#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 0.00 -2.18 1.96 -0.02 -1.26 -4.85 135.00 128.65 1q9c n PRO 7 Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.07 1q9c n PRO 7 Cb 0.00 -0.99 -0.03 0.00 -0.02 0.00 0.00 33.50 32.46 1q9c n PRO 7 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1q9c s TYR 8 N -1.98 3.20 -0.85 6.00 5.04 -1.26 -4.98 117.35 122.52 1q9c s TYR 8 Ca 0.56 1.26 -0.05 0.00 -2.44 0.00 0.00 57.07 56.40 1q9c s TYR 8 Cb -0.48 -3.63 0.21 0.00 0.35 0.00 0.00 41.96 38.41 1q9c s TYR 8 CO 0.66 -1.91 0.74 -1.21 -1.34 0.00 0.00 175.55 172.49 1q9c s GLU 9 N -0.56 3.28 0.32 4.97 0.41 -1.26 -4.94 118.70 120.92 1q9c s GLU 9 Ca 0.55 -2.96 0.10 0.00 -0.41 0.00 0.00 54.97 52.24 1q9c s GLU 9 Cb -0.38 -4.06 0.92 0.00 -1.78 0.00 0.00 34.13 28.83 1q9c s GLU 9 CO 0.42 -1.24 1.70 0.74 -0.49 0.00 0.00 175.26 176.39 1q9c h PHE 10 N 6.63 0.90 -2.30 1.61 -1.00 -1.95 -3.00 116.94 117.82 1q9c h PHE 10 Ca 0.11 0.04 -0.73 0.00 2.81 0.00 0.00 57.97 60.20 1q9c h PHE 10 Cb 0.89 -0.24 -0.33 0.00 3.61 0.00 0.00 35.95 39.88 1q9c h PHE 10 CO 0.77 -0.05 0.39 1.19 -1.61 0.00 0.00 178.31 179.01 1q9c n PHE 11 N -4.98 3.21 -4.07 -0.55 0.99 -1.26 -2.74 117.46 108.06 1q9c n PHE 11 Ca 0.27 -3.11 -0.22 0.00 -0.00 0.00 0.00 57.45 54.40 1q9c n PHE 11 Cb 0.80 -0.94 -0.04 0.00 -1.00 0.00 0.00 39.48 38.31 1q9c n PHE 11 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.76 175.64 1q9c s SER 12 N -2.14 5.79 0.00 4.37 0.01 -1.13 -4.75 113.70 115.85 1q9c s SER 12 Ca 0.42 -0.14 0.01 0.00 1.31 0.00 0.00 55.95 57.55 1q9c s SER 12 Cb 0.21 -1.56 0.08 0.00 0.21 0.00 0.00 66.02 64.97 1q9c s SER 12 CO -0.12 -0.04 0.49 1.21 0.41 0.00 0.00 173.24 175.19 1q9c n GLU 13 N -1.22 0.05 0.00 12.44 2.13 -1.26 -0.56 120.64 132.22 1q9c n GLU 13 Ca -0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.74 1q9c n GLU 13 Cb 0.57 -1.40 0.00 0.00 0.27 0.00 0.00 31.44 30.88 1q9c n GLU 13 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1q9c n GLU 14 N -0.90 2.74 0.00 5.31 2.13 -1.26 -4.84 120.64 123.81 1q9c n GLU 14 Ca 0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.83 1q9c n GLU 14 Cb 0.00 -0.76 0.00 0.00 0.27 0.00 0.00 31.44 30.96 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 -1.17 4.67 -0.33 4.31 4.13 -0.31 -4.80 115.26 121.77 1q9c n ASN 15 Ca 0.00 0.00 0.07 0.00 1.68 0.00 0.00 54.58 56.33 1q9c n ASN 15 Cb 0.00 0.63 0.16 0.00 -1.54 0.00 0.00 39.78 39.03 1q9c n ASN 15 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1q9c h ALA 16 N 0.00 0.74 0.00 5.41 0.00 -0.64 0.46 119.26 125.24 1q9c h ALA 16 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1q9c h ALA 16 Cb 0.61 0.65 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1q9c h ALA 16 CO 0.00 -0.43 0.23 -1.35 0.00 0.00 0.00 179.25 177.70 1q9c h PRO 17 N 0.01 0.00 0.00 0.00 0.11 -1.87 -0.03 132.00 130.22 1q9c h PRO 17 Ca 0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.58 1q9c h PRO 17 Cb 0.79 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.90 1q9c h PRO 17 CO -0.92 0.00 -1.49 1.63 -0.21 0.00 0.00 178.00 177.01 1q9c n LYS 18 N -2.18 0.63 -0.03 1.05 5.02 0.16 -4.71 118.16 118.10 1q9c n LYS 18 Ca -0.01 -0.03 -0.06 0.00 -2.02 0.00 0.00 58.31 56.19 1q9c n LYS 18 Cb 0.26 -1.68 -0.02 0.00 -0.02 0.00 0.00 35.03 33.56 1q9c n LYS 18 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1q9c n TRP 19 N -2.49 0.00 -1.69 2.13 7.02 -0.17 -4.83 117.44 117.41 1q9c n TRP 19 Ca -0.02 0.00 -0.61 0.00 -1.02 0.00 0.00 57.50 55.84 1q9c n TRP 19 Cb 0.57 -0.23 -0.09 0.00 -2.42 0.00 0.00 31.31 29.14 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 -3.12 0.65 -1.06 -0.99 5.12 -0.38 0.59 116.66 117.47 1q9c n ARG 20 Ca -0.12 0.24 -0.02 0.00 -1.93 0.00 0.00 57.85 56.01 1q9c n ARG 20 Cb 0.60 -1.86 -0.01 0.00 -1.16 0.00 0.00 32.46 30.03 1q9c n ARG 20 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1q9c n GLY 21 N 4.39 0.54 0.13 -0.13 0.00 -1.26 -4.92 105.19 103.94 1q9c n GLY 21 Ca 0.30 -0.42 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 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 0.61 0.07 0.99 5.85 -0.18 -3.38 115.31 119.27 1q9c h LEU 22 Ca -0.04 -0.69 -0.33 0.00 0.84 0.00 0.00 57.88 57.66 1q9c h LEU 22 Cb 0.23 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 1q9c h LEU 22 CO 0.06 1.55 -1.86 0.18 -0.34 0.00 0.00 178.44 178.03 1q9c n LEU 23 N -3.60 1.87 -0.33 2.25 4.77 -1.26 -4.42 117.00 116.28 1q9c n LEU 23 Ca -0.14 0.31 0.02 0.00 -0.03 0.00 0.00 56.01 56.17 1q9c n LEU 23 Cb 1.07 -0.56 0.08 0.00 -2.33 0.00 0.00 43.42 41.68 1q9c n LEU 23 CO 0.56 0.65 0.55 0.52 -1.33 0.00 0.00 177.39 178.34 1q9c n VAL 24 N -3.30 -0.41 -0.05 4.08 0.31 -1.26 -0.52 118.33 117.19 1q9c n VAL 24 Ca -0.25 2.03 -0.09 0.00 -0.01 0.00 0.00 64.34 66.02 1q9c n VAL 24 Cb 1.05 -2.74 -0.02 0.00 -0.91 0.00 0.00 33.84 31.21 1q9c n VAL 24 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1q9c h PRO 25 N 0.00 -0.27 -0.42 5.55 0.11 -1.77 -0.50 132.00 134.70 1q9c h PRO 25 Ca 0.37 0.02 -0.09 0.00 0.11 0.00 0.00 66.00 66.41 1q9c h PRO 25 Cb 0.59 0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.74 1q9c h PRO 25 CO -0.89 -0.18 -0.10 0.00 -0.21 0.00 0.00 178.00 176.62 1q9c h ALA 26 N 0.70 1.03 -0.89 -0.75 0.00 -1.17 -2.96 119.26 115.22 1q9c h ALA 26 Ca 0.13 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.75 1q9c h ALA 26 Cb 0.50 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 1q9c h ALA 26 CO -0.41 0.59 0.59 -0.07 0.00 0.00 0.00 179.25 179.95 1q9c h LEU 27 N 0.68 1.01 -0.98 0.00 3.38 0.08 -0.98 115.31 118.49 1q9c h LEU 27 Ca 0.12 -0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.17 1q9c h LEU 27 Cb 0.57 -0.25 -0.08 0.00 0.09 0.00 0.00 40.66 40.99 1q9c h LEU 27 CO 0.04 0.72 0.62 0.11 0.09 0.00 0.00 178.44 180.01 1q9c h LYS 28 N 1.19 0.99 -0.69 1.13 1.57 -0.95 0.25 116.57 120.06 1q9c h LYS 28 Ca 0.33 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 59.03 1q9c h LYS 28 Cb -0.11 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 31.95 1q9c h LYS 28 CO -0.08 0.66 0.33 0.87 -0.57 0.00 0.00 179.45 180.65 1q9c h LYS 29 N 1.02 1.00 0.25 3.15 1.79 -1.21 -2.18 116.57 120.39 1q9c h LYS 29 Ca 0.47 -0.15 -0.01 0.00 -2.18 0.00 0.00 60.65 58.78 1q9c h LYS 29 Cb 0.38 -0.18 0.00 0.00 -1.58 0.00 0.00 32.23 30.85 1q9c h LYS 29 CO -0.24 0.79 -0.12 0.28 -1.08 0.00 0.00 179.45 179.08 1q9c h VAL 30 N 0.96 0.80 -0.84 0.50 2.07 -0.17 -2.79 116.25 116.79 1q9c h VAL 30 Ca 0.24 -0.34 0.13 0.00 0.82 0.00 0.00 66.70 67.55 1q9c h VAL 30 Cb 0.12 1.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.83 1q9c h VAL 30 CO -0.03 0.07 0.55 -0.61 0.02 0.00 0.00 177.57 177.57 1q9c h GLN 31 N -0.51 0.64 0.00 1.57 4.15 -1.03 0.48 115.11 120.42 1q9c h GLN 31 Ca -0.03 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.35 1q9c h GLN 31 Cb 0.38 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.92 1q9c h GLN 31 CO 0.06 0.43 0.00 0.41 -1.93 0.00 0.00 178.83 177.79 1q9c n GLY 32 N -1.45 -0.94 0.13 2.39 0.00 -0.82 -0.61 105.19 103.88 1q9c n GLY 32 Ca 0.16 -0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1q9c n GLY 32 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1q9c n GLN 33 N -1.39 0.63 0.03 1.61 6.02 0.16 -3.59 117.38 120.86 1q9c n GLN 33 Ca 0.06 0.35 0.13 0.00 -0.01 0.00 0.00 57.00 57.53 1q9c n GLN 33 Cb 0.16 -1.64 0.32 0.00 1.02 0.00 0.00 30.24 30.10 1q9c n GLN 33 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1q9c n VAL 34 N -3.97 0.18 -2.89 5.09 0.24 -0.98 -4.56 118.33 111.45 1q9c n VAL 34 Ca -0.40 -0.12 -0.09 0.00 -2.04 0.00 0.00 64.34 61.69 1q9c n VAL 34 Cb 0.87 -0.12 -0.01 0.00 -1.47 0.00 0.00 33.84 33.11 1q9c n VAL 34 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1q9c n HIS 35 N -1.78 -3.24 -0.16 6.34 8.25 0.22 -4.94 115.22 119.91 1q9c n HIS 35 Ca 0.05 -1.77 -0.05 0.00 -0.26 0.00 0.00 57.72 55.69 1q9c n HIS 35 Cb 0.38 1.24 0.04 0.00 1.12 0.00 0.00 29.99 32.76 1q9c n HIS 35 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1q9c h PRO 36 N 5.10 0.54 0.17 -0.41 0.11 -1.72 -3.25 132.00 132.54 1q9c h PRO 36 Ca 0.10 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.17 1q9c h PRO 36 Cb 1.07 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 1q9c h PRO 36 CO 0.09 0.35 -0.15 1.15 -0.21 0.00 0.00 178.00 179.24 1q9c h THR 37 N 0.55 0.00 -2.05 -1.15 2.02 -1.92 -3.44 112.91 106.91 1q9c h THR 37 Ca 0.20 0.00 -0.61 0.00 0.77 0.00 0.00 66.41 66.77 1q9c h THR 37 Cb 0.05 0.00 0.16 0.00 -1.74 0.00 0.00 68.15 66.62 1q9c h THR 37 CO -0.11 0.00 -0.79 0.18 0.37 0.00 0.00 175.52 175.17 1q9c n LEU 38 N -3.18 -1.91 -4.94 2.58 4.77 -1.23 -4.98 117.00 108.11 1q9c n LEU 38 Ca -0.04 0.80 -0.22 0.00 -0.03 0.00 0.00 56.01 56.52 1q9c n LEU 38 Cb 0.14 -0.97 -0.03 0.00 -2.33 0.00 0.00 43.42 40.24 1q9c n LEU 38 CO 0.08 -3.87 -0.07 -1.61 -1.33 0.00 0.00 177.39 170.60 1q9c s GLU 39 N -1.27 3.35 0.35 3.23 2.02 -0.51 -4.92 118.70 120.95 1q9c s GLU 39 Ca 0.61 -0.79 -0.21 0.00 0.02 0.00 0.00 54.97 54.60 1q9c s GLU 39 Cb -0.58 -2.85 -0.10 0.00 0.10 0.00 0.00 34.13 30.70 1q9c s GLU 39 CO 0.61 0.44 0.87 -1.12 0.02 0.00 0.00 175.26 176.08 1q9c s SER 40 N -3.85 7.04 -0.14 -0.19 0.01 -1.26 -3.47 113.70 111.84 1q9c s SER 40 Ca 0.34 1.61 -0.01 0.00 1.31 0.00 0.00 55.95 59.20 1q9c s SER 40 Cb -0.09 -2.50 0.04 0.00 0.21 0.00 0.00 66.02 63.68 1q9c s SER 40 CO 0.28 -0.19 -0.01 0.21 0.41 0.00 0.00 173.24 173.94 1q9c s ASN 41 N -1.95 2.37 0.18 2.44 3.84 -1.26 -4.94 114.94 115.61 1q9c s ASN 41 Ca 0.54 -0.48 -0.13 0.00 0.21 0.00 0.00 52.86 53.00 1q9c s ASN 41 Cb -0.13 -0.66 0.08 0.00 -0.55 0.00 0.00 41.25 39.99 1q9c s ASN 41 CO 0.18 -0.21 1.82 0.44 -2.79 0.00 0.00 177.10 176.54 1q9c h ASP 42 N 8.23 0.70 0.14 -4.21 3.32 -1.96 0.14 116.42 122.78 1q9c h ASP 42 Ca -0.21 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 56.77 1q9c h ASP 42 Cb 1.12 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 40.49 1q9c h ASP 42 CO 0.34 0.55 -0.06 -0.78 -1.72 0.00 0.00 179.24 177.56 1q9c h ASP 43 N 0.79 0.00 0.09 6.45 3.58 -1.96 -2.13 116.42 123.24 1q9c h ASP 43 Ca 0.21 0.00 -0.33 0.00 0.42 0.00 0.00 57.03 57.33 1q9c h ASP 43 Cb -0.03 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.00 1q9c h ASP 43 CO -0.04 0.06 -1.81 0.00 -2.88 0.00 0.00 179.24 174.57 1q9c n ALA 44 N -2.35 0.86 1.10 -0.78 0.00 -0.85 -3.84 120.51 114.67 1q9c n ALA 44 Ca -0.03 -0.57 0.09 0.00 0.00 0.00 0.00 53.44 52.94 1q9c n ALA 44 Cb 0.15 -0.64 0.54 0.00 0.00 0.00 0.00 19.45 19.50 1q9c n ALA 44 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1q9c n LEU 45 N -3.75 0.00 -0.04 0.00 4.77 0.43 -1.47 117.00 116.94 1q9c n LEU 45 Ca -0.32 0.06 -0.05 0.00 -0.03 0.00 0.00 56.01 55.67 1q9c n LEU 45 Cb 0.95 -0.06 -0.14 0.00 -2.33 0.00 0.00 43.42 41.84 1q9c n LEU 45 CO 0.36 -0.03 -0.77 1.67 -1.33 0.00 0.00 177.39 177.30 1q9c n GLN 46 N -1.06 0.66 0.05 3.23 7.27 -0.82 -3.06 117.38 123.65 1q9c n GLN 46 Ca 0.13 0.10 -0.09 0.00 0.07 0.00 0.00 57.00 57.21 1q9c n GLN 46 Cb 0.08 -1.65 0.05 0.00 2.41 0.00 0.00 30.24 31.13 1q9c n GLN 46 CO 0.00 0.00 0.00 -0.92 0.07 0.00 0.00 177.06 176.21 1q9c h TYR 47 N 0.00 0.55 -0.45 3.69 3.20 -1.36 -1.86 116.97 120.74 1q9c h TYR 47 Ca -0.34 -0.23 -0.13 0.00 3.14 0.00 0.00 58.73 61.18 1q9c h TYR 47 Cb 1.91 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 40.07 1q9c h TYR 47 CO 0.00 0.96 -0.21 0.28 -1.64 0.00 0.00 178.16 177.55 1q9c h VAL 48 N 0.29 1.27 -0.36 1.81 2.07 -1.58 -2.07 116.25 117.68 1q9c h VAL 48 Ca -0.02 -1.36 0.01 0.00 0.82 0.00 0.00 66.70 66.15 1q9c h VAL 48 Cb 1.23 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 32.16 1q9c h VAL 48 CO 0.12 0.47 0.22 -0.08 0.02 0.00 0.00 177.57 178.31 1q9c h GLU 49 N 0.78 0.44 -0.73 1.57 4.81 -1.43 0.39 114.58 120.41 1q9c h GLU 49 Ca 0.10 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.34 1q9c h GLU 49 Cb 0.78 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 30.02 1q9c h GLU 49 CO 0.06 0.29 0.46 0.93 -0.73 0.00 0.00 179.01 180.02 1q9c h GLU 50 N 0.45 0.87 -0.09 1.92 5.08 -1.19 0.21 114.58 121.83 1q9c h GLU 50 Ca 0.14 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1q9c h GLU 50 Cb -0.01 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.04 1q9c h GLU 50 CO -0.06 0.57 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.43 1q9c h LEU 51 N 0.89 0.19 -2.18 1.33 3.38 -0.75 -1.16 115.31 117.01 1q9c h LEU 51 Ca 0.29 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1q9c h LEU 51 Cb 0.01 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1q9c h LEU 51 CO -0.11 0.54 -0.05 0.40 0.09 0.00 0.00 178.44 179.31 1q9c h ILE 52 N -0.16 0.69 0.14 1.22 1.08 0.02 -1.88 117.51 118.62 1q9c h ILE 52 Ca 0.02 -0.18 -0.19 0.00 -0.39 0.00 0.00 64.86 64.11 1q9c h ILE 52 Cb 0.46 1.11 0.02 0.00 -3.07 0.00 0.00 36.82 35.34 1q9c h ILE 52 CO 0.01 0.05 -0.84 -0.07 -0.69 0.00 0.00 178.15 176.60 1q9c h LEU 53 N 0.00 0.51 -2.77 1.44 3.38 -0.76 -1.78 115.31 115.33 1q9c h LEU 53 Ca -0.00 -0.93 -0.00 0.00 0.09 0.00 0.00 57.88 57.04 1q9c h LEU 53 Cb 0.11 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 1q9c h LEU 53 CO 0.01 1.40 -0.00 1.56 0.09 0.00 0.00 178.44 181.50 1q9c h GLN 54 N -0.31 0.00 0.07 1.13 4.20 -0.76 0.20 115.11 119.65 1q9c h GLN 54 Ca -0.14 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.43 1q9c h GLN 54 Cb 1.65 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.44 1q9c h GLN 54 CO 0.16 0.00 -0.62 1.25 -0.67 0.00 0.00 178.83 178.95 1q9c h LEU 55 N 0.00 0.23 -1.37 1.46 5.85 -1.32 -3.26 115.31 116.90 1q9c h LEU 55 Ca -0.00 -0.92 0.13 0.00 0.84 0.00 0.00 57.88 57.94 1q9c h LEU 55 Cb 0.07 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 40.97 1q9c h LEU 55 CO 0.00 1.28 0.54 0.25 -0.34 0.00 0.00 178.44 180.17 1q9c h LEU 56 N -0.66 0.59 -1.50 2.25 5.85 -0.13 0.25 115.31 121.95 1q9c h LEU 56 Ca -0.13 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1q9c h LEU 56 Cb 1.38 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.32 1q9c h LEU 56 CO 0.05 0.31 0.00 -3.20 -0.34 0.00 0.00 178.44 175.26 1q9c n ASN 57 N -4.53 0.69 0.00 1.25 5.15 0.54 -2.06 115.26 116.30 1q9c n ASN 57 Ca 0.16 -0.69 0.00 0.00 -0.60 0.00 0.00 54.58 53.45 1q9c n ASN 57 Cb 0.45 -0.17 0.00 0.00 -0.53 0.00 0.00 39.78 39.53 1q9c n ASN 57 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1q9c n LEU 59 N 0.58 0.00 -0.00 1.20 4.77 0.86 -2.03 117.00 122.38 1q9c n LEU 59 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.04 1q9c n LEU 59 Cb 0.13 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.13 1q9c n LEU 59 CO 0.00 0.00 -0.29 0.00 -1.33 0.00 0.00 177.39 175.77 1q9c h GLN 61 N 0.00 0.49 -0.61 0.00 4.15 -1.70 0.20 115.11 117.64 1q9c h GLN 61 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1q9c h GLN 61 Cb 0.43 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.01 1q9c h GLN 61 CO 0.00 0.33 0.00 0.00 -1.93 0.00 0.00 178.83 177.23 1q9c n ALA 62 N -2.40 2.00 -3.61 3.38 0.00 -1.26 -4.85 120.51 113.76 1q9c n ALA 62 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.31 1q9c n ALA 62 Cb 0.22 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 18.68 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 0.13 -0.72 -1.70 0.00 6.02 0.70 -4.76 117.38 117.05 1q9c n GLN 63 Ca 0.00 0.11 -0.42 0.00 -0.01 0.00 0.00 57.00 56.68 1q9c n GLN 63 Cb 0.15 -1.13 -0.03 0.00 1.02 0.00 0.00 30.24 30.25 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 -5.13 4.14 -0.02 -1.09 0.02 -1.26 -4.87 135.00 126.79 1q9c s PRO 64 Ca 0.15 2.58 0.18 0.00 0.02 0.00 0.00 61.00 63.93 1q9c s PRO 64 Cb -0.08 -4.14 -0.27 0.00 0.02 0.00 0.00 34.50 30.03 1q9c s PRO 64 CO 0.54 -0.94 0.41 0.54 -0.33 0.00 0.00 177.00 177.22 1q9c n ARG 65 N 7.47 0.58 -4.47 5.54 1.74 -1.26 -4.99 116.66 121.27 1q9c n ARG 65 Ca 0.20 -0.15 -0.23 0.00 -0.77 0.00 0.00 57.85 56.90 1q9c n ARG 65 Cb 0.41 -1.41 -0.10 0.00 -1.02 0.00 0.00 32.46 30.34 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 -3.95 2.45 0.21 0.55 1.04 -1.26 -4.53 113.70 108.21 1q9c s SER 66 Ca -0.06 -1.49 -0.09 0.00 0.48 0.00 0.00 55.95 54.80 1q9c s SER 66 Cb 0.11 0.16 0.15 0.00 0.10 0.00 0.00 66.02 66.54 1q9c s SER 66 CO 0.73 -0.74 1.78 0.00 0.98 0.00 0.00 173.24 176.00 1q9c h ALA 67 N 2.01 0.99 -0.01 5.32 0.00 -1.94 -2.90 119.26 122.72 1q9c h ALA 67 Ca -0.39 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.18 1q9c h ALA 67 Cb 1.26 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1q9c h ALA 67 CO 0.64 0.58 -0.78 1.03 0.00 0.00 0.00 179.25 180.72 1q9c h SER 68 N 1.09 0.20 -1.02 0.00 0.87 -1.97 -3.27 113.55 109.45 1q9c h SER 68 Ca 0.26 -0.15 0.25 0.00 -1.23 0.00 0.00 61.79 60.92 1q9c h SER 68 Cb 0.16 -0.06 -0.11 0.00 -0.44 0.00 0.00 62.40 61.96 1q9c h SER 68 CO -0.03 0.90 0.63 0.44 -0.53 0.00 0.00 176.83 178.25 1q9c h ASP 69 N 0.10 0.58 -0.10 6.23 3.32 -1.91 -1.28 116.42 123.34 1q9c h ASP 69 Ca -0.03 0.10 -0.11 0.00 0.02 0.00 0.00 57.03 57.02 1q9c h ASP 69 Cb 1.37 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.94 1q9c h ASP 69 CO 0.12 0.12 -0.35 0.58 -1.72 0.00 0.00 179.24 177.99 1q9c h VAL 70 N 0.51 1.39 -0.77 -1.35 2.07 -1.63 -3.24 116.25 113.23 1q9c h VAL 70 Ca 0.61 -1.68 0.15 0.00 0.82 0.00 0.00 66.70 66.60 1q9c h VAL 70 Cb 1.32 2.18 -0.10 0.00 -1.52 0.00 0.00 31.29 33.16 1q9c h VAL 70 CO -0.37 0.50 0.29 -0.08 0.02 0.00 0.00 177.57 177.93 1q9c h GLU 71 N -0.01 0.40 0.00 1.57 4.81 -1.35 0.17 114.58 120.17 1q9c h GLU 71 Ca -0.01 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1q9c h GLU 71 Cb 0.98 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.26 1q9c h GLU 71 CO 0.07 0.27 -0.21 0.93 -0.73 0.00 0.00 179.01 179.34 1q9c h GLU 72 N 0.41 0.00 0.00 1.92 5.08 -1.56 -1.64 114.58 118.80 1q9c h GLU 72 Ca 0.43 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.60 1q9c h GLU 72 Cb 0.68 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 1q9c h GLU 72 CO -0.43 0.21 -0.86 -0.09 -1.00 0.00 0.00 179.01 176.83 1q9c h ARG 73 N 0.00 0.12 0.00 2.33 9.65 -0.72 -3.10 114.38 122.65 1q9c h ARG 73 Ca -0.00 -0.13 -0.24 0.00 -1.10 0.00 0.00 59.98 58.51 1q9c h ARG 73 Cb 0.47 0.04 0.01 0.00 -1.39 0.00 0.00 29.97 29.10 1q9c h ARG 73 CO 0.03 0.91 -0.97 0.28 2.80 0.00 0.00 179.97 183.01 1q9c h VAL 74 N 0.06 1.37 0.00 0.20 2.07 -0.82 -2.85 116.25 116.29 1q9c h VAL 74 Ca -0.03 -2.41 0.00 0.00 0.82 0.00 0.00 66.70 65.07 1q9c h VAL 74 Cb 1.50 2.42 0.00 0.00 -1.52 0.00 0.00 31.29 33.69 1q9c h VAL 74 CO 0.12 0.73 0.00 1.67 0.02 0.00 0.00 177.57 180.11 1q9c n GLN 75 N -3.77 0.00 -0.00 1.57 -0.06 -0.66 -1.04 117.38 113.42 1q9c n GLN 75 Ca -0.08 0.22 0.06 0.00 -2.00 0.00 0.00 57.00 55.20 1q9c n GLN 75 Cb 0.85 -1.50 -0.08 0.00 -4.06 0.00 0.00 30.24 25.45 1q9c n GLN 75 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1q9c n LYS 76 N -1.50 1.46 -0.04 3.69 5.02 -1.18 -4.75 118.16 120.86 1q9c n LYS 76 Ca 0.04 -0.07 -0.06 0.00 -2.02 0.00 0.00 58.31 56.20 1q9c n LYS 76 Cb 0.19 -1.19 -0.04 0.00 -0.02 0.00 0.00 35.03 33.97 1q9c n LYS 76 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1q9c n SER 77 N -1.67 3.23 -4.65 4.39 3.41 -1.08 -4.99 113.62 112.27 1q9c n SER 77 Ca -0.00 -0.04 -0.43 0.00 -0.26 0.00 0.00 58.87 58.14 1q9c n SER 77 Cb 0.26 -0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.05 1q9c n SER 77 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1q9c s PHE 78 N -2.17 2.22 0.95 7.33 0.40 -0.21 -5.00 117.98 121.50 1q9c s PHE 78 Ca -0.11 0.49 -0.15 0.00 -0.60 0.00 0.00 56.93 56.56 1q9c s PHE 78 Cb 0.03 -3.84 0.23 0.00 0.51 0.00 0.00 43.02 39.95 1q9c s PHE 78 CO 0.19 -3.07 0.51 -2.30 0.70 0.00 0.00 175.22 171.26 1q9c n PRO 79 N 7.16 -2.98 -3.93 0.24 -0.02 -1.26 -4.00 135.00 130.21 1q9c n PRO 79 Ca 0.17 -0.86 -0.35 0.00 -2.02 0.00 0.00 63.50 60.43 1q9c n PRO 79 Cb 0.44 -1.27 -0.10 0.00 -0.02 0.00 0.00 33.50 32.56 1q9c n PRO 79 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1q9c s HIS 80 N -1.73 3.25 0.10 6.00 2.46 -1.26 -1.48 115.29 122.63 1q9c s HIS 80 Ca 0.40 0.06 -0.31 0.00 0.47 0.00 0.00 55.06 55.68 1q9c s HIS 80 Cb -0.07 -2.12 -0.12 0.00 -0.13 0.00 0.00 32.58 30.15 1q9c s HIS 80 CO 0.33 0.11 1.60 -1.35 -2.47 0.00 0.00 174.74 172.96 1q9c h PRO 81 N 6.92 -0.68 0.00 2.88 0.11 -2.01 -3.49 132.00 135.72 1q9c h PRO 81 Ca -0.37 0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1q9c h PRO 81 Cb 1.17 0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1q9c h PRO 81 CO 0.69 -0.45 0.00 -0.89 -0.21 0.00 0.00 178.00 177.14 1q9c n ILE 82 N -5.47 0.00 -0.27 4.15 5.41 -1.24 -0.94 119.36 121.00 1q9c n ILE 82 Ca -0.08 0.19 -0.05 0.00 1.00 0.00 0.00 62.75 63.81 1q9c n ILE 82 Cb 0.38 -0.25 -0.03 0.00 -0.71 0.00 0.00 39.64 39.03 1q9c n ILE 82 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1q9c n ASP 83 N -2.02 -0.59 0.37 4.38 5.68 -0.55 0.51 116.55 124.33 1q9c n ASP 83 Ca 0.00 1.16 -0.18 0.00 -0.50 0.00 0.00 54.79 55.27 1q9c n ASP 83 Cb 0.00 -0.20 -0.09 0.00 -1.14 0.00 0.00 41.12 39.69 1q9c n ASP 83 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 1q9c h LYS 84 N 0.00 -0.88 0.07 0.11 1.57 -1.31 -1.94 116.57 114.19 1q9c h LYS 84 Ca 0.15 0.06 0.02 0.00 -1.87 0.00 0.00 60.65 59.01 1q9c h LYS 84 Cb 0.32 0.20 -0.05 0.00 0.08 0.00 0.00 32.23 32.78 1q9c h LYS 84 CO -0.63 -0.59 -0.49 -1.49 -0.57 0.00 0.00 179.45 175.68 1q9c h TRP 85 N -0.92 -1.41 -0.24 -1.35 -0.00 -0.43 -1.67 115.95 109.93 1q9c h TRP 85 Ca -0.09 0.04 0.04 0.00 -0.00 0.00 0.00 58.89 58.88 1q9c h TRP 85 Cb 0.71 0.61 -0.07 0.00 -0.00 0.00 0.00 29.16 30.40 1q9c h TRP 85 CO -0.03 -0.56 -0.52 0.00 -0.00 0.00 0.00 178.44 177.34 1q9c h ALA 86 N -0.34 -0.76 -0.88 1.49 0.00 0.06 -0.40 119.26 118.42 1q9c h ALA 86 Ca 0.02 -0.02 0.21 0.00 0.00 0.00 0.00 54.91 55.11 1q9c h ALA 86 Cb 0.72 0.99 -0.12 0.00 0.00 0.00 0.00 17.79 19.38 1q9c h ALA 86 CO -0.30 -1.03 0.39 0.82 0.00 0.00 0.00 179.25 179.12 1q9c h ILE 87 N -0.49 0.51 0.40 0.00 2.04 -1.16 0.39 117.51 119.19 1q9c h ILE 87 Ca 0.06 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1q9c h ILE 87 Cb 0.64 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1q9c h ILE 87 CO -0.49 0.08 -0.28 0.00 0.00 0.00 0.00 178.15 177.46 1q9c h ALA 88 N 1.69 -0.66 -0.62 1.87 0.00 -0.15 0.39 119.26 121.78 1q9c h ALA 88 Ca 0.54 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.38 1q9c h ALA 88 Cb 0.99 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 19.09 1q9c h ALA 88 CO -0.51 -0.89 0.34 0.22 0.00 0.00 0.00 179.25 178.42 1q9c h ASP 89 N -0.66 0.51 0.63 0.00 -0.00 0.07 0.27 116.42 117.24 1q9c h ASP 89 Ca -0.04 0.03 -0.03 0.00 -0.00 0.00 0.00 57.03 56.99 1q9c h ASP 89 Cb 0.56 -0.07 -0.00 0.00 -0.00 0.00 0.00 39.33 39.81 1q9c h ASP 89 CO 0.02 0.34 -0.38 0.00 -0.00 0.00 0.00 179.24 179.21 1q9c h ALA 90 N 1.32 -0.97 -0.43 -0.78 0.00 0.10 0.20 119.26 118.70 1q9c h ALA 90 Ca 0.28 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.05 1q9c h ALA 90 Cb 0.16 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1q9c h ALA 90 CO -0.17 -1.06 0.29 1.96 0.00 0.00 0.00 179.25 180.27 1q9c h GLN 91 N -0.95 0.33 0.00 0.00 4.20 0.05 0.49 115.11 119.23 1q9c h GLN 91 Ca -0.08 -0.02 -0.08 0.00 0.06 0.00 0.00 58.65 58.54 1q9c h GLN 91 Cb 0.77 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.46 1q9c h GLN 91 CO 0.08 0.22 -0.37 1.03 -0.67 0.00 0.00 178.83 179.13 1q9c h SER 92 N 0.34 0.00 -0.30 1.46 0.87 0.21 -3.18 113.55 112.94 1q9c h SER 92 Ca 0.19 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.57 1q9c h SER 92 Cb 0.32 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1q9c h SER 92 CO -0.04 0.37 -0.51 0.00 -0.53 0.00 0.00 176.83 176.11 1q9c h ALA 93 N 1.63 0.47 -0.33 6.23 0.00 0.17 -3.15 119.26 124.28 1q9c h ALA 93 Ca -0.00 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.31 1q9c h ALA 93 Cb 0.90 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 1q9c h ALA 93 CO 0.05 0.66 0.12 0.44 0.00 0.00 0.00 179.25 180.52 1q9c n ILE 94 N -4.03 1.52 0.08 0.00 -5.35 -1.11 -3.67 119.36 106.80 1q9c n ILE 94 Ca -0.04 -0.71 0.01 0.00 -0.27 0.00 0.00 62.75 61.74 1q9c n ILE 94 Cb 0.61 -0.55 0.00 0.00 -1.74 0.00 0.00 39.64 37.96 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 0.07 1.14 -2.66 6.28 1.02 -1.19 -5.09 120.64 120.22 1q9c n GLU 95 Ca 0.18 -0.45 -0.05 0.00 -0.02 0.00 0.00 57.16 56.82 1q9c n GLU 95 Cb 0.81 -0.92 -0.04 0.00 -0.02 0.00 0.00 31.44 31.27 1q9c n GLU 95 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1q9c n LYS 96 N -0.19 -4.25 0.00 3.49 5.02 -1.24 -5.12 118.16 115.86 1q9c n LYS 96 Ca 0.01 3.24 0.00 0.00 -2.02 0.00 0.00 58.31 59.54 1q9c n LYS 96 Cb 0.04 -4.78 0.00 0.00 -0.02 0.00 0.00 35.03 30.27 1q9c n LYS 96 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1q9c n ARG 99 N 1.68 0.00 0.12 1.97 0.63 -1.26 -5.16 116.66 114.64 1q9c n ARG 99 Ca -0.35 0.00 -0.05 0.00 -0.92 0.00 0.00 57.85 56.53 1q9c n ARG 99 Cb 0.55 0.00 -0.02 0.00 0.45 0.00 0.00 32.46 33.44 1q9c n ARG 99 CO 0.00 0.00 0.00 0.07 -2.51 0.00 0.00 177.63 175.19 1q9c h ARG 100 N 0.00 -0.33 -4.43 -0.14 0.11 -2.06 -3.40 114.38 104.13 1q9c h ARG 100 Ca 0.00 0.02 -0.71 0.00 0.10 0.00 0.00 59.98 59.39 1q9c h ARG 100 Cb 0.00 0.07 -0.32 0.00 1.11 0.00 0.00 29.97 30.84 1q9c h ARG 100 CO 0.00 -0.22 -0.49 -0.80 0.10 0.00 0.00 179.97 178.56 1q9c s ASN 101 N -3.51 5.45 0.99 0.08 0.01 -1.26 -5.09 114.94 111.61 1q9c s ASN 101 Ca -0.05 -1.86 -0.18 0.00 -0.71 0.00 0.00 52.86 50.05 1q9c s ASN 101 Cb 0.00 -1.91 0.01 0.00 0.41 0.00 0.00 41.25 39.76 1q9c s ASN 101 CO 0.15 -0.58 -0.44 -2.65 -1.51 0.00 0.00 177.10 172.07 1q9c n PRO 102 N 4.76 -1.08 -1.74 -0.60 -0.02 -1.26 -4.89 135.00 130.17 1q9c n PRO 102 Ca -0.06 -0.31 -0.36 0.00 -2.02 0.00 0.00 63.50 60.75 1q9c n PRO 102 Cb 0.41 -1.34 0.07 0.00 -0.02 0.00 0.00 33.50 32.62 1q9c n PRO 102 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1q9c s LEU 103 N 3.12 3.53 0.00 2.45 1.43 -1.26 -4.96 118.68 122.99 1q9c s LEU 103 Ca 0.38 2.50 0.00 0.00 -1.03 0.00 0.00 54.13 55.99 1q9c s LEU 103 Cb -0.02 -4.61 0.00 0.00 0.03 0.00 0.00 46.19 41.60 1q9c s LEU 103 CO 0.51 -1.97 0.00 -1.20 0.23 0.00 0.00 176.35 173.92 1q9c n SER 104 N -2.02 2.63 -4.77 2.29 7.64 -1.26 -5.08 113.62 113.05 1q9c n SER 104 Ca 0.15 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.65 1q9c n SER 104 Cb 0.49 0.01 -0.01 0.00 -1.01 0.00 0.00 64.21 63.70 1q9c n SER 104 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1q9c s LEU 105 N -4.24 4.12 -0.87 -3.43 1.02 -1.26 -4.72 118.68 109.30 1q9c s LEU 105 Ca 0.00 2.44 -0.26 0.00 0.02 0.00 0.00 54.13 56.34 1q9c s LEU 105 Cb 0.00 -4.08 -0.14 0.00 0.02 0.00 0.00 46.19 41.99 1q9c s LEU 105 CO 0.00 -0.87 2.29 -2.84 0.02 0.00 0.00 176.35 174.95 1q9c s PRO 106 N -2.45 1.67 0.10 1.29 0.02 -1.26 -4.77 135.00 129.60 1q9c s PRO 106 Ca 0.60 0.18 -0.13 0.00 0.02 0.00 0.00 61.00 61.67 1q9c s PRO 106 Cb -0.33 -4.87 -0.11 0.00 0.02 0.00 0.00 34.50 29.21 1q9c s PRO 106 CO 0.41 -4.50 1.37 -0.24 -0.33 0.00 0.00 177.00 173.70 1q9c h VAL 107 N 7.42 1.29 0.00 3.83 3.04 -1.99 -1.49 116.25 128.35 1q9c h VAL 107 Ca 0.02 -1.73 0.00 0.00 -1.01 0.00 0.00 66.70 63.98 1q9c h VAL 107 Cb 1.00 1.76 0.00 0.00 -2.01 0.00 0.00 31.29 32.04 1q9c h VAL 107 CO 1.04 0.56 0.00 -0.62 -1.01 0.00 0.00 177.57 177.53 1q9c n GLU 108 N -4.07 0.15 -0.13 4.17 -0.58 -1.26 -1.17 120.64 117.74 1q9c n GLU 108 Ca -0.05 0.48 -0.26 0.00 -0.42 0.00 0.00 57.16 56.91 1q9c n GLU 108 Cb 0.62 -1.85 -0.10 0.00 -0.57 0.00 0.00 31.44 29.53 1q9c n GLU 108 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1q9c n LYS 109 N -2.15 0.60 -0.13 3.49 5.02 -1.15 -4.43 118.16 119.42 1q9c n LYS 109 Ca 0.01 0.22 -0.04 0.00 -2.02 0.00 0.00 58.31 56.48 1q9c n LYS 109 Cb 0.15 -1.49 0.16 0.00 -0.02 0.00 0.00 35.03 33.83 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 -0.67 1.24 -0.23 -0.18 2.04 -1.20 -2.97 117.51 115.54 1q9c h ILE 110 Ca -0.66 -0.95 0.05 0.00 1.00 0.00 0.00 64.86 64.30 1q9c h ILE 110 Cb 1.70 0.78 -0.07 0.00 -0.74 0.00 0.00 36.82 38.49 1q9c h ILE 110 CO -0.32 0.34 -0.44 -0.74 0.00 0.00 0.00 178.15 177.00 1q9c h HIS 111 N 0.79 -1.27 -0.08 1.37 2.76 -1.37 0.20 115.15 117.55 1q9c h HIS 111 Ca 0.16 0.06 -0.02 0.00 -2.20 0.00 0.00 60.37 58.37 1q9c h HIS 111 Cb 0.40 0.59 -0.01 0.00 1.55 0.00 0.00 27.41 29.94 1q9c h HIS 111 CO 0.02 -0.47 -0.05 -1.35 -1.30 0.00 0.00 177.93 174.78 1q9c h PRO 112 N -0.44 0.11 0.00 5.26 0.11 -1.75 -2.04 132.00 133.24 1q9c h PRO 112 Ca 0.09 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.12 1q9c h PRO 112 Cb 0.62 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.70 1q9c h PRO 112 CO -0.47 0.17 -0.34 -0.07 -0.21 0.00 0.00 178.00 177.09 1q9c h LEU 113 N 0.11 0.00 -0.84 2.35 3.38 -0.84 -2.99 115.31 116.48 1q9c h LEU 113 Ca 0.03 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1q9c h LEU 113 Cb 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1q9c h LEU 113 CO 0.01 0.34 -0.43 -0.07 0.09 0.00 0.00 178.44 178.38 1q9c h LEU 114 N 0.00 0.00 0.00 1.67 3.38 0.06 -2.50 115.31 117.92 1q9c h LEU 114 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1q9c h LEU 114 Cb 0.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.61 1q9c h LEU 114 CO 0.04 0.43 0.00 0.29 0.09 0.00 0.00 178.44 179.30 1q9c n LYS 115 N -3.56 0.79 0.00 1.13 5.02 -1.13 -1.83 118.16 118.58 1q9c n LYS 115 Ca -0.00 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.31 1q9c n LYS 115 Cb 0.55 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.09 1q9c n LYS 115 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1q9c n GLU 116 N -0.96 2.31 -0.05 1.97 2.13 -0.95 -4.21 120.64 120.88 1q9c n GLU 116 Ca 0.18 -0.43 -0.05 0.00 0.66 0.00 0.00 57.16 57.52 1q9c n GLU 116 Cb 0.08 -0.91 -0.09 0.00 0.27 0.00 0.00 31.44 30.79 1q9c n GLU 116 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1q9c n VAL 117 N -0.34 0.73 -0.07 6.31 0.31 -0.93 -4.70 118.33 119.64 1q9c n VAL 117 Ca 0.02 -0.47 -0.19 0.00 -0.01 0.00 0.00 64.34 63.68 1q9c n VAL 117 Cb 0.09 -0.62 -0.12 0.00 -0.91 0.00 0.00 33.84 32.27 1q9c n VAL 117 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1q9c h LEU 118 N 0.00 0.07 0.00 7.52 3.38 -1.62 -3.46 115.31 121.21 1q9c h LEU 118 Ca -0.29 -0.72 0.00 0.00 0.09 0.00 0.00 57.88 56.96 1q9c h LEU 118 Cb 1.62 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.34 1q9c h LEU 118 CO 0.02 1.37 0.00 0.61 0.09 0.00 0.00 178.44 180.52 1q9c n GLY 119 N 1.55 1.33 3.83 0.83 0.00 -1.26 -5.08 105.19 106.39 1q9c n GLY 119 Ca -0.24 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.00 0.12 -0.06 1.61 -0.85 -1.26 -5.09 117.35 109.83 1q9c s TYR 120 Ca 0.00 -0.74 -0.21 0.00 -0.52 0.00 0.00 57.07 55.61 1q9c s TYR 120 Cb 0.00 0.81 -0.05 0.00 0.38 0.00 0.00 41.96 43.10 1q9c s TYR 120 CO 0.00 -1.41 0.59 0.21 -1.52 0.00 0.00 175.55 173.42 1q9c s LYS 121 N -2.17 4.35 -0.00 -3.49 2.20 -1.26 -4.61 119.74 114.76 1q9c s LYS 121 Ca 0.18 0.69 0.07 0.00 -0.36 0.00 0.00 55.97 56.55 1q9c s LYS 121 Cb -0.04 -3.40 -0.02 0.00 -1.51 0.00 0.00 37.83 32.86 1q9c s LYS 121 CO 0.10 0.22 -0.23 0.96 -0.36 0.00 0.00 175.35 176.04 1q9c s ILE 122 N 0.33 1.79 1.14 5.43 -4.36 -1.26 -5.05 121.20 119.22 1q9c s ILE 122 Ca 0.31 -1.03 -0.14 0.00 -0.26 0.00 0.00 60.65 59.53 1q9c s ILE 122 Cb -0.17 -1.50 0.24 0.00 1.25 0.00 0.00 42.46 42.28 1q9c s ILE 122 CO 0.15 0.44 0.81 0.47 0.24 0.00 0.00 174.94 177.05 1q9c n ASP 123 N 2.35 -1.72 -0.02 4.36 8.00 -1.26 -4.91 116.55 123.35 1q9c n ASP 123 Ca -0.16 -0.09 -0.13 0.00 0.71 0.00 0.00 54.79 55.12 1q9c n ASP 123 Cb 0.52 -1.22 -0.09 0.00 -0.02 0.00 0.00 41.12 40.32 1q9c n ASP 123 CO 0.00 0.00 0.00 -0.74 -0.39 0.00 0.00 177.20 176.07 1q9c h HIS 124 N -2.48 0.12 -1.21 1.24 2.76 -2.00 -3.11 115.15 110.47 1q9c h HIS 124 Ca -0.58 -0.04 0.35 0.00 -2.20 0.00 0.00 60.37 57.90 1q9c h HIS 124 Cb 1.33 -0.03 -0.08 0.00 1.55 0.00 0.00 27.41 30.19 1q9c h HIS 124 CO 0.27 0.55 0.83 1.96 -1.30 0.00 0.00 177.93 180.23 1q9c h GLN 125 N -0.33 0.14 0.64 5.26 4.20 -1.99 -0.37 115.11 122.66 1q9c h GLN 125 Ca 0.01 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1q9c h GLN 125 Cb 0.52 -0.03 0.01 0.00 0.30 0.00 0.00 27.48 28.28 1q9c h GLN 125 CO 0.01 0.09 -0.31 0.28 -0.67 0.00 0.00 178.83 178.23 1q9c h VAL 126 N 0.14 0.33 0.44 -0.54 2.07 -1.87 0.13 116.25 116.95 1q9c h VAL 126 Ca 0.64 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 68.03 1q9c h VAL 126 Cb 2.16 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 32.28 1q9c h VAL 126 CO -0.16 0.02 -0.52 0.28 0.02 0.00 0.00 177.57 177.21 1q9c h SER 127 N -0.95 -1.45 -0.82 0.57 0.02 -1.17 0.29 113.55 110.05 1q9c h SER 127 Ca -0.09 0.12 0.20 0.00 -0.84 0.00 0.00 61.79 61.19 1q9c h SER 127 Cb 0.69 0.49 -0.13 0.00 0.14 0.00 0.00 62.40 63.58 1q9c h SER 127 CO 0.15 -0.66 0.15 0.58 -1.14 0.00 0.00 176.83 175.91 1q9c h VAL 128 N -0.97 0.35 0.69 2.27 2.07 -1.42 0.48 116.25 119.71 1q9c h VAL 128 Ca -0.05 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 1q9c h VAL 128 Cb 0.86 0.15 0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1q9c h VAL 128 CO -0.11 0.03 -0.33 0.22 0.02 0.00 0.00 177.57 177.41 1q9c h TYR 129 N 0.19 -0.85 -0.38 1.57 3.20 -0.19 -0.18 116.97 120.32 1q9c h TYR 129 Ca 0.49 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.40 1q9c h TYR 129 Cb 0.92 0.28 -0.06 0.00 1.54 0.00 0.00 36.73 39.41 1q9c h TYR 129 CO -0.32 -0.52 0.00 0.82 -1.64 0.00 0.00 178.16 176.50 1q9c h ILE 130 N -0.96 0.72 -0.59 1.81 2.04 0.12 -1.66 117.51 118.98 1q9c h ILE 130 Ca -0.09 -0.04 0.04 0.00 1.00 0.00 0.00 64.86 65.77 1q9c h ILE 130 Cb 0.72 0.61 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 1q9c h ILE 130 CO 0.15 0.02 0.35 0.58 0.00 0.00 0.00 178.15 179.25 1q9c h VAL 131 N 0.11 1.03 -0.22 1.67 2.07 -0.05 -1.77 116.25 119.08 1q9c h VAL 131 Ca 0.18 -0.23 0.05 0.00 0.82 0.00 0.00 66.70 67.52 1q9c h VAL 131 Cb 0.25 0.30 -0.05 0.00 -1.52 0.00 0.00 31.29 30.27 1q9c h VAL 131 CO -0.30 0.12 -0.12 0.00 0.02 0.00 0.00 177.57 177.29 1q9c h ALA 132 N 1.28 0.05 -0.99 1.67 0.00 -0.16 0.77 119.26 121.88 1q9c h ALA 132 Ca 0.25 0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.31 1q9c h ALA 132 Cb 0.07 0.29 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 1q9c h ALA 132 CO -0.13 -0.54 0.64 0.28 0.00 0.00 0.00 179.25 179.50 1q9c h VAL 133 N -0.11 1.08 -0.30 0.00 2.07 -0.91 -0.51 116.25 117.56 1q9c h VAL 133 Ca 0.12 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1q9c h VAL 133 Cb 0.29 -0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 29.87 1q9c h VAL 133 CO -0.28 0.21 0.13 -0.07 0.02 0.00 0.00 177.57 177.57 1q9c h LEU 134 N 1.15 0.41 -0.78 2.57 3.38 -0.35 -2.68 115.31 119.02 1q9c h LEU 134 Ca 0.43 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 1q9c h LEU 134 Cb 0.19 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1q9c h LEU 134 CO -0.17 0.46 0.44 -0.08 0.09 0.00 0.00 178.44 179.17 1q9c h GLU 135 N 0.34 1.08 0.34 1.13 4.81 -0.10 -0.84 114.58 121.34 1q9c h GLU 135 Ca 0.10 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1q9c h GLU 135 Cb 0.17 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.30 1q9c h GLU 135 CO -0.01 0.79 -0.45 -0.92 -0.73 0.00 0.00 179.01 177.69 1q9c h TYR 136 N 1.08 -1.26 -0.93 0.92 3.20 -0.91 0.29 116.97 119.35 1q9c h TYR 136 Ca 0.28 0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.26 1q9c h TYR 136 Cb 0.02 0.51 -0.07 0.00 1.54 0.00 0.00 36.73 38.73 1q9c h TYR 136 CO 0.00 -0.59 0.60 0.82 -1.64 0.00 0.00 178.16 177.35 1q9c h ILE 137 N -0.84 0.97 0.62 1.81 1.08 -1.34 0.33 117.51 120.15 1q9c h ILE 137 Ca -0.03 -0.32 -0.02 0.00 -0.39 0.00 0.00 64.86 64.10 1q9c h ILE 137 Cb 0.77 -0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 34.45 1q9c h ILE 137 CO -0.13 0.17 -0.49 0.28 -0.69 0.00 0.00 178.15 177.29 1q9c h SER 138 N 0.95 -1.30 0.07 1.72 0.02 0.01 0.38 113.55 115.40 1q9c h SER 138 Ca 0.43 0.09 0.02 0.00 -0.84 0.00 0.00 61.79 61.50 1q9c h SER 138 Cb 0.39 0.41 -0.04 0.00 0.14 0.00 0.00 62.40 63.30 1q9c h SER 138 CO -0.19 -0.70 -0.27 0.00 -1.14 0.00 0.00 176.83 174.53 1q9c h ALA 139 N -0.95 -0.42 -0.87 3.77 0.00 0.30 -0.32 119.26 120.76 1q9c h ALA 139 Ca -0.08 -0.03 0.19 0.00 0.00 0.00 0.00 54.91 54.99 1q9c h ALA 139 Cb 0.91 0.45 -0.11 0.00 0.00 0.00 0.00 17.79 19.04 1q9c h ALA 139 CO 0.01 -0.79 0.41 0.22 0.00 0.00 0.00 179.25 179.10 1q9c h ASP 140 N -0.45 0.42 0.32 0.00 1.82 -0.16 0.99 116.42 119.36 1q9c h ASP 140 Ca 0.04 0.13 -0.02 0.00 -0.39 0.00 0.00 57.03 56.79 1q9c h ASP 140 Cb 0.50 0.08 0.00 0.00 0.68 0.00 0.00 39.33 40.59 1q9c h ASP 140 CO -0.19 0.10 -0.15 0.40 -1.61 0.00 0.00 179.24 177.79 1q9c h ILE 141 N 0.50 0.71 0.68 2.25 2.04 0.59 -2.15 117.51 122.13 1q9c h ILE 141 Ca 0.52 -0.33 -0.03 0.00 1.00 0.00 0.00 64.86 66.02 1q9c h ILE 141 Cb 0.88 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 1q9c h ILE 141 CO -0.45 0.07 -0.47 -0.07 0.00 0.00 0.00 178.15 177.22 1q9c h LEU 142 N -0.61 -1.22 -0.98 1.44 3.38 0.36 -1.80 115.31 115.88 1q9c h LEU 142 Ca -0.04 0.08 0.30 0.00 0.09 0.00 0.00 57.88 58.30 1q9c h LEU 142 Cb 0.44 0.37 -0.18 0.00 0.09 0.00 0.00 40.66 41.38 1q9c h LEU 142 CO 0.07 -0.70 0.11 1.17 0.09 0.00 0.00 178.44 179.19 1q9c n LYS 143 N -5.59 -0.07 0.03 1.13 4.81 0.33 0.20 118.16 119.00 1q9c n LYS 143 Ca -0.14 1.45 -0.01 0.00 -0.87 0.00 0.00 58.31 58.74 1q9c n LYS 143 Cb 0.47 -2.35 -0.01 0.00 0.02 0.00 0.00 35.03 33.16 1q9c n LYS 143 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 1q9c h LEU 144 N 0.00 -0.07 -0.91 3.14 5.85 -0.91 -2.35 115.31 120.05 1q9c h LEU 144 Ca 0.64 0.00 0.17 0.00 0.84 0.00 0.00 57.88 59.53 1q9c h LEU 144 Cb 1.41 0.02 -0.10 0.00 0.37 0.00 0.00 40.66 42.35 1q9c h LEU 144 CO -0.89 -0.05 0.50 0.00 -0.34 0.00 0.00 178.44 177.66 1q9c h ALA 145 N -1.95 1.44 -0.80 1.25 0.00 -0.38 0.13 119.26 118.95 1q9c h ALA 145 Ca -0.01 0.09 0.13 0.00 0.00 0.00 0.00 54.91 55.12 1q9c h ALA 145 Cb 0.07 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 1q9c h ALA 145 CO 0.01 -0.10 0.52 0.78 0.00 0.00 0.00 179.25 180.47 1q9c h GLY 146 N 0.66 0.94 0.97 0.00 0.00 0.23 0.11 103.07 105.97 1q9c h GLY 146 Ca 0.52 -0.25 -0.22 0.00 0.00 0.00 0.00 47.33 47.38 1q9c h GLY 146 CO -0.39 0.10 -0.89 -0.57 0.00 0.00 0.00 176.54 174.79 1q9c h ASN 147 N 0.59 0.69 -0.85 0.19 -0.73 -0.22 -2.40 115.58 112.86 1q9c h ASN 147 Ca 0.39 -0.80 0.09 0.00 1.87 0.00 0.00 56.30 57.85 1q9c h ASN 147 Cb 0.68 -0.22 -0.07 0.00 0.27 0.00 0.00 38.32 38.98 1q9c h ASN 147 CO -0.15 1.42 0.49 0.22 -0.37 0.00 0.00 177.43 179.04 1q9c h TYR 148 N 0.05 0.89 0.81 0.67 3.20 -0.35 0.59 116.97 122.84 1q9c h TYR 148 Ca -0.13 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.73 1q9c h TYR 148 Cb 1.60 -0.28 0.01 0.00 1.54 0.00 0.00 36.73 39.60 1q9c h TYR 148 CO 0.14 0.37 -0.39 0.28 -1.64 0.00 0.00 178.16 176.92 1q9c h VAL 149 N 0.83 0.16 -0.68 1.81 2.07 -0.83 -2.75 116.25 116.86 1q9c h VAL 149 Ca 0.41 -0.08 0.16 0.00 0.82 0.00 0.00 66.70 68.01 1q9c h VAL 149 Cb 0.36 0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 30.27 1q9c h VAL 149 CO -0.24 0.01 0.47 -0.09 0.02 0.00 0.00 177.57 177.73 1q9c h ARG 150 N -1.15 0.21 -0.42 1.57 2.43 -0.93 0.21 114.38 116.30 1q9c h ARG 150 Ca -0.11 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 58.96 1q9c h ARG 150 Cb 0.84 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.33 1q9c h ARG 150 CO 0.18 0.14 -0.08 -0.97 -1.51 0.00 0.00 179.97 177.73 1q9c h ASN 151 N 0.21 0.72 -0.06 -3.80 -1.24 -0.66 -2.42 115.58 108.32 1q9c h ASN 151 Ca 0.33 -0.20 0.00 0.00 0.71 0.00 0.00 56.30 57.14 1q9c h ASN 151 Cb 0.99 -0.19 0.00 0.00 0.73 0.00 0.00 38.32 39.85 1q9c h ASN 151 CO -0.06 0.84 0.00 2.30 -1.29 0.00 0.00 177.43 179.21 1q9c n ILE 152 N -4.18 0.05 -2.92 2.57 -5.35 -0.08 -4.99 119.36 104.46 1q9c n ILE 152 Ca 0.02 -0.34 -0.03 0.00 -0.27 0.00 0.00 62.75 62.12 1q9c n ILE 152 Cb 0.34 0.72 0.00 0.00 -1.74 0.00 0.00 39.64 38.97 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 0.52 -1.68 0.00 6.28 5.12 -0.35 -5.00 116.66 121.55 1q9c n ARG 153 Ca 0.18 1.70 0.00 0.00 -1.93 0.00 0.00 57.85 57.80 1q9c n ARG 153 Cb 0.42 -5.57 0.00 0.00 -1.16 0.00 0.00 32.46 26.14 1q9c n ARG 153 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1q9c n HIS 154 N -1.17 0.00 -0.69 -1.55 8.25 -1.17 -5.02 115.22 113.87 1q9c n HIS 154 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1q9c n HIS 154 Cb 0.48 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.59 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 -1.51 0.00 -3.75 4.41 4.02 -1.26 -4.93 117.16 114.14 1q9c n TYR 155 Ca 0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.74 1q9c n TYR 155 Cb 0.25 -1.25 -0.15 0.00 -0.02 0.00 0.00 39.34 38.17 1q9c n TYR 155 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 1q9c s GLU 156 N -0.94 0.03 -0.89 -0.72 2.12 -1.26 -1.43 118.70 115.61 1q9c s GLU 156 Ca 0.00 0.32 -0.18 0.00 0.36 0.00 0.00 54.97 55.47 1q9c s GLU 156 Cb 0.00 -0.23 0.14 0.00 0.26 0.00 0.00 34.13 34.31 1q9c s GLU 156 CO 0.00 -0.18 1.04 0.42 -0.54 0.00 0.00 175.26 176.00 1q9c s ILE 157 N 1.25 4.89 0.88 -3.70 1.01 -1.23 -4.96 121.20 119.34 1q9c s ILE 157 Ca -0.08 -1.69 -0.13 0.00 0.00 0.00 0.00 60.65 58.75 1q9c s ILE 157 Cb -0.12 -4.71 0.13 0.00 0.01 0.00 0.00 42.46 37.76 1q9c s ILE 157 CO -0.05 -1.41 1.17 -0.89 0.00 0.00 0.00 174.94 173.77 1q9c s THR 158 N 2.25 1.99 0.04 2.92 2.01 -1.26 -4.39 115.64 119.20 1q9c s THR 158 Ca 0.29 0.00 -0.26 0.00 0.31 0.00 0.00 61.69 62.03 1q9c s THR 158 Cb -0.07 -2.87 -0.17 0.00 0.01 0.00 0.00 72.50 69.40 1q9c s THR 158 CO -0.08 0.00 1.47 0.50 -0.69 0.00 0.00 174.62 175.82 1q9c h LYS 159 N -1.37 -0.26 -0.26 4.92 3.64 -1.89 -2.33 116.57 119.02 1q9c h LYS 159 Ca -0.48 0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.00 1q9c h LYS 159 Cb 1.32 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.19 1q9c h LYS 159 CO 0.60 -0.02 0.24 0.37 -2.27 0.00 0.00 179.45 178.37 1q9c h GLN 160 N -0.47 0.00 -0.25 1.90 5.75 -1.96 -0.19 115.11 119.89 1q9c h GLN 160 Ca -0.03 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.45 1q9c h GLN 160 Cb 0.36 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.90 1q9c h GLN 160 CO 0.05 0.00 0.06 -0.44 -2.65 0.00 0.00 178.83 175.85 1q9c h ASP 161 N 0.00 0.38 -0.68 -0.69 5.19 -1.79 -2.63 116.42 116.20 1q9c h ASP 161 Ca 0.12 -0.23 -0.06 0.00 -0.62 0.00 0.00 57.03 56.24 1q9c h ASP 161 Cb 0.61 -0.10 -0.03 0.00 0.18 0.00 0.00 39.33 39.99 1q9c h ASP 161 CO -0.00 0.51 0.18 0.40 -3.12 0.00 0.00 179.24 177.21 1q9c h ILE 162 N 0.23 1.26 0.27 0.35 2.04 -0.76 -1.78 117.51 119.11 1q9c h ILE 162 Ca 0.08 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 65.01 1q9c h ILE 162 Cb 0.28 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1q9c h ILE 162 CO 0.00 0.35 -0.31 0.11 0.00 0.00 0.00 178.15 178.30 1q9c h LYS 163 N 1.00 -0.57 0.25 2.37 1.57 -1.28 -3.16 116.57 116.75 1q9c h LYS 163 Ca 0.21 0.04 0.01 0.00 -1.87 0.00 0.00 60.65 59.04 1q9c h LYS 163 Cb 0.34 0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.74 1q9c h LYS 163 CO -0.00 -0.38 -0.39 0.28 -0.57 0.00 0.00 179.45 178.39 1q9c h VAL 164 N -0.59 0.20 0.00 0.50 2.07 -1.49 -2.14 116.25 114.80 1q9c h VAL 164 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1q9c h VAL 164 Cb 0.52 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1q9c h VAL 164 CO -0.06 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.53 1q9c n ALA 165 N -2.75 1.06 0.00 1.67 0.00 -0.67 -2.79 120.51 117.02 1q9c n ALA 165 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1q9c n ALA 165 Cb 0.38 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.98 1q9c n ALA 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q9c n ALA 168 N 0.00 -0.04 -2.35 0.00 0.00 -1.12 -3.88 120.51 113.13 1q9c n ALA 168 Ca 0.00 0.86 -0.43 0.00 0.00 0.00 0.00 53.44 53.87 1q9c n ALA 168 Cb 0.00 -0.41 -0.02 0.00 0.00 0.00 0.00 19.45 19.01 1q9c n ALA 168 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1q9c s ASP 169 N -5.28 6.66 0.45 0.00 -1.08 -1.24 -4.89 116.67 111.29 1q9c s ASP 169 Ca -0.12 1.41 0.25 0.00 -0.52 0.00 0.00 52.55 53.57 1q9c s ASP 169 Cb 0.18 -2.54 0.63 0.00 -1.46 0.00 0.00 42.92 39.74 1q9c s ASP 169 CO 0.61 -1.06 1.71 0.11 0.52 0.00 0.00 175.17 177.07 1q9c h LYS 170 N 9.40 0.00 -0.35 4.34 1.57 -1.96 -3.29 116.57 126.28 1q9c h LYS 170 Ca -0.28 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.43 1q9c h LYS 170 Cb 1.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 1q9c h LYS 170 CO 1.01 0.08 -0.07 0.28 -0.57 0.00 0.00 179.45 180.19 1q9c h VAL 171 N 0.00 1.27 0.00 0.50 2.07 -1.91 0.12 116.25 118.30 1q9c h VAL 171 Ca -0.00 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.41 1q9c h VAL 171 Cb 0.89 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 1q9c h VAL 171 CO 0.01 0.37 0.00 0.18 0.02 0.00 0.00 177.57 178.15 1q9c n LEU 172 N -4.43 2.59 -1.18 2.57 4.77 -1.24 -4.79 117.00 115.29 1q9c n LEU 172 Ca -0.02 -1.28 -0.02 0.00 -0.03 0.00 0.00 56.01 54.67 1q9c n LEU 172 Cb 0.33 -0.45 -0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1q9c n LEU 172 CO 0.41 0.44 -0.01 -0.67 -1.33 0.00 0.00 177.39 176.23 1q9c n ASP 174 N 0.67 -0.28 0.00 -1.43 -0.08 0.41 -4.51 116.55 111.34 1q9c n ASP 174 Ca 0.00 0.06 0.00 0.00 -1.51 0.00 0.00 54.79 53.34 1q9c n ASP 174 Cb 0.41 -0.27 0.00 0.00 2.34 0.00 0.00 41.12 43.59 1q9c n ASP 174 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1q9c n PHE 176 N -0.74 0.00 -1.78 -0.67 3.01 -1.26 -4.95 117.46 111.07 1q9c n PHE 176 Ca 0.00 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.16 1q9c n PHE 176 Cb 0.12 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.53 1q9c n PHE 176 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 1q9c n HIS 177 N 0.00 2.29 0.00 1.38 -0.00 -1.26 -1.71 115.22 115.92 1q9c n HIS 177 Ca 0.00 -1.38 0.00 0.00 0.46 0.00 0.00 57.72 56.80 1q9c n HIS 177 Cb 0.00 -2.37 0.00 0.00 -0.12 0.00 0.00 29.99 27.50 1q9c n HIS 177 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1q9c n GLN 178 N 8.00 0.00 0.00 1.57 10.64 -1.26 -4.94 117.38 131.38 1q9c n GLN 178 Ca 0.46 0.00 0.06 0.00 -1.83 0.00 0.00 57.00 55.69 1q9c n GLN 178 Cb 0.45 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.77 1q9c n GLN 178 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1q9c n ASP 179 N 0.00 0.78 -4.79 2.61 8.00 -0.70 -5.00 116.55 117.46 1q9c n ASP 179 Ca 0.00 -0.89 -0.36 0.00 0.71 0.00 0.00 54.79 54.25 1q9c n ASP 179 Cb 0.00 0.89 -0.06 0.00 -0.02 0.00 0.00 41.12 41.93 1q9c n ASP 179 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1q9c s VAL 180 N -2.09 4.05 0.31 2.53 1.01 -1.13 -4.97 120.40 120.11 1q9c s VAL 180 Ca 0.06 1.60 -0.12 0.00 0.00 0.00 0.00 61.98 63.52 1q9c s VAL 180 Cb 0.10 -3.84 -0.08 0.00 0.00 0.00 0.00 36.38 32.56 1q9c s VAL 180 CO 0.48 0.04 0.68 -0.70 0.00 0.00 0.00 175.10 175.60 1q9c s GLU 181 N -2.34 3.89 0.29 2.72 2.12 -1.26 -5.03 118.70 119.09 1q9c s GLU 181 Ca 0.54 0.50 -0.29 0.00 0.36 0.00 0.00 54.97 56.07 1q9c s GLU 181 Cb -0.19 -2.49 -0.10 0.00 0.26 0.00 0.00 34.13 31.61 1q9c s GLU 181 CO 0.24 0.17 1.39 0.34 -0.54 0.00 0.00 175.26 176.86 1q9c s ASP 182 N -2.49 6.67 0.00 -1.70 -1.08 -1.26 -5.07 116.67 111.74 1q9c s ASP 182 Ca 0.51 2.71 0.00 0.00 -0.52 0.00 0.00 52.55 55.26 1q9c s ASP 182 Cb -0.10 -2.64 0.00 0.00 -1.46 0.00 0.00 42.92 38.72 1q9c s ASP 182 CO 0.21 -0.65 0.35 2.30 0.52 0.00 0.00 175.17 177.91