#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dvk n ARG 80 N 0.00 1.42 -0.14 3.17 5.12 -1.26 -4.96 116.66 120.01 1dvk n ARG 80 Ca 0.00 -3.69 -0.10 0.00 -1.93 0.00 0.00 57.85 52.13 1dvk n ARG 80 Cb 0.00 -1.74 -0.01 0.00 -1.16 0.00 0.00 32.46 29.55 1dvk n ARG 80 CO 0.00 0.00 0.00 0.97 -1.93 0.00 0.00 177.63 176.67 1dvk h ILE 81 N 1.66 1.24 -0.80 0.55 2.10 -2.05 -3.08 117.51 117.13 1dvk h ILE 81 Ca 0.11 -0.88 0.11 0.00 1.08 0.00 0.00 64.86 65.28 1dvk h ILE 81 Cb 0.85 1.01 -0.06 0.00 -1.09 0.00 0.00 36.82 37.54 1dvk h ILE 81 CO 0.57 0.30 0.52 -0.61 -1.08 0.00 0.00 178.15 177.86 1dvk h GLN 82 N 0.54 0.66 0.00 2.19 5.75 -1.95 0.29 115.11 122.59 1dvk h GLN 82 Ca 0.13 -0.04 -0.11 0.00 -0.15 0.00 0.00 58.65 58.47 1dvk h GLN 82 Cb 0.38 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.76 1dvk h GLN 82 CO 0.01 0.44 -0.53 0.93 -2.65 0.00 0.00 178.83 177.02 1dvk h GLU 83 N 0.68 0.00 -0.24 1.69 4.39 -1.88 -1.84 114.58 117.37 1dvk h GLU 83 Ca 0.38 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.93 1dvk h GLU 83 Cb 0.54 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.19 1dvk h GLU 83 CO -0.15 0.53 -0.42 0.00 -1.16 0.00 0.00 179.01 177.82 1dvk h ALA 84 N 1.47 0.38 -0.35 3.43 0.00 -0.94 -3.19 119.26 120.06 1dvk h ALA 84 Ca -0.01 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1dvk h ALA 84 Cb 1.01 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1dvk h ALA 84 CO 0.07 0.49 0.19 0.82 0.00 0.00 0.00 179.25 180.82 1dvk h ILE 85 N 0.43 1.14 -0.07 0.00 2.04 -0.97 -1.90 117.51 118.17 1dvk h ILE 85 Ca 0.02 -0.36 0.02 0.00 1.00 0.00 0.00 64.86 65.54 1dvk h ILE 85 Cb 1.02 0.75 -0.00 0.00 -0.74 0.00 0.00 36.82 37.84 1dvk h ILE 85 CO 0.09 0.14 0.09 0.00 0.00 0.00 0.00 178.15 178.47 1dvk h ALA 86 N 1.06 1.63 -0.01 1.87 0.00 -1.35 -1.83 119.26 120.63 1dvk h ALA 86 Ca 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1dvk h ALA 86 Cb 0.06 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1dvk h ALA 86 CO -0.02 -0.13 -0.64 1.04 0.00 0.00 0.00 179.25 179.50 1dvk n GLN 87 N -3.80 1.09 -2.02 0.00 3.00 -1.05 -4.94 117.38 109.66 1dvk n GLN 87 Ca -0.01 -0.49 -0.43 0.00 -0.01 0.00 0.00 57.00 56.06 1dvk n GLN 87 Cb 0.18 -1.40 -0.03 0.00 0.00 0.00 0.00 30.24 29.00 1dvk n GLN 87 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1dvk s ASP 88 N -2.51 5.92 0.00 1.08 3.68 -0.69 -4.87 116.67 119.28 1dvk s ASP 88 Ca 0.12 1.27 0.29 0.00 2.13 0.00 0.00 52.55 56.36 1dvk s ASP 88 Cb 0.15 -2.53 1.62 0.00 -1.45 0.00 0.00 42.92 40.71 1dvk s ASP 88 CO 0.64 -1.69 2.05 0.29 0.13 0.00 0.00 175.17 176.59 1dvk n LYS 89 N 8.41 1.14 -0.05 4.34 5.02 -1.26 -3.37 118.16 132.39 1dvk n LYS 89 Ca 0.22 -0.21 0.12 0.00 -2.02 0.00 0.00 58.31 56.42 1dvk n LYS 89 Cb 0.47 -1.47 0.43 0.00 -0.02 0.00 0.00 35.03 34.45 1dvk n LYS 89 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1dvk n THR 90 N -0.72 0.14 -3.57 -0.18 -2.24 -1.26 -4.83 114.28 101.61 1dvk n THR 90 Ca 0.22 -0.31 -0.38 0.00 -2.27 0.00 0.00 64.05 61.31 1dvk n THR 90 Cb 0.15 0.40 -0.10 0.00 -2.10 0.00 0.00 70.33 68.68 1dvk n THR 90 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1dvk s ILE 91 N -1.86 5.30 0.71 2.28 1.01 -1.22 -5.09 121.20 122.33 1dvk s ILE 91 Ca 0.34 0.24 0.01 0.00 0.00 0.00 0.00 60.65 61.24 1dvk s ILE 91 Cb 0.19 -3.55 0.14 0.00 0.01 0.00 0.00 42.46 39.24 1dvk s ILE 91 CO 0.29 0.26 0.97 -1.54 0.00 0.00 0.00 174.94 174.92 1dvk n SER 92 N 4.92 1.40 -0.08 3.58 3.41 -1.26 -5.00 113.62 120.58 1dvk n SER 92 Ca -0.13 -2.16 0.13 0.00 -0.26 0.00 0.00 58.87 56.45 1dvk n SER 92 Cb 0.52 -0.62 0.45 0.00 -0.26 0.00 0.00 64.21 64.29 1dvk n SER 92 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1dvk n VAL 93 N -2.80 0.00 -2.23 -3.33 0.24 -1.26 -4.78 118.33 104.17 1dvk n VAL 93 Ca 0.16 -0.04 -0.42 0.00 -2.04 0.00 0.00 64.34 62.00 1dvk n VAL 93 Cb 0.59 0.05 -0.03 0.00 -1.47 0.00 0.00 33.84 32.98 1dvk n VAL 93 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1dvk s ILE 94 N -2.74 3.66 -0.23 1.34 1.01 -1.26 -4.62 121.20 118.35 1dvk s ILE 94 Ca 0.20 1.09 -0.10 0.00 0.00 0.00 0.00 60.65 61.84 1dvk s ILE 94 Cb 0.19 -3.70 -0.05 0.00 0.01 0.00 0.00 42.46 38.91 1dvk s ILE 94 CO 0.57 0.02 0.15 -0.63 0.00 0.00 0.00 174.94 175.05 1dvk s ILE 95 N 2.08 5.30 -0.35 2.92 1.01 -1.26 -5.06 121.20 125.84 1dvk s ILE 95 Ca 0.64 0.16 -0.18 0.00 0.00 0.00 0.00 60.65 61.27 1dvk s ILE 95 Cb -0.32 -3.47 -0.00 0.00 0.01 0.00 0.00 42.46 38.68 1dvk s ILE 95 CO 0.27 0.36 0.51 -0.62 0.00 0.00 0.00 174.94 175.46 1dvk s ASP 96 N 0.98 6.31 0.54 3.58 -1.08 -1.26 -4.96 116.67 120.79 1dvk s ASP 96 Ca 0.07 -0.04 0.25 0.00 -0.52 0.00 0.00 52.55 52.30 1dvk s ASP 96 Cb -0.13 -2.27 1.42 0.00 -1.46 0.00 0.00 42.92 40.48 1dvk s ASP 96 CO 0.04 -0.48 2.03 1.55 0.52 0.00 0.00 175.17 178.82 1dvk h PRO 97 N 8.47 0.00 0.00 4.34 0.13 -1.98 -1.46 132.00 141.49 1dvk h PRO 97 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1dvk h PRO 97 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1dvk h PRO 97 CO 0.77 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.20 1dvk h SER 98 N 0.00 0.00 0.57 1.44 4.64 -1.97 -1.68 113.55 116.55 1dvk h SER 98 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1dvk h SER 98 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 1dvk h SER 98 CO -0.00 0.00 -0.40 0.00 -0.87 0.00 0.00 176.83 175.56 1dvk n GLN 99 N -3.06 0.04 -2.36 4.77 1.13 -0.55 -4.75 117.38 112.60 1dvk n GLN 99 Ca -0.02 -0.02 -0.43 0.00 -1.94 0.00 0.00 57.00 54.59 1dvk n GLN 99 Cb 0.14 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 28.97 1dvk n GLN 99 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1dvk s ILE 100 N -2.97 4.17 0.00 5.09 1.01 -0.63 -2.53 121.20 125.33 1dvk s ILE 100 Ca 0.12 1.40 0.00 0.00 0.00 0.00 0.00 60.65 62.17 1dvk s ILE 100 Cb 0.18 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.71 1dvk s ILE 100 CO 0.66 -0.16 0.00 0.61 0.00 0.00 0.00 174.94 176.05 1dvk n GLY 101 N 3.76 1.82 3.67 6.18 0.00 -1.26 -5.07 105.19 114.29 1dvk n GLY 101 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1dvk n GLY 101 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dvk s SER 102 N -0.49 6.57 0.17 1.61 0.15 -1.05 -4.90 113.70 115.75 1dvk s SER 102 Ca 0.00 2.49 -0.10 0.00 0.70 0.00 0.00 55.95 59.03 1dvk s SER 102 Cb 0.00 -2.55 0.05 0.00 -1.71 0.00 0.00 66.02 61.81 1dvk s SER 102 CO 0.00 -0.95 1.62 0.71 1.20 0.00 0.00 173.24 175.82 1dvk h THR 103 N 5.22 1.26 -0.04 6.45 1.35 -1.97 -2.74 112.91 122.44 1dvk h THR 103 Ca -0.44 -1.13 -0.13 0.00 -0.55 0.00 0.00 66.41 64.17 1dvk h THR 103 Cb 1.21 0.88 -0.01 0.00 -1.73 0.00 0.00 68.15 68.49 1dvk h THR 103 CO 0.94 0.40 -0.56 1.05 -0.25 0.00 0.00 175.52 177.10 1dvk h GLU 104 N 0.88 0.12 -0.15 4.72 4.11 -1.97 -2.98 114.58 119.31 1dvk h GLU 104 Ca 0.16 -0.08 0.00 0.00 0.07 0.00 0.00 59.36 59.51 1dvk h GLU 104 Cb 0.55 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1dvk h GLU 104 CO 0.03 0.65 0.00 0.41 0.07 0.00 0.00 179.01 180.17 1dvk n GLY 105 N 0.13 0.07 0.16 1.06 0.00 -1.16 -4.33 105.19 101.12 1dvk n GLY 105 Ca -0.02 -0.36 -0.08 0.00 0.00 0.00 0.00 46.02 45.57 1dvk n GLY 105 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1dvk h LYS 106 N 1.78 0.41 -0.55 1.61 3.64 -1.32 -1.12 116.57 121.01 1dvk h LYS 106 Ca 0.00 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.40 1dvk h LYS 106 Cb 0.39 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.07 1dvk h LYS 106 CO 0.00 0.27 0.29 -1.35 -2.27 0.00 0.00 179.45 176.39 1dvk h PRO 107 N 0.42 0.54 -0.36 1.90 0.11 -1.82 -0.52 132.00 132.27 1dvk h PRO 107 Ca 0.14 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.18 1dvk h PRO 107 Cb 0.00 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 30.98 1dvk h PRO 107 CO -0.06 0.36 0.06 1.25 -0.21 0.00 0.00 178.00 179.39 1dvk h LEU 108 N 0.55 0.56 -0.80 2.35 5.85 -1.81 -2.77 115.31 119.24 1dvk h LEU 108 Ca 0.24 -0.25 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 1dvk h LEU 108 Cb 0.14 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1dvk h LEU 108 CO -0.16 0.67 0.29 0.25 -0.34 0.00 0.00 178.44 179.15 1dvk h LEU 109 N 0.43 1.09 -0.51 2.25 5.85 -0.93 -1.38 115.31 122.11 1dvk h LEU 109 Ca 0.11 -0.18 0.05 0.00 0.84 0.00 0.00 57.88 58.69 1dvk h LEU 109 Cb 0.35 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 1dvk h LEU 109 CO 0.01 0.98 0.25 -1.28 -0.34 0.00 0.00 178.44 178.05 1dvk h SER 110 N 1.14 0.34 -0.05 1.25 0.87 -0.98 -1.37 113.55 114.75 1dvk h SER 110 Ca 0.26 0.03 -0.12 0.00 -1.23 0.00 0.00 61.79 60.73 1dvk h SER 110 Cb 0.25 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 1dvk h SER 110 CO -0.02 0.24 -0.33 -0.03 -0.53 0.00 0.00 176.83 176.16 1dvk h MET 111 N 0.48 0.53 -0.51 2.24 1.85 -1.19 -2.61 114.93 115.72 1dvk h MET 111 Ca 0.23 -0.24 -0.07 0.00 -0.61 0.00 0.00 59.70 59.01 1dvk h MET 111 Cb 0.15 -0.01 -0.02 0.00 0.43 0.00 0.00 31.60 32.15 1dvk h MET 111 CO -0.17 0.79 0.04 0.87 -0.40 0.00 0.00 176.91 178.04 1dvk h LYS 112 N 0.45 0.83 -0.44 0.39 1.57 -0.61 -0.33 116.57 118.43 1dvk h LYS 112 Ca 0.05 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.54 1dvk h LYS 112 Cb 0.79 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.98 1dvk h LYS 112 CO 0.06 0.81 -0.07 0.00 -0.57 0.00 0.00 179.45 179.68 1dvk h ASN 114 N 0.70 0.27 -0.50 0.00 -1.24 -1.05 -1.78 115.58 111.98 1dvk h ASN 114 Ca 0.13 -0.19 -0.03 0.00 0.71 0.00 0.00 56.30 56.91 1dvk h ASN 114 Cb 0.53 -0.07 -0.02 0.00 0.73 0.00 0.00 38.32 39.49 1dvk h ASN 114 CO 0.03 0.39 0.18 -0.07 -1.29 0.00 0.00 177.43 176.67 1dvk h LEU 115 N 0.14 0.71 -0.44 0.34 3.38 -0.76 -2.31 115.31 116.37 1dvk h LEU 115 Ca 0.06 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 1dvk h LEU 115 Cb 0.21 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1dvk h LEU 115 CO -0.00 0.71 -0.07 0.22 0.09 0.00 0.00 178.44 179.38 1dvk h TYR 116 N 0.67 0.92 -0.82 1.13 3.20 -1.08 -0.86 116.97 120.13 1dvk h TYR 116 Ca 0.16 -0.19 0.02 0.00 3.14 0.00 0.00 58.73 61.86 1dvk h TYR 116 Cb 0.24 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.24 1dvk h TYR 116 CO 0.01 0.91 0.54 0.82 -1.64 0.00 0.00 178.16 178.80 1dvk h ILE 117 N 0.65 1.19 -0.46 1.81 2.04 -1.27 0.13 117.51 121.60 1dvk h ILE 117 Ca 0.12 -0.37 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 1dvk h ILE 117 Cb 0.60 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1dvk h ILE 117 CO 0.04 0.20 0.11 0.45 0.00 0.00 0.00 178.15 178.95 1dvk h HIS 118 N 1.09 0.71 -0.31 1.37 3.86 -1.14 -1.86 115.15 118.86 1dvk h HIS 118 Ca 0.31 -0.06 -0.14 0.00 -1.16 0.00 0.00 60.37 59.32 1dvk h HIS 118 Cb -0.09 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.16 1dvk h HIS 118 CO -0.02 0.60 -0.38 1.49 0.86 0.00 0.00 177.93 180.49 1dvk h GLU 119 N 0.67 0.72 -0.35 2.45 4.22 0.32 -1.30 114.58 121.31 1dvk h GLU 119 Ca 0.15 -0.36 -0.07 0.00 0.08 0.00 0.00 59.36 59.16 1dvk h GLU 119 Cb 0.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1dvk h GLU 119 CO -0.00 0.98 -0.04 0.82 -2.18 0.00 0.00 179.01 178.59 1dvk h ILE 120 N 0.59 1.27 -0.46 2.32 2.04 -0.49 -2.12 117.51 120.66 1dvk h ILE 120 Ca 0.05 -1.05 -0.03 0.00 1.00 0.00 0.00 64.86 64.83 1dvk h ILE 120 Cb 0.91 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 38.21 1dvk h ILE 120 CO 0.08 0.35 0.17 -0.07 0.00 0.00 0.00 178.15 178.68 1dvk h LEU 121 N 0.45 0.61 -0.58 1.44 3.38 -1.24 -1.30 115.31 118.07 1dvk h LEU 121 Ca 0.10 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1dvk h LEU 121 Cb 0.52 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1dvk h LEU 121 CO 0.03 0.57 0.23 -1.28 0.09 0.00 0.00 178.44 178.08 1dvk h SER 122 N 0.66 0.80 0.26 -0.43 0.87 -0.95 -0.54 113.55 114.22 1dvk h SER 122 Ca 0.16 -0.17 -0.15 0.00 -1.23 0.00 0.00 61.79 60.40 1dvk h SER 122 Cb 0.16 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 1dvk h SER 122 CO -0.01 0.75 -0.61 0.03 -0.53 0.00 0.00 176.83 176.46 1dvk h ARG 123 N 0.80 0.34 -0.27 2.24 3.08 -0.92 -2.38 114.38 117.27 1dvk h ARG 123 Ca 0.19 -0.24 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 1dvk h ARG 123 Cb 0.20 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1dvk h ARG 123 CO -0.02 0.84 0.11 2.35 -1.07 0.00 0.00 179.97 182.18 1dvk h TRP 124 N 0.26 0.41 -0.74 3.04 2.91 -0.99 -1.62 115.95 119.22 1dvk h TRP 124 Ca -0.01 -0.03 0.13 0.00 1.13 0.00 0.00 58.89 60.11 1dvk h TRP 124 Cb 1.13 -0.12 -0.05 0.00 -0.51 0.00 0.00 29.16 29.60 1dvk h TRP 124 CO 0.03 0.42 0.49 -0.22 -1.03 0.00 0.00 178.44 178.13 1dvk h LYS 125 N 0.28 0.49 0.00 2.65 3.64 -0.98 0.64 116.57 123.29 1dvk h LYS 125 Ca 0.09 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1dvk h LYS 125 Cb 0.19 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1dvk h LYS 125 CO -0.01 0.32 0.00 0.00 -2.27 0.00 0.00 179.45 177.49 1dvk n ALA 126 N -2.50 2.19 -0.53 5.00 0.00 -0.76 -3.20 120.51 120.72 1dvk n ALA 126 Ca 0.13 -0.06 0.06 0.00 0.00 0.00 0.00 53.44 53.57 1dvk n ALA 126 Cb 0.45 -1.44 0.14 0.00 0.00 0.00 0.00 19.45 18.60 1dvk n ALA 126 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1dvk n SER 127 N -1.78 2.83 -0.29 0.00 7.64 0.21 -4.77 113.62 117.45 1dvk n SER 127 Ca 0.06 -2.49 0.12 0.00 1.01 0.00 0.00 58.87 57.57 1dvk n SER 127 Cb 0.34 -0.30 0.28 0.00 -1.01 0.00 0.00 64.21 63.52 1dvk n SER 127 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1dvk h LEU 128 N 1.06 0.12 -2.33 -3.43 3.38 -1.04 0.16 115.31 113.23 1dvk h LEU 128 Ca 0.00 0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1dvk h LEU 128 Cb 0.91 0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 1dvk h LEU 128 CO 0.06 -0.09 -0.03 -0.33 0.09 0.00 0.00 178.44 178.14 1dvk h GLU 129 N 0.28 0.00 0.00 1.13 5.08 -1.88 -3.19 114.58 116.01 1dvk h GLU 129 Ca 0.54 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.90 1dvk h GLU 129 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1dvk h GLU 129 CO -0.59 0.03 -0.55 0.00 -1.00 0.00 0.00 179.01 176.90 1dvk n ALA 130 N -2.16 2.73 -3.72 3.43 0.00 0.39 -4.99 120.51 116.19 1dvk n ALA 130 Ca -0.02 -0.18 -0.23 0.00 0.00 0.00 0.00 53.44 53.01 1dvk n ALA 130 Cb 0.17 -0.24 -0.17 0.00 0.00 0.00 0.00 19.45 19.20 1dvk n ALA 130 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1dvk s TYR 131 N -1.83 0.51 0.00 0.00 5.04 -0.24 -4.98 117.35 115.84 1dvk s TYR 131 Ca 0.01 -0.16 0.00 0.00 -2.44 0.00 0.00 57.07 54.48 1dvk s TYR 131 Cb 0.05 -0.74 0.00 0.00 0.35 0.00 0.00 41.96 41.62 1dvk s TYR 131 CO 0.28 -0.35 0.00 0.72 -1.34 0.00 0.00 175.55 174.86 1dvk n HIS 132 N 5.19 0.00 0.22 4.97 8.25 -1.26 -4.62 115.22 127.97 1dvk n HIS 132 Ca -0.06 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.50 1dvk n HIS 132 Cb 0.50 0.00 0.68 0.00 1.12 0.00 0.00 29.99 32.28 1dvk n HIS 132 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1dvk h PRO 133 N 2.01 0.00 0.00 -0.41 0.13 -1.91 -1.77 132.00 130.05 1dvk h PRO 133 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1dvk h PRO 133 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1dvk h PRO 133 CO 0.00 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 176.92 1dvk n GLU 134 N -4.44 0.05 -0.01 0.86 0.00 -1.26 -3.07 120.64 112.77 1dvk n GLU 134 Ca -0.01 0.21 0.08 0.00 0.00 0.00 0.00 57.16 57.43 1dvk n GLU 134 Cb 0.17 -1.50 -0.11 0.00 0.00 0.00 0.00 31.44 30.00 1dvk n GLU 134 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1dvk n LEU 135 N -1.46 0.20 0.04 -1.84 4.77 -0.67 -4.78 117.00 113.27 1dvk n LEU 135 Ca 0.05 -0.14 -0.03 0.00 -0.03 0.00 0.00 56.01 55.85 1dvk n LEU 135 Cb 0.18 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.25 1dvk n LEU 135 CO 0.14 0.05 0.50 0.15 -1.33 0.00 0.00 177.39 176.91 1dvk h PHE 136 N 0.00 -0.28 -0.89 -1.77 3.57 -1.56 -2.23 116.94 113.78 1dvk h PHE 136 Ca 0.00 0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.74 1dvk h PHE 136 Cb 0.60 0.11 -0.15 0.00 2.79 0.00 0.00 35.95 39.31 1dvk h PHE 136 CO 0.00 -0.13 0.12 1.25 -2.23 0.00 0.00 178.31 177.32 1dvk h LEU 137 N -0.18 -0.24 -0.69 0.59 5.85 -1.86 0.19 115.31 118.96 1dvk h LEU 137 Ca -0.01 0.23 -0.12 0.00 0.84 0.00 0.00 57.88 58.82 1dvk h LEU 137 Cb 0.16 0.36 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 1dvk h LEU 137 CO -0.03 -0.24 -0.24 0.44 -0.34 0.00 0.00 178.44 178.04 1dvk h ASP 138 N 0.11 0.77 -0.20 1.25 3.45 -1.85 -1.62 116.42 118.33 1dvk h ASP 138 Ca 0.54 -0.28 -0.05 0.00 0.43 0.00 0.00 57.03 57.67 1dvk h ASP 138 Cb 1.09 -0.21 -0.01 0.00 -0.56 0.00 0.00 39.33 39.64 1dvk h ASP 138 CO -0.75 0.98 -0.06 0.74 -1.57 0.00 0.00 179.24 178.57 1dvk h THR 139 N 0.66 1.29 -0.06 0.35 2.02 -0.40 -1.61 112.91 115.16 1dvk h THR 139 Ca 0.09 -1.08 0.03 0.00 0.77 0.00 0.00 66.41 66.22 1dvk h THR 139 Cb 0.75 1.60 -0.04 0.00 -1.74 0.00 0.00 68.15 68.72 1dvk h THR 139 CO 0.06 0.32 -0.14 0.50 0.37 0.00 0.00 175.52 176.63 1dvk h LYS 140 N 0.10 -0.20 -0.60 6.66 3.64 -1.01 -2.17 116.57 122.99 1dvk h LYS 140 Ca 0.05 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 1dvk h LYS 140 Cb 0.53 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.36 1dvk h LYS 140 CO 0.02 -0.14 0.22 0.87 -2.27 0.00 0.00 179.45 178.16 1dvk h LYS 141 N -0.21 0.88 0.00 1.90 1.57 -1.28 -1.98 116.57 117.45 1dvk h LYS 141 Ca 0.07 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1dvk h LYS 141 Cb 0.31 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.47 1dvk h LYS 141 CO -0.18 0.73 0.00 0.00 -0.57 0.00 0.00 179.45 179.43 1dvk h ALA 142 N 1.38 1.00 0.00 3.86 0.00 -0.93 -2.97 119.26 121.60 1dvk h ALA 142 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1dvk h ALA 142 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1dvk h ALA 142 CO -0.02 0.00 -0.82 1.28 0.00 0.00 0.00 179.25 179.69 1dvk n LEU 143 N -2.74 0.65 -0.18 0.00 4.32 -0.76 -4.44 117.00 113.85 1dvk n LEU 143 Ca 0.01 0.11 -0.01 0.00 -0.02 0.00 0.00 56.01 56.11 1dvk n LEU 143 Cb 0.29 -0.14 0.09 0.00 -1.62 0.00 0.00 43.42 42.04 1dvk n LEU 143 CO 0.25 -0.01 0.90 -0.26 -1.22 0.00 0.00 177.39 177.05 1dvk h PHE 144 N 0.00 0.15 -0.59 -1.77 -1.00 -1.34 -0.92 116.94 111.46 1dvk h PHE 144 Ca 0.00 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.82 1dvk h PHE 144 Cb 0.74 0.02 -0.03 0.00 3.61 0.00 0.00 35.95 40.29 1dvk h PHE 144 CO 0.00 -0.04 0.39 -1.00 -1.61 0.00 0.00 178.31 176.05 1dvk h PRO 145 N 0.23 0.78 -0.31 1.51 0.13 -1.80 -1.06 132.00 131.47 1dvk h PRO 145 Ca 0.28 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.36 1dvk h PRO 145 Cb 0.41 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.35 1dvk h PRO 145 CO -0.38 0.52 0.16 1.25 -0.23 0.00 0.00 178.00 179.32 1dvk h LEU 146 N 0.80 0.40 -0.82 1.56 5.85 -1.72 -1.61 115.31 119.76 1dvk h LEU 146 Ca 0.22 -0.10 0.08 0.00 0.84 0.00 0.00 57.88 58.91 1dvk h LEU 146 Cb -0.09 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 40.78 1dvk h LEU 146 CO -0.05 0.39 0.48 -0.07 -0.34 0.00 0.00 178.44 178.85 1dvk h LEU 147 N 0.38 0.71 -0.73 2.25 3.38 -0.88 0.54 115.31 120.96 1dvk h LEU 147 Ca 0.11 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 1dvk h LEU 147 Cb 0.08 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1dvk h LEU 147 CO -0.02 0.43 0.12 0.25 0.09 0.00 0.00 178.44 179.31 1dvk h LEU 148 N 0.84 1.04 -0.72 1.67 5.85 -0.89 -0.43 115.31 122.66 1dvk h LEU 148 Ca 0.38 -0.24 -0.07 0.00 0.84 0.00 0.00 57.88 58.80 1dvk h LEU 148 Cb 0.29 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 1dvk h LEU 148 CO -0.22 1.02 0.19 1.56 -0.34 0.00 0.00 178.44 180.65 1dvk h GLN 149 N 1.02 1.15 -0.47 1.25 4.20 -0.22 -1.58 115.11 120.46 1dvk h GLN 149 Ca 0.21 -0.27 -0.09 0.00 0.06 0.00 0.00 58.65 58.56 1dvk h GLN 149 Cb 0.42 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 1dvk h GLN 149 CO 0.01 1.00 -0.05 -0.07 -0.67 0.00 0.00 178.83 179.05 1dvk h LEU 150 N 1.09 0.86 -1.73 1.46 3.38 -0.61 0.21 115.31 119.97 1dvk h LEU 150 Ca 0.23 -0.33 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1dvk h LEU 150 Cb 0.36 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1dvk h LEU 150 CO -0.00 0.99 -0.17 -0.09 0.09 0.00 0.00 178.44 179.26 1dvk h ARG 151 N 0.72 0.00 -0.42 1.13 2.43 -0.83 -2.10 114.38 115.30 1dvk h ARG 151 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1dvk h ARG 151 Cb 0.58 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.13 1dvk h ARG 151 CO 0.03 0.17 0.00 0.54 -1.51 0.00 0.00 179.97 179.20 1dvk n ARG 152 N -4.03 2.43 -3.85 0.20 1.74 -0.62 -4.80 116.66 107.74 1dvk n ARG 152 Ca -0.02 -2.20 -0.25 0.00 -0.77 0.00 0.00 57.85 54.60 1dvk n ARG 152 Cb 0.25 -1.44 0.01 0.00 -1.02 0.00 0.00 32.46 30.26 1dvk n ARG 152 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1dvk n ASN 153 N 1.22 -1.78 -1.14 0.55 4.05 0.13 -4.89 115.26 113.40 1dvk n ASN 153 Ca 0.17 -0.88 0.11 0.00 0.45 0.00 0.00 54.58 54.44 1dvk n ASN 153 Cb 0.54 -3.66 0.22 0.00 1.23 0.00 0.00 39.78 38.11 1dvk n ASN 153 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1dvk n GLN 154 N -4.40 2.50 -2.73 1.20 6.02 0.51 -4.98 117.38 115.49 1dvk n GLN 154 Ca -0.21 -2.30 -0.32 0.00 -0.01 0.00 0.00 57.00 54.15 1dvk n GLN 154 Cb 0.64 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.35 1dvk n GLN 154 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1dvk s LEU 155 N -1.35 3.85 0.39 1.08 2.96 -1.26 -5.03 118.68 119.31 1dvk s LEU 155 Ca 0.39 1.54 -0.25 0.00 -0.22 0.00 0.00 54.13 55.59 1dvk s LEU 155 Cb 0.22 -4.42 -0.09 0.00 0.50 0.00 0.00 46.19 42.40 1dvk s LEU 155 CO 0.30 -0.41 1.07 0.00 -1.32 0.00 0.00 176.35 175.99 1dvk s ALA 156 N -2.31 3.13 0.20 5.97 0.00 -1.26 -4.86 121.76 122.63 1dvk s ALA 156 Ca 0.59 0.75 -0.22 0.00 0.00 0.00 0.00 51.96 53.08 1dvk s ALA 156 Cb -0.10 -3.29 0.13 0.00 0.00 0.00 0.00 23.12 19.87 1dvk s ALA 156 CO 0.21 -0.25 1.55 -1.35 0.00 0.00 0.00 175.76 175.93 1dvk h PRO 157 N 2.67 -0.03 0.00 0.00 0.11 -1.99 -0.17 132.00 132.58 1dvk h PRO 157 Ca -0.48 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.56 1dvk h PRO 157 Cb 1.22 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1dvk h PRO 157 CO 0.63 -0.02 -0.33 -0.44 -0.21 0.00 0.00 178.00 177.63 1dvk h ASP 158 N -0.03 0.00 0.41 -2.05 3.45 -1.98 -1.90 116.42 114.32 1dvk h ASP 158 Ca 0.28 0.00 -0.22 0.00 0.43 0.00 0.00 57.03 57.52 1dvk h ASP 158 Cb 0.54 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.31 1dvk h ASP 158 CO -0.93 0.33 -0.91 0.25 -1.57 0.00 0.00 179.24 176.41 1dvk h LEU 159 N 0.00 0.45 -0.24 1.55 5.85 -1.59 -2.49 115.31 118.84 1dvk h LEU 159 Ca -0.00 -0.36 -0.21 0.00 0.84 0.00 0.00 57.88 58.15 1dvk h LEU 159 Cb 0.86 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 41.76 1dvk h LEU 159 CO 0.04 1.15 -0.78 0.25 -0.34 0.00 0.00 178.44 178.77 1dvk h LEU 160 N 0.20 0.78 -0.58 2.25 5.85 -0.93 -2.47 115.31 120.40 1dvk h LEU 160 Ca -0.07 -0.52 0.00 0.00 0.84 0.00 0.00 57.88 58.14 1dvk h LEU 160 Cb 1.54 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.31 1dvk h LEU 160 CO 0.15 1.30 0.37 0.40 -0.34 0.00 0.00 178.44 180.33 1dvk h ILE 161 N 0.44 1.16 -0.43 4.05 2.04 -1.34 0.57 117.51 124.00 1dvk h ILE 161 Ca -0.05 -0.31 -0.09 0.00 1.00 0.00 0.00 64.86 65.41 1dvk h ILE 161 Cb 1.39 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 1dvk h ILE 161 CO 0.15 0.15 -0.10 0.28 0.00 0.00 0.00 178.15 178.64 1dvk h SER 162 N 0.78 0.82 -0.43 1.72 0.02 -1.43 -1.65 113.55 113.39 1dvk h SER 162 Ca 0.21 -0.36 -0.10 0.00 -0.84 0.00 0.00 61.79 60.71 1dvk h SER 162 Cb -0.07 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.23 1dvk h SER 162 CO -0.04 0.99 -0.10 0.25 -1.14 0.00 0.00 176.83 176.79 1dvk h LEU 163 N 0.64 0.84 -1.05 5.07 5.85 -1.22 -2.32 115.31 123.13 1dvk h LEU 163 Ca 0.11 -0.36 -0.07 0.00 0.84 0.00 0.00 57.88 58.40 1dvk h LEU 163 Cb 0.63 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 1dvk h LEU 163 CO 0.04 1.01 -0.10 0.00 -0.34 0.00 0.00 178.44 179.05 1dvk h ALA 164 N 0.86 1.21 -0.20 1.25 0.00 -0.86 -1.28 119.26 120.24 1dvk h ALA 164 Ca 0.11 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1dvk h ALA 164 Cb 0.64 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1dvk h ALA 164 CO 0.04 0.51 0.06 1.15 0.00 0.00 0.00 179.25 181.02 1dvk h THR 165 N 0.53 1.19 0.19 0.00 2.02 -1.12 0.37 112.91 116.08 1dvk h THR 165 Ca 0.10 -0.59 -0.00 0.00 0.77 0.00 0.00 66.41 66.69 1dvk h THR 165 Cb 0.49 1.20 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 1dvk h THR 165 CO 0.03 0.18 -0.13 0.58 0.37 0.00 0.00 175.52 176.55 1dvk h VAL 166 N 0.15 0.72 -0.68 3.16 2.07 -1.17 -2.14 116.25 118.37 1dvk h VAL 166 Ca 0.06 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.59 1dvk h VAL 166 Cb 0.23 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1dvk h VAL 166 CO -0.00 0.00 0.45 -0.07 0.02 0.00 0.00 177.57 177.97 1dvk h LEU 167 N -0.32 0.78 0.10 2.57 3.38 -1.14 -1.41 115.31 119.27 1dvk h LEU 167 Ca -0.01 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.96 1dvk h LEU 167 Cb 0.28 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1dvk h LEU 167 CO 0.00 0.56 -0.29 0.22 0.09 0.00 0.00 178.44 179.03 1dvk h TYR 168 N 0.92 -0.78 -0.14 1.13 3.20 -0.05 -0.88 116.97 120.37 1dvk h TYR 168 Ca 0.25 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.13 1dvk h TYR 168 Cb -0.10 0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 1dvk h TYR 168 CO -0.03 -0.39 0.04 0.45 -1.64 0.00 0.00 178.16 176.59 1dvk h HIS 169 N -0.49 0.19 0.00 -3.82 3.86 -1.22 -0.46 115.15 113.20 1dvk h HIS 169 Ca 0.04 -0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.19 1dvk h HIS 169 Cb 0.53 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.93 1dvk h HIS 169 CO -0.27 0.17 -0.24 1.25 0.86 0.00 0.00 177.93 179.70 1dvk h LEU 170 N 0.20 0.00 0.00 2.43 5.85 -0.22 -1.82 115.31 121.75 1dvk h LEU 170 Ca 0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1dvk h LEU 170 Cb 0.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1dvk h LEU 170 CO -0.00 0.24 -0.18 0.00 -0.34 0.00 0.00 178.44 178.15 1dvk n GLN 171 N -3.74 0.10 -3.53 1.25 6.02 -0.20 -4.87 117.38 112.41 1dvk n GLN 171 Ca -0.01 0.06 -0.37 0.00 -0.01 0.00 0.00 57.00 56.66 1dvk n GLN 171 Cb 0.35 -1.59 -0.06 0.00 1.02 0.00 0.00 30.24 29.96 1dvk n GLN 171 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1dvk s GLN 172 N -3.04 3.87 0.11 -1.09 -1.52 -0.68 -5.05 119.66 112.26 1dvk s GLN 172 Ca 0.12 0.35 -0.31 0.00 -1.95 0.00 0.00 55.36 53.57 1dvk s GLN 172 Cb 0.16 -3.19 -0.09 0.00 -0.22 0.00 0.00 33.01 29.68 1dvk s GLN 172 CO 0.60 0.68 1.51 -2.14 -0.25 0.00 0.00 175.29 175.70 1dvk s PRO 173 N -1.19 4.25 -1.36 2.91 0.02 -1.26 -3.21 135.00 135.15 1dvk s PRO 173 Ca 0.25 2.23 0.00 0.00 0.02 0.00 0.00 61.00 63.49 1dvk s PRO 173 Cb -0.16 -3.32 0.00 0.00 0.02 0.00 0.00 34.50 31.04 1dvk s PRO 173 CO 0.13 -0.58 0.00 1.63 -0.33 0.00 0.00 177.00 177.86 1dvk n LYS 174 N 4.47 -1.15 -0.81 5.54 5.02 -1.26 -4.91 118.16 125.06 1dvk n LYS 174 Ca 0.13 0.81 0.02 0.00 -2.02 0.00 0.00 58.31 57.25 1dvk n LYS 174 Cb 0.41 -5.09 0.18 0.00 -0.02 0.00 0.00 35.03 30.51 1dvk n LYS 174 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1dvk n GLU 175 N -2.47 1.84 -0.03 1.97 1.02 -1.20 -4.74 120.64 117.03 1dvk n GLU 175 Ca -0.17 -3.41 0.00 0.00 -0.02 0.00 0.00 57.16 53.56 1dvk n GLU 175 Cb 0.60 -1.69 0.30 0.00 -0.02 0.00 0.00 31.44 30.62 1dvk n GLU 175 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1dvk h ILE 176 N 1.24 1.19 0.00 -3.67 6.09 -1.82 -1.57 117.51 118.96 1dvk h ILE 176 Ca 0.05 -0.67 -0.12 0.00 -1.37 0.00 0.00 64.86 62.75 1dvk h ILE 176 Cb 1.08 0.78 -0.02 0.00 0.47 0.00 0.00 36.82 39.14 1dvk h ILE 176 CO 0.10 0.24 -0.56 0.78 -3.07 0.00 0.00 178.15 175.64 1dvk h ASN 177 N 0.59 0.00 0.33 2.19 2.35 -1.96 -1.85 115.58 117.22 1dvk h ASN 177 Ca 0.13 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.72 1dvk h ASN 177 Cb 0.24 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 1dvk h ASN 177 CO -0.00 0.56 -0.68 -0.07 -1.65 0.00 0.00 177.43 175.60 1dvk h LEU 178 N 0.00 0.36 -0.40 1.61 4.07 -1.73 -1.55 115.31 117.68 1dvk h LEU 178 Ca -0.01 -0.23 -0.09 0.00 0.08 0.00 0.00 57.88 57.64 1dvk h LEU 178 Cb 1.03 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.65 1dvk h LEU 178 CO 0.07 0.93 -0.10 0.00 -1.08 0.00 0.00 178.44 178.26 1dvk h ALA 179 N 1.06 0.55 -0.52 1.53 0.00 -1.01 -1.64 119.26 119.23 1dvk h ALA 179 Ca -0.02 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.50 1dvk h ALA 179 Cb 1.22 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1dvk h ALA 179 CO 0.11 0.42 0.05 0.28 0.00 0.00 0.00 179.25 180.11 1dvk h VAL 180 N 0.58 1.26 -0.42 0.00 2.07 -1.28 0.12 116.25 118.58 1dvk h VAL 180 Ca 0.10 -1.00 -0.00 0.00 0.82 0.00 0.00 66.70 66.62 1dvk h VAL 180 Cb 0.63 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1dvk h VAL 180 CO 0.04 0.36 0.26 1.56 0.02 0.00 0.00 177.57 179.81 1dvk h GLN 181 N 0.76 0.56 -0.72 1.57 4.20 -1.21 -0.52 115.11 119.74 1dvk h GLN 181 Ca 0.15 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 1dvk h GLN 181 Cb 0.45 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 1dvk h GLN 181 CO 0.02 0.40 0.28 0.77 -0.67 0.00 0.00 178.83 179.63 1dvk h SER 182 N 0.56 1.01 -0.80 1.46 0.02 -1.10 -2.56 113.55 112.14 1dvk h SER 182 Ca 0.15 -0.18 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1dvk h SER 182 Cb -0.02 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.22 1dvk h SER 182 CO -0.03 0.91 0.47 0.22 -1.14 0.00 0.00 176.83 177.26 1dvk h TYR 183 N 1.04 1.06 -0.16 3.45 3.20 -0.46 -1.76 116.97 123.34 1dvk h TYR 183 Ca 0.24 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.04 1dvk h TYR 183 Cb 0.23 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 1dvk h TYR 183 CO 0.02 0.72 -0.15 0.52 -1.64 0.00 0.00 178.16 177.62 1dvk h MET 184 N 1.09 0.26 0.41 1.82 2.86 -0.81 0.32 114.93 120.88 1dvk h MET 184 Ca 0.28 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.84 1dvk h MET 184 Cb -0.02 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.61 1dvk h MET 184 CO -0.05 0.42 -0.20 0.87 1.06 0.00 0.00 176.91 179.01 1dvk h LYS 185 N 0.24 -0.53 -0.82 1.72 1.57 -0.98 -2.44 116.57 115.34 1dvk h LYS 185 Ca 0.05 0.04 0.13 0.00 -1.87 0.00 0.00 60.65 58.99 1dvk h LYS 185 Cb 0.42 0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.79 1dvk h LYS 185 CO 0.03 -0.23 0.53 1.25 -0.57 0.00 0.00 179.45 180.46 1dvk h LEU 186 N -0.80 0.59 -1.22 2.94 5.85 -1.03 -0.88 115.31 120.76 1dvk h LEU 186 Ca -0.06 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1dvk h LEU 186 Cb 0.54 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 1dvk h LEU 186 CO 0.09 0.32 0.41 -1.28 -0.34 0.00 0.00 178.44 177.64 1dvk h SER 187 N 0.64 0.83 -0.80 1.25 0.87 -0.09 -2.94 113.55 113.31 1dvk h SER 187 Ca 0.40 -0.05 -0.44 0.00 -1.23 0.00 0.00 61.79 60.47 1dvk h SER 187 Cb 0.64 -0.21 -0.25 0.00 -0.44 0.00 0.00 62.40 62.14 1dvk h SER 187 CO -0.16 0.65 0.41 2.30 -0.53 0.00 0.00 176.83 179.50 1dvk n ILE 188 N -4.39 3.04 -1.78 2.23 -5.35 -0.78 -4.93 119.36 107.41 1dvk n ILE 188 Ca 0.07 -2.38 -0.10 0.00 -0.27 0.00 0.00 62.75 60.07 1dvk n ILE 188 Cb 0.08 -0.53 -0.02 0.00 -1.74 0.00 0.00 39.64 37.42 1dvk n ILE 188 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1dvk n GLY 189 N -1.10 0.52 3.45 3.28 0.00 -1.11 -5.00 105.19 105.23 1dvk n GLY 189 Ca 0.52 -0.50 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 1dvk n GLY 189 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dvk s ASN 190 N -2.70 3.85 0.38 1.61 0.02 -0.41 -1.33 114.94 116.36 1dvk s ASN 190 Ca 0.00 -0.30 -0.27 0.00 -1.02 0.00 0.00 52.86 51.27 1dvk s ASN 190 Cb 0.00 -0.71 -0.09 0.00 0.02 0.00 0.00 41.25 40.47 1dvk s ASN 190 CO 0.00 0.31 1.25 -0.69 0.02 0.00 0.00 177.10 178.00 1dvk s VAL 191 N -0.79 2.84 -0.13 1.60 1.01 -0.92 -2.85 120.40 121.16 1dvk s VAL 191 Ca 0.13 0.76 0.03 0.00 0.00 0.00 0.00 61.98 62.89 1dvk s VAL 191 Cb -0.11 -3.45 0.01 0.00 0.00 0.00 0.00 36.38 32.83 1dvk s VAL 191 CO 0.02 0.12 -0.21 0.00 0.00 0.00 0.00 175.10 175.03 1dvk s ALA 192 N -1.27 2.12 0.18 5.51 0.00 -1.26 -4.85 121.76 122.20 1dvk s ALA 192 Ca 0.54 -1.00 0.09 0.00 0.00 0.00 0.00 51.96 51.59 1dvk s ALA 192 Cb -0.36 -0.93 -0.04 0.00 0.00 0.00 0.00 23.12 21.79 1dvk s ALA 192 CO 0.46 0.03 -0.08 -1.58 0.00 0.00 0.00 175.76 174.59 1dvk s TRP 193 N 0.75 2.67 0.45 0.00 0.52 -1.26 -3.79 118.94 118.29 1dvk s TRP 193 Ca -0.09 -0.21 -0.24 0.00 0.02 0.00 0.00 56.10 55.58 1dvk s TRP 193 Cb -0.16 -1.30 -0.09 0.00 -1.15 0.00 0.00 33.47 30.77 1dvk s TRP 193 CO 0.00 0.51 1.19 -0.35 0.02 0.00 0.00 176.95 178.32 1dvk n PRO 194 N 0.03 1.66 -4.00 4.98 -0.04 -1.26 -4.98 135.00 131.38 1dvk n PRO 194 Ca -0.11 0.60 -0.35 0.00 -0.04 0.00 0.00 63.50 63.60 1dvk n PRO 194 Cb 0.55 -2.30 -0.11 0.00 -0.04 0.00 0.00 33.50 31.60 1dvk n PRO 194 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1dvk s ILE 195 N -1.26 4.58 -0.09 0.52 1.01 -1.26 -4.51 121.20 120.19 1dvk s ILE 195 Ca 0.64 -0.10 0.00 0.00 0.00 0.00 0.00 60.65 61.19 1dvk s ILE 195 Cb -0.50 -3.07 0.00 0.00 0.01 0.00 0.00 42.46 38.90 1dvk s ILE 195 CO 0.56 0.43 0.00 0.61 0.00 0.00 0.00 174.94 176.54 1dvk n GLY 196 N 3.86 0.48 3.26 6.18 0.00 -1.26 -5.02 105.19 112.70 1dvk n GLY 196 Ca -0.16 -0.29 -0.10 0.00 0.00 0.00 0.00 46.02 45.46 1dvk n GLY 196 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1dvk s VAL 197 N -1.94 0.05 0.00 1.61 -7.23 -1.26 -5.28 120.40 106.35 1dvk s VAL 197 Ca 0.00 -1.75 0.00 0.00 -1.81 0.00 0.00 61.98 58.42 1dvk s VAL 197 Cb 0.00 -2.14 0.00 0.00 0.56 0.00 0.00 36.38 34.80 1dvk s VAL 197 CO 0.00 -0.24 0.00 0.41 -0.31 0.00 0.00 175.10 174.96 1dvk n THR 198 N -0.21 0.00 0.00 5.32 -1.04 -1.26 -4.92 114.28 112.18 1dvk n THR 198 Ca -0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 1dvk n THR 198 Cb 0.64 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.15 1dvk n THR 198 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1dvk n ALA 218 N 7.74 2.95 -2.81 2.41 0.00 -1.26 -5.09 120.51 124.45 1dvk n ALA 218 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 1dvk n ALA 218 Cb 0.00 0.37 -0.06 0.00 0.00 0.00 0.00 19.45 19.76 1dvk n ALA 218 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1dvk s ASN 219 N -4.94 5.75 -0.02 0.00 0.02 -1.26 -2.16 114.94 112.33 1dvk s ASN 219 Ca 0.00 0.07 -0.02 0.00 -1.02 0.00 0.00 52.86 51.89 1dvk s ASN 219 Cb 0.00 -1.61 0.00 0.00 0.02 0.00 0.00 41.25 39.66 1dvk s ASN 219 CO 0.00 0.17 0.06 -0.51 0.02 0.00 0.00 177.10 176.84 1dvk s ILE 220 N -1.42 0.01 0.05 0.60 1.10 -0.44 -4.78 121.20 116.32 1dvk s ILE 220 Ca 0.31 -0.12 -0.30 0.00 -0.51 0.00 0.00 60.65 60.02 1dvk s ILE 220 Cb -0.12 -0.13 -0.05 0.00 0.15 0.00 0.00 42.46 42.31 1dvk s ILE 220 CO 0.23 -0.07 1.08 -0.32 -2.11 0.00 0.00 174.94 173.76 1dvk s MET 221 N -0.18 4.52 -0.27 3.50 -2.45 -1.26 -4.70 119.30 118.46 1dvk s MET 221 Ca -0.02 1.60 -0.01 0.00 -1.25 0.00 0.00 55.69 56.01 1dvk s MET 221 Cb -0.02 -3.39 0.08 0.00 1.25 0.00 0.00 34.83 32.76 1dvk s MET 221 CO 0.00 -0.11 0.05 0.42 1.05 0.00 0.00 175.02 176.43 1dvk s ILE 222 N 0.84 1.03 0.63 10.11 1.01 -1.26 -5.05 121.20 128.51 1dvk s ILE 222 Ca 0.54 -1.22 0.04 0.00 0.00 0.00 0.00 60.65 60.01 1dvk s ILE 222 Cb -0.26 -1.61 0.12 0.00 0.01 0.00 0.00 42.46 40.72 1dvk s ILE 222 CO 0.29 -0.44 0.87 -0.90 0.00 0.00 0.00 174.94 174.77 1dvk n ASP 223 N 4.82 1.65 -0.28 3.58 5.75 -1.26 -4.83 116.55 125.98 1dvk n ASP 223 Ca -0.05 -2.28 0.07 0.00 -0.01 0.00 0.00 54.79 52.52 1dvk n ASP 223 Cb 0.44 -0.52 0.30 0.00 -1.03 0.00 0.00 41.12 40.31 1dvk n ASP 223 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1dvk h GLU 224 N 0.00 0.85 0.11 0.11 3.07 -2.00 0.20 114.58 116.92 1dvk h GLU 224 Ca -0.29 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.51 1dvk h GLU 224 Cb 1.19 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 28.91 1dvk h GLU 224 CO 0.36 0.56 -0.05 -0.09 -1.40 0.00 0.00 179.01 178.38 1dvk h ARG 225 N 0.87 -0.14 -0.51 2.33 9.65 -2.01 -2.55 114.38 122.03 1dvk h ARG 225 Ca 0.41 0.01 -0.08 0.00 -1.10 0.00 0.00 59.98 59.21 1dvk h ARG 225 Cb 0.41 0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.00 1dvk h ARG 225 CO -0.17 0.03 -0.01 1.15 2.80 0.00 0.00 179.97 183.77 1dvk h THR 226 N -0.29 1.26 -0.83 0.20 2.02 -1.79 -2.88 112.91 110.61 1dvk h THR 226 Ca -0.01 -1.10 0.10 0.00 0.77 0.00 0.00 66.41 66.16 1dvk h THR 226 Cb 0.24 0.97 -0.06 0.00 -1.74 0.00 0.00 68.15 67.56 1dvk h THR 226 CO 0.02 0.39 0.54 -0.09 0.37 0.00 0.00 175.52 176.75 1dvk h ARG 227 N 0.77 0.76 -0.06 6.66 9.65 -0.58 -2.02 114.38 129.56 1dvk h ARG 227 Ca 0.14 -0.05 0.02 0.00 -1.10 0.00 0.00 59.98 58.99 1dvk h ARG 227 Cb 0.54 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.93 1dvk h ARG 227 CO 0.03 0.50 -0.05 -0.07 2.80 0.00 0.00 179.97 183.18 1dvk h LEU 228 N 0.78 -0.14 -0.56 3.80 3.38 -1.23 -2.07 115.31 119.27 1dvk h LEU 228 Ca 0.38 0.03 -0.15 0.00 0.09 0.00 0.00 57.88 58.24 1dvk h LEU 228 Cb 0.44 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1dvk h LEU 228 CO -0.15 -0.07 -0.69 4.11 0.09 0.00 0.00 178.44 181.73 1dvk h TRP 229 N -0.05 0.00 -0.44 1.13 5.08 -1.52 -2.94 115.95 117.21 1dvk h TRP 229 Ca 0.04 0.00 0.02 0.00 1.08 0.00 0.00 58.89 60.04 1dvk h TRP 229 Cb 0.11 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.24 1dvk h TRP 229 CO -0.15 0.69 0.25 0.82 -1.28 0.00 0.00 178.44 178.77 1dvk h ILE 230 N 0.00 1.02 -0.82 0.12 2.04 -1.17 0.11 117.51 118.81 1dvk h ILE 230 Ca -0.01 -0.17 0.01 0.00 1.00 0.00 0.00 64.86 65.70 1dvk h ILE 230 Cb 1.26 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 37.78 1dvk h ILE 230 CO 0.09 0.09 0.54 0.74 0.00 0.00 0.00 178.15 179.61 1dvk h THR 231 N 0.50 1.20 -0.39 -0.27 2.02 -1.30 -2.69 112.91 111.99 1dvk h THR 231 Ca 0.18 -0.38 -0.13 0.00 0.77 0.00 0.00 66.41 66.86 1dvk h THR 231 Cb 0.04 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.44 1dvk h THR 231 CO -0.10 0.20 -0.27 0.28 0.37 0.00 0.00 175.52 176.00 1dvk h SER 232 N 1.10 0.84 -0.67 4.18 0.02 -1.19 -2.90 113.55 114.93 1dvk h SER 232 Ca 0.31 -0.33 0.17 0.00 -0.84 0.00 0.00 61.79 61.10 1dvk h SER 232 Cb -0.10 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.17 1dvk h SER 232 CO -0.07 1.06 0.47 0.40 -1.14 0.00 0.00 176.83 177.54 1dvk h ILE 233 N 0.69 0.72 -0.37 3.27 1.08 -0.45 0.66 117.51 123.12 1dvk h ILE 233 Ca 0.08 -0.05 -0.02 0.00 -0.39 0.00 0.00 64.86 64.48 1dvk h ILE 233 Cb 0.81 0.57 -0.02 0.00 -3.07 0.00 0.00 36.82 35.11 1dvk h ILE 233 CO 0.07 0.03 0.13 0.50 -0.69 0.00 0.00 178.15 178.18 1dvk h LYS 234 N 0.14 0.52 -0.05 2.37 3.64 -1.46 -1.48 116.57 120.25 1dvk h LYS 234 Ca 0.32 -0.07 -0.09 0.00 -1.27 0.00 0.00 60.65 59.55 1dvk h LYS 234 Cb 1.08 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.79 1dvk h LYS 234 CO -0.05 0.45 -0.38 0.00 -2.27 0.00 0.00 179.45 177.20 1dvk h ARG 235 N 0.52 0.10 -0.41 1.90 3.08 -0.99 -1.99 114.38 116.58 1dvk h ARG 235 Ca 0.13 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 59.99 1dvk h ARG 235 Cb 0.14 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1dvk h ARG 235 CO -0.01 0.47 -0.32 -0.07 -1.07 0.00 0.00 179.97 178.96 1dvk h LEU 236 N 0.08 0.98 -0.29 3.04 3.38 -1.25 -1.51 115.31 119.75 1dvk h LEU 236 Ca 0.01 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.56 1dvk h LEU 236 Cb 0.72 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1dvk h LEU 236 CO 0.05 1.21 0.18 0.40 0.09 0.00 0.00 178.44 180.38 1dvk h ILE 237 N 0.78 1.09 -0.20 1.22 2.04 -1.02 -0.58 117.51 120.85 1dvk h ILE 237 Ca 0.08 -0.20 -0.09 0.00 1.00 0.00 0.00 64.86 65.64 1dvk h ILE 237 Cb 0.91 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 1dvk h ILE 237 CO 0.08 0.09 -0.28 0.71 0.00 0.00 0.00 178.15 178.76 1dvk h THR 238 N 0.37 1.27 -0.30 -0.27 1.35 -1.30 -1.33 112.91 112.70 1dvk h THR 238 Ca 0.10 -1.27 -0.04 0.00 -0.55 0.00 0.00 66.41 64.65 1dvk h THR 238 Cb -0.01 1.42 -0.01 0.00 -1.73 0.00 0.00 68.15 67.82 1dvk h THR 238 CO -0.02 0.40 0.03 0.15 -0.25 0.00 0.00 175.52 175.83 1dvk h PHE 239 N 0.35 0.55 -0.65 4.73 3.57 -0.87 -2.08 116.94 122.53 1dvk h PHE 239 Ca 0.05 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 1dvk h PHE 239 Cb 0.67 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 1dvk h PHE 239 CO 0.02 0.62 0.36 0.93 -2.23 0.00 0.00 178.31 178.01 1dvk h GLU 240 N 0.32 0.90 -0.15 1.11 4.39 -0.89 0.22 114.58 120.48 1dvk h GLU 240 Ca 0.09 -0.10 0.04 0.00 0.34 0.00 0.00 59.36 59.73 1dvk h GLU 240 Cb 0.38 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 28.81 1dvk h GLU 240 CO 0.01 0.67 -0.08 1.49 -1.16 0.00 0.00 179.01 179.94 1dvk h GLU 241 N 0.88 -0.07 0.22 2.33 4.81 -1.14 0.18 114.58 121.78 1dvk h GLU 241 Ca 0.23 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 1dvk h GLU 241 Cb 0.03 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1dvk h GLU 241 CO -0.04 -0.05 -0.10 2.35 -0.73 0.00 0.00 179.01 180.44 1dvk h TRP 242 N -0.07 -0.27 -0.54 0.92 7.01 -1.06 -2.05 115.95 119.89 1dvk h TRP 242 Ca 0.09 -0.01 0.10 0.00 2.11 0.00 0.00 58.89 61.18 1dvk h TRP 242 Cb 0.20 0.09 -0.08 0.00 -2.10 0.00 0.00 29.16 27.27 1dvk h TRP 242 CO -0.22 -0.12 0.04 -0.92 -2.79 0.00 0.00 178.44 174.42 1dvk h TYR 243 N -0.35 0.03 -0.32 2.65 3.20 -0.29 -0.26 116.97 121.63 1dvk h TYR 243 Ca -0.03 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 1dvk h TYR 243 Cb 0.27 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 1dvk h TYR 243 CO -0.05 -0.09 0.18 1.15 -1.64 0.00 0.00 178.16 177.71 1dvk h THR 244 N 0.16 1.13 0.00 1.81 2.02 -0.85 -2.65 112.91 114.53 1dvk h THR 244 Ca 0.28 -0.34 -0.06 0.00 0.77 0.00 0.00 66.41 67.05 1dvk h THR 244 Cb 0.42 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.59 1dvk h THR 244 CO -0.42 0.13 -0.30 0.77 0.37 0.00 0.00 175.52 176.07 1dvk h SER 245 N 0.40 0.00 -0.48 4.18 4.64 -0.76 -2.72 113.55 118.80 1dvk h SER 245 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1dvk h SER 245 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1dvk h SER 245 CO -0.02 0.30 0.00 0.59 -0.87 0.00 0.00 176.83 176.84 1dvk n ASN 246 N -3.96 2.88 0.00 4.97 4.13 -0.16 -5.10 115.26 118.01 1dvk n ASN 246 Ca -0.02 -2.09 0.00 0.00 1.68 0.00 0.00 54.58 54.15 1dvk n ASN 246 Cb 0.37 -0.37 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1dvk n ASN 246 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95