#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3il9 s TYR 2 N 0.00 1.83 -0.12 1.12 2.02 0.95 -4.72 117.35 118.44 3il9 s TYR 2 Ca 0.00 -1.16 -0.01 0.00 -0.37 0.00 0.00 57.07 55.53 3il9 s TYR 2 Cb 0.00 -1.20 -0.03 0.00 -0.40 0.00 0.00 41.96 40.33 3il9 s TYR 2 CO 0.00 -0.18 -0.07 0.99 -1.57 0.00 0.00 175.55 174.72 3il9 s THR 3 N -3.26 3.63 -0.01 -0.71 2.01 -1.26 -0.08 115.64 115.96 3il9 s THR 3 Ca 0.28 -0.47 0.05 0.00 0.31 0.00 0.00 61.69 61.85 3il9 s THR 3 Cb 0.05 -2.54 -0.03 0.00 0.01 0.00 0.00 72.50 69.99 3il9 s THR 3 CO 0.14 0.54 -0.13 -0.54 -0.69 0.00 0.00 174.62 173.93 3il9 s LYS 4 N -0.03 2.39 -0.45 4.92 1.02 0.54 0.25 119.74 128.38 3il9 s LYS 4 Ca -0.00 -0.79 -0.23 0.00 0.02 0.00 0.00 55.97 54.96 3il9 s LYS 4 Cb -0.14 -2.35 0.02 0.00 -0.52 0.00 0.00 37.83 34.85 3il9 s LYS 4 CO 0.03 0.59 0.81 0.42 -0.92 0.00 0.00 175.35 176.28 3il9 s ILE 5 N -0.86 4.63 -1.36 2.17 1.01 -1.26 -0.37 121.20 125.16 3il9 s ILE 5 Ca 0.14 0.51 0.14 0.00 0.00 0.00 0.00 60.65 61.44 3il9 s ILE 5 Cb -0.11 -4.33 0.01 0.00 0.01 0.00 0.00 42.46 38.04 3il9 s ILE 5 CO 0.04 -0.72 0.80 2.30 0.00 0.00 0.00 174.94 177.37 3il9 n ILE 6 N 6.16 0.00 -3.67 2.92 -5.35 -0.23 -4.96 119.36 114.23 3il9 n ILE 6 Ca 0.03 -0.37 -0.14 0.00 -0.27 0.00 0.00 62.75 62.00 3il9 n ILE 6 Cb 0.48 1.18 -0.08 0.00 -1.74 0.00 0.00 39.64 39.48 3il9 n ILE 6 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3il9 s GLY 7 N -1.67 -0.44 0.10 3.28 0.00 -1.15 -3.73 107.32 103.72 3il9 s GLY 7 Ca 0.12 1.56 0.05 0.00 0.00 0.00 0.00 44.72 46.45 3il9 s GLY 7 CO 0.34 1.33 -0.12 -0.51 0.00 0.00 0.00 173.10 174.13 3il9 s THR 8 N 0.13 1.09 0.14 0.90 -4.23 -1.26 -0.22 115.64 112.18 3il9 s THR 8 Ca -0.01 -1.58 -0.18 0.00 -1.18 0.00 0.00 61.69 58.74 3il9 s THR 8 Cb -0.04 -1.33 0.05 0.00 1.34 0.00 0.00 72.50 72.52 3il9 s THR 8 CO 0.02 -0.44 0.47 -0.83 -0.54 0.00 0.00 174.62 173.30 3il9 s GLY 9 N -2.27 -0.38 0.07 3.99 0.00 -0.28 -3.53 107.32 104.92 3il9 s GLY 9 Ca 0.05 0.11 -0.23 0.00 0.00 0.00 0.00 44.72 44.65 3il9 s GLY 9 CO 0.01 -0.16 0.54 -1.35 0.00 0.00 0.00 173.10 172.15 3il9 s SER 10 N -2.79 -0.47 -0.07 1.64 1.04 -1.26 -0.15 113.70 111.65 3il9 s SER 10 Ca 0.03 0.14 -0.03 0.00 0.48 0.00 0.00 55.95 56.57 3il9 s SER 10 Cb 0.01 0.52 0.04 0.00 0.10 0.00 0.00 66.02 66.69 3il9 s SER 10 CO -0.12 -0.78 0.13 -0.47 0.98 0.00 0.00 173.24 172.98 3il9 s TYR 11 N -2.78 -0.14 -0.08 5.02 6.14 0.43 -4.67 117.35 121.28 3il9 s TYR 11 Ca -0.03 0.48 0.04 0.00 0.64 0.00 0.00 57.07 58.19 3il9 s TYR 11 Cb -0.00 -0.17 -0.01 0.00 0.42 0.00 0.00 41.96 42.19 3il9 s TYR 11 CO -0.04 -0.19 -0.19 -0.51 0.64 0.00 0.00 175.55 175.25 3il9 s LEU 12 N 1.55 2.39 0.91 6.97 2.01 -1.26 -1.69 118.68 129.55 3il9 s LEU 12 Ca -0.05 -0.40 -0.12 0.00 0.01 0.00 0.00 54.13 53.57 3il9 s LEU 12 Cb -0.12 -1.48 0.09 0.00 0.01 0.00 0.00 46.19 44.69 3il9 s LEU 12 CO -0.05 0.23 0.84 -2.65 1.01 0.00 0.00 176.35 175.73 3il9 n PRO 13 N 3.06 -0.29 -0.09 1.29 -0.02 -1.26 -4.95 135.00 132.74 3il9 n PRO 13 Ca -0.18 -0.03 -0.12 0.00 -2.02 0.00 0.00 63.50 61.16 3il9 n PRO 13 Cb 0.52 -2.16 -0.04 0.00 -0.02 0.00 0.00 33.50 31.80 3il9 n PRO 13 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3il9 h GLU 14 N -1.59 0.56 -6.60 -0.52 4.81 -1.98 -3.42 114.58 105.83 3il9 h GLU 14 Ca -0.44 -0.24 -0.53 0.00 -0.13 0.00 0.00 59.36 58.03 3il9 h GLU 14 Cb 1.28 -0.02 0.02 0.00 0.63 0.00 0.00 28.75 30.66 3il9 h GLU 14 CO 0.39 0.79 0.63 -1.14 -0.73 0.00 0.00 179.01 178.95 3il9 s GLN 15 N -4.64 4.40 -0.11 1.92 0.74 -1.26 -4.92 119.66 115.79 3il9 s GLN 15 Ca -0.13 1.96 0.01 0.00 0.05 0.00 0.00 55.36 57.25 3il9 s GLN 15 Cb 0.08 -3.25 -0.01 0.00 1.10 0.00 0.00 33.01 30.93 3il9 s GLN 15 CO 0.78 -0.26 -0.16 0.08 -0.55 0.00 0.00 175.29 175.18 3il9 s VAL 16 N 0.52 2.79 -0.36 1.34 1.01 -1.26 -0.51 120.40 123.93 3il9 s VAL 16 Ca 0.58 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 61.66 3il9 s VAL 16 Cb -0.34 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 3il9 s VAL 16 CO 0.34 0.54 0.27 -0.60 0.00 0.00 0.00 175.10 175.64 3il9 s ARG 17 N 0.24 3.35 0.66 2.72 3.52 0.70 -4.94 118.95 125.19 3il9 s ARG 17 Ca -0.11 -0.74 -0.02 0.00 -0.13 0.00 0.00 55.73 54.74 3il9 s ARG 17 Cb -0.16 -3.86 0.08 0.00 -1.56 0.00 0.00 34.95 29.45 3il9 s ARG 17 CO 0.06 -0.54 0.92 0.95 -0.81 0.00 0.00 175.30 175.88 3il9 s THR 18 N 1.73 2.37 0.31 4.11 -4.23 -1.26 -2.19 115.64 116.49 3il9 s THR 18 Ca 0.06 -0.53 0.07 0.00 -1.18 0.00 0.00 61.69 60.11 3il9 s THR 18 Cb -0.18 -2.84 0.06 0.00 1.34 0.00 0.00 72.50 70.88 3il9 s THR 18 CO 0.10 0.00 1.74 0.78 -0.54 0.00 0.00 174.62 176.71 3il9 h ASN 19 N -0.34 0.23 -0.45 3.99 2.35 -1.87 -1.73 115.58 117.75 3il9 h ASN 19 Ca -0.41 -0.09 0.04 0.00 -0.55 0.00 0.00 56.30 55.29 3il9 h ASN 19 Cb 1.29 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 39.56 3il9 h ASN 19 CO 0.49 0.58 0.23 0.00 -1.65 0.00 0.00 177.43 177.08 3il9 h ALA 20 N 1.44 0.57 -0.44 -0.83 0.00 -1.94 -0.55 119.26 117.50 3il9 h ALA 20 Ca 0.02 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.00 3il9 h ALA 20 Cb 0.73 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 3il9 h ALA 20 CO 0.06 -0.12 0.18 -0.44 0.00 0.00 0.00 179.25 178.92 3il9 h ASP 21 N 0.46 0.22 -0.19 0.00 3.32 -1.79 -2.47 116.42 115.97 3il9 h ASP 21 Ca 0.19 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.25 3il9 h ASP 21 Cb 0.10 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 3il9 h ASP 21 CO -0.13 0.16 0.02 -0.07 -1.72 0.00 0.00 179.24 177.50 3il9 h LEU 22 N 0.36 0.39 -2.40 1.55 3.38 -0.77 -2.41 115.31 115.41 3il9 h LEU 22 Ca 0.20 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 3il9 h LEU 22 Cb 0.17 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 3il9 h LEU 22 CO -0.18 0.43 -0.02 -0.33 0.09 0.00 0.00 178.44 178.42 3il9 h GLU 23 N 0.41 0.00 0.00 1.13 5.08 -0.62 -0.03 114.58 120.55 3il9 h GLU 23 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3il9 h GLU 23 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 3il9 h GLU 23 CO 0.00 0.02 -1.21 1.63 -1.00 0.00 0.00 179.01 178.46 3il9 n LYS 24 N -3.74 0.59 0.05 2.33 5.02 -0.92 -4.30 118.16 117.20 3il9 n LYS 24 Ca -0.03 0.05 -0.22 0.00 -2.02 0.00 0.00 58.31 56.09 3il9 n LYS 24 Cb 0.11 -1.75 -0.15 0.00 -0.02 0.00 0.00 35.03 33.23 3il9 n LYS 24 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 3il9 h MET 25 N 0.00 0.35 -4.90 1.97 2.86 -1.00 -3.48 114.93 110.72 3il9 h MET 25 Ca 0.00 -0.60 -0.45 0.00 -2.06 0.00 0.00 59.70 56.60 3il9 h MET 25 Cb 0.98 0.22 -0.14 0.00 0.06 0.00 0.00 31.60 32.73 3il9 h MET 25 CO 0.00 1.28 -0.54 0.14 1.06 0.00 0.00 176.91 178.86 3il9 s VAL 26 N -2.53 0.29 -0.82 -2.22 -7.23 -0.18 -4.79 120.40 102.91 3il9 s VAL 26 Ca -0.17 -2.00 -0.19 0.00 -1.81 0.00 0.00 61.98 57.81 3il9 s VAL 26 Cb 0.05 -2.48 0.12 0.00 0.56 0.00 0.00 36.38 34.63 3il9 s VAL 26 CO 0.83 0.00 1.01 -0.62 -0.31 0.00 0.00 175.10 176.01 3il9 s ASP 27 N -3.41 6.48 0.33 4.85 3.68 -1.26 -4.44 116.67 122.90 3il9 s ASP 27 Ca 0.35 -1.79 -0.14 0.00 2.13 0.00 0.00 52.55 53.10 3il9 s ASP 27 Cb 0.04 -2.38 0.03 0.00 -1.45 0.00 0.00 42.92 39.16 3il9 s ASP 27 CO 0.19 -1.12 0.67 0.28 0.13 0.00 0.00 175.17 175.32 3il9 s THR 28 N 2.80 0.00 0.08 1.71 -1.32 -1.26 -5.04 115.64 112.61 3il9 s THR 28 Ca 0.27 -1.17 0.04 0.00 -1.21 0.00 0.00 61.69 59.61 3il9 s THR 28 Cb -0.10 -2.50 -0.03 0.00 -1.51 0.00 0.00 72.50 68.36 3il9 s THR 28 CO -0.03 0.00 -0.10 -0.94 -2.21 0.00 0.00 174.62 171.34 3il9 s SER 29 N -3.05 1.35 0.24 8.08 1.04 -1.26 -4.70 113.70 115.40 3il9 s SER 29 Ca 0.18 -0.73 -0.05 0.00 0.48 0.00 0.00 55.95 55.83 3il9 s SER 29 Cb -0.04 0.01 0.33 0.00 0.10 0.00 0.00 66.02 66.42 3il9 s SER 29 CO 0.11 -0.23 1.86 -0.78 0.98 0.00 0.00 173.24 175.19 3il9 h ASP 30 N 3.86 0.88 -0.27 7.02 3.58 -2.00 -1.88 116.42 127.60 3il9 h ASP 30 Ca -0.37 0.01 -0.10 0.00 0.42 0.00 0.00 57.03 56.99 3il9 h ASP 30 Cb 1.19 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 42.05 3il9 h ASP 30 CO 0.49 0.57 -0.18 -0.08 -2.88 0.00 0.00 179.24 177.15 3il9 h GLU 31 N 1.01 0.73 -0.15 0.28 4.81 -1.99 -0.83 114.58 118.44 3il9 h GLU 31 Ca 0.38 -0.27 -0.22 0.00 -0.13 0.00 0.00 59.36 59.13 3il9 h GLU 31 Cb 0.15 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 29.49 3il9 h GLU 31 CO -0.17 0.86 -0.76 2.35 -0.73 0.00 0.00 179.01 180.56 3il9 h TRP 32 N 0.65 1.00 0.16 0.92 7.01 -1.92 -0.64 115.95 123.12 3il9 h TRP 32 Ca 0.10 -0.44 -0.01 0.00 2.11 0.00 0.00 58.89 60.66 3il9 h TRP 32 Cb 0.66 -0.16 0.00 0.00 -2.10 0.00 0.00 29.16 27.56 3il9 h TRP 32 CO 0.03 1.26 -0.07 0.82 -2.79 0.00 0.00 178.44 177.69 3il9 h ILE 33 N 0.51 0.88 -0.37 2.65 2.04 -1.18 -0.73 117.51 121.31 3il9 h ILE 33 Ca -0.05 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 3il9 h ILE 33 Cb 1.38 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 38.40 3il9 h ILE 33 CO 0.15 0.03 0.10 0.58 0.00 0.00 0.00 178.15 179.01 3il9 h VAL 34 N -0.27 1.22 -0.21 1.67 2.07 -1.17 0.14 116.25 119.70 3il9 h VAL 34 Ca -0.02 -0.74 -0.08 0.00 0.82 0.00 0.00 66.70 66.68 3il9 h VAL 34 Cb 0.21 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 3il9 h VAL 34 CO 0.04 0.25 -0.23 0.74 0.02 0.00 0.00 177.57 178.39 3il9 h THR 35 N 0.45 1.25 0.00 2.57 2.02 -1.10 0.19 112.91 118.29 3il9 h THR 35 Ca 0.12 -1.16 -0.16 0.00 0.77 0.00 0.00 66.41 65.98 3il9 h THR 35 Cb 0.29 1.34 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 3il9 h THR 35 CO -0.00 0.36 -1.69 0.54 0.37 0.00 0.00 175.52 175.10 3il9 n ARG 36 N -4.15 0.64 0.00 6.66 5.12 -0.28 -4.65 116.66 120.00 3il9 n ARG 36 Ca -0.00 0.08 0.00 0.00 -1.93 0.00 0.00 57.85 56.00 3il9 n ARG 36 Cb 0.37 -1.69 0.00 0.00 -1.16 0.00 0.00 32.46 29.98 3il9 n ARG 36 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 3il9 n THR 37 N -2.72 0.00 -0.87 0.55 -2.24 0.49 -4.83 114.28 104.67 3il9 n THR 37 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 3il9 n THR 37 Cb 0.83 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 3il9 n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3il9 n GLY 38 N 2.19 0.88 3.77 3.38 0.00 0.67 -1.45 105.19 114.62 3il9 n GLY 38 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 3il9 n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3il9 s ILE 39 N -3.46 5.00 -0.05 -0.61 1.01 -1.26 -3.99 121.20 117.84 3il9 s ILE 39 Ca 0.00 1.05 0.02 0.00 0.00 0.00 0.00 60.65 61.71 3il9 s ILE 39 Cb 0.00 -3.84 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 3il9 s ILE 39 CO 0.00 0.45 -0.02 0.54 0.00 0.00 0.00 174.94 175.91 3il9 n ARG 40 N 2.67 1.45 -3.94 2.79 1.74 -0.75 -4.18 116.66 116.43 3il9 n ARG 40 Ca -0.09 0.02 -0.10 0.00 -0.77 0.00 0.00 57.85 56.91 3il9 n ARG 40 Cb 0.51 -1.11 -0.10 0.00 -1.02 0.00 0.00 32.46 30.74 3il9 n ARG 40 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3il9 s GLU 41 N -2.11 0.40 0.05 5.56 2.02 -0.01 -2.76 118.70 121.85 3il9 s GLU 41 Ca -0.05 -0.57 0.00 0.00 0.02 0.00 0.00 54.97 54.38 3il9 s GLU 41 Cb 0.02 0.16 -0.03 0.00 0.10 0.00 0.00 34.13 34.37 3il9 s GLU 41 CO 0.15 -0.08 -0.05 1.03 0.02 0.00 0.00 175.26 176.33 3il9 s ARG 42 N -1.60 0.52 0.04 1.61 3.00 -0.93 -2.80 118.95 118.79 3il9 s ARG 42 Ca -0.14 -0.93 -0.11 0.00 0.00 0.00 0.00 55.73 54.55 3il9 s ARG 42 Cb -0.08 0.01 -0.06 0.00 0.00 0.00 0.00 34.95 34.82 3il9 s ARG 42 CO -0.01 -0.04 0.38 -1.01 0.00 0.00 0.00 175.30 174.62 3il9 s HIS 43 N -2.50 3.63 -0.21 -0.53 3.76 -1.26 -0.22 115.29 117.96 3il9 s HIS 43 Ca -0.04 0.82 0.01 0.00 -0.15 0.00 0.00 55.06 55.70 3il9 s HIS 43 Cb -0.02 -2.17 0.04 0.00 1.11 0.00 0.00 32.58 31.54 3il9 s HIS 43 CO -0.04 0.57 -0.12 0.42 -0.85 0.00 0.00 174.74 174.72 3il9 s ILE 44 N -1.28 1.82 0.28 0.60 -1.09 0.33 -0.43 121.20 121.43 3il9 s ILE 44 Ca 0.29 -1.11 -0.30 0.00 -2.23 0.00 0.00 60.65 57.30 3il9 s ILE 44 Cb -0.15 -1.85 -0.12 0.00 -1.58 0.00 0.00 42.46 38.77 3il9 s ILE 44 CO 0.16 0.21 1.60 0.00 -1.23 0.00 0.00 174.94 175.68 3il9 n ALA 45 N 4.63 2.50 -1.18 9.38 0.00 -1.26 -4.10 120.51 130.48 3il9 n ALA 45 Ca -0.16 0.38 -0.31 0.00 0.00 0.00 0.00 53.44 53.35 3il9 n ALA 45 Cb 0.46 -2.46 0.10 0.00 0.00 0.00 0.00 19.45 17.56 3il9 n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3il9 s ALA 46 N 0.17 2.10 0.56 0.00 0.00 -1.26 -4.88 121.76 118.44 3il9 s ALA 46 Ca 0.66 0.29 0.24 0.00 0.00 0.00 0.00 51.96 53.15 3il9 s ALA 46 Cb -0.51 -3.29 1.58 0.00 0.00 0.00 0.00 23.12 20.91 3il9 s ALA 46 CO 0.46 -1.94 2.19 -1.00 0.00 0.00 0.00 175.76 175.47 3il9 h PRO 47 N -1.26 0.00 -0.04 0.00 0.13 -2.05 0.14 132.00 128.92 3il9 h PRO 47 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3il9 h PRO 47 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3il9 h PRO 47 CO 0.50 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.54 3il9 n ASN 48 N -4.13 1.17 -4.86 1.44 6.94 -1.26 -4.85 115.26 109.71 3il9 n ASN 48 Ca -0.02 -1.45 -0.34 0.00 -0.02 0.00 0.00 54.58 52.75 3il9 n ASN 48 Cb 0.12 -0.02 -0.06 0.00 -2.36 0.00 0.00 39.78 37.46 3il9 n ASN 48 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 3il9 s GLU 49 N -1.96 3.32 0.27 -3.83 2.02 0.50 -4.99 118.70 114.03 3il9 s GLU 49 Ca 0.38 -0.35 0.02 0.00 0.02 0.00 0.00 54.97 55.04 3il9 s GLU 49 Cb 0.20 -3.03 -0.04 0.00 0.10 0.00 0.00 34.13 31.36 3il9 s GLU 49 CO 0.32 0.68 0.16 0.95 0.02 0.00 0.00 175.26 177.38 3il9 s THR 50 N -1.25 0.21 0.30 3.63 -4.23 -1.26 -4.76 115.64 108.28 3il9 s THR 50 Ca 0.24 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.81 3il9 s THR 50 Cb -0.12 -2.52 0.30 0.00 1.34 0.00 0.00 72.50 71.49 3il9 s THR 50 CO 0.15 0.00 1.76 0.58 -0.54 0.00 0.00 174.62 176.57 3il9 h VAL 51 N 2.36 0.65 -0.17 2.29 2.07 -1.92 -1.79 116.25 119.74 3il9 h VAL 51 Ca -0.34 -0.24 -0.22 0.00 0.82 0.00 0.00 66.70 66.73 3il9 h VAL 51 Cb 1.25 -0.09 0.01 0.00 -1.52 0.00 0.00 31.29 30.94 3il9 h VAL 51 CO 0.51 0.13 -0.74 0.28 0.02 0.00 0.00 177.57 177.76 3il9 h SER 52 N 0.69 0.95 -0.35 0.57 0.02 -1.95 -0.68 113.55 112.79 3il9 h SER 52 Ca 0.58 -0.62 -0.17 0.00 -0.84 0.00 0.00 61.79 60.74 3il9 h SER 52 Cb 0.95 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 63.21 3il9 h SER 52 CO -0.41 1.41 -0.44 0.71 -1.14 0.00 0.00 176.83 176.96 3il9 h THR 53 N 0.54 1.27 -0.43 -2.27 1.35 -1.86 0.04 112.91 111.55 3il9 h THR 53 Ca -0.05 -1.61 -0.06 0.00 -0.55 0.00 0.00 66.41 64.14 3il9 h THR 53 Cb 1.37 1.47 -0.02 0.00 -1.73 0.00 0.00 68.15 69.25 3il9 h THR 53 CO 0.16 0.54 0.05 0.24 -0.25 0.00 0.00 175.52 176.25 3il9 h MET 54 N 0.73 0.72 -0.67 4.72 0.00 -1.39 -2.04 114.93 117.00 3il9 h MET 54 Ca 0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 59.70 59.53 3il9 h MET 54 Cb 1.04 -0.08 -0.03 0.00 0.00 0.00 0.00 31.60 32.53 3il9 h MET 54 CO 0.10 0.77 0.38 0.78 0.00 0.00 0.00 176.91 178.94 3il9 h GLY 55 N 0.57 0.99 0.97 8.32 0.00 -1.01 -0.95 103.07 111.97 3il9 h GLY 55 Ca 0.13 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 3il9 h GLY 55 CO 0.01 0.41 0.24 -2.75 0.00 0.00 0.00 176.54 174.45 3il9 h PHE 56 N 0.93 0.68 -0.21 5.60 3.04 -0.70 0.02 116.94 126.30 3il9 h PHE 56 Ca 0.24 -0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.15 3il9 h PHE 56 Cb 0.00 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 38.29 3il9 h PHE 56 CO 0.01 0.53 0.10 0.93 -2.02 0.00 0.00 178.31 177.85 3il9 h GLU 57 N 0.63 0.31 -0.93 1.11 4.39 -0.77 -0.24 114.58 119.07 3il9 h GLU 57 Ca 0.16 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 3il9 h GLU 57 Cb 0.10 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.65 3il9 h GLU 57 CO -0.02 0.34 0.54 0.00 -1.16 0.00 0.00 179.01 178.71 3il9 h ALA 58 N 0.95 1.20 -0.39 3.43 0.00 -1.07 -2.37 119.26 121.02 3il9 h ALA 58 Ca 0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3il9 h ALA 58 Cb 0.14 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3il9 h ALA 58 CO -0.01 0.67 0.07 0.00 0.00 0.00 0.00 179.25 179.98 3il9 h ALA 59 N 1.30 0.52 -0.90 0.00 0.00 -0.70 -1.26 119.26 118.22 3il9 h ALA 59 Ca 0.33 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 55.13 3il9 h ALA 59 Cb -0.03 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.54 3il9 h ALA 59 CO -0.06 0.21 0.55 1.15 0.00 0.00 0.00 179.25 181.10 3il9 h THR 60 N 0.49 0.96 -0.12 0.00 2.02 -0.75 0.91 112.91 116.42 3il9 h THR 60 Ca 0.12 -0.32 -0.20 0.00 0.77 0.00 0.00 66.41 66.78 3il9 h THR 60 Cb 0.35 -0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.71 3il9 h THR 60 CO 0.01 0.17 -0.75 0.03 0.37 0.00 0.00 175.52 175.35 3il9 h ARG 61 N 0.93 0.61 -0.81 6.66 3.08 -1.14 -0.92 114.38 122.78 3il9 h ARG 61 Ca 0.42 -0.49 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 3il9 h ARG 61 Cb 0.33 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.44 3il9 h ARG 61 CO -0.23 1.11 0.41 0.00 -1.07 0.00 0.00 179.97 180.19 3il9 h ALA 62 N 0.75 1.04 -0.34 0.04 0.00 -0.71 -2.13 119.26 117.90 3il9 h ALA 62 Ca -0.04 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 3il9 h ALA 62 Cb 1.35 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3il9 h ALA 62 CO 0.14 0.58 -0.24 0.82 0.00 0.00 0.00 179.25 180.55 3il9 h ILE 63 N 1.13 1.27 -0.29 0.00 2.04 -0.66 -1.24 117.51 119.76 3il9 h ILE 63 Ca 0.28 -1.33 0.05 0.00 1.00 0.00 0.00 64.86 64.86 3il9 h ILE 63 Cb 0.09 1.27 -0.04 0.00 -0.74 0.00 0.00 36.82 37.39 3il9 h ILE 63 CO -0.04 0.44 0.01 -0.33 0.00 0.00 0.00 178.15 178.23 3il9 h GLU 64 N 0.59 0.10 -0.32 2.37 5.08 -0.89 -1.43 114.58 120.08 3il9 h GLU 64 Ca 0.08 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.33 3il9 h GLU 64 Cb 0.72 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 3il9 h GLU 64 CO 0.06 0.07 -0.23 1.98 -1.00 0.00 0.00 179.01 179.88 3il9 h MET 65 N 0.10 0.63 0.00 2.33 4.05 -1.12 -3.08 114.93 117.84 3il9 h MET 65 Ca 0.14 -0.24 -0.10 0.00 -0.28 0.00 0.00 59.70 59.21 3il9 h MET 65 Cb 0.17 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 30.92 3il9 h MET 65 CO -0.22 0.81 -0.49 0.00 0.23 0.00 0.00 176.91 177.25 3il9 h ALA 66 N 1.19 0.96 -0.21 0.39 0.00 -0.83 -3.45 119.26 117.31 3il9 h ALA 66 Ca 0.08 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 3il9 h ALA 66 Cb 0.70 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 3il9 h ALA 66 CO 0.05 0.61 -0.07 0.41 0.00 0.00 0.00 179.25 180.24 3il9 n GLY 67 N 0.31 0.66 3.96 0.00 0.00 -0.58 -4.93 105.19 104.61 3il9 n GLY 67 Ca -0.00 -0.88 -0.19 0.00 0.00 0.00 0.00 46.02 44.94 3il9 n GLY 67 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3il9 s ILE 68 N -2.15 3.44 0.18 -0.61 -4.36 -1.25 -5.11 121.20 111.35 3il9 s ILE 68 Ca 0.00 -1.11 -0.14 0.00 -0.26 0.00 0.00 60.65 59.14 3il9 s ILE 68 Cb 0.00 -3.18 -0.07 0.00 1.25 0.00 0.00 42.46 40.45 3il9 s ILE 68 CO 0.00 -0.09 0.57 -1.61 0.24 0.00 0.00 174.94 174.05 3il9 s GLU 69 N -4.19 3.96 0.35 0.37 0.41 -1.26 -4.87 118.70 113.47 3il9 s GLU 69 Ca 0.48 0.48 0.08 0.00 -0.41 0.00 0.00 54.97 55.60 3il9 s GLU 69 Cb -0.08 -2.85 0.80 0.00 -1.78 0.00 0.00 34.13 30.22 3il9 s GLU 69 CO 0.30 0.42 1.87 0.87 -0.49 0.00 0.00 175.26 178.24 3il9 h LYS 70 N 3.28 0.70 0.00 1.61 1.57 -1.97 -0.61 116.57 121.14 3il9 h LYS 70 Ca -0.48 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 3il9 h LYS 70 Cb 1.19 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.34 3il9 h LYS 70 CO 0.66 0.46 0.00 -0.40 -0.57 0.00 0.00 179.45 179.60 3il9 n ASP 71 N -4.56 0.00 0.02 0.86 5.75 -1.26 -2.06 116.55 115.30 3il9 n ASP 71 Ca 0.17 -1.09 0.12 0.00 -0.01 0.00 0.00 54.79 53.98 3il9 n ASP 71 Cb 0.46 0.00 0.26 0.00 -1.03 0.00 0.00 41.12 40.81 3il9 n ASP 71 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3il9 n GLN 72 N -0.89 0.10 -2.22 0.11 6.02 -0.24 -4.90 117.38 115.36 3il9 n GLN 72 Ca 0.17 0.03 -0.42 0.00 -0.01 0.00 0.00 57.00 56.77 3il9 n GLN 72 Cb 0.08 -1.57 -0.03 0.00 1.02 0.00 0.00 30.24 29.74 3il9 n GLN 72 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3il9 s ILE 73 N -3.06 3.52 -1.41 5.09 1.01 -0.87 -4.33 121.20 121.15 3il9 s ILE 73 Ca 0.10 1.06 0.11 0.00 0.00 0.00 0.00 60.65 61.92 3il9 s ILE 73 Cb 0.16 -3.68 0.09 0.00 0.01 0.00 0.00 42.46 39.04 3il9 s ILE 73 CO 0.69 0.06 0.86 0.61 0.00 0.00 0.00 174.94 177.16 3il9 n GLY 74 N 3.48 -0.33 3.64 6.18 0.00 0.11 -4.77 105.19 113.51 3il9 n GLY 74 Ca 0.11 -0.32 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 3il9 n GLY 74 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3il9 s LEU 75 N -0.94 -0.63 -0.13 0.99 2.96 -1.21 -4.06 118.68 115.67 3il9 s LEU 75 Ca 0.13 1.13 0.01 0.00 -0.22 0.00 0.00 54.13 55.18 3il9 s LEU 75 Cb 0.09 2.10 0.02 0.00 0.50 0.00 0.00 46.19 48.90 3il9 s LEU 75 CO 0.14 -0.19 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.21 3il9 s ILE 76 N 0.72 1.49 -0.12 6.68 1.01 -0.50 -0.48 121.20 129.99 3il9 s ILE 76 Ca -0.02 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.03 3il9 s ILE 76 Cb -0.05 -1.39 0.02 0.00 0.01 0.00 0.00 42.46 41.05 3il9 s ILE 76 CO -0.08 0.44 -0.15 -0.69 0.00 0.00 0.00 174.94 174.46 3il9 s VAL 77 N 1.26 1.54 -0.21 2.92 1.01 -0.37 -1.93 120.40 124.63 3il9 s VAL 77 Ca -0.01 -0.65 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 3il9 s VAL 77 Cb -0.14 -1.41 -0.00 0.00 0.00 0.00 0.00 36.38 34.83 3il9 s VAL 77 CO -0.06 0.45 -0.09 -0.69 0.00 0.00 0.00 175.10 174.71 3il9 s VAL 78 N 1.13 3.03 -0.33 2.92 1.01 -0.46 -1.33 120.40 126.37 3il9 s VAL 78 Ca -0.03 -0.61 -0.23 0.00 0.00 0.00 0.00 61.98 61.11 3il9 s VAL 78 Cb -0.14 -2.35 0.00 0.00 0.00 0.00 0.00 36.38 33.89 3il9 s VAL 78 CO -0.04 0.46 0.78 0.00 0.00 0.00 0.00 175.10 176.29 3il9 s ALA 79 N 1.40 3.49 0.06 5.51 0.00 0.94 -0.22 121.76 132.93 3il9 s ALA 79 Ca 0.05 -0.53 -0.25 0.00 0.00 0.00 0.00 51.96 51.23 3il9 s ALA 79 Cb -0.14 -3.31 0.06 0.00 0.00 0.00 0.00 23.12 19.73 3il9 s ALA 79 CO -0.05 -1.31 0.60 -0.08 0.00 0.00 0.00 175.76 174.91 3il9 s THR 80 N 2.99 0.01 -0.04 0.00 -1.32 -1.04 -1.75 115.64 114.50 3il9 s THR 80 Ca 0.31 -0.09 0.12 0.00 -1.21 0.00 0.00 61.69 60.82 3il9 s THR 80 Cb -0.14 -0.99 0.21 0.00 -1.51 0.00 0.00 72.50 70.07 3il9 s THR 80 CO 0.14 -0.05 1.09 0.35 -2.21 0.00 0.00 174.62 173.95 3il9 n THR 81 N 0.29 0.51 -2.42 5.08 -2.24 -1.26 -4.36 114.28 109.88 3il9 n THR 81 Ca -0.18 -0.96 0.01 0.00 -2.27 0.00 0.00 64.05 60.65 3il9 n THR 81 Cb 0.61 0.46 0.01 0.00 -2.10 0.00 0.00 70.33 69.30 3il9 n THR 81 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3il9 n SER 82 N -0.19 0.51 -4.77 3.42 3.41 -1.26 -5.04 113.62 109.70 3il9 n SER 82 Ca 0.06 -2.01 -0.31 0.00 -0.26 0.00 0.00 58.87 56.35 3il9 n SER 82 Cb 0.82 -0.15 0.09 0.00 -0.26 0.00 0.00 64.21 64.71 3il9 n SER 82 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3il9 s ALA 83 N -0.36 2.29 0.15 7.33 0.00 -1.26 -4.63 121.76 125.28 3il9 s ALA 83 Ca 0.25 0.28 0.14 0.00 0.00 0.00 0.00 51.96 52.63 3il9 s ALA 83 Cb 0.30 -3.27 0.40 0.00 0.00 0.00 0.00 23.12 20.54 3il9 s ALA 83 CO -0.12 -1.71 1.60 1.79 0.00 0.00 0.00 175.76 177.33 3il9 h THR 84 N -1.02 1.15 -3.92 0.00 1.35 -1.99 -3.45 112.91 105.03 3il9 h THR 84 Ca -0.44 -2.02 -0.41 0.00 -0.55 0.00 0.00 66.41 63.00 3il9 h THR 84 Cb 1.23 2.17 -0.30 0.00 -1.73 0.00 0.00 68.15 69.52 3il9 h THR 84 CO 0.52 0.53 -0.78 -1.00 -0.25 0.00 0.00 175.52 174.53 3il9 s HIS 85 N -3.42 0.86 0.10 4.73 4.02 -1.26 -5.02 115.29 115.30 3il9 s HIS 85 Ca 0.00 -0.19 -0.20 0.00 1.02 0.00 0.00 55.06 55.70 3il9 s HIS 85 Cb 0.11 -0.59 -0.08 0.00 -1.02 0.00 0.00 32.58 31.00 3il9 s HIS 85 CO 0.73 -0.06 1.67 0.00 1.02 0.00 0.00 174.74 178.11 3il9 h ALA 86 N 6.16 0.26 -2.94 -1.40 0.00 -1.99 -3.41 119.26 115.93 3il9 h ALA 86 Ca -0.32 -0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.35 3il9 h ALA 86 Cb 1.17 -0.08 -0.22 0.00 0.00 0.00 0.00 17.79 18.66 3il9 h ALA 86 CO 0.49 -0.18 -0.54 -0.59 0.00 0.00 0.00 179.25 178.43 3il9 s PHE 87 N -5.71 0.03 0.55 0.00 -0.71 -1.26 -4.09 117.98 106.78 3il9 s PHE 87 Ca -0.13 -0.07 -0.21 0.00 -1.04 0.00 0.00 56.93 55.47 3il9 s PHE 87 Cb 0.08 -0.05 -0.05 0.00 -1.21 0.00 0.00 43.02 41.79 3il9 s PHE 87 CO 0.70 -0.22 1.30 -1.25 -1.34 0.00 0.00 175.22 174.41 3il9 s PRO 88 N -1.05 3.17 0.94 1.99 0.04 -1.26 -5.13 135.00 133.69 3il9 s PRO 88 Ca -0.11 2.10 -0.11 0.00 0.04 0.00 0.00 61.00 62.91 3il9 s PRO 88 Cb -0.06 -2.21 0.15 0.00 0.04 0.00 0.00 34.50 32.43 3il9 s PRO 88 CO 0.01 -1.13 1.10 -1.54 0.04 0.00 0.00 177.00 175.49 3il9 s SER 89 N -1.13 2.91 0.28 6.66 1.04 -1.26 -4.52 113.70 117.67 3il9 s SER 89 Ca 0.72 1.86 -0.03 0.00 0.48 0.00 0.00 55.95 58.98 3il9 s SER 89 Cb -0.37 -2.43 0.38 0.00 0.10 0.00 0.00 66.02 63.70 3il9 s SER 89 CO 0.43 -3.05 1.91 0.00 0.98 0.00 0.00 173.24 173.50 3il9 h ALA 90 N -1.83 1.30 -0.87 5.32 0.00 -1.90 -1.61 119.26 119.66 3il9 h ALA 90 Ca -0.48 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.31 3il9 h ALA 90 Cb 1.28 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.72 3il9 h ALA 90 CO 0.47 0.57 0.52 0.00 0.00 0.00 0.00 179.25 180.82 3il9 h ALA 91 N 1.40 1.11 -0.57 0.00 0.00 -1.91 0.33 119.26 119.62 3il9 h ALA 91 Ca 0.27 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 3il9 h ALA 91 Cb 0.01 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 3il9 h ALA 91 CO -0.05 0.57 0.11 0.00 0.00 0.00 0.00 179.25 179.88 3il9 h GLN 93 N 0.83 1.05 -0.45 0.00 4.20 -0.70 -2.10 115.11 117.94 3il9 h GLN 93 Ca 0.17 -0.32 -0.11 0.00 0.06 0.00 0.00 58.65 58.45 3il9 h GLN 93 Cb 0.40 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 3il9 h GLN 93 CO 0.01 1.01 -0.17 0.82 -0.67 0.00 0.00 178.83 179.83 3il9 h ILE 94 N 0.97 1.27 -0.53 2.54 2.04 -0.83 -1.58 117.51 121.39 3il9 h ILE 94 Ca 0.18 -1.30 0.05 0.00 1.00 0.00 0.00 64.86 64.79 3il9 h ILE 94 Cb 0.52 1.10 -0.05 0.00 -0.74 0.00 0.00 36.82 37.66 3il9 h ILE 94 CO 0.03 0.44 0.27 -0.61 0.00 0.00 0.00 178.15 178.28 3il9 h GLN 95 N 0.77 0.51 -0.53 2.37 4.15 -0.73 0.04 115.11 121.69 3il9 h GLN 95 Ca 0.11 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.43 3il9 h GLN 95 Cb 0.70 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.26 3il9 h GLN 95 CO 0.05 0.34 0.06 1.03 -1.93 0.00 0.00 178.83 178.38 3il9 h SER 96 N 0.52 0.87 -0.18 -0.69 0.87 -1.20 -1.95 113.55 111.78 3il9 h SER 96 Ca 0.23 -0.27 -0.02 0.00 -1.23 0.00 0.00 61.79 60.50 3il9 h SER 96 Cb 0.14 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 3il9 h SER 96 CO -0.16 0.92 0.07 0.24 -0.53 0.00 0.00 176.83 177.37 3il9 h MET 97 N 0.78 0.34 0.00 2.24 2.86 -0.77 -0.95 114.93 119.44 3il9 h MET 97 Ca 0.16 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 3il9 h MET 97 Cb 0.44 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.03 3il9 h MET 97 CO 0.02 0.32 -0.00 1.28 1.06 0.00 0.00 176.91 179.58 3il9 n LEU 98 N -4.41 0.25 -0.38 1.22 4.77 -0.05 -4.92 117.00 113.48 3il9 n LEU 98 Ca 0.01 0.52 -0.05 0.00 -0.03 0.00 0.00 56.01 56.46 3il9 n LEU 98 Cb 0.15 -0.44 -0.02 0.00 -2.33 0.00 0.00 43.42 40.77 3il9 n LEU 98 CO 0.36 -0.05 -0.05 0.61 -1.33 0.00 0.00 177.39 176.93 3il9 n GLY 99 N 1.44 0.69 3.65 -0.72 0.00 -0.36 -4.99 105.19 104.90 3il9 n GLY 99 Ca 0.07 -0.84 -0.24 0.00 0.00 0.00 0.00 46.02 45.01 3il9 n GLY 99 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3il9 s ILE 100 N -2.18 3.51 0.01 -0.61 -4.36 -1.06 -5.03 121.20 111.47 3il9 s ILE 100 Ca 0.00 -1.79 -0.11 0.00 -0.26 0.00 0.00 60.65 58.49 3il9 s ILE 100 Cb 0.00 -2.85 0.01 0.00 1.25 0.00 0.00 42.46 40.87 3il9 s ILE 100 CO 0.00 -0.30 0.23 -1.59 0.24 0.00 0.00 174.94 173.51 3il9 s LYS 101 N -3.48 0.62 0.00 0.37 -2.85 -1.26 -4.40 119.74 108.74 3il9 s LYS 101 Ca 0.30 -0.38 0.00 0.00 -1.00 0.00 0.00 55.97 54.89 3il9 s LYS 101 Cb -0.07 0.27 0.00 0.00 -2.06 0.00 0.00 37.83 35.96 3il9 s LYS 101 CO 0.19 -0.17 0.00 0.41 0.10 0.00 0.00 175.35 175.88 3il9 n GLY 102 N 1.16 3.29 3.76 0.59 0.00 -1.26 -5.08 105.19 107.65 3il9 n GLY 102 Ca -0.21 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.53 3il9 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3il9 n PRO 104 N -1.13 1.88 -3.69 0.00 -0.04 -1.26 -4.86 135.00 125.90 3il9 n PRO 104 Ca 0.11 0.68 -0.12 0.00 -0.04 0.00 0.00 63.50 64.13 3il9 n PRO 104 Cb 0.48 -2.51 -0.12 0.00 -0.04 0.00 0.00 33.50 31.31 3il9 n PRO 104 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3il9 s ALA 105 N -1.25 -0.72 0.16 0.55 0.00 -1.26 -1.41 121.76 117.83 3il9 s ALA 105 Ca 0.66 1.14 -0.18 0.00 0.00 0.00 0.00 51.96 53.57 3il9 s ALA 105 Cb -0.45 -0.91 0.04 0.00 0.00 0.00 0.00 23.12 21.79 3il9 s ALA 105 CO 0.54 -0.44 0.49 -0.59 0.00 0.00 0.00 175.76 175.76 3il9 s PHE 106 N 1.88 -0.23 0.03 0.00 -0.71 -0.81 -4.64 117.98 113.49 3il9 s PHE 106 Ca -0.05 -0.08 -0.01 0.00 -1.04 0.00 0.00 56.93 55.75 3il9 s PHE 106 Cb -0.11 0.37 -0.04 0.00 -1.21 0.00 0.00 43.02 42.03 3il9 s PHE 106 CO -0.10 -0.82 0.17 -0.51 -1.34 0.00 0.00 175.22 172.62 3il9 s ASP 107 N -2.82 6.19 -0.07 1.98 1.01 -1.26 -1.36 116.67 120.34 3il9 s ASP 107 Ca 0.05 0.26 0.05 0.00 0.71 0.00 0.00 52.55 53.62 3il9 s ASP 107 Cb 0.00 -1.88 -0.01 0.00 1.01 0.00 0.00 42.92 42.04 3il9 s ASP 107 CO -0.08 0.22 -0.23 -0.69 0.21 0.00 0.00 175.17 174.60 3il9 s VAL 108 N -1.38 2.24 -0.36 -1.27 1.01 0.69 -4.90 120.40 116.43 3il9 s VAL 108 Ca 0.30 -0.99 -0.08 0.00 0.00 0.00 0.00 61.98 61.21 3il9 s VAL 108 Cb -0.13 -1.83 0.05 0.00 0.00 0.00 0.00 36.38 34.47 3il9 s VAL 108 CO 0.22 0.57 0.16 0.00 0.00 0.00 0.00 175.10 176.04 3il9 s ALA 109 N -0.13 3.14 -0.24 5.51 0.00 -1.26 -2.48 121.76 126.29 3il9 s ALA 109 Ca -0.04 -1.84 0.17 0.00 0.00 0.00 0.00 51.96 50.25 3il9 s ALA 109 Cb -0.14 -2.41 0.42 0.00 0.00 0.00 0.00 23.12 20.99 3il9 s ALA 109 CO 0.04 -1.42 1.28 0.00 0.00 0.00 0.00 175.76 175.66 3il9 n ALA 110 N 4.86 2.80 0.00 0.00 0.00 -1.26 -5.03 120.51 121.87 3il9 n ALA 110 Ca -0.12 -1.84 0.00 0.00 0.00 0.00 0.00 53.44 51.49 3il9 n ALA 110 Cb 0.44 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 19.10 3il9 n ALA 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3il9 n ALA 111 N -0.82 0.00 0.00 0.00 0.00 -1.26 -2.13 120.51 116.30 3il9 n ALA 111 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3il9 n ALA 111 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.31 3il9 n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3il9 n ALA 113 N 0.00 0.00 -0.31 0.00 0.00 -1.26 -4.10 120.51 114.84 3il9 n ALA 113 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 3il9 n ALA 113 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.56 3il9 n ALA 113 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3il9 h GLY 114 N 0.00 1.24 1.17 0.00 0.00 -1.77 -2.38 103.07 101.33 3il9 h GLY 114 Ca 0.00 -0.41 -0.08 0.00 0.00 0.00 0.00 47.33 46.84 3il9 h GLY 114 CO 0.00 0.35 0.08 -2.75 0.00 0.00 0.00 176.54 174.22 3il9 h PHE 115 N 1.06 1.08 -0.41 5.60 3.57 -1.83 -0.24 116.94 125.78 3il9 h PHE 115 Ca 0.34 -0.15 -0.05 0.00 3.53 0.00 0.00 57.97 61.65 3il9 h PHE 115 Cb 0.01 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.43 3il9 h PHE 115 CO -0.02 0.92 0.05 1.79 -2.23 0.00 0.00 178.31 178.82 3il9 h THR 116 N 0.95 1.20 -0.19 4.41 1.35 -1.80 0.17 112.91 119.01 3il9 h THR 116 Ca 0.19 -0.77 -0.05 0.00 -0.55 0.00 0.00 66.41 65.23 3il9 h THR 116 Cb 0.44 0.83 -0.01 0.00 -1.73 0.00 0.00 68.15 67.69 3il9 h THR 116 CO 0.01 0.27 -0.08 1.88 -0.25 0.00 0.00 175.52 177.35 3il9 h TYR 117 N 0.60 0.44 -0.35 4.73 -1.99 -1.04 -2.03 116.97 117.33 3il9 h TYR 117 Ca 0.13 -0.11 -0.11 0.00 2.00 0.00 0.00 58.73 60.65 3il9 h TYR 117 Cb 0.30 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 38.91 3il9 h TYR 117 CO 0.01 0.68 -0.22 0.00 -0.00 0.00 0.00 178.16 178.63 3il9 h ALA 118 N 0.70 0.96 -0.42 3.88 0.00 -0.76 -1.48 119.26 122.14 3il9 h ALA 118 Ca 0.04 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 54.54 3il9 h ALA 118 Cb 0.56 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 3il9 h ALA 118 CO 0.03 0.60 0.04 1.25 0.00 0.00 0.00 179.25 181.17 3il9 h LEU 119 N 0.60 0.70 -0.38 0.00 5.85 -0.67 -1.27 115.31 120.14 3il9 h LEU 119 Ca 0.09 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.53 3il9 h LEU 119 Cb 0.69 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 3il9 h LEU 119 CO 0.05 0.81 0.24 -1.28 -0.34 0.00 0.00 178.44 177.93 3il9 h SER 120 N 0.57 0.40 -0.18 1.25 0.87 -1.14 0.07 113.55 115.40 3il9 h SER 120 Ca 0.12 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.68 3il9 h SER 120 Cb 0.43 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 3il9 h SER 120 CO 0.01 0.29 0.11 0.58 -0.53 0.00 0.00 176.83 177.29 3il9 h VAL 121 N 0.49 1.08 -0.64 2.23 2.07 -1.08 -2.20 116.25 118.20 3il9 h VAL 121 Ca 0.14 -0.20 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 3il9 h VAL 121 Cb -0.03 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 3il9 h VAL 121 CO -0.05 0.07 0.20 0.00 0.02 0.00 0.00 177.57 177.82 3il9 h ALA 122 N 1.02 1.14 -0.94 1.67 0.00 -1.07 -2.09 119.26 118.98 3il9 h ALA 122 Ca 0.06 -0.20 0.10 0.00 0.00 0.00 0.00 54.91 54.87 3il9 h ALA 122 Cb 0.03 -0.26 -0.08 0.00 0.00 0.00 0.00 17.79 17.49 3il9 h ALA 122 CO -0.01 0.60 0.58 0.22 0.00 0.00 0.00 179.25 180.63 3il9 h ASP 123 N 0.95 0.86 -0.77 0.00 3.58 -0.65 -1.70 116.42 118.69 3il9 h ASP 123 Ca 0.21 0.04 0.01 0.00 0.42 0.00 0.00 57.03 57.71 3il9 h ASP 123 Cb 0.27 -0.13 -0.04 0.00 1.72 0.00 0.00 39.33 41.15 3il9 h ASP 123 CO -0.01 0.48 0.51 1.56 -2.88 0.00 0.00 179.24 178.90 3il9 h GLN 124 N 0.95 1.01 -0.09 0.28 1.08 -0.76 -0.35 115.11 117.24 3il9 h GLN 124 Ca 0.45 -0.06 -0.16 0.00 -1.45 0.00 0.00 58.65 57.42 3il9 h GLN 124 Cb 0.39 -0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.58 3il9 h GLN 124 CO -0.24 0.67 -0.65 1.88 -0.95 0.00 0.00 178.83 179.54 3il9 h TYR 125 N 1.04 0.47 0.03 2.96 -1.99 -1.30 -2.69 116.97 115.49 3il9 h TYR 125 Ca 0.28 -0.19 -0.21 0.00 2.00 0.00 0.00 58.73 60.61 3il9 h TYR 125 Cb -0.12 -0.08 0.02 0.00 2.00 0.00 0.00 36.73 38.55 3il9 h TYR 125 CO -0.02 0.91 -0.84 0.28 -0.00 0.00 0.00 178.16 178.49 3il9 h VAL 126 N 0.26 1.37 -0.61 -2.88 2.07 -1.12 -2.15 116.25 113.19 3il9 h VAL 126 Ca -0.01 -2.22 -0.01 0.00 0.82 0.00 0.00 66.70 65.28 3il9 h VAL 126 Cb 1.19 2.60 -0.03 0.00 -1.52 0.00 0.00 31.29 33.54 3il9 h VAL 126 CO 0.11 0.66 0.35 0.11 0.02 0.00 0.00 177.57 178.82 3il9 h LYS 127 N 0.07 0.84 0.00 1.57 1.57 -1.12 -2.43 116.57 117.06 3il9 h LYS 127 Ca -0.11 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 3il9 h LYS 127 Cb 1.54 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.67 3il9 h LYS 127 CO 0.16 0.60 0.00 -1.13 -0.57 0.00 0.00 179.45 178.52 3il9 n SER 128 N -4.40 0.00 0.00 0.86 3.41 -1.02 -4.61 113.62 107.87 3il9 n SER 128 Ca 0.06 -0.28 0.00 0.00 -0.26 0.00 0.00 58.87 58.39 3il9 n SER 128 Cb 0.09 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 3il9 n SER 128 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3il9 n GLY 129 N 1.16 0.81 0.14 5.00 0.00 -0.92 -4.92 105.19 106.46 3il9 n GLY 129 Ca 0.16 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.11 3il9 n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3il9 h ALA 130 N 0.00 0.70 -3.44 4.61 0.00 -1.63 -3.44 119.26 116.05 3il9 h ALA 130 Ca 0.00 -0.65 -0.40 0.00 0.00 0.00 0.00 54.91 53.87 3il9 h ALA 130 Cb 0.00 -0.09 -0.34 0.00 0.00 0.00 0.00 17.79 17.36 3il9 h ALA 130 CO 0.00 0.85 -0.77 0.08 0.00 0.00 0.00 179.25 179.41 3il9 s VAL 131 N -3.43 0.43 -0.04 0.00 1.01 -0.97 -5.02 120.40 112.38 3il9 s VAL 131 Ca -0.03 -0.04 -0.21 0.00 0.00 0.00 0.00 61.98 61.70 3il9 s VAL 131 Cb 0.11 -0.49 -0.32 0.00 0.00 0.00 0.00 36.38 35.68 3il9 s VAL 131 CO 0.81 0.21 0.91 0.50 0.00 0.00 0.00 175.10 177.53 3il9 h LYS 132 N 7.34 0.33 -4.81 2.72 3.64 -1.89 -3.37 116.57 120.53 3il9 h LYS 132 Ca -0.37 -0.56 -0.52 0.00 -1.27 0.00 0.00 60.65 57.94 3il9 h LYS 132 Cb 1.14 0.21 -0.32 0.00 -0.41 0.00 0.00 32.23 32.85 3il9 h LYS 132 CO 0.44 1.27 -0.82 0.71 -2.27 0.00 0.00 179.45 178.78 3il9 s TYR 133 N -2.46 1.47 0.03 1.91 1.51 -1.26 -1.82 117.35 116.73 3il9 s TYR 133 Ca -0.13 -0.48 0.06 0.00 -1.01 0.00 0.00 57.07 55.51 3il9 s TYR 133 Cb 0.01 -1.04 -0.02 0.00 -0.11 0.00 0.00 41.96 40.80 3il9 s TYR 133 CO 0.84 -0.21 -0.19 0.00 -1.11 0.00 0.00 175.55 174.88 3il9 s ALA 134 N 0.38 1.56 -0.22 3.71 0.00 -0.43 0.10 121.76 126.86 3il9 s ALA 134 Ca -0.09 -0.93 -0.07 0.00 0.00 0.00 0.00 51.96 50.87 3il9 s ALA 134 Cb -0.13 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 3il9 s ALA 134 CO 0.03 0.35 0.06 -1.17 0.00 0.00 0.00 175.76 175.02 3il9 s LEU 135 N -0.94 3.52 -0.14 0.00 2.96 0.36 -0.51 118.68 123.92 3il9 s LEU 135 Ca 0.06 -0.12 0.02 0.00 -0.22 0.00 0.00 54.13 53.88 3il9 s LEU 135 Cb -0.08 -1.92 0.01 0.00 0.50 0.00 0.00 46.19 44.70 3il9 s LEU 135 CO 0.01 0.05 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.18 3il9 s VAL 136 N 1.11 2.07 -0.04 1.68 1.01 -0.39 -1.23 120.40 124.62 3il9 s VAL 136 Ca 0.04 -0.97 0.07 0.00 0.00 0.00 0.00 61.98 61.11 3il9 s VAL 136 Cb -0.14 -1.83 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 3il9 s VAL 136 CO 0.03 0.55 -0.24 -0.69 0.00 0.00 0.00 175.10 174.74 3il9 s VAL 137 N 0.86 2.18 -0.21 2.92 1.01 -0.44 -0.51 120.40 126.21 3il9 s VAL 137 Ca -0.06 -1.05 -0.01 0.00 0.00 0.00 0.00 61.98 60.87 3il9 s VAL 137 Cb -0.15 -1.78 0.01 0.00 0.00 0.00 0.00 36.38 34.47 3il9 s VAL 137 CO -0.03 0.58 -0.12 -0.83 0.00 0.00 0.00 175.10 174.70 3il9 s GLY 138 N -0.45 1.51 -0.11 4.51 0.00 0.12 -0.04 107.32 112.86 3il9 s GLY 138 Ca 0.05 -1.27 -0.05 0.00 0.00 0.00 0.00 44.72 43.45 3il9 s GLY 138 CO 0.01 0.39 0.25 -0.45 0.00 0.00 0.00 173.10 173.29 3il9 s SER 139 N 1.35 -0.25 -0.02 1.64 0.15 -0.72 -0.37 113.70 115.48 3il9 s SER 139 Ca 0.04 0.53 -0.21 0.00 0.70 0.00 0.00 55.95 57.01 3il9 s SER 139 Cb -0.14 0.42 0.04 0.00 -1.71 0.00 0.00 66.02 64.63 3il9 s SER 139 CO -0.08 -0.17 0.45 -1.81 1.20 0.00 0.00 173.24 172.83 3il9 s ASP 140 N 1.31 -0.37 -0.44 5.45 1.01 -0.88 -4.30 116.67 118.44 3il9 s ASP 140 Ca -0.09 0.31 0.06 0.00 0.71 0.00 0.00 52.55 53.54 3il9 s ASP 140 Cb -0.10 0.40 0.42 0.00 1.01 0.00 0.00 42.92 44.65 3il9 s ASP 140 CO -0.09 -0.53 1.09 1.33 0.21 0.00 0.00 175.17 177.18 3il9 n VAL 141 N 1.07 2.33 0.25 -1.27 0.24 -1.26 -1.93 118.33 117.76 3il9 n VAL 141 Ca -0.20 -4.88 0.09 0.00 -2.04 0.00 0.00 64.34 57.31 3il9 n VAL 141 Cb 0.57 -1.16 0.66 0.00 -1.47 0.00 0.00 33.84 32.44 3il9 n VAL 141 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3il9 h LEU 142 N 2.64 0.00 -1.49 1.34 3.38 -1.91 0.53 115.31 119.80 3il9 h LEU 142 Ca 0.26 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 3il9 h LEU 142 Cb 0.90 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 3il9 h LEU 142 CO 0.82 0.10 0.28 0.00 0.09 0.00 0.00 178.44 179.73 3il9 h ALA 143 N 1.90 1.62 0.00 1.53 0.00 -1.79 0.34 119.26 122.87 3il9 h ALA 143 Ca -0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3il9 h ALA 143 Cb 0.20 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3il9 h ALA 143 CO 0.01 0.34 -0.08 -0.09 0.00 0.00 0.00 179.25 179.43 3il9 h ARG 144 N 0.64 0.00 -0.00 0.00 2.43 -1.23 -2.86 114.38 113.36 3il9 h ARG 144 Ca 0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 3il9 h ARG 144 Cb -0.02 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 3il9 h ARG 144 CO -0.03 0.08 -0.49 0.25 -1.51 0.00 0.00 179.97 178.27 3il9 n THR 145 N -3.30 0.00 -2.81 0.20 -2.24 0.09 -4.93 114.28 101.30 3il9 n THR 145 Ca -0.01 -0.04 -0.35 0.00 -2.27 0.00 0.00 64.05 61.38 3il9 n THR 145 Cb 0.29 0.39 -0.07 0.00 -2.10 0.00 0.00 70.33 68.83 3il9 n THR 145 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3il9 s ASP 147 N -1.83 6.15 0.00 0.00 3.68 -1.26 -4.87 116.67 118.54 3il9 s ASP 147 Ca 0.54 1.48 0.10 0.00 2.13 0.00 0.00 52.55 56.80 3il9 s ASP 147 Cb -0.15 -2.53 0.50 0.00 -1.45 0.00 0.00 42.92 39.30 3il9 s ASP 147 CO 0.20 -1.47 1.21 -0.81 0.13 0.00 0.00 175.17 174.43 3il9 n PRO 148 N 8.03 0.14 0.00 4.34 -0.04 -1.26 -0.28 135.00 145.93 3il9 n PRO 148 Ca 0.21 0.20 0.11 0.00 -0.04 0.00 0.00 63.50 63.98 3il9 n PRO 148 Cb 0.46 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.47 3il9 n PRO 148 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3il9 n THR 149 N -1.30 0.00 -3.10 0.52 -2.24 -1.26 -4.68 114.28 102.22 3il9 n THR 149 Ca 0.05 -0.39 -0.43 0.00 -2.27 0.00 0.00 64.05 61.00 3il9 n THR 149 Cb 0.08 1.37 -0.06 0.00 -2.10 0.00 0.00 70.33 69.63 3il9 n THR 149 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3il9 s ASP 150 N -2.16 6.26 0.45 3.42 2.15 0.62 -4.92 116.67 122.49 3il9 s ASP 150 Ca 0.23 -0.71 0.14 0.00 0.43 0.00 0.00 52.55 52.64 3il9 s ASP 150 Cb 0.18 -2.32 1.07 0.00 -0.30 0.00 0.00 42.92 41.56 3il9 s ASP 150 CO 0.41 -0.92 2.02 -0.09 -0.17 0.00 0.00 175.17 176.43 3il9 h ARG 151 N 9.02 0.33 0.00 4.34 2.43 -1.90 -1.76 114.38 126.84 3il9 h ARG 151 Ca -0.27 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 3il9 h ARG 151 Cb 1.09 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 3il9 h ARG 151 CO 0.97 0.22 0.00 0.78 -1.51 0.00 0.00 179.97 180.42 3il9 h GLY 152 N 0.34 0.00 0.00 2.80 0.00 -1.95 -3.35 103.07 100.91 3il9 h GLY 152 Ca 0.22 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.54 3il9 h GLY 152 CO -0.05 0.00 -1.03 -1.30 0.00 0.00 0.00 176.54 174.16 3il9 n THR 153 N -2.96 0.03 0.27 4.70 -2.24 -1.01 -4.73 114.28 108.32 3il9 n THR 153 Ca 0.02 -0.01 0.14 0.00 -2.27 0.00 0.00 64.05 61.93 3il9 n THR 153 Cb 0.39 -0.54 0.72 0.00 -2.10 0.00 0.00 70.33 68.80 3il9 n THR 153 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 3il9 h ILE 154 N 0.00 0.40 0.00 2.28 6.09 -1.50 -1.25 117.51 123.53 3il9 h ILE 154 Ca -0.01 -0.59 0.00 0.00 -1.37 0.00 0.00 64.86 62.89 3il9 h ILE 154 Cb 1.02 1.42 0.00 0.00 0.47 0.00 0.00 36.82 39.73 3il9 h ILE 154 CO -0.00 0.11 0.00 0.16 -3.07 0.00 0.00 178.15 175.34 3il9 h ILE 155 N 0.00 0.00 0.05 2.19 3.07 -1.79 -3.37 117.51 117.66 3il9 h ILE 155 Ca -0.00 -0.74 -0.33 0.00 1.55 0.00 0.00 64.86 65.34 3il9 h ILE 155 Cb 0.41 1.72 -0.03 0.00 -0.27 0.00 0.00 36.82 38.65 3il9 h ILE 155 CO 0.01 0.00 -1.84 -0.38 -1.05 0.00 0.00 178.15 174.89 3il9 n ILE 156 N -2.76 1.63 -3.45 0.16 2.08 -0.48 -4.98 119.36 111.57 3il9 n ILE 156 Ca 0.04 -0.39 -0.35 0.00 0.56 0.00 0.00 62.75 62.62 3il9 n ILE 156 Cb 0.46 -1.83 -0.06 0.00 -0.75 0.00 0.00 39.64 37.46 3il9 n ILE 156 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 3il9 s PHE 157 N -2.48 3.59 0.43 1.39 0.40 -1.15 -1.08 117.98 119.08 3il9 s PHE 157 Ca -0.28 0.94 0.03 0.00 -0.60 0.00 0.00 56.93 57.03 3il9 s PHE 157 Cb 0.08 -2.28 -0.02 0.00 0.51 0.00 0.00 43.02 41.30 3il9 s PHE 157 CO 0.66 0.46 0.11 0.20 0.70 0.00 0.00 175.22 177.34 3il9 s GLY 158 N -1.76 2.69 0.16 4.36 0.00 0.12 -4.50 107.32 108.39 3il9 s GLY 158 Ca 0.36 -1.09 0.08 0.00 0.00 0.00 0.00 44.72 44.07 3il9 s GLY 158 CO 0.19 -1.90 -0.06 0.99 0.00 0.00 0.00 173.10 172.32 3il9 s ASP 159 N -3.66 4.50 0.00 1.64 1.01 0.43 -3.59 116.67 117.00 3il9 s ASP 159 Ca 0.20 -0.45 0.00 0.00 0.71 0.00 0.00 52.55 53.01 3il9 s ASP 159 Cb 0.02 -0.87 0.00 0.00 1.01 0.00 0.00 42.92 43.08 3il9 s ASP 159 CO 0.13 0.12 0.00 0.61 0.21 0.00 0.00 175.17 176.23 3il9 n GLY 160 N 0.14 -0.29 3.27 0.21 0.00 -0.81 -4.50 105.19 103.21 3il9 n GLY 160 Ca -0.11 -1.12 -0.13 0.00 0.00 0.00 0.00 46.02 44.66 3il9 n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3il9 s ALA 161 N -2.00 -0.92 0.17 4.61 0.00 -0.68 -2.08 121.76 120.86 3il9 s ALA 161 Ca 0.00 0.95 0.04 0.00 0.00 0.00 0.00 51.96 52.95 3il9 s ALA 161 Cb 0.00 -0.50 -0.05 0.00 0.00 0.00 0.00 23.12 22.57 3il9 s ALA 161 CO 0.00 -0.19 -0.06 0.20 0.00 0.00 0.00 175.76 175.71 3il9 s GLY 162 N -0.06 1.22 0.08 0.00 0.00 0.50 -0.42 107.32 108.63 3il9 s GLY 162 Ca -0.02 -1.58 -0.14 0.00 0.00 0.00 0.00 44.72 42.97 3il9 s GLY 162 CO 0.01 -1.60 0.33 0.00 0.00 0.00 0.00 173.10 171.84 3il9 s ALA 163 N -3.41 -0.74 0.01 3.20 0.00 0.79 -0.70 121.76 120.91 3il9 s ALA 163 Ca 0.21 -0.07 0.01 0.00 0.00 0.00 0.00 51.96 52.10 3il9 s ALA 163 Cb 0.04 0.48 -0.01 0.00 0.00 0.00 0.00 23.12 23.63 3il9 s ALA 163 CO 0.03 -0.51 -0.03 0.00 0.00 0.00 0.00 175.76 175.25 3il9 s ALA 164 N -3.19 0.19 -0.20 0.00 0.00 0.33 -1.13 121.76 117.76 3il9 s ALA 164 Ca -0.01 -0.27 -0.10 0.00 0.00 0.00 0.00 51.96 51.58 3il9 s ALA 164 Cb 0.01 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 23.10 3il9 s ALA 164 CO -0.07 -0.02 0.12 0.08 0.00 0.00 0.00 175.76 175.87 3il9 s VAL 165 N -0.53 5.28 -0.03 0.00 1.01 0.69 -1.26 120.40 125.57 3il9 s VAL 165 Ca -0.04 0.14 0.02 0.00 0.00 0.00 0.00 61.98 62.10 3il9 s VAL 165 Cb -0.04 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 3il9 s VAL 165 CO -0.00 0.43 -0.07 -0.76 0.00 0.00 0.00 175.10 174.70 3il9 s LEU 166 N 0.46 3.18 0.02 3.92 1.43 0.33 -1.07 118.68 126.95 3il9 s LEU 166 Ca 0.07 -0.09 0.02 0.00 -1.03 0.00 0.00 54.13 53.11 3il9 s LEU 166 Cb -0.12 -1.77 -0.01 0.00 0.03 0.00 0.00 46.19 44.32 3il9 s LEU 166 CO -0.01 0.32 -0.07 0.00 0.23 0.00 0.00 176.35 176.82 3il9 s ALA 167 N -0.92 0.56 0.37 4.21 0.00 0.50 -1.32 121.76 125.17 3il9 s ALA 167 Ca 0.15 -0.53 -0.28 0.00 0.00 0.00 0.00 51.96 51.30 3il9 s ALA 167 Cb -0.11 -0.05 -0.11 0.00 0.00 0.00 0.00 23.12 22.85 3il9 s ALA 167 CO 0.05 0.06 1.49 0.00 0.00 0.00 0.00 175.76 177.36 3il9 n ALA 168 N 2.17 2.39 -3.08 0.00 0.00 -0.76 -0.34 120.51 120.89 3il9 n ALA 168 Ca -0.18 0.34 -0.12 0.00 0.00 0.00 0.00 53.44 53.48 3il9 n ALA 168 Cb 0.56 -2.42 -0.08 0.00 0.00 0.00 0.00 19.45 17.51 3il9 n ALA 168 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3il9 s SER 169 N -0.09 -0.11 0.24 0.00 0.15 0.88 -4.79 113.70 109.97 3il9 s SER 169 Ca 0.54 -0.11 0.25 0.00 0.70 0.00 0.00 55.95 57.33 3il9 s SER 169 Cb -0.48 0.32 0.87 0.00 -1.71 0.00 0.00 66.02 65.02 3il9 s SER 169 CO 0.63 -0.52 1.76 -0.62 1.20 0.00 0.00 173.24 175.68 3il9 n GLU 170 N 0.94 0.25 -3.90 5.44 1.02 -1.26 -0.03 120.64 123.09 3il9 n GLU 170 Ca -0.20 0.30 -0.11 0.00 -0.02 0.00 0.00 57.16 57.13 3il9 n GLU 170 Cb 0.58 -1.85 -0.11 0.00 -0.02 0.00 0.00 31.44 30.04 3il9 n GLU 170 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 3il9 s GLU 171 N -3.19 0.30 0.47 3.49 2.12 -1.26 -4.72 118.70 115.91 3il9 s GLU 171 Ca 0.08 -0.31 -0.21 0.00 0.36 0.00 0.00 54.97 54.89 3il9 s GLU 171 Cb 0.11 0.12 -0.08 0.00 0.26 0.00 0.00 34.13 34.54 3il9 s GLU 171 CO 0.53 -0.06 1.08 -1.25 -0.54 0.00 0.00 175.26 175.01 3il9 s PRO 172 N -0.95 3.80 1.00 4.30 0.04 -1.26 -4.75 135.00 137.18 3il9 s PRO 172 Ca -0.10 1.51 0.00 0.00 0.04 0.00 0.00 61.00 62.44 3il9 s PRO 172 Cb -0.06 -2.24 0.00 0.00 0.04 0.00 0.00 34.50 32.24 3il9 s PRO 172 CO 0.00 -0.45 0.00 0.41 0.04 0.00 0.00 177.00 177.00 3il9 n GLY 173 N 0.07 -1.76 3.59 0.56 0.00 0.30 -4.67 105.19 103.28 3il9 n GLY 173 Ca 0.08 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 3il9 n GLY 173 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3il9 s ILE 174 N 0.00 3.85 0.01 -0.61 1.01 0.14 -0.59 121.20 125.01 3il9 s ILE 174 Ca 0.00 0.82 -0.21 0.00 0.00 0.00 0.00 60.65 61.26 3il9 s ILE 174 Cb 0.00 -4.28 -0.18 0.00 0.01 0.00 0.00 42.46 38.01 3il9 s ILE 174 CO 0.00 -0.91 1.24 0.40 0.00 0.00 0.00 174.94 175.67 3il9 h ILE 175 N 6.45 1.40 -2.96 2.92 2.04 -0.78 -3.42 117.51 123.16 3il9 h ILE 175 Ca -0.27 -1.54 -0.02 0.00 1.00 0.00 0.00 64.86 64.03 3il9 h ILE 175 Cb 1.10 2.17 -0.12 0.00 -0.74 0.00 0.00 36.82 39.22 3il9 h ILE 175 CO 1.12 0.44 0.20 -0.94 0.00 0.00 0.00 178.15 178.98 3il9 s SER 176 N -6.23 -0.57 0.13 1.72 1.04 -1.21 -5.01 113.70 103.57 3il9 s SER 176 Ca -0.14 0.03 0.06 0.00 0.48 0.00 0.00 55.95 56.38 3il9 s SER 176 Cb 0.04 0.59 -0.04 0.00 0.10 0.00 0.00 66.02 66.72 3il9 s SER 176 CO 0.76 -0.95 -0.14 0.42 0.98 0.00 0.00 173.24 174.31 3il9 s THR 177 N -3.62 1.35 -0.03 2.02 -4.23 -1.26 -1.42 115.64 108.45 3il9 s THR 177 Ca 0.00 -1.80 -0.01 0.00 -1.18 0.00 0.00 61.69 58.70 3il9 s THR 177 Cb -0.01 -1.62 0.02 0.00 1.34 0.00 0.00 72.50 72.24 3il9 s THR 177 CO -0.12 -0.47 0.06 -1.00 -0.54 0.00 0.00 174.62 172.55 3il9 s HIS 178 N -2.35 -0.04 -0.01 3.99 3.76 -0.61 -4.99 115.29 115.03 3il9 s HIS 178 Ca 0.11 0.20 0.03 0.00 -0.15 0.00 0.00 55.06 55.25 3il9 s HIS 178 Cb -0.04 -0.12 -0.01 0.00 1.11 0.00 0.00 32.58 33.53 3il9 s HIS 178 CO 0.03 -0.08 -0.11 -0.51 -0.85 0.00 0.00 174.74 173.22 3il9 s LEU 179 N 0.75 1.98 0.06 0.89 1.43 -1.26 -1.03 118.68 121.51 3il9 s LEU 179 Ca -0.06 -0.20 -0.04 0.00 -1.03 0.00 0.00 54.13 52.80 3il9 s LEU 179 Cb -0.08 -0.56 -0.02 0.00 0.03 0.00 0.00 46.19 45.55 3il9 s LEU 179 CO -0.03 0.12 0.06 -1.00 0.23 0.00 0.00 176.35 175.74 3il9 s HIS 180 N -0.18 0.35 0.06 0.29 3.76 0.14 -5.01 115.29 114.70 3il9 s HIS 180 Ca 0.03 -0.82 -0.22 0.00 -0.15 0.00 0.00 55.06 53.90 3il9 s HIS 180 Cb -0.05 -0.24 0.05 0.00 1.11 0.00 0.00 32.58 33.45 3il9 s HIS 180 CO -0.00 -0.43 0.51 0.00 -0.85 0.00 0.00 174.74 173.96 3il9 s ALA 181 N -3.71 -1.30 -0.28 -1.40 0.00 -1.26 -1.05 121.76 112.76 3il9 s ALA 181 Ca 0.05 0.52 -0.00 0.00 0.00 0.00 0.00 51.96 52.52 3il9 s ALA 181 Cb 0.06 0.45 0.14 0.00 0.00 0.00 0.00 23.12 23.76 3il9 s ALA 181 CO -0.10 -0.54 0.32 0.34 0.00 0.00 0.00 175.76 175.79 3il9 s ASP 182 N -2.11 1.22 0.00 0.00 -1.08 -0.26 -4.99 116.67 109.46 3il9 s ASP 182 Ca -0.04 -0.55 0.17 0.00 -0.52 0.00 0.00 52.55 51.61 3il9 s ASP 182 Cb -0.00 0.69 0.87 0.00 -1.46 0.00 0.00 42.92 43.02 3il9 s ASP 182 CO -0.04 -0.37 1.49 0.61 0.52 0.00 0.00 175.17 177.39 3il9 n GLY 183 N 5.33 -0.82 0.08 2.66 0.00 -1.25 -1.49 105.19 109.70 3il9 n GLY 183 Ca -0.02 -0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.02 3il9 n GLY 183 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3il9 n SER 184 N -1.26 0.42 -1.44 1.61 3.41 -1.26 -1.37 113.62 113.73 3il9 n SER 184 Ca 0.08 0.61 0.09 0.00 -0.26 0.00 0.00 58.87 59.39 3il9 n SER 184 Cb 0.13 -0.70 0.32 0.00 -0.26 0.00 0.00 64.21 63.70 3il9 n SER 184 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3il9 n TYR 185 N -1.97 1.31 -0.15 7.33 4.02 -1.14 -4.65 117.16 121.91 3il9 n TYR 185 Ca 0.02 -0.53 0.19 0.00 -0.01 0.00 0.00 57.90 57.58 3il9 n TYR 185 Cb 0.20 -0.21 0.58 0.00 -0.02 0.00 0.00 39.34 39.89 3il9 n TYR 185 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3il9 h GLY 186 N 4.38 0.49 2.00 2.72 0.00 -1.20 -1.99 103.07 109.46 3il9 h GLY 186 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.21 3il9 h GLY 186 CO 0.20 0.02 0.00 0.83 0.00 0.00 0.00 176.54 177.59 3il9 h GLU 187 N 0.26 0.00 0.00 4.80 5.08 -1.85 -3.27 114.58 119.60 3il9 h GLU 187 Ca 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 3il9 h GLU 187 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 3il9 h GLU 187 CO -0.09 0.00 -0.02 1.28 -1.00 0.00 0.00 179.01 179.18 3il9 n LEU 188 N -2.69 0.57 -3.24 1.33 4.77 -0.75 -4.64 117.00 112.35 3il9 n LEU 188 Ca 0.03 0.54 0.03 0.00 -0.03 0.00 0.00 56.01 56.58 3il9 n LEU 188 Cb 0.36 -0.37 -0.02 0.00 -2.33 0.00 0.00 43.42 41.06 3il9 n LEU 188 CO 0.27 -0.12 0.18 -0.22 -1.33 0.00 0.00 177.39 176.17 3il9 s LEU 189 N -4.05 -1.34 0.04 2.23 2.96 -1.23 -0.68 118.68 116.61 3il9 s LEU 189 Ca 0.12 0.99 0.00 0.00 -0.22 0.00 0.00 54.13 55.02 3il9 s LEU 189 Cb 0.14 2.18 -0.03 0.00 0.50 0.00 0.00 46.19 48.99 3il9 s LEU 189 CO 0.58 -0.25 -0.04 0.42 -1.32 0.00 0.00 176.35 175.74 3il9 s THR 190 N 2.87 0.25 -0.28 3.68 -4.23 -0.29 -4.44 115.64 113.20 3il9 s THR 190 Ca 0.16 -1.35 -0.04 0.00 -1.18 0.00 0.00 61.69 59.28 3il9 s THR 190 Cb -0.14 -0.89 0.10 0.00 1.34 0.00 0.00 72.50 72.90 3il9 s THR 190 CO -0.21 -0.71 0.12 -0.22 -0.54 0.00 0.00 174.62 173.07 3il9 s LEU 191 N -2.15 0.68 0.49 4.79 2.96 -1.26 -0.50 118.68 123.68 3il9 s LEU 191 Ca -0.04 -1.27 -0.23 0.00 -0.22 0.00 0.00 54.13 52.37 3il9 s LEU 191 Cb -0.02 -0.39 -0.06 0.00 0.50 0.00 0.00 46.19 46.22 3il9 s LEU 191 CO -0.05 -0.43 1.25 -2.84 -1.32 0.00 0.00 176.35 172.96 3il9 s PRO 192 N 2.06 3.52 0.74 0.98 0.02 -1.26 -5.04 135.00 136.02 3il9 s PRO 192 Ca 0.08 1.97 -0.08 0.00 0.02 0.00 0.00 61.00 63.00 3il9 s PRO 192 Cb -0.16 -2.36 0.08 0.00 0.02 0.00 0.00 34.50 32.08 3il9 s PRO 192 CO -0.34 -0.81 1.06 -0.80 -0.33 0.00 0.00 177.00 175.78 3il9 s ASN 193 N -1.18 4.61 0.20 2.53 0.02 -1.26 -4.79 114.94 115.07 3il9 s ASN 193 Ca 0.67 0.43 -0.32 0.00 -1.02 0.00 0.00 52.86 52.62 3il9 s ASN 193 Cb -0.34 -1.00 -0.14 0.00 0.02 0.00 0.00 41.25 39.79 3il9 s ASN 193 CO 0.40 -1.74 1.33 0.00 0.02 0.00 0.00 177.10 177.11 3il9 n ALA 194 N -3.04 0.36 -2.60 0.60 0.00 -1.26 -4.87 120.51 109.70 3il9 n ALA 194 Ca 0.09 0.44 -0.43 0.00 0.00 0.00 0.00 53.44 53.54 3il9 n ALA 194 Cb 0.60 -2.18 -0.04 0.00 0.00 0.00 0.00 19.45 17.83 3il9 n ALA 194 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3il9 s ASP 195 N 0.24 6.40 0.00 0.00 3.68 -1.26 -4.89 116.67 120.84 3il9 s ASP 195 Ca 0.72 -0.16 0.21 0.00 2.13 0.00 0.00 52.55 55.44 3il9 s ASP 195 Cb -0.74 -2.43 0.74 0.00 -1.45 0.00 0.00 42.92 39.05 3il9 s ASP 195 CO 0.49 -1.09 1.55 0.54 0.13 0.00 0.00 175.17 176.79 3il9 n ARG 196 N 7.17 1.76 -0.10 4.34 1.74 -1.26 -2.39 116.66 127.92 3il9 n ARG 196 Ca 0.03 -1.14 -0.16 0.00 -0.77 0.00 0.00 57.85 55.81 3il9 n ARG 196 Cb 0.48 -1.40 -0.08 0.00 -1.02 0.00 0.00 32.46 30.43 3il9 n ARG 196 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3il9 n VAL 197 N 0.37 1.09 -3.69 1.55 0.31 -1.26 -4.85 118.33 111.85 3il9 n VAL 197 Ca 0.16 -0.37 -0.29 0.00 -0.01 0.00 0.00 64.34 63.84 3il9 n VAL 197 Cb 0.34 -1.37 -0.12 0.00 -0.91 0.00 0.00 33.84 31.78 3il9 n VAL 197 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3il9 s ASN 198 N -6.16 3.47 0.00 4.52 0.01 -1.24 -5.00 114.94 110.55 3il9 s ASN 198 Ca -0.26 -3.05 0.01 0.00 -0.71 0.00 0.00 52.86 48.85 3il9 s ASN 198 Cb 0.08 -1.07 0.06 0.00 0.41 0.00 0.00 41.25 40.73 3il9 s ASN 198 CO 0.41 -0.20 1.04 -2.65 -1.51 0.00 0.00 177.10 174.19 3il9 n PRO 199 N 2.97 0.00 0.07 -0.60 -0.02 -1.00 -1.89 135.00 134.53 3il9 n PRO 199 Ca 0.16 0.48 0.13 0.00 -2.02 0.00 0.00 63.50 62.25 3il9 n PRO 199 Cb 0.38 -1.50 0.36 0.00 -0.02 0.00 0.00 33.50 32.71 3il9 n PRO 199 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3il9 n GLU 200 N -1.50 0.22 -2.14 -0.52 0.00 -1.26 -4.80 120.64 110.64 3il9 n GLU 200 Ca 0.00 0.13 -0.39 0.00 0.00 0.00 0.00 57.16 56.91 3il9 n GLU 200 Cb 0.02 -1.71 -0.01 0.00 0.00 0.00 0.00 31.44 29.74 3il9 n GLU 200 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 3il9 s ASN 201 N -4.12 6.32 0.60 -1.84 0.02 -0.79 -4.97 114.94 110.16 3il9 s ASN 201 Ca 0.10 2.53 -0.19 0.00 -1.02 0.00 0.00 52.86 54.27 3il9 s ASN 201 Cb 0.14 -2.63 -0.03 0.00 0.02 0.00 0.00 41.25 38.75 3il9 s ASN 201 CO 0.63 -0.83 1.25 -0.55 0.02 0.00 0.00 177.10 177.62 3il9 s SER 202 N -0.93 5.06 -0.07 -1.22 0.15 -1.26 -4.72 113.70 110.71 3il9 s SER 202 Ca 0.58 2.50 0.10 0.00 0.70 0.00 0.00 55.95 59.84 3il9 s SER 202 Cb -0.35 -2.61 0.23 0.00 -1.71 0.00 0.00 66.02 61.58 3il9 s SER 202 CO 0.44 -1.69 1.16 2.30 1.20 0.00 0.00 173.24 176.65 3il9 n ILE 203 N -1.57 1.47 -2.41 6.45 -5.35 -1.26 -4.81 119.36 111.88 3il9 n ILE 203 Ca 0.14 -1.52 -0.35 0.00 -0.27 0.00 0.00 62.75 60.74 3il9 n ILE 203 Cb 0.49 0.16 -0.02 0.00 -1.74 0.00 0.00 39.64 38.52 3il9 n ILE 203 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 3il9 s HIS 204 N -1.86 2.91 0.34 4.28 3.76 -1.26 -4.37 115.29 119.09 3il9 s HIS 204 Ca 0.21 1.57 -0.29 0.00 -0.15 0.00 0.00 55.06 56.40 3il9 s HIS 204 Cb 0.16 -3.20 -0.11 0.00 1.11 0.00 0.00 32.58 30.55 3il9 s HIS 204 CO 0.05 -1.15 1.44 -1.17 -0.85 0.00 0.00 174.74 173.06 3il9 s LEU 205 N -3.39 4.36 0.10 0.89 0.20 -0.53 -4.42 118.68 115.88 3il9 s LEU 205 Ca 0.67 2.89 0.08 0.00 0.69 0.00 0.00 54.13 58.46 3il9 s LEU 205 Cb -0.21 -3.65 -0.03 0.00 -0.43 0.00 0.00 46.19 41.86 3il9 s LEU 205 CO 0.26 -0.76 -0.21 0.42 -0.29 0.00 0.00 176.35 175.76 3il9 s THR 206 N -0.87 1.77 -0.22 3.68 -4.23 0.35 -4.64 115.64 111.48 3il9 s THR 206 Ca 0.54 -1.54 -0.12 0.00 -1.18 0.00 0.00 61.69 59.38 3il9 s THR 206 Cb -0.44 -1.60 0.07 0.00 1.34 0.00 0.00 72.50 71.87 3il9 s THR 206 CO 0.56 -0.03 0.54 -0.32 -0.54 0.00 0.00 174.62 174.83 3il9 s MET 207 N -1.88 0.54 -1.10 3.99 0.00 -1.26 -1.13 119.30 118.46 3il9 s MET 207 Ca 0.07 1.00 -0.12 0.00 0.00 0.00 0.00 55.69 56.64 3il9 s MET 207 Cb -0.10 0.06 0.22 0.00 0.00 0.00 0.00 34.83 35.02 3il9 s MET 207 CO 0.04 -0.16 1.18 0.00 0.00 0.00 0.00 175.02 176.09 3il9 s ALA 208 N 1.54 4.30 0.41 4.11 0.00 0.14 -4.94 121.76 127.32 3il9 s ALA 208 Ca -0.10 -3.53 0.13 0.00 0.00 0.00 0.00 51.96 48.46 3il9 s ALA 208 Cb -0.07 -3.79 0.97 0.00 0.00 0.00 0.00 23.12 20.23 3il9 s ALA 208 CO -0.16 -2.47 1.92 0.78 0.00 0.00 0.00 175.76 175.83 3il9 h GLY 209 N 8.15 0.83 1.28 0.00 0.00 -1.94 -1.79 103.07 109.61 3il9 h GLY 209 Ca 0.22 -0.22 -0.22 0.00 0.00 0.00 0.00 47.33 47.11 3il9 h GLY 209 CO 1.07 0.09 -0.80 -0.57 0.00 0.00 0.00 176.54 176.33 3il9 h ASN 210 N 0.51 0.83 -0.02 0.19 -1.24 -1.97 -1.00 115.58 112.88 3il9 h ASN 210 Ca 0.37 -0.56 -0.14 0.00 0.71 0.00 0.00 56.30 56.68 3il9 h ASN 210 Cb 0.73 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 39.53 3il9 h ASN 210 CO -0.13 1.35 -0.46 -0.33 -1.29 0.00 0.00 177.43 176.57 3il9 h GLU 211 N 0.46 0.57 -0.39 6.67 4.39 -1.79 -2.91 114.58 121.59 3il9 h GLU 211 Ca -0.06 -0.32 -0.09 0.00 0.34 0.00 0.00 59.36 59.24 3il9 h GLU 211 Cb 1.42 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 30.08 3il9 h GLU 211 CO 0.16 0.91 -0.11 0.28 -1.16 0.00 0.00 179.01 179.09 3il9 h VAL 212 N 0.46 1.28 -0.48 3.13 2.07 -1.24 -3.15 116.25 118.32 3il9 h VAL 212 Ca 0.03 -1.21 0.04 0.00 0.82 0.00 0.00 66.70 66.38 3il9 h VAL 212 Cb 0.98 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 3il9 h VAL 212 CO 0.09 0.40 0.24 0.15 0.02 0.00 0.00 177.57 178.47 3il9 h PHE 213 N 0.57 0.44 0.01 1.57 3.57 -1.12 -0.09 116.94 121.89 3il9 h PHE 213 Ca 0.10 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.64 3il9 h PHE 213 Cb 0.64 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 3il9 h PHE 213 CO 0.05 0.22 -0.17 0.87 -2.23 0.00 0.00 178.31 177.05 3il9 h LYS 214 N 0.47 -0.27 -0.41 1.11 1.57 -1.50 -1.74 116.57 115.79 3il9 h LYS 214 Ca 0.21 0.02 -0.15 0.00 -1.87 0.00 0.00 60.65 58.85 3il9 h LYS 214 Cb 0.11 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3il9 h LYS 214 CO -0.15 -0.18 -0.34 0.28 -0.57 0.00 0.00 179.45 178.49 3il9 h VAL 215 N -0.28 1.27 -0.22 0.50 2.07 -1.47 -2.97 116.25 115.15 3il9 h VAL 215 Ca 0.05 -1.51 0.01 0.00 0.82 0.00 0.00 66.70 66.07 3il9 h VAL 215 Cb 0.35 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 3il9 h VAL 215 CO -0.16 0.51 0.11 0.00 0.02 0.00 0.00 177.57 178.05 3il9 h ALA 216 N 0.81 0.27 -0.68 1.67 0.00 -0.79 0.19 119.26 120.73 3il9 h ALA 216 Ca 0.07 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3il9 h ALA 216 Cb 0.93 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 3il9 h ALA 216 CO 0.09 -0.30 0.44 0.28 0.00 0.00 0.00 179.25 179.76 3il9 h VAL 217 N 0.23 1.15 0.08 0.00 2.07 -1.32 0.33 116.25 118.79 3il9 h VAL 217 Ca 0.09 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 3il9 h VAL 217 Cb 0.02 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 3il9 h VAL 217 CO -0.06 0.16 -0.04 0.74 0.02 0.00 0.00 177.57 178.39 3il9 h THR 218 N 0.90 1.08 -0.02 2.57 2.02 -1.29 -2.03 112.91 116.14 3il9 h THR 218 Ca 0.26 -0.58 -0.16 0.00 0.77 0.00 0.00 66.41 66.70 3il9 h THR 218 Cb -0.07 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 3il9 h THR 218 CO -0.07 0.14 -0.72 -0.33 0.37 0.00 0.00 175.52 174.92 3il9 h GLU 219 N -0.37 0.12 -0.59 6.66 4.39 -0.87 -1.20 114.58 122.73 3il9 h GLU 219 Ca -0.01 -0.10 -0.08 0.00 0.34 0.00 0.00 59.36 59.51 3il9 h GLU 219 Cb 0.32 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 3il9 h GLU 219 CO 0.02 0.78 0.06 -0.07 -1.16 0.00 0.00 179.01 178.64 3il9 h LEU 220 N 0.08 0.94 -0.26 1.33 3.38 -0.97 -0.68 115.31 119.12 3il9 h LEU 220 Ca -0.02 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 3il9 h LEU 220 Cb 1.27 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 3il9 h LEU 220 CO 0.10 0.97 0.14 0.00 0.09 0.00 0.00 178.44 179.74 3il9 h ALA 221 N 1.14 0.34 -0.42 1.53 0.00 -1.03 -1.80 119.26 119.02 3il9 h ALA 221 Ca 0.18 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.06 3il9 h ALA 221 Cb 0.45 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 3il9 h ALA 221 CO 0.02 -0.12 0.18 0.45 0.00 0.00 0.00 179.25 179.77 3il9 h HIS 222 N 0.31 0.32 0.02 0.00 3.86 -0.92 -2.45 115.15 116.28 3il9 h HIS 222 Ca 0.09 0.02 -0.21 0.00 -1.16 0.00 0.00 60.37 59.11 3il9 h HIS 222 Cb 0.08 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 3il9 h HIS 222 CO -0.03 0.15 -0.93 0.97 0.86 0.00 0.00 177.93 178.94 3il9 h ILE 223 N 0.36 1.50 -0.48 2.45 2.10 -0.93 0.10 117.51 122.61 3il9 h ILE 223 Ca 0.19 -2.70 -0.07 0.00 1.08 0.00 0.00 64.86 63.35 3il9 h ILE 223 Cb 0.14 2.54 -0.02 0.00 -1.09 0.00 0.00 36.82 38.39 3il9 h ILE 223 CO -0.16 0.79 0.01 -0.37 -1.08 0.00 0.00 178.15 177.34 3il9 h VAL 224 N 0.11 1.26 -0.43 2.19 -1.51 -1.28 -0.50 116.25 116.10 3il9 h VAL 224 Ca -0.05 -1.04 -0.13 0.00 -1.23 0.00 0.00 66.70 64.24 3il9 h VAL 224 Cb 1.58 0.98 -0.01 0.00 -2.13 0.00 0.00 31.29 31.71 3il9 h VAL 224 CO 0.14 0.37 -0.27 0.44 -1.23 0.00 0.00 177.57 177.02 3il9 h ASP 225 N 0.71 0.94 -0.87 4.19 3.45 -1.30 -2.26 116.42 121.27 3il9 h ASP 225 Ca 0.14 -0.37 0.09 0.00 0.43 0.00 0.00 57.03 57.32 3il9 h ASP 225 Cb 0.49 -0.26 -0.07 0.00 -0.56 0.00 0.00 39.33 38.92 3il9 h ASP 225 CO 0.02 1.15 0.52 -0.08 -1.57 0.00 0.00 179.24 179.28 3il9 h GLU 226 N 0.78 0.85 -0.50 3.56 4.81 -0.66 -1.91 114.58 121.50 3il9 h GLU 226 Ca 0.09 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.16 3il9 h GLU 226 Cb 0.83 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 3il9 h GLU 226 CO 0.07 0.56 -0.10 1.15 -0.73 0.00 0.00 179.01 179.96 3il9 h THR 227 N 0.87 1.27 -0.11 0.32 2.02 -0.74 -1.64 112.91 114.89 3il9 h THR 227 Ca 0.42 -1.24 -0.02 0.00 0.77 0.00 0.00 66.41 66.34 3il9 h THR 227 Cb 0.36 1.04 -0.00 0.00 -1.74 0.00 0.00 68.15 67.80 3il9 h THR 227 CO -0.24 0.43 0.01 -0.07 0.37 0.00 0.00 175.52 176.02 3il9 h LEU 228 N 0.82 0.19 -0.77 2.58 3.38 -1.18 -3.19 115.31 117.13 3il9 h LEU 228 Ca 0.13 -0.29 -0.10 0.00 0.09 0.00 0.00 57.88 57.71 3il9 h LEU 228 Cb 0.66 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 3il9 h LEU 228 CO 0.05 0.44 -0.10 0.00 0.09 0.00 0.00 178.44 178.91 3il9 h ALA 229 N 0.76 0.96 -0.16 1.53 0.00 -1.28 -1.22 119.26 119.86 3il9 h ALA 229 Ca 0.03 -0.32 0.05 0.00 0.00 0.00 0.00 54.91 54.67 3il9 h ALA 229 Cb 0.33 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3il9 h ALA 229 CO 0.00 0.61 0.12 0.00 0.00 0.00 0.00 179.25 179.99 3il9 h ALA 230 N 1.14 2.12 -0.51 0.00 0.00 -1.32 -0.24 119.26 120.45 3il9 h ALA 230 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3il9 h ALA 230 Cb 0.60 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3il9 h ALA 230 CO 0.04 -0.20 0.00 0.09 0.00 0.00 0.00 179.25 179.18 3il9 n ASN 231 N -4.44 3.77 -3.67 0.00 4.13 -0.85 -4.96 115.26 109.25 3il9 n ASN 231 Ca 0.01 -2.24 -0.27 0.00 1.68 0.00 0.00 54.58 53.76 3il9 n ASN 231 Cb 0.25 -0.42 0.04 0.00 -1.54 0.00 0.00 39.78 38.11 3il9 n ASN 231 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 3il9 n ASN 232 N 0.82 -5.41 -4.34 6.41 5.15 -0.10 -4.97 115.26 112.81 3il9 n ASN 232 Ca 0.20 -0.61 -0.31 0.00 -0.60 0.00 0.00 54.58 53.25 3il9 n ASN 232 Cb 0.65 -4.31 -0.15 0.00 -0.53 0.00 0.00 39.78 35.44 3il9 n ASN 232 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3il9 s LEU 233 N -7.17 2.21 0.39 1.20 1.43 -0.52 -5.02 118.68 111.20 3il9 s LEU 233 Ca 0.58 -0.41 -0.19 0.00 -1.03 0.00 0.00 54.13 53.08 3il9 s LEU 233 Cb -0.28 -1.39 -0.10 0.00 0.03 0.00 0.00 46.19 44.45 3il9 s LEU 233 CO 0.72 0.32 0.88 -0.62 0.23 0.00 0.00 176.35 177.87 3il9 s ASP 234 N -0.59 6.89 0.54 2.29 -1.08 -1.26 -4.33 116.67 119.14 3il9 s ASP 234 Ca 0.09 1.56 0.22 0.00 -0.52 0.00 0.00 52.55 53.90 3il9 s ASP 234 Cb -0.10 -2.49 1.44 0.00 -1.46 0.00 0.00 42.92 40.31 3il9 s ASP 234 CO -0.00 -0.30 2.13 0.08 0.52 0.00 0.00 175.17 177.60 3il9 h ARG 235 N 2.05 0.00 0.00 4.34 0.11 -1.96 0.16 114.38 119.08 3il9 h ARG 235 Ca -0.49 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.59 3il9 h ARG 235 Cb 1.18 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.26 3il9 h ARG 235 CO 0.63 0.00 0.00 -1.13 0.10 0.00 0.00 179.97 179.57 3il9 n SER 236 N -4.29 0.40 0.03 0.08 3.41 -1.26 -2.06 113.62 109.93 3il9 n SER 236 Ca 0.00 0.64 0.12 0.00 -0.26 0.00 0.00 58.87 59.38 3il9 n SER 236 Cb 0.22 -0.71 0.31 0.00 -0.26 0.00 0.00 64.21 63.77 3il9 n SER 236 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3il9 n GLN 237 N -1.99 0.11 -2.29 4.33 1.13 0.04 -4.86 117.38 113.85 3il9 n GLN 237 Ca 0.01 0.04 -0.41 0.00 -1.94 0.00 0.00 57.00 54.70 3il9 n GLN 237 Cb 0.11 -1.58 -0.03 0.00 0.11 0.00 0.00 30.24 28.85 3il9 n GLN 237 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3il9 s LEU 238 N -3.49 4.43 -0.14 1.08 1.43 -0.87 -4.68 118.68 116.43 3il9 s LEU 238 Ca 0.10 2.31 0.10 0.00 -1.03 0.00 0.00 54.13 55.61 3il9 s LEU 238 Cb 0.16 -3.61 -0.23 0.00 0.03 0.00 0.00 46.19 42.54 3il9 s LEU 238 CO 0.66 -0.46 0.29 0.47 0.23 0.00 0.00 176.35 177.54 3il9 n ASP 239 N 2.66 0.93 -3.78 2.29 8.00 -0.29 -4.98 116.55 121.38 3il9 n ASP 239 Ca 0.06 0.16 -0.13 0.00 0.71 0.00 0.00 54.79 55.59 3il9 n ASP 239 Cb 0.44 0.12 -0.13 0.00 -0.02 0.00 0.00 41.12 41.53 3il9 n ASP 239 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 3il9 s TRP 240 N -2.54 -0.24 -0.19 1.24 0.52 -0.98 -4.76 118.94 111.99 3il9 s TRP 240 Ca -0.14 0.58 -0.07 0.00 0.02 0.00 0.00 56.10 56.49 3il9 s TRP 240 Cb 0.07 0.05 -0.04 0.00 -1.15 0.00 0.00 33.47 32.40 3il9 s TRP 240 CO 0.79 -0.14 0.06 -1.17 0.02 0.00 0.00 176.95 176.51 3il9 s LEU 241 N 0.48 3.75 -0.52 2.99 2.96 -0.22 -0.90 118.68 127.22 3il9 s LEU 241 Ca -0.03 0.04 0.04 0.00 -0.22 0.00 0.00 54.13 53.95 3il9 s LEU 241 Cb -0.05 -1.96 0.13 0.00 0.50 0.00 0.00 46.19 44.82 3il9 s LEU 241 CO -0.02 0.14 0.26 -0.69 -1.32 0.00 0.00 176.35 174.72 3il9 s VAL 242 N 0.55 2.56 0.33 1.68 1.01 0.40 -1.18 120.40 125.76 3il9 s VAL 242 Ca 0.03 -3.32 -0.08 0.00 0.00 0.00 0.00 61.98 58.61 3il9 s VAL 242 Cb -0.13 -2.78 -0.06 0.00 0.00 0.00 0.00 36.38 33.41 3il9 s VAL 242 CO 0.01 -0.80 0.66 -2.16 0.00 0.00 0.00 175.10 172.80 3il9 s PRO 243 N -0.29 3.74 0.31 2.72 0.04 -1.26 -2.44 135.00 137.82 3il9 s PRO 243 Ca 0.17 0.27 -0.29 0.00 0.04 0.00 0.00 61.00 61.19 3il9 s PRO 243 Cb -0.26 -2.52 -0.12 0.00 0.04 0.00 0.00 34.50 31.64 3il9 s PRO 243 CO -0.00 0.11 1.52 1.58 0.04 0.00 0.00 177.00 180.25 3il9 n HIS 244 N -0.97 2.76 -3.23 0.56 -0.00 0.54 -4.63 115.22 110.26 3il9 n HIS 244 Ca 0.01 0.35 -0.46 0.00 -0.00 0.00 0.00 57.72 57.62 3il9 n HIS 244 Cb 0.54 -2.55 -0.01 0.00 -0.00 0.00 0.00 29.99 27.97 3il9 n HIS 244 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 3il9 s GLN 245 N -1.05 3.84 -0.23 1.57 -1.52 -1.26 -4.76 119.66 116.24 3il9 s GLN 245 Ca 0.61 -2.60 -0.05 0.00 -1.95 0.00 0.00 55.36 51.37 3il9 s GLN 245 Cb -0.51 -4.61 -0.18 0.00 -0.22 0.00 0.00 33.01 27.48 3il9 s GLN 245 CO 0.54 -1.40 -0.09 0.00 -0.25 0.00 0.00 175.29 174.08 3il9 n ALA 246 N 4.18 1.22 -3.58 6.09 0.00 -1.26 -3.79 120.51 123.37 3il9 n ALA 246 Ca 0.21 -0.95 -0.06 0.00 0.00 0.00 0.00 53.44 52.64 3il9 n ALA 246 Cb 0.45 -0.22 -0.03 0.00 0.00 0.00 0.00 19.45 19.65 3il9 n ALA 246 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3il9 s ASN 247 N -6.86 -0.22 0.33 0.00 2.20 -1.26 -4.77 114.94 104.36 3il9 s ASN 247 Ca -0.33 0.10 0.03 0.00 -0.94 0.00 0.00 52.86 51.72 3il9 s ASN 247 Cb 0.09 0.21 0.58 0.00 -2.00 0.00 0.00 41.25 40.13 3il9 s ASN 247 CO 0.61 -0.30 1.91 0.25 -2.94 0.00 0.00 177.10 176.63 3il9 h LEU 248 N 2.14 0.62 -0.66 3.54 5.85 -1.57 -2.63 115.31 122.59 3il9 h LEU 248 Ca -0.13 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.51 3il9 h LEU 248 Cb 1.18 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 3il9 h LEU 248 CO 0.26 0.59 0.43 0.03 -0.34 0.00 0.00 178.44 179.41 3il9 h ARG 249 N 0.66 0.87 -0.15 1.25 3.08 -1.88 0.63 114.38 118.85 3il9 h ARG 249 Ca 0.16 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.13 3il9 h ARG 249 Cb 0.19 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 3il9 h ARG 249 CO -0.01 0.59 0.02 0.82 -1.07 0.00 0.00 179.97 180.32 3il9 h ILE 250 N 0.89 1.22 -0.39 2.04 2.04 -1.89 -1.25 117.51 120.18 3il9 h ILE 250 Ca 0.24 -0.72 0.03 0.00 1.00 0.00 0.00 64.86 65.41 3il9 h ILE 250 Cb -0.09 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 3il9 h ILE 250 CO -0.05 0.21 0.21 0.40 0.00 0.00 0.00 178.15 178.92 3il9 h ILE 251 N 0.02 1.00 -0.43 -0.67 2.04 -1.31 -1.27 117.51 116.90 3il9 h ILE 251 Ca 0.04 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 3il9 h ILE 251 Cb 0.31 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 3il9 h ILE 251 CO 0.00 0.08 0.13 0.28 0.00 0.00 0.00 178.15 178.64 3il9 h SER 252 N 0.43 0.57 -0.35 1.72 0.02 -0.78 -0.96 113.55 114.20 3il9 h SER 252 Ca 0.16 -0.07 -0.09 0.00 -0.84 0.00 0.00 61.79 60.95 3il9 h SER 252 Cb 0.05 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 3il9 h SER 252 CO -0.10 0.55 -0.13 0.00 -1.14 0.00 0.00 176.83 176.01 3il9 h ALA 253 N 1.54 0.48 -0.50 3.77 0.00 -0.53 -1.59 119.26 122.42 3il9 h ALA 253 Ca 0.15 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 3il9 h ALA 253 Cb 0.19 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3il9 h ALA 253 CO -0.01 0.37 -0.08 1.15 0.00 0.00 0.00 179.25 180.68 3il9 h THR 254 N 0.48 1.26 -0.53 0.00 2.02 -0.88 -1.39 112.91 113.88 3il9 h THR 254 Ca 0.08 -1.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.07 3il9 h THR 254 Cb 0.65 0.96 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 3il9 h THR 254 CO 0.04 0.42 0.31 0.00 0.37 0.00 0.00 175.52 176.66 3il9 h ALA 255 N 1.08 0.67 -0.38 6.16 0.00 -1.08 -2.10 119.26 123.61 3il9 h ALA 255 Ca 0.14 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.00 3il9 h ALA 255 Cb 0.60 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3il9 h ALA 255 CO 0.04 0.17 0.20 -0.22 0.00 0.00 0.00 179.25 179.44 3il9 h LYS 256 N 0.71 0.40 -0.73 0.00 3.64 -1.02 -0.26 116.57 119.30 3il9 h LYS 256 Ca 0.19 -0.02 0.16 0.00 -1.27 0.00 0.00 60.65 59.70 3il9 h LYS 256 Cb 0.01 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 31.69 3il9 h LYS 256 CO -0.03 0.26 0.50 -0.22 -2.27 0.00 0.00 179.45 177.68 3il9 h LYS 257 N 0.41 0.31 -0.02 1.90 1.63 -0.80 0.37 116.57 120.37 3il9 h LYS 257 Ca 0.16 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.94 3il9 h LYS 257 Cb 0.05 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.61 3il9 h LYS 257 CO -0.10 0.21 -0.07 1.28 -3.45 0.00 0.00 179.45 177.32 3il9 n LEU 258 N -4.45 2.12 -1.18 5.20 4.77 -0.71 -4.94 117.00 117.81 3il9 n LEU 258 Ca 0.14 -0.71 -0.13 0.00 -0.03 0.00 0.00 56.01 55.29 3il9 n LEU 258 Cb 0.58 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.62 3il9 n LEU 258 CO 0.34 0.36 -0.14 0.61 -1.33 0.00 0.00 177.39 177.23 3il9 n GLY 259 N 1.29 0.71 3.77 -0.72 0.00 0.12 -4.70 105.19 105.65 3il9 n GLY 259 Ca 0.15 -0.40 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 3il9 n GLY 259 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3il9 s MET 260 N -3.74 4.01 0.54 1.61 1.00 -0.22 -5.01 119.30 117.47 3il9 s MET 260 Ca 0.00 -0.18 -0.21 0.00 0.00 0.00 0.00 55.69 55.29 3il9 s MET 260 Cb 0.00 -3.36 -0.05 0.00 0.00 0.00 0.00 34.83 31.42 3il9 s MET 260 CO 0.00 0.42 1.30 0.45 0.00 0.00 0.00 175.02 177.19 3il9 s SER 261 N 0.01 5.40 0.11 3.03 0.15 -1.26 -4.43 113.70 116.71 3il9 s SER 261 Ca 0.10 2.62 0.11 0.00 0.70 0.00 0.00 55.95 59.48 3il9 s SER 261 Cb -0.11 -2.62 0.54 0.00 -1.71 0.00 0.00 66.02 62.12 3il9 s SER 261 CO -0.00 -1.47 1.35 0.23 1.20 0.00 0.00 173.24 174.55 3il9 n MET 262 N -1.04 0.06 0.28 5.44 0.00 -1.26 -0.60 117.12 120.00 3il9 n MET 262 Ca 0.10 0.47 0.15 0.00 0.00 0.00 0.00 57.70 58.43 3il9 n MET 262 Cb 0.46 -1.66 0.79 0.00 0.00 0.00 0.00 33.22 32.82 3il9 n MET 262 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 175.97 175.53 3il9 h ASP 263 N 0.00 0.00 -0.43 7.83 3.32 -2.01 -2.35 116.42 122.78 3il9 h ASP 263 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3il9 h ASP 263 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 3il9 h ASP 263 CO 0.00 0.08 0.00 0.59 -1.72 0.00 0.00 179.24 178.19 3il9 n ASN 264 N -3.46 4.51 -4.29 6.45 4.13 0.23 -4.93 115.26 117.90 3il9 n ASN 264 Ca -0.02 -2.81 -0.32 0.00 1.68 0.00 0.00 54.58 53.12 3il9 n ASN 264 Cb 0.23 -0.56 -0.16 0.00 -1.54 0.00 0.00 39.78 37.74 3il9 n ASN 264 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3il9 s VAL 265 N -2.49 2.17 -0.34 2.41 1.01 -0.89 -1.06 120.40 121.22 3il9 s VAL 265 Ca 0.46 -1.02 -0.23 0.00 0.00 0.00 0.00 61.98 61.19 3il9 s VAL 265 Cb 0.34 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.93 3il9 s VAL 265 CO 0.14 0.57 0.75 -0.69 0.00 0.00 0.00 175.10 175.87 3il9 s VAL 266 N -0.19 4.79 -0.18 2.92 1.01 -0.33 -4.96 120.40 123.46 3il9 s VAL 266 Ca -0.03 0.91 -0.00 0.00 0.00 0.00 0.00 61.98 62.86 3il9 s VAL 266 Cb -0.14 -4.16 0.01 0.00 0.00 0.00 0.00 36.38 32.10 3il9 s VAL 266 CO 0.03 -0.35 -0.16 -0.69 0.00 0.00 0.00 175.10 173.94 3il9 s VAL 267 N 2.97 2.42 0.00 2.92 1.01 -1.26 -4.48 120.40 123.97 3il9 s VAL 267 Ca 0.30 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 61.46 3il9 s VAL 267 Cb -0.14 -2.04 0.00 0.00 0.00 0.00 0.00 36.38 34.21 3il9 s VAL 267 CO 0.15 0.51 0.17 0.35 0.00 0.00 0.00 175.10 176.28 3il9 n THR 268 N 4.58 0.00 -0.35 3.92 -2.24 -1.26 -4.82 114.28 114.11 3il9 n THR 268 Ca -0.20 -0.46 0.15 0.00 -2.27 0.00 0.00 64.05 61.26 3il9 n THR 268 Cb 0.50 1.03 0.35 0.00 -2.10 0.00 0.00 70.33 70.11 3il9 n THR 268 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3il9 h LEU 269 N 0.00 0.74 -1.81 3.22 5.85 -1.91 0.64 115.31 122.04 3il9 h LEU 269 Ca 0.00 0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 3il9 h LEU 269 Cb 0.01 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.01 3il9 h LEU 269 CO 0.00 0.23 -0.15 -2.24 -0.34 0.00 0.00 178.44 175.94 3il9 h ASP 270 N 0.70 0.00 0.00 1.25 2.03 -1.88 -0.64 116.42 117.88 3il9 h ASP 270 Ca 0.59 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.78 3il9 h ASP 270 Cb 1.01 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.48 3il9 h ASP 270 CO -0.39 0.15 -1.94 0.54 -1.03 0.00 0.00 179.24 176.57 3il9 n ARG 271 N -3.77 0.82 -0.01 4.15 1.74 0.03 -0.83 116.66 118.79 3il9 n ARG 271 Ca -0.02 -0.11 0.02 0.00 -0.77 0.00 0.00 57.85 56.98 3il9 n ARG 271 Cb 0.26 -1.43 -0.07 0.00 -1.02 0.00 0.00 32.46 30.20 3il9 n ARG 271 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3il9 n HIS 272 N -2.31 0.00 -4.81 -1.55 8.25 -0.11 -3.99 115.22 110.70 3il9 n HIS 272 Ca -0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.34 3il9 n HIS 272 Cb 0.68 -0.27 0.00 0.00 1.12 0.00 0.00 29.99 31.52 3il9 n HIS 272 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3il9 n GLY 273 N 2.12 0.18 3.54 -1.41 0.00 -0.26 -4.24 105.19 105.11 3il9 n GLY 273 Ca -0.05 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 3il9 n GLY 273 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3il9 s ASN 274 N -4.00 6.39 -0.26 1.61 3.84 -0.24 -4.71 114.94 117.56 3il9 s ASN 274 Ca 0.00 -0.15 0.12 0.00 0.21 0.00 0.00 52.86 53.04 3il9 s ASN 274 Cb 0.00 -2.36 0.62 0.00 -0.55 0.00 0.00 41.25 38.96 3il9 s ASN 274 CO 0.00 -0.83 1.59 0.35 -2.79 0.00 0.00 177.10 175.42 3il9 n THR 275 N 5.97 2.62 0.00 -5.21 -2.24 -1.26 -0.70 114.28 113.45 3il9 n THR 275 Ca 0.01 -1.97 0.00 0.00 -2.27 0.00 0.00 64.05 59.82 3il9 n THR 275 Cb 0.48 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 3il9 n THR 275 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3il9 n SER 276 N -0.49 0.00 0.30 3.42 2.88 -1.26 -1.75 113.62 116.72 3il9 n SER 276 Ca 0.32 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 58.04 3il9 n SER 276 Cb 1.13 0.00 0.92 0.00 -0.75 0.00 0.00 64.21 65.51 3il9 n SER 276 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3il9 h ALA 277 N -0.83 1.10 0.00 -1.46 0.00 -1.87 -0.70 119.26 115.50 3il9 h ALA 277 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3il9 h ALA 277 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3il9 h ALA 277 CO 0.00 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.29 3il9 h ALA 278 N 1.97 1.00 0.50 0.00 0.00 -1.41 -3.38 119.26 117.93 3il9 h ALA 278 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3il9 h ALA 278 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3il9 h ALA 278 CO 0.00 0.00 -0.24 1.03 0.00 0.00 0.00 179.25 180.04 3il9 h SER 279 N 0.00 -0.57 0.12 0.00 0.87 -1.22 -1.45 113.55 111.30 3il9 h SER 279 Ca 0.00 -0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 3il9 h SER 279 Cb 0.66 0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 3il9 h SER 279 CO 0.00 -0.25 -0.06 0.58 -0.53 0.00 0.00 176.83 176.57 3il9 h VAL 280 N -0.89 0.92 -0.20 2.23 2.07 -1.77 -1.69 116.25 116.92 3il9 h VAL 280 Ca -0.07 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 3il9 h VAL 280 Cb 0.60 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 3il9 h VAL 280 CO 0.11 0.04 0.00 1.55 0.02 0.00 0.00 177.57 179.29 3il9 h PRO 281 N -0.22 0.29 -0.37 1.57 0.13 -1.77 0.23 132.00 131.85 3il9 h PRO 281 Ca -0.02 -0.04 -0.10 0.00 -0.87 0.00 0.00 66.00 64.97 3il9 h PRO 281 Cb 0.18 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.25 3il9 h PRO 281 CO 0.03 0.32 -0.14 0.00 -0.23 0.00 0.00 178.00 177.97 3il9 h ALA 283 N 0.81 0.55 -0.18 0.00 0.00 -0.69 -1.64 119.26 118.11 3il9 h ALA 283 Ca 0.09 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.78 3il9 h ALA 283 Cb 0.68 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 3il9 h ALA 283 CO 0.05 0.31 -0.02 1.25 0.00 0.00 0.00 179.25 180.84 3il9 h LEU 284 N 0.55 -0.11 -0.77 0.00 5.85 -0.55 -2.36 115.31 117.92 3il9 h LEU 284 Ca 0.12 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3il9 h LEU 284 Cb 0.44 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 3il9 h LEU 284 CO 0.02 -0.03 0.48 -0.78 -0.34 0.00 0.00 178.44 177.79 3il9 h ASP 285 N 0.03 0.90 -0.57 1.25 3.58 -0.96 -0.78 116.42 119.88 3il9 h ASP 285 Ca 0.09 -0.05 0.02 0.00 0.42 0.00 0.00 57.03 57.51 3il9 h ASP 285 Cb 0.12 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 40.91 3il9 h ASP 285 CO -0.16 0.68 0.36 -0.08 -2.88 0.00 0.00 179.24 177.16 3il9 h GLU 286 N 1.04 0.70 0.00 0.28 4.81 -1.03 -0.19 114.58 120.20 3il9 h GLU 286 Ca 0.28 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.35 3il9 h GLU 286 Cb -0.07 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.13 3il9 h GLU 286 CO -0.06 0.47 -0.57 0.00 -0.73 0.00 0.00 179.01 178.12 3il9 h ALA 287 N 1.23 0.72 -0.11 2.92 0.00 -0.90 -2.10 119.26 121.01 3il9 h ALA 287 Ca 0.22 -0.51 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 3il9 h ALA 287 Cb -0.03 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3il9 h ALA 287 CO -0.07 0.71 -0.11 0.28 0.00 0.00 0.00 179.25 180.06 3il9 h VAL 288 N 0.00 1.35 0.00 0.00 2.07 -0.98 -1.13 116.25 117.56 3il9 h VAL 288 Ca -0.01 -1.26 -0.07 0.00 0.82 0.00 0.00 66.70 66.19 3il9 h VAL 288 Cb 1.31 1.94 -0.01 0.00 -1.52 0.00 0.00 31.29 33.01 3il9 h VAL 288 CO 0.07 0.36 -0.33 0.03 0.02 0.00 0.00 177.57 177.72 3il9 h ARG 289 N -0.13 0.00 -0.03 1.57 3.08 -0.84 -2.87 114.38 115.16 3il9 h ARG 289 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 3il9 h ARG 289 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.67 3il9 h ARG 289 CO 0.03 0.33 0.00 -0.40 -1.07 0.00 0.00 179.97 178.86 3il9 n ASP 290 N -3.52 2.43 0.00 7.04 3.85 -0.81 -4.96 116.55 120.58 3il9 n ASP 290 Ca -0.00 -1.81 0.00 0.00 -0.71 0.00 0.00 54.79 52.27 3il9 n ASP 290 Cb 0.48 -0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.25 3il9 n ASP 290 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3il9 n GLY 291 N 1.28 0.55 0.13 6.12 0.00 -1.09 -4.96 105.19 107.22 3il9 n GLY 291 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 3il9 n GLY 291 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3il9 h ARG 292 N 4.70 0.33 -6.01 1.61 3.08 -1.61 -3.39 114.38 113.09 3il9 h ARG 292 Ca 0.00 -0.05 -0.60 0.00 0.07 0.00 0.00 59.98 59.40 3il9 h ARG 292 Cb 0.00 -0.06 -0.11 0.00 0.08 0.00 0.00 29.97 29.89 3il9 h ARG 292 CO 0.00 0.34 0.52 0.42 -1.07 0.00 0.00 179.97 180.18 3il9 s ILE 293 N -5.70 4.58 0.21 2.04 1.01 -0.50 -5.02 121.20 117.82 3il9 s ILE 293 Ca -0.13 0.88 0.08 0.00 0.00 0.00 0.00 60.65 61.47 3il9 s ILE 293 Cb 0.08 -4.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 3il9 s ILE 293 CO 0.71 -0.64 0.04 -0.54 0.00 0.00 0.00 174.94 174.50 3il9 s LYS 294 N 3.47 2.49 0.29 2.79 1.02 -1.26 -4.78 119.74 123.76 3il9 s LYS 294 Ca 0.35 -1.15 -0.28 0.00 0.02 0.00 0.00 55.97 54.90 3il9 s LYS 294 Cb -0.12 -2.36 -0.14 0.00 -0.52 0.00 0.00 37.83 34.69 3il9 s LYS 294 CO 0.21 0.43 1.10 -2.30 -0.92 0.00 0.00 175.35 173.87 3il9 n PRO 295 N -0.47 1.53 0.00 -1.68 -0.02 -1.26 -1.79 135.00 131.32 3il9 n PRO 295 Ca -0.09 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 3il9 n PRO 295 Cb 0.56 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 3il9 n PRO 295 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3il9 n GLY 296 N 1.23 1.91 3.84 -1.23 0.00 0.32 -5.00 105.19 106.26 3il9 n GLY 296 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 3il9 n GLY 296 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3il9 s GLN 297 N -0.43 4.06 -0.25 1.61 -0.21 -0.74 -4.74 119.66 118.96 3il9 s GLN 297 Ca 0.00 0.83 -0.11 0.00 0.02 0.00 0.00 55.36 56.10 3il9 s GLN 297 Cb 0.00 -2.32 -0.05 0.00 1.00 0.00 0.00 33.01 31.64 3il9 s GLN 297 CO 0.00 0.04 0.19 -1.17 -2.12 0.00 0.00 175.29 172.23 3il9 s LEU 298 N -3.21 4.08 -0.08 2.90 2.96 -1.26 -1.30 118.68 122.78 3il9 s LEU 298 Ca 0.57 0.09 0.04 0.00 -0.22 0.00 0.00 54.13 54.61 3il9 s LEU 298 Cb -0.10 -2.13 0.00 0.00 0.50 0.00 0.00 46.19 44.46 3il9 s LEU 298 CO 0.18 0.01 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.33 3il9 s VAL 299 N 1.33 1.75 -0.28 1.68 1.01 0.60 -1.14 120.40 125.35 3il9 s VAL 299 Ca 0.08 -0.86 -0.05 0.00 0.00 0.00 0.00 61.98 61.15 3il9 s VAL 299 Cb -0.14 -1.51 0.01 0.00 0.00 0.00 0.00 36.38 34.74 3il9 s VAL 299 CO 0.07 0.49 0.04 -0.22 0.00 0.00 0.00 175.10 175.49 3il9 s LEU 300 N 0.27 3.69 0.02 3.92 0.20 -0.08 -0.55 118.68 126.16 3il9 s LEU 300 Ca -0.13 -0.76 -0.15 0.00 0.69 0.00 0.00 54.13 53.77 3il9 s LEU 300 Cb -0.16 -1.82 -0.06 0.00 -0.43 0.00 0.00 46.19 43.72 3il9 s LEU 300 CO 0.06 -0.18 0.44 -0.76 -0.29 0.00 0.00 176.35 175.62 3il9 s LEU 301 N 1.45 4.48 0.08 -0.68 1.43 0.03 -0.45 118.68 125.02 3il9 s LEU 301 Ca 0.02 1.02 -0.15 0.00 -1.03 0.00 0.00 54.13 53.99 3il9 s LEU 301 Cb -0.17 -2.68 0.03 0.00 0.03 0.00 0.00 46.19 43.40 3il9 s LEU 301 CO 0.01 0.30 0.35 -1.83 0.23 0.00 0.00 176.35 175.42 3il9 s GLU 302 N -1.14 0.94 -0.03 1.70 4.04 -1.02 -1.52 118.70 121.66 3il9 s GLU 302 Ca 0.25 -0.60 -0.30 0.00 0.04 0.00 0.00 54.97 54.36 3il9 s GLU 302 Cb -0.17 0.41 0.07 0.00 0.02 0.00 0.00 34.13 34.46 3il9 s GLU 302 CO 0.15 -0.33 0.68 0.00 -1.84 0.00 0.00 175.26 173.92 3il9 s ALA 303 N -3.15 -1.76 0.00 -0.84 0.00 -0.29 -0.34 121.76 115.39 3il9 s ALA 303 Ca -0.01 1.25 0.03 0.00 0.00 0.00 0.00 51.96 53.23 3il9 s ALA 303 Cb 0.01 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.18 3il9 s ALA 303 CO -0.07 -0.41 -0.08 0.12 0.00 0.00 0.00 175.76 175.32 3il9 s PHE 304 N -1.44 0.75 0.32 0.00 5.36 -1.26 -0.81 117.98 120.90 3il9 s PHE 304 Ca -0.09 -0.20 -0.10 0.00 -0.96 0.00 0.00 56.93 55.57 3il9 s PHE 304 Cb -0.00 -0.47 0.04 0.00 -0.34 0.00 0.00 43.02 42.25 3il9 s PHE 304 CO 0.07 -0.01 0.61 0.41 -1.46 0.00 0.00 175.22 174.84 3il9 n GLY 305 N 2.61 1.34 3.63 13.12 0.00 0.11 -4.28 105.19 121.71 3il9 n GLY 305 Ca -0.15 -1.27 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 3il9 n GLY 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3il9 n GLY 306 N -0.45 -0.06 0.00 -0.02 0.00 -1.26 -1.07 105.19 102.33 3il9 n GLY 306 Ca -0.06 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3il9 n GLY 306 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3il9 n GLY 307 N 1.11 0.71 3.80 -0.02 0.00 -1.26 -3.48 105.19 106.06 3il9 n GLY 307 Ca 0.09 -0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 3il9 n GLY 307 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3il9 s PHE 308 N 0.00 3.01 0.05 1.61 0.08 -0.55 -3.27 117.98 118.90 3il9 s PHE 308 Ca 0.00 1.53 0.03 0.00 0.12 0.00 0.00 56.93 58.60 3il9 s PHE 308 Cb 0.00 -3.02 -0.03 0.00 -0.57 0.00 0.00 43.02 39.41 3il9 s PHE 308 CO 0.00 -1.00 -0.09 0.95 -0.10 0.00 0.00 175.22 174.98 3il9 s THR 309 N -2.32 0.67 0.10 0.64 -4.23 -0.23 -1.10 115.64 109.17 3il9 s THR 309 Ca 0.65 -1.19 -0.14 0.00 -1.18 0.00 0.00 61.69 59.82 3il9 s THR 309 Cb -0.16 -0.78 0.03 0.00 1.34 0.00 0.00 72.50 72.92 3il9 s THR 309 CO 0.32 -0.39 0.34 -1.66 -0.54 0.00 0.00 174.62 172.69 3il9 s TRP 310 N -1.54 -0.12 0.21 3.99 -2.14 -0.22 0.07 118.94 119.19 3il9 s TRP 310 Ca -0.07 -0.17 -0.23 0.00 2.66 0.00 0.00 56.10 58.29 3il9 s TRP 310 Cb -0.09 0.17 0.05 0.00 -3.10 0.00 0.00 33.47 30.49 3il9 s TRP 310 CO 0.00 -0.63 0.75 0.20 -2.66 0.00 0.00 176.95 174.61 3il9 s GLY 311 N -2.65 -0.27 0.16 3.67 0.00 0.01 -0.68 107.32 107.56 3il9 s GLY 311 Ca 0.02 0.05 -0.15 0.00 0.00 0.00 0.00 44.72 44.63 3il9 s GLY 311 CO -0.10 0.01 0.42 -1.35 0.00 0.00 0.00 173.10 172.08 3il9 s SER 312 N -2.85 -0.18 -0.10 1.64 1.04 -0.19 -1.13 113.70 111.92 3il9 s SER 312 Ca 0.08 -0.49 -0.07 0.00 0.48 0.00 0.00 55.95 55.95 3il9 s SER 312 Cb -0.04 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.62 3il9 s SER 312 CO 0.00 -0.93 0.24 0.00 0.98 0.00 0.00 173.24 173.54 3il9 s ALA 313 N -3.86 -0.59 -0.22 5.32 0.00 -0.58 -1.58 121.76 120.25 3il9 s ALA 313 Ca 0.08 0.80 -0.07 0.00 0.00 0.00 0.00 51.96 52.76 3il9 s ALA 313 Cb 0.01 -0.48 -0.03 0.00 0.00 0.00 0.00 23.12 22.61 3il9 s ALA 313 CO -0.06 -0.14 0.07 -1.17 0.00 0.00 0.00 175.76 174.45 3il9 s LEU 314 N 0.53 3.56 -0.06 0.00 2.96 -0.51 -0.79 118.68 124.38 3il9 s LEU 314 Ca -0.03 -0.11 0.02 0.00 -0.22 0.00 0.00 54.13 53.79 3il9 s LEU 314 Cb -0.05 -1.93 0.01 0.00 0.50 0.00 0.00 46.19 44.72 3il9 s LEU 314 CO -0.03 0.04 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.24 3il9 s VAL 315 N 1.16 1.03 -0.34 1.68 1.01 0.28 -0.03 120.40 125.19 3il9 s VAL 315 Ca 0.04 -0.42 -0.14 0.00 0.00 0.00 0.00 61.98 61.47 3il9 s VAL 315 Cb -0.14 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.27 3il9 s VAL 315 CO 0.03 0.33 0.31 -0.60 0.00 0.00 0.00 175.10 175.18 3il9 s ARG 316 N 0.70 3.58 0.00 2.72 3.52 0.24 -0.29 118.95 129.42 3il9 s ARG 316 Ca -0.14 -0.47 0.28 0.00 -0.13 0.00 0.00 55.73 55.27 3il9 s ARG 316 Cb -0.16 -3.79 1.10 0.00 -1.56 0.00 0.00 34.95 30.54 3il9 s ARG 316 CO 0.03 -0.47 1.77 1.19 -0.81 0.00 0.00 175.30 177.01