#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q9c n PRO 7 N 0.00 1.28 -1.72 3.23 -0.02 -1.26 -4.90 135.00 131.61 1q9c n PRO 7 Ca 0.00 0.46 -0.39 0.00 -2.02 0.00 0.00 63.50 61.55 1q9c n PRO 7 Cb 0.00 -2.06 0.03 0.00 -0.02 0.00 0.00 33.50 31.46 1q9c n PRO 7 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1q9c n TYR 8 N -0.70 2.10 -3.76 6.00 9.36 -1.26 -4.98 117.16 123.93 1q9c n TYR 8 Ca 0.10 0.45 -0.36 0.00 3.32 0.00 0.00 57.90 61.40 1q9c n TYR 8 Cb 0.41 -2.35 -0.11 0.00 -0.63 0.00 0.00 39.34 36.66 1q9c n TYR 8 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 1q9c s GLU 9 N -2.67 2.09 0.14 2.98 2.56 -1.26 -4.98 118.70 117.56 1q9c s GLU 9 Ca 0.69 -1.89 -0.15 0.00 0.00 0.00 0.00 54.97 53.61 1q9c s GLU 9 Cb -0.44 -3.62 0.01 0.00 2.00 0.00 0.00 34.13 32.08 1q9c s GLU 9 CO 0.52 -1.09 1.73 0.74 -0.56 0.00 0.00 175.26 176.59 1q9c h PHE 10 N 7.97 0.62 -2.30 5.30 -1.00 -1.94 -3.32 116.94 122.28 1q9c h PHE 10 Ca -0.12 -0.03 -0.69 0.00 2.81 0.00 0.00 57.97 59.93 1q9c h PHE 10 Cb 1.04 -0.19 -0.35 0.00 3.61 0.00 0.00 35.95 40.06 1q9c h PHE 10 CO 0.57 0.50 0.15 1.19 -1.61 0.00 0.00 178.31 179.11 1q9c n PHE 11 N -4.67 3.41 -4.09 -0.55 3.01 -1.26 -3.00 117.46 110.31 1q9c n PHE 11 Ca 0.01 -3.32 -0.24 0.00 1.01 0.00 0.00 57.45 54.90 1q9c n PHE 11 Cb 0.11 -0.83 -0.05 0.00 -0.01 0.00 0.00 39.48 38.70 1q9c n PHE 11 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1q9c s SER 12 N -2.44 5.60 0.63 4.37 1.04 -1.25 -4.74 113.70 116.92 1q9c s SER 12 Ca 0.43 -0.16 0.23 0.00 0.48 0.00 0.00 55.95 56.93 1q9c s SER 12 Cb 0.22 -1.47 1.09 0.00 0.10 0.00 0.00 66.02 65.97 1q9c s SER 12 CO -0.12 0.01 1.59 -0.33 0.98 0.00 0.00 173.24 175.37 1q9c h GLU 13 N 1.89 0.00 0.02 4.02 5.08 -1.95 0.60 114.58 124.24 1q9c h GLU 13 Ca -0.48 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.49 1q9c h GLU 13 Cb 1.22 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.41 1q9c h GLU 13 CO 0.62 0.00 -2.37 -1.91 -1.00 0.00 0.00 179.01 174.35 1q9c n GLU 14 N -3.11 0.66 0.03 2.33 2.13 -1.26 -4.63 120.64 116.79 1q9c n GLU 14 Ca 0.06 0.19 0.11 0.00 0.66 0.00 0.00 57.16 58.19 1q9c n GLU 14 Cb 0.83 -1.56 -0.09 0.00 0.27 0.00 0.00 31.44 30.89 1q9c n GLU 14 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1q9c n ASN 15 N -3.44 0.37 -0.22 4.31 3.02 -0.68 -4.43 115.26 114.19 1q9c n ASN 15 Ca -0.44 0.02 0.03 0.00 -0.03 0.00 0.00 54.58 54.16 1q9c n ASN 15 Cb 0.98 1.36 0.13 0.00 -0.61 0.00 0.00 39.78 41.63 1q9c n ASN 15 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1q9c h ALA 16 N 2.11 0.70 0.00 5.41 0.00 0.26 0.37 119.26 128.12 1q9c h ALA 16 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1q9c h ALA 16 Cb 0.94 0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1q9c h ALA 16 CO 0.00 -0.39 0.02 -2.30 0.00 0.00 0.00 179.25 176.59 1q9c n PRO 17 N -5.27 0.00 -0.04 0.00 -0.02 -1.26 -0.76 135.00 127.64 1q9c n PRO 17 Ca 0.11 0.45 -0.01 0.00 -2.02 0.00 0.00 63.50 62.03 1q9c n PRO 17 Cb 0.40 -1.52 -0.15 0.00 -0.02 0.00 0.00 33.50 32.20 1q9c n PRO 17 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1q9c n LYS 18 N -1.45 0.67 -0.04 -0.52 4.76 0.13 -4.66 118.16 117.05 1q9c n LYS 18 Ca 0.00 -0.03 -0.04 0.00 -2.87 0.00 0.00 58.31 55.37 1q9c n LYS 18 Cb 0.02 -1.58 -0.06 0.00 -1.84 0.00 0.00 35.03 31.57 1q9c n LYS 18 CO 0.00 0.00 0.00 0.91 -1.37 0.00 0.00 177.40 176.94 1q9c n TRP 19 N -2.61 0.00 -1.59 2.13 7.02 -0.61 -4.78 117.44 117.00 1q9c n TRP 19 Ca -0.18 0.00 -0.52 0.00 -1.02 0.00 0.00 57.50 55.78 1q9c n TRP 19 Cb 0.89 -0.40 -0.06 0.00 -2.42 0.00 0.00 31.31 29.32 1q9c n TRP 19 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 1q9c n ARG 20 N -2.30 1.42 -1.60 -0.99 1.74 0.06 -0.57 116.66 114.41 1q9c n ARG 20 Ca -0.13 0.47 -0.15 0.00 -0.77 0.00 0.00 57.85 57.27 1q9c n ARG 20 Cb 0.76 -2.43 -0.06 0.00 -1.02 0.00 0.00 32.46 29.72 1q9c n ARG 20 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1q9c n GLY 21 N 5.29 1.23 0.12 -0.13 0.00 -1.26 -4.88 105.19 105.56 1q9c n GLY 21 Ca 0.32 -0.28 -0.01 0.00 0.00 0.00 0.00 46.02 46.05 1q9c n GLY 21 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1q9c h LEU 22 N 0.00 0.00 0.00 0.99 5.85 -1.14 -3.33 115.31 117.68 1q9c h LEU 22 Ca -0.33 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 1q9c h LEU 22 Cb 1.06 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.08 1q9c h LEU 22 CO 0.46 0.67 -1.65 0.18 -0.34 0.00 0.00 178.44 177.76 1q9c n LEU 23 N -3.45 0.00 -0.23 2.25 4.77 -1.26 -4.64 117.00 114.45 1q9c n LEU 23 Ca 0.00 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.99 1q9c n LEU 23 Cb 0.73 0.01 0.09 0.00 -2.33 0.00 0.00 43.42 41.92 1q9c n LEU 23 CO 0.42 0.01 0.76 0.58 -1.33 0.00 0.00 177.39 177.83 1q9c h VAL 24 N 0.00 0.36 -0.84 4.08 2.07 -1.89 0.24 116.25 120.27 1q9c h VAL 24 Ca -0.02 -0.01 0.13 0.00 0.82 0.00 0.00 66.70 67.63 1q9c h VAL 24 Cb 0.69 0.33 -0.06 0.00 -1.52 0.00 0.00 31.29 30.73 1q9c h VAL 24 CO 0.00 0.00 0.55 -0.65 0.02 0.00 0.00 177.57 177.49 1q9c h PRO 25 N 0.03 0.63 0.02 1.57 0.11 -1.82 -1.82 132.00 130.71 1q9c h PRO 25 Ca 0.33 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.40 1q9c h PRO 25 Cb 0.52 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.49 1q9c h PRO 25 CO -0.66 0.41 -0.01 0.00 -0.21 0.00 0.00 178.00 177.54 1q9c h ALA 26 N 1.61 -0.03 -1.06 -0.75 0.00 -1.10 -3.26 119.26 114.66 1q9c h ALA 26 Ca 0.41 -0.37 0.28 0.00 0.00 0.00 0.00 54.91 55.24 1q9c h ALA 26 Cb 0.68 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.40 1q9c h ALA 26 CO -0.17 -0.07 0.70 -0.07 0.00 0.00 0.00 179.25 179.64 1q9c h LEU 27 N -0.91 0.35 -0.45 0.00 3.38 -0.36 0.45 115.31 117.76 1q9c h LEU 27 Ca -0.00 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1q9c h LEU 27 Cb 0.75 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1q9c h LEU 27 CO 0.00 0.06 0.18 0.50 0.09 0.00 0.00 178.44 179.28 1q9c h LYS 28 N 0.31 0.68 -0.72 1.13 3.64 -1.42 -0.10 116.57 120.08 1q9c h LYS 28 Ca 0.59 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.81 1q9c h LYS 28 Cb 1.66 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 33.34 1q9c h LYS 28 CO -0.24 0.62 0.32 -0.22 -2.27 0.00 0.00 179.45 177.65 1q9c h LYS 29 N 0.59 1.04 0.59 1.90 3.64 -0.21 -2.13 116.57 121.99 1q9c h LYS 29 Ca 0.15 -0.16 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1q9c h LYS 29 Cb 0.19 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1q9c h LYS 29 CO -0.01 0.82 -0.28 0.28 -2.27 0.00 0.00 179.45 177.99 1q9c h VAL 30 N 1.03 0.31 -0.84 2.00 2.07 -0.63 -1.92 116.25 118.27 1q9c h VAL 30 Ca 0.25 -0.29 0.23 0.00 0.82 0.00 0.00 66.70 67.70 1q9c h VAL 30 Cb 0.15 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.27 1q9c h VAL 30 CO -0.03 0.03 0.59 -0.61 0.02 0.00 0.00 177.57 177.58 1q9c h GLN 31 N -1.01 0.09 -0.44 1.57 4.15 -0.96 0.33 115.11 118.84 1q9c h GLN 31 Ca -0.08 -0.01 -0.14 0.00 0.77 0.00 0.00 58.65 59.19 1q9c h GLN 31 Cb 0.66 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.32 1q9c h GLN 31 CO 0.13 0.06 -0.27 0.78 -1.93 0.00 0.00 178.83 177.60 1q9c h GLY 32 N 0.10 1.05 1.77 2.39 0.00 -1.06 0.36 103.07 107.69 1q9c h GLY 32 Ca 0.41 -0.99 -0.12 0.00 0.00 0.00 0.00 47.33 46.64 1q9c h GLY 32 CO -0.05 0.89 -0.45 1.46 0.00 0.00 0.00 176.54 178.40 1q9c h GLN 33 N 0.81 0.25 0.00 4.80 4.20 0.39 -2.93 115.11 122.64 1q9c h GLN 33 Ca 0.09 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 1q9c h GLN 33 Cb 0.86 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.64 1q9c h GLN 33 CO 0.08 0.66 -0.14 0.28 -0.67 0.00 0.00 178.83 179.04 1q9c h VAL 34 N 0.21 0.89 -3.04 -0.54 2.07 -0.98 -3.43 116.25 111.42 1q9c h VAL 34 Ca 0.01 -1.71 -0.62 0.00 0.82 0.00 0.00 66.70 65.21 1q9c h VAL 34 Cb 0.88 1.71 -0.40 0.00 -1.52 0.00 0.00 31.29 31.96 1q9c h VAL 34 CO 0.07 0.30 -0.70 -1.00 0.02 0.00 0.00 177.57 176.26 1q9c s HIS 35 N -1.97 2.53 0.51 1.57 3.76 0.13 -4.97 115.29 116.85 1q9c s HIS 35 Ca -0.12 -2.80 0.26 0.00 -0.15 0.00 0.00 55.06 52.26 1q9c s HIS 35 Cb -0.01 -2.19 1.58 0.00 1.11 0.00 0.00 32.58 33.07 1q9c s HIS 35 CO 0.37 -0.72 2.16 -1.35 -0.85 0.00 0.00 174.74 174.35 1q9c h PRO 36 N 6.27 0.00 0.00 8.40 0.11 -1.68 -2.82 132.00 142.28 1q9c h PRO 36 Ca 0.04 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.06 1q9c h PRO 36 Cb 0.88 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 1q9c h PRO 36 CO 0.57 0.06 -0.69 1.15 -0.21 0.00 0.00 178.00 178.88 1q9c h THR 37 N 0.00 0.49 -3.33 -1.15 2.02 -1.92 -3.46 112.91 105.55 1q9c h THR 37 Ca -0.00 -1.76 -0.56 0.00 0.77 0.00 0.00 66.41 64.87 1q9c h THR 37 Cb 0.14 2.12 -0.04 0.00 -1.74 0.00 0.00 68.15 68.63 1q9c h THR 37 CO 0.01 0.28 -0.03 -0.76 0.37 0.00 0.00 175.52 175.39 1q9c s LEU 38 N -6.09 4.43 0.16 2.58 1.43 -1.06 -4.91 118.68 115.21 1q9c s LEU 38 Ca 0.02 1.23 -0.11 0.00 -1.03 0.00 0.00 54.13 54.24 1q9c s LEU 38 Cb 0.08 -3.16 -0.07 0.00 0.03 0.00 0.00 46.19 43.07 1q9c s LEU 38 CO 0.75 0.17 0.49 -1.61 0.23 0.00 0.00 176.35 176.39 1q9c s GLU 39 N -1.57 3.83 -0.01 1.70 2.02 -0.56 -4.91 118.70 119.20 1q9c s GLU 39 Ca 0.35 0.29 -0.17 0.00 0.02 0.00 0.00 54.97 55.45 1q9c s GLU 39 Cb -0.17 -2.85 -0.06 0.00 0.10 0.00 0.00 34.13 31.15 1q9c s GLU 39 CO 0.20 0.45 0.47 -1.54 0.02 0.00 0.00 175.26 174.86 1q9c s SER 40 N -2.00 6.86 -0.32 -0.19 1.04 -1.26 -2.77 113.70 115.05 1q9c s SER 40 Ca 0.40 1.02 -0.05 0.00 0.48 0.00 0.00 55.95 57.80 1q9c s SER 40 Cb -0.13 -2.29 0.04 0.00 0.10 0.00 0.00 66.02 63.74 1q9c s SER 40 CO 0.20 0.23 0.07 0.20 0.98 0.00 0.00 173.24 174.92 1q9c s ASN 41 N -0.65 5.17 0.31 7.02 -0.87 -1.26 -4.98 114.94 119.69 1q9c s ASN 41 Ca 0.26 -1.16 0.08 0.00 -1.57 0.00 0.00 52.86 50.47 1q9c s ASN 41 Cb -0.17 -1.82 0.87 0.00 -0.02 0.00 0.00 41.25 40.11 1q9c s ASN 41 CO 0.14 -0.30 1.70 0.44 -2.57 0.00 0.00 177.10 176.51 1q9c h ASP 42 N 8.15 0.47 -0.78 -1.22 3.32 -1.97 0.57 116.42 124.96 1q9c h ASP 42 Ca -0.23 0.16 0.12 0.00 0.02 0.00 0.00 57.03 57.10 1q9c h ASP 42 Cb 1.08 0.11 -0.08 0.00 0.22 0.00 0.00 39.33 40.65 1q9c h ASP 42 CO 0.58 -0.01 0.38 -0.78 -1.72 0.00 0.00 179.24 177.70 1q9c h ASP 43 N 0.43 0.47 0.05 6.45 3.58 -1.96 0.30 116.42 125.74 1q9c h ASP 43 Ca 0.63 0.08 -0.16 0.00 0.42 0.00 0.00 57.03 58.00 1q9c h ASP 43 Cb 1.26 0.01 0.02 0.00 1.72 0.00 0.00 39.33 42.34 1q9c h ASP 43 CO -0.54 0.23 -0.65 0.00 -2.88 0.00 0.00 179.24 175.40 1q9c h ALA 44 N 1.50 0.01 -0.90 -0.78 0.00 -0.37 -3.08 119.26 115.63 1q9c h ALA 44 Ca 0.41 -0.61 0.11 0.00 0.00 0.00 0.00 54.91 54.82 1q9c h ALA 44 Cb 0.52 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.29 1q9c h ALA 44 CO -0.33 0.34 0.53 -0.07 0.00 0.00 0.00 179.25 179.72 1q9c h LEU 45 N -0.25 0.76 -1.27 0.00 3.38 0.15 0.18 115.31 118.25 1q9c h LEU 45 Ca -0.10 0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1q9c h LEU 45 Cb 1.42 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 1q9c h LEU 45 CO 0.13 0.41 -0.10 1.56 0.09 0.00 0.00 178.44 180.53 1q9c h GLN 46 N 0.85 0.38 -0.39 1.13 4.20 -0.50 -1.23 115.11 119.56 1q9c h GLN 46 Ca 0.45 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 59.04 1q9c h GLN 46 Cb 0.45 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1q9c h GLN 46 CO -0.27 0.49 0.13 -0.92 -0.67 0.00 0.00 178.83 177.59 1q9c h TYR 47 N 0.36 0.62 -0.53 2.96 3.20 -0.61 -1.55 116.97 121.41 1q9c h TYR 47 Ca 0.07 -0.06 0.01 0.00 3.14 0.00 0.00 58.73 61.89 1q9c h TYR 47 Cb 0.39 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.46 1q9c h TYR 47 CO 0.01 0.57 0.35 0.28 -1.64 0.00 0.00 178.16 177.73 1q9c h VAL 48 N 0.48 1.13 -0.64 1.81 2.07 -0.75 -1.95 116.25 118.41 1q9c h VAL 48 Ca 0.13 -0.25 0.12 0.00 0.82 0.00 0.00 66.70 67.52 1q9c h VAL 48 Cb 0.24 0.36 -0.08 0.00 -1.52 0.00 0.00 31.29 30.28 1q9c h VAL 48 CO -0.01 0.13 0.19 -0.08 0.02 0.00 0.00 177.57 177.83 1q9c h GLU 49 N 0.72 0.33 -0.48 1.57 4.81 -0.83 0.29 114.58 120.99 1q9c h GLU 49 Ca 0.19 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.44 1q9c h GLU 49 Cb -0.08 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.18 1q9c h GLU 49 CO -0.04 0.22 0.24 0.93 -0.73 0.00 0.00 179.01 179.63 1q9c h GLU 50 N 0.34 0.47 -0.22 1.92 5.08 -0.57 0.65 114.58 122.26 1q9c h GLU 50 Ca 0.34 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.65 1q9c h GLU 50 Cb 0.49 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1q9c h GLU 50 CO -0.38 0.31 0.05 -0.07 -1.00 0.00 0.00 179.01 177.91 1q9c h LEU 51 N 0.48 0.34 -0.12 1.33 3.38 -0.50 -2.40 115.31 117.81 1q9c h LEU 51 Ca 0.21 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1q9c h LEU 51 Cb 0.11 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1q9c h LEU 51 CO -0.14 0.49 0.08 0.40 0.09 0.00 0.00 178.44 179.36 1q9c h ILE 52 N 0.17 1.02 -0.23 1.22 1.08 -0.17 -2.03 117.51 118.57 1q9c h ILE 52 Ca 0.07 -0.05 0.03 0.00 -0.39 0.00 0.00 64.86 64.51 1q9c h ILE 52 Cb 0.29 0.85 -0.01 0.00 -3.07 0.00 0.00 36.82 34.88 1q9c h ILE 52 CO 0.00 0.03 0.16 -0.07 -0.69 0.00 0.00 178.15 177.58 1q9c h LEU 53 N 0.16 0.16 -0.56 1.44 3.38 -0.86 -0.22 115.31 118.82 1q9c h LEU 53 Ca 0.05 -0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 1q9c h LEU 53 Cb -0.01 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1q9c h LEU 53 CO -0.02 0.11 -0.04 -0.61 0.09 0.00 0.00 178.44 177.98 1q9c h GLN 54 N 0.19 1.01 -0.08 1.13 5.75 -0.86 -1.78 115.11 120.47 1q9c h GLN 54 Ca 0.10 -0.34 -0.03 0.00 -0.15 0.00 0.00 58.65 58.23 1q9c h GLN 54 Cb 0.16 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 1q9c h GLN 54 CO -0.02 1.03 -0.08 1.25 -2.65 0.00 0.00 178.83 178.36 1q9c h LEU 55 N 0.90 0.11 -0.72 -2.39 5.85 -0.42 -1.26 115.31 117.36 1q9c h LEU 55 Ca 0.15 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 1q9c h LEU 55 Cb 0.60 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.56 1q9c h LEU 55 CO 0.04 0.21 0.45 0.25 -0.34 0.00 0.00 178.44 179.04 1q9c h LEU 56 N 0.11 0.86 -1.95 2.25 5.85 -0.44 -1.44 115.31 120.56 1q9c h LEU 56 Ca 0.03 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1q9c h LEU 56 Cb 0.23 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1q9c h LEU 56 CO 0.01 0.66 0.00 0.59 -0.34 0.00 0.00 178.44 179.37 1q9c n ASN 57 N -4.53 0.47 0.00 1.25 3.02 -0.48 -0.70 115.26 114.29 1q9c n ASN 57 Ca 0.06 -0.32 0.00 0.00 -0.03 0.00 0.00 54.58 54.29 1q9c n ASN 57 Cb 0.05 -0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.14 1q9c n ASN 57 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1q9c n LEU 59 N 0.90 0.00 0.18 3.41 4.77 -0.54 0.42 117.00 126.13 1q9c n LEU 59 Ca 0.00 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.03 1q9c n LEU 59 Cb 0.08 0.00 0.32 0.00 -2.33 0.00 0.00 43.42 41.49 1q9c n LEU 59 CO 0.00 0.00 0.66 0.00 -1.33 0.00 0.00 177.39 176.72 1q9c n GLN 61 N -3.60 0.01 -0.07 0.00 6.02 0.17 0.30 117.38 120.19 1q9c n GLN 61 Ca -0.00 0.38 0.12 0.00 -0.01 0.00 0.00 57.00 57.49 1q9c n GLN 61 Cb 0.51 -1.50 0.29 0.00 1.02 0.00 0.00 30.24 30.56 1q9c n GLN 61 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1q9c n ALA 62 N -1.48 2.49 -3.96 -1.58 0.00 -1.07 -4.97 120.51 109.94 1q9c n ALA 62 Ca 0.02 -0.68 -0.32 0.00 0.00 0.00 0.00 53.44 52.45 1q9c n ALA 62 Cb 0.07 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.54 1q9c n ALA 62 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1q9c n GLN 63 N 0.89 -1.73 -1.82 0.00 6.02 0.15 -4.86 117.38 116.03 1q9c n GLN 63 Ca 0.17 0.30 -0.42 0.00 -0.01 0.00 0.00 57.00 57.04 1q9c n GLN 63 Cb 0.48 -3.85 -0.03 0.00 1.02 0.00 0.00 30.24 27.86 1q9c n GLN 63 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 1q9c s PRO 64 N -6.70 4.16 0.00 -1.09 0.02 -1.26 -4.89 135.00 125.23 1q9c s PRO 64 Ca 0.24 2.50 0.03 0.00 0.02 0.00 0.00 61.00 63.79 1q9c s PRO 64 Cb -0.10 -3.10 0.01 0.00 0.02 0.00 0.00 34.50 31.33 1q9c s PRO 64 CO 0.92 -0.67 0.50 0.54 -0.33 0.00 0.00 177.00 177.96 1q9c n ARG 65 N 3.65 0.95 -3.72 5.54 1.74 -1.26 -5.01 116.66 118.55 1q9c n ARG 65 Ca 0.14 -0.55 -0.11 0.00 -0.77 0.00 0.00 57.85 56.56 1q9c n ARG 65 Cb 0.37 -0.97 -0.06 0.00 -1.02 0.00 0.00 32.46 30.77 1q9c n ARG 65 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1q9c s SER 66 N -0.52 -0.13 0.33 0.55 1.04 -1.26 -4.74 113.70 108.96 1q9c s SER 66 Ca 0.03 -0.32 0.06 0.00 0.48 0.00 0.00 55.95 56.20 1q9c s SER 66 Cb 0.03 0.41 0.72 0.00 0.10 0.00 0.00 66.02 67.27 1q9c s SER 66 CO 0.06 -0.74 1.87 0.00 0.98 0.00 0.00 173.24 175.41 1q9c h ALA 67 N 2.76 1.71 -0.44 5.32 0.00 -1.90 -0.62 119.26 126.09 1q9c h ALA 67 Ca -0.33 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 1q9c h ALA 67 Cb 1.22 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1q9c h ALA 67 CO 0.48 0.06 -0.08 0.77 0.00 0.00 0.00 179.25 180.49 1q9c h SER 68 N 0.81 0.76 -0.32 0.00 0.02 -1.99 -3.07 113.55 109.76 1q9c h SER 68 Ca 0.45 -0.21 0.02 0.00 -0.84 0.00 0.00 61.79 61.21 1q9c h SER 68 Cb 0.59 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 1q9c h SER 68 CO -0.21 0.88 0.15 0.44 -1.14 0.00 0.00 176.83 176.94 1q9c h ASP 69 N 0.71 0.21 -0.97 3.07 3.45 -1.51 -1.99 116.42 119.40 1q9c h ASP 69 Ca 0.13 0.02 0.05 0.00 0.43 0.00 0.00 57.03 57.66 1q9c h ASP 69 Cb 0.55 -0.02 -0.06 0.00 -0.56 0.00 0.00 39.33 39.24 1q9c h ASP 69 CO 0.03 0.16 0.63 0.58 -1.57 0.00 0.00 179.24 179.07 1q9c h VAL 70 N 0.31 1.12 -0.87 -1.35 2.07 -1.44 -1.38 116.25 114.71 1q9c h VAL 70 Ca 0.13 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 1q9c h VAL 70 Cb 0.06 -0.15 -0.04 0.00 -1.52 0.00 0.00 31.29 29.64 1q9c h VAL 70 CO -0.10 0.21 0.43 -0.08 0.02 0.00 0.00 177.57 178.05 1q9c h GLU 71 N 1.16 1.24 0.00 1.57 4.81 -1.32 -1.76 114.58 120.28 1q9c h GLU 71 Ca 0.40 -0.17 -0.06 0.00 -0.13 0.00 0.00 59.36 59.40 1q9c h GLU 71 Cb 0.11 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1q9c h GLU 71 CO -0.14 0.94 -0.29 0.93 -0.73 0.00 0.00 179.01 179.71 1q9c h GLU 72 N 1.23 0.00 0.18 1.92 5.08 -0.58 -1.59 114.58 120.83 1q9c h GLU 72 Ca 0.30 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.65 1q9c h GLU 72 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1q9c h GLU 72 CO -0.04 0.29 -0.09 -0.09 -1.00 0.00 0.00 179.01 178.08 1q9c h ARG 73 N 0.00 -0.24 -0.83 2.33 9.65 -0.60 -3.13 114.38 121.57 1q9c h ARG 73 Ca -0.00 0.02 0.06 0.00 -1.10 0.00 0.00 59.98 58.95 1q9c h ARG 73 Cb 0.58 0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 29.16 1q9c h ARG 73 CO 0.04 0.17 0.54 0.28 2.80 0.00 0.00 179.97 183.80 1q9c h VAL 74 N -0.83 1.07 0.00 0.20 2.07 -1.29 -0.48 116.25 116.98 1q9c h VAL 74 Ca -0.03 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.17 1q9c h VAL 74 Cb 0.52 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1q9c h VAL 74 CO 0.04 0.17 0.00 1.67 0.02 0.00 0.00 177.57 179.47 1q9c n GLN 75 N -4.48 0.14 -0.00 1.57 7.27 -0.60 -1.22 117.38 120.06 1q9c n GLN 75 Ca 0.12 0.46 0.02 0.00 0.07 0.00 0.00 57.00 57.67 1q9c n GLN 75 Cb 0.19 -1.81 -0.03 0.00 2.41 0.00 0.00 30.24 30.99 1q9c n GLN 75 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1q9c n LYS 76 N -2.08 3.19 -0.07 3.69 5.02 -0.40 -4.81 118.16 122.70 1q9c n LYS 76 Ca 0.01 -0.02 -0.14 0.00 -2.02 0.00 0.00 58.31 56.15 1q9c n LYS 76 Cb 0.16 -0.89 -0.05 0.00 -0.02 0.00 0.00 35.03 34.23 1q9c n LYS 76 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1q9c n SER 77 N -1.35 1.54 -4.69 4.39 7.64 -0.33 -5.01 113.62 115.81 1q9c n SER 77 Ca 0.00 0.26 -0.44 0.00 1.01 0.00 0.00 58.87 59.69 1q9c n SER 77 Cb 0.10 -0.60 -0.03 0.00 -1.01 0.00 0.00 64.21 62.67 1q9c n SER 77 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1q9c n PHE 78 N -4.03 2.42 -1.03 1.43 3.01 -0.36 -4.98 117.46 113.92 1q9c n PHE 78 Ca -0.24 0.27 -0.29 0.00 1.01 0.00 0.00 57.45 58.20 1q9c n PHE 78 Cb 0.56 -2.55 0.17 0.00 -0.01 0.00 0.00 39.48 37.65 1q9c n PHE 78 CO 0.00 0.00 0.00 -2.14 1.01 0.00 0.00 176.76 175.63 1q9c s PRO 79 N 0.39 0.67 0.28 -1.08 0.02 -1.26 -4.34 135.00 129.67 1q9c s PRO 79 Ca 0.73 0.84 -0.19 0.00 0.02 0.00 0.00 61.00 62.40 1q9c s PRO 79 Cb -0.61 -1.74 -0.09 0.00 0.02 0.00 0.00 34.50 32.08 1q9c s PRO 79 CO 0.42 -2.65 0.77 -1.58 -0.33 0.00 0.00 177.00 173.62 1q9c s HIS 80 N -2.82 3.54 -0.13 6.54 2.46 -1.26 0.66 115.29 124.27 1q9c s HIS 80 Ca 0.65 1.39 0.16 0.00 0.47 0.00 0.00 55.06 57.73 1q9c s HIS 80 Cb -0.20 -2.64 -0.07 0.00 -0.13 0.00 0.00 32.58 29.54 1q9c s HIS 80 CO 0.59 0.21 1.06 -1.00 -2.47 0.00 0.00 174.74 173.13 1q9c h PRO 81 N 2.91 0.00 -0.90 2.88 0.13 -2.02 -3.45 132.00 131.55 1q9c h PRO 81 Ca -0.48 0.00 0.25 0.00 -0.87 0.00 0.00 66.00 64.91 1q9c h PRO 81 Cb 1.19 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.16 1q9c h PRO 81 CO 0.65 0.38 0.22 0.97 -0.23 0.00 0.00 178.00 179.99 1q9c h ILE 82 N 0.00 0.24 -0.39 -3.56 6.09 -1.91 0.17 117.51 118.15 1q9c h ILE 82 Ca -0.10 -0.06 -0.01 0.00 -1.37 0.00 0.00 64.86 63.33 1q9c h ILE 82 Cb 1.51 0.07 -0.02 0.00 0.47 0.00 0.00 36.82 38.85 1q9c h ILE 82 CO 0.05 0.03 0.21 -2.24 -3.07 0.00 0.00 178.15 173.14 1q9c h ASP 83 N 0.16 0.50 0.71 2.19 2.03 0.03 -0.74 116.42 121.29 1q9c h ASP 83 Ca 0.58 -0.09 -0.03 0.00 -0.73 0.00 0.00 57.03 56.75 1q9c h ASP 83 Cb 1.21 -0.13 0.01 0.00 -0.83 0.00 0.00 39.33 39.59 1q9c h ASP 83 CO -0.71 0.45 -0.34 0.50 -1.03 0.00 0.00 179.24 178.11 1q9c h LYS 84 N 0.50 -0.92 -0.87 4.15 3.64 -1.25 -2.69 116.57 119.14 1q9c h LYS 84 Ca 0.14 0.06 0.14 0.00 -1.27 0.00 0.00 60.65 59.72 1q9c h LYS 84 Cb 0.07 0.21 -0.09 0.00 -0.41 0.00 0.00 32.23 32.00 1q9c h LYS 84 CO -0.02 -0.61 0.47 -1.49 -2.27 0.00 0.00 179.45 175.53 1q9c h TRP 85 N -1.01 0.83 0.37 1.91 -0.00 -1.29 -1.54 115.95 115.22 1q9c h TRP 85 Ca -0.10 0.03 -0.01 0.00 -0.00 0.00 0.00 58.89 58.82 1q9c h TRP 85 Cb 0.73 -0.24 -0.03 0.00 -0.00 0.00 0.00 29.16 29.63 1q9c h TRP 85 CO 0.05 0.23 -0.49 0.00 -0.00 0.00 0.00 178.44 178.23 1q9c h ALA 86 N 1.55 -1.09 -0.93 1.49 0.00 -1.09 0.30 119.26 119.50 1q9c h ALA 86 Ca 0.47 -0.16 0.12 0.00 0.00 0.00 0.00 54.91 55.34 1q9c h ALA 86 Cb 0.63 0.76 -0.07 0.00 0.00 0.00 0.00 17.79 19.11 1q9c h ALA 86 CO -0.34 -1.14 0.59 0.82 0.00 0.00 0.00 179.25 179.18 1q9c h ILE 87 N -0.88 0.90 -0.33 0.00 2.04 -1.14 0.30 117.51 118.40 1q9c h ILE 87 Ca -0.04 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.52 1q9c h ILE 87 Cb 0.79 -0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.84 1q9c h ILE 87 CO -0.12 0.16 0.18 0.00 0.00 0.00 0.00 178.15 178.37 1q9c h ALA 88 N 1.57 0.42 0.40 1.87 0.00 -0.58 0.42 119.26 123.36 1q9c h ALA 88 Ca 0.45 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.27 1q9c h ALA 88 Cb 0.55 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1q9c h ALA 88 CO -0.22 -0.05 -0.19 0.22 0.00 0.00 0.00 179.25 179.01 1q9c h ASP 89 N 0.42 -0.46 -0.16 0.00 -0.00 0.13 -0.66 116.42 115.70 1q9c h ASP 89 Ca 0.12 -0.09 0.04 0.00 -0.00 0.00 0.00 57.03 57.10 1q9c h ASP 89 Cb 0.05 0.12 -0.04 0.00 -0.00 0.00 0.00 39.33 39.46 1q9c h ASP 89 CO -0.02 -0.17 -0.09 0.00 -0.00 0.00 0.00 179.24 178.95 1q9c h ALA 90 N -0.24 0.04 0.17 -0.78 0.00 -0.41 -1.04 119.26 117.00 1q9c h ALA 90 Ca -0.06 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1q9c h ALA 90 Cb 0.52 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1q9c h ALA 90 CO 0.09 -0.53 -0.31 0.37 0.00 0.00 0.00 179.25 178.87 1q9c h GLN 91 N -0.09 -0.54 -0.96 0.00 5.75 -0.16 -0.41 115.11 118.70 1q9c h GLN 91 Ca 0.09 0.04 0.28 0.00 -0.15 0.00 0.00 58.65 58.91 1q9c h GLN 91 Cb 0.22 0.12 -0.04 0.00 1.07 0.00 0.00 27.48 28.86 1q9c h GLN 91 CO -0.21 -0.36 0.69 1.03 -2.65 0.00 0.00 178.83 177.33 1q9c h SER 92 N -0.56 0.01 0.25 -0.69 0.87 -0.74 -1.34 113.55 111.34 1q9c h SER 92 Ca 0.02 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 1q9c h SER 92 Cb 0.57 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.53 1q9c h SER 92 CO -0.15 0.00 -0.12 0.00 -0.53 0.00 0.00 176.83 176.04 1q9c h ALA 93 N 1.52 -0.34 0.00 6.23 0.00 0.26 -2.67 119.26 124.27 1q9c h ALA 93 Ca 0.46 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1q9c h ALA 93 Cb 1.82 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.74 1q9c h ALA 93 CO -0.01 -0.49 0.00 0.44 0.00 0.00 0.00 179.25 179.19 1q9c n ILE 94 N -5.07 0.63 0.05 0.00 -5.35 -0.56 -1.39 119.36 107.66 1q9c n ILE 94 Ca -0.09 0.16 0.09 0.00 -0.27 0.00 0.00 62.75 62.64 1q9c n ILE 94 Cb 0.26 -0.93 -0.08 0.00 -1.74 0.00 0.00 39.64 37.15 1q9c n ILE 94 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1q9c n GLU 95 N -1.30 0.63 -1.84 6.28 1.02 -0.86 -4.98 120.64 119.60 1q9c n GLU 95 Ca 0.06 0.01 -0.05 0.00 -0.02 0.00 0.00 57.16 57.17 1q9c n GLU 95 Cb 0.11 -1.70 -0.01 0.00 -0.02 0.00 0.00 31.44 29.82 1q9c n GLU 95 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1q9c n LYS 96 N -2.55 -0.36 -2.68 3.49 4.81 -0.49 -5.03 118.16 115.35 1q9c n LYS 96 Ca -0.04 0.34 -0.32 0.00 -0.87 0.00 0.00 58.31 57.42 1q9c n LYS 96 Cb 0.61 -4.09 -0.05 0.00 0.02 0.00 0.00 35.03 31.52 1q9c n LYS 96 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1q9c s ARG 97 N -3.75 4.06 0.48 1.64 0.52 -1.10 -4.99 118.95 115.81 1q9c s ARG 97 Ca 0.00 0.96 -0.21 0.00 -0.52 0.00 0.00 55.73 55.96 1q9c s ARG 97 Cb 0.00 -2.20 -0.10 0.00 0.52 0.00 0.00 34.95 33.17 1q9c s ARG 97 CO 0.00 -0.11 0.66 1.63 0.02 0.00 0.00 175.30 177.50 1q9c n LYS 98 N -1.05 0.74 -3.83 3.54 5.02 -1.26 -4.86 118.16 116.45 1q9c n LYS 98 Ca 0.06 0.27 -0.12 0.00 -2.02 0.00 0.00 58.31 56.50 1q9c n LYS 98 Cb 0.54 -1.73 -0.13 0.00 -0.02 0.00 0.00 35.03 33.70 1q9c n LYS 98 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1q9c s ARG 99 N -1.92 0.17 0.08 1.97 0.52 -1.26 -5.07 118.95 113.44 1q9c s ARG 99 Ca 0.66 0.14 -0.23 0.00 -0.52 0.00 0.00 55.73 55.78 1q9c s ARG 99 Cb -0.53 0.08 -0.15 0.00 0.52 0.00 0.00 34.95 34.88 1q9c s ARG 99 CO 0.56 -0.02 1.68 0.00 0.02 0.00 0.00 175.30 177.54 1q9c h ARG 100 N 5.85 0.04 -4.55 3.54 3.08 -2.07 -3.38 114.38 116.89 1q9c h ARG 100 Ca -0.25 -0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.13 1q9c h ARG 100 Cb 1.20 -0.01 -0.39 0.00 0.08 0.00 0.00 29.97 30.85 1q9c h ARG 100 CO 0.43 0.09 -0.67 -0.80 -1.07 0.00 0.00 179.97 177.95 1q9c s ASN 101 N -5.29 4.85 0.34 7.04 0.01 -1.26 -5.10 114.94 115.53 1q9c s ASN 101 Ca -0.13 -2.20 -0.26 0.00 -0.71 0.00 0.00 52.86 49.56 1q9c s ASN 101 Cb 0.06 -1.67 -0.13 0.00 0.41 0.00 0.00 41.25 39.91 1q9c s ASN 101 CO 0.67 -0.40 0.94 -2.65 -1.51 0.00 0.00 177.10 174.15 1q9c n PRO 102 N 4.24 1.23 -1.43 -0.60 -0.02 -1.26 -4.83 135.00 132.32 1q9c n PRO 102 Ca 0.03 0.43 -0.45 0.00 -2.02 0.00 0.00 63.50 61.49 1q9c n PRO 102 Cb 0.41 -1.84 -0.01 0.00 -0.02 0.00 0.00 33.50 32.04 1q9c n PRO 102 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1q9c n LEU 103 N 1.04 -0.70 -0.05 2.45 4.32 -1.26 -4.92 117.00 117.88 1q9c n LEU 103 Ca 0.10 1.04 -0.05 0.00 -0.02 0.00 0.00 56.01 57.08 1q9c n LEU 103 Cb 0.35 -1.04 -0.08 0.00 -1.62 0.00 0.00 43.42 41.03 1q9c n LEU 103 CO 0.58 -2.87 -0.83 -1.20 -1.22 0.00 0.00 177.39 171.85 1q9c n SER 104 N 1.76 2.49 -4.69 -1.43 7.64 -1.26 -5.01 113.62 113.12 1q9c n SER 104 Ca 0.14 0.00 -0.44 0.00 1.01 0.00 0.00 58.87 59.58 1q9c n SER 104 Cb 0.32 0.77 -0.03 0.00 -1.01 0.00 0.00 64.21 64.26 1q9c n SER 104 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1q9c n LEU 105 N -2.37 3.49 -4.04 -3.43 4.77 -1.26 -4.76 117.00 109.41 1q9c n LEU 105 Ca -0.16 1.13 -0.35 0.00 -0.03 0.00 0.00 56.01 56.60 1q9c n LEU 105 Cb 0.82 -1.48 -0.08 0.00 -2.33 0.00 0.00 43.42 40.35 1q9c n LEU 105 CO 0.22 -0.26 1.68 -2.65 -1.33 0.00 0.00 177.39 175.04 1q9c n PRO 106 N 2.29 1.11 0.25 3.23 -0.02 -1.26 -4.75 135.00 135.85 1q9c n PRO 106 Ca 0.11 -1.89 -0.18 0.00 -2.02 0.00 0.00 63.50 59.52 1q9c n PRO 106 Cb 0.33 -3.24 -0.10 0.00 -0.02 0.00 0.00 33.50 30.47 1q9c n PRO 106 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1q9c h VAL 107 N 5.39 0.00 0.00 -1.45 2.07 -1.98 0.17 116.25 120.45 1q9c h VAL 107 Ca 0.28 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.80 1q9c h VAL 107 Cb 0.80 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1q9c h VAL 107 CO 1.62 0.00 0.49 -0.33 0.02 0.00 0.00 177.57 179.36 1q9c h GLU 108 N -0.95 0.00 0.02 1.57 5.08 -2.00 0.56 114.58 118.86 1q9c h GLU 108 Ca -0.05 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 57.92 1q9c h GLU 108 Cb 0.84 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.03 1q9c h GLU 108 CO -0.11 0.00 -2.41 1.63 -1.00 0.00 0.00 179.01 177.12 1q9c n LYS 109 N -2.37 0.66 -0.18 2.33 5.02 -0.65 -4.40 118.16 118.57 1q9c n LYS 109 Ca -0.01 0.17 -0.10 0.00 -2.02 0.00 0.00 58.31 56.35 1q9c n LYS 109 Cb 0.51 -1.55 0.01 0.00 -0.02 0.00 0.00 35.03 33.98 1q9c n LYS 109 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1q9c h ILE 110 N -0.02 1.27 -0.22 -0.18 2.04 0.25 -3.29 117.51 117.36 1q9c h ILE 110 Ca -0.56 -1.16 0.03 0.00 1.00 0.00 0.00 64.86 64.17 1q9c h ILE 110 Cb 1.91 0.95 -0.06 0.00 -0.74 0.00 0.00 36.82 38.88 1q9c h ILE 110 CO -0.08 0.41 -0.47 -0.74 0.00 0.00 0.00 178.15 177.27 1q9c h HIS 111 N 0.83 -1.42 -0.82 1.37 2.76 -0.31 -0.70 115.15 116.86 1q9c h HIS 111 Ca 0.15 0.06 0.22 0.00 -2.20 0.00 0.00 60.37 58.60 1q9c h HIS 111 Cb 0.58 0.65 -0.04 0.00 1.55 0.00 0.00 27.41 30.15 1q9c h HIS 111 CO 0.04 -0.45 0.58 -1.35 -1.30 0.00 0.00 177.93 175.45 1q9c h PRO 112 N -0.43 0.11 0.00 5.26 0.11 -1.77 -0.03 132.00 135.26 1q9c h PRO 112 Ca 0.04 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 66.02 1q9c h PRO 112 Cb 0.55 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.62 1q9c h PRO 112 CO -0.43 0.07 -0.62 -0.07 -0.21 0.00 0.00 178.00 176.74 1q9c h LEU 113 N 0.11 0.00 -1.33 2.35 3.38 -1.25 -3.23 115.31 115.34 1q9c h LEU 113 Ca 0.40 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.34 1q9c h LEU 113 Cb 1.42 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.15 1q9c h LEU 113 CO -0.05 0.62 0.08 -0.07 0.09 0.00 0.00 178.44 179.11 1q9c h LEU 114 N 0.00 0.49 -1.94 1.67 3.38 0.22 -1.31 115.31 117.81 1q9c h LEU 114 Ca -0.01 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1q9c h LEU 114 Cb 1.37 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 1q9c h LEU 114 CO 0.08 0.50 -0.11 0.11 0.09 0.00 0.00 178.44 179.11 1q9c h LYS 115 N 0.53 0.00 0.00 1.13 1.57 -1.57 0.10 116.57 118.33 1q9c h LYS 115 Ca 0.12 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 1q9c h LYS 115 Cb 0.21 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.52 1q9c h LYS 115 CO -0.00 0.11 -0.77 0.93 -0.57 0.00 0.00 179.45 179.14 1q9c h GLU 116 N 0.00 0.00 0.13 3.15 5.08 -1.40 -1.55 114.58 119.99 1q9c h GLU 116 Ca -0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.05 1q9c h GLU 116 Cb 0.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1q9c h GLU 116 CO 0.01 0.05 -1.57 0.28 -1.00 0.00 0.00 179.01 176.78 1q9c h VAL 117 N 0.00 1.11 0.17 3.13 2.07 -0.71 -3.37 116.25 118.66 1q9c h VAL 117 Ca -0.02 -2.75 -0.34 0.00 0.82 0.00 0.00 66.70 64.42 1q9c h VAL 117 Cb 1.07 2.75 0.01 0.00 -1.52 0.00 0.00 31.29 33.60 1q9c h VAL 117 CO 0.01 0.82 -1.71 -0.07 0.02 0.00 0.00 177.57 176.63 1q9c h LEU 118 N 0.07 0.57 0.00 2.57 3.38 -1.14 -3.45 115.31 117.32 1q9c h LEU 118 Ca -0.26 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 56.78 1q9c h LEU 118 Cb 2.03 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.59 1q9c h LEU 118 CO 0.16 1.77 0.00 0.61 0.09 0.00 0.00 178.44 181.07 1q9c n GLY 119 N 1.85 0.53 3.03 0.83 0.00 -0.58 -5.06 105.19 105.79 1q9c n GLY 119 Ca -0.25 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.68 1q9c n GLY 119 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1q9c s TYR 120 N -2.19 0.40 0.13 1.61 -0.85 -1.23 -5.01 117.35 110.21 1q9c s TYR 120 Ca 0.00 -0.72 -0.32 0.00 -0.52 0.00 0.00 57.07 55.51 1q9c s TYR 120 Cb 0.00 -0.29 -0.11 0.00 0.38 0.00 0.00 41.96 41.94 1q9c s TYR 120 CO 0.00 -0.24 1.78 1.63 -1.52 0.00 0.00 175.55 177.20 1q9c n LYS 121 N 1.04 2.66 -4.64 -3.49 5.02 -1.26 -4.66 118.16 112.83 1q9c n LYS 121 Ca -0.20 0.97 -0.31 0.00 -2.02 0.00 0.00 58.31 56.74 1q9c n LYS 121 Cb 0.57 -2.83 -0.12 0.00 -0.02 0.00 0.00 35.03 32.63 1q9c n LYS 121 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1q9c s ILE 122 N 2.25 2.98 0.13 -0.18 2.07 -1.26 -5.07 121.20 122.12 1q9c s ILE 122 Ca 0.81 -1.07 -0.30 0.00 -1.41 0.00 0.00 60.65 58.68 1q9c s ILE 122 Cb -0.53 -2.26 -0.07 0.00 0.13 0.00 0.00 42.46 39.74 1q9c s ILE 122 CO 0.37 0.37 1.07 -0.62 -1.91 0.00 0.00 174.94 174.22 1q9c s ASP 123 N -1.38 7.30 0.26 4.50 -1.08 -1.26 -4.94 116.67 120.07 1q9c s ASP 123 Ca 0.15 1.98 -0.11 0.00 -0.52 0.00 0.00 52.55 54.05 1q9c s ASP 123 Cb -0.11 -2.59 0.38 0.00 -1.46 0.00 0.00 42.92 39.14 1q9c s ASP 123 CO 0.05 -0.23 1.57 -0.74 0.52 0.00 0.00 175.17 176.35 1q9c h HIS 124 N 5.62 -0.57 -1.01 -5.34 -0.00 -2.00 0.38 115.15 112.24 1q9c h HIS 124 Ca -0.43 0.08 0.21 0.00 -0.00 0.00 0.00 60.37 60.24 1q9c h HIS 124 Cb 1.21 0.39 -0.11 0.00 -0.00 0.00 0.00 27.41 28.90 1q9c h HIS 124 CO 0.64 -0.40 0.61 0.37 -0.00 0.00 0.00 177.93 179.15 1q9c h GLN 125 N -0.01 0.67 -0.56 5.26 4.15 -1.99 0.11 115.11 122.74 1q9c h GLN 125 Ca 0.42 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.77 1q9c h GLN 125 Cb 0.66 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 28.17 1q9c h GLN 125 CO -0.94 0.44 0.23 0.28 -1.93 0.00 0.00 178.83 176.91 1q9c h VAL 126 N 0.69 1.22 -0.22 2.39 2.07 -0.60 -0.88 116.25 120.92 1q9c h VAL 126 Ca 0.61 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 1q9c h VAL 126 Cb 1.04 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1q9c h VAL 126 CO -0.42 0.26 0.11 0.28 0.02 0.00 0.00 177.57 177.81 1q9c h SER 127 N 0.76 0.29 -0.37 0.57 0.02 -0.62 -1.04 113.55 113.17 1q9c h SER 127 Ca 0.19 -0.12 0.06 0.00 -0.84 0.00 0.00 61.79 61.08 1q9c h SER 127 Cb 0.18 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.59 1q9c h SER 127 CO -0.02 0.32 0.04 0.58 -1.14 0.00 0.00 176.83 176.61 1q9c h VAL 128 N 0.23 0.77 -0.06 2.27 2.07 -0.87 0.17 116.25 120.84 1q9c h VAL 128 Ca 0.08 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.57 1q9c h VAL 128 Cb 0.11 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 1q9c h VAL 128 CO -0.01 0.03 -0.13 0.22 0.02 0.00 0.00 177.57 177.70 1q9c h TYR 129 N 0.15 -0.32 0.27 1.57 3.20 -0.90 0.15 116.97 121.09 1q9c h TYR 129 Ca 0.18 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.07 1q9c h TYR 129 Cb 0.23 0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 1q9c h TYR 129 CO -0.22 -0.19 -0.30 0.82 -1.64 0.00 0.00 178.16 176.63 1q9c h ILE 130 N -0.18 0.37 -0.39 1.81 2.04 -0.53 -0.52 117.51 120.10 1q9c h ILE 130 Ca 0.07 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.01 1q9c h ILE 130 Cb 0.27 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 1q9c h ILE 130 CO -0.17 0.00 0.28 0.58 0.00 0.00 0.00 178.15 178.84 1q9c h VAL 131 N -0.62 0.87 -0.38 1.67 2.07 -0.47 0.34 116.25 119.74 1q9c h VAL 131 Ca -0.01 -0.05 -0.10 0.00 0.82 0.00 0.00 66.70 67.36 1q9c h VAL 131 Cb 0.57 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 1q9c h VAL 131 CO -0.08 0.02 -0.19 0.00 0.02 0.00 0.00 177.57 177.35 1q9c h ALA 132 N 1.80 0.96 -0.20 1.67 0.00 0.35 -0.77 119.26 123.08 1q9c h ALA 132 Ca 0.18 -0.35 -0.21 0.00 0.00 0.00 0.00 54.91 54.54 1q9c h ALA 132 Cb 0.55 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1q9c h ALA 132 CO -0.02 0.61 -0.69 0.28 0.00 0.00 0.00 179.25 179.42 1q9c h VAL 133 N 0.64 1.28 -0.76 0.00 2.07 0.10 -2.62 116.25 116.96 1q9c h VAL 133 Ca 0.10 -1.90 -0.03 0.00 0.82 0.00 0.00 66.70 65.69 1q9c h VAL 133 Cb 0.67 1.86 -0.04 0.00 -1.52 0.00 0.00 31.29 32.26 1q9c h VAL 133 CO 0.05 0.60 0.36 -0.07 0.02 0.00 0.00 177.57 178.53 1q9c h LEU 134 N 0.56 0.99 -0.30 2.57 3.38 -0.29 -2.92 115.31 119.30 1q9c h LEU 134 Ca -0.03 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.68 1q9c h LEU 134 Cb 1.30 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 1q9c h LEU 134 CO 0.14 0.84 -0.42 -0.08 0.09 0.00 0.00 178.44 179.01 1q9c h GLU 135 N 1.08 0.81 -0.36 1.13 4.81 -1.10 -1.69 114.58 119.26 1q9c h GLU 135 Ca 0.26 -0.47 0.07 0.00 -0.13 0.00 0.00 59.36 59.09 1q9c h GLU 135 Cb 0.11 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.47 1q9c h GLU 135 CO -0.03 1.10 -0.07 -0.92 -0.73 0.00 0.00 179.01 178.36 1q9c h TYR 136 N 0.58 -0.16 -0.39 0.92 3.20 -1.29 0.28 116.97 120.12 1q9c h TYR 136 Ca 0.03 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.83 1q9c h TYR 136 Cb 1.01 0.12 -0.02 0.00 1.54 0.00 0.00 36.73 39.39 1q9c h TYR 136 CO 0.07 -0.14 -0.18 0.82 -1.64 0.00 0.00 178.16 177.10 1q9c h ILE 137 N 0.02 1.26 0.09 1.81 1.08 -1.53 0.30 117.51 120.54 1q9c h ILE 137 Ca 0.17 -1.25 0.01 0.00 -0.39 0.00 0.00 64.86 63.40 1q9c h ILE 137 Cb 0.26 1.15 -0.02 0.00 -3.07 0.00 0.00 36.82 35.15 1q9c h ILE 137 CO -0.36 0.42 -0.14 0.28 -0.69 0.00 0.00 178.15 177.66 1q9c h SER 138 N 0.65 -0.39 0.41 1.72 0.02 -0.19 -0.17 113.55 115.61 1q9c h SER 138 Ca 0.10 0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 61.03 1q9c h SER 138 Cb 0.66 0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.34 1q9c h SER 138 CO 0.05 -0.21 -0.30 0.00 -1.14 0.00 0.00 176.83 175.23 1q9c h ALA 139 N 0.59 1.35 -0.38 3.77 0.00 -0.36 -2.65 119.26 121.57 1q9c h ALA 139 Ca 0.02 -0.27 -0.15 0.00 0.00 0.00 0.00 54.91 54.51 1q9c h ALA 139 Cb 0.30 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1q9c h ALA 139 CO -0.07 0.37 -0.35 0.22 0.00 0.00 0.00 179.25 179.42 1q9c h ASP 140 N 0.00 0.95 0.05 0.00 -0.00 -0.09 0.92 116.42 118.24 1q9c h ASP 140 Ca -0.00 -0.42 -0.00 0.00 -0.00 0.00 0.00 57.03 56.61 1q9c h ASP 140 Cb 0.58 -0.27 0.00 0.00 -0.00 0.00 0.00 39.33 39.65 1q9c h ASP 140 CO 0.04 1.20 -0.03 0.40 -0.00 0.00 0.00 179.24 180.85 1q9c h ILE 141 N 0.74 1.21 -0.40 2.25 2.04 -0.84 -2.17 117.51 120.34 1q9c h ILE 141 Ca 0.07 -0.90 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 1q9c h ILE 141 Cb 0.93 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.79 1q9c h ILE 141 CO 0.09 0.22 0.20 -0.07 0.00 0.00 0.00 178.15 178.59 1q9c h LEU 142 N -0.47 0.52 -1.23 1.44 3.38 -1.51 -0.27 115.31 117.17 1q9c h LEU 142 Ca -0.01 -0.12 0.14 0.00 0.09 0.00 0.00 57.88 57.99 1q9c h LEU 142 Cb 0.42 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 40.96 1q9c h LEU 142 CO 0.01 0.49 0.59 0.50 0.09 0.00 0.00 178.44 180.12 1q9c h LYS 143 N 0.51 0.72 0.30 1.13 3.64 -0.82 0.29 116.57 122.34 1q9c h LYS 143 Ca 0.14 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.46 1q9c h LYS 143 Cb 0.11 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 1q9c h LYS 143 CO -0.02 0.48 -0.14 1.25 -2.27 0.00 0.00 179.45 178.74 1q9c h LEU 144 N 0.74 -0.34 -0.75 5.20 5.85 -0.82 -3.17 115.31 122.01 1q9c h LEU 144 Ca 0.47 -0.01 0.15 0.00 0.84 0.00 0.00 57.88 59.33 1q9c h LEU 144 Cb 0.71 0.09 -0.10 0.00 0.37 0.00 0.00 40.66 41.72 1q9c h LEU 144 CO -0.23 0.12 0.27 0.00 -0.34 0.00 0.00 178.44 178.27 1q9c h ALA 145 N -1.07 1.05 -0.50 1.25 0.00 -0.81 -1.21 119.26 117.96 1q9c h ALA 145 Ca -0.04 0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.10 1q9c h ALA 145 Cb 0.33 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 18.16 1q9c h ALA 145 CO 0.07 -0.25 0.01 0.78 0.00 0.00 0.00 179.25 179.86 1q9c h GLY 146 N 0.40 0.53 1.03 0.00 0.00 -0.52 0.13 103.07 104.64 1q9c h GLY 146 Ca 0.42 0.06 -0.06 0.00 0.00 0.00 0.00 47.33 47.75 1q9c h GLY 146 CO -0.43 -0.14 0.20 -0.57 0.00 0.00 0.00 176.54 175.60 1q9c h ASN 147 N 0.13 0.99 -0.21 0.19 -0.73 -1.22 0.18 115.58 114.90 1q9c h ASN 147 Ca 0.26 -0.22 0.04 0.00 1.87 0.00 0.00 56.30 58.25 1q9c h ASN 147 Cb 0.38 -0.26 -0.04 0.00 0.27 0.00 0.00 38.32 38.68 1q9c h ASN 147 CO -0.42 0.94 -0.05 0.22 -0.37 0.00 0.00 177.43 177.76 1q9c h TYR 148 N 0.98 -0.11 0.27 0.67 3.20 -0.41 0.18 116.97 121.76 1q9c h TYR 148 Ca 0.21 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.10 1q9c h TYR 148 Cb 0.32 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 1q9c h TYR 148 CO 0.02 -0.09 -0.22 0.28 -1.64 0.00 0.00 178.16 176.51 1q9c h VAL 149 N 0.00 0.52 -0.25 1.81 2.07 -0.38 -1.77 116.25 118.26 1q9c h VAL 149 Ca 0.10 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.69 1q9c h VAL 149 Cb 0.15 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1q9c h VAL 149 CO -0.21 0.00 0.25 -0.09 0.02 0.00 0.00 177.57 177.54 1q9c h ARG 150 N -0.51 0.00 0.00 1.57 9.65 -0.19 0.44 114.38 125.35 1q9c h ARG 150 Ca -0.01 0.00 -0.06 0.00 -1.10 0.00 0.00 59.98 58.80 1q9c h ARG 150 Cb 0.45 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.02 1q9c h ARG 150 CO -0.02 0.00 -0.29 -0.97 2.80 0.00 0.00 179.97 181.49 1q9c h ASN 151 N 0.00 0.00 -0.02 -3.80 -0.73 0.23 -3.23 115.58 108.03 1q9c h ASN 151 Ca 0.12 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.29 1q9c h ASN 151 Cb 0.63 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.22 1q9c h ASN 151 CO -0.00 0.29 -0.08 2.30 -0.37 0.00 0.00 177.43 179.57 1q9c n ILE 152 N -3.20 0.00 -2.46 2.57 -5.35 0.01 -5.04 119.36 105.88 1q9c n ILE 152 Ca 0.02 -0.46 -0.05 0.00 -0.27 0.00 0.00 62.75 62.00 1q9c n ILE 152 Cb 0.62 1.32 0.01 0.00 -1.74 0.00 0.00 39.64 39.85 1q9c n ILE 152 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1q9c n ARG 153 N 0.71 -1.88 0.00 6.28 1.74 -0.39 -5.02 116.66 118.11 1q9c n ARG 153 Ca 0.09 1.77 0.00 0.00 -0.77 0.00 0.00 57.85 58.94 1q9c n ARG 153 Cb 0.41 -4.49 0.00 0.00 -1.02 0.00 0.00 32.46 27.37 1q9c n ARG 153 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1q9c n HIS 154 N -0.21 0.00 -0.79 -1.55 8.25 -1.23 -5.02 115.22 114.68 1q9c n HIS 154 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 1q9c n HIS 154 Cb 0.28 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.39 1q9c n HIS 154 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1q9c n TYR 155 N -0.55 0.00 -3.74 4.41 0.53 -1.26 -4.91 117.16 111.63 1q9c n TYR 155 Ca 0.00 0.00 -0.15 0.00 -1.02 0.00 0.00 57.90 56.73 1q9c n TYR 155 Cb 0.05 -1.47 -0.16 0.00 -1.03 0.00 0.00 39.34 36.73 1q9c n TYR 155 CO 0.00 0.00 0.00 -2.00 -1.02 0.00 0.00 176.86 173.84 1q9c s GLU 156 N -1.26 0.02 -0.67 -0.72 2.12 -1.26 -1.49 118.70 115.43 1q9c s GLU 156 Ca 0.00 0.33 -0.20 0.00 0.36 0.00 0.00 54.97 55.46 1q9c s GLU 156 Cb 0.00 -0.25 0.10 0.00 0.26 0.00 0.00 34.13 34.24 1q9c s GLU 156 CO 0.00 -0.20 0.84 0.42 -0.54 0.00 0.00 175.26 175.78 1q9c s ILE 157 N 1.38 4.69 0.83 -3.70 1.01 -1.12 -4.96 121.20 119.34 1q9c s ILE 157 Ca -0.06 -0.93 -0.11 0.00 0.00 0.00 0.00 60.65 59.55 1q9c s ILE 157 Cb -0.12 -4.59 0.12 0.00 0.01 0.00 0.00 42.46 37.88 1q9c s ILE 157 CO -0.05 -1.28 1.17 -0.89 0.00 0.00 0.00 174.94 173.90 1q9c s THR 158 N 3.01 2.08 0.26 2.92 2.01 -1.26 -3.98 115.64 120.68 1q9c s THR 158 Ca 0.18 -0.13 0.01 0.00 0.31 0.00 0.00 61.69 62.06 1q9c s THR 158 Cb -0.19 -2.95 0.04 0.00 0.01 0.00 0.00 72.50 69.41 1q9c s THR 158 CO 0.05 0.00 1.67 0.50 -0.69 0.00 0.00 174.62 176.15 1q9c h LYS 159 N -1.09 0.53 -0.38 4.92 3.64 -1.90 -2.84 116.57 119.46 1q9c h LYS 159 Ca -0.44 -0.22 -0.12 0.00 -1.27 0.00 0.00 60.65 58.60 1q9c h LYS 159 Cb 1.29 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.08 1q9c h LYS 159 CO 0.52 0.77 -0.22 1.96 -2.27 0.00 0.00 179.45 180.22 1q9c h GLN 160 N 0.46 0.81 -0.78 1.90 1.08 -1.99 -2.17 115.11 114.42 1q9c h GLN 160 Ca 0.06 -0.37 0.09 0.00 -1.45 0.00 0.00 58.65 56.98 1q9c h GLN 160 Cb 0.75 -0.02 -0.07 0.00 -0.05 0.00 0.00 27.48 28.09 1q9c h GLN 160 CO 0.06 1.00 0.43 -0.44 -0.95 0.00 0.00 178.83 178.93 1q9c h ASP 161 N 0.61 0.61 0.33 1.46 3.32 -1.89 0.11 116.42 120.96 1q9c h ASP 161 Ca 0.08 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 1q9c h ASP 161 Cb 0.78 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1q9c h ASP 161 CO 0.06 0.35 -0.16 0.40 -1.72 0.00 0.00 179.24 178.18 1q9c h ILE 162 N 0.73 0.70 0.02 0.35 2.04 -1.36 0.49 117.51 120.48 1q9c h ILE 162 Ca 0.38 -0.28 0.01 0.00 1.00 0.00 0.00 64.86 65.97 1q9c h ILE 162 Cb 0.35 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 1q9c h ILE 162 CO -0.25 0.06 -0.27 0.11 0.00 0.00 0.00 178.15 177.79 1q9c h LYS 163 N -0.59 -0.35 -0.86 2.37 1.57 -0.72 -2.09 116.57 115.91 1q9c h LYS 163 Ca -0.04 0.02 0.18 0.00 -1.87 0.00 0.00 60.65 58.94 1q9c h LYS 163 Cb 0.43 0.08 -0.11 0.00 0.08 0.00 0.00 32.23 32.71 1q9c h LYS 163 CO 0.07 -0.23 0.40 0.28 -0.57 0.00 0.00 179.45 179.41 1q9c h VAL 164 N -0.36 0.61 0.00 0.50 2.07 -0.84 -2.19 116.25 116.04 1q9c h VAL 164 Ca 0.00 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1q9c h VAL 164 Cb 0.38 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1q9c h VAL 164 CO -0.17 0.09 0.00 0.00 0.02 0.00 0.00 177.57 177.51 1q9c n ALA 165 N -2.47 0.98 0.00 1.67 0.00 0.16 -2.69 120.51 118.17 1q9c n ALA 165 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1q9c n ALA 165 Cb 0.53 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 19.01 1q9c n ALA 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q9c h ALA 168 N 0.00 0.05 -2.34 0.00 0.00 -1.79 -3.43 119.26 111.75 1q9c h ALA 168 Ca 0.00 -0.31 -0.55 0.00 0.00 0.00 0.00 54.91 54.05 1q9c h ALA 168 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1q9c h ALA 168 CO 0.00 -0.12 0.86 0.34 0.00 0.00 0.00 179.25 180.33 1q9c s ASP 169 N -5.90 6.85 0.07 0.00 -1.08 -1.09 -4.92 116.67 110.60 1q9c s ASP 169 Ca -0.16 2.07 -0.16 0.00 -0.52 0.00 0.00 52.55 53.78 1q9c s ASP 169 Cb 0.02 -2.56 -0.13 0.00 -1.46 0.00 0.00 42.92 38.79 1q9c s ASP 169 CO 0.70 -0.74 1.33 0.11 0.52 0.00 0.00 175.17 177.10 1q9c h LYS 170 N 8.02 0.62 0.00 4.34 1.57 -1.94 -3.36 116.57 125.81 1q9c h LYS 170 Ca -0.37 -0.40 0.00 0.00 -1.87 0.00 0.00 60.65 58.02 1q9c h LYS 170 Cb 1.17 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1q9c h LYS 170 CO 0.91 1.01 0.00 0.28 -0.57 0.00 0.00 179.45 181.09 1q9c n VAL 171 N -4.25 0.00 0.00 0.50 0.31 -1.26 0.50 118.33 114.13 1q9c n VAL 171 Ca -0.06 1.35 0.00 0.00 -0.01 0.00 0.00 64.34 65.63 1q9c n VAL 171 Cb 0.53 -2.09 0.00 0.00 -0.91 0.00 0.00 33.84 31.37 1q9c n VAL 171 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1q9c n LEU 172 N -2.01 0.00 -0.72 7.52 4.77 -1.26 -4.67 117.00 120.62 1q9c n LEU 172 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1q9c n LEU 172 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1q9c n LEU 172 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.39 175.39 1q9c n ASP 174 N 0.87 0.00 0.00 -1.43 2.03 0.18 -4.48 116.55 113.73 1q9c n ASP 174 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1q9c n ASP 174 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1q9c n ASP 174 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1q9c n PHE 176 N -0.21 0.00 -0.44 -0.67 3.01 -1.26 -4.83 117.46 113.06 1q9c n PHE 176 Ca 0.00 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.43 1q9c n PHE 176 Cb 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.43 1q9c n PHE 176 CO 0.00 0.00 0.00 -2.39 1.01 0.00 0.00 176.76 175.38 1q9c n HIS 177 N 0.00 0.00 0.00 1.38 1.44 -1.26 -3.47 115.22 113.31 1q9c n HIS 177 Ca 0.00 -0.75 -0.00 0.00 -2.01 0.00 0.00 57.72 54.96 1q9c n HIS 177 Cb 0.00 -0.71 -0.00 0.00 0.12 0.00 0.00 29.99 29.40 1q9c n HIS 177 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1q9c n GLN 178 N 2.10 0.01 -0.02 -1.40 10.64 -1.26 -4.88 117.38 122.57 1q9c n GLN 178 Ca 0.11 0.00 0.09 0.00 -1.83 0.00 0.00 57.00 55.37 1q9c n GLN 178 Cb 0.42 -0.16 0.09 0.00 -0.86 0.00 0.00 30.24 29.73 1q9c n GLN 178 CO 0.00 0.00 0.00 -0.40 -1.83 0.00 0.00 177.06 174.83 1q9c n ASP 179 N -2.59 2.53 -4.55 2.61 5.68 -1.25 -4.93 116.55 114.06 1q9c n ASP 179 Ca -0.00 -1.75 -0.33 0.00 -0.50 0.00 0.00 54.79 52.22 1q9c n ASP 179 Cb 0.01 -0.03 -0.05 0.00 -1.14 0.00 0.00 41.12 39.91 1q9c n ASP 179 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 1q9c n VAL 180 N 0.99 -0.07 -1.63 2.12 0.31 -1.23 -4.86 118.33 113.97 1q9c n VAL 180 Ca 0.11 -0.69 -0.44 0.00 -0.01 0.00 0.00 64.34 63.32 1q9c n VAL 180 Cb 0.44 -2.44 -0.03 0.00 -0.91 0.00 0.00 33.84 30.90 1q9c n VAL 180 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1q9c n GLU 181 N 8.87 2.37 -1.94 5.55 1.02 -1.26 -4.96 120.64 130.30 1q9c n GLU 181 Ca 0.42 0.80 -0.29 0.00 -0.02 0.00 0.00 57.16 58.06 1q9c n GLU 181 Cb 0.48 -3.03 0.07 0.00 -0.02 0.00 0.00 31.44 28.93 1q9c n GLU 181 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1q9c s ASP 182 N 6.02 4.92 0.00 1.62 -1.08 -1.26 -4.99 116.67 121.91 1q9c s ASP 182 Ca 0.95 0.88 0.10 0.00 -0.52 0.00 0.00 52.55 53.96 1q9c s ASP 182 Cb -0.44 -1.52 0.59 0.00 -1.46 0.00 0.00 42.92 40.09 1q9c s ASP 182 CO 0.41 -1.64 1.04 -0.38 0.52 0.00 0.00 175.17 175.11