#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hup n SER 80 N 0.00 2.32 -4.71 1.67 3.41 -1.26 -4.95 113.62 110.10 3hup n SER 80 Ca 0.00 -1.88 -0.42 0.00 -0.26 0.00 0.00 58.87 56.31 3hup n SER 80 Cb 0.00 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 63.71 3hup n SER 80 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3hup s HIS 81 N -1.57 3.06 -0.18 7.33 5.04 -1.26 -5.03 115.29 122.69 3hup s HIS 81 Ca 0.33 0.81 -0.01 0.00 -1.54 0.00 0.00 55.06 54.65 3hup s HIS 81 Cb 0.18 -3.75 0.00 0.00 0.04 0.00 0.00 32.58 29.05 3hup s HIS 81 CO 0.25 -2.71 -0.14 0.08 -2.34 0.00 0.00 174.74 169.88 3hup s VAL 82 N 1.49 2.70 -0.14 0.89 1.01 -1.26 -5.11 120.40 119.99 3hup s VAL 82 Ca 0.66 -0.74 -0.29 0.00 0.00 0.00 0.00 61.98 61.61 3hup s VAL 82 Cb -0.37 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 3hup s VAL 82 CO 0.30 0.50 1.41 -0.55 0.00 0.00 0.00 175.10 176.75 3hup s SER 83 N 1.10 6.82 -0.17 3.32 0.15 -1.26 -4.98 113.70 118.68 3hup s SER 83 Ca 0.00 1.84 -0.30 0.00 0.70 0.00 0.00 55.95 58.20 3hup s SER 83 Cb -0.14 -2.54 0.12 0.00 -1.71 0.00 0.00 66.02 61.75 3hup s SER 83 CO -0.04 -0.85 0.97 -0.55 1.20 0.00 0.00 173.24 173.97 3hup s SER 84 N 2.55 -0.41 0.80 5.45 0.15 -1.26 -5.12 113.70 115.86 3hup s SER 84 Ca 0.61 0.50 -0.11 0.00 0.70 0.00 0.00 55.95 57.66 3hup s SER 84 Cb -0.25 0.40 0.07 0.00 -1.71 0.00 0.00 66.02 64.54 3hup s SER 84 CO 0.20 -0.34 1.09 0.00 1.20 0.00 0.00 173.24 175.39 3hup s SER 86 N -3.38 3.98 0.03 0.00 0.01 -1.26 -4.90 113.70 108.17 3hup s SER 86 Ca 0.62 0.85 -0.38 0.00 1.31 0.00 0.00 55.95 58.34 3hup s SER 86 Cb -0.17 -1.36 -0.18 0.00 0.21 0.00 0.00 66.02 64.51 3hup s SER 86 CO 0.56 -2.25 1.25 1.21 0.41 0.00 0.00 173.24 174.42 3hup n GLU 87 N -3.55 0.65 -0.95 12.44 4.07 -1.26 -1.49 120.64 130.56 3hup n GLU 87 Ca 0.08 0.24 0.00 0.00 -0.06 0.00 0.00 57.16 57.41 3hup n GLU 87 Cb 0.60 -1.82 0.00 0.00 -0.06 0.00 0.00 31.44 30.16 3hup n GLU 87 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 3hup n ASP 88 N 2.22 -2.36 -4.69 4.31 8.00 -1.26 -5.02 116.55 117.75 3hup n ASP 88 Ca 0.20 0.00 -0.25 0.00 0.71 0.00 0.00 54.79 55.44 3hup n ASP 88 Cb 0.14 -1.04 -0.07 0.00 -0.02 0.00 0.00 41.12 40.13 3hup n ASP 88 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 3hup s TRP 89 N -2.30 2.87 -0.13 1.24 0.52 -0.55 -4.78 118.94 115.81 3hup s TRP 89 Ca 0.00 -0.14 0.01 0.00 0.02 0.00 0.00 56.10 55.99 3hup s TRP 89 Cb 0.00 -1.35 -0.00 0.00 -1.15 0.00 0.00 33.47 30.96 3hup s TRP 89 CO 0.00 0.54 -0.18 0.08 0.02 0.00 0.00 176.95 177.41 3hup s VAL 90 N -1.91 2.53 -0.19 4.03 1.01 0.10 -4.70 120.40 121.28 3hup s VAL 90 Ca 0.29 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 61.31 3hup s VAL 90 Cb -0.09 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 3hup s VAL 90 CO 0.20 0.53 0.23 -0.83 0.00 0.00 0.00 175.10 175.23 3hup s GLY 91 N 0.55 2.12 -0.23 4.51 0.00 -1.26 0.24 107.32 113.25 3hup s GLY 91 Ca -0.11 -0.58 -0.13 0.00 0.00 0.00 0.00 44.72 43.90 3hup s GLY 91 CO 0.04 0.35 0.56 -0.47 0.00 0.00 0.00 173.10 173.58 3hup s TYR 92 N 0.55 -0.88 -1.40 1.90 5.04 -0.26 -4.97 117.35 117.33 3hup s TYR 92 Ca 0.13 1.77 -0.04 0.00 -2.44 0.00 0.00 57.07 56.49 3hup s TYR 92 Cb -0.12 0.48 0.03 0.00 0.35 0.00 0.00 41.96 42.69 3hup s TYR 92 CO 0.02 -0.46 0.73 1.04 -1.34 0.00 0.00 175.55 175.55 3hup n GLN 93 N 4.39 -4.77 -1.37 4.97 1.13 -1.26 -1.61 117.38 118.86 3hup n GLN 93 Ca -0.21 0.57 -0.13 0.00 -1.94 0.00 0.00 57.00 55.30 3hup n GLN 93 Cb 0.57 -5.16 -0.06 0.00 0.11 0.00 0.00 30.24 25.70 3hup n GLN 93 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3hup n ARG 94 N -4.41 -1.24 -4.39 -1.09 1.74 -1.26 -4.99 116.66 101.02 3hup n ARG 94 Ca -0.20 0.93 -0.25 0.00 -0.77 0.00 0.00 57.85 57.56 3hup n ARG 94 Cb 0.63 -5.12 -0.11 0.00 -1.02 0.00 0.00 32.46 26.84 3hup n ARG 94 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3hup s LYS 95 N -2.99 1.42 -0.12 5.56 1.02 -0.64 -1.68 119.74 122.32 3hup s LYS 95 Ca 0.00 -1.49 -0.01 0.00 0.02 0.00 0.00 55.97 54.50 3hup s LYS 95 Cb 0.00 -1.62 -0.02 0.00 -0.52 0.00 0.00 37.83 35.66 3hup s LYS 95 CO 0.00 0.34 -0.08 0.00 -0.92 0.00 0.00 175.35 174.69 3hup s TYR 97 N -0.06 2.56 -0.03 0.00 1.51 0.14 -1.30 117.35 120.16 3hup s TYR 97 Ca -0.00 -0.25 0.01 0.00 -1.01 0.00 0.00 57.07 55.82 3hup s TYR 97 Cb -0.13 -1.40 0.01 0.00 -0.11 0.00 0.00 41.96 40.33 3hup s TYR 97 CO 0.03 0.33 -0.04 0.12 -1.11 0.00 0.00 175.55 174.89 3hup s PHE 98 N -1.06 0.57 -0.14 2.71 5.36 -0.36 -0.72 117.98 124.34 3hup s PHE 98 Ca 0.17 -0.12 -0.02 0.00 -0.96 0.00 0.00 56.93 55.99 3hup s PHE 98 Cb -0.11 -0.50 -0.02 0.00 -0.34 0.00 0.00 43.02 42.06 3hup s PHE 98 CO 0.08 -0.12 -0.08 -1.50 -1.46 0.00 0.00 175.22 172.15 3hup s ILE 99 N 0.59 3.51 0.67 3.12 2.07 -1.26 -0.35 121.20 129.56 3hup s ILE 99 Ca -0.07 -0.50 -0.13 0.00 -1.41 0.00 0.00 60.65 58.55 3hup s ILE 99 Cb -0.10 -2.51 -0.00 0.00 0.13 0.00 0.00 42.46 39.97 3hup s ILE 99 CO -0.00 0.51 1.07 -0.94 -1.91 0.00 0.00 174.94 173.66 3hup s SER 100 N 0.32 5.37 0.00 4.50 1.04 -0.17 -4.97 113.70 119.78 3hup s SER 100 Ca -0.07 1.74 0.13 0.00 0.48 0.00 0.00 55.95 58.23 3hup s SER 100 Cb -0.15 -2.52 0.12 0.00 0.10 0.00 0.00 66.02 63.57 3hup s SER 100 CO 0.04 -1.45 0.93 0.35 0.98 0.00 0.00 173.24 174.09 3hup n THR 101 N -2.77 0.07 -4.14 2.02 -2.24 -1.26 -4.74 114.28 101.22 3hup n THR 101 Ca 0.08 -0.53 -0.10 0.00 -2.27 0.00 0.00 64.05 61.22 3hup n THR 101 Cb 0.53 1.21 -0.10 0.00 -2.10 0.00 0.00 70.33 69.87 3hup n THR 101 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3hup s VAL 102 N -1.06 0.60 -0.15 2.28 -7.23 -1.26 -5.12 120.40 108.45 3hup s VAL 102 Ca 0.16 -1.76 -0.12 0.00 -1.81 0.00 0.00 61.98 58.45 3hup s VAL 102 Cb 0.11 -1.46 -0.05 0.00 0.56 0.00 0.00 36.38 35.54 3hup s VAL 102 CO 0.16 -0.80 0.23 -0.54 -0.31 0.00 0.00 175.10 173.84 3hup s LYS 103 N -3.43 4.10 0.22 4.82 1.02 -1.26 -4.28 119.74 120.93 3hup s LYS 103 Ca 0.07 -0.00 -0.06 0.00 0.02 0.00 0.00 55.97 56.00 3hup s LYS 103 Cb 0.03 -3.38 -0.02 0.00 -0.52 0.00 0.00 37.83 33.94 3hup s LYS 103 CO -0.05 0.37 0.29 1.03 -0.92 0.00 0.00 175.35 176.07 3hup s ARG 104 N 0.11 1.36 0.97 1.68 1.81 -0.30 -4.62 118.95 119.95 3hup s ARG 104 Ca 0.14 -1.46 -0.11 0.00 -1.72 0.00 0.00 55.73 52.58 3hup s ARG 104 Cb -0.13 0.36 0.17 0.00 -0.45 0.00 0.00 34.95 34.91 3hup s ARG 104 CO 0.03 -0.50 1.09 -1.54 -0.68 0.00 0.00 175.30 173.70 3hup s SER 105 N -3.10 2.66 0.20 0.23 1.04 -1.25 -1.45 113.70 112.03 3hup s SER 105 Ca 0.31 1.78 -0.11 0.00 0.48 0.00 0.00 55.95 58.41 3hup s SER 105 Cb 0.04 -2.38 0.14 0.00 0.10 0.00 0.00 66.02 63.91 3hup s SER 105 CO 0.11 -3.20 1.86 -0.25 0.98 0.00 0.00 173.24 172.74 3hup h TRP 106 N -1.93 0.84 -0.36 5.02 7.01 -1.25 0.03 115.95 125.30 3hup h TRP 106 Ca -0.50 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 60.48 3hup h TRP 106 Cb 1.29 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 28.05 3hup h TRP 106 CO 0.42 0.51 0.07 1.15 -2.79 0.00 0.00 178.44 177.80 3hup h THR 107 N 0.90 1.23 -0.74 2.65 2.02 -1.92 0.06 112.91 117.11 3hup h THR 107 Ca 0.26 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.60 3hup h THR 107 Cb -0.07 1.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.38 3hup h THR 107 CO -0.07 0.28 0.42 0.28 0.37 0.00 0.00 175.52 176.80 3hup h SER 108 N 0.44 0.92 -0.27 4.18 0.02 -1.86 -0.69 113.55 116.29 3hup h SER 108 Ca 0.11 -0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3hup h SER 108 Cb 0.35 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 3hup h SER 108 CO 0.01 0.74 0.16 0.00 -1.14 0.00 0.00 176.83 176.59 3hup h ALA 109 N 1.22 0.34 -0.72 3.77 0.00 -0.70 0.43 119.26 123.60 3hup h ALA 109 Ca 0.26 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.19 3hup h ALA 109 Cb 0.01 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 3hup h ALA 109 CO -0.04 -0.16 0.42 0.37 0.00 0.00 0.00 179.25 179.83 3hup h GLN 110 N 0.34 0.74 -0.71 0.00 5.75 -0.72 -0.53 115.11 119.98 3hup h GLN 110 Ca 0.10 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.55 3hup h GLN 110 Cb 0.01 -0.17 -0.03 0.00 1.07 0.00 0.00 27.48 28.36 3hup h GLN 110 CO -0.02 0.49 0.43 -0.91 -2.65 0.00 0.00 178.83 176.17 3hup h ASN 111 N 0.77 0.86 -0.76 -0.69 2.35 -0.60 -0.70 115.58 116.81 3hup h ASN 111 Ca 0.32 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.98 3hup h ASN 111 Cb 0.18 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.29 3hup h ASN 111 CO -0.18 0.67 0.38 0.00 -1.65 0.00 0.00 177.43 176.65 3hup h ALA 112 N 1.23 0.98 -0.52 -0.83 0.00 -0.22 -1.72 119.26 118.18 3hup h ALA 112 Ca 0.26 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3hup h ALA 112 Cb -0.03 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 3hup h ALA 112 CO -0.05 0.53 0.09 0.00 0.00 0.00 0.00 179.25 179.82 3hup h SER 114 N 0.74 0.14 0.08 0.00 4.64 -0.78 -0.35 113.55 118.02 3hup h SER 114 Ca 0.16 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3hup h SER 114 Cb 0.39 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.45 3hup h SER 114 CO 0.01 0.34 -0.00 -0.33 -0.87 0.00 0.00 176.83 175.98 3hup h GLU 115 N 0.13 0.00 -0.09 4.77 5.08 -1.14 -1.94 114.58 121.39 3hup h GLU 115 Ca 0.03 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 3hup h GLU 115 Cb 0.43 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 3hup h GLU 115 CO 0.03 0.00 -0.30 0.72 -1.00 0.00 0.00 179.01 178.46 3hup n HIS 116 N -3.19 0.27 -1.49 4.33 8.25 -0.35 -4.96 115.22 118.09 3hup n HIS 116 Ca -0.03 -1.41 -0.11 0.00 -0.26 0.00 0.00 57.72 55.92 3hup n HIS 116 Cb 0.09 -0.29 -0.04 0.00 1.12 0.00 0.00 29.99 30.88 3hup n HIS 116 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hup n GLY 117 N -1.15 0.96 3.67 -1.41 0.00 -0.73 -5.00 105.19 101.53 3hup n GLY 117 Ca 0.22 -0.51 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 3hup n GLY 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hup s ALA 118 N -2.43 3.73 0.29 4.61 0.00 -0.29 -4.89 121.76 122.79 3hup s ALA 118 Ca 0.00 -0.51 0.04 0.00 0.00 0.00 0.00 51.96 51.49 3hup s ALA 118 Cb 0.00 0.35 -0.06 0.00 0.00 0.00 0.00 23.12 23.41 3hup s ALA 118 CO 0.00 -0.16 0.04 0.95 0.00 0.00 0.00 175.76 176.59 3hup s THR 119 N -3.02 1.11 0.44 0.00 -4.23 -0.98 -2.67 115.64 106.29 3hup s THR 119 Ca 0.10 -2.02 -0.23 0.00 -1.18 0.00 0.00 61.69 58.36 3hup s THR 119 Cb 0.01 -2.65 -0.10 0.00 1.34 0.00 0.00 72.50 71.09 3hup s THR 119 CO 0.07 -0.10 0.95 0.18 -0.54 0.00 0.00 174.62 175.18 3hup n LEU 120 N -0.59 2.39 -4.68 4.79 4.77 -1.26 -1.18 117.00 121.24 3hup n LEU 120 Ca -0.03 1.00 -0.45 0.00 -0.03 0.00 0.00 56.01 56.50 3hup n LEU 120 Cb 0.66 -1.33 -0.04 0.00 -2.33 0.00 0.00 43.42 40.38 3hup n LEU 120 CO 0.40 -1.69 1.19 0.00 -1.33 0.00 0.00 177.39 175.96 3hup n ALA 121 N -0.66 1.58 -2.80 -1.18 0.00 0.55 -3.59 120.51 114.41 3hup n ALA 121 Ca 0.10 0.43 -0.33 0.00 0.00 0.00 0.00 53.44 53.64 3hup n ALA 121 Cb 0.40 -2.37 -0.07 0.00 0.00 0.00 0.00 19.45 17.42 3hup n ALA 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3hup s VAL 122 N 0.73 4.87 -0.27 0.00 -7.23 -1.26 -0.12 120.40 117.12 3hup s VAL 122 Ca 0.76 -0.32 0.01 0.00 -1.81 0.00 0.00 61.98 60.61 3hup s VAL 122 Cb -0.64 -3.22 0.05 0.00 0.56 0.00 0.00 36.38 33.13 3hup s VAL 122 CO 0.40 0.37 -0.08 -0.63 -0.31 0.00 0.00 175.10 174.85 3hup s ILE 123 N -1.19 2.48 -0.97 -0.62 1.01 -1.26 -4.98 121.20 115.67 3hup s ILE 123 Ca 0.23 -1.47 0.22 0.00 0.00 0.00 0.00 60.65 59.62 3hup s ILE 123 Cb -0.12 -2.41 -0.19 0.00 0.01 0.00 0.00 42.46 39.74 3hup s ILE 123 CO 0.14 -0.01 0.97 0.47 0.00 0.00 0.00 174.94 176.51 3hup n ASP 124 N 4.52 0.89 -3.75 3.58 8.00 -1.26 -5.00 116.55 123.54 3hup n ASP 124 Ca -0.14 -0.85 -0.09 0.00 0.71 0.00 0.00 54.79 54.42 3hup n ASP 124 Cb 0.43 0.91 -0.03 0.00 -0.02 0.00 0.00 41.12 42.41 3hup n ASP 124 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3hup s SER 125 N -3.05 -0.32 0.32 -2.24 1.04 -1.26 -5.00 113.70 103.20 3hup s SER 125 Ca 0.08 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.04 3hup s SER 125 Cb 0.16 0.66 0.54 0.00 0.10 0.00 0.00 66.02 67.48 3hup s SER 125 CO 0.84 -1.19 1.97 -0.08 0.98 0.00 0.00 173.24 175.76 3hup h GLU 126 N 2.06 0.90 -0.16 4.02 4.57 -1.98 0.18 114.58 124.17 3hup h GLU 126 Ca -0.25 -0.08 0.01 0.00 -1.18 0.00 0.00 59.36 57.87 3hup h GLU 126 Cb 1.27 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 29.65 3hup h GLU 126 CO 0.30 0.63 0.07 0.87 -1.18 0.00 0.00 179.01 179.70 3hup h LYS 127 N 0.92 0.15 -0.42 1.92 1.57 -1.99 0.18 116.57 118.90 3hup h LYS 127 Ca 0.24 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.05 3hup h LYS 127 Cb -0.03 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.20 3hup h LYS 127 CO -0.05 0.10 0.18 -0.44 -0.57 0.00 0.00 179.45 178.67 3hup h ASP 128 N 0.16 0.22 -0.34 0.86 3.32 -1.80 -0.05 116.42 118.80 3hup h ASP 128 Ca 0.06 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 3hup h ASP 128 Cb 0.02 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 3hup h ASP 128 CO -0.05 0.17 0.20 -0.03 -1.72 0.00 0.00 179.24 177.81 3hup h MET 129 N 0.36 0.46 -0.77 3.56 4.05 -0.54 0.49 114.93 122.54 3hup h MET 129 Ca 0.19 -0.04 -0.04 0.00 -0.28 0.00 0.00 59.70 59.53 3hup h MET 129 Cb 0.14 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 30.81 3hup h MET 129 CO -0.17 0.35 0.33 -0.91 0.23 0.00 0.00 176.91 176.74 3hup h ASN 130 N 0.44 1.05 -0.18 1.39 2.35 -0.36 -1.46 115.58 118.80 3hup h ASN 130 Ca 0.12 -0.16 -0.02 0.00 -0.55 0.00 0.00 56.30 55.69 3hup h ASN 130 Cb 0.01 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.10 3hup h ASN 130 CO -0.02 0.92 0.04 0.15 -1.65 0.00 0.00 177.43 176.87 3hup h PHE 131 N 1.11 0.31 -0.28 1.19 3.57 -0.68 -2.71 116.94 119.43 3hup h PHE 131 Ca 0.26 -0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.73 3hup h PHE 131 Cb 0.19 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 3hup h PHE 131 CO 0.02 0.43 0.18 -0.07 -2.23 0.00 0.00 178.31 176.63 3hup h LEU 132 N 0.10 0.30 -0.61 0.59 3.38 -0.68 0.91 115.31 119.30 3hup h LEU 132 Ca 0.06 -0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.07 3hup h LEU 132 Cb 0.28 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 3hup h LEU 132 CO 0.00 0.22 0.34 0.11 0.09 0.00 0.00 178.44 179.20 3hup h LYS 133 N 0.37 0.62 -0.18 1.13 1.57 -1.28 0.16 116.57 118.96 3hup h LYS 133 Ca 0.11 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 3hup h LYS 133 Cb -0.03 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 3hup h LYS 133 CO -0.03 0.41 -0.07 0.00 -0.57 0.00 0.00 179.45 179.19 3hup h ARG 134 N 0.64 0.37 -0.73 3.15 3.08 -1.16 -2.97 114.38 116.77 3hup h ARG 134 Ca 0.27 -0.15 0.03 0.00 0.07 0.00 0.00 59.98 60.20 3hup h ARG 134 Cb 0.14 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.13 3hup h ARG 134 CO -0.16 0.65 0.48 -0.92 -1.07 0.00 0.00 179.97 178.95 3hup h TYR 135 N 0.07 0.85 -0.80 3.04 3.20 -0.55 -2.53 116.97 120.26 3hup h TYR 135 Ca 0.04 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 3hup h TYR 135 Cb 0.53 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.48 3hup h TYR 135 CO 0.06 0.50 0.41 0.00 -1.64 0.00 0.00 178.16 177.49 3hup h ALA 136 N 1.57 1.22 -0.30 1.82 0.00 -0.58 -3.49 119.26 119.51 3hup h ALA 136 Ca 0.29 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hup h ALA 136 Cb 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.51 3hup h ALA 136 CO -0.08 0.61 0.00 0.41 0.00 0.00 0.00 179.25 180.19 3hup n GLY 137 N -1.11 -0.20 0.07 0.00 0.00 -0.95 -4.15 105.19 98.83 3hup n GLY 137 Ca 0.08 -1.02 0.13 0.00 0.00 0.00 0.00 46.02 45.21 3hup n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hup n ARG 138 N 0.00 0.19 -3.85 1.61 1.74 -1.26 -0.69 116.66 114.40 3hup n ARG 138 Ca 0.00 0.13 -0.31 0.00 -0.77 0.00 0.00 57.85 56.90 3hup n ARG 138 Cb 0.00 -1.69 -0.04 0.00 -1.02 0.00 0.00 32.46 29.70 3hup n ARG 138 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3hup s GLU 139 N -3.08 3.49 0.21 5.56 2.02 -1.26 -4.82 118.70 120.82 3hup s GLU 139 Ca 0.11 -0.34 -0.31 0.00 0.02 0.00 0.00 54.97 54.46 3hup s GLU 139 Cb 0.14 -2.98 -0.10 0.00 0.10 0.00 0.00 34.13 31.29 3hup s GLU 139 CO 0.60 0.57 1.52 -1.21 0.02 0.00 0.00 175.26 176.76 3hup s GLU 140 N -2.56 4.23 -0.10 1.61 8.01 -1.26 -4.56 118.70 124.08 3hup s GLU 140 Ca 0.37 2.36 0.01 0.00 0.01 0.00 0.00 54.97 57.71 3hup s GLU 140 Cb -0.13 -3.12 0.02 0.00 -4.31 0.00 0.00 34.13 26.59 3hup s GLU 140 CO 0.27 -0.53 -0.09 -1.01 0.01 0.00 0.00 175.26 173.90 3hup s HIS 141 N 0.57 1.48 0.37 1.61 3.76 -0.13 -3.30 115.29 119.64 3hup s HIS 141 Ca 0.65 -0.67 -0.27 0.00 -0.15 0.00 0.00 55.06 54.62 3hup s HIS 141 Cb -0.43 -1.17 -0.11 0.00 1.11 0.00 0.00 32.58 31.97 3hup s HIS 141 CO 0.38 -0.43 1.28 0.91 -0.85 0.00 0.00 174.74 176.03 3hup n TRP 142 N 4.51 2.23 -4.48 1.40 5.03 0.47 -0.92 117.44 125.67 3hup n TRP 142 Ca -0.17 0.53 -0.24 0.00 3.03 0.00 0.00 57.50 60.65 3hup n TRP 142 Cb 0.51 -2.40 -0.08 0.00 -1.03 0.00 0.00 31.31 28.30 3hup n TRP 142 CO 0.00 0.00 0.00 0.14 -0.03 0.00 0.00 177.69 177.80 3hup s VAL 143 N -1.14 0.62 -1.19 -0.99 -7.23 -0.62 -2.04 120.40 107.80 3hup s VAL 143 Ca 0.57 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.69 3hup s VAL 143 Cb -0.54 -2.41 0.09 0.00 0.56 0.00 0.00 36.38 34.07 3hup s VAL 143 CO 0.61 0.00 2.50 0.61 -0.31 0.00 0.00 175.10 178.51 3hup n GLY 144 N -0.85 4.99 2.79 2.32 0.00 0.82 -4.54 105.19 110.72 3hup n GLY 144 Ca -0.05 -1.98 -0.18 0.00 0.00 0.00 0.00 46.02 43.82 3hup n GLY 144 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hup s LEU 145 N -1.95 0.94 -0.03 0.99 2.96 -1.26 -1.02 118.68 119.31 3hup s LEU 145 Ca 0.56 -0.01 -0.12 0.00 -0.22 0.00 0.00 54.13 54.34 3hup s LEU 145 Cb 0.22 -0.22 0.02 0.00 0.50 0.00 0.00 46.19 46.71 3hup s LEU 145 CO -0.11 -0.14 0.27 -0.75 -1.32 0.00 0.00 176.35 174.30 3hup s LYS 146 N 1.30 0.56 -0.17 1.98 2.20 -1.10 -2.40 119.74 122.11 3hup s LYS 146 Ca -0.06 -0.10 0.01 0.00 -0.36 0.00 0.00 55.97 55.46 3hup s LYS 146 Cb -0.13 0.25 0.01 0.00 -1.51 0.00 0.00 37.83 36.45 3hup s LYS 146 CO -0.02 -0.14 -0.18 0.21 -0.36 0.00 0.00 175.35 174.86 3hup s LYS 147 N -1.00 3.09 -0.07 4.03 2.47 -0.58 -2.38 119.74 125.30 3hup s LYS 147 Ca -0.11 -0.79 -0.03 0.00 -1.56 0.00 0.00 55.97 53.48 3hup s LYS 147 Cb -0.05 -2.60 -0.04 0.00 -1.46 0.00 0.00 37.83 33.68 3hup s LYS 147 CO 0.03 -0.12 0.06 -1.21 0.16 0.00 0.00 175.35 174.27 3hup s GLU 148 N 1.10 3.12 0.26 4.03 0.41 -1.26 -4.80 118.70 121.56 3hup s GLU 148 Ca 0.00 -0.36 -0.30 0.00 -0.41 0.00 0.00 54.97 53.90 3hup s GLU 148 Cb -0.14 -2.91 -0.13 0.00 -1.78 0.00 0.00 34.13 29.16 3hup s GLU 148 CO -0.07 0.71 1.33 -2.30 -0.49 0.00 0.00 175.26 174.44 3hup n PRO 149 N 1.81 1.94 -0.93 0.39 -0.02 -1.26 -1.64 135.00 135.29 3hup n PRO 149 Ca -0.17 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 3hup n PRO 149 Cb 0.54 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 3hup n PRO 149 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hup n GLY 150 N 1.75 1.08 3.29 -1.23 0.00 -1.26 -5.00 105.19 103.82 3hup n GLY 150 Ca 0.10 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.92 3hup n GLY 150 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hup s HIS 151 N -3.91 1.62 0.89 1.61 3.76 -0.65 -5.14 115.29 113.46 3hup s HIS 151 Ca 0.00 -0.52 -0.12 0.00 -0.15 0.00 0.00 55.06 54.27 3hup s HIS 151 Cb 0.00 -0.82 0.12 0.00 1.11 0.00 0.00 32.58 32.99 3hup s HIS 151 CO 0.00 0.25 1.11 -1.25 -0.85 0.00 0.00 174.74 174.00 3hup s PRO 152 N -2.84 1.36 0.26 8.40 0.04 -1.26 -4.45 135.00 136.50 3hup s PRO 152 Ca 0.13 0.53 -0.31 0.00 0.04 0.00 0.00 61.00 61.40 3hup s PRO 152 Cb -0.05 -1.84 -0.13 0.00 0.04 0.00 0.00 34.50 32.52 3hup s PRO 152 CO 0.05 -2.10 1.37 0.91 0.04 0.00 0.00 177.00 177.27 3hup n TRP 153 N -3.74 2.14 -4.07 0.56 7.02 -1.26 -4.51 117.44 113.58 3hup n TRP 153 Ca 0.07 0.46 -0.15 0.00 -1.02 0.00 0.00 57.50 56.85 3hup n TRP 153 Cb 0.57 -2.44 -0.15 0.00 -2.42 0.00 0.00 31.31 26.87 3hup n TRP 153 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 3hup s LYS 154 N -0.67 0.35 0.66 -0.99 1.02 -1.00 -1.47 119.74 117.64 3hup s LYS 154 Ca 0.66 -0.11 -0.14 0.00 0.02 0.00 0.00 55.97 56.40 3hup s LYS 154 Cb -0.64 -0.36 -0.00 0.00 -0.52 0.00 0.00 37.83 36.30 3hup s LYS 154 CO 0.52 0.04 1.08 -1.58 -0.92 0.00 0.00 175.35 174.49 3hup s TRP 155 N 0.12 2.82 -1.33 3.18 0.52 -0.05 -2.72 118.94 121.49 3hup s TRP 155 Ca -0.01 1.52 0.13 0.00 0.02 0.00 0.00 56.10 57.76 3hup s TRP 155 Cb -0.04 -3.05 0.65 0.00 -1.15 0.00 0.00 33.47 29.89 3hup s TRP 155 CO -0.00 -1.43 1.37 0.43 0.02 0.00 0.00 176.95 177.33 3hup n SER 156 N -2.58 0.00 -0.92 2.95 7.64 -0.19 -1.97 113.62 118.56 3hup n SER 156 Ca 0.09 0.19 0.12 0.00 1.01 0.00 0.00 58.87 60.28 3hup n SER 156 Cb 0.53 -0.34 0.26 0.00 -1.01 0.00 0.00 64.21 63.65 3hup n SER 156 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3hup n ASN 157 N -1.34 2.77 0.00 6.43 0.23 -1.26 -4.94 115.26 117.15 3hup n ASN 157 Ca 0.06 -1.89 0.00 0.00 -0.53 0.00 0.00 54.58 52.22 3hup n ASN 157 Cb 0.12 -0.17 0.00 0.00 -2.08 0.00 0.00 39.78 37.65 3hup n ASN 157 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3hup n GLY 158 N 1.36 0.55 3.73 4.83 0.00 -0.83 -5.06 105.19 109.76 3hup n GLY 158 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3hup n GLY 158 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hup s LYS 159 N -0.84 4.56 0.34 1.61 2.20 -1.26 -4.85 119.74 121.50 3hup s LYS 159 Ca 0.00 1.64 -0.27 0.00 -0.36 0.00 0.00 55.97 56.97 3hup s LYS 159 Cb 0.00 -3.34 -0.09 0.00 -1.51 0.00 0.00 37.83 32.88 3hup s LYS 159 CO 0.00 -0.01 1.15 -2.00 -0.36 0.00 0.00 175.35 174.12 3hup s GLU 160 N 0.31 4.36 -0.08 4.03 2.12 -1.26 -0.87 118.70 127.31 3hup s GLU 160 Ca 0.52 1.84 -0.29 0.00 0.36 0.00 0.00 54.97 57.40 3hup s GLU 160 Cb -0.27 -2.93 -0.02 0.00 0.26 0.00 0.00 34.13 31.17 3hup s GLU 160 CO 0.31 -0.06 0.96 0.12 -0.54 0.00 0.00 175.26 176.06 3hup s PHE 161 N -1.30 3.55 -0.40 5.30 5.36 -0.54 -4.82 117.98 125.14 3hup s PHE 161 Ca 0.51 1.57 0.07 0.00 -0.96 0.00 0.00 56.93 58.13 3hup s PHE 161 Cb -0.32 -3.13 0.57 0.00 -0.34 0.00 0.00 43.02 39.80 3hup s PHE 161 CO 0.41 -0.14 1.53 0.09 -1.46 0.00 0.00 175.22 175.64 3hup n ASN 162 N 4.62 4.16 -3.82 6.13 3.02 -1.26 -4.77 115.26 123.34 3hup n ASN 162 Ca 0.07 -2.88 -0.28 0.00 -0.03 0.00 0.00 54.58 51.46 3hup n ASN 162 Cb 0.50 -0.68 0.04 0.00 -0.61 0.00 0.00 39.78 39.02 3hup n ASN 162 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3hup n ASN 163 N 0.01 -4.87 -0.03 6.41 4.13 -1.26 -4.84 115.26 114.81 3hup n ASN 163 Ca 0.30 -0.72 0.15 0.00 1.68 0.00 0.00 54.58 55.98 3hup n ASN 163 Cb 1.12 -4.20 0.77 0.00 -1.54 0.00 0.00 39.78 35.93 3hup n ASN 163 CO 0.00 0.00 0.00 -2.67 0.28 0.00 0.00 177.26 174.87 3hup n TRP 164 N -4.73 0.00 -4.08 3.10 4.27 -1.26 -4.73 117.44 110.01 3hup n TRP 164 Ca 0.00 0.00 -0.07 0.00 -3.89 0.00 0.00 57.50 53.54 3hup n TRP 164 Cb 0.55 -0.20 -0.10 0.00 -1.36 0.00 0.00 31.31 30.20 3hup n TRP 164 CO 0.00 0.00 0.00 -0.59 -2.29 0.00 0.00 177.69 174.81 3hup s PHE 165 N -2.43 0.53 0.10 -2.67 -0.12 -1.26 -5.15 117.98 106.98 3hup s PHE 165 Ca 0.33 -1.06 -0.23 0.00 -0.05 0.00 0.00 56.93 55.92 3hup s PHE 165 Cb 0.21 -0.38 -0.07 0.00 -0.63 0.00 0.00 43.02 42.15 3hup s PHE 165 CO 0.44 -0.40 0.69 1.21 -0.05 0.00 0.00 175.22 177.11 3hup s ASN 166 N -2.93 7.21 -0.27 1.98 2.47 -1.26 -5.05 114.94 117.09 3hup s ASN 166 Ca 0.08 1.44 -0.00 0.00 0.42 0.00 0.00 52.86 54.81 3hup s ASN 166 Cb 0.08 -2.44 0.05 0.00 -1.45 0.00 0.00 41.25 37.49 3hup s ASN 166 CO -0.09 0.19 -0.05 -0.69 -3.72 0.00 0.00 177.10 172.73 3hup s VAL 167 N -0.84 2.66 0.74 -5.21 1.01 -1.26 -4.80 120.40 112.70 3hup s VAL 167 Ca 0.34 -1.40 -0.06 0.00 0.00 0.00 0.00 61.98 60.85 3hup s VAL 167 Cb -0.21 -2.50 0.16 0.00 0.00 0.00 0.00 36.38 33.83 3hup s VAL 167 CO 0.22 -0.01 1.01 0.35 0.00 0.00 0.00 175.10 176.68 3hup n THR 168 N 4.56 0.00 -1.94 3.92 -2.24 -1.24 -4.90 114.28 112.44 3hup n THR 168 Ca -0.14 -1.17 0.00 0.00 -2.27 0.00 0.00 64.05 60.47 3hup n THR 168 Cb 0.44 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 67.45 3hup n THR 168 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hup n GLY 169 N -2.19 -1.40 1.18 3.38 0.00 -1.26 -2.43 105.19 102.47 3hup n GLY 169 Ca 0.15 -1.63 -0.01 0.00 0.00 0.00 0.00 46.02 44.53 3hup n GLY 169 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hup n SER 170 N 0.10 0.12 -4.46 1.61 3.41 -1.26 -4.97 113.62 108.17 3hup n SER 170 Ca 0.00 -1.94 -0.23 0.00 -0.26 0.00 0.00 58.87 56.43 3hup n SER 170 Cb 0.00 -0.05 -0.10 0.00 -0.26 0.00 0.00 64.21 63.79 3hup n SER 170 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3hup s ASP 171 N -1.44 2.70 0.18 4.04 1.01 -1.26 -5.00 116.67 116.90 3hup s ASP 171 Ca 0.17 -1.41 0.15 0.00 0.71 0.00 0.00 52.55 52.17 3hup s ASP 171 Cb 0.19 -0.07 -0.04 0.00 1.01 0.00 0.00 42.92 44.01 3hup s ASP 171 CO -0.08 -0.61 1.18 0.11 0.21 0.00 0.00 175.17 175.97 3hup h LYS 172 N 2.01 0.00 -5.99 8.23 1.57 -1.87 -3.43 116.57 117.08 3hup h LYS 172 Ca -0.41 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 57.69 3hup h LYS 172 Cb 1.25 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.36 3hup h LYS 172 CO 0.71 0.46 -0.70 0.00 -0.57 0.00 0.00 179.45 179.35 3hup s VAL 174 N -0.58 5.37 0.26 0.00 1.01 -1.01 -1.02 120.40 124.44 3hup s VAL 174 Ca 0.09 0.16 0.05 0.00 0.00 0.00 0.00 61.98 62.28 3hup s VAL 174 Cb -0.12 -3.35 -0.06 0.00 0.00 0.00 0.00 36.38 32.86 3hup s VAL 174 CO 0.02 0.60 -0.02 0.72 0.00 0.00 0.00 175.10 176.41 3hup s PHE 175 N -0.85 1.78 0.15 5.22 -0.12 -0.45 -1.59 117.98 122.11 3hup s PHE 175 Ca 0.14 -0.82 -0.04 0.00 -0.05 0.00 0.00 56.93 56.16 3hup s PHE 175 Cb -0.12 -1.04 -0.03 0.00 -0.63 0.00 0.00 43.02 41.20 3hup s PHE 175 CO 0.03 0.11 0.15 -0.48 -0.05 0.00 0.00 175.22 174.98 3hup s LEU 176 N -3.39 1.42 0.00 -1.99 0.05 -0.10 -1.88 118.68 112.79 3hup s LEU 176 Ca 0.30 -1.10 -0.03 0.00 0.05 0.00 0.00 54.13 53.35 3hup s LEU 176 Cb 0.05 0.64 0.01 0.00 -2.05 0.00 0.00 46.19 44.85 3hup s LEU 176 CO 0.11 -0.80 0.46 2.29 -0.55 0.00 0.00 176.35 177.86 3hup n LYS 177 N -0.15 0.67 0.01 1.48 2.85 -0.04 -0.95 118.16 122.03 3hup n LYS 177 Ca -0.06 -2.49 0.05 0.00 -1.05 0.00 0.00 58.31 54.76 3hup n LYS 177 Cb 0.64 2.45 0.24 0.00 -0.65 0.00 0.00 35.03 37.70 3hup n LYS 177 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 3hup n ASN 178 N -1.66 0.05 -0.05 -5.58 0.23 0.13 -2.46 115.26 105.93 3hup n ASN 178 Ca -0.00 0.51 0.02 0.00 -0.53 0.00 0.00 54.58 54.58 3hup n ASN 178 Cb 0.53 -0.52 0.03 0.00 -2.08 0.00 0.00 39.78 37.73 3hup n ASN 178 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 3hup n THR 179 N -1.56 0.89 -3.60 5.53 -2.24 -1.26 -4.84 114.28 107.19 3hup n THR 179 Ca 0.02 -0.96 -0.13 0.00 -2.27 0.00 0.00 64.05 60.72 3hup n THR 179 Cb 0.12 0.47 -0.07 0.00 -2.10 0.00 0.00 70.33 68.75 3hup n THR 179 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3hup s GLU 180 N -1.07 0.75 -0.13 -0.78 2.12 -1.03 -5.12 118.70 113.44 3hup s GLU 180 Ca 0.06 0.59 0.00 0.00 0.36 0.00 0.00 54.97 55.99 3hup s GLU 180 Cb 0.05 0.36 0.02 0.00 0.26 0.00 0.00 34.13 34.82 3hup s GLU 180 CO 0.01 -0.15 -0.13 0.08 -0.54 0.00 0.00 175.26 174.53 3hup s VAL 181 N -0.22 1.43 0.00 3.70 1.01 -1.26 -0.86 120.40 124.20 3hup s VAL 181 Ca -0.02 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.41 3hup s VAL 181 Cb -0.03 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 35.00 3hup s VAL 181 CO 0.01 0.43 0.00 -0.24 0.00 0.00 0.00 175.10 175.30 3hup n SER 182 N 4.68 0.00 -4.20 3.32 2.88 -0.79 -3.64 113.62 115.86 3hup n SER 182 Ca -0.16 -0.83 -0.17 0.00 -1.33 0.00 0.00 58.87 56.38 3hup n SER 182 Cb 0.50 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.85 3hup n SER 182 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3hup s SER 183 N -0.54 1.77 0.05 -3.46 1.04 -1.02 -1.34 113.70 110.20 3hup s SER 183 Ca 0.00 -0.74 -0.10 0.00 0.48 0.00 0.00 55.95 55.59 3hup s SER 183 Cb 0.00 -0.05 0.01 0.00 0.10 0.00 0.00 66.02 66.08 3hup s SER 183 CO 0.00 -0.14 0.21 -0.32 0.98 0.00 0.00 173.24 173.97 3hup s MET 184 N -2.35 0.73 0.08 4.02 1.75 -0.19 -4.58 119.30 118.77 3hup s MET 184 Ca 0.04 -0.65 -0.36 0.00 -1.25 0.00 0.00 55.69 53.48 3hup s MET 184 Cb -0.06 0.30 -0.15 0.00 2.84 0.00 0.00 34.83 37.76 3hup s MET 184 CO 0.02 -0.22 1.49 0.39 -0.65 0.00 0.00 175.02 176.06 3hup n GLU 185 N 0.58 1.62 0.24 4.11 1.02 -1.26 -3.51 120.64 123.43 3hup n GLU 185 Ca -0.18 0.58 0.14 0.00 -0.02 0.00 0.00 57.16 57.69 3hup n GLU 185 Cb 0.59 -2.29 0.81 0.00 -0.02 0.00 0.00 31.44 30.53 3hup n GLU 185 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hup n GLU 187 N -4.03 0.01 -2.18 0.00 -0.58 -1.26 -1.03 120.64 111.57 3hup n GLU 187 Ca -0.01 0.01 -0.37 0.00 -0.42 0.00 0.00 57.16 56.37 3hup n GLU 187 Cb 0.19 -1.51 -0.00 0.00 -0.57 0.00 0.00 31.44 29.55 3hup n GLU 187 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 3hup s LYS 188 N -3.01 3.62 -0.29 3.49 2.20 -0.56 -4.54 119.74 120.66 3hup s LYS 188 Ca 0.13 1.83 -0.24 0.00 -0.36 0.00 0.00 55.97 57.33 3hup s LYS 188 Cb 0.18 -2.34 -0.00 0.00 -1.51 0.00 0.00 37.83 34.16 3hup s LYS 188 CO 0.56 -0.68 0.81 -0.80 -0.36 0.00 0.00 175.35 174.89 3hup s ASN 189 N -1.34 6.73 0.10 1.43 0.01 -1.26 -3.82 114.94 116.80 3hup s ASN 189 Ca 0.66 0.81 0.03 0.00 -0.71 0.00 0.00 52.86 53.65 3hup s ASN 189 Cb -0.30 -2.42 -0.04 0.00 0.41 0.00 0.00 41.25 38.90 3hup s ASN 189 CO 0.36 -0.59 -0.09 -0.76 -1.51 0.00 0.00 177.10 174.51 3hup s LEU 190 N 2.95 2.46 1.14 0.60 1.43 -0.53 -4.64 118.68 122.08 3hup s LEU 190 Ca 0.34 -0.90 -0.12 0.00 -1.03 0.00 0.00 54.13 52.41 3hup s LEU 190 Cb -0.14 -0.23 0.27 0.00 0.03 0.00 0.00 46.19 46.11 3hup s LEU 190 CO 0.11 -0.34 1.04 -0.31 0.23 0.00 0.00 176.35 177.08 3hup s TYR 191 N -2.94 1.34 0.18 0.29 2.02 -1.21 -1.15 117.35 115.88 3hup s TYR 191 Ca 0.09 1.30 -0.05 0.00 -0.37 0.00 0.00 57.07 58.03 3hup s TYR 191 Cb 0.00 -3.13 -0.02 0.00 -0.40 0.00 0.00 41.96 38.41 3hup s TYR 191 CO -0.01 -3.77 0.21 1.67 -1.57 0.00 0.00 175.55 172.08 3hup s TRP 192 N -2.46 0.71 -0.06 2.71 -2.14 -1.26 -0.40 118.94 116.03 3hup s TRP 192 Ca 0.68 -1.04 0.02 0.00 2.66 0.00 0.00 56.10 58.42 3hup s TRP 192 Cb -0.25 -0.26 0.01 0.00 -3.10 0.00 0.00 33.47 29.87 3hup s TRP 192 CO 0.64 -0.68 -0.12 0.42 -2.66 0.00 0.00 176.95 174.54 3hup s ILE 193 N -4.05 1.13 0.16 0.66 1.01 -0.87 -1.00 121.20 118.25 3hup s ILE 193 Ca 0.25 -0.48 0.03 0.00 0.00 0.00 0.00 60.65 60.46 3hup s ILE 193 Cb 0.05 -1.04 -0.04 0.00 0.01 0.00 0.00 42.46 41.45 3hup s ILE 193 CO 0.05 0.35 0.25 0.00 0.00 0.00 0.00 174.94 175.59 3hup s ASN 195 N -3.24 0.00 -0.06 0.00 2.20 -0.32 -1.23 114.94 112.29 3hup s ASN 195 Ca 0.34 -0.97 -0.31 0.00 -0.94 0.00 0.00 52.86 50.98 3hup s ASN 195 Cb -0.11 0.49 0.08 0.00 -2.00 0.00 0.00 41.25 39.71 3hup s ASN 195 CO 0.27 -0.98 0.72 -1.59 -2.94 0.00 0.00 177.10 172.58 3hup s LYS 196 N -4.02 1.00 0.60 3.55 -2.85 -0.42 -2.32 119.74 115.29 3hup s LYS 196 Ca 0.23 0.25 -0.17 0.00 -1.00 0.00 0.00 55.97 55.28 3hup s LYS 196 Cb 0.02 0.47 -0.03 0.00 -2.06 0.00 0.00 37.83 36.24 3hup s LYS 196 CO 0.05 -0.31 1.09 -1.25 0.10 0.00 0.00 175.35 175.04 3hup s PRO 197 N -1.17 3.14 0.09 1.78 0.04 -1.26 -0.20 135.00 137.42 3hup s PRO 197 Ca -0.10 1.39 0.05 0.00 0.04 0.00 0.00 61.00 62.38 3hup s PRO 197 Cb -0.00 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 3hup s PRO 197 CO 0.09 -0.98 -0.12 1.52 0.04 0.00 0.00 177.00 177.55 3hup s TYR 198 N -2.22 1.19 0.00 0.56 1.13 -0.67 -4.76 117.35 112.58 3hup s TYR 198 Ca 0.67 -0.55 0.00 0.00 -1.41 0.00 0.00 57.07 55.78 3hup s TYR 198 Cb -0.20 -0.65 0.00 0.00 -1.10 0.00 0.00 41.96 40.01 3hup s TYR 198 CO 0.35 0.06 0.36 1.63 -2.51 0.00 0.00 175.55 175.44