#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iad s HIS 126 N 0.00 0.48 -0.11 1.61 0.09 -1.26 -5.06 115.29 111.03 2iad s HIS 126 Ca 0.00 -0.81 -0.07 0.00 -0.00 0.00 0.00 55.06 54.19 2iad s HIS 126 Cb 0.00 -0.93 -0.02 0.00 -0.00 0.00 0.00 32.58 31.63 2iad s HIS 126 CO 0.00 -0.73 -0.13 0.00 -0.00 0.00 0.00 174.74 173.88 2iad h ALA 127 N 8.37 0.00 -2.57 -1.40 0.00 -2.05 -3.46 119.26 118.15 2iad h ALA 127 Ca -0.18 -0.40 -0.59 0.00 0.00 0.00 0.00 54.91 53.75 2iad h ALA 127 Cb 1.06 0.37 -0.08 0.00 0.00 0.00 0.00 17.79 19.13 2iad h ALA 127 CO 0.39 0.37 0.15 -0.08 0.00 0.00 0.00 179.25 180.08 2iad s THR 128 N -1.97 5.01 0.04 0.00 -1.32 -1.26 -4.85 115.64 111.28 2iad s THR 128 Ca -0.11 1.29 -0.01 0.00 -1.21 0.00 0.00 61.69 61.66 2iad s THR 128 Cb 0.01 -3.99 -0.04 0.00 -1.51 0.00 0.00 72.50 66.98 2iad s THR 128 CO 0.16 0.12 0.19 -1.10 -2.21 0.00 0.00 174.62 171.78 2iad s GLN 129 N 1.75 3.41 0.00 7.08 -1.52 -1.26 -5.12 119.66 124.00 2iad s GLN 129 Ca 0.32 -0.41 0.06 0.00 -1.95 0.00 0.00 55.36 53.38 2iad s GLN 129 Cb -0.16 -3.04 -0.03 0.00 -0.22 0.00 0.00 33.01 29.56 2iad s GLN 129 CO 0.12 0.63 -0.19 0.20 -0.25 0.00 0.00 175.29 175.80 2iad s GLY 130 N -2.29 1.49 0.18 3.09 0.00 -1.26 -4.96 107.32 103.58 2iad s GLY 130 Ca 0.32 -1.13 -0.30 0.00 0.00 0.00 0.00 44.72 43.61 2iad s GLY 130 CO 0.24 -0.97 1.31 0.14 0.00 0.00 0.00 173.10 173.82 2iad s VAL 131 N -0.81 3.26 0.06 1.40 1.01 -1.26 -5.00 120.40 119.07 2iad s VAL 131 Ca 0.13 1.02 -0.24 0.00 0.00 0.00 0.00 61.98 62.89 2iad s VAL 131 Cb -0.10 -3.65 -0.06 0.00 0.00 0.00 0.00 36.38 32.56 2iad s VAL 131 CO 0.03 0.14 0.73 0.28 0.00 0.00 0.00 175.10 176.28 2iad s THR 132 N 0.23 4.68 -0.22 3.92 -1.32 -1.26 -4.93 115.64 116.75 2iad s THR 132 Ca 0.57 1.57 -0.26 0.00 -1.21 0.00 0.00 61.69 62.37 2iad s THR 132 Cb -0.36 -4.08 -0.01 0.00 -1.51 0.00 0.00 72.50 66.54 2iad s THR 132 CO 0.37 0.41 0.87 0.00 -2.21 0.00 0.00 174.62 174.06 2iad s ALA 133 N -0.36 3.62 0.18 11.08 0.00 -1.26 -5.01 121.76 130.01 2iad s ALA 133 Ca 0.36 -0.03 -0.30 0.00 0.00 0.00 0.00 51.96 52.00 2iad s ALA 133 Cb -0.21 -3.32 -0.07 0.00 0.00 0.00 0.00 23.12 19.52 2iad s ALA 133 CO 0.23 -0.87 1.04 0.00 0.00 0.00 0.00 175.76 176.16 2iad s ALA 134 N 2.70 3.34 0.07 0.00 0.00 -1.26 -5.03 121.76 121.58 2iad s ALA 134 Ca 0.38 0.73 -0.14 0.00 0.00 0.00 0.00 51.96 52.93 2iad s ALA 134 Cb -0.16 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.59 2iad s ALA 134 CO 0.09 -0.10 0.47 -1.12 0.00 0.00 0.00 175.76 175.09 2iad s SER 135 N -0.27 6.80 0.86 0.00 0.01 -1.26 -5.09 113.70 114.75 2iad s SER 135 Ca 0.47 0.99 -0.07 0.00 1.31 0.00 0.00 55.95 58.65 2iad s SER 135 Cb -0.28 -2.26 0.15 0.00 0.21 0.00 0.00 66.02 63.84 2iad s SER 135 CO 0.34 0.22 0.91 -1.54 0.41 0.00 0.00 173.24 173.57 2iad n SER 136 N 1.29 0.47 -4.98 2.44 3.41 -1.26 -5.04 113.62 109.95 2iad n SER 136 Ca -0.10 -1.57 -0.18 0.00 -0.26 0.00 0.00 58.87 56.76 2iad n SER 136 Cb 0.52 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 2iad n SER 136 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2iad s HIS 137 N -2.83 2.80 0.00 7.33 2.46 -1.26 -5.20 115.29 118.59 2iad s HIS 137 Ca 0.54 -0.41 0.00 0.00 0.47 0.00 0.00 55.06 55.66 2iad s HIS 137 Cb -0.02 -2.33 0.00 0.00 -0.13 0.00 0.00 32.58 30.10 2iad s HIS 137 CO 0.37 -0.35 0.00 0.39 -2.47 0.00 0.00 174.74 172.68 2iad n GLU 4 N -1.79 0.00 -0.63 2.88 1.02 -1.26 -5.15 120.64 115.71 2iad n GLU 4 Ca 0.07 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.22 2iad n GLU 4 Cb 0.60 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 32.01 2iad n GLU 4 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2iad n ARG 5 N 0.00 -1.63 -4.14 3.49 3.00 -1.26 -5.31 116.66 110.81 2iad n ARG 5 Ca 0.00 1.27 -0.35 0.00 -0.01 0.00 0.00 57.85 58.77 2iad n ARG 5 Cb 0.00 -1.61 -0.12 0.00 0.00 0.00 0.00 32.46 30.73 2iad n ARG 5 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 2iad s HIS 6 N -4.47 3.04 0.12 -1.55 5.65 -1.26 -5.10 115.29 111.72 2iad s HIS 6 Ca 0.00 -0.41 0.07 0.00 0.25 0.00 0.00 55.06 54.96 2iad s HIS 6 Cb 0.00 -2.05 -0.04 0.00 -1.18 0.00 0.00 32.58 29.31 2iad s HIS 6 CO 0.00 -0.19 -0.16 -0.06 -0.65 0.00 0.00 174.74 173.68 2iad s PHE 7 N 0.84 1.53 0.06 3.88 0.08 -1.26 -5.12 117.98 117.99 2iad s PHE 7 Ca 0.00 -0.50 -0.04 0.00 0.12 0.00 0.00 56.93 56.52 2iad s PHE 7 Cb -0.14 -0.81 -0.02 0.00 -0.57 0.00 0.00 43.02 41.48 2iad s PHE 7 CO 0.02 0.18 0.05 0.08 -0.10 0.00 0.00 175.22 175.45 2iad s VAL 8 N -1.79 0.18 -0.04 -0.44 1.01 -1.26 -5.03 120.40 113.02 2iad s VAL 8 Ca 0.08 -1.48 -0.14 0.00 0.00 0.00 0.00 61.98 60.44 2iad s VAL 8 Cb -0.07 -1.33 0.02 0.00 0.00 0.00 0.00 36.38 35.01 2iad s VAL 8 CO 0.04 -0.82 0.31 0.68 0.00 0.00 0.00 175.10 175.31 2iad s VAL 9 N -3.62 0.04 0.01 2.92 -7.23 -1.26 -0.17 120.40 111.10 2iad s VAL 9 Ca 0.04 -0.36 0.02 0.00 -1.81 0.00 0.00 61.98 59.87 2iad s VAL 9 Cb 0.05 -0.57 -0.01 0.00 0.56 0.00 0.00 36.38 36.41 2iad s VAL 9 CO -0.09 -0.20 -0.07 -1.10 -0.31 0.00 0.00 175.10 173.33 2iad s GLN 10 N -0.93 0.53 -0.10 4.82 -0.21 0.10 -4.93 119.66 118.94 2iad s GLN 10 Ca -0.10 -0.39 0.04 0.00 0.02 0.00 0.00 55.36 54.92 2iad s GLN 10 Cb -0.05 -0.46 -0.00 0.00 1.00 0.00 0.00 33.01 33.50 2iad s GLN 10 CO 0.03 0.12 -0.23 0.12 -2.12 0.00 0.00 175.29 173.21 2iad s PHE 11 N -0.50 2.59 -0.11 0.91 5.36 -1.26 -0.37 117.98 124.59 2iad s PHE 11 Ca -0.01 -1.00 0.01 0.00 -0.96 0.00 0.00 56.93 54.97 2iad s PHE 11 Cb -0.05 -1.72 0.02 0.00 -0.34 0.00 0.00 43.02 40.93 2iad s PHE 11 CO 0.00 -0.39 -0.12 0.15 -1.46 0.00 0.00 175.22 173.40 2iad s LYS 12 N 0.33 1.90 -0.34 10.12 1.02 -0.35 -4.98 119.74 127.45 2iad s LYS 12 Ca -0.18 -0.42 -0.06 0.00 0.02 0.00 0.00 55.97 55.33 2iad s LYS 12 Cb -0.18 -1.76 0.04 0.00 -0.52 0.00 0.00 37.83 35.41 2iad s LYS 12 CO 0.09 -0.17 0.10 0.20 -0.92 0.00 0.00 175.35 174.64 2iad s GLY 13 N 1.35 1.84 -0.05 -3.33 0.00 -1.26 -0.87 107.32 105.00 2iad s GLY 13 Ca -0.00 -1.76 0.06 0.00 0.00 0.00 0.00 44.72 43.02 2iad s GLY 13 CO -0.06 0.77 -0.24 -1.83 0.00 0.00 0.00 173.10 171.74 2iad s GLU 14 N 1.39 2.34 -0.10 2.90 -1.05 0.72 -4.96 118.70 119.93 2iad s GLU 14 Ca -0.02 -0.87 0.01 0.00 -0.15 0.00 0.00 54.97 53.94 2iad s GLU 14 Cb -0.20 -2.05 0.02 0.00 -0.44 0.00 0.00 34.13 31.47 2iad s GLU 14 CO 0.02 0.41 -0.10 0.00 0.95 0.00 0.00 175.26 176.54 2iad s TYR 16 N 1.29 3.58 0.03 0.00 1.51 -0.92 -4.99 117.35 117.86 2iad s TYR 16 Ca -0.02 0.60 0.05 0.00 -1.01 0.00 0.00 57.07 56.70 2iad s TYR 16 Cb -0.14 -2.09 -0.02 0.00 -0.11 0.00 0.00 41.96 39.61 2iad s TYR 16 CO -0.04 0.60 -0.16 0.71 -1.11 0.00 0.00 175.55 175.55 2iad s TYR 17 N -0.68 1.40 -0.08 2.71 1.51 -1.26 -2.09 117.35 118.86 2iad s TYR 17 Ca 0.16 -0.33 -0.04 0.00 -1.01 0.00 0.00 57.07 55.84 2iad s TYR 17 Cb -0.13 -0.85 0.04 0.00 -0.11 0.00 0.00 41.96 40.91 2iad s TYR 17 CO 0.05 0.04 0.19 -0.08 -1.11 0.00 0.00 175.55 174.64 2iad s THR 18 N -0.72 -0.04 -0.99 -0.71 -1.32 -0.61 -4.86 115.64 106.40 2iad s THR 18 Ca 0.04 0.14 -0.01 0.00 -1.21 0.00 0.00 61.69 60.65 2iad s THR 18 Cb -0.08 -0.30 -0.01 0.00 -1.51 0.00 0.00 72.50 70.61 2iad s THR 18 CO 0.01 0.06 0.83 0.59 -2.21 0.00 0.00 174.62 173.90 2iad n ASN 19 N 4.03 -2.43 0.00 8.08 4.13 -1.26 -2.84 115.26 124.96 2iad n ASN 19 Ca -0.24 -0.53 0.00 0.00 1.68 0.00 0.00 54.58 55.50 2iad n ASN 19 Cb 0.53 -4.38 0.00 0.00 -1.54 0.00 0.00 39.78 34.40 2iad n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2iad n GLY 20 N -1.13 0.28 0.88 7.41 0.00 -1.26 -3.07 105.19 108.31 2iad n GLY 20 Ca -0.22 -0.72 0.08 0.00 0.00 0.00 0.00 46.02 45.16 2iad n GLY 20 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2iad n THR 21 N 0.00 0.87 -0.11 2.61 5.66 -1.26 -4.47 114.28 117.57 2iad n THR 21 Ca 0.00 -0.93 -0.03 0.00 -3.05 0.00 0.00 64.05 60.04 2iad n THR 21 Cb 0.00 0.61 0.20 0.00 -1.55 0.00 0.00 70.33 69.59 2iad n THR 21 CO 0.00 0.00 0.00 -0.61 -3.05 0.00 0.00 175.07 171.41 2iad h GLN 22 N 2.92 0.78 -4.03 1.09 4.15 -1.72 -3.39 115.11 114.91 2iad h GLN 22 Ca 0.00 -0.17 -0.56 0.00 0.77 0.00 0.00 58.65 58.69 2iad h GLN 22 Cb 0.81 -0.11 -0.39 0.00 0.21 0.00 0.00 27.48 28.00 2iad h GLN 22 CO 0.00 0.73 -0.78 0.50 -1.93 0.00 0.00 178.83 177.35 2iad s ARG 23 N -5.15 1.24 -0.08 1.69 3.52 -1.13 -5.05 118.95 113.99 2iad s ARG 23 Ca -0.09 -0.67 0.01 0.00 -0.13 0.00 0.00 55.73 54.84 2iad s ARG 23 Cb 0.15 -2.27 0.02 0.00 -1.56 0.00 0.00 34.95 31.29 2iad s ARG 23 CO 0.80 -0.57 -0.10 0.42 -0.81 0.00 0.00 175.30 175.04 2iad s ILE 24 N 1.61 1.06 -0.07 4.11 1.01 -1.26 -1.58 121.20 126.09 2iad s ILE 24 Ca -0.03 -0.38 0.05 0.00 0.00 0.00 0.00 60.65 60.29 2iad s ILE 24 Cb -0.17 -1.02 -0.00 0.00 0.01 0.00 0.00 42.46 41.28 2iad s ILE 24 CO -0.07 0.35 -0.21 -0.60 0.00 0.00 0.00 174.94 174.41 2iad s ARG 25 N 1.10 2.40 -0.23 2.79 3.52 -0.89 -5.02 118.95 122.62 2iad s ARG 25 Ca -0.06 -0.77 -0.04 0.00 -0.13 0.00 0.00 55.73 54.72 2iad s ARG 25 Cb -0.14 -1.96 -0.00 0.00 -1.56 0.00 0.00 34.95 31.28 2iad s ARG 25 CO -0.01 0.26 -0.03 -1.17 -0.81 0.00 0.00 175.30 173.53 2iad s LEU 26 N 0.10 3.02 -0.11 -0.88 0.20 -1.26 -2.17 118.68 117.58 2iad s LEU 26 Ca -0.09 -0.47 0.03 0.00 0.69 0.00 0.00 54.13 54.30 2iad s LEU 26 Cb -0.14 -1.75 0.01 0.00 -0.43 0.00 0.00 46.19 43.87 2iad s LEU 26 CO 0.05 -0.05 -0.22 -0.69 -0.29 0.00 0.00 176.35 175.15 2iad s VAL 27 N 1.47 1.93 -0.03 1.68 1.01 -0.68 -1.82 120.40 123.96 2iad s VAL 27 Ca 0.05 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.15 2iad s VAL 27 Cb -0.15 -1.69 -0.01 0.00 0.00 0.00 0.00 36.38 34.53 2iad s VAL 27 CO -0.03 0.53 -0.20 0.42 0.00 0.00 0.00 175.10 175.83 2iad s THR 28 N 0.55 1.58 0.07 3.92 -4.23 -0.83 -0.20 115.64 116.50 2iad s THR 28 Ca -0.14 -0.83 0.06 0.00 -1.18 0.00 0.00 61.69 59.59 2iad s THR 28 Cb -0.17 -1.33 -0.03 0.00 1.34 0.00 0.00 72.50 72.31 2iad s THR 28 CO 0.05 0.45 -0.16 -0.13 -0.54 0.00 0.00 174.62 174.29 2iad s ARG 29 N -0.26 0.94 -0.21 3.99 0.52 -0.04 -1.23 118.95 122.65 2iad s ARG 29 Ca 0.02 -0.94 0.01 0.00 -0.52 0.00 0.00 55.73 54.31 2iad s ARG 29 Cb -0.10 -1.00 0.03 0.00 0.52 0.00 0.00 34.95 34.40 2iad s ARG 29 CO 0.01 0.23 -0.16 0.71 0.02 0.00 0.00 175.30 176.11 2iad s TYR 30 N -1.11 2.94 -0.09 -0.53 1.51 -0.56 -1.21 117.35 118.30 2iad s TYR 30 Ca 0.01 -1.80 0.02 0.00 -1.01 0.00 0.00 57.07 54.29 2iad s TYR 30 Cb -0.09 -1.94 -0.02 0.00 -0.11 0.00 0.00 41.96 39.80 2iad s TYR 30 CO 0.02 -0.81 -0.15 0.42 -1.11 0.00 0.00 175.55 173.92 2iad s ILE 31 N 1.25 2.91 -0.31 2.71 1.09 0.50 -1.14 121.20 128.21 2iad s ILE 31 Ca 0.01 -0.74 -0.04 0.00 -1.10 0.00 0.00 60.65 58.78 2iad s ILE 31 Cb -0.15 -2.17 0.04 0.00 -1.06 0.00 0.00 42.46 39.12 2iad s ILE 31 CO -0.10 0.55 0.04 -0.47 -0.10 0.00 0.00 174.94 174.87 2iad s TYR 32 N -0.07 3.24 0.00 3.97 5.04 0.39 -0.72 117.35 129.20 2iad s TYR 32 Ca -0.03 -1.63 0.00 0.00 -2.44 0.00 0.00 57.07 52.97 2iad s TYR 32 Cb -0.14 -2.18 0.00 0.00 0.35 0.00 0.00 41.96 39.99 2iad s TYR 32 CO 0.04 -0.76 0.00 0.09 -1.34 0.00 0.00 175.55 173.58 2iad n ASN 33 N 4.71 0.00 -0.23 4.32 3.02 0.76 -0.71 115.26 127.14 2iad n ASN 33 Ca -0.13 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.43 2iad n ASN 33 Cb 0.44 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.63 2iad n ASN 33 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2iad n ARG 34 N 0.00 0.44 -3.87 3.52 1.74 -1.26 -4.76 116.66 112.46 2iad n ARG 34 Ca 0.00 -1.07 -0.36 0.00 -0.77 0.00 0.00 57.85 55.66 2iad n ARG 34 Cb 0.00 -0.67 -0.14 0.00 -1.02 0.00 0.00 32.46 30.64 2iad n ARG 34 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2iad s GLU 35 N -0.44 2.88 0.04 5.56 2.12 0.12 -5.08 118.70 123.89 2iad s GLU 35 Ca 0.04 -0.97 -0.30 0.00 0.36 0.00 0.00 54.97 54.10 2iad s GLU 35 Cb 0.03 -3.17 -0.05 0.00 0.26 0.00 0.00 34.13 31.21 2iad s GLU 35 CO 0.00 -0.45 1.12 -2.00 -0.54 0.00 0.00 175.26 173.40 2iad s GLU 36 N 1.39 4.47 -0.02 4.30 2.12 -1.26 -0.46 118.70 129.23 2iad s GLU 36 Ca 0.00 1.64 0.01 0.00 0.36 0.00 0.00 54.97 56.98 2iad s GLU 36 Cb -0.17 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 30.81 2iad s GLU 36 CO -0.01 -0.19 -0.02 2.48 -0.54 0.00 0.00 175.26 176.98 2iad n TYR 37 N 3.96 0.00 -4.50 5.30 4.11 -0.29 -4.05 117.16 121.69 2iad n TYR 37 Ca 0.08 0.00 -0.23 0.00 -0.00 0.00 0.00 57.90 57.75 2iad n TYR 37 Cb 0.48 -0.09 -0.14 0.00 -0.00 0.00 0.00 39.34 39.59 2iad n TYR 37 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 2iad s VAL 38 N -2.05 1.39 0.03 -3.48 1.01 -1.24 0.16 120.40 116.22 2iad s VAL 38 Ca -0.03 -1.09 -0.10 0.00 0.00 0.00 0.00 61.98 60.76 2iad s VAL 38 Cb 0.01 -1.23 0.01 0.00 0.00 0.00 0.00 36.38 35.16 2iad s VAL 38 CO 0.06 0.11 0.20 -0.60 0.00 0.00 0.00 175.10 174.88 2iad s ARG 39 N -1.15 0.68 -0.22 2.72 3.52 -0.27 -1.49 118.95 122.73 2iad s ARG 39 Ca 0.05 -0.57 0.02 0.00 -0.13 0.00 0.00 55.73 55.09 2iad s ARG 39 Cb -0.08 0.28 0.05 0.00 -1.56 0.00 0.00 34.95 33.64 2iad s ARG 39 CO 0.01 -0.19 -0.12 -0.47 -0.81 0.00 0.00 175.30 173.72 2iad s TYR 40 N -2.37 2.82 -0.14 5.12 5.04 -0.37 -1.40 117.35 126.05 2iad s TYR 40 Ca -0.07 -1.91 -0.01 0.00 -2.44 0.00 0.00 57.07 52.64 2iad s TYR 40 Cb -0.02 -1.80 -0.02 0.00 0.35 0.00 0.00 41.96 40.47 2iad s TYR 40 CO -0.03 -0.81 -0.11 0.34 -1.34 0.00 0.00 175.55 173.60 2iad s ASP 41 N 1.26 4.13 0.17 4.32 2.15 -1.25 -1.96 116.67 125.49 2iad s ASP 41 Ca -0.04 -0.31 -0.22 0.00 0.43 0.00 0.00 52.55 52.42 2iad s ASP 41 Cb -0.17 -1.64 0.09 0.00 -0.30 0.00 0.00 42.92 40.89 2iad s ASP 41 CO -0.08 0.15 1.60 0.28 -0.17 0.00 0.00 175.17 176.94 2iad h SER 42 N 6.86 -1.08 0.07 -0.34 0.02 -1.74 0.36 113.55 117.70 2iad h SER 42 Ca -0.28 0.20 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2iad h SER 42 Cb 1.20 0.52 0.00 0.00 0.14 0.00 0.00 62.40 64.27 2iad h SER 42 CO 0.57 -0.31 0.00 0.47 -1.14 0.00 0.00 176.83 176.42 2iad n ASP 43 N -5.42 0.00 -0.08 3.07 9.92 -1.26 -2.74 116.55 120.03 2iad n ASP 43 Ca 0.02 -0.08 -0.11 0.00 -0.53 0.00 0.00 54.79 54.09 2iad n ASP 43 Cb 0.34 -0.13 -0.08 0.00 -0.64 0.00 0.00 41.12 40.61 2iad n ASP 43 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 2iad n VAL 44 N -1.13 0.97 0.00 2.53 0.31 0.11 -5.03 118.33 116.10 2iad n VAL 44 Ca 0.05 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 63.97 2iad n VAL 44 Cb 0.05 -1.03 0.00 0.00 -0.91 0.00 0.00 33.84 31.95 2iad n VAL 44 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2iad n GLY 45 N 2.59 2.09 3.77 2.92 0.00 -0.57 -5.02 105.19 110.97 2iad n GLY 45 Ca -0.29 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.64 2iad n GLY 45 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2iad s GLU 46 N -0.85 2.20 0.33 1.61 -1.05 -1.26 -5.00 118.70 114.67 2iad s GLU 46 Ca 0.00 -1.47 -0.29 0.00 -0.15 0.00 0.00 54.97 53.06 2iad s GLU 46 Cb 0.00 0.61 -0.10 0.00 -0.44 0.00 0.00 34.13 34.19 2iad s GLU 46 CO 0.00 -1.02 1.32 0.71 0.95 0.00 0.00 175.26 177.22 2iad s TYR 47 N -2.42 3.04 0.01 4.83 2.02 -1.26 -3.95 117.35 119.62 2iad s TYR 47 Ca 0.17 1.39 0.01 0.00 -0.37 0.00 0.00 57.07 58.27 2iad s TYR 47 Cb -0.05 -3.69 -0.01 0.00 -0.40 0.00 0.00 41.96 37.81 2iad s TYR 47 CO 0.12 -1.92 -0.04 1.03 -1.57 0.00 0.00 175.55 173.17 2iad s ARG 48 N -1.70 0.32 0.16 -0.62 1.81 -0.49 -4.88 118.95 113.55 2iad s ARG 48 Ca 0.50 -0.29 -0.26 0.00 -1.72 0.00 0.00 55.73 53.96 2iad s ARG 48 Cb -0.40 -0.23 -0.08 0.00 -0.45 0.00 0.00 34.95 33.80 2iad s ARG 48 CO 0.52 0.05 0.80 0.00 -0.68 0.00 0.00 175.30 176.00 2iad s ALA 49 N -0.47 3.42 -0.10 2.13 0.00 -1.26 -1.12 121.76 124.37 2iad s ALA 49 Ca -0.03 0.39 0.20 0.00 0.00 0.00 0.00 51.96 52.53 2iad s ALA 49 Cb -0.04 -3.00 -0.25 0.00 0.00 0.00 0.00 23.12 19.83 2iad s ALA 49 CO -0.00 0.25 0.49 1.33 0.00 0.00 0.00 175.76 177.83 2iad n VAL 50 N 1.73 0.55 -4.34 0.00 0.24 0.41 -4.93 118.33 112.00 2iad n VAL 50 Ca -0.05 -0.62 -0.18 0.00 -2.04 0.00 0.00 64.34 61.46 2iad n VAL 50 Cb 0.49 -0.24 -0.10 0.00 -1.47 0.00 0.00 33.84 32.51 2iad n VAL 50 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2iad s THR 51 N -3.18 0.60 0.50 3.34 -4.23 -1.18 -4.98 115.64 106.51 2iad s THR 51 Ca -0.07 -2.00 0.14 0.00 -1.18 0.00 0.00 61.69 58.58 2iad s THR 51 Cb 0.11 -2.63 0.27 0.00 1.34 0.00 0.00 72.50 71.59 2iad s THR 51 CO 0.87 0.00 2.13 -0.33 -0.54 0.00 0.00 174.62 176.74 2iad h GLU 52 N 2.32 0.12 -0.02 3.99 4.39 -1.93 -2.51 114.58 120.94 2iad h GLU 52 Ca -0.38 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.31 2iad h GLU 52 Cb 1.25 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 2iad h GLU 52 CO 0.61 0.08 0.00 1.47 -1.16 0.00 0.00 179.01 180.01 2iad n LEU 53 N -4.52 0.51 -0.43 1.33 -0.00 -1.26 -2.96 117.00 109.67 2iad n LEU 53 Ca -0.01 -0.18 0.13 0.00 -0.00 0.00 0.00 56.01 55.94 2iad n LEU 53 Cb 0.09 -0.01 0.28 0.00 -0.00 0.00 0.00 43.42 43.79 2iad n LEU 53 CO 0.34 0.09 0.60 0.61 -0.00 0.00 0.00 177.39 179.04 2iad n GLY 54 N 1.02 -0.16 0.22 1.47 0.00 -0.95 -4.38 105.19 102.41 2iad n GLY 54 Ca 0.21 -0.50 -0.15 0.00 0.00 0.00 0.00 46.02 45.57 2iad n GLY 54 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2iad h ARG 55 N 2.11 -0.47 -1.00 1.61 3.08 -1.67 -2.20 114.38 115.84 2iad h ARG 55 Ca 0.00 0.03 0.21 0.00 0.07 0.00 0.00 59.98 60.29 2iad h ARG 55 Cb 0.62 0.11 -0.10 0.00 0.08 0.00 0.00 29.97 30.68 2iad h ARG 55 CO 0.00 -0.25 0.62 -1.35 -1.07 0.00 0.00 179.97 177.92 2iad h PRO 56 N -0.59 0.62 0.01 0.04 0.11 -1.82 -1.79 132.00 128.59 2iad h PRO 56 Ca -0.05 -0.04 -0.23 0.00 0.11 0.00 0.00 66.00 65.79 2iad h PRO 56 Cb 0.43 -0.14 0.02 0.00 0.11 0.00 0.00 31.00 31.42 2iad h PRO 56 CO 0.08 0.41 -0.90 -0.44 -0.21 0.00 0.00 178.00 176.94 2iad h ASP 57 N 0.64 0.77 -0.64 -2.05 3.32 -1.82 -2.71 116.42 113.94 2iad h ASP 57 Ca 0.57 -0.76 0.04 0.00 0.02 0.00 0.00 57.03 56.90 2iad h ASP 57 Cb 1.07 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 40.34 2iad h ASP 57 CO -0.35 1.43 0.38 0.00 -1.72 0.00 0.00 179.24 178.98 2iad h ALA 58 N 0.35 0.83 0.83 3.45 0.00 -0.87 0.30 119.26 124.15 2iad h ALA 58 Ca -0.12 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2iad h ALA 58 Cb 1.58 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 19.21 2iad h ALA 58 CO 0.18 0.11 -0.40 0.93 0.00 0.00 0.00 179.25 180.07 2iad h GLU 59 N 0.74 -1.07 0.39 0.00 4.39 -1.40 -2.31 114.58 115.32 2iad h GLU 59 Ca 0.26 0.07 -0.02 0.00 0.34 0.00 0.00 59.36 60.02 2iad h GLU 59 Cb 0.07 0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2iad h GLU 59 CO -0.12 -0.71 -0.19 -0.92 -1.16 0.00 0.00 179.01 175.91 2iad h TYR 60 N -1.16 -0.49 0.00 4.33 3.20 -1.31 -2.05 116.97 119.49 2iad h TYR 60 Ca -0.11 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.73 2iad h TYR 60 Cb 0.86 0.16 -0.00 0.00 1.54 0.00 0.00 36.73 39.29 2iad h TYR 60 CO -0.01 -0.26 -0.09 -1.49 -1.64 0.00 0.00 178.16 174.67 2iad h TRP 61 N -0.61 0.00 0.00 -3.82 6.55 -1.02 0.53 115.95 117.59 2iad h TRP 61 Ca -0.05 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.79 2iad h TRP 61 Cb 0.45 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.75 2iad h TRP 61 CO -0.03 0.09 -0.11 -0.91 -1.05 0.00 0.00 178.44 176.43 2iad h ASN 62 N 0.00 0.00 0.03 -3.49 2.35 -1.37 -3.16 115.58 109.94 2iad h ASN 62 Ca -0.00 -0.02 -0.19 0.00 -0.55 0.00 0.00 56.30 55.54 2iad h ASN 62 Cb 0.18 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.57 2iad h ASN 62 CO 0.01 0.01 -0.74 0.28 -1.65 0.00 0.00 177.43 175.34 2iad h SER 63 N 0.00 0.60 -3.09 5.81 0.02 0.72 -3.42 113.55 114.18 2iad h SER 63 Ca 0.00 -0.79 -0.56 0.00 -0.84 0.00 0.00 61.79 59.60 2iad h SER 63 Cb 0.84 -0.19 -0.08 0.00 0.14 0.00 0.00 62.40 63.12 2iad h SER 63 CO 0.00 1.32 0.94 -1.10 -1.14 0.00 0.00 176.83 176.85 2iad s GLN 64 N -3.10 3.46 0.45 3.45 -1.52 0.01 -4.91 119.66 117.49 2iad s GLN 64 Ca -0.12 0.13 0.11 0.00 -1.95 0.00 0.00 55.36 53.53 2iad s GLN 64 Cb 0.04 -4.04 1.03 0.00 -0.22 0.00 0.00 33.01 29.82 2iad s GLN 64 CO 0.85 -1.72 2.07 -1.35 -0.25 0.00 0.00 175.29 174.89 2iad h PRO 65 N 9.58 0.34 0.05 2.91 0.11 -1.82 -2.15 132.00 141.02 2iad h PRO 65 Ca -0.25 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.83 2iad h PRO 65 Cb 1.06 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.09 2iad h PRO 65 CO 1.19 0.22 -0.02 1.49 -0.21 0.00 0.00 178.00 180.67 2iad h GLU 66 N 0.35 -0.06 -0.98 1.05 4.81 -1.91 0.44 114.58 118.27 2iad h GLU 66 Ca 0.13 0.00 0.16 0.00 -0.13 0.00 0.00 59.36 59.52 2iad h GLU 66 Cb 0.09 0.01 -0.17 0.00 0.63 0.00 0.00 28.75 29.32 2iad h GLU 66 CO -0.03 -0.04 -0.36 0.82 -0.73 0.00 0.00 179.01 178.67 2iad h ILE 67 N -0.07 0.01 -0.76 2.32 5.03 -1.83 0.87 117.51 123.07 2iad h ILE 67 Ca -0.01 0.00 0.09 0.00 -0.12 0.00 0.00 64.86 64.82 2iad h ILE 67 Cb 0.05 0.01 -0.07 0.00 -3.03 0.00 0.00 36.82 33.78 2iad h ILE 67 CO 0.01 0.00 0.42 0.25 -0.68 0.00 0.00 178.15 178.15 2iad h LEU 68 N -0.01 0.59 -0.16 1.44 5.85 -1.38 -0.49 115.31 121.15 2iad h LEU 68 Ca 0.37 0.05 -0.23 0.00 0.84 0.00 0.00 57.88 58.91 2iad h LEU 68 Cb 0.62 -0.06 0.01 0.00 0.37 0.00 0.00 40.66 41.60 2iad h LEU 68 CO -0.99 0.35 -0.94 -0.08 -0.34 0.00 0.00 178.44 176.44 2iad h GLU 69 N 0.72 0.47 0.74 1.25 4.22 0.28 -1.06 114.58 121.20 2iad h GLU 69 Ca 0.37 -0.49 -0.04 0.00 0.08 0.00 0.00 59.36 59.28 2iad h GLU 69 Cb 0.33 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2iad h GLU 69 CO -0.24 1.14 -0.38 -0.09 -2.18 0.00 0.00 179.01 177.26 2iad h ARG 70 N 0.27 -0.99 -0.04 1.92 2.43 0.49 -2.52 114.38 115.95 2iad h ARG 70 Ca -0.08 0.07 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 2iad h ARG 70 Cb 1.57 0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 31.31 2iad h ARG 70 CO 0.17 -0.66 -0.35 1.15 -1.51 0.00 0.00 179.97 178.77 2iad h THR 71 N -1.02 0.00 -1.13 0.20 2.02 -1.15 -2.41 112.91 109.42 2iad h THR 71 Ca -0.10 0.00 0.32 0.00 0.77 0.00 0.00 66.41 67.40 2iad h THR 71 Cb 0.79 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.14 2iad h THR 71 CO 0.15 0.00 0.79 -0.09 0.37 0.00 0.00 175.52 176.74 2iad h ARG 72 N -0.41 0.12 0.00 6.66 2.43 -1.22 -0.89 114.38 121.07 2iad h ARG 72 Ca 0.01 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.13 2iad h ARG 72 Cb 0.45 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 2iad h ARG 72 CO -0.25 0.08 -0.69 0.00 -1.51 0.00 0.00 179.97 177.60 2iad h ALA 73 N 1.49 0.70 -0.88 2.80 0.00 -0.98 -3.34 119.26 119.05 2iad h ALA 73 Ca 0.58 -0.22 0.26 0.00 0.00 0.00 0.00 54.91 55.52 2iad h ALA 73 Cb 2.02 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.81 2iad h ALA 73 CO -0.11 0.26 0.77 0.93 0.00 0.00 0.00 179.25 181.10 2iad h GLU 74 N 0.00 0.00 -0.92 0.00 5.08 -0.72 0.76 114.58 118.78 2iad h GLU 74 Ca -0.03 0.00 0.19 0.00 -1.00 0.00 0.00 59.36 58.52 2iad h GLU 74 Cb 1.17 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.34 2iad h GLU 74 CO 0.02 0.00 0.60 -0.24 -1.00 0.00 0.00 179.01 178.39 2iad h VAL 75 N 0.00 0.71 0.00 3.13 3.04 -1.73 0.55 116.25 121.95 2iad h VAL 75 Ca 0.42 -0.18 -0.30 0.00 -1.01 0.00 0.00 66.70 65.63 2iad h VAL 75 Cb 1.96 0.15 -0.04 0.00 -2.01 0.00 0.00 31.29 31.34 2iad h VAL 75 CO -0.00 0.09 -1.69 0.47 -1.01 0.00 0.00 177.57 175.43 2iad n ASP 76 N -4.56 1.90 0.25 3.17 8.00 0.24 -1.26 116.55 124.28 2iad n ASP 76 Ca 0.20 0.40 0.07 0.00 0.71 0.00 0.00 54.79 56.17 2iad n ASP 76 Cb 0.64 -0.90 0.60 0.00 -0.02 0.00 0.00 41.12 41.44 2iad n ASP 76 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 2iad h THR 77 N -1.00 1.02 0.00 -3.53 1.35 -1.36 -0.38 112.91 109.02 2iad h THR 77 Ca -0.45 -0.22 -0.08 0.00 -0.55 0.00 0.00 66.41 65.11 2iad h THR 77 Cb 1.37 1.12 -0.01 0.00 -1.73 0.00 0.00 68.15 68.90 2iad h THR 77 CO -0.27 0.06 -0.90 0.00 -0.25 0.00 0.00 175.52 174.15 2iad n ALA 78 N -2.52 2.30 0.10 6.62 0.00 0.19 -4.41 120.51 122.79 2iad n ALA 78 Ca -0.03 -0.34 -0.11 0.00 0.00 0.00 0.00 53.44 52.96 2iad n ALA 78 Cb 0.14 0.26 -0.07 0.00 0.00 0.00 0.00 19.45 19.78 2iad n ALA 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2iad h ARG 80 N -0.85 0.67 0.49 0.00 2.43 -1.13 -2.17 114.38 113.81 2iad h ARG 80 Ca -0.03 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 2iad h ARG 80 Cb 0.51 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 2iad h ARG 80 CO 0.05 0.54 -0.46 1.25 -1.51 0.00 0.00 179.97 179.83 2iad h HIS 81 N 0.63 -1.28 -0.60 2.20 2.76 -1.12 -1.28 115.15 116.45 2iad h HIS 81 Ca 0.17 0.01 0.11 0.00 -2.20 0.00 0.00 60.37 58.46 2iad h HIS 81 Cb 0.07 0.50 -0.09 0.00 1.55 0.00 0.00 27.41 29.44 2iad h HIS 81 CO -0.02 -0.62 0.13 -0.91 -1.30 0.00 0.00 177.93 175.21 2iad h ASN 82 N -0.94 0.00 0.06 3.26 4.21 -1.15 0.15 115.58 121.17 2iad h ASN 82 Ca -0.06 0.11 -0.00 0.00 1.21 0.00 0.00 56.30 57.56 2iad h ASN 82 Cb 0.81 0.15 0.00 0.00 -1.12 0.00 0.00 38.32 38.16 2iad h ASN 82 CO -0.04 0.01 -0.03 0.22 -1.29 0.00 0.00 177.43 176.30 2iad h TYR 83 N 0.26 -0.08 0.19 1.19 5.03 -1.27 -0.86 116.97 121.43 2iad h TYR 83 Ca 0.31 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.61 2iad h TYR 83 Cb 0.47 0.03 0.00 0.00 1.55 0.00 0.00 36.73 38.77 2iad h TYR 83 CO -0.25 -0.01 -0.09 0.93 -1.32 0.00 0.00 178.16 177.42 2iad h GLU 84 N -0.12 -0.25 0.00 1.82 3.07 -0.80 -2.70 114.58 115.60 2iad h GLU 84 Ca -0.01 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 2iad h GLU 84 Cb 0.10 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 2iad h GLU 84 CO 0.01 -0.16 0.00 0.41 -1.40 0.00 0.00 179.01 177.87 2iad n GLY 85 N -1.13 -2.16 0.00 -3.84 0.00 0.47 -3.95 105.19 94.58 2iad n GLY 85 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2iad n GLY 85 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2iad n PRO 86 N 0.00 0.00 -0.33 1.61 -0.02 -0.70 -3.28 135.00 132.28 2iad n PRO 86 Ca 0.00 0.48 0.27 0.00 -2.02 0.00 0.00 63.50 62.23 2iad n PRO 86 Cb 0.00 -1.01 0.51 0.00 -0.02 0.00 0.00 33.50 32.98 2iad n PRO 86 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2iad h GLU 87 N 0.00 0.20 0.00 -0.52 4.39 -1.33 0.76 114.58 118.08 2iad h GLU 87 Ca 0.00 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2iad h GLU 87 Cb 0.00 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.60 2iad h GLU 87 CO 0.00 0.13 0.00 1.15 -1.16 0.00 0.00 179.01 179.13 2iad h THR 88 N 0.21 0.00 -0.01 1.13 2.02 -1.46 0.72 112.91 115.51 2iad h THR 88 Ca 0.77 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 67.58 2iad h THR 88 Cb 1.87 1.25 0.00 0.00 -1.74 0.00 0.00 68.15 69.53 2iad h THR 88 CO -0.67 0.00 -0.01 -1.54 0.37 0.00 0.00 175.52 173.68 2iad n SER 89 N -2.73 1.61 0.00 4.18 3.41 0.18 -4.34 113.62 115.93 2iad n SER 89 Ca 0.01 -1.31 0.00 0.00 -0.26 0.00 0.00 58.87 57.31 2iad n SER 89 Cb 0.26 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 2iad n SER 89 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2iad n THR 90 N 0.40 0.00 -0.09 6.66 -1.04 -0.74 -4.83 114.28 114.64 2iad n THR 90 Ca 0.04 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.91 2iad n THR 90 Cb 0.19 -0.15 -0.04 0.00 -1.82 0.00 0.00 70.33 68.51 2iad n THR 90 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2iad h SER 91 N 0.00 0.98 0.37 8.00 0.02 -1.66 -3.02 113.55 118.25 2iad h SER 91 Ca 0.00 -0.52 0.00 0.00 -0.84 0.00 0.00 61.79 60.43 2iad h SER 91 Cb 0.00 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.26 2iad h SER 91 CO 0.00 1.31 0.00 0.18 -1.14 0.00 0.00 176.83 177.18 2iad n LEU 92 N -4.03 0.00 -0.15 5.07 4.32 0.24 -2.59 117.00 119.86 2iad n LEU 92 Ca -0.04 0.34 0.02 0.00 -0.02 0.00 0.00 56.01 56.31 2iad n LEU 92 Cb 0.61 -0.34 0.02 0.00 -1.62 0.00 0.00 43.42 42.08 2iad n LEU 92 CO 0.50 -0.16 0.31 0.54 -1.22 0.00 0.00 177.39 177.36 2iad n ARG 93 N -1.34 -0.46 -2.20 3.23 1.74 -1.18 -4.98 116.66 111.45 2iad n ARG 93 Ca 0.07 -0.73 -0.42 0.00 -0.77 0.00 0.00 57.85 56.00 2iad n ARG 93 Cb 0.15 -1.07 -0.03 0.00 -1.02 0.00 0.00 32.46 30.49 2iad n ARG 93 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2iad s ARG 94 N -0.31 4.33 -0.08 5.56 6.06 -1.07 -5.01 118.95 128.43 2iad s ARG 94 Ca 0.04 2.04 -0.01 0.00 -2.50 0.00 0.00 55.73 55.29 2iad s ARG 94 Cb 0.03 -3.26 0.03 0.00 0.06 0.00 0.00 34.95 31.81 2iad s ARG 94 CO 0.05 -0.42 0.01 -0.51 -2.50 0.00 0.00 175.30 171.93 2iad s LEU 94 N 1.11 0.61 -0.24 -0.88 1.02 -1.26 -4.24 118.68 114.79 2iad s LEU 94 Ca 0.64 -0.13 0.02 0.00 0.02 0.00 0.00 54.13 54.68 2iad s LEU 94 Cb -0.36 -0.44 0.05 0.00 0.02 0.00 0.00 46.19 45.46 2iad s LEU 94 CO 0.30 -0.20 -0.12 -1.61 0.02 0.00 0.00 176.35 174.73 2iad s GLU 95 N 1.97 2.33 -0.02 1.70 0.41 0.96 -4.91 118.70 121.15 2iad s GLU 95 Ca 0.05 -1.21 -0.30 0.00 -0.41 0.00 0.00 54.97 53.10 2iad s GLU 95 Cb -0.13 -2.79 -0.05 0.00 -1.78 0.00 0.00 34.13 29.38 2iad s GLU 95 CO -0.05 -0.50 1.48 -1.14 -0.49 0.00 0.00 175.26 174.56 2iad s GLN 96 N 1.17 4.24 0.70 1.61 0.74 -1.26 -1.97 119.66 124.88 2iad s GLN 96 Ca -0.06 2.04 -0.15 0.00 0.05 0.00 0.00 55.36 57.24 2iad s GLN 96 Cb -0.18 -3.70 0.02 0.00 1.10 0.00 0.00 33.01 30.25 2iad s GLN 96 CO -0.07 -0.68 1.15 -1.25 -0.55 0.00 0.00 175.29 173.90 2iad s PRO 97 N 2.95 2.44 -0.18 1.67 0.04 -1.26 -4.64 135.00 136.01 2iad s PRO 97 Ca 0.67 1.55 0.01 0.00 0.04 0.00 0.00 61.00 63.27 2iad s PRO 97 Cb -0.32 -1.89 0.03 0.00 0.04 0.00 0.00 34.50 32.35 2iad s PRO 97 CO 0.27 -1.56 -0.18 -0.80 0.04 0.00 0.00 177.00 174.77 2iad s ASN 98 N -2.37 3.22 -0.03 6.66 0.01 -0.65 -4.93 114.94 116.84 2iad s ASN 98 Ca 0.70 -0.72 -0.01 0.00 -0.71 0.00 0.00 52.86 52.12 2iad s ASN 98 Cb -0.24 -1.43 -0.04 0.00 0.41 0.00 0.00 41.25 39.95 2iad s ASN 98 CO 0.44 -0.03 0.06 0.68 -1.51 0.00 0.00 177.10 176.73 2iad s VAL 99 N 1.30 4.61 -0.02 1.60 -7.23 -1.25 -1.79 120.40 117.62 2iad s VAL 99 Ca 0.03 -0.34 -0.07 0.00 -1.81 0.00 0.00 61.98 59.79 2iad s VAL 99 Cb -0.14 -3.05 0.01 0.00 0.56 0.00 0.00 36.38 33.76 2iad s VAL 99 CO -0.12 0.44 0.16 0.00 -0.31 0.00 0.00 175.10 175.27 2iad s ALA 100 N -1.09 -0.39 -0.08 1.32 0.00 -1.05 -4.94 121.76 115.53 2iad s ALA 100 Ca 0.19 0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.30 2iad s ALA 100 Cb -0.12 -0.04 -0.02 0.00 0.00 0.00 0.00 23.12 22.95 2iad s ALA 100 CO 0.10 -0.17 -0.19 0.96 0.00 0.00 0.00 175.76 176.46 2iad s ILE 101 N -0.85 2.61 0.04 0.00 -0.00 -1.26 -0.27 121.20 121.47 2iad s ILE 101 Ca -0.09 -0.86 0.04 0.00 -0.00 0.00 0.00 60.65 59.74 2iad s ILE 101 Cb -0.05 -2.02 -0.02 0.00 -0.00 0.00 0.00 42.46 40.37 2iad s ILE 101 CO 0.01 0.56 -0.11 -0.44 -0.00 0.00 0.00 174.94 174.96 2iad s SER 102 N -0.15 1.29 -0.13 4.36 0.01 0.69 -4.97 113.70 114.80 2iad s SER 102 Ca -0.02 -0.50 -0.29 0.00 1.31 0.00 0.00 55.95 56.45 2iad s SER 102 Cb -0.14 -0.04 -0.01 0.00 0.21 0.00 0.00 66.02 66.05 2iad s SER 102 CO 0.04 -0.07 1.04 -0.22 0.41 0.00 0.00 173.24 174.44 2iad s LEU 103 N -1.35 4.21 0.00 2.44 2.96 -1.26 -1.07 118.68 124.61 2iad s LEU 103 Ca -0.03 1.53 0.00 0.00 -0.22 0.00 0.00 54.13 55.41 2iad s LEU 103 Cb -0.09 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.05 2iad s LEU 103 CO 0.01 -0.53 0.00 -0.24 -1.32 0.00 0.00 176.35 174.27 2iad n SER 104 N 5.41 1.90 -1.82 3.68 2.88 1.08 -4.69 113.62 122.07 2iad n SER 104 Ca 0.10 -0.78 -0.18 0.00 -1.33 0.00 0.00 58.87 56.69 2iad n SER 104 Cb 0.48 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.91 2iad n SER 104 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2iad n ARG 105 N -0.04 -1.36 0.00 -1.46 3.00 -1.26 -3.75 116.66 111.79 2iad n ARG 105 Ca 0.00 0.94 0.00 0.00 -0.01 0.00 0.00 57.85 58.78 2iad n ARG 105 Cb 0.00 -5.36 0.00 0.00 0.00 0.00 0.00 32.46 27.10 2iad n ARG 105 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2iad n THR 106 N -3.54 0.00 -3.30 0.55 -2.24 -1.26 -5.00 114.28 99.50 2iad n THR 106 Ca -0.20 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2iad n THR 106 Cb 0.64 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 2iad n THR 106 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2iad n GLU 107 N 0.00 2.80 -3.46 -0.78 -0.58 -1.26 -5.09 120.64 112.26 2iad n GLU 107 Ca 0.00 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.31 2iad n GLU 107 Cb 0.00 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 30.83 2iad n GLU 107 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2iad s ALA 108 N -2.00 3.96 -1.02 0.62 0.00 -1.26 -4.78 121.76 117.29 2iad s ALA 108 Ca 0.00 -3.35 -0.04 0.00 0.00 0.00 0.00 51.96 48.57 2iad s ALA 108 Cb 0.00 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 2iad s ALA 108 CO 0.00 -2.22 0.88 1.28 0.00 0.00 0.00 175.76 175.70 2iad n LEU 109 N 3.70 -4.91 -0.00 0.00 7.99 -1.26 -4.96 117.00 117.55 2iad n LEU 109 Ca 0.13 -0.63 0.02 0.00 -0.01 0.00 0.00 56.01 55.51 2iad n LEU 109 Cb 0.44 -3.00 -0.03 0.00 -0.11 0.00 0.00 43.42 40.72 2iad n LEU 109 CO 0.34 0.18 -0.55 0.59 -1.51 0.00 0.00 177.39 176.43 2iad n ASN 110 N -3.06 4.05 -2.22 -1.43 3.02 -1.26 -4.66 115.26 109.69 2iad n ASN 110 Ca -0.13 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.39 2iad n ASN 110 Cb 0.63 1.15 0.07 0.00 -0.61 0.00 0.00 39.78 41.02 2iad n ASN 110 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 2iad n HIS 111 N -1.68 -1.44 -3.83 3.10 -0.00 -1.26 -5.09 115.22 105.03 2iad n HIS 111 Ca -0.01 -1.39 -0.35 0.00 0.46 0.00 0.00 57.72 56.42 2iad n HIS 111 Cb 0.14 1.23 -0.12 0.00 -0.12 0.00 0.00 29.99 31.12 2iad n HIS 111 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2iad s HIS 112 N 0.01 3.61 -0.03 1.57 3.76 -1.26 -4.79 115.29 118.15 2iad s HIS 112 Ca 0.07 -2.50 0.05 0.00 -0.15 0.00 0.00 55.06 52.53 2iad s HIS 112 Cb 0.33 -3.13 -0.07 0.00 1.11 0.00 0.00 32.58 30.82 2iad s HIS 112 CO -0.09 -0.96 0.06 0.27 -0.85 0.00 0.00 174.74 173.16 2iad n ASN 113 N 4.53 3.81 -4.53 1.40 0.23 -1.05 -4.44 115.26 115.21 2iad n ASN 113 Ca -0.02 0.00 -0.43 0.00 -0.53 0.00 0.00 54.58 53.61 2iad n ASN 113 Cb 0.42 0.87 -0.04 0.00 -2.08 0.00 0.00 39.78 38.95 2iad n ASN 113 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2iad s THR 114 N -2.22 4.29 -0.24 5.53 2.01 -1.25 -2.91 115.64 120.86 2iad s THR 114 Ca -0.02 0.37 -0.25 0.00 0.31 0.00 0.00 61.69 62.10 2iad s THR 114 Cb 0.02 -4.60 -0.00 0.00 0.01 0.00 0.00 72.50 67.93 2iad s THR 114 CO 0.21 -1.21 0.84 -0.76 -0.69 0.00 0.00 174.62 173.01 2iad s LEU 115 N 4.22 4.08 -0.17 4.42 1.02 -0.95 0.35 118.68 131.65 2iad s LEU 115 Ca 0.33 1.05 -0.03 0.00 0.02 0.00 0.00 54.13 55.49 2iad s LEU 115 Cb -0.12 -3.20 -0.02 0.00 0.02 0.00 0.00 46.19 42.87 2iad s LEU 115 CO 0.20 -0.52 -0.05 -0.69 0.02 0.00 0.00 176.35 175.31 2iad s VAL 116 N 2.85 3.65 -0.17 -1.59 1.01 -0.23 -0.45 120.40 125.46 2iad s VAL 116 Ca 0.35 -0.43 -0.04 0.00 0.00 0.00 0.00 61.98 61.86 2iad s VAL 116 Cb -0.15 -2.61 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 2iad s VAL 116 CO 0.07 0.47 -0.04 0.00 0.00 0.00 0.00 175.10 175.61 2iad s SER 118 N 0.66 5.59 -0.41 0.00 1.04 0.63 -1.80 113.70 119.42 2iad s SER 118 Ca -0.02 -1.33 -0.15 0.00 0.48 0.00 0.00 55.95 54.93 2iad s SER 118 Cb -0.14 -1.97 0.02 0.00 0.10 0.00 0.00 66.02 64.02 2iad s SER 118 CO 0.02 -0.46 0.29 -0.69 0.98 0.00 0.00 173.24 173.38 2iad s VAL 119 N 1.45 5.24 0.27 5.02 1.01 -0.90 -2.53 120.40 129.96 2iad s VAL 119 Ca 0.02 -0.64 0.07 0.00 0.00 0.00 0.00 61.98 61.43 2iad s VAL 119 Cb -0.21 -3.91 -0.06 0.00 0.00 0.00 0.00 36.38 32.20 2iad s VAL 119 CO 0.03 -0.29 -0.07 0.42 0.00 0.00 0.00 175.10 175.19 2iad s THR 120 N 1.68 1.66 -1.41 3.92 -4.23 -0.74 -1.07 115.64 115.45 2iad s THR 120 Ca 0.05 -2.14 -0.08 0.00 -1.18 0.00 0.00 61.69 58.34 2iad s THR 120 Cb -0.19 -2.40 0.01 0.00 1.34 0.00 0.00 72.50 71.27 2iad s THR 120 CO 0.10 -0.34 1.07 0.47 -0.54 0.00 0.00 174.62 175.38 2iad n ASP 121 N -0.56 -6.32 -4.71 3.99 8.00 0.33 -1.64 116.55 115.64 2iad n ASP 121 Ca -0.06 -0.50 -0.23 0.00 0.71 0.00 0.00 54.79 54.72 2iad n ASP 121 Cb 0.63 -5.00 -0.06 0.00 -0.02 0.00 0.00 41.12 36.67 2iad n ASP 121 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2iad s PHE 122 N -3.29 2.86 -0.25 1.24 -0.71 -0.97 -4.42 117.98 112.45 2iad s PHE 122 Ca 0.54 -0.17 -0.19 0.00 -1.04 0.00 0.00 56.93 56.06 2iad s PHE 122 Cb -0.24 -1.29 0.07 0.00 -1.21 0.00 0.00 43.02 40.35 2iad s PHE 122 CO 0.66 0.57 0.64 -0.47 -1.34 0.00 0.00 175.22 175.28 2iad s TYR 123 N -2.18 -0.80 0.20 3.49 6.14 -0.83 0.08 117.35 123.44 2iad s TYR 123 Ca 0.31 1.81 -0.03 0.00 0.64 0.00 0.00 57.07 59.80 2iad s TYR 123 Cb -0.07 0.36 0.05 0.00 0.42 0.00 0.00 41.96 42.71 2iad s TYR 123 CO 0.21 -0.40 0.23 -0.35 0.64 0.00 0.00 175.55 175.89 2iad n PRO 124 N 3.33 -0.71 0.00 4.97 -0.04 -1.26 -0.03 135.00 141.26 2iad n PRO 124 Ca -0.16 -0.36 0.08 0.00 -0.04 0.00 0.00 63.50 63.02 2iad n PRO 124 Cb 0.56 -0.27 0.38 0.00 -0.04 0.00 0.00 33.50 34.13 2iad n PRO 124 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2iad n ALA 125 N -3.23 1.83 -2.22 0.55 0.00 -1.26 -4.79 120.51 111.38 2iad n ALA 125 Ca -0.04 -0.07 -0.42 0.00 0.00 0.00 0.00 53.44 52.91 2iad n ALA 125 Cb 0.11 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.27 2iad n ALA 125 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2iad s LYS 126 N -2.75 4.30 -0.04 0.00 2.20 -1.26 -4.99 119.74 117.21 2iad s LYS 126 Ca 0.12 1.98 -0.29 0.00 -0.36 0.00 0.00 55.97 57.43 2iad s LYS 126 Cb 0.11 -3.47 0.10 0.00 -1.51 0.00 0.00 37.83 33.06 2iad s LYS 126 CO 0.27 -0.51 0.88 -1.50 -0.36 0.00 0.00 175.35 174.12 2iad s ILE 127 N 1.94 0.00 -0.04 5.43 2.07 -1.26 -4.61 121.20 124.73 2iad s ILE 127 Ca 0.64 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.86 2iad s ILE 127 Cb -0.33 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.29 2iad s ILE 127 CO 0.28 0.00 0.07 -0.75 -1.91 0.00 0.00 174.94 172.63 2iad s LYS 128 N -2.51 -0.04 -0.06 3.50 2.47 -0.57 -5.00 119.74 117.53 2iad s LYS 128 Ca 0.02 0.33 0.06 0.00 -1.56 0.00 0.00 55.97 54.81 2iad s LYS 128 Cb -0.01 -0.36 -0.01 0.00 -1.46 0.00 0.00 37.83 36.00 2iad s LYS 128 CO -0.05 -0.25 -0.24 0.08 0.16 0.00 0.00 175.35 175.05 2iad s VAL 129 N 1.68 1.96 0.16 4.02 1.01 -1.26 0.12 120.40 128.09 2iad s VAL 129 Ca -0.02 -1.01 0.06 0.00 0.00 0.00 0.00 61.98 61.02 2iad s VAL 129 Cb -0.12 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 2iad s VAL 129 CO -0.04 0.55 -0.14 -0.13 0.00 0.00 0.00 175.10 175.34 2iad s ARG 130 N -0.10 1.16 -0.04 2.72 0.52 0.56 -4.98 118.95 118.78 2iad s ARG 130 Ca -0.05 -1.42 0.06 0.00 -0.52 0.00 0.00 55.73 53.81 2iad s ARG 130 Cb -0.14 -0.96 -0.02 0.00 0.52 0.00 0.00 34.95 34.35 2iad s ARG 130 CO 0.04 0.17 -0.21 -1.58 0.02 0.00 0.00 175.30 173.74 2iad s TRP 131 N -2.65 2.50 -0.06 -0.53 0.52 -1.26 -0.87 118.94 116.60 2iad s TRP 131 Ca 0.16 -0.38 0.03 0.00 0.02 0.00 0.00 56.10 55.93 2iad s TRP 131 Cb -0.02 -1.58 0.01 0.00 -1.15 0.00 0.00 33.47 30.73 2iad s TRP 131 CO 0.04 0.02 -0.15 -0.06 0.02 0.00 0.00 176.95 176.82 2iad s PHE 132 N -0.56 1.68 -0.39 -1.98 0.08 -0.34 0.20 117.98 116.67 2iad s PHE 132 Ca 0.08 -0.59 -0.08 0.00 0.12 0.00 0.00 56.93 56.46 2iad s PHE 132 Cb -0.11 -1.17 0.06 0.00 -0.57 0.00 0.00 43.02 41.23 2iad s PHE 132 CO 0.00 -0.26 0.19 0.50 -0.10 0.00 0.00 175.22 175.56 2iad s ARG 133 N 0.42 2.57 -1.24 0.44 3.52 0.20 -0.28 118.95 124.57 2iad s ARG 133 Ca -0.12 -1.37 -0.33 0.00 -0.13 0.00 0.00 55.73 53.79 2iad s ARG 133 Cb -0.15 -3.64 0.05 0.00 -1.56 0.00 0.00 34.95 29.65 2iad s ARG 133 CO 0.04 -0.85 0.62 0.27 -0.81 0.00 0.00 175.30 174.57 2iad n ASN 134 N 4.85 -3.62 0.00 -2.12 2.04 0.27 -2.18 115.26 114.49 2iad n ASN 134 Ca -0.10 -1.31 0.00 0.00 -0.44 0.00 0.00 54.58 52.73 2iad n ASN 134 Cb 0.44 -1.57 0.00 0.00 -2.53 0.00 0.00 39.78 36.11 2iad n ASN 134 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2iad n GLY 135 N -2.16 2.56 3.61 4.83 0.00 -1.26 -4.98 105.19 107.80 2iad n GLY 135 Ca -0.13 -0.48 -0.24 0.00 0.00 0.00 0.00 46.02 45.17 2iad n GLY 135 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2iad s GLN 136 N 0.00 2.19 0.12 1.61 1.11 -0.93 -5.09 119.66 118.66 2iad s GLN 136 Ca 0.00 -1.41 -0.26 0.00 0.01 0.00 0.00 55.36 53.70 2iad s GLN 136 Cb 0.00 -2.13 -0.07 0.00 -1.01 0.00 0.00 33.01 29.80 2iad s GLN 136 CO 0.00 0.38 0.80 -2.00 0.01 0.00 0.00 175.29 174.47 2iad s GLU 137 N -3.46 4.56 -0.44 2.91 2.12 -1.26 0.59 118.70 123.72 2iad s GLU 137 Ca 0.30 1.16 -0.20 0.00 0.36 0.00 0.00 54.97 56.59 2iad s GLU 137 Cb -0.07 -3.31 0.03 0.00 0.26 0.00 0.00 34.13 31.04 2iad s GLU 137 CO 0.18 0.42 0.60 -2.00 -0.54 0.00 0.00 175.26 173.92 2iad s GLU 138 N -0.62 3.21 -0.21 4.30 2.56 0.13 -4.84 118.70 123.24 2iad s GLU 138 Ca 0.38 -0.53 -0.14 0.00 0.00 0.00 0.00 54.97 54.68 2iad s GLU 138 Cb -0.22 -3.97 -0.19 0.00 2.00 0.00 0.00 34.13 31.74 2iad s GLU 138 CO 0.26 -1.01 0.08 2.41 -0.56 0.00 0.00 175.26 176.44 2iad n THR 139 N 5.73 1.58 -2.91 -1.70 -1.04 -1.26 -4.40 114.28 110.28 2iad n THR 139 Ca -0.04 -0.30 -0.41 0.00 -2.04 0.00 0.00 64.05 61.27 2iad n THR 139 Cb 0.47 -1.88 -0.04 0.00 -1.82 0.00 0.00 70.33 67.06 2iad n THR 139 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2iad s VAL 140 N -2.45 4.93 0.00 12.58 1.01 -1.26 -3.92 120.40 131.28 2iad s VAL 140 Ca -0.30 1.64 0.00 0.00 0.00 0.00 0.00 61.98 63.32 2iad s VAL 140 Cb 0.08 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.33 2iad s VAL 140 CO 0.61 0.11 0.00 0.61 0.00 0.00 0.00 175.10 176.43 2iad n GLY 141 N 3.27 1.54 3.36 4.51 0.00 -1.26 -4.83 105.19 111.78 2iad n GLY 141 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 2iad n GLY 141 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2iad s VAL 142 N -2.00 3.30 -0.15 1.61 -7.23 -1.25 0.18 120.40 114.85 2iad s VAL 142 Ca 0.00 -0.55 -0.01 0.00 -1.81 0.00 0.00 61.98 59.61 2iad s VAL 142 Cb 0.00 -2.44 0.04 0.00 0.56 0.00 0.00 36.38 34.54 2iad s VAL 142 CO 0.00 0.48 -0.04 -0.55 -0.31 0.00 0.00 175.10 174.69 2iad s SER 143 N 0.80 2.62 -0.16 4.85 0.15 0.89 -4.96 113.70 117.89 2iad s SER 143 Ca -0.03 -0.58 -0.08 0.00 0.70 0.00 0.00 55.95 55.96 2iad s SER 143 Cb -0.15 -0.80 -0.04 0.00 -1.71 0.00 0.00 66.02 63.31 2iad s SER 143 CO 0.01 -0.20 0.13 -0.44 1.20 0.00 0.00 173.24 173.95 2iad s SER 144 N 1.71 6.25 0.72 5.45 0.01 -1.26 0.40 113.70 126.99 2iad s SER 144 Ca 0.01 0.33 -0.11 0.00 1.31 0.00 0.00 55.95 57.49 2iad s SER 144 Cb -0.15 -2.07 0.02 0.00 0.21 0.00 0.00 66.02 64.04 2iad s SER 144 CO -0.07 0.29 1.10 0.42 0.41 0.00 0.00 173.24 175.39 2iad s THR 145 N -0.29 3.34 0.81 1.44 -4.23 0.16 -4.99 115.64 111.88 2iad s THR 145 Ca 0.11 0.43 -0.12 0.00 -1.18 0.00 0.00 61.69 60.93 2iad s THR 145 Cb -0.12 -3.41 0.08 0.00 1.34 0.00 0.00 72.50 70.40 2iad s THR 145 CO 0.01 -0.57 1.15 -1.10 -0.54 0.00 0.00 174.62 173.57 2iad s GLN 146 N -5.36 1.76 0.03 3.99 -1.52 -1.26 -4.50 119.66 112.80 2iad s GLN 146 Ca 0.59 1.52 -0.30 0.00 -1.95 0.00 0.00 55.36 55.21 2iad s GLN 146 Cb -0.11 -1.81 -0.06 0.00 -0.22 0.00 0.00 33.01 30.81 2iad s GLN 146 CO 0.52 -2.07 1.31 -1.17 -0.25 0.00 0.00 175.29 173.62 2iad s LEU 147 N -5.88 4.34 -0.12 2.90 0.20 -1.26 -4.66 118.68 114.20 2iad s LEU 147 Ca 0.68 2.08 -0.07 0.00 0.69 0.00 0.00 54.13 57.52 2iad s LEU 147 Cb -0.23 -3.57 -0.04 0.00 -0.43 0.00 0.00 46.19 41.92 2iad s LEU 147 CO 0.52 -0.61 0.12 -0.63 -0.29 0.00 0.00 176.35 175.47 2iad s ILE 148 N 1.70 5.37 -0.33 6.68 1.09 -0.17 -4.99 121.20 130.55 2iad s ILE 148 Ca 0.61 0.16 -0.07 0.00 -1.10 0.00 0.00 60.65 60.25 2iad s ILE 148 Cb -0.31 -3.34 0.03 0.00 -1.06 0.00 0.00 42.46 37.78 2iad s ILE 148 CO 0.27 0.61 0.11 -0.60 -0.10 0.00 0.00 174.94 175.23 2iad s ARG 149 N -0.92 2.83 0.44 2.79 3.52 -1.26 -2.25 118.95 124.11 2iad s ARG 149 Ca 0.14 -1.04 0.13 0.00 -0.13 0.00 0.00 55.73 54.83 2iad s ARG 149 Cb -0.12 -3.47 0.99 0.00 -1.56 0.00 0.00 34.95 30.79 2iad s ARG 149 CO 0.03 -0.58 2.00 -0.91 -0.81 0.00 0.00 175.30 175.03 2iad h ASN 150 N 8.26 0.07 0.00 -2.12 2.35 -1.56 -3.46 115.58 119.12 2iad h ASN 150 Ca -0.27 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 2iad h ASN 150 Cb 1.10 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.45 2iad h ASN 150 CO 0.61 0.21 0.00 0.61 -1.65 0.00 0.00 177.43 177.21 2iad n GLY 151 N -1.09 1.07 2.03 2.83 0.00 -1.26 -4.90 105.19 103.87 2iad n GLY 151 Ca -0.02 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 2iad n GLY 151 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2iad n ASP 152 N 0.00 3.95 -2.20 1.61 5.68 -1.26 -4.87 116.55 119.46 2iad n ASP 152 Ca 0.00 -3.50 -0.13 0.00 -0.50 0.00 0.00 54.79 50.66 2iad n ASP 152 Cb 0.00 -0.79 0.04 0.00 -1.14 0.00 0.00 41.12 39.24 2iad n ASP 152 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 2iad n TRP 153 N -0.84 -1.57 -3.74 2.11 7.02 -1.26 -5.04 117.44 114.12 2iad n TRP 153 Ca 0.51 0.56 -0.13 0.00 -1.02 0.00 0.00 57.50 57.42 2iad n TRP 153 Cb 1.52 -3.23 -0.08 0.00 -2.42 0.00 0.00 31.31 27.10 2iad n TRP 153 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2iad s THR 154 N -3.18 0.07 0.52 -0.99 -4.23 -1.26 -4.74 115.64 101.83 2iad s THR 154 Ca 0.31 -0.54 0.02 0.00 -1.18 0.00 0.00 61.69 60.30 2iad s THR 154 Cb -0.14 -0.78 -0.00 0.00 1.34 0.00 0.00 72.50 72.93 2iad s THR 154 CO 0.40 -0.30 0.11 -0.36 -0.54 0.00 0.00 174.62 173.93 2iad s PHE 155 N -1.87 1.82 -0.03 3.99 0.08 0.11 -1.35 117.98 120.72 2iad s PHE 155 Ca -0.10 -0.92 -0.29 0.00 0.12 0.00 0.00 56.93 55.75 2iad s PHE 155 Cb -0.03 -1.69 0.10 0.00 -0.57 0.00 0.00 43.02 40.83 2iad s PHE 155 CO 0.01 0.05 0.85 1.14 -0.10 0.00 0.00 175.22 177.17 2iad s GLN 156 N -3.98 0.85 0.15 0.44 -2.07 -0.96 -0.51 119.66 113.58 2iad s GLN 156 Ca 0.13 -0.11 -0.21 0.00 -1.82 0.00 0.00 55.36 53.35 2iad s GLN 156 Cb 0.01 0.40 0.06 0.00 -1.09 0.00 0.00 33.01 32.38 2iad s GLN 156 CO 0.08 -0.33 0.54 0.54 -1.32 0.00 0.00 175.29 174.80 2iad s VAL 157 N -2.34 0.02 -0.18 3.63 0.11 -0.23 -1.00 120.40 120.40 2iad s VAL 157 Ca 0.00 -0.17 0.01 0.00 -2.93 0.00 0.00 61.98 58.89 2iad s VAL 157 Cb -0.01 -1.05 0.03 0.00 -1.53 0.00 0.00 36.38 33.82 2iad s VAL 157 CO -0.04 -0.09 -0.18 -0.76 -3.33 0.00 0.00 175.10 170.70 2iad s LEU 158 N -2.73 2.21 -0.27 2.54 1.43 -1.26 -2.11 118.68 118.48 2iad s LEU 158 Ca 0.01 -0.72 -0.04 0.00 -1.03 0.00 0.00 54.13 52.35 2iad s LEU 158 Cb -0.00 -1.44 0.02 0.00 0.03 0.00 0.00 46.19 44.80 2iad s LEU 158 CO -0.12 -0.03 0.01 -0.69 0.23 0.00 0.00 176.35 175.75 2iad s VAL 159 N 1.30 3.44 0.18 -1.59 1.01 -0.74 0.38 120.40 124.39 2iad s VAL 159 Ca 0.03 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.21 2iad s VAL 159 Cb -0.14 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 2iad s VAL 159 CO -0.12 0.14 0.25 -0.04 0.00 0.00 0.00 175.10 175.34 2iad s MET 160 N 1.42 3.24 -0.07 2.72 -1.94 0.16 -1.11 119.30 123.73 2iad s MET 160 Ca 0.01 -0.76 0.02 0.00 -1.71 0.00 0.00 55.69 53.26 2iad s MET 160 Cb -0.17 -2.82 0.02 0.00 2.01 0.00 0.00 34.83 33.86 2iad s MET 160 CO -0.01 0.48 -0.11 -1.17 -0.01 0.00 0.00 175.02 174.20 2iad s LEU 161 N -3.44 1.57 0.36 -0.03 2.96 0.40 -0.08 118.68 120.42 2iad s LEU 161 Ca 0.33 -0.28 -0.26 0.00 -0.22 0.00 0.00 54.13 53.70 2iad s LEU 161 Cb -0.10 -0.79 -0.09 0.00 0.50 0.00 0.00 46.19 45.71 2iad s LEU 161 CO 0.27 0.01 1.07 -0.70 -1.32 0.00 0.00 176.35 175.68 2iad s GLU 162 N 0.78 4.32 0.22 1.98 2.56 0.48 -2.23 118.70 126.81 2iad s GLU 162 Ca -0.12 1.63 -0.21 0.00 0.00 0.00 0.00 54.97 56.27 2iad s GLU 162 Cb -0.15 -2.78 0.07 0.00 2.00 0.00 0.00 34.13 33.28 2iad s GLU 162 CO 0.02 -0.03 1.01 0.00 -0.56 0.00 0.00 175.26 175.70 2iad s MET 163 N -2.12 1.45 -0.38 4.30 0.23 -1.14 -4.93 119.30 116.72 2iad s MET 163 Ca 0.53 -0.94 0.07 0.00 -1.03 0.00 0.00 55.69 54.32 2iad s MET 163 Cb -0.26 0.40 0.19 0.00 -1.53 0.00 0.00 34.83 33.63 2iad s MET 163 CO 0.33 -0.68 0.64 0.95 -2.03 0.00 0.00 175.02 174.23 2iad s THR 164 N -2.13 -0.97 1.06 3.16 -4.23 -1.26 -2.52 115.64 108.75 2iad s THR 164 Ca 0.22 0.00 -0.20 0.00 -1.18 0.00 0.00 61.69 60.53 2iad s THR 164 Cb -0.03 -0.26 0.05 0.00 1.34 0.00 0.00 72.50 73.60 2iad s THR 164 CO 0.06 0.00 -0.31 -0.81 -0.54 0.00 0.00 174.62 173.02 2iad n PRO 165 N 4.66 -1.34 -3.63 3.99 -0.04 -1.26 -5.07 135.00 132.31 2iad n PRO 165 Ca 0.09 -0.38 -0.15 0.00 -0.04 0.00 0.00 63.50 63.02 2iad n PRO 165 Cb 0.56 -1.48 -0.07 0.00 -0.04 0.00 0.00 33.50 32.47 2iad n PRO 165 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2iad s HIS 166 N -2.14 -0.67 -0.14 0.54 4.02 -1.26 -5.12 115.29 110.52 2iad s HIS 166 Ca 0.46 1.53 -0.29 0.00 1.02 0.00 0.00 55.06 57.78 2iad s HIS 166 Cb -0.05 0.27 -0.01 0.00 -1.02 0.00 0.00 32.58 31.76 2iad s HIS 166 CO 0.59 -0.40 1.17 -1.14 1.02 0.00 0.00 174.74 175.98 2iad s GLN 167 N -0.06 4.29 0.00 1.40 -0.44 -1.26 -2.44 119.66 121.16 2iad s GLN 167 Ca -0.03 1.58 0.00 0.00 -2.50 0.00 0.00 55.36 54.41 2iad s GLN 167 Cb -0.04 -3.65 0.00 0.00 -1.64 0.00 0.00 33.01 27.68 2iad s GLN 167 CO 0.03 -0.57 0.00 0.41 0.50 0.00 0.00 175.29 175.66 2iad n GLY 168 N 3.43 0.93 3.86 2.59 0.00 -1.26 -5.10 105.19 109.64 2iad n GLY 168 Ca 0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 2iad n GLY 168 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2iad s GLU 169 N -0.27 3.68 -0.14 1.61 2.02 -1.02 -5.02 118.70 119.55 2iad s GLU 169 Ca 0.00 0.13 0.00 0.00 0.02 0.00 0.00 54.97 55.12 2iad s GLU 169 Cb 0.00 -3.19 0.02 0.00 0.10 0.00 0.00 34.13 31.06 2iad s GLU 169 CO 0.00 0.72 -0.12 0.08 0.02 0.00 0.00 175.26 175.96 2iad s VAL 170 N -1.09 1.41 -0.18 2.63 1.01 -1.26 -4.51 120.40 118.41 2iad s VAL 170 Ca 0.21 -0.53 -0.07 0.00 0.00 0.00 0.00 61.98 61.58 2iad s VAL 170 Cb -0.14 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 2iad s VAL 170 CO 0.10 0.43 0.05 -0.31 0.00 0.00 0.00 175.10 175.37 2iad s TYR 171 N 1.55 3.23 -0.04 5.22 1.51 -0.63 0.94 117.35 129.13 2iad s TYR 171 Ca 0.05 0.03 0.06 0.00 -1.01 0.00 0.00 57.07 56.20 2iad s TYR 171 Cb -0.13 -2.07 -0.02 0.00 -0.11 0.00 0.00 41.96 39.63 2iad s TYR 171 CO -0.10 0.13 -0.20 0.99 -1.11 0.00 0.00 175.55 175.25 2iad s THR 172 N 0.40 2.54 -0.41 -0.71 2.01 0.61 -0.44 115.64 119.64 2iad s THR 172 Ca 0.02 -0.92 -0.13 0.00 0.31 0.00 0.00 61.69 60.98 2iad s THR 172 Cb -0.13 -1.94 0.04 0.00 0.01 0.00 0.00 72.50 70.48 2iad s THR 172 CO 0.01 0.58 0.27 0.00 -0.69 0.00 0.00 174.62 174.79 2iad s HIS 174 N 1.59 3.20 -0.14 0.00 5.04 -0.05 -2.82 115.29 122.11 2iad s HIS 174 Ca 0.03 -0.10 -0.01 0.00 -1.54 0.00 0.00 55.06 53.44 2iad s HIS 174 Cb -0.21 -2.39 -0.01 0.00 0.04 0.00 0.00 32.58 30.02 2iad s HIS 174 CO 0.07 -0.27 -0.12 0.08 -2.34 0.00 0.00 174.74 172.16 2iad s VAL 175 N 1.72 3.08 -0.20 0.89 1.01 -0.62 -0.33 120.40 125.95 2iad s VAL 175 Ca 0.06 -0.64 -0.03 0.00 0.00 0.00 0.00 61.98 61.37 2iad s VAL 175 Cb -0.16 -2.31 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 2iad s VAL 175 CO 0.09 0.51 -0.05 -1.61 0.00 0.00 0.00 175.10 174.05 2iad s GLU 176 N 0.53 3.43 -0.01 2.72 2.02 0.12 -1.63 118.70 125.87 2iad s GLU 176 Ca -0.08 -0.61 -0.18 0.00 0.02 0.00 0.00 54.97 54.12 2iad s GLU 176 Cb -0.16 -2.95 0.03 0.00 0.10 0.00 0.00 34.13 31.15 2iad s GLU 176 CO 0.04 -0.08 0.38 -1.58 0.02 0.00 0.00 175.26 174.04 2iad s HIS 177 N 1.16 -0.27 -0.00 1.61 2.46 -1.26 -1.52 115.29 117.47 2iad s HIS 177 Ca 0.02 0.39 0.31 0.00 0.47 0.00 0.00 55.06 56.25 2iad s HIS 177 Cb -0.14 0.16 1.44 0.00 -0.13 0.00 0.00 32.58 33.91 2iad s HIS 177 CO -0.01 -0.45 1.93 -1.35 -2.47 0.00 0.00 174.74 172.39 2iad h PRO 178 N 3.60 0.00 0.00 2.88 0.11 -1.93 -2.81 132.00 133.84 2iad h PRO 178 Ca -0.29 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.67 2iad h PRO 178 Cb 1.17 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 2iad h PRO 178 CO 0.41 0.00 -0.79 0.66 -0.21 0.00 0.00 178.00 178.07 2iad h SER 179 N 0.00 0.00 -4.37 -2.05 4.64 -1.88 -3.46 113.55 106.43 2iad h SER 179 Ca 0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 2iad h SER 179 Cb 0.29 0.00 0.10 0.00 -0.31 0.00 0.00 62.40 62.47 2iad h SER 179 CO 0.00 0.67 0.37 -0.76 -0.87 0.00 0.00 176.83 176.24 2iad s LEU 180 N -6.45 2.72 -0.01 5.97 2.01 -1.06 -4.81 118.68 117.05 2iad s LEU 180 Ca 0.02 1.23 0.13 0.00 0.01 0.00 0.00 54.13 55.52 2iad s LEU 180 Cb 0.08 -3.91 -0.17 0.00 0.01 0.00 0.00 46.19 42.20 2iad s LEU 180 CO 0.78 -1.72 0.42 0.29 1.01 0.00 0.00 176.35 177.12 2iad n LYS 181 N -3.27 1.57 -3.66 1.70 5.02 -1.26 -4.96 118.16 113.30 2iad n LYS 181 Ca 0.07 -0.06 -0.13 0.00 -2.02 0.00 0.00 58.31 56.17 2iad n LYS 181 Cb 0.57 -1.21 -0.08 0.00 -0.02 0.00 0.00 35.03 34.29 2iad n LYS 181 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2iad s SER 182 N -2.88 -0.68 0.44 4.39 1.04 -1.26 -5.13 113.70 109.62 2iad s SER 182 Ca -0.00 1.27 -0.23 0.00 0.48 0.00 0.00 55.95 57.47 2iad s SER 182 Cb 0.09 1.27 -0.10 0.00 0.10 0.00 0.00 66.02 67.38 2iad s SER 182 CO 0.54 -0.22 0.88 -2.65 0.98 0.00 0.00 173.24 172.77 2iad n PRO 183 N 2.99 1.09 -3.72 4.02 -0.02 -1.26 -4.94 135.00 133.15 2iad n PRO 183 Ca -0.15 0.39 -0.29 0.00 -2.02 0.00 0.00 63.50 61.44 2iad n PRO 183 Cb 0.56 -1.92 -0.04 0.00 -0.02 0.00 0.00 33.50 32.09 2iad n PRO 183 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2iad s ILE 184 N -1.36 5.22 0.19 4.25 -4.36 -0.65 -4.90 121.20 119.59 2iad s ILE 184 Ca 0.65 -0.28 0.04 0.00 -0.26 0.00 0.00 60.65 60.80 2iad s ILE 184 Cb -0.55 -3.69 -0.05 0.00 1.25 0.00 0.00 42.46 39.42 2iad s ILE 184 CO 0.56 -0.08 -0.04 -0.89 0.24 0.00 0.00 174.94 174.72 2iad s THR 185 N -1.77 1.06 -0.12 8.37 2.01 -1.26 -1.59 115.64 122.34 2iad s THR 185 Ca 0.39 -2.04 -0.24 0.00 0.31 0.00 0.00 61.69 60.10 2iad s THR 185 Cb -0.12 -2.12 0.06 0.00 0.01 0.00 0.00 72.50 70.34 2iad s THR 185 CO 0.28 -0.51 0.59 0.68 -0.69 0.00 0.00 174.62 174.96 2iad s VAL 186 N -3.40 0.01 0.02 3.82 -7.23 -1.13 -4.96 120.40 107.52 2iad s VAL 186 Ca 0.23 -0.08 0.03 0.00 -1.81 0.00 0.00 61.98 60.35 2iad s VAL 186 Cb 0.04 -0.87 -0.01 0.00 0.56 0.00 0.00 36.38 36.10 2iad s VAL 186 CO 0.05 -0.04 -0.09 -1.61 -0.31 0.00 0.00 175.10 173.09 2iad s GLU 187 N -0.56 0.68 0.00 4.82 2.02 -1.26 -0.35 118.70 124.05 2iad s GLU 187 Ca -0.07 -0.50 0.08 0.00 0.02 0.00 0.00 54.97 54.51 2iad s GLU 187 Cb -0.03 -0.62 -0.02 0.00 0.10 0.00 0.00 34.13 33.56 2iad s GLU 187 CO 0.05 0.16 -0.25 -0.46 0.02 0.00 0.00 175.26 174.77 2iad s TRP 188 N -0.60 2.27 0.00 1.61 -0.00 0.42 -4.96 118.94 117.68 2iad s TRP 188 Ca -0.00 -0.42 0.00 0.00 -0.00 0.00 0.00 56.10 55.68 2iad s TRP 188 Cb -0.06 -1.43 0.00 0.00 -0.00 0.00 0.00 33.47 31.99 2iad s TRP 188 CO 0.00 0.01 0.00 -1.13 -0.00 0.00 0.00 176.95 175.84 2iad n SER 189 N 2.24 0.00 0.00 5.86 3.41 -1.26 -1.61 113.62 122.25 2iad n SER 189 Ca -0.16 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 2iad n SER 189 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 2iad n SER 189 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68