#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hyh h TYR 55 N 0.00 -0.05 -3.43 1.20 0.99 -1.89 -3.46 116.97 110.33 3hyh h TYR 55 Ca 0.00 -0.00 -0.66 0.00 2.00 0.00 0.00 58.73 60.06 3hyh h TYR 55 Cb 0.00 0.02 -0.19 0.00 1.00 0.00 0.00 36.73 37.56 3hyh h TYR 55 CO 0.00 -0.03 -0.66 -0.65 -0.00 0.00 0.00 178.16 176.82 3hyh s GLN 56 N -1.51 3.17 0.41 4.88 -1.52 -1.20 -4.97 119.66 118.92 3hyh s GLN 56 Ca -0.01 -0.49 -0.23 0.00 -1.95 0.00 0.00 55.36 52.67 3hyh s GLN 56 Cb 0.00 -2.77 -0.09 0.00 -0.22 0.00 0.00 33.01 29.92 3hyh s GLN 56 CO 0.02 0.52 1.03 0.42 -0.25 0.00 0.00 175.29 177.03 3hyh s ILE 57 N -0.38 3.84 -0.08 1.08 1.01 -1.26 -2.63 121.20 122.78 3hyh s ILE 57 Ca 0.06 1.35 -0.03 0.00 0.00 0.00 0.00 60.65 62.03 3hyh s ILE 57 Cb -0.12 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.65 3hyh s ILE 57 CO 0.02 -0.05 -0.10 0.52 0.00 0.00 0.00 174.94 175.34 3hyh n VAL 58 N -0.21 0.43 -3.48 2.92 0.31 0.96 -4.95 118.33 114.31 3hyh n VAL 58 Ca 0.06 -0.12 -0.15 0.00 -0.01 0.00 0.00 64.34 64.12 3hyh n VAL 58 Cb 0.51 -1.48 -0.04 0.00 -0.91 0.00 0.00 33.84 31.91 3hyh n VAL 58 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 3hyh s LYS 59 N -2.14 1.15 -0.25 5.55 2.20 -1.04 -5.00 119.74 120.21 3hyh s LYS 59 Ca -0.11 -0.05 -0.17 0.00 -0.36 0.00 0.00 55.97 55.28 3hyh s LYS 59 Cb 0.04 0.54 -0.03 0.00 -1.51 0.00 0.00 37.83 36.87 3hyh s LYS 59 CO 0.14 -0.43 0.48 0.99 -0.36 0.00 0.00 175.35 176.17 3hyh s THR 60 N -2.29 5.11 0.02 3.43 2.01 -1.26 0.49 115.64 123.15 3hyh s THR 60 Ca -0.06 0.81 0.10 0.00 0.31 0.00 0.00 61.69 62.86 3hyh s THR 60 Cb -0.00 -3.80 -0.18 0.00 0.01 0.00 0.00 72.50 68.53 3hyh s THR 60 CO 0.00 0.13 1.10 -0.07 -0.69 0.00 0.00 174.62 175.09 3hyh h LEU 61 N 8.52 0.00 0.00 4.42 3.38 -1.10 -3.47 115.31 127.06 3hyh h LEU 61 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3hyh h LEU 61 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3hyh h LEU 61 CO 0.70 0.91 0.00 0.61 0.09 0.00 0.00 178.44 180.75 3hyh n GLY 62 N 1.39 -0.56 3.04 0.83 0.00 -1.10 -5.02 105.19 103.77 3hyh n GLY 62 Ca -0.05 -0.74 -0.10 0.00 0.00 0.00 0.00 46.02 45.13 3hyh n GLY 62 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hyh s GLU 63 N -0.77 0.40 0.00 1.61 2.02 -1.26 -2.32 118.70 118.37 3hyh s GLU 63 Ca 0.00 -0.52 0.00 0.00 0.02 0.00 0.00 54.97 54.47 3hyh s GLU 63 Cb 0.00 0.15 0.00 0.00 0.10 0.00 0.00 34.13 34.38 3hyh s GLU 63 CO 0.00 -0.08 0.00 0.41 0.02 0.00 0.00 175.26 175.61 3hyh n GLY 67 N 1.50 0.00 3.99 -1.39 0.00 -1.16 -4.97 105.19 103.17 3hyh n GLY 67 Ca -0.23 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.61 3hyh n GLY 67 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hyh s LYS 68 N 0.00 2.85 -0.14 1.61 -2.85 -1.17 -4.86 119.74 115.18 3hyh s LYS 68 Ca 0.00 -1.23 0.02 0.00 -1.00 0.00 0.00 55.97 53.76 3hyh s LYS 68 Cb 0.00 -2.73 0.01 0.00 -2.06 0.00 0.00 37.83 33.04 3hyh s LYS 68 CO 0.00 -0.20 -0.20 0.08 0.10 0.00 0.00 175.35 175.13 3hyh s VAL 69 N -2.33 2.25 0.19 1.79 1.01 -0.98 -1.25 120.40 121.08 3hyh s VAL 69 Ca 0.53 -0.92 0.11 0.00 0.00 0.00 0.00 61.98 61.70 3hyh s VAL 69 Cb -0.09 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.33 3hyh s VAL 69 CO 0.32 0.54 -0.22 -0.54 0.00 0.00 0.00 175.10 175.20 3hyh s LYS 70 N 0.80 1.58 -0.11 2.72 1.02 -0.48 -0.49 119.74 124.78 3hyh s LYS 70 Ca -0.07 -1.49 -0.13 0.00 0.02 0.00 0.00 55.97 54.31 3hyh s LYS 70 Cb -0.16 -1.89 -0.05 0.00 -0.52 0.00 0.00 37.83 35.22 3hyh s LYS 70 CO -0.01 0.41 0.29 -1.17 -0.92 0.00 0.00 175.35 173.95 3hyh s LEU 71 N -2.66 4.33 0.21 3.17 2.96 0.18 -0.58 118.68 126.29 3hyh s LEU 71 Ca 0.21 0.62 -0.09 0.00 -0.22 0.00 0.00 54.13 54.65 3hyh s LEU 71 Cb -0.08 -2.37 -0.02 0.00 0.50 0.00 0.00 46.19 44.22 3hyh s LEU 71 CO 0.10 0.21 0.33 0.00 -1.32 0.00 0.00 176.35 175.67 3hyh s ALA 72 N -0.21 0.20 -0.05 5.97 0.00 -0.44 -0.03 121.76 127.21 3hyh s ALA 72 Ca 0.18 -1.09 -0.08 0.00 0.00 0.00 0.00 51.96 50.97 3hyh s ALA 72 Cb -0.14 1.09 0.02 0.00 0.00 0.00 0.00 23.12 24.08 3hyh s ALA 72 CO 0.06 -0.72 0.20 1.52 0.00 0.00 0.00 175.76 176.82 3hyh s TYR 73 N -4.04 -0.15 0.12 0.00 -0.85 -1.08 -0.54 117.35 110.81 3hyh s TYR 73 Ca 0.25 0.35 -0.31 0.00 -0.52 0.00 0.00 57.07 56.83 3hyh s TYR 73 Cb 0.03 0.04 -0.08 0.00 0.38 0.00 0.00 41.96 42.33 3hyh s TYR 73 CO 0.07 -0.18 1.44 -1.58 -1.52 0.00 0.00 175.55 173.78 3hyh s HIS 74 N -0.41 3.15 -2.29 -3.49 5.65 -0.77 -3.06 115.29 114.07 3hyh s HIS 74 Ca -0.05 0.84 0.28 0.00 0.25 0.00 0.00 55.06 56.39 3hyh s HIS 74 Cb -0.03 -3.75 1.30 0.00 -1.18 0.00 0.00 32.58 28.92 3hyh s HIS 74 CO 0.01 -2.69 1.88 2.41 -0.65 0.00 0.00 174.74 175.70 3hyh n THR 75 N 4.02 0.02 -0.10 0.89 -1.04 -1.26 -0.70 114.28 116.11 3hyh n THR 75 Ca 0.12 -0.17 -0.13 0.00 -2.04 0.00 0.00 64.05 61.84 3hyh n THR 75 Cb 0.41 0.13 -0.04 0.00 -1.82 0.00 0.00 70.33 69.01 3hyh n THR 75 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 3hyh n THR 76 N -0.24 1.51 0.08 12.58 -1.04 -1.26 -4.74 114.28 121.17 3hyh n THR 76 Ca 0.20 0.04 0.05 0.00 -2.04 0.00 0.00 64.05 62.30 3hyh n THR 76 Cb 0.26 -2.26 -0.03 0.00 -1.82 0.00 0.00 70.33 66.48 3hyh n THR 76 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 3hyh h THR 77 N -1.00 0.30 0.00 12.58 1.35 -1.99 -3.48 112.91 120.68 3hyh h THR 77 Ca -0.14 -1.57 0.00 0.00 -0.55 0.00 0.00 66.41 64.16 3hyh h THR 77 Cb 1.12 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 69.39 3hyh h THR 77 CO -0.08 0.17 0.00 0.61 -0.25 0.00 0.00 175.52 175.97 3hyh n GLY 78 N 1.28 0.90 3.71 5.82 0.00 0.12 -5.01 105.19 112.01 3hyh n GLY 78 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 3hyh n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hyh n GLN 79 N -2.00 2.77 -2.49 1.61 10.64 -1.25 -4.59 117.38 122.08 3hyh n GLN 79 Ca 0.00 1.00 -0.40 0.00 -1.83 0.00 0.00 57.00 55.77 3hyh n GLN 79 Cb 0.00 -2.86 -0.04 0.00 -0.86 0.00 0.00 30.24 26.47 3hyh n GLN 79 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 3hyh s LYS 80 N 1.58 4.65 0.02 2.61 1.02 -1.26 -1.84 119.74 126.51 3hyh s LYS 80 Ca 0.77 1.79 -0.08 0.00 0.02 0.00 0.00 55.97 58.47 3hyh s LYS 80 Cb -0.50 -3.19 0.00 0.00 -0.52 0.00 0.00 37.83 33.62 3hyh s LYS 80 CO 0.34 0.23 0.15 0.54 -0.92 0.00 0.00 175.35 175.69 3hyh s VAL 81 N -1.17 0.10 -0.11 3.17 0.11 0.30 -2.18 120.40 120.62 3hyh s VAL 81 Ca 0.44 -0.81 -0.01 0.00 -2.93 0.00 0.00 61.98 58.68 3hyh s VAL 81 Cb -0.32 -0.66 -0.03 0.00 -1.53 0.00 0.00 36.38 33.85 3hyh s VAL 81 CO 0.41 -0.45 -0.07 0.00 -3.33 0.00 0.00 175.10 171.66 3hyh s ALA 82 N -1.92 2.93 -0.40 1.54 0.00 0.14 -1.33 121.76 122.72 3hyh s ALA 82 Ca -0.10 -0.87 -0.12 0.00 0.00 0.00 0.00 51.96 50.87 3hyh s ALA 82 Cb -0.05 -1.33 0.03 0.00 0.00 0.00 0.00 23.12 21.78 3hyh s ALA 82 CO -0.01 0.40 0.25 -0.51 0.00 0.00 0.00 175.76 175.90 3hyh s LEU 83 N -0.24 4.93 -0.57 0.00 1.43 0.26 -1.45 118.68 123.04 3hyh s LEU 83 Ca 0.03 -1.04 -0.19 0.00 -1.03 0.00 0.00 54.13 51.91 3hyh s LEU 83 Cb -0.13 -2.07 0.09 0.00 0.03 0.00 0.00 46.19 44.11 3hyh s LEU 83 CO 0.03 -0.44 0.69 -0.54 0.23 0.00 0.00 176.35 176.32 3hyh s LYS 84 N 1.59 3.07 -0.45 1.70 1.02 -0.49 -1.38 119.74 124.80 3hyh s LYS 84 Ca 0.03 -1.18 -0.22 0.00 0.02 0.00 0.00 55.97 54.62 3hyh s LYS 84 Cb -0.20 -4.22 0.03 0.00 -0.52 0.00 0.00 37.83 32.92 3hyh s LYS 84 CO 0.07 -1.47 0.73 0.42 -0.92 0.00 0.00 175.35 174.19 3hyh s ILE 85 N 2.73 4.71 -0.21 2.17 1.01 -0.38 -1.84 121.20 129.40 3hyh s ILE 85 Ca 0.13 0.27 -0.05 0.00 0.00 0.00 0.00 60.65 61.00 3hyh s ILE 85 Cb -0.22 -4.29 -0.02 0.00 0.01 0.00 0.00 42.46 37.94 3hyh s ILE 85 CO 0.08 -0.69 0.00 -0.63 0.00 0.00 0.00 174.94 173.70 3hyh s ILE 86 N 3.12 3.88 -0.17 2.92 1.01 0.93 -2.98 121.20 129.91 3hyh s ILE 86 Ca 0.27 -0.33 -0.11 0.00 0.00 0.00 0.00 60.65 60.48 3hyh s ILE 86 Cb -0.13 -2.77 -0.05 0.00 0.01 0.00 0.00 42.46 39.52 3hyh s ILE 86 CO 0.21 0.41 0.18 0.20 0.00 0.00 0.00 174.94 175.94 3hyh s ASN 87 N 1.17 6.31 -0.46 3.58 -0.87 -1.26 -0.30 114.94 123.12 3hyh s ASN 87 Ca 0.03 0.35 -0.27 0.00 -1.57 0.00 0.00 52.86 51.40 3hyh s ASN 87 Cb -0.14 -2.12 -0.08 0.00 -0.02 0.00 0.00 41.25 38.89 3hyh s ASN 87 CO 0.01 0.19 2.38 0.29 -2.57 0.00 0.00 177.10 177.41 3hyh n LYS 88 N 3.28 1.18 0.00 -0.60 5.02 -0.30 -4.84 118.16 121.89 3hyh n LYS 88 Ca -0.15 0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 3hyh n LYS 88 Cb 0.52 -3.21 0.00 0.00 -0.02 0.00 0.00 35.03 32.33 3hyh n LYS 88 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 3hyh n LYS 89 N 8.87 0.00 -3.70 1.97 2.85 -1.26 -5.04 118.16 121.84 3hyh n LYS 89 Ca 0.38 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 57.40 3hyh n LYS 89 Cb 0.47 0.00 -0.01 0.00 -0.65 0.00 0.00 35.03 34.84 3hyh n LYS 89 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 177.40 175.71 3hyh s MET 96 N 0.00 2.35 0.41 -1.58 1.00 -1.26 -5.08 119.30 115.15 3hyh s MET 96 Ca 0.00 -1.80 0.08 0.00 0.00 0.00 0.00 55.69 53.96 3hyh s MET 96 Cb 0.00 -2.24 0.88 0.00 0.00 0.00 0.00 34.83 33.46 3hyh s MET 96 CO 0.00 -0.47 2.06 1.96 0.00 0.00 0.00 175.02 178.57 3hyh h GLN 97 N 0.83 0.52 -0.14 2.03 4.20 -2.04 -1.76 115.11 118.75 3hyh h GLN 97 Ca -0.38 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.24 3hyh h GLN 97 Cb 1.29 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.94 3hyh h GLN 97 CO 0.56 0.35 -0.17 0.78 -0.67 0.00 0.00 178.83 179.68 3hyh h GLY 98 N 0.54 0.25 1.44 3.46 0.00 -2.05 -2.36 103.07 104.35 3hyh h GLY 98 Ca 0.16 -0.16 -0.18 0.00 0.00 0.00 0.00 47.33 47.14 3hyh h GLY 98 CO -0.03 0.15 -0.64 3.21 0.00 0.00 0.00 176.54 179.23 3hyh h ARG 99 N 0.22 0.57 -0.46 4.80 3.08 -1.75 -0.67 114.38 120.16 3hyh h ARG 99 Ca 0.04 -0.41 -0.05 0.00 0.07 0.00 0.00 59.98 59.64 3hyh h ARG 99 Cb 0.44 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.53 3hyh h ARG 99 CO 0.03 1.02 0.10 0.82 -1.07 0.00 0.00 179.97 180.87 3hyh h ILE 100 N 0.42 1.24 -0.67 2.04 1.08 -1.50 -2.11 117.51 118.01 3hyh h ILE 100 Ca -0.01 -0.84 -0.02 0.00 -0.39 0.00 0.00 64.86 63.59 3hyh h ILE 100 Cb 1.21 0.91 -0.03 0.00 -3.07 0.00 0.00 36.82 35.84 3hyh h ILE 100 CO 0.12 0.30 0.33 -0.33 -0.69 0.00 0.00 178.15 177.88 3hyh h GLU 101 N 0.61 0.94 -0.74 2.37 5.08 -1.33 -1.14 114.58 120.37 3hyh h GLU 101 Ca 0.14 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 3hyh h GLU 101 Cb 0.34 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 3hyh h GLU 101 CO 0.00 0.72 0.34 -0.09 -1.00 0.00 0.00 179.01 178.99 3hyh h ARG 102 N 0.94 1.08 0.06 2.33 2.43 -0.96 0.28 114.38 120.55 3hyh h ARG 102 Ca 0.23 -0.17 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3hyh h ARG 102 Cb 0.08 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.44 3hyh h ARG 102 CO -0.03 0.86 -0.03 1.49 -1.51 0.00 0.00 179.97 180.74 3hyh h GLU 103 N 1.05 -0.08 -0.30 0.20 4.57 -0.69 -1.05 114.58 118.29 3hyh h GLU 103 Ca 0.25 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.46 3hyh h GLU 103 Cb 0.14 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.73 3hyh h GLU 103 CO -0.03 0.11 0.14 0.82 -1.18 0.00 0.00 179.01 178.87 3hyh h ILE 104 N -0.26 0.98 -0.04 2.32 2.04 -1.13 -0.93 117.51 120.49 3hyh h ILE 104 Ca -0.01 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.75 3hyh h ILE 104 Cb 0.23 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 36.96 3hyh h ILE 104 CO 0.01 0.05 0.03 -1.28 0.00 0.00 0.00 178.15 176.97 3hyh h SER 105 N 0.30 0.05 0.01 1.72 0.87 -0.89 -1.31 113.55 114.30 3hyh h SER 105 Ca 0.13 -0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.69 3hyh h SER 105 Cb 0.05 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 61.98 3hyh h SER 105 CO -0.09 0.05 -0.11 1.88 -0.53 0.00 0.00 176.83 178.03 3hyh h TYR 106 N 0.04 -0.28 -0.22 2.24 -1.99 -1.08 -1.62 116.97 114.06 3hyh h TYR 106 Ca 0.02 0.01 0.01 0.00 2.00 0.00 0.00 58.73 60.77 3hyh h TYR 106 Cb 0.01 0.13 -0.01 0.00 2.00 0.00 0.00 36.73 38.85 3hyh h TYR 106 CO -0.07 -0.17 0.15 -0.07 -0.00 0.00 0.00 178.16 178.00 3hyh h LEU 107 N -0.19 0.22 -0.29 3.88 3.38 -1.04 -0.79 115.31 120.47 3hyh h LEU 107 Ca 0.04 -0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.80 3hyh h LEU 107 Cb 0.24 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 3hyh h LEU 107 CO -0.11 0.16 -0.85 0.03 0.09 0.00 0.00 178.44 177.76 3hyh h ARG 108 N 0.26 0.32 -0.03 1.13 3.08 -0.88 -3.31 114.38 114.94 3hyh h ARG 108 Ca 0.09 -0.31 -0.21 0.00 0.07 0.00 0.00 59.98 59.62 3hyh h ARG 108 Cb 0.03 0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 3hyh h ARG 108 CO -0.02 1.00 -0.85 1.25 -1.07 0.00 0.00 179.97 180.28 3hyh h LEU 109 N 0.19 0.47 -8.59 3.04 5.85 -0.60 -3.43 115.31 112.23 3hyh h LEU 109 Ca -0.05 -0.35 -0.68 0.00 0.84 0.00 0.00 57.88 57.64 3hyh h LEU 109 Cb 1.46 -0.14 -0.21 0.00 0.37 0.00 0.00 40.66 42.14 3hyh h LEU 109 CO 0.14 1.13 -0.51 -0.76 -0.34 0.00 0.00 178.44 178.09 3hyh s LEU 110 N -7.77 4.40 -0.27 2.25 1.43 -0.37 -5.04 118.68 113.31 3hyh s LEU 110 Ca -0.05 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.51 3hyh s LEU 110 Cb 0.10 -2.07 0.07 0.00 0.03 0.00 0.00 46.19 44.32 3hyh s LEU 110 CO 0.85 -0.25 -0.08 -0.13 0.23 0.00 0.00 176.35 176.97 3hyh s ARG 111 N 1.65 2.14 -0.13 1.70 3.00 -1.26 -4.81 118.95 121.24 3hyh s ARG 111 Ca 0.05 -1.43 -0.14 0.00 0.00 0.00 0.00 55.73 54.21 3hyh s ARG 111 Cb -0.18 -2.95 0.04 0.00 0.00 0.00 0.00 34.95 31.86 3hyh s ARG 111 CO 0.08 -0.63 0.39 -1.58 0.00 0.00 0.00 175.30 173.57 3hyh s HIS 112 N 1.08 -0.40 0.63 -0.53 2.46 -1.26 -5.05 115.29 112.21 3hyh s HIS 112 Ca -0.06 0.95 0.28 0.00 0.47 0.00 0.00 55.06 56.70 3hyh s HIS 112 Cb -0.20 0.15 1.46 0.00 -0.13 0.00 0.00 32.58 33.86 3hyh s HIS 112 CO -0.05 -0.25 1.84 -1.35 -2.47 0.00 0.00 174.74 172.46 3hyh h PRO 113 N 5.19 0.00 -0.05 2.88 0.11 -1.97 -1.97 132.00 136.19 3hyh h PRO 113 Ca -0.27 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.84 3hyh h PRO 113 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 3hyh h PRO 113 CO 0.28 0.00 -0.01 0.72 -0.21 0.00 0.00 178.00 178.78 3hyh n HIS 114 N -3.21 0.19 -5.07 0.65 8.25 -1.26 -4.89 115.22 109.87 3hyh n HIS 114 Ca 0.03 -1.00 -0.32 0.00 -0.26 0.00 0.00 57.72 56.17 3hyh n HIS 114 Cb 0.56 -0.19 -0.16 0.00 1.12 0.00 0.00 29.99 31.32 3hyh n HIS 114 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3hyh s ILE 115 N -2.88 2.41 0.22 1.59 1.01 -0.74 -0.72 121.20 122.08 3hyh s ILE 115 Ca 0.34 -0.90 -0.32 0.00 0.00 0.00 0.00 60.65 59.77 3hyh s ILE 115 Cb 0.30 -1.95 -0.13 0.00 0.01 0.00 0.00 42.46 40.68 3hyh s ILE 115 CO 0.04 0.55 1.49 0.00 0.00 0.00 0.00 174.94 177.02 3hyh n ILE 116 N 3.45 0.65 -2.84 2.92 3.06 0.17 -4.60 119.36 122.18 3hyh n ILE 116 Ca -0.19 -0.16 -0.39 0.00 -2.50 0.00 0.00 62.75 59.51 3hyh n ILE 116 Cb 0.53 -1.58 -0.06 0.00 0.54 0.00 0.00 39.64 39.07 3hyh n ILE 116 CO 0.00 0.00 0.00 -0.54 -2.50 0.00 0.00 176.55 173.51 3hyh s LYS 117 N 0.01 4.71 -0.39 9.51 -0.14 -1.26 -4.92 119.74 127.26 3hyh s LYS 117 Ca 0.71 1.35 -0.09 0.00 -1.36 0.00 0.00 55.97 56.58 3hyh s LYS 117 Cb -0.63 -3.20 0.06 0.00 -1.68 0.00 0.00 37.83 32.38 3hyh s LYS 117 CO 0.45 0.50 0.21 -1.17 -0.76 0.00 0.00 175.35 174.59 3hyh s LEU 118 N -1.32 4.89 0.31 3.17 2.96 -1.26 -1.06 118.68 126.38 3hyh s LEU 118 Ca 0.41 -1.34 0.19 0.00 -0.22 0.00 0.00 54.13 53.17 3hyh s LEU 118 Cb -0.24 -1.96 0.14 0.00 0.50 0.00 0.00 46.19 44.63 3hyh s LEU 118 CO 0.29 -0.46 1.40 1.88 -1.32 0.00 0.00 176.35 178.13 3hyh h TYR 119 N 8.36 0.00 -1.15 5.38 0.05 -0.97 -3.47 116.97 125.17 3hyh h TYR 119 Ca -0.23 0.00 0.23 0.00 0.05 0.00 0.00 58.73 58.78 3hyh h TYR 119 Cb 1.09 0.00 -0.26 0.00 1.01 0.00 0.00 36.73 38.57 3hyh h TYR 119 CO 0.60 0.25 0.90 0.34 -1.05 0.00 0.00 178.16 179.20 3hyh s ASP 120 N -6.16 -0.08 -0.19 3.88 3.68 -1.17 -5.01 116.67 111.60 3hyh s ASP 120 Ca 0.04 0.08 0.00 0.00 2.13 0.00 0.00 52.55 54.80 3hyh s ASP 120 Cb 0.07 0.07 0.05 0.00 -1.45 0.00 0.00 42.92 41.66 3hyh s ASP 120 CO 0.73 -0.09 -0.08 -0.69 0.13 0.00 0.00 175.17 175.18 3hyh s VAL 121 N -1.23 1.44 -0.27 1.11 1.01 -1.26 -0.15 120.40 121.05 3hyh s VAL 121 Ca 0.08 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 61.02 3hyh s VAL 121 Cb -0.01 -1.59 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 3hyh s VAL 121 CO -0.06 0.10 0.19 -0.63 0.00 0.00 0.00 175.10 174.71 3hyh s ILE 122 N 1.48 5.32 -0.00 2.22 1.01 0.81 -4.93 121.20 127.10 3hyh s ILE 122 Ca -0.01 0.19 0.07 0.00 0.00 0.00 0.00 60.65 60.90 3hyh s ILE 122 Cb -0.16 -3.53 -0.02 0.00 0.01 0.00 0.00 42.46 38.76 3hyh s ILE 122 CO -0.08 0.27 -0.21 -0.54 0.00 0.00 0.00 174.94 174.38 3hyh s LYS 123 N 1.60 1.64 0.20 2.79 1.02 -1.26 0.73 119.74 126.46 3hyh s LYS 123 Ca 0.08 -0.80 0.04 0.00 0.02 0.00 0.00 55.97 55.31 3hyh s LYS 123 Cb -0.15 -1.63 -0.02 0.00 -0.52 0.00 0.00 37.83 35.51 3hyh s LYS 123 CO 0.09 0.44 0.15 -1.13 -0.92 0.00 0.00 175.35 173.98 3hyh n SER 124 N 2.40 -0.13 0.27 2.83 3.41 -0.42 -5.01 113.62 116.97 3hyh n SER 124 Ca -0.16 -2.28 0.14 0.00 -0.26 0.00 0.00 58.87 56.31 3hyh n SER 124 Cb 0.53 0.91 0.78 0.00 -0.26 0.00 0.00 64.21 66.17 3hyh n SER 124 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 3hyh h LYS 125 N 0.00 0.00 0.00 4.33 2.10 -2.04 -3.30 116.57 117.66 3hyh h LYS 125 Ca -0.15 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.18 3hyh h LYS 125 Cb 0.70 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 31.98 3hyh h LYS 125 CO 0.22 0.09 -2.21 -0.25 -2.00 0.00 0.00 179.45 175.30 3hyh n ASP 126 N -3.52 1.64 -4.05 7.07 8.00 -1.26 -4.92 116.55 119.52 3hyh n ASP 126 Ca -0.02 -0.07 -0.09 0.00 0.71 0.00 0.00 54.79 55.33 3hyh n ASP 126 Cb 0.23 0.22 -0.11 0.00 -0.02 0.00 0.00 41.12 41.44 3hyh n ASP 126 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 3hyh s GLU 127 N -2.42 0.49 -0.14 -1.24 -1.05 -1.24 -1.15 118.70 111.95 3hyh s GLU 127 Ca -0.20 -0.92 0.01 0.00 -0.15 0.00 0.00 54.97 53.71 3hyh s GLU 127 Cb 0.06 0.08 -0.00 0.00 -0.44 0.00 0.00 34.13 33.83 3hyh s GLU 127 CO 0.59 -0.06 -0.17 0.42 0.95 0.00 0.00 175.26 176.99 3hyh s ILE 128 N -2.58 2.59 -0.27 1.83 1.01 0.59 -1.30 121.20 123.07 3hyh s ILE 128 Ca -0.04 -0.81 0.00 0.00 0.00 0.00 0.00 60.65 59.80 3hyh s ILE 128 Cb -0.02 -2.07 0.05 0.00 0.01 0.00 0.00 42.46 40.43 3hyh s ILE 128 CO -0.05 0.53 -0.06 -0.63 0.00 0.00 0.00 174.94 174.73 3hyh s ILE 129 N 0.62 2.64 -0.10 2.92 1.01 0.22 -0.05 121.20 128.46 3hyh s ILE 129 Ca -0.09 -1.37 -0.23 0.00 0.00 0.00 0.00 60.65 58.95 3hyh s ILE 129 Cb -0.16 -2.47 -0.03 0.00 0.01 0.00 0.00 42.46 39.80 3hyh s ILE 129 CO 0.03 0.01 0.69 -0.04 0.00 0.00 0.00 174.94 175.63 3hyh s MET 130 N 1.22 4.38 -0.45 2.79 -1.94 -0.76 -0.14 119.30 124.39 3hyh s MET 130 Ca -0.05 0.82 -0.11 0.00 -1.71 0.00 0.00 55.69 54.64 3hyh s MET 130 Cb -0.19 -3.48 0.09 0.00 2.01 0.00 0.00 34.83 33.26 3hyh s MET 130 CO -0.04 -0.03 0.33 0.08 -0.01 0.00 0.00 175.02 175.35 3hyh s VAL 131 N 1.14 4.51 -0.03 -6.03 1.01 0.79 -1.39 120.40 120.40 3hyh s VAL 131 Ca 0.35 -1.44 0.07 0.00 0.00 0.00 0.00 61.98 60.96 3hyh s VAL 131 Cb -0.17 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 3hyh s VAL 131 CO 0.16 -0.62 -0.23 -0.63 0.00 0.00 0.00 175.10 173.78 3hyh s ILE 132 N 1.47 2.34 0.34 2.22 1.01 -0.53 -0.22 121.20 127.83 3hyh s ILE 132 Ca 0.04 -1.00 -0.28 0.00 0.00 0.00 0.00 60.65 59.40 3hyh s ILE 132 Cb -0.25 -1.84 -0.12 0.00 0.01 0.00 0.00 42.46 40.26 3hyh s ILE 132 CO 0.02 0.58 1.39 -1.84 0.00 0.00 0.00 174.94 175.09 3hyh n GLU 133 N 2.42 2.33 -2.77 2.79 0.28 -0.22 0.24 120.64 125.71 3hyh n GLU 133 Ca -0.16 0.82 -0.41 0.00 -0.16 0.00 0.00 57.16 57.24 3hyh n GLU 133 Cb 0.51 -2.47 -0.04 0.00 1.43 0.00 0.00 31.44 30.88 3hyh n GLU 133 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 3hyh s TYR 134 N -0.90 3.67 -0.20 -1.84 5.04 -0.93 -4.56 117.35 117.64 3hyh s TYR 134 Ca 0.57 1.64 -0.03 0.00 -2.44 0.00 0.00 57.07 56.81 3hyh s TYR 134 Cb -0.54 -3.06 0.06 0.00 0.35 0.00 0.00 41.96 38.78 3hyh s TYR 134 CO 0.60 0.05 0.05 0.00 -1.34 0.00 0.00 175.55 174.91 3hyh s ALA 135 N 0.79 0.90 -1.87 3.97 0.00 -1.26 -4.88 121.76 119.40 3hyh s ALA 135 Ca 0.49 -0.69 0.30 0.00 0.00 0.00 0.00 51.96 52.06 3hyh s ALA 135 Cb -0.21 -1.19 1.49 0.00 0.00 0.00 0.00 23.12 23.22 3hyh s ALA 135 CO 0.27 -1.23 2.01 0.41 0.00 0.00 0.00 175.76 177.22 3hyh n GLY 136 N 5.09 -0.87 3.23 0.00 0.00 -1.24 -4.72 105.19 106.69 3hyh n GLY 136 Ca -0.08 -0.25 -0.16 0.00 0.00 0.00 0.00 46.02 45.53 3hyh n GLY 136 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hyh s ASN 137 N -2.24 1.80 0.05 1.61 0.01 -1.15 -5.02 114.94 109.99 3hyh s ASN 137 Ca 0.37 -0.90 -0.06 0.00 -0.71 0.00 0.00 52.86 51.57 3hyh s ASN 137 Cb 0.21 -0.03 -0.05 0.00 0.41 0.00 0.00 41.25 41.79 3hyh s ASN 137 CO 0.41 -0.25 0.30 -1.61 -1.51 0.00 0.00 177.10 174.45 3hyh s GLU 138 N -3.15 3.60 0.44 -0.60 2.02 -1.26 0.05 118.70 119.80 3hyh s GLU 138 Ca 0.11 -0.08 0.10 0.00 0.02 0.00 0.00 54.97 55.13 3hyh s GLU 138 Cb -0.01 -3.02 1.00 0.00 0.10 0.00 0.00 34.13 32.19 3hyh s GLU 138 CO 0.01 0.60 2.08 1.25 0.02 0.00 0.00 175.26 179.22 3hyh h LEU 139 N 3.63 0.32 -0.39 1.80 5.85 -0.52 -2.89 115.31 123.11 3hyh h LEU 139 Ca -0.49 -0.01 -0.17 0.00 0.84 0.00 0.00 57.88 58.06 3hyh h LEU 139 Cb 1.19 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 3hyh h LEU 139 CO 0.68 0.23 -0.81 -0.26 -0.34 0.00 0.00 178.44 177.95 3hyh h PHE 140 N 0.38 0.04 -0.04 1.25 -1.00 -1.78 -2.06 116.94 113.74 3hyh h PHE 140 Ca 0.12 -0.02 -0.10 0.00 2.81 0.00 0.00 57.97 60.77 3hyh h PHE 140 Cb 0.02 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.57 3hyh h PHE 140 CO -0.00 0.82 -0.46 0.38 -1.61 0.00 0.00 178.31 177.45 3hyh h ASP 141 N 0.02 0.10 -0.60 2.17 -0.00 -1.89 -0.32 116.42 115.91 3hyh h ASP 141 Ca -0.01 -0.05 0.00 0.00 -0.00 0.00 0.00 57.03 56.97 3hyh h ASP 141 Cb 1.42 -0.03 -0.03 0.00 -0.00 0.00 0.00 39.33 40.69 3hyh h ASP 141 CO 0.11 0.55 0.39 0.22 -0.00 0.00 0.00 179.24 180.50 3hyh h TYR 142 N 0.08 0.76 -0.06 4.15 3.20 -1.33 -0.18 116.97 123.59 3hyh h TYR 142 Ca 0.00 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 3hyh h TYR 142 Cb 0.84 -0.26 -0.00 0.00 1.54 0.00 0.00 36.73 38.85 3hyh h TYR 142 CO 0.01 0.49 0.02 0.82 -1.64 0.00 0.00 178.16 177.86 3hyh h ILE 143 N 0.81 1.14 -0.25 1.81 2.04 -1.05 -2.92 117.51 119.09 3hyh h ILE 143 Ca 0.22 -0.43 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 3hyh h ILE 143 Cb -0.07 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 3hyh h ILE 143 CO -0.05 0.12 -0.01 0.58 0.00 0.00 0.00 178.15 178.80 3hyh h VAL 144 N -0.07 1.26 0.00 1.67 2.07 -1.03 -3.28 116.25 116.87 3hyh h VAL 144 Ca 0.02 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.61 3hyh h VAL 144 Cb 0.17 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 3hyh h VAL 144 CO -0.00 0.29 0.00 1.56 0.02 0.00 0.00 177.57 179.44 3hyh h GLN 145 N 0.22 0.00 -6.24 1.57 4.20 -1.10 -3.45 115.11 110.31 3hyh h GLN 145 Ca 0.07 0.00 -0.47 0.00 0.06 0.00 0.00 58.65 58.31 3hyh h GLN 145 Cb 0.43 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.19 3hyh h GLN 145 CO 0.01 0.00 -0.36 1.03 -0.67 0.00 0.00 178.83 178.84 3hyh s ARG 146 N -3.47 2.66 1.17 1.46 0.52 -1.10 -5.09 118.95 115.10 3hyh s ARG 146 Ca 0.04 -1.40 -0.17 0.00 -0.52 0.00 0.00 55.73 53.67 3hyh s ARG 146 Cb 0.07 -2.50 0.27 0.00 0.52 0.00 0.00 34.95 33.32 3hyh s ARG 146 CO 0.59 -0.15 1.07 -0.51 0.02 0.00 0.00 175.30 176.33 3hyh s ASP 147 N -4.16 1.10 -0.19 0.23 1.11 -1.26 -4.89 116.67 108.61 3hyh s ASP 147 Ca 0.48 0.93 -0.34 0.00 0.18 0.00 0.00 52.55 53.80 3hyh s ASP 147 Cb -0.05 -1.40 -0.11 0.00 1.07 0.00 0.00 42.92 42.43 3hyh s ASP 147 CO 0.29 -4.05 2.00 1.17 1.18 0.00 0.00 175.17 175.76 3hyh n LYS 148 N -4.75 1.78 -2.64 8.23 4.81 -1.26 -4.90 118.16 119.42 3hyh n LYS 148 Ca 0.09 0.60 -0.34 0.00 -0.87 0.00 0.00 58.31 57.79 3hyh n LYS 148 Cb 0.58 -2.63 -0.05 0.00 0.02 0.00 0.00 35.03 32.95 3hyh n LYS 148 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3hyh s MET 149 N 4.91 4.03 0.68 1.64 0.23 -1.26 -5.01 119.30 124.53 3hyh s MET 149 Ca 0.99 1.31 -0.17 0.00 -1.03 0.00 0.00 55.69 56.79 3hyh s MET 149 Cb -0.72 -2.22 0.01 0.00 -1.53 0.00 0.00 34.83 30.36 3hyh s MET 149 CO 0.50 -0.22 1.21 -1.13 -2.03 0.00 0.00 175.02 173.35 3hyh n SER 150 N -0.65 1.57 -0.21 -1.18 3.41 -1.26 -4.80 113.62 110.50 3hyh n SER 150 Ca 0.08 0.76 0.06 0.00 -0.26 0.00 0.00 58.87 59.51 3hyh n SER 150 Cb 0.52 -1.52 0.34 0.00 -0.26 0.00 0.00 64.21 63.29 3hyh n SER 150 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3hyh h GLU 151 N 0.16 0.77 -0.80 4.33 4.81 -1.95 -1.37 114.58 120.52 3hyh h GLU 151 Ca -0.49 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 58.65 3hyh h GLU 151 Cb 1.33 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 30.50 3hyh h GLU 151 CO 0.51 0.51 0.34 1.96 -0.73 0.00 0.00 179.01 181.60 3hyh h GLN 152 N 0.80 1.17 -0.09 1.92 7.50 -1.99 -0.32 115.11 124.10 3hyh h GLN 152 Ca 0.33 -0.20 -0.03 0.00 0.50 0.00 0.00 58.65 59.26 3hyh h GLN 152 Cb 0.28 -0.20 -0.00 0.00 0.05 0.00 0.00 27.48 27.61 3hyh h GLN 152 CO -0.12 0.93 -0.06 1.49 -1.50 0.00 0.00 178.83 179.58 3hyh h GLU 153 N 1.14 0.20 -0.56 1.46 4.81 -1.74 -1.85 114.58 118.04 3hyh h GLU 153 Ca 0.27 -0.09 0.01 0.00 -0.13 0.00 0.00 59.36 59.41 3hyh h GLU 153 Cb 0.18 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 3hyh h GLU 153 CO -0.03 0.59 0.37 0.00 -0.73 0.00 0.00 179.01 179.21 3hyh h ALA 154 N 0.61 0.71 -0.50 2.92 0.00 -1.21 -2.59 119.26 119.21 3hyh h ALA 154 Ca 0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3hyh h ALA 154 Cb 0.53 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3hyh h ALA 154 CO 0.02 0.13 0.27 -0.09 0.00 0.00 0.00 179.25 179.58 3hyh h ARG 155 N 0.75 0.71 -0.27 0.00 2.43 -1.03 0.36 114.38 117.34 3hyh h ARG 155 Ca 0.21 -0.09 0.06 0.00 -0.81 0.00 0.00 59.98 59.35 3hyh h ARG 155 Cb -0.07 -0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 29.27 3hyh h ARG 155 CO -0.05 0.57 -0.24 -0.09 -1.51 0.00 0.00 179.97 178.64 3hyh h ARG 156 N 0.67 -0.23 -0.52 0.20 2.43 -1.10 0.64 114.38 116.47 3hyh h ARG 156 Ca 0.18 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.36 3hyh h ARG 156 Cb 0.07 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 3hyh h ARG 156 CO -0.03 -0.15 0.31 0.74 -1.51 0.00 0.00 179.97 179.33 3hyh h PHE 157 N -0.24 0.69 -0.95 2.20 0.04 -1.25 -3.00 116.94 114.43 3hyh h PHE 157 Ca 0.14 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.90 3hyh h PHE 157 Cb 0.46 -0.23 -0.05 0.00 2.20 0.00 0.00 35.95 38.34 3hyh h PHE 157 CO -0.41 0.48 0.58 0.35 -0.60 0.00 0.00 178.31 178.71 3hyh h PHE 158 N 0.70 1.26 -0.55 -0.55 3.57 -0.22 -1.35 116.94 119.78 3hyh h PHE 158 Ca 0.19 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 3hyh h PHE 158 Cb -0.00 -0.41 -0.03 0.00 2.79 0.00 0.00 35.95 38.30 3hyh h PHE 158 CO -0.02 0.83 0.31 1.96 -2.23 0.00 0.00 178.31 179.16 3hyh h GLN 159 N 1.31 0.77 -0.51 1.11 4.20 -0.81 -1.12 115.11 120.06 3hyh h GLN 159 Ca 0.34 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.97 3hyh h GLN 159 Cb -0.06 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.54 3hyh h GLN 159 CO -0.06 0.58 0.32 1.96 -0.67 0.00 0.00 178.83 180.95 3hyh h GLN 160 N 0.74 0.68 0.04 1.46 4.20 -1.30 -0.78 115.11 120.14 3hyh h GLN 160 Ca 0.20 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.85 3hyh h GLN 160 Cb 0.03 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.66 3hyh h GLN 160 CO -0.03 0.48 -0.02 0.82 -0.67 0.00 0.00 178.83 179.41 3hyh h ILE 161 N 0.68 1.09 -0.82 2.54 2.04 -0.99 -2.61 117.51 119.43 3hyh h ILE 161 Ca 0.18 -0.39 -0.03 0.00 1.00 0.00 0.00 64.86 65.62 3hyh h ILE 161 Cb -0.04 1.35 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 3hyh h ILE 161 CO -0.04 0.10 0.39 0.40 0.00 0.00 0.00 178.15 179.00 3hyh h ILE 162 N -0.22 1.26 -0.48 -0.67 1.08 -1.14 -1.03 117.51 116.30 3hyh h ILE 162 Ca -0.01 -0.73 0.03 0.00 -0.39 0.00 0.00 64.86 63.76 3hyh h ILE 162 Cb 0.20 0.21 -0.03 0.00 -3.07 0.00 0.00 36.82 34.13 3hyh h ILE 162 CO 0.01 0.31 0.28 -1.28 -0.69 0.00 0.00 178.15 176.78 3hyh h SER 163 N 1.18 0.44 -0.48 1.72 0.87 -1.11 -0.10 113.55 116.07 3hyh h SER 163 Ca 0.28 0.01 -0.09 0.00 -1.23 0.00 0.00 61.79 60.77 3hyh h SER 163 Cb 0.13 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 3hyh h SER 163 CO -0.03 0.31 -0.03 0.00 -0.53 0.00 0.00 176.83 176.54 3hyh h ALA 164 N 1.22 0.65 -0.39 6.23 0.00 -1.04 -2.09 119.26 123.85 3hyh h ALA 164 Ca 0.20 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3hyh h ALA 164 Cb 0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3hyh h ALA 164 CO -0.10 0.49 0.07 0.28 0.00 0.00 0.00 179.25 179.99 3hyh h VAL 165 N 0.73 1.24 -0.54 0.00 2.07 -1.02 -1.70 116.25 117.03 3hyh h VAL 165 Ca 0.13 -0.84 0.09 0.00 0.82 0.00 0.00 66.70 66.89 3hyh h VAL 165 Cb 0.56 1.04 -0.07 0.00 -1.52 0.00 0.00 31.29 31.30 3hyh h VAL 165 CO 0.03 0.29 0.16 -0.08 0.02 0.00 0.00 177.57 177.99 3hyh h GLU 166 N 0.49 0.30 -0.97 1.57 4.22 -0.87 0.29 114.58 119.61 3hyh h GLU 166 Ca 0.12 -0.02 0.04 0.00 0.08 0.00 0.00 59.36 59.58 3hyh h GLU 166 Cb 0.35 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.48 3hyh h GLU 166 CO 0.01 0.20 0.63 -0.92 -2.18 0.00 0.00 179.01 176.75 3hyh h TYR 167 N 0.31 1.18 -0.09 0.92 5.03 -1.21 0.01 116.97 123.14 3hyh h TYR 167 Ca 0.27 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.60 3hyh h TYR 167 Cb 0.34 -0.39 -0.00 0.00 1.55 0.00 0.00 36.73 38.23 3hyh h TYR 167 CO -0.20 0.67 0.03 0.00 -1.32 0.00 0.00 178.16 177.34 3hyh h HIS 169 N -0.05 0.00 -0.22 0.00 3.86 -0.74 0.16 115.15 118.16 3hyh h HIS 169 Ca 0.03 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.14 3hyh h HIS 169 Cb 0.22 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 3hyh h HIS 169 CO -0.00 0.18 -0.28 -0.09 0.86 0.00 0.00 177.93 178.59 3hyh h ARG 170 N 0.00 0.44 -0.64 2.45 2.43 -0.82 -2.26 114.38 115.99 3hyh h ARG 170 Ca -0.00 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 3hyh h ARG 170 Cb 0.33 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 3hyh h ARG 170 CO 0.02 0.68 0.00 0.72 -1.51 0.00 0.00 179.97 179.89 3hyh n HIS 171 N -4.10 1.74 -2.16 2.20 8.25 -0.85 -4.92 115.22 115.38 3hyh n HIS 171 Ca -0.01 -0.61 -0.15 0.00 -0.26 0.00 0.00 57.72 56.69 3hyh n HIS 171 Cb 0.42 -0.42 -0.02 0.00 1.12 0.00 0.00 29.99 31.09 3hyh n HIS 171 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3hyh n LYS 172 N 0.62 -1.17 -3.83 -0.41 5.02 -0.85 -5.00 118.16 112.54 3hyh n LYS 172 Ca 0.24 0.77 -0.36 0.00 -2.02 0.00 0.00 58.31 56.94 3hyh n LYS 172 Cb 1.03 -5.07 -0.13 0.00 -0.02 0.00 0.00 35.03 30.84 3hyh n LYS 172 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3hyh s ILE 173 N -2.72 3.67 -0.17 -0.18 1.01 0.51 -4.98 121.20 118.34 3hyh s ILE 173 Ca 0.00 -0.66 -0.16 0.00 0.00 0.00 0.00 60.65 59.83 3hyh s ILE 173 Cb 0.00 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.60 3hyh s ILE 173 CO 0.00 0.20 0.39 -0.69 0.00 0.00 0.00 174.94 174.84 3hyh s VAL 174 N 1.47 5.22 -0.04 2.92 1.01 -1.26 -2.82 120.40 126.89 3hyh s VAL 174 Ca 0.03 0.73 -0.17 0.00 0.00 0.00 0.00 61.98 62.58 3hyh s VAL 174 Cb -0.16 -3.73 -0.11 0.00 0.00 0.00 0.00 36.38 32.38 3hyh s VAL 174 CO 0.00 0.30 0.70 -0.74 0.00 0.00 0.00 175.10 175.35 3hyh h HIS 175 N 7.08 -0.37 0.00 5.22 2.76 -1.95 -3.47 115.15 124.41 3hyh h HIS 175 Ca -0.38 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 57.78 3hyh h HIS 175 Cb 1.17 0.12 0.00 0.00 1.55 0.00 0.00 27.41 30.25 3hyh h HIS 175 CO 0.65 -0.10 0.00 0.54 -1.30 0.00 0.00 177.93 177.72 3hyh n ARG 176 N -5.05 -0.07 -1.36 5.26 1.74 -1.26 -4.79 116.66 111.13 3hyh n ARG 176 Ca -0.07 0.02 0.03 0.00 -0.77 0.00 0.00 57.85 57.06 3hyh n ARG 176 Cb 0.22 -3.05 0.01 0.00 -1.02 0.00 0.00 32.46 28.62 3hyh n ARG 176 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3hyh n ASP 177 N -0.03 0.74 -4.61 0.55 8.00 -1.26 -5.01 116.55 114.93 3hyh n ASP 177 Ca 0.00 -1.99 -0.43 0.00 0.71 0.00 0.00 54.79 53.08 3hyh n ASP 177 Cb 0.02 -0.24 -0.02 0.00 -0.02 0.00 0.00 41.12 40.85 3hyh n ASP 177 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3hyh s LEU 178 N 0.00 3.72 0.00 0.64 1.43 -1.26 -4.87 118.68 118.34 3hyh s LEU 178 Ca 0.28 0.97 -0.03 0.00 -1.03 0.00 0.00 54.13 54.32 3hyh s LEU 178 Cb 0.32 -3.54 0.01 0.00 0.03 0.00 0.00 46.19 43.01 3hyh s LEU 178 CO -0.14 -1.26 0.35 2.29 0.23 0.00 0.00 176.35 177.83 3hyh n LYS 179 N 7.71 0.51 0.13 1.70 2.85 -1.26 -4.88 118.16 124.92 3hyh n LYS 179 Ca 0.15 -1.74 -0.14 0.00 -1.05 0.00 0.00 58.31 55.53 3hyh n LYS 179 Cb 0.47 1.76 -0.08 0.00 -0.65 0.00 0.00 35.03 36.53 3hyh n LYS 179 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 177.40 176.00 3hyh h PRO 180 N 0.00 -0.30 0.00 -1.58 0.11 -1.94 -3.16 132.00 125.13 3hyh h PRO 180 Ca -0.18 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.95 3hyh h PRO 180 Cb 0.78 0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.95 3hyh h PRO 180 CO 0.25 -0.07 0.00 0.93 -0.21 0.00 0.00 178.00 178.90 3hyh h GLU 181 N -0.49 0.00 0.00 1.05 3.07 -1.99 -3.01 114.58 113.22 3hyh h GLU 181 Ca -0.03 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3hyh h GLU 181 Cb 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.28 3hyh h GLU 181 CO 0.05 0.00 -1.54 0.27 -1.40 0.00 0.00 179.01 176.39 3hyh n ASN 182 N -2.53 0.43 -4.23 1.42 6.94 -1.21 -4.71 115.26 111.37 3hyh n ASN 182 Ca -0.00 -0.38 -0.42 0.00 -0.02 0.00 0.00 54.58 53.75 3hyh n ASN 182 Cb 0.16 1.52 -0.06 0.00 -2.36 0.00 0.00 39.78 39.03 3hyh n ASN 182 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3hyh s LEU 183 N -3.92 5.96 0.52 -4.53 1.43 -1.14 -2.00 118.68 115.01 3hyh s LEU 183 Ca -0.01 -2.27 -0.05 0.00 -1.03 0.00 0.00 54.13 50.77 3hyh s LEU 183 Cb 0.15 -2.06 -0.01 0.00 0.03 0.00 0.00 46.19 44.29 3hyh s LEU 183 CO 0.89 -0.63 0.82 -0.76 0.23 0.00 0.00 176.35 176.89 3hyh s LEU 184 N 0.82 3.47 -0.06 1.79 1.43 -0.45 0.14 118.68 125.81 3hyh s LEU 184 Ca 0.11 0.74 0.02 0.00 -1.03 0.00 0.00 54.13 53.97 3hyh s LEU 184 Cb -0.22 -3.63 0.01 0.00 0.03 0.00 0.00 46.19 42.39 3hyh s LEU 184 CO -0.03 -0.80 -0.12 -0.76 0.23 0.00 0.00 176.35 174.87 3hyh s LEU 185 N -4.82 1.67 0.00 1.79 1.43 0.11 -0.67 118.68 118.19 3hyh s LEU 185 Ca 0.50 -0.30 -0.03 0.00 -1.03 0.00 0.00 54.13 53.27 3hyh s LEU 185 Cb -0.10 -0.82 0.11 0.00 0.03 0.00 0.00 46.19 45.41 3hyh s LEU 185 CO 0.44 0.04 0.73 -0.90 0.23 0.00 0.00 176.35 176.89 3hyh n ASP 186 N 3.75 0.68 0.18 2.29 3.85 -0.55 -2.92 116.55 123.84 3hyh n ASP 186 Ca -0.22 -1.65 0.13 0.00 -0.71 0.00 0.00 54.79 52.34 3hyh n ASP 186 Cb 0.52 -0.50 0.63 0.00 -1.35 0.00 0.00 41.12 40.42 3hyh n ASP 186 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 3hyh h GLU 187 N 0.00 0.00 -0.55 0.11 4.11 -1.90 0.13 114.58 116.48 3hyh h GLU 187 Ca -0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.19 3hyh h GLU 187 Cb 0.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.07 3hyh h GLU 187 CO 0.23 0.00 0.00 0.72 0.07 0.00 0.00 179.01 180.03 3hyh n HIS 188 N -2.42 1.52 -3.43 2.06 8.25 -1.26 -4.95 115.22 114.98 3hyh n HIS 188 Ca -0.00 -0.68 -0.25 0.00 -0.26 0.00 0.00 57.72 56.53 3hyh n HIS 188 Cb 0.14 -0.32 0.04 0.00 1.12 0.00 0.00 29.99 30.96 3hyh n HIS 188 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3hyh n LEU 189 N 0.70 -2.64 -4.71 2.41 4.77 0.03 -4.98 117.00 112.58 3hyh n LEU 189 Ca 0.25 -0.48 -0.37 0.00 -0.03 0.00 0.00 56.01 55.38 3hyh n LEU 189 Cb 0.95 -2.75 -0.07 0.00 -2.33 0.00 0.00 43.42 39.22 3hyh n LEU 189 CO 0.24 0.38 -0.00 0.20 -1.33 0.00 0.00 177.39 176.88 3hyh s ASN 190 N -3.00 6.41 0.36 -1.43 0.01 -1.26 -4.86 114.94 111.18 3hyh s ASN 190 Ca 0.48 0.48 -0.28 0.00 -0.71 0.00 0.00 52.86 52.83 3hyh s ASN 190 Cb -0.23 -2.19 -0.10 0.00 0.41 0.00 0.00 41.25 39.15 3hyh s ASN 190 CO 0.59 0.06 1.32 -0.69 -1.51 0.00 0.00 177.10 176.87 3hyh s VAL 191 N 0.70 2.62 -0.16 1.60 1.01 -1.26 -1.49 120.40 123.43 3hyh s VAL 191 Ca 0.16 0.60 -0.02 0.00 0.00 0.00 0.00 61.98 62.72 3hyh s VAL 191 Cb -0.13 -3.37 0.05 0.00 0.00 0.00 0.00 36.38 32.92 3hyh s VAL 191 CO 0.05 0.12 0.02 -0.54 0.00 0.00 0.00 175.10 174.75 3hyh s LYS 192 N -1.99 0.67 0.01 2.72 -0.14 0.16 -4.35 119.74 116.81 3hyh s LYS 192 Ca 0.52 -0.27 -0.30 0.00 -1.36 0.00 0.00 55.97 54.56 3hyh s LYS 192 Cb -0.40 -1.79 -0.07 0.00 -1.68 0.00 0.00 37.83 33.90 3hyh s LYS 192 CO 0.52 -0.54 1.64 0.42 -0.76 0.00 0.00 175.35 176.64 3hyh s ILE 193 N 1.89 3.34 -0.31 2.17 1.01 0.10 -1.34 121.20 128.06 3hyh s ILE 193 Ca 0.01 0.62 0.09 0.00 0.00 0.00 0.00 60.65 61.38 3hyh s ILE 193 Cb -0.16 -3.40 -0.12 0.00 0.01 0.00 0.00 42.46 38.80 3hyh s ILE 193 CO -0.07 -0.03 0.34 0.00 0.00 0.00 0.00 174.94 175.18 3hyh n ALA 194 N 6.33 2.96 0.07 9.38 0.00 -0.85 -0.65 120.51 137.74 3hyh n ALA 194 Ca 0.16 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3hyh n ALA 194 Cb 0.42 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.53 3hyh n ALA 194 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3hyh n ASP 195 N -1.41 0.60 0.00 0.00 5.75 -1.26 -4.92 116.55 115.30 3hyh n ASP 195 Ca 0.01 0.21 0.00 0.00 -0.01 0.00 0.00 54.79 55.00 3hyh n ASP 195 Cb 0.18 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 3hyh n ASP 195 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 3hyh n PHE 196 N -3.34 0.00 0.00 2.11 3.01 -1.26 -4.39 117.46 113.58 3hyh n PHE 196 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3hyh n PHE 196 Cb 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 39.46 3hyh n PHE 196 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hyh n GLY 197 N -2.64 4.51 3.29 1.37 0.00 -1.26 -4.97 105.19 105.49 3hyh n GLY 197 Ca 0.00 -0.72 -0.45 0.00 0.00 0.00 0.00 46.02 44.85 3hyh n GLY 197 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hyh s LEU 198 N 0.00 6.04 0.00 0.99 1.43 -1.26 -5.16 118.68 120.72 3hyh s LEU 198 Ca 0.00 -1.80 0.00 0.00 -1.03 0.00 0.00 54.13 51.30 3hyh s LEU 198 Cb 0.00 -2.16 0.00 0.00 0.03 0.00 0.00 46.19 44.06 3hyh s LEU 198 CO 0.00 -0.81 0.00 -1.20 0.23 0.00 0.00 176.35 174.57 3hyh n SER 199 N 5.16 0.00 0.04 2.29 7.64 -1.26 -4.82 113.62 122.67 3hyh n SER 199 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.76 3hyh n SER 199 Cb 0.40 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 3hyh n SER 199 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3hyh n PRO 215 N 0.00 0.00 0.21 1.43 -0.04 -1.26 -5.16 135.00 130.18 3hyh n PRO 215 Ca 0.00 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.60 3hyh n PRO 215 Cb 0.00 0.00 0.75 0.00 -0.04 0.00 0.00 33.50 34.21 3hyh n PRO 215 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 3hyh h ASN 216 N 0.00 0.00 -0.01 3.54 2.35 -1.99 -2.62 115.58 116.85 3hyh h ASN 216 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3hyh h ASN 216 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3hyh h ASN 216 CO 0.00 0.00 -0.37 -1.22 -1.65 0.00 0.00 177.43 174.19 3hyh n TYR 217 N -2.46 0.00 -2.99 1.19 4.01 -1.26 -4.83 117.16 110.82 3hyh n TYR 217 Ca -0.02 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.32 3hyh n TYR 217 Cb 0.04 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.03 3hyh n TYR 217 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3hyh s ALA 218 N -1.89 3.34 0.70 -0.72 0.00 -0.99 -4.00 121.76 118.21 3hyh s ALA 218 Ca 0.11 0.24 -0.16 0.00 0.00 0.00 0.00 51.96 52.15 3hyh s ALA 218 Cb 0.12 -3.00 0.02 0.00 0.00 0.00 0.00 23.12 20.27 3hyh s ALA 218 CO 0.41 -0.02 1.21 0.00 0.00 0.00 0.00 175.76 177.36 3hyh s ALA 219 N 0.37 2.21 0.32 0.00 0.00 -1.26 -4.83 121.76 118.57 3hyh s ALA 219 Ca 0.39 0.90 0.08 0.00 0.00 0.00 0.00 51.96 53.33 3hyh s ALA 219 Cb -0.19 -3.46 0.79 0.00 0.00 0.00 0.00 23.12 20.25 3hyh s ALA 219 CO 0.21 -1.73 1.79 -1.35 0.00 0.00 0.00 175.76 174.68 3hyh h PRO 220 N -0.07 0.70 0.00 0.00 0.11 -1.92 -1.03 132.00 129.79 3hyh h PRO 220 Ca -0.48 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 3hyh h PRO 220 Cb 1.30 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3hyh h PRO 220 CO 0.51 0.46 -0.12 1.05 -0.21 0.00 0.00 178.00 179.69 3hyh h GLU 221 N 0.72 0.00 -0.11 1.05 9.09 -1.88 -2.58 114.58 120.88 3hyh h GLU 221 Ca 0.56 0.00 -0.16 0.00 0.05 0.00 0.00 59.36 59.81 3hyh h GLU 221 Cb 0.93 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.02 3hyh h GLU 221 CO -0.34 0.12 -0.61 0.28 0.05 0.00 0.00 179.01 178.51 3hyh h VAL 222 N 0.00 1.36 0.09 -1.06 2.07 -1.51 -3.33 116.25 113.87 3hyh h VAL 222 Ca -0.00 -1.94 -0.00 0.00 0.82 0.00 0.00 66.70 65.57 3hyh h VAL 222 Cb 0.86 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 3hyh h VAL 222 CO 0.02 0.58 -0.04 0.40 0.02 0.00 0.00 177.57 178.55 3hyh h ILE 223 N 0.27 1.16 -4.36 4.57 2.04 -1.22 -3.45 117.51 116.52 3hyh h ILE 223 Ca -0.01 -1.15 -0.51 0.00 1.00 0.00 0.00 64.86 64.19 3hyh h ILE 223 Cb 1.13 1.87 0.07 0.00 -0.74 0.00 0.00 36.82 39.15 3hyh h ILE 223 CO 0.10 0.27 0.41 -0.94 0.00 0.00 0.00 178.15 177.99 3hyh s SER 224 N -5.58 5.99 0.03 1.72 1.04 -0.99 -5.01 113.70 110.90 3hyh s SER 224 Ca -0.15 1.45 -0.23 0.00 0.48 0.00 0.00 55.95 57.50 3hyh s SER 224 Cb 0.01 -2.45 -0.16 0.00 0.10 0.00 0.00 66.02 63.52 3hyh s SER 224 CO 0.60 -1.03 1.46 1.23 0.98 0.00 0.00 173.24 176.47 3hyh h GLY 225 N -0.43 0.12 -0.85 7.32 0.00 -1.87 -3.46 103.07 103.90 3hyh h GLY 225 Ca -0.44 -0.09 -0.45 0.00 0.00 0.00 0.00 47.33 46.35 3hyh h GLY 225 CO 0.61 0.08 0.20 0.54 0.00 0.00 0.00 176.54 177.97 3hyh s LYS 226 N -4.96 0.43 0.13 4.80 3.01 -1.26 -4.80 119.74 117.09 3hyh s LYS 226 Ca -0.15 0.44 0.00 0.00 -1.01 0.00 0.00 55.97 55.25 3hyh s LYS 226 Cb 0.04 -1.74 0.00 0.00 -1.01 0.00 0.00 37.83 35.12 3hyh s LYS 226 CO 0.69 -2.72 0.00 1.28 0.51 0.00 0.00 175.35 175.11 3hyh n LEU 227 N -4.15 -5.32 -4.77 3.17 4.77 -1.26 -4.80 117.00 104.63 3hyh n LEU 227 Ca 0.05 2.50 -0.40 0.00 -0.03 0.00 0.00 56.01 58.13 3hyh n LEU 227 Cb 0.58 -2.71 0.01 0.00 -2.33 0.00 0.00 43.42 38.97 3hyh n LEU 227 CO 0.57 -1.61 1.09 -0.47 -1.33 0.00 0.00 177.39 175.65 3hyh s TYR 228 N -0.42 2.47 -0.94 -1.77 6.14 -1.26 -4.82 117.35 116.75 3hyh s TYR 228 Ca 0.00 1.23 -0.16 0.00 0.64 0.00 0.00 57.07 58.78 3hyh s TYR 228 Cb 0.00 -3.97 0.17 0.00 0.42 0.00 0.00 41.96 38.59 3hyh s TYR 228 CO 0.00 -3.01 1.05 0.00 0.64 0.00 0.00 175.55 174.22 3hyh s ALA 229 N -1.18 3.75 0.77 3.97 0.00 -1.26 -4.98 121.76 122.83 3hyh s ALA 229 Ca 0.59 -3.08 0.00 0.00 0.00 0.00 0.00 51.96 49.47 3hyh s ALA 229 Cb -0.45 -3.86 0.00 0.00 0.00 0.00 0.00 23.12 18.81 3hyh s ALA 229 CO 0.59 -2.69 0.00 0.41 0.00 0.00 0.00 175.76 174.07 3hyh n GLY 230 N 4.68 -0.28 0.40 0.00 0.00 -1.26 -4.89 105.19 103.84 3hyh n GLY 230 Ca 0.22 -1.75 0.22 0.00 0.00 0.00 0.00 46.02 44.70 3hyh n GLY 230 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hyh h PRO 231 N 0.00 0.00 0.00 1.61 0.11 -1.97 -2.40 132.00 129.34 3hyh h PRO 231 Ca 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 3hyh h PRO 231 Cb 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 3hyh h PRO 231 CO 0.00 0.00 -0.02 0.93 -0.21 0.00 0.00 178.00 178.70 3hyh h GLU 232 N 0.00 0.00 -0.11 1.05 3.07 -1.94 -2.49 114.58 114.16 3hyh h GLU 232 Ca 0.25 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.99 3hyh h GLU 232 Cb 1.14 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.04 3hyh h GLU 232 CO -0.00 0.02 -0.46 -0.39 -1.40 0.00 0.00 179.01 176.78 3hyh h VAL 233 N 0.00 1.33 -0.07 3.13 -1.51 -1.77 -2.13 116.25 115.23 3hyh h VAL 233 Ca -0.00 -1.65 -0.13 0.00 -1.23 0.00 0.00 66.70 63.69 3hyh h VAL 233 Cb 0.20 1.75 -0.01 0.00 -2.13 0.00 0.00 31.29 31.10 3hyh h VAL 233 CO 0.00 0.49 -0.55 0.44 -1.23 0.00 0.00 177.57 176.73 3hyh h ASP 234 N 0.23 0.24 -0.22 4.19 3.32 -1.65 -2.06 116.42 120.47 3hyh h ASP 234 Ca 0.01 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 3hyh h ASP 234 Cb 0.90 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 3hyh h ASP 234 CO 0.07 0.74 0.13 0.58 -1.72 0.00 0.00 179.24 179.04 3hyh h VAL 235 N 0.17 1.10 -0.20 -1.35 2.07 -1.45 -0.34 116.25 116.24 3hyh h VAL 235 Ca 0.00 -0.24 0.02 0.00 0.82 0.00 0.00 66.70 67.30 3hyh h VAL 235 Cb 1.02 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 3hyh h VAL 235 CO 0.08 0.09 0.04 -0.25 0.02 0.00 0.00 177.57 177.56 3hyh h TRP 236 N 0.26 0.07 -0.73 1.57 2.91 -1.29 -0.80 115.95 117.94 3hyh h TRP 236 Ca 0.08 0.01 0.02 0.00 1.13 0.00 0.00 58.89 60.12 3hyh h TRP 236 Cb 0.04 -0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 28.64 3hyh h TRP 236 CO -0.04 0.03 0.48 0.77 -1.03 0.00 0.00 178.44 178.64 3hyh h SER 237 N 0.12 0.81 -0.25 2.65 0.02 -1.27 -1.69 113.55 113.94 3hyh h SER 237 Ca 0.09 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 3hyh h SER 237 Cb 0.08 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 3hyh h SER 237 CO -0.11 0.58 0.11 0.00 -1.14 0.00 0.00 176.83 176.26 3hyh h GLY 239 N 0.61 1.11 0.92 0.00 0.00 -0.29 -0.42 103.07 105.00 3hyh h GLY 239 Ca 0.11 -0.78 -0.03 0.00 0.00 0.00 0.00 47.33 46.62 3hyh h GLY 239 CO -0.01 0.72 0.10 -2.08 0.00 0.00 0.00 176.54 175.27 3hyh h VAL 240 N 0.92 1.22 -0.30 4.60 2.07 -1.03 -1.46 116.25 122.27 3hyh h VAL 240 Ca 0.17 -0.74 0.02 0.00 0.82 0.00 0.00 66.70 66.98 3hyh h VAL 240 Cb 0.50 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 3hyh h VAL 240 CO 0.02 0.25 0.15 0.40 0.02 0.00 0.00 177.57 178.41 3hyh h ILE 241 N 0.44 0.99 -0.64 4.57 2.04 -0.96 -0.38 117.51 123.56 3hyh h ILE 241 Ca 0.11 -0.11 0.01 0.00 1.00 0.00 0.00 64.86 65.87 3hyh h ILE 241 Cb 0.29 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 3hyh h ILE 241 CO -0.00 0.06 0.42 0.25 0.00 0.00 0.00 178.15 178.88 3hyh h LEU 242 N 0.31 0.73 -0.44 1.44 5.85 -1.05 -1.81 115.31 120.35 3hyh h LEU 242 Ca 0.12 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.88 3hyh h LEU 242 Cb 0.04 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.84 3hyh h LEU 242 CO -0.09 0.53 0.17 0.22 -0.34 0.00 0.00 178.44 178.93 3hyh h TYR 243 N 0.86 0.30 -0.23 1.25 3.20 -0.82 -1.66 116.97 119.87 3hyh h TYR 243 Ca 0.23 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.12 3hyh h TYR 243 Cb -0.10 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 3hyh h TYR 243 CO -0.03 0.12 0.12 0.28 -1.64 0.00 0.00 178.16 177.00 3hyh h VAL 244 N 0.34 1.13 -0.98 1.81 2.07 -0.72 0.13 116.25 120.03 3hyh h VAL 244 Ca 0.20 -0.36 0.01 0.00 0.82 0.00 0.00 66.70 67.37 3hyh h VAL 244 Cb 0.18 0.95 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 3hyh h VAL 244 CO -0.20 0.13 0.65 0.24 0.02 0.00 0.00 177.57 178.41 3hyh h MET 245 N 0.25 1.28 0.19 1.57 2.86 -1.10 0.17 114.93 120.15 3hyh h MET 245 Ca 0.08 -0.08 -0.31 0.00 -2.06 0.00 0.00 59.70 57.34 3hyh h MET 245 Cb 0.10 -0.29 0.02 0.00 0.06 0.00 0.00 31.60 31.49 3hyh h MET 245 CO -0.01 0.85 -1.37 -0.07 1.06 0.00 0.00 176.91 177.37 3hyh h LEU 246 N 1.32 0.62 -0.01 1.22 4.07 -1.05 -3.36 115.31 118.13 3hyh h LEU 246 Ca 0.36 -0.67 0.00 0.00 0.08 0.00 0.00 57.88 57.65 3hyh h LEU 246 Cb -0.15 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 41.39 3hyh h LEU 246 CO -0.08 1.53 -0.71 0.00 -1.08 0.00 0.00 178.44 178.10 3hyh n ARG 248 N -1.34 -4.70 -3.46 0.00 1.74 0.60 -4.96 116.66 104.54 3hyh n ARG 248 Ca 0.03 0.52 -0.14 0.00 -0.77 0.00 0.00 57.85 57.49 3hyh n ARG 248 Cb 0.23 -5.36 -0.04 0.00 -1.02 0.00 0.00 32.46 26.28 3hyh n ARG 248 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 3hyh s ARG 249 N -6.72 1.17 0.16 5.56 1.70 -1.26 -5.09 118.95 114.48 3hyh s ARG 249 Ca 0.70 -0.19 -0.28 0.00 -0.47 0.00 0.00 55.73 55.48 3hyh s ARG 249 Cb -0.36 0.55 -0.07 0.00 -0.57 0.00 0.00 34.95 34.49 3hyh s ARG 249 CO 0.86 -0.46 0.88 -0.51 -1.08 0.00 0.00 175.30 174.99 3hyh s LEU 250 N -2.15 4.57 0.25 -1.89 1.43 -1.26 -3.89 118.68 115.74 3hyh s LEU 250 Ca -0.03 1.77 0.01 0.00 -1.03 0.00 0.00 54.13 54.85 3hyh s LEU 250 Cb -0.01 -3.48 0.31 0.00 0.03 0.00 0.00 46.19 43.05 3hyh s LEU 250 CO -0.04 0.09 1.64 1.55 0.23 0.00 0.00 176.35 179.82 3hyh h PRO 251 N 4.80 0.46 -0.05 1.29 0.13 -1.91 -3.31 132.00 133.40 3hyh h PRO 251 Ca -0.45 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 3hyh h PRO 251 Cb 1.21 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3hyh h PRO 251 CO 0.69 0.77 0.00 1.19 -0.23 0.00 0.00 178.00 180.42 3hyh n PHE 252 N -4.04 0.04 -1.89 1.56 3.01 -1.26 -4.52 117.46 110.36 3hyh n PHE 252 Ca -0.01 -0.03 -0.41 0.00 1.01 0.00 0.00 57.45 58.01 3hyh n PHE 252 Cb 0.49 -0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.96 3hyh n PHE 252 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 3hyh s ASP 253 N -1.34 6.36 -0.05 4.37 2.15 -1.25 -4.63 116.67 122.28 3hyh s ASP 253 Ca 0.20 2.92 -0.17 0.00 0.43 0.00 0.00 52.55 55.93 3hyh s ASP 253 Cb 0.14 -2.66 0.03 0.00 -0.30 0.00 0.00 42.92 40.13 3hyh s ASP 253 CO 0.21 -0.85 0.39 -0.62 -0.17 0.00 0.00 175.17 174.13 3hyh s ASP 254 N -0.32 -0.32 0.56 -0.34 -1.08 -1.26 -4.95 116.67 108.97 3hyh s ASP 254 Ca 0.53 0.36 0.33 0.00 -0.52 0.00 0.00 52.55 53.26 3hyh s ASP 254 Cb -0.44 0.47 1.66 0.00 -1.46 0.00 0.00 42.92 43.15 3hyh s ASP 254 CO 0.59 -0.41 2.12 -0.33 0.52 0.00 0.00 175.17 177.66 3hyh h GLU 255 N 4.09 0.00 -5.21 4.34 5.08 -2.00 -3.42 114.58 117.45 3hyh h GLU 255 Ca -0.29 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.46 3hyh h GLU 255 Cb 1.17 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.28 3hyh h GLU 255 CO 0.36 0.06 -0.29 0.45 -1.00 0.00 0.00 179.01 178.59 3hyh s SER 256 N -5.79 6.27 0.15 1.42 0.15 -1.26 -5.00 113.70 109.64 3hyh s SER 256 Ca -0.02 0.31 -0.23 0.00 0.70 0.00 0.00 55.95 56.71 3hyh s SER 256 Cb 0.12 -2.19 0.02 0.00 -1.71 0.00 0.00 66.02 62.26 3hyh s SER 256 CO 0.53 -0.09 1.62 0.40 1.20 0.00 0.00 173.24 176.90 3hyh h ILE 257 N 5.20 0.36 -0.65 6.45 1.08 -2.00 -0.89 117.51 127.06 3hyh h ILE 257 Ca -0.34 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.10 3hyh h ILE 257 Cb 1.17 0.36 -0.03 0.00 -3.07 0.00 0.00 36.82 35.25 3hyh h ILE 257 CO 0.66 0.00 0.32 -0.65 -0.69 0.00 0.00 178.15 177.79 3hyh h PRO 258 N -0.28 0.92 -0.23 2.37 0.11 -1.97 -2.17 132.00 130.76 3hyh h PRO 258 Ca 0.13 -0.12 -0.05 0.00 0.11 0.00 0.00 66.00 66.07 3hyh h PRO 258 Cb 0.48 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 3hyh h PRO 258 CO -0.39 0.71 -0.06 0.28 -0.21 0.00 0.00 178.00 178.33 3hyh h VAL 259 N 0.92 1.29 -0.17 3.15 2.07 -1.79 -1.67 116.25 120.04 3hyh h VAL 259 Ca 0.23 -1.07 0.05 0.00 0.82 0.00 0.00 66.70 66.73 3hyh h VAL 259 Cb 0.09 1.51 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 3hyh h VAL 259 CO -0.03 0.33 -0.16 0.25 0.02 0.00 0.00 177.57 177.98 3hyh h LEU 260 N 0.18 -0.51 -0.98 2.57 5.85 -1.04 0.12 115.31 121.51 3hyh h LEU 260 Ca 0.06 0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 3hyh h LEU 260 Cb 0.52 0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.77 3hyh h LEU 260 CO 0.02 -0.21 0.20 -0.26 -0.34 0.00 0.00 178.44 177.86 3hyh h PHE 261 N -0.18 0.97 -0.47 1.25 0.04 -1.33 -1.52 116.94 115.69 3hyh h PHE 261 Ca 0.11 -0.08 -0.04 0.00 2.80 0.00 0.00 57.97 60.76 3hyh h PHE 261 Cb 0.34 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 38.19 3hyh h PHE 261 CO -0.30 0.77 0.14 -0.22 -0.60 0.00 0.00 178.31 178.11 3hyh h LYS 262 N 0.92 0.74 -0.55 1.51 3.64 -1.01 -1.37 116.57 120.45 3hyh h LYS 262 Ca 0.21 -0.16 0.02 0.00 -1.27 0.00 0.00 60.65 59.44 3hyh h LYS 262 Cb 0.25 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 3hyh h LYS 262 CO -0.01 0.71 0.34 -0.91 -2.27 0.00 0.00 179.45 177.31 3hyh h ASN 263 N 0.63 0.56 -0.09 4.20 2.35 -0.29 -0.77 115.58 122.16 3hyh h ASN 263 Ca 0.15 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.88 3hyh h ASN 263 Cb 0.28 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.53 3hyh h ASN 263 CO -0.00 0.39 -0.02 0.40 -1.65 0.00 0.00 177.43 176.55 3hyh h ILE 264 N 0.67 1.29 -0.18 2.81 2.04 -1.20 0.33 117.51 123.27 3hyh h ILE 264 Ca 0.22 -0.93 -0.05 0.00 1.00 0.00 0.00 64.86 65.10 3hyh h ILE 264 Cb -0.00 1.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 3hyh h ILE 264 CO -0.08 0.26 -0.13 0.77 0.00 0.00 0.00 178.15 178.97 3hyh h SER 265 N -0.14 0.28 0.10 1.72 4.64 -1.12 -1.79 113.55 117.23 3hyh h SER 265 Ca 0.02 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3hyh h SER 265 Cb 0.42 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 3hyh h SER 265 CO 0.01 0.43 -0.19 0.59 -0.87 0.00 0.00 176.83 176.80 3hyh n ASN 266 N -4.26 1.51 -3.59 4.97 5.03 -0.31 -4.96 115.26 113.66 3hyh n ASN 266 Ca -0.00 -1.28 -0.23 0.00 0.87 0.00 0.00 54.58 53.94 3hyh n ASN 266 Cb 0.28 0.13 0.08 0.00 -1.02 0.00 0.00 39.78 39.25 3hyh n ASN 266 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3hyh n GLY 267 N 1.30 -0.52 3.58 7.41 0.00 0.02 -4.94 105.19 112.04 3hyh n GLY 267 Ca 0.14 0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.97 3hyh n GLY 267 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hyh s VAL 268 N -3.33 4.85 0.23 1.61 1.01 0.95 -5.01 120.40 120.70 3hyh s VAL 268 Ca 0.50 0.73 -0.22 0.00 0.00 0.00 0.00 61.98 62.99 3hyh s VAL 268 Cb -0.22 -4.11 0.04 0.00 0.00 0.00 0.00 36.38 32.09 3hyh s VAL 268 CO 0.74 -0.32 0.72 -0.72 0.00 0.00 0.00 175.10 175.52 3hyh s TYR 269 N 2.81 -0.27 -0.13 5.22 -0.85 -1.26 -4.69 117.35 118.18 3hyh s TYR 269 Ca 0.27 -0.10 -0.02 0.00 -0.52 0.00 0.00 57.07 56.70 3hyh s TYR 269 Cb -0.14 0.66 -0.03 0.00 0.38 0.00 0.00 41.96 42.83 3hyh s TYR 269 CO 0.15 -1.08 -0.05 0.99 -1.52 0.00 0.00 175.55 174.04 3hyh s THR 270 N -3.79 3.79 -0.49 -3.49 2.01 -1.26 -5.08 115.64 107.33 3hyh s THR 270 Ca 0.08 -0.41 -0.18 0.00 0.31 0.00 0.00 61.69 61.49 3hyh s THR 270 Cb -0.04 -2.63 0.06 0.00 0.01 0.00 0.00 72.50 69.90 3hyh s THR 270 CO 0.01 0.53 0.55 -0.22 -0.69 0.00 0.00 174.62 174.80 3hyh s LEU 271 N 0.03 5.09 0.57 4.42 2.96 -1.26 -5.00 118.68 125.50 3hyh s LEU 271 Ca -0.00 -0.96 -0.21 0.00 -0.22 0.00 0.00 54.13 52.74 3hyh s LEU 271 Cb -0.13 -2.39 -0.04 0.00 0.50 0.00 0.00 46.19 44.13 3hyh s LEU 271 CO 0.03 -0.79 1.32 -2.65 -1.32 0.00 0.00 176.35 172.93 3hyh n PRO 272 N 5.88 1.51 0.26 0.98 -0.02 -1.26 -4.91 135.00 137.44 3hyh n PRO 272 Ca -0.08 0.56 0.15 0.00 -2.02 0.00 0.00 63.50 62.11 3hyh n PRO 272 Cb 0.45 -2.54 0.68 0.00 -0.02 0.00 0.00 33.50 32.07 3hyh n PRO 272 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3hyh h LYS 273 N 1.17 0.00 0.00 -0.52 1.57 -2.02 -2.90 116.57 113.88 3hyh h LYS 273 Ca -0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 3hyh h LYS 273 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 3hyh h LYS 273 CO 0.56 0.09 0.00 1.97 -0.57 0.00 0.00 179.45 181.50 3hyh n PHE 274 N -3.28 0.00 -2.36 -1.35 1.16 -1.26 -4.80 117.46 105.56 3hyh n PHE 274 Ca -0.00 0.00 -0.41 0.00 -1.87 0.00 0.00 57.45 55.17 3hyh n PHE 274 Cb 0.31 -0.39 -0.03 0.00 -1.61 0.00 0.00 39.48 37.76 3hyh n PHE 274 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 3hyh s LEU 275 N -2.77 4.47 0.65 5.98 1.02 -1.10 -5.01 118.68 121.91 3hyh s LEU 275 Ca 0.14 2.29 -0.18 0.00 0.02 0.00 0.00 54.13 56.40 3hyh s LEU 275 Cb 0.13 -3.61 -0.02 0.00 0.02 0.00 0.00 46.19 42.70 3hyh s LEU 275 CO 0.31 -0.35 1.09 -1.54 0.02 0.00 0.00 176.35 175.89 3hyh n SER 276 N 2.13 1.21 -0.36 2.29 3.41 -1.26 -4.78 113.62 116.27 3hyh n SER 276 Ca 0.03 0.78 0.07 0.00 -0.26 0.00 0.00 58.87 59.49 3hyh n SER 276 Cb 0.44 -1.46 0.23 0.00 -0.26 0.00 0.00 64.21 63.17 3hyh n SER 276 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3hyh h PRO 277 N 0.32 0.96 -0.31 4.33 0.11 -1.96 -1.43 132.00 134.02 3hyh h PRO 277 Ca -0.49 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.51 3hyh h PRO 277 Cb 1.35 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3hyh h PRO 277 CO 0.51 0.63 -0.00 0.78 -0.21 0.00 0.00 178.00 179.71 3hyh h GLY 278 N 0.99 0.59 0.84 -0.55 0.00 -1.99 -0.87 103.07 102.08 3hyh h GLY 278 Ca 0.49 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 47.36 3hyh h GLY 278 CO -0.26 0.40 0.03 0.00 0.00 0.00 0.00 176.54 176.71 3hyh h ALA 279 N 0.84 0.27 -0.72 3.60 0.00 -1.87 -2.26 119.26 119.11 3hyh h ALA 279 Ca 0.09 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 3hyh h ALA 279 Cb 0.44 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3hyh h ALA 279 CO 0.02 -0.06 0.32 0.00 0.00 0.00 0.00 179.25 179.54 3hyh h ALA 280 N 0.83 0.94 -0.54 0.00 0.00 -1.30 -1.18 119.26 118.01 3hyh h ALA 280 Ca 0.06 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3hyh h ALA 280 Cb 0.32 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3hyh h ALA 280 CO 0.00 0.52 0.20 0.78 0.00 0.00 0.00 179.25 180.76 3hyh h GLY 281 N 1.02 0.89 0.80 0.00 0.00 -1.11 -0.91 103.07 103.75 3hyh h GLY 281 Ca 0.25 -0.50 -0.00 0.00 0.00 0.00 0.00 47.33 47.08 3hyh h GLY 281 CO -0.03 0.47 -0.00 -2.00 0.00 0.00 0.00 176.54 174.98 3hyh h LEU 282 N 0.75 -0.00 -0.64 3.11 5.85 -1.29 -2.96 115.31 120.12 3hyh h LEU 282 Ca 0.18 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.75 3hyh h LEU 282 Cb 0.22 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 3hyh h LEU 282 CO -0.01 0.19 0.38 0.40 -0.34 0.00 0.00 178.44 179.06 3hyh h ILE 283 N -0.20 1.03 -0.93 4.05 2.04 -1.14 -2.50 117.51 119.86 3hyh h ILE 283 Ca -0.00 -0.25 0.08 0.00 1.00 0.00 0.00 64.86 65.69 3hyh h ILE 283 Cb 0.20 0.24 -0.06 0.00 -0.74 0.00 0.00 36.82 36.46 3hyh h ILE 283 CO 0.00 0.13 0.60 0.50 0.00 0.00 0.00 178.15 179.38 3hyh h LYS 284 N 0.72 0.98 0.00 2.37 3.64 -1.18 -1.66 116.57 121.45 3hyh h LYS 284 Ca 0.27 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 3hyh h LYS 284 Cb 0.09 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 3hyh h LYS 284 CO -0.14 0.65 0.00 0.00 -2.27 0.00 0.00 179.45 177.69 3hyh h ARG 285 N 1.01 0.00 0.17 1.90 3.08 -1.29 -3.29 114.38 115.96 3hyh h ARG 285 Ca 0.41 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 60.12 3hyh h ARG 285 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 3hyh h ARG 285 CO -0.17 0.00 -1.73 0.52 -1.07 0.00 0.00 179.97 177.52 3hyh h MET 286 N 0.00 0.36 -2.94 0.04 2.86 -0.92 -0.94 114.93 113.39 3hyh h MET 286 Ca 0.00 -0.61 -0.77 0.00 -2.06 0.00 0.00 59.70 56.26 3hyh h MET 286 Cb 0.84 0.23 -0.18 0.00 0.06 0.00 0.00 31.60 32.55 3hyh h MET 286 CO 0.00 1.27 1.83 1.28 1.06 0.00 0.00 176.91 182.35 3hyh n LEU 287 N -3.55 7.20 -4.20 1.22 4.77 -0.71 -4.23 117.00 117.49 3hyh n LEU 287 Ca -0.23 -4.92 -0.32 0.00 -0.03 0.00 0.00 56.01 50.51 3hyh n LEU 287 Cb 1.07 -1.36 -0.17 0.00 -2.33 0.00 0.00 43.42 40.63 3hyh n LEU 287 CO 0.51 1.75 -0.55 -0.63 -1.33 0.00 0.00 177.39 177.14 3hyh s ILE 288 N -1.28 2.02 0.03 -0.08 1.01 -1.26 -4.97 121.20 116.68 3hyh s ILE 288 Ca 0.43 -0.99 -0.27 0.00 0.00 0.00 0.00 60.65 59.82 3hyh s ILE 288 Cb 0.13 -1.75 -0.17 0.00 0.01 0.00 0.00 42.46 40.68 3hyh s ILE 288 CO -0.03 0.55 1.38 0.58 0.00 0.00 0.00 174.94 177.43 3hyh h VAL 289 N 5.74 0.56 -2.17 2.92 2.07 -1.92 -3.39 116.25 120.07 3hyh h VAL 289 Ca -0.22 -0.34 -0.56 0.00 0.82 0.00 0.00 66.70 66.40 3hyh h VAL 289 Cb 1.23 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 3hyh h VAL 289 CO 0.48 0.06 1.43 0.21 0.02 0.00 0.00 177.57 179.78 3hyh s ASN 290 N -4.84 5.44 0.65 0.57 3.04 -1.26 -4.84 114.94 113.70 3hyh s ASN 290 Ca -0.15 1.46 0.43 0.00 0.04 0.00 0.00 52.86 54.64 3hyh s ASN 290 Cb 0.03 -2.52 2.28 0.00 -1.54 0.00 0.00 41.25 39.50 3hyh s ASN 290 CO 0.57 -2.04 2.32 1.55 -3.04 0.00 0.00 177.10 176.46 3hyh h PRO 291 N 14.97 0.00 -0.33 0.43 0.13 -1.97 -1.70 132.00 143.53 3hyh h PRO 291 Ca -0.35 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.73 3hyh h PRO 291 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 3hyh h PRO 291 CO 1.03 0.00 0.00 1.25 -0.23 0.00 0.00 178.00 180.05 3hyh h LEU 292 N 0.00 0.47 -1.57 1.56 5.85 -1.92 -2.62 115.31 117.08 3hyh h LEU 292 Ca -0.00 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.64 3hyh h LEU 292 Cb 0.08 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 40.99 3hyh h LEU 292 CO 0.00 0.54 -0.01 0.59 -0.34 0.00 0.00 178.44 179.22 3hyh n ASN 293 N -4.29 2.45 -4.74 1.25 3.02 -0.64 -4.92 115.26 107.39 3hyh n ASN 293 Ca 0.01 -1.81 -0.41 0.00 -0.03 0.00 0.00 54.58 52.35 3hyh n ASN 293 Cb 0.24 0.01 -0.04 0.00 -0.61 0.00 0.00 39.78 39.38 3hyh n ASN 293 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3hyh s ARG 294 N -2.01 4.59 0.55 3.52 3.52 -0.99 -4.97 118.95 123.16 3hyh s ARG 294 Ca 0.31 1.77 -0.21 0.00 -0.13 0.00 0.00 55.73 57.47 3hyh s ARG 294 Cb 0.20 -3.25 -0.05 0.00 -1.56 0.00 0.00 34.95 30.30 3hyh s ARG 294 CO 0.32 0.08 1.34 1.51 -0.81 0.00 0.00 175.30 177.74 3hyh n ILE 295 N 2.08 3.88 -2.91 4.11 3.06 -0.36 -5.01 119.36 124.22 3hyh n ILE 295 Ca 0.02 -0.50 -0.25 0.00 -2.50 0.00 0.00 62.75 59.52 3hyh n ILE 295 Cb 0.45 -1.64 0.01 0.00 0.54 0.00 0.00 39.64 39.00 3hyh n ILE 295 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3hyh s SER 296 N -0.94 6.01 0.23 9.51 1.04 -1.26 -4.92 113.70 123.37 3hyh s SER 296 Ca 0.72 0.55 -0.06 0.00 0.48 0.00 0.00 55.95 57.64 3hyh s SER 296 Cb -0.42 -1.86 0.36 0.00 0.10 0.00 0.00 66.02 64.21 3hyh s SER 296 CO 0.49 -0.63 1.79 0.40 0.98 0.00 0.00 173.24 176.27 3hyh h ILE 297 N 0.36 0.86 -0.37 -1.02 1.08 -1.95 -0.54 117.51 115.92 3hyh h ILE 297 Ca -0.47 -0.22 -0.15 0.00 -0.39 0.00 0.00 64.86 63.63 3hyh h ILE 297 Cb 1.23 0.15 -0.01 0.00 -3.07 0.00 0.00 36.82 35.12 3hyh h ILE 297 CO 0.60 0.12 -0.36 0.45 -0.69 0.00 0.00 178.15 178.27 3hyh h HIS 298 N 0.65 1.01 -0.81 1.37 3.86 -1.99 -1.65 115.15 117.59 3hyh h HIS 298 Ca 0.37 -0.29 -0.00 0.00 -1.16 0.00 0.00 60.37 59.29 3hyh h HIS 298 Cb 0.38 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 28.59 3hyh h HIS 298 CO -0.09 1.08 0.49 0.93 0.86 0.00 0.00 177.93 181.20 3hyh h GLU 299 N 0.70 1.10 -0.27 2.45 5.08 -1.87 -2.82 114.58 118.96 3hyh h GLU 299 Ca 0.07 -0.10 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 3hyh h GLU 299 Cb 0.93 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 29.91 3hyh h GLU 299 CO 0.09 0.77 0.03 0.82 -1.00 0.00 0.00 179.01 179.72 3hyh h ILE 300 N 1.12 0.85 0.00 3.13 2.04 -0.72 -1.64 117.51 122.28 3hyh h ILE 300 Ca 0.29 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 66.11 3hyh h ILE 300 Cb -0.05 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 3hyh h ILE 300 CO -0.06 0.02 0.00 0.23 0.00 0.00 0.00 178.15 178.35 3hyh n MET 301 N -5.12 0.17 0.00 2.37 2.81 -0.66 -0.69 117.12 116.01 3hyh n MET 301 Ca -0.01 0.54 0.10 0.00 -1.81 0.00 0.00 57.70 56.53 3hyh n MET 301 Cb 0.13 -1.93 -0.02 0.00 -0.71 0.00 0.00 33.22 30.68 3hyh n MET 301 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 3hyh n GLN 302 N -2.28 1.15 -1.87 0.03 1.13 -0.73 -4.72 117.38 110.09 3hyh n GLN 302 Ca 0.00 -0.84 -0.41 0.00 -1.94 0.00 0.00 57.00 53.81 3hyh n GLN 302 Cb 0.13 -1.45 -0.01 0.00 0.11 0.00 0.00 30.24 29.02 3hyh n GLN 302 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3hyh s ASP 303 N -2.46 6.46 0.17 1.08 -1.08 0.13 -4.92 116.67 116.05 3hyh s ASP 303 Ca 0.16 2.91 -0.15 0.00 -0.52 0.00 0.00 52.55 54.96 3hyh s ASP 303 Cb 0.17 -2.65 0.08 0.00 -1.46 0.00 0.00 42.92 39.06 3hyh s ASP 303 CO 0.59 -0.81 1.79 0.44 0.52 0.00 0.00 175.17 177.70 3hyh h ASP 304 N 3.87 0.38 -0.38 -0.34 3.32 -1.92 -1.33 116.42 120.02 3hyh h ASP 304 Ca -0.49 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.54 3hyh h ASP 304 Cb 1.23 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.70 3hyh h ASP 304 CO 0.71 0.27 0.09 -0.25 -1.72 0.00 0.00 179.24 178.33 3hyh h TRP 305 N 0.49 0.63 -0.93 4.55 7.01 -1.92 -3.01 115.95 122.78 3hyh h TRP 305 Ca 0.19 -0.08 0.06 0.00 2.11 0.00 0.00 58.89 61.17 3hyh h TRP 305 Cb 0.06 -0.18 -0.06 0.00 -2.10 0.00 0.00 29.16 26.87 3hyh h TRP 305 CO -0.08 0.63 0.59 0.35 -2.79 0.00 0.00 178.44 177.13 3hyh h PHE 306 N 0.46 1.09 0.00 2.65 3.57 -1.78 -2.93 116.94 120.01 3hyh h PHE 306 Ca 0.12 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.61 3hyh h PHE 306 Cb 0.31 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 3hyh h PHE 306 CO 0.02 0.56 -0.20 0.87 -2.23 0.00 0.00 178.31 177.33 3hyh h LYS 307 N 1.07 0.00 -6.22 1.11 1.57 -1.11 -3.43 116.57 109.57 3hyh h LYS 307 Ca 0.40 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 58.52 3hyh h LYS 307 Cb 0.17 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.49 3hyh h LYS 307 CO -0.17 0.20 1.04 0.28 -0.57 0.00 0.00 179.45 180.22 3hyh n VAL 308 N -3.47 0.48 -2.47 0.50 0.31 -1.11 -1.62 118.33 110.95 3hyh n VAL 308 Ca -0.01 -0.09 -0.19 0.00 -0.01 0.00 0.00 64.34 64.04 3hyh n VAL 308 Cb 0.37 -1.63 -0.01 0.00 -0.91 0.00 0.00 33.84 31.66 3hyh n VAL 308 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3hyh n ASP 309 N 6.26 -5.48 -4.66 4.52 8.00 -1.26 -4.92 116.55 119.01 3hyh n ASP 309 Ca 0.25 0.01 -0.43 0.00 0.71 0.00 0.00 54.79 55.33 3hyh n ASP 309 Cb 0.23 -4.56 -0.02 0.00 -0.02 0.00 0.00 41.12 36.74 3hyh n ASP 309 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3hyh s LEU 310 N -6.00 4.26 0.19 0.64 2.96 -0.64 -4.97 118.68 115.13 3hyh s LEU 310 Ca 0.03 1.99 -0.30 0.00 -0.22 0.00 0.00 54.13 55.63 3hyh s LEU 310 Cb -0.01 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 43.05 3hyh s LEU 310 CO 0.03 -0.83 1.36 -2.84 -1.32 0.00 0.00 176.35 172.75 3hyh s PRO 311 N 3.58 4.34 0.36 0.98 0.02 -1.26 -4.92 135.00 138.10 3hyh s PRO 311 Ca 0.64 2.12 0.11 0.00 0.02 0.00 0.00 61.00 63.89 3hyh s PRO 311 Cb -0.28 -3.18 0.88 0.00 0.02 0.00 0.00 34.50 31.94 3hyh s PRO 311 CO 0.23 -0.33 1.83 0.93 -0.33 0.00 0.00 177.00 179.33 3hyh h GLU 312 N 5.59 0.60 0.00 5.54 5.08 -2.02 -0.25 114.58 129.13 3hyh h GLU 312 Ca -0.44 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 3hyh h GLU 312 Cb 1.21 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.33 3hyh h GLU 312 CO 0.79 0.40 0.00 0.10 -1.00 0.00 0.00 179.01 179.30 3hyh h TYR 313 N 0.62 0.00 0.00 4.33 -0.00 -2.03 -2.76 116.97 117.13 3hyh h TYR 313 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.23 3hyh h TYR 313 Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.68 3hyh h TYR 313 CO -0.00 0.00 -0.40 -0.07 -0.00 0.00 0.00 178.16 177.69 3hyh h LEU 314 N 0.00 0.00 0.00 0.10 3.38 -1.41 -3.51 115.31 113.87 3hyh h LEU 314 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hyh h LEU 314 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3hyh h LEU 314 CO 0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71