#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qjk n THR 10 N 0.00 2.58 -0.04 2.61 -1.04 -1.26 -3.97 114.28 113.16 2qjk n THR 10 Ca 0.00 -1.39 -0.08 0.00 -2.04 0.00 0.00 64.05 60.54 2qjk n THR 10 Cb 0.00 -0.44 -0.07 0.00 -1.82 0.00 0.00 70.33 68.01 2qjk n THR 10 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 2qjk h ARG 11 N 2.12 -0.03 -0.09 -2.82 3.08 -2.05 -2.42 114.38 112.17 2qjk h ARG 11 Ca 0.26 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.18 2qjk h ARG 11 Cb 2.16 0.01 0.01 0.00 0.08 0.00 0.00 29.97 32.22 2qjk h ARG 11 CO 0.67 0.48 -0.46 0.07 -1.07 0.00 0.00 179.97 179.66 2qjk h ARG 12 N -0.98 0.46 -0.80 0.04 0.11 -2.01 -3.18 114.38 108.02 2qjk h ARG 12 Ca -0.00 -0.38 0.06 0.00 0.10 0.00 0.00 59.98 59.76 2qjk h ARG 12 Cb 0.53 0.08 -0.05 0.00 1.11 0.00 0.00 29.97 31.64 2qjk h ARG 12 CO 0.01 1.02 0.52 0.22 0.10 0.00 0.00 179.97 181.84 2qjk h ASP 13 N 0.03 0.77 0.64 0.08 3.58 -1.71 0.10 116.42 119.91 2qjk h ASP 13 Ca -0.03 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.39 2qjk h ASP 13 Cb 1.11 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 42.00 2qjk h ASP 13 CO 0.09 0.50 -0.37 0.15 -2.88 0.00 0.00 179.24 176.73 2qjk h PHE 14 N 0.88 -0.97 -0.36 0.28 3.57 -1.44 -0.97 116.94 117.92 2qjk h PHE 14 Ca 0.34 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.90 2qjk h PHE 14 Cb 0.22 0.34 -0.09 0.00 2.79 0.00 0.00 35.95 39.22 2qjk h PHE 14 CO -0.00 -0.57 -0.38 1.25 -2.23 0.00 0.00 178.31 176.38 2qjk h LEU 15 N -0.95 -1.24 -1.22 0.59 5.85 -1.33 0.40 115.31 117.42 2qjk h LEU 15 Ca -0.08 0.20 0.22 0.00 0.84 0.00 0.00 57.88 59.05 2qjk h LEU 15 Cb 0.76 0.55 -0.09 0.00 0.37 0.00 0.00 40.66 42.24 2qjk h LEU 15 CO 0.10 -0.35 0.62 1.88 -0.34 0.00 0.00 178.44 180.35 2qjk h TYR 16 N -0.31 0.84 0.00 1.25 -1.99 -0.80 0.28 116.97 116.23 2qjk h TYR 16 Ca 0.15 0.03 -0.09 0.00 2.00 0.00 0.00 58.73 60.81 2qjk h TYR 16 Cb 0.57 -0.25 -0.01 0.00 2.00 0.00 0.00 36.73 39.03 2qjk h TYR 16 CO -0.56 0.16 -0.74 1.88 -0.00 0.00 0.00 178.16 178.90 2qjk h TYR 17 N 0.58 0.00 0.00 4.88 0.05 0.56 -2.29 116.97 120.75 2qjk h TYR 17 Ca 0.56 0.00 -0.20 0.00 0.05 0.00 0.00 58.73 59.14 2qjk h TYR 17 Cb 1.13 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.86 2qjk h TYR 17 CO -0.00 0.38 -0.88 0.00 -1.05 0.00 0.00 178.16 176.61 2qjk h ALA 18 N 1.62 0.51 0.18 3.88 0.00 0.17 -2.78 119.26 122.84 2qjk h ALA 18 Ca -0.05 -0.72 -0.01 0.00 0.00 0.00 0.00 54.91 54.13 2qjk h ALA 18 Cb 1.33 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2qjk h ALA 18 CO 0.04 0.91 -0.09 1.15 0.00 0.00 0.00 179.25 181.27 2qjk h THR 19 N 0.11 0.00 -1.39 0.00 2.02 -0.57 -2.60 112.91 110.49 2qjk h THR 19 Ca -0.04 -0.15 0.40 0.00 0.77 0.00 0.00 66.41 67.39 2qjk h THR 19 Cb 1.51 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.86 2qjk h THR 19 CO 0.13 0.00 1.00 0.00 0.37 0.00 0.00 175.52 177.02 2qjk h ALA 20 N -1.74 3.30 0.66 6.16 0.00 -1.54 0.73 119.26 126.84 2qjk h ALA 20 Ca -0.02 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2qjk h ALA 20 Cb 0.19 0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.09 2qjk h ALA 20 CO 0.04 -1.70 -0.32 0.78 0.00 0.00 0.00 179.25 178.05 2qjk h GLY 21 N 0.01 -0.93 0.61 0.00 0.00 -1.40 -1.84 103.07 99.52 2qjk h GLY 21 Ca 0.66 0.34 0.09 0.00 0.00 0.00 0.00 47.33 48.43 2qjk h GLY 21 CO -0.02 -0.34 0.60 0.00 0.00 0.00 0.00 176.54 176.79 2qjk h ALA 22 N -0.82 1.38 -0.01 3.60 0.00 -0.51 -2.05 119.26 120.86 2qjk h ALA 22 Ca -0.09 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.83 2qjk h ALA 22 Cb 0.72 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2qjk h ALA 22 CO 0.15 0.30 -0.23 0.78 0.00 0.00 0.00 179.25 180.25 2qjk h GLY 23 N 1.04 -1.29 -0.53 0.00 0.00 -1.06 -1.33 103.07 99.89 2qjk h GLY 23 Ca 0.44 0.64 0.14 0.00 0.00 0.00 0.00 47.33 48.55 2qjk h GLY 23 CO -0.22 -0.41 -0.25 0.00 0.00 0.00 0.00 176.54 175.67 2qjk h ALA 24 N -1.02 0.31 -0.37 3.60 0.00 -0.89 -0.25 119.26 120.64 2qjk h ALA 24 Ca 0.01 0.26 0.06 0.00 0.00 0.00 0.00 54.91 55.24 2qjk h ALA 24 Cb 0.31 0.68 -0.09 0.00 0.00 0.00 0.00 17.79 18.69 2qjk h ALA 24 CO -0.16 -0.51 -0.45 0.28 0.00 0.00 0.00 179.25 178.41 2qjk h VAL 25 N -0.05 0.10 0.42 0.00 2.07 -0.71 -1.09 116.25 116.99 2qjk h VAL 25 Ca 0.32 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.83 2qjk h VAL 25 Cb 0.56 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2qjk h VAL 25 CO -0.77 0.00 -0.38 0.00 0.02 0.00 0.00 177.57 176.44 2qjk h ALA 26 N 0.31 -1.08 -0.68 1.67 0.00 -0.21 -1.75 119.26 117.53 2qjk h ALA 26 Ca 0.12 -0.15 0.13 0.00 0.00 0.00 0.00 54.91 55.01 2qjk h ALA 26 Cb 0.59 0.59 -0.13 0.00 0.00 0.00 0.00 17.79 18.85 2qjk h ALA 26 CO -0.56 -1.09 -0.19 2.41 0.00 0.00 0.00 179.25 179.83 2qjk n THR 27 N -4.72 -0.30 -0.17 0.00 -1.04 -0.21 0.14 114.28 108.00 2qjk n THR 27 Ca -0.09 1.55 -0.10 0.00 -2.04 0.00 0.00 64.05 63.37 2qjk n THR 27 Cb 0.35 -2.13 0.00 0.00 -1.82 0.00 0.00 70.33 66.73 2qjk n THR 27 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2qjk h GLY 28 N 0.00 0.99 1.02 3.41 0.00 -0.94 -1.77 103.07 105.78 2qjk h GLY 28 Ca 0.31 -0.78 0.11 0.00 0.00 0.00 0.00 47.33 46.96 2qjk h GLY 28 CO -0.69 0.72 0.39 0.00 0.00 0.00 0.00 176.54 176.95 2qjk h ALA 29 N 0.91 2.09 0.00 3.60 0.00 0.22 0.97 119.26 127.04 2qjk h ALA 29 Ca 0.13 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2qjk h ALA 29 Cb 0.61 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2qjk h ALA 29 CO 0.04 -0.58 -0.02 0.00 0.00 0.00 0.00 179.25 178.69 2qjk h ALA 30 N 1.58 0.00 -0.59 0.00 0.00 -0.84 -3.38 119.26 116.03 2qjk h ALA 30 Ca 0.18 -0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.15 2qjk h ALA 30 Cb 0.95 0.01 -0.11 0.00 0.00 0.00 0.00 17.79 18.64 2qjk h ALA 30 CO -0.00 0.01 -0.20 0.28 0.00 0.00 0.00 179.25 179.35 2qjk h VAL 31 N -1.00 0.34 -0.26 0.00 2.07 -0.42 -3.04 116.25 113.93 2qjk h VAL 31 Ca -0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 2qjk h VAL 31 Cb 0.09 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.15 2qjk h VAL 31 CO -0.00 0.00 -0.31 -0.25 0.02 0.00 0.00 177.57 177.03 2qjk h TRP 32 N -0.05 -0.96 -0.36 1.57 -0.00 -1.03 -1.01 115.95 114.11 2qjk h TRP 32 Ca 0.28 0.05 0.10 0.00 -0.00 0.00 0.00 58.89 59.32 2qjk h TRP 32 Cb 0.48 0.45 -0.01 0.00 -0.00 0.00 0.00 29.16 30.08 2qjk h TRP 32 CO -0.53 -0.26 0.26 -1.00 -0.00 0.00 0.00 178.44 176.91 2qjk h PRO 33 N -0.20 0.00 0.00 2.65 0.13 -1.72 0.85 132.00 133.71 2qjk h PRO 33 Ca 0.05 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.12 2qjk h PRO 33 Cb 0.32 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.44 2qjk h PRO 33 CO -0.35 0.00 -0.25 -0.07 -0.23 0.00 0.00 178.00 177.10 2qjk h LEU 34 N 0.00 0.00 0.00 1.56 3.38 -1.10 -1.95 115.31 117.20 2qjk h LEU 34 Ca 0.17 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.00 2qjk h LEU 34 Cb 0.70 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 2qjk h LEU 34 CO -0.00 0.25 -0.85 0.40 0.09 0.00 0.00 178.44 178.33 2qjk h ILE 35 N 0.00 0.82 -0.57 1.22 2.04 1.00 -3.38 117.51 118.63 2qjk h ILE 35 Ca -0.00 -1.91 0.13 0.00 1.00 0.00 0.00 64.86 64.08 2qjk h ILE 35 Cb 0.52 1.84 -0.03 0.00 -0.74 0.00 0.00 36.82 38.41 2qjk h ILE 35 CO 0.03 0.28 0.39 -1.13 0.00 0.00 0.00 178.15 177.72 2qjk h ASN 36 N -1.00 0.19 -0.63 1.72 -0.00 0.44 -1.36 115.58 114.93 2qjk h ASN 36 Ca -0.21 0.01 0.18 0.00 -0.00 0.00 0.00 56.30 56.28 2qjk h ASN 36 Cb 1.03 -0.03 -0.03 0.00 -0.00 0.00 0.00 38.32 39.29 2qjk h ASN 36 CO -0.13 0.10 0.56 0.06 -0.00 0.00 0.00 177.43 178.03 2qjk h GLN 37 N 0.20 0.00 0.00 6.67 -0.00 -1.54 0.36 115.11 120.81 2qjk h GLN 37 Ca 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.92 2qjk h GLN 37 Cb 0.79 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.27 2qjk h GLN 37 CO -0.05 0.00 0.00 0.52 -0.00 0.00 0.00 178.83 179.30 2qjk h MET 38 N 0.00 0.00 -7.29 0.06 2.86 -1.49 -3.45 114.93 105.61 2qjk h MET 38 Ca 0.30 0.00 -0.48 0.00 -2.06 0.00 0.00 59.70 57.46 2qjk h MET 38 Cb 1.42 0.00 0.17 0.00 0.06 0.00 0.00 31.60 33.24 2qjk h MET 38 CO -0.00 0.00 0.21 -0.80 1.06 0.00 0.00 176.91 177.37 2qjk s ASN 39 N -5.64 2.97 -0.10 1.22 0.02 0.13 -4.85 114.94 108.69 2qjk s ASN 39 Ca 0.06 1.60 -0.38 0.00 -1.02 0.00 0.00 52.86 53.11 2qjk s ASN 39 Cb 0.08 -2.25 -0.16 0.00 0.02 0.00 0.00 41.25 38.94 2qjk s ASN 39 CO 0.60 -2.97 1.60 -2.65 0.02 0.00 0.00 177.10 173.70 2qjk n PRO 40 N -4.11 1.32 -1.74 -0.60 -0.02 -1.26 -4.95 135.00 123.65 2qjk n PRO 40 Ca 0.07 0.48 -0.33 0.00 -2.02 0.00 0.00 63.50 61.70 2qjk n PRO 40 Cb 0.55 -2.17 0.05 0.00 -0.02 0.00 0.00 33.50 31.90 2qjk n PRO 40 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2qjk s SER 41 N 2.31 5.09 0.34 2.55 1.04 -1.26 -4.79 113.70 118.98 2qjk s SER 41 Ca 0.91 1.99 0.17 0.00 0.48 0.00 0.00 55.95 59.50 2qjk s SER 41 Cb -0.96 -2.55 0.94 0.00 0.10 0.00 0.00 66.02 63.55 2qjk s SER 41 CO 0.55 -1.64 1.47 0.00 0.98 0.00 0.00 173.24 174.60 2qjk h ALA 42 N -0.02 1.13 0.00 5.32 0.00 -1.97 -0.46 119.26 123.27 2qjk h ALA 42 Ca -0.47 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.18 2qjk h ALA 42 Cb 1.24 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 2qjk h ALA 42 CO 0.54 -0.13 -1.50 0.38 0.00 0.00 0.00 179.25 178.54 2qjk h ASP 43 N 0.00 0.00 0.53 0.00 2.03 -2.00 -3.31 116.42 113.67 2qjk h ASP 43 Ca 0.00 0.00 -0.24 0.00 -0.73 0.00 0.00 57.03 56.06 2qjk h ASP 43 Cb 0.39 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.89 2qjk h ASP 43 CO 0.00 0.97 -1.05 0.58 -1.03 0.00 0.00 179.24 178.70 2qjk h VAL 44 N 0.00 1.47 0.00 4.15 2.07 -1.47 -3.16 116.25 119.30 2qjk h VAL 44 Ca -0.21 -2.77 0.00 0.00 0.82 0.00 0.00 66.70 64.55 2qjk h VAL 44 Cb 1.92 2.66 0.00 0.00 -1.52 0.00 0.00 31.29 34.35 2qjk h VAL 44 CO 0.09 0.81 0.00 0.00 0.02 0.00 0.00 177.57 178.49 2qjk n GLN 45 N -3.63 0.70 -2.86 1.57 6.02 -0.72 -4.34 117.38 114.12 2qjk n GLN 45 Ca -0.07 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.49 2qjk n GLN 45 Cb 0.91 -1.27 0.01 0.00 1.02 0.00 0.00 30.24 30.91 2qjk n GLN 45 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qjk n ALA 46 N -0.00 5.05 -1.91 -1.58 0.00 -1.20 -4.97 120.51 115.90 2qjk n ALA 46 Ca 0.00 -4.62 -0.36 0.00 0.00 0.00 0.00 53.44 48.46 2qjk n ALA 46 Cb 0.13 -2.58 -0.03 0.00 0.00 0.00 0.00 19.45 16.97 2qjk n ALA 46 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2qjk s LEU 47 N -1.64 3.29 0.00 0.00 0.20 -1.26 -4.97 118.68 114.30 2qjk s LEU 47 Ca 0.34 0.40 0.00 0.00 0.69 0.00 0.00 54.13 55.56 2qjk s LEU 47 Cb 0.04 -2.53 0.00 0.00 -0.43 0.00 0.00 46.19 43.27 2qjk s LEU 47 CO 0.05 -2.59 0.00 0.00 -0.29 0.00 0.00 176.35 173.52 2qjk n ALA 48 N 13.85 0.00 -3.49 5.97 0.00 -1.26 -5.10 120.51 130.49 2qjk n ALA 48 Ca 0.27 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.64 2qjk n ALA 48 Cb 0.52 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.89 2qjk n ALA 48 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2qjk s SER 49 N -1.01 -0.18 0.60 0.00 0.01 -1.26 -4.87 113.70 106.98 2qjk s SER 49 Ca 0.00 0.69 0.04 0.00 1.31 0.00 0.00 55.95 57.98 2qjk s SER 49 Cb 0.00 1.36 0.08 0.00 0.21 0.00 0.00 66.02 67.67 2qjk s SER 49 CO 0.00 -0.26 0.82 0.27 0.41 0.00 0.00 173.24 174.48 2qjk s ILE 50 N 2.62 2.41 -0.03 1.44 -4.36 -1.01 -4.96 121.20 117.30 2qjk s ILE 50 Ca 0.06 -0.77 0.03 0.00 -0.26 0.00 0.00 60.65 59.71 2qjk s ILE 50 Cb -0.14 -2.64 0.00 0.00 1.25 0.00 0.00 42.46 40.94 2qjk s ILE 50 CO -0.15 0.00 -0.12 -0.36 0.24 0.00 0.00 174.94 174.55 2qjk s PHE 51 N -2.81 1.19 -0.17 1.37 0.40 -1.26 -2.83 117.98 113.87 2qjk s PHE 51 Ca 0.61 -0.31 0.01 0.00 -0.60 0.00 0.00 56.93 56.64 2qjk s PHE 51 Cb -0.07 -0.82 0.02 0.00 0.51 0.00 0.00 43.02 42.65 2qjk s PHE 51 CO 0.40 -0.11 -0.17 0.08 0.70 0.00 0.00 175.22 176.11 2qjk s VAL 52 N 0.10 1.87 -0.13 -0.44 1.01 -0.35 -4.98 120.40 117.48 2qjk s VAL 52 Ca -0.03 -0.84 -0.29 0.00 0.00 0.00 0.00 61.98 60.82 2qjk s VAL 52 Cb -0.09 -1.72 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 2qjk s VAL 52 CO 0.01 0.49 1.04 -0.62 0.00 0.00 0.00 175.10 176.01 2qjk s ASP 53 N 1.36 7.19 -0.14 3.32 2.15 -1.26 -1.83 116.67 127.46 2qjk s ASP 53 Ca 0.05 1.53 0.18 0.00 0.43 0.00 0.00 52.55 54.74 2qjk s ASP 53 Cb -0.13 -2.55 0.34 0.00 -0.30 0.00 0.00 42.92 40.27 2qjk s ASP 53 CO -0.12 -0.51 1.20 0.55 -0.17 0.00 0.00 175.17 176.12 2qjk n VAL 54 N 4.73 1.97 -0.26 1.11 3.14 -0.61 -4.75 118.33 123.65 2qjk n VAL 54 Ca 0.10 -2.22 -0.07 0.00 -2.96 0.00 0.00 64.34 59.18 2qjk n VAL 54 Cb 0.48 -0.24 0.05 0.00 -1.06 0.00 0.00 33.84 33.07 2qjk n VAL 54 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 2qjk h SER 55 N 0.35 1.05 0.00 6.55 4.64 -1.91 -2.88 113.55 121.35 2qjk h SER 55 Ca 0.00 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 2qjk h SER 55 Cb 1.08 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 2qjk h SER 55 CO 0.04 0.98 0.00 -1.54 -0.87 0.00 0.00 176.83 175.44 2qjk n SER 56 N -4.28 1.17 -4.30 4.97 3.41 -1.26 -4.75 113.62 108.57 2qjk n SER 56 Ca 0.06 -1.95 -0.41 0.00 -0.26 0.00 0.00 58.87 56.30 2qjk n SER 56 Cb 0.23 -0.49 -0.10 0.00 -0.26 0.00 0.00 64.21 63.59 2qjk n SER 56 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2qjk s VAL 57 N -0.90 4.42 0.78 -3.33 1.01 -1.09 -5.07 120.40 116.22 2qjk s VAL 57 Ca 0.00 -1.26 -0.12 0.00 0.00 0.00 0.00 61.98 60.60 2qjk s VAL 57 Cb 0.00 -3.65 0.06 0.00 0.00 0.00 0.00 36.38 32.79 2qjk s VAL 57 CO 0.00 -0.47 1.15 -1.61 0.00 0.00 0.00 175.10 174.18 2qjk s GLU 58 N 1.48 2.20 0.38 2.72 8.01 -1.26 -4.98 118.70 127.24 2qjk s GLU 58 Ca 0.03 0.19 -0.25 0.00 0.01 0.00 0.00 54.97 54.95 2qjk s GLU 58 Cb -0.22 -1.98 -0.09 0.00 -4.31 0.00 0.00 34.13 27.53 2qjk s GLU 58 CO 0.03 -1.44 1.06 -1.25 0.01 0.00 0.00 175.26 173.67 2qjk s PRO 59 N -5.51 4.22 0.00 0.39 0.04 -1.26 -3.14 135.00 129.74 2qjk s PRO 59 Ca 0.61 1.57 0.00 0.00 0.04 0.00 0.00 61.00 63.22 2qjk s PRO 59 Cb -0.11 -2.64 0.00 0.00 0.04 0.00 0.00 34.50 31.79 2qjk s PRO 59 CO 0.50 -0.10 0.00 0.41 0.04 0.00 0.00 177.00 177.84 2qjk n GLY 60 N 0.48 0.87 3.35 0.56 0.00 0.23 -4.90 105.19 105.78 2qjk n GLY 60 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 2qjk n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qjk s VAL 61 N -2.04 2.45 -0.08 1.61 1.01 -1.19 -4.98 120.40 117.19 2qjk s VAL 61 Ca 0.00 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.02 2qjk s VAL 61 Cb 0.00 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 2qjk s VAL 61 CO 0.00 0.57 0.03 -1.58 0.00 0.00 0.00 175.10 174.12 2qjk s GLN 62 N -0.35 3.04 -0.26 2.72 0.74 -1.26 -1.84 119.66 122.45 2qjk s GLN 62 Ca 0.03 -0.39 -0.02 0.00 0.05 0.00 0.00 55.36 55.03 2qjk s GLN 62 Cb -0.12 -2.84 0.03 0.00 1.10 0.00 0.00 33.01 31.17 2qjk s GLN 62 CO 0.02 0.71 -0.05 -1.17 -0.55 0.00 0.00 175.29 174.24 2qjk s LEU 63 N -1.01 3.29 -0.25 3.68 2.96 0.19 -4.93 118.68 122.61 2qjk s LEU 63 Ca 0.15 -0.93 -0.10 0.00 -0.22 0.00 0.00 54.13 53.03 2qjk s LEU 63 Cb -0.11 -1.67 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 2qjk s LEU 63 CO 0.04 -0.15 0.14 -0.89 -1.32 0.00 0.00 176.35 174.17 2qjk s THR 64 N 1.31 5.08 0.05 3.68 2.01 -1.26 -1.45 115.64 125.06 2qjk s THR 64 Ca -0.01 0.09 0.07 0.00 0.31 0.00 0.00 61.69 62.14 2qjk s THR 64 Cb -0.17 -3.38 -0.03 0.00 0.01 0.00 0.00 72.50 68.94 2qjk s THR 64 CO -0.04 0.33 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.35 2qjk s VAL 65 N 1.29 1.47 0.15 3.82 1.01 -0.76 -4.93 120.40 122.45 2qjk s VAL 65 Ca 0.07 -1.19 -0.17 0.00 0.00 0.00 0.00 61.98 60.69 2qjk s VAL 65 Cb -0.14 -1.30 -0.07 0.00 0.00 0.00 0.00 36.38 34.86 2qjk s VAL 65 CO 0.06 0.08 0.60 -0.75 0.00 0.00 0.00 175.10 175.08 2qjk s LYS 66 N -1.30 4.09 -0.29 2.72 2.20 -1.26 -0.05 119.74 125.85 2qjk s LYS 66 Ca 0.05 0.63 -0.15 0.00 -0.36 0.00 0.00 55.97 56.14 2qjk s LYS 66 Cb -0.09 -2.98 0.11 0.00 -1.51 0.00 0.00 37.83 33.37 2qjk s LYS 66 CO 0.02 0.49 0.80 0.12 -0.36 0.00 0.00 175.35 176.42 2qjk s PHE 67 N -1.41 -0.91 -1.25 4.03 5.36 -0.57 -4.90 117.98 118.33 2qjk s PHE 67 Ca 0.37 1.78 0.00 0.00 -0.96 0.00 0.00 56.93 58.12 2qjk s PHE 67 Cb -0.16 0.55 0.00 0.00 -0.34 0.00 0.00 43.02 43.06 2qjk s PHE 67 CO 0.20 -0.45 0.00 1.28 -1.46 0.00 0.00 175.22 174.78 2qjk n LEU 68 N 4.28 -1.33 0.00 6.12 4.77 -1.26 -1.14 117.00 128.44 2qjk n LEU 68 Ca -0.18 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2qjk n LEU 68 Cb 0.57 -2.33 0.00 0.00 -2.33 0.00 0.00 43.42 39.33 2qjk n LEU 68 CO -0.01 -0.18 0.00 0.61 -1.33 0.00 0.00 177.39 176.48 2qjk n GLY 69 N -0.83 1.99 3.47 -0.72 0.00 -1.26 -5.01 105.19 102.84 2qjk n GLY 69 Ca -0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 2qjk n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qjk s LYS 70 N -0.06 1.70 0.64 1.61 1.02 -0.29 -5.09 119.74 119.26 2qjk s LYS 70 Ca 0.00 -1.60 -0.14 0.00 0.02 0.00 0.00 55.97 54.24 2qjk s LYS 70 Cb 0.00 -1.86 -0.01 0.00 -0.52 0.00 0.00 37.83 35.43 2qjk s LYS 70 CO 0.00 0.37 1.07 -1.25 -0.92 0.00 0.00 175.35 174.62 2qjk s PRO 71 N -3.13 3.07 -0.05 -1.68 0.04 -1.26 -1.51 135.00 130.48 2qjk s PRO 71 Ca 0.26 1.19 -0.01 0.00 0.04 0.00 0.00 61.00 62.47 2qjk s PRO 71 Cb -0.07 -2.00 0.03 0.00 0.04 0.00 0.00 34.50 32.50 2qjk s PRO 71 CO 0.13 -1.01 0.02 0.42 0.04 0.00 0.00 177.00 176.61 2qjk s ILE 72 N -2.58 0.14 0.05 0.56 1.01 0.93 -2.34 121.20 118.97 2qjk s ILE 72 Ca 0.63 0.23 -0.22 0.00 0.00 0.00 0.00 60.65 61.29 2qjk s ILE 72 Cb -0.16 -0.33 -0.06 0.00 0.01 0.00 0.00 42.46 41.92 2qjk s ILE 72 CO 0.43 0.20 0.65 -0.36 0.00 0.00 0.00 174.94 175.86 2qjk s PHE 73 N 1.82 3.76 -0.31 3.97 0.08 0.82 -1.82 117.98 126.31 2qjk s PHE 73 Ca 0.02 1.34 -0.02 0.00 0.12 0.00 0.00 56.93 58.39 2qjk s PHE 73 Cb -0.12 -2.65 0.10 0.00 -0.57 0.00 0.00 43.02 39.78 2qjk s PHE 73 CO -0.04 0.42 0.12 0.42 -0.10 0.00 0.00 175.22 176.04 2qjk s ILE 74 N -0.53 0.50 -0.08 0.64 1.01 -0.53 -1.56 121.20 120.66 2qjk s ILE 74 Ca 0.33 -1.23 -0.00 0.00 0.00 0.00 0.00 60.65 59.75 2qjk s ILE 74 Cb -0.20 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 40.85 2qjk s ILE 74 CO 0.20 -0.73 -0.06 -0.60 0.00 0.00 0.00 174.94 173.76 2qjk s ARG 75 N 1.71 2.90 -0.48 2.79 3.52 -0.47 0.54 118.95 129.46 2qjk s ARG 75 Ca 0.10 -0.53 -0.12 0.00 -0.13 0.00 0.00 55.73 55.05 2qjk s ARG 75 Cb -0.17 -2.65 0.11 0.00 -1.56 0.00 0.00 34.95 30.67 2qjk s ARG 75 CO -0.27 0.61 0.38 0.50 -0.81 0.00 0.00 175.30 175.71 2qjk s ARG 76 N -0.65 2.73 0.58 5.12 3.52 -0.76 -1.53 118.95 127.96 2qjk s ARG 76 Ca 0.10 -1.63 -0.19 0.00 -0.13 0.00 0.00 55.73 53.88 2qjk s ARG 76 Cb -0.12 -4.04 -0.04 0.00 -1.56 0.00 0.00 34.95 29.19 2qjk s ARG 76 CO 0.02 -1.17 1.18 1.03 -0.81 0.00 0.00 175.30 175.55 2qjk s ARG 77 N 1.49 3.06 0.83 5.12 0.52 0.10 0.78 118.95 130.85 2qjk s ARG 77 Ca 0.04 1.75 -0.09 0.00 -0.52 0.00 0.00 55.73 56.92 2qjk s ARG 77 Cb -0.26 -1.95 0.15 0.00 0.52 0.00 0.00 34.95 33.41 2qjk s ARG 77 CO 0.02 -1.12 1.15 0.95 0.02 0.00 0.00 175.30 176.33 2qjk s THR 78 N -1.67 2.08 0.02 0.02 -4.23 -1.26 -4.52 115.64 106.07 2qjk s THR 78 Ca 0.76 -0.27 -0.23 0.00 -1.18 0.00 0.00 61.69 60.76 2qjk s THR 78 Cb -0.28 -2.81 -0.16 0.00 1.34 0.00 0.00 72.50 70.59 2qjk s THR 78 CO 0.32 0.00 1.37 -0.33 -0.54 0.00 0.00 174.62 175.43 2qjk h GLU 79 N -1.06 0.17 -0.84 3.99 5.08 -1.98 -0.84 114.58 119.08 2qjk h GLU 79 Ca -0.41 -0.07 0.20 0.00 -1.00 0.00 0.00 59.36 58.07 2qjk h GLU 79 Cb 1.26 -0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.35 2qjk h GLU 79 CO 0.42 0.54 -0.04 0.00 -1.00 0.00 0.00 179.01 178.92 2qjk h ALA 80 N 0.63 0.83 0.68 3.43 0.00 -1.99 0.40 119.26 123.23 2qjk h ALA 80 Ca 0.02 0.29 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 2qjk h ALA 80 Cb 0.49 0.52 0.01 0.00 0.00 0.00 0.00 17.79 18.81 2qjk h ALA 80 CO 0.01 -0.45 -0.33 -0.44 0.00 0.00 0.00 179.25 178.04 2qjk h ASP 81 N 0.06 -0.77 -0.56 0.00 3.32 -1.85 -2.93 116.42 113.69 2qjk h ASP 81 Ca 0.46 -0.01 0.13 0.00 0.02 0.00 0.00 57.03 57.63 2qjk h ASP 81 Cb 0.83 0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.55 2qjk h ASP 81 CO -0.79 -0.47 0.39 0.40 -1.72 0.00 0.00 179.24 177.05 2qjk h ILE 82 N -1.06 0.82 0.00 0.35 2.04 0.37 -2.67 117.51 117.35 2qjk h ILE 82 Ca -0.09 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.69 2qjk h ILE 82 Cb 0.73 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2qjk h ILE 82 CO 0.15 0.04 0.00 1.21 0.00 0.00 0.00 178.15 179.55 2qjk n GLU 83 N -4.44 0.00 -0.28 2.37 4.07 0.12 -2.62 120.64 119.87 2qjk n GLU 83 Ca 0.10 0.17 0.23 0.00 -0.06 0.00 0.00 57.16 57.60 2qjk n GLU 83 Cb 0.48 -1.15 0.43 0.00 -0.06 0.00 0.00 31.44 31.14 2qjk n GLU 83 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 2qjk n LEU 84 N -1.01 0.18 -0.16 4.31 4.32 -1.12 0.41 117.00 123.94 2qjk n LEU 84 Ca 0.00 1.43 -0.03 0.00 -0.02 0.00 0.00 56.01 57.39 2qjk n LEU 84 Cb 0.00 -0.64 0.06 0.00 -1.62 0.00 0.00 43.42 41.22 2qjk n LEU 84 CO 0.00 -1.55 0.95 1.23 -1.22 0.00 0.00 177.39 176.80 2qjk h GLY 85 N 0.00 0.64 2.00 -0.72 0.00 -1.39 -1.74 103.07 101.86 2qjk h GLY 85 Ca 0.66 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.91 2qjk h GLY 85 CO -0.70 -0.00 0.00 3.21 0.00 0.00 0.00 176.54 179.04 2qjk h ARG 86 N 0.33 0.00 0.42 4.80 3.08 0.21 -3.31 114.38 119.91 2qjk h ARG 86 Ca 0.24 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.27 2qjk h ARG 86 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.32 2qjk h ARG 86 CO -0.25 0.00 -0.20 0.66 -1.07 0.00 0.00 179.97 179.10 2qjk h SER 87 N 0.00 -0.48 -0.94 7.04 4.64 -0.37 -3.45 113.55 119.98 2qjk h SER 87 Ca 0.00 0.02 -0.69 0.00 -0.47 0.00 0.00 61.79 60.64 2qjk h SER 87 Cb 0.83 0.12 0.07 0.00 -0.31 0.00 0.00 62.40 63.12 2qjk h SER 87 CO 0.00 -0.29 -0.19 0.52 -0.87 0.00 0.00 176.83 176.00 2qjk n VAL 88 N -3.84 0.82 -3.50 0.95 0.31 -1.14 -4.96 118.33 106.96 2qjk n VAL 88 Ca -0.07 -0.20 -0.37 0.00 -0.01 0.00 0.00 64.34 63.68 2qjk n VAL 88 Cb 0.22 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 33.07 2qjk n VAL 88 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2qjk s GLN 89 N -0.41 4.15 0.08 5.55 -0.21 -1.26 -4.94 119.66 122.62 2qjk s GLN 89 Ca 0.74 0.03 -0.02 0.00 0.02 0.00 0.00 55.36 56.13 2qjk s GLN 89 Cb -1.05 -3.52 0.14 0.00 1.00 0.00 0.00 33.01 29.58 2qjk s GLN 89 CO 0.53 0.04 0.46 -0.11 -2.12 0.00 0.00 175.29 174.09 2qjk n LEU 90 N 4.27 -0.10 0.00 2.90 7.94 -1.26 0.26 117.00 131.01 2qjk n LEU 90 Ca -0.11 0.51 0.09 0.00 -1.11 0.00 0.00 56.01 55.39 2qjk n LEU 90 Cb 0.51 -0.16 0.50 0.00 0.53 0.00 0.00 43.42 44.81 2qjk n LEU 90 CO 0.38 -0.49 0.78 0.61 -1.11 0.00 0.00 177.39 177.56 2qjk n GLY 91 N -1.18 -0.82 0.09 -3.96 0.00 -1.26 -1.88 105.19 96.19 2qjk n GLY 91 Ca 0.05 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.09 2qjk n GLY 91 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2qjk n GLN 92 N -1.20 0.52 -1.97 1.61 6.02 0.73 -4.92 117.38 118.17 2qjk n GLN 92 Ca 0.11 0.09 -0.34 0.00 -0.01 0.00 0.00 57.00 56.85 2qjk n GLN 92 Cb 0.12 -1.77 0.03 0.00 1.02 0.00 0.00 30.24 29.64 2qjk n GLN 92 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2qjk s LEU 93 N -4.99 3.54 -0.02 1.08 1.43 -0.79 -4.97 118.68 113.97 2qjk s LEU 93 Ca 0.01 2.06 0.12 0.00 -1.03 0.00 0.00 54.13 55.28 2qjk s LEU 93 Cb 0.11 -4.56 -0.23 0.00 0.03 0.00 0.00 46.19 41.54 2qjk s LEU 93 CO 0.78 -1.44 0.76 0.58 0.23 0.00 0.00 176.35 177.26 2qjk h VAL 94 N 0.51 0.98 -3.78 -1.59 2.07 -1.86 -3.44 116.25 109.14 2qjk h VAL 94 Ca -0.48 -2.81 -0.66 0.00 0.82 0.00 0.00 66.70 63.57 2qjk h VAL 94 Cb 1.25 2.48 -0.32 0.00 -1.52 0.00 0.00 31.29 33.19 2qjk h VAL 94 CO 0.55 0.56 -0.87 -0.62 0.02 0.00 0.00 177.57 177.21 2qjk s ASP 95 N -6.19 2.84 -0.12 0.57 -1.08 -1.26 -5.00 116.67 106.43 2qjk s ASP 95 Ca -0.04 -0.48 0.15 0.00 -0.52 0.00 0.00 52.55 51.66 2qjk s ASP 95 Cb 0.08 -0.95 -0.24 0.00 -1.46 0.00 0.00 42.92 40.35 2qjk s ASP 95 CO 0.82 0.19 0.37 0.41 0.52 0.00 0.00 175.17 177.49 2qjk n THR 96 N 3.18 1.50 -2.22 1.71 -1.04 -1.26 -4.77 114.28 111.37 2qjk n THR 96 Ca -0.18 -0.83 -0.41 0.00 -2.04 0.00 0.00 64.05 60.59 2qjk n THR 96 Cb 0.52 -0.75 -0.03 0.00 -1.82 0.00 0.00 70.33 68.26 2qjk n THR 96 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2qjk s ASN 97 N -5.79 6.92 0.54 8.00 3.84 -1.26 0.94 114.94 128.13 2qjk s ASN 97 Ca -0.07 2.53 0.32 0.00 0.21 0.00 0.00 52.86 55.85 2qjk s ASN 97 Cb 0.07 -2.64 1.49 0.00 -0.55 0.00 0.00 41.25 39.62 2qjk s ASN 97 CO 0.83 -0.44 2.05 0.00 -2.79 0.00 0.00 177.10 176.75 2qjk h ALA 98 N 3.89 1.08 -6.42 1.71 0.00 -1.75 -3.39 119.26 114.38 2qjk h ALA 98 Ca -0.48 -0.07 -0.49 0.00 0.00 0.00 0.00 54.91 53.87 2qjk h ALA 98 Cb 1.22 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.92 2qjk h ALA 98 CO 0.68 0.09 -0.79 0.54 0.00 0.00 0.00 179.25 179.77 2qjk n ARG 99 N -3.30 -4.67 -3.95 0.00 5.12 -1.26 -4.72 116.66 103.88 2qjk n ARG 99 Ca -0.01 0.52 -0.35 0.00 -1.93 0.00 0.00 57.85 56.09 2qjk n ARG 99 Cb 0.27 -5.29 -0.14 0.00 -1.16 0.00 0.00 32.46 26.14 2qjk n ARG 99 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 2qjk s ASN 100 N -3.47 4.12 0.46 0.55 3.84 -1.26 -1.96 114.94 117.22 2qjk s ASN 100 Ca 0.59 -0.55 0.26 0.00 0.21 0.00 0.00 52.86 53.37 2qjk s ASN 100 Cb -0.30 -1.68 0.88 0.00 -0.55 0.00 0.00 41.25 39.59 2qjk s ASN 100 CO 0.86 -0.05 1.80 0.00 -2.79 0.00 0.00 177.10 176.93 2qjk h ALA 101 N 8.06 0.98 -0.08 1.71 0.00 -1.77 -3.03 119.26 125.12 2qjk h ALA 101 Ca -0.40 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.25 2qjk h ALA 101 Cb 1.14 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2qjk h ALA 101 CO 0.60 0.17 -0.55 -0.91 0.00 0.00 0.00 179.25 178.56 2qjk h ASN 102 N 0.00 0.28 -5.18 0.00 2.35 -1.84 -3.46 115.58 107.73 2qjk h ASN 102 Ca -0.00 -0.15 -0.47 0.00 -0.55 0.00 0.00 56.30 55.13 2qjk h ASN 102 Cb 0.78 -0.08 -0.05 0.00 0.05 0.00 0.00 38.32 39.02 2qjk h ASN 102 CO 0.02 0.78 -0.25 2.30 -1.65 0.00 0.00 177.43 178.63 2qjk n ILE 103 N -3.91 0.00 -1.43 2.81 -5.35 -1.15 -5.09 119.36 105.24 2qjk n ILE 103 Ca -0.02 -1.75 -0.37 0.00 -0.27 0.00 0.00 62.75 60.34 2qjk n ILE 103 Cb 0.58 -0.02 0.06 0.00 -1.74 0.00 0.00 39.64 38.52 2qjk n ILE 103 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2qjk n ASP 104 N -1.74 -0.28 0.00 7.28 2.03 -1.26 -4.84 116.55 117.73 2qjk n ASP 104 Ca -0.05 0.70 0.12 0.00 0.52 0.00 0.00 54.79 56.08 2qjk n ASP 104 Cb 0.49 -1.29 0.61 0.00 -0.72 0.00 0.00 41.12 40.21 2qjk n ASP 104 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qjk n ALA 105 N -2.09 2.23 0.73 -1.67 0.00 -1.26 -2.89 120.51 115.56 2qjk n ALA 105 Ca 0.12 -0.11 0.08 0.00 0.00 0.00 0.00 53.44 53.53 2qjk n ALA 105 Cb 0.49 -1.39 -0.11 0.00 0.00 0.00 0.00 19.45 18.44 2qjk n ALA 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qjk n GLY 106 N 0.78 -0.69 3.00 0.00 0.00 -1.26 -4.93 105.19 102.09 2qjk n GLY 106 Ca 0.11 -0.49 -0.37 0.00 0.00 0.00 0.00 46.02 45.27 2qjk n GLY 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qjk n ALA 107 N -1.51 -5.61 -2.50 4.61 0.00 -1.14 -4.86 120.51 109.50 2qjk n ALA 107 Ca 0.03 -0.90 -0.32 0.00 0.00 0.00 0.00 53.44 52.25 2qjk n ALA 107 Cb 0.30 -1.04 -0.12 0.00 0.00 0.00 0.00 19.45 18.59 2qjk n ALA 107 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2qjk s GLU 108 N -2.00 2.37 0.00 0.00 2.02 -1.26 -2.92 118.70 116.91 2qjk s GLU 108 Ca 0.39 -0.80 0.00 0.00 0.02 0.00 0.00 54.97 54.58 2qjk s GLU 108 Cb -0.09 -2.35 0.00 0.00 0.10 0.00 0.00 34.13 31.79 2qjk s GLU 108 CO 0.78 0.59 0.00 0.00 0.02 0.00 0.00 175.26 176.65 2qjk n ALA 109 N 1.86 1.11 -1.77 5.21 0.00 0.27 -4.47 120.51 122.71 2qjk n ALA 109 Ca -0.16 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 52.89 2qjk n ALA 109 Cb 0.52 -0.99 -0.03 0.00 0.00 0.00 0.00 19.45 18.95 2qjk n ALA 109 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2qjk s THR 110 N 0.99 3.35 0.48 0.00 -4.23 -1.26 -4.88 115.64 110.08 2qjk s THR 110 Ca 0.00 1.19 0.26 0.00 -1.18 0.00 0.00 61.69 61.96 2qjk s THR 110 Cb 0.00 -3.69 0.45 0.00 1.34 0.00 0.00 72.50 70.60 2qjk s THR 110 CO 0.00 0.16 1.83 -0.78 -0.54 0.00 0.00 174.62 175.29 2qjk h ASP 111 N 3.01 0.21 0.28 3.99 1.82 -1.88 0.37 116.42 124.22 2qjk h ASP 111 Ca -0.48 0.03 -0.07 0.00 -0.39 0.00 0.00 57.03 56.12 2qjk h ASP 111 Cb 1.22 -0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.22 2qjk h ASP 111 CO 0.64 0.06 -0.31 1.56 -1.61 0.00 0.00 179.24 179.58 2qjk h GLN 112 N 0.19 0.04 -0.07 0.28 7.50 -1.92 -2.48 115.11 118.65 2qjk h GLN 112 Ca 0.51 -0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.65 2qjk h GLN 112 Cb 1.65 -0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.18 2qjk h GLN 112 CO -0.12 0.35 0.00 0.09 -1.50 0.00 0.00 178.83 177.65 2qjk n ASN 113 N -4.16 0.93 -0.01 1.46 3.02 0.13 -3.74 115.26 112.88 2qjk n ASN 113 Ca -0.02 -1.51 0.08 0.00 -0.03 0.00 0.00 54.58 53.10 2qjk n ASN 113 Cb 0.36 -0.05 -0.12 0.00 -0.61 0.00 0.00 39.78 39.37 2qjk n ASN 113 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2qjk n ARG 114 N -0.20 0.85 -3.05 3.52 5.12 -0.93 -4.85 116.66 117.11 2qjk n ARG 114 Ca 0.17 -0.11 -0.18 0.00 -1.93 0.00 0.00 57.85 55.80 2qjk n ARG 114 Cb 0.22 -1.35 0.01 0.00 -1.16 0.00 0.00 32.46 30.19 2qjk n ARG 114 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2qjk s THR 115 N -2.95 2.89 -0.14 0.55 -4.23 -1.22 -4.49 115.64 106.04 2qjk s THR 115 Ca -0.03 -1.02 0.01 0.00 -1.18 0.00 0.00 61.69 59.47 2qjk s THR 115 Cb 0.11 -2.91 -0.23 0.00 1.34 0.00 0.00 72.50 70.80 2qjk s THR 115 CO 0.67 0.00 0.26 0.18 -0.54 0.00 0.00 174.62 175.19 2qjk n LEU 116 N -1.87 2.11 -4.97 4.79 4.77 -0.94 -4.96 117.00 115.93 2qjk n LEU 116 Ca 0.08 0.15 -0.22 0.00 -0.03 0.00 0.00 56.01 56.00 2qjk n LEU 116 Cb 0.59 -0.66 0.02 0.00 -2.33 0.00 0.00 43.42 41.05 2qjk n LEU 116 CO 0.39 0.75 0.30 1.51 -1.33 0.00 0.00 177.39 179.01 2qjk s ASP 117 N -6.58 5.58 0.25 -1.43 -4.77 -1.26 -5.01 116.67 103.44 2qjk s ASP 117 Ca -0.20 0.09 0.14 0.00 -3.30 0.00 0.00 52.55 49.28 2qjk s ASP 117 Cb 0.07 -1.18 0.02 0.00 -1.09 0.00 0.00 42.92 40.75 2qjk s ASP 117 CO 0.75 -0.89 1.38 -0.33 0.70 0.00 0.00 175.17 176.78 2qjk h GLU 118 N 0.28 0.00 0.00 2.11 3.07 -1.94 -3.06 114.58 115.05 2qjk h GLU 118 Ca -0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.42 2qjk h GLU 118 Cb 1.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.18 2qjk h GLU 118 CO 0.54 0.53 0.00 0.00 -1.40 0.00 0.00 179.01 178.68 2qjk h ALA 119 N 1.45 1.00 -4.19 3.43 0.00 -1.99 -3.47 119.26 115.48 2qjk h ALA 119 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.63 2qjk h ALA 119 Cb 1.44 0.00 0.09 0.00 0.00 0.00 0.00 17.79 19.32 2qjk h ALA 119 CO 0.07 0.00 -0.45 0.41 0.00 0.00 0.00 179.25 179.28 2qjk n GLY 120 N 0.73 -0.03 0.11 0.00 0.00 -1.16 -4.94 105.19 99.90 2qjk n GLY 120 Ca 0.04 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 2qjk n GLY 120 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2qjk n GLU 121 N -3.43 0.67 -3.16 1.61 2.13 -1.26 -4.77 120.64 112.43 2qjk n GLU 121 Ca -0.01 0.06 -0.45 0.00 0.66 0.00 0.00 57.16 57.42 2qjk n GLU 121 Cb 0.54 -1.52 -0.03 0.00 0.27 0.00 0.00 31.44 30.70 2qjk n GLU 121 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 2qjk s TRP 122 N -2.50 3.31 -0.35 4.31 0.52 -1.26 0.03 118.94 122.99 2qjk s TRP 122 Ca -0.20 -1.44 -0.17 0.00 0.02 0.00 0.00 56.10 54.31 2qjk s TRP 122 Cb 0.07 -3.99 -0.00 0.00 -1.15 0.00 0.00 33.47 28.39 2qjk s TRP 122 CO 0.74 -1.21 0.47 -1.17 0.02 0.00 0.00 176.95 175.80 2qjk s LEU 123 N 1.74 4.39 -0.10 2.99 2.96 -0.58 -2.22 118.68 127.87 2qjk s LEU 123 Ca 0.18 -0.11 0.03 0.00 -0.22 0.00 0.00 54.13 54.01 2qjk s LEU 123 Cb -0.15 -2.52 0.01 0.00 0.50 0.00 0.00 46.19 44.03 2qjk s LEU 123 CO -0.03 -0.45 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.67 2qjk s VAL 124 N 2.30 1.67 0.08 1.68 1.01 -1.26 -1.37 120.40 124.51 2qjk s VAL 124 Ca 0.17 -0.78 -0.26 0.00 0.00 0.00 0.00 61.98 61.11 2qjk s VAL 124 Cb -0.16 -1.48 0.08 0.00 0.00 0.00 0.00 36.38 34.82 2qjk s VAL 124 CO 0.13 0.47 0.80 0.00 0.00 0.00 0.00 175.10 176.51 2qjk s MET 125 N 0.62 1.06 -0.17 2.72 0.23 -0.60 -4.61 119.30 118.55 2qjk s MET 125 Ca -0.14 -0.43 -0.29 0.00 -1.03 0.00 0.00 55.69 53.80 2qjk s MET 125 Cb -0.16 0.46 -0.04 0.00 -1.53 0.00 0.00 34.83 33.56 2qjk s MET 125 CO 0.04 -0.47 1.65 -1.58 -2.03 0.00 0.00 175.02 172.63 2qjk s TRP 126 N -3.37 2.03 0.00 3.16 0.52 0.39 -0.12 118.94 121.55 2qjk s TRP 126 Ca 0.05 0.44 -0.03 0.00 0.02 0.00 0.00 56.10 56.58 2qjk s TRP 126 Cb -0.01 -3.95 -0.12 0.00 -1.15 0.00 0.00 33.47 28.23 2qjk s TRP 126 CO -0.08 -3.26 2.23 0.41 0.02 0.00 0.00 176.95 176.28 2qjk n GLY 127 N 4.53 2.21 2.97 0.98 0.00 -0.99 -4.56 105.19 110.33 2qjk n GLY 127 Ca 0.19 -0.56 -0.31 0.00 0.00 0.00 0.00 46.02 45.34 2qjk n GLY 127 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qjk s VAL 128 N 1.29 2.62 0.06 1.61 1.01 -1.26 -3.79 120.40 121.94 2qjk s VAL 128 Ca 0.31 -3.14 -0.32 0.00 0.00 0.00 0.00 61.98 58.82 2qjk s VAL 128 Cb 0.15 -2.83 -0.17 0.00 0.00 0.00 0.00 36.38 33.53 2qjk s VAL 128 CO 0.00 -0.77 0.79 0.00 0.00 0.00 0.00 175.10 175.12 2qjk n THR 130 N 0.88 0.04 0.00 0.00 -2.24 -1.26 -3.06 114.28 108.64 2qjk n THR 130 Ca 0.17 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 2qjk n THR 130 Cb 0.12 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.22 2qjk n THR 130 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 2qjk n HIS 131 N -0.55 0.00 0.00 4.78 -0.00 -1.26 -4.37 115.22 113.82 2qjk n HIS 131 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.84 2qjk n HIS 131 Cb 0.10 -0.24 0.00 0.00 -0.00 0.00 0.00 29.99 29.85 2qjk n HIS 131 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 2qjk n LEU 132 N -1.21 0.00 0.00 0.27 4.77 -1.26 -4.97 117.00 114.61 2qjk n LEU 132 Ca 0.00 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2qjk n LEU 132 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2qjk n LEU 132 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 2qjk n GLY 133 N 1.66 1.33 3.27 -0.72 0.00 -1.17 -5.07 105.19 104.48 2qjk n GLY 133 Ca 0.00 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2qjk n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qjk s SER 135 N -1.77 5.84 0.34 0.00 0.15 -1.25 0.18 113.70 117.19 2qjk s SER 135 Ca 0.54 -1.12 -0.29 0.00 0.70 0.00 0.00 55.95 55.78 2qjk s SER 135 Cb -0.12 -2.06 -0.12 0.00 -1.71 0.00 0.00 66.02 62.02 2qjk s SER 135 CO 0.67 -0.46 1.46 -2.65 1.20 0.00 0.00 173.24 173.46 2qjk n PRO 136 N 5.04 2.53 -2.22 5.44 -0.02 -1.25 -4.90 135.00 139.62 2qjk n PRO 136 Ca -0.11 0.89 -0.42 0.00 -2.02 0.00 0.00 63.50 61.83 2qjk n PRO 136 Cb 0.45 -2.60 -0.03 0.00 -0.02 0.00 0.00 33.50 31.31 2qjk n PRO 136 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2qjk s ILE 137 N -0.82 3.85 0.00 4.25 1.01 0.50 -4.73 121.20 125.27 2qjk s ILE 137 Ca 0.57 1.12 0.00 0.00 0.00 0.00 0.00 60.65 62.34 2qjk s ILE 137 Cb -0.51 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.24 2qjk s ILE 137 CO 0.59 -0.06 0.00 0.61 0.00 0.00 0.00 174.94 176.09 2qjk n GLY 138 N 3.77 1.63 2.15 6.18 0.00 -1.26 -1.13 105.19 116.53 2qjk n GLY 138 Ca 0.15 -1.72 -0.08 0.00 0.00 0.00 0.00 46.02 44.37 2qjk n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qjk n GLY 139 N 5.00 0.24 3.16 -0.02 0.00 -1.26 -4.02 105.19 108.29 2qjk n GLY 139 Ca 0.00 -0.28 -0.18 0.00 0.00 0.00 0.00 46.02 45.57 2qjk n GLY 139 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2qjk n VAL 140 N -2.86 -8.15 -4.29 1.61 0.31 -1.16 -5.01 118.33 98.79 2qjk n VAL 140 Ca -0.06 0.41 -0.19 0.00 -0.01 0.00 0.00 64.34 64.49 2qjk n VAL 140 Cb 0.55 -5.75 -0.13 0.00 -0.91 0.00 0.00 33.84 27.60 2qjk n VAL 140 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2qjk s SER 141 N -2.37 1.62 0.00 4.52 0.01 0.33 -4.77 113.70 113.04 2qjk s SER 141 Ca 0.23 -0.50 0.00 0.00 1.31 0.00 0.00 55.95 56.99 2qjk s SER 141 Cb -0.04 -0.08 0.00 0.00 0.21 0.00 0.00 66.02 66.10 2qjk s SER 141 CO 0.81 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 175.06 2qjk n GLY 142 N 1.72 0.75 0.00 3.44 0.00 -1.26 -2.27 105.19 107.57 2qjk n GLY 142 Ca -0.19 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 43.92 2qjk n GLY 142 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qjk n ASP 143 N -0.45 0.00 -0.81 1.61 8.00 -1.26 -2.84 116.55 120.80 2qjk n ASP 143 Ca 0.00 0.33 0.05 0.00 0.71 0.00 0.00 54.79 55.88 2qjk n ASP 143 Cb 0.00 -0.33 0.11 0.00 -0.02 0.00 0.00 41.12 40.88 2qjk n ASP 143 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2qjk n PHE 144 N -1.31 0.00 -2.63 1.24 3.01 -1.26 -4.99 117.46 111.52 2qjk n PHE 144 Ca 0.00 -0.87 -0.21 0.00 1.01 0.00 0.00 57.45 57.38 2qjk n PHE 144 Cb 0.08 -0.17 0.01 0.00 -0.01 0.00 0.00 39.48 39.38 2qjk n PHE 144 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qjk n GLY 145 N -0.46 -0.51 0.00 1.37 0.00 -1.13 -3.49 105.19 100.97 2qjk n GLY 145 Ca 0.11 0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2qjk n GLY 145 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qjk n GLY 146 N -1.18 1.64 3.16 -0.02 0.00 -1.11 -3.51 105.19 104.17 2qjk n GLY 146 Ca -0.19 -0.08 -0.17 0.00 0.00 0.00 0.00 46.02 45.58 2qjk n GLY 146 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qjk s TRP 147 N 1.76 1.11 -0.12 1.61 0.51 -0.68 -0.51 118.94 122.61 2qjk s TRP 147 Ca 0.00 -0.52 0.00 0.00 -2.12 0.00 0.00 56.10 53.46 2qjk s TRP 147 Cb 0.00 -0.62 0.02 0.00 -0.81 0.00 0.00 33.47 32.06 2qjk s TRP 147 CO 0.00 0.03 -0.11 0.12 -0.51 0.00 0.00 176.95 176.48 2qjk s PHE 148 N -1.63 1.80 -0.49 -1.98 5.36 -0.28 -1.48 117.98 119.28 2qjk s PHE 148 Ca -0.01 -0.94 -0.23 0.00 -0.96 0.00 0.00 56.93 54.80 2qjk s PHE 148 Cb -0.08 -1.39 0.04 0.00 -0.34 0.00 0.00 43.02 41.25 2qjk s PHE 148 CO 0.02 -0.56 0.80 0.00 -1.46 0.00 0.00 175.22 174.01 2qjk n PRO 150 N 6.83 0.22 -0.06 0.00 -0.04 -1.26 -1.34 135.00 139.34 2qjk n PRO 150 Ca 0.00 0.14 -0.15 0.00 -0.04 0.00 0.00 63.50 63.46 2qjk n PRO 150 Cb 0.47 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.38 2qjk n PRO 150 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qjk n HIS 152 N -4.14 0.00 -2.64 0.00 8.25 -1.23 -5.06 115.22 110.40 2qjk n HIS 152 Ca -0.06 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.31 2qjk n HIS 152 Cb 0.59 0.01 0.05 0.00 1.12 0.00 0.00 29.99 31.76 2qjk n HIS 152 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qjk n GLY 153 N 0.00 -0.33 3.58 -1.41 0.00 -0.45 -4.67 105.19 101.91 2qjk n GLY 153 Ca 0.00 0.20 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 2qjk n GLY 153 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qjk s SER 154 N -3.35 5.10 -0.08 1.61 0.01 -1.04 -4.31 113.70 111.64 2qjk s SER 154 Ca 0.24 -0.01 -0.03 0.00 1.31 0.00 0.00 55.95 57.47 2qjk s SER 154 Cb -0.03 -1.73 -0.04 0.00 0.21 0.00 0.00 66.02 64.43 2qjk s SER 154 CO 0.46 0.23 0.04 -1.00 0.41 0.00 0.00 173.24 173.38 2qjk s HIS 155 N 0.01 3.27 0.06 2.43 0.09 0.17 -0.87 115.29 120.45 2qjk s HIS 155 Ca 0.02 0.27 0.06 0.00 -0.00 0.00 0.00 55.06 55.41 2qjk s HIS 155 Cb -0.13 -1.81 -0.03 0.00 -0.00 0.00 0.00 32.58 30.61 2qjk s HIS 155 CO 0.02 0.54 -0.16 0.71 -0.00 0.00 0.00 174.74 175.85 2qjk s TYR 156 N -0.96 1.41 0.65 1.40 1.51 -0.55 -0.36 117.35 120.45 2qjk s TYR 156 Ca 0.15 -0.40 -0.03 0.00 -1.01 0.00 0.00 57.07 55.79 2qjk s TYR 156 Cb -0.12 -0.81 0.13 0.00 -0.11 0.00 0.00 41.96 41.05 2qjk s TYR 156 CO 0.04 0.08 0.89 -0.40 -1.11 0.00 0.00 175.55 175.05 2qjk n ASP 157 N 1.56 0.94 0.00 2.29 5.68 -0.24 -1.69 116.55 125.09 2qjk n ASP 157 Ca -0.19 -1.85 0.03 0.00 -0.50 0.00 0.00 54.79 52.27 2qjk n ASP 157 Cb 0.54 -0.60 0.15 0.00 -1.14 0.00 0.00 41.12 40.07 2qjk n ASP 157 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 2qjk n SER 158 N -3.07 0.00 -0.18 -1.12 3.41 -1.23 -0.43 113.62 111.00 2qjk n SER 158 Ca 0.14 -0.31 0.02 0.00 -0.26 0.00 0.00 58.87 58.46 2qjk n SER 158 Cb 0.49 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.47 2qjk n SER 158 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qjk n ALA 159 N -0.84 2.42 -1.72 7.33 0.00 -1.26 -4.89 120.51 121.56 2qjk n ALA 159 Ca 0.04 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.86 2qjk n ALA 159 Cb 0.02 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.32 2qjk n ALA 159 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qjk n GLY 160 N 0.18 0.45 3.85 0.00 0.00 0.42 -4.94 105.19 105.15 2qjk n GLY 160 Ca 0.03 -0.88 -0.36 0.00 0.00 0.00 0.00 46.02 44.81 2qjk n GLY 160 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qjk s ARG 161 N -3.49 3.36 0.19 1.61 0.52 -1.25 -1.41 118.95 118.48 2qjk s ARG 161 Ca 0.00 -0.19 -0.30 0.00 -0.52 0.00 0.00 55.73 54.72 2qjk s ARG 161 Cb 0.00 -3.11 -0.08 0.00 0.52 0.00 0.00 34.95 32.27 2qjk s ARG 161 CO 0.00 0.76 1.24 -1.50 0.02 0.00 0.00 175.30 175.82 2qjk s ILE 162 N -1.02 3.43 0.00 1.52 1.10 -1.26 -1.08 121.20 123.89 2qjk s ILE 162 Ca 0.15 1.20 0.00 0.00 -0.51 0.00 0.00 60.65 61.49 2qjk s ILE 162 Cb -0.12 -3.76 0.00 0.00 0.15 0.00 0.00 42.46 38.73 2qjk s ILE 162 CO 0.04 0.19 0.00 0.54 -2.11 0.00 0.00 174.94 173.60 2qjk n ARG 163 N 2.53 3.16 -3.63 3.50 5.12 0.51 -3.75 116.66 124.10 2qjk n ARG 163 Ca 0.05 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.84 2qjk n ARG 163 Cb 0.44 -0.64 -0.07 0.00 -1.16 0.00 0.00 32.46 31.03 2qjk n ARG 163 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2qjk s LYS 164 N -0.87 0.76 0.00 5.56 2.20 -1.16 -4.91 119.74 121.32 2qjk s LYS 164 Ca 0.00 0.86 0.00 0.00 -0.36 0.00 0.00 55.97 56.47 2qjk s LYS 164 Cb 0.00 0.37 0.00 0.00 -1.51 0.00 0.00 37.83 36.69 2qjk s LYS 164 CO 0.00 -0.10 0.00 0.41 -0.36 0.00 0.00 175.35 175.30 2qjk n GLY 165 N 2.47 -1.33 0.23 5.54 0.00 -1.26 0.44 105.19 111.29 2qjk n GLY 165 Ca -0.14 -2.23 0.10 0.00 0.00 0.00 0.00 46.02 43.76 2qjk n GLY 165 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qjk h PRO 166 N 4.99 0.00 -6.45 1.61 0.13 -1.84 -3.45 132.00 126.99 2qjk h PRO 166 Ca 0.00 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.52 2qjk h PRO 166 Cb 0.00 0.00 0.11 0.00 0.13 0.00 0.00 31.00 31.24 2qjk h PRO 166 CO 0.00 0.21 0.05 0.00 -0.23 0.00 0.00 178.00 178.03 2qjk n ALA 167 N -2.24 -0.45 0.18 -0.56 0.00 -1.26 -4.86 120.51 111.31 2qjk n ALA 167 Ca -0.00 0.36 0.05 0.00 0.00 0.00 0.00 53.44 53.84 2qjk n ALA 167 Cb 0.39 -1.98 0.07 0.00 0.00 0.00 0.00 19.45 17.93 2qjk n ALA 167 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2qjk n PRO 168 N 0.67 1.27 -3.96 0.00 -0.04 -1.26 -4.96 135.00 126.72 2qjk n PRO 168 Ca 0.10 -1.39 -0.10 0.00 -0.04 0.00 0.00 63.50 62.08 2qjk n PRO 168 Cb 0.33 -1.19 -0.06 0.00 -0.04 0.00 0.00 33.50 32.53 2qjk n PRO 168 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2qjk s GLU 169 N -0.85 1.29 0.39 0.54 2.02 -1.26 -4.82 118.70 116.02 2qjk s GLU 169 Ca 0.14 -1.19 -0.16 0.00 0.02 0.00 0.00 54.97 53.77 2qjk s GLU 169 Cb 0.08 0.41 -0.09 0.00 0.10 0.00 0.00 34.13 34.64 2qjk s GLU 169 CO 0.12 -0.50 0.84 -0.80 0.02 0.00 0.00 175.26 174.94 2qjk s ASN 170 N -2.98 6.75 0.09 -0.19 0.01 -1.26 -4.22 114.94 113.13 2qjk s ASN 170 Ca 0.19 1.40 -0.35 0.00 -0.71 0.00 0.00 52.86 53.40 2qjk s ASN 170 Cb 0.02 -2.43 -0.14 0.00 0.41 0.00 0.00 41.25 39.11 2qjk s ASN 170 CO 0.03 -0.34 1.59 0.18 -1.51 0.00 0.00 177.10 177.05 2qjk n LEU 171 N -0.79 2.86 -4.77 0.60 4.77 -0.50 -4.91 117.00 114.25 2qjk n LEU 171 Ca 0.05 1.07 -0.35 0.00 -0.03 0.00 0.00 56.01 56.75 2qjk n LEU 171 Cb 0.54 -1.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.27 2qjk n LEU 171 CO 0.42 -0.40 0.79 -2.84 -1.33 0.00 0.00 177.39 174.04 2qjk s PRO 172 N 1.40 3.37 -0.21 3.23 0.02 -1.26 -4.78 135.00 136.77 2qjk s PRO 172 Ca 0.83 1.65 -0.05 0.00 0.02 0.00 0.00 61.00 63.45 2qjk s PRO 172 Cb -0.75 -2.05 -0.02 0.00 0.02 0.00 0.00 34.50 31.70 2qjk s PRO 172 CO 0.43 -0.84 0.00 0.42 -0.33 0.00 0.00 177.00 176.68 2qjk s ILE 173 N -1.72 3.90 0.57 2.83 1.01 -0.83 -0.46 121.20 126.50 2qjk s ILE 173 Ca 0.72 -0.32 -0.08 0.00 0.00 0.00 0.00 60.65 60.97 2qjk s ILE 173 Cb -0.25 -2.78 -0.03 0.00 0.01 0.00 0.00 42.46 39.42 2qjk s ILE 173 CO 0.28 0.41 0.92 -2.16 0.00 0.00 0.00 174.94 174.40 2qjk s PRO 174 N 1.17 3.42 -0.07 2.79 0.04 -1.26 -2.32 135.00 138.76 2qjk s PRO 174 Ca 0.03 0.41 -0.38 0.00 0.04 0.00 0.00 61.00 61.10 2qjk s PRO 174 Cb -0.14 -2.22 -0.16 0.00 0.04 0.00 0.00 34.50 32.02 2qjk s PRO 174 CO 0.01 -0.49 1.57 1.28 0.04 0.00 0.00 177.00 179.42 2qjk n LEU 175 N -2.56 2.23 -3.51 -3.56 4.77 -1.26 -4.69 117.00 108.42 2qjk n LEU 175 Ca 0.04 1.08 -0.15 0.00 -0.03 0.00 0.00 56.01 56.95 2qjk n LEU 175 Cb 0.55 -1.21 -0.05 0.00 -2.33 0.00 0.00 43.42 40.39 2qjk n LEU 175 CO 0.55 -0.64 0.38 0.00 -1.33 0.00 0.00 177.39 176.35 2qjk s ALA 176 N 2.09 -1.58 -0.20 -1.18 0.00 -1.26 -0.54 121.76 119.08 2qjk s ALA 176 Ca 0.90 0.88 -0.31 0.00 0.00 0.00 0.00 51.96 53.44 2qjk s ALA 176 Cb -0.95 0.35 0.15 0.00 0.00 0.00 0.00 23.12 22.66 2qjk s ALA 176 CO 0.54 -0.51 1.15 -1.59 0.00 0.00 0.00 175.76 175.35 2qjk s LYS 177 N -2.23 0.37 -0.05 0.00 -2.85 -1.25 -4.97 119.74 108.77 2qjk s LYS 177 Ca -0.06 0.03 -0.30 0.00 -1.00 0.00 0.00 55.97 54.64 2qjk s LYS 177 Cb -0.01 0.17 -0.03 0.00 -2.06 0.00 0.00 37.83 35.91 2qjk s LYS 177 CO 0.00 -0.13 1.08 -0.06 0.10 0.00 0.00 175.35 176.35 2qjk s PHE 178 N -1.39 3.44 -0.54 1.78 0.40 -1.26 -0.37 117.98 120.04 2qjk s PHE 178 Ca 0.04 1.48 0.24 0.00 -0.60 0.00 0.00 56.93 58.08 2qjk s PHE 178 Cb -0.01 -3.27 0.23 0.00 0.51 0.00 0.00 43.02 40.49 2qjk s PHE 178 CO -0.03 -0.61 1.23 0.82 0.70 0.00 0.00 175.22 177.32 2qjk h ILE 179 N 4.95 0.00 -0.63 0.64 1.08 -0.76 -3.47 117.51 119.31 2qjk h ILE 179 Ca -0.35 -0.61 0.00 0.00 -0.39 0.00 0.00 64.86 63.51 2qjk h ILE 179 Cb 1.17 1.14 0.00 0.00 -3.07 0.00 0.00 36.82 36.06 2qjk h ILE 179 CO 0.84 0.00 0.00 -0.90 -0.69 0.00 0.00 178.15 177.40 2qjk n ASP 180 N -2.23 0.00 0.18 1.72 5.68 -1.20 -5.01 116.55 115.69 2qjk n ASP 180 Ca 0.02 -0.21 0.14 0.00 -0.50 0.00 0.00 54.79 54.24 2qjk n ASP 180 Cb 0.46 0.00 0.72 0.00 -1.14 0.00 0.00 41.12 41.16 2qjk n ASP 180 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2qjk h GLU 181 N 0.00 0.00 -0.09 0.11 5.08 -2.03 -3.27 114.58 114.37 2qjk h GLU 181 Ca 0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 2qjk h GLU 181 Cb 0.00 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 28.94 2qjk h GLU 181 CO 0.00 0.00 -0.80 -2.37 -1.00 0.00 0.00 179.01 174.84 2qjk n THR 182 N -4.28 0.28 -3.72 1.13 5.66 -1.26 -4.97 114.28 107.12 2qjk n THR 182 Ca 0.01 -1.19 -0.12 0.00 -3.05 0.00 0.00 64.05 59.70 2qjk n THR 182 Cb 0.28 0.95 -0.13 0.00 -1.55 0.00 0.00 70.33 69.88 2qjk n THR 182 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2qjk s THR 183 N -0.82 -0.08 -0.07 1.09 2.01 -1.24 -1.58 115.64 114.96 2qjk s THR 183 Ca 0.22 0.15 -0.00 0.00 0.31 0.00 0.00 61.69 62.37 2qjk s THR 183 Cb 0.29 -0.43 -0.03 0.00 0.01 0.00 0.00 72.50 72.34 2qjk s THR 183 CO -0.10 0.06 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.22 2qjk s ILE 184 N 1.41 3.91 -0.70 1.82 1.01 -0.76 0.01 121.20 127.90 2qjk s ILE 184 Ca -0.08 -0.40 -0.06 0.00 0.00 0.00 0.00 60.65 60.11 2qjk s ILE 184 Cb -0.10 -2.62 0.18 0.00 0.01 0.00 0.00 42.46 39.93 2qjk s ILE 184 CO -0.09 0.60 0.55 -1.58 0.00 0.00 0.00 174.94 174.42 2qjk s GLN 185 N -0.83 2.90 0.15 2.79 0.74 0.50 -1.22 119.66 124.70 2qjk s GLN 185 Ca 0.13 -2.55 -0.31 0.00 0.05 0.00 0.00 55.36 52.68 2qjk s GLN 185 Cb -0.11 -3.94 -0.08 0.00 1.10 0.00 0.00 33.01 29.97 2qjk s GLN 185 CO 0.02 -1.21 1.36 -0.51 -0.55 0.00 0.00 175.29 174.39 2qjk s LEU 186 N -0.07 4.39 0.00 3.68 1.43 -1.13 -3.76 118.68 123.22 2qjk s LEU 186 Ca 0.18 2.37 0.00 0.00 -1.03 0.00 0.00 54.13 55.65 2qjk s LEU 186 Cb -0.17 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.45 2qjk s LEU 186 CO -0.05 -0.60 0.00 0.61 0.23 0.00 0.00 176.35 176.53