#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iec s ILE 50 N 0.00 -0.30 0.00 0.61 2.07 -0.19 -4.93 121.20 118.45 3iec s ILE 50 Ca 0.00 0.23 0.00 0.00 -1.41 0.00 0.00 60.65 59.47 3iec s ILE 50 Cb 0.00 -0.44 0.00 0.00 0.13 0.00 0.00 42.46 42.15 3iec s ILE 50 CO 0.00 0.10 0.00 0.61 -1.91 0.00 0.00 174.94 173.74 3iec n GLY 51 N 4.99 3.33 1.36 1.50 0.00 -1.26 -1.66 105.19 113.45 3iec n GLY 51 Ca -0.12 -0.17 -0.03 0.00 0.00 0.00 0.00 46.02 45.69 3iec n GLY 51 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3iec n ASN 52 N 3.46 3.35 -4.23 1.61 5.03 -1.26 -4.89 115.26 118.33 3iec n ASN 52 Ca 0.00 -2.59 -0.30 0.00 0.87 0.00 0.00 54.58 52.55 3iec n ASN 52 Cb 0.00 -0.62 -0.17 0.00 -1.02 0.00 0.00 39.78 37.97 3iec n ASN 52 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 3iec s TYR 53 N -1.76 2.30 -0.29 3.10 1.51 -0.66 -0.43 117.35 121.12 3iec s TYR 53 Ca 0.27 -0.74 -0.13 0.00 -1.01 0.00 0.00 57.07 55.46 3iec s TYR 53 Cb 0.22 -1.52 -0.04 0.00 -0.11 0.00 0.00 41.96 40.50 3iec s TYR 53 CO 0.07 -0.25 0.27 0.50 -1.11 0.00 0.00 175.55 175.03 3iec s ARG 54 N 0.00 3.90 0.34 -0.62 3.52 -0.25 -1.03 118.95 124.82 3iec s ARG 54 Ca -0.07 -0.24 -0.23 0.00 -0.13 0.00 0.00 55.73 55.06 3iec s ARG 54 Cb -0.14 -3.68 -0.10 0.00 -1.56 0.00 0.00 34.95 29.46 3iec s ARG 54 CO 0.05 -0.27 0.90 -0.51 -0.81 0.00 0.00 175.30 174.66 3iec s LEU 55 N 1.88 4.19 0.00 -0.88 1.43 -1.26 -1.38 118.68 122.67 3iec s LEU 55 Ca 0.10 1.70 0.00 0.00 -1.03 0.00 0.00 54.13 54.90 3iec s LEU 55 Cb -0.16 -4.13 0.00 0.00 0.03 0.00 0.00 46.19 41.92 3iec s LEU 55 CO 0.11 -0.16 0.00 0.18 0.23 0.00 0.00 176.35 176.71 3iec n LEU 56 N 0.13 0.00 -4.71 1.79 4.77 0.11 -4.81 117.00 114.29 3iec n LEU 56 Ca 0.03 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.67 3iec n LEU 56 Cb 0.52 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.71 3iec n LEU 56 CO 0.42 0.00 0.80 -1.59 -1.33 0.00 0.00 177.39 175.69 3iec s LYS 57 N 2.91 1.95 -0.23 3.23 -2.85 -1.26 -4.37 119.74 119.12 3iec s LYS 57 Ca 0.00 1.80 -0.28 0.00 -1.00 0.00 0.00 55.97 56.50 3iec s LYS 57 Cb 0.00 -1.81 0.01 0.00 -2.06 0.00 0.00 37.83 33.97 3iec s LYS 57 CO 0.00 -1.99 0.98 0.99 0.10 0.00 0.00 175.35 175.43 3iec s THR 58 N -1.98 4.73 -1.82 3.79 2.01 -1.26 -0.64 115.64 120.47 3iec s THR 58 Ca 0.75 1.90 0.15 0.00 0.31 0.00 0.00 61.69 64.80 3iec s THR 58 Cb -0.30 -4.25 0.15 0.00 0.01 0.00 0.00 72.50 68.11 3iec s THR 58 CO 0.47 -0.15 1.02 2.30 -0.69 0.00 0.00 174.62 177.57 3iec n ILE 59 N 5.29 0.11 0.00 1.82 -5.35 0.11 -4.94 119.36 116.40 3iec n ILE 59 Ca 0.10 -0.55 0.00 0.00 -0.27 0.00 0.00 62.75 62.03 3iec n ILE 59 Cb 0.46 1.23 0.00 0.00 -1.74 0.00 0.00 39.64 39.59 3iec n ILE 59 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3iec n GLY 60 N 0.85 1.77 0.00 3.28 0.00 -0.98 -4.94 105.19 105.17 3iec n GLY 60 Ca 0.10 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.37 3iec n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iec n ALA 65 N -3.00 -0.98 -1.77 4.61 0.00 -1.26 -2.09 120.51 116.02 3iec n ALA 65 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 3iec n ALA 65 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 3iec n ALA 65 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3iec s LYS 66 N 0.00 3.82 -0.25 0.00 1.02 -1.14 -4.85 119.74 118.34 3iec s LYS 66 Ca 0.00 1.99 0.02 0.00 0.02 0.00 0.00 55.97 58.00 3iec s LYS 66 Cb 0.00 -2.57 0.06 0.00 -0.52 0.00 0.00 37.83 34.79 3iec s LYS 66 CO 0.00 -0.57 -0.10 0.08 -0.92 0.00 0.00 175.35 173.85 3iec s VAL 67 N -1.38 1.99 -0.06 3.17 1.01 -0.89 -0.48 120.40 123.75 3iec s VAL 67 Ca 0.61 -1.50 -0.04 0.00 0.00 0.00 0.00 61.98 61.05 3iec s VAL 67 Cb -0.34 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 3iec s VAL 67 CO 0.42 -0.03 0.13 -0.54 0.00 0.00 0.00 175.10 175.08 3iec s LYS 68 N 1.19 3.32 0.40 2.72 1.02 -0.57 0.06 119.74 127.87 3iec s LYS 68 Ca -0.08 -0.28 -0.24 0.00 0.02 0.00 0.00 55.97 55.39 3iec s LYS 68 Cb -0.19 -3.05 -0.09 0.00 -0.52 0.00 0.00 37.83 33.97 3iec s LYS 68 CO -0.06 0.72 1.09 -1.17 -0.92 0.00 0.00 175.35 175.01 3iec s LEU 69 N -1.41 4.15 0.16 3.17 2.96 0.19 -0.03 118.68 127.87 3iec s LEU 69 Ca 0.20 2.14 -0.11 0.00 -0.22 0.00 0.00 54.13 56.14 3iec s LEU 69 Cb -0.12 -4.13 0.00 0.00 0.50 0.00 0.00 46.19 42.44 3iec s LEU 69 CO 0.10 -0.57 0.32 0.00 -1.32 0.00 0.00 176.35 174.88 3iec s ALA 70 N -1.57 -0.25 -0.13 5.97 0.00 0.89 0.07 121.76 126.74 3iec s ALA 70 Ca 0.58 -0.68 0.02 0.00 0.00 0.00 0.00 51.96 51.88 3iec s ALA 70 Cb -0.25 0.79 0.01 0.00 0.00 0.00 0.00 23.12 23.67 3iec s ALA 70 CO 0.31 -0.65 -0.20 1.03 0.00 0.00 0.00 175.76 176.25 3iec s ARG 71 N -3.93 2.75 0.01 0.00 0.52 -0.48 -0.26 118.95 117.57 3iec s ARG 71 Ca 0.13 -0.76 -0.30 0.00 -0.52 0.00 0.00 55.73 54.28 3iec s ARG 71 Cb 0.03 -2.23 -0.06 0.00 0.52 0.00 0.00 34.95 33.20 3iec s ARG 71 CO -0.03 -0.01 1.42 -1.58 0.02 0.00 0.00 175.30 175.12 3iec s HIS 72 N 0.83 2.83 0.20 -0.53 5.65 0.37 -1.09 115.29 123.54 3iec s HIS 72 Ca -0.08 0.78 -0.01 0.00 0.25 0.00 0.00 55.06 56.00 3iec s HIS 72 Cb -0.16 -3.69 0.14 0.00 -1.18 0.00 0.00 32.58 27.70 3iec s HIS 72 CO -0.01 -2.56 1.50 -0.84 -0.65 0.00 0.00 174.74 172.19 3iec h ILE 73 N 4.89 1.35 -0.04 0.89 3.07 -1.08 0.51 117.51 127.10 3iec h ILE 73 Ca -0.38 -1.91 -0.19 0.00 1.55 0.00 0.00 64.86 63.93 3iec h ILE 73 Cb 1.18 1.90 -0.00 0.00 -0.27 0.00 0.00 36.82 39.62 3iec h ILE 73 CO 0.90 0.58 -0.81 -0.07 -1.05 0.00 0.00 178.15 177.71 3iec h LEU 74 N 0.33 0.43 0.00 0.16 3.38 -1.92 -3.34 115.31 114.35 3iec h LEU 74 Ca -0.00 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3iec h LEU 74 Cb 1.14 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.76 3iec h LEU 74 CO 0.11 1.07 -1.28 0.35 0.09 0.00 0.00 178.44 178.78 3iec n THR 75 N -3.78 0.00 -0.98 0.22 -2.24 -1.21 -4.99 114.28 101.31 3iec n THR 75 Ca -0.05 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 3iec n THR 75 Cb 0.76 0.47 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 3iec n THR 75 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3iec n GLY 76 N 1.58 0.41 3.76 3.38 0.00 0.18 -5.00 105.19 109.51 3iec n GLY 76 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 3iec n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3iec s LYS 77 N -0.50 4.79 0.07 1.61 -0.14 -1.23 -4.67 119.74 119.66 3iec s LYS 77 Ca 0.00 1.44 -0.26 0.00 -1.36 0.00 0.00 55.97 55.79 3iec s LYS 77 Cb 0.00 -3.16 -0.06 0.00 -1.68 0.00 0.00 37.83 32.93 3iec s LYS 77 CO 0.00 0.46 0.82 -2.00 -0.76 0.00 0.00 175.35 173.87 3iec s GLU 78 N -1.39 4.56 0.16 1.68 2.12 -1.26 -0.48 118.70 124.08 3iec s GLU 78 Ca 0.43 1.18 -0.02 0.00 0.36 0.00 0.00 54.97 56.92 3iec s GLU 78 Cb -0.24 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 30.75 3iec s GLU 78 CO 0.30 0.28 0.10 0.14 -0.54 0.00 0.00 175.26 175.54 3iec s VAL 79 N -0.09 0.06 -0.21 3.70 -7.23 0.65 -4.53 120.40 112.75 3iec s VAL 79 Ca 0.41 -1.90 -0.07 0.00 -1.81 0.00 0.00 61.98 58.61 3iec s VAL 79 Cb -0.21 -2.19 -0.04 0.00 0.56 0.00 0.00 36.38 34.50 3iec s VAL 79 CO 0.25 -0.29 0.07 0.00 -0.31 0.00 0.00 175.10 174.82 3iec s ALA 80 N -4.08 3.31 -0.33 1.32 0.00 0.52 -0.08 121.76 122.42 3iec s ALA 80 Ca 0.29 -0.89 -0.03 0.00 0.00 0.00 0.00 51.96 51.33 3iec s ALA 80 Cb 0.07 -1.98 0.06 0.00 0.00 0.00 0.00 23.12 21.27 3iec s ALA 80 CO 0.05 -0.07 0.07 0.08 0.00 0.00 0.00 175.76 175.89 3iec s VAL 81 N 0.84 3.21 0.05 0.00 1.01 0.96 -0.09 120.40 126.37 3iec s VAL 81 Ca 0.04 -1.48 -0.31 0.00 0.00 0.00 0.00 61.98 60.23 3iec s VAL 81 Cb -0.14 -2.92 -0.06 0.00 0.00 0.00 0.00 36.38 33.27 3iec s VAL 81 CO 0.02 -0.25 1.23 -0.54 0.00 0.00 0.00 175.10 175.56 3iec s LYS 82 N 1.26 4.40 -0.30 2.72 -0.14 0.21 -1.51 119.74 126.38 3iec s LYS 82 Ca -0.01 1.80 -0.01 0.00 -1.36 0.00 0.00 55.97 56.38 3iec s LYS 82 Cb -0.20 -3.38 0.05 0.00 -1.68 0.00 0.00 37.83 32.62 3iec s LYS 82 CO -0.01 -0.32 -0.01 0.42 -0.76 0.00 0.00 175.35 174.67 3iec s ILE 83 N 1.29 2.92 -0.20 2.17 1.01 0.36 -1.61 121.20 127.15 3iec s ILE 83 Ca 0.59 -1.40 -0.01 0.00 0.00 0.00 0.00 60.65 59.83 3iec s ILE 83 Cb -0.30 -2.68 0.01 0.00 0.01 0.00 0.00 42.46 39.50 3iec s ILE 83 CO 0.28 -0.10 -0.12 -0.63 0.00 0.00 0.00 174.94 174.37 3iec s ILE 84 N 1.24 2.72 -0.28 2.92 1.01 0.03 -2.87 121.20 125.97 3iec s ILE 84 Ca -0.06 -0.72 -0.29 0.00 0.00 0.00 0.00 60.65 59.59 3iec s ILE 84 Cb -0.20 -2.20 0.01 0.00 0.01 0.00 0.00 42.46 40.09 3iec s ILE 84 CO -0.01 0.48 1.10 -0.62 0.00 0.00 0.00 174.94 175.89 3iec s ASP 85 N 1.35 6.96 0.07 3.58 2.15 -1.26 -0.67 116.67 128.85 3iec s ASP 85 Ca 0.05 1.19 0.03 0.00 0.43 0.00 0.00 52.55 54.25 3iec s ASP 85 Cb -0.14 -2.54 -0.24 0.00 -0.30 0.00 0.00 42.92 39.70 3iec s ASP 85 CO -0.08 -0.83 1.12 0.11 -0.17 0.00 0.00 175.17 175.32 3iec h LYS 86 N 8.02 0.11 -0.88 4.34 1.57 -1.07 -3.40 116.57 125.26 3iec h LYS 86 Ca -0.21 -0.20 0.20 0.00 -1.87 0.00 0.00 60.65 58.57 3iec h LYS 86 Cb 1.07 0.07 -0.16 0.00 0.08 0.00 0.00 32.23 33.28 3iec h LYS 86 CO 1.02 1.03 -0.11 1.79 -0.57 0.00 0.00 179.45 182.61 3iec h THR 87 N 0.03 0.14 0.00 -0.16 1.35 -1.91 -0.96 112.91 111.40 3iec h THR 87 Ca -0.11 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 3iec h THR 87 Cb 1.89 0.11 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 3iec h THR 87 CO 0.15 0.00 -0.10 0.06 -0.25 0.00 0.00 175.52 175.39 3iec h GLN 88 N 0.03 0.00 -7.05 4.72 3.07 -1.95 -3.47 115.11 110.46 3iec h GLN 88 Ca 0.46 0.00 -0.50 0.00 0.09 0.00 0.00 58.65 58.71 3iec h GLN 88 Cb 0.81 0.00 0.06 0.00 0.08 0.00 0.00 27.48 28.42 3iec h GLN 88 CO -0.86 0.00 0.44 -0.51 0.09 0.00 0.00 178.83 177.99 3iec s LEU 89 N -5.72 3.87 0.39 0.06 1.43 -0.37 -5.04 118.68 113.29 3iec s LEU 89 Ca 0.07 2.16 0.04 0.00 -1.03 0.00 0.00 54.13 55.37 3iec s LEU 89 Cb 0.07 -4.45 -0.01 0.00 0.03 0.00 0.00 46.19 41.83 3iec s LEU 89 CO 0.67 -1.01 0.56 0.54 0.23 0.00 0.00 176.35 177.34 3iec s ASN 90 N -1.67 5.91 0.22 2.29 6.03 -1.26 -4.86 114.94 121.60 3iec s ASN 90 Ca 0.68 0.04 -0.19 0.00 -1.03 0.00 0.00 52.86 52.37 3iec s ASN 90 Cb -0.24 -1.38 0.21 0.00 -3.03 0.00 0.00 41.25 36.80 3iec s ASN 90 CO 0.28 -0.56 1.54 -1.20 -2.03 0.00 0.00 177.10 175.14 3iec n SER 91 N -1.85 -0.69 -0.35 3.54 7.64 -1.26 -0.24 113.62 120.41 3iec n SER 91 Ca 0.00 1.74 0.03 0.00 1.01 0.00 0.00 58.87 61.65 3iec n SER 91 Cb 0.58 -0.38 0.18 0.00 -1.01 0.00 0.00 64.21 63.58 3iec n SER 91 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 3iec h SER 92 N 0.00 0.96 1.07 6.43 0.87 -1.99 0.24 113.55 121.14 3iec h SER 92 Ca 0.33 0.02 -0.17 0.00 -1.23 0.00 0.00 61.79 60.73 3iec h SER 92 Cb 0.58 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.33 3iec h SER 92 CO -0.98 0.59 -0.82 0.28 -0.53 0.00 0.00 176.83 175.37 3iec h SER 93 N 1.08 0.00 -0.07 6.23 0.02 -1.12 -2.18 113.55 117.51 3iec h SER 93 Ca 0.43 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.35 3iec h SER 93 Cb 0.23 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.77 3iec h SER 93 CO -0.19 0.82 -0.06 0.25 -1.14 0.00 0.00 176.83 176.51 3iec h LEU 94 N 0.00 0.17 -0.44 5.07 5.85 0.12 -1.78 115.31 124.31 3iec h LEU 94 Ca -0.01 -0.48 0.07 0.00 0.84 0.00 0.00 57.88 58.30 3iec h LEU 94 Cb 1.58 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.50 3iec h LEU 94 CO 0.11 0.62 0.07 -0.61 -0.34 0.00 0.00 178.44 178.29 3iec h GLN 95 N -0.27 0.19 -0.88 1.25 4.15 -0.52 -0.82 115.11 118.21 3iec h GLN 95 Ca 0.01 -0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.48 3iec h GLN 95 Cb 0.57 -0.04 -0.06 0.00 0.21 0.00 0.00 27.48 28.16 3iec h GLN 95 CO 0.02 0.13 0.58 0.87 -1.93 0.00 0.00 178.83 178.49 3iec h LYS 96 N 0.20 0.96 -0.36 1.69 1.57 -1.41 -1.26 116.57 117.97 3iec h LYS 96 Ca 0.22 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.89 3iec h LYS 96 Cb 0.28 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3iec h LYS 96 CO -0.30 0.64 0.04 1.25 -0.57 0.00 0.00 179.45 180.51 3iec h LEU 97 N 0.99 0.58 -0.76 2.94 5.85 -0.30 0.86 115.31 125.46 3iec h LEU 97 Ca 0.38 -0.27 0.04 0.00 0.84 0.00 0.00 57.88 58.86 3iec h LEU 97 Cb 0.21 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.04 3iec h LEU 97 CO -0.14 0.71 0.48 -0.26 -0.34 0.00 0.00 178.44 178.89 3iec h PHE 98 N 0.43 0.89 -0.41 1.25 -1.00 -0.84 -1.77 116.94 115.50 3iec h PHE 98 Ca 0.11 0.02 -0.04 0.00 2.81 0.00 0.00 57.97 60.87 3iec h PHE 98 Cb 0.39 -0.29 -0.02 0.00 3.61 0.00 0.00 35.95 39.64 3iec h PHE 98 CO 0.03 0.50 0.08 -0.09 -1.61 0.00 0.00 178.31 177.21 3iec h ARG 99 N 0.92 0.66 -0.73 1.51 2.43 -1.01 -0.59 114.38 117.57 3iec h ARG 99 Ca 0.31 -0.17 0.08 0.00 -0.81 0.00 0.00 59.98 59.39 3iec h ARG 99 Cb 0.05 -0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 29.45 3iec h ARG 99 CO -0.13 0.70 0.39 1.49 -1.51 0.00 0.00 179.97 180.91 3iec h GLU 100 N 0.52 0.67 -0.41 0.20 4.81 -0.58 0.16 114.58 119.94 3iec h GLU 100 Ca 0.12 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.20 3iec h GLU 100 Cb 0.35 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 3iec h GLU 100 CO 0.01 0.44 -0.18 0.28 -0.73 0.00 0.00 179.01 178.83 3iec h VAL 101 N 0.69 1.28 -0.52 0.32 2.07 -0.90 -0.78 116.25 118.41 3iec h VAL 101 Ca 0.34 -1.31 0.04 0.00 0.82 0.00 0.00 66.70 66.60 3iec h VAL 101 Cb 0.30 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 3iec h VAL 101 CO -0.23 0.44 0.26 -0.09 0.02 0.00 0.00 177.57 177.98 3iec h ARG 102 N 0.67 0.50 -0.01 1.57 2.43 -0.38 -2.21 114.38 116.95 3iec h ARG 102 Ca 0.10 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3iec h ARG 102 Cb 0.73 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.17 3iec h ARG 102 CO 0.06 0.33 0.01 0.82 -1.51 0.00 0.00 179.97 179.67 3iec h ILE 103 N 0.51 1.12 -0.75 1.20 2.04 -0.48 -2.81 117.51 118.35 3iec h ILE 103 Ca 0.23 -0.35 0.06 0.00 1.00 0.00 0.00 64.86 65.80 3iec h ILE 103 Cb 0.13 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 37.50 3iec h ILE 103 CO -0.16 0.09 0.49 0.24 0.00 0.00 0.00 178.15 178.82 3iec h MET 104 N -0.12 0.78 0.00 2.37 2.86 -0.99 -1.73 114.93 118.10 3iec h MET 104 Ca 0.01 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 3iec h MET 104 Cb 0.15 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.63 3iec h MET 104 CO -0.00 0.52 -0.13 0.87 1.06 0.00 0.00 176.91 179.22 3iec h LYS 105 N 0.81 0.00 0.00 1.72 1.57 -1.13 -3.05 116.57 116.48 3iec h LYS 105 Ca 0.32 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.00 3iec h LYS 105 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 3iec h LYS 105 CO -0.11 0.13 -0.79 -0.39 -0.57 0.00 0.00 179.45 177.73 3iec h VAL 106 N 0.00 0.49 -3.35 0.50 -1.51 -1.26 -3.46 116.25 107.67 3iec h VAL 106 Ca -0.00 -1.79 -0.56 0.00 -1.23 0.00 0.00 66.70 63.12 3iec h VAL 106 Cb 0.25 2.10 -0.05 0.00 -2.13 0.00 0.00 31.29 31.46 3iec h VAL 106 CO 0.02 0.28 0.28 -0.76 -1.23 0.00 0.00 177.57 176.16 3iec s LEU 107 N -6.04 4.29 -0.38 4.19 1.43 -1.15 -5.00 118.68 116.01 3iec s LEU 107 Ca 0.02 1.33 0.01 0.00 -1.03 0.00 0.00 54.13 54.46 3iec s LEU 107 Cb 0.08 -3.29 0.14 0.00 0.03 0.00 0.00 46.19 43.15 3iec s LEU 107 CO 0.76 -0.25 0.23 0.21 0.23 0.00 0.00 176.35 177.52 3iec s ASN 108 N 0.97 3.05 -0.09 2.29 2.47 -1.26 -4.86 114.94 117.52 3iec s ASN 108 Ca 0.42 -2.35 -0.08 0.00 0.42 0.00 0.00 52.86 51.27 3iec s ASN 108 Cb -0.18 -0.55 0.02 0.00 -1.45 0.00 0.00 41.25 39.09 3iec s ASN 108 CO 0.19 -0.29 0.23 -2.28 -3.72 0.00 0.00 177.10 171.23 3iec s HIS 109 N 0.83 -0.25 -0.68 0.43 2.46 -1.26 -4.83 115.29 111.99 3iec s HIS 109 Ca 0.19 0.62 0.17 0.00 0.47 0.00 0.00 55.06 56.51 3iec s HIS 109 Cb -0.22 0.08 0.75 0.00 -0.13 0.00 0.00 32.58 33.07 3iec s HIS 109 CO -0.01 -0.13 1.52 -0.35 -2.47 0.00 0.00 174.74 173.31 3iec n PRO 110 N 3.01 0.10 -0.53 2.88 -0.04 -1.26 -1.81 135.00 137.34 3iec n PRO 110 Ca -0.13 0.41 0.04 0.00 -0.04 0.00 0.00 63.50 63.78 3iec n PRO 110 Cb 0.58 -1.71 0.20 0.00 -0.04 0.00 0.00 33.50 32.53 3iec n PRO 110 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3iec n ASN 111 N -1.90 2.51 -4.09 3.54 4.13 -1.26 -4.85 115.26 113.34 3iec n ASN 111 Ca 0.02 -3.53 -0.26 0.00 1.68 0.00 0.00 54.58 52.48 3iec n ASN 111 Cb 0.15 -0.55 -0.17 0.00 -1.54 0.00 0.00 39.78 37.67 3iec n ASN 111 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3iec s ILE 112 N -3.09 1.39 -0.10 2.41 1.01 -0.75 -0.18 121.20 121.89 3iec s ILE 112 Ca 0.40 -0.64 -0.34 0.00 0.00 0.00 0.00 60.65 60.07 3iec s ILE 112 Cb 0.36 -1.24 -0.11 0.00 0.01 0.00 0.00 42.46 41.48 3iec s ILE 112 CO 0.00 0.41 1.92 0.52 0.00 0.00 0.00 174.94 177.79 3iec n VAL 113 N 3.62 0.57 -2.66 2.92 0.31 -0.68 -4.65 118.33 117.77 3iec n VAL 113 Ca -0.21 -0.13 -0.40 0.00 -0.01 0.00 0.00 64.34 63.59 3iec n VAL 113 Cb 0.52 -1.92 -0.05 0.00 -0.91 0.00 0.00 33.84 31.48 3iec n VAL 113 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 3iec s LYS 114 N 4.30 4.76 -0.07 5.55 2.20 -1.26 -4.89 119.74 130.33 3iec s LYS 114 Ca 0.94 1.58 -0.26 0.00 -0.36 0.00 0.00 55.97 57.87 3iec s LYS 114 Cb -0.67 -3.27 -0.03 0.00 -1.51 0.00 0.00 37.83 32.34 3iec s LYS 114 CO 0.51 0.36 0.81 -1.17 -0.36 0.00 0.00 175.35 175.49 3iec s LEU 115 N -0.96 4.30 -0.19 5.43 2.96 -1.26 -1.07 118.68 127.87 3iec s LEU 115 Ca 0.44 1.32 0.06 0.00 -0.22 0.00 0.00 54.13 55.72 3iec s LEU 115 Cb -0.27 -3.25 -0.16 0.00 0.50 0.00 0.00 46.19 43.00 3iec s LEU 115 CO 0.34 -0.22 -0.10 0.49 -1.32 0.00 0.00 176.35 175.54 3iec n PHE 116 N 4.16 0.00 -3.54 5.38 3.72 0.10 -4.98 117.46 122.30 3iec n PHE 116 Ca 0.02 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.25 3iec n PHE 116 Cb 0.51 -0.80 -0.06 0.00 -0.94 0.00 0.00 39.48 38.18 3iec n PHE 116 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 3iec s GLU 117 N -2.41 1.02 -0.10 -1.08 2.12 -1.17 -3.94 118.70 113.15 3iec s GLU 117 Ca -0.21 0.18 0.03 0.00 0.36 0.00 0.00 54.97 55.32 3iec s GLU 117 Cb 0.06 0.48 0.01 0.00 0.26 0.00 0.00 34.13 34.94 3iec s GLU 117 CO 0.55 -0.32 -0.18 0.08 -0.54 0.00 0.00 175.26 174.84 3iec s VAL 118 N -1.31 1.67 -0.09 3.70 1.01 -0.61 -1.04 120.40 123.73 3iec s VAL 118 Ca -0.11 -0.76 0.04 0.00 0.00 0.00 0.00 61.98 61.14 3iec s VAL 118 Cb -0.01 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.89 3iec s VAL 118 CO 0.08 0.47 -0.21 -0.63 0.00 0.00 0.00 175.10 174.81 3iec s ILE 119 N 0.73 1.85 -0.07 2.22 1.01 -0.48 -4.67 121.20 121.78 3iec s ILE 119 Ca -0.11 -0.90 0.05 0.00 0.00 0.00 0.00 60.65 59.69 3iec s ILE 119 Cb -0.16 -1.61 -0.00 0.00 0.01 0.00 0.00 42.46 40.70 3iec s ILE 119 CO 0.02 0.51 -0.22 -1.61 0.00 0.00 0.00 174.94 173.64 3iec s GLU 120 N 0.41 2.50 0.30 2.79 2.02 -1.26 -1.07 118.70 124.38 3iec s GLU 120 Ca -0.18 -0.80 0.00 0.00 0.02 0.00 0.00 54.97 54.02 3iec s GLU 120 Cb -0.17 -2.03 -0.00 0.00 0.10 0.00 0.00 34.13 32.03 3iec s GLU 120 CO 0.08 0.26 0.01 0.25 0.02 0.00 0.00 175.26 175.87 3iec n THR 121 N 3.25 0.00 -0.19 3.63 -2.24 -0.26 -5.02 114.28 113.45 3iec n THR 121 Ca -0.19 -1.43 -0.03 0.00 -2.27 0.00 0.00 64.05 60.14 3iec n THR 121 Cb 0.52 0.31 0.07 0.00 -2.10 0.00 0.00 70.33 69.13 3iec n THR 121 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3iec h GLU 122 N 0.00 0.55 0.00 -0.78 3.07 -2.03 -3.31 114.58 112.08 3iec h GLU 122 Ca -0.24 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.58 3iec h GLU 122 Cb 0.76 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 3iec h GLU 122 CO 0.40 0.36 -1.05 1.63 -1.40 0.00 0.00 179.01 178.96 3iec n LYS 123 N -4.86 1.74 -4.27 2.33 4.01 -1.26 -4.90 118.16 110.96 3iec n LYS 123 Ca 0.06 -0.05 -0.18 0.00 -0.51 0.00 0.00 58.31 57.63 3iec n LYS 123 Cb 0.16 -1.13 -0.13 0.00 -0.51 0.00 0.00 35.03 33.41 3iec n LYS 123 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 3iec s THR 124 N -2.38 0.79 -0.18 -0.18 2.01 -1.25 -0.37 115.64 114.08 3iec s THR 124 Ca -0.01 -0.74 -0.04 0.00 0.31 0.00 0.00 61.69 61.22 3iec s THR 124 Cb 0.07 -0.72 -0.02 0.00 0.01 0.00 0.00 72.50 71.84 3iec s THR 124 CO 0.42 -0.00 -0.04 -0.22 -0.69 0.00 0.00 174.62 174.08 3iec s LEU 125 N -0.83 3.11 -0.17 4.42 2.96 0.15 -1.10 118.68 127.23 3iec s LEU 125 Ca -0.00 -0.23 -0.03 0.00 -0.22 0.00 0.00 54.13 53.65 3iec s LEU 125 Cb -0.06 -1.76 -0.02 0.00 0.50 0.00 0.00 46.19 44.84 3iec s LEU 125 CO 0.00 0.11 -0.04 -0.31 -1.32 0.00 0.00 176.35 174.79 3iec s TYR 126 N 0.74 2.99 -0.24 5.38 1.51 -0.24 -0.79 117.35 126.71 3iec s TYR 126 Ca -0.02 -0.43 -0.04 0.00 -1.01 0.00 0.00 57.07 55.58 3iec s TYR 126 Cb -0.15 -1.98 0.01 0.00 -0.11 0.00 0.00 41.96 39.73 3iec s TYR 126 CO 0.02 -0.14 -0.03 -0.51 -1.11 0.00 0.00 175.55 173.78 3iec s LEU 127 N 0.57 3.14 -0.29 -1.29 1.43 -0.63 -1.38 118.68 120.23 3iec s LEU 127 Ca -0.03 -0.60 -0.14 0.00 -1.03 0.00 0.00 54.13 52.33 3iec s LEU 127 Cb -0.14 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 3iec s LEU 127 CO 0.03 -0.08 0.34 -0.69 0.23 0.00 0.00 176.35 176.17 3iec s VAL 128 N 1.43 5.20 0.23 -1.59 1.01 -0.20 -0.62 120.40 125.85 3iec s VAL 128 Ca 0.04 0.38 0.01 0.00 0.00 0.00 0.00 61.98 62.40 3iec s VAL 128 Cb -0.15 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 3iec s VAL 128 CO -0.03 0.12 0.09 0.00 0.00 0.00 0.00 175.10 175.28 3iec s MET 129 N 2.00 1.29 0.19 2.72 0.23 0.87 0.02 119.30 126.63 3iec s MET 129 Ca 0.13 -1.68 -0.33 0.00 -1.03 0.00 0.00 55.69 52.78 3iec s MET 129 Cb -0.16 -0.10 -0.15 0.00 -1.53 0.00 0.00 34.83 32.90 3iec s MET 129 CO 0.11 -0.30 1.35 -1.91 -2.03 0.00 0.00 175.02 172.24 3iec n GLU 130 N -0.37 1.67 -3.29 3.16 2.13 -0.24 -0.35 120.64 123.36 3iec n GLU 130 Ca -0.01 0.60 -0.39 0.00 0.66 0.00 0.00 57.16 58.02 3iec n GLU 130 Cb 0.66 -2.22 -0.07 0.00 0.27 0.00 0.00 31.44 30.07 3iec n GLU 130 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 3iec s TYR 131 N 0.11 3.34 -0.71 4.31 5.04 -1.26 -4.45 117.35 123.72 3iec s TYR 131 Ca 0.73 0.68 -0.11 0.00 -2.44 0.00 0.00 57.07 55.93 3iec s TYR 131 Cb -0.75 -2.64 0.19 0.00 0.35 0.00 0.00 41.96 39.10 3iec s TYR 131 CO 0.48 -0.13 0.62 0.00 -1.34 0.00 0.00 175.55 175.18 3iec s ALA 132 N 1.75 3.85 0.12 3.97 0.00 -1.26 -4.85 121.76 125.34 3iec s ALA 132 Ca 0.22 -3.13 0.34 0.00 0.00 0.00 0.00 51.96 49.38 3iec s ALA 132 Cb -0.15 -3.22 1.45 0.00 0.00 0.00 0.00 23.12 21.19 3iec s ALA 132 CO 0.09 -2.17 2.01 0.66 0.00 0.00 0.00 175.76 176.35 3iec h SER 133 N 7.82 0.00 0.15 0.00 4.64 -1.83 -2.80 113.55 121.53 3iec h SER 133 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3iec h SER 133 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 3iec h SER 133 CO 0.79 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.36 3iec n GLY 134 N -0.07 -0.94 7.00 -0.77 0.00 0.67 -4.90 105.19 106.18 3iec n GLY 134 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3iec n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iec n GLY 135 N 0.75 -1.17 3.86 -0.02 0.00 -1.06 -4.67 105.19 102.89 3iec n GLY 135 Ca 0.18 -1.24 -0.33 0.00 0.00 0.00 0.00 46.02 44.62 3iec n GLY 135 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3iec s GLU 136 N 0.00 3.86 0.43 1.61 2.02 -1.26 -0.74 118.70 124.61 3iec s GLU 136 Ca 0.00 0.34 0.10 0.00 0.02 0.00 0.00 54.97 55.43 3iec s GLU 136 Cb 0.00 -2.77 0.94 0.00 0.10 0.00 0.00 34.13 32.41 3iec s GLU 136 CO 0.00 0.39 2.04 0.28 0.02 0.00 0.00 175.26 177.99 3iec h VAL 137 N 2.33 1.10 -0.25 2.63 2.07 -0.19 -1.97 116.25 121.96 3iec h VAL 137 Ca -0.48 -0.32 0.06 0.00 0.82 0.00 0.00 66.70 66.79 3iec h VAL 137 Cb 1.18 0.84 -0.06 0.00 -1.52 0.00 0.00 31.29 31.73 3iec h VAL 137 CO 0.68 0.12 -0.14 0.15 0.02 0.00 0.00 177.57 178.40 3iec h PHE 138 N 0.31 -0.34 0.00 1.57 3.57 -1.72 -0.11 116.94 120.23 3iec h PHE 138 Ca 0.08 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.49 3iec h PHE 138 Cb 0.08 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 3iec h PHE 138 CO 0.00 -0.21 -0.58 -0.44 -2.23 0.00 0.00 178.31 174.86 3iec h ASP 139 N -0.12 0.00 -0.42 0.41 3.32 -1.74 -1.77 116.42 116.11 3iec h ASP 139 Ca 0.14 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.10 3iec h ASP 139 Cb 0.32 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 3iec h ASP 139 CO -0.32 0.58 -0.07 0.22 -1.72 0.00 0.00 179.24 177.93 3iec h TYR 140 N 0.00 0.88 -0.59 4.55 5.03 -0.85 -0.48 116.97 125.51 3iec h TYR 140 Ca -0.01 -0.18 -0.05 0.00 2.58 0.00 0.00 58.73 61.08 3iec h TYR 140 Cb 1.05 -0.22 -0.03 0.00 1.55 0.00 0.00 36.73 39.08 3iec h TYR 140 CO 0.00 0.89 0.19 -0.07 -1.32 0.00 0.00 178.16 177.85 3iec h LEU 141 N 0.62 0.85 -0.52 2.82 3.38 -0.86 0.27 115.31 121.87 3iec h LEU 141 Ca 0.11 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3iec h LEU 141 Cb 0.58 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3iec h LEU 141 CO 0.03 0.83 0.29 0.58 0.09 0.00 0.00 178.44 180.26 3iec h VAL 142 N 0.83 1.18 -0.20 1.22 2.07 -1.11 0.50 116.25 120.74 3iec h VAL 142 Ca 0.19 -0.45 -0.12 0.00 0.82 0.00 0.00 66.70 67.14 3iec h VAL 142 Cb 0.27 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 3iec h VAL 142 CO -0.01 0.19 -0.39 0.00 0.02 0.00 0.00 177.57 177.38 3iec h ALA 143 N 1.12 0.96 -0.02 1.67 0.00 -0.90 -3.27 119.26 118.82 3iec h ALA 143 Ca 0.18 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3iec h ALA 143 Cb 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3iec h ALA 143 CO -0.03 0.62 -0.02 0.72 0.00 0.00 0.00 179.25 180.54 3iec n HIS 144 N -4.03 0.00 0.00 0.00 8.25 0.07 -5.01 115.22 114.49 3iec n HIS 144 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 3iec n HIS 144 Cb 0.49 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.60 3iec n HIS 144 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3iec n GLY 145 N 0.78 1.55 3.81 -1.41 0.00 0.17 -4.83 105.19 105.26 3iec n GLY 145 Ca 0.08 -0.04 -0.02 0.00 0.00 0.00 0.00 46.02 46.04 3iec n GLY 145 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3iec s TRP 146 N 0.00 -0.02 -0.09 1.61 -2.14 -1.26 -4.02 118.94 113.03 3iec s TRP 146 Ca 0.00 -0.28 -0.01 0.00 2.66 0.00 0.00 56.10 58.48 3iec s TRP 146 Cb 0.00 0.64 -0.03 0.00 -3.10 0.00 0.00 33.47 30.98 3iec s TRP 146 CO 0.00 -0.72 -0.04 -1.64 -2.66 0.00 0.00 176.95 171.89 3iec s MET 147 N -2.56 2.95 0.88 3.25 -1.94 -0.12 -5.02 119.30 116.75 3iec s MET 147 Ca 0.18 -0.49 -0.11 0.00 -1.71 0.00 0.00 55.69 53.56 3iec s MET 147 Cb -0.01 -2.71 0.12 0.00 2.01 0.00 0.00 34.83 34.25 3iec s MET 147 CO 0.02 0.63 1.15 0.15 -0.01 0.00 0.00 175.02 176.96 3iec s LYS 148 N -0.69 1.26 0.28 2.03 1.02 -1.26 -4.41 119.74 117.96 3iec s LYS 148 Ca 0.11 1.56 -0.03 0.00 0.02 0.00 0.00 55.97 57.63 3iec s LYS 148 Cb -0.11 -1.75 0.38 0.00 -0.52 0.00 0.00 37.83 35.82 3iec s LYS 148 CO 0.02 -2.45 1.89 0.93 -0.92 0.00 0.00 175.35 174.82 3iec h GLU 149 N -1.60 1.04 -0.95 1.68 5.08 -1.96 0.14 114.58 118.02 3iec h GLU 149 Ca -0.44 -0.12 0.03 0.00 -1.00 0.00 0.00 59.36 57.83 3iec h GLU 149 Cb 1.27 -0.20 -0.06 0.00 0.50 0.00 0.00 28.75 30.26 3iec h GLU 149 CO 0.43 0.78 0.62 0.87 -1.00 0.00 0.00 179.01 180.71 3iec h LYS 150 N 1.05 1.18 -0.07 2.33 1.57 -1.99 0.11 116.57 120.74 3iec h LYS 150 Ca 0.26 -0.07 -0.20 0.00 -1.87 0.00 0.00 60.65 58.77 3iec h LYS 150 Cb 0.05 -0.27 0.01 0.00 0.08 0.00 0.00 32.23 32.11 3iec h LYS 150 CO -0.04 0.78 -0.73 1.49 -0.57 0.00 0.00 179.45 180.38 3iec h GLU 151 N 1.21 0.62 -0.88 3.15 4.81 -1.65 -2.40 114.58 119.44 3iec h GLU 151 Ca 0.38 -0.57 0.02 0.00 -0.13 0.00 0.00 59.36 59.05 3iec h GLU 151 Cb -0.01 0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.46 3iec h GLU 151 CO -0.12 1.19 0.58 0.00 -0.73 0.00 0.00 179.01 179.93 3iec h ALA 152 N 0.45 1.13 -0.50 2.92 0.00 -0.41 -2.16 119.26 120.69 3iec h ALA 152 Ca -0.07 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3iec h ALA 152 Cb 1.38 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 3iec h ALA 152 CO 0.15 0.48 0.30 -0.09 0.00 0.00 0.00 179.25 180.08 3iec h ARG 153 N 1.16 0.68 -0.61 0.00 2.43 -0.77 0.30 114.38 117.56 3iec h ARG 153 Ca 0.33 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.46 3iec h ARG 153 Cb -0.08 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.29 3iec h ARG 153 CO -0.09 0.50 0.38 0.00 -1.51 0.00 0.00 179.97 179.25 3iec h ALA 154 N 1.14 0.79 -0.37 2.80 0.00 -0.87 -0.90 119.26 121.84 3iec h ALA 154 Ca 0.18 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 3iec h ALA 154 Cb -0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3iec h ALA 154 CO -0.03 0.13 -0.01 0.87 0.00 0.00 0.00 179.25 180.21 3iec h LYS 155 N 0.75 0.67 -0.01 0.00 6.56 -1.24 -3.24 116.57 120.06 3iec h LYS 155 Ca 0.24 -0.22 -0.14 0.00 -1.06 0.00 0.00 60.65 59.48 3iec h LYS 155 Cb 0.01 -0.06 -0.02 0.00 -0.57 0.00 0.00 32.23 31.59 3iec h LYS 155 CO -0.09 0.77 -0.62 0.35 -2.06 0.00 0.00 179.45 177.80 3iec h PHE 156 N 0.48 0.07 -0.86 -1.35 3.57 0.18 -0.37 116.94 118.68 3iec h PHE 156 Ca 0.11 -0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.60 3iec h PHE 156 Cb 0.48 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.16 3iec h PHE 156 CO 0.04 0.66 0.56 0.00 -2.23 0.00 0.00 178.31 177.34 3iec h ARG 157 N 0.04 1.09 -0.41 1.11 3.08 -1.27 0.24 114.38 118.27 3iec h ARG 157 Ca -0.01 -0.07 -0.09 0.00 0.07 0.00 0.00 59.98 59.89 3iec h ARG 157 Cb 1.11 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.90 3iec h ARG 157 CO 0.08 0.72 -0.09 1.96 -1.07 0.00 0.00 179.97 181.58 3iec h GLN 158 N 1.12 0.78 -0.23 0.04 4.20 -1.40 -0.73 115.11 118.89 3iec h GLN 158 Ca 0.33 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 3iec h GLN 158 Cb -0.07 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 3iec h GLN 158 CO -0.09 0.90 0.12 0.82 -0.67 0.00 0.00 178.83 179.91 3iec h ILE 159 N 0.60 1.12 -0.50 2.54 2.04 -0.74 -1.23 117.51 121.33 3iec h ILE 159 Ca 0.10 -0.33 -0.12 0.00 1.00 0.00 0.00 64.86 65.51 3iec h ILE 159 Cb 0.61 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 3iec h ILE 159 CO 0.04 0.12 -0.17 0.58 0.00 0.00 0.00 178.15 178.71 3iec h VAL 160 N 0.25 1.27 -0.40 1.67 2.07 -0.47 -0.72 116.25 119.92 3iec h VAL 160 Ca 0.08 -1.34 0.02 0.00 0.82 0.00 0.00 66.70 66.29 3iec h VAL 160 Cb 0.08 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 3iec h VAL 160 CO -0.01 0.46 0.22 -1.28 0.02 0.00 0.00 177.57 176.98 3iec h SER 161 N 0.86 0.35 -0.35 0.57 0.87 -0.97 -0.25 113.55 114.62 3iec h SER 161 Ca 0.12 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.67 3iec h SER 161 Cb 0.75 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.63 3iec h SER 161 CO 0.06 0.25 0.14 0.00 -0.53 0.00 0.00 176.83 176.75 3iec h ALA 162 N 1.19 0.46 -0.36 6.23 0.00 -1.00 -1.49 119.26 124.29 3iec h ALA 162 Ca 0.16 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.78 3iec h ALA 162 Cb 0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3iec h ALA 162 CO -0.09 0.07 -0.41 0.28 0.00 0.00 0.00 179.25 179.10 3iec h VAL 163 N 0.42 1.27 -0.68 0.00 2.07 -0.85 -1.10 116.25 117.39 3iec h VAL 163 Ca 0.12 -1.58 -0.00 0.00 0.82 0.00 0.00 66.70 66.05 3iec h VAL 163 Cb 0.20 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 3iec h VAL 163 CO -0.01 0.53 0.42 -0.61 0.02 0.00 0.00 177.57 177.92 3iec h GLN 164 N 0.73 0.91 -0.40 1.57 -0.00 -1.01 -1.66 115.11 115.24 3iec h GLN 164 Ca 0.05 -0.07 -0.15 0.00 -0.00 0.00 0.00 58.65 58.48 3iec h GLN 164 Cb 1.00 -0.20 -0.01 0.00 0.00 0.00 0.00 27.48 28.27 3iec h GLN 164 CO 0.10 0.62 -0.35 -0.92 0.00 0.00 0.00 178.83 178.29 3iec h TYR 165 N 0.93 1.12 -0.74 3.99 3.20 -0.87 0.17 116.97 124.76 3iec h TYR 165 Ca 0.25 -0.32 0.11 0.00 3.14 0.00 0.00 58.73 61.91 3iec h TYR 165 Cb -0.06 -0.24 -0.08 0.00 1.54 0.00 0.00 36.73 37.89 3iec h TYR 165 CO 0.00 1.15 0.35 0.00 -1.64 0.00 0.00 178.16 178.01 3iec h HIS 167 N 0.56 1.07 -0.85 0.00 3.86 -0.57 0.15 115.15 119.36 3iec h HIS 167 Ca 0.38 -0.09 0.15 0.00 -1.16 0.00 0.00 60.37 59.65 3iec h HIS 167 Cb 0.48 -0.32 -0.10 0.00 1.06 0.00 0.00 27.41 28.53 3iec h HIS 167 CO -0.12 0.84 0.43 1.96 0.86 0.00 0.00 177.93 181.90 3iec h GLN 168 N 0.99 0.58 -0.09 2.45 4.20 -0.40 0.68 115.11 123.51 3iec h GLN 168 Ca 0.23 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.90 3iec h GLN 168 Cb 0.25 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.90 3iec h GLN 168 CO -0.01 0.38 0.00 1.63 -0.67 0.00 0.00 178.83 180.16 3iec n LYS 169 N -4.89 1.27 -2.90 1.46 4.76 -0.77 -4.92 118.16 112.17 3iec n LYS 169 Ca 0.18 -0.42 -0.14 0.00 -2.87 0.00 0.00 58.31 55.06 3iec n LYS 169 Cb 0.46 -1.23 0.03 0.00 -1.84 0.00 0.00 35.03 32.46 3iec n LYS 169 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 3iec n PHE 170 N -0.28 -1.44 -4.68 2.13 3.01 0.23 -4.96 117.46 111.48 3iec n PHE 170 Ca 0.10 0.44 -0.29 0.00 1.01 0.00 0.00 57.45 58.72 3iec n PHE 170 Cb 0.14 -3.30 -0.17 0.00 -0.01 0.00 0.00 39.48 36.14 3iec n PHE 170 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3iec s ILE 171 N -3.03 1.57 -0.12 4.37 1.01 -0.06 -0.67 121.20 124.27 3iec s ILE 171 Ca 0.26 -0.71 -0.08 0.00 0.00 0.00 0.00 60.65 60.12 3iec s ILE 171 Cb -0.11 -1.41 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 3iec s ILE 171 CO 0.32 0.45 0.17 0.68 0.00 0.00 0.00 174.94 176.56 3iec s VAL 172 N 0.75 5.44 -0.11 2.92 -7.23 -0.26 -3.37 120.40 118.54 3iec s VAL 172 Ca -0.11 0.28 -0.13 0.00 -1.81 0.00 0.00 61.98 60.20 3iec s VAL 172 Cb -0.16 -3.45 -0.12 0.00 0.56 0.00 0.00 36.38 33.22 3iec s VAL 172 CO 0.02 0.59 0.38 -0.74 -0.31 0.00 0.00 175.10 175.04 3iec h HIS 173 N 5.18 -0.02 0.00 2.82 2.76 -1.91 -2.26 115.15 121.71 3iec h HIS 173 Ca -0.53 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.64 3iec h HIS 173 Cb 1.22 0.01 0.00 0.00 1.55 0.00 0.00 27.41 30.19 3iec h HIS 173 CO 0.73 0.41 0.00 0.54 -1.30 0.00 0.00 177.93 178.31 3iec n ARG 174 N -4.73 0.00 -2.63 5.26 1.74 -1.26 -2.13 116.66 112.91 3iec n ARG 174 Ca -0.05 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.93 3iec n ARG 174 Cb 0.21 -3.23 0.03 0.00 -1.02 0.00 0.00 32.46 28.45 3iec n ARG 174 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3iec n ASP 175 N 0.00 2.28 -4.67 0.55 2.03 -1.26 -4.38 116.55 111.09 3iec n ASP 175 Ca 0.00 -2.73 -0.42 0.00 0.52 0.00 0.00 54.79 52.15 3iec n ASP 175 Cb 0.00 -0.49 -0.03 0.00 -0.72 0.00 0.00 41.12 39.89 3iec n ASP 175 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3iec s LEU 176 N -3.45 4.30 0.10 -2.67 1.02 -1.26 -4.77 118.68 111.95 3iec s LEU 176 Ca 0.32 2.13 -0.26 0.00 0.02 0.00 0.00 54.13 56.34 3iec s LEU 176 Cb 0.40 -3.55 0.08 0.00 0.02 0.00 0.00 46.19 43.14 3iec s LEU 176 CO -0.02 -0.83 0.93 -1.59 0.02 0.00 0.00 176.35 174.86 3iec s LYS 177 N 3.27 1.07 0.33 1.70 -2.85 -1.26 -4.88 119.74 117.12 3iec s LYS 177 Ca 0.67 -0.54 0.01 0.00 -1.00 0.00 0.00 55.97 55.12 3iec s LYS 177 Cb -0.31 0.40 0.58 0.00 -2.06 0.00 0.00 37.83 36.44 3iec s LYS 177 CO 0.26 -0.49 1.97 0.00 0.10 0.00 0.00 175.35 177.20 3iec h ALA 178 N 2.00 1.53 0.00 0.59 0.00 -1.93 0.71 119.26 122.17 3iec h ALA 178 Ca -0.24 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 3iec h ALA 178 Cb 1.24 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 3iec h ALA 178 CO 0.28 0.40 -0.09 0.93 0.00 0.00 0.00 179.25 180.76 3iec h GLU 179 N 0.95 0.00 -0.54 0.00 3.07 -1.95 -2.62 114.58 113.49 3iec h GLU 179 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 3iec h GLU 179 Cb 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 3iec h GLU 179 CO -0.08 0.09 0.00 0.09 -1.40 0.00 0.00 179.01 177.71 3iec n ASN 180 N -3.84 3.56 -4.36 1.42 5.03 0.22 -4.74 115.26 112.56 3iec n ASN 180 Ca -0.02 -1.99 -0.38 0.00 0.87 0.00 0.00 54.58 53.05 3iec n ASN 180 Cb 0.19 -0.35 -0.12 0.00 -1.02 0.00 0.00 39.78 38.47 3iec n ASN 180 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3iec s LEU 181 N -1.26 4.22 0.34 3.41 1.43 -1.02 -1.14 118.68 124.67 3iec s LEU 181 Ca 0.43 -0.82 0.07 0.00 -1.03 0.00 0.00 54.13 52.77 3iec s LEU 181 Cb 0.24 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.50 3iec s LEU 181 CO 0.32 -0.27 0.42 -0.76 0.23 0.00 0.00 176.35 176.29 3iec s LEU 182 N 1.52 3.84 -0.06 1.79 1.43 -0.09 0.19 118.68 127.30 3iec s LEU 182 Ca 0.02 -0.29 0.04 0.00 -1.03 0.00 0.00 54.13 52.87 3iec s LEU 182 Cb -0.18 -2.58 0.00 0.00 0.03 0.00 0.00 46.19 43.46 3iec s LEU 182 CO 0.04 -0.42 -0.19 -0.76 0.23 0.00 0.00 176.35 175.25 3iec s LEU 183 N -4.13 1.92 0.00 1.79 1.43 0.08 -0.54 118.68 119.22 3iec s LEU 183 Ca 0.44 -0.41 -0.06 0.00 -1.03 0.00 0.00 54.13 53.07 3iec s LEU 183 Cb -0.08 -1.10 0.17 0.00 0.03 0.00 0.00 46.19 45.20 3iec s LEU 183 CO 0.30 0.14 1.09 -0.90 0.23 0.00 0.00 176.35 177.21 3iec n ASP 184 N 3.36 0.85 -0.31 2.29 5.68 -0.45 -0.24 116.55 127.72 3iec n ASP 184 Ca -0.19 -1.86 0.20 0.00 -0.50 0.00 0.00 54.79 52.43 3iec n ASP 184 Cb 0.53 -0.77 0.47 0.00 -1.14 0.00 0.00 41.12 40.21 3iec n ASP 184 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3iec h ALA 185 N -1.06 2.10 -0.28 2.12 0.00 -1.90 0.60 119.26 120.83 3iec h ALA 185 Ca -0.36 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3iec h ALA 185 Cb 1.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3iec h ALA 185 CO 0.33 -0.48 0.00 -0.25 0.00 0.00 0.00 179.25 178.85 3iec n ASP 186 N -4.64 2.39 -2.29 0.00 8.00 -1.26 -4.90 116.55 113.85 3iec n ASP 186 Ca 0.24 -2.21 -0.21 0.00 0.71 0.00 0.00 54.79 53.32 3iec n ASP 186 Cb 0.78 -0.40 -0.02 0.00 -0.02 0.00 0.00 41.12 41.45 3iec n ASP 186 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3iec n MET 187 N 0.34 -1.66 -3.38 -1.24 2.81 0.20 -5.00 117.12 109.19 3iec n MET 187 Ca 0.11 1.04 -0.35 0.00 -1.81 0.00 0.00 57.70 56.69 3iec n MET 187 Cb 0.47 -5.67 -0.06 0.00 -0.71 0.00 0.00 33.22 27.26 3iec n MET 187 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 3iec s ASN 188 N -2.15 6.82 0.32 7.83 0.01 -1.26 -4.83 114.94 121.68 3iec s ASN 188 Ca 0.00 1.06 -0.28 0.00 -0.71 0.00 0.00 52.86 52.92 3iec s ASN 188 Cb 0.00 -2.28 -0.09 0.00 0.41 0.00 0.00 41.25 39.29 3iec s ASN 188 CO 0.00 0.12 1.16 -0.63 -1.51 0.00 0.00 177.10 176.24 3iec s ILE 189 N -1.43 3.26 -0.18 0.60 -1.09 -1.26 -1.34 121.20 119.75 3iec s ILE 189 Ca 0.37 1.21 -0.02 0.00 -2.23 0.00 0.00 60.65 59.98 3iec s ILE 189 Cb -0.15 -3.75 0.05 0.00 -1.58 0.00 0.00 42.46 37.04 3iec s ILE 189 CO 0.19 0.24 0.01 -0.54 -1.23 0.00 0.00 174.94 173.61 3iec s LYS 190 N -1.76 0.83 0.20 2.79 -0.14 0.29 -4.20 119.74 117.77 3iec s LYS 190 Ca 0.49 -0.43 -0.30 0.00 -1.36 0.00 0.00 55.97 54.36 3iec s LYS 190 Cb -0.33 -2.03 -0.08 0.00 -1.68 0.00 0.00 37.83 33.71 3iec s LYS 190 CO 0.42 -0.58 1.04 0.42 -0.76 0.00 0.00 175.35 175.90 3iec s ILE 191 N 1.80 3.93 0.33 2.17 1.01 0.75 -0.91 121.20 130.28 3iec s ILE 191 Ca -0.01 1.76 0.03 0.00 0.00 0.00 0.00 60.65 62.44 3iec s ILE 191 Cb -0.17 -4.12 -0.05 0.00 0.01 0.00 0.00 42.46 38.13 3iec s ILE 191 CO -0.07 0.35 0.07 0.00 0.00 0.00 0.00 174.94 175.29 3iec s ALA 192 N -0.60 2.40 -0.26 9.38 0.00 -0.29 -1.68 121.76 130.71 3iec s ALA 192 Ca 0.46 -1.88 -0.05 0.00 0.00 0.00 0.00 51.96 50.49 3iec s ALA 192 Cb -0.28 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.56 3iec s ALA 192 CO 0.35 -0.33 0.31 -3.47 0.00 0.00 0.00 175.76 172.62 3iec n ASP 193 N -0.77 -4.91 -1.84 0.00 2.03 -1.26 -4.83 116.55 104.98 3iec n ASP 193 Ca -0.03 0.17 -0.15 0.00 0.52 0.00 0.00 54.79 55.30 3iec n ASP 193 Cb 0.66 -3.15 0.14 0.00 -0.72 0.00 0.00 41.12 38.05 3iec n ASP 193 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3iec n PHE 194 N -0.71 2.12 0.21 -0.67 3.01 -1.26 -4.53 117.46 115.62 3iec n PHE 194 Ca 0.04 -1.37 0.07 0.00 1.01 0.00 0.00 57.45 57.20 3iec n PHE 194 Cb 0.31 -0.71 0.42 0.00 -0.01 0.00 0.00 39.48 39.49 3iec n PHE 194 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3iec h GLY 195 N 2.10 0.00 -1.83 1.37 0.00 -1.93 -2.64 103.07 100.14 3iec h GLY 195 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.74 3iec h GLY 195 CO 0.75 0.00 -0.03 0.69 0.00 0.00 0.00 176.54 177.94 3iec n PHE 196 N -3.57 0.00 -1.60 5.60 0.99 -1.26 -4.96 117.46 112.65 3iec n PHE 196 Ca -0.01 0.00 -0.33 0.00 -0.00 0.00 0.00 57.45 57.12 3iec n PHE 196 Cb 0.44 0.00 0.06 0.00 -1.00 0.00 0.00 39.48 38.98 3iec n PHE 196 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.76 175.64 3iec s SER 197 N -2.00 4.84 0.12 4.37 0.01 -0.91 -4.67 113.70 115.46 3iec s SER 197 Ca 0.27 2.01 -0.17 0.00 1.31 0.00 0.00 55.95 59.37 3iec s SER 197 Cb 0.20 -2.55 0.04 0.00 0.21 0.00 0.00 66.02 63.91 3iec s SER 197 CO 0.31 -1.81 0.42 0.21 0.41 0.00 0.00 173.24 172.77 3iec s ASN 198 N -2.68 -0.26 0.49 2.44 3.84 -0.85 -4.88 114.94 113.04 3iec s ASN 198 Ca 0.67 -0.28 -0.20 0.00 0.21 0.00 0.00 52.86 53.26 3iec s ASN 198 Cb -0.21 0.48 -0.08 0.00 -0.55 0.00 0.00 41.25 40.89 3iec s ASN 198 CO 0.45 -0.85 1.04 -1.61 -2.79 0.00 0.00 177.10 173.33 3iec s GLU 199 N -3.75 3.77 0.13 0.43 8.01 -1.26 -1.10 118.70 124.93 3iec s GLU 199 Ca 0.02 1.34 0.04 0.00 0.01 0.00 0.00 54.97 56.38 3iec s GLU 199 Cb 0.02 -2.09 -0.04 0.00 -4.31 0.00 0.00 34.13 27.70 3iec s GLU 199 CO -0.12 -0.45 -0.10 -0.59 0.01 0.00 0.00 175.26 174.02 3iec s PHE 200 N -2.03 1.16 -0.23 1.61 -0.12 0.15 -4.86 117.98 113.67 3iec s PHE 200 Ca 0.67 -0.76 -0.03 0.00 -0.05 0.00 0.00 56.93 56.76 3iec s PHE 200 Cb -0.16 -0.61 0.07 0.00 -0.63 0.00 0.00 43.02 41.69 3iec s PHE 200 CO 0.21 0.03 0.07 0.95 -0.05 0.00 0.00 175.22 176.43 3iec s THR 201 N -3.17 0.35 0.10 -4.49 -4.23 -1.26 -4.77 115.64 98.16 3iec s THR 201 Ca 0.13 -0.66 0.08 0.00 -1.18 0.00 0.00 61.69 60.06 3iec s THR 201 Cb 0.02 -1.04 0.12 0.00 1.34 0.00 0.00 72.50 72.94 3iec s THR 201 CO -0.00 -0.40 0.31 0.49 -0.54 0.00 0.00 174.62 174.48 3iec n PHE 202 N 5.10 0.10 1.39 3.99 3.01 -1.26 0.84 117.46 130.62 3iec n PHE 202 Ca -0.07 0.10 0.00 0.00 1.01 0.00 0.00 57.45 58.49 3iec n PHE 202 Cb 0.46 -0.35 0.00 0.00 -0.01 0.00 0.00 39.48 39.57 3iec n PHE 202 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3iec n GLY 203 N -1.13 -0.60 2.88 1.37 0.00 -1.26 -4.69 105.19 101.75 3iec n GLY 203 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 3iec n GLY 203 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3iec s ASN 204 N -1.22 0.65 0.71 1.61 0.01 0.25 -5.15 114.94 111.80 3iec s ASN 204 Ca 0.00 0.12 -0.12 0.00 -0.71 0.00 0.00 52.86 52.15 3iec s ASN 204 Cb 0.00 0.82 0.02 0.00 0.41 0.00 0.00 41.25 42.50 3iec s ASN 204 CO 0.00 -0.30 1.08 -0.54 -1.51 0.00 0.00 177.10 175.83 3iec s LYS 205 N 2.46 2.64 0.23 -0.60 1.02 -1.26 -4.48 119.74 119.74 3iec s LYS 205 Ca 0.09 1.15 0.06 0.00 0.02 0.00 0.00 55.97 57.30 3iec s LYS 205 Cb -0.15 -1.94 -0.04 0.00 -0.52 0.00 0.00 37.83 35.18 3iec s LYS 205 CO -0.14 -1.34 0.19 -0.51 -0.92 0.00 0.00 175.35 172.63 3iec s LEU 206 N -5.49 3.85 -0.00 3.17 1.02 0.33 -4.81 118.68 116.75 3iec s LEU 206 Ca 0.62 -0.20 0.03 0.00 0.02 0.00 0.00 54.13 54.60 3iec s LEU 206 Cb -0.17 -2.40 -0.05 0.00 0.02 0.00 0.00 46.19 43.59 3iec s LEU 206 CO 0.51 -0.01 0.07 0.47 0.02 0.00 0.00 176.35 177.41 3iec n ASP 207 N -0.98 4.16 -4.85 2.29 9.92 -1.26 -2.50 116.55 123.33 3iec n ASP 207 Ca -0.08 -0.01 -0.37 0.00 -0.53 0.00 0.00 54.79 53.80 3iec n ASP 207 Cb 0.57 1.15 -0.06 0.00 -0.64 0.00 0.00 41.12 42.13 3iec n ASP 207 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 3iec s THR 208 N -2.21 5.48 -0.62 -3.53 -4.23 -1.26 -4.96 115.64 104.31 3iec s THR 208 Ca -0.01 0.22 0.03 0.00 -1.18 0.00 0.00 61.69 60.75 3iec s THR 208 Cb 0.02 -3.42 0.38 0.00 1.34 0.00 0.00 72.50 70.82 3iec s THR 208 CO 0.14 0.58 1.33 0.49 -0.54 0.00 0.00 174.62 176.62 3iec n PHE 209 N 2.28 3.42 -3.45 3.99 3.01 -1.26 -5.02 117.46 120.42 3iec n PHE 209 Ca -0.19 -3.11 -0.33 0.00 1.01 0.00 0.00 57.45 54.82 3iec n PHE 209 Cb 0.54 -0.52 -0.05 0.00 -0.01 0.00 0.00 39.48 39.44 3iec n PHE 209 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3iec n GLY 211 N 0.39 -0.70 3.10 0.00 0.00 -1.26 -4.92 105.19 101.80 3iec n GLY 211 Ca -0.03 -0.85 -0.31 0.00 0.00 0.00 0.00 46.02 44.83 3iec n GLY 211 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3iec s SER 212 N -4.00 2.79 0.24 1.61 0.01 -1.26 -5.05 113.70 108.03 3iec s SER 212 Ca 0.00 -0.52 -0.10 0.00 1.31 0.00 0.00 55.95 56.64 3iec s SER 212 Cb 0.00 -1.27 0.36 0.00 0.21 0.00 0.00 66.02 65.32 3iec s SER 212 CO 0.00 0.03 1.62 -0.65 0.41 0.00 0.00 173.24 174.65 3iec h PRO 213 N 7.49 0.03 0.00 12.44 0.11 -1.99 -0.80 132.00 149.28 3iec h PRO 213 Ca -0.33 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3iec h PRO 213 Cb 1.17 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3iec h PRO 213 CO 0.53 0.02 0.00 -0.35 -0.21 0.00 0.00 178.00 177.99 3iec n PRO 214 N -5.44 0.11 -0.06 1.05 -0.04 -1.26 -2.79 135.00 126.57 3iec n PRO 214 Ca 0.12 0.30 0.07 0.00 -0.04 0.00 0.00 63.50 63.95 3iec n PRO 214 Cb 0.42 -1.69 0.10 0.00 -0.04 0.00 0.00 33.50 32.28 3iec n PRO 214 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3iec n TYR 215 N -1.90 0.16 -3.24 0.54 4.02 -0.34 -4.73 117.16 111.67 3iec n TYR 215 Ca 0.03 -0.13 -0.38 0.00 -0.01 0.00 0.00 57.90 57.40 3iec n TYR 215 Cb 0.23 -0.01 -0.06 0.00 -0.02 0.00 0.00 39.34 39.49 3iec n TYR 215 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3iec s ALA 216 N -1.13 3.46 0.37 -0.72 0.00 -1.02 -3.66 121.76 119.07 3iec s ALA 216 Ca 0.20 -0.07 -0.28 0.00 0.00 0.00 0.00 51.96 51.81 3iec s ALA 216 Cb 0.13 -2.72 -0.11 0.00 0.00 0.00 0.00 23.12 20.42 3iec s ALA 216 CO 0.18 0.06 1.49 0.00 0.00 0.00 0.00 175.76 177.49 3iec n ALA 217 N 3.31 2.37 0.01 0.00 0.00 -1.26 -4.90 120.51 120.04 3iec n ALA 217 Ca -0.06 0.34 0.12 0.00 0.00 0.00 0.00 53.44 53.84 3iec n ALA 217 Cb 0.51 -2.42 0.56 0.00 0.00 0.00 0.00 19.45 18.10 3iec n ALA 217 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3iec h PRO 218 N 3.06 0.25 0.00 0.00 0.13 -1.90 -0.17 132.00 133.37 3iec h PRO 218 Ca -0.50 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.60 3iec h PRO 218 Cb 1.24 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 3iec h PRO 218 CO 0.65 0.17 -0.04 1.05 -0.23 0.00 0.00 178.00 179.59 3iec h GLU 219 N 0.26 0.00 -0.38 0.86 9.09 -1.90 -1.31 114.58 121.20 3iec h GLU 219 Ca 0.20 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.55 3iec h GLU 219 Cb 0.46 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.55 3iec h GLU 219 CO -0.04 0.04 0.01 -0.07 0.05 0.00 0.00 179.01 179.00 3iec h LEU 220 N 0.00 0.64 -0.69 3.06 3.38 -1.31 -0.87 115.31 119.52 3iec h LEU 220 Ca -0.00 -0.30 0.04 0.00 0.09 0.00 0.00 57.88 57.71 3iec h LEU 220 Cb 0.08 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 3iec h LEU 220 CO 0.01 0.78 0.42 -0.26 0.09 0.00 0.00 178.44 179.47 3iec h PHE 221 N 0.48 0.77 0.00 1.13 0.04 -1.38 -2.83 116.94 115.16 3iec h PHE 221 Ca 0.11 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.90 3iec h PHE 221 Cb 0.45 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 38.35 3iec h PHE 221 CO 0.03 0.42 -0.02 1.96 -0.60 0.00 0.00 178.31 180.10 3iec h GLN 222 N 0.80 0.00 -0.96 1.51 4.20 -0.98 -3.47 115.11 116.21 3iec h GLN 222 Ca 0.29 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.99 3iec h GLN 222 Cb 0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.86 3iec h GLN 222 CO -0.13 0.02 -0.02 0.41 -0.67 0.00 0.00 178.83 178.44 3iec n GLY 223 N 0.33 0.84 3.75 3.46 0.00 -0.38 -5.06 105.19 108.13 3iec n GLY 223 Ca 0.01 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 44.99 3iec n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3iec s LYS 224 N -4.88 3.89 0.24 1.61 1.02 -0.91 -5.06 119.74 115.65 3iec s LYS 224 Ca 0.01 -0.22 -0.30 0.00 0.02 0.00 0.00 55.97 55.47 3iec s LYS 224 Cb -0.01 -3.29 -0.15 0.00 -0.52 0.00 0.00 37.83 33.87 3iec s LYS 224 CO 0.01 0.45 1.14 1.63 -0.92 0.00 0.00 175.35 177.66 3iec n LYS 225 N 3.03 1.40 -4.15 1.68 5.02 -1.26 -4.74 118.16 119.15 3iec n LYS 225 Ca -0.17 0.50 -0.13 0.00 -2.02 0.00 0.00 58.31 56.48 3iec n LYS 225 Cb 0.53 -1.97 -0.11 0.00 -0.02 0.00 0.00 35.03 33.46 3iec n LYS 225 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 3iec s TYR 226 N -0.55 0.93 0.06 2.13 -0.85 -1.04 -4.83 117.35 113.20 3iec s TYR 226 Ca 0.66 -0.67 -0.18 0.00 -0.52 0.00 0.00 57.07 56.36 3iec s TYR 226 Cb -0.75 -0.53 -0.13 0.00 0.38 0.00 0.00 41.96 40.93 3iec s TYR 226 CO 0.55 -0.05 1.34 -0.44 -1.52 0.00 0.00 175.55 175.43 3iec h ASP 227 N 3.69 0.56 0.00 -0.18 3.32 -1.90 0.95 116.42 122.87 3iec h ASP 227 Ca -0.37 -0.52 0.00 0.00 0.02 0.00 0.00 57.03 56.16 3iec h ASP 227 Cb 1.19 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.58 3iec h ASP 227 CO 0.52 0.98 0.00 0.61 -1.72 0.00 0.00 179.24 179.63 3iec n GLY 228 N 0.32 0.95 0.36 2.75 0.00 -1.26 -4.48 105.19 103.83 3iec n GLY 228 Ca -0.06 -0.18 0.16 0.00 0.00 0.00 0.00 46.02 45.94 3iec n GLY 228 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3iec h PRO 229 N 0.00 0.64 -0.00 1.61 0.11 -1.94 -1.53 132.00 130.88 3iec h PRO 229 Ca 0.00 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.07 3iec h PRO 229 Cb 0.00 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 30.97 3iec h PRO 229 CO 0.00 0.42 0.00 1.05 -0.21 0.00 0.00 178.00 179.26 3iec h GLU 230 N 0.66 0.00 -0.13 1.05 9.09 -1.94 -1.03 114.58 122.29 3iec h GLU 230 Ca 0.60 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.83 3iec h GLU 230 Cb 1.08 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.17 3iec h GLU 230 CO -0.40 0.00 -0.67 0.28 0.05 0.00 0.00 179.01 178.27 3iec h VAL 231 N 0.00 1.34 -0.20 -1.06 2.07 -1.69 -2.43 116.25 114.29 3iec h VAL 231 Ca 0.00 -1.99 -0.07 0.00 0.82 0.00 0.00 66.70 65.46 3iec h VAL 231 Cb 0.01 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 3iec h VAL 231 CO -0.00 0.61 -0.19 0.44 0.02 0.00 0.00 177.57 178.45 3iec h ASP 232 N 0.37 0.33 -0.48 0.57 3.32 -1.29 -2.84 116.42 116.40 3iec h ASP 232 Ca -0.02 -0.09 -0.04 0.00 0.02 0.00 0.00 57.03 56.90 3iec h ASP 232 Cb 1.24 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.68 3iec h ASP 232 CO 0.12 0.54 0.14 0.58 -1.72 0.00 0.00 179.24 178.91 3iec h VAL 233 N 0.31 1.23 -0.36 -1.35 2.07 -0.85 -1.44 116.25 115.87 3iec h VAL 233 Ca 0.06 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 3iec h VAL 233 Cb 0.52 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 3iec h VAL 233 CO 0.03 0.28 0.16 -0.25 0.02 0.00 0.00 177.57 177.81 3iec h TRP 234 N 0.64 0.53 -0.91 1.57 2.91 -1.41 -2.65 115.95 116.63 3iec h TRP 234 Ca 0.15 -0.03 0.13 0.00 1.13 0.00 0.00 58.89 60.27 3iec h TRP 234 Cb 0.28 -0.16 -0.07 0.00 -0.51 0.00 0.00 29.16 28.70 3iec h TRP 234 CO 0.02 0.46 0.58 0.77 -1.03 0.00 0.00 178.44 179.24 3iec h SER 235 N 0.44 0.73 0.05 2.65 0.02 -1.27 -0.98 113.55 115.19 3iec h SER 235 Ca 0.12 0.04 -0.09 0.00 -0.84 0.00 0.00 61.79 61.02 3iec h SER 235 Cb 0.14 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 3iec h SER 235 CO -0.01 0.39 -0.27 -0.07 -1.14 0.00 0.00 176.83 175.73 3iec h LEU 236 N 0.78 0.35 -0.28 5.07 -0.00 -0.97 -0.37 115.31 119.90 3iec h LEU 236 Ca 0.45 -0.11 0.00 0.00 -0.00 0.00 0.00 57.88 58.22 3iec h LEU 236 Cb 0.62 -0.09 -0.01 0.00 -0.00 0.00 0.00 40.66 41.17 3iec h LEU 236 CO -0.21 0.61 0.17 1.23 -0.00 0.00 0.00 178.44 180.25 3iec h GLY 237 N 1.02 0.40 0.97 0.83 0.00 -0.86 -1.12 103.07 104.30 3iec h GLY 237 Ca 0.05 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 3iec h GLY 237 CO 0.05 0.15 0.24 -2.08 0.00 0.00 0.00 176.54 174.90 3iec h VAL 238 N 0.36 1.16 -0.47 4.60 2.07 -0.89 -1.88 116.25 121.20 3iec h VAL 238 Ca 0.10 -0.40 0.09 0.00 0.82 0.00 0.00 66.70 67.31 3iec h VAL 238 Cb -0.01 0.64 -0.08 0.00 -1.52 0.00 0.00 31.29 30.32 3iec h VAL 238 CO -0.02 0.16 -0.03 0.40 0.02 0.00 0.00 177.57 178.11 3iec h ILE 239 N 0.56 0.61 -0.07 4.57 2.04 -0.92 -1.19 117.51 123.11 3iec h ILE 239 Ca 0.15 -0.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.98 3iec h ILE 239 Cb 0.05 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.65 3iec h ILE 239 CO -0.02 0.02 0.04 0.25 0.00 0.00 0.00 178.15 178.43 3iec h LEU 240 N 0.08 0.08 -0.74 1.44 6.46 -0.94 0.82 115.31 122.52 3iec h LEU 240 Ca 0.23 -0.04 0.10 0.00 -0.12 0.00 0.00 57.88 58.06 3iec h LEU 240 Cb 0.35 -0.02 -0.08 0.00 -0.73 0.00 0.00 40.66 40.18 3iec h LEU 240 CO -0.41 0.10 0.36 0.22 -0.62 0.00 0.00 178.44 178.09 3iec h TYR 241 N 0.06 0.65 -0.00 1.25 5.03 -0.89 -2.68 116.97 120.39 3iec h TYR 241 Ca 0.03 0.03 -0.18 0.00 2.58 0.00 0.00 58.73 61.19 3iec h TYR 241 Cb 0.03 -0.18 -0.02 0.00 1.55 0.00 0.00 36.73 38.11 3iec h TYR 241 CO -0.06 0.21 -0.81 1.79 -1.32 0.00 0.00 178.16 177.97 3iec h THR 242 N 0.60 1.53 -0.60 1.81 1.35 -0.46 -1.58 112.91 115.56 3iec h THR 242 Ca 0.37 -2.64 -0.02 0.00 -0.55 0.00 0.00 66.41 63.58 3iec h THR 242 Cb 0.43 2.44 -0.03 0.00 -1.73 0.00 0.00 68.15 69.26 3iec h THR 242 CO -0.29 0.76 0.32 -0.07 -0.25 0.00 0.00 175.52 175.98 3iec h LEU 243 N 0.05 0.77 0.00 3.87 3.38 -0.63 0.33 115.31 123.07 3iec h LEU 243 Ca -0.02 -0.11 -0.14 0.00 0.09 0.00 0.00 57.88 57.70 3iec h LEU 243 Cb 1.42 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.95 3iec h LEU 243 CO 0.11 0.65 -1.20 -0.37 0.09 0.00 0.00 178.44 177.72 3iec h VAL 244 N 0.82 0.54 0.00 1.22 -1.51 -1.34 -0.28 116.25 115.69 3iec h VAL 244 Ca 0.21 -1.97 -0.22 0.00 -1.23 0.00 0.00 66.70 63.50 3iec h VAL 244 Cb 0.07 2.07 -0.04 0.00 -2.13 0.00 0.00 31.29 31.26 3iec h VAL 244 CO -0.03 0.30 -2.01 -1.54 -1.23 0.00 0.00 177.57 173.07 3iec n SER 245 N -2.94 1.10 0.00 4.19 3.41 -0.61 -4.57 113.62 114.20 3iec n SER 245 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 3iec n SER 245 Cb 0.80 1.12 0.00 0.00 -0.26 0.00 0.00 64.21 65.86 3iec n SER 245 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3iec n GLY 246 N 1.90 0.52 3.40 5.00 0.00 0.12 -4.78 105.19 111.35 3iec n GLY 246 Ca -0.20 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.62 3iec n GLY 246 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3iec s SER 247 N -2.13 2.41 -0.05 1.61 0.01 -1.25 -4.95 113.70 109.35 3iec s SER 247 Ca 0.00 -1.24 -0.12 0.00 1.31 0.00 0.00 55.95 55.91 3iec s SER 247 Cb 0.00 -0.10 -0.05 0.00 0.21 0.00 0.00 66.02 66.08 3iec s SER 247 CO 0.00 -0.45 0.30 -0.76 0.41 0.00 0.00 173.24 172.74 3iec s LEU 248 N -3.41 4.44 0.27 2.44 1.43 -1.26 -3.63 118.68 118.95 3iec s LEU 248 Ca 0.31 0.77 0.09 0.00 -1.03 0.00 0.00 54.13 54.26 3iec s LEU 248 Cb 0.05 -2.38 0.34 0.00 0.03 0.00 0.00 46.19 44.24 3iec s LEU 248 CO 0.12 0.36 1.61 1.55 0.23 0.00 0.00 176.35 180.21 3iec h PRO 249 N 4.81 0.08 -4.12 1.29 0.13 -1.91 -3.43 132.00 128.85 3iec h PRO 249 Ca -0.53 -0.06 -0.54 0.00 -0.87 0.00 0.00 66.00 64.00 3iec h PRO 249 Cb 1.22 0.01 -0.38 0.00 0.13 0.00 0.00 31.00 31.98 3iec h PRO 249 CO 0.60 0.65 -0.79 -0.06 -0.23 0.00 0.00 178.00 178.17 3iec s PHE 250 N -3.70 1.58 0.17 1.56 0.40 -1.26 -4.72 117.98 112.01 3iec s PHE 250 Ca -0.02 -0.97 -0.24 0.00 -0.60 0.00 0.00 56.93 55.10 3iec s PHE 250 Cb 0.13 -1.26 0.07 0.00 0.51 0.00 0.00 43.02 42.46 3iec s PHE 250 CO 0.77 -0.58 0.99 0.34 0.70 0.00 0.00 175.22 177.44 3iec s ASP 251 N 1.67 -0.10 0.06 1.36 -1.08 -1.26 -4.69 116.67 112.63 3iec s ASP 251 Ca 0.02 -0.54 -0.03 0.00 -0.52 0.00 0.00 52.55 51.48 3iec s ASP 251 Cb -0.15 0.50 0.01 0.00 -1.46 0.00 0.00 42.92 41.83 3iec s ASP 251 CO -0.08 -0.96 0.17 0.61 0.52 0.00 0.00 175.17 175.44 3iec n GLY 252 N -0.56 1.51 0.22 2.66 0.00 -1.26 -4.50 105.19 103.26 3iec n GLY 252 Ca -0.05 -1.01 0.01 0.00 0.00 0.00 0.00 46.02 44.96 3iec n GLY 252 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3iec h GLN 253 N 0.00 0.22 -4.75 1.61 5.75 -2.02 -3.45 115.11 112.47 3iec h GLN 253 Ca -0.06 -0.07 -0.33 0.00 -0.15 0.00 0.00 58.65 58.03 3iec h GLN 253 Cb 0.23 -0.02 -0.14 0.00 1.07 0.00 0.00 27.48 28.62 3iec h GLN 253 CO 0.08 0.47 -0.58 0.54 -2.65 0.00 0.00 178.83 176.69 3iec s ASN 254 N -6.88 0.87 0.36 -0.69 2.20 -1.26 -5.07 114.94 104.47 3iec s ASN 254 Ca -0.05 -1.49 0.07 0.00 -0.94 0.00 0.00 52.86 50.45 3iec s ASN 254 Cb 0.14 0.38 0.68 0.00 -2.00 0.00 0.00 41.25 40.46 3iec s ASN 254 CO 0.75 -0.87 1.88 -0.07 -2.94 0.00 0.00 177.10 175.85 3iec h LEU 255 N 2.41 0.34 -1.48 3.54 4.07 -2.00 -3.07 115.31 119.12 3iec h LEU 255 Ca -0.34 -0.07 -0.04 0.00 0.08 0.00 0.00 57.88 57.51 3iec h LEU 255 Cb 1.25 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 42.89 3iec h LEU 255 CO 0.51 0.48 -0.09 0.50 -1.08 0.00 0.00 178.44 178.76 3iec h LYS 256 N 0.34 0.23 0.05 1.13 3.64 -1.98 0.21 116.57 120.19 3iec h LYS 256 Ca 0.07 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3iec h LYS 256 Cb 0.39 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 3iec h LYS 256 CO 0.02 0.33 -0.02 0.93 -2.27 0.00 0.00 179.45 178.44 3iec h GLU 257 N 0.23 -0.06 -0.22 1.90 5.08 -1.94 -2.15 114.58 117.42 3iec h GLU 257 Ca 0.05 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 3iec h GLU 257 Cb 0.30 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.49 3iec h GLU 257 CO 0.02 0.43 -0.43 1.25 -1.00 0.00 0.00 179.01 179.27 3iec h LEU 258 N -0.58 -1.38 -0.65 1.33 5.85 -1.33 0.18 115.31 118.72 3iec h LEU 258 Ca -0.01 0.19 0.13 0.00 0.84 0.00 0.00 57.88 59.03 3iec h LEU 258 Cb 0.52 0.57 -0.12 0.00 0.37 0.00 0.00 40.66 42.00 3iec h LEU 258 CO 0.01 -0.41 -0.16 -0.09 -0.34 0.00 0.00 178.44 177.45 3iec h ARG 259 N -0.45 0.00 -0.54 1.25 2.43 -1.06 0.12 114.38 116.14 3iec h ARG 259 Ca 0.09 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 3iec h ARG 259 Cb 0.62 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.14 3iec h ARG 259 CO -0.45 0.00 0.33 1.49 -1.51 0.00 0.00 179.97 179.82 3iec h GLU 260 N 0.00 0.73 -0.38 0.20 4.81 -0.36 -0.23 114.58 119.35 3iec h GLU 260 Ca 0.31 -0.06 -0.15 0.00 -0.13 0.00 0.00 59.36 59.33 3iec h GLU 260 Cb 0.48 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 3iec h GLU 260 CO -0.67 0.53 -0.34 0.00 -0.73 0.00 0.00 179.01 177.80 3iec h ARG 261 N 0.73 0.88 -0.33 1.92 3.08 0.25 0.11 114.38 121.01 3iec h ARG 261 Ca 0.19 -0.43 0.02 0.00 0.07 0.00 0.00 59.98 59.83 3iec h ARG 261 Cb -0.02 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.01 3iec h ARG 261 CO -0.04 1.08 0.17 0.28 -1.07 0.00 0.00 179.97 180.39 3iec h VAL 262 N 0.73 1.00 -0.48 2.04 2.07 -0.52 0.11 116.25 121.20 3iec h VAL 262 Ca 0.07 -0.12 -0.12 0.00 0.82 0.00 0.00 66.70 67.35 3iec h VAL 262 Cb 0.91 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 3iec h VAL 262 CO 0.08 0.06 -0.16 -0.07 0.02 0.00 0.00 177.57 177.50 3iec h LEU 263 N 0.35 0.98 -0.89 2.57 3.38 -0.82 -1.38 115.31 119.50 3iec h LEU 263 Ca 0.14 -0.38 0.09 0.00 0.09 0.00 0.00 57.88 57.81 3iec h LEU 263 Cb 0.04 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.45 3iec h LEU 263 CO -0.09 1.13 0.54 0.03 0.09 0.00 0.00 178.44 180.15 3iec h ARG 264 N 0.81 0.90 -0.08 1.13 3.08 -0.62 -3.46 114.38 116.13 3iec h ARG 264 Ca 0.12 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 3iec h ARG 264 Cb 0.73 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.57 3iec h ARG 264 CO 0.06 0.59 -0.03 0.41 -1.07 0.00 0.00 179.97 179.93 3iec n GLY 265 N -1.33 0.51 3.61 0.04 0.00 0.38 -5.03 105.19 103.37 3iec n GLY 265 Ca 0.15 -0.95 -0.32 0.00 0.00 0.00 0.00 46.02 44.89 3iec n GLY 265 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3iec s LYS 266 N -2.04 2.57 0.06 1.61 1.02 -1.25 -4.95 119.74 116.76 3iec s LYS 266 Ca 0.00 -0.72 -0.09 0.00 0.02 0.00 0.00 55.97 55.18 3iec s LYS 266 Cb 0.00 -2.52 -0.00 0.00 -0.52 0.00 0.00 37.83 34.78 3iec s LYS 266 CO 0.00 0.60 0.18 1.52 -0.92 0.00 0.00 175.35 176.73 3iec s TYR 267 N -1.04 0.12 -0.04 3.18 -0.85 -1.26 -4.91 117.35 112.55 3iec s TYR 267 Ca 0.18 -0.46 -0.17 0.00 -0.52 0.00 0.00 57.07 56.11 3iec s TYR 267 Cb -0.11 -0.06 -0.05 0.00 0.38 0.00 0.00 41.96 42.11 3iec s TYR 267 CO 0.09 -0.48 0.46 1.03 -1.52 0.00 0.00 175.55 175.13 3iec s ARG 268 N -3.21 4.14 -0.36 -3.49 0.52 -1.26 -5.06 118.95 110.24 3iec s ARG 268 Ca -0.00 0.47 -0.14 0.00 -0.52 0.00 0.00 55.73 55.53 3iec s ARG 268 Cb 0.02 -3.31 -0.01 0.00 0.52 0.00 0.00 34.95 32.17 3iec s ARG 268 CO -0.07 0.46 0.32 0.42 0.02 0.00 0.00 175.30 176.44 3iec s ILE 269 N -0.38 5.22 0.57 1.52 -1.09 -1.26 -5.05 121.20 120.73 3iec s ILE 269 Ca 0.25 -0.18 -0.19 0.00 -2.23 0.00 0.00 60.65 58.30 3iec s ILE 269 Cb -0.16 -3.82 -0.05 0.00 -1.58 0.00 0.00 42.46 36.85 3iec s ILE 269 CO 0.13 -0.12 1.14 -2.16 -1.23 0.00 0.00 174.94 172.69 3iec s PRO 270 N 1.88 3.21 0.49 2.79 0.04 -1.26 -4.92 135.00 137.23 3iec s PRO 270 Ca 0.09 1.62 0.21 0.00 0.04 0.00 0.00 61.00 62.95 3iec s PRO 270 Cb -0.17 -1.98 1.25 0.00 0.04 0.00 0.00 34.50 33.63 3iec s PRO 270 CO 0.11 -0.97 1.97 0.35 0.04 0.00 0.00 177.00 178.51 3iec h PHE 271 N 0.98 0.20 0.00 0.56 3.57 -2.03 -0.72 116.94 119.49 3iec h PHE 271 Ca -0.50 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.01 3iec h PHE 271 Cb 1.27 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.94 3iec h PHE 271 CO 0.51 0.08 0.00 2.48 -2.23 0.00 0.00 178.31 179.15 3iec n TYR 272 N -4.42 0.34 -2.13 0.41 0.18 -1.26 -4.84 117.16 105.44 3iec n TYR 272 Ca 0.11 0.10 -0.42 0.00 1.88 0.00 0.00 57.90 59.58 3iec n TYR 272 Cb 0.56 -0.67 -0.03 0.00 -0.38 0.00 0.00 39.34 38.82 3iec n TYR 272 CO 0.00 0.00 0.00 1.41 -2.08 0.00 0.00 176.86 176.19 3iec s MET 273 N -3.05 4.31 0.73 -3.48 1.75 -0.28 -4.98 119.30 114.30 3iec s MET 273 Ca 0.12 2.13 -0.15 0.00 -1.25 0.00 0.00 55.69 56.53 3iec s MET 273 Cb 0.16 -3.22 0.04 0.00 2.84 0.00 0.00 34.83 34.64 3iec s MET 273 CO 0.52 -0.45 1.23 -1.54 -0.65 0.00 0.00 175.02 174.13 3iec s SER 274 N 1.03 4.11 0.34 1.11 1.04 -1.26 -4.85 113.70 115.23 3iec s SER 274 Ca 0.65 2.43 0.12 0.00 0.48 0.00 0.00 55.95 59.63 3iec s SER 274 Cb -0.38 -2.60 0.62 0.00 0.10 0.00 0.00 66.02 63.76 3iec s SER 274 CO 0.31 -2.32 1.76 0.71 0.98 0.00 0.00 173.24 174.68 3iec h THR 275 N -0.27 1.31 -0.57 2.02 1.35 -1.98 -1.71 112.91 113.07 3iec h THR 275 Ca -0.48 -1.52 -0.07 0.00 -0.55 0.00 0.00 66.41 63.80 3iec h THR 275 Cb 1.31 1.82 -0.02 0.00 -1.73 0.00 0.00 68.15 69.52 3iec h THR 275 CO 0.49 0.43 0.08 0.44 -0.25 0.00 0.00 175.52 176.72 3iec h ASP 276 N 0.00 0.86 -0.17 5.36 3.32 -1.99 -1.10 116.42 122.71 3iec h ASP 276 Ca -0.00 -0.19 -0.06 0.00 0.02 0.00 0.00 57.03 56.80 3iec h ASP 276 Cb 0.79 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.10 3iec h ASP 276 CO 0.06 0.87 -0.11 0.00 -1.72 0.00 0.00 179.24 178.34 3iec h GLU 278 N 0.04 0.78 -0.38 0.00 4.81 -1.26 -1.86 114.58 116.70 3iec h GLU 278 Ca 0.03 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.15 3iec h GLU 278 Cb 0.62 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 3iec h GLU 278 CO 0.03 0.52 -0.03 -0.91 -0.73 0.00 0.00 179.01 177.89 3iec h ASN 279 N 0.80 0.59 -0.19 1.04 2.35 -1.16 -1.92 115.58 117.09 3iec h ASN 279 Ca 0.32 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.91 3iec h ASN 279 Cb 0.16 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 3iec h ASN 279 CO -0.17 0.69 0.02 0.25 -1.65 0.00 0.00 177.43 176.57 3iec h LEU 280 N 0.59 0.31 -1.06 1.61 6.46 -0.89 -3.00 115.31 119.33 3iec h LEU 280 Ca 0.12 -0.28 0.16 0.00 -0.12 0.00 0.00 57.88 57.76 3iec h LEU 280 Cb 0.42 -0.08 -0.09 0.00 -0.73 0.00 0.00 40.66 40.17 3iec h LEU 280 CO 0.02 0.51 0.62 -0.07 -0.62 0.00 0.00 178.44 178.90 3iec h LEU 281 N 0.10 0.81 -2.63 2.25 3.38 -1.11 -0.16 115.31 117.94 3iec h LEU 281 Ca 0.06 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.10 3iec h LEU 281 Cb 0.34 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 3iec h LEU 281 CO 0.01 0.35 0.04 0.11 0.09 0.00 0.00 178.44 179.03 3iec h LYS 282 N 0.82 0.00 0.00 1.13 1.57 -1.21 -0.87 116.57 118.01 3iec h LYS 282 Ca 0.54 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.32 3iec h LYS 282 Cb 0.76 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.07 3iec h LYS 282 CO -0.32 0.00 -0.47 0.87 -0.57 0.00 0.00 179.45 178.96 3iec h LYS 283 N 0.00 0.00 0.01 3.15 1.57 -1.04 -3.38 116.57 116.89 3iec h LYS 283 Ca 0.01 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.43 3iec h LYS 283 Cb 0.08 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.34 3iec h LYS 283 CO -0.00 0.00 -1.99 1.19 -0.57 0.00 0.00 179.45 178.08 3iec n PHE 284 N -2.38 0.54 -2.67 -1.35 3.72 -0.72 -0.80 117.46 113.79 3iec n PHE 284 Ca 0.03 0.20 -0.42 0.00 -0.05 0.00 0.00 57.45 57.21 3iec n PHE 284 Cb 0.47 -1.06 0.01 0.00 -0.94 0.00 0.00 39.48 37.96 3iec n PHE 284 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3iec n LEU 285 N -4.12 6.91 -4.37 4.37 4.77 -0.41 -4.21 117.00 119.94 3iec n LEU 285 Ca -0.43 -5.13 -0.33 0.00 -0.03 0.00 0.00 56.01 50.10 3iec n LEU 285 Cb 0.84 -1.29 -0.14 0.00 -2.33 0.00 0.00 43.42 40.50 3iec n LEU 285 CO 0.16 1.78 -0.45 -0.63 -1.33 0.00 0.00 177.39 176.92 3iec s ILE 286 N -2.47 3.06 0.23 -0.08 1.01 -1.26 -4.89 121.20 116.81 3iec s ILE 286 Ca 0.37 -0.66 -0.07 0.00 0.00 0.00 0.00 60.65 60.29 3iec s ILE 286 Cb 0.11 -2.29 0.22 0.00 0.01 0.00 0.00 42.46 40.51 3iec s ILE 286 CO 0.01 0.52 1.89 -0.07 0.00 0.00 0.00 174.94 177.28 3iec h LEU 287 N 6.74 1.09 -8.90 2.97 3.38 -1.92 -3.40 115.31 115.27 3iec h LEU 287 Ca -0.26 -0.06 -0.57 0.00 0.09 0.00 0.00 57.88 57.08 3iec h LEU 287 Cb 1.21 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.62 3iec h LEU 287 CO 0.56 0.83 0.89 0.21 0.09 0.00 0.00 178.44 181.02 3iec s ASN 288 N -6.13 6.81 0.27 -0.43 3.04 -1.26 -4.81 114.94 112.43 3iec s ASN 288 Ca -0.13 0.96 -0.03 0.00 0.04 0.00 0.00 52.86 53.71 3iec s ASN 288 Cb 0.17 -2.54 0.35 0.00 -1.54 0.00 0.00 41.25 37.69 3iec s ASN 288 CO 0.82 -1.01 1.82 1.55 -3.04 0.00 0.00 177.10 177.24 3iec h PRO 289 N 8.61 0.92 0.00 0.43 0.13 -1.99 -1.47 132.00 138.63 3iec h PRO 289 Ca -0.22 -0.18 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 3iec h PRO 289 Cb 1.07 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.05 3iec h PRO 289 CO 1.05 0.79 0.00 -1.13 -0.23 0.00 0.00 178.00 178.49 3iec n SER 290 N -4.28 0.63 -1.11 1.44 3.41 -1.26 -2.19 113.62 110.25 3iec n SER 290 Ca 0.05 0.70 0.10 0.00 -0.26 0.00 0.00 58.87 59.46 3iec n SER 290 Cb 0.21 -0.82 0.25 0.00 -0.26 0.00 0.00 64.21 63.59 3iec n SER 290 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3iec n LYS 291 N -2.25 2.65 -2.47 4.33 5.02 -0.56 -4.96 118.16 119.92 3iec n LYS 291 Ca 0.01 -2.40 -0.37 0.00 -2.02 0.00 0.00 58.31 53.53 3iec n LYS 291 Cb 0.16 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 33.66 3iec n LYS 291 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 3iec s ARG 292 N -1.08 4.18 0.71 1.97 0.52 -0.93 -4.95 118.95 119.37 3iec s ARG 292 Ca 0.40 1.62 -0.16 0.00 -0.52 0.00 0.00 55.73 57.07 3iec s ARG 292 Cb 0.21 -2.64 0.02 0.00 0.52 0.00 0.00 34.95 33.07 3iec s ARG 292 CO 0.28 -0.16 1.21 0.41 0.02 0.00 0.00 175.30 177.07 3iec n GLY 293 N 0.51 0.21 3.85 -3.53 0.00 0.02 -5.02 105.19 101.22 3iec n GLY 293 Ca 0.04 -0.29 -0.32 0.00 0.00 0.00 0.00 46.02 45.45 3iec n GLY 293 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iec s THR 294 N -1.70 4.62 0.47 2.61 2.01 -1.26 -4.92 115.64 117.47 3iec s THR 294 Ca 0.78 1.02 0.15 0.00 0.31 0.00 0.00 61.69 63.96 3iec s THR 294 Cb -0.35 -3.68 0.21 0.00 0.01 0.00 0.00 72.50 68.70 3iec s THR 294 CO 0.45 -0.48 2.05 -0.07 -0.69 0.00 0.00 174.62 175.88 3iec h LEU 295 N 1.44 0.00 -0.00 4.42 3.38 -1.98 0.32 115.31 122.88 3iec h LEU 295 Ca -0.47 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.50 3iec h LEU 295 Cb 1.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.93 3iec h LEU 295 CO 0.63 0.12 0.00 -0.33 0.09 0.00 0.00 178.44 178.95 3iec h GLU 296 N 0.00 0.01 -0.01 1.13 4.39 -1.99 0.87 114.58 118.98 3iec h GLU 296 Ca -0.00 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.71 3iec h GLU 296 Cb 0.21 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 3iec h GLU 296 CO 0.02 0.11 -0.04 1.96 -1.16 0.00 0.00 179.01 179.90 3iec h GLN 297 N -0.10 -0.06 -0.47 2.33 4.20 -1.81 -3.09 115.11 116.11 3iec h GLN 297 Ca 0.00 0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.81 3iec h GLN 297 Cb 0.11 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 3iec h GLN 297 CO -0.00 -0.04 0.32 0.82 -0.67 0.00 0.00 178.83 179.26 3iec h ILE 298 N -0.06 0.87 0.00 2.54 2.04 -0.73 0.00 117.51 122.17 3iec h ILE 298 Ca 0.02 -0.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 3iec h ILE 298 Cb 0.09 0.64 -0.00 0.00 -0.74 0.00 0.00 36.82 36.80 3iec h ILE 298 CO -0.05 0.04 -0.02 0.24 0.00 0.00 0.00 178.15 178.36 3iec h MET 299 N 0.21 0.00 -0.05 2.37 2.86 -0.74 -1.88 114.93 117.71 3iec h MET 299 Ca 0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 3iec h MET 299 Cb 0.58 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.24 3iec h MET 299 CO -0.04 0.02 0.00 1.63 1.06 0.00 0.00 176.91 179.58 3iec n LYS 300 N -3.55 1.90 -1.99 1.72 5.02 -0.02 -4.22 118.16 117.02 3iec n LYS 300 Ca -0.03 -1.31 -0.39 0.00 -2.02 0.00 0.00 58.31 54.56 3iec n LYS 300 Cb 0.11 -1.47 0.01 0.00 -0.02 0.00 0.00 35.03 33.66 3iec n LYS 300 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3iec s ASP 301 N -1.95 5.97 0.17 4.39 -1.08 -0.71 -4.94 116.67 118.52 3iec s ASP 301 Ca 0.35 2.65 -0.19 0.00 -0.52 0.00 0.00 52.55 54.84 3iec s ASP 301 Cb 0.20 -2.63 0.08 0.00 -1.46 0.00 0.00 42.92 39.12 3iec s ASP 301 CO 0.32 -1.09 1.64 0.03 0.52 0.00 0.00 175.17 176.60 3iec h ARG 302 N 2.21 -0.11 -0.76 4.34 3.08 -1.93 -2.53 114.38 118.68 3iec h ARG 302 Ca -0.50 0.01 0.09 0.00 0.07 0.00 0.00 59.98 59.65 3iec h ARG 302 Cb 1.26 0.02 -0.07 0.00 0.08 0.00 0.00 29.97 31.27 3iec h ARG 302 CO 0.61 -0.07 0.41 2.35 -1.07 0.00 0.00 179.97 182.19 3iec h TRP 303 N -0.11 0.74 0.00 3.04 7.01 -1.92 -0.87 115.95 123.83 3iec h TRP 303 Ca 0.18 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.20 3iec h TRP 303 Cb 0.40 -0.22 -0.00 0.00 -2.10 0.00 0.00 29.16 27.24 3iec h TRP 303 CO -0.40 0.29 -0.05 0.52 -2.79 0.00 0.00 178.44 176.01 3iec h MET 304 N 0.69 0.00 -0.11 2.65 2.86 -1.78 -3.08 114.93 116.16 3iec h MET 304 Ca 0.37 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.01 3iec h MET 304 Cb 0.35 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.01 3iec h MET 304 CO -0.25 0.05 0.00 0.09 1.06 0.00 0.00 176.91 177.86 3iec n ASN 305 N -4.31 2.09 -4.68 1.22 3.02 -0.39 -4.88 115.26 107.32 3iec n ASN 305 Ca -0.03 -1.60 -0.46 0.00 -0.03 0.00 0.00 54.58 52.47 3iec n ASN 305 Cb 0.13 -0.07 -0.04 0.00 -0.61 0.00 0.00 39.78 39.19 3iec n ASN 305 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3iec n VAL 306 N 0.42 0.18 -0.99 2.41 0.31 -0.83 0.14 118.33 119.96 3iec n VAL 306 Ca 0.07 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 3iec n VAL 306 Cb 0.28 -1.74 0.00 0.00 -0.91 0.00 0.00 33.84 31.47 3iec n VAL 306 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3iec n GLY 307 N 3.80 0.45 2.49 2.92 0.00 -1.26 -4.92 105.19 108.67 3iec n GLY 307 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 3iec n GLY 307 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3iec n HIS 308 N -2.79 1.95 -0.35 1.61 -0.00 0.12 -4.93 115.22 110.83 3iec n HIS 308 Ca 0.00 -2.26 0.13 0.00 -0.00 0.00 0.00 57.72 55.58 3iec n HIS 308 Cb 0.07 -0.28 0.32 0.00 -0.00 0.00 0.00 29.99 30.10 3iec n HIS 308 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.34 177.39 3iec h GLU 309 N 2.46 0.74 -0.94 -0.41 9.09 -1.92 0.02 114.58 123.62 3iec h GLU 309 Ca 0.09 -0.04 -0.61 0.00 0.05 0.00 0.00 59.36 58.84 3iec h GLU 309 Cb 1.35 -0.17 -0.37 0.00 -1.65 0.00 0.00 28.75 27.92 3iec h GLU 309 CO 0.46 0.49 -0.09 -0.25 0.05 0.00 0.00 179.01 179.67 3iec n ASP 310 N -4.77 6.08 -2.69 3.06 8.00 -1.26 -4.62 116.55 120.35 3iec n ASP 310 Ca 0.23 -3.77 -0.06 0.00 0.71 0.00 0.00 54.79 51.90 3iec n ASP 310 Cb 0.57 -0.62 0.09 0.00 -0.02 0.00 0.00 41.12 41.14 3iec n ASP 310 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3iec n ASP 311 N -0.77 -1.77 -4.74 -2.24 2.03 -0.02 -5.13 116.55 103.90 3iec n ASP 311 Ca 0.51 -2.37 -0.41 0.00 0.52 0.00 0.00 54.79 53.04 3iec n ASP 311 Cb 0.80 1.07 0.00 0.00 -0.72 0.00 0.00 41.12 42.28 3iec n ASP 311 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 3iec n GLU 312 N -0.51 2.40 -1.99 -0.67 2.13 -1.17 -4.83 120.64 116.00 3iec n GLU 312 Ca -0.07 0.84 -0.42 0.00 0.66 0.00 0.00 57.16 58.17 3iec n GLU 312 Cb 0.80 -2.54 -0.03 0.00 0.27 0.00 0.00 31.44 29.95 3iec n GLU 312 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 3iec s LEU 313 N -1.78 4.38 0.16 4.31 2.96 -1.26 -5.01 118.68 122.43 3iec s LEU 313 Ca 0.55 2.60 -0.03 0.00 -0.22 0.00 0.00 54.13 57.04 3iec s LEU 313 Cb -0.50 -3.60 -0.03 0.00 0.50 0.00 0.00 46.19 42.55 3iec s LEU 313 CO 0.62 -0.76 0.13 -1.59 -1.32 0.00 0.00 176.35 173.43 3iec s LYS 314 N 0.60 1.08 0.32 1.98 -2.85 -1.26 -4.58 119.74 115.02 3iec s LYS 314 Ca 0.66 -1.46 -0.29 0.00 -1.00 0.00 0.00 55.97 53.88 3iec s LYS 314 Cb -0.42 0.28 -0.12 0.00 -2.06 0.00 0.00 37.83 35.50 3iec s LYS 314 CO 0.35 -0.34 1.36 -2.30 0.10 0.00 0.00 175.35 174.52 3iec n PRO 315 N -0.18 2.20 -2.16 1.78 -0.02 -1.26 -4.94 135.00 130.42 3iec n PRO 315 Ca -0.03 0.77 -0.40 0.00 -2.02 0.00 0.00 63.50 61.83 3iec n PRO 315 Cb 0.64 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.70 3iec n PRO 315 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3iec s TYR 316 N -0.76 3.01 -0.23 6.00 5.04 -1.26 -5.02 117.35 124.12 3iec s TYR 316 Ca 0.59 1.47 -0.06 0.00 -2.44 0.00 0.00 57.07 56.63 3iec s TYR 316 Cb -0.57 -3.57 -0.02 0.00 0.35 0.00 0.00 41.96 38.14 3iec s TYR 316 CO 0.58 -1.71 0.03 0.08 -1.34 0.00 0.00 175.55 173.19 3iec s VAL 317 N -1.26 4.02 0.13 3.14 1.01 -1.26 -4.98 120.40 121.21 3iec s VAL 317 Ca 0.54 -0.27 -0.31 0.00 0.00 0.00 0.00 61.98 61.93 3iec s VAL 317 Cb -0.36 -2.86 -0.08 0.00 0.00 0.00 0.00 36.38 33.08 3iec s VAL 317 CO 0.47 0.38 1.37 -0.70 0.00 0.00 0.00 175.10 176.61 3iec s GLU 318 N 1.46 4.34 0.61 2.72 2.12 -1.26 -4.97 118.70 123.72 3iec s GLU 318 Ca 0.05 2.07 -0.19 0.00 0.36 0.00 0.00 54.97 57.26 3iec s GLU 318 Cb -0.15 -3.23 -0.03 0.00 0.26 0.00 0.00 34.13 30.98 3iec s GLU 318 CO 0.02 -0.39 1.24 -2.30 -0.54 0.00 0.00 175.26 173.28 3iec n PRO 319 N 3.63 1.21 -2.45 4.30 -0.02 -1.26 -4.97 135.00 135.44 3iec n PRO 319 Ca 0.10 0.46 -0.37 0.00 -2.02 0.00 0.00 63.50 61.67 3iec n PRO 319 Cb 0.42 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.41 3iec n PRO 319 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3iec s LEU 320 N -3.60 4.18 0.36 2.45 1.43 -1.26 -4.96 118.68 117.28 3iec s LEU 320 Ca 0.78 2.16 -0.28 0.00 -1.03 0.00 0.00 54.13 55.76 3iec s LEU 320 Cb -0.40 -4.10 -0.10 0.00 0.03 0.00 0.00 46.19 41.62 3iec s LEU 320 CO 0.44 -0.54 1.38 -2.16 0.23 0.00 0.00 176.35 175.70 3iec s PRO 321 N -2.37 4.21 -0.39 1.29 0.04 -1.26 -4.99 135.00 131.53 3iec s PRO 321 Ca 0.57 2.37 0.02 0.00 0.04 0.00 0.00 61.00 64.00 3iec s PRO 321 Cb -0.26 -2.99 0.11 0.00 0.04 0.00 0.00 34.50 31.40 3iec s PRO 321 CO 0.32 -0.37 0.14 0.34 0.04 0.00 0.00 177.00 177.47 3iec s ASP 322 N -0.36 4.23 0.00 6.66 2.15 -1.26 -4.97 116.67 123.12 3iec s ASP 322 Ca 0.51 -2.28 0.25 0.00 0.43 0.00 0.00 52.55 51.47 3iec s ASP 322 Cb -0.43 -1.29 0.49 0.00 -0.30 0.00 0.00 42.92 41.40 3iec s ASP 322 CO 0.57 -0.34 1.40 -1.22 -0.17 0.00 0.00 175.17 175.42 3iec n TYR 323 N 4.05 0.00 -2.53 -5.34 4.01 -1.26 -4.43 117.16 111.66 3iec n TYR 323 Ca 0.04 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.59 3iec n TYR 323 Cb 0.38 -0.05 0.02 0.00 -0.31 0.00 0.00 39.34 39.38 3iec n TYR 323 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 3iec n LYS 324 N -0.16 2.48 -2.22 -0.72 5.02 -1.26 -4.85 118.16 116.44 3iec n LYS 324 Ca 0.12 -3.94 -0.43 0.00 -2.02 0.00 0.00 58.31 52.05 3iec n LYS 324 Cb 0.41 -1.83 -0.02 0.00 -0.02 0.00 0.00 35.03 33.57 3iec n LYS 324 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3iec s ASP 325 N -3.41 6.61 0.33 4.39 2.15 -1.26 -4.91 116.67 120.57 3iec s ASP 325 Ca 0.39 1.67 0.03 0.00 0.43 0.00 0.00 52.55 55.07 3iec s ASP 325 Cb 0.42 -2.53 0.57 0.00 -0.30 0.00 0.00 42.92 41.07 3iec s ASP 325 CO -0.07 -1.06 1.90 -0.65 -0.17 0.00 0.00 175.17 175.12 3iec h PRO 326 N 9.69 0.66 0.43 4.34 0.11 -1.99 -1.85 132.00 143.38 3iec h PRO 326 Ca -0.32 -0.11 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 3iec h PRO 326 Cb 1.14 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.14 3iec h PRO 326 CO 0.99 0.59 -0.20 -0.09 -0.21 0.00 0.00 178.00 179.08 3iec h ARG 327 N 0.65 -0.55 -0.35 1.05 2.43 -2.00 -1.44 114.38 114.16 3iec h ARG 327 Ca 0.15 0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.32 3iec h ARG 327 Cb 0.22 0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 3iec h ARG 327 CO -0.01 -0.28 0.06 0.00 -1.51 0.00 0.00 179.97 178.23 3iec h ARG 328 N -0.75 0.53 -0.46 0.20 3.08 -1.94 -2.08 114.38 112.96 3iec h ARG 328 Ca -0.06 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 59.84 3iec h ARG 328 Cb 0.53 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 3iec h ARG 328 CO 0.10 0.51 0.05 1.15 -1.07 0.00 0.00 179.97 180.71 3iec h THR 329 N 0.51 1.25 -0.07 2.04 2.02 -1.23 -0.92 112.91 116.51 3iec h THR 329 Ca 0.12 -0.94 -0.00 0.00 0.77 0.00 0.00 66.41 66.35 3iec h THR 329 Cb 0.25 0.98 -0.00 0.00 -1.74 0.00 0.00 68.15 67.63 3iec h THR 329 CO 0.00 0.33 0.04 -0.33 0.37 0.00 0.00 175.52 175.93 3iec h GLU 330 N 0.63 0.09 -0.55 6.66 4.39 -0.93 -0.09 114.58 124.78 3iec h GLU 330 Ca 0.14 -0.01 0.09 0.00 0.34 0.00 0.00 59.36 59.92 3iec h GLU 330 Cb 0.42 -0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 28.98 3iec h GLU 330 CO 0.01 0.09 0.16 -0.07 -1.16 0.00 0.00 179.01 178.04 3iec h LEU 331 N 0.07 0.10 -0.62 1.33 3.38 -1.24 -0.78 115.31 117.55 3iec h LEU 331 Ca 0.02 0.08 -0.14 0.00 0.09 0.00 0.00 57.88 57.94 3iec h LEU 331 Cb 0.02 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3iec h LEU 331 CO -0.00 0.08 -0.45 0.24 0.09 0.00 0.00 178.44 178.39 3iec h MET 332 N 0.31 0.57 -0.52 1.13 2.86 -0.91 -1.24 114.93 117.13 3iec h MET 332 Ca 0.27 -0.31 -0.08 0.00 -2.06 0.00 0.00 59.70 57.53 3iec h MET 332 Cb 0.35 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.01 3iec h MET 332 CO -0.32 0.90 0.02 0.28 1.06 0.00 0.00 176.91 178.85 3iec h VAL 333 N 0.46 1.25 -0.15 -2.22 2.07 -0.66 -1.06 116.25 115.93 3iec h VAL 333 Ca 0.03 -1.02 -0.05 0.00 0.82 0.00 0.00 66.70 66.48 3iec h VAL 333 Cb 0.96 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 3iec h VAL 333 CO 0.09 0.37 -0.14 0.28 0.02 0.00 0.00 177.57 178.18 3iec h SER 334 N 0.81 0.23 0.73 0.57 0.02 -0.63 -0.32 113.55 114.97 3iec h SER 334 Ca 0.16 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3iec h SER 334 Cb 0.46 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.94 3iec h SER 334 CO 0.02 0.40 0.00 0.23 -1.14 0.00 0.00 176.83 176.34 3iec n MET 335 N -4.26 0.03 0.00 3.45 2.81 -0.52 -4.92 117.12 113.71 3iec n MET 335 Ca -0.01 0.11 0.00 0.00 -1.81 0.00 0.00 57.70 56.00 3iec n MET 335 Cb 0.28 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.29 3iec n MET 335 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3iec n GLY 336 N 0.79 1.05 3.88 3.03 0.00 -0.13 -5.08 105.19 108.73 3iec n GLY 336 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 3iec n GLY 336 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3iec s TYR 337 N -2.00 3.49 0.12 1.61 2.02 -0.48 -4.98 117.35 117.14 3iec s TYR 337 Ca 0.00 1.11 0.04 0.00 -0.37 0.00 0.00 57.07 57.85 3iec s TYR 337 Cb 0.00 -2.80 -0.04 0.00 -0.40 0.00 0.00 41.96 38.72 3iec s TYR 337 CO 0.00 -0.82 0.11 0.95 -1.57 0.00 0.00 175.55 174.21 3iec s THR 338 N -3.18 4.49 0.42 -0.71 -4.23 -1.26 -4.04 115.64 107.13 3iec s THR 338 Ca 0.55 -0.94 0.13 0.00 -1.18 0.00 0.00 61.69 60.26 3iec s THR 338 Cb -0.11 -3.23 0.33 0.00 1.34 0.00 0.00 72.50 70.84 3iec s THR 338 CO 0.52 0.00 1.96 0.03 -0.54 0.00 0.00 174.62 176.59 3iec h ARG 339 N 2.84 0.44 -0.41 3.99 3.08 -1.97 -2.30 114.38 120.05 3iec h ARG 339 Ca -0.47 -0.03 -0.14 0.00 0.07 0.00 0.00 59.98 59.41 3iec h ARG 339 Cb 1.18 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 3iec h ARG 339 CO 0.64 0.29 -0.29 1.49 -1.07 0.00 0.00 179.97 181.04 3iec h GLU 340 N 0.46 0.89 0.00 0.04 4.81 -1.99 -0.47 114.58 118.32 3iec h GLU 340 Ca 0.31 -0.41 -0.18 0.00 -0.13 0.00 0.00 59.36 58.96 3iec h GLU 340 Cb 0.61 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.95 3iec h GLU 340 CO -0.10 1.06 -0.84 1.05 -0.73 0.00 0.00 179.01 179.45 3iec h GLU 341 N 0.76 0.01 -0.62 1.92 4.11 -1.92 -0.92 114.58 117.93 3iec h GLU 341 Ca 0.09 -0.01 -0.06 0.00 0.07 0.00 0.00 59.36 59.44 3iec h GLU 341 Cb 0.85 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.08 3iec h GLU 341 CO 0.07 0.85 0.16 0.82 0.07 0.00 0.00 179.01 180.98 3iec h ILE 342 N 0.01 1.25 -0.13 -1.06 2.04 -1.22 -1.31 117.51 117.09 3iec h ILE 342 Ca -0.01 -0.90 -0.01 0.00 1.00 0.00 0.00 64.86 64.94 3iec h ILE 342 Cb 1.49 0.66 -0.00 0.00 -0.74 0.00 0.00 36.82 38.23 3iec h ILE 342 CO 0.11 0.34 0.02 -0.61 0.00 0.00 0.00 178.15 178.01 3iec h GLN 343 N 0.90 0.21 -0.73 2.37 4.15 -0.65 -1.55 115.11 119.80 3iec h GLN 343 Ca 0.19 -0.06 0.06 0.00 0.77 0.00 0.00 58.65 59.62 3iec h GLN 343 Cb 0.34 -0.02 -0.06 0.00 0.21 0.00 0.00 27.48 27.95 3iec h GLN 343 CO 0.00 0.40 0.43 0.22 -1.93 0.00 0.00 178.83 177.94 3iec h ASP 344 N -0.01 0.65 -0.37 -0.69 1.82 -1.12 -0.37 116.42 116.33 3iec h ASP 344 Ca 0.04 0.03 -0.15 0.00 -0.39 0.00 0.00 57.03 56.56 3iec h ASP 344 Cb 0.29 -0.10 -0.01 0.00 0.68 0.00 0.00 39.33 40.19 3iec h ASP 344 CO 0.00 0.41 -0.34 0.28 -1.61 0.00 0.00 179.24 177.98 3iec h SER 345 N 0.78 0.94 0.15 2.28 0.02 -1.07 -1.72 113.55 114.93 3iec h SER 345 Ca 0.33 -0.46 -0.26 0.00 -0.84 0.00 0.00 61.79 60.55 3iec h SER 345 Cb 0.19 -0.27 0.01 0.00 0.14 0.00 0.00 62.40 62.47 3iec h SER 345 CO -0.18 1.21 -1.26 -0.07 -1.14 0.00 0.00 176.83 175.39 3iec h LEU 346 N 0.69 0.49 -0.79 5.07 3.38 -1.11 -1.02 115.31 122.03 3iec h LEU 346 Ca 0.06 -0.90 -0.05 0.00 0.09 0.00 0.00 57.88 57.08 3iec h LEU 346 Cb 0.93 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 3iec h LEU 346 CO 0.09 1.57 0.29 0.58 0.09 0.00 0.00 178.44 181.06 3iec h VAL 347 N -0.23 1.26 0.00 1.22 2.07 -1.16 -0.77 116.25 118.64 3iec h VAL 347 Ca -0.25 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.41 3iec h VAL 347 Cb 1.81 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 3iec h VAL 347 CO 0.13 0.35 0.00 0.61 0.02 0.00 0.00 177.57 178.68 3iec n GLY 348 N -0.84 -1.11 3.96 2.17 0.00 -0.65 -4.92 105.19 103.81 3iec n GLY 348 Ca 0.07 -0.17 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 3iec n GLY 348 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3iec n GLN 349 N -1.14 -3.44 0.14 1.61 1.13 -0.30 -4.86 117.38 110.52 3iec n GLN 349 Ca 0.19 0.42 0.13 0.00 -1.94 0.00 0.00 57.00 55.79 3iec n GLN 349 Cb 0.17 -4.64 0.29 0.00 0.11 0.00 0.00 30.24 26.17 3iec n GLN 349 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3iec h ARG 350 N -1.82 0.00 -5.93 -1.09 3.08 -1.48 -3.48 114.38 103.66 3iec h ARG 350 Ca -0.63 0.00 -0.45 0.00 0.07 0.00 0.00 59.98 58.98 3iec h ARG 350 Cb 1.37 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.38 3iec h ARG 350 CO 0.63 0.00 -0.70 0.66 -1.07 0.00 0.00 179.97 179.50 3iec n TYR 351 N -2.53 -2.13 -2.17 3.04 4.01 -1.26 -4.85 117.16 111.27 3iec n TYR 351 Ca 0.05 0.76 0.00 0.00 -0.16 0.00 0.00 57.90 58.55 3iec n TYR 351 Cb 0.47 -3.74 0.00 0.00 -0.31 0.00 0.00 39.34 35.76 3iec n TYR 351 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 3iec n ASN 352 N -2.66 0.00 -0.10 7.72 6.94 -1.26 -1.57 115.26 124.32 3iec n ASN 352 Ca 0.02 -0.68 -0.05 0.00 -0.02 0.00 0.00 54.58 53.84 3iec n ASN 352 Cb 0.54 0.00 0.14 0.00 -2.36 0.00 0.00 39.78 38.10 3iec n ASN 352 CO 0.00 0.00 0.00 1.05 -1.03 0.00 0.00 177.26 177.28 3iec h GLU 353 N 0.00 0.78 0.41 -3.83 -0.00 -1.94 -1.94 114.58 108.06 3iec h GLU 353 Ca 0.00 -0.24 -0.02 0.00 -0.00 0.00 0.00 59.36 59.10 3iec h GLU 353 Cb 0.00 -0.08 0.00 0.00 -0.00 0.00 0.00 28.75 28.68 3iec h GLU 353 CO 0.00 0.83 -0.20 0.28 -0.00 0.00 0.00 179.01 179.92 3iec h VAL 354 N 0.72 0.59 -0.97 -1.06 2.07 -1.95 -1.97 116.25 113.69 3iec h VAL 354 Ca 0.13 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.38 3iec h VAL 354 Cb 0.53 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 3iec h VAL 354 CO 0.03 0.05 0.64 -0.03 0.02 0.00 0.00 177.57 178.28 3iec h MET 355 N -0.71 1.27 -0.35 1.57 1.85 -1.87 -2.02 114.93 114.67 3iec h MET 355 Ca -0.06 -0.08 -0.00 0.00 -0.61 0.00 0.00 59.70 58.96 3iec h MET 355 Cb 0.50 -0.29 -0.02 0.00 0.43 0.00 0.00 31.60 32.23 3iec h MET 355 CO 0.09 0.84 0.21 0.00 -0.40 0.00 0.00 176.91 177.65 3iec h ALA 356 N 1.36 0.44 -0.50 0.39 0.00 -1.20 0.18 119.26 119.93 3iec h ALA 356 Ca 0.36 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.22 3iec h ALA 356 Cb -0.15 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 3iec h ALA 356 CO -0.08 -0.06 0.33 1.15 0.00 0.00 0.00 179.25 180.59 3iec h THR 357 N 0.45 1.12 -0.35 0.00 2.02 -0.98 0.23 112.91 115.40 3iec h THR 357 Ca 0.12 -0.23 0.04 0.00 0.77 0.00 0.00 66.41 67.12 3iec h THR 357 Cb 0.01 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 66.77 3iec h THR 357 CO -0.02 0.12 0.12 0.22 0.37 0.00 0.00 175.52 176.33 3iec h TYR 358 N 0.67 0.21 -0.54 3.16 3.20 -0.81 -1.07 116.97 121.79 3iec h TYR 358 Ca 0.18 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.00 3iec h TYR 358 Cb -0.07 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.14 3iec h TYR 358 CO -0.04 0.08 0.07 -0.07 -1.64 0.00 0.00 178.16 176.56 3iec h LEU 359 N 0.26 0.88 -1.27 2.82 3.38 -0.07 -3.06 115.31 118.25 3iec h LEU 359 Ca 0.16 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 3iec h LEU 359 Cb 0.14 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3iec h LEU 359 CO -0.17 0.93 -0.34 -0.07 0.09 0.00 0.00 178.44 178.89 3iec h LEU 360 N 0.80 0.00 -0.28 1.67 3.38 -0.20 -1.02 115.31 119.66 3iec h LEU 360 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3iec h LEU 360 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3iec h LEU 360 CO 0.01 0.34 0.00 0.18 0.09 0.00 0.00 178.44 179.06 3iec n LEU 361 N -3.85 0.54 -1.56 1.67 4.77 -0.44 -3.32 117.00 114.82 3iec n LEU 361 Ca -0.01 0.59 -0.08 0.00 -0.03 0.00 0.00 56.01 56.48 3iec n LEU 361 Cb 0.41 -0.47 0.15 0.00 -2.33 0.00 0.00 43.42 41.18 3iec n LEU 361 CO 0.37 -0.32 0.83 0.61 -1.33 0.00 0.00 177.39 177.55 3iec n GLY 362 N 0.63 3.05 0.04 -0.72 0.00 -0.39 -5.00 105.19 102.80 3iec n GLY 362 Ca 0.04 -0.59 0.16 0.00 0.00 0.00 0.00 46.02 45.63 3iec n GLY 362 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60