#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iza n GLU 14 N 0.00 0.00 -0.17 0.00 2.13 -1.26 -0.16 120.64 121.18 2iza n GLU 14 Ca 0.00 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.80 2iza n GLU 14 Cb 0.00 0.00 0.07 0.00 0.27 0.00 0.00 31.44 31.78 2iza n GLU 14 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2iza h ALA 15 N 0.00 0.66 0.00 4.31 0.00 -1.94 -1.19 119.26 121.10 2iza h ALA 15 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2iza h ALA 15 Cb 0.00 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2iza h ALA 15 CO 0.00 -0.20 -0.03 0.78 0.00 0.00 0.00 179.25 179.81 2iza h GLY 16 N 0.38 0.00 0.88 0.00 0.00 -0.98 -2.81 103.07 100.54 2iza h GLY 16 Ca 0.26 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 47.24 2iza h GLY 16 CO -0.25 0.00 -1.79 -2.22 0.00 0.00 0.00 176.54 172.27 2iza h ILE 17 N 0.00 0.88 -2.54 2.60 2.04 -1.40 -3.46 117.51 115.63 2iza h ILE 17 Ca -0.00 -2.50 -0.60 0.00 1.00 0.00 0.00 64.86 62.76 2iza h ILE 17 Cb 0.25 2.70 0.08 0.00 -0.74 0.00 0.00 36.82 39.12 2iza h ILE 17 CO 0.00 0.86 0.53 0.41 0.00 0.00 0.00 178.15 179.95 2iza n THR 18 N -3.55 1.00 0.00 -0.27 -1.04 -0.57 -4.78 114.28 105.08 2iza n THR 18 Ca -0.26 -0.25 0.00 0.00 -2.04 0.00 0.00 64.05 61.50 2iza n THR 18 Cb 1.07 -1.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.24 2iza n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2iza n GLY 19 N 2.06 0.86 3.75 3.41 0.00 0.18 -4.98 105.19 110.46 2iza n GLY 19 Ca 0.12 -1.98 -0.35 0.00 0.00 0.00 0.00 46.02 43.81 2iza n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2iza s THR 20 N -1.76 5.35 0.08 2.61 2.01 -1.26 -1.37 115.64 121.30 2iza s THR 20 Ca 0.00 0.17 0.08 0.00 0.31 0.00 0.00 61.69 62.25 2iza s THR 20 Cb 0.00 -3.42 -0.03 0.00 0.01 0.00 0.00 72.50 69.06 2iza s THR 20 CO 0.00 0.48 -0.22 0.26 -0.69 0.00 0.00 174.62 174.45 2iza s TRP 21 N 0.09 1.91 0.04 4.92 0.52 0.13 -4.60 118.94 121.95 2iza s TRP 21 Ca 0.09 -0.40 0.06 0.00 0.02 0.00 0.00 56.10 55.87 2iza s TRP 21 Cb -0.11 -1.08 -0.02 0.00 -1.15 0.00 0.00 33.47 31.10 2iza s TRP 21 CO -0.01 0.18 -0.17 0.71 0.02 0.00 0.00 176.95 177.68 2iza s TYR 22 N -1.00 1.50 0.50 -1.98 2.02 0.09 -1.29 117.35 117.20 2iza s TYR 22 Ca 0.08 -0.36 0.04 0.00 -0.37 0.00 0.00 57.07 56.46 2iza s TYR 22 Cb -0.10 -0.89 -0.00 0.00 -0.40 0.00 0.00 41.96 40.57 2iza s TYR 22 CO 0.03 0.07 0.19 0.54 -1.57 0.00 0.00 175.55 174.81 2iza s ASN 23 N -1.19 4.37 0.47 2.29 2.20 -0.88 -0.94 114.94 121.26 2iza s ASN 23 Ca 0.04 -1.38 0.13 0.00 -0.94 0.00 0.00 52.86 50.72 2iza s ASN 23 Cb -0.08 0.26 1.09 0.00 -2.00 0.00 0.00 41.25 40.52 2iza s ASN 23 CO 0.02 -0.88 2.07 1.56 -2.94 0.00 0.00 177.10 176.92 2iza h GLN 24 N 1.15 0.27 -0.09 3.55 1.08 -1.91 -2.69 115.11 116.46 2iza h GLN 24 Ca -0.41 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.77 2iza h GLN 24 Cb 1.30 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.67 2iza h GLN 24 CO 0.67 0.18 0.00 1.28 -0.95 0.00 0.00 178.83 180.01 2iza n LEU 25 N -4.49 0.82 0.00 1.46 4.77 -1.26 -4.89 117.00 113.41 2iza n LEU 25 Ca 0.03 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.66 2iza n LEU 25 Cb 0.19 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 2iza n LEU 25 CO 0.35 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 2iza n GLY 26 N 0.92 0.82 3.91 -0.72 0.00 -1.01 -4.71 105.19 104.41 2iza n GLY 26 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 2iza n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2iza s SER 27 N -2.07 6.22 0.02 1.61 0.01 -1.26 -4.44 113.70 113.79 2iza s SER 27 Ca 0.00 0.83 0.02 0.00 1.31 0.00 0.00 55.95 58.11 2iza s SER 27 Cb 0.00 -2.17 -0.02 0.00 0.21 0.00 0.00 66.02 64.04 2iza s SER 27 CO 0.00 -0.57 -0.06 -0.89 0.41 0.00 0.00 173.24 172.13 2iza s THR 28 N -2.69 0.44 -0.02 1.44 2.01 -0.55 -2.06 115.64 114.21 2iza s THR 28 Ca 0.47 -0.70 -0.03 0.00 0.31 0.00 0.00 61.69 61.73 2iza s THR 28 Cb -0.10 -0.46 0.00 0.00 0.01 0.00 0.00 72.50 71.95 2iza s THR 28 CO 0.43 -0.19 0.07 0.72 -0.69 0.00 0.00 174.62 174.97 2iza s PHE 29 N -0.86 -0.01 -0.13 4.92 -0.12 -0.41 -0.53 117.98 120.84 2iza s PHE 29 Ca -0.06 0.05 0.02 0.00 -0.05 0.00 0.00 56.93 56.90 2iza s PHE 29 Cb -0.07 -0.02 -0.00 0.00 -0.63 0.00 0.00 43.02 42.31 2iza s PHE 29 CO 0.00 -0.11 -0.20 0.42 -0.05 0.00 0.00 175.22 175.28 2iza s ILE 30 N -0.42 2.34 0.09 -4.49 1.09 -0.22 -0.69 121.20 118.89 2iza s ILE 30 Ca -0.05 -0.90 0.03 0.00 -1.10 0.00 0.00 60.65 58.63 2iza s ILE 30 Cb -0.03 -1.94 -0.03 0.00 -1.06 0.00 0.00 42.46 39.40 2iza s ILE 30 CO 0.00 0.54 -0.10 0.68 -0.10 0.00 0.00 174.94 175.97 2iza s VAL 31 N 0.55 0.87 -0.12 2.92 -7.23 -0.47 -1.67 120.40 115.25 2iza s VAL 31 Ca -0.12 -1.55 0.01 0.00 -1.81 0.00 0.00 61.98 58.51 2iza s VAL 31 Cb -0.17 -1.25 0.02 0.00 0.56 0.00 0.00 36.38 35.54 2iza s VAL 31 CO 0.04 -0.53 -0.15 -0.89 -0.31 0.00 0.00 175.10 173.26 2iza s THR 32 N -2.28 1.54 -0.39 5.32 2.01 -0.51 -0.65 115.64 120.68 2iza s THR 32 Ca 0.03 -0.65 -0.14 0.00 0.31 0.00 0.00 61.69 61.24 2iza s THR 32 Cb -0.04 -1.42 0.02 0.00 0.01 0.00 0.00 72.50 71.07 2iza s THR 32 CO -0.00 0.45 0.27 0.00 -0.69 0.00 0.00 174.62 174.64 2iza s ALA 33 N 1.12 3.43 0.47 7.40 0.00 -1.26 -1.99 121.76 130.94 2iza s ALA 33 Ca -0.03 -1.66 -0.13 0.00 0.00 0.00 0.00 51.96 50.14 2iza s ALA 33 Cb -0.14 -2.77 -0.07 0.00 0.00 0.00 0.00 23.12 20.14 2iza s ALA 33 CO -0.04 -1.35 0.88 0.20 0.00 0.00 0.00 175.76 175.45 2iza s GLY 34 N 1.66 1.94 0.33 0.00 0.00 0.46 -4.74 107.32 106.97 2iza s GLY 34 Ca 0.04 -0.06 0.13 0.00 0.00 0.00 0.00 44.72 44.83 2iza s GLY 34 CO 0.09 0.17 1.65 0.00 0.00 0.00 0.00 173.10 175.02 2iza h ALA 35 N 0.92 1.84 -0.97 3.20 0.00 -1.98 -2.84 119.26 119.44 2iza h ALA 35 Ca -0.47 0.20 -0.68 0.00 0.00 0.00 0.00 54.91 53.97 2iza h ALA 35 Cb 1.19 0.20 -0.28 0.00 0.00 0.00 0.00 17.79 18.90 2iza h ALA 35 CO 0.63 -0.58 0.89 -0.25 0.00 0.00 0.00 179.25 179.94 2iza n ASP 36 N -5.10 7.60 0.00 0.00 8.00 -1.26 -4.85 116.55 120.93 2iza n ASP 36 Ca 0.30 -3.75 0.00 0.00 0.71 0.00 0.00 54.79 52.05 2iza n ASP 36 Cb 0.95 -1.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.04 2iza n ASP 36 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2iza n GLY 37 N -0.74 0.74 3.88 0.44 0.00 -1.07 -5.01 105.19 103.42 2iza n GLY 37 Ca 0.59 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.30 2iza n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2iza s ALA 38 N -2.72 3.53 -0.10 4.61 0.00 -1.24 -1.37 121.76 124.48 2iza s ALA 38 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 51.96 51.69 2iza s ALA 38 Cb 0.00 -2.47 0.02 0.00 0.00 0.00 0.00 23.12 20.67 2iza s ALA 38 CO 0.00 0.42 -0.09 -0.51 0.00 0.00 0.00 175.76 175.58 2iza s LEU 39 N -3.01 1.33 0.05 0.00 1.43 -0.63 -0.41 118.68 117.45 2iza s LEU 39 Ca 0.48 -0.30 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 2iza s LEU 39 Cb -0.11 -0.83 -0.03 0.00 0.03 0.00 0.00 46.19 45.25 2iza s LEU 39 CO 0.23 -0.07 -0.06 0.42 0.23 0.00 0.00 176.35 177.10 2iza s THR 40 N 1.38 0.45 -3.96 5.49 -4.23 -0.84 -1.02 115.64 112.91 2iza s THR 40 Ca -0.01 -1.37 0.00 0.00 -1.18 0.00 0.00 61.69 59.13 2iza s THR 40 Cb -0.14 -0.94 0.00 0.00 1.34 0.00 0.00 72.50 72.76 2iza s THR 40 CO -0.05 -0.62 0.00 0.61 -0.54 0.00 0.00 174.62 174.02 2iza n GLY 41 N 0.91 -0.52 3.02 3.99 0.00 -1.09 -1.42 105.19 110.08 2iza n GLY 41 Ca -0.19 -0.89 -0.11 0.00 0.00 0.00 0.00 46.02 44.83 2iza n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2iza s THR 42 N -3.34 0.32 -0.08 2.61 -4.23 -0.67 -1.69 115.64 108.55 2iza s THR 42 Ca 0.00 -1.03 0.04 0.00 -1.18 0.00 0.00 61.69 59.52 2iza s THR 42 Cb 0.00 -0.47 -0.01 0.00 1.34 0.00 0.00 72.50 73.36 2iza s THR 42 CO 0.00 -0.46 -0.21 -0.47 -0.54 0.00 0.00 174.62 172.94 2iza s TYR 43 N -1.52 2.59 -0.18 3.99 6.14 0.08 -1.06 117.35 127.39 2iza s TYR 43 Ca -0.12 -0.70 0.01 0.00 0.64 0.00 0.00 57.07 56.90 2iza s TYR 43 Cb -0.09 -1.68 0.02 0.00 0.42 0.00 0.00 41.96 40.62 2iza s TYR 43 CO -0.01 -0.21 -0.19 -1.83 0.64 0.00 0.00 175.55 173.95 2iza s GLU 44 N -0.01 2.91 0.76 4.97 1.03 0.31 -0.78 118.70 127.89 2iza s GLU 44 Ca -0.07 -0.83 -0.05 0.00 0.03 0.00 0.00 54.97 54.06 2iza s GLU 44 Cb -0.15 -2.55 0.13 0.00 -0.80 0.00 0.00 34.13 30.76 2iza s GLU 44 CO 0.05 -0.23 1.05 -1.54 -1.33 0.00 0.00 175.26 173.27 2iza s SER 45 N 1.30 4.22 0.00 0.83 1.04 -1.19 -1.48 113.70 118.42 2iza s SER 45 Ca 0.04 -0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.41 2iza s SER 45 Cb -0.13 -0.32 0.00 0.00 0.10 0.00 0.00 66.02 65.67 2iza s SER 45 CO -0.13 -1.96 0.00 0.00 0.98 0.00 0.00 173.24 172.14 2iza n ALA 46 N -3.02 1.60 -2.32 5.32 0.00 -1.26 -4.80 120.51 116.04 2iza n ALA 46 Ca 0.13 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.41 2iza n ALA 46 Cb 0.60 0.07 -0.10 0.00 0.00 0.00 0.00 19.45 20.02 2iza n ALA 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2iza s VAL 47 N -1.60 0.83 0.00 0.00 -7.23 -1.26 -5.01 120.40 106.13 2iza s VAL 47 Ca 0.00 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.16 2iza s VAL 47 Cb 0.00 -2.42 0.00 0.00 0.56 0.00 0.00 36.38 34.52 2iza s VAL 47 CO 0.00 -0.24 0.00 0.61 -0.31 0.00 0.00 175.10 175.16 2iza n GLY 48 N -0.41 -1.81 2.55 2.32 0.00 -1.26 -4.36 105.19 102.21 2iza n GLY 48 Ca -0.04 -1.82 -0.40 0.00 0.00 0.00 0.00 46.02 43.76 2iza n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2iza n ASN 49 N 0.26 7.75 -4.35 1.61 5.15 -1.26 -4.86 115.26 119.56 2iza n ASN 49 Ca 0.00 -3.31 -0.19 0.00 -0.60 0.00 0.00 54.58 50.47 2iza n ASN 49 Cb 0.00 -1.30 -0.10 0.00 -0.53 0.00 0.00 39.78 37.84 2iza n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2iza s ALA 50 N -2.12 2.04 -0.32 5.20 0.00 -1.26 -4.51 121.76 120.79 2iza s ALA 50 Ca 0.49 -1.64 -0.04 0.00 0.00 0.00 0.00 51.96 50.77 2iza s ALA 50 Cb 0.18 -0.11 0.19 0.00 0.00 0.00 0.00 23.12 23.39 2iza s ALA 50 CO -0.10 0.10 0.87 -2.00 0.00 0.00 0.00 175.76 174.63 2iza s GLU 51 N -3.52 0.35 0.00 0.00 2.12 -1.26 -4.98 118.70 111.41 2iza s GLU 51 Ca 0.22 0.16 0.00 0.00 0.36 0.00 0.00 54.97 55.71 2iza s GLU 51 Cb -0.02 0.11 0.00 0.00 0.26 0.00 0.00 34.13 34.48 2iza s GLU 51 CO 0.07 -0.59 0.00 0.45 -0.54 0.00 0.00 175.26 174.65 2iza n SER 52 N 4.84 0.00 -4.81 -1.70 2.88 -1.26 -4.70 113.62 108.87 2iza n SER 52 Ca 0.08 0.00 -0.37 0.00 -1.33 0.00 0.00 58.87 57.24 2iza n SER 52 Cb 0.58 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.97 2iza n SER 52 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2iza s ARG 53 N 0.00 3.96 0.10 -1.46 0.52 -1.26 -3.20 118.95 117.61 2iza s ARG 53 Ca 0.00 0.25 0.08 0.00 -0.52 0.00 0.00 55.73 55.54 2iza s ARG 53 Cb 0.00 -3.28 -0.03 0.00 0.52 0.00 0.00 34.95 32.15 2iza s ARG 53 CO 0.00 0.55 -0.20 0.71 0.02 0.00 0.00 175.30 176.38 2iza s TYR 54 N -0.55 1.70 0.34 -0.53 1.51 0.04 -4.86 117.35 115.00 2iza s TYR 54 Ca 0.21 -0.43 -0.27 0.00 -1.01 0.00 0.00 57.07 55.58 2iza s TYR 54 Cb -0.15 -0.93 -0.09 0.00 -0.11 0.00 0.00 41.96 40.68 2iza s TYR 54 CO 0.09 0.18 1.07 0.08 -1.11 0.00 0.00 175.55 175.87 2iza s VAL 55 N -1.19 3.61 0.07 0.71 1.01 -1.26 -0.74 120.40 122.61 2iza s VAL 55 Ca 0.05 1.42 0.06 0.00 0.00 0.00 0.00 61.98 63.51 2iza s VAL 55 Cb -0.10 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 2iza s VAL 55 CO 0.04 0.19 -0.16 -1.48 0.00 0.00 0.00 175.10 173.69 2iza s LEU 56 N -2.04 2.25 -0.05 3.92 0.05 -0.68 -4.36 118.68 117.77 2iza s LEU 56 Ca 0.51 -0.59 -0.08 0.00 0.05 0.00 0.00 54.13 54.02 2iza s LEU 56 Cb -0.27 -0.66 0.01 0.00 -2.05 0.00 0.00 46.19 43.23 2iza s LEU 56 CO 0.34 -0.00 0.19 0.28 -0.55 0.00 0.00 176.35 176.61 2iza s THR 57 N -1.11 0.03 0.00 5.48 -1.32 -0.99 -2.67 115.64 115.06 2iza s THR 57 Ca 0.01 -0.26 0.00 0.00 -1.21 0.00 0.00 61.69 60.23 2iza s THR 57 Cb -0.09 -0.36 0.00 0.00 -1.51 0.00 0.00 72.50 70.53 2iza s THR 57 CO 0.02 -0.14 0.00 0.61 -2.21 0.00 0.00 174.62 172.90 2iza n GLY 58 N 2.34 1.72 3.12 6.08 0.00 -0.19 -0.98 105.19 117.29 2iza n GLY 58 Ca -0.17 -0.88 -0.09 0.00 0.00 0.00 0.00 46.02 44.89 2iza n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2iza s ARG 59 N -1.15 0.62 0.07 1.61 1.81 -0.43 -1.60 118.95 119.88 2iza s ARG 59 Ca 0.00 -0.82 0.02 0.00 -1.72 0.00 0.00 55.73 53.21 2iza s ARG 59 Cb 0.00 0.24 -0.03 0.00 -0.45 0.00 0.00 34.95 34.71 2iza s ARG 59 CO 0.00 -0.16 -0.07 1.52 -0.68 0.00 0.00 175.30 175.91 2iza s TYR 60 N -2.89 0.77 -0.46 -0.53 1.13 -0.47 -1.56 117.35 113.34 2iza s TYR 60 Ca -0.03 -0.68 -0.08 0.00 -1.41 0.00 0.00 57.07 54.88 2iza s TYR 60 Cb 0.00 -0.45 0.12 0.00 -1.10 0.00 0.00 41.96 40.53 2iza s TYR 60 CO -0.06 -0.11 0.32 0.34 -2.51 0.00 0.00 175.55 173.53 2iza s ASP 61 N -2.20 5.62 0.01 -0.18 3.68 -0.25 -4.58 116.67 118.79 2iza s ASP 61 Ca -0.01 -1.94 -0.30 0.00 2.13 0.00 0.00 52.55 52.43 2iza s ASP 61 Cb -0.04 -1.98 -0.04 0.00 -1.45 0.00 0.00 42.92 39.42 2iza s ASP 61 CO -0.02 -0.67 1.09 -0.55 0.13 0.00 0.00 175.17 175.16 2iza s SER 62 N 2.52 7.21 0.00 -0.34 0.15 -1.26 -4.33 113.70 117.66 2iza s SER 62 Ca 0.06 1.82 0.01 0.00 0.70 0.00 0.00 55.95 58.54 2iza s SER 62 Cb -0.26 -2.57 -0.01 0.00 -1.71 0.00 0.00 66.02 61.48 2iza s SER 62 CO -0.01 -0.39 -0.04 0.00 1.20 0.00 0.00 173.24 174.00 2iza s ALA 63 N 1.20 0.30 -0.15 5.45 0.00 -1.26 -5.10 121.76 122.20 2iza s ALA 63 Ca 0.55 -0.24 -0.31 0.00 0.00 0.00 0.00 51.96 51.97 2iza s ALA 63 Cb -0.25 -0.05 -0.08 0.00 0.00 0.00 0.00 23.12 22.75 2iza s ALA 63 CO 0.27 0.05 2.10 -0.35 0.00 0.00 0.00 175.76 177.83 2iza n PRO 64 N 2.75 2.12 -4.85 0.00 -0.04 -1.26 -5.01 135.00 128.71 2iza n PRO 64 Ca -0.14 0.68 -0.31 0.00 -0.04 0.00 0.00 63.50 63.69 2iza n PRO 64 Cb 0.58 -2.98 -0.14 0.00 -0.04 0.00 0.00 33.50 30.92 2iza n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2iza s ALA 65 N 6.51 2.47 -0.05 0.55 0.00 -1.26 -5.00 121.76 124.98 2iza s ALA 65 Ca 0.98 -1.16 0.08 0.00 0.00 0.00 0.00 51.96 51.85 2iza s ALA 65 Cb -0.49 -0.69 0.12 0.00 0.00 0.00 0.00 23.12 22.06 2iza s ALA 65 CO 0.42 0.56 1.00 0.25 0.00 0.00 0.00 175.76 177.98 2iza n THR 66 N 1.85 0.99 -2.31 0.00 -2.24 -1.26 -4.78 114.28 106.53 2iza n THR 66 Ca -0.16 -1.14 0.04 0.00 -2.27 0.00 0.00 64.05 60.51 2iza n THR 66 Cb 0.52 0.26 0.03 0.00 -2.10 0.00 0.00 70.33 69.04 2iza n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2iza n ASP 67 N -0.70 0.89 -3.12 3.42 5.75 -1.26 -5.03 116.55 116.50 2iza n ASP 67 Ca 0.07 -2.16 -0.23 0.00 -0.01 0.00 0.00 54.79 52.46 2iza n ASP 67 Cb 0.55 -0.30 0.04 0.00 -1.03 0.00 0.00 41.12 40.38 2iza n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2iza n GLY 68 N 0.25 -0.53 3.95 6.12 0.00 -1.26 -5.02 105.19 108.70 2iza n GLY 68 Ca 0.06 0.15 -0.24 0.00 0.00 0.00 0.00 46.02 45.99 2iza n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2iza s SER 69 N -2.80 4.82 0.60 1.61 0.01 -1.26 -5.08 113.70 111.61 2iza s SER 69 Ca 0.35 0.24 -0.01 0.00 1.31 0.00 0.00 55.95 57.84 2iza s SER 69 Cb -0.16 -0.90 0.04 0.00 0.21 0.00 0.00 66.02 65.21 2iza s SER 69 CO 0.43 -1.55 0.86 -0.83 0.41 0.00 0.00 173.24 172.56 2iza s GLY 70 N -4.53 1.78 -0.27 3.44 0.00 -1.26 -4.95 107.32 101.53 2iza s GLY 70 Ca 0.61 -1.18 -0.12 0.00 0.00 0.00 0.00 44.72 44.03 2iza s GLY 70 CO 0.43 -0.86 0.23 -1.59 0.00 0.00 0.00 173.10 171.32 2iza s THR 71 N -2.93 5.29 0.29 0.90 2.01 0.23 -4.85 115.64 116.58 2iza s THR 71 Ca 0.58 0.27 -0.29 0.00 0.31 0.00 0.00 61.69 62.57 2iza s THR 71 Cb -0.10 -3.57 -0.09 0.00 0.01 0.00 0.00 72.50 68.75 2iza s THR 71 CO 0.41 0.25 1.06 0.00 -0.69 0.00 0.00 174.62 175.65 2iza s ALA 72 N 1.69 3.34 0.28 7.40 0.00 -1.26 -0.25 121.76 132.95 2iza s ALA 72 Ca 0.09 0.81 -0.19 0.00 0.00 0.00 0.00 51.96 52.67 2iza s ALA 72 Cb -0.15 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 19.69 2iza s ALA 72 CO 0.10 -0.10 0.68 -0.48 0.00 0.00 0.00 175.76 175.95 2iza s LEU 73 N -1.61 -0.14 -0.02 0.00 2.34 -0.29 -1.08 118.68 117.87 2iza s LEU 73 Ca 0.46 -0.68 -0.29 0.00 0.06 0.00 0.00 54.13 53.68 2iza s LEU 73 Cb -0.29 2.55 0.09 0.00 -0.56 0.00 0.00 46.19 47.98 2iza s LEU 73 CO 0.37 -1.32 0.76 -0.83 -1.06 0.00 0.00 176.35 174.27 2iza s GLY 74 N -2.94 -0.51 0.16 -3.48 0.00 -0.60 -1.47 107.32 98.48 2iza s GLY 74 Ca 0.13 1.22 -0.13 0.00 0.00 0.00 0.00 44.72 45.94 2iza s GLY 74 CO 0.08 0.68 0.38 0.66 0.00 0.00 0.00 173.10 174.90 2iza s TRP 75 N -2.09 0.10 0.05 1.90 -2.14 -0.77 -1.31 118.94 114.69 2iza s TRP 75 Ca -0.04 -0.46 0.06 0.00 2.66 0.00 0.00 56.10 58.32 2iza s TRP 75 Cb -0.00 0.15 -0.03 0.00 -3.10 0.00 0.00 33.47 30.49 2iza s TRP 75 CO -0.00 -0.77 -0.17 0.99 -2.66 0.00 0.00 176.95 174.34 2iza s THR 76 N -3.90 1.33 -0.06 0.66 2.01 -0.16 -1.09 115.64 114.44 2iza s THR 76 Ca 0.11 -1.16 -0.00 0.00 0.31 0.00 0.00 61.69 60.95 2iza s THR 76 Cb 0.02 -1.20 0.02 0.00 0.01 0.00 0.00 72.50 71.35 2iza s THR 76 CO -0.04 0.02 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.19 2iza s VAL 77 N -0.93 0.52 -0.19 3.82 1.01 -0.38 -2.35 120.40 121.90 2iza s VAL 77 Ca 0.03 -0.04 -0.12 0.00 0.00 0.00 0.00 61.98 61.85 2iza s VAL 77 Cb -0.09 -0.59 -0.05 0.00 0.00 0.00 0.00 36.38 35.65 2iza s VAL 77 CO 0.02 0.25 0.21 0.00 0.00 0.00 0.00 175.10 175.58 2iza s ALA 78 N 1.39 3.63 -1.52 5.51 0.00 -1.26 -0.77 121.76 128.74 2iza s ALA 78 Ca -0.04 -0.63 -0.09 0.00 0.00 0.00 0.00 51.96 51.20 2iza s ALA 78 Cb -0.13 -2.32 -0.01 0.00 0.00 0.00 0.00 23.12 20.66 2iza s ALA 78 CO -0.03 0.03 2.69 0.91 0.00 0.00 0.00 175.76 179.36 2iza n TRP 79 N 3.78 2.60 -4.04 0.00 7.02 -0.24 -4.76 117.44 121.80 2iza n TRP 79 Ca -0.14 -3.00 -0.18 0.00 -1.02 0.00 0.00 57.50 53.16 2iza n TRP 79 Cb 0.52 -2.31 -0.16 0.00 -2.42 0.00 0.00 31.31 26.94 2iza n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 2iza s LYS 80 N 1.33 0.51 0.00 -0.99 2.20 -1.26 -0.91 119.74 120.63 2iza s LYS 80 Ca 0.62 -0.02 0.00 0.00 -0.36 0.00 0.00 55.97 56.22 2iza s LYS 80 Cb 0.17 -0.60 0.00 0.00 -1.51 0.00 0.00 37.83 35.89 2iza s LYS 80 CO -0.07 -0.09 0.00 0.27 -0.36 0.00 0.00 175.35 175.10 2iza n ASN 81 N 3.99 0.00 0.00 1.43 0.23 0.26 -4.79 115.26 116.37 2iza n ASN 81 Ca -0.25 -0.36 0.12 0.00 -0.53 0.00 0.00 54.58 53.55 2iza n ASN 81 Cb 0.51 0.00 0.64 0.00 -2.08 0.00 0.00 39.78 38.85 2iza n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2iza n ASN 82 N -0.70 0.00 0.00 0.53 3.02 -1.26 -3.52 115.26 113.34 2iza n ASN 82 Ca 0.00 -0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.39 2iza n ASN 82 Cb 0.00 -0.25 0.00 0.00 -0.61 0.00 0.00 39.78 38.92 2iza n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2iza n TYR 83 N -1.25 0.00 -3.78 3.10 4.02 -1.26 -5.06 117.16 112.92 2iza n TYR 83 Ca 0.13 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.89 2iza n TYR 83 Cb 0.18 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.41 2iza n TYR 83 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 2iza s ARG 84 N -1.43 0.59 -0.35 -0.72 3.52 -1.23 -5.02 118.95 114.31 2iza s ARG 84 Ca 0.00 -0.13 -0.00 0.00 -0.13 0.00 0.00 55.73 55.47 2iza s ARG 84 Cb 0.00 0.26 0.14 0.00 -1.56 0.00 0.00 34.95 33.79 2iza s ARG 84 CO 0.00 -0.15 0.21 1.21 -0.81 0.00 0.00 175.30 175.76 2iza s ASN 85 N -1.11 2.91 0.00 -2.12 3.84 -1.26 -0.58 114.94 116.62 2iza s ASN 85 Ca -0.12 -2.07 0.30 0.00 0.21 0.00 0.00 52.86 51.19 2iza s ASN 85 Cb -0.05 -0.33 1.56 0.00 -0.55 0.00 0.00 41.25 41.88 2iza s ASN 85 CO 0.03 -0.32 2.03 0.00 -2.79 0.00 0.00 177.10 176.06 2iza n ALA 86 N 4.16 2.65 -3.68 1.71 0.00 -0.08 -4.91 120.51 120.36 2iza n ALA 86 Ca 0.10 -0.29 -0.23 0.00 0.00 0.00 0.00 53.44 53.03 2iza n ALA 86 Cb 0.38 -1.38 0.05 0.00 0.00 0.00 0.00 19.45 18.50 2iza n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2iza n HIS 87 N -0.59 -2.19 -3.79 0.00 -0.00 -1.26 -4.90 115.22 102.48 2iza n HIS 87 Ca 0.21 0.90 -0.09 0.00 -0.00 0.00 0.00 57.72 58.75 2iza n HIS 87 Cb 0.21 -4.55 -0.03 0.00 -0.00 0.00 0.00 29.99 25.62 2iza n HIS 87 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 2iza s SER 88 N -4.00 -0.27 -0.03 0.41 1.04 -1.26 -1.59 113.70 108.01 2iza s SER 88 Ca 0.22 -0.54 -0.13 0.00 0.48 0.00 0.00 55.95 55.99 2iza s SER 88 Cb -0.11 0.64 0.02 0.00 0.10 0.00 0.00 66.02 66.68 2iza s SER 88 CO 0.79 -1.18 0.27 0.00 0.98 0.00 0.00 173.24 174.10 2iza s ALA 89 N -3.90 -0.68 0.03 5.32 0.00 -0.48 -1.08 121.76 120.98 2iza s ALA 89 Ca 0.11 0.31 0.08 0.00 0.00 0.00 0.00 51.96 52.46 2iza s ALA 89 Cb -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 2iza s ALA 89 CO 0.02 -0.23 -0.22 0.99 0.00 0.00 0.00 175.76 176.31 2iza s THR 90 N -1.10 1.80 -0.03 0.00 2.01 0.05 -1.14 115.64 117.23 2iza s THR 90 Ca -0.12 -1.19 0.05 0.00 0.31 0.00 0.00 61.69 60.75 2iza s THR 90 Cb -0.05 -1.54 -0.01 0.00 0.01 0.00 0.00 72.50 70.90 2iza s THR 90 CO 0.03 0.31 -0.19 0.42 -0.69 0.00 0.00 174.62 174.50 2iza s THR 91 N -0.74 1.51 -0.09 -0.82 -4.23 -0.43 -1.24 115.64 109.60 2iza s THR 91 Ca 0.09 -0.80 0.03 0.00 -1.18 0.00 0.00 61.69 59.83 2iza s THR 91 Cb -0.09 -1.27 -0.02 0.00 1.34 0.00 0.00 72.50 72.46 2iza s THR 91 CO 0.01 0.43 -0.17 0.26 -0.54 0.00 0.00 174.62 174.61 2iza s TRP 92 N -0.28 2.67 -0.07 3.99 0.51 -0.25 -1.66 118.94 123.86 2iza s TRP 92 Ca 0.03 -0.56 0.04 0.00 -2.12 0.00 0.00 56.10 53.49 2iza s TRP 92 Cb -0.09 -1.71 0.00 0.00 -0.81 0.00 0.00 33.47 30.86 2iza s TRP 92 CO 0.00 -0.12 -0.18 0.45 -0.51 0.00 0.00 176.95 176.60 2iza s SER 93 N -0.08 2.36 0.00 2.95 0.15 -0.19 -1.85 113.70 117.04 2iza s SER 93 Ca -0.03 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.21 2iza s SER 93 Cb -0.14 -0.93 0.00 0.00 -1.71 0.00 0.00 66.02 63.24 2iza s SER 93 CO 0.04 0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.21 2iza n GLY 94 N 3.47 0.97 3.16 9.45 0.00 -0.55 -1.66 105.19 120.04 2iza n GLY 94 Ca -0.20 -0.46 -0.11 0.00 0.00 0.00 0.00 46.02 45.25 2iza n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2iza s GLN 95 N 1.43 0.61 -0.11 1.61 -2.07 -0.75 -1.14 119.66 119.23 2iza s GLN 95 Ca 0.00 -0.45 -0.10 0.00 -1.82 0.00 0.00 55.36 52.99 2iza s GLN 95 Cb 0.00 0.26 -0.05 0.00 -1.09 0.00 0.00 33.01 32.13 2iza s GLN 95 CO 0.00 -0.16 0.20 -0.47 -1.32 0.00 0.00 175.29 173.54 2iza s TYR 96 N -1.86 3.58 -0.09 9.60 5.04 0.65 -1.87 117.35 132.41 2iza s TYR 96 Ca -0.11 0.60 0.02 0.00 -2.44 0.00 0.00 57.07 55.14 2iza s TYR 96 Cb -0.04 -2.08 0.01 0.00 0.35 0.00 0.00 41.96 40.20 2iza s TYR 96 CO -0.00 0.61 -0.13 0.08 -1.34 0.00 0.00 175.55 174.76 2iza s VAL 97 N -0.70 1.30 0.00 3.14 1.01 -0.18 -0.60 120.40 124.37 2iza s VAL 97 Ca 0.16 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.59 2iza s VAL 97 Cb -0.13 -1.19 0.00 0.00 0.00 0.00 0.00 36.38 35.06 2iza s VAL 97 CO 0.05 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.16 2iza n GLY 98 N 4.04 1.90 0.00 4.51 0.00 -1.26 -0.66 105.19 113.71 2iza n GLY 98 Ca -0.20 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.72 2iza n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2iza n GLY 99 N 5.00 -1.13 0.40 -0.02 0.00 -1.26 -4.26 105.19 103.92 2iza n GLY 99 Ca 0.00 -2.18 -0.07 0.00 0.00 0.00 0.00 46.02 43.78 2iza n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2iza h ALA 100 N 0.00 -0.24 -2.57 4.61 0.00 -2.06 -2.58 119.26 116.41 2iza h ALA 100 Ca 0.00 0.17 -0.62 0.00 0.00 0.00 0.00 54.91 54.46 2iza h ALA 100 Cb 0.00 1.13 -0.41 0.00 0.00 0.00 0.00 17.79 18.51 2iza h ALA 100 CO 0.00 -0.81 -0.51 -0.85 0.00 0.00 0.00 179.25 177.09 2iza n GLU 101 N -5.38 2.34 -2.10 0.00 0.28 -1.26 -5.06 120.64 109.46 2iza n GLU 101 Ca 0.05 -4.59 -0.38 0.00 -0.16 0.00 0.00 57.16 52.07 2iza n GLU 101 Cb 0.34 -2.29 -0.00 0.00 1.43 0.00 0.00 31.44 30.92 2iza n GLU 101 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2iza s ALA 102 N -2.04 3.10 0.22 -1.84 0.00 -0.98 -4.89 121.76 115.33 2iza s ALA 102 Ca 0.33 1.13 -0.18 0.00 0.00 0.00 0.00 51.96 53.24 2iza s ALA 102 Cb 0.06 -3.46 0.02 0.00 0.00 0.00 0.00 23.12 19.75 2iza s ALA 102 CO -0.08 -0.82 0.56 -0.98 0.00 0.00 0.00 175.76 174.44 2iza s ARG 103 N -2.47 1.48 -0.14 0.00 1.70 0.16 -4.29 118.95 115.38 2iza s ARG 103 Ca 0.61 -0.93 -0.00 0.00 -0.47 0.00 0.00 55.73 54.93 2iza s ARG 103 Cb -0.35 0.53 0.03 0.00 -0.57 0.00 0.00 34.95 34.60 2iza s ARG 103 CO 0.43 -0.64 -0.07 0.42 -1.08 0.00 0.00 175.30 174.37 2iza s ILE 104 N -3.90 1.11 -0.19 4.99 1.01 -0.64 -1.01 121.20 122.56 2iza s ILE 104 Ca 0.11 -0.50 -0.09 0.00 0.00 0.00 0.00 60.65 60.17 2iza s ILE 104 Cb -0.02 -1.21 -0.05 0.00 0.01 0.00 0.00 42.46 41.20 2iza s ILE 104 CO 0.01 0.24 0.11 0.20 0.00 0.00 0.00 174.94 175.50 2iza s ASN 105 N 1.65 6.03 0.15 3.58 -0.87 -0.78 -0.89 114.94 123.81 2iza s ASN 105 Ca 0.03 0.19 -0.01 0.00 -1.57 0.00 0.00 52.86 51.49 2iza s ASN 105 Cb -0.14 -2.05 -0.04 0.00 -0.02 0.00 0.00 41.25 39.00 2iza s ASN 105 CO -0.08 0.18 0.08 0.42 -2.57 0.00 0.00 177.10 175.13 2iza s THR 106 N 0.35 0.07 0.03 1.60 -4.23 -0.13 -1.81 115.64 111.52 2iza s THR 106 Ca 0.06 -1.94 0.05 0.00 -1.18 0.00 0.00 61.69 58.68 2iza s THR 106 Cb -0.11 -2.19 -0.02 0.00 1.34 0.00 0.00 72.50 71.51 2iza s THR 106 CO -0.01 -0.31 -0.14 -1.10 -0.54 0.00 0.00 174.62 172.52 2iza s GLN 107 N -4.09 0.97 0.11 3.99 -0.21 -0.67 -1.56 119.66 118.20 2iza s GLN 107 Ca 0.29 -0.71 0.03 0.00 0.02 0.00 0.00 55.36 54.99 2iza s GLN 107 Cb 0.07 -0.97 -0.04 0.00 1.00 0.00 0.00 33.01 33.08 2iza s GLN 107 CO 0.05 0.24 -0.08 1.67 -2.12 0.00 0.00 175.29 175.05 2iza s TRP 108 N -0.76 1.01 -0.09 0.91 1.48 0.73 -1.02 118.94 121.21 2iza s TRP 108 Ca 0.02 -0.80 0.02 0.00 -1.06 0.00 0.00 56.10 54.28 2iza s TRP 108 Cb -0.07 -0.56 0.01 0.00 -1.16 0.00 0.00 33.47 31.70 2iza s TRP 108 CO 0.01 -0.06 -0.13 -0.51 -4.06 0.00 0.00 176.95 172.20 2iza s LEU 109 N -2.89 1.63 -0.22 -4.66 1.43 -0.66 -1.66 118.68 111.65 2iza s LEU 109 Ca 0.11 -0.36 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 2iza s LEU 109 Cb 0.02 -0.95 0.03 0.00 0.03 0.00 0.00 46.19 45.32 2iza s LEU 109 CO -0.02 0.01 -0.14 -0.22 0.23 0.00 0.00 176.35 176.21 2iza s LEU 110 N 0.90 2.72 -0.08 1.79 2.96 -0.17 -1.32 118.68 125.48 2iza s LEU 110 Ca -0.09 -0.85 0.01 0.00 -0.22 0.00 0.00 54.13 52.98 2iza s LEU 110 Cb -0.15 -1.56 -0.03 0.00 0.50 0.00 0.00 46.19 44.96 2iza s LEU 110 CO 0.00 -0.07 -0.10 -0.89 -1.32 0.00 0.00 176.35 173.97 2iza s THR 111 N 1.27 3.38 0.05 3.68 2.01 -0.29 -0.84 115.64 124.90 2iza s THR 111 Ca 0.01 -0.58 0.04 0.00 0.31 0.00 0.00 61.69 61.46 2iza s THR 111 Cb -0.15 -2.38 -0.04 0.00 0.01 0.00 0.00 72.50 69.94 2iza s THR 111 CO -0.09 0.57 -0.03 -0.44 -0.69 0.00 0.00 174.62 173.95 2iza s SER 112 N -0.44 4.88 0.06 3.53 0.01 -0.52 -1.38 113.70 119.84 2iza s SER 112 Ca 0.06 -0.15 -0.30 0.00 1.31 0.00 0.00 55.95 56.86 2iza s SER 112 Cb -0.12 -1.16 -0.06 0.00 0.21 0.00 0.00 66.02 64.89 2iza s SER 112 CO 0.02 0.23 1.17 -0.83 0.41 0.00 0.00 173.24 174.24 2iza s GLY 113 N -1.90 2.49 0.33 3.44 0.00 -0.62 -4.85 107.32 106.21 2iza s GLY 113 Ca 0.22 0.82 0.04 0.00 0.00 0.00 0.00 44.72 45.79 2iza s GLY 113 CO 0.13 1.98 0.13 -1.30 0.00 0.00 0.00 173.10 174.04 2iza n THR 114 N 3.81 0.00 -2.83 0.90 -2.24 -1.26 -5.03 114.28 107.63 2iza n THR 114 Ca 0.08 -1.97 -0.24 0.00 -2.27 0.00 0.00 64.05 59.65 2iza n THR 114 Cb 0.47 0.73 0.01 0.00 -2.10 0.00 0.00 70.33 69.45 2iza n THR 114 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2iza s THR 115 N -2.85 3.99 0.25 4.28 -4.23 -1.26 -4.88 115.64 110.95 2iza s THR 115 Ca 0.19 -0.33 -0.03 0.00 -1.18 0.00 0.00 61.69 60.33 2iza s THR 115 Cb 0.01 -3.50 0.22 0.00 1.34 0.00 0.00 72.50 70.57 2iza s THR 115 CO 0.13 -0.40 1.79 -0.33 -0.54 0.00 0.00 174.62 175.27 2iza h GLU 116 N 0.26 0.68 -0.45 3.99 5.08 -2.01 -0.36 114.58 121.77 2iza h GLU 116 Ca -0.46 -0.04 0.08 0.00 -1.00 0.00 0.00 59.36 57.94 2iza h GLU 116 Cb 1.25 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.32 2iza h GLU 116 CO 0.58 0.45 0.31 0.00 -1.00 0.00 0.00 179.01 179.35 2iza h ALA 117 N 1.50 2.06 -0.47 3.43 0.00 -2.07 -2.49 119.26 121.22 2iza h ALA 117 Ca 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2iza h ALA 117 Cb 0.48 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2iza h ALA 117 CO -0.30 -0.16 0.00 0.09 0.00 0.00 0.00 179.25 178.89 2iza n ASN 118 N -4.47 3.42 -0.22 0.00 3.02 -0.22 -4.49 115.26 112.30 2iza n ASN 118 Ca 0.06 -1.96 0.08 0.00 -0.03 0.00 0.00 54.58 52.73 2iza n ASN 118 Cb 0.32 -0.31 0.35 0.00 -0.61 0.00 0.00 39.78 39.53 2iza n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2iza h ALA 119 N 3.76 1.72 -0.24 5.41 0.00 -0.86 -1.70 119.26 127.36 2iza h ALA 119 Ca 0.00 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.97 2iza h ALA 119 Cb 0.90 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2iza h ALA 119 CO 0.00 0.12 0.30 0.11 0.00 0.00 0.00 179.25 179.78 2iza h TRP 120 N 0.77 0.00 -0.48 0.00 5.08 -1.80 -0.28 115.95 119.24 2iza h TRP 120 Ca 0.36 0.00 -0.28 0.00 1.08 0.00 0.00 58.89 60.05 2iza h TRP 120 Cb 0.39 0.00 -0.17 0.00 -3.00 0.00 0.00 29.16 26.38 2iza h TRP 120 CO -0.00 0.00 -0.05 0.36 -1.28 0.00 0.00 178.44 177.47 2iza n LYS 121 N -3.64 2.10 0.05 0.12 2.85 -0.64 -4.71 118.16 114.29 2iza n LYS 121 Ca 0.03 -3.30 0.12 0.00 -1.05 0.00 0.00 58.31 54.11 2iza n LYS 121 Cb 0.43 -1.92 0.15 0.00 -0.65 0.00 0.00 35.03 33.03 2iza n LYS 121 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2iza n SER 122 N -1.07 0.68 -4.22 -5.58 3.41 -0.12 -4.90 113.62 101.81 2iza n SER 122 Ca 0.38 0.06 -0.32 0.00 -0.26 0.00 0.00 58.87 58.73 2iza n SER 122 Cb 1.05 0.27 -0.16 0.00 -0.26 0.00 0.00 64.21 65.11 2iza n SER 122 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2iza s THR 123 N -3.17 2.21 0.09 6.66 2.01 -1.26 -1.44 115.64 120.75 2iza s THR 123 Ca 0.06 -0.95 0.02 0.00 0.31 0.00 0.00 61.69 61.13 2iza s THR 123 Cb 0.14 -1.87 -0.04 0.00 0.01 0.00 0.00 72.50 70.73 2iza s THR 123 CO 0.73 0.55 0.15 -0.76 -0.69 0.00 0.00 174.62 174.60 2iza s LEU 124 N 0.54 4.05 0.05 4.42 1.43 -0.02 -4.92 118.68 124.23 2iza s LEU 124 Ca -0.13 0.09 0.06 0.00 -1.03 0.00 0.00 54.13 53.12 2iza s LEU 124 Cb -0.17 -2.68 -0.02 0.00 0.03 0.00 0.00 46.19 43.34 2iza s LEU 124 CO 0.04 0.15 -0.17 0.54 0.23 0.00 0.00 176.35 177.14 2iza s VAL 125 N -1.50 1.33 0.10 -1.59 0.11 -1.26 -1.00 120.40 116.59 2iza s VAL 125 Ca 0.32 -1.14 -0.05 0.00 -2.93 0.00 0.00 61.98 58.18 2iza s VAL 125 Cb -0.12 -1.20 0.02 0.00 -1.53 0.00 0.00 36.38 33.55 2iza s VAL 125 CO 0.25 0.04 0.25 0.61 -3.33 0.00 0.00 175.10 172.92 2iza n GLY 126 N 1.75 1.51 3.10 6.54 0.00 -0.66 -4.98 105.19 112.44 2iza n GLY 126 Ca -0.18 -1.05 -0.09 0.00 0.00 0.00 0.00 46.02 44.69 2iza n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2iza s HIS 127 N -6.34 0.22 -0.02 1.61 -3.43 -1.26 -0.19 115.29 105.87 2iza s HIS 127 Ca 0.05 -0.53 -0.10 0.00 -0.80 0.00 0.00 55.06 53.68 2iza s HIS 127 Cb -0.01 -0.16 0.01 0.00 -1.43 0.00 0.00 32.58 30.99 2iza s HIS 127 CO 0.03 -0.35 0.22 -0.51 -2.00 0.00 0.00 174.74 172.12 2iza s ASP 128 N -2.11 -0.11 -0.09 7.38 1.01 -0.60 -4.94 116.67 117.21 2iza s ASP 128 Ca -0.05 0.04 0.03 0.00 0.71 0.00 0.00 52.55 53.28 2iza s ASP 128 Cb -0.01 0.30 0.00 0.00 1.01 0.00 0.00 42.92 44.22 2iza s ASP 128 CO -0.05 -0.34 -0.20 -0.89 0.21 0.00 0.00 175.17 173.91 2iza s THR 129 N -1.04 1.72 0.03 -1.27 2.01 -1.26 -0.95 115.64 114.87 2iza s THR 129 Ca -0.11 -0.82 0.05 0.00 0.31 0.00 0.00 61.69 61.11 2iza s THR 129 Cb -0.06 -1.50 -0.03 0.00 0.01 0.00 0.00 72.50 70.92 2iza s THR 129 CO 0.02 0.48 -0.10 -0.36 -0.69 0.00 0.00 174.62 173.98 2iza s PHE 130 N 0.44 2.79 0.28 4.92 0.40 -0.07 -3.72 117.98 123.01 2iza s PHE 130 Ca -0.17 -0.11 0.02 0.00 -0.60 0.00 0.00 56.93 56.07 2iza s PHE 130 Cb -0.17 -1.55 -0.06 0.00 0.51 0.00 0.00 43.02 41.76 2iza s PHE 130 CO 0.07 0.35 0.08 0.95 0.70 0.00 0.00 175.22 177.37 2iza s THR 131 N -1.01 0.78 -0.97 0.64 -4.23 -0.12 -1.63 115.64 109.10 2iza s THR 131 Ca 0.17 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.94 2iza s THR 131 Cb -0.11 -2.67 0.05 0.00 1.34 0.00 0.00 72.50 71.12 2iza s THR 131 CO 0.08 -0.02 1.51 0.29 -0.54 0.00 0.00 174.62 175.94 2iza n LYS 132 N -0.53 0.02 0.00 3.99 5.02 -1.26 -0.73 118.16 124.67 2iza n LYS 132 Ca -0.01 0.01 0.06 0.00 -2.02 0.00 0.00 58.31 56.35 2iza n LYS 132 Cb 0.66 -1.51 0.05 0.00 -0.02 0.00 0.00 35.03 34.21 2iza n LYS 132 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16