#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 2.59 -0.06 2.61 -1.04 -1.26 -3.97 114.28 113.14 2qjk n THR 10 Ca 0.00 -1.38 -0.10 0.00 -2.04 0.00 0.00 64.05 60.52 2qjk n THR 10 Cb 0.00 -0.41 -0.10 0.00 -1.82 0.00 0.00 70.33 68.00 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 2.32 -0.00 -0.07 -2.82 3.08 -2.05 -2.38 114.38 112.46 2qjk h ARG 11 Ca 0.23 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.14 2qjk h ARG 11 Cb 2.13 0.00 0.01 0.00 0.08 0.00 0.00 29.97 32.19 2qjk h ARG 11 CO 0.65 0.74 -0.53 0.07 -1.07 0.00 0.00 179.97 179.83 2qjk h ARG 12 N -1.00 0.48 -0.81 0.04 0.11 -2.01 -3.17 114.38 108.02 2qjk h ARG 12 Ca -0.00 -0.42 0.05 0.00 0.10 0.00 0.00 59.98 59.71 2qjk h ARG 12 Cb 0.74 0.10 -0.05 0.00 1.11 0.00 0.00 29.97 31.87 2qjk h ARG 12 CO 0.00 1.06 0.53 0.22 0.10 0.00 0.00 179.97 181.88 2qjk h ASP 13 N 0.04 0.81 0.60 0.08 3.58 -1.72 -0.15 116.42 119.66 2qjk h ASP 13 Ca -0.05 -0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.38 2qjk h ASP 13 Cb 1.19 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 42.06 2qjk h ASP 13 CO 0.11 0.54 -0.37 0.15 -2.88 0.00 0.00 179.24 176.78 2qjk h PHE 14 N 0.93 -0.99 -0.39 0.28 3.57 -1.44 -1.08 116.94 117.82 2qjk h PHE 14 Ca 0.34 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.91 2qjk h PHE 14 Cb 0.16 0.35 -0.09 0.00 2.79 0.00 0.00 35.95 39.16 2qjk h PHE 14 CO -0.00 -0.57 -0.34 1.25 -2.23 0.00 0.00 178.31 176.42 2qjk h LEU 15 N -0.93 -1.13 -1.21 0.59 5.85 -1.34 0.38 115.31 117.52 2qjk h LEU 15 Ca -0.07 0.19 0.20 0.00 0.84 0.00 0.00 57.88 59.04 2qjk h LEU 15 Cb 0.75 0.52 -0.09 0.00 0.37 0.00 0.00 40.66 42.21 2qjk h LEU 15 CO 0.07 -0.33 0.62 1.88 -0.34 0.00 0.00 178.44 180.34 2qjk h TYR 16 N -0.27 0.86 0.00 1.25 -1.99 -0.84 0.33 116.97 116.31 2qjk h TYR 16 Ca 0.17 0.03 -0.18 0.00 2.00 0.00 0.00 58.73 60.74 2qjk h TYR 16 Cb 0.55 -0.26 -0.03 0.00 2.00 0.00 0.00 36.73 38.99 2qjk h TYR 16 CO -0.54 0.20 -0.92 1.88 -0.00 0.00 0.00 178.16 178.77 2qjk h TYR 17 N 0.62 0.00 -0.01 4.88 0.05 0.41 -2.29 116.97 120.62 2qjk h TYR 17 Ca 0.54 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 59.13 2qjk h TYR 17 Cb 1.04 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.77 2qjk h TYR 17 CO -0.00 0.81 -0.83 0.00 -1.05 0.00 0.00 178.16 177.09 2qjk h ALA 18 N 1.19 0.58 0.17 3.88 0.00 0.15 -2.82 119.26 122.40 2qjk h ALA 18 Ca -0.04 -0.69 -0.01 0.00 0.00 0.00 0.00 54.91 54.17 2qjk h ALA 18 Cb 1.65 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.37 2qjk h ALA 18 CO 0.10 0.88 -0.08 1.15 0.00 0.00 0.00 179.25 181.30 2qjk h THR 19 N 0.12 0.00 -1.40 0.00 2.02 -0.47 -2.65 112.91 110.54 2qjk h THR 19 Ca -0.04 -0.13 0.41 0.00 0.77 0.00 0.00 66.41 67.42 2qjk h THR 19 Cb 1.43 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.78 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 -1.77 3.26 0.68 6.16 0.00 -1.54 0.13 119.26 126.19 2qjk h ALA 20 Ca -0.02 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2qjk h ALA 20 Cb 0.17 0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.08 2qjk h ALA 20 CO 0.04 -1.68 -0.33 0.78 0.00 0.00 0.00 179.25 178.06 2qjk h GLY 21 N 0.02 -0.95 0.63 0.00 0.00 -1.44 -1.63 103.07 99.71 2qjk h GLY 21 Ca 0.68 0.35 0.08 0.00 0.00 0.00 0.00 47.33 48.45 2qjk h GLY 21 CO -0.04 -0.35 0.61 0.00 0.00 0.00 0.00 176.54 176.76 2qjk h ALA 22 N -0.84 1.37 0.01 3.60 0.00 -0.44 -2.03 119.26 120.94 2qjk h ALA 22 Ca -0.09 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2qjk h ALA 22 Cb 0.73 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2qjk h ALA 22 CO 0.15 0.31 -0.21 0.78 0.00 0.00 0.00 179.25 180.28 2qjk h GLY 23 N 1.05 -1.27 -0.62 0.00 0.00 -0.97 -1.37 103.07 99.89 2qjk h GLY 23 Ca 0.44 0.61 0.14 0.00 0.00 0.00 0.00 47.33 48.53 2qjk h GLY 23 CO -0.21 -0.41 -0.27 0.00 0.00 0.00 0.00 176.54 175.65 2qjk h ALA 24 N -1.09 0.30 -0.44 3.60 0.00 -0.89 -0.16 119.26 120.58 2qjk h ALA 24 Ca 0.00 0.26 0.07 0.00 0.00 0.00 0.00 54.91 55.24 2qjk h ALA 24 Cb 0.29 0.73 -0.09 0.00 0.00 0.00 0.00 17.79 18.72 2qjk h ALA 24 CO -0.14 -0.52 -0.48 0.28 0.00 0.00 0.00 179.25 178.39 2qjk h VAL 25 N -0.05 0.06 0.50 0.00 2.07 -0.72 -0.88 116.25 117.23 2qjk h VAL 25 Ca 0.33 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.84 2qjk h VAL 25 Cb 0.58 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 2qjk h VAL 25 CO -0.81 0.00 -0.44 0.00 0.02 0.00 0.00 177.57 176.34 2qjk h ALA 26 N 0.29 -1.13 -0.73 1.67 0.00 -0.16 -1.64 119.26 117.56 2qjk h ALA 26 Ca 0.12 -0.18 0.15 0.00 0.00 0.00 0.00 54.91 55.00 2qjk h ALA 26 Cb 0.59 0.64 -0.14 0.00 0.00 0.00 0.00 17.79 18.88 2qjk h ALA 26 CO -0.61 -1.14 -0.18 2.41 0.00 0.00 0.00 179.25 179.73 2qjk n THR 27 N -5.10 -0.31 -0.17 0.00 -1.04 -0.19 0.15 114.28 107.63 2qjk n THR 27 Ca -0.11 1.68 -0.11 0.00 -2.04 0.00 0.00 64.05 63.47 2qjk n THR 27 Cb 0.41 -2.32 0.00 0.00 -1.82 0.00 0.00 70.33 66.60 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 1.02 1.13 3.41 0.00 -0.83 -1.88 103.07 105.92 2qjk h GLY 28 Ca 0.35 -0.85 0.09 0.00 0.00 0.00 0.00 47.33 46.93 2qjk h GLY 28 CO -0.75 0.77 0.35 0.00 0.00 0.00 0.00 176.54 176.91 2qjk h ALA 29 N 0.89 2.00 0.00 3.60 0.00 0.23 0.11 119.26 126.09 2qjk h ALA 29 Ca 0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2qjk h ALA 29 Cb 0.68 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 2qjk h ALA 29 CO 0.05 -0.51 -0.04 0.00 0.00 0.00 0.00 179.25 178.75 2qjk h ALA 30 N 1.60 0.00 -0.44 0.00 0.00 -0.85 -3.38 119.26 116.19 2qjk h ALA 30 Ca 0.15 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 55.04 2qjk h ALA 30 Cb 0.85 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.57 2qjk h ALA 30 CO -0.00 0.03 -0.25 0.28 0.00 0.00 0.00 179.25 179.31 2qjk h VAL 31 N -1.00 0.32 -0.25 0.00 2.07 -0.50 -3.04 116.25 113.85 2qjk h VAL 31 Ca -0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 2qjk h VAL 31 Cb 0.19 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 2qjk h VAL 31 CO -0.00 0.00 -0.17 -0.25 0.02 0.00 0.00 177.57 177.17 2qjk h TRP 32 N -0.16 -0.54 -0.43 1.57 -0.00 -1.00 -0.95 115.95 114.44 2qjk h TRP 32 Ca 0.21 0.03 0.12 0.00 -0.00 0.00 0.00 58.89 59.25 2qjk h TRP 32 Cb 0.49 0.27 -0.02 0.00 -0.00 0.00 0.00 29.16 29.90 2qjk h TRP 32 CO -0.50 -0.12 0.34 -1.00 -0.00 0.00 0.00 178.44 177.16 2qjk h PRO 33 N -0.03 0.00 0.00 2.65 0.13 -1.73 0.71 132.00 133.74 2qjk h PRO 33 Ca 0.04 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.10 2qjk h PRO 33 Cb 0.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.26 2qjk h PRO 33 CO -0.25 0.00 -0.32 -0.07 -0.23 0.00 0.00 178.00 177.13 2qjk h LEU 34 N 0.00 0.00 0.00 1.56 3.38 -1.09 -1.92 115.31 117.24 2qjk h LEU 34 Ca 0.20 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.08 2qjk h LEU 34 Cb 0.88 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 2qjk h LEU 34 CO -0.00 0.32 -0.65 0.40 0.09 0.00 0.00 178.44 178.60 2qjk h ILE 35 N 0.00 0.72 -0.79 1.22 2.04 0.10 -3.39 117.51 117.42 2qjk h ILE 35 Ca -0.00 -1.74 0.17 0.00 1.00 0.00 0.00 64.86 64.28 2qjk h ILE 35 Cb 0.58 1.56 -0.05 0.00 -0.74 0.00 0.00 36.82 38.17 2qjk h ILE 35 CO 0.04 0.24 0.53 -1.13 0.00 0.00 0.00 178.15 177.83 2qjk h ASN 36 N -1.00 0.36 -0.73 1.72 -0.00 -0.01 -1.23 115.58 114.69 2qjk h ASN 36 Ca -0.14 0.03 0.21 0.00 -0.00 0.00 0.00 56.30 56.39 2qjk h ASN 36 Cb 0.86 -0.04 -0.03 0.00 -0.00 0.00 0.00 38.32 39.11 2qjk h ASN 36 CO -0.09 0.17 0.65 0.06 -0.00 0.00 0.00 177.43 178.23 2qjk h GLN 37 N 0.37 0.00 0.00 6.67 -0.00 -1.53 0.39 115.11 121.01 2qjk h GLN 37 Ca 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.04 2qjk h GLN 37 Cb 0.98 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.46 2qjk h GLN 37 CO -0.12 0.00 0.00 0.52 -0.00 0.00 0.00 178.83 179.23 2qjk h MET 38 N 0.00 0.00 -7.29 0.06 2.86 -1.47 -3.46 114.93 105.64 2qjk h MET 38 Ca 0.35 0.00 -0.49 0.00 -2.06 0.00 0.00 59.70 57.50 2qjk h MET 38 Cb 1.65 0.00 0.17 0.00 0.06 0.00 0.00 31.60 33.48 2qjk h MET 38 CO -0.00 0.00 0.21 -0.80 1.06 0.00 0.00 176.91 177.38 2qjk s ASN 39 N -5.81 3.06 -0.08 1.22 0.02 0.14 -4.85 114.94 108.63 2qjk s ASN 39 Ca 0.05 1.69 -0.38 0.00 -1.02 0.00 0.00 52.86 53.21 2qjk s ASN 39 Cb 0.07 -2.33 -0.16 0.00 0.02 0.00 0.00 41.25 38.86 2qjk s ASN 39 CO 0.61 -2.93 1.57 -2.65 0.02 0.00 0.00 177.10 173.72 2qjk n PRO 40 N -4.09 1.28 -1.77 -0.60 -0.02 -1.26 -4.94 135.00 123.60 2qjk n PRO 40 Ca 0.08 0.47 -0.33 0.00 -2.02 0.00 0.00 63.50 61.69 2qjk n PRO 40 Cb 0.54 -2.15 0.04 0.00 -0.02 0.00 0.00 33.50 31.92 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 2.11 5.18 0.20 2.55 1.04 -1.26 -4.90 113.70 118.61 2qjk s SER 41 Ca 0.91 1.95 0.11 0.00 0.48 0.00 0.00 55.95 59.40 2qjk s SER 41 Cb -0.97 -2.55 0.58 0.00 0.10 0.00 0.00 66.02 63.18 2qjk s SER 41 CO 0.55 -1.58 1.24 0.00 0.98 0.00 0.00 173.24 174.43 2qjk n ALA 42 N -2.44 0.79 0.00 5.32 0.00 -1.26 -1.73 120.51 121.19 2qjk n ALA 42 Ca 0.10 0.10 -0.09 0.00 0.00 0.00 0.00 53.44 53.55 2qjk n ALA 42 Cb 0.52 -0.93 -0.14 0.00 0.00 0.00 0.00 19.45 18.91 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 0.03 -0.31 0.00 2.03 -2.02 -3.37 116.42 112.78 2qjk h ASP 43 Ca 0.00 -0.04 -0.10 0.00 -0.73 0.00 0.00 57.03 56.16 2qjk h ASP 43 Cb 0.30 -0.01 -0.01 0.00 -0.83 0.00 0.00 39.33 38.78 2qjk h ASP 43 CO 0.00 1.04 -0.18 0.58 -1.03 0.00 0.00 179.24 179.65 2qjk h VAL 44 N 0.00 1.29 0.00 4.15 2.07 -1.70 -3.29 116.25 118.77 2qjk h VAL 44 Ca -0.22 -1.29 0.00 0.00 0.82 0.00 0.00 66.70 66.01 2qjk h VAL 44 Cb 1.95 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 33.18 2qjk h VAL 44 CO 0.10 0.42 0.00 0.00 0.02 0.00 0.00 177.57 178.10 2qjk n GLN 45 N -4.35 0.00 -2.85 1.57 6.02 -1.24 -4.30 117.38 112.23 2qjk n GLN 45 Ca -0.03 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.53 2qjk n GLN 45 Cb 0.40 -0.97 0.01 0.00 1.02 0.00 0.00 30.24 30.70 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 0.31 5.04 -1.97 -1.58 0.00 -1.24 -4.97 120.51 116.09 2qjk n ALA 46 Ca 0.00 -4.61 -0.33 0.00 0.00 0.00 0.00 53.44 48.49 2qjk n ALA 46 Cb 0.00 -2.59 -0.04 0.00 0.00 0.00 0.00 19.45 16.82 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 -1.57 3.24 0.00 0.00 0.20 -1.26 -4.97 118.68 114.32 2qjk s LEU 47 Ca 0.34 0.09 0.00 0.00 0.69 0.00 0.00 54.13 55.25 2qjk s LEU 47 Cb 0.04 -2.54 0.00 0.00 -0.43 0.00 0.00 46.19 43.26 2qjk s LEU 47 CO 0.05 -2.62 0.00 0.00 -0.29 0.00 0.00 176.35 173.49 2qjk n ALA 48 N 13.74 0.00 -3.47 5.97 0.00 -1.26 -5.10 120.51 130.40 2qjk n ALA 48 Ca 0.29 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.65 2qjk n ALA 48 Cb 0.50 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.87 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 -0.06 0.61 0.00 0.01 -1.26 -4.87 113.70 107.13 2qjk s SER 49 Ca 0.00 0.59 0.03 0.00 1.31 0.00 0.00 55.95 57.89 2qjk s SER 49 Cb 0.00 1.27 0.09 0.00 0.21 0.00 0.00 66.02 67.59 2qjk s SER 49 CO 0.00 -0.27 0.85 0.27 0.41 0.00 0.00 173.24 174.50 2qjk s ILE 50 N 2.59 2.33 -0.03 1.44 -4.36 -0.95 -4.96 121.20 117.27 2qjk s ILE 50 Ca 0.07 -0.76 0.03 0.00 -0.26 0.00 0.00 60.65 59.73 2qjk s ILE 50 Cb -0.14 -2.57 0.00 0.00 1.25 0.00 0.00 42.46 41.00 2qjk s ILE 50 CO -0.15 0.00 -0.11 -0.36 0.24 0.00 0.00 174.94 174.57 2qjk s PHE 51 N -2.85 1.07 -0.17 1.37 0.40 -1.26 -2.77 117.98 113.76 2qjk s PHE 51 Ca 0.62 -0.27 0.01 0.00 -0.60 0.00 0.00 56.93 56.69 2qjk s PHE 51 Cb -0.07 -0.75 0.02 0.00 0.51 0.00 0.00 43.02 42.74 2qjk s PHE 51 CO 0.40 -0.10 -0.17 0.08 0.70 0.00 0.00 175.22 176.14 2qjk s VAL 52 N 0.11 1.84 -0.13 -0.44 1.01 -0.37 -4.98 120.40 117.44 2qjk s VAL 52 Ca -0.02 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 60.81 2qjk s VAL 52 Cb -0.08 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 2qjk s VAL 52 CO 0.01 0.45 1.07 -0.62 0.00 0.00 0.00 175.10 176.01 2qjk s ASP 53 N 1.37 7.15 -0.14 3.32 2.15 -1.26 -1.90 116.67 127.36 2qjk s ASP 53 Ca 0.04 1.56 0.18 0.00 0.43 0.00 0.00 52.55 54.76 2qjk s ASP 53 Cb -0.13 -2.55 0.34 0.00 -0.30 0.00 0.00 42.92 40.28 2qjk s ASP 53 CO -0.11 -0.55 1.21 0.55 -0.17 0.00 0.00 175.17 176.10 2qjk n VAL 54 N 4.81 1.98 -0.27 1.11 3.14 -0.49 -4.75 118.33 123.86 2qjk n VAL 54 Ca 0.10 -2.21 -0.06 0.00 -2.96 0.00 0.00 64.34 59.21 2qjk n VAL 54 Cb 0.47 -0.24 0.06 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 0.40 1.08 -0.01 6.55 4.64 -1.91 -2.94 113.55 121.36 2qjk h SER 55 Ca 0.00 -0.19 -0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2qjk h SER 55 Cb 1.10 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.91 2qjk h SER 55 CO 0.05 0.98 0.00 -1.54 -0.87 0.00 0.00 176.83 175.45 2qjk n SER 56 N -4.28 1.33 -4.29 4.97 3.41 -1.26 -4.75 113.62 108.74 2qjk n SER 56 Ca 0.06 -2.02 -0.41 0.00 -0.26 0.00 0.00 58.87 56.25 2qjk n SER 56 Cb 0.21 -0.50 -0.10 0.00 -0.26 0.00 0.00 64.21 63.56 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 4.33 0.79 -3.33 1.01 -1.11 -5.07 120.40 116.12 2qjk s VAL 57 Ca 0.01 -1.32 -0.12 0.00 0.00 0.00 0.00 61.98 60.55 2qjk s VAL 57 Cb 0.01 -3.62 0.07 0.00 0.00 0.00 0.00 36.38 32.83 2qjk s VAL 57 CO 0.00 -0.49 1.15 -1.61 0.00 0.00 0.00 175.10 174.16 2qjk s GLU 58 N 1.45 2.13 0.35 2.72 8.01 -1.26 -4.98 118.70 127.12 2qjk s GLU 58 Ca 0.03 0.23 -0.26 0.00 0.01 0.00 0.00 54.97 54.98 2qjk s GLU 58 Cb -0.23 -1.96 -0.09 0.00 -4.31 0.00 0.00 34.13 27.54 2qjk s GLU 58 CO 0.03 -1.50 1.05 -1.25 0.01 0.00 0.00 175.26 173.60 2qjk s PRO 59 N -5.49 4.36 0.00 0.39 0.04 -1.26 -3.16 135.00 129.88 2qjk s PRO 59 Ca 0.61 1.59 0.00 0.00 0.04 0.00 0.00 61.00 63.24 2qjk s PRO 59 Cb -0.11 -2.78 0.00 0.00 0.04 0.00 0.00 34.50 31.64 2qjk s PRO 59 CO 0.50 0.01 0.00 0.41 0.04 0.00 0.00 177.00 177.97 2qjk n GLY 60 N 0.66 0.91 3.33 0.56 0.00 0.24 -4.89 105.19 106.00 2qjk n GLY 60 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.01 2.37 -0.05 1.61 1.01 -1.19 -4.98 120.40 117.17 2qjk s VAL 61 Ca 0.00 -0.96 -0.01 0.00 0.00 0.00 0.00 61.98 61.01 2qjk s VAL 61 Cb 0.00 -1.88 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 2qjk s VAL 61 CO 0.00 0.57 0.04 -1.58 0.00 0.00 0.00 175.10 174.13 2qjk s GLN 62 N -0.31 3.01 -0.25 2.72 0.74 -1.26 -1.78 119.66 122.53 2qjk s GLN 62 Ca 0.01 -0.45 -0.01 0.00 0.05 0.00 0.00 55.36 54.96 2qjk s GLN 62 Cb -0.13 -2.82 0.03 0.00 1.10 0.00 0.00 33.01 31.19 2qjk s GLN 62 CO 0.02 0.68 -0.07 -1.17 -0.55 0.00 0.00 175.29 174.21 2qjk s LEU 63 N -1.29 3.20 -0.23 3.68 2.96 0.21 -4.93 118.68 122.27 2qjk s LEU 63 Ca 0.18 -0.91 -0.09 0.00 -0.22 0.00 0.00 54.13 53.08 2qjk s LEU 63 Cb -0.12 -1.65 -0.04 0.00 0.50 0.00 0.00 46.19 44.87 2qjk s LEU 63 CO 0.08 -0.13 0.13 -0.89 -1.32 0.00 0.00 176.35 174.21 2qjk s THR 64 N 1.31 5.07 0.06 3.68 2.01 -1.26 -1.65 115.64 124.86 2qjk s THR 64 Ca -0.00 0.08 0.06 0.00 0.31 0.00 0.00 61.69 62.13 2qjk s THR 64 Cb -0.17 -3.35 -0.03 0.00 0.01 0.00 0.00 72.50 68.96 2qjk s THR 64 CO -0.05 0.36 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.40 2qjk s VAL 65 N 1.08 1.22 0.34 3.82 1.01 -0.71 -4.94 120.40 122.22 2qjk s VAL 65 Ca 0.06 -1.24 -0.13 0.00 0.00 0.00 0.00 61.98 60.67 2qjk s VAL 65 Cb -0.14 -1.13 -0.08 0.00 0.00 0.00 0.00 36.38 35.03 2qjk s VAL 65 CO 0.04 -0.12 0.73 -0.75 0.00 0.00 0.00 175.10 175.00 2qjk s LYS 66 N -1.56 3.90 -0.29 2.72 2.20 -1.26 0.01 119.74 125.45 2qjk s LYS 66 Ca 0.01 0.56 -0.16 0.00 -0.36 0.00 0.00 55.97 56.01 2qjk s LYS 66 Cb -0.09 -2.44 0.16 0.00 -1.51 0.00 0.00 37.83 33.95 2qjk s LYS 66 CO 0.02 0.11 1.04 0.12 -0.36 0.00 0.00 175.35 176.28 2qjk s PHE 67 N -2.10 -0.47 -1.16 4.03 5.36 -0.50 -4.90 117.98 118.24 2qjk s PHE 67 Ca 0.52 0.92 0.00 0.00 -0.96 0.00 0.00 56.93 57.42 2qjk s PHE 67 Cb -0.10 0.28 0.00 0.00 -0.34 0.00 0.00 43.02 42.86 2qjk s PHE 67 CO 0.23 -0.23 0.00 1.28 -1.46 0.00 0.00 175.22 175.03 2qjk n LEU 68 N 3.78 -1.26 0.00 6.12 4.77 -1.26 -1.07 117.00 128.08 2qjk n LEU 68 Ca -0.17 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2qjk n LEU 68 Cb 0.57 -2.26 0.00 0.00 -2.33 0.00 0.00 43.42 39.39 2qjk n LEU 68 CO 0.02 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.55 2qjk n GLY 69 N -0.84 2.31 3.50 -0.72 0.00 -1.26 -5.01 105.19 103.17 2qjk n GLY 69 Ca -0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.59 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 1.79 0.68 1.61 1.02 -0.23 -5.09 119.74 119.51 2qjk s LYS 70 Ca 0.00 -1.43 -0.13 0.00 0.02 0.00 0.00 55.97 54.42 2qjk s LYS 70 Cb 0.00 -1.98 0.01 0.00 -0.52 0.00 0.00 37.83 35.33 2qjk s LYS 70 CO 0.00 0.41 1.09 -1.25 -0.92 0.00 0.00 175.35 174.67 2qjk s PRO 71 N -2.85 2.79 -0.04 -1.68 0.04 -1.26 -1.40 135.00 130.60 2qjk s PRO 71 Ca 0.24 1.23 -0.01 0.00 0.04 0.00 0.00 61.00 62.50 2qjk s PRO 71 Cb -0.08 -1.96 0.03 0.00 0.04 0.00 0.00 34.50 32.53 2qjk s PRO 71 CO 0.13 -1.24 0.03 0.42 0.04 0.00 0.00 177.00 176.38 2qjk s ILE 72 N -2.60 0.09 0.01 0.56 1.01 0.10 -2.24 121.20 118.12 2qjk s ILE 72 Ca 0.64 0.24 -0.20 0.00 0.00 0.00 0.00 60.65 61.32 2qjk s ILE 72 Cb -0.18 -0.27 -0.06 0.00 0.01 0.00 0.00 42.46 41.97 2qjk s ILE 72 CO 0.46 0.18 0.59 -0.36 0.00 0.00 0.00 174.94 175.81 2qjk s PHE 73 N 1.69 3.70 -0.32 3.97 0.08 0.17 -1.74 117.98 125.54 2qjk s PHE 73 Ca -0.01 1.21 -0.02 0.00 0.12 0.00 0.00 56.93 58.24 2qjk s PHE 73 Cb -0.13 -2.59 0.11 0.00 -0.57 0.00 0.00 43.02 39.83 2qjk s PHE 73 CO -0.03 0.38 0.13 0.42 -0.10 0.00 0.00 175.22 176.02 2qjk s ILE 74 N -0.31 0.55 -0.10 0.64 1.01 -0.66 -1.39 121.20 120.93 2qjk s ILE 74 Ca 0.31 -1.29 -0.01 0.00 0.00 0.00 0.00 60.65 59.66 2qjk s ILE 74 Cb -0.18 -1.42 -0.03 0.00 0.01 0.00 0.00 42.46 40.84 2qjk s ILE 74 CO 0.17 -0.73 -0.06 -0.60 0.00 0.00 0.00 174.94 173.72 2qjk s ARG 75 N 1.65 3.12 -0.51 2.79 3.52 -0.30 0.65 118.95 129.87 2qjk s ARG 75 Ca 0.11 -0.54 -0.15 0.00 -0.13 0.00 0.00 55.73 55.01 2qjk s ARG 75 Cb -0.18 -2.71 0.11 0.00 -1.56 0.00 0.00 34.95 30.61 2qjk s ARG 75 CO -0.25 0.49 0.44 0.50 -0.81 0.00 0.00 175.30 175.66 2qjk s ARG 76 N -0.33 2.91 0.57 5.12 3.52 -0.73 -1.31 118.95 128.71 2qjk s ARG 76 Ca 0.05 -1.59 -0.19 0.00 -0.13 0.00 0.00 55.73 53.86 2qjk s ARG 76 Cb -0.12 -4.18 -0.04 0.00 -1.56 0.00 0.00 34.95 29.04 2qjk s ARG 76 CO 0.02 -1.20 1.19 1.03 -0.81 0.00 0.00 175.30 175.53 2qjk s ARG 77 N 1.58 3.12 0.84 5.12 0.52 0.15 0.83 118.95 131.12 2qjk s ARG 77 Ca 0.04 1.78 -0.09 0.00 -0.52 0.00 0.00 55.73 56.93 2qjk s ARG 77 Cb -0.27 -1.98 0.16 0.00 0.52 0.00 0.00 34.95 33.37 2qjk s ARG 77 CO 0.04 -1.08 1.17 0.95 0.02 0.00 0.00 175.30 176.40 2qjk s THR 78 N -1.63 2.08 0.04 0.02 -4.23 -1.26 -4.52 115.64 106.13 2qjk s THR 78 Ca 0.75 -0.24 -0.21 0.00 -1.18 0.00 0.00 61.69 60.81 2qjk s THR 78 Cb -0.29 -2.84 -0.14 0.00 1.34 0.00 0.00 72.50 70.57 2qjk s THR 78 CO 0.32 0.00 1.39 -0.33 -0.54 0.00 0.00 174.62 175.46 2qjk h GLU 79 N -1.12 0.27 -0.82 3.99 5.08 -1.98 -1.14 114.58 118.86 2qjk h GLU 79 Ca -0.42 -0.12 0.19 0.00 -1.00 0.00 0.00 59.36 58.01 2qjk h GLU 79 Cb 1.26 -0.01 -0.15 0.00 0.50 0.00 0.00 28.75 30.35 2qjk h GLU 79 CO 0.42 0.61 -0.07 0.00 -1.00 0.00 0.00 179.01 178.97 2qjk h ALA 80 N 0.66 0.77 0.54 3.43 0.00 -1.99 0.63 119.26 123.30 2qjk h ALA 80 Ca 0.03 0.29 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 2qjk h ALA 80 Cb 0.53 0.53 0.01 0.00 0.00 0.00 0.00 17.79 18.85 2qjk h ALA 80 CO 0.02 -0.44 -0.26 -0.44 0.00 0.00 0.00 179.25 178.13 2qjk h ASP 81 N 0.05 -0.61 -0.58 0.00 3.32 -1.86 -2.96 116.42 113.78 2qjk h ASP 81 Ca 0.44 -0.04 0.08 0.00 0.02 0.00 0.00 57.03 57.53 2qjk h ASP 81 Cb 0.77 0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.45 2qjk h ASP 81 CO -0.78 -0.33 0.38 0.40 -1.72 0.00 0.00 179.24 177.19 2qjk h ILE 82 N -0.87 0.95 0.00 0.35 2.04 0.22 -2.62 117.51 117.58 2qjk h ILE 82 Ca -0.07 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2qjk h ILE 82 Cb 0.61 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 2qjk h ILE 82 CO 0.12 0.09 0.00 1.21 0.00 0.00 0.00 178.15 179.57 2qjk n GLU 83 N -4.47 0.00 -0.22 2.37 4.07 0.20 -2.56 120.64 120.03 2qjk n GLU 83 Ca 0.09 0.08 0.17 0.00 -0.06 0.00 0.00 57.16 57.43 2qjk n GLU 83 Cb 0.30 -0.87 0.32 0.00 -0.06 0.00 0.00 31.44 31.13 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 -0.45 0.12 -0.21 4.31 4.32 -1.13 0.11 117.00 124.07 2qjk n LEU 84 Ca 0.00 1.10 -0.02 0.00 -0.02 0.00 0.00 56.01 57.07 2qjk n LEU 84 Cb 0.00 -0.49 0.09 0.00 -1.62 0.00 0.00 43.42 41.40 2qjk n LEU 84 CO 0.00 -1.19 1.06 1.23 -1.22 0.00 0.00 177.39 177.28 2qjk h GLY 85 N 0.00 0.90 2.00 -0.72 0.00 -1.35 -0.96 103.07 102.94 2qjk h GLY 85 Ca 0.50 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.61 2qjk h GLY 85 CO -0.54 0.13 0.00 0.54 0.00 0.00 0.00 176.54 176.67 2qjk n ARG 86 N -4.83 0.19 -0.82 4.80 1.74 0.30 -3.14 116.66 114.90 2qjk n ARG 86 Ca 0.07 0.17 -0.13 0.00 -0.77 0.00 0.00 57.85 57.19 2qjk n ARG 86 Cb 0.17 -1.73 0.15 0.00 -1.02 0.00 0.00 32.46 30.04 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 -2.06 3.64 -4.07 0.55 3.41 -0.37 -4.82 113.62 109.91 2qjk n SER 87 Ca 0.06 -3.05 -0.32 0.00 -0.26 0.00 0.00 58.87 55.30 2qjk n SER 87 Cb 0.40 -0.72 -0.16 0.00 -0.26 0.00 0.00 64.21 63.47 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 -2.29 1.91 -0.02 -3.33 1.01 -1.19 -4.99 120.40 111.51 2qjk s VAL 88 Ca 0.39 -1.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 2qjk s VAL 88 Cb 0.33 -1.86 -0.07 0.00 0.00 0.00 0.00 36.38 34.78 2qjk s VAL 88 CO 0.08 0.33 1.76 -1.10 0.00 0.00 0.00 175.10 176.16 2qjk s GLN 89 N 1.30 4.17 0.00 2.72 1.11 -1.26 -4.82 119.66 122.88 2qjk s GLN 89 Ca 0.01 2.33 0.00 0.00 0.01 0.00 0.00 55.36 57.70 2qjk s GLN 89 Cb -0.15 -4.04 0.00 0.00 -1.01 0.00 0.00 33.01 27.80 2qjk s GLN 89 CO -0.10 -0.88 0.29 -0.11 0.01 0.00 0.00 175.29 174.50 2qjk n LEU 90 N 7.27 0.00 -0.31 2.90 7.94 -1.26 0.28 117.00 133.82 2qjk n LEU 90 Ca 0.18 0.04 0.03 0.00 -1.11 0.00 0.00 56.01 55.15 2qjk n LEU 90 Cb 0.42 -0.04 0.07 0.00 0.53 0.00 0.00 43.42 44.40 2qjk n LEU 90 CO 0.64 -0.04 0.53 0.61 -1.11 0.00 0.00 177.39 178.01 2qjk n GLY 91 N -0.79 2.18 0.44 -3.96 0.00 -1.26 -4.47 105.19 97.34 2qjk n GLY 91 Ca 0.00 -0.19 0.04 0.00 0.00 0.00 0.00 46.02 45.87 2qjk n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qjk n GLN 92 N 0.08 2.05 -3.24 1.61 10.64 0.80 -4.98 117.38 124.34 2qjk n GLN 92 Ca 0.05 -1.64 -0.24 0.00 -1.83 0.00 0.00 57.00 53.35 2qjk n GLN 92 Cb 0.30 -1.19 -0.00 0.00 -0.86 0.00 0.00 30.24 28.49 2qjk n GLN 92 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2qjk s LEU 93 N -0.91 3.90 -0.13 2.61 1.43 -1.24 -4.99 118.68 119.34 2qjk s LEU 93 Ca 0.15 0.42 0.03 0.00 -1.03 0.00 0.00 54.13 53.70 2qjk s LEU 93 Cb 0.09 -3.29 -0.24 0.00 0.03 0.00 0.00 46.19 42.78 2qjk s LEU 93 CO 0.12 -0.42 0.31 0.52 0.23 0.00 0.00 176.35 177.11 2qjk n VAL 94 N -1.89 1.65 -4.04 -1.59 0.31 -1.23 -4.81 118.33 106.73 2qjk n VAL 94 Ca -0.03 -0.70 -0.35 0.00 -0.01 0.00 0.00 64.34 63.25 2qjk n VAL 94 Cb 0.57 -1.36 -0.13 0.00 -0.91 0.00 0.00 33.84 32.01 2qjk n VAL 94 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2qjk s ASP 95 N -6.53 4.70 0.02 4.52 2.15 -1.26 -4.99 116.67 115.28 2qjk s ASP 95 Ca -0.18 -0.25 0.14 0.00 0.43 0.00 0.00 52.55 52.68 2qjk s ASP 95 Cb 0.07 -1.80 -0.18 0.00 -0.30 0.00 0.00 42.92 40.71 2qjk s ASP 95 CO 0.76 0.04 0.81 0.74 -0.17 0.00 0.00 175.17 177.35 2qjk h THR 96 N 5.48 0.79 -3.86 1.71 2.02 -1.92 -3.45 112.91 113.68 2qjk h THR 96 Ca -0.37 -2.47 -0.52 0.00 0.77 0.00 0.00 66.41 63.82 2qjk h THR 96 Cb 1.18 2.31 0.05 0.00 -1.74 0.00 0.00 68.15 69.94 2qjk h THR 96 CO 0.60 0.45 0.57 0.21 0.37 0.00 0.00 175.52 177.73 2qjk s ASN 97 N -6.04 6.92 0.52 4.18 3.84 -1.26 0.12 114.94 123.22 2qjk s ASN 97 Ca -0.03 2.53 0.30 0.00 0.21 0.00 0.00 52.86 55.87 2qjk s ASN 97 Cb 0.08 -2.64 1.28 0.00 -0.55 0.00 0.00 41.25 39.43 2qjk s ASN 97 CO 0.82 -0.41 1.96 0.00 -2.79 0.00 0.00 177.10 176.68 2qjk h ALA 98 N 3.48 1.05 -6.37 1.71 0.00 -1.75 -3.38 119.26 113.98 2qjk h ALA 98 Ca -0.48 -0.09 -0.48 0.00 0.00 0.00 0.00 54.91 53.86 2qjk h ALA 98 Cb 1.22 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.94 2qjk h ALA 98 CO 0.66 0.12 -0.79 0.54 0.00 0.00 0.00 179.25 179.77 2qjk n ARG 99 N -3.27 -4.82 -3.94 0.00 5.12 -1.26 -4.74 116.66 103.73 2qjk n ARG 99 Ca -0.00 0.54 -0.35 0.00 -1.93 0.00 0.00 57.85 56.11 2qjk n ARG 99 Cb 0.33 -5.29 -0.14 0.00 -1.16 0.00 0.00 32.46 26.19 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 -3.54 4.17 0.47 0.55 3.84 -1.26 -1.42 114.94 117.74 2qjk s ASN 100 Ca 0.53 -0.56 0.27 0.00 0.21 0.00 0.00 52.86 53.31 2qjk s ASN 100 Cb -0.27 -1.69 0.89 0.00 -0.55 0.00 0.00 41.25 39.63 2qjk s ASN 100 CO 0.85 -0.05 1.81 0.00 -2.79 0.00 0.00 177.10 176.92 2qjk h ALA 101 N 8.07 0.98 -0.13 1.71 0.00 -1.74 -3.09 119.26 125.06 2qjk h ALA 101 Ca -0.40 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.26 2qjk h ALA 101 Cb 1.14 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2qjk h ALA 101 CO 0.60 0.14 -0.56 -0.91 0.00 0.00 0.00 179.25 178.52 2qjk h ASN 102 N 0.00 0.45 -5.31 0.00 2.35 -1.83 -3.46 115.58 107.77 2qjk h ASN 102 Ca -0.00 -0.24 -0.47 0.00 -0.55 0.00 0.00 56.30 55.04 2qjk h ASN 102 Cb 0.77 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.96 2qjk h ASN 102 CO 0.01 0.92 -0.24 2.30 -1.65 0.00 0.00 177.43 178.77 2qjk n ILE 103 N -3.93 0.00 -1.48 2.81 -5.35 -1.17 -5.09 119.36 105.15 2qjk n ILE 103 Ca -0.03 -1.77 -0.37 0.00 -0.27 0.00 0.00 62.75 60.31 2qjk n ILE 103 Cb 0.60 -0.07 0.06 0.00 -1.74 0.00 0.00 39.64 38.48 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 -1.81 -0.11 0.00 7.28 2.03 -1.26 -4.84 116.55 117.83 2qjk n ASP 104 Ca -0.03 0.72 0.12 0.00 0.52 0.00 0.00 54.79 56.12 2qjk n ASP 104 Cb 0.50 -1.30 0.60 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 -1.97 2.21 0.77 -1.67 0.00 -1.26 -2.85 120.51 115.74 2qjk n ALA 105 Ca 0.13 -0.11 0.08 0.00 0.00 0.00 0.00 53.44 53.54 2qjk n ALA 105 Cb 0.48 -1.38 -0.10 0.00 0.00 0.00 0.00 19.45 18.45 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 0.72 -0.64 3.01 0.00 0.00 -1.26 -4.93 105.19 102.09 2qjk n GLY 106 Ca 0.11 -0.48 -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 -1.44 -5.60 -2.45 4.61 0.00 -1.13 -4.87 120.51 109.63 2qjk n ALA 107 Ca 0.03 -1.05 -0.31 0.00 0.00 0.00 0.00 53.44 52.11 2qjk n ALA 107 Cb 0.28 -0.99 -0.13 0.00 0.00 0.00 0.00 19.45 18.61 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 -2.06 2.13 0.00 0.00 2.02 -1.26 -3.05 118.70 116.48 2qjk s GLU 108 Ca 0.39 -0.94 0.00 0.00 0.02 0.00 0.00 54.97 54.44 2qjk s GLU 108 Cb -0.04 -2.21 0.00 0.00 0.10 0.00 0.00 34.13 31.99 2qjk s GLU 108 CO 0.74 0.55 0.00 0.00 0.02 0.00 0.00 175.26 176.57 2qjk n ALA 109 N 1.71 1.22 -2.00 5.21 0.00 0.33 -4.44 120.51 122.54 2qjk n ALA 109 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.87 2qjk n ALA 109 Cb 0.52 -1.21 -0.04 0.00 0.00 0.00 0.00 19.45 18.73 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 1.21 3.55 0.50 0.00 -4.23 -1.26 -4.86 115.64 110.54 2qjk s THR 110 Ca 0.00 1.35 0.38 0.00 -1.18 0.00 0.00 61.69 62.24 2qjk s THR 110 Cb 0.00 -3.86 0.59 0.00 1.34 0.00 0.00 72.50 70.57 2qjk s THR 110 CO 0.00 0.24 1.67 -0.78 -0.54 0.00 0.00 174.62 175.21 2qjk h ASP 111 N 4.93 0.11 0.68 3.99 1.82 -1.88 1.14 116.42 127.21 2qjk h ASP 111 Ca -0.45 0.05 -0.10 0.00 -0.39 0.00 0.00 57.03 56.14 2qjk h ASP 111 Cb 1.21 0.04 -0.01 0.00 0.68 0.00 0.00 39.33 41.25 2qjk h ASP 111 CO 0.73 -0.05 -0.48 1.56 -1.61 0.00 0.00 179.24 179.39 2qjk h GLN 112 N 0.06 0.00 -0.13 0.28 7.50 -1.92 -2.96 115.11 117.94 2qjk h GLN 112 Ca 0.78 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.93 2qjk h GLN 112 Cb 2.83 0.00 0.00 0.00 0.05 0.00 0.00 27.48 30.36 2qjk h GLN 112 CO -0.16 0.48 0.00 0.09 -1.50 0.00 0.00 178.83 177.74 2qjk n ASN 113 N -3.72 1.26 -0.01 1.46 3.02 0.39 -3.86 115.26 113.81 2qjk n ASN 113 Ca -0.01 -1.64 0.08 0.00 -0.03 0.00 0.00 54.58 52.97 2qjk n ASN 113 Cb 0.54 -0.08 -0.11 0.00 -0.61 0.00 0.00 39.78 39.52 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 0.06 0.84 -3.02 3.52 5.12 -1.12 -4.84 116.66 117.22 2qjk n ARG 114 Ca 0.15 -0.11 -0.17 0.00 -1.93 0.00 0.00 57.85 55.79 2qjk n ARG 114 Cb 0.26 -1.32 0.02 0.00 -1.16 0.00 0.00 32.46 30.26 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 -2.91 2.84 -0.16 0.55 -4.23 -1.24 -4.58 115.64 105.91 2qjk s THR 115 Ca -0.03 -1.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.49 2qjk s THR 115 Cb 0.10 -2.84 -0.23 0.00 1.34 0.00 0.00 72.50 70.87 2qjk s THR 115 CO 0.63 0.00 0.19 0.18 -0.54 0.00 0.00 174.62 175.08 2qjk n LEU 116 N -1.92 2.22 -4.96 4.79 4.77 -0.91 -4.97 117.00 116.02 2qjk n LEU 116 Ca 0.09 0.11 -0.22 0.00 -0.03 0.00 0.00 56.01 55.96 2qjk n LEU 116 Cb 0.59 -0.70 0.02 0.00 -2.33 0.00 0.00 43.42 41.00 2qjk n LEU 116 CO 0.39 0.78 0.29 1.51 -1.33 0.00 0.00 177.39 179.03 2qjk s ASP 117 N -6.58 5.69 0.31 -1.43 -4.77 -1.26 -5.01 116.67 103.62 2qjk s ASP 117 Ca -0.23 0.18 0.20 0.00 -3.30 0.00 0.00 52.55 49.40 2qjk s ASP 117 Cb 0.07 -1.34 0.14 0.00 -1.09 0.00 0.00 42.92 40.71 2qjk s ASP 117 CO 0.73 -0.80 1.38 -0.33 0.70 0.00 0.00 175.17 176.85 2qjk h GLU 118 N 0.34 0.00 0.00 2.11 3.07 -1.94 -2.96 114.58 115.20 2qjk h GLU 118 Ca -0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.41 2qjk h GLU 118 Cb 1.26 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.17 2qjk h GLU 118 CO 0.56 0.20 0.00 0.00 -1.40 0.00 0.00 179.01 178.36 2qjk h ALA 119 N 1.77 1.00 -0.77 3.43 0.00 -1.99 -3.47 119.26 119.23 2qjk h ALA 119 Ca -0.02 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 2qjk h ALA 119 Cb 1.19 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.94 2qjk h ALA 119 CO 0.03 0.00 -0.19 0.41 0.00 0.00 0.00 179.25 179.50 2qjk n GLY 120 N 0.73 0.58 0.10 0.00 0.00 -1.12 -4.95 105.19 100.54 2qjk n GLY 120 Ca 0.04 -0.60 -0.14 0.00 0.00 0.00 0.00 46.02 45.32 2qjk n GLY 120 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2qjk h GLU 121 N 0.00 0.18 -4.44 1.61 4.81 -1.88 -3.44 114.58 111.42 2qjk h GLU 121 Ca -0.19 -0.30 -0.73 0.00 -0.13 0.00 0.00 59.36 58.00 2qjk h GLU 121 Cb 0.82 0.11 -0.22 0.00 0.63 0.00 0.00 28.75 30.10 2qjk h GLU 121 CO 0.25 1.01 0.33 -1.58 -0.73 0.00 0.00 179.01 178.29 2qjk s TRP 122 N -2.63 3.35 -0.38 0.92 0.52 -1.26 0.33 118.94 119.79 2qjk s TRP 122 Ca -0.07 -1.52 -0.17 0.00 0.02 0.00 0.00 56.10 54.36 2qjk s TRP 122 Cb 0.07 -4.02 0.00 0.00 -1.15 0.00 0.00 33.47 28.38 2qjk s TRP 122 CO 0.84 -1.23 0.47 -1.17 0.02 0.00 0.00 176.95 175.88 2qjk s LEU 123 N 1.66 4.53 -0.11 2.99 2.96 -0.43 -2.15 118.68 128.13 2qjk s LEU 123 Ca 0.21 -0.29 0.03 0.00 -0.22 0.00 0.00 54.13 53.85 2qjk s LEU 123 Cb -0.13 -2.48 0.01 0.00 0.50 0.00 0.00 46.19 44.09 2qjk s LEU 123 CO -0.05 -0.50 -0.20 -0.69 -1.32 0.00 0.00 176.35 173.59 2qjk s VAL 124 N 2.27 1.83 0.13 1.68 1.01 -1.26 -1.15 120.40 124.92 2qjk s VAL 124 Ca 0.16 -0.86 -0.24 0.00 0.00 0.00 0.00 61.98 61.03 2qjk s VAL 124 Cb -0.16 -1.62 0.08 0.00 0.00 0.00 0.00 36.38 34.67 2qjk s VAL 124 CO 0.14 0.51 0.65 0.00 0.00 0.00 0.00 175.10 176.39 2qjk s MET 125 N 0.69 1.20 -0.27 2.72 0.23 -0.48 -4.61 119.30 118.78 2qjk s MET 125 Ca -0.11 -0.43 -0.29 0.00 -1.03 0.00 0.00 55.69 53.83 2qjk s MET 125 Cb -0.16 0.55 -0.02 0.00 -1.53 0.00 0.00 34.83 33.67 2qjk s MET 125 CO 0.02 -0.52 1.69 -1.58 -2.03 0.00 0.00 175.02 172.60 2qjk s TRP 126 N -3.59 1.98 0.00 3.16 0.52 0.13 0.46 118.94 121.61 2qjk s TRP 126 Ca 0.01 0.56 -0.03 0.00 0.02 0.00 0.00 56.10 56.67 2qjk s TRP 126 Cb -0.01 -4.06 -0.13 0.00 -1.15 0.00 0.00 33.47 28.12 2qjk s TRP 126 CO -0.12 -2.95 2.07 0.41 0.02 0.00 0.00 176.95 176.39 2qjk n GLY 127 N 4.99 2.04 2.94 0.98 0.00 -0.95 -4.57 105.19 110.61 2qjk n GLY 127 Ca 0.20 -0.58 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 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 1.76 2.53 0.01 1.61 1.01 -1.26 -3.83 120.40 122.23 2qjk s VAL 128 Ca 0.32 -3.28 -0.31 0.00 0.00 0.00 0.00 61.98 58.71 2qjk s VAL 128 Cb 0.15 -2.76 -0.16 0.00 0.00 0.00 0.00 36.38 33.62 2qjk s VAL 128 CO 0.00 -0.80 0.82 0.00 0.00 0.00 0.00 175.10 175.12 2qjk n THR 130 N 1.11 0.00 0.00 0.00 -2.24 -1.26 -3.06 114.28 108.83 2qjk n THR 130 Ca 0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 2qjk n THR 130 Cb 0.07 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 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 -0.74 0.00 0.00 4.78 -0.00 -1.26 -4.41 115.22 113.59 2qjk n HIS 131 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.83 2qjk n HIS 131 Cb 0.05 -0.14 0.00 0.00 -0.00 0.00 0.00 29.99 29.90 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 -0.91 0.00 0.00 0.27 4.77 -1.26 -4.98 117.00 114.89 2qjk n LEU 132 Ca 0.00 -0.14 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 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 1.56 1.35 3.31 -0.72 0.00 -1.17 -5.07 105.19 104.44 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 -1.84 5.85 0.46 0.00 0.15 -1.25 -0.01 113.70 117.06 2qjk s SER 135 Ca 0.55 -0.95 -0.25 0.00 0.70 0.00 0.00 55.95 56.00 2qjk s SER 135 Cb -0.15 -2.07 -0.08 0.00 -1.71 0.00 0.00 66.02 62.02 2qjk s SER 135 CO 0.67 -0.40 1.43 -2.84 1.20 0.00 0.00 173.24 173.30 2qjk s PRO 136 N 1.60 3.63 0.21 5.44 0.02 -1.26 -4.90 135.00 139.74 2qjk s PRO 136 Ca 0.03 2.42 -0.30 0.00 0.02 0.00 0.00 61.00 63.17 2qjk s PRO 136 Cb -0.19 -2.62 -0.08 0.00 0.02 0.00 0.00 34.50 31.63 2qjk s PRO 136 CO 0.08 -0.87 1.07 0.42 -0.33 0.00 0.00 177.00 177.37 2qjk s ILE 137 N -1.20 3.81 0.00 2.83 1.01 0.03 -4.75 121.20 122.93 2qjk s ILE 137 Ca 0.62 1.67 0.00 0.00 0.00 0.00 0.00 60.65 62.94 2qjk s ILE 137 Cb -0.44 -4.06 0.00 0.00 0.01 0.00 0.00 42.46 37.97 2qjk s ILE 137 CO 0.56 0.33 0.00 0.61 0.00 0.00 0.00 174.94 176.45 2qjk n GLY 138 N 1.72 1.85 3.28 6.18 0.00 -1.26 -1.42 105.19 115.54 2qjk n GLY 138 Ca 0.01 -1.76 -0.17 0.00 0.00 0.00 0.00 46.02 44.10 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 -0.32 3.25 -0.02 0.00 -1.26 -3.96 105.19 107.88 2qjk n GLY 139 Ca 0.00 0.08 -0.14 0.00 0.00 0.00 0.00 46.02 45.96 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 -4.06 -3.77 -4.37 1.61 0.31 -1.21 -5.01 118.33 101.83 2qjk n VAL 140 Ca -0.22 0.47 -0.19 0.00 -0.01 0.00 0.00 64.34 64.40 2qjk n VAL 140 Cb 0.64 -3.65 -0.10 0.00 -0.91 0.00 0.00 33.84 29.81 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 -1.27 1.88 0.00 4.52 0.01 0.39 -4.78 113.70 114.45 2qjk s SER 141 Ca 0.14 -1.32 0.00 0.00 1.31 0.00 0.00 55.95 56.09 2qjk s SER 141 Cb -0.02 0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.22 2qjk s SER 141 CO 0.39 -0.60 0.00 0.61 0.41 0.00 0.00 173.24 174.05 2qjk n GLY 142 N -0.53 -1.80 0.84 3.44 0.00 -1.26 -0.59 105.19 105.28 2qjk n GLY 142 Ca -0.03 -1.97 0.03 0.00 0.00 0.00 0.00 46.02 44.05 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 0.04 2.70 -0.35 1.61 8.00 -1.26 -4.47 116.55 122.82 2qjk n ASP 143 Ca 0.00 -3.49 0.00 0.00 0.71 0.00 0.00 54.79 52.01 2qjk n ASP 143 Cb 0.00 -0.56 0.00 0.00 -0.02 0.00 0.00 41.12 40.54 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 -1.02 0.00 -3.29 1.24 3.01 -1.26 -5.03 117.46 111.10 2qjk n PHE 144 Ca 0.25 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.49 2qjk n PHE 144 Cb 0.89 0.01 0.06 0.00 -0.01 0.00 0.00 39.48 40.42 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 0.00 -0.46 0.00 1.37 0.00 -1.25 -3.74 105.19 101.11 2qjk n GLY 145 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.74 1.84 3.16 -0.02 0.00 0.25 -3.50 105.19 105.18 2qjk n GLY 146 Ca -0.04 -0.22 -0.17 0.00 0.00 0.00 0.00 46.02 45.59 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 1.25 1.13 -0.14 1.61 0.51 -0.58 -0.46 118.94 122.26 2qjk s TRP 147 Ca 0.00 -0.47 0.00 0.00 -2.12 0.00 0.00 56.10 53.51 2qjk s TRP 147 Cb 0.00 -0.64 0.03 0.00 -0.81 0.00 0.00 33.47 32.05 2qjk s TRP 147 CO 0.00 0.04 -0.11 0.12 -0.51 0.00 0.00 176.95 176.49 2qjk s PHE 148 N -1.34 1.90 -0.55 -1.98 5.36 -0.51 -1.23 117.98 119.62 2qjk s PHE 148 Ca -0.03 -1.06 -0.22 0.00 -0.96 0.00 0.00 56.93 54.66 2qjk s PHE 148 Cb -0.10 -1.45 0.05 0.00 -0.34 0.00 0.00 43.02 41.19 2qjk s PHE 148 CO 0.02 -0.61 0.85 0.00 -1.46 0.00 0.00 175.22 174.02 2qjk n PRO 150 N 7.11 0.16 -0.03 0.00 -0.04 -1.26 -1.29 135.00 139.64 2qjk n PRO 150 Ca -0.02 0.17 -0.16 0.00 -0.04 0.00 0.00 63.50 63.45 2qjk n PRO 150 Cb 0.47 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.35 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 -4.13 0.00 -2.71 0.00 8.25 -1.21 -5.06 115.22 110.36 2qjk n HIS 152 Ca -0.07 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.28 2qjk n HIS 152 Cb 0.64 0.01 0.05 0.00 1.12 0.00 0.00 29.99 31.81 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 -0.42 3.56 -1.41 0.00 -0.41 -4.67 105.19 101.84 2qjk n GLY 153 Ca 0.00 0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.36 4.89 -0.06 1.61 0.01 -1.09 -4.20 113.70 111.50 2qjk s SER 154 Ca 0.26 -0.04 -0.01 0.00 1.31 0.00 0.00 55.95 57.47 2qjk s SER 154 Cb -0.03 -1.59 -0.03 0.00 0.21 0.00 0.00 66.02 64.57 2qjk s SER 154 CO 0.49 0.26 0.02 -1.00 0.41 0.00 0.00 173.24 173.42 2qjk s HIS 155 N -0.17 3.18 0.04 2.43 0.09 0.02 -0.94 115.29 119.95 2qjk s HIS 155 Ca 0.03 0.19 0.05 0.00 -0.00 0.00 0.00 55.06 55.33 2qjk s HIS 155 Cb -0.13 -1.76 -0.02 0.00 -0.00 0.00 0.00 32.58 30.67 2qjk s HIS 155 CO 0.02 0.49 -0.15 0.71 -0.00 0.00 0.00 174.74 175.82 2qjk s TYR 156 N -0.98 1.30 0.63 1.40 1.51 -0.37 -0.58 117.35 120.27 2qjk s TYR 156 Ca 0.16 -0.37 -0.05 0.00 -1.01 0.00 0.00 57.07 55.80 2qjk s TYR 156 Cb -0.11 -0.77 0.13 0.00 -0.11 0.00 0.00 41.96 41.10 2qjk s TYR 156 CO 0.06 0.05 0.87 -0.40 -1.11 0.00 0.00 175.55 175.01 2qjk n ASP 157 N 1.80 0.69 0.00 2.29 5.68 -0.07 -1.53 116.55 125.42 2qjk n ASP 157 Ca -0.18 -1.69 0.03 0.00 -0.50 0.00 0.00 54.79 52.44 2qjk n ASP 157 Cb 0.54 -0.61 0.16 0.00 -1.14 0.00 0.00 41.12 40.08 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 -3.20 0.00 -0.11 -1.12 3.41 -1.23 -0.48 113.62 110.90 2qjk n SER 158 Ca 0.13 -0.46 0.01 0.00 -0.26 0.00 0.00 58.87 58.29 2qjk n SER 158 Cb 0.45 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.42 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 -0.77 2.37 -2.06 7.33 0.00 -1.26 -4.88 120.51 121.24 2qjk n ALA 159 Ca 0.04 -0.66 -0.02 0.00 0.00 0.00 0.00 53.44 52.80 2qjk n ALA 159 Cb 0.02 -0.09 -0.00 0.00 0.00 0.00 0.00 19.45 19.38 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 0.03 0.32 3.84 0.00 0.00 0.37 -4.95 105.19 104.81 2qjk n GLY 160 Ca 0.02 -0.80 -0.35 0.00 0.00 0.00 0.00 46.02 44.89 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 -4.14 3.29 0.16 1.61 0.52 -1.26 -1.57 118.95 117.56 2qjk s ARG 161 Ca 0.00 -0.30 -0.30 0.00 -0.52 0.00 0.00 55.73 54.61 2qjk s ARG 161 Cb -0.00 -3.03 -0.07 0.00 0.52 0.00 0.00 34.95 32.36 2qjk s ARG 161 CO 0.00 0.71 1.17 -1.50 0.02 0.00 0.00 175.30 175.71 2qjk s ILE 162 N -1.14 3.74 0.00 1.52 1.10 -1.26 -0.89 121.20 124.28 2qjk s ILE 162 Ca 0.20 1.42 0.00 0.00 -0.51 0.00 0.00 60.65 61.76 2qjk s ILE 162 Cb -0.12 -3.91 0.00 0.00 0.15 0.00 0.00 42.46 38.58 2qjk s ILE 162 CO 0.10 0.21 0.00 0.54 -2.11 0.00 0.00 174.94 173.68 2qjk n ARG 163 N 2.78 2.86 -3.49 3.50 5.12 0.25 -3.56 116.66 124.12 2qjk n ARG 163 Ca 0.05 0.00 -0.15 0.00 -1.93 0.00 0.00 57.85 55.82 2qjk n ARG 163 Cb 0.45 -0.68 -0.04 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 -1.03 1.08 0.00 5.56 2.20 -1.19 -4.90 119.74 121.46 2qjk s LYS 164 Ca 0.00 -0.03 0.00 0.00 -0.36 0.00 0.00 55.97 55.58 2qjk s LYS 164 Cb 0.00 0.50 0.00 0.00 -1.51 0.00 0.00 37.83 36.82 2qjk s LYS 164 CO 0.00 -0.40 0.00 0.41 -0.36 0.00 0.00 175.35 175.00 2qjk n GLY 165 N 0.39 0.54 0.24 5.54 0.00 -1.26 -0.80 105.19 109.84 2qjk n GLY 165 Ca -0.17 -2.12 0.12 0.00 0.00 0.00 0.00 46.02 43.85 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 0.00 0.00 -6.41 1.61 0.13 -1.83 -3.45 132.00 122.05 2qjk h PRO 166 Ca 0.00 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.50 2qjk h PRO 166 Cb 0.00 0.00 0.09 0.00 0.13 0.00 0.00 31.00 31.22 2qjk h PRO 166 CO 0.00 0.17 0.27 0.00 -0.23 0.00 0.00 178.00 178.21 2qjk n ALA 167 N -2.23 -0.35 0.13 -0.56 0.00 -1.26 -4.88 120.51 111.36 2qjk n ALA 167 Ca -0.01 0.43 0.06 0.00 0.00 0.00 0.00 53.44 53.93 2qjk n ALA 167 Cb 0.35 -2.06 0.12 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 1.47 1.93 -3.92 0.00 -0.04 -1.26 -4.96 135.00 128.22 2qjk n PRO 168 Ca 0.13 -1.75 -0.09 0.00 -0.04 0.00 0.00 63.50 61.74 2qjk n PRO 168 Cb 0.28 -1.28 -0.06 0.00 -0.04 0.00 0.00 33.50 32.40 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 -1.04 1.30 0.38 0.54 2.02 -1.26 -4.76 118.70 115.87 2qjk s GLU 169 Ca 0.22 -1.12 -0.18 0.00 0.02 0.00 0.00 54.97 53.90 2qjk s GLU 169 Cb 0.13 0.43 -0.10 0.00 0.10 0.00 0.00 34.13 34.69 2qjk s GLU 169 CO 0.17 -0.51 0.84 -0.80 0.02 0.00 0.00 175.26 174.99 2qjk s ASN 170 N -2.96 6.86 0.06 -0.19 0.01 -1.26 -4.20 114.94 113.26 2qjk s ASN 170 Ca 0.17 1.49 -0.36 0.00 -0.71 0.00 0.00 52.86 53.45 2qjk s ASN 170 Cb 0.01 -2.46 -0.15 0.00 0.41 0.00 0.00 41.25 39.07 2qjk s ASN 170 CO 0.02 -0.28 1.54 0.18 -1.51 0.00 0.00 177.10 177.05 2qjk n LEU 171 N -0.49 2.53 -4.77 0.60 4.77 -0.61 -4.90 117.00 114.12 2qjk n LEU 171 Ca 0.05 1.08 -0.35 0.00 -0.03 0.00 0.00 56.01 56.76 2qjk n LEU 171 Cb 0.54 -1.30 0.00 0.00 -2.33 0.00 0.00 43.42 40.32 2qjk n LEU 171 CO 0.39 -0.56 0.79 -2.84 -1.33 0.00 0.00 177.39 173.85 2qjk s PRO 172 N 1.38 3.41 -0.19 3.23 0.02 -1.26 -4.79 135.00 136.80 2qjk s PRO 172 Ca 0.84 1.64 -0.05 0.00 0.02 0.00 0.00 61.00 63.45 2qjk s PRO 172 Cb -0.82 -2.06 -0.02 0.00 0.02 0.00 0.00 34.50 31.62 2qjk s PRO 172 CO 0.45 -0.81 -0.01 0.42 -0.33 0.00 0.00 177.00 176.72 2qjk s ILE 173 N -1.74 3.87 0.53 2.83 1.01 -0.51 -0.69 121.20 126.50 2qjk s ILE 173 Ca 0.72 -0.35 -0.07 0.00 0.00 0.00 0.00 60.65 60.95 2qjk s ILE 173 Cb -0.25 -2.74 -0.03 0.00 0.01 0.00 0.00 42.46 39.45 2qjk s ILE 173 CO 0.28 0.44 0.87 -2.16 0.00 0.00 0.00 174.94 174.37 2qjk s PRO 174 N 0.89 3.51 -0.10 2.79 0.04 -1.26 -2.17 135.00 138.70 2qjk s PRO 174 Ca 0.00 0.35 -0.38 0.00 0.04 0.00 0.00 61.00 61.01 2qjk s PRO 174 Cb -0.14 -2.28 -0.16 0.00 0.04 0.00 0.00 34.50 31.96 2qjk s PRO 174 CO 0.02 -0.36 1.59 1.28 0.04 0.00 0.00 177.00 179.56 2qjk n LEU 175 N -2.44 2.20 -3.51 -3.56 4.77 -1.26 -4.68 117.00 108.51 2qjk n LEU 175 Ca 0.02 1.09 -0.17 0.00 -0.03 0.00 0.00 56.01 56.92 2qjk n LEU 175 Cb 0.55 -1.19 -0.05 0.00 -2.33 0.00 0.00 43.42 40.40 2qjk n LEU 175 CO 0.55 -0.64 0.41 0.00 -1.33 0.00 0.00 177.39 176.38 2qjk s ALA 176 N 2.25 -1.69 -0.30 -1.18 0.00 -1.26 -0.52 121.76 119.06 2qjk s ALA 176 Ca 0.92 1.12 -0.26 0.00 0.00 0.00 0.00 51.96 53.74 2qjk s ALA 176 Cb -0.98 0.16 0.19 0.00 0.00 0.00 0.00 23.12 22.50 2qjk s ALA 176 CO 0.56 -0.44 1.45 -1.59 0.00 0.00 0.00 175.76 175.74 2qjk s LYS 177 N -1.66 0.04 0.11 0.00 0.00 -1.25 -4.95 119.74 112.03 2qjk s LYS 177 Ca -0.09 0.04 -0.31 0.00 0.00 0.00 0.00 55.97 55.61 2qjk s LYS 177 Cb -0.00 0.02 -0.09 0.00 0.00 0.00 0.00 37.83 37.75 2qjk s LYS 177 CO 0.06 -0.01 1.68 -0.06 0.00 0.00 0.00 175.35 177.02 2qjk s PHE 178 N -0.13 2.52 -0.64 1.78 0.40 -1.26 -1.60 117.98 119.05 2qjk s PHE 178 Ca 0.08 0.30 0.24 0.00 -0.60 0.00 0.00 56.93 56.95 2qjk s PHE 178 Cb -0.04 -4.02 0.23 0.00 0.51 0.00 0.00 43.02 39.70 2qjk s PHE 178 CO -0.15 -4.04 1.21 -0.89 0.70 0.00 0.00 175.22 172.05 2qjk n ILE 179 N 4.53 0.27 -2.72 0.64 2.08 0.11 -4.92 119.36 119.36 2qjk n ILE 179 Ca 0.16 -0.26 0.00 0.00 0.56 0.00 0.00 62.75 63.21 2qjk n ILE 179 Cb 0.39 0.01 0.00 0.00 -0.75 0.00 0.00 39.64 39.29 2qjk n ILE 179 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 2qjk n ASP 180 N -2.04 0.00 0.28 4.38 5.68 -1.20 -5.01 116.55 118.64 2qjk n ASP 180 Ca 0.03 -0.10 0.12 0.00 -0.50 0.00 0.00 54.79 54.34 2qjk n ASP 180 Cb 0.44 0.00 0.80 0.00 -1.14 0.00 0.00 41.12 41.22 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 -0.06 0.11 5.08 -2.03 -3.29 114.58 114.39 2qjk h GLU 181 Ca 0.00 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 2qjk h GLU 181 Cb 0.00 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 28.96 2qjk h GLU 181 CO 0.00 0.03 -0.74 -2.37 -1.00 0.00 0.00 179.01 174.93 2qjk n THR 182 N -4.01 0.19 -3.71 1.13 5.66 -1.26 -4.96 114.28 107.32 2qjk n THR 182 Ca -0.03 -0.98 -0.13 0.00 -3.05 0.00 0.00 64.05 59.87 2qjk n THR 182 Cb 0.12 0.89 -0.13 0.00 -1.55 0.00 0.00 70.33 69.66 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 -0.55 -0.14 -0.09 1.09 2.01 -1.24 -1.40 115.64 115.32 2qjk s THR 183 Ca 0.20 0.19 -0.01 0.00 0.31 0.00 0.00 61.69 62.37 2qjk s THR 183 Cb 0.27 -0.39 -0.03 0.00 0.01 0.00 0.00 72.50 72.35 2qjk s THR 183 CO -0.09 0.08 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.27 2qjk s ILE 184 N 1.59 4.16 -0.71 1.82 1.01 -0.80 0.08 121.20 128.35 2qjk s ILE 184 Ca -0.06 -0.30 -0.07 0.00 0.00 0.00 0.00 60.65 60.22 2qjk s ILE 184 Cb -0.11 -2.75 0.18 0.00 0.01 0.00 0.00 42.46 39.80 2qjk s ILE 184 CO -0.08 0.59 0.57 -1.58 0.00 0.00 0.00 174.94 174.44 2qjk s GLN 185 N -0.76 2.97 0.16 2.79 0.74 -0.62 -1.24 119.66 123.70 2qjk s GLN 185 Ca 0.12 -2.54 -0.31 0.00 0.05 0.00 0.00 55.36 52.68 2qjk s GLN 185 Cb -0.11 -3.99 -0.08 0.00 1.10 0.00 0.00 33.01 29.92 2qjk s GLN 185 CO 0.02 -1.22 1.37 -0.51 -0.55 0.00 0.00 175.29 174.41 2qjk s LEU 186 N -0.04 4.39 0.00 3.68 1.43 -1.12 -3.87 118.68 123.15 2qjk s LEU 186 Ca 0.18 2.39 0.00 0.00 -1.03 0.00 0.00 54.13 55.67 2qjk s LEU 186 Cb -0.16 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.46 2qjk s LEU 186 CO -0.06 -0.62 0.00 0.61 0.23 0.00 0.00 176.35 176.51