#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 -0.02 0.00 3.57 -1.16 0.25 -4.92 121.20 118.92 3iec s ILE 50 Ca 0.00 0.08 0.00 0.00 -0.51 0.00 0.00 60.65 60.22 3iec s ILE 50 Cb 0.00 -0.61 0.00 0.00 0.61 0.00 0.00 42.46 42.46 3iec s ILE 50 CO 0.00 0.03 0.00 0.61 -2.81 0.00 0.00 174.94 172.77 3iec n GLY 51 N 4.13 2.61 1.43 1.50 0.00 -1.26 0.20 105.19 113.81 3iec n GLY 51 Ca -0.22 0.20 -0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 2.86 3.77 -4.21 1.61 3.02 -1.26 -4.91 115.26 116.13 3iec n ASN 52 Ca 0.00 -2.65 -0.31 0.00 -0.03 0.00 0.00 54.58 51.59 3iec n ASN 52 Cb 0.00 -0.63 -0.17 0.00 -0.61 0.00 0.00 39.78 38.37 3iec n ASN 52 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3iec s TYR 53 N -2.04 2.39 -0.38 3.10 1.51 0.13 -0.88 117.35 121.18 3iec s TYR 53 Ca 0.33 -0.89 -0.21 0.00 -1.01 0.00 0.00 57.07 55.29 3iec s TYR 53 Cb 0.26 -1.60 0.01 0.00 -0.11 0.00 0.00 41.96 40.52 3iec s TYR 53 CO 0.09 -0.34 0.65 0.50 -1.11 0.00 0.00 175.55 175.34 3iec s ARG 54 N 0.21 3.58 0.22 -0.62 3.52 -0.27 -0.58 118.95 125.01 3iec s ARG 54 Ca -0.14 -0.03 -0.30 0.00 -0.13 0.00 0.00 55.73 55.13 3iec s ARG 54 Cb -0.16 -3.85 -0.09 0.00 -1.56 0.00 0.00 34.95 29.29 3iec s ARG 54 CO 0.07 -0.83 1.02 -0.51 -0.81 0.00 0.00 175.30 174.24 3iec s LEU 55 N 2.79 4.57 0.00 -0.88 1.43 -1.26 -1.00 118.68 124.33 3iec s LEU 55 Ca 0.25 2.05 0.00 0.00 -1.03 0.00 0.00 54.13 55.40 3iec s LEU 55 Cb -0.14 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.47 3iec s LEU 55 CO 0.16 -0.02 0.00 0.18 0.23 0.00 0.00 176.35 176.90 3iec n LEU 56 N 1.73 0.00 -4.75 1.79 4.77 0.41 -4.65 117.00 116.29 3iec n LEU 56 Ca -0.00 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.61 3iec n LEU 56 Cb 0.46 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.59 3iec n LEU 56 CO 0.52 0.00 0.86 -1.59 -1.33 0.00 0.00 177.39 175.85 3iec s LYS 57 N 3.42 3.03 0.22 3.23 -2.85 -1.26 -4.52 119.74 121.02 3iec s LYS 57 Ca 0.00 1.89 -0.30 0.00 -1.00 0.00 0.00 55.97 56.57 3iec s LYS 57 Cb 0.00 -2.01 -0.09 0.00 -2.06 0.00 0.00 37.83 33.67 3iec s LYS 57 CO 0.00 -1.17 1.27 0.99 0.10 0.00 0.00 175.35 176.53 3iec s THR 58 N -1.53 3.23 0.00 3.79 2.01 -1.26 -0.57 115.64 121.31 3iec s THR 58 Ca 0.76 1.07 0.00 0.00 0.31 0.00 0.00 61.69 63.83 3iec s THR 58 Cb -0.32 -3.68 0.00 0.00 0.01 0.00 0.00 72.50 68.51 3iec s THR 58 CO 0.36 0.19 0.52 2.30 -0.69 0.00 0.00 174.62 177.29 3iec n ILE 59 N 2.19 0.27 -3.66 1.82 -5.35 0.13 -4.87 119.36 109.90 3iec n ILE 59 Ca 0.04 -0.37 0.01 0.00 -0.27 0.00 0.00 62.75 62.16 3iec n ILE 59 Cb 0.43 1.09 -0.01 0.00 -1.74 0.00 0.00 39.64 39.42 3iec n ILE 59 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3iec s GLY 60 N -0.27 -0.37 0.29 3.28 0.00 -1.01 -4.94 107.32 104.30 3iec s GLY 60 Ca 0.00 0.55 0.04 0.00 0.00 0.00 0.00 44.72 45.31 3iec s GLY 60 CO 0.00 0.30 0.21 0.54 0.00 0.00 0.00 173.10 174.15 3iec s LYS 61 N -2.57 1.58 0.00 2.90 -0.14 -1.26 -1.36 119.74 118.89 3iec s LYS 61 Ca 0.14 -1.90 0.00 0.00 -1.36 0.00 0.00 55.97 52.86 3iec s LYS 61 Cb 0.03 0.20 0.00 0.00 -1.68 0.00 0.00 37.83 36.38 3iec s LYS 61 CO -0.02 -0.54 0.00 0.41 -0.76 0.00 0.00 175.35 174.44 3iec n GLY 62 N -0.53 -1.95 1.75 -3.33 0.00 -1.26 -4.71 105.19 95.16 3iec n GLY 62 Ca 0.04 0.65 -0.01 0.00 0.00 0.00 0.00 46.02 46.71 3iec n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iec n ALA 65 N 0.00 -3.14 -1.77 4.61 0.00 -1.26 -5.12 120.51 113.83 3iec n ALA 65 Ca 0.00 0.38 -0.37 0.00 0.00 0.00 0.00 53.44 53.44 3iec n ALA 65 Cb 0.00 -0.74 -0.02 0.00 0.00 0.00 0.00 19.45 18.69 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 -0.71 4.00 -0.16 0.00 1.02 -1.02 -4.82 119.74 118.05 3iec s LYS 66 Ca -0.04 1.69 -0.01 0.00 0.02 0.00 0.00 55.97 57.63 3iec s LYS 66 Cb 0.00 -2.54 -0.01 0.00 -0.52 0.00 0.00 37.83 34.77 3iec s LYS 66 CO 0.17 -0.32 -0.13 0.08 -0.92 0.00 0.00 175.35 174.23 3iec s VAL 67 N -1.55 2.88 -0.06 3.17 1.01 -0.46 0.08 120.40 125.46 3iec s VAL 67 Ca 0.59 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.92 3iec s VAL 67 Cb -0.27 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.86 3iec s VAL 67 CO 0.33 0.50 -0.18 -0.54 0.00 0.00 0.00 175.10 175.21 3iec s LYS 68 N 0.83 2.65 0.35 2.72 1.02 -0.45 -0.69 119.74 126.17 3iec s LYS 68 Ca -0.04 -0.78 -0.27 0.00 0.02 0.00 0.00 55.97 54.90 3iec s LYS 68 Cb -0.15 -2.33 -0.09 0.00 -0.52 0.00 0.00 37.83 34.73 3iec s LYS 68 CO 0.00 0.47 1.20 -1.17 -0.92 0.00 0.00 175.35 174.93 3iec s LEU 69 N -0.35 4.35 0.17 3.17 2.96 0.26 -0.79 118.68 128.46 3iec s LEU 69 Ca 0.03 2.46 -0.06 0.00 -0.22 0.00 0.00 54.13 56.33 3iec s LEU 69 Cb -0.12 -3.80 -0.02 0.00 0.50 0.00 0.00 46.19 42.74 3iec s LEU 69 CO 0.02 -0.51 0.22 0.00 -1.32 0.00 0.00 176.35 174.76 3iec s ALA 70 N -1.26 0.39 -0.12 5.97 0.00 0.43 -0.44 121.76 126.73 3iec s ALA 70 Ca 0.51 -1.17 0.03 0.00 0.00 0.00 0.00 51.96 51.33 3iec s ALA 70 Cb -0.34 0.97 0.01 0.00 0.00 0.00 0.00 23.12 23.75 3iec s ALA 70 CO 0.44 -0.62 -0.20 0.50 0.00 0.00 0.00 175.76 175.88 3iec s ARG 71 N -4.02 2.75 -0.12 0.00 6.06 -0.17 -0.87 118.95 122.57 3iec s ARG 71 Ca 0.23 -0.76 -0.29 0.00 -2.50 0.00 0.00 55.73 52.40 3iec s ARG 71 Cb 0.05 -2.20 -0.03 0.00 0.06 0.00 0.00 34.95 32.82 3iec s ARG 71 CO 0.03 0.03 1.43 -1.58 -2.50 0.00 0.00 175.30 172.71 3iec s HIS 72 N 0.72 2.48 0.36 5.12 5.65 0.10 -1.11 115.29 128.62 3iec s HIS 72 Ca -0.10 0.67 0.06 0.00 0.25 0.00 0.00 55.06 55.93 3iec s HIS 72 Cb -0.16 -3.68 0.70 0.00 -1.18 0.00 0.00 32.58 28.25 3iec s HIS 72 CO 0.01 -2.59 1.93 0.82 -0.65 0.00 0.00 174.74 174.26 3iec h ILE 73 N 5.55 1.17 0.00 0.89 2.04 -1.34 0.40 117.51 126.21 3iec h ILE 73 Ca -0.32 -0.61 -0.21 0.00 1.00 0.00 0.00 64.86 64.73 3iec h ILE 73 Cb 1.13 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 38.03 3iec h ILE 73 CO 0.97 0.22 -1.31 -0.07 0.00 0.00 0.00 178.15 177.95 3iec h LEU 74 N 0.49 0.00 0.00 1.44 3.38 -1.91 -3.37 115.31 115.33 3iec h LEU 74 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3iec h LEU 74 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3iec h LEU 74 CO -0.00 0.77 -0.65 0.35 0.09 0.00 0.00 178.44 179.00 3iec n THR 75 N -3.06 0.00 -0.87 0.22 -2.24 -1.15 -5.01 114.28 102.17 3iec n THR 75 Ca -0.09 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 3iec n THR 75 Cb 0.91 0.81 0.00 0.00 -2.10 0.00 0.00 70.33 69.95 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 1.42 0.47 3.75 3.38 0.00 0.14 -5.00 105.19 109.35 3iec n GLY 76 Ca 0.01 0.00 -0.40 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 -0.58 4.74 0.16 1.61 -0.14 -1.24 -4.64 119.74 119.67 3iec s LYS 77 Ca 0.00 1.62 -0.30 0.00 -1.36 0.00 0.00 55.97 55.93 3iec s LYS 77 Cb 0.00 -3.26 -0.07 0.00 -1.68 0.00 0.00 37.83 32.82 3iec s LYS 77 CO 0.00 0.34 1.03 -1.21 -0.76 0.00 0.00 175.35 174.74 3iec s GLU 78 N -1.05 4.67 0.18 1.68 2.02 -1.26 0.02 118.70 124.96 3iec s GLU 78 Ca 0.44 1.59 -0.02 0.00 0.02 0.00 0.00 54.97 57.00 3iec s GLU 78 Cb -0.28 -3.31 -0.04 0.00 0.10 0.00 0.00 34.13 30.60 3iec s GLU 78 CO 0.35 0.19 0.13 0.14 0.02 0.00 0.00 175.26 176.10 3iec s VAL 79 N -0.31 0.04 -0.21 2.63 -7.23 -0.05 -4.60 120.40 110.66 3iec s VAL 79 Ca 0.47 -1.91 -0.03 0.00 -1.81 0.00 0.00 61.98 58.70 3iec s VAL 79 Cb -0.27 -2.30 -0.01 0.00 0.56 0.00 0.00 36.38 34.37 3iec s VAL 79 CO 0.33 -0.17 -0.06 0.00 -0.31 0.00 0.00 175.10 174.89 3iec s ALA 80 N -4.11 2.76 -0.31 1.32 0.00 0.09 -0.43 121.76 121.09 3iec s ALA 80 Ca 0.32 -1.15 -0.11 0.00 0.00 0.00 0.00 51.96 51.02 3iec s ALA 80 Cb 0.07 -1.63 -0.02 0.00 0.00 0.00 0.00 23.12 21.54 3iec s ALA 80 CO 0.08 -0.38 0.18 0.08 0.00 0.00 0.00 175.76 175.72 3iec s VAL 81 N 1.38 4.93 -0.19 0.00 1.01 0.03 -0.42 120.40 127.13 3iec s VAL 81 Ca 0.05 -0.22 -0.25 0.00 0.00 0.00 0.00 61.98 61.55 3iec s VAL 81 Cb -0.14 -3.47 -0.01 0.00 0.00 0.00 0.00 36.38 32.76 3iec s VAL 81 CO -0.04 0.10 0.85 -0.75 0.00 0.00 0.00 175.10 175.27 3iec s LYS 82 N 1.68 4.27 -0.27 2.72 2.20 0.70 -1.34 119.74 129.70 3iec s LYS 82 Ca 0.06 1.04 -0.07 0.00 -0.36 0.00 0.00 55.97 56.63 3iec s LYS 82 Cb -0.17 -3.60 -0.01 0.00 -1.51 0.00 0.00 37.83 32.54 3iec s LYS 82 CO 0.08 -0.40 0.07 0.42 -0.36 0.00 0.00 175.35 175.16 3iec s ILE 83 N 2.41 4.16 -0.12 5.43 1.01 0.11 -1.25 121.20 132.95 3iec s ILE 83 Ca 0.38 -0.38 -0.00 0.00 0.00 0.00 0.00 60.65 60.65 3iec s ILE 83 Cb -0.16 -3.02 0.02 0.00 0.01 0.00 0.00 42.46 39.31 3iec s ILE 83 CO 0.11 0.24 -0.10 -0.63 0.00 0.00 0.00 174.94 174.56 3iec s ILE 84 N 1.57 1.23 -0.28 2.92 1.01 -0.42 -2.42 121.20 124.81 3iec s ILE 84 Ca 0.05 -0.42 -0.26 0.00 0.00 0.00 0.00 60.65 60.02 3iec s ILE 84 Cb -0.16 -1.20 0.00 0.00 0.01 0.00 0.00 42.46 41.11 3iec s ILE 84 CO 0.03 0.40 0.90 -0.62 0.00 0.00 0.00 174.94 175.65 3iec s ASP 85 N 1.57 6.83 0.12 3.58 2.15 -1.26 -1.12 116.67 128.54 3iec s ASP 85 Ca 0.04 0.96 0.11 0.00 0.43 0.00 0.00 52.55 54.10 3iec s ASP 85 Cb -0.13 -2.46 -0.13 0.00 -0.30 0.00 0.00 42.92 39.90 3iec s ASP 85 CO -0.08 -0.65 1.14 0.11 -0.17 0.00 0.00 175.17 175.52 3iec h LYS 86 N 7.88 0.00 -0.50 4.34 1.57 -1.61 -3.37 116.57 124.88 3iec h LYS 86 Ca -0.22 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.62 3iec h LYS 86 Cb 1.08 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.36 3iec h LYS 86 CO 0.92 0.68 0.33 1.79 -0.57 0.00 0.00 179.45 182.61 3iec h THR 87 N 0.00 0.98 -0.00 -0.16 1.35 -1.87 -0.76 112.91 112.44 3iec h THR 87 Ca -0.08 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 3iec h THR 87 Cb 1.69 0.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.61 3iec h THR 87 CO 0.09 0.08 -0.28 1.67 -0.25 0.00 0.00 175.52 176.83 3iec n GLN 88 N -4.47 0.10 -2.86 4.72 -0.06 -1.26 -4.94 117.38 108.61 3iec n GLN 88 Ca 0.07 -0.04 -0.34 0.00 -2.00 0.00 0.00 57.00 54.68 3iec n GLN 88 Cb 0.24 -1.50 -0.07 0.00 -4.06 0.00 0.00 30.24 24.86 3iec n GLN 88 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 3iec s LEU 89 N -2.93 4.09 0.58 1.69 1.02 -0.29 -5.08 118.68 117.75 3iec s LEU 89 Ca 0.14 1.68 0.01 0.00 0.02 0.00 0.00 54.13 55.98 3iec s LEU 89 Cb 0.18 -4.29 0.05 0.00 0.02 0.00 0.00 46.19 42.15 3iec s LEU 89 CO 0.61 -0.24 0.81 0.54 0.02 0.00 0.00 176.35 178.10 3iec s ASN 90 N -2.00 5.14 0.23 2.29 6.03 -1.26 -4.89 114.94 120.48 3iec s ASN 90 Ca 0.57 -0.06 -0.05 0.00 -1.03 0.00 0.00 52.86 52.29 3iec s ASN 90 Cb -0.12 -0.75 0.23 0.00 -3.03 0.00 0.00 41.25 37.58 3iec s ASN 90 CO 0.17 -1.25 1.72 0.28 -2.03 0.00 0.00 177.10 175.99 3iec h SER 91 N -0.02 0.90 -0.30 3.54 0.02 -1.99 0.91 113.55 116.61 3iec h SER 91 Ca -0.41 -0.22 0.03 0.00 -0.84 0.00 0.00 61.79 60.35 3iec h SER 91 Cb 1.29 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 63.56 3iec h SER 91 CO 0.51 0.94 0.11 -1.28 -1.14 0.00 0.00 176.83 175.96 3iec h SER 92 N 0.87 0.13 0.26 3.07 0.87 -2.00 -1.74 113.55 115.01 3iec h SER 92 Ca 0.17 0.03 -0.12 0.00 -1.23 0.00 0.00 61.79 60.64 3iec h SER 92 Cb 0.47 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.43 3iec h SER 92 CO 0.02 0.11 -0.47 0.28 -0.53 0.00 0.00 176.83 176.24 3iec h SER 93 N 0.25 0.27 0.06 6.23 0.02 -1.57 -2.03 113.55 116.78 3iec h SER 93 Ca 0.13 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 3iec h SER 93 Cb 0.09 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 3iec h SER 93 CO -0.13 0.70 -0.06 0.25 -1.14 0.00 0.00 176.83 176.46 3iec h LEU 94 N 0.21 -0.15 -0.42 5.07 5.85 -0.58 -1.18 115.31 124.11 3iec h LEU 94 Ca 0.01 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.80 3iec h LEU 94 Cb 0.91 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.94 3iec h LEU 94 CO 0.07 -0.09 0.16 -0.61 -0.34 0.00 0.00 178.44 177.64 3iec h GLN 95 N -0.13 0.33 -0.23 1.25 4.15 -1.11 -1.83 115.11 117.54 3iec h GLN 95 Ca 0.00 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.37 3iec h GLN 95 Cb 0.13 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.73 3iec h GLN 95 CO -0.01 0.22 0.01 0.87 -1.93 0.00 0.00 178.83 177.98 3iec h LYS 96 N 0.34 0.33 -0.29 1.69 1.57 -1.22 -1.09 116.57 117.90 3iec h LYS 96 Ca 0.19 -0.05 -0.17 0.00 -1.87 0.00 0.00 60.65 58.76 3iec h LYS 96 Cb 0.17 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 3iec h LYS 96 CO -0.18 0.36 -0.48 1.25 -0.57 0.00 0.00 179.45 179.83 3iec h LEU 97 N 0.33 0.86 -0.71 2.94 5.85 -0.68 0.21 115.31 124.11 3iec h LEU 97 Ca 0.08 -0.43 -0.09 0.00 0.84 0.00 0.00 57.88 58.28 3iec h LEU 97 Cb 0.21 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 3iec h LEU 97 CO 0.00 1.20 0.04 -0.26 -0.34 0.00 0.00 178.44 179.08 3iec h PHE 98 N 0.63 1.11 -0.34 1.25 -1.00 -0.81 -1.79 116.94 115.99 3iec h PHE 98 Ca 0.03 -0.17 -0.04 0.00 2.81 0.00 0.00 57.97 60.60 3iec h PHE 98 Cb 1.05 -0.30 -0.01 0.00 3.61 0.00 0.00 35.95 40.30 3iec h PHE 98 CO 0.06 0.97 0.07 -0.09 -1.61 0.00 0.00 178.31 177.70 3iec h ARG 99 N 0.96 0.55 -0.38 1.51 2.43 -0.98 -0.50 114.38 117.98 3iec h ARG 99 Ca 0.18 -0.14 0.06 0.00 -0.81 0.00 0.00 59.98 59.27 3iec h ARG 99 Cb 0.50 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.93 3iec h ARG 99 CO 0.02 0.62 0.06 1.49 -1.51 0.00 0.00 179.97 180.66 3iec h GLU 100 N 0.39 0.18 -0.65 0.20 4.81 -0.41 -0.87 114.58 118.24 3iec h GLU 100 Ca 0.10 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 3iec h GLU 100 Cb 0.33 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 3iec h GLU 100 CO 0.00 0.12 0.35 0.28 -0.73 0.00 0.00 179.01 179.03 3iec h VAL 101 N 0.18 1.21 -0.72 0.32 2.07 -1.08 -1.02 116.25 117.21 3iec h VAL 101 Ca 0.18 -0.52 0.08 0.00 0.82 0.00 0.00 66.70 67.25 3iec h VAL 101 Cb 0.22 0.37 -0.06 0.00 -1.52 0.00 0.00 31.29 30.30 3iec h VAL 101 CO -0.25 0.23 0.39 -0.09 0.02 0.00 0.00 177.57 177.87 3iec h ARG 102 N 0.89 0.67 -0.19 1.57 2.43 -0.68 -1.64 114.38 117.43 3iec h ARG 102 Ca 0.23 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 3iec h ARG 102 Cb 0.05 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.44 3iec h ARG 102 CO -0.04 0.44 -0.12 0.82 -1.51 0.00 0.00 179.97 179.57 3iec h ILE 103 N 0.69 1.32 -0.69 1.20 2.04 -0.83 -3.08 117.51 118.15 3iec h ILE 103 Ca 0.33 -1.20 0.03 0.00 1.00 0.00 0.00 64.86 65.02 3iec h ILE 103 Cb 0.27 1.71 -0.04 0.00 -0.74 0.00 0.00 36.82 38.02 3iec h ILE 103 CO -0.22 0.36 0.46 0.24 0.00 0.00 0.00 178.15 178.99 3iec h MET 104 N 0.09 0.82 0.00 2.37 2.86 -0.80 -1.67 114.93 118.60 3iec h MET 104 Ca 0.04 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 3iec h MET 104 Cb 0.62 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 32.09 3iec h MET 104 CO 0.03 0.54 -0.13 0.87 1.06 0.00 0.00 176.91 179.28 3iec h LYS 105 N 0.85 0.00 0.00 1.72 1.57 -1.27 -2.98 116.57 116.46 3iec h LYS 105 Ca 0.27 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.90 3iec h LYS 105 Cb 0.04 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 3iec h LYS 105 CO -0.07 0.13 -0.70 0.28 -0.57 0.00 0.00 179.45 178.52 3iec h VAL 106 N 0.00 1.34 -3.41 0.50 2.07 -1.21 -3.46 116.25 112.08 3iec h VAL 106 Ca -0.00 -2.53 -0.59 0.00 0.82 0.00 0.00 66.70 64.39 3iec h VAL 106 Cb 0.27 2.43 -0.10 0.00 -1.52 0.00 0.00 31.29 32.37 3iec h VAL 106 CO 0.02 0.69 -0.08 -0.76 0.02 0.00 0.00 177.57 177.45 3iec s LEU 107 N -6.96 4.19 -0.40 2.57 1.43 -1.13 -5.03 118.68 113.36 3iec s LEU 107 Ca 0.01 0.72 0.01 0.00 -1.03 0.00 0.00 54.13 53.84 3iec s LEU 107 Cb 0.10 -2.70 0.14 0.00 0.03 0.00 0.00 46.19 43.76 3iec s LEU 107 CO 0.77 -0.11 0.23 0.21 0.23 0.00 0.00 176.35 177.68 3iec s ASN 108 N 0.96 3.23 -0.03 2.29 2.47 -1.26 -4.84 114.94 117.75 3iec s ASN 108 Ca 0.25 -2.45 -0.03 0.00 0.42 0.00 0.00 52.86 51.04 3iec s ASN 108 Cb -0.15 -0.71 0.01 0.00 -1.45 0.00 0.00 41.25 38.95 3iec s ASN 108 CO 0.10 -0.28 0.09 -2.28 -3.72 0.00 0.00 177.10 171.00 3iec s HIS 109 N 0.66 -0.09 -1.37 0.43 2.46 -1.26 -4.88 115.29 111.24 3iec s HIS 109 Ca 0.19 0.24 0.14 0.00 0.47 0.00 0.00 55.06 56.10 3iec s HIS 109 Cb -0.22 0.01 0.70 0.00 -0.13 0.00 0.00 32.58 32.94 3iec s HIS 109 CO -0.01 -0.06 1.39 -0.35 -2.47 0.00 0.00 174.74 173.25 3iec n PRO 110 N 3.17 0.17 -0.52 2.88 -0.04 -1.26 -1.56 135.00 137.85 3iec n PRO 110 Ca -0.14 0.17 0.05 0.00 -0.04 0.00 0.00 63.50 63.54 3iec n PRO 110 Cb 0.58 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.74 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 -1.32 2.09 -4.08 3.54 4.13 -1.26 -4.85 115.26 113.51 3iec n ASN 111 Ca 0.06 -3.67 -0.28 0.00 1.68 0.00 0.00 54.58 52.38 3iec n ASN 111 Cb 0.12 -0.53 -0.17 0.00 -1.54 0.00 0.00 39.78 37.66 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 -3.15 1.48 -0.13 2.41 1.01 -0.60 -0.87 121.20 121.35 3iec s ILE 112 Ca 0.38 -0.66 -0.35 0.00 0.00 0.00 0.00 60.65 60.01 3iec s ILE 112 Cb 0.36 -1.33 -0.13 0.00 0.01 0.00 0.00 42.46 41.37 3iec s ILE 112 CO -0.03 0.43 1.85 0.52 0.00 0.00 0.00 174.94 177.71 3iec n VAL 113 N 3.88 0.51 -2.91 2.92 0.31 -0.57 -4.62 118.33 117.86 3iec n VAL 113 Ca -0.21 -0.09 -0.38 0.00 -0.01 0.00 0.00 64.34 63.65 3iec n VAL 113 Cb 0.52 -1.73 -0.06 0.00 -0.91 0.00 0.00 33.84 31.66 3iec n VAL 113 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3iec s LYS 114 N 3.92 4.54 -0.05 5.55 1.02 -1.26 -4.90 119.74 128.56 3iec s LYS 114 Ca 0.94 1.19 -0.21 0.00 0.02 0.00 0.00 55.97 57.92 3iec s LYS 114 Cb -0.78 -3.01 -0.05 0.00 -0.52 0.00 0.00 37.83 33.47 3iec s LYS 114 CO 0.55 0.42 0.59 -1.17 -0.92 0.00 0.00 175.35 174.81 3iec s LEU 115 N -1.66 4.35 -0.18 3.17 2.96 -1.26 -1.36 118.68 124.71 3iec s LEU 115 Ca 0.43 1.07 0.09 0.00 -0.22 0.00 0.00 54.13 55.50 3iec s LEU 115 Cb -0.20 -2.90 -0.17 0.00 0.50 0.00 0.00 46.19 43.42 3iec s LEU 115 CO 0.25 0.02 -0.04 0.49 -1.32 0.00 0.00 176.35 175.75 3iec n PHE 116 N 3.23 0.00 -3.61 5.38 3.72 0.20 -4.97 117.46 121.41 3iec n PHE 116 Ca -0.06 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.21 3iec n PHE 116 Cb 0.51 -0.78 -0.07 0.00 -0.94 0.00 0.00 39.48 38.20 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 -2.39 0.78 -0.17 -1.08 2.12 -1.19 -3.91 118.70 112.87 3iec s GLU 117 Ca -0.16 0.69 -0.00 0.00 0.36 0.00 0.00 54.97 55.86 3iec s GLU 117 Cb 0.06 0.38 -0.00 0.00 0.26 0.00 0.00 34.13 34.82 3iec s GLU 117 CO 0.58 -0.14 -0.14 0.08 -0.54 0.00 0.00 175.26 175.09 3iec s VAL 118 N -0.09 2.70 -0.13 3.70 1.01 -0.42 -0.78 120.40 126.39 3iec s VAL 118 Ca -0.02 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.23 3iec s VAL 118 Cb -0.04 -2.15 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 3iec s VAL 118 CO 0.01 0.51 -0.17 -0.63 0.00 0.00 0.00 175.10 174.82 3iec s ILE 119 N 0.96 2.68 -0.11 2.22 1.01 -0.13 -4.67 121.20 123.17 3iec s ILE 119 Ca -0.02 -0.79 0.04 0.00 0.00 0.00 0.00 60.65 59.88 3iec s ILE 119 Cb -0.15 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.22 3iec s ILE 119 CO -0.02 0.53 -0.23 -1.61 0.00 0.00 0.00 174.94 173.61 3iec s GLU 120 N 0.49 2.98 0.47 2.79 2.02 -1.26 -0.20 118.70 125.98 3iec s GLU 120 Ca -0.11 -0.85 0.04 0.00 0.02 0.00 0.00 54.97 54.06 3iec s GLU 120 Cb -0.16 -2.28 -0.04 0.00 0.10 0.00 0.00 34.13 31.75 3iec s GLU 120 CO 0.05 0.14 0.03 0.95 0.02 0.00 0.00 175.26 176.44 3iec s THR 121 N 0.44 1.54 0.13 3.63 -4.23 0.69 -5.01 115.64 112.83 3iec s THR 121 Ca -0.17 -1.97 -0.30 0.00 -1.18 0.00 0.00 61.69 58.08 3iec s THR 121 Cb -0.17 -2.50 -0.06 0.00 1.34 0.00 0.00 72.50 71.10 3iec s THR 121 CO 0.07 0.00 1.57 -0.08 -0.54 0.00 0.00 174.62 175.64 3iec h GLU 122 N 1.48 -0.47 0.00 3.99 4.81 -2.03 -3.04 114.58 119.33 3iec h GLU 122 Ca -0.44 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 3iec h GLU 122 Cb 1.28 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.77 3iec h GLU 122 CO 0.76 -0.31 -0.66 0.87 -0.73 0.00 0.00 179.01 178.94 3iec h LYS 123 N -0.48 0.00 -3.94 1.92 1.57 -1.96 -3.45 116.57 110.23 3iec h LYS 123 Ca 0.08 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.62 3iec h LYS 123 Cb 0.63 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 32.68 3iec h LYS 123 CO -0.44 0.00 -0.72 0.99 -0.57 0.00 0.00 179.45 178.71 3iec s THR 124 N -3.22 0.13 -0.16 -0.16 2.01 -1.15 -1.54 115.64 111.56 3iec s THR 124 Ca 0.05 -0.32 -0.03 0.00 0.31 0.00 0.00 61.69 61.70 3iec s THR 124 Cb 0.12 -0.16 -0.02 0.00 0.01 0.00 0.00 72.50 72.44 3iec s THR 124 CO 0.73 -0.13 -0.07 -0.22 -0.69 0.00 0.00 174.62 174.25 3iec s LEU 125 N -0.47 3.03 -0.15 4.42 2.96 -0.28 -0.23 118.68 127.97 3iec s LEU 125 Ca -0.04 -0.23 -0.02 0.00 -0.22 0.00 0.00 54.13 53.62 3iec s LEU 125 Cb -0.03 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.92 3iec s LEU 125 CO -0.00 0.14 -0.09 -0.31 -1.32 0.00 0.00 176.35 174.76 3iec s TYR 126 N 0.55 2.90 -0.24 5.38 1.51 0.72 -1.30 117.35 126.87 3iec s TYR 126 Ca -0.05 -0.58 -0.01 0.00 -1.01 0.00 0.00 57.07 55.43 3iec s TYR 126 Cb -0.15 -1.91 0.03 0.00 -0.11 0.00 0.00 41.96 39.82 3iec s TYR 126 CO 0.03 -0.20 -0.09 -0.51 -1.11 0.00 0.00 175.55 173.67 3iec s LEU 127 N 0.49 3.03 -0.26 -1.29 1.43 -0.38 -0.95 118.68 120.75 3iec s LEU 127 Ca -0.07 -0.90 -0.15 0.00 -1.03 0.00 0.00 54.13 51.99 3iec s LEU 127 Cb -0.15 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.41 3iec s LEU 127 CO 0.04 -0.11 0.35 -0.69 0.23 0.00 0.00 176.35 176.17 3iec s VAL 128 N 1.29 5.20 0.22 -1.59 1.01 0.04 -0.21 120.40 126.36 3iec s VAL 128 Ca -0.00 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.53 3iec s VAL 128 Cb -0.16 -3.68 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 3iec s VAL 128 CO -0.06 0.19 0.11 0.00 0.00 0.00 0.00 175.10 175.34 3iec s MET 129 N 1.87 1.28 0.25 2.72 0.23 0.43 -0.62 119.30 125.46 3iec s MET 129 Ca 0.15 -1.68 -0.31 0.00 -1.03 0.00 0.00 55.69 52.81 3iec s MET 129 Cb -0.15 0.02 -0.13 0.00 -1.53 0.00 0.00 34.83 33.04 3iec s MET 129 CO 0.09 -0.34 1.48 -1.91 -2.03 0.00 0.00 175.02 172.32 3iec n GLU 130 N -0.35 2.24 -3.49 3.16 2.13 -0.46 -0.73 120.64 123.14 3iec n GLU 130 Ca 0.01 0.80 -0.37 0.00 0.66 0.00 0.00 57.16 58.26 3iec n GLU 130 Cb 0.66 -2.50 -0.07 0.00 0.27 0.00 0.00 31.44 29.80 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 0.08 3.49 -0.51 4.31 5.04 -1.26 -4.56 117.35 123.94 3iec s TYR 131 Ca 0.68 0.69 -0.01 0.00 -2.44 0.00 0.00 57.07 55.99 3iec s TYR 131 Cb -0.61 -2.38 0.13 0.00 0.35 0.00 0.00 41.96 39.46 3iec s TYR 131 CO 0.48 0.26 0.29 0.00 -1.34 0.00 0.00 175.55 175.24 3iec s ALA 132 N 0.36 3.33 -1.04 3.97 0.00 -1.26 -4.86 121.76 122.26 3iec s ALA 132 Ca 0.19 -2.95 0.29 0.00 0.00 0.00 0.00 51.96 49.50 3iec s ALA 132 Cb -0.14 -2.43 1.27 0.00 0.00 0.00 0.00 23.12 21.82 3iec s ALA 132 CO 0.06 -1.95 1.94 -1.13 0.00 0.00 0.00 175.76 174.68 3iec n SER 133 N 3.88 0.00 0.00 0.00 3.41 -1.20 -2.60 113.62 117.11 3iec n SER 133 Ca 0.04 0.44 0.12 0.00 -0.26 0.00 0.00 58.87 59.20 3iec n SER 133 Cb 0.39 -0.48 0.55 0.00 -0.26 0.00 0.00 64.21 64.41 3iec n SER 133 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3iec n GLY 134 N 1.48 -1.25 7.00 5.00 0.00 0.16 -4.88 105.19 112.70 3iec n GLY 134 Ca 0.08 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 0.92 -1.25 3.81 -0.02 0.00 -1.07 -4.65 105.19 102.94 3iec n GLY 135 Ca 0.08 -1.25 -0.36 0.00 0.00 0.00 0.00 46.02 44.49 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 4.30 0.39 1.61 2.02 -1.26 -0.20 118.70 125.56 3iec s GLU 136 Ca 0.00 0.98 0.06 0.00 0.02 0.00 0.00 54.97 56.04 3iec s GLU 136 Cb 0.00 -2.73 0.79 0.00 0.10 0.00 0.00 34.13 32.29 3iec s GLU 136 CO 0.00 0.29 2.01 0.28 0.02 0.00 0.00 175.26 177.86 3iec h VAL 137 N 2.51 1.13 -0.09 2.63 2.07 -0.66 -1.85 116.25 121.99 3iec h VAL 137 Ca -0.48 -0.34 0.04 0.00 0.82 0.00 0.00 66.70 66.74 3iec h VAL 137 Cb 1.19 0.60 -0.06 0.00 -1.52 0.00 0.00 31.29 31.50 3iec h VAL 137 CO 0.65 0.14 -0.43 0.15 0.02 0.00 0.00 177.57 178.10 3iec h PHE 138 N 0.55 -1.24 0.00 1.57 3.57 -1.73 0.21 116.94 119.88 3iec h PHE 138 Ca 0.14 0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 3iec h PHE 138 Cb 0.03 0.56 -0.01 0.00 2.79 0.00 0.00 35.95 39.32 3iec h PHE 138 CO 0.00 -0.49 -0.34 -0.44 -2.23 0.00 0.00 178.31 174.81 3iec h ASP 139 N -0.53 0.00 -0.35 0.41 3.32 -1.78 -1.53 116.42 115.96 3iec h ASP 139 Ca 0.06 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.05 3iec h ASP 139 Cb 0.64 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.18 3iec h ASP 139 CO -0.38 0.34 -0.03 0.22 -1.72 0.00 0.00 179.24 177.67 3iec h TYR 140 N 0.00 0.71 -0.73 4.55 5.03 -0.62 -1.64 116.97 124.27 3iec h TYR 140 Ca -0.00 -0.13 -0.02 0.00 2.58 0.00 0.00 58.73 61.15 3iec h TYR 140 Cb 0.64 -0.18 -0.03 0.00 1.55 0.00 0.00 36.73 38.71 3iec h TYR 140 CO 0.00 0.77 0.35 -0.07 -1.32 0.00 0.00 178.16 177.89 3iec h LEU 141 N 0.44 0.94 -0.45 2.82 3.38 -0.11 -1.05 115.31 121.27 3iec h LEU 141 Ca 0.10 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 3iec h LEU 141 Cb 0.51 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3iec h LEU 141 CO 0.02 0.79 -0.03 0.58 0.09 0.00 0.00 178.44 179.90 3iec h VAL 142 N 1.03 1.27 -0.49 1.22 2.07 -1.17 0.25 116.25 120.42 3iec h VAL 142 Ca 0.25 -1.09 -0.07 0.00 0.82 0.00 0.00 66.70 66.61 3iec h VAL 142 Cb 0.10 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 3iec h VAL 142 CO -0.03 0.38 0.02 0.00 0.02 0.00 0.00 177.57 177.95 3iec h ALA 143 N 0.90 1.11 -0.02 1.67 0.00 -1.15 -3.35 119.26 118.43 3iec h ALA 143 Ca 0.13 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3iec h ALA 143 Cb 0.54 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3iec h ALA 143 CO 0.03 0.57 0.00 0.72 0.00 0.00 0.00 179.25 180.57 3iec n HIS 144 N -4.22 0.01 0.00 0.00 8.25 -0.41 -5.02 115.22 113.83 3iec n HIS 144 Ca 0.03 -0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3iec n HIS 144 Cb 0.29 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.40 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 0.38 1.83 3.84 -1.41 0.00 0.88 -4.80 105.19 105.92 3iec n GLY 145 Ca 0.04 -0.13 -0.04 0.00 0.00 0.00 0.00 46.02 45.89 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 0.04 -0.07 1.61 -2.14 -1.26 -4.00 118.94 113.12 3iec s TRP 146 Ca 0.00 -0.47 0.02 0.00 2.66 0.00 0.00 56.10 58.31 3iec s TRP 146 Cb 0.00 0.72 -0.03 0.00 -3.10 0.00 0.00 33.47 31.06 3iec s TRP 146 CO 0.00 -1.03 -0.11 -1.64 -2.66 0.00 0.00 176.95 171.51 3iec s MET 147 N -2.43 2.73 0.84 3.25 -1.94 -0.36 -5.00 119.30 116.39 3iec s MET 147 Ca 0.19 -0.63 -0.11 0.00 -1.71 0.00 0.00 55.69 53.42 3iec s MET 147 Cb -0.03 -2.50 0.10 0.00 2.01 0.00 0.00 34.83 34.41 3iec s MET 147 CO 0.06 0.58 1.15 0.15 -0.01 0.00 0.00 175.02 176.95 3iec s LYS 148 N -0.60 1.51 0.35 2.03 1.02 -1.26 -4.39 119.74 118.40 3iec s LYS 148 Ca 0.09 1.52 0.04 0.00 0.02 0.00 0.00 55.97 57.64 3iec s LYS 148 Cb -0.11 -1.78 0.68 0.00 -0.52 0.00 0.00 37.83 36.09 3iec s LYS 148 CO 0.01 -2.26 1.96 0.93 -0.92 0.00 0.00 175.35 175.08 3iec h GLU 149 N -1.37 0.80 -0.63 1.68 5.08 -1.95 0.22 114.58 118.41 3iec h GLU 149 Ca -0.44 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 57.86 3iec h GLU 149 Cb 1.27 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 3iec h GLU 149 CO 0.45 0.53 0.37 0.87 -1.00 0.00 0.00 179.01 180.23 3iec h LYS 150 N 0.83 0.86 -0.17 2.33 1.57 -1.99 -0.12 116.57 119.88 3iec h LYS 150 Ca 0.31 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.90 3iec h LYS 150 Cb 0.16 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.29 3iec h LYS 150 CO -0.10 0.63 -0.30 1.49 -0.57 0.00 0.00 179.45 180.60 3iec h GLU 151 N 0.85 0.50 -0.98 3.15 4.81 -1.52 -2.58 114.58 118.82 3iec h GLU 151 Ca 0.22 -0.31 0.12 0.00 -0.13 0.00 0.00 59.36 59.26 3iec h GLU 151 Cb -0.00 0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.34 3iec h GLU 151 CO -0.04 0.92 0.62 0.00 -0.73 0.00 0.00 179.01 179.78 3iec h ALA 152 N 0.58 1.57 -0.47 2.92 0.00 -0.91 -1.96 119.26 120.99 3iec h ALA 152 Ca 0.01 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 3iec h ALA 152 Cb 0.89 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3iec h ALA 152 CO 0.07 0.20 -0.12 -0.09 0.00 0.00 0.00 179.25 179.30 3iec h ARG 153 N 0.95 0.91 -0.63 0.00 2.43 -0.95 0.94 114.38 118.03 3iec h ARG 153 Ca 0.48 -0.36 0.02 0.00 -0.81 0.00 0.00 59.98 59.31 3iec h ARG 153 Cb 0.49 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.96 3iec h ARG 153 CO -0.24 1.01 0.41 0.00 -1.51 0.00 0.00 179.97 179.63 3iec h ALA 154 N 0.88 0.82 -0.43 2.80 0.00 -0.98 0.39 119.26 122.74 3iec h ALA 154 Ca 0.12 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 3iec h ALA 154 Cb 0.68 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3iec h ALA 154 CO 0.05 0.19 -0.11 0.87 0.00 0.00 0.00 179.25 180.25 3iec h LYS 155 N 0.82 0.83 0.06 0.00 6.56 -1.23 -3.22 116.57 120.38 3iec h LYS 155 Ca 0.24 -0.32 -0.24 0.00 -1.06 0.00 0.00 60.65 59.27 3iec h LYS 155 Cb -0.04 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 31.57 3iec h LYS 155 CO -0.08 0.95 -1.06 0.35 -2.06 0.00 0.00 179.45 177.55 3iec h PHE 156 N 0.66 0.51 -0.73 -1.35 3.57 -0.32 -0.12 116.94 119.17 3iec h PHE 156 Ca 0.11 -0.32 0.12 0.00 3.53 0.00 0.00 57.97 61.41 3iec h PHE 156 Cb 0.64 -0.04 -0.08 0.00 2.79 0.00 0.00 35.95 39.26 3iec h PHE 156 CO 0.05 1.18 0.32 0.00 -2.23 0.00 0.00 178.31 177.63 3iec h ARG 157 N 0.15 0.49 -0.29 1.11 3.08 -1.03 0.12 114.38 118.00 3iec h ARG 157 Ca -0.10 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.87 3iec h ARG 157 Cb 1.73 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.66 3iec h ARG 157 CO 0.18 0.32 -0.01 1.96 -1.07 0.00 0.00 179.97 181.35 3iec h GLN 158 N 0.51 0.52 -0.25 0.04 4.20 -1.49 -1.32 115.11 117.32 3iec h GLN 158 Ca 0.38 -0.17 0.01 0.00 0.06 0.00 0.00 58.65 58.93 3iec h GLN 158 Cb 0.51 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 3iec h GLN 158 CO -0.34 0.68 0.15 0.82 -0.67 0.00 0.00 178.83 179.46 3iec h ILE 159 N 0.31 1.04 -0.44 2.54 2.04 -0.77 -1.30 117.51 120.93 3iec h ILE 159 Ca 0.08 -0.11 -0.13 0.00 1.00 0.00 0.00 64.86 65.71 3iec h ILE 159 Cb 0.45 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 3iec h ILE 159 CO 0.02 0.06 -0.23 0.58 0.00 0.00 0.00 178.15 178.57 3iec h VAL 160 N 0.31 1.27 -0.63 1.67 2.07 -0.72 -1.38 116.25 118.84 3iec h VAL 160 Ca 0.09 -1.38 0.04 0.00 0.82 0.00 0.00 66.70 66.27 3iec h VAL 160 Cb -0.02 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 30.88 3iec h VAL 160 CO -0.04 0.47 0.37 -1.28 0.02 0.00 0.00 177.57 177.11 3iec h SER 161 N 0.78 0.56 -0.10 0.57 0.87 -0.95 -0.98 113.55 114.30 3iec h SER 161 Ca 0.10 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.67 3iec h SER 161 Cb 0.79 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.65 3iec h SER 161 CO 0.07 0.38 0.04 0.00 -0.53 0.00 0.00 176.83 176.78 3iec h ALA 162 N 1.31 0.13 -0.17 6.23 0.00 -0.80 -0.87 119.26 125.09 3iec h ALA 162 Ca 0.27 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 3iec h ALA 162 Cb 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3iec h ALA 162 CO -0.15 -0.27 -0.36 0.28 0.00 0.00 0.00 179.25 178.75 3iec h VAL 163 N -0.01 1.34 -0.55 0.00 2.07 -1.22 -1.39 116.25 116.48 3iec h VAL 163 Ca 0.03 -1.61 0.02 0.00 0.82 0.00 0.00 66.70 65.97 3iec h VAL 163 Cb 0.19 1.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 3iec h VAL 163 CO -0.00 0.49 0.37 -0.61 0.02 0.00 0.00 177.57 177.84 3iec h GLN 164 N 0.20 0.66 -0.53 1.57 -0.00 -1.17 -1.50 115.11 114.34 3iec h GLN 164 Ca 0.00 -0.04 -0.04 0.00 -0.00 0.00 0.00 58.65 58.57 3iec h GLN 164 Cb 0.96 -0.15 -0.02 0.00 0.00 0.00 0.00 27.48 28.27 3iec h GLN 164 CO 0.08 0.44 0.17 -0.92 0.00 0.00 0.00 178.83 178.60 3iec h TYR 165 N 0.68 0.85 -0.81 3.99 3.20 -0.97 -0.21 116.97 123.70 3iec h TYR 165 Ca 0.22 -0.08 0.08 0.00 3.14 0.00 0.00 58.73 62.09 3iec h TYR 165 Cb 0.03 -0.25 -0.07 0.00 1.54 0.00 0.00 36.73 37.98 3iec h TYR 165 CO -0.00 0.72 0.47 0.00 -1.64 0.00 0.00 178.16 177.72 3iec h HIS 167 N 0.82 0.74 -0.67 0.00 3.86 -1.01 0.64 115.15 119.53 3iec h HIS 167 Ca 0.38 -0.14 0.09 0.00 -1.16 0.00 0.00 60.37 59.55 3iec h HIS 167 Cb 0.30 -0.19 -0.07 0.00 1.06 0.00 0.00 27.41 28.51 3iec h HIS 167 CO -0.06 0.78 0.31 1.96 0.86 0.00 0.00 177.93 181.78 3iec h GLN 168 N 0.60 0.51 -0.82 2.45 4.20 0.82 -0.79 115.11 122.09 3iec h GLN 168 Ca 0.10 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 3iec h GLN 168 Cb 0.60 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 3iec h GLN 168 CO 0.04 0.34 0.03 1.63 -0.67 0.00 0.00 178.83 180.20 3iec n LYS 169 N -4.91 2.76 -3.34 1.46 5.02 -0.50 -4.91 118.16 113.74 3iec n LYS 169 Ca 0.10 -1.50 -0.24 0.00 -2.02 0.00 0.00 58.31 54.66 3iec n LYS 169 Cb 0.28 -1.84 0.06 0.00 -0.02 0.00 0.00 35.03 33.50 3iec n LYS 169 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3iec n PHE 170 N 0.25 -2.44 -4.99 2.13 3.72 -0.30 -4.96 117.46 110.86 3iec n PHE 170 Ca 0.15 0.78 -0.28 0.00 -0.05 0.00 0.00 57.45 58.05 3iec n PHE 170 Cb 0.74 -4.74 -0.16 0.00 -0.94 0.00 0.00 39.48 34.37 3iec n PHE 170 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 3iec s ILE 171 N -3.25 1.65 -0.09 4.37 1.01 0.14 -0.99 121.20 124.04 3iec s ILE 171 Ca 0.46 -0.84 -0.02 0.00 0.00 0.00 0.00 60.65 60.25 3iec s ILE 171 Cb -0.20 -1.41 -0.03 0.00 0.01 0.00 0.00 42.46 40.82 3iec s ILE 171 CO 0.57 0.47 -0.00 0.68 0.00 0.00 0.00 174.94 176.66 3iec s VAL 172 N -0.01 4.29 -0.14 2.92 -7.23 -0.42 -3.34 120.40 116.47 3iec s VAL 172 Ca -0.04 -0.25 -0.21 0.00 -1.81 0.00 0.00 61.98 59.66 3iec s VAL 172 Cb -0.12 -2.81 -0.19 0.00 0.56 0.00 0.00 36.38 33.82 3iec s VAL 172 CO 0.03 0.59 0.51 -0.74 -0.31 0.00 0.00 175.10 175.18 3iec h HIS 173 N 5.30 0.00 0.00 2.82 2.76 -1.90 -2.25 115.15 121.88 3iec h HIS 173 Ca -0.49 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.68 3iec h HIS 173 Cb 1.19 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.15 3iec h HIS 173 CO 0.62 0.81 0.00 0.54 -1.30 0.00 0.00 177.93 178.61 3iec n ARG 174 N -4.62 -0.33 -2.63 5.26 1.74 -1.26 -2.50 116.66 112.31 3iec n ARG 174 Ca -0.10 0.08 -0.04 0.00 -0.77 0.00 0.00 57.85 57.02 3iec n ARG 174 Cb 0.40 -3.68 0.05 0.00 -1.02 0.00 0.00 32.46 28.20 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 -0.16 2.07 -4.69 0.55 2.03 -1.26 -4.39 116.55 110.70 3iec n ASP 175 Ca 0.00 -2.30 -0.42 0.00 0.52 0.00 0.00 54.79 52.58 3iec n ASP 175 Cb 0.08 -0.45 -0.03 0.00 -0.72 0.00 0.00 41.12 40.00 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 -3.61 4.36 0.08 -2.67 1.02 -1.26 -4.76 118.68 111.84 3iec s LEU 176 Ca 0.31 2.42 -0.27 0.00 0.02 0.00 0.00 54.13 56.61 3iec s LEU 176 Cb 0.34 -3.56 0.08 0.00 0.02 0.00 0.00 46.19 43.07 3iec s LEU 176 CO -0.03 -0.88 0.94 -1.59 0.02 0.00 0.00 176.35 174.81 3iec s LYS 177 N 2.80 1.02 0.34 1.70 -2.85 -1.26 -4.89 119.74 116.60 3iec s LYS 177 Ca 0.73 -0.50 0.04 0.00 -1.00 0.00 0.00 55.97 55.24 3iec s LYS 177 Cb -0.38 0.39 0.66 0.00 -2.06 0.00 0.00 37.83 36.44 3iec s LYS 177 CO 0.31 -0.46 1.94 0.00 0.10 0.00 0.00 175.35 177.25 3iec h ALA 178 N 2.00 1.64 0.00 0.59 0.00 -1.93 -1.69 119.26 119.86 3iec h ALA 178 Ca -0.23 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 3iec h ALA 178 Cb 1.23 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 3iec h ALA 178 CO 0.28 0.24 -0.18 0.93 0.00 0.00 0.00 179.25 180.52 3iec h GLU 179 N 0.86 0.00 -0.53 0.00 3.07 -1.94 -2.60 114.58 113.43 3iec h GLU 179 Ca 0.34 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.20 3iec h GLU 179 Cb 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 3iec h GLU 179 CO -0.12 0.18 0.00 0.09 -1.40 0.00 0.00 179.01 177.76 3iec n ASN 180 N -3.75 3.22 -4.39 1.42 5.03 -0.65 -4.72 115.26 111.42 3iec n ASN 180 Ca -0.02 -1.97 -0.39 0.00 0.87 0.00 0.00 54.58 53.07 3iec n ASN 180 Cb 0.29 -0.35 -0.12 0.00 -1.02 0.00 0.00 39.78 38.58 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 -1.16 4.24 0.31 3.41 1.43 -1.01 -1.98 118.68 123.92 3iec s LEU 181 Ca 0.40 -0.74 0.06 0.00 -1.03 0.00 0.00 54.13 52.82 3iec s LEU 181 Cb 0.22 -1.97 -0.02 0.00 0.03 0.00 0.00 46.19 44.45 3iec s LEU 181 CO 0.29 -0.26 0.44 -0.76 0.23 0.00 0.00 176.35 176.29 3iec s LEU 182 N 1.55 4.08 -0.07 1.79 1.43 0.39 -0.28 118.68 127.57 3iec s LEU 182 Ca 0.03 -0.11 0.04 0.00 -1.03 0.00 0.00 54.13 53.06 3iec s LEU 182 Cb -0.18 -2.78 -0.00 0.00 0.03 0.00 0.00 46.19 43.25 3iec s LEU 182 CO 0.05 -0.32 -0.21 -0.76 0.23 0.00 0.00 176.35 175.34 3iec s LEU 183 N -4.11 1.98 0.00 1.79 1.43 0.72 -0.10 118.68 120.39 3iec s LEU 183 Ca 0.42 -0.46 -0.07 0.00 -1.03 0.00 0.00 54.13 52.99 3iec s LEU 183 Cb -0.09 -1.22 0.17 0.00 0.03 0.00 0.00 46.19 45.08 3iec s LEU 183 CO 0.30 0.17 1.10 -0.90 0.23 0.00 0.00 176.35 177.25 3iec n ASP 184 N 3.30 0.81 0.03 2.29 5.68 -0.51 0.39 116.55 128.53 3iec n ASP 184 Ca -0.19 -1.84 0.19 0.00 -0.50 0.00 0.00 54.79 52.45 3iec n ASP 184 Cb 0.52 -0.77 0.69 0.00 -1.14 0.00 0.00 41.12 40.42 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 -1.10 2.45 -0.48 2.12 0.00 -1.89 0.28 119.26 120.63 3iec h ALA 185 Ca -0.36 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3iec h ALA 185 Cb 1.17 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3iec h ALA 185 CO 0.32 -0.59 0.00 -0.25 0.00 0.00 0.00 179.25 178.73 3iec n ASP 186 N -4.39 2.69 -1.24 0.00 8.00 -1.26 -4.92 116.55 115.44 3iec n ASP 186 Ca 0.08 -1.98 -0.12 0.00 0.71 0.00 0.00 54.79 53.49 3iec n ASP 186 Cb 0.56 -0.32 -0.01 0.00 -0.02 0.00 0.00 41.12 41.32 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 0.97 -0.90 -3.42 -1.24 2.81 0.09 -5.02 117.12 110.41 3iec n MET 187 Ca 0.17 0.63 -0.34 0.00 -1.81 0.00 0.00 57.70 56.35 3iec n MET 187 Cb 0.43 -4.74 -0.05 0.00 -0.71 0.00 0.00 33.22 28.14 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 -2.55 6.70 0.30 7.83 0.01 -1.26 -4.81 114.94 121.15 3iec s ASN 188 Ca 0.00 0.95 -0.29 0.00 -0.71 0.00 0.00 52.86 52.81 3iec s ASN 188 Cb 0.00 -2.24 -0.10 0.00 0.41 0.00 0.00 41.25 39.33 3iec s ASN 188 CO 0.00 0.03 1.13 -0.63 -1.51 0.00 0.00 177.10 176.12 3iec s ILE 189 N -1.62 3.37 -0.17 0.60 -1.09 -1.26 -1.42 121.20 119.61 3iec s ILE 189 Ca 0.42 1.36 -0.02 0.00 -2.23 0.00 0.00 60.65 60.17 3iec s ILE 189 Cb -0.13 -3.85 0.05 0.00 -1.58 0.00 0.00 42.46 36.95 3iec s ILE 189 CO 0.20 0.30 0.01 -0.54 -1.23 0.00 0.00 174.94 173.68 3iec s LYS 190 N -1.59 0.87 0.24 2.79 -0.14 0.86 -4.24 119.74 118.53 3iec s LYS 190 Ca 0.46 -0.40 -0.30 0.00 -1.36 0.00 0.00 55.97 54.38 3iec s LYS 190 Cb -0.32 -1.95 -0.09 0.00 -1.68 0.00 0.00 37.83 33.79 3iec s LYS 190 CO 0.42 -0.54 1.08 0.42 -0.76 0.00 0.00 175.35 175.96 3iec s ILE 191 N 1.80 3.69 -0.07 2.17 1.01 -0.05 -0.46 121.20 129.29 3iec s ILE 191 Ca -0.00 1.62 -0.07 0.00 0.00 0.00 0.00 60.65 62.20 3iec s ILE 191 Cb -0.16 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.24 3iec s ILE 191 CO -0.07 0.35 -0.15 0.00 0.00 0.00 0.00 174.94 175.07 3iec n ALA 192 N 1.64 2.20 -3.78 9.38 0.00 -0.84 -1.52 120.51 127.59 3iec n ALA 192 Ca 0.00 -0.40 -0.36 0.00 0.00 0.00 0.00 53.44 52.68 3iec n ALA 192 Cb 0.46 0.26 -0.12 0.00 0.00 0.00 0.00 19.45 20.05 3iec n ALA 192 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3iec s ASP 193 N -6.00 5.18 -0.31 0.00 2.15 -1.26 -4.87 116.67 111.55 3iec s ASP 193 Ca -0.14 -1.97 0.06 0.00 0.43 0.00 0.00 52.55 50.93 3iec s ASP 193 Cb 0.04 -1.80 0.60 0.00 -0.30 0.00 0.00 42.92 41.46 3iec s ASP 193 CO 0.19 -0.50 1.68 0.49 -0.17 0.00 0.00 175.17 176.86 3iec n PHE 194 N 4.57 2.26 0.21 -5.34 3.01 -1.26 -4.58 117.46 116.32 3iec n PHE 194 Ca -0.03 -1.26 0.07 0.00 1.01 0.00 0.00 57.45 57.24 3iec n PHE 194 Cb 0.42 -0.69 0.58 0.00 -0.01 0.00 0.00 39.48 39.77 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 2.46 0.10 -1.74 1.37 0.00 -1.93 -1.62 103.07 101.71 3iec h GLY 195 Ca 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.63 3iec h GLY 195 CO 0.74 0.04 0.00 0.69 0.00 0.00 0.00 176.54 178.01 3iec n PHE 196 N -4.49 0.15 -1.25 5.60 0.99 -1.26 -4.95 117.46 112.26 3iec n PHE 196 Ca -0.02 -0.09 -0.32 0.00 -0.00 0.00 0.00 57.45 57.02 3iec n PHE 196 Cb 0.12 -0.00 0.10 0.00 -1.00 0.00 0.00 39.48 38.69 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 -1.55 4.26 -0.00 4.37 0.01 -0.61 -4.66 113.70 115.52 3iec s SER 197 Ca 0.27 1.97 -0.24 0.00 1.31 0.00 0.00 55.95 59.26 3iec s SER 197 Cb 0.18 -2.54 0.05 0.00 0.21 0.00 0.00 66.02 63.92 3iec s SER 197 CO 0.26 -2.20 0.52 0.21 0.41 0.00 0.00 173.24 172.44 3iec s ASN 198 N -2.99 -0.45 0.52 2.44 2.47 -0.85 -4.89 114.94 111.19 3iec s ASN 198 Ca 0.64 0.34 -0.19 0.00 0.42 0.00 0.00 52.86 54.08 3iec s ASN 198 Cb -0.20 0.46 -0.07 0.00 -1.45 0.00 0.00 41.25 40.00 3iec s ASN 198 CO 0.53 -0.61 1.05 -1.61 -3.72 0.00 0.00 177.10 172.74 3iec s GLU 199 N -1.73 3.63 0.17 0.43 8.01 -1.26 -1.30 118.70 126.65 3iec s GLU 199 Ca -0.09 1.35 0.03 0.00 0.01 0.00 0.00 54.97 56.27 3iec s GLU 199 Cb -0.01 -2.07 -0.05 0.00 -4.31 0.00 0.00 34.13 27.69 3iec s GLU 199 CO 0.04 -0.57 -0.03 -0.59 0.01 0.00 0.00 175.26 174.12 3iec s PHE 200 N -2.07 1.28 -0.36 1.61 -0.12 -0.16 -4.89 117.98 113.27 3iec s PHE 200 Ca 0.67 -0.93 0.01 0.00 -0.05 0.00 0.00 56.93 56.63 3iec s PHE 200 Cb -0.17 -0.72 0.14 0.00 -0.63 0.00 0.00 43.02 41.65 3iec s PHE 200 CO 0.25 -0.10 0.25 0.95 -0.05 0.00 0.00 175.22 176.52 3iec s THR 201 N -3.52 0.03 0.00 -4.49 -4.23 -1.26 -4.82 115.64 97.34 3iec s THR 201 Ca 0.22 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 3iec s THR 201 Cb 0.05 -1.01 0.00 0.00 1.34 0.00 0.00 72.50 72.88 3iec s THR 201 CO 0.04 -0.90 0.00 0.49 -0.54 0.00 0.00 174.62 173.70 3iec n PHE 202 N 4.07 0.00 0.27 3.99 3.01 -1.26 -1.26 117.46 126.29 3iec n PHE 202 Ca 0.12 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.59 3iec n PHE 202 Cb 0.39 -0.36 0.04 0.00 -0.01 0.00 0.00 39.48 39.54 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 -0.87 -0.14 3.02 1.37 0.00 -1.26 -4.57 105.19 102.74 3iec n GLY 203 Ca 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.91 -0.07 0.56 1.61 0.01 -0.39 -5.15 114.94 109.61 3iec s ASN 204 Ca 0.02 0.47 -0.17 0.00 -0.71 0.00 0.00 52.86 52.47 3iec s ASN 204 Cb 0.01 1.30 -0.05 0.00 0.41 0.00 0.00 41.25 42.92 3iec s ASN 204 CO 0.02 -0.28 1.06 -0.54 -1.51 0.00 0.00 177.10 175.84 3iec s LYS 205 N 2.60 3.45 0.52 -0.60 1.02 -1.26 -4.54 119.74 120.93 3iec s LYS 205 Ca 0.11 1.29 -0.04 0.00 0.02 0.00 0.00 55.97 57.34 3iec s LYS 205 Cb -0.15 -2.05 -0.01 0.00 -0.52 0.00 0.00 37.83 35.11 3iec s LYS 205 CO -0.16 -0.71 0.81 -0.51 -0.92 0.00 0.00 175.35 173.86 3iec s LEU 206 N -4.15 3.45 0.00 3.17 1.02 0.09 -4.84 118.68 117.42 3iec s LEU 206 Ca 0.65 0.67 0.00 0.00 0.02 0.00 0.00 54.13 55.47 3iec s LEU 206 Cb -0.17 -3.54 0.00 0.00 0.02 0.00 0.00 46.19 42.50 3iec s LEU 206 CO 0.31 -0.83 0.05 0.47 0.02 0.00 0.00 176.35 176.37 3iec n ASP 207 N -2.36 0.10 -4.63 2.29 8.00 -1.26 -2.80 116.55 115.88 3iec n ASP 207 Ca 0.03 -0.39 -0.34 0.00 0.71 0.00 0.00 54.79 54.79 3iec n ASP 207 Cb 0.57 0.36 -0.10 0.00 -0.02 0.00 0.00 41.12 41.93 3iec n ASP 207 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3iec s THR 208 N -0.36 4.70 -0.87 -3.53 2.01 -1.26 -4.99 115.64 111.34 3iec s THR 208 Ca 0.00 -0.07 0.00 0.00 0.31 0.00 0.00 61.69 61.93 3iec s THR 208 Cb 0.00 -3.10 0.34 0.00 0.01 0.00 0.00 72.50 69.74 3iec s THR 208 CO 0.00 0.47 1.67 0.49 -0.69 0.00 0.00 174.62 176.56 3iec n PHE 209 N 3.44 3.09 -3.50 4.92 3.01 -1.26 -5.00 117.46 122.16 3iec n PHE 209 Ca -0.17 -2.79 -0.37 0.00 1.01 0.00 0.00 57.45 55.13 3iec n PHE 209 Cb 0.52 -0.99 -0.06 0.00 -0.01 0.00 0.00 39.48 38.94 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 1.50 -1.16 3.27 0.00 0.00 -1.26 -4.91 105.19 102.63 3iec n GLY 211 Ca -0.12 -0.79 -0.34 0.00 0.00 0.00 0.00 46.02 44.78 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 3.85 0.31 1.61 0.01 -1.26 -5.03 113.70 109.19 3iec s SER 212 Ca 0.00 -0.46 0.05 0.00 1.31 0.00 0.00 55.95 56.86 3iec s SER 212 Cb 0.00 -1.62 0.71 0.00 0.21 0.00 0.00 66.02 65.31 3iec s SER 212 CO 0.00 0.03 1.80 -0.65 0.41 0.00 0.00 173.24 174.84 3iec h PRO 213 N 7.69 0.79 0.00 12.44 0.11 -1.99 -0.62 132.00 150.42 3iec h PRO 213 Ca -0.38 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3iec h PRO 213 Cb 1.17 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3iec h PRO 213 CO 0.60 0.52 0.00 -1.00 -0.21 0.00 0.00 178.00 177.91 3iec h PRO 214 N 0.82 0.00 -0.01 1.05 0.13 -1.97 -2.86 132.00 129.15 3iec h PRO 214 Ca 0.54 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.67 3iec h PRO 214 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 3iec h PRO 214 CO -0.32 0.00 -0.33 0.66 -0.23 0.00 0.00 178.00 177.78 3iec n TYR 215 N -2.84 0.00 -2.71 1.56 4.02 -0.30 -4.71 117.16 112.18 3iec n TYR 215 Ca 0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.49 3iec n TYR 215 Cb 0.27 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.54 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 -1.93 3.28 0.47 -0.72 0.00 -0.83 -3.65 121.76 118.39 3iec s ALA 216 Ca 0.14 0.61 -0.23 0.00 0.00 0.00 0.00 51.96 52.48 3iec s ALA 216 Cb 0.14 -3.27 -0.07 0.00 0.00 0.00 0.00 23.12 19.92 3iec s ALA 216 CO 0.41 0.01 1.20 0.00 0.00 0.00 0.00 175.76 177.38 3iec s ALA 217 N -0.31 2.95 0.32 0.00 0.00 -1.26 -4.91 121.76 118.55 3iec s ALA 217 Ca 0.46 1.01 0.05 0.00 0.00 0.00 0.00 51.96 53.48 3iec s ALA 217 Cb -0.25 -3.42 0.69 0.00 0.00 0.00 0.00 23.12 20.15 3iec s ALA 217 CO 0.31 -0.79 1.85 -1.00 0.00 0.00 0.00 175.76 176.14 3iec h PRO 218 N 1.96 0.81 0.00 0.00 0.13 -1.89 -1.17 132.00 131.84 3iec h PRO 218 Ca -0.50 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 3iec h PRO 218 Cb 1.26 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.20 3iec h PRO 218 CO 0.60 0.54 0.00 1.05 -0.23 0.00 0.00 178.00 179.96 3iec h GLU 219 N 0.84 0.00 0.16 0.86 9.09 -1.91 -2.02 114.58 121.61 3iec h GLU 219 Ca 0.47 0.00 -0.22 0.00 0.05 0.00 0.00 59.36 59.66 3iec h GLU 219 Cb 0.60 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.73 3iec h GLU 219 CO -0.23 0.00 -0.95 -0.07 0.05 0.00 0.00 179.01 177.80 3iec h LEU 220 N 0.00 0.54 -1.63 3.06 3.38 -1.51 -1.43 115.31 117.72 3iec h LEU 220 Ca 0.00 -0.95 0.11 0.00 0.09 0.00 0.00 57.88 57.13 3iec h LEU 220 Cb 0.06 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 3iec h LEU 220 CO 0.00 1.46 0.42 -0.26 0.09 0.00 0.00 178.44 180.15 3iec h PHE 221 N -0.27 0.44 0.00 1.13 0.04 -1.45 -2.49 116.94 114.34 3iec h PHE 221 Ca -0.17 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.61 3iec h PHE 221 Cb 1.75 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 39.76 3iec h PHE 221 CO 0.18 0.20 0.00 1.96 -0.60 0.00 0.00 178.31 180.06 3iec h GLN 222 N 0.41 0.00 -3.44 1.51 4.20 -1.32 -3.47 115.11 112.99 3iec h GLN 222 Ca 0.29 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.83 3iec h GLN 222 Cb 0.60 0.00 0.07 0.00 0.30 0.00 0.00 27.48 28.45 3iec h GLN 222 CO -0.08 0.00 -0.33 0.41 -0.67 0.00 0.00 178.83 178.16 3iec n GLY 223 N 1.19 0.18 3.48 3.46 0.00 -0.94 -5.04 105.19 107.52 3iec n GLY 223 Ca 0.05 -0.23 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 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 -5.17 3.64 -0.21 1.61 1.02 -0.57 -5.06 119.74 115.01 3iec s LYS 224 Ca 0.15 -0.53 -0.42 0.00 0.02 0.00 0.00 55.97 55.19 3iec s LYS 224 Cb -0.07 -2.96 -0.19 0.00 -0.52 0.00 0.00 37.83 34.09 3iec s LYS 224 CO 0.34 0.17 1.35 1.63 -0.92 0.00 0.00 175.35 177.91 3iec n LYS 225 N 3.76 0.18 -4.25 1.68 5.02 -1.26 -4.77 118.16 118.51 3iec n LYS 225 Ca -0.17 0.06 -0.18 0.00 -2.02 0.00 0.00 58.31 56.00 3iec n LYS 225 Cb 0.52 -1.59 -0.11 0.00 -0.02 0.00 0.00 35.03 33.83 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 1.46 1.43 -0.31 2.13 -0.85 -1.12 -4.93 117.35 115.15 3iec s TYR 226 Ca 0.96 -0.57 -0.23 0.00 -0.52 0.00 0.00 57.07 56.72 3iec s TYR 226 Cb -1.32 -0.74 -0.00 0.00 0.38 0.00 0.00 41.96 40.28 3iec s TYR 226 CO 0.66 0.16 0.74 -0.51 -1.52 0.00 0.00 175.55 175.09 3iec s ASP 227 N -2.56 6.60 0.16 -0.18 1.01 -1.26 -0.73 116.67 119.72 3iec s ASP 227 Ca 0.10 0.56 -0.28 0.00 0.71 0.00 0.00 52.55 53.64 3iec s ASP 227 Cb -0.04 -2.38 -0.01 0.00 1.01 0.00 0.00 42.92 41.49 3iec s ASP 227 CO 0.03 -0.59 1.55 1.23 0.21 0.00 0.00 175.17 177.60 3iec h GLY 228 N 9.41 -0.66 0.37 0.21 0.00 -1.95 -2.95 103.07 107.50 3iec h GLY 228 Ca -0.25 0.67 0.19 0.00 0.00 0.00 0.00 47.33 47.94 3iec h GLY 228 CO 0.86 -0.09 0.58 -2.55 0.00 0.00 0.00 176.54 175.35 3iec h PRO 229 N -0.18 0.45 0.00 4.80 0.10 -1.94 -1.68 132.00 133.56 3iec h PRO 229 Ca 0.16 -0.03 0.00 0.00 0.10 0.00 0.00 66.00 66.24 3iec h PRO 229 Cb 0.53 -0.10 0.00 0.00 0.10 0.00 0.00 31.00 31.53 3iec h PRO 229 CO -0.77 0.30 0.00 1.05 0.10 0.00 0.00 178.00 178.68 3iec h GLU 230 N 0.47 0.00 -0.55 1.05 9.09 -1.90 -1.64 114.58 121.11 3iec h GLU 230 Ca 0.46 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.77 3iec h GLU 230 Cb 1.05 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.13 3iec h GLU 230 CO -0.19 0.00 -0.06 0.28 0.05 0.00 0.00 179.01 179.09 3iec h VAL 231 N 0.00 1.27 -0.25 -1.06 2.07 -1.43 -2.05 116.25 114.78 3iec h VAL 231 Ca 0.00 -1.20 -0.09 0.00 0.82 0.00 0.00 66.70 66.23 3iec h VAL 231 Cb 0.55 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 3iec h VAL 231 CO 0.00 0.43 -0.22 0.44 0.02 0.00 0.00 177.57 178.24 3iec h ASP 232 N 0.88 0.46 -0.44 0.57 3.32 -1.39 -2.93 116.42 116.89 3iec h ASP 232 Ca 0.15 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3iec h ASP 232 Cb 0.62 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 3iec h ASP 232 CO 0.04 0.69 0.28 0.58 -1.72 0.00 0.00 179.24 179.11 3iec h VAL 233 N 0.42 1.13 0.27 -1.35 2.07 -0.99 -1.67 116.25 116.13 3iec h VAL 233 Ca 0.07 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 3iec h VAL 233 Cb 0.62 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 3iec h VAL 233 CO 0.04 0.13 -0.14 -0.25 0.02 0.00 0.00 177.57 177.37 3iec h TRP 234 N 0.60 -0.35 -0.81 1.57 2.91 -1.35 -2.67 115.95 115.85 3iec h TRP 234 Ca 0.16 -0.01 0.16 0.00 1.13 0.00 0.00 58.89 60.33 3iec h TRP 234 Cb -0.04 0.12 -0.06 0.00 -0.51 0.00 0.00 29.16 28.67 3iec h TRP 234 CO -0.04 -0.22 0.54 0.77 -1.03 0.00 0.00 178.44 178.46 3iec h SER 235 N -0.37 0.44 -0.23 2.65 0.02 -1.39 -0.81 113.55 113.86 3iec h SER 235 Ca -0.03 0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 3iec h SER 235 Cb 0.29 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 3iec h SER 235 CO 0.05 0.22 -0.10 -0.07 -1.14 0.00 0.00 176.83 175.80 3iec h LEU 236 N 0.47 0.60 -0.71 5.07 -0.00 -0.97 -0.72 115.31 119.04 3iec h LEU 236 Ca 0.40 -0.16 -0.03 0.00 -0.00 0.00 0.00 57.88 58.10 3iec h LEU 236 Cb 0.89 -0.16 -0.03 0.00 -0.00 0.00 0.00 40.66 41.35 3iec h LEU 236 CO -0.15 0.73 0.34 1.23 -0.00 0.00 0.00 178.44 180.60 3iec h GLY 237 N 0.95 1.11 1.00 0.83 0.00 -0.93 -0.29 103.07 105.74 3iec h GLY 237 Ca 0.10 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 3iec h GLY 237 CO 0.03 0.52 0.35 -2.08 0.00 0.00 0.00 176.54 175.36 3iec h VAL 238 N 1.00 1.22 -0.33 4.60 2.07 -1.11 -1.53 116.25 122.17 3iec h VAL 238 Ca 0.25 -0.57 0.01 0.00 0.82 0.00 0.00 66.70 67.21 3iec h VAL 238 Cb 0.12 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 3iec h VAL 238 CO -0.03 0.24 0.20 0.40 0.02 0.00 0.00 177.57 178.40 3iec h ILE 239 N 0.92 1.04 -0.34 4.57 2.04 -0.94 -1.34 117.51 123.45 3iec h ILE 239 Ca 0.23 -0.14 0.06 0.00 1.00 0.00 0.00 64.86 66.02 3iec h ILE 239 Cb 0.07 0.60 -0.06 0.00 -0.74 0.00 0.00 36.82 36.70 3iec h ILE 239 CO -0.03 0.07 -0.03 0.25 0.00 0.00 0.00 178.15 178.41 3iec h LEU 240 N 0.41 -0.20 -0.58 1.44 6.46 -0.69 0.42 115.31 122.57 3iec h LEU 240 Ca 0.13 0.09 0.00 0.00 -0.12 0.00 0.00 57.88 57.98 3iec h LEU 240 Cb -0.01 0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 40.06 3iec h LEU 240 CO -0.05 -0.06 0.38 0.22 -0.62 0.00 0.00 178.44 178.30 3iec h TYR 241 N 0.06 0.74 -0.66 1.25 5.03 -1.07 -2.42 116.97 119.90 3iec h TYR 241 Ca 0.17 0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.45 3iec h TYR 241 Cb 0.24 -0.25 -0.03 0.00 1.55 0.00 0.00 36.73 38.24 3iec h TYR 241 CO -0.27 0.47 0.24 1.15 -1.32 0.00 0.00 178.16 178.44 3iec h THR 242 N 0.79 1.24 -0.59 1.81 2.02 -0.75 -1.47 112.91 115.97 3iec h THR 242 Ca 0.21 -0.79 -0.04 0.00 0.77 0.00 0.00 66.41 66.56 3iec h THR 242 Cb -0.08 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 66.82 3iec h THR 242 CO -0.05 0.31 0.21 -0.07 0.37 0.00 0.00 175.52 176.30 3iec h LEU 243 N 0.95 0.83 0.06 2.58 3.38 -0.56 0.15 115.31 122.69 3iec h LEU 243 Ca 0.22 -0.19 -0.24 0.00 0.09 0.00 0.00 57.88 57.76 3iec h LEU 243 Cb 0.24 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 3iec h LEU 243 CO -0.01 0.79 -1.13 0.58 0.09 0.00 0.00 178.44 178.76 3iec h VAL 244 N 0.82 1.60 0.00 1.22 2.07 -1.30 -0.95 116.25 119.70 3iec h VAL 244 Ca 0.19 -3.25 -0.24 0.00 0.82 0.00 0.00 66.70 64.23 3iec h VAL 244 Cb 0.24 2.88 -0.04 0.00 -1.52 0.00 0.00 31.29 32.84 3iec h VAL 244 CO -0.01 0.93 -2.07 -1.54 0.02 0.00 0.00 177.57 174.90 3iec n SER 245 N -3.42 0.90 0.00 0.57 3.41 -0.57 -4.48 113.62 110.03 3iec n SER 245 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 3iec n SER 245 Cb 0.98 1.11 0.00 0.00 -0.26 0.00 0.00 64.21 66.04 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 1.87 0.64 3.32 5.00 0.00 0.51 -4.74 105.19 111.79 3iec n GLY 246 Ca -0.22 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.28 1.91 0.02 1.61 0.01 -1.25 -4.94 113.70 108.78 3iec s SER 247 Ca 0.00 -1.18 -0.18 0.00 1.31 0.00 0.00 55.95 55.91 3iec s SER 247 Cb 0.00 -0.01 -0.06 0.00 0.21 0.00 0.00 66.02 66.16 3iec s SER 247 CO 0.00 -0.46 0.50 -0.76 0.41 0.00 0.00 173.24 172.93 3iec s LEU 248 N -3.29 4.47 0.19 2.44 1.43 -1.26 -3.68 118.68 118.98 3iec s LEU 248 Ca 0.26 1.10 0.03 0.00 -1.03 0.00 0.00 54.13 54.49 3iec s LEU 248 Cb 0.05 -2.76 0.08 0.00 0.03 0.00 0.00 46.19 43.59 3iec s LEU 248 CO 0.07 0.25 1.44 1.55 0.23 0.00 0.00 176.35 179.90 3iec h PRO 249 N 4.92 0.22 -4.83 1.29 0.13 -1.92 -3.43 132.00 128.39 3iec h PRO 249 Ca -0.49 -0.20 -0.63 0.00 -0.87 0.00 0.00 66.00 63.80 3iec h PRO 249 Cb 1.21 0.05 -0.36 0.00 0.13 0.00 0.00 31.00 32.04 3iec h PRO 249 CO 0.64 0.89 -0.84 -0.06 -0.23 0.00 0.00 178.00 178.40 3iec s PHE 250 N -3.41 2.42 0.11 1.56 0.08 -1.26 -4.74 117.98 112.75 3iec s PHE 250 Ca -0.03 -1.40 -0.06 0.00 0.12 0.00 0.00 56.93 55.55 3iec s PHE 250 Cb 0.11 -1.73 0.02 0.00 -0.57 0.00 0.00 43.02 40.85 3iec s PHE 250 CO 0.82 -0.73 0.30 -3.47 -0.10 0.00 0.00 175.22 172.04 3iec n ASP 251 N 4.71 -0.72 -2.90 1.36 -0.08 -1.26 -4.72 116.55 112.93 3iec n ASP 251 Ca -0.19 -1.46 0.02 0.00 -1.51 0.00 0.00 54.79 51.65 3iec n ASP 251 Cb 0.50 1.19 0.01 0.00 2.34 0.00 0.00 41.12 45.16 3iec n ASP 251 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3iec n GLY 252 N -0.21 0.32 0.22 0.27 0.00 -1.26 -4.32 105.19 100.20 3iec n GLY 252 Ca -0.02 -0.97 0.10 0.00 0.00 0.00 0.00 46.02 45.13 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 0.00 -3.78 1.61 5.75 -2.00 -3.46 115.11 113.23 3iec h GLN 253 Ca -0.14 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.28 3iec h GLN 253 Cb 0.77 0.00 -0.11 0.00 1.07 0.00 0.00 27.48 29.21 3iec h GLN 253 CO 0.20 0.20 -0.22 0.54 -2.65 0.00 0.00 178.83 176.90 3iec s ASN 254 N -6.15 -0.04 0.49 -0.69 2.20 -1.26 -5.04 114.94 104.45 3iec s ASN 254 Ca 0.02 -0.89 0.16 0.00 -0.94 0.00 0.00 52.86 51.21 3iec s ASN 254 Cb 0.09 0.51 1.20 0.00 -2.00 0.00 0.00 41.25 41.05 3iec s ASN 254 CO 0.64 -1.01 2.08 -0.07 -2.94 0.00 0.00 177.10 175.80 3iec h LEU 255 N 2.39 0.13 0.05 3.54 4.07 -1.99 -1.59 115.31 121.92 3iec h LEU 255 Ca -0.29 -0.00 0.02 0.00 0.08 0.00 0.00 57.88 57.69 3iec h LEU 255 Cb 1.24 -0.03 -0.03 0.00 1.08 0.00 0.00 40.66 42.92 3iec h LEU 255 CO 0.42 0.09 -0.19 0.11 -1.08 0.00 0.00 178.44 177.79 3iec h LYS 256 N 0.15 -0.32 -0.52 1.13 1.57 -1.98 0.14 116.57 116.74 3iec h LYS 256 Ca 0.12 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 3iec h LYS 256 Cb 0.29 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 3iec h LYS 256 CO -0.02 -0.21 0.25 0.93 -0.57 0.00 0.00 179.45 179.83 3iec h GLU 257 N -0.33 0.75 0.27 3.15 5.08 -1.71 -2.06 114.58 119.73 3iec h GLU 257 Ca 0.04 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3iec h GLU 257 Cb 0.38 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 3iec h GLU 257 CO -0.14 0.62 -0.17 1.25 -1.00 0.00 0.00 179.01 179.57 3iec h LEU 258 N 0.70 -0.42 -0.60 1.33 5.85 -1.05 -1.47 115.31 119.65 3iec h LEU 258 Ca 0.18 0.03 0.12 0.00 0.84 0.00 0.00 57.88 59.05 3iec h LEU 258 Cb 0.11 0.12 -0.12 0.00 0.37 0.00 0.00 40.66 41.15 3iec h LEU 258 CO -0.02 -0.27 -0.19 -0.09 -0.34 0.00 0.00 178.44 177.53 3iec h ARG 259 N -0.42 -0.04 -0.46 1.25 2.43 -0.63 -0.45 114.38 116.06 3iec h ARG 259 Ca -0.03 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.04 3iec h ARG 259 Cb 0.35 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 3iec h ARG 259 CO 0.03 -0.02 -0.14 1.49 -1.51 0.00 0.00 179.97 179.81 3iec h GLU 260 N -0.04 0.86 -0.55 0.20 4.57 -1.08 -0.59 114.58 117.96 3iec h GLU 260 Ca 0.28 -0.31 -0.08 0.00 -1.18 0.00 0.00 59.36 58.07 3iec h GLU 260 Cb 0.47 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.98 3iec h GLU 260 CO -0.64 0.95 0.03 0.00 -1.18 0.00 0.00 179.01 178.17 3iec h ARG 261 N 0.77 0.91 -0.11 1.92 3.08 -0.63 0.64 114.38 120.96 3iec h ARG 261 Ca 0.12 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 3iec h ARG 261 Cb 0.66 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 3iec h ARG 261 CO 0.05 0.89 0.00 0.28 -1.07 0.00 0.00 179.97 180.12 3iec h VAL 262 N 0.85 1.25 -0.56 2.04 2.07 -0.61 -1.11 116.25 120.18 3iec h VAL 262 Ca 0.16 -0.80 -0.02 0.00 0.82 0.00 0.00 66.70 66.86 3iec h VAL 262 Cb 0.46 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.77 3iec h VAL 262 CO 0.02 0.23 0.25 -0.07 0.02 0.00 0.00 177.57 178.02 3iec h LEU 263 N -0.07 0.71 -1.12 2.57 3.38 -0.95 -1.17 115.31 118.67 3iec h LEU 263 Ca 0.03 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.84 3iec h LEU 263 Cb 0.35 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 3iec h LEU 263 CO 0.01 0.62 -0.43 0.03 0.09 0.00 0.00 178.44 178.76 3iec h ARG 264 N 0.78 0.02 -0.10 1.13 3.08 -0.79 -3.47 114.38 115.04 3iec h ARG 264 Ca 0.19 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.19 3iec h ARG 264 Cb 0.11 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 3iec h ARG 264 CO -0.02 0.45 -0.04 0.41 -1.07 0.00 0.00 179.97 179.70 3iec n GLY 265 N -0.28 0.55 3.73 0.04 0.00 -0.43 -5.02 105.19 103.79 3iec n GLY 265 Ca -0.02 -0.50 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.44 2.97 0.12 1.61 -0.14 -1.25 -4.98 119.74 116.64 3iec s LYS 266 Ca 0.00 -0.49 -0.11 0.00 -1.36 0.00 0.00 55.97 54.01 3iec s LYS 266 Cb 0.00 -2.80 0.01 0.00 -1.68 0.00 0.00 37.83 33.36 3iec s LYS 266 CO 0.00 0.66 0.29 1.52 -0.76 0.00 0.00 175.35 177.05 3iec s TYR 267 N -1.08 0.09 -0.14 3.18 -0.85 -1.26 -4.91 117.35 112.38 3iec s TYR 267 Ca 0.19 -0.48 -0.05 0.00 -0.52 0.00 0.00 57.07 56.21 3iec s TYR 267 Cb -0.12 0.05 -0.04 0.00 0.38 0.00 0.00 41.96 42.24 3iec s TYR 267 CO 0.10 -0.65 0.05 0.50 -1.52 0.00 0.00 175.55 174.03 3iec s ARG 268 N -3.87 3.53 -0.39 -3.49 3.52 -1.26 -5.07 118.95 111.93 3iec s ARG 268 Ca 0.07 -0.34 -0.20 0.00 -0.13 0.00 0.00 55.73 55.13 3iec s ARG 268 Cb 0.03 -3.05 0.01 0.00 -1.56 0.00 0.00 34.95 30.39 3iec s ARG 268 CO -0.08 0.50 0.64 0.42 -0.81 0.00 0.00 175.30 175.96 3iec s ILE 269 N -0.30 4.87 0.58 4.11 -1.09 -1.26 -5.04 121.20 123.08 3iec s ILE 269 Ca 0.08 0.39 -0.20 0.00 -2.23 0.00 0.00 60.65 58.69 3iec s ILE 269 Cb -0.12 -4.13 -0.04 0.00 -1.58 0.00 0.00 42.46 36.60 3iec s ILE 269 CO 0.02 -0.43 1.27 -2.84 -1.23 0.00 0.00 174.94 171.73 3iec s PRO 270 N 2.75 2.96 0.44 2.79 0.02 -1.26 -4.90 135.00 137.80 3iec s PRO 270 Ca 0.24 2.00 0.16 0.00 0.02 0.00 0.00 61.00 63.42 3iec s PRO 270 Cb -0.14 -2.03 1.09 0.00 0.02 0.00 0.00 34.50 33.43 3iec s PRO 270 CO 0.17 -1.26 1.94 0.35 -0.33 0.00 0.00 177.00 177.86 3iec h PHE 271 N 1.04 0.43 0.00 6.54 3.57 -2.03 -2.38 116.94 124.10 3iec h PHE 271 Ca -0.51 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.01 3iec h PHE 271 Cb 1.31 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.91 3iec h PHE 271 CO 0.45 0.17 0.00 2.48 -2.23 0.00 0.00 178.31 179.18 3iec n TYR 272 N -4.46 0.86 -2.09 0.41 0.18 -1.26 -4.86 117.16 105.94 3iec n TYR 272 Ca 0.13 0.26 -0.42 0.00 1.88 0.00 0.00 57.90 59.76 3iec n TYR 272 Cb 0.52 -0.93 -0.03 0.00 -0.38 0.00 0.00 39.34 38.52 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 -3.13 4.30 0.62 -3.48 1.75 -0.90 -4.98 119.30 113.49 3iec s MET 273 Ca 0.10 2.21 -0.18 0.00 -1.25 0.00 0.00 55.69 56.57 3iec s MET 273 Cb 0.12 -3.16 -0.02 0.00 2.84 0.00 0.00 34.83 34.62 3iec s MET 273 CO 0.55 -0.39 1.19 -1.54 -0.65 0.00 0.00 175.02 174.18 3iec s SER 274 N 0.53 5.05 0.37 1.11 1.04 -1.26 -4.84 113.70 115.69 3iec s SER 274 Ca 0.60 2.31 0.10 0.00 0.48 0.00 0.00 55.95 59.43 3iec s SER 274 Cb -0.40 -2.59 0.72 0.00 0.10 0.00 0.00 66.02 63.85 3iec s SER 274 CO 0.39 -1.68 1.86 0.71 0.98 0.00 0.00 173.24 175.50 3iec h THR 275 N 0.58 1.21 -0.21 2.02 1.35 -1.97 -1.18 112.91 114.71 3iec h THR 275 Ca -0.49 -1.00 -0.00 0.00 -0.55 0.00 0.00 66.41 64.37 3iec h THR 275 Cb 1.29 1.38 -0.01 0.00 -1.73 0.00 0.00 68.15 69.08 3iec h THR 275 CO 0.54 0.30 0.12 0.44 -0.25 0.00 0.00 175.52 176.67 3iec h ASP 276 N 0.18 0.26 -0.47 5.36 3.32 -1.99 0.19 116.42 123.27 3iec h ASP 276 Ca 0.03 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 3iec h ASP 276 Cb 0.50 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 3iec h ASP 276 CO 0.03 0.26 0.28 0.00 -1.72 0.00 0.00 179.24 178.10 3iec h GLU 278 N 0.62 0.59 -0.58 0.00 4.81 -1.03 -0.38 114.58 118.62 3iec h GLU 278 Ca 0.17 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 3iec h GLU 278 Cb 0.00 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.22 3iec h GLU 278 CO -0.03 0.39 0.34 -0.91 -0.73 0.00 0.00 179.01 178.07 3iec h ASN 279 N 0.61 0.72 -0.22 1.04 2.35 -0.09 -2.69 115.58 117.29 3iec h ASN 279 Ca 0.25 -0.08 0.03 0.00 -0.55 0.00 0.00 56.30 55.95 3iec h ASN 279 Cb 0.11 -0.18 -0.03 0.00 0.05 0.00 0.00 38.32 38.27 3iec h ASN 279 CO -0.14 0.58 0.03 0.25 -1.65 0.00 0.00 177.43 176.50 3iec h LEU 280 N 0.79 -0.01 -1.12 1.61 6.46 -0.55 -2.76 115.31 119.74 3iec h LEU 280 Ca 0.21 0.04 0.13 0.00 -0.12 0.00 0.00 57.88 58.14 3iec h LEU 280 Cb 0.01 0.06 -0.08 0.00 -0.73 0.00 0.00 40.66 39.92 3iec h LEU 280 CO -0.04 0.02 0.61 -0.07 -0.62 0.00 0.00 178.44 178.34 3iec h LEU 281 N 0.11 0.82 -0.80 2.25 3.38 -0.78 0.93 115.31 121.23 3iec h LEU 281 Ca 0.10 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3iec h LEU 281 Cb 0.11 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3iec h LEU 281 CO -0.14 0.43 0.00 0.11 0.09 0.00 0.00 178.44 178.92 3iec h LYS 282 N 0.88 0.00 0.00 1.13 1.57 -1.18 -1.18 116.57 117.78 3iec h LYS 282 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 3iec h LYS 282 Cb 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 3iec h LYS 282 CO -0.24 0.00 -0.16 0.87 -0.57 0.00 0.00 179.45 179.35 3iec h LYS 283 N 0.00 0.00 0.00 3.15 1.57 -0.76 -3.38 116.57 117.15 3iec h LYS 283 Ca 0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.52 3iec h LYS 283 Cb 0.35 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.62 3iec h LYS 283 CO 0.00 0.00 -1.69 1.19 -0.57 0.00 0.00 179.45 178.38 3iec n PHE 284 N -2.64 0.37 -2.58 -1.35 3.72 -0.55 -3.59 117.46 110.84 3iec n PHE 284 Ca 0.04 0.16 -0.43 0.00 -0.05 0.00 0.00 57.45 57.17 3iec n PHE 284 Cb 0.48 -0.90 0.01 0.00 -0.94 0.00 0.00 39.48 38.13 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 -4.38 6.46 -4.32 4.37 4.77 -0.59 -4.32 117.00 118.99 3iec n LEU 285 Ca -0.36 -4.79 -0.32 0.00 -0.03 0.00 0.00 56.01 50.51 3iec n LEU 285 Cb 0.69 -1.44 -0.15 0.00 -2.33 0.00 0.00 43.42 40.19 3iec n LEU 285 CO 0.11 1.41 -0.51 -0.63 -1.33 0.00 0.00 177.39 176.45 3iec s ILE 286 N -0.37 2.55 0.18 -0.08 1.01 -1.26 -4.87 121.20 118.35 3iec s ILE 286 Ca 0.37 -0.86 -0.10 0.00 0.00 0.00 0.00 60.65 60.06 3iec s ILE 286 Cb 0.07 -2.01 0.07 0.00 0.01 0.00 0.00 42.46 40.61 3iec s ILE 286 CO 0.03 0.55 1.68 -0.07 0.00 0.00 0.00 174.94 177.13 3iec h LEU 287 N 6.38 0.95 -8.77 2.97 3.38 -1.93 -3.40 115.31 114.89 3iec h LEU 287 Ca -0.28 -0.25 -0.56 0.00 0.09 0.00 0.00 57.88 56.88 3iec h LEU 287 Cb 1.20 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 41.63 3iec h LEU 287 CO 0.51 0.96 0.93 0.21 0.09 0.00 0.00 178.44 181.13 3iec s ASN 288 N -6.36 6.66 0.35 -0.43 3.04 -1.26 -4.83 114.94 112.11 3iec s ASN 288 Ca -0.12 0.61 0.04 0.00 0.04 0.00 0.00 52.86 53.42 3iec s ASN 288 Cb 0.13 -2.55 0.63 0.00 -1.54 0.00 0.00 41.25 37.93 3iec s ASN 288 CO 0.83 -1.20 1.94 1.55 -3.04 0.00 0.00 177.10 177.17 3iec h PRO 289 N 9.15 0.64 -0.24 0.43 0.13 -1.97 0.34 132.00 140.48 3iec h PRO 289 Ca -0.23 -0.09 0.07 0.00 -0.87 0.00 0.00 66.00 64.88 3iec h PRO 289 Cb 1.06 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.07 3iec h PRO 289 CO 1.11 0.54 0.36 0.77 -0.23 0.00 0.00 178.00 180.55 3iec h SER 290 N 0.64 0.00 -0.51 1.44 0.02 -1.96 -2.37 113.55 110.81 3iec h SER 290 Ca 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3iec h SER 290 Cb 0.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.68 3iec h SER 290 CO -0.01 0.00 0.00 1.17 -1.14 0.00 0.00 176.83 176.85 3iec n LYS 291 N -3.46 3.14 -3.71 3.45 4.81 0.12 -4.90 118.16 117.62 3iec n LYS 291 Ca 0.03 -2.56 -0.36 0.00 -0.87 0.00 0.00 58.31 54.55 3iec n LYS 291 Cb 0.49 -1.61 -0.07 0.00 0.02 0.00 0.00 35.03 33.86 3iec n LYS 291 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 3iec s ARG 292 N -1.53 3.93 0.84 1.64 0.52 -0.89 -4.92 118.95 118.53 3iec s ARG 292 Ca 0.40 -0.05 -0.10 0.00 -0.52 0.00 0.00 55.73 55.46 3iec s ARG 292 Cb 0.25 -3.32 0.10 0.00 0.52 0.00 0.00 34.95 32.49 3iec s ARG 292 CO 0.21 0.49 1.11 0.20 0.02 0.00 0.00 175.30 177.33 3iec s GLY 293 N -0.23 1.68 0.60 -3.53 0.00 -1.24 -5.01 107.32 99.60 3iec s GLY 293 Ca 0.14 0.37 -0.12 0.00 0.00 0.00 0.00 44.72 45.11 3iec s GLY 293 CO 0.03 0.75 1.02 -0.51 0.00 0.00 0.00 173.10 174.40 3iec s THR 294 N -2.80 4.63 0.33 0.90 -4.23 -1.26 -4.89 115.64 108.31 3iec s THR 294 Ca 0.63 0.94 0.01 0.00 -1.18 0.00 0.00 61.69 62.09 3iec s THR 294 Cb -0.19 -3.81 0.23 0.00 1.34 0.00 0.00 72.50 70.06 3iec s THR 294 CO 0.57 -1.04 1.95 -0.07 -0.54 0.00 0.00 174.62 175.49 3iec h LEU 295 N -0.08 0.74 -0.96 4.79 3.38 -1.97 -0.63 115.31 120.59 3iec h LEU 295 Ca -0.45 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.41 3iec h LEU 295 Cb 1.19 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.73 3iec h LEU 295 CO 0.62 0.61 0.15 -0.08 0.09 0.00 0.00 178.44 179.82 3iec h GLU 296 N 0.84 0.91 0.10 1.13 4.81 -1.96 -0.18 114.58 120.22 3iec h GLU 296 Ca 0.21 -0.19 -0.27 0.00 -0.13 0.00 0.00 59.36 58.98 3iec h GLU 296 Cb 0.04 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 29.29 3iec h GLU 296 CO -0.03 0.81 -1.16 -0.56 -0.73 0.00 0.00 179.01 177.33 3iec h GLN 297 N 0.88 0.42 -0.12 1.92 3.07 -1.88 -3.22 115.11 116.18 3iec h GLN 297 Ca 0.19 -0.58 0.03 0.00 0.09 0.00 0.00 58.65 58.39 3iec h GLN 297 Cb 0.30 0.19 -0.00 0.00 0.08 0.00 0.00 27.48 28.05 3iec h GLN 297 CO -0.00 1.24 0.13 0.82 0.09 0.00 0.00 178.83 181.10 3iec h ILE 298 N 0.18 0.52 0.00 1.86 2.04 -0.56 -1.04 117.51 120.51 3iec h ILE 298 Ca -0.14 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 3iec h ILE 298 Cb 1.84 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 38.82 3iec h ILE 298 CO 0.20 0.00 -0.04 0.24 0.00 0.00 0.00 178.15 178.55 3iec h MET 299 N 0.00 0.00 -0.00 2.37 2.86 -1.05 -2.24 114.93 116.87 3iec h MET 299 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 3iec h MET 299 Cb 0.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.97 3iec h MET 299 CO -0.00 0.04 -0.03 1.63 1.06 0.00 0.00 176.91 179.62 3iec n LYS 300 N -3.85 0.90 -2.00 1.72 5.02 -0.39 -4.34 118.16 115.22 3iec n LYS 300 Ca -0.03 -0.18 -0.38 0.00 -2.02 0.00 0.00 58.31 55.71 3iec n LYS 300 Cb 0.13 -1.50 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 -2.22 5.84 0.13 4.39 -1.08 -0.84 -4.90 116.67 117.98 3iec s ASP 301 Ca 0.39 2.60 -0.26 0.00 -0.52 0.00 0.00 52.55 54.75 3iec s ASP 301 Cb 0.21 -2.63 -0.05 0.00 -1.46 0.00 0.00 42.92 39.00 3iec s ASP 301 CO 0.41 -1.17 1.62 -0.09 0.52 0.00 0.00 175.17 176.46 3iec h ARG 302 N 1.98 -0.41 -0.59 4.34 2.43 -1.92 -2.40 114.38 117.80 3iec h ARG 302 Ca -0.50 0.03 0.05 0.00 -0.81 0.00 0.00 59.98 58.75 3iec h ARG 302 Cb 1.27 0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.86 3iec h ARG 302 CO 0.60 -0.27 0.32 2.35 -1.51 0.00 0.00 179.97 181.45 3iec h TRP 303 N -0.42 0.58 -0.86 2.20 7.01 -1.92 -1.65 115.95 120.88 3iec h TRP 303 Ca 0.07 0.02 0.19 0.00 2.11 0.00 0.00 58.89 61.28 3iec h TRP 303 Cb 0.52 -0.18 -0.06 0.00 -2.10 0.00 0.00 29.16 27.35 3iec h TRP 303 CO -0.33 0.28 0.57 0.52 -2.79 0.00 0.00 178.44 176.70 3iec h MET 304 N 0.60 0.35 -0.39 2.65 2.86 -1.79 -2.99 114.93 116.23 3iec h MET 304 Ca 0.26 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 3iec h MET 304 Cb 0.16 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 31.74 3iec h MET 304 CO -0.17 0.23 0.00 0.09 1.06 0.00 0.00 176.91 178.13 3iec n ASN 305 N -4.48 3.06 -4.69 1.22 3.02 -0.67 -4.90 115.26 107.83 3iec n ASN 305 Ca 0.18 -2.02 -0.42 0.00 -0.03 0.00 0.00 54.58 52.29 3iec n ASN 305 Cb 0.68 -0.27 -0.03 0.00 -0.61 0.00 0.00 39.78 39.55 3iec n ASN 305 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3iec s VAL 306 N -1.04 2.78 0.00 2.41 1.01 -0.94 -0.55 120.40 124.07 3iec s VAL 306 Ca 0.26 0.22 0.00 0.00 0.00 0.00 0.00 61.98 62.46 3iec s VAL 306 Cb 0.14 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.38 3iec s VAL 306 CO 0.18 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.88 3iec n GLY 307 N 4.17 0.92 2.58 4.51 0.00 -1.26 -4.94 105.19 111.16 3iec n GLY 307 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.00 3.16 0.05 1.61 -0.00 0.29 -4.94 115.22 113.38 3iec n HIS 308 Ca 0.00 -3.27 -0.12 0.00 -0.00 0.00 0.00 57.72 54.33 3iec n HIS 308 Cb 0.00 -0.20 -0.08 0.00 -0.00 0.00 0.00 29.99 29.71 3iec n HIS 308 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.34 177.27 3iec h GLU 309 N 2.72 -0.04 -0.87 -0.41 3.07 -1.93 -2.53 114.58 114.59 3iec h GLU 309 Ca 0.21 0.00 -0.50 0.00 -0.50 0.00 0.00 59.36 58.58 3iec h GLU 309 Cb 0.88 0.01 -0.27 0.00 -0.84 0.00 0.00 28.75 28.52 3iec h GLU 309 CO 0.79 0.06 0.50 -0.25 -1.40 0.00 0.00 179.01 178.71 3iec n ASP 310 N -5.07 4.50 -2.74 1.42 9.92 -1.26 -4.54 116.55 118.79 3iec n ASP 310 Ca -0.08 -3.70 -0.09 0.00 -0.53 0.00 0.00 54.79 50.40 3iec n ASP 310 Cb 0.09 -0.81 0.09 0.00 -0.64 0.00 0.00 41.12 39.85 3iec n ASP 310 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 3iec n ASP 311 N -1.07 -1.80 -4.74 -2.24 2.03 -0.97 -5.13 116.55 102.65 3iec n ASP 311 Ca 0.55 -3.10 -0.42 0.00 0.52 0.00 0.00 54.79 52.34 3iec n ASP 311 Cb 1.28 1.29 -0.01 0.00 -0.72 0.00 0.00 41.12 42.96 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 -0.07 2.52 -1.73 -0.67 2.13 -1.14 -4.79 120.64 116.90 3iec n GLU 312 Ca 0.03 0.89 -0.42 0.00 0.66 0.00 0.00 57.16 58.33 3iec n GLU 312 Cb 0.77 -2.61 -0.03 0.00 0.27 0.00 0.00 31.44 29.83 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 -0.89 4.37 0.20 4.31 2.96 -1.26 -5.00 118.68 123.37 3iec s LEU 313 Ca 0.60 2.86 0.02 0.00 -0.22 0.00 0.00 54.13 57.39 3iec s LEU 313 Cb -0.52 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 42.52 3iec s LEU 313 CO 0.55 -0.98 0.02 -0.54 -1.32 0.00 0.00 176.35 174.08 3iec s LYS 314 N 1.33 1.19 0.28 1.98 1.02 -1.26 -4.53 119.74 119.76 3iec s LYS 314 Ca 0.75 -1.59 -0.30 0.00 0.02 0.00 0.00 55.97 54.85 3iec s LYS 314 Cb -0.49 -0.29 -0.12 0.00 -0.52 0.00 0.00 37.83 36.40 3iec s LYS 314 CO 0.32 -0.16 1.53 -2.30 -0.92 0.00 0.00 175.35 173.82 3iec n PRO 315 N -0.30 2.49 -1.93 -1.68 -0.02 -1.26 -4.94 135.00 127.35 3iec n PRO 315 Ca -0.05 0.88 -0.41 0.00 -2.02 0.00 0.00 63.50 61.90 3iec n PRO 315 Cb 0.64 -2.62 -0.02 0.00 -0.02 0.00 0.00 33.50 31.48 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 -0.10 2.91 -0.26 6.00 5.04 -1.26 -5.00 117.35 124.68 3iec s TYR 316 Ca 0.64 0.98 -0.11 0.00 -2.44 0.00 0.00 57.07 56.15 3iec s TYR 316 Cb -0.54 -3.90 -0.05 0.00 0.35 0.00 0.00 41.96 37.82 3iec s TYR 316 CO 0.50 -2.92 0.18 0.08 -1.34 0.00 0.00 175.55 172.05 3iec s VAL 317 N -0.15 5.33 0.09 3.14 1.01 -1.26 -4.98 120.40 123.58 3iec s VAL 317 Ca 0.59 0.20 -0.31 0.00 0.00 0.00 0.00 61.98 62.46 3iec s VAL 317 Cb -0.44 -3.52 -0.08 0.00 0.00 0.00 0.00 36.38 32.34 3iec s VAL 317 CO 0.47 0.30 1.47 -0.70 0.00 0.00 0.00 175.10 176.63 3iec s GLU 318 N 1.40 4.27 0.47 2.72 2.12 -1.26 -4.97 118.70 123.46 3iec s GLU 318 Ca 0.08 2.15 -0.24 0.00 0.36 0.00 0.00 54.97 57.32 3iec s GLU 318 Cb -0.15 -3.35 -0.08 0.00 0.26 0.00 0.00 34.13 30.81 3iec s GLU 318 CO 0.08 -0.55 1.38 -2.30 -0.54 0.00 0.00 175.26 173.33 3iec n PRO 319 N 4.52 2.04 -2.04 4.30 -0.02 -1.26 -4.95 135.00 137.59 3iec n PRO 319 Ca 0.13 0.73 -0.38 0.00 -2.02 0.00 0.00 63.50 61.96 3iec n PRO 319 Cb 0.42 -2.57 0.01 0.00 -0.02 0.00 0.00 33.50 31.34 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 -2.68 3.94 0.70 2.45 1.43 -1.26 -4.95 118.68 118.31 3iec s LEU 320 Ca 0.64 2.52 -0.16 0.00 -1.03 0.00 0.00 54.13 56.10 3iec s LEU 320 Cb -0.45 -4.26 0.02 0.00 0.03 0.00 0.00 46.19 41.54 3iec s LEU 320 CO 0.55 -1.22 1.25 -2.84 0.23 0.00 0.00 176.35 174.32 3iec s PRO 321 N -2.79 2.25 -0.41 1.29 0.02 -1.26 -4.98 135.00 129.11 3iec s PRO 321 Ca 0.67 1.90 0.08 0.00 0.02 0.00 0.00 61.00 63.67 3iec s PRO 321 Cb -0.34 -1.83 0.25 0.00 0.02 0.00 0.00 34.50 32.60 3iec s PRO 321 CO 0.41 -1.79 0.54 -3.47 -0.33 0.00 0.00 177.00 172.36 3iec n ASP 322 N -2.43 0.49 -0.53 2.53 2.03 -1.26 -4.97 116.55 112.41 3iec n ASP 322 Ca 0.15 -2.76 0.14 0.00 0.52 0.00 0.00 54.79 52.84 3iec n ASP 322 Cb 0.49 -0.64 0.45 0.00 -0.72 0.00 0.00 41.12 40.70 3iec n ASP 322 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 3iec n TYR 323 N 1.37 0.00 -2.55 -0.67 4.01 -1.26 -4.39 117.16 113.67 3iec n TYR 323 Ca 0.22 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.76 3iec n TYR 323 Cb 0.52 -0.01 0.01 0.00 -0.31 0.00 0.00 39.34 39.55 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 0.27 2.58 -2.68 -0.72 5.02 -1.26 -4.87 118.16 116.51 3iec n LYS 324 Ca 0.18 -4.04 -0.43 0.00 -2.02 0.00 0.00 58.31 51.99 3iec n LYS 324 Cb 0.39 -1.88 -0.02 0.00 -0.02 0.00 0.00 35.03 33.50 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 -3.39 6.84 0.18 4.39 2.15 -1.26 -4.93 116.67 120.65 3iec s ASP 325 Ca 0.40 0.88 -0.14 0.00 0.43 0.00 0.00 52.55 54.12 3iec s ASP 325 Cb 0.42 -2.52 0.15 0.00 -0.30 0.00 0.00 42.92 40.66 3iec s ASP 325 CO -0.10 -0.91 1.73 -0.65 -0.17 0.00 0.00 175.17 175.06 3iec h PRO 326 N 8.30 0.24 0.24 4.34 0.11 -1.98 -0.89 132.00 142.36 3iec h PRO 326 Ca -0.21 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.89 3iec h PRO 326 Cb 1.06 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 3iec h PRO 326 CO 1.03 0.16 -0.26 -0.09 -0.21 0.00 0.00 178.00 178.62 3iec h ARG 327 N 0.24 -0.52 -0.10 1.05 2.43 -2.00 -0.18 114.38 115.30 3iec h ARG 327 Ca 0.22 0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.35 3iec h ARG 327 Cb 0.27 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 3iec h ARG 327 CO -0.28 -0.35 -0.29 0.00 -1.51 0.00 0.00 179.97 177.55 3iec h ARG 328 N -0.54 0.18 -0.24 0.20 3.08 -1.94 -2.36 114.38 112.76 3iec h ARG 328 Ca -0.00 -0.06 -0.15 0.00 0.07 0.00 0.00 59.98 59.84 3iec h ARG 328 Cb 0.51 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 3iec h ARG 328 CO -0.07 0.45 -0.46 1.15 -1.07 0.00 0.00 179.97 179.97 3iec h THR 329 N 0.16 1.30 -0.04 2.04 2.02 -0.77 -1.15 112.91 116.47 3iec h THR 329 Ca 0.02 -1.66 -0.14 0.00 0.77 0.00 0.00 66.41 65.40 3iec h THR 329 Cb 0.59 1.61 0.01 0.00 -1.74 0.00 0.00 68.15 68.63 3iec h THR 329 CO 0.04 0.52 -0.53 -0.08 0.37 0.00 0.00 175.52 175.85 3iec h GLU 330 N 0.50 0.44 -0.97 6.66 4.22 -0.88 0.73 114.58 125.27 3iec h GLU 330 Ca 0.03 -0.41 0.17 0.00 0.08 0.00 0.00 59.36 59.23 3iec h GLU 330 Cb 0.99 0.10 -0.10 0.00 0.50 0.00 0.00 28.75 30.24 3iec h GLU 330 CO 0.09 1.06 0.58 -0.07 -2.18 0.00 0.00 179.01 178.49 3iec h LEU 331 N -0.04 0.76 -0.33 1.64 3.38 -1.36 -0.55 115.31 118.81 3iec h LEU 331 Ca -0.05 0.09 -0.19 0.00 0.09 0.00 0.00 57.88 57.81 3iec h LEU 331 Cb 1.21 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.92 3iec h LEU 331 CO 0.11 0.30 -0.69 0.24 0.09 0.00 0.00 178.44 178.48 3iec h MET 332 N 0.77 0.63 -0.65 1.13 2.86 -0.89 -2.43 114.93 116.36 3iec h MET 332 Ca 0.55 -0.48 0.02 0.00 -2.06 0.00 0.00 59.70 57.72 3iec h MET 332 Cb 0.79 0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.50 3iec h MET 332 CO -0.36 1.10 0.42 0.28 1.06 0.00 0.00 176.91 179.40 3iec h VAL 333 N 0.45 1.13 -0.88 -2.22 2.07 -0.12 -0.68 116.25 116.00 3iec h VAL 333 Ca -0.03 -0.29 0.13 0.00 0.82 0.00 0.00 66.70 67.34 3iec h VAL 333 Cb 1.28 0.22 -0.09 0.00 -1.52 0.00 0.00 31.29 31.19 3iec h VAL 333 CO 0.13 0.15 0.49 0.28 0.02 0.00 0.00 177.57 178.65 3iec h SER 334 N 0.84 0.66 0.52 0.57 0.02 -1.03 0.15 113.55 115.27 3iec h SER 334 Ca 0.25 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 3iec h SER 334 Cb -0.05 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.44 3iec h SER 334 CO -0.07 0.32 0.00 0.23 -1.14 0.00 0.00 176.83 176.17 3iec n MET 335 N -4.78 0.01 -0.12 3.45 2.81 -0.76 -4.87 117.12 112.86 3iec n MET 335 Ca 0.17 0.25 0.00 0.00 -1.81 0.00 0.00 57.70 56.31 3iec n MET 335 Cb 0.38 -1.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.37 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 0.03 0.94 3.84 3.03 0.00 0.51 -5.10 105.19 108.44 3iec n GLY 336 Ca 0.04 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 3.24 0.16 1.61 2.02 -0.33 -4.98 117.35 117.06 3iec s TYR 337 Ca 0.00 1.28 0.05 0.00 -0.37 0.00 0.00 57.07 58.03 3iec s TYR 337 Cb 0.00 -2.90 -0.04 0.00 -0.40 0.00 0.00 41.96 38.62 3iec s TYR 337 CO 0.00 -1.16 0.11 0.95 -1.57 0.00 0.00 175.55 173.88 3iec s THR 338 N -3.15 4.37 0.34 -0.71 -4.23 -1.26 -3.95 115.64 107.05 3iec s THR 338 Ca 0.58 -1.11 0.06 0.00 -1.18 0.00 0.00 61.69 60.03 3iec s THR 338 Cb -0.13 -3.22 0.30 0.00 1.34 0.00 0.00 72.50 70.80 3iec s THR 338 CO 0.54 -0.09 1.89 0.03 -0.54 0.00 0.00 174.62 176.45 3iec h ARG 339 N 2.52 0.79 -0.33 3.99 3.08 -1.97 -1.86 114.38 120.59 3iec h ARG 339 Ca -0.47 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 59.44 3iec h ARG 339 Cb 1.20 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 31.06 3iec h ARG 339 CO 0.63 0.52 -0.15 0.93 -1.07 0.00 0.00 179.97 180.82 3iec h GLU 340 N 0.81 0.68 -0.09 0.04 3.07 -1.99 -1.15 114.58 115.96 3iec h GLU 340 Ca 0.42 -0.30 -0.17 0.00 -0.50 0.00 0.00 59.36 58.81 3iec h GLU 340 Cb 0.51 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 3iec h GLU 340 CO -0.19 0.89 -0.68 1.05 -1.40 0.00 0.00 179.01 178.69 3iec h GLU 341 N 0.45 0.37 -0.43 2.33 4.11 -1.93 -1.70 114.58 117.77 3iec h GLU 341 Ca 0.07 -0.28 0.03 0.00 0.07 0.00 0.00 59.36 59.25 3iec h GLU 341 Cb 0.68 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 3iec h GLU 341 CO 0.05 0.91 0.23 0.82 0.07 0.00 0.00 179.01 181.09 3iec h ILE 342 N 0.26 0.99 -0.06 -1.06 2.04 -1.30 -0.94 117.51 117.44 3iec h ILE 342 Ca -0.02 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.68 3iec h ILE 342 Cb 1.23 0.49 -0.00 0.00 -0.74 0.00 0.00 36.82 37.80 3iec h ILE 342 CO 0.11 0.08 0.00 -0.61 0.00 0.00 0.00 178.15 177.74 3iec h GLN 343 N 0.46 0.11 -0.58 2.37 4.15 -1.02 -1.73 115.11 118.87 3iec h GLN 343 Ca 0.18 -0.03 0.05 0.00 0.77 0.00 0.00 58.65 59.62 3iec h GLN 343 Cb 0.07 -0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.70 3iec h GLN 343 CO -0.12 0.37 0.31 0.22 -1.93 0.00 0.00 178.83 177.68 3iec h ASP 344 N -0.16 0.46 -0.80 -0.69 1.82 -1.28 -0.51 116.42 115.25 3iec h ASP 344 Ca 0.02 0.03 -0.02 0.00 -0.39 0.00 0.00 57.03 56.67 3iec h ASP 344 Cb 0.31 -0.06 -0.04 0.00 0.68 0.00 0.00 39.33 40.23 3iec h ASP 344 CO 0.00 0.31 0.42 0.28 -1.61 0.00 0.00 179.24 178.64 3iec h SER 345 N 0.59 1.02 0.05 2.28 0.02 -1.03 0.76 113.55 117.24 3iec h SER 345 Ca 0.26 -0.11 -0.08 0.00 -0.84 0.00 0.00 61.79 61.01 3iec h SER 345 Cb 0.15 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.43 3iec h SER 345 CO -0.16 0.84 -0.39 -0.07 -1.14 0.00 0.00 176.83 175.91 3iec h LEU 346 N 1.12 0.16 -0.68 5.07 3.38 -1.23 -0.77 115.31 122.36 3iec h LEU 346 Ca 0.28 -0.95 -0.00 0.00 0.09 0.00 0.00 57.88 57.30 3iec h LEU 346 Cb 0.06 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 3iec h LEU 346 CO -0.04 1.18 0.41 0.58 0.09 0.00 0.00 178.44 180.65 3iec h VAL 347 N -0.78 1.20 0.00 1.22 2.07 -1.13 -0.70 116.25 118.13 3iec h VAL 347 Ca -0.08 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.01 3iec h VAL 347 Cb 1.24 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 3iec h VAL 347 CO 0.03 0.20 0.00 0.61 0.02 0.00 0.00 177.57 178.44 3iec n GLY 348 N -1.16 -1.16 3.84 2.17 0.00 0.26 -4.93 105.19 104.20 3iec n GLY 348 Ca 0.06 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.41 -2.14 0.17 1.61 1.13 -0.27 -4.87 117.38 111.60 3iec n GLN 349 Ca 0.08 0.40 0.08 0.00 -1.94 0.00 0.00 57.00 55.61 3iec n GLN 349 Cb 0.22 -4.19 0.09 0.00 0.11 0.00 0.00 30.24 26.47 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 -1.93 0.00 -6.24 -1.09 3.08 -1.47 -3.48 114.38 103.25 3iec h ARG 350 Ca -0.65 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 58.92 3iec h ARG 350 Cb 1.37 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.38 3iec h ARG 350 CO 0.55 0.21 -0.75 0.66 -1.07 0.00 0.00 179.97 179.57 3iec n TYR 351 N -3.10 -2.27 -2.68 3.04 4.01 -1.26 -4.84 117.16 110.05 3iec n TYR 351 Ca 0.02 0.88 -0.08 0.00 -0.16 0.00 0.00 57.90 58.56 3iec n TYR 351 Cb 0.63 -3.93 0.04 0.00 -0.31 0.00 0.00 39.34 35.77 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 -2.80 0.67 -0.07 7.72 6.94 -1.26 -1.30 115.26 125.16 3iec n ASN 352 Ca 0.04 -1.52 0.02 0.00 -0.02 0.00 0.00 54.58 53.10 3iec n ASN 352 Cb 0.53 -0.22 0.34 0.00 -2.36 0.00 0.00 39.78 38.07 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 0.70 -0.09 -3.83 4.11 -1.94 -2.55 114.58 110.98 3iec h GLU 353 Ca -0.12 -0.06 -0.01 0.00 0.07 0.00 0.00 59.36 59.24 3iec h GLU 353 Cb 0.49 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 3iec h GLU 353 CO 0.15 0.49 0.01 0.28 0.07 0.00 0.00 179.01 180.01 3iec h VAL 354 N 0.71 1.22 -0.59 -1.06 2.07 -1.95 -2.24 116.25 114.41 3iec h VAL 354 Ca 0.19 -0.69 -0.03 0.00 0.82 0.00 0.00 66.70 66.98 3iec h VAL 354 Cb -0.02 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 3iec h VAL 354 CO -0.03 0.19 0.24 -0.03 0.02 0.00 0.00 177.57 177.96 3iec h MET 355 N -0.10 0.88 -0.04 1.57 1.85 -1.85 -2.32 114.93 114.92 3iec h MET 355 Ca 0.03 -0.16 -0.00 0.00 -0.61 0.00 0.00 59.70 58.95 3iec h MET 355 Cb 0.29 -0.14 -0.00 0.00 0.43 0.00 0.00 31.60 32.18 3iec h MET 355 CO 0.00 0.76 0.03 0.00 -0.40 0.00 0.00 176.91 177.30 3iec h ALA 356 N 1.08 0.06 -0.69 0.39 0.00 -1.40 0.06 119.26 118.76 3iec h ALA 356 Ca 0.20 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.17 3iec h ALA 356 Cb 0.20 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.91 3iec h ALA 356 CO -0.02 -0.43 0.33 1.15 0.00 0.00 0.00 179.25 180.29 3iec h THR 357 N 0.02 0.84 -0.22 0.00 2.02 -1.25 0.15 112.91 114.48 3iec h THR 357 Ca 0.02 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 3iec h THR 357 Cb 0.03 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 3iec h THR 357 CO -0.00 0.10 0.11 0.22 0.37 0.00 0.00 175.52 176.32 3iec h TYR 358 N 0.57 0.31 -0.39 3.16 3.20 -0.78 -0.73 116.97 122.32 3iec h TYR 358 Ca 0.34 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.19 3iec h TYR 358 Cb 0.36 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 3iec h TYR 358 CO -0.12 0.31 0.24 -0.07 -1.64 0.00 0.00 178.16 176.88 3iec h LEU 359 N 0.22 0.46 -1.47 2.82 3.38 -0.63 -2.87 115.31 117.23 3iec h LEU 359 Ca 0.07 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 3iec h LEU 359 Cb 0.11 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3iec h LEU 359 CO -0.01 0.37 -0.27 -0.07 0.09 0.00 0.00 178.44 178.55 3iec h LEU 360 N 0.51 0.00 -1.38 1.67 3.38 -0.45 0.19 115.31 119.23 3iec h LEU 360 Ca 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3iec h LEU 360 Cb -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 3iec h LEU 360 CO -0.03 0.27 -0.05 -0.07 0.09 0.00 0.00 178.44 178.65 3iec h LEU 361 N 0.00 0.00 0.01 1.67 3.38 -0.92 -3.15 115.31 116.30 3iec h LEU 361 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3iec h LEU 361 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3iec h LEU 361 CO 0.04 0.05 -0.12 1.23 0.09 0.00 0.00 178.44 179.73 3iec h GLY 362 N 2.03 0.07 0.08 0.83 0.00 -0.88 -3.50 103.07 101.71 3iec h GLY 362 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.19 3iec h GLY 362 CO 0.01 0.13 0.00 2.98 0.00 0.00 0.00 176.54 179.65