00 64.86 65.25 2h92 h ILE 173 Cb 0.75 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 2h92 h ILE 173 CO 0.06 0.27 0.06 -0.08 0.00 0.00 0.00 178.15 178.46 2h92 h GLU 174 N 0.87 0.60 -0.79 2.37 4.57 -1.12 -1.71 114.58 119.38 2h92 h GLU 174 Ca 0.21 -0.16 -0.04 0.00 -1.18 0.00 0.00 59.36 58.19 2h92 h GLU 174 Cb 0.17 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.65 2h92 h GLU 174 CO -0.02 0.67 0.33 0.00 -1.18 0.00 0.00 179.01 178.81 2h92 h ALA 175 N 0.91 1.03 -0.06 2.92 0.00 -0.97 -0.34 119.26 122.74 2h92 h ALA 175 Ca 0.11 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2h92 h ALA 175 Cb 0.36 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2h92 h ALA 175 CO 0.01 0.64 -0.02 0.00 0.00 0.00 0.00 179.25 179.88 2h92 h ARG 176 N 1.14 0.12 -0.67 0.00 3.08 -0.96 -1.41 114.38 115.69 2h92 h ARG 176 Ca 0.27 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.32 2h92 h ARG 176 Cb 0.19 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.18 2h92 h ARG 176 CO -0.02 0.46 0.38 -0.44 -1.07 0.00 0.00 179.97 179.27 2h92 h ASP 177 N -0.22 0.58 -0.05 7.04 3.32 -1.19 0.74 116.42 126.65 2h92 h ASP 177 Ca 0.02 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 2h92 h ASP 177 Cb 0.41 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.87 2h92 h ASP 177 CO 0.01 0.38 0.03 -0.61 -1.72 0.00 0.00 179.24 177.33 2h92 h GLN 178 N 0.71 0.07 -0.45 3.56 5.75 -0.97 0.22 115.11 124.00 2h92 h GLN 178 Ca 0.29 -0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.80 2h92 h GLN 178 Cb 0.16 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.67 2h92 h GLN 178 CO -0.17 0.07 0.30 -0.92 -2.65 0.00 0.00 178.83 175.46 2h92 h TYR 179 N 0.04 0.56 0.00 3.99 3.20 -0.83 -1.47 116.97 122.46 2h92 h TYR 179 Ca 0.02 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.85 2h92 h TYR 179 Cb 0.02 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 2h92 h TYR 179 CO -0.07 0.35 -0.23 -0.44 -1.64 0.00 0.00 178.16 176.14 2h92 h ASP 180 N 0.60 0.00 1.46 -2.11 3.32 -0.58 -1.21 116.42 117.90 2h92 h ASP 180 Ca 0.17 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.17 2h92 h ASP 180 Cb -0.06 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 2h92 h ASP 180 CO -0.04 0.23 -0.56 0.24 -1.72 0.00 0.00 179.24 177.39 2h92 h MET 181 N 0.00 0.00 -0.01 3.56 2.86 -0.52 0.04 114.93 120.86 2h92 h MET 181 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2h92 h MET 181 Cb 0.41 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.07 2h92 h MET 181 CO 0.03 0.18 -0.42 0.09 1.06 0.00 0.00 176.91 177.85 2h92 n ASN 182 N -3.01 1.51 -4.73 1.22 3.02 -0.59 -4.60 115.26 108.07 2h92 n ASN 182 Ca 0.01 -1.25 -0.35 0.00 -0.03 0.00 0.00 54.58 52.95 2h92 n ASN 182 Cb 0.63 0.56 0.08 0.00 -0.61 0.00 0.00 39.78 40.44 2h92 n ASN 182 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2h92 s ARG 183 N -2.05 2.40 0.17 3.52 1.70 -0.49 -4.94 118.95 119.26 2h92 s ARG 183 Ca 0.12 1.79 -0.12 0.00 -0.47 0.00 0.00 55.73 57.06 2h92 s ARG 183 Cb 0.13 -1.86 0.06 0.00 -0.57 0.00 0.00 34.95 32.71 2h92 s ARG 183 CO 0.46 -1.64 1.71 0.93 -1.08 0.00 0.00 175.30 175.68 2h92 h GLU 184 N 0.08 0.86 -5.44 3.89 4.39 -1.91 -3.38 114.58 113.07 2h92 h GLU 184 Ca -0.49 -0.17 -0.59 0.00 0.34 0.00 0.00 59.36 58.45 2h92 h GLU 184 Cb 1.30 -0.13 -0.11 0.00 -0.10 0.00 0.00 28.75 29.71 2h92 h GLU 184 CO 0.51 0.76 -0.31 0.42 -1.16 0.00 0.00 179.01 179.23 2h92 s ILE 185 N -5.48 5.29 -1.04 3.13 1.01 -1.26 -4.64 121.20 118.21 2h92 s ILE 185 Ca -0.13 0.55 -0.18 0.00 0.00 0.00 0.00 60.65 60.90 2h92 s ILE 185 Cb 0.12 -3.64 0.02 0.00 0.01 0.00 0.00 42.46 38.98 2h92 s ILE 185 CO 0.79 0.36 0.33 -1.20 0.00 0.00 0.00 174.94 175.22 2h92 n SER 186 N 3.82 -1.73 -4.68 3.58 7.64 -1.26 -4.88 113.62 116.10 2h92 n SER 186 Ca -0.11 -1.01 -0.31 0.00 1.01 0.00 0.00 58.87 58.45 2h92 n SER 186 Cb 0.52 -1.23 0.15 0.00 -1.01 0.00 0.00 64.21 62.64 2h92 n SER 186 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2h92 s PRO 187 N -6.76 1.13 0.01 1.43 0.04 -1.26 -4.69 135.00 124.91 2h92 s PRO 187 Ca 0.25 1.31 -0.30 0.00 0.04 0.00 0.00 61.00 62.29 2h92 s PRO 187 Cb -0.14 -1.76 -0.07 0.00 0.04 0.00 0.00 34.50 32.57 2h92 s PRO 187 CO 0.77 -2.47 1.69 -1.17 0.04 0.00 0.00 177.00 175.85 2h92 s LEU 188 N -6.47 4.36 -0.10 -3.56 2.96 -0.00 -4.78 118.68 111.08 2h92 s LEU 188 Ca 0.65 2.40 -0.30 0.00 -0.22 0.00 0.00 54.13 56.66 2h92 s LEU 188 Cb -0.21 -3.55 0.11 0.00 0.50 0.00 0.00 46.19 43.04 2h92 s LEU 188 CO 0.58 -0.92 0.88 0.00 -1.32 0.00 0.00 176.35 175.57 2h92 s ARG 189 N 3.44 0.77 0.11 1.98 1.70 -1.26 -4.62 118.95 121.08 2h92 s ARG 189 Ca 0.75 0.12 -0.30 0.00 -0.47 0.00 0.00 55.73 55.83 2h92 s ARG 189 Cb -0.37 0.36 -0.07 0.00 -0.57 0.00 0.00 34.95 34.30 2h92 s ARG 189 CO 0.32 -0.25 1.20 0.21 -1.08 0.00 0.00 175.30 175.70 2h92 s LYS 190 N -1.38 4.46 0.67 3.89 2.20 -1.26 -4.80 119.74 123.51 2h92 s LYS 190 Ca -0.04 1.81 -0.14 0.00 -0.36 0.00 0.00 55.97 57.24 2h92 s LYS 190 Cb -0.00 -3.31 0.00 0.00 -1.51 0.00 0.00 37.83 33.01 2h92 s LYS 190 CO 0.03 -0.18 1.08 0.00 -0.36 0.00 0.00 175.35 175.92 2h92 s ALA 191 N 0.62 2.54 0.35 3.13 0.00 -1.26 -4.94 121.76 122.20 2h92 s ALA 191 Ca 0.56 0.38 0.03 0.00 0.00 0.00 0.00 51.96 52.94 2h92 s ALA 191 Cb -0.31 -3.26 0.65 0.00 0.00 0.00 0.00 23.12 20.20 2h92 s ALA 191 CO 0.32 -1.23 1.98 -0.44 0.00 0.00 0.00 175.76 176.39 2h92 h ASP 192 N -0.19 0.64 -0.54 0.00 3.32 -1.95 -2.51 116.42 115.19 2h92 h ASP 192 Ca -0.46 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.55 2h92 h ASP 192 Cb 1.23 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.62 2h92 h ASP 192 CO 0.55 0.52 0.00 -0.90 -1.72 0.00 0.00 179.24 177.69 2h92 n ASP 193 N -4.40 4.96 -4.90 6.45 5.75 -1.26 -4.96 116.55 118.19 2h92 n ASP 193 Ca 0.05 -2.69 -0.28 0.00 -0.01 0.00 0.00 54.79 51.86 2h92 n ASP 193 Cb 0.10 -0.63 -0.02 0.00 -1.03 0.00 0.00 41.12 39.54 2h92 n ASP 193 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2h92 s ALA 194 N -2.32 3.46 -0.17 2.12 0.00 -0.95 -4.61 121.76 119.29 2h92 s ALA 194 Ca 0.48 -0.47 -0.02 0.00 0.00 0.00 0.00 51.96 51.95 2h92 s ALA 194 Cb 0.35 -2.51 -0.01 0.00 0.00 0.00 0.00 23.12 20.94 2h92 s ALA 194 CO 0.17 -0.09 -0.08 0.08 0.00 0.00 0.00 175.76 175.85 2h92 s VAL 195 N -2.44 3.31 0.29 0.00 1.01 0.07 -4.93 120.40 117.70 2h92 s VAL 195 Ca 0.47 -0.54 -0.29 0.00 0.00 0.00 0.00 61.98 61.61 2h92 s VAL 195 Cb -0.10 -2.45 -0.10 0.00 0.00 0.00 0.00 36.38 33.73 2h92 s VAL 195 CO 0.37 0.48 1.14 -0.89 0.00 0.00 0.00 175.10 176.19 2h92 s THR 196 N 0.86 3.33 -0.18 3.92 2.01 -1.26 -1.01 115.64 123.31 2h92 s THR 196 Ca -0.02 1.34 -0.05 0.00 0.31 0.00 0.00 61.69 63.28 2h92 s THR 196 Cb -0.15 -3.86 0.07 0.00 0.01 0.00 0.00 72.50 68.58 2h92 s THR 196 CO 0.01 0.32 0.13 -0.22 -0.69 0.00 0.00 174.62 174.17 2h92 s LEU 197 N -1.52 0.22 -0.11 4.42 0.20 -0.15 -4.88 118.68 116.86 2h92 s LEU 197 Ca 0.45 -0.51 -0.28 0.00 0.69 0.00 0.00 54.13 54.49 2h92 s LEU 197 Cb -0.33 -0.06 -0.02 0.00 -0.43 0.00 0.00 46.19 45.34 2h92 s LEU 197 CO 0.43 -0.34 0.92 -0.62 -0.29 0.00 0.00 176.35 176.45 2h92 s ASP 198 N 2.19 7.15 0.00 3.68 3.68 -1.26 -1.29 116.67 130.83 2h92 s ASP 198 Ca 0.03 1.41 0.23 0.00 2.13 0.00 0.00 52.55 56.35 2h92 s ASP 198 Cb -0.16 -2.51 0.10 0.00 -1.45 0.00 0.00 42.92 38.90 2h92 s ASP 198 CO -0.10 -0.38 1.14 0.35 0.13 0.00 0.00 175.17 176.30 2h92 n THR 199 N 4.45 0.00 -1.65 1.71 -2.24 -0.23 -4.93 114.28 111.39 2h92 n THR 199 Ca 0.06 -0.09 -0.45 0.00 -2.27 0.00 0.00 64.05 61.31 2h92 n THR 199 Cb 0.49 0.85 -0.02 0.00 -2.10 0.00 0.00 70.33 69.54 2h92 n THR 199 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2h92 n THR 200 N -1.00 1.30 -3.07 4.28 -2.24 -1.26 -2.15 114.28 110.15 2h92 n THR 200 Ca 0.07 -0.33 -0.22 0.00 -2.27 0.00 0.00 64.05 61.30 2h92 n THR 200 Cb 0.37 -1.30 0.02 0.00 -2.10 0.00 0.00 70.33 67.31 2h92 n THR 200 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2h92 n GLY 201 N 1.73 -0.51 2.95 3.38 0.00 -1.26 -4.98 105.19 106.50 2h92 n GLY 201 Ca 0.11 0.10 -0.20 0.00 0.00 0.00 0.00 46.02 46.03 2h92 n GLY 201 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h92 s LYS 202 N -5.73 0.94 0.51 1.61 1.02 -0.91 -5.13 119.74 112.05 2h92 s LYS 202 Ca 0.30 -0.21 -0.23 0.00 0.02 0.00 0.00 55.97 55.85 2h92 s LYS 202 Cb -0.14 -0.89 -0.06 0.00 -0.52 0.00 0.00 37.83 36.22 2h92 s LYS 202 CO 0.37 0.01 1.32 0.45 -0.92 0.00 0.00 175.35 176.58 2h92 s SER 203 N 0.57 5.58 0.54 2.83 0.15 -1.26 -4.79 113.70 117.32 2h92 s SER 203 Ca -0.08 2.67 0.37 0.00 0.70 0.00 0.00 55.95 59.61 2h92 s SER 203 Cb -0.12 -2.63 1.55 0.00 -1.71 0.00 0.00 66.02 63.11 2h92 s SER 203 CO 0.01 -1.35 1.80 -0.29 1.20 0.00 0.00 173.24 174.60 2h92 h ILE 204 N 1.67 0.40 0.08 6.45 2.10 -2.00 0.18 117.51 126.39 2h92 h ILE 204 Ca -0.50 -0.00 -0.16 0.00 1.08 0.00 0.00 64.86 65.28 2h92 h ILE 204 Cb 1.28 0.39 0.02 0.00 -1.09 0.00 0.00 36.82 37.42 2h92 h ILE 204 CO 0.58 0.00 -0.66 -0.33 -1.08 0.00 0.00 178.15 176.67 2h92 h GLU 205 N 0.00 0.31 -0.37 2.19 5.08 -1.99 -3.09 114.58 116.71 2h92 h GLU 205 Ca 0.57 -0.44 0.07 0.00 -1.00 0.00 0.00 59.36 58.56 2h92 h GLU 205 Cb 2.29 0.15 -0.06 0.00 0.50 0.00 0.00 28.75 31.63 2h92 h GLU 205 CO -0.01 1.16 -0.01 0.93 -1.00 0.00 0.00 179.01 180.09 2h92 h GLU 206 N -0.34 0.09 -0.29 2.33 5.08 -1.02 0.16 114.58 120.60 2h92 h GLU 206 Ca -0.11 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.18 2h92 h GLU 206 Cb 1.46 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.67 2h92 h GLU 206 CO 0.13 0.06 -0.11 0.28 -1.00 0.00 0.00 179.01 178.37 2h92 h VAL 207 N 0.09 1.22 -0.47 3.13 2.07 -1.46 -0.78 116.25 120.06 2h92 h VAL 207 Ca 0.18 -0.97 -0.08 0.00 0.82 0.00 0.00 66.70 66.65 2h92 h VAL 207 Cb 0.25 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 2h92 h VAL 207 CO -0.30 0.32 -0.01 0.74 0.02 0.00 0.00 177.57 178.33 2h92 h THR 208 N 0.44 1.26 -0.90 2.57 2.02 -1.21 -2.06 112.91 115.03 2h92 h THR 208 Ca 0.08 -1.08 -0.01 0.00 0.77 0.00 0.00 66.41 66.18 2h92 h THR 208 Cb 0.46 1.03 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 2h92 h THR 208 CO 0.03 0.37 0.54 0.44 0.37 0.00 0.00 175.52 177.27 2h92 h ASP 209 N 0.69 1.08 -0.35 4.18 3.32 -0.13 -0.66 116.42 124.55 2h92 h ASP 209 Ca 0.13 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.08 2h92 h ASP 209 Cb 0.52 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 2h92 h ASP 209 CO 0.03 0.83 0.07 -0.08 -1.72 0.00 0.00 179.24 178.37 2h92 h GLU 210 N 1.25 0.57 -0.71 3.56 4.81 -0.87 0.09 114.58 123.27 2h92 h GLU 210 Ca 0.32 -0.15 -0.07 0.00 -0.13 0.00 0.00 59.36 59.34 2h92 h GLU 210 Cb -0.05 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 2h92 h GLU 210 CO -0.06 0.63 0.17 0.82 -0.73 0.00 0.00 179.01 179.84 2h92 h ILE 211 N 0.41 1.26 -0.75 2.32 2.04 -1.06 -1.97 117.51 119.76 2h92 h ILE 211 Ca 0.11 -0.98 -0.02 0.00 1.00 0.00 0.00 64.86 64.97 2h92 h ILE 211 Cb 0.33 0.53 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 2h92 h ILE 211 CO 0.00 0.38 0.40 -0.07 0.00 0.00 0.00 178.15 178.86 2h92 h LEU 212 N 1.08 0.95 -0.82 1.44 3.38 -0.90 -0.24 115.31 120.20 2h92 h LEU 212 Ca 0.22 -0.11 0.08 0.00 0.09 0.00 0.00 57.88 58.17 2h92 h LEU 212 Cb 0.38 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.82 2h92 h LEU 212 CO 0.00 0.79 0.48 0.00 0.09 0.00 0.00 178.44 179.80 2h92 h ALA 213 N 1.20 1.15 -0.39 1.53 0.00 -0.41 0.54 119.26 122.89 2h92 h ALA 213 Ca 0.26 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 2h92 h ALA 213 Cb 0.06 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2h92 h ALA 213 CO -0.04 0.15 -0.27 0.52 0.00 0.00 0.00 179.25 179.61 2h92 h MET 214 N 0.84 0.83 -0.76 0.00 2.86 -0.61 -3.05 114.93 115.03 2h92 h MET 214 Ca 0.38 -0.37 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 2h92 h MET 214 Cb 0.29 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.89 2h92 h MET 214 CO -0.22 1.00 0.38 0.28 1.06 0.00 0.00 176.91 179.41 2h92 h VAL 215 N 0.71 1.24 0.00 -2.22 2.07 0.36 -1.89 116.25 116.52 2h92 h VAL 215 Ca 0.09 -0.66 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 2h92 h VAL 215 Cb 0.81 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 30.85 2h92 h VAL 215 CO 0.07 0.28 -0.02 0.77 0.02 0.00 0.00 177.57 178.69 2h92 h SER 216 N 1.07 0.00 0.49 0.57 4.64 -0.85 -0.05 113.55 119.42 2h92 h SER 216 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 2h92 h SER 216 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2h92 h SER 216 CO -0.04 0.02 -0.03 0.00 -0.87 0.00 0.00 176.83 175.91 2h92 n GLN 217 N -3.86 0.52 0.00 4.77 6.02 -0.71 -5.12 117.38 119.00 2h92 n GLN 217 Ca -0.03 -0.05 0.00 0.00 -0.01 0.00 0.00 57.00 56.91 2h92 n GLN 217 Cb 0.10 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.86 2h92 n GLN 217 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.06 177.56