#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hcw s ASN 57 N 0.00 2.22 -0.36 3.42 0.01 -1.26 -5.03 114.94 113.94 3hcw s ASN 57 Ca 0.00 0.49 0.12 0.00 -0.71 0.00 0.00 52.86 52.76 3hcw s ASN 57 Cb 0.00 -0.67 0.45 0.00 0.41 0.00 0.00 41.25 41.44 3hcw s ASN 57 CO 0.00 -3.31 1.06 0.00 -1.51 0.00 0.00 177.10 173.34 3hcw n GLN 58 N -4.19 2.39 0.02 -0.60 1.13 -1.26 -4.84 117.38 110.03 3hcw n GLN 58 Ca 0.13 -3.88 0.11 0.00 -1.94 0.00 0.00 57.00 51.43 3hcw n GLN 58 Cb 0.59 -1.80 -0.02 0.00 0.11 0.00 0.00 30.24 29.13 3hcw n GLN 58 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3hcw n THR 59 N -0.36 0.11 -4.08 5.09 -2.24 -1.26 -4.98 114.28 106.56 3hcw n THR 59 Ca 0.25 -0.21 -0.33 0.00 -2.27 0.00 0.00 64.05 61.49 3hcw n THR 59 Cb 0.77 0.34 -0.01 0.00 -2.10 0.00 0.00 70.33 69.33 3hcw n THR 59 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3hcw n TYR 60 N -1.89 -1.91 -4.29 4.78 4.01 -1.26 -4.90 117.16 111.70 3hcw n TYR 60 Ca 0.02 0.83 -0.18 0.00 -0.16 0.00 0.00 57.90 58.41 3hcw n TYR 60 Cb 0.43 -3.42 -0.14 0.00 -0.31 0.00 0.00 39.34 35.90 3hcw n TYR 60 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 3hcw s LYS 61 N -6.76 0.73 -0.16 -0.72 1.02 -1.26 -0.63 119.74 111.95 3hcw s LYS 61 Ca 0.60 -0.52 -0.00 0.00 0.02 0.00 0.00 55.97 56.07 3hcw s LYS 61 Cb -0.32 -0.68 -0.00 0.00 -0.52 0.00 0.00 37.83 36.31 3hcw s LYS 61 CO 0.89 0.17 -0.14 0.42 -0.92 0.00 0.00 175.35 175.77 3hcw s ILE 62 N -0.60 2.76 -0.08 2.17 -1.09 0.07 -0.56 121.20 123.86 3hcw s ILE 62 Ca 0.00 -0.73 -0.27 0.00 -2.23 0.00 0.00 60.65 57.42 3hcw s ILE 62 Cb -0.06 -2.18 -0.02 0.00 -1.58 0.00 0.00 42.46 38.62 3hcw s ILE 62 CO 0.00 0.50 0.88 -0.83 -1.23 0.00 0.00 174.94 174.27 3hcw s GLY 63 N 0.90 2.51 -0.39 6.18 0.00 0.55 -0.78 107.32 116.30 3hcw s GLY 63 Ca -0.03 0.27 -0.07 0.00 0.00 0.00 0.00 44.72 44.89 3hcw s GLY 63 CO -0.01 1.61 0.19 1.08 0.00 0.00 0.00 173.10 175.97 3hcw s LEU 64 N 1.47 4.87 -0.35 0.66 1.43 -0.38 -1.07 118.68 125.31 3hcw s LEU 64 Ca 0.44 -1.49 -0.27 0.00 -1.03 0.00 0.00 54.13 51.78 3hcw s LEU 64 Cb -0.18 -1.91 0.02 0.00 0.03 0.00 0.00 46.19 44.14 3hcw s LEU 64 CO 0.19 -0.47 1.00 -0.69 0.23 0.00 0.00 176.35 176.62 3hcw s VAL 65 N 1.36 4.53 0.36 -1.59 1.01 -0.70 -1.74 120.40 123.62 3hcw s VAL 65 Ca 0.02 1.44 0.00 0.00 0.00 0.00 0.00 61.98 63.45 3hcw s VAL 65 Cb -0.22 -4.38 -0.03 0.00 0.00 0.00 0.00 36.38 31.75 3hcw s VAL 65 CO 0.01 -0.54 0.56 -0.76 0.00 0.00 0.00 175.10 174.37 3hcw s LEU 66 N 3.62 3.97 0.04 3.92 2.01 -1.26 -1.29 118.68 129.68 3hcw s LEU 66 Ca 0.42 0.43 -0.19 0.00 0.01 0.00 0.00 54.13 54.80 3hcw s LEU 66 Cb -0.12 -3.30 -0.16 0.00 0.01 0.00 0.00 46.19 42.62 3hcw s LEU 66 CO 0.18 -0.34 1.27 0.50 1.01 0.00 0.00 176.35 178.98 3hcw h LYS 67 N 0.71 0.45 -3.03 1.70 3.64 -1.91 -3.49 116.57 114.65 3hcw h LYS 67 Ca -0.49 -0.31 -0.01 0.00 -1.27 0.00 0.00 60.65 58.57 3hcw h LYS 67 Cb 1.22 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.08 3hcw h LYS 67 CO 0.61 0.92 0.26 0.20 -2.27 0.00 0.00 179.45 179.16 3hcw s GLY 68 N -3.71 0.32 0.00 5.01 0.00 -1.26 -4.74 107.32 102.94 3hcw s GLY 68 Ca -0.13 -0.70 0.13 0.00 0.00 0.00 0.00 44.72 44.02 3hcw s GLY 68 CO 0.79 -0.29 0.90 1.44 0.00 0.00 0.00 173.10 175.94 3hcw n SER 69 N -1.26 2.04 -4.50 1.64 7.64 -1.22 -4.67 113.62 113.30 3hcw n SER 69 Ca -0.07 -1.52 -0.37 0.00 1.01 0.00 0.00 58.87 57.91 3hcw n SER 69 Cb 0.60 0.04 0.05 0.00 -1.01 0.00 0.00 64.21 63.89 3hcw n SER 69 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3hcw n GLU 70 N 0.67 0.51 -0.19 1.43 -0.58 -1.26 -4.34 120.64 116.88 3hcw n GLU 70 Ca 0.07 0.21 0.00 0.00 -0.42 0.00 0.00 57.16 57.03 3hcw n GLU 70 Cb 0.32 -1.84 0.10 0.00 -0.57 0.00 0.00 31.44 29.45 3hcw n GLU 70 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 3hcw h GLU 71 N 0.07 0.17 0.00 3.49 4.81 -1.98 0.13 114.58 121.27 3hcw h GLU 71 Ca -0.46 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 3hcw h GLU 71 Cb 1.38 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.72 3hcw h GLU 71 CO 0.46 0.11 0.00 -2.30 -0.73 0.00 0.00 179.01 176.56 3hcw n PRO 72 N -5.21 0.97 -0.09 0.92 -0.02 -1.26 -2.61 135.00 127.71 3hcw n PRO 72 Ca 0.08 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.37 3hcw n PRO 72 Cb 0.33 -1.13 -0.07 0.00 -0.02 0.00 0.00 33.50 32.61 3hcw n PRO 72 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3hcw n ILE 73 N -0.63 1.02 0.43 4.25 5.41 0.26 -3.59 119.36 126.50 3hcw n ILE 73 Ca 0.06 -0.28 0.13 0.00 1.00 0.00 0.00 62.75 63.67 3hcw n ILE 73 Cb 0.03 -1.67 0.47 0.00 -0.71 0.00 0.00 39.64 37.76 3hcw n ILE 73 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 176.55 176.63 3hcw h ARG 74 N -0.58 0.00 -0.01 0.38 0.11 -1.16 -2.58 114.38 110.53 3hcw h ARG 74 Ca -0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.62 3hcw h ARG 74 Cb 1.44 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.52 3hcw h ARG 74 CO -0.26 0.00 -0.49 1.28 0.10 0.00 0.00 179.97 180.61 3hcw n LEU 75 N -2.49 1.87 -4.65 0.08 4.32 -1.07 -4.75 117.00 110.30 3hcw n LEU 75 Ca 0.03 -0.69 -0.43 0.00 -0.02 0.00 0.00 56.01 54.90 3hcw n LEU 75 Cb 0.34 -0.01 -0.03 0.00 -1.62 0.00 0.00 43.42 42.10 3hcw n LEU 75 CO 0.26 0.35 1.31 0.21 -1.22 0.00 0.00 177.39 178.30 3hcw s ASN 76 N -2.51 6.68 0.30 -1.43 3.84 -0.97 -4.88 114.94 115.96 3hcw s ASN 76 Ca 0.18 2.00 0.20 0.00 0.21 0.00 0.00 52.86 55.45 3hcw s ASN 76 Cb 0.18 -2.53 1.08 0.00 -0.55 0.00 0.00 41.25 39.43 3hcw s ASN 76 CO 0.59 -0.95 1.60 -2.65 -2.79 0.00 0.00 177.10 172.90 3hcw n PRO 77 N 7.11 0.13 0.25 0.43 -0.02 -1.26 -1.78 135.00 139.86 3hcw n PRO 77 Ca 0.17 0.63 -0.14 0.00 -2.02 0.00 0.00 63.50 62.14 3hcw n PRO 77 Cb 0.44 -1.94 -0.07 0.00 -0.02 0.00 0.00 33.50 31.90 3hcw n PRO 77 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3hcw h PHE 78 N 0.00 -0.62 -0.47 6.00 3.57 -1.92 -2.51 116.94 120.98 3hcw h PHE 78 Ca 0.00 -0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.35 3hcw h PHE 78 Cb 0.03 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 3hcw h PHE 78 CO 0.00 -0.30 -0.23 1.88 -2.23 0.00 0.00 178.31 177.43 3hcw h TYR 79 N -1.00 1.14 -0.48 0.41 0.05 -1.63 0.33 116.97 115.79 3hcw h TYR 79 Ca -0.07 -0.28 0.08 0.00 0.05 0.00 0.00 58.73 58.51 3hcw h TYR 79 Cb 0.60 -0.26 -0.07 0.00 1.01 0.00 0.00 36.73 38.01 3hcw h TYR 79 CO 0.01 1.11 0.11 0.82 -1.05 0.00 0.00 178.16 179.16 3hcw h ILE 80 N 0.85 0.75 -0.09 -2.88 2.04 -1.45 0.36 117.51 117.08 3hcw h ILE 80 Ca 0.11 -0.08 -0.19 0.00 1.00 0.00 0.00 64.86 65.69 3hcw h ILE 80 Cb 0.82 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 37.38 3hcw h ILE 80 CO 0.07 0.04 -0.75 0.78 0.00 0.00 0.00 178.15 178.29 3hcw h ASN 81 N 0.24 0.58 0.05 1.72 2.35 -1.28 -1.68 115.58 117.56 3hcw h ASN 81 Ca 0.24 -0.38 -0.00 0.00 -0.55 0.00 0.00 56.30 55.60 3hcw h ASN 81 Cb 0.31 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.51 3hcw h ASN 81 CO -0.30 1.14 -0.02 0.58 -1.65 0.00 0.00 177.43 177.17 3hcw h VAL 82 N 0.32 1.11 -0.84 2.81 2.07 -0.61 0.01 116.25 121.13 3hcw h VAL 82 Ca -0.04 -0.52 0.02 0.00 0.82 0.00 0.00 66.70 66.99 3hcw h VAL 82 Cb 1.34 1.45 -0.05 0.00 -1.52 0.00 0.00 31.29 32.52 3hcw h VAL 82 CO 0.13 0.13 0.55 -0.07 0.02 0.00 0.00 177.57 178.33 3hcw h LEU 83 N -0.29 0.92 -0.50 2.57 3.38 -1.00 0.12 115.31 120.50 3hcw h LEU 83 Ca -0.01 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.97 3hcw h LEU 83 Cb 0.26 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 3hcw h LEU 83 CO 0.01 0.65 0.31 0.25 0.09 0.00 0.00 178.44 179.75 3hcw h LEU 84 N 1.08 0.51 -0.19 1.67 5.85 -1.22 0.47 115.31 123.48 3hcw h LEU 84 Ca 0.32 -0.00 0.03 0.00 0.84 0.00 0.00 57.88 59.07 3hcw h LEU 84 Cb -0.05 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 3hcw h LEU 84 CO -0.10 0.36 0.01 1.23 -0.34 0.00 0.00 178.44 179.60 3hcw h GLY 85 N 0.62 0.19 0.92 3.75 0.00 -0.38 -1.94 103.07 106.23 3hcw h GLY 85 Ca 0.20 0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.54 3hcw h GLY 85 CO -0.08 -0.03 -0.01 -2.22 0.00 0.00 0.00 176.54 174.21 3hcw h ILE 86 N 0.07 1.04 -0.27 2.60 2.04 -0.60 -3.16 117.51 119.23 3hcw h ILE 86 Ca 0.09 -0.20 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 3hcw h ILE 86 Cb 0.10 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 3hcw h ILE 86 CO -0.14 0.05 -0.01 0.28 0.00 0.00 0.00 178.15 178.33 3hcw h SER 87 N -0.11 0.48 -0.52 1.72 0.02 -0.81 -1.25 113.55 113.07 3hcw h SER 87 Ca -0.00 -0.32 -0.04 0.00 -0.84 0.00 0.00 61.79 60.58 3hcw h SER 87 Cb 0.10 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.49 3hcw h SER 87 CO 0.00 0.68 0.18 1.05 -1.14 0.00 0.00 176.83 177.60 3hcw h GLU 88 N 0.26 0.85 0.17 3.45 4.11 -1.46 0.26 114.58 122.22 3hcw h GLU 88 Ca 0.07 -0.16 -0.01 0.00 0.07 0.00 0.00 59.36 59.34 3hcw h GLU 88 Cb 0.44 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.56 3hcw h GLU 88 CO 0.02 0.74 -0.08 1.15 0.07 0.00 0.00 179.01 180.90 3hcw h THR 89 N 0.83 0.95 -0.73 -1.06 2.02 -1.49 -2.17 112.91 111.26 3hcw h THR 89 Ca 0.19 -0.64 0.11 0.00 0.77 0.00 0.00 66.41 66.84 3hcw h THR 89 Cb 0.24 1.33 -0.08 0.00 -1.74 0.00 0.00 68.15 67.90 3hcw h THR 89 CO -0.01 0.15 0.33 0.00 0.37 0.00 0.00 175.52 176.36 3hcw h ASN 91 N 0.54 0.00 0.33 0.00 -0.26 -0.39 -0.06 115.58 115.73 3hcw h ASN 91 Ca 0.38 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.12 3hcw h ASN 91 Cb 0.48 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.74 3hcw h ASN 91 CO -0.32 0.00 -0.09 0.00 -1.06 0.00 0.00 177.43 175.96 3hcw n GLN 92 N -2.70 0.74 -0.32 0.81 6.02 -0.82 -3.77 117.38 117.35 3hcw n GLN 92 Ca 0.02 -0.24 0.06 0.00 -0.01 0.00 0.00 57.00 56.83 3hcw n GLN 92 Cb 0.32 -1.50 0.09 0.00 1.02 0.00 0.00 30.24 30.17 3hcw n GLN 92 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 3hcw n HIS 93 N -0.92 0.00 -1.02 1.08 8.25 -0.90 -5.00 115.22 116.71 3hcw n HIS 93 Ca 0.15 -0.65 -0.01 0.00 -0.26 0.00 0.00 57.72 56.96 3hcw n HIS 93 Cb 0.27 -0.12 -0.00 0.00 1.12 0.00 0.00 29.99 31.25 3hcw n HIS 93 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hcw n GLY 94 N -0.82 0.48 3.77 -1.41 0.00 -1.17 -5.03 105.19 101.01 3hcw n GLY 94 Ca 0.10 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 3hcw n GLY 94 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hcw s TYR 95 N -1.95 3.41 0.50 1.61 1.51 -0.09 -4.91 117.35 117.44 3hcw s TYR 95 Ca 0.00 0.34 0.03 0.00 -1.01 0.00 0.00 57.07 56.43 3hcw s TYR 95 Cb 0.00 -1.96 0.02 0.00 -0.11 0.00 0.00 41.96 39.91 3hcw s TYR 95 CO 0.00 0.51 0.70 0.20 -1.11 0.00 0.00 175.55 175.85 3hcw s GLY 96 N -0.54 1.83 0.09 0.71 0.00 0.19 -3.01 107.32 106.59 3hcw s GLY 96 Ca 0.11 -1.40 0.05 0.00 0.00 0.00 0.00 44.72 43.49 3hcw s GLY 96 CO 0.02 -1.16 -0.14 -0.51 0.00 0.00 0.00 173.10 171.31 3hcw s THR 97 N -2.61 1.20 -0.27 0.90 -4.23 -1.26 -0.75 115.64 108.61 3hcw s THR 97 Ca 0.55 -1.51 -0.03 0.00 -1.18 0.00 0.00 61.69 59.52 3hcw s THR 97 Cb -0.10 -1.29 0.10 0.00 1.34 0.00 0.00 72.50 72.55 3hcw s THR 97 CO 0.37 -0.33 0.16 -1.58 -0.54 0.00 0.00 174.62 172.70 3hcw s GLN 98 N -2.21 0.20 -0.07 3.99 0.74 0.04 -4.88 119.66 117.47 3hcw s GLN 98 Ca 0.03 -0.38 -0.30 0.00 0.05 0.00 0.00 55.36 54.77 3hcw s GLN 98 Cb -0.07 -1.15 -0.03 0.00 1.10 0.00 0.00 33.01 32.86 3hcw s GLN 98 CO 0.02 -0.96 1.12 0.99 -0.55 0.00 0.00 175.29 175.91 3hcw s THR 99 N 2.16 4.47 0.55 -0.34 2.01 -1.26 -1.25 115.64 121.98 3hcw s THR 99 Ca 0.08 1.77 -0.22 0.00 0.31 0.00 0.00 61.69 63.64 3hcw s THR 99 Cb -0.16 -4.14 -0.05 0.00 0.01 0.00 0.00 72.50 68.17 3hcw s THR 99 CO -0.32 0.01 1.34 0.42 -0.69 0.00 0.00 174.62 175.39 3hcw s THR 100 N 2.05 2.13 -0.33 -0.82 -4.23 -0.71 -4.95 115.64 108.79 3hcw s THR 100 Ca 0.53 0.10 0.03 0.00 -1.18 0.00 0.00 61.69 61.17 3hcw s THR 100 Cb -0.22 -3.05 0.03 0.00 1.34 0.00 0.00 72.50 70.60 3hcw s THR 100 CO 0.21 -0.00 0.67 0.55 -0.54 0.00 0.00 174.62 175.51 3hcw n VAL 101 N -1.04 0.18 -2.26 2.29 3.14 -1.26 -4.66 118.33 114.73 3hcw n VAL 101 Ca 0.10 -0.59 -0.34 0.00 -2.96 0.00 0.00 64.34 60.55 3hcw n VAL 101 Cb 0.45 0.96 -0.00 0.00 -1.06 0.00 0.00 33.84 34.19 3hcw n VAL 101 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 3hcw s SER 102 N -0.37 5.85 0.00 6.55 0.15 -1.26 -4.63 113.70 119.99 3hcw s SER 102 Ca 0.04 2.03 0.02 0.00 0.70 0.00 0.00 55.95 58.73 3hcw s SER 102 Cb 0.02 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 3hcw s SER 102 CO 0.04 -1.13 0.38 -0.46 1.20 0.00 0.00 173.24 173.27 3hcw n ASN 103 N -1.44 0.76 -4.06 5.45 0.23 -1.26 -3.44 115.26 111.50 3hcw n ASN 103 Ca 0.10 -0.88 -0.10 0.00 -0.53 0.00 0.00 54.58 53.18 3hcw n ASN 103 Cb 0.52 0.40 -0.08 0.00 -2.08 0.00 0.00 39.78 38.53 3hcw n ASN 103 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3hcw s ASN 104 N -0.59 0.14 0.16 0.53 2.20 -1.26 -4.75 114.94 111.36 3hcw s ASN 104 Ca 0.02 -1.07 -0.12 0.00 -0.94 0.00 0.00 52.86 50.75 3hcw s ASN 104 Cb 0.02 0.39 0.04 0.00 -2.00 0.00 0.00 41.25 39.70 3hcw s ASN 104 CO 0.05 -0.85 1.65 -0.03 -2.94 0.00 0.00 177.10 174.98 3hcw h MET 105 N 2.64 0.88 -0.46 3.55 1.85 -1.96 -0.13 114.93 121.29 3hcw h MET 105 Ca -0.33 -0.23 -0.12 0.00 -0.61 0.00 0.00 59.70 58.41 3hcw h MET 105 Cb 1.22 -0.11 -0.02 0.00 0.43 0.00 0.00 31.60 33.13 3hcw h MET 105 CO 0.51 0.85 -0.18 -0.91 -0.40 0.00 0.00 176.91 176.78 3hcw h ASN 106 N 0.77 0.93 0.32 1.39 -0.26 -1.99 -0.73 115.58 116.01 3hcw h ASN 106 Ca 0.16 -0.33 -0.14 0.00 -0.56 0.00 0.00 56.30 55.43 3hcw h ASN 106 Cb 0.39 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.39 3hcw h ASN 106 CO 0.01 1.09 -0.57 0.44 -1.06 0.00 0.00 177.43 177.33 3hcw h ASP 107 N 0.80 0.29 0.66 5.81 3.32 -1.97 -2.27 116.42 123.07 3hcw h ASP 107 Ca 0.11 -0.16 -0.17 0.00 0.02 0.00 0.00 57.03 56.84 3hcw h ASP 107 Cb 0.73 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 3hcw h ASP 107 CO 0.06 0.80 -0.76 0.25 -1.72 0.00 0.00 179.24 177.87 3hcw h LEU 108 N 0.20 0.09 -0.80 1.55 5.85 -0.86 -0.10 115.31 121.25 3hcw h LEU 108 Ca -0.00 -0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.54 3hcw h LEU 108 Cb 1.07 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.06 3hcw h LEU 108 CO 0.09 0.82 -0.26 0.24 -0.34 0.00 0.00 178.44 178.98 3hcw h MET 109 N 0.04 0.61 0.07 1.25 2.86 -1.09 -2.47 114.93 116.20 3hcw h MET 109 Ca -0.02 -0.25 -0.00 0.00 -2.06 0.00 0.00 59.70 57.37 3hcw h MET 109 Cb 1.34 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.97 3hcw h MET 109 CO 0.11 0.81 -0.03 -0.44 1.06 0.00 0.00 176.91 178.42 3hcw h ASP 110 N 0.53 -0.07 1.03 1.22 3.32 -1.09 -2.74 116.42 118.62 3hcw h ASP 110 Ca 0.07 -0.35 -0.09 0.00 0.02 0.00 0.00 57.03 56.68 3hcw h ASP 110 Cb 0.73 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.28 3hcw h ASP 110 CO 0.06 0.32 -0.42 1.05 -1.72 0.00 0.00 179.24 178.52 3hcw h GLU 111 N -0.48 0.00 0.01 3.56 4.11 -1.06 -1.25 114.58 119.47 3hcw h GLU 111 Ca -0.01 0.00 -0.27 0.00 0.07 0.00 0.00 59.36 59.15 3hcw h GLU 111 Cb 0.42 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.69 3hcw h GLU 111 CO 0.01 0.42 -1.06 0.28 0.07 0.00 0.00 179.01 178.74 3hcw h VAL 112 N 0.00 1.29 -0.60 -1.06 2.07 -1.56 -2.90 116.25 113.49 3hcw h VAL 112 Ca -0.00 -2.29 -0.02 0.00 0.82 0.00 0.00 66.70 65.20 3hcw h VAL 112 Cb 1.05 2.42 -0.03 0.00 -1.52 0.00 0.00 31.29 33.22 3hcw h VAL 112 CO 0.06 0.71 0.30 0.22 0.02 0.00 0.00 177.57 178.87 3hcw h TYR 113 N 0.37 0.83 -0.09 1.57 3.20 -1.20 -1.41 116.97 120.23 3hcw h TYR 113 Ca -0.13 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.73 3hcw h TYR 113 Cb 1.71 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 39.70 3hcw h TYR 113 CO 0.10 0.61 -0.01 -0.22 -1.64 0.00 0.00 178.16 177.00 3hcw h LYS 114 N 0.84 0.02 -0.55 1.82 3.64 -1.27 -0.35 116.57 120.71 3hcw h LYS 114 Ca 0.21 -0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.68 3hcw h LYS 114 Cb 0.08 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 3hcw h LYS 114 CO -0.03 0.01 0.37 0.52 -2.27 0.00 0.00 179.45 178.06 3hcw h MET 115 N 0.02 0.36 0.45 1.90 2.86 -1.17 0.46 114.93 119.79 3hcw h MET 115 Ca 0.04 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 3hcw h MET 115 Cb 0.06 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.64 3hcw h MET 115 CO -0.08 0.24 -0.22 0.82 1.06 0.00 0.00 176.91 178.73 3hcw h ILE 116 N 0.37 0.11 -0.65 -1.22 1.08 -0.87 -1.47 117.51 114.86 3hcw h ILE 116 Ca 0.25 -0.58 -0.03 0.00 -0.39 0.00 0.00 64.86 64.11 3hcw h ILE 116 Cb 0.52 0.18 -0.03 0.00 -3.07 0.00 0.00 36.82 34.42 3hcw h ILE 116 CO -0.06 0.03 0.27 0.11 -0.69 0.00 0.00 178.15 177.80 3hcw h LYS 117 N -1.12 0.97 -0.00 2.37 1.79 -0.86 -1.20 116.57 118.51 3hcw h LYS 117 Ca -0.06 -0.17 0.00 0.00 -2.18 0.00 0.00 60.65 58.24 3hcw h LYS 117 Cb 0.50 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 3hcw h LYS 117 CO 0.10 0.80 0.00 1.04 -1.08 0.00 0.00 179.45 180.31 3hcw n GLN 118 N -4.43 1.01 -4.01 3.15 6.02 0.13 -4.91 117.38 114.35 3hcw n GLN 118 Ca 0.05 -0.02 -0.31 0.00 -0.01 0.00 0.00 57.00 56.71 3hcw n GLN 118 Cb 0.16 -1.15 0.00 0.00 1.02 0.00 0.00 30.24 30.27 3hcw n GLN 118 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3hcw n ARG 119 N -0.63 -4.34 0.16 -1.09 5.12 -0.45 -4.89 116.66 110.54 3hcw n ARG 119 Ca 0.07 0.49 0.05 0.00 -1.93 0.00 0.00 57.85 56.54 3hcw n ARG 119 Cb 0.04 -5.19 0.09 0.00 -1.16 0.00 0.00 32.46 26.23 3hcw n ARG 119 CO 0.00 0.00 0.00 0.52 -1.93 0.00 0.00 177.63 176.22 3hcw h MET 120 N -1.83 0.00 -4.83 5.56 2.86 -1.49 -3.46 114.93 111.74 3hcw h MET 120 Ca -0.59 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 56.74 3hcw h MET 120 Cb 1.38 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 32.89 3hcw h MET 120 CO 0.69 0.38 -0.65 0.14 1.06 0.00 0.00 176.91 178.54 3hcw s VAL 121 N -3.06 0.64 -0.08 -2.22 -7.23 -1.26 -4.79 120.40 102.41 3hcw s VAL 121 Ca 0.04 -1.99 0.13 0.00 -1.81 0.00 0.00 61.98 58.35 3hcw s VAL 121 Cb 0.07 -2.28 -0.23 0.00 0.56 0.00 0.00 36.38 34.50 3hcw s VAL 121 CO 0.72 -0.33 0.54 0.47 -0.31 0.00 0.00 175.10 176.19 3hcw n ASP 122 N -0.31 0.79 -3.51 4.85 10.43 0.27 -4.64 116.55 124.43 3hcw n ASP 122 Ca -0.04 0.33 -0.07 0.00 2.57 0.00 0.00 54.79 57.58 3hcw n ASP 122 Cb 0.64 0.08 -0.00 0.00 1.84 0.00 0.00 41.12 43.68 3hcw n ASP 122 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3hcw s ALA 123 N -2.58 -1.17 0.14 2.24 0.00 -1.24 -4.55 121.76 114.61 3hcw s ALA 123 Ca -0.07 -0.38 0.06 0.00 0.00 0.00 0.00 51.96 51.57 3hcw s ALA 123 Cb 0.08 0.76 -0.04 0.00 0.00 0.00 0.00 23.12 23.91 3hcw s ALA 123 CO 0.82 -1.03 -0.14 -0.06 0.00 0.00 0.00 175.76 175.36 3hcw s PHE 124 N -3.18 1.44 -0.20 0.00 0.08 -0.87 -0.33 117.98 114.92 3hcw s PHE 124 Ca 0.13 -0.59 -0.01 0.00 0.12 0.00 0.00 56.93 56.59 3hcw s PHE 124 Cb -0.05 -0.73 0.06 0.00 -0.57 0.00 0.00 43.02 41.73 3hcw s PHE 124 CO 0.08 0.17 -0.01 0.42 -0.10 0.00 0.00 175.22 175.77 3hcw s ILE 125 N -2.46 1.01 -0.19 0.64 1.01 -0.23 -1.50 121.20 119.49 3hcw s ILE 125 Ca 0.12 -0.82 -0.29 0.00 0.00 0.00 0.00 60.65 59.67 3hcw s ILE 125 Cb -0.03 -1.36 -0.01 0.00 0.01 0.00 0.00 42.46 41.07 3hcw s ILE 125 CO 0.03 -0.10 1.18 -0.76 0.00 0.00 0.00 174.94 175.29 3hcw s LEU 126 N 1.64 4.15 -0.11 2.97 1.43 0.23 -1.73 118.68 127.27 3hcw s LEU 126 Ca -0.02 1.58 0.05 0.00 -1.03 0.00 0.00 54.13 54.71 3hcw s LEU 126 Cb -0.17 -3.54 0.33 0.00 0.03 0.00 0.00 46.19 42.84 3hcw s LEU 126 CO -0.07 -0.73 1.06 0.18 0.23 0.00 0.00 176.35 177.03 3hcw n LEU 127 N 6.48 3.16 -3.73 1.79 4.77 -0.41 0.10 117.00 129.17 3hcw n LEU 127 Ca 0.13 -1.61 -0.10 0.00 -0.03 0.00 0.00 56.01 54.41 3hcw n LEU 127 Cb 0.45 -0.59 -0.04 0.00 -2.33 0.00 0.00 43.42 40.92 3hcw n LEU 127 CO 0.54 0.45 0.28 -0.72 -1.33 0.00 0.00 177.39 176.61 3hcw s TYR 128 N -1.68 -0.13 -0.08 -1.77 1.13 -1.18 -4.85 117.35 108.79 3hcw s TYR 128 Ca 0.23 -0.21 0.03 0.00 -1.41 0.00 0.00 57.07 55.70 3hcw s TYR 128 Cb 0.18 0.40 0.01 0.00 -1.10 0.00 0.00 41.96 41.45 3hcw s TYR 128 CO 0.06 -0.92 -0.15 0.45 -2.51 0.00 0.00 175.55 172.48 3hcw s SER 129 N -2.87 2.12 -0.06 -0.18 0.15 -1.24 -4.54 113.70 107.09 3hcw s SER 129 Ca 0.09 -0.37 -0.07 0.00 0.70 0.00 0.00 55.95 56.30 3hcw s SER 129 Cb -0.01 -0.98 0.02 0.00 -1.71 0.00 0.00 66.02 63.34 3hcw s SER 129 CO -0.03 0.06 0.19 -0.75 1.20 0.00 0.00 173.24 173.92 3hcw s LYS 130 N 0.59 0.30 0.24 5.44 2.20 -1.26 -3.68 119.74 123.58 3hcw s LYS 130 Ca -0.15 0.12 -0.30 0.00 -0.36 0.00 0.00 55.97 55.28 3hcw s LYS 130 Cb -0.16 0.14 -0.10 0.00 -1.51 0.00 0.00 37.83 36.20 3hcw s LYS 130 CO 0.05 -0.05 1.37 -2.00 -0.36 0.00 0.00 175.35 174.36 3hcw s GLU 131 N -0.26 4.33 -1.33 4.03 2.12 -1.26 -3.01 118.70 123.33 3hcw s GLU 131 Ca -0.04 2.19 -0.00 0.00 0.36 0.00 0.00 54.97 57.49 3hcw s GLU 131 Cb -0.03 -3.14 0.00 0.00 0.26 0.00 0.00 34.13 31.23 3hcw s GLU 131 CO 0.01 -0.32 0.65 0.09 -0.54 0.00 0.00 175.26 175.15 3hcw n ASN 132 N 2.22 -1.04 -4.63 -1.70 3.02 -1.26 -4.95 115.26 106.92 3hcw n ASN 132 Ca 0.05 -0.85 -0.43 0.00 -0.03 0.00 0.00 54.58 53.32 3hcw n ASN 132 Cb 0.41 -3.88 -0.02 0.00 -0.61 0.00 0.00 39.78 35.68 3hcw n ASN 132 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hcw s ASP 133 N -4.36 6.78 0.44 6.41 3.68 -1.16 -4.92 116.67 123.53 3hcw s ASP 133 Ca 0.01 1.19 0.24 0.00 2.13 0.00 0.00 52.55 56.12 3hcw s ASP 133 Cb -0.00 -2.54 0.85 0.00 -1.45 0.00 0.00 42.92 39.77 3hcw s ASP 133 CO 0.83 -0.99 1.79 -0.65 0.13 0.00 0.00 175.17 176.28 3hcw h PRO 134 N 8.82 0.00 0.00 4.34 0.11 -1.93 -0.95 132.00 142.39 3hcw h PRO 134 Ca -0.24 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.67 3hcw h PRO 134 Cb 1.09 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 3hcw h PRO 134 CO 1.03 0.22 -1.05 0.97 -0.21 0.00 0.00 178.00 178.96 3hcw h ILE 135 N 0.00 1.33 -0.45 4.15 -0.00 -1.97 -0.39 117.51 120.18 3hcw h ILE 135 Ca -0.00 -2.99 -0.09 0.00 -0.00 0.00 0.00 64.86 61.78 3hcw h ILE 135 Cb 0.80 2.65 -0.02 0.00 -0.00 0.00 0.00 36.82 40.24 3hcw h ILE 135 CO 0.03 0.76 -0.10 0.50 -0.00 0.00 0.00 178.15 179.34 3hcw h LYS 136 N 0.00 0.81 -0.47 2.19 3.64 -1.92 -2.69 116.57 118.13 3hcw h LYS 136 Ca -0.07 -0.27 -0.06 0.00 -1.27 0.00 0.00 60.65 58.99 3hcw h LYS 136 Cb 1.73 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 33.46 3hcw h LYS 136 CO 0.10 0.88 0.05 1.96 -2.27 0.00 0.00 179.45 180.17 3hcw h GLN 137 N 0.73 0.75 0.21 1.90 1.08 -1.09 -2.57 115.11 116.13 3hcw h GLN 137 Ca 0.13 -0.18 -0.00 0.00 -1.45 0.00 0.00 58.65 57.15 3hcw h GLN 137 Cb 0.58 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.90 3hcw h GLN 137 CO 0.04 0.73 -0.15 1.98 -0.95 0.00 0.00 178.83 180.48 3hcw h MET 138 N 0.71 -0.35 0.00 1.46 4.05 -0.90 0.15 114.93 120.05 3hcw h MET 138 Ca 0.15 0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.57 3hcw h MET 138 Cb 0.37 0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 31.25 3hcw h MET 138 CO 0.01 -0.24 -0.13 -0.07 0.23 0.00 0.00 176.91 176.72 3hcw h LEU 139 N -0.37 0.00 -0.00 3.39 3.38 -1.46 0.14 115.31 120.39 3hcw h LEU 139 Ca -0.01 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 3hcw h LEU 139 Cb 0.32 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.08 3hcw h LEU 139 CO 0.00 0.13 -0.40 0.40 0.09 0.00 0.00 178.44 178.66 3hcw h ILE 140 N 0.00 1.50 -0.68 1.22 2.04 -1.14 -0.93 117.51 119.51 3hcw h ILE 140 Ca -0.00 -2.01 0.01 0.00 1.00 0.00 0.00 64.86 63.86 3hcw h ILE 140 Cb 0.31 2.70 -0.03 0.00 -0.74 0.00 0.00 36.82 39.05 3hcw h ILE 140 CO 0.02 0.57 0.45 0.44 0.00 0.00 0.00 178.15 179.62 3hcw h ASP 141 N -0.33 0.78 -0.70 1.72 3.45 -0.25 -3.12 116.42 117.97 3hcw h ASP 141 Ca -0.05 -0.02 -0.17 0.00 0.43 0.00 0.00 57.03 57.22 3hcw h ASP 141 Cb 1.14 -0.19 -0.10 0.00 -0.56 0.00 0.00 39.33 39.61 3hcw h ASP 141 CO 0.08 0.56 0.21 -0.62 -1.57 0.00 0.00 179.24 177.91 3hcw n GLU 142 N -4.61 3.89 -2.15 3.56 1.02 -0.00 -4.95 120.64 117.40 3hcw n GLU 142 Ca 0.06 -3.11 -0.14 0.00 -0.02 0.00 0.00 57.16 53.95 3hcw n GLU 142 Cb 0.02 -2.22 -0.02 0.00 -0.02 0.00 0.00 31.44 29.20 3hcw n GLU 142 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3hcw n SER 143 N -0.05 -4.25 -4.71 1.62 7.64 -1.12 -4.96 113.62 107.80 3hcw n SER 143 Ca 0.38 0.20 -0.41 0.00 1.01 0.00 0.00 58.87 60.05 3hcw n SER 143 Cb 1.35 -3.67 -0.03 0.00 -1.01 0.00 0.00 64.21 60.84 3hcw n SER 143 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 3hcw s MET 144 N -4.53 4.51 0.32 1.43 -1.94 -0.37 -5.01 119.30 113.71 3hcw s MET 144 Ca 0.00 1.26 -0.29 0.00 -1.71 0.00 0.00 55.69 54.95 3hcw s MET 144 Cb 0.00 -3.46 -0.10 0.00 2.01 0.00 0.00 34.83 33.27 3hcw s MET 144 CO 0.00 -0.04 1.39 -2.14 -0.01 0.00 0.00 175.02 174.22 3hcw s PRO 145 N 1.03 4.28 0.16 2.03 0.02 -1.26 -4.71 135.00 136.55 3hcw s PRO 145 Ca 0.47 2.32 -0.15 0.00 0.02 0.00 0.00 61.00 63.67 3hcw s PRO 145 Cb -0.20 -3.06 0.02 0.00 0.02 0.00 0.00 34.50 31.28 3hcw s PRO 145 CO 0.24 -0.33 0.42 -0.59 -0.33 0.00 0.00 177.00 176.41 3hcw s PHE 146 N -0.78 -0.01 0.16 6.54 -0.71 -1.26 -2.05 117.98 119.87 3hcw s PHE 146 Ca 0.53 -0.33 0.10 0.00 -1.04 0.00 0.00 56.93 56.19 3hcw s PHE 146 Cb -0.42 0.23 -0.04 0.00 -1.21 0.00 0.00 43.02 41.58 3hcw s PHE 146 CO 0.52 -0.79 -0.20 0.42 -1.34 0.00 0.00 175.22 173.83 3hcw s ILE 147 N -3.87 2.65 -0.11 -4.49 1.09 -0.56 -4.48 121.20 111.42 3hcw s ILE 147 Ca 0.09 -1.76 0.03 0.00 -1.10 0.00 0.00 60.65 57.91 3hcw s ILE 147 Cb 0.01 -2.25 0.00 0.00 -1.06 0.00 0.00 42.46 39.17 3hcw s ILE 147 CO -0.05 -0.02 -0.23 -0.69 -0.10 0.00 0.00 174.94 173.85 3hcw s VAL 148 N -1.42 2.13 -0.50 2.92 1.01 -0.90 -0.60 120.40 123.05 3hcw s VAL 148 Ca 0.20 -0.98 -0.22 0.00 0.00 0.00 0.00 61.98 60.97 3hcw s VAL 148 Cb -0.09 -1.83 0.04 0.00 0.00 0.00 0.00 36.38 34.50 3hcw s VAL 148 CO 0.10 0.55 0.76 -0.63 0.00 0.00 0.00 175.10 175.89 3hcw s ILE 149 N 0.47 4.66 -5.00 2.22 1.01 0.12 -0.88 121.20 123.79 3hcw s ILE 149 Ca -0.15 0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.56 3hcw s ILE 149 Cb -0.17 -4.36 0.00 0.00 0.01 0.00 0.00 42.46 37.93 3hcw s ILE 149 CO 0.06 -0.85 0.00 0.61 0.00 0.00 0.00 174.94 174.76 3hcw n GLY 150 N 5.09 0.33 3.74 6.18 0.00 0.05 -3.07 105.19 117.51 3hcw n GLY 150 Ca -0.01 -1.62 -0.37 0.00 0.00 0.00 0.00 46.02 44.02 3hcw n GLY 150 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hcw s LYS 151 N -2.00 4.22 0.28 1.61 2.20 -1.26 -4.08 119.74 120.71 3hcw s LYS 151 Ca 0.00 0.21 -0.30 0.00 -0.36 0.00 0.00 55.97 55.52 3hcw s LYS 151 Cb 0.00 -3.40 -0.11 0.00 -1.51 0.00 0.00 37.83 32.81 3hcw s LYS 151 CO 0.00 0.28 1.60 -1.25 -0.36 0.00 0.00 175.35 175.61 3hcw s PRO 152 N 0.32 4.13 0.00 4.03 0.04 -1.26 -4.86 135.00 137.40 3hcw s PRO 152 Ca 0.20 2.56 0.00 0.00 0.04 0.00 0.00 61.00 63.80 3hcw s PRO 152 Cb -0.14 -3.04 0.00 0.00 0.04 0.00 0.00 34.50 31.37 3hcw s PRO 152 CO 0.06 -0.63 0.44 -2.37 0.04 0.00 0.00 177.00 174.54 3hcw n THR 153 N 2.38 0.19 -4.01 1.26 5.66 -1.26 -5.11 114.28 113.40 3hcw n THR 153 Ca 0.09 -0.35 -0.11 0.00 -3.05 0.00 0.00 64.05 60.63 3hcw n THR 153 Cb 0.37 1.21 -0.04 0.00 -1.55 0.00 0.00 70.33 70.33 3hcw n THR 153 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 3hcw s SER 154 N -0.19 0.28 0.10 1.09 0.15 -1.26 -5.06 113.70 108.81 3hcw s SER 154 Ca 0.00 -1.16 -0.17 0.00 0.70 0.00 0.00 55.95 55.32 3hcw s SER 154 Cb 0.00 0.65 -0.06 0.00 -1.71 0.00 0.00 66.02 64.89 3hcw s SER 154 CO 0.00 -1.26 1.53 0.44 1.20 0.00 0.00 173.24 175.14 3hcw h ASP 155 N 2.18 0.53 0.61 5.45 3.32 -2.04 -3.16 116.42 123.31 3hcw h ASP 155 Ca -0.28 -0.32 -0.02 0.00 0.02 0.00 0.00 57.03 56.43 3hcw h ASP 155 Cb 1.25 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.65 3hcw h ASP 155 CO 0.37 0.73 -0.09 0.16 -1.72 0.00 0.00 179.24 178.70 3hcw h ILE 156 N 0.32 0.31 0.00 0.35 3.07 -2.03 -2.86 117.51 116.67 3hcw h ILE 156 Ca 0.08 -0.56 0.00 0.00 1.55 0.00 0.00 64.86 65.94 3hcw h ILE 156 Cb 0.47 1.42 0.00 0.00 -0.27 0.00 0.00 36.82 38.44 3hcw h ILE 156 CO 0.02 0.08 0.00 0.44 -1.05 0.00 0.00 178.15 177.64 3hcw h ASP 157 N 0.00 0.00 -0.03 2.16 3.45 -1.90 -1.16 116.42 118.93 3hcw h ASP 157 Ca -0.00 0.00 0.01 0.00 0.43 0.00 0.00 57.03 57.47 3hcw h ASP 157 Cb 0.41 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.18 3hcw h ASP 157 CO 0.01 0.00 0.02 0.45 -1.57 0.00 0.00 179.24 178.16 3hcw h HIS 158 N 0.00 0.00 0.00 4.55 3.86 -1.66 -2.65 115.15 119.24 3hcw h HIS 158 Ca 0.00 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.13 3hcw h HIS 158 Cb 0.08 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.54 3hcw h HIS 158 CO 0.00 0.00 -0.37 1.96 0.86 0.00 0.00 177.93 180.38 3hcw h GLN 159 N 0.00 0.00 -5.21 2.45 1.08 -1.45 -3.45 115.11 108.54 3hcw h GLN 159 Ca 0.02 0.00 -0.66 0.00 -1.45 0.00 0.00 58.65 56.55 3hcw h GLN 159 Cb 0.06 0.00 -0.29 0.00 -0.05 0.00 0.00 27.48 27.20 3hcw h GLN 159 CO -0.00 0.37 -0.78 -0.06 -0.95 0.00 0.00 178.83 177.41 3hcw s PHE 160 N -3.19 2.82 0.17 2.96 0.08 -1.00 -4.97 117.98 114.84 3hcw s PHE 160 Ca 0.03 -0.90 -0.32 0.00 0.12 0.00 0.00 56.93 55.87 3hcw s PHE 160 Cb 0.08 -1.90 -0.11 0.00 -0.57 0.00 0.00 43.02 40.52 3hcw s PHE 160 CO 0.71 -0.40 1.72 0.99 -0.10 0.00 0.00 175.22 178.14 3hcw s THR 161 N 0.75 2.31 0.02 0.64 2.01 -1.26 -4.86 115.64 115.26 3hcw s THR 161 Ca -0.06 0.13 0.06 0.00 0.31 0.00 0.00 61.69 62.13 3hcw s THR 161 Cb -0.15 -3.08 -0.03 0.00 0.01 0.00 0.00 72.50 69.24 3hcw s THR 161 CO 0.01 0.01 -0.16 -1.00 -0.69 0.00 0.00 174.62 172.79 3hcw s HIS 162 N 1.65 2.63 -0.16 4.92 3.76 -0.88 -2.11 115.29 125.10 3hcw s HIS 162 Ca 0.75 -0.21 0.00 0.00 -0.15 0.00 0.00 55.06 55.46 3hcw s HIS 162 Cb -0.47 -1.51 0.02 0.00 1.11 0.00 0.00 32.58 31.73 3hcw s HIS 162 CO 0.33 0.26 -0.15 0.42 -0.85 0.00 0.00 174.74 174.75 3hcw s ILE 163 N -0.91 1.67 0.18 0.60 1.09 -0.06 -0.38 121.20 123.39 3hcw s ILE 163 Ca 0.15 -0.71 -0.03 0.00 -1.10 0.00 0.00 60.65 58.96 3hcw s ILE 163 Cb -0.11 -1.56 -0.03 0.00 -1.06 0.00 0.00 42.46 39.70 3hcw s ILE 163 CO 0.05 0.46 0.15 -0.62 -0.10 0.00 0.00 174.94 174.88 3hcw s ASP 164 N 1.44 0.17 0.54 3.58 2.15 -0.33 -0.77 116.67 123.46 3hcw s ASP 164 Ca 0.05 -1.26 -0.02 0.00 0.43 0.00 0.00 52.55 51.75 3hcw s ASP 164 Cb -0.13 0.38 0.02 0.00 -0.30 0.00 0.00 42.92 42.88 3hcw s ASP 164 CO -0.11 -0.84 0.81 0.20 -0.17 0.00 0.00 175.17 175.06 3hcw s ASN 165 N -3.10 5.52 -0.72 -0.34 -0.87 -1.26 -1.13 114.94 113.04 3hcw s ASN 165 Ca 0.32 0.38 -0.23 0.00 -1.57 0.00 0.00 52.86 51.76 3hcw s ASN 165 Cb 0.06 -1.40 0.07 0.00 -0.02 0.00 0.00 41.25 39.96 3hcw s ASN 165 CO 0.08 -1.01 1.05 -0.62 -2.57 0.00 0.00 177.10 174.02 3hcw s ASP 166 N -4.32 6.24 0.31 -1.22 3.68 -1.26 -4.88 116.67 115.22 3hcw s ASP 166 Ca 0.53 -1.07 0.21 0.00 2.13 0.00 0.00 52.55 54.35 3hcw s ASP 166 Cb -0.10 -2.44 0.16 0.00 -1.45 0.00 0.00 42.92 39.08 3hcw s ASP 166 CO 0.41 -1.45 1.36 0.78 0.13 0.00 0.00 175.17 176.40 3hcw h ASN 167 N 9.55 0.00 0.06 -0.34 2.35 -1.96 -1.25 115.58 123.99 3hcw h ASN 167 Ca -0.21 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.54 3hcw h ASN 167 Cb 1.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.43 3hcw h ASN 167 CO 1.20 0.14 -0.03 0.40 -1.65 0.00 0.00 177.43 177.49 3hcw h ILE 168 N 0.00 1.20 -0.51 2.81 2.04 -1.90 -2.74 117.51 118.41 3hcw h ILE 168 Ca -0.02 -0.96 -0.01 0.00 1.00 0.00 0.00 64.86 64.88 3hcw h ILE 168 Cb 1.12 1.82 -0.02 0.00 -0.74 0.00 0.00 36.82 39.00 3hcw h ILE 168 CO 0.02 0.24 0.28 0.25 0.00 0.00 0.00 178.15 178.93 3hcw h LEU 169 N -0.52 0.64 -0.32 1.44 5.85 -1.89 0.70 115.31 121.22 3hcw h LEU 169 Ca -0.01 -0.09 0.06 0.00 0.84 0.00 0.00 57.88 58.68 3hcw h LEU 169 Cb 0.45 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.26 3hcw h LEU 169 CO 0.01 0.55 -0.03 0.00 -0.34 0.00 0.00 178.44 178.64 3hcw h ALA 170 N 1.12 0.27 -0.54 1.25 0.00 -1.32 0.28 119.26 120.32 3hcw h ALA 170 Ca 0.18 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 3hcw h ALA 170 Cb 0.05 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3hcw h ALA 170 CO -0.03 -0.43 0.10 1.03 0.00 0.00 0.00 179.25 179.93 3hcw h SER 171 N 0.06 0.84 -0.73 0.00 0.87 -1.16 -1.59 113.55 111.84 3hcw h SER 171 Ca 0.16 -0.25 -0.01 0.00 -1.23 0.00 0.00 61.79 60.46 3hcw h SER 171 Cb 0.22 -0.22 -0.04 0.00 -0.44 0.00 0.00 62.40 61.93 3hcw h SER 171 CO -0.29 0.88 0.43 -0.33 -0.53 0.00 0.00 176.83 176.99 3hcw h GLU 172 N 0.77 1.00 -0.54 2.24 5.08 -0.22 0.40 114.58 123.31 3hcw h GLU 172 Ca 0.16 -0.10 0.01 0.00 -1.00 0.00 0.00 59.36 58.43 3hcw h GLU 172 Cb 0.38 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 3hcw h GLU 172 CO 0.01 0.72 0.36 -0.91 -1.00 0.00 0.00 179.01 178.18 3hcw h ASN 173 N 1.00 0.61 -0.15 1.42 2.35 -0.27 -0.01 115.58 120.53 3hcw h ASN 173 Ca 0.26 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.96 3hcw h ASN 173 Cb -0.01 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.20 3hcw h ASN 173 CO -0.05 0.44 -0.06 0.25 -1.65 0.00 0.00 177.43 176.36 3hcw h LEU 174 N 0.73 0.32 -0.71 1.61 5.85 -0.84 -2.41 115.31 119.85 3hcw h LEU 174 Ca 0.20 -0.40 -0.03 0.00 0.84 0.00 0.00 57.88 58.49 3hcw h LEU 174 Cb -0.08 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 3hcw h LEU 174 CO -0.05 0.65 0.34 0.74 -0.34 0.00 0.00 178.44 179.78 3hcw h THR 175 N -0.01 1.24 -0.46 1.05 2.02 -0.14 -2.60 112.91 114.01 3hcw h THR 175 Ca 0.04 -0.67 0.02 0.00 0.77 0.00 0.00 66.41 66.56 3hcw h THR 175 Cb 0.52 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 3hcw h THR 175 CO 0.02 0.28 0.28 0.03 0.37 0.00 0.00 175.52 176.50 3hcw h ARG 176 N 1.00 0.54 -0.65 6.66 2.47 -0.99 -2.84 114.38 120.56 3hcw h ARG 176 Ca 0.24 -0.03 0.05 0.00 -1.26 0.00 0.00 59.98 58.98 3hcw h ARG 176 Cb 0.13 -0.12 -0.05 0.00 -1.65 0.00 0.00 29.97 28.28 3hcw h ARG 176 CO -0.03 0.36 0.37 1.25 0.56 0.00 0.00 179.97 182.48 3hcw h HIS 177 N 0.56 0.69 -0.26 3.04 2.76 -1.06 -0.25 115.15 120.63 3hcw h HIS 177 Ca 0.18 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.29 3hcw h HIS 177 Cb 0.00 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 28.74 3hcw h HIS 177 CO -0.07 0.35 -0.20 -0.39 -1.30 0.00 0.00 177.93 176.32 3hcw h VAL 178 N 0.70 1.25 -0.52 5.26 -1.51 -1.40 -2.65 116.25 117.39 3hcw h VAL 178 Ca 0.29 -1.15 -0.11 0.00 -1.23 0.00 0.00 66.70 64.49 3hcw h VAL 178 Cb 0.14 1.27 -0.02 0.00 -2.13 0.00 0.00 31.29 30.56 3hcw h VAL 178 CO -0.16 0.37 -0.12 0.40 -1.23 0.00 0.00 177.57 176.83 3hcw h ILE 179 N 0.42 1.27 -0.01 7.19 2.04 -1.15 -2.55 117.51 124.72 3hcw h ILE 179 Ca 0.07 -1.27 0.00 0.00 1.00 0.00 0.00 64.86 64.67 3hcw h ILE 179 Cb 0.59 0.99 -0.00 0.00 -0.74 0.00 0.00 36.82 37.66 3hcw h ILE 179 CO 0.04 0.44 0.01 -0.33 0.00 0.00 0.00 178.15 178.32 3hcw h GLU 180 N 0.87 0.00 0.00 2.37 5.08 -0.73 -0.06 114.58 122.11 3hcw h GLU 180 Ca 0.13 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3hcw h GLU 180 Cb 0.68 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 3hcw h GLU 180 CO 0.05 0.00 -0.05 1.96 -1.00 0.00 0.00 179.01 179.97 3hcw h GLN 181 N 0.00 0.00 0.00 2.33 1.08 -1.15 -3.49 115.11 113.88 3hcw h GLN 181 Ca 0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 3hcw h GLN 181 Cb 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 3hcw h GLN 181 CO -0.00 0.01 0.00 0.41 -0.95 0.00 0.00 178.83 178.30 3hcw n GLY 182 N 1.11 0.52 3.12 3.46 0.00 -0.04 -5.04 105.19 108.32 3hcw n GLY 182 Ca 0.04 -0.80 -0.13 0.00 0.00 0.00 0.00 46.02 45.13 3hcw n GLY 182 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hcw s VAL 183 N 0.00 0.68 -0.26 1.61 -7.23 -1.26 -4.88 120.40 109.07 3hcw s VAL 183 Ca 0.00 -1.49 -0.04 0.00 -1.81 0.00 0.00 61.98 58.64 3hcw s VAL 183 Cb 0.00 -1.13 -0.15 0.00 0.56 0.00 0.00 36.38 35.66 3hcw s VAL 183 CO 0.00 -0.58 -0.27 0.47 -0.31 0.00 0.00 175.10 174.41 3hcw n ASP 184 N 0.77 1.99 -4.08 4.85 9.92 0.88 -4.97 116.55 125.90 3hcw n ASP 184 Ca -0.18 0.04 -0.19 0.00 -0.53 0.00 0.00 54.79 53.93 3hcw n ASP 184 Cb 0.57 -0.55 -0.14 0.00 -0.64 0.00 0.00 41.12 40.36 3hcw n ASP 184 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 3hcw s GLU 185 N -2.50 0.87 0.04 -1.24 -6.30 -0.93 -3.66 118.70 104.97 3hcw s GLU 185 Ca -0.35 -0.53 0.08 0.00 -2.50 0.00 0.00 54.97 51.66 3hcw s GLU 185 Cb 0.11 -0.84 -0.03 0.00 0.00 0.00 0.00 34.13 33.37 3hcw s GLU 185 CO 0.54 0.22 -0.24 -0.51 0.02 0.00 0.00 175.26 175.29 3hcw s LEU 186 N -0.64 2.15 -0.10 2.70 1.43 -0.21 -2.70 118.68 121.32 3hcw s LEU 186 Ca 0.02 -0.55 0.01 0.00 -1.03 0.00 0.00 54.13 52.59 3hcw s LEU 186 Cb -0.06 -1.18 0.02 0.00 0.03 0.00 0.00 46.19 45.00 3hcw s LEU 186 CO 0.00 0.23 -0.13 -0.63 0.23 0.00 0.00 176.35 176.05 3hcw s ILE 187 N -0.78 1.31 -0.18 -0.59 1.01 -0.47 -1.57 121.20 119.92 3hcw s ILE 187 Ca 0.10 -0.53 -0.06 0.00 0.00 0.00 0.00 60.65 60.17 3hcw s ILE 187 Cb -0.09 -1.21 -0.03 0.00 0.01 0.00 0.00 42.46 41.13 3hcw s ILE 187 CO 0.02 0.40 0.01 0.12 0.00 0.00 0.00 174.94 175.49 3hcw s PHE 188 N 1.02 3.11 -0.18 3.97 5.36 -0.56 -0.14 117.98 130.56 3hcw s PHE 188 Ca -0.07 -0.22 -0.03 0.00 -0.96 0.00 0.00 56.93 55.66 3hcw s PHE 188 Cb -0.15 -2.05 -0.02 0.00 -0.34 0.00 0.00 43.02 40.47 3hcw s PHE 188 CO -0.01 -0.04 -0.06 0.42 -1.46 0.00 0.00 175.22 174.07 3hcw s ILE 189 N 0.61 3.48 0.31 3.12 1.01 0.15 -0.79 121.20 129.10 3hcw s ILE 189 Ca 0.00 -0.48 0.05 0.00 0.00 0.00 0.00 60.65 60.22 3hcw s ILE 189 Cb -0.14 -2.54 -0.06 0.00 0.01 0.00 0.00 42.46 39.73 3hcw s ILE 189 CO 0.02 0.47 0.02 0.28 0.00 0.00 0.00 174.94 175.72 3hcw s THR 190 N 0.88 1.34 0.14 2.92 -1.32 0.37 -1.04 115.64 118.93 3hcw s THR 190 Ca -0.01 -2.04 0.03 0.00 -1.21 0.00 0.00 61.69 58.46 3hcw s THR 190 Cb -0.15 -2.66 -0.04 0.00 -1.51 0.00 0.00 72.50 68.15 3hcw s THR 190 CO 0.01 -0.12 0.21 -1.61 -2.21 0.00 0.00 174.62 170.90 3hcw s GLU 191 N -3.83 3.21 0.92 7.08 2.02 -1.26 -1.12 118.70 125.72 3hcw s GLU 191 Ca 0.34 -0.69 -0.11 0.00 0.02 0.00 0.00 54.97 54.52 3hcw s GLU 191 Cb 0.07 -2.84 0.14 0.00 0.10 0.00 0.00 34.13 31.60 3hcw s GLU 191 CO 0.14 0.52 1.09 0.15 0.02 0.00 0.00 175.26 177.18 3hcw s LYS 192 N -3.09 1.06 0.00 1.61 1.02 -1.24 -4.86 119.74 114.24 3hcw s LYS 192 Ca 0.33 1.03 0.00 0.00 0.02 0.00 0.00 55.97 57.35 3hcw s LYS 192 Cb -0.11 -1.77 0.00 0.00 -0.52 0.00 0.00 37.83 35.43 3hcw s LYS 192 CO 0.26 -2.44 0.00 0.41 -0.92 0.00 0.00 175.35 172.67 3hcw n GLY 193 N -0.60 2.53 2.34 -3.33 0.00 -1.26 -4.85 105.19 100.02 3hcw n GLY 193 Ca 0.08 -1.62 -0.23 0.00 0.00 0.00 0.00 46.02 44.24 3hcw n GLY 193 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hcw n ASN 194 N 0.00 6.21 -4.73 1.61 3.02 -1.26 -4.96 115.26 115.15 3hcw n ASN 194 Ca 0.00 -2.97 -0.41 0.00 -0.03 0.00 0.00 54.58 51.17 3hcw n ASN 194 Cb 0.00 -1.30 -0.04 0.00 -0.61 0.00 0.00 39.78 37.83 3hcw n ASN 194 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3hcw s PHE 195 N -0.80 3.69 0.42 3.10 0.08 -1.26 -4.65 117.98 118.57 3hcw s PHE 195 Ca 0.61 1.68 0.10 0.00 0.12 0.00 0.00 56.93 59.45 3hcw s PHE 195 Cb 0.35 -3.18 0.92 0.00 -0.57 0.00 0.00 43.02 40.54 3hcw s PHE 195 CO -0.15 -0.26 2.01 0.93 -0.10 0.00 0.00 175.22 177.65 3hcw h GLU 196 N 5.38 0.27 -0.47 0.44 4.39 -1.93 -2.08 114.58 120.57 3hcw h GLU 196 Ca -0.44 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.19 3hcw h GLU 196 Cb 1.21 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.79 3hcw h GLU 196 CO 0.72 0.29 0.13 -0.24 -1.16 0.00 0.00 179.01 178.75 3hcw h VAL 197 N 0.27 1.23 0.02 3.13 3.04 -1.93 0.25 116.25 122.26 3hcw h VAL 197 Ca 0.06 -0.80 0.01 0.00 -1.01 0.00 0.00 66.70 64.97 3hcw h VAL 197 Cb 0.17 0.85 -0.02 0.00 -2.01 0.00 0.00 31.29 30.28 3hcw h VAL 197 CO 0.00 0.29 -0.09 -1.28 -1.01 0.00 0.00 177.57 175.47 3hcw h SER 198 N 0.64 -0.27 -0.57 3.17 0.87 -1.85 -0.89 113.55 114.65 3hcw h SER 198 Ca 0.15 0.04 0.02 0.00 -1.23 0.00 0.00 61.79 60.77 3hcw h SER 198 Cb 0.30 0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 62.34 3hcw h SER 198 CO -0.00 -0.14 0.35 0.11 -0.53 0.00 0.00 176.83 176.62 3hcw h LYS 199 N -0.17 0.68 -0.45 2.24 1.57 -1.13 -0.44 116.57 118.87 3hcw h LYS 199 Ca 0.03 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 3hcw h LYS 199 Cb 0.21 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.34 3hcw h LYS 199 CO -0.08 0.45 0.16 -0.44 -0.57 0.00 0.00 179.45 178.96 3hcw h ASP 200 N 0.70 0.64 -0.04 0.86 3.45 -0.83 -1.16 116.42 120.02 3hcw h ASP 200 Ca 0.23 -0.19 -0.20 0.00 0.43 0.00 0.00 57.03 57.30 3hcw h ASP 200 Cb 0.01 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 38.61 3hcw h ASP 200 CO -0.09 0.65 -0.69 0.03 -1.57 0.00 0.00 179.24 177.57 3hcw h ARG 201 N 0.58 0.68 -0.08 3.56 3.08 -0.97 -2.17 114.38 119.05 3hcw h ARG 201 Ca 0.15 -0.51 0.01 0.00 0.07 0.00 0.00 59.98 59.71 3hcw h ARG 201 Cb 0.23 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 3hcw h ARG 201 CO -0.01 1.13 -0.01 0.82 -1.07 0.00 0.00 179.97 180.83 3hcw h ILE 202 N 0.48 0.93 -0.70 2.04 2.04 -1.11 -2.37 117.51 118.83 3hcw h ILE 202 Ca -0.03 -0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.90 3hcw h ILE 202 Cb 1.29 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 38.22 3hcw h ILE 202 CO 0.14 0.00 0.37 -0.61 0.00 0.00 0.00 178.15 178.05 3hcw h GLN 203 N 0.01 0.65 -0.23 2.37 5.75 -1.10 -0.27 115.11 122.29 3hcw h GLN 203 Ca 0.04 -0.04 -0.08 0.00 -0.15 0.00 0.00 58.65 58.42 3hcw h GLN 203 Cb 0.05 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.44 3hcw h GLN 203 CO -0.08 0.43 -0.21 0.78 -2.65 0.00 0.00 178.83 177.10 3hcw h GLY 204 N 0.66 0.45 0.56 2.39 0.00 -1.36 -1.73 103.07 104.05 3hcw h GLY 204 Ca 0.33 -0.34 -0.00 0.00 0.00 0.00 0.00 47.33 47.31 3hcw h GLY 204 CO -0.22 0.31 -0.04 -2.75 0.00 0.00 0.00 176.54 173.84 3hcw h PHE 205 N 0.38 -0.10 -0.50 5.60 3.57 -0.84 -2.83 116.94 122.22 3hcw h PHE 205 Ca 0.06 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 3hcw h PHE 205 Cb 0.58 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.33 3hcw h PHE 205 CO 0.02 0.32 0.29 0.93 -2.23 0.00 0.00 178.31 177.63 3hcw h GLU 206 N -0.56 0.67 -0.17 1.11 5.08 -1.03 -1.70 114.58 117.99 3hcw h GLU 206 Ca -0.01 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 3hcw h GLU 206 Cb 0.47 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 3hcw h GLU 206 CO 0.02 0.48 -0.17 1.15 -1.00 0.00 0.00 179.01 179.50 3hcw h THR 207 N 0.68 1.34 -0.33 1.13 2.02 -1.32 -0.98 112.91 115.46 3hcw h THR 207 Ca 0.18 -1.33 -0.15 0.00 0.77 0.00 0.00 66.41 65.88 3hcw h THR 207 Cb -0.01 1.83 -0.01 0.00 -1.74 0.00 0.00 68.15 68.22 3hcw h THR 207 CO -0.03 0.40 -0.39 0.58 0.37 0.00 0.00 175.52 176.44 3hcw h VAL 208 N 0.05 1.28 -0.82 3.16 2.07 -1.39 0.21 116.25 120.82 3hcw h VAL 208 Ca 0.03 -1.57 -0.02 0.00 0.82 0.00 0.00 66.70 65.96 3hcw h VAL 208 Cb 0.70 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.88 3hcw h VAL 208 CO 0.04 0.51 0.43 0.00 0.02 0.00 0.00 177.57 178.58 3hcw h ALA 209 N 0.89 1.05 -0.07 1.67 0.00 -1.36 -1.87 119.26 119.57 3hcw h ALA 209 Ca 0.05 -0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.60 3hcw h ALA 209 Cb 0.96 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 18.43 3hcw h ALA 209 CO 0.09 0.57 -0.86 0.66 0.00 0.00 0.00 179.25 179.71 3hcw h SER 210 N 1.14 0.76 -0.64 0.00 4.64 -1.00 0.91 113.55 119.36 3hcw h SER 210 Ca 0.29 -0.54 0.09 0.00 -0.47 0.00 0.00 61.79 61.15 3hcw h SER 210 Cb 0.06 -0.23 -0.04 0.00 -0.31 0.00 0.00 62.40 61.88 3hcw h SER 210 CO -0.04 1.33 0.43 -0.61 -0.87 0.00 0.00 176.83 177.06 3hcw h GLN 211 N 0.39 0.50 -0.65 4.77 5.75 -0.73 -0.58 115.11 124.55 3hcw h GLN 211 Ca -0.07 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.40 3hcw h GLN 211 Cb 1.48 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.92 3hcw h GLN 211 CO 0.16 0.33 0.00 1.19 -2.65 0.00 0.00 178.83 177.86 3hcw n PHE 212 N -4.48 1.08 -3.87 3.99 3.72 -0.72 -4.97 117.46 112.21 3hcw n PHE 212 Ca 0.10 -0.55 -0.25 0.00 -0.05 0.00 0.00 57.45 56.71 3hcw n PHE 212 Cb 0.33 -0.09 -0.00 0.00 -0.94 0.00 0.00 39.48 38.78 3hcw n PHE 212 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3hcw n ASN 213 N 1.29 -0.97 -4.88 4.37 2.85 -0.23 -4.99 115.26 112.71 3hcw n ASN 213 Ca 0.23 -0.93 -0.30 0.00 -0.11 0.00 0.00 54.58 53.47 3hcw n ASN 213 Cb 0.69 -3.44 -0.05 0.00 1.24 0.00 0.00 39.78 38.23 3hcw n ASN 213 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 3hcw s LEU 214 N -6.89 4.20 0.20 1.20 1.02 0.27 -5.02 118.68 113.65 3hcw s LEU 214 Ca 0.07 0.17 -0.30 0.00 0.02 0.00 0.00 54.13 54.09 3hcw s LEU 214 Cb -0.04 -2.81 -0.08 0.00 0.02 0.00 0.00 46.19 43.28 3hcw s LEU 214 CO 0.86 0.15 1.01 -1.81 0.02 0.00 0.00 176.35 176.59 3hcw s ASP 215 N -2.60 7.45 0.09 2.29 -0.00 -1.24 -4.64 116.67 118.02 3hcw s ASP 215 Ca 0.33 2.00 -0.11 0.00 -0.00 0.00 0.00 52.55 54.77 3hcw s ASP 215 Cb -0.12 -2.61 0.01 0.00 -0.00 0.00 0.00 42.92 40.20 3hcw s ASP 215 CO 0.26 -0.05 0.26 -0.72 -0.00 0.00 0.00 175.17 174.92 3hcw s TYR 216 N -0.63 0.02 0.06 4.23 -0.85 -1.26 -1.04 117.35 117.88 3hcw s TYR 216 Ca 0.45 -0.37 0.01 0.00 -0.52 0.00 0.00 57.07 56.65 3hcw s TYR 216 Cb -0.27 0.04 -0.03 0.00 0.38 0.00 0.00 41.96 42.08 3hcw s TYR 216 CO 0.34 -0.57 -0.06 1.14 -1.52 0.00 0.00 175.55 174.88 3hcw s GLN 217 N -3.55 0.61 -0.12 -3.49 -2.07 -0.61 -4.97 119.66 105.46 3hcw s GLN 217 Ca 0.02 -1.01 -0.00 0.00 -1.82 0.00 0.00 55.36 52.55 3hcw s GLN 217 Cb 0.03 -0.11 -0.02 0.00 -1.09 0.00 0.00 33.01 31.82 3hcw s GLN 217 CO -0.10 -0.02 -0.11 0.42 -1.32 0.00 0.00 175.29 174.17 3hcw s ILE 218 N -2.59 3.24 -0.15 3.63 -1.09 -1.26 -1.49 121.20 121.49 3hcw s ILE 218 Ca -0.01 -0.60 0.02 0.00 -2.23 0.00 0.00 60.65 57.83 3hcw s ILE 218 Cb -0.02 -2.36 0.01 0.00 -1.58 0.00 0.00 42.46 38.51 3hcw s ILE 218 CO -0.03 0.53 -0.21 -0.63 -1.23 0.00 0.00 174.94 173.37 3hcw s ILE 219 N 0.18 2.12 -0.20 2.92 1.01 0.03 -4.98 121.20 122.28 3hcw s ILE 219 Ca -0.06 -0.95 -0.08 0.00 0.00 0.00 0.00 60.65 59.55 3hcw s ILE 219 Cb -0.15 -1.86 -0.04 0.00 0.01 0.00 0.00 42.46 40.42 3hcw s ILE 219 CO 0.04 0.54 0.08 -0.70 0.00 0.00 0.00 174.94 174.91 3hcw s GLU 220 N 0.90 3.98 0.05 2.79 2.12 -1.26 -0.48 118.70 126.79 3hcw s GLU 220 Ca -0.05 -0.33 -0.06 0.00 0.36 0.00 0.00 54.97 54.89 3hcw s GLU 220 Cb -0.15 -3.29 -0.01 0.00 0.26 0.00 0.00 34.13 30.93 3hcw s GLU 220 CO -0.04 0.20 0.11 -0.08 -0.54 0.00 0.00 175.26 174.91 3hcw s THR 221 N 0.60 0.14 0.58 -1.70 -1.32 -0.27 -4.97 115.64 108.70 3hcw s THR 221 Ca 0.04 -1.14 -0.07 0.00 -1.21 0.00 0.00 61.69 59.31 3hcw s THR 221 Cb -0.13 -1.02 -0.01 0.00 -1.51 0.00 0.00 72.50 69.84 3hcw s THR 221 CO 0.01 -0.63 0.91 -0.94 -2.21 0.00 0.00 174.62 171.76 3hcw s SER 222 N -2.30 5.82 0.00 8.08 1.04 -1.26 -3.68 113.70 121.41 3hcw s SER 222 Ca -0.02 0.90 0.09 0.00 0.48 0.00 0.00 55.95 57.40 3hcw s SER 222 Cb 0.01 -1.96 0.55 0.00 0.10 0.00 0.00 66.02 64.71 3hcw s SER 222 CO -0.06 -0.95 0.98 -0.46 0.98 0.00 0.00 173.24 173.74 3hcw n ASN 223 N -2.57 0.00 -4.69 7.02 6.94 -1.26 -4.55 115.26 116.15 3hcw n ASN 223 Ca 0.04 -0.63 -0.42 0.00 -0.02 0.00 0.00 54.58 53.55 3hcw n ASN 223 Cb 0.56 0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 37.96 3hcw n ASN 223 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 3hcw s GLU 224 N -2.00 4.28 0.18 -3.83 2.02 -1.26 -4.93 118.70 113.17 3hcw s GLU 224 Ca 0.14 2.00 -0.24 0.00 0.02 0.00 0.00 54.97 56.88 3hcw s GLU 224 Cb 0.06 -3.53 0.07 0.00 0.10 0.00 0.00 34.13 30.83 3hcw s GLU 224 CO 0.11 -0.56 1.56 -0.09 0.02 0.00 0.00 175.26 176.29 3hcw h ARG 225 N 7.73 -0.11 -0.64 1.61 9.65 -1.97 -0.42 114.38 130.22 3hcw h ARG 225 Ca -0.39 0.01 0.10 0.00 -1.10 0.00 0.00 59.98 58.60 3hcw h ARG 225 Cb 1.18 0.03 -0.08 0.00 -1.39 0.00 0.00 29.97 29.71 3hcw h ARG 225 CO 0.90 -0.08 0.25 1.49 2.80 0.00 0.00 179.97 185.33 3hcw h GLU 226 N -0.12 0.42 -0.16 0.20 4.81 -1.98 0.27 114.58 118.02 3hcw h GLU 226 Ca 0.22 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.39 3hcw h GLU 226 Cb 0.54 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.82 3hcw h GLU 226 CO -0.82 0.28 -0.05 0.28 -0.73 0.00 0.00 179.01 177.97 3hcw h VAL 227 N 0.43 1.29 -0.16 0.32 2.07 -1.59 -1.74 116.25 116.88 3hcw h VAL 227 Ca 0.33 -1.03 0.01 0.00 0.82 0.00 0.00 66.70 66.83 3hcw h VAL 227 Cb 0.42 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 3hcw h VAL 227 CO -0.32 0.30 0.07 0.40 0.02 0.00 0.00 177.57 178.05 3hcw h ILE 228 N -0.00 0.99 -0.73 4.57 1.08 -0.95 -2.66 117.51 119.81 3hcw h ILE 228 Ca 0.04 -0.06 0.14 0.00 -0.39 0.00 0.00 64.86 64.59 3hcw h ILE 228 Cb 0.49 0.82 -0.10 0.00 -3.07 0.00 0.00 36.82 34.96 3hcw h ILE 228 CO 0.02 0.03 0.26 0.25 -0.69 0.00 0.00 178.15 178.02 3hcw h LEU 229 N 0.16 0.21 -0.54 1.44 5.85 -0.85 -0.60 115.31 120.98 3hcw h LEU 229 Ca 0.06 0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 3hcw h LEU 229 Cb 0.02 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 3hcw h LEU 229 CO -0.05 0.07 0.19 -1.13 -0.34 0.00 0.00 178.44 177.19 3hcw h ASN 230 N 0.39 0.76 -0.70 1.25 -1.24 -1.08 0.12 115.58 115.09 3hcw h ASN 230 Ca 0.40 -0.19 -0.04 0.00 0.71 0.00 0.00 56.30 57.19 3hcw h ASN 230 Cb 0.62 -0.20 -0.03 0.00 0.73 0.00 0.00 38.32 39.44 3hcw h ASN 230 CO -0.42 0.74 0.29 1.88 -1.29 0.00 0.00 177.43 178.63 3hcw h TYR 231 N 0.73 1.06 0.00 0.67 0.05 -1.02 -2.52 116.97 115.93 3hcw h TYR 231 Ca 0.18 -0.07 -0.18 0.00 0.05 0.00 0.00 58.73 58.71 3hcw h TYR 231 Cb 0.23 -0.32 -0.03 0.00 1.01 0.00 0.00 36.73 37.63 3hcw h TYR 231 CO 0.01 0.81 -0.83 0.52 -1.05 0.00 0.00 178.16 177.62 3hcw h MET 232 N 1.00 0.00 -0.53 4.88 2.86 -0.92 -3.16 114.93 119.06 3hcw h MET 232 Ca 0.24 0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.92 3hcw h MET 232 Cb 0.19 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.81 3hcw h MET 232 CO -0.02 0.83 0.28 1.96 1.06 0.00 0.00 176.91 181.02 3hcw h GLN 233 N 0.00 0.53 -0.60 1.72 4.20 -0.65 -1.20 115.11 119.11 3hcw h GLN 233 Ca -0.01 -0.03 0.16 0.00 0.06 0.00 0.00 58.65 58.83 3hcw h GLN 233 Cb 1.49 -0.12 -0.03 0.00 0.30 0.00 0.00 27.48 29.13 3hcw h GLN 233 CO 0.11 0.35 0.43 -0.91 -0.67 0.00 0.00 178.83 178.14 3hcw h ASN 234 N 0.55 0.07 -0.01 1.46 2.35 -1.42 -2.64 115.58 115.94 3hcw h ASN 234 Ca 0.23 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 3hcw h ASN 234 Cb 0.11 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.47 3hcw h ASN 234 CO -0.15 0.04 -0.72 0.18 -1.65 0.00 0.00 177.43 175.13 3hcw n LEU 235 N -4.39 1.45 -0.19 1.61 4.77 -0.86 -4.68 117.00 114.71 3hcw n LEU 235 Ca 0.11 -0.62 -0.00 0.00 -0.03 0.00 0.00 56.01 55.46 3hcw n LEU 235 Cb 0.62 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.79 3hcw n LEU 235 CO 0.36 0.30 0.80 -0.74 -1.33 0.00 0.00 177.39 176.79 3hcw h HIS 236 N 1.13 -0.14 -0.53 -1.77 2.76 -0.85 0.14 115.15 115.88 3hcw h HIS 236 Ca 0.00 0.05 -0.03 0.00 -2.20 0.00 0.00 60.37 58.19 3hcw h HIS 236 Cb 0.60 0.15 -0.02 0.00 1.55 0.00 0.00 27.41 29.69 3hcw h HIS 236 CO 0.00 -0.19 0.23 1.15 -1.30 0.00 0.00 177.93 177.82 3hcw h THR 237 N 0.07 1.21 -0.23 6.26 2.02 -1.83 -1.91 112.91 118.49 3hcw h THR 237 Ca 0.29 -0.64 -0.17 0.00 0.77 0.00 0.00 66.41 66.66 3hcw h THR 237 Cb 0.47 0.64 -0.00 0.00 -1.74 0.00 0.00 68.15 67.51 3hcw h THR 237 CO -0.54 0.25 -0.53 -0.09 0.37 0.00 0.00 175.52 174.98 3hcw h ARG 238 N 0.72 0.68 0.00 6.66 2.43 -1.67 -2.66 114.38 120.54 3hcw h ARG 238 Ca 0.18 -0.42 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 3hcw h ARG 238 Cb 0.17 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 3hcw h ARG 238 CO -0.02 1.04 0.00 -0.07 -1.51 0.00 0.00 179.97 179.41 3hcw h LEU 239 N 0.53 0.00 -1.82 3.80 3.38 -0.56 -1.79 115.31 118.84 3hcw h LEU 239 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3hcw h LEU 239 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3hcw h LEU 239 CO 0.11 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.93 3hcw n LYS 240 N -2.84 1.46 -2.37 1.13 5.02 -0.74 -4.57 118.16 115.25 3hcw n LYS 240 Ca -0.01 -1.58 -0.43 0.00 -2.02 0.00 0.00 58.31 54.27 3hcw n LYS 240 Cb 0.14 -1.31 -0.02 0.00 -0.02 0.00 0.00 35.03 33.81 3hcw n LYS 240 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3hcw s ASP 241 N -1.25 6.82 0.47 4.39 3.68 -0.68 -4.92 116.67 125.19 3hcw s ASP 241 Ca 0.21 1.61 0.27 0.00 2.13 0.00 0.00 52.55 56.77 3hcw s ASP 241 Cb 0.14 -2.54 1.01 0.00 -1.45 0.00 0.00 42.92 40.08 3hcw s ASP 241 CO 0.20 -0.88 1.86 -0.65 0.13 0.00 0.00 175.17 175.82 3hcw h PRO 242 N 8.74 0.00 0.00 4.34 0.11 -1.92 -2.90 132.00 140.37 3hcw h PRO 242 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3hcw h PRO 242 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3hcw h PRO 242 CO 0.99 0.15 0.00 -0.91 -0.21 0.00 0.00 178.00 178.02 3hcw h ASN 243 N 0.00 0.00 -3.54 -2.05 2.35 -1.96 -3.43 115.58 106.95 3hcw h ASN 243 Ca -0.00 0.00 -0.67 0.00 -0.55 0.00 0.00 56.30 55.08 3hcw h ASN 243 Cb 0.70 0.00 -0.27 0.00 0.05 0.00 0.00 38.32 38.80 3hcw h ASN 243 CO 0.02 0.00 -0.67 -0.63 -1.65 0.00 0.00 177.43 174.50 3hcw s ILE 244 N -3.32 3.70 -0.33 2.81 1.09 -1.10 -5.05 121.20 118.99 3hcw s ILE 244 Ca 0.06 -0.59 -0.22 0.00 -1.10 0.00 0.00 60.65 58.79 3hcw s ILE 244 Cb 0.08 -2.81 0.00 0.00 -1.06 0.00 0.00 42.46 38.67 3hcw s ILE 244 CO 0.59 0.24 0.73 -0.54 -0.10 0.00 0.00 174.94 175.86 3hcw s LYS 245 N 1.49 3.83 0.22 2.79 1.02 -1.26 -4.82 119.74 123.00 3hcw s LYS 245 Ca 0.04 0.35 0.11 0.00 0.02 0.00 0.00 55.97 56.49 3hcw s LYS 245 Cb -0.16 -3.77 -0.05 0.00 -0.52 0.00 0.00 37.83 33.34 3hcw s LYS 245 CO 0.00 -0.73 -0.20 -0.65 -0.92 0.00 0.00 175.35 172.85 3hcw s GLN 246 N 2.91 1.67 -0.01 1.68 -0.21 -1.26 -0.08 119.66 124.35 3hcw s GLN 246 Ca 0.29 -1.55 0.02 0.00 0.02 0.00 0.00 55.36 54.14 3hcw s GLN 246 Cb -0.14 -1.88 0.00 0.00 1.00 0.00 0.00 33.01 31.99 3hcw s GLN 246 CO 0.14 0.38 -0.06 0.00 -2.12 0.00 0.00 175.29 173.64 3hcw s ALA 247 N -1.92 0.55 -0.21 6.09 0.00 -1.10 -1.12 121.76 124.06 3hcw s ALA 247 Ca 0.24 -0.22 -0.04 0.00 0.00 0.00 0.00 51.96 51.94 3hcw s ALA 247 Cb -0.07 -0.19 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 3hcw s ALA 247 CO 0.12 0.10 -0.04 0.42 0.00 0.00 0.00 175.76 176.37 3hcw s ILE 248 N 0.07 3.53 -0.15 0.00 1.01 0.77 -1.37 121.20 125.07 3hcw s ILE 248 Ca -0.01 -0.45 -0.01 0.00 0.00 0.00 0.00 60.65 60.18 3hcw s ILE 248 Cb -0.05 -2.59 -0.02 0.00 0.01 0.00 0.00 42.46 39.81 3hcw s ILE 248 CO -0.00 0.43 -0.10 -0.63 0.00 0.00 0.00 174.94 174.64 3hcw s ILE 249 N 1.22 3.23 0.00 2.92 1.01 0.80 -1.95 121.20 128.42 3hcw s ILE 249 Ca 0.03 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 60.09 3hcw s ILE 249 Cb -0.14 -2.38 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 3hcw s ILE 249 CO -0.01 0.51 0.04 -0.44 0.00 0.00 0.00 174.94 175.04 3hcw s SER 250 N 0.50 5.41 0.33 3.58 0.01 -0.88 0.35 113.70 122.99 3hcw s SER 250 Ca -0.07 0.06 0.11 0.00 1.31 0.00 0.00 55.95 57.36 3hcw s SER 250 Cb -0.15 -1.48 0.96 0.00 0.21 0.00 0.00 66.02 65.56 3hcw s SER 250 CO 0.04 0.27 1.70 0.25 0.41 0.00 0.00 173.24 175.90 3hcw h LEU 251 N 4.16 0.57 -7.05 2.44 5.85 -1.44 -3.27 115.31 116.57 3hcw h LEU 251 Ca -0.49 0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.33 3hcw h LEU 251 Cb 1.18 0.09 -0.19 0.00 0.37 0.00 0.00 40.66 42.11 3hcw h LEU 251 CO 0.60 -0.02 0.14 -0.62 -0.34 0.00 0.00 178.44 178.20 3hcw s ASP 252 N -5.06 -0.62 0.36 1.25 2.15 -1.26 -4.24 116.67 109.24 3hcw s ASP 252 Ca -0.10 0.71 0.03 0.00 0.43 0.00 0.00 52.55 53.62 3hcw s ASP 252 Cb 0.28 0.58 0.68 0.00 -0.30 0.00 0.00 42.92 44.17 3hcw s ASP 252 CO 0.79 -0.57 2.01 0.00 -0.17 0.00 0.00 175.17 177.24 3hcw h ALA 253 N 3.24 1.60 -0.32 3.66 0.00 -1.64 -0.92 119.26 124.88 3hcw h ALA 253 Ca -0.27 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 3hcw h ALA 253 Cb 1.15 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3hcw h ALA 253 CO 0.37 0.36 0.00 1.98 0.00 0.00 0.00 179.25 181.96 3hcw h MET 254 N 0.80 0.56 -0.50 0.00 -1.53 -1.95 -0.87 114.93 111.45 3hcw h MET 254 Ca 0.23 -0.18 -0.03 0.00 -3.44 0.00 0.00 59.70 56.29 3hcw h MET 254 Cb -0.04 -0.05 -0.02 0.00 -0.55 0.00 0.00 31.60 30.94 3hcw h MET 254 CO -0.06 0.69 0.18 1.25 0.14 0.00 0.00 176.91 179.11 3hcw h LEU 255 N 0.36 0.70 -1.23 3.39 5.85 -1.93 -3.13 115.31 119.32 3hcw h LEU 255 Ca 0.09 -0.18 0.12 0.00 0.84 0.00 0.00 57.88 58.75 3hcw h LEU 255 Cb 0.43 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.21 3hcw h LEU 255 CO 0.02 0.69 0.57 -0.74 -0.34 0.00 0.00 178.44 178.64 3hcw h HIS 256 N 0.66 0.90 -0.25 1.25 2.76 -0.85 -1.97 115.15 117.65 3hcw h HIS 256 Ca 0.16 0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.29 3hcw h HIS 256 Cb 0.22 -0.29 -0.01 0.00 1.55 0.00 0.00 27.41 28.88 3hcw h HIS 256 CO 0.01 0.38 -0.16 -0.07 -1.30 0.00 0.00 177.93 176.79 3hcw h LEU 257 N 0.80 0.42 -0.51 0.26 3.38 -1.11 -1.24 115.31 117.31 3hcw h LEU 257 Ca 0.43 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 58.18 3hcw h LEU 257 Cb 0.55 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3hcw h LEU 257 CO -0.19 0.60 -0.13 0.00 0.09 0.00 0.00 178.44 178.80 3hcw h ALA 258 N 1.45 0.70 -0.17 1.53 0.00 -1.41 -2.69 119.26 118.67 3hcw h ALA 258 Ca 0.07 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 54.64 3hcw h ALA 258 Cb 0.51 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3hcw h ALA 258 CO 0.03 0.63 0.04 0.82 0.00 0.00 0.00 179.25 180.77 3hcw h ILE 259 N 0.85 0.93 -0.43 0.00 1.08 -0.94 -2.38 117.51 116.62 3hcw h ILE 259 Ca 0.13 -0.04 -0.00 0.00 -0.39 0.00 0.00 64.86 64.56 3hcw h ILE 259 Cb 0.70 0.82 -0.02 0.00 -3.07 0.00 0.00 36.82 35.25 3hcw h ILE 259 CO 0.05 0.02 0.26 -0.07 -0.69 0.00 0.00 178.15 177.73 3hcw h LEU 260 N 0.11 0.51 -0.46 1.44 3.38 -1.20 -0.05 115.31 119.03 3hcw h LEU 260 Ca 0.07 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 3hcw h LEU 260 Cb 0.06 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3hcw h LEU 260 CO -0.09 0.39 0.00 -1.28 0.09 0.00 0.00 178.44 177.55 3hcw h SER 261 N 0.59 0.79 -0.32 -0.43 0.87 -1.20 0.48 113.55 114.34 3hcw h SER 261 Ca 0.16 -0.30 -0.13 0.00 -1.23 0.00 0.00 61.79 60.28 3hcw h SER 261 Cb -0.03 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 61.71 3hcw h SER 261 CO -0.03 0.91 -0.31 0.58 -0.53 0.00 0.00 176.83 177.44 3hcw h VAL 262 N 0.66 1.29 -0.61 2.23 2.07 -0.90 -2.01 116.25 118.99 3hcw h VAL 262 Ca 0.13 -1.48 0.01 0.00 0.82 0.00 0.00 66.70 66.18 3hcw h VAL 262 Cb 0.50 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 3hcw h VAL 262 CO 0.02 0.48 0.40 -0.07 0.02 0.00 0.00 177.57 178.43 3hcw h LEU 263 N 0.54 0.68 -0.30 2.57 4.07 -0.86 -1.29 115.31 120.73 3hcw h LEU 263 Ca 0.05 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 57.97 3hcw h LEU 263 Cb 0.89 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.45 3hcw h LEU 263 CO 0.08 0.49 0.10 0.22 -1.08 0.00 0.00 178.44 178.25 3hcw h TYR 264 N 0.80 0.47 -0.32 1.13 3.20 -0.73 -0.41 116.97 121.12 3hcw h TYR 264 Ca 0.23 -0.05 0.01 0.00 3.14 0.00 0.00 58.73 62.06 3hcw h TYR 264 Cb -0.06 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.05 3hcw h TYR 264 CO -0.00 0.49 0.21 1.49 -1.64 0.00 0.00 178.16 178.71 3hcw h GLU 265 N 0.32 0.40 -0.22 1.82 4.81 -0.51 -1.82 114.58 119.38 3hcw h GLU 265 Ca 0.10 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3hcw h GLU 265 Cb 0.23 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.52 3hcw h GLU 265 CO -0.00 0.27 0.00 1.28 -0.73 0.00 0.00 179.01 179.82 3hcw n LEU 266 N -4.49 2.52 -3.14 1.64 4.77 -0.62 -4.94 117.00 112.74 3hcw n LEU 266 Ca 0.02 -1.02 -0.23 0.00 -0.03 0.00 0.00 56.01 54.75 3hcw n LEU 266 Cb 0.08 -0.13 0.03 0.00 -2.33 0.00 0.00 43.42 41.06 3hcw n LEU 266 CO 0.35 0.51 0.00 -3.20 -1.33 0.00 0.00 177.39 173.72 3hcw n ASN 267 N 0.90 -5.55 -4.41 -1.43 4.05 -0.69 -4.96 115.26 103.18 3hcw n ASN 267 Ca 0.17 -0.33 -0.44 0.00 0.45 0.00 0.00 54.58 54.44 3hcw n ASN 267 Cb 0.48 -4.49 -0.04 0.00 1.23 0.00 0.00 39.78 36.95 3hcw n ASN 267 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3hcw s ILE 268 N -3.13 4.60 0.17 -1.44 1.01 -0.20 -5.03 121.20 117.18 3hcw s ILE 268 Ca 0.34 -0.70 -0.16 0.00 0.00 0.00 0.00 60.65 60.13 3hcw s ILE 268 Cb -0.16 -4.57 -0.07 0.00 0.01 0.00 0.00 42.46 37.66 3hcw s ILE 268 CO 0.42 -1.27 0.60 -1.83 0.00 0.00 0.00 174.94 172.87 3hcw s GLU 269 N 3.29 4.06 -0.08 2.79 -1.05 -1.26 -4.56 118.70 121.89 3hcw s GLU 269 Ca 0.16 0.60 0.04 0.00 -0.15 0.00 0.00 54.97 55.62 3hcw s GLU 269 Cb -0.21 -2.91 -0.00 0.00 -0.44 0.00 0.00 34.13 30.57 3hcw s GLU 269 CO 0.08 0.45 -0.21 0.42 0.95 0.00 0.00 175.26 176.95 3hcw s ILE 270 N -1.49 1.81 -1.38 1.83 1.01 -1.26 0.98 121.20 122.69 3hcw s ILE 270 Ca 0.40 -0.89 0.30 0.00 0.00 0.00 0.00 60.65 60.45 3hcw s ILE 270 Cb -0.15 -1.56 0.45 0.00 0.01 0.00 0.00 42.46 41.20 3hcw s ILE 270 CO 0.20 0.51 1.98 -0.81 0.00 0.00 0.00 174.94 176.81 3hcw n PRO 271 N 3.41 0.39 -0.09 2.79 -0.04 -1.26 -4.77 135.00 135.43 3hcw n PRO 271 Ca -0.19 -0.04 -0.08 0.00 -0.04 0.00 0.00 63.50 63.15 3hcw n PRO 271 Cb 0.53 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.47 3hcw n PRO 271 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3hcw h LYS 272 N 0.10 -0.25 0.05 0.54 3.64 -1.91 -3.17 116.57 115.57 3hcw h LYS 272 Ca 0.00 0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.25 3hcw h LYS 272 Cb 0.34 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 3hcw h LYS 272 CO 0.00 -0.17 -0.78 -0.44 -2.27 0.00 0.00 179.45 175.80 3hcw h ASP 273 N -0.26 0.16 -4.47 4.20 3.32 0.31 -3.48 116.42 116.20 3hcw h ASP 273 Ca 0.16 -0.83 -0.20 0.00 0.02 0.00 0.00 57.03 56.18 3hcw h ASP 273 Cb 0.51 -0.05 -0.24 0.00 0.22 0.00 0.00 39.33 39.78 3hcw h ASP 273 CO -0.48 1.33 -0.71 -0.69 -1.72 0.00 0.00 179.24 176.97 3hcw s VAL 274 N -2.35 0.09 0.16 -1.35 1.01 -1.11 -4.39 120.40 112.46 3hcw s VAL 274 Ca -0.21 -0.55 -0.10 0.00 0.00 0.00 0.00 61.98 61.12 3hcw s VAL 274 Cb 0.02 -0.17 -0.06 0.00 0.00 0.00 0.00 36.38 36.16 3hcw s VAL 274 CO 0.70 -0.29 0.48 -0.04 0.00 0.00 0.00 175.10 175.95 3hcw s MET 275 N -0.87 3.79 0.07 2.72 -1.94 -0.27 -4.13 119.30 118.66 3hcw s MET 275 Ca -0.09 0.23 0.03 0.00 -1.71 0.00 0.00 55.69 54.15 3hcw s MET 275 Cb -0.06 -2.83 -0.03 0.00 2.01 0.00 0.00 34.83 33.92 3hcw s MET 275 CO -0.01 0.44 -0.10 0.95 -0.01 0.00 0.00 175.02 176.29 3hcw s THR 276 N -1.60 0.81 0.17 2.05 -4.23 -0.51 -0.16 115.64 112.16 3hcw s THR 276 Ca 0.40 -1.31 -0.23 0.00 -1.18 0.00 0.00 61.69 59.37 3hcw s THR 276 Cb -0.13 -0.97 0.06 0.00 1.34 0.00 0.00 72.50 72.81 3hcw s THR 276 CO 0.21 -0.40 0.65 0.00 -0.54 0.00 0.00 174.62 174.54 3hcw s ALA 277 N -1.69 -1.55 0.00 3.99 0.00 -0.82 -4.07 121.76 117.62 3hcw s ALA 277 Ca -0.03 0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.30 3hcw s ALA 277 Cb -0.08 0.84 0.00 0.00 0.00 0.00 0.00 23.12 23.89 3hcw s ALA 277 CO 0.01 -0.82 0.00 -2.37 0.00 0.00 0.00 175.76 172.58 3hcw n THR 278 N -0.39 0.00 -4.43 0.00 5.66 -0.85 -2.07 114.28 112.20 3hcw n THR 278 Ca -0.14 0.00 -0.25 0.00 -3.05 0.00 0.00 64.05 60.61 3hcw n THR 278 Cb 0.64 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.32 3hcw n THR 278 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 3hcw s PHE 279 N -7.12 2.47 -0.50 1.09 0.08 -1.23 -2.41 117.98 110.36 3hcw s PHE 279 Ca 0.00 -0.43 -0.15 0.00 0.12 0.00 0.00 56.93 56.47 3hcw s PHE 279 Cb 0.00 -1.37 0.02 0.00 -0.57 0.00 0.00 43.02 41.10 3hcw s PHE 279 CO 0.00 0.56 0.63 -1.71 -0.10 0.00 0.00 175.22 174.59 3hcw n ASN 280 N -0.85 -7.60 -4.72 1.36 4.05 -0.61 -1.80 115.26 105.09 3hcw n ASN 280 Ca -0.05 0.32 -0.43 0.00 0.45 0.00 0.00 54.58 54.87 3hcw n ASN 280 Cb 0.62 -4.90 -0.03 0.00 1.23 0.00 0.00 39.78 36.70 3hcw n ASN 280 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 177.26 173.54 3hcw n ASP 281 N -0.62 3.83 -1.10 1.20 2.03 -1.06 -4.72 116.55 116.11 3hcw n ASP 281 Ca 0.06 1.08 -0.01 0.00 0.52 0.00 0.00 54.79 56.45 3hcw n ASP 281 Cb 0.50 -1.56 -0.00 0.00 -0.72 0.00 0.00 41.12 39.34 3hcw n ASP 281 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 3hcw n SER 282 N 3.48 -0.06 0.24 1.67 3.41 -1.26 -4.81 113.62 116.28 3hcw n SER 282 Ca 0.14 -1.10 0.13 0.00 -0.26 0.00 0.00 58.87 57.79 3hcw n SER 282 Cb 0.34 0.11 0.77 0.00 -0.26 0.00 0.00 64.21 65.18 3hcw n SER 282 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 3hcw h TYR 283 N 1.05 0.00 -0.07 7.33 3.20 -1.99 -2.89 116.97 123.59 3hcw h TYR 283 Ca -0.01 0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.67 3hcw h TYR 283 Cb 0.06 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.32 3hcw h TYR 283 CO 0.00 0.00 -0.74 -0.07 -1.64 0.00 0.00 178.16 175.71 3hcw h LEU 284 N 0.00 0.47 -0.09 2.82 3.38 -1.95 -1.98 115.31 117.96 3hcw h LEU 284 Ca 0.04 -0.31 -0.23 0.00 0.09 0.00 0.00 57.88 57.47 3hcw h LEU 284 Cb 0.19 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3hcw h LEU 284 CO -0.00 1.05 -1.02 0.71 0.09 0.00 0.00 178.44 179.27 3hcw h THR 285 N 0.27 1.52 -1.00 0.22 1.35 -1.89 -2.28 112.91 111.10 3hcw h THR 285 Ca -0.03 -2.86 0.06 0.00 -0.55 0.00 0.00 66.41 63.04 3hcw h THR 285 Cb 1.31 2.67 -0.07 0.00 -1.73 0.00 0.00 68.15 70.34 3hcw h THR 285 CO 0.13 0.83 0.64 -0.08 -0.25 0.00 0.00 175.52 176.79 3hcw h GLU 286 N 0.10 1.14 -0.26 4.72 4.81 -1.39 0.43 114.58 124.13 3hcw h GLU 286 Ca -0.07 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.01 3hcw h GLU 286 Cb 1.71 -0.26 -0.05 0.00 0.63 0.00 0.00 28.75 30.78 3hcw h GLU 286 CO 0.16 0.75 -0.05 0.44 -0.73 0.00 0.00 179.01 179.58 3hcw n ILE 287 N -4.51 2.35 -1.11 2.32 -5.35 -0.76 -4.47 119.36 107.83 3hcw n ILE 287 Ca 0.15 -2.35 -0.29 0.00 -0.27 0.00 0.00 62.75 60.00 3hcw n ILE 287 Cb 0.18 -0.28 0.19 0.00 -1.74 0.00 0.00 39.64 37.99 3hcw n ILE 287 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hcw s ALA 288 N -3.03 0.75 -0.42 -1.28 0.00 -0.86 -4.90 121.76 112.02 3hcw s ALA 288 Ca 0.42 -0.42 -0.05 0.00 0.00 0.00 0.00 51.96 51.91 3hcw s ALA 288 Cb 0.36 -3.10 0.11 0.00 0.00 0.00 0.00 23.12 20.49 3hcw s ALA 288 CO 0.04 -3.03 0.24 -1.12 0.00 0.00 0.00 175.76 171.88 3hcw s SER 289 N -3.43 5.38 0.68 0.00 0.01 -1.26 -1.93 113.70 113.15 3hcw s SER 289 Ca 0.66 -1.96 -0.07 0.00 1.31 0.00 0.00 55.95 55.89 3hcw s SER 289 Cb -0.18 -1.88 0.04 0.00 0.21 0.00 0.00 66.02 64.21 3hcw s SER 289 CO 0.58 -0.57 1.01 -2.16 0.41 0.00 0.00 173.24 172.50 3hcw s PRO 290 N 1.21 2.45 0.18 12.44 0.04 -1.26 -4.95 135.00 145.11 3hcw s PRO 290 Ca 0.07 -0.07 -0.32 0.00 0.04 0.00 0.00 61.00 60.72 3hcw s PRO 290 Cb -0.24 -2.16 -0.16 0.00 0.04 0.00 0.00 34.50 31.99 3hcw s PRO 290 CO -0.03 -1.10 1.08 -2.30 0.04 0.00 0.00 177.00 174.69 3hcw n PRO 291 N -2.87 1.00 -4.06 0.56 -0.02 -0.81 -4.78 135.00 124.02 3hcw n PRO 291 Ca 0.07 0.36 -0.35 0.00 -2.02 0.00 0.00 63.50 61.55 3hcw n PRO 291 Cb 0.59 -1.79 -0.09 0.00 -0.02 0.00 0.00 33.50 32.19 3hcw n PRO 291 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3hcw s GLN 292 N -0.55 3.65 0.16 -0.52 -1.52 0.13 -1.86 119.66 119.16 3hcw s GLN 292 Ca 0.72 -0.31 -0.31 0.00 -1.95 0.00 0.00 55.36 53.50 3hcw s GLN 292 Cb -0.87 -3.12 -0.09 0.00 -0.22 0.00 0.00 33.01 28.72 3hcw s GLN 292 CO 0.54 0.47 1.41 0.99 -0.25 0.00 0.00 175.29 178.45 3hcw s THR 293 N -0.19 3.04 0.04 -0.19 2.01 -1.26 -4.53 115.64 114.57 3hcw s THR 293 Ca 0.08 0.79 -0.18 0.00 0.31 0.00 0.00 61.69 62.68 3hcw s THR 293 Cb -0.12 -3.51 0.04 0.00 0.01 0.00 0.00 72.50 68.92 3hcw s THR 293 CO 0.01 0.08 0.42 0.00 -0.69 0.00 0.00 174.62 174.44 3hcw s ILE 295 N -2.40 5.05 -0.28 0.00 -1.09 -1.01 -0.25 121.20 121.22 3hcw s ILE 295 Ca -0.06 0.80 -0.29 0.00 -2.23 0.00 0.00 60.65 58.87 3hcw s ILE 295 Cb -0.01 -3.87 0.01 0.00 -1.58 0.00 0.00 42.46 37.01 3hcw s ILE 295 CO -0.02 0.02 1.17 -0.62 -1.23 0.00 0.00 174.94 174.26 3hcw s ASP 296 N 1.59 6.87 -0.13 3.58 2.15 0.14 -1.58 116.67 129.29 3hcw s ASP 296 Ca 0.21 1.25 0.16 0.00 0.43 0.00 0.00 52.55 54.60 3hcw s ASP 296 Cb -0.15 -2.54 0.63 0.00 -0.30 0.00 0.00 42.92 40.55 3hcw s ASP 296 CO 0.10 -0.90 1.54 2.30 -0.17 0.00 0.00 175.17 178.05 3hcw n ILE 297 N 5.82 1.99 -3.84 4.11 -5.35 -1.26 -1.76 119.36 119.07 3hcw n ILE 297 Ca 0.13 -1.39 -0.37 0.00 -0.27 0.00 0.00 62.75 60.86 3hcw n ILE 297 Cb 0.46 0.01 0.03 0.00 -1.74 0.00 0.00 39.64 38.41 3hcw n ILE 297 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 3hcw n LYS 298 N 0.52 -0.82 0.19 6.28 4.76 -1.26 -4.80 118.16 123.04 3hcw n LYS 298 Ca 0.23 0.34 0.03 0.00 -2.87 0.00 0.00 58.31 56.04 3hcw n LYS 298 Cb 0.88 -3.37 0.40 0.00 -1.84 0.00 0.00 35.03 31.10 3hcw n LYS 298 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 3hcw h PRO 299 N -2.06 0.01 -0.42 1.97 0.13 -1.92 -0.64 132.00 129.07 3hcw h PRO 299 Ca -0.67 -0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.33 3hcw h PRO 299 Cb 1.37 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.49 3hcw h PRO 299 CO 0.48 0.32 -0.25 -0.09 -0.23 0.00 0.00 178.00 178.23 3hcw h ARG 300 N 0.01 0.88 -0.25 0.86 2.43 -1.90 -1.74 114.38 114.66 3hcw h ARG 300 Ca -0.00 -0.38 -0.02 0.00 -0.81 0.00 0.00 59.98 58.76 3hcw h ARG 300 Cb 0.55 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 3hcw h ARG 300 CO 0.04 1.03 0.06 0.52 -1.51 0.00 0.00 179.97 180.11 3hcw h MET 301 N 0.75 0.40 -0.71 0.20 2.86 -1.77 -1.53 114.93 115.12 3hcw h MET 301 Ca 0.09 -0.09 0.12 0.00 -2.06 0.00 0.00 59.70 57.76 3hcw h MET 301 Cb 0.80 -0.05 -0.09 0.00 0.06 0.00 0.00 31.60 32.33 3hcw h MET 301 CO 0.07 0.49 0.28 -0.07 1.06 0.00 0.00 176.91 178.74 3hcw h LEU 302 N 0.23 0.27 -0.28 1.22 3.38 -1.01 -0.81 115.31 118.31 3hcw h LEU 302 Ca 0.08 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.10 3hcw h LEU 302 Cb 0.27 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3hcw h LEU 302 CO 0.00 0.12 0.01 1.23 0.09 0.00 0.00 178.44 179.89 3hcw h GLY 303 N 0.44 0.52 0.98 0.83 0.00 -1.21 -1.50 103.07 103.13 3hcw h GLY 303 Ca 0.38 -0.38 0.01 0.00 0.00 0.00 0.00 47.33 47.34 3hcw h GLY 303 CO -0.37 0.35 0.44 1.46 0.00 0.00 0.00 176.54 178.41 3hcw h GLN 304 N 0.27 0.86 -0.56 4.80 4.20 -0.93 -0.11 115.11 123.63 3hcw h GLN 304 Ca 0.08 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.66 3hcw h GLN 304 Cb 0.41 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 3hcw h GLN 304 CO 0.01 0.57 0.04 1.96 -0.67 0.00 0.00 178.83 180.74 3hcw h GLN 305 N 0.88 0.94 -0.49 1.46 1.08 -1.07 -0.39 115.11 117.52 3hcw h GLN 305 Ca 0.25 -0.25 -0.12 0.00 -1.45 0.00 0.00 58.65 57.07 3hcw h GLN 305 Cb -0.08 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.23 3hcw h GLN 305 CO -0.06 0.90 -0.18 0.00 -0.95 0.00 0.00 178.83 178.53 3hcw h ALA 306 N 1.17 0.75 -0.27 3.87 0.00 -0.95 -1.13 119.26 122.70 3hcw h ALA 306 Ca 0.17 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3hcw h ALA 306 Cb 0.45 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3hcw h ALA 306 CO 0.02 0.67 0.13 0.78 0.00 0.00 0.00 179.25 180.85 3hcw h GLY 307 N 0.91 0.41 0.99 0.00 0.00 -0.79 -2.08 103.07 102.50 3hcw h GLY 307 Ca 0.12 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 3hcw h GLY 307 CO 0.06 0.19 0.29 1.76 0.00 0.00 0.00 176.54 178.84 3hcw h SER 308 N 0.30 0.56 -0.25 0.19 0.02 -1.02 -2.74 113.55 110.60 3hcw h SER 308 Ca 0.09 -0.05 0.01 0.00 -0.84 0.00 0.00 61.79 61.00 3hcw h SER 308 Cb 0.11 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 3hcw h SER 308 CO -0.01 0.44 0.15 0.00 -1.14 0.00 0.00 176.83 176.26 3hcw h ALA 309 N 1.14 0.31 -0.29 3.77 0.00 -1.10 -1.50 119.26 121.60 3hcw h ALA 309 Ca 0.17 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 3hcw h ALA 309 Cb -0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3hcw h ALA 309 CO -0.03 -0.24 -0.29 0.97 0.00 0.00 0.00 179.25 179.66 3hcw h ILE 310 N 0.30 1.28 -0.81 0.00 6.09 -1.38 -0.89 117.51 122.10 3hcw h ILE 310 Ca 0.10 -1.38 -0.04 0.00 -1.37 0.00 0.00 64.86 62.17 3hcw h ILE 310 Cb -0.01 1.37 -0.04 0.00 0.47 0.00 0.00 36.82 38.62 3hcw h ILE 310 CO -0.04 0.44 0.34 -0.07 -3.07 0.00 0.00 178.15 175.75 3hcw h LEU 311 N 0.51 1.10 -0.49 2.19 4.07 -1.35 -1.33 115.31 120.01 3hcw h LEU 311 Ca 0.07 -0.16 -0.15 0.00 0.08 0.00 0.00 57.88 57.71 3hcw h LEU 311 Cb 0.76 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 42.21 3hcw h LEU 311 CO 0.06 0.96 -0.41 0.78 -1.08 0.00 0.00 178.44 178.75 3hcw h ASN 312 N 1.17 0.84 -0.64 -0.43 -0.26 -0.84 -1.73 115.58 113.69 3hcw h ASN 312 Ca 0.27 -0.39 -0.01 0.00 -0.56 0.00 0.00 56.30 55.61 3hcw h ASN 312 Cb 0.19 -0.24 -0.03 0.00 -1.06 0.00 0.00 38.32 37.18 3hcw h ASN 312 CO -0.03 1.14 0.36 0.40 -1.06 0.00 0.00 177.43 178.24 3hcw h ILE 313 N 0.64 1.20 0.00 2.81 2.04 -0.96 -2.87 117.51 120.37 3hcw h ILE 313 Ca 0.05 -0.49 -0.00 0.00 1.00 0.00 0.00 64.86 65.42 3hcw h ILE 313 Cb 0.97 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.42 3hcw h ILE 313 CO 0.09 0.22 -0.00 -0.07 0.00 0.00 0.00 178.15 178.39 3hcw h LEU 314 N 0.87 0.00 0.09 1.44 3.38 -1.05 -3.11 115.31 116.93 3hcw h LEU 314 Ca 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 3hcw h LEU 314 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3hcw h LEU 314 CO -0.04 0.00 -0.04 0.11 0.09 0.00 0.00 178.44 178.56 3hcw h LYS 315 N 0.00 -0.12 0.00 1.13 1.57 -1.09 -3.51 116.57 114.56 3hcw h LYS 315 Ca -0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3hcw h LYS 315 Cb 0.59 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.93 3hcw h LYS 315 CO 0.00 0.20 0.00 -1.71 -0.57 0.00 0.00 179.45 177.37 3hcw n ASN 316 N -5.00 0.00 0.00 0.86 2.85 -1.18 -5.12 115.26 107.67 3hcw n ASN 316 Ca -0.08 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.39 3hcw n ASN 316 Cb 0.20 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.22 3hcw n ASN 316 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 3hcw n ASP 320 N 0.00 0.00 -4.67 1.20 8.00 -1.26 -5.00 116.55 114.82 3hcw n ASP 320 Ca 0.00 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.08 3hcw n ASP 320 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 3hcw n ASP 320 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hcw s VAL 321 N -1.62 3.81 -0.41 2.53 1.01 -1.26 -4.99 120.40 119.47 3hcw s VAL 321 Ca 0.00 1.05 -0.20 0.00 0.00 0.00 0.00 61.98 62.83 3hcw s VAL 321 Cb 0.00 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.72 3hcw s VAL 321 CO 0.00 -0.07 0.63 -0.63 0.00 0.00 0.00 175.10 175.03 3hcw s ILE 322 N 3.45 4.86 0.19 2.22 -1.09 -1.26 -4.98 121.20 124.59 3hcw s ILE 322 Ca 0.65 0.23 -0.06 0.00 -2.23 0.00 0.00 60.65 59.24 3hcw s ILE 322 Cb -0.29 -4.15 0.01 0.00 -1.58 0.00 0.00 42.46 36.44 3hcw s ILE 322 CO 0.24 -0.50 1.58 -0.33 -1.23 0.00 0.00 174.94 174.71 3hcw h GLU 323 N 8.74 0.84 -2.34 2.79 5.08 -1.89 -3.37 114.58 124.43 3hcw h GLU 323 Ca -0.26 -0.37 -0.04 0.00 -1.00 0.00 0.00 59.36 57.69 3hcw h GLU 323 Cb 1.10 -0.02 -0.24 0.00 0.50 0.00 0.00 28.75 30.08 3hcw h GLU 323 CO 0.87 1.00 -0.22 -1.17 -1.00 0.00 0.00 179.01 178.49 3hcw s LEU 324 N -8.90 -0.66 -0.19 1.33 2.96 -1.26 -2.08 118.68 109.88 3hcw s LEU 324 Ca -0.10 1.19 -0.04 0.00 -0.22 0.00 0.00 54.13 54.96 3hcw s LEU 324 Cb 0.12 1.75 -0.02 0.00 0.50 0.00 0.00 46.19 48.54 3hcw s LEU 324 CO 0.85 -0.22 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.94 3hcw s VAL 325 N 2.15 3.67 -0.21 1.68 1.01 0.48 -4.97 120.40 124.22 3hcw s VAL 325 Ca -0.06 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.45 3hcw s VAL 325 Cb -0.10 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 3hcw s VAL 325 CO -0.15 0.44 0.02 -0.63 0.00 0.00 0.00 175.10 174.78 3hcw s ILE 326 N 0.99 4.14 -0.24 2.22 -1.09 -1.26 -1.19 121.20 124.77 3hcw s ILE 326 Ca 0.01 -0.25 -0.11 0.00 -2.23 0.00 0.00 60.65 58.07 3hcw s ILE 326 Cb -0.15 -2.89 -0.05 0.00 -1.58 0.00 0.00 42.46 37.80 3hcw s ILE 326 CO 0.01 0.41 0.18 -0.63 -1.23 0.00 0.00 174.94 173.68 3hcw s ILE 327 N 1.04 5.34 0.43 2.92 1.09 -0.29 -5.00 121.20 126.73 3hcw s ILE 327 Ca 0.03 0.21 -0.24 0.00 -1.10 0.00 0.00 60.65 59.54 3hcw s ILE 327 Cb -0.14 -3.52 -0.08 0.00 -1.06 0.00 0.00 42.46 37.66 3hcw s ILE 327 CO 0.02 0.32 1.22 -1.81 -0.10 0.00 0.00 174.94 174.59 3hcw s ASP 328 N 1.16 6.25 0.46 3.58 1.01 -1.26 -4.13 116.67 123.73 3hcw s ASP 328 Ca 0.08 2.45 0.07 0.00 0.71 0.00 0.00 52.55 55.87 3hcw s ASP 328 Cb -0.14 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.18 3hcw s ASP 328 CO 0.06 -0.87 0.43 0.42 0.21 0.00 0.00 175.17 175.41 3hcw s THR 329 N -1.40 2.40 -0.13 -1.27 -4.23 -1.26 -4.71 115.64 105.04 3hcw s THR 329 Ca 0.60 -1.33 -0.05 0.00 -1.18 0.00 0.00 61.69 59.73 3hcw s THR 329 Cb -0.33 -2.73 0.06 0.00 1.34 0.00 0.00 72.50 70.84 3hcw s THR 329 CO 0.41 0.00 0.27 -0.70 -0.54 0.00 0.00 174.62 174.06 3hcw s GLU 330 N -4.22 0.17 0.12 3.99 2.12 -0.72 -4.97 118.70 115.19 3hcw s GLU 330 Ca 0.47 0.72 -0.31 0.00 0.36 0.00 0.00 54.97 56.20 3hcw s GLU 330 Cb -0.03 -0.04 -0.09 0.00 0.26 0.00 0.00 34.13 34.23 3hcw s GLU 330 CO 0.28 -0.25 1.52 -1.17 -0.54 0.00 0.00 175.26 175.09 3hcw s LEU 331 N 2.15 4.36 -0.31 2.70 2.96 -1.26 0.27 118.68 129.55 3hcw s LEU 331 Ca -0.02 2.46 -0.01 0.00 -0.22 0.00 0.00 54.13 56.35 3hcw s LEU 331 Cb -0.12 -3.58 0.06 0.00 0.50 0.00 0.00 46.19 43.05 3hcw s LEU 331 CO -0.09 -0.78 0.01 -0.54 -1.32 0.00 0.00 176.35 173.63 3hcw s LYS 332 N 1.54 2.33 -0.09 1.98 -0.14 0.66 -4.93 119.74 121.09 3hcw s LYS 332 Ca 0.69 -1.35 -0.27 0.00 -1.36 0.00 0.00 55.97 53.67 3hcw s LYS 332 Cb -0.40 -3.19 -0.02 0.00 -1.68 0.00 0.00 37.83 32.54 3hcw s LYS 332 CO 0.31 -0.67 0.90 0.42 -0.76 0.00 0.00 175.35 175.54 3hcw s ILE 333 N 1.21 4.88 0.00 2.17 1.01 -1.26 -1.74 121.20 127.47 3hcw s ILE 333 Ca -0.04 1.83 0.00 0.00 0.00 0.00 0.00 60.65 62.44 3hcw s ILE 333 Cb -0.20 -4.22 0.00 0.00 0.01 0.00 0.00 42.46 38.05 3hcw s ILE 333 CO -0.02 0.10 0.00 0.54 0.00 0.00 0.00 174.94 175.56 3hcw n ARG 334 N 4.53 1.12 0.15 2.79 1.74 -1.26 -4.92 116.66 120.81 3hcw n ARG 334 Ca 0.05 0.00 0.06 0.00 -0.77 0.00 0.00 57.85 57.19 3hcw n ARG 334 Cb 0.50 0.00 0.53 0.00 -1.02 0.00 0.00 32.46 32.47 3hcw n ARG 334 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 3hcw h LYS 335 N 0.00 0.23 0.00 5.56 1.63 -1.89 -3.11 116.57 119.00 3hcw h LYS 335 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 3hcw h LYS 335 Cb 0.00 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.58 3hcw h LYS 335 CO 0.00 0.18 0.00 -1.13 -3.45 0.00 0.00 179.45 175.05 3hcw n SER 336 N -4.48 0.42 -0.13 4.20 3.41 -0.77 -1.00 113.62 115.26 3hcw n SER 336 Ca -0.00 0.61 0.08 0.00 -0.26 0.00 0.00 58.87 59.30 3hcw n SER 336 Cb 0.10 -0.70 0.13 0.00 -0.26 0.00 0.00 64.21 63.48 3hcw n SER 336 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3hcw n THR 337 N -1.97 1.78 -4.59 6.66 -2.24 -1.18 -1.43 114.28 111.32 3hcw n THR 337 Ca 0.02 -2.04 -0.33 0.00 -2.27 0.00 0.00 64.05 59.43 3hcw n THR 337 Cb 0.19 -0.12 -0.15 0.00 -2.10 0.00 0.00 70.33 68.16 3hcw n THR 337 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3hcw s GLN 338 N -2.58 3.34 0.29 -0.78 -0.21 -0.17 -4.93 119.66 114.62 3hcw s GLN 338 Ca 0.28 -0.69 -0.29 0.00 0.02 0.00 0.00 55.36 54.67 3hcw s GLN 338 Cb 0.24 -2.68 -0.10 0.00 1.00 0.00 0.00 33.01 31.47 3hcw s GLN 338 CO 0.03 0.11 1.21 1.03 -2.12 0.00 0.00 175.29 175.55 3hcw s ARG 339 N 0.62 4.49 0.00 2.91 0.52 -1.26 -4.78 118.95 121.45 3hcw s ARG 339 Ca -0.07 2.00 0.28 0.00 -0.52 0.00 0.00 55.73 57.42 3hcw s ARG 339 Cb -0.15 -3.14 1.22 0.00 0.52 0.00 0.00 34.95 33.39 3hcw s ARG 339 CO 0.03 -0.01 1.90 0.39 0.02 0.00 0.00 175.30 177.63 3hcw n GLU 340 N 1.25 0.08 0.00 3.54 1.02 -1.26 -5.18 120.64 120.08 3hcw n GLU 340 Ca 0.00 0.03 0.12 0.00 -0.02 0.00 0.00 57.16 57.29 3hcw n GLU 340 Cb 0.43 -1.50 0.21 0.00 -0.02 0.00 0.00 31.44 30.56 3hcw n GLU 340 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72