#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 2.64 -0.06 2.61 -1.04 -1.26 -3.95 114.28 113.22 2qjk n THR 10 Ca 0.00 -1.43 -0.09 0.00 -2.04 0.00 0.00 64.05 60.49 2qjk n THR 10 Cb 0.00 -0.44 -0.08 0.00 -1.82 0.00 0.00 70.33 67.99 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 2.06 0.00 -0.01 -2.82 3.08 -2.05 -2.34 114.38 112.29 2qjk h ARG 11 Ca 0.29 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.11 2qjk h ARG 11 Cb 2.21 0.00 0.02 0.00 0.08 0.00 0.00 29.97 32.28 2qjk h ARG 11 CO 0.70 0.62 -0.87 0.00 -1.07 0.00 0.00 179.97 179.35 2qjk h ARG 12 N -1.00 0.61 -0.67 0.04 2.47 -2.01 -3.17 114.38 110.65 2qjk h ARG 12 Ca -0.00 -0.64 0.04 0.00 -1.26 0.00 0.00 59.98 58.11 2qjk h ARG 12 Cb 0.63 0.18 -0.04 0.00 -1.65 0.00 0.00 29.97 29.09 2qjk h ARG 12 CO -0.00 1.25 0.44 0.22 0.56 0.00 0.00 179.97 182.44 2qjk h ASP 13 N 0.23 0.68 0.71 7.04 3.58 -1.71 -0.23 116.42 126.73 2qjk h ASP 13 Ca -0.11 -0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.31 2qjk h ASP 13 Cb 1.54 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 42.44 2qjk h ASP 13 CO 0.17 0.47 -0.38 0.15 -2.88 0.00 0.00 179.24 176.77 2qjk h PHE 14 N 0.79 -0.99 -0.45 0.28 3.57 -1.42 -1.53 116.94 117.18 2qjk h PHE 14 Ca 0.27 -0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.84 2qjk h PHE 14 Cb 0.10 0.34 -0.10 0.00 2.79 0.00 0.00 35.95 39.08 2qjk h PHE 14 CO -0.00 -0.60 -0.37 1.25 -2.23 0.00 0.00 178.31 176.37 2qjk h LEU 15 N -1.01 -1.23 -1.21 0.59 5.85 -1.31 0.31 115.31 117.30 2qjk h LEU 15 Ca -0.09 0.21 0.21 0.00 0.84 0.00 0.00 57.88 59.04 2qjk h LEU 15 Cb 0.79 0.57 -0.09 0.00 0.37 0.00 0.00 40.66 42.30 2qjk h LEU 15 CO 0.13 -0.33 0.62 1.88 -0.34 0.00 0.00 178.44 180.40 2qjk h TYR 16 N -0.26 0.85 0.00 1.25 -1.99 -0.92 0.28 116.97 116.19 2qjk h TYR 16 Ca 0.17 0.03 -0.08 0.00 2.00 0.00 0.00 58.73 60.85 2qjk h TYR 16 Cb 0.56 -0.26 -0.01 0.00 2.00 0.00 0.00 36.73 39.02 2qjk h TYR 16 CO -0.60 0.18 -0.76 1.88 -0.00 0.00 0.00 178.16 178.86 2qjk h TYR 17 N 0.60 0.00 0.02 4.88 -1.99 0.13 -2.23 116.97 118.38 2qjk h TYR 17 Ca 0.55 0.00 -0.20 0.00 2.00 0.00 0.00 58.73 61.08 2qjk h TYR 17 Cb 1.09 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.80 2qjk h TYR 17 CO -0.00 0.34 -0.92 0.00 -0.00 0.00 0.00 178.16 177.58 2qjk h ALA 18 N 1.66 0.48 0.24 3.88 0.00 0.14 -2.80 119.26 122.86 2qjk h ALA 18 Ca -0.05 -0.78 -0.01 0.00 0.00 0.00 0.00 54.91 54.07 2qjk h ALA 18 Cb 1.30 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2qjk h ALA 18 CO 0.04 1.01 -0.11 1.15 0.00 0.00 0.00 179.25 181.33 2qjk h THR 19 N 0.06 0.00 -1.31 0.00 2.02 -0.57 -2.61 112.91 110.50 2qjk h THR 19 Ca -0.04 -0.23 0.38 0.00 0.77 0.00 0.00 66.41 67.29 2qjk h THR 19 Cb 1.59 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.94 2qjk h THR 19 CO 0.13 0.00 0.94 0.00 0.37 0.00 0.00 175.52 176.96 2qjk h ALA 20 N -1.62 3.21 0.57 6.16 0.00 -1.52 0.13 119.26 126.19 2qjk h ALA 20 Ca -0.03 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2qjk h ALA 20 Cb 0.25 0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.14 2qjk h ALA 20 CO 0.05 -1.59 -0.28 0.78 0.00 0.00 0.00 179.25 178.22 2qjk h GLY 21 N 0.02 -0.80 0.57 0.00 0.00 -1.42 -1.94 103.07 99.49 2qjk h GLY 21 Ca 0.63 0.30 0.09 0.00 0.00 0.00 0.00 47.33 48.35 2qjk h GLY 21 CO -0.02 -0.29 0.59 0.00 0.00 0.00 0.00 176.54 176.81 2qjk h ALA 22 N -0.65 1.37 0.00 3.60 0.00 -0.40 -2.14 119.26 121.04 2qjk h ALA 22 Ca -0.08 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2qjk h ALA 22 Cb 0.65 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2qjk h ALA 22 CO 0.13 0.26 -0.18 0.78 0.00 0.00 0.00 179.25 180.23 2qjk h GLY 23 N 0.99 -1.29 -0.64 0.00 0.00 -1.02 -1.36 103.07 99.75 2qjk h GLY 23 Ca 0.44 0.61 0.15 0.00 0.00 0.00 0.00 47.33 48.54 2qjk h GLY 23 CO -0.23 -0.43 -0.25 0.00 0.00 0.00 0.00 176.54 175.64 2qjk h ALA 24 N -1.14 0.40 -0.33 3.60 0.00 -0.97 -0.42 119.26 120.40 2qjk h ALA 24 Ca 0.00 0.29 0.05 0.00 0.00 0.00 0.00 54.91 55.26 2qjk h ALA 24 Cb 0.25 0.69 -0.08 0.00 0.00 0.00 0.00 17.79 18.65 2qjk h ALA 24 CO -0.12 -0.47 -0.49 0.28 0.00 0.00 0.00 179.25 178.45 2qjk h VAL 25 N -0.03 0.06 0.40 0.00 2.07 -0.75 -1.02 116.25 116.98 2qjk h VAL 25 Ca 0.36 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.87 2qjk h VAL 25 Cb 0.59 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 2qjk h VAL 25 CO -0.83 0.00 -0.41 0.00 0.02 0.00 0.00 177.57 176.34 2qjk h ALA 26 N 0.13 -1.08 -0.67 1.67 0.00 -0.15 -1.63 119.26 117.53 2qjk h ALA 26 Ca 0.09 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 54.97 2qjk h ALA 26 Cb 0.61 0.65 -0.12 0.00 0.00 0.00 0.00 17.79 18.94 2qjk h ALA 26 CO -0.54 -1.10 -0.22 2.41 0.00 0.00 0.00 179.25 179.80 2qjk n THR 27 N -4.92 -0.32 -0.18 0.00 -1.04 -0.28 0.15 114.28 107.69 2qjk n THR 27 Ca -0.10 1.56 -0.10 0.00 -2.04 0.00 0.00 64.05 63.38 2qjk n THR 27 Cb 0.38 -2.11 0.01 0.00 -1.82 0.00 0.00 70.33 66.78 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 0.98 1.09 3.41 0.00 -0.90 -1.75 103.07 105.90 2qjk h GLY 28 Ca 0.28 -0.73 0.09 0.00 0.00 0.00 0.00 47.33 46.97 2qjk h GLY 28 CO -0.68 0.67 0.37 0.00 0.00 0.00 0.00 176.54 176.90 2qjk h ALA 29 N 0.93 1.96 0.00 3.60 0.00 0.24 0.11 119.26 126.10 2qjk h ALA 29 Ca 0.14 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2qjk h ALA 29 Cb 0.54 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 2qjk h ALA 29 CO 0.03 -0.53 -0.05 0.00 0.00 0.00 0.00 179.25 178.70 2qjk h ALA 30 N 1.56 0.00 -0.50 0.00 0.00 -0.62 -3.38 119.26 116.31 2qjk h ALA 30 Ca 0.15 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.02 2qjk h ALA 30 Cb 0.89 0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.62 2qjk h ALA 30 CO -0.00 0.04 -0.19 0.28 0.00 0.00 0.00 179.25 179.38 2qjk h VAL 31 N -1.00 0.39 -0.35 0.00 2.07 -0.43 -3.03 116.25 113.91 2qjk h VAL 31 Ca -0.01 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.55 2qjk h VAL 31 Cb 0.24 0.39 -0.06 0.00 -1.52 0.00 0.00 31.29 30.34 2qjk h VAL 31 CO -0.00 0.00 -0.34 -0.25 0.02 0.00 0.00 177.57 177.00 2qjk h TRP 32 N -0.07 -1.06 -0.40 1.57 -0.00 -1.00 -1.26 115.95 113.73 2qjk h TRP 32 Ca 0.24 0.06 0.11 0.00 -0.00 0.00 0.00 58.89 59.29 2qjk h TRP 32 Cb 0.44 0.51 -0.02 0.00 -0.00 0.00 0.00 29.16 30.09 2qjk h TRP 32 CO -0.48 -0.27 0.29 -1.00 -0.00 0.00 0.00 178.44 176.98 2qjk h PRO 33 N -0.17 0.05 0.00 2.65 0.13 -1.72 0.97 132.00 133.91 2qjk h PRO 33 Ca 0.06 -0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.14 2qjk h PRO 33 Cb 0.32 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.43 2qjk h PRO 33 CO -0.42 0.03 -0.24 -0.07 -0.23 0.00 0.00 178.00 177.07 2qjk h LEU 34 N 0.05 0.00 0.00 1.56 3.38 -1.14 -1.64 115.31 117.52 2qjk h LEU 34 Ca 0.19 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.04 2qjk h LEU 34 Cb 0.69 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 2qjk h LEU 34 CO -0.01 0.24 -0.86 0.40 0.09 0.00 0.00 178.44 178.30 2qjk h ILE 35 N 0.00 0.60 -0.73 1.22 2.04 0.91 -3.39 117.51 118.16 2qjk h ILE 35 Ca -0.00 -1.71 0.17 0.00 1.00 0.00 0.00 64.86 64.32 2qjk h ILE 35 Cb 0.48 1.39 -0.04 0.00 -0.74 0.00 0.00 36.82 37.91 2qjk h ILE 35 CO 0.03 0.20 0.50 -1.13 0.00 0.00 0.00 178.15 177.75 2qjk h ASN 36 N -1.00 0.23 -0.53 1.72 -0.00 0.66 -1.18 115.58 115.48 2qjk h ASN 36 Ca -0.19 0.02 0.15 0.00 -0.00 0.00 0.00 56.30 56.28 2qjk h ASN 36 Cb 0.94 -0.03 -0.02 0.00 -0.00 0.00 0.00 38.32 39.21 2qjk h ASN 36 CO -0.11 0.11 0.55 0.06 -0.00 0.00 0.00 177.43 178.04 2qjk h GLN 37 N 0.24 0.00 0.00 6.67 -0.00 -1.49 0.29 115.11 120.83 2qjk h GLN 37 Ca 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.01 2qjk h GLN 37 Cb 1.04 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.52 2qjk h GLN 37 CO -0.08 0.00 0.00 0.52 -0.00 0.00 0.00 178.83 179.27 2qjk h MET 38 N 0.00 0.00 -7.28 0.06 2.86 -1.46 -3.46 114.93 105.66 2qjk h MET 38 Ca 0.25 0.00 -0.48 0.00 -2.06 0.00 0.00 59.70 57.41 2qjk h MET 38 Cb 1.35 0.00 0.17 0.00 0.06 0.00 0.00 31.60 33.18 2qjk h MET 38 CO -0.00 0.00 0.19 -0.80 1.06 0.00 0.00 176.91 177.36 2qjk s ASN 39 N -5.95 2.79 -0.13 1.22 0.02 0.10 -4.85 114.94 108.15 2qjk s ASN 39 Ca 0.06 1.66 -0.38 0.00 -1.02 0.00 0.00 52.86 53.19 2qjk s ASN 39 Cb 0.06 -2.30 -0.15 0.00 0.02 0.00 0.00 41.25 38.88 2qjk s ASN 39 CO 0.64 -3.10 1.65 -2.65 0.02 0.00 0.00 177.10 173.66 2qjk n PRO 40 N -4.20 1.36 -1.61 -0.60 -0.02 -1.26 -4.94 135.00 123.73 2qjk n PRO 40 Ca 0.07 0.50 -0.33 0.00 -2.02 0.00 0.00 63.50 61.72 2qjk n PRO 40 Cb 0.54 -2.20 0.06 0.00 -0.02 0.00 0.00 33.50 31.89 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 2.63 4.88 0.24 2.55 1.04 -1.26 -4.84 113.70 118.95 2qjk s SER 41 Ca 0.93 1.98 0.13 0.00 0.48 0.00 0.00 55.95 59.47 2qjk s SER 41 Cb -0.96 -2.55 0.71 0.00 0.10 0.00 0.00 66.02 63.32 2qjk s SER 41 CO 0.57 -1.78 1.34 0.00 0.98 0.00 0.00 173.24 174.35 2qjk n ALA 42 N -2.72 0.84 -0.01 5.32 0.00 -1.26 -1.33 120.51 121.36 2qjk n ALA 42 Ca 0.10 0.12 -0.09 0.00 0.00 0.00 0.00 53.44 53.58 2qjk n ALA 42 Cb 0.52 -1.01 -0.14 0.00 0.00 0.00 0.00 19.45 18.83 2qjk n ALA 42 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2qjk h ASP 43 N 0.00 0.01 -0.22 0.00 2.03 -2.01 -3.34 116.42 112.89 2qjk h ASP 43 Ca 0.00 -0.03 -0.13 0.00 -0.73 0.00 0.00 57.03 56.15 2qjk h ASP 43 Cb 0.25 -0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.75 2qjk h ASP 43 CO 0.00 1.02 -0.36 0.58 -1.03 0.00 0.00 179.24 179.45 2qjk h VAL 44 N 0.00 1.32 0.00 4.15 2.07 -1.56 -3.12 116.25 119.11 2qjk h VAL 44 Ca -0.24 -1.57 0.00 0.00 0.82 0.00 0.00 66.70 65.71 2qjk h VAL 44 Cb 1.97 1.79 0.00 0.00 -1.52 0.00 0.00 31.29 33.54 2qjk h VAL 44 CO 0.09 0.49 0.00 0.00 0.02 0.00 0.00 177.57 178.17 2qjk n GLN 45 N -4.26 0.00 -2.78 1.57 6.02 -1.09 -4.15 117.38 112.69 2qjk n GLN 45 Ca -0.05 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.51 2qjk n GLN 45 Cb 0.51 -0.98 0.01 0.00 1.02 0.00 0.00 30.24 30.80 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 -0.10 5.12 -2.04 -1.58 0.00 -1.18 -4.97 120.51 115.76 2qjk n ALA 46 Ca 0.00 -4.59 -0.39 0.00 0.00 0.00 0.00 53.44 48.46 2qjk n ALA 46 Cb 0.00 -2.63 -0.03 0.00 0.00 0.00 0.00 19.45 16.79 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 -1.49 3.31 0.00 0.00 2.96 -1.26 -4.97 118.68 117.23 2qjk s LEU 47 Ca 0.35 0.41 0.00 0.00 -0.22 0.00 0.00 54.13 54.66 2qjk s LEU 47 Cb 0.05 -2.60 0.00 0.00 0.50 0.00 0.00 46.19 44.14 2qjk s LEU 47 CO 0.05 -2.33 0.00 0.00 -1.32 0.00 0.00 176.35 172.75 2qjk n ALA 48 N 12.58 0.00 -3.48 5.97 0.00 -1.26 -5.10 120.51 129.22 2qjk n ALA 48 Ca 0.21 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.59 2qjk n ALA 48 Cb 0.52 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.90 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 -1.00 -0.44 0.61 0.00 0.01 -1.26 -4.88 113.70 106.74 2qjk s SER 49 Ca 0.00 0.84 0.04 0.00 1.31 0.00 0.00 55.95 58.14 2qjk s SER 49 Cb 0.00 1.57 0.08 0.00 0.21 0.00 0.00 66.02 67.89 2qjk s SER 49 CO 0.00 -0.25 0.84 0.27 0.41 0.00 0.00 173.24 174.51 2qjk s ILE 50 N 2.68 2.33 -0.03 1.44 -4.36 -1.00 -4.97 121.20 117.29 2qjk s ILE 50 Ca 0.06 -0.78 0.03 0.00 -0.26 0.00 0.00 60.65 59.69 2qjk s ILE 50 Cb -0.14 -2.55 0.01 0.00 1.25 0.00 0.00 42.46 41.03 2qjk s ILE 50 CO -0.16 0.00 -0.10 -0.36 0.24 0.00 0.00 174.94 174.56 2qjk s PHE 51 N -2.84 1.11 -0.19 1.37 0.40 -1.26 -2.93 117.98 113.64 2qjk s PHE 51 Ca 0.62 -0.31 0.01 0.00 -0.60 0.00 0.00 56.93 56.66 2qjk s PHE 51 Cb -0.07 -0.79 0.03 0.00 0.51 0.00 0.00 43.02 42.69 2qjk s PHE 51 CO 0.40 -0.14 -0.18 0.08 0.70 0.00 0.00 175.22 176.08 2qjk s VAL 52 N 0.29 2.04 -0.18 -0.44 1.01 -0.48 -4.98 120.40 117.67 2qjk s VAL 52 Ca -0.05 -1.01 -0.29 0.00 0.00 0.00 0.00 61.98 60.62 2qjk s VAL 52 Cb -0.10 -1.89 -0.00 0.00 0.00 0.00 0.00 36.38 34.38 2qjk s VAL 52 CO 0.01 0.46 1.08 -0.62 0.00 0.00 0.00 175.10 176.03 2qjk s ASP 53 N 1.28 7.11 -0.16 3.32 2.15 -1.26 -1.93 116.67 127.18 2qjk s ASP 53 Ca 0.03 1.50 0.18 0.00 0.43 0.00 0.00 52.55 54.69 2qjk s ASP 53 Cb -0.14 -2.55 0.40 0.00 -0.30 0.00 0.00 42.92 40.34 2qjk s ASP 53 CO -0.12 -0.62 1.28 0.55 -0.17 0.00 0.00 175.17 176.08 2qjk n VAL 54 N 5.09 2.08 -0.23 1.11 3.14 -0.62 -4.74 118.33 124.16 2qjk n VAL 54 Ca 0.11 -2.14 -0.08 0.00 -2.96 0.00 0.00 64.34 59.28 2qjk n VAL 54 Cb 0.46 -0.25 0.03 0.00 -1.06 0.00 0.00 33.84 33.03 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 0.82 0.93 0.00 6.55 4.64 -1.91 -2.91 113.55 121.68 2qjk h SER 55 Ca 0.01 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 2qjk h SER 55 Cb 1.21 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 2qjk h SER 55 CO 0.11 0.90 0.00 -1.54 -0.87 0.00 0.00 176.83 175.42 2qjk n SER 56 N -4.36 1.26 -4.29 4.97 3.41 -1.26 -4.75 113.62 108.61 2qjk n SER 56 Ca 0.04 -1.92 -0.41 0.00 -0.26 0.00 0.00 58.87 56.32 2qjk n SER 56 Cb 0.22 -0.48 -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 -0.84 4.38 0.84 -3.33 1.01 -1.10 -5.07 120.40 116.29 2qjk s VAL 57 Ca 0.00 -1.36 -0.12 0.00 0.00 0.00 0.00 61.98 60.50 2qjk s VAL 57 Cb 0.00 -3.68 0.10 0.00 0.00 0.00 0.00 36.38 32.80 2qjk s VAL 57 CO 0.00 -0.52 1.17 -1.61 0.00 0.00 0.00 175.10 174.13 2qjk s GLU 58 N 1.46 1.69 0.36 2.72 8.01 -1.26 -4.98 118.70 126.69 2qjk s GLU 58 Ca 0.03 0.16 -0.25 0.00 0.01 0.00 0.00 54.97 54.92 2qjk s GLU 58 Cb -0.23 -1.91 -0.09 0.00 -4.31 0.00 0.00 34.13 27.58 2qjk s GLU 58 CO 0.03 -1.79 1.02 -1.25 0.01 0.00 0.00 175.26 173.27 2qjk s PRO 59 N -5.49 4.36 0.00 0.39 0.04 -1.26 -3.23 135.00 129.81 2qjk s PRO 59 Ca 0.63 1.48 0.00 0.00 0.04 0.00 0.00 61.00 63.14 2qjk s PRO 59 Cb -0.12 -2.70 0.00 0.00 0.04 0.00 0.00 34.50 31.72 2qjk s PRO 59 CO 0.50 0.04 0.00 0.41 0.04 0.00 0.00 177.00 178.00 2qjk n GLY 60 N 0.49 0.89 3.30 0.56 0.00 0.27 -4.90 105.19 105.80 2qjk n GLY 60 Ca 0.03 -0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.00 2.10 -0.09 1.61 1.01 -1.20 -4.98 120.40 116.86 2qjk s VAL 61 Ca 0.00 -1.07 -0.02 0.00 0.00 0.00 0.00 61.98 60.89 2qjk s VAL 61 Cb 0.00 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 2qjk s VAL 61 CO 0.00 0.58 0.01 -1.58 0.00 0.00 0.00 175.10 174.11 2qjk s GLN 62 N -0.38 3.01 -0.24 2.72 0.74 -1.26 -1.70 119.66 122.56 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 -2.82 0.02 0.00 1.10 0.00 0.00 33.01 31.19 2qjk s GLN 62 CO 0.02 0.71 -0.06 -1.17 -0.55 0.00 0.00 175.29 174.23 2qjk s LEU 63 N -0.91 3.05 -0.24 3.68 2.96 0.23 -4.93 118.68 122.52 2qjk s LEU 63 Ca 0.14 -0.74 -0.09 0.00 -0.22 0.00 0.00 54.13 53.22 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 0.03 -0.09 0.11 -0.89 -1.32 0.00 0.00 176.35 174.18 2qjk s THR 64 N 1.36 4.79 0.06 3.68 2.01 -1.26 -1.53 115.64 124.75 2qjk s THR 64 Ca 0.02 -0.02 0.07 0.00 0.31 0.00 0.00 61.69 62.07 2qjk s THR 64 Cb -0.16 -3.23 -0.03 0.00 0.01 0.00 0.00 72.50 69.10 2qjk s THR 64 CO -0.05 0.35 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.36 2qjk s VAL 65 N 1.24 1.48 0.28 3.82 1.01 -0.74 -4.94 120.40 122.55 2qjk s VAL 65 Ca 0.06 -1.24 -0.15 0.00 0.00 0.00 0.00 61.98 60.65 2qjk s VAL 65 Cb -0.14 -1.33 -0.08 0.00 0.00 0.00 0.00 36.38 34.83 2qjk s VAL 65 CO 0.05 0.04 0.69 -0.75 0.00 0.00 0.00 175.10 175.13 2qjk s LYS 66 N -1.41 4.00 -0.29 2.72 2.20 -1.26 -0.32 119.74 125.39 2qjk s LYS 66 Ca 0.05 0.62 -0.16 0.00 -0.36 0.00 0.00 55.97 56.12 2qjk s LYS 66 Cb -0.09 -2.58 0.12 0.00 -1.51 0.00 0.00 37.83 33.77 2qjk s LYS 66 CO 0.02 0.25 0.86 0.12 -0.36 0.00 0.00 175.35 176.24 2qjk s PHE 67 N -1.84 -0.77 -1.22 4.03 5.36 -0.32 -4.89 117.98 118.32 2qjk s PHE 67 Ca 0.50 1.54 0.00 0.00 -0.96 0.00 0.00 56.93 58.01 2qjk s PHE 67 Cb -0.12 0.46 0.00 0.00 -0.34 0.00 0.00 43.02 43.03 2qjk s PHE 67 CO 0.19 -0.38 0.00 1.28 -1.46 0.00 0.00 175.22 174.84 2qjk n LEU 68 N 4.00 -1.22 0.00 6.12 4.77 -1.26 -0.93 117.00 128.48 2qjk n LEU 68 Ca -0.19 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 2qjk n LEU 68 Cb 0.58 -2.23 0.00 0.00 -2.33 0.00 0.00 43.42 39.43 2qjk n LEU 68 CO 0.00 -0.25 0.00 0.61 -1.33 0.00 0.00 177.39 176.42 2qjk n GLY 69 N -0.73 2.35 3.64 -0.72 0.00 -1.26 -5.01 105.19 103.46 2qjk n GLY 69 Ca -0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.01 2.33 0.65 1.61 1.02 -0.11 -5.09 119.74 120.14 2qjk s LYS 70 Ca 0.00 -1.04 -0.13 0.00 0.02 0.00 0.00 55.97 54.82 2qjk s LYS 70 Cb 0.00 -2.37 -0.01 0.00 -0.52 0.00 0.00 37.83 34.93 2qjk s LYS 70 CO 0.00 0.48 1.06 -1.25 -0.92 0.00 0.00 175.35 174.72 2qjk s PRO 71 N -2.62 3.14 -0.05 -1.68 0.04 -1.26 -1.18 135.00 131.39 2qjk s PRO 71 Ca 0.25 1.06 -0.00 0.00 0.04 0.00 0.00 61.00 62.35 2qjk s PRO 71 Cb -0.10 -2.01 0.03 0.00 0.04 0.00 0.00 34.50 32.45 2qjk s PRO 71 CO 0.17 -0.94 -0.00 0.42 0.04 0.00 0.00 177.00 176.68 2qjk s ILE 72 N -2.79 0.33 0.01 0.56 1.01 0.57 -2.05 121.20 118.85 2qjk s ILE 72 Ca 0.60 0.08 -0.18 0.00 0.00 0.00 0.00 60.65 61.16 2qjk s ILE 72 Cb -0.15 -0.46 -0.06 0.00 0.01 0.00 0.00 42.46 41.81 2qjk s ILE 72 CO 0.47 0.22 0.50 -0.36 0.00 0.00 0.00 174.94 175.77 2qjk s PHE 73 N 1.55 3.73 -0.31 3.97 0.08 0.18 -1.80 117.98 125.38 2qjk s PHE 73 Ca -0.02 1.12 -0.02 0.00 0.12 0.00 0.00 56.93 58.13 2qjk s PHE 73 Cb -0.13 -2.44 0.10 0.00 -0.57 0.00 0.00 43.02 39.98 2qjk s PHE 73 CO -0.03 0.53 0.12 0.42 -0.10 0.00 0.00 175.22 176.16 2qjk s ILE 74 N -0.77 0.43 -0.09 0.64 1.01 -0.58 -1.55 121.20 120.28 2qjk s ILE 74 Ca 0.27 -1.17 -0.01 0.00 0.00 0.00 0.00 60.65 59.75 2qjk s ILE 74 Cb -0.18 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 40.92 2qjk s ILE 74 CO 0.16 -0.72 -0.06 -0.60 0.00 0.00 0.00 174.94 173.71 2qjk s ARG 75 N 1.77 3.04 -0.48 2.79 3.52 -0.36 0.74 118.95 129.95 2qjk s ARG 75 Ca 0.10 -0.54 -0.14 0.00 -0.13 0.00 0.00 55.73 55.02 2qjk s ARG 75 Cb -0.17 -2.68 0.10 0.00 -1.56 0.00 0.00 34.95 30.63 2qjk s ARG 75 CO -0.28 0.53 0.40 0.50 -0.81 0.00 0.00 175.30 175.63 2qjk s ARG 76 N -0.44 2.86 0.57 5.12 3.52 -0.69 -1.44 118.95 128.45 2qjk s ARG 76 Ca 0.07 -1.53 -0.19 0.00 -0.13 0.00 0.00 55.73 53.95 2qjk s ARG 76 Cb -0.12 -4.10 -0.05 0.00 -1.56 0.00 0.00 34.95 29.12 2qjk s ARG 76 CO 0.02 -1.13 1.16 1.03 -0.81 0.00 0.00 175.30 175.57 2qjk s ARG 77 N 1.56 3.17 0.83 5.12 0.52 0.42 0.95 118.95 131.52 2qjk s ARG 77 Ca 0.04 1.68 -0.08 0.00 -0.52 0.00 0.00 55.73 56.84 2qjk s ARG 77 Cb -0.26 -1.97 0.15 0.00 0.52 0.00 0.00 34.95 33.39 2qjk s ARG 77 CO 0.04 -1.01 1.14 0.95 0.02 0.00 0.00 175.30 176.44 2qjk s THR 78 N -1.74 2.09 0.03 0.02 -4.23 -1.26 -4.52 115.64 106.03 2qjk s THR 78 Ca 0.74 -0.28 -0.23 0.00 -1.18 0.00 0.00 61.69 60.75 2qjk s THR 78 Cb -0.26 -2.82 -0.16 0.00 1.34 0.00 0.00 72.50 70.61 2qjk s THR 78 CO 0.30 0.00 1.39 -0.33 -0.54 0.00 0.00 174.62 175.44 2qjk h GLU 79 N -1.04 0.18 -0.87 3.99 5.08 -1.98 -0.75 114.58 119.20 2qjk h GLU 79 Ca -0.41 -0.08 0.19 0.00 -1.00 0.00 0.00 59.36 58.07 2qjk h GLU 79 Cb 1.26 -0.01 -0.16 0.00 0.50 0.00 0.00 28.75 30.34 2qjk h GLU 79 CO 0.42 0.53 -0.12 0.00 -1.00 0.00 0.00 179.01 178.84 2qjk h ALA 80 N 0.65 0.74 0.59 3.43 0.00 -1.99 0.53 119.26 123.21 2qjk h ALA 80 Ca 0.02 0.32 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 2qjk h ALA 80 Cb 0.46 0.60 0.01 0.00 0.00 0.00 0.00 17.79 18.86 2qjk h ALA 80 CO 0.01 -0.44 -0.28 -0.44 0.00 0.00 0.00 179.25 178.10 2qjk h ASP 81 N 0.02 -0.67 -0.38 0.00 3.32 -1.84 -2.91 116.42 113.97 2qjk h ASP 81 Ca 0.45 -0.03 0.07 0.00 0.02 0.00 0.00 57.03 57.55 2qjk h ASP 81 Cb 0.78 0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.48 2qjk h ASP 81 CO -0.85 -0.38 0.26 0.40 -1.72 0.00 0.00 179.24 176.95 2qjk h ILE 82 N -0.94 0.91 0.00 0.35 2.04 0.47 -2.66 117.51 117.68 2qjk h ILE 82 Ca -0.08 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.71 2qjk h ILE 82 Cb 0.65 0.69 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 2qjk h ILE 82 CO 0.13 0.04 0.00 1.21 0.00 0.00 0.00 178.15 179.53 2qjk n GLU 83 N -4.47 0.00 -0.38 2.37 4.07 0.17 -2.76 120.64 119.64 2qjk n GLU 83 Ca 0.05 0.30 0.32 0.00 -0.06 0.00 0.00 57.16 57.78 2qjk n GLU 83 Cb 0.31 -1.27 0.59 0.00 -0.06 0.00 0.00 31.44 31.01 2qjk n GLU 83 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2qjk h LEU 84 N 0.00 0.34 -0.59 4.31 4.07 -1.43 0.42 115.31 122.43 2qjk h LEU 84 Ca 0.00 0.19 0.04 0.00 0.08 0.00 0.00 57.88 58.18 2qjk h LEU 84 Cb 0.00 0.17 -0.04 0.00 1.08 0.00 0.00 40.66 41.87 2qjk h LEU 84 CO 0.00 -0.24 0.34 1.23 -1.08 0.00 0.00 178.44 178.69 2qjk h GLY 85 N 0.12 0.84 2.00 0.83 0.00 -1.44 -1.60 103.07 103.82 2qjk h GLY 85 Ca 0.81 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.89 2qjk h GLY 85 CO -0.57 0.18 0.00 0.54 0.00 0.00 0.00 176.54 176.70 2qjk n ARG 86 N -4.79 0.14 -0.74 4.80 1.74 0.14 -3.71 116.66 114.25 2qjk n ARG 86 Ca 0.06 0.15 -0.14 0.00 -0.77 0.00 0.00 57.85 57.15 2qjk n ARG 86 Cb 0.11 -1.68 0.06 0.00 -1.02 0.00 0.00 32.46 29.94 2qjk n ARG 86 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2qjk n SER 87 N -1.92 4.91 -3.74 0.55 3.41 -0.60 -4.84 113.62 111.39 2qjk n SER 87 Ca 0.06 -2.91 -0.21 0.00 -0.26 0.00 0.00 58.87 55.54 2qjk n SER 87 Cb 0.36 -0.86 -0.18 0.00 -0.26 0.00 0.00 64.21 63.28 2qjk n SER 87 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2qjk s VAL 88 N -1.92 0.18 0.19 -3.33 1.01 -1.24 -5.01 120.40 110.28 2qjk s VAL 88 Ca 0.29 0.23 -0.32 0.00 0.00 0.00 0.00 61.98 62.18 2qjk s VAL 88 Cb 0.23 -0.37 -0.11 0.00 0.00 0.00 0.00 36.38 36.13 2qjk s VAL 88 CO 0.02 0.22 1.69 -1.10 0.00 0.00 0.00 175.10 175.93 2qjk s GLN 89 N 1.96 4.15 0.39 2.72 -1.52 -1.26 -4.81 119.66 121.28 2qjk s GLN 89 Ca 0.04 2.55 0.15 0.00 -1.95 0.00 0.00 55.36 56.14 2qjk s GLN 89 Cb -0.12 -3.11 1.00 0.00 -0.22 0.00 0.00 33.01 30.55 2qjk s GLN 89 CO -0.04 -0.72 1.83 1.25 -0.25 0.00 0.00 175.29 177.35 2qjk h LEU 90 N 6.87 0.51 0.00 2.90 6.46 -1.97 0.53 115.31 130.61 2qjk h LEU 90 Ca -0.43 0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.39 2qjk h LEU 90 Cb 1.20 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 41.10 2qjk h LEU 90 CO 0.95 0.19 0.00 0.61 -0.62 0.00 0.00 178.44 179.57 2qjk n GLY 91 N -1.47 -0.61 0.01 3.75 0.00 -1.26 -1.52 105.19 104.09 2qjk n GLY 91 Ca 0.21 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.30 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 -1.35 0.14 -2.66 1.61 6.02 0.18 -4.95 117.38 116.37 2qjk n GLN 92 Ca 0.03 -0.02 -0.33 0.00 -0.01 0.00 0.00 57.00 56.67 2qjk n GLN 92 Cb 0.07 -1.53 -0.05 0.00 1.02 0.00 0.00 30.24 29.75 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 -3.39 3.85 0.01 1.08 1.43 -0.58 -4.99 118.68 116.09 2qjk s LEU 93 Ca 0.06 1.72 -0.18 0.00 -1.03 0.00 0.00 54.13 54.70 2qjk s LEU 93 Cb 0.16 -4.54 -0.34 0.00 0.03 0.00 0.00 46.19 41.50 2qjk s LEU 93 CO 0.83 -0.51 0.98 0.58 0.23 0.00 0.00 176.35 178.46 2qjk h VAL 94 N 1.61 1.35 -3.37 -1.59 2.07 -1.87 -3.42 116.25 111.02 2qjk h VAL 94 Ca -0.49 -2.63 -0.67 0.00 0.82 0.00 0.00 66.70 63.74 2qjk h VAL 94 Cb 1.19 3.06 -0.17 0.00 -1.52 0.00 0.00 31.29 33.85 2qjk h VAL 94 CO 0.61 0.78 -0.64 -0.62 0.02 0.00 0.00 177.57 177.72 2qjk s ASP 95 N -7.40 5.08 -0.13 0.57 2.15 -1.26 -4.98 116.67 110.69 2qjk s ASP 95 Ca -0.10 0.06 0.14 0.00 0.43 0.00 0.00 52.55 53.07 2qjk s ASP 95 Cb 0.03 -1.53 -0.24 0.00 -0.30 0.00 0.00 42.92 40.88 2qjk s ASP 95 CO 0.92 0.32 0.34 0.41 -0.17 0.00 0.00 175.17 176.98 2qjk n THR 96 N 2.56 1.51 -2.18 1.71 -1.04 -1.26 -4.81 114.28 110.76 2qjk n THR 96 Ca -0.18 -0.81 -0.41 0.00 -2.04 0.00 0.00 64.05 60.61 2qjk n THR 96 Cb 0.53 -0.80 -0.02 0.00 -1.82 0.00 0.00 70.33 68.22 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 -5.85 6.86 0.49 8.00 3.84 -1.26 0.13 114.94 127.16 2qjk s ASN 97 Ca -0.09 2.61 0.28 0.00 0.21 0.00 0.00 52.86 55.87 2qjk s ASN 97 Cb 0.07 -2.64 1.21 0.00 -0.55 0.00 0.00 41.25 39.33 2qjk s ASN 97 CO 0.82 -0.46 1.94 0.00 -2.79 0.00 0.00 177.10 176.60 2qjk h ALA 98 N 3.49 1.08 -6.25 1.71 0.00 -1.76 -3.39 119.26 114.14 2qjk h ALA 98 Ca -0.48 -0.13 -0.46 0.00 0.00 0.00 0.00 54.91 53.83 2qjk h ALA 98 Cb 1.22 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 2qjk h ALA 98 CO 0.66 0.18 -0.76 0.54 0.00 0.00 0.00 179.25 179.86 2qjk n ARG 99 N -3.37 -5.60 -3.97 0.00 5.12 -1.26 -4.75 116.66 102.83 2qjk n ARG 99 Ca -0.00 0.61 -0.34 0.00 -1.93 0.00 0.00 57.85 56.19 2qjk n ARG 99 Cb 0.34 -5.47 -0.14 0.00 -1.16 0.00 0.00 32.46 26.03 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 -3.45 4.14 0.43 0.55 3.84 -1.26 -1.30 114.94 117.88 2qjk s ASN 100 Ca 0.57 -0.72 0.23 0.00 0.21 0.00 0.00 52.86 53.16 2qjk s ASN 100 Cb -0.28 -1.66 0.90 0.00 -0.55 0.00 0.00 41.25 39.66 2qjk s ASN 100 CO 0.82 -0.08 1.82 0.00 -2.79 0.00 0.00 177.10 176.87 2qjk h ALA 101 N 8.03 1.03 -0.10 1.71 0.00 -1.73 -3.03 119.26 125.16 2qjk h ALA 101 Ca -0.37 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.21 2qjk h ALA 101 Cb 1.13 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2qjk h ALA 101 CO 0.59 0.31 -0.43 -0.91 0.00 0.00 0.00 179.25 178.81 2qjk h ASN 102 N 0.00 0.25 -5.02 0.00 2.35 -1.82 -3.46 115.58 107.88 2qjk h ASN 102 Ca -0.00 -0.11 -0.48 0.00 -0.55 0.00 0.00 56.30 55.16 2qjk h ASN 102 Cb 0.75 -0.07 -0.06 0.00 0.05 0.00 0.00 38.32 38.99 2qjk h ASN 102 CO 0.03 0.66 -0.28 2.30 -1.65 0.00 0.00 177.43 178.49 2qjk n ILE 103 N -4.01 0.00 -1.46 2.81 -5.35 -1.15 -5.09 119.36 105.10 2qjk n ILE 103 Ca -0.02 -1.77 -0.37 0.00 -0.27 0.00 0.00 62.75 60.33 2qjk n ILE 103 Cb 0.49 0.07 0.06 0.00 -1.74 0.00 0.00 39.64 38.53 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 -1.61 0.01 0.00 7.28 2.03 -1.26 -4.84 116.55 118.16 2qjk n ASP 104 Ca -0.08 0.72 0.12 0.00 0.52 0.00 0.00 54.79 56.07 2qjk n ASP 104 Cb 0.49 -1.33 0.63 0.00 -0.72 0.00 0.00 41.12 40.20 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 -2.06 2.26 0.73 -1.67 0.00 -1.26 -2.82 120.51 115.70 2qjk n ALA 105 Ca 0.13 -0.12 0.09 0.00 0.00 0.00 0.00 53.44 53.53 2qjk n ALA 105 Cb 0.48 -1.40 -0.11 0.00 0.00 0.00 0.00 19.45 18.43 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 0.79 -0.71 2.90 0.00 0.00 -1.26 -4.93 105.19 101.99 2qjk n GLY 106 Ca 0.12 -0.50 -0.36 0.00 0.00 0.00 0.00 46.02 45.29 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 -5.51 -2.46 4.61 0.00 -1.13 -4.85 120.51 109.65 2qjk n ALA 107 Ca 0.03 -0.96 -0.31 0.00 0.00 0.00 0.00 53.44 52.19 2qjk n ALA 107 Cb 0.30 -0.96 -0.13 0.00 0.00 0.00 0.00 19.45 18.67 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 -1.93 2.19 0.00 0.00 2.02 -1.26 -3.04 118.70 116.68 2qjk s GLU 108 Ca 0.37 -0.90 0.00 0.00 0.02 0.00 0.00 54.97 54.46 2qjk s GLU 108 Cb -0.05 -2.24 0.00 0.00 0.10 0.00 0.00 34.13 31.94 2qjk s GLU 108 CO 0.73 0.56 0.00 0.00 0.02 0.00 0.00 175.26 176.57 2qjk n ALA 109 N 1.77 1.21 -2.12 5.21 0.00 0.36 -4.47 120.51 122.47 2qjk n ALA 109 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.86 2qjk n ALA 109 Cb 0.52 -1.22 -0.03 0.00 0.00 0.00 0.00 19.45 18.71 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 1.22 3.72 0.53 0.00 -4.23 -1.26 -4.85 115.64 110.77 2qjk s THR 110 Ca 0.00 1.41 0.42 0.00 -1.18 0.00 0.00 61.69 62.34 2qjk s THR 110 Cb 0.00 -3.90 0.63 0.00 1.34 0.00 0.00 72.50 70.57 2qjk s THR 110 CO 0.00 0.21 1.66 -0.78 -0.54 0.00 0.00 174.62 175.17 2qjk h ASP 111 N 5.47 0.06 0.08 3.99 1.82 -1.87 1.35 116.42 127.31 2qjk h ASP 111 Ca -0.44 0.03 -0.06 0.00 -0.39 0.00 0.00 57.03 56.16 2qjk h ASP 111 Cb 1.21 0.02 -0.01 0.00 0.68 0.00 0.00 39.33 41.23 2qjk h ASP 111 CO 0.75 -0.03 -0.20 1.56 -1.61 0.00 0.00 179.24 179.71 2qjk h GLN 112 N 0.03 0.23 -0.07 0.28 7.50 -1.92 -2.26 115.11 118.91 2qjk h GLN 112 Ca 0.79 -0.07 0.00 0.00 0.50 0.00 0.00 58.65 59.88 2qjk h GLN 112 Cb 3.04 -0.03 0.00 0.00 0.05 0.00 0.00 27.48 30.54 2qjk h GLN 112 CO -0.09 0.43 0.00 0.09 -1.50 0.00 0.00 178.83 177.76 2qjk n ASN 113 N -4.21 0.81 -0.00 1.46 3.02 0.46 -3.71 115.26 113.08 2qjk n ASN 113 Ca -0.01 -1.50 0.08 0.00 -0.03 0.00 0.00 54.58 53.12 2qjk n ASN 113 Cb 0.32 -0.04 -0.11 0.00 -0.61 0.00 0.00 39.78 39.34 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 -0.27 0.99 -3.12 3.52 5.12 -0.85 -4.82 116.66 117.22 2qjk n ARG 114 Ca 0.16 -0.09 -0.18 0.00 -1.93 0.00 0.00 57.85 55.80 2qjk n ARG 114 Cb 0.20 -1.32 0.02 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 -2.87 2.72 -0.17 0.55 -4.23 -1.20 -4.55 115.64 105.89 2qjk s THR 115 Ca -0.02 -1.06 0.04 0.00 -1.18 0.00 0.00 61.69 59.47 2qjk s THR 115 Cb 0.11 -2.79 -0.22 0.00 1.34 0.00 0.00 72.50 70.94 2qjk s THR 115 CO 0.65 0.00 0.17 0.18 -0.54 0.00 0.00 174.62 175.08 2qjk n LEU 116 N -1.89 1.97 -4.97 4.79 4.77 -0.90 -4.97 117.00 115.81 2qjk n LEU 116 Ca 0.09 0.10 -0.21 0.00 -0.03 0.00 0.00 56.01 55.95 2qjk n LEU 116 Cb 0.60 -0.54 0.02 0.00 -2.33 0.00 0.00 43.42 41.17 2qjk n LEU 116 CO 0.40 0.74 0.26 1.51 -1.33 0.00 0.00 177.39 178.97 2qjk s ASP 117 N -6.43 5.70 0.27 -1.43 -4.77 -1.26 -5.01 116.67 103.74 2qjk s ASP 117 Ca -0.21 0.09 0.24 0.00 -3.30 0.00 0.00 52.55 49.37 2qjk s ASP 117 Cb 0.07 -1.27 0.34 0.00 -1.09 0.00 0.00 42.92 40.98 2qjk s ASP 117 CO 0.74 -0.78 1.43 -0.33 0.70 0.00 0.00 175.17 176.93 2qjk h GLU 118 N 0.41 0.00 0.00 2.11 3.07 -1.94 -3.06 114.58 115.16 2qjk h GLU 118 Ca -0.45 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.41 2qjk h GLU 118 Cb 1.27 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.17 2qjk h GLU 118 CO 0.55 0.00 -0.03 0.00 -1.40 0.00 0.00 179.01 178.12 2qjk h ALA 119 N 2.20 0.98 0.00 3.43 0.00 -1.99 -3.48 119.26 120.40 2qjk h ALA 119 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2qjk h ALA 119 Cb 0.90 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2qjk h ALA 119 CO 0.00 0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.70 2qjk n GLY 120 N 1.10 0.43 0.24 0.00 0.00 -1.16 -4.95 105.19 100.85 2qjk n GLY 120 Ca 0.04 -0.75 -0.09 0.00 0.00 0.00 0.00 46.02 45.22 2qjk n GLY 120 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2qjk h GLU 121 N 0.33 0.71 -4.03 1.61 5.08 -1.88 -3.42 114.58 112.97 2qjk h GLU 121 Ca 0.00 -0.36 -0.75 0.00 -1.00 0.00 0.00 59.36 57.25 2qjk h GLU 121 Cb 0.00 0.01 -0.27 0.00 0.50 0.00 0.00 28.75 28.98 2qjk h GLU 121 CO 0.00 0.98 -0.20 -1.58 -1.00 0.00 0.00 179.01 177.21 2qjk s TRP 122 N -4.32 3.45 -0.37 4.33 0.52 -1.26 -0.43 118.94 120.86 2qjk s TRP 122 Ca -0.09 -1.79 -0.16 0.00 0.02 0.00 0.00 56.10 54.08 2qjk s TRP 122 Cb 0.12 -3.66 0.00 0.00 -1.15 0.00 0.00 33.47 28.78 2qjk s TRP 122 CO 0.85 -0.99 0.41 -1.17 0.02 0.00 0.00 176.95 176.07 2qjk s LEU 123 N 0.99 4.60 -0.11 2.99 2.96 -0.52 -2.12 118.68 127.46 2qjk s LEU 123 Ca 0.09 -0.39 0.02 0.00 -0.22 0.00 0.00 54.13 53.64 2qjk s LEU 123 Cb -0.23 -2.38 0.01 0.00 0.50 0.00 0.00 46.19 44.09 2qjk s LEU 123 CO -0.02 -0.45 -0.18 -0.69 -1.32 0.00 0.00 176.35 173.69 2qjk s VAL 124 N 2.11 1.70 0.13 1.68 1.01 -1.26 -1.23 120.40 124.53 2qjk s VAL 124 Ca 0.13 -0.78 -0.25 0.00 0.00 0.00 0.00 61.98 61.08 2qjk s VAL 124 Cb -0.17 -1.52 0.07 0.00 0.00 0.00 0.00 36.38 34.77 2qjk s VAL 124 CO 0.13 0.48 0.80 0.00 0.00 0.00 0.00 175.10 176.51 2qjk s MET 125 N 0.79 1.20 -0.20 2.72 0.23 -0.59 -4.58 119.30 118.86 2qjk s MET 125 Ca -0.10 -0.55 -0.29 0.00 -1.03 0.00 0.00 55.69 53.72 2qjk s MET 125 Cb -0.16 0.48 -0.03 0.00 -1.53 0.00 0.00 34.83 33.60 2qjk s MET 125 CO 0.01 -0.54 1.59 -1.58 -2.03 0.00 0.00 175.02 172.47 2qjk s TRP 126 N -3.47 2.16 0.00 3.16 0.52 -0.06 0.48 118.94 121.73 2qjk s TRP 126 Ca 0.07 0.54 -0.03 0.00 0.02 0.00 0.00 56.10 56.70 2qjk s TRP 126 Cb -0.02 -3.94 -0.12 0.00 -1.15 0.00 0.00 33.47 28.24 2qjk s TRP 126 CO -0.05 -2.93 2.24 0.41 0.02 0.00 0.00 176.95 176.64 2qjk n GLY 127 N 4.52 2.23 2.99 0.98 0.00 -0.87 -4.55 105.19 110.49 2qjk n GLY 127 Ca 0.18 -0.55 -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 1.23 2.74 0.04 1.61 1.01 -1.26 -3.88 120.40 121.88 2qjk s VAL 128 Ca 0.30 -3.06 -0.34 0.00 0.00 0.00 0.00 61.98 58.87 2qjk s VAL 128 Cb 0.14 -2.90 -0.18 0.00 0.00 0.00 0.00 36.38 33.45 2qjk s VAL 128 CO 0.00 -0.77 0.88 0.00 0.00 0.00 0.00 175.10 175.20 2qjk n THR 130 N 1.09 0.00 0.00 0.00 -2.24 -1.26 -2.95 114.28 108.92 2qjk n THR 130 Ca 0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 2qjk n THR 130 Cb 0.10 -0.33 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 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 -0.81 0.00 0.00 4.78 -0.00 -1.26 -4.38 115.22 113.56 2qjk n HIS 131 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.86 2qjk n HIS 131 Cb 0.06 -0.18 0.00 0.00 -0.00 0.00 0.00 29.99 29.87 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 -1.05 0.00 0.00 0.27 4.77 -1.26 -4.97 117.00 114.76 2qjk n LEU 132 Ca 0.00 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.82 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 1.61 1.86 3.25 -0.72 0.00 -1.15 -5.07 105.19 104.97 2qjk n GLY 133 Ca 0.00 -0.12 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.69 5.91 0.41 0.00 0.15 -1.25 -0.01 113.70 117.22 2qjk s SER 135 Ca 0.52 -1.26 -0.26 0.00 0.70 0.00 0.00 55.95 55.65 2qjk s SER 135 Cb -0.11 -2.09 -0.10 0.00 -1.71 0.00 0.00 66.02 62.00 2qjk s SER 135 CO 0.68 -0.54 1.28 -2.65 1.20 0.00 0.00 173.24 173.21 2qjk n PRO 136 N 5.07 1.98 -2.14 5.44 -0.02 -1.26 -4.91 135.00 139.17 2qjk n PRO 136 Ca -0.11 0.70 -0.40 0.00 -2.02 0.00 0.00 63.50 61.67 2qjk n PRO 136 Cb 0.44 -2.38 -0.01 0.00 -0.02 0.00 0.00 33.50 31.53 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 -1.18 2.79 0.00 4.25 1.09 0.16 -4.75 121.20 123.57 2qjk s ILE 137 Ca 0.60 0.72 0.00 0.00 -1.10 0.00 0.00 60.65 60.87 2qjk s ILE 137 Cb -0.52 -3.43 0.00 0.00 -1.06 0.00 0.00 42.46 37.45 2qjk s ILE 137 CO 0.59 0.12 0.00 0.61 -0.10 0.00 0.00 174.94 176.16 2qjk n GLY 138 N 0.72 4.54 1.87 6.18 0.00 -1.26 -2.06 105.19 115.18 2qjk n GLY 138 Ca 0.03 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 44.01 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 0.48 2.99 -0.02 0.00 -1.26 -4.31 105.19 108.07 2qjk n GLY 139 Ca 0.00 -0.83 -0.07 0.00 0.00 0.00 0.00 46.02 45.12 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 -3.77 -7.80 -4.15 1.61 0.31 -1.21 -5.04 118.33 98.29 2qjk n VAL 140 Ca 0.00 1.05 -0.12 0.00 -0.01 0.00 0.00 64.34 65.26 2qjk n VAL 140 Cb 0.47 -5.37 -0.10 0.00 -0.91 0.00 0.00 33.84 27.93 2qjk n VAL 140 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2qjk s SER 141 N -1.59 1.14 0.00 4.52 1.04 -0.86 -4.82 113.70 113.14 2qjk s SER 141 Ca 0.10 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 55.66 2qjk s SER 141 Cb -0.02 0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.17 2qjk s SER 141 CO 0.56 -0.37 0.00 0.61 0.98 0.00 0.00 173.24 175.02 2qjk n GLY 142 N 0.40 0.25 0.27 7.32 0.00 -1.26 -2.39 105.19 109.78 2qjk n GLY 142 Ca -0.15 -2.20 0.04 0.00 0.00 0.00 0.00 46.02 43.70 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 0.00 1.50 -1.24 1.61 8.00 -1.26 -4.62 116.55 120.54 2qjk n ASP 143 Ca 0.00 -1.25 0.03 0.00 0.71 0.00 0.00 54.79 54.28 2qjk n ASP 143 Cb 0.00 0.07 0.10 0.00 -0.02 0.00 0.00 41.12 41.27 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 0.29 0.19 -3.94 1.24 3.01 -1.26 -5.00 117.46 111.99 2qjk n PHE 144 Ca 0.04 -1.06 -0.31 0.00 1.01 0.00 0.00 57.45 57.13 2qjk n PHE 144 Cb 0.17 -0.20 0.02 0.00 -0.01 0.00 0.00 39.48 39.46 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 -0.26 -0.48 0.00 1.37 0.00 -1.26 -3.10 105.19 101.47 2qjk n GLY 145 Ca 0.13 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.33 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 -1.66 1.77 3.11 -0.02 0.00 -1.06 -3.31 105.19 104.02 2qjk n GLY 146 Ca 0.03 -0.19 -0.15 0.00 0.00 0.00 0.00 46.02 45.71 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 1.29 0.90 -0.14 1.61 0.51 -0.66 -2.02 118.94 120.43 2qjk s TRP 147 Ca 0.00 -0.51 -0.00 0.00 -2.12 0.00 0.00 56.10 53.47 2qjk s TRP 147 Cb 0.00 -0.52 0.03 0.00 -0.81 0.00 0.00 33.47 32.17 2qjk s TRP 147 CO 0.00 -0.03 -0.09 0.12 -0.51 0.00 0.00 176.95 176.44 2qjk s PHE 148 N -1.47 1.75 -0.58 -1.98 5.36 -0.88 -1.28 117.98 118.91 2qjk s PHE 148 Ca -0.06 -0.97 -0.23 0.00 -0.96 0.00 0.00 56.93 54.71 2qjk s PHE 148 Cb -0.09 -1.36 0.05 0.00 -0.34 0.00 0.00 43.02 41.28 2qjk s PHE 148 CO 0.01 -0.59 0.90 0.00 -1.46 0.00 0.00 175.22 174.09 2qjk n PRO 150 N 7.35 0.07 -0.10 0.00 -0.04 -1.26 -1.38 135.00 139.63 2qjk n PRO 150 Ca -0.01 0.27 -0.13 0.00 -0.04 0.00 0.00 63.50 63.59 2qjk n PRO 150 Cb 0.47 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.39 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 -4.29 0.00 -2.62 0.00 8.25 -1.20 -5.06 115.22 110.30 2qjk n HIS 152 Ca -0.03 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.33 2qjk n HIS 152 Cb 0.44 -0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.60 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 -0.31 3.59 -1.41 0.00 -0.48 -4.66 105.19 101.91 2qjk n GLY 153 Ca 0.00 0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.34 4.95 -0.07 1.61 0.01 -1.09 -4.23 113.70 111.54 2qjk s SER 154 Ca 0.23 -0.00 -0.01 0.00 1.31 0.00 0.00 55.95 57.48 2qjk s SER 154 Cb -0.03 -1.55 -0.03 0.00 0.21 0.00 0.00 66.02 64.62 2qjk s SER 154 CO 0.45 0.28 0.01 -1.00 0.41 0.00 0.00 173.24 173.39 2qjk s HIS 155 N -0.32 3.15 0.05 2.43 0.09 0.23 -1.06 115.29 119.87 2qjk s HIS 155 Ca 0.06 0.18 0.06 0.00 -0.00 0.00 0.00 55.06 55.35 2qjk s HIS 155 Cb -0.12 -1.77 -0.02 0.00 -0.00 0.00 0.00 32.58 30.66 2qjk s HIS 155 CO 0.02 0.47 -0.16 0.71 -0.00 0.00 0.00 174.74 175.79 2qjk s TYR 156 N -0.93 1.37 0.73 1.40 1.51 -0.40 -0.56 117.35 120.48 2qjk s TYR 156 Ca 0.15 -0.38 -0.04 0.00 -1.01 0.00 0.00 57.07 55.79 2qjk s TYR 156 Cb -0.11 -0.80 0.15 0.00 -0.11 0.00 0.00 41.96 41.09 2qjk s TYR 156 CO 0.04 0.06 1.00 -0.40 -1.11 0.00 0.00 175.55 175.14 2qjk n ASP 157 N 1.70 0.96 0.00 2.29 5.68 -0.02 -1.65 116.55 125.51 2qjk n ASP 157 Ca -0.19 -1.90 0.02 0.00 -0.50 0.00 0.00 54.79 52.23 2qjk n ASP 157 Cb 0.54 -0.68 0.13 0.00 -1.14 0.00 0.00 41.12 39.97 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 -3.13 0.00 -0.18 -1.12 3.41 -1.18 -0.03 113.62 111.40 2qjk n SER 158 Ca 0.15 -0.21 0.02 0.00 -0.26 0.00 0.00 58.87 58.57 2qjk n SER 158 Cb 0.54 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.52 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 -0.90 2.35 -1.90 7.33 0.00 -1.26 -4.90 120.51 121.23 2qjk n ALA 159 Ca 0.03 -0.70 -0.01 0.00 0.00 0.00 0.00 53.44 52.77 2qjk n ALA 159 Cb 0.02 -0.14 -0.00 0.00 0.00 0.00 0.00 19.45 19.33 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 0.10 0.35 3.80 0.00 0.00 0.96 -4.94 105.19 105.46 2qjk n GLY 160 Ca 0.03 -0.88 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 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 -3.82 3.25 0.19 1.61 0.52 -1.25 -1.62 118.95 117.82 2qjk s ARG 161 Ca 0.00 -0.27 -0.30 0.00 -0.52 0.00 0.00 55.73 54.64 2qjk s ARG 161 Cb 0.00 -3.02 -0.08 0.00 0.52 0.00 0.00 34.95 32.37 2qjk s ARG 161 CO 0.00 0.73 1.30 -1.50 0.02 0.00 0.00 175.30 175.85 2qjk s ILE 162 N -1.01 3.29 0.00 1.52 1.10 -1.26 -0.84 121.20 123.99 2qjk s ILE 162 Ca 0.16 1.05 0.00 0.00 -0.51 0.00 0.00 60.65 61.35 2qjk s ILE 162 Cb -0.12 -3.67 0.00 0.00 0.15 0.00 0.00 42.46 38.82 2qjk s ILE 162 CO 0.05 0.15 0.00 0.54 -2.11 0.00 0.00 174.94 173.57 2qjk n ARG 163 N 2.75 3.09 -3.69 3.50 5.12 0.28 -3.73 116.66 123.98 2qjk n ARG 163 Ca 0.06 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.86 2qjk n ARG 163 Cb 0.43 -0.72 -0.09 0.00 -1.16 0.00 0.00 32.46 30.92 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 -0.98 0.58 0.00 5.56 2.20 -1.16 -4.91 119.74 121.03 2qjk s LYS 164 Ca 0.00 0.76 0.00 0.00 -0.36 0.00 0.00 55.97 56.37 2qjk s LYS 164 Cb 0.00 0.24 0.00 0.00 -1.51 0.00 0.00 37.83 36.56 2qjk s LYS 164 CO 0.00 -0.09 0.00 0.41 -0.36 0.00 0.00 175.35 175.31 2qjk n GLY 165 N 3.08 -1.41 0.24 5.54 0.00 -1.26 0.75 105.19 112.13 2qjk n GLY 165 Ca -0.15 -2.22 0.12 0.00 0.00 0.00 0.00 46.02 43.77 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 4.79 0.00 -6.42 1.61 0.13 -1.83 -3.45 132.00 126.83 2qjk h PRO 166 Ca 0.00 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.51 2qjk h PRO 166 Cb 0.00 0.00 0.10 0.00 0.13 0.00 0.00 31.00 31.23 2qjk h PRO 166 CO 0.00 0.16 0.20 0.00 -0.23 0.00 0.00 178.00 178.13 2qjk n ALA 167 N -2.21 -0.39 0.29 -0.56 0.00 -1.26 -4.87 120.51 111.52 2qjk n ALA 167 Ca -0.00 0.42 0.06 0.00 0.00 0.00 0.00 53.44 53.91 2qjk n ALA 167 Cb 0.37 -2.03 0.08 0.00 0.00 0.00 0.00 19.45 17.86 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 1.21 1.21 -3.94 0.00 -0.04 -1.26 -4.96 135.00 127.22 2qjk n PRO 168 Ca 0.12 -1.42 -0.10 0.00 -0.04 0.00 0.00 63.50 62.06 2qjk n PRO 168 Cb 0.29 -1.23 -0.07 0.00 -0.04 0.00 0.00 33.50 32.45 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 -0.95 1.18 0.38 0.54 2.02 -1.26 -4.77 118.70 115.82 2qjk s GLU 169 Ca 0.16 -1.14 -0.19 0.00 0.02 0.00 0.00 54.97 53.82 2qjk s GLU 169 Cb 0.10 0.39 -0.10 0.00 0.10 0.00 0.00 34.13 34.62 2qjk s GLU 169 CO 0.15 -0.44 0.86 -0.80 0.02 0.00 0.00 175.26 175.05 2qjk s ASN 170 N -2.96 6.91 0.08 -0.19 0.01 -1.26 -4.27 114.94 113.27 2qjk s ASN 170 Ca 0.16 1.54 -0.36 0.00 -0.71 0.00 0.00 52.86 53.50 2qjk s ASN 170 Cb 0.03 -2.48 -0.15 0.00 0.41 0.00 0.00 41.25 39.06 2qjk s ASN 170 CO -0.00 -0.27 1.49 0.18 -1.51 0.00 0.00 177.10 176.99 2qjk n LEU 171 N -0.41 2.36 -4.78 0.60 4.77 -0.64 -4.90 117.00 114.00 2qjk n LEU 171 Ca 0.05 1.09 -0.35 0.00 -0.03 0.00 0.00 56.01 56.77 2qjk n LEU 171 Cb 0.53 -1.29 -0.01 0.00 -2.33 0.00 0.00 43.42 40.33 2qjk n LEU 171 CO 0.39 -0.66 0.78 -2.84 -1.33 0.00 0.00 177.39 173.73 2qjk s PRO 172 N 1.05 3.51 -0.19 3.23 0.02 -1.26 -4.80 135.00 136.56 2qjk s PRO 172 Ca 0.84 1.59 -0.04 0.00 0.02 0.00 0.00 61.00 63.40 2qjk s PRO 172 Cb -0.84 -2.09 -0.02 0.00 0.02 0.00 0.00 34.50 31.57 2qjk s PRO 172 CO 0.45 -0.72 -0.02 0.42 -0.33 0.00 0.00 177.00 176.81 2qjk s ILE 173 N -1.77 3.87 0.56 2.83 1.01 -0.42 -0.88 121.20 126.40 2qjk s ILE 173 Ca 0.70 -0.35 -0.06 0.00 0.00 0.00 0.00 60.65 60.94 2qjk s ILE 173 Cb -0.23 -2.73 -0.01 0.00 0.01 0.00 0.00 42.46 39.49 2qjk s ILE 173 CO 0.27 0.45 0.88 -2.16 0.00 0.00 0.00 174.94 174.37 2qjk s PRO 174 N 0.85 3.19 -0.09 2.79 0.04 -1.26 -2.15 135.00 138.37 2qjk s PRO 174 Ca 0.00 0.14 -0.37 0.00 0.04 0.00 0.00 61.00 60.81 2qjk s PRO 174 Cb -0.14 -2.28 -0.15 0.00 0.04 0.00 0.00 34.50 31.97 2qjk s PRO 174 CO 0.02 -0.53 1.65 1.28 0.04 0.00 0.00 177.00 179.45 2qjk n LEU 175 N -2.50 2.52 -3.55 -3.56 4.77 -1.26 -4.64 117.00 108.77 2qjk n LEU 175 Ca 0.03 1.07 -0.16 0.00 -0.03 0.00 0.00 56.01 56.92 2qjk n LEU 175 Cb 0.56 -1.24 -0.06 0.00 -2.33 0.00 0.00 43.42 40.36 2qjk n LEU 175 CO 0.54 -0.49 0.35 0.00 -1.33 0.00 0.00 177.39 176.46 2qjk s ALA 176 N 2.52 -1.54 -0.20 -1.18 0.00 -1.26 -0.38 121.76 119.72 2qjk s ALA 176 Ca 0.91 0.98 -0.29 0.00 0.00 0.00 0.00 51.96 53.56 2qjk s ALA 176 Cb -0.91 0.16 0.13 0.00 0.00 0.00 0.00 23.12 22.50 2qjk s ALA 176 CO 0.54 -0.42 1.04 -1.59 0.00 0.00 0.00 175.76 175.34 2qjk s LYS 177 N -1.67 0.52 -0.03 0.00 -2.85 -1.24 -4.95 119.74 109.52 2qjk s LYS 177 Ca -0.09 0.24 -0.30 0.00 -1.00 0.00 0.00 55.97 54.82 2qjk s LYS 177 Cb -0.01 0.25 -0.03 0.00 -2.06 0.00 0.00 37.83 35.98 2qjk s LYS 177 CO 0.05 -0.14 1.16 -0.06 0.10 0.00 0.00 175.35 176.46 2qjk s PHE 178 N -0.74 3.31 -0.62 1.78 0.40 -1.26 -0.46 117.98 120.39 2qjk s PHE 178 Ca 0.00 1.32 0.24 0.00 -0.60 0.00 0.00 56.93 57.89 2qjk s PHE 178 Cb -0.02 -3.37 0.29 0.00 0.51 0.00 0.00 43.02 40.43 2qjk s PHE 178 CO -0.01 -1.07 1.27 0.82 0.70 0.00 0.00 175.22 176.92 2qjk h ILE 179 N 4.91 0.00 -0.58 0.64 1.08 -0.87 -3.48 117.51 119.21 2qjk h ILE 179 Ca -0.36 -0.51 0.00 0.00 -0.39 0.00 0.00 64.86 63.60 2qjk h ILE 179 Cb 1.17 1.05 0.00 0.00 -3.07 0.00 0.00 36.82 35.98 2qjk h ILE 179 CO 0.85 0.00 0.00 -0.90 -0.69 0.00 0.00 178.15 177.41 2qjk n ASP 180 N -2.12 0.00 0.27 1.72 5.68 -1.20 -5.01 116.55 115.88 2qjk n ASP 180 Ca 0.03 -0.15 0.10 0.00 -0.50 0.00 0.00 54.79 54.27 2qjk n ASP 180 Cb 0.44 0.00 0.71 0.00 -1.14 0.00 0.00 41.12 41.13 2qjk n ASP 180 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2qjk h GLU 181 N 0.00 0.00 -0.08 0.11 4.81 -2.02 -3.29 114.58 114.10 2qjk h GLU 181 Ca 0.00 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.06 2qjk h GLU 181 Cb 0.00 0.00 -0.28 0.00 0.63 0.00 0.00 28.75 29.10 2qjk h GLU 181 CO 0.00 0.04 -0.72 -2.37 -0.73 0.00 0.00 179.01 175.23 2qjk n THR 182 N -4.23 0.24 -3.70 0.32 5.66 -1.26 -4.98 114.28 106.32 2qjk n THR 182 Ca -0.03 -1.06 -0.12 0.00 -3.05 0.00 0.00 64.05 59.79 2qjk n THR 182 Cb 0.12 0.91 -0.12 0.00 -1.55 0.00 0.00 70.33 69.69 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 -0.69 -0.16 -0.07 1.09 2.01 -1.24 -1.59 115.64 114.99 2qjk s THR 183 Ca 0.19 0.15 -0.01 0.00 0.31 0.00 0.00 61.69 62.33 2qjk s THR 183 Cb 0.27 -0.49 -0.03 0.00 0.01 0.00 0.00 72.50 72.25 2qjk s THR 183 CO -0.09 0.06 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.27 2qjk s ILE 184 N 1.64 4.20 -0.63 1.82 1.01 -0.81 -0.13 121.20 128.30 2qjk s ILE 184 Ca -0.07 -0.32 -0.05 0.00 0.00 0.00 0.00 60.65 60.21 2qjk s ILE 184 Cb -0.10 -2.77 0.16 0.00 0.01 0.00 0.00 42.46 39.76 2qjk s ILE 184 CO -0.10 0.58 0.46 -1.58 0.00 0.00 0.00 174.94 174.30 2qjk s GLN 185 N -0.95 2.66 0.14 2.79 0.74 0.39 -1.38 119.66 124.06 2qjk s GLN 185 Ca 0.14 -2.41 -0.31 0.00 0.05 0.00 0.00 55.36 52.83 2qjk s GLN 185 Cb -0.11 -3.83 -0.08 0.00 1.10 0.00 0.00 33.01 30.08 2qjk s GLN 185 CO 0.03 -1.18 1.32 -0.51 -0.55 0.00 0.00 175.29 174.39 2qjk s LEU 186 N 0.16 4.39 0.00 3.68 1.43 -1.15 -3.67 118.68 123.53 2qjk s LEU 186 Ca 0.16 2.30 0.00 0.00 -1.03 0.00 0.00 54.13 55.56 2qjk s LEU 186 Cb -0.19 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.43 2qjk s LEU 186 CO -0.04 -0.56 0.00 0.61 0.23 0.00 0.00 176.35 176.59