#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ize h GLU 14 N 0.00 -0.13 -0.60 0.00 -0.00 -1.89 -2.67 114.58 109.30 2ize h GLU 14 Ca 0.00 0.01 0.12 0.00 -0.00 0.00 0.00 59.36 59.49 2ize h GLU 14 Cb 0.00 0.03 -0.10 0.00 -0.00 0.00 0.00 28.75 28.68 2ize h GLU 14 CO 0.00 -0.09 0.01 0.00 -0.00 0.00 0.00 179.01 178.93 2ize h ALA 15 N 1.12 0.59 0.00 1.06 0.00 -1.94 -0.17 119.26 119.92 2ize h ALA 15 Ca 0.25 0.18 -0.06 0.00 0.00 0.00 0.00 54.91 55.28 2ize h ALA 15 Cb 0.54 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2ize h ALA 15 CO -0.66 -0.39 -0.28 0.78 0.00 0.00 0.00 179.25 178.70 2ize h GLY 16 N 0.12 0.00 1.06 0.00 0.00 -1.92 -3.08 103.07 99.25 2ize h GLY 16 Ca 0.31 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 47.29 2ize h GLY 16 CO -0.50 0.00 -1.65 -2.22 0.00 0.00 0.00 176.54 172.17 2ize h ILE 17 N 0.00 1.07 -2.56 2.60 2.04 -1.23 -3.46 117.51 115.96 2ize h ILE 17 Ca -0.00 -2.60 -0.59 0.00 1.00 0.00 0.00 64.86 62.67 2ize h ILE 17 Cb 0.52 2.87 0.08 0.00 -0.74 0.00 0.00 36.82 39.55 2ize h ILE 17 CO 0.04 0.84 0.53 0.41 0.00 0.00 0.00 178.15 179.97 2ize n THR 18 N -3.63 1.02 -1.79 -0.27 -1.04 -0.16 -4.80 114.28 103.61 2ize n THR 18 Ca -0.22 -0.26 0.00 0.00 -2.04 0.00 0.00 64.05 61.54 2ize n THR 18 Cb 1.09 -1.35 0.00 0.00 -1.82 0.00 0.00 70.33 68.25 2ize n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ize n GLY 19 N 2.03 -0.04 3.47 3.41 0.00 -0.70 -4.98 105.19 108.39 2ize n GLY 19 Ca 0.12 -1.60 -0.33 0.00 0.00 0.00 0.00 46.02 44.20 2ize n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ize s THR 20 N -2.48 3.37 0.11 2.61 2.01 -1.26 -1.47 115.64 118.53 2ize s THR 20 Ca 0.00 -0.57 0.04 0.00 0.31 0.00 0.00 61.69 61.47 2ize s THR 20 Cb 0.00 -2.40 -0.04 0.00 0.01 0.00 0.00 72.50 70.07 2ize s THR 20 CO 0.00 0.55 -0.10 0.26 -0.69 0.00 0.00 174.62 174.64 2ize s TRP 21 N -0.17 1.13 0.08 4.92 0.52 0.29 -1.93 118.94 123.78 2ize s TRP 21 Ca 0.01 -0.70 0.03 0.00 0.02 0.00 0.00 56.10 55.46 2ize s TRP 21 Cb -0.13 -0.61 -0.03 0.00 -1.15 0.00 0.00 33.47 31.55 2ize s TRP 21 CO 0.03 0.02 -0.09 1.52 0.02 0.00 0.00 176.95 178.45 2ize s TYR 22 N -2.78 0.97 0.45 -1.98 -0.85 -0.35 -1.59 117.35 111.22 2ize s TYR 22 Ca 0.10 -0.64 0.05 0.00 -0.52 0.00 0.00 57.07 56.05 2ize s TYR 22 Cb -0.01 -0.54 -0.05 0.00 0.38 0.00 0.00 41.96 41.74 2ize s TYR 22 CO 0.00 -0.03 0.01 0.54 -1.52 0.00 0.00 175.55 174.55 2ize s ASN 23 N -2.28 3.98 0.31 -0.18 2.20 -0.94 -0.65 114.94 117.39 2ize s ASN 23 Ca 0.02 -1.48 0.17 0.00 -0.94 0.00 0.00 52.86 50.64 2ize s ASN 23 Cb -0.04 -0.04 0.95 0.00 -2.00 0.00 0.00 41.25 40.11 2ize s ASN 23 CO -0.00 -0.61 1.49 0.00 -2.94 0.00 0.00 177.10 175.04 2ize n GLN 24 N -1.09 0.11 0.03 3.55 0.00 -1.22 -1.14 117.38 117.63 2ize n GLN 24 Ca -0.10 0.60 0.12 0.00 0.00 0.00 0.00 57.00 57.61 2ize n GLN 24 Cb 0.67 -1.99 0.10 0.00 0.00 0.00 0.00 30.24 29.02 2ize n GLN 24 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2ize n LEU 25 N -2.14 0.63 0.00 2.61 4.77 -1.26 -4.94 117.00 116.67 2ize n LEU 25 Ca -0.01 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 2ize n LEU 25 Cb 0.14 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2ize n LEU 25 CO 0.08 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.78 2ize n GLY 26 N 1.38 1.02 3.86 -0.72 0.00 -0.29 -4.77 105.19 105.66 2ize n GLY 26 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 2ize n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ize s SER 27 N -2.00 6.55 -0.07 1.61 0.01 -1.26 -4.63 113.70 113.92 2ize s SER 27 Ca 0.00 1.39 0.02 0.00 1.31 0.00 0.00 55.95 58.66 2ize s SER 27 Cb 0.00 -2.43 -0.03 0.00 0.21 0.00 0.00 66.02 63.77 2ize s SER 27 CO 0.00 -0.54 -0.11 -0.89 0.41 0.00 0.00 173.24 172.12 2ize s THR 28 N -2.57 3.35 -0.11 1.44 2.01 0.38 -2.20 115.64 117.94 2ize s THR 28 Ca 0.56 -0.60 -0.01 0.00 0.31 0.00 0.00 61.69 61.95 2ize s THR 28 Cb -0.10 -2.35 0.03 0.00 0.01 0.00 0.00 72.50 70.08 2ize s THR 28 CO 0.33 0.58 -0.06 0.12 -0.69 0.00 0.00 174.62 174.90 2ize s PHE 29 N -0.58 1.35 -0.24 4.92 5.36 -0.62 -0.44 117.98 127.73 2ize s PHE 29 Ca 0.08 -0.67 -0.01 0.00 -0.96 0.00 0.00 56.93 55.38 2ize s PHE 29 Cb -0.12 -1.16 0.03 0.00 -0.34 0.00 0.00 43.02 41.43 2ize s PHE 29 CO 0.02 -0.49 -0.08 0.42 -1.46 0.00 0.00 175.22 173.62 2ize s ILE 30 N 1.75 2.67 0.12 3.12 -1.09 -0.50 -0.55 121.20 126.73 2ize s ILE 30 Ca 0.05 -1.11 0.04 0.00 -2.23 0.00 0.00 60.65 57.40 2ize s ILE 30 Cb -0.13 -2.36 -0.04 0.00 -1.58 0.00 0.00 42.46 38.35 2ize s ILE 30 CO -0.08 0.20 -0.10 0.54 -1.23 0.00 0.00 174.94 174.28 2ize s VAL 31 N 1.29 1.00 -0.08 2.92 0.11 -0.54 -1.58 120.40 123.51 2ize s VAL 31 Ca -0.01 -1.88 0.01 0.00 -2.93 0.00 0.00 61.98 57.18 2ize s VAL 31 Cb -0.17 -1.63 0.02 0.00 -1.53 0.00 0.00 36.38 33.07 2ize s VAL 31 CO -0.06 -0.70 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.04 2ize s THR 32 N -3.03 0.95 -0.26 5.04 2.01 -0.61 -1.71 115.64 118.03 2ize s THR 32 Ca 0.11 -0.31 -0.13 0.00 0.31 0.00 0.00 61.69 61.68 2ize s THR 32 Cb 0.01 -0.93 -0.04 0.00 0.01 0.00 0.00 72.50 71.54 2ize s THR 32 CO -0.01 0.33 0.27 0.00 -0.69 0.00 0.00 174.62 174.52 2ize s ALA 33 N 1.19 3.56 0.50 7.40 0.00 -1.26 -2.56 121.76 130.59 2ize s ALA 33 Ca -0.05 -0.90 -0.04 0.00 0.00 0.00 0.00 51.96 50.97 2ize s ALA 33 Cb -0.14 -2.54 -0.02 0.00 0.00 0.00 0.00 23.12 20.42 2ize s ALA 33 CO -0.02 -0.48 0.78 0.20 0.00 0.00 0.00 175.76 176.24 2ize s GLY 34 N 1.49 1.53 0.49 0.00 0.00 0.15 -4.72 107.32 106.26 2ize s GLY 34 Ca 0.11 -0.68 0.15 0.00 0.00 0.00 0.00 44.72 44.30 2ize s GLY 34 CO 0.09 -0.49 2.09 0.00 0.00 0.00 0.00 173.10 174.79 2ize h ALA 35 N 0.17 2.01 -0.06 3.20 0.00 -1.97 -2.11 119.26 120.50 2ize h ALA 35 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2ize h ALA 35 Cb 1.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2ize h ALA 35 CO 0.61 -0.05 0.00 -0.40 0.00 0.00 0.00 179.25 179.40 2ize n ASP 36 N -4.50 0.52 0.00 0.00 5.75 -1.26 -4.83 116.55 112.23 2ize n ASP 36 Ca 0.01 -2.01 0.00 0.00 -0.01 0.00 0.00 54.79 52.78 2ize n ASP 36 Cb 0.19 -0.12 0.00 0.00 -1.03 0.00 0.00 41.12 40.15 2ize n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ize n GLY 37 N 0.51 0.76 3.89 6.12 0.00 -0.80 -4.96 105.19 110.71 2ize n GLY 37 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 2ize n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ize s ALA 38 N -2.33 3.58 -0.10 4.61 0.00 -1.24 -1.32 121.76 124.96 2ize s ALA 38 Ca 0.00 -0.39 0.02 0.00 0.00 0.00 0.00 51.96 51.59 2ize s ALA 38 Cb 0.00 -2.39 0.01 0.00 0.00 0.00 0.00 23.12 20.74 2ize s ALA 38 CO 0.00 0.37 -0.15 -1.17 0.00 0.00 0.00 175.76 174.80 2ize s LEU 39 N -3.18 1.73 0.10 0.00 2.96 -0.45 0.31 118.68 120.15 2ize s LEU 39 Ca 0.46 -0.42 -0.00 0.00 -0.22 0.00 0.00 54.13 53.94 2ize s LEU 39 Cb -0.11 -1.08 -0.04 0.00 0.50 0.00 0.00 46.19 45.46 2ize s LEU 39 CO 0.25 0.02 0.01 0.42 -1.32 0.00 0.00 176.35 175.73 2ize s THR 40 N 0.93 0.26 -5.00 3.68 -4.23 -1.06 -1.07 115.64 109.15 2ize s THR 40 Ca -0.08 -1.88 0.00 0.00 -1.18 0.00 0.00 61.69 58.55 2ize s THR 40 Cb -0.15 -1.81 0.00 0.00 1.34 0.00 0.00 72.50 71.88 2ize s THR 40 CO -0.01 -0.71 0.00 0.61 -0.54 0.00 0.00 174.62 173.97 2ize n GLY 41 N -0.02 -0.18 3.14 3.99 0.00 -1.09 -1.57 105.19 109.46 2ize n GLY 41 Ca -0.10 -1.31 -0.13 0.00 0.00 0.00 0.00 46.02 44.48 2ize n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ize s THR 42 N -2.98 0.78 -0.04 2.61 -4.23 -0.62 -1.29 115.64 109.87 2ize s THR 42 Ca 0.00 -1.56 0.04 0.00 -1.18 0.00 0.00 61.69 58.98 2ize s THR 42 Cb 0.00 -1.24 -0.00 0.00 1.34 0.00 0.00 72.50 72.60 2ize s THR 42 CO 0.00 -0.59 -0.14 -0.47 -0.54 0.00 0.00 174.62 172.88 2ize s TYR 43 N -2.45 1.45 -0.25 3.99 6.14 0.13 -1.41 117.35 124.97 2ize s TYR 43 Ca 0.03 -0.40 0.03 0.00 0.64 0.00 0.00 57.07 57.37 2ize s TYR 43 Cb -0.03 -0.99 0.05 0.00 0.42 0.00 0.00 41.96 41.42 2ize s TYR 43 CO -0.01 -0.14 -0.12 -2.00 0.64 0.00 0.00 175.55 173.92 2ize s GLU 44 N 0.07 2.31 0.17 4.97 2.12 0.41 -0.86 118.70 127.89 2ize s GLU 44 Ca -0.03 -1.25 -0.03 0.00 0.36 0.00 0.00 54.97 54.02 2ize s GLU 44 Cb -0.10 -2.82 -0.05 0.00 0.26 0.00 0.00 34.13 31.42 2ize s GLU 44 CO 0.01 -0.52 0.38 0.45 -0.54 0.00 0.00 175.26 175.05 2ize s SER 45 N 1.15 6.44 0.04 -1.70 0.15 -1.26 -0.47 113.70 118.05 2ize s SER 45 Ca -0.07 0.51 0.22 0.00 0.70 0.00 0.00 55.95 57.31 2ize s SER 45 Cb -0.19 -2.06 -0.21 0.00 -1.71 0.00 0.00 66.02 61.85 2ize s SER 45 CO -0.06 0.01 0.66 0.00 1.20 0.00 0.00 173.24 175.04 2ize n ALA 46 N -0.25 2.60 -2.57 5.45 0.00 -1.26 -4.90 120.51 119.58 2ize n ALA 46 Ca -0.03 -0.47 -0.26 0.00 0.00 0.00 0.00 53.44 52.67 2ize n ALA 46 Cb 0.53 -0.85 -0.11 0.00 0.00 0.00 0.00 19.45 19.02 2ize n ALA 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2ize s VAL 47 N -3.38 1.85 0.00 0.00 -7.23 -1.26 -5.05 120.40 105.34 2ize s VAL 47 Ca -0.05 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.09 2ize s VAL 47 Cb 0.12 -2.91 0.00 0.00 0.56 0.00 0.00 36.38 34.15 2ize s VAL 47 CO 0.86 -0.03 0.00 0.61 -0.31 0.00 0.00 175.10 176.23 2ize n GLY 48 N -0.89 -2.42 2.83 2.32 0.00 -1.26 -4.39 105.19 101.38 2ize n GLY 48 Ca -0.04 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.87 2ize n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ize n ASN 49 N 0.08 6.44 -4.32 1.61 5.15 -1.26 -4.92 115.26 118.04 2ize n ASN 49 Ca 0.00 -3.35 -0.29 0.00 -0.60 0.00 0.00 54.58 50.34 2ize n ASN 49 Cb 0.00 -1.32 -0.15 0.00 -0.53 0.00 0.00 39.78 37.78 2ize n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ize s ALA 50 N -2.00 2.12 -0.25 5.20 0.00 -1.26 -4.53 121.76 121.03 2ize s ALA 50 Ca 0.38 -1.20 -0.02 0.00 0.00 0.00 0.00 51.96 51.12 2ize s ALA 50 Cb 0.10 -0.45 0.13 0.00 0.00 0.00 0.00 23.12 22.91 2ize s ALA 50 CO 0.01 0.50 0.33 -2.00 0.00 0.00 0.00 175.76 174.60 2ize s GLU 51 N -1.17 0.32 0.31 0.00 2.12 -1.26 -5.01 118.70 114.02 2ize s GLU 51 Ca 0.11 0.23 0.00 0.00 0.36 0.00 0.00 54.97 55.67 2ize s GLU 51 Cb -0.10 -0.65 0.00 0.00 0.26 0.00 0.00 34.13 33.64 2ize s GLU 51 CO 0.02 -0.80 0.00 0.45 -0.54 0.00 0.00 175.26 174.38 2ize n SER 52 N 5.34 0.00 -4.91 -1.70 2.88 -1.26 -4.62 113.62 109.35 2ize n SER 52 Ca -0.03 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.21 2ize n SER 52 Cb 0.49 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.91 2ize n SER 52 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2ize s ARG 53 N 0.00 3.58 0.11 -1.46 0.52 -1.26 -4.41 118.95 116.03 2ize s ARG 53 Ca 0.00 -0.18 0.07 0.00 -0.52 0.00 0.00 55.73 55.10 2ize s ARG 53 Cb 0.00 -2.85 -0.04 0.00 0.52 0.00 0.00 34.95 32.59 2ize s ARG 53 CO 0.00 0.44 -0.17 0.71 0.02 0.00 0.00 175.30 176.31 2ize s TYR 54 N -1.73 1.54 0.31 -0.53 1.51 -0.04 -4.88 117.35 113.52 2ize s TYR 54 Ca 0.40 -0.49 -0.21 0.00 -1.01 0.00 0.00 57.07 55.76 2ize s TYR 54 Cb -0.12 -0.82 -0.09 0.00 -0.11 0.00 0.00 41.96 40.82 2ize s TYR 54 CO 0.26 0.18 0.84 0.08 -1.11 0.00 0.00 175.55 175.80 2ize s VAL 55 N -1.71 4.44 0.09 0.71 1.01 -1.26 -0.69 120.40 122.98 2ize s VAL 55 Ca 0.07 1.44 0.04 0.00 0.00 0.00 0.00 61.98 63.53 2ize s VAL 55 Cb -0.07 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 2ize s VAL 55 CO 0.04 0.02 -0.12 -1.48 0.00 0.00 0.00 175.10 173.56 2ize s LEU 56 N -2.41 2.35 -0.09 3.92 0.05 -0.41 -4.41 118.68 117.68 2ize s LEU 56 Ca 0.51 -0.72 -0.08 0.00 0.05 0.00 0.00 54.13 53.88 2ize s LEU 56 Cb -0.15 -0.39 0.02 0.00 -2.05 0.00 0.00 46.19 43.63 2ize s LEU 56 CO 0.20 -0.18 0.24 0.28 -0.55 0.00 0.00 176.35 176.33 2ize s THR 57 N -1.91 0.00 0.03 5.48 -1.32 -1.07 -2.67 115.64 114.18 2ize s THR 57 Ca 0.02 -0.01 -0.01 0.00 -1.21 0.00 0.00 61.69 60.48 2ize s THR 57 Cb -0.06 -0.34 0.00 0.00 -1.51 0.00 0.00 72.50 70.59 2ize s THR 57 CO 0.01 -0.00 0.06 0.61 -2.21 0.00 0.00 174.62 173.09 2ize n GLY 58 N 2.93 2.03 3.10 6.08 0.00 -0.23 -1.26 105.19 117.83 2ize n GLY 58 Ca -0.13 -1.07 -0.09 0.00 0.00 0.00 0.00 46.02 44.74 2ize n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ize s ARG 59 N -2.01 0.58 0.24 1.61 1.81 -0.50 -1.35 118.95 119.33 2ize s ARG 59 Ca 0.01 -0.86 -0.06 0.00 -1.72 0.00 0.00 55.73 53.10 2ize s ARG 59 Cb -0.00 0.22 -0.02 0.00 -0.45 0.00 0.00 34.95 34.69 2ize s ARG 59 CO 0.01 -0.13 0.32 1.52 -0.68 0.00 0.00 175.30 176.34 2ize s TYR 60 N -2.87 0.84 -0.49 -0.53 1.13 -0.43 -1.54 117.35 113.45 2ize s TYR 60 Ca -0.03 -1.10 -0.24 0.00 -1.41 0.00 0.00 57.07 54.29 2ize s TYR 60 Cb 0.00 -0.20 0.03 0.00 -1.10 0.00 0.00 41.96 40.70 2ize s TYR 60 CO -0.06 -0.85 0.86 0.34 -2.51 0.00 0.00 175.55 173.33 2ize s ASP 61 N -3.12 6.39 0.00 -0.18 3.68 -0.72 -4.68 116.67 118.05 2ize s ASP 61 Ca 0.31 -0.19 0.27 0.00 2.13 0.00 0.00 52.55 55.07 2ize s ASP 61 Cb 0.03 -2.41 1.27 0.00 -1.45 0.00 0.00 42.92 40.35 2ize s ASP 61 CO 0.12 -1.06 1.90 -1.54 0.13 0.00 0.00 175.17 174.73 2ize n SER 62 N 7.05 0.00 -3.27 -0.34 3.41 -1.26 -3.96 113.62 115.25 2ize n SER 62 Ca 0.02 0.19 -0.25 0.00 -0.26 0.00 0.00 58.87 58.58 2ize n SER 62 Cb 0.48 -0.39 -0.07 0.00 -0.26 0.00 0.00 64.21 63.97 2ize n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ize n ALA 63 N -1.39 3.26 -1.02 7.33 0.00 -1.26 -4.82 120.51 122.61 2ize n ALA 63 Ca 0.10 -4.08 -0.11 0.00 0.00 0.00 0.00 53.44 49.35 2ize n ALA 63 Cb 0.27 -0.85 0.15 0.00 0.00 0.00 0.00 19.45 19.01 2ize n ALA 63 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2ize n PRO 64 N 0.97 -2.30 -3.05 0.00 -0.04 -1.25 -5.02 135.00 124.31 2ize n PRO 64 Ca 0.26 -1.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.40 2ize n PRO 64 Cb 0.48 -0.95 -0.06 0.00 -0.04 0.00 0.00 33.50 32.93 2ize n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ize s ALA 65 N -2.97 3.28 -0.98 0.55 0.00 -1.26 -4.96 121.76 115.42 2ize s ALA 65 Ca 0.41 0.07 -0.08 0.00 0.00 0.00 0.00 51.96 52.36 2ize s ALA 65 Cb -0.04 -2.82 -0.12 0.00 0.00 0.00 0.00 23.12 20.14 2ize s ALA 65 CO 0.31 0.26 3.12 0.25 0.00 0.00 0.00 175.76 179.70 2ize n THR 66 N -0.53 3.91 -3.65 0.00 -2.24 -1.26 -4.65 114.28 105.85 2ize n THR 66 Ca 0.04 -2.42 -0.05 0.00 -2.27 0.00 0.00 64.05 59.35 2ize n THR 66 Cb 0.53 -2.29 -0.01 0.00 -2.10 0.00 0.00 70.33 66.46 2ize n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2ize n ASP 67 N 2.87 -0.56 -3.07 3.42 5.68 -1.26 -5.01 116.55 118.61 2ize n ASP 67 Ca 0.63 -1.67 -0.34 0.00 -0.50 0.00 0.00 54.79 52.92 2ize n ASP 67 Cb 0.48 1.02 -0.05 0.00 -1.14 0.00 0.00 41.12 41.43 2ize n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ize n GLY 68 N -0.21 4.38 3.96 6.12 0.00 -1.26 -4.86 105.19 113.31 2ize n GLY 68 Ca -0.00 -1.67 -0.23 0.00 0.00 0.00 0.00 46.02 44.11 2ize n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ize s SER 69 N 1.38 6.33 0.64 1.61 0.01 -1.26 -5.10 113.70 117.31 2ize s SER 69 Ca 0.63 0.13 -0.01 0.00 1.31 0.00 0.00 55.95 58.01 2ize s SER 69 Cb 0.22 -1.89 0.07 0.00 0.21 0.00 0.00 66.02 64.64 2ize s SER 69 CO -0.08 -0.04 0.89 -0.83 0.41 0.00 0.00 173.24 173.60 2ize s GLY 70 N -3.71 1.78 -0.27 3.44 0.00 -1.26 -4.91 107.32 102.39 2ize s GLY 70 Ca 0.34 -1.42 -0.09 0.00 0.00 0.00 0.00 44.72 43.55 2ize s GLY 70 CO 0.29 -1.01 0.13 -1.59 0.00 0.00 0.00 173.10 170.92 2ize s THR 71 N -2.98 4.75 0.41 0.90 2.01 0.26 -4.77 115.64 116.23 2ize s THR 71 Ca 0.61 -0.07 -0.24 0.00 0.31 0.00 0.00 61.69 62.30 2ize s THR 71 Cb -0.08 -3.27 -0.09 0.00 0.01 0.00 0.00 72.50 69.07 2ize s THR 71 CO 0.42 0.26 1.07 0.00 -0.69 0.00 0.00 174.62 175.68 2ize s ALA 72 N 1.67 3.08 0.28 7.40 0.00 -1.26 -0.57 121.76 132.36 2ize s ALA 72 Ca 0.06 0.75 -0.20 0.00 0.00 0.00 0.00 51.96 52.57 2ize s ALA 72 Cb -0.16 -3.29 0.04 0.00 0.00 0.00 0.00 23.12 19.71 2ize s ALA 72 CO 0.07 -0.29 0.81 -0.48 0.00 0.00 0.00 175.76 175.88 2ize s LEU 73 N -2.67 -0.15 -0.10 0.00 2.34 -0.94 -1.75 118.68 115.42 2ize s LEU 73 Ca 0.58 -0.72 -0.30 0.00 0.06 0.00 0.00 54.13 53.75 2ize s LEU 73 Cb -0.23 2.60 0.12 0.00 -0.56 0.00 0.00 46.19 48.11 2ize s LEU 73 CO 0.29 -1.33 0.98 -0.83 -1.06 0.00 0.00 176.35 174.40 2ize s GLY 74 N -3.01 -0.35 0.16 -3.48 0.00 -0.59 -2.22 107.32 97.83 2ize s GLY 74 Ca 0.13 1.54 -0.16 0.00 0.00 0.00 0.00 44.72 46.23 2ize s GLY 74 CO 0.07 0.67 0.46 0.66 0.00 0.00 0.00 173.10 174.96 2ize s TRP 75 N -2.14 -0.13 0.06 1.90 -2.14 -0.73 -1.41 118.94 114.36 2ize s TRP 75 Ca 0.03 -0.20 0.06 0.00 2.66 0.00 0.00 56.10 58.64 2ize s TRP 75 Cb -0.01 0.31 -0.03 0.00 -3.10 0.00 0.00 33.47 30.64 2ize s TRP 75 CO -0.04 -0.81 -0.17 0.99 -2.66 0.00 0.00 176.95 174.26 2ize s THR 76 N -3.85 1.37 -0.04 0.66 2.01 -0.39 -0.91 115.64 114.50 2ize s THR 76 Ca 0.07 -1.21 -0.00 0.00 0.31 0.00 0.00 61.69 60.85 2ize s THR 76 Cb 0.01 -1.24 0.03 0.00 0.01 0.00 0.00 72.50 71.30 2ize s THR 76 CO -0.07 -0.00 0.01 -0.69 -0.69 0.00 0.00 174.62 173.18 2ize s VAL 77 N -0.98 0.15 -0.16 3.82 1.01 -0.72 -2.60 120.40 120.92 2ize s VAL 77 Ca 0.03 0.14 -0.06 0.00 0.00 0.00 0.00 61.98 62.09 2ize s VAL 77 Cb -0.09 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.97 2ize s VAL 77 CO 0.02 0.16 0.05 0.00 0.00 0.00 0.00 175.10 175.33 2ize s ALA 78 N 1.28 3.38 -1.34 5.51 0.00 -1.26 -1.25 121.76 128.09 2ize s ALA 78 Ca -0.06 -0.75 -0.08 0.00 0.00 0.00 0.00 51.96 51.07 2ize s ALA 78 Cb -0.13 -1.84 -0.06 0.00 0.00 0.00 0.00 23.12 21.09 2ize s ALA 78 CO -0.02 0.26 2.90 0.91 0.00 0.00 0.00 175.76 179.80 2ize n TRP 79 N 3.28 2.17 -4.17 0.00 7.02 -0.10 -4.79 117.44 120.85 2ize n TRP 79 Ca -0.17 -2.83 -0.21 0.00 -1.02 0.00 0.00 57.50 53.27 2ize n TRP 79 Cb 0.53 -2.21 -0.16 0.00 -2.42 0.00 0.00 31.31 27.04 2ize n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 2ize s LYS 80 N 1.15 0.93 0.00 -0.99 2.20 -1.26 -0.36 119.74 121.41 2ize s LYS 80 Ca 0.66 -0.13 0.00 0.00 -0.36 0.00 0.00 55.97 56.14 2ize s LYS 80 Cb 0.20 -0.94 0.00 0.00 -1.51 0.00 0.00 37.83 35.59 2ize s LYS 80 CO -0.07 -0.09 0.00 0.27 -0.36 0.00 0.00 175.35 175.10 2ize n ASN 81 N 4.14 0.00 0.00 1.43 0.23 0.52 -4.82 115.26 116.76 2ize n ASN 81 Ca -0.23 -0.46 0.14 0.00 -0.53 0.00 0.00 54.58 53.50 2ize n ASN 81 Cb 0.51 0.00 0.64 0.00 -2.08 0.00 0.00 39.78 38.85 2ize n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2ize n ASN 82 N -1.30 0.00 -0.09 0.53 5.03 -1.26 -3.84 115.26 114.32 2ize n ASN 82 Ca 0.00 0.25 -0.13 0.00 0.87 0.00 0.00 54.58 55.57 2ize n ASN 82 Cb 0.00 -0.41 -0.09 0.00 -1.02 0.00 0.00 39.78 38.26 2ize n ASN 82 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2ize n TYR 83 N -1.41 0.00 -4.14 3.10 4.01 -1.26 -5.05 117.16 112.40 2ize n TYR 83 Ca 0.09 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.74 2ize n TYR 83 Cb 0.29 -0.74 -0.10 0.00 -0.31 0.00 0.00 39.34 38.47 2ize n TYR 83 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2ize s ARG 84 N -2.38 0.76 -0.09 -0.72 3.52 -1.25 -5.06 118.95 113.73 2ize s ARG 84 Ca -0.24 -1.30 -0.03 0.00 -0.13 0.00 0.00 55.73 54.03 2ize s ARG 84 Cb 0.06 -0.04 0.05 0.00 -1.56 0.00 0.00 34.95 33.46 2ize s ARG 84 CO 0.46 -0.06 0.11 1.21 -0.81 0.00 0.00 175.30 176.21 2ize s ASN 85 N -3.00 1.28 0.00 -2.12 3.84 -1.26 -0.35 114.94 113.33 2ize s ASN 85 Ca 0.10 -0.00 0.18 0.00 0.21 0.00 0.00 52.86 53.35 2ize s ASN 85 Cb 0.06 -0.00 0.04 0.00 -0.55 0.00 0.00 41.25 40.80 2ize s ASN 85 CO -0.07 -0.27 0.98 0.00 -2.79 0.00 0.00 177.10 174.95 2ize n ALA 86 N 5.30 3.02 -3.60 1.71 0.00 0.52 -4.97 120.51 122.49 2ize n ALA 86 Ca -0.04 -0.60 -0.22 0.00 0.00 0.00 0.00 53.44 52.58 2ize n ALA 86 Cb 0.50 -0.63 0.07 0.00 0.00 0.00 0.00 19.45 19.38 2ize n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2ize n HIS 87 N 0.29 -2.35 -3.85 0.00 8.25 -1.26 -4.85 115.22 111.44 2ize n HIS 87 Ca 0.09 0.94 -0.10 0.00 -0.26 0.00 0.00 57.72 58.39 2ize n HIS 87 Cb 0.41 -4.78 -0.05 0.00 1.12 0.00 0.00 29.99 26.68 2ize n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2ize s SER 88 N -3.92 -0.10 -0.08 0.41 1.04 -1.26 -0.83 113.70 108.96 2ize s SER 88 Ca 0.26 -0.68 -0.12 0.00 0.48 0.00 0.00 55.95 55.89 2ize s SER 88 Cb -0.12 0.50 0.03 0.00 0.10 0.00 0.00 66.02 66.53 2ize s SER 88 CO 0.76 -0.97 0.31 0.00 0.98 0.00 0.00 173.24 174.32 2ize s ALA 89 N -3.92 -0.76 -0.01 5.32 0.00 0.28 -0.92 121.76 121.75 2ize s ALA 89 Ca 0.13 0.66 0.08 0.00 0.00 0.00 0.00 51.96 52.83 2ize s ALA 89 Cb 0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.81 2ize s ALA 89 CO -0.02 -0.19 -0.26 0.99 0.00 0.00 0.00 175.76 176.29 2ize s THR 90 N -0.39 2.05 -0.03 0.00 2.01 -0.38 -0.80 115.64 118.11 2ize s THR 90 Ca -0.05 -1.15 0.06 0.00 0.31 0.00 0.00 61.69 60.86 2ize s THR 90 Cb -0.03 -1.71 -0.01 0.00 0.01 0.00 0.00 72.50 70.75 2ize s THR 90 CO 0.02 0.54 -0.20 0.42 -0.69 0.00 0.00 174.62 174.71 2ize s THR 91 N -0.64 1.60 -0.06 -0.82 -4.23 -0.43 -1.75 115.64 109.31 2ize s THR 91 Ca 0.10 -0.84 0.04 0.00 -1.18 0.00 0.00 61.69 59.81 2ize s THR 91 Cb -0.10 -1.35 -0.02 0.00 1.34 0.00 0.00 72.50 72.38 2ize s THR 91 CO -0.01 0.45 -0.19 0.26 -0.54 0.00 0.00 174.62 174.60 2ize s TRP 92 N -0.26 2.59 -0.09 3.99 0.51 -0.09 -1.88 118.94 123.71 2ize s TRP 92 Ca 0.02 -0.47 0.02 0.00 -2.12 0.00 0.00 56.10 53.56 2ize s TRP 92 Cb -0.10 -1.64 0.01 0.00 -0.81 0.00 0.00 33.47 30.93 2ize s TRP 92 CO 0.01 -0.05 -0.16 0.45 -0.51 0.00 0.00 176.95 176.69 2ize s SER 93 N -0.33 2.38 0.00 2.95 0.15 0.05 -1.78 113.70 117.12 2ize s SER 93 Ca 0.02 -0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.25 2ize s SER 93 Cb -0.13 -1.08 0.00 0.00 -1.71 0.00 0.00 66.02 63.10 2ize s SER 93 CO 0.02 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.13 2ize n GLY 94 N 3.91 1.60 3.12 9.45 0.00 -0.94 -1.60 105.19 120.72 2ize n GLY 94 Ca -0.20 -0.50 -0.11 0.00 0.00 0.00 0.00 46.02 45.21 2ize n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2ize s GLN 95 N 1.44 0.54 -0.10 1.61 -2.07 -0.74 -2.21 119.66 118.13 2ize s GLN 95 Ca 0.00 -0.52 -0.11 0.00 -1.82 0.00 0.00 55.36 52.90 2ize s GLN 95 Cb 0.00 0.22 -0.05 0.00 -1.09 0.00 0.00 33.01 32.09 2ize s GLN 95 CO 0.00 -0.13 0.26 -0.47 -1.32 0.00 0.00 175.29 173.63 2ize s TYR 96 N -1.85 3.59 -0.16 9.60 5.04 0.27 -1.52 117.35 132.32 2ize s TYR 96 Ca -0.11 0.68 -0.00 0.00 -2.44 0.00 0.00 57.07 55.20 2ize s TYR 96 Cb -0.05 -2.17 0.04 0.00 0.35 0.00 0.00 41.96 40.13 2ize s TYR 96 CO -0.01 0.56 -0.07 0.08 -1.34 0.00 0.00 175.55 174.77 2ize s VAL 97 N -0.58 1.17 0.69 3.14 1.01 -0.08 -0.57 120.40 125.18 2ize s VAL 97 Ca 0.18 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.56 2ize s VAL 97 Cb -0.14 -1.30 0.12 0.00 0.00 0.00 0.00 36.38 35.06 2ize s VAL 97 CO 0.07 0.18 0.94 -0.83 0.00 0.00 0.00 175.10 175.46 2ize s GLY 98 N 1.61 1.75 0.00 4.51 0.00 -1.26 -1.38 107.32 112.55 2ize s GLY 98 Ca 0.01 -1.85 0.00 0.00 0.00 0.00 0.00 44.72 42.89 2ize s GLY 98 CO -0.08 -1.30 0.00 0.61 0.00 0.00 0.00 173.10 172.33 2ize n GLY 99 N -2.69 0.75 0.27 0.20 0.00 -1.26 -4.79 105.19 97.67 2ize n GLY 99 Ca 0.15 -1.77 -0.06 0.00 0.00 0.00 0.00 46.02 44.35 2ize n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ize h ALA 100 N 0.00 1.00 -3.31 4.61 0.00 -2.06 -3.33 119.26 116.16 2ize h ALA 100 Ca 0.00 -0.32 -0.64 0.00 0.00 0.00 0.00 54.91 53.94 2ize h ALA 100 Cb 0.00 -0.17 -0.40 0.00 0.00 0.00 0.00 17.79 17.22 2ize h ALA 100 CO 0.00 0.60 -0.58 -1.21 0.00 0.00 0.00 179.25 178.05 2ize s GLU 101 N -4.77 2.12 0.19 0.00 2.02 -1.26 -5.09 118.70 111.92 2ize s GLU 101 Ca -0.09 -2.72 -0.30 0.00 0.02 0.00 0.00 54.97 51.88 2ize s GLU 101 Cb 0.14 -3.39 -0.08 0.00 0.10 0.00 0.00 34.13 30.90 2ize s GLU 101 CO 0.82 -1.14 1.03 0.00 0.02 0.00 0.00 175.26 175.99 2ize s ALA 102 N -0.43 3.34 0.14 5.21 0.00 -1.25 -4.90 121.76 123.86 2ize s ALA 102 Ca 0.18 0.72 0.03 0.00 0.00 0.00 0.00 51.96 52.89 2ize s ALA 102 Cb -0.23 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.55 2ize s ALA 102 CO -0.03 -0.05 -0.07 1.03 0.00 0.00 0.00 175.76 176.64 2ize s ARG 103 N -0.63 1.00 -0.14 0.00 1.81 -0.48 -3.06 118.95 117.45 2ize s ARG 103 Ca 0.46 -1.43 -0.01 0.00 -1.72 0.00 0.00 55.73 53.03 2ize s ARG 103 Cb -0.27 -0.41 0.04 0.00 -0.45 0.00 0.00 34.95 33.85 2ize s ARG 103 CO 0.34 -0.00 -0.05 0.42 -0.68 0.00 0.00 175.30 175.33 2ize s ILE 104 N -3.49 0.95 -0.20 1.52 1.01 -0.90 -0.90 121.20 119.19 2ize s ILE 104 Ca 0.17 -0.42 -0.08 0.00 0.00 0.00 0.00 60.65 60.31 2ize s ILE 104 Cb 0.04 -1.10 -0.04 0.00 0.01 0.00 0.00 42.46 41.37 2ize s ILE 104 CO -0.01 0.20 0.09 0.20 0.00 0.00 0.00 174.94 175.42 2ize s ASN 105 N 1.71 5.70 0.23 3.58 0.01 -0.58 -1.14 114.94 124.46 2ize s ASN 105 Ca 0.03 0.06 0.01 0.00 -0.71 0.00 0.00 52.86 52.25 2ize s ASN 105 Cb -0.14 -1.99 -0.05 0.00 0.41 0.00 0.00 41.25 39.48 2ize s ASN 105 CO -0.08 0.13 0.07 0.42 -1.51 0.00 0.00 177.10 176.14 2ize s THR 106 N 0.65 0.53 0.01 1.60 -4.23 -0.26 -1.79 115.64 112.14 2ize s THR 106 Ca 0.05 -1.99 0.04 0.00 -1.18 0.00 0.00 61.69 58.60 2ize s THR 106 Cb -0.13 -2.47 -0.01 0.00 1.34 0.00 0.00 72.50 71.22 2ize s THR 106 CO 0.01 -0.14 -0.12 -1.10 -0.54 0.00 0.00 174.62 172.73 2ize s GLN 107 N -4.01 0.94 0.16 3.99 -0.21 -0.62 -2.17 119.66 117.72 2ize s GLN 107 Ca 0.34 -0.52 0.04 0.00 0.02 0.00 0.00 55.36 55.23 2ize s GLN 107 Cb 0.07 -0.91 -0.05 0.00 1.00 0.00 0.00 33.01 33.13 2ize s GLN 107 CO 0.11 0.24 -0.08 1.67 -2.12 0.00 0.00 175.29 175.11 2ize s TRP 108 N -0.47 1.27 -0.04 0.91 1.48 -0.59 -0.77 118.94 120.73 2ize s TRP 108 Ca 0.03 -0.81 0.02 0.00 -1.06 0.00 0.00 56.10 54.28 2ize s TRP 108 Cb -0.06 -0.67 0.01 0.00 -1.16 0.00 0.00 33.47 31.59 2ize s TRP 108 CO 0.00 0.03 -0.09 -0.51 -4.06 0.00 0.00 176.95 172.32 2ize s LEU 109 N -3.18 1.66 -0.22 -4.66 1.43 -0.79 -2.30 118.68 110.63 2ize s LEU 109 Ca 0.18 -0.20 0.02 0.00 -1.03 0.00 0.00 54.13 53.09 2ize s LEU 109 Cb 0.03 -0.60 0.05 0.00 0.03 0.00 0.00 46.19 45.70 2ize s LEU 109 CO 0.01 0.04 -0.11 -0.22 0.23 0.00 0.00 176.35 176.30 2ize s LEU 110 N 0.44 2.66 -0.11 1.79 0.20 0.35 -1.31 118.68 122.70 2ize s LEU 110 Ca -0.08 -1.05 -0.02 0.00 0.69 0.00 0.00 54.13 53.68 2ize s LEU 110 Cb -0.11 -1.36 -0.03 0.00 -0.43 0.00 0.00 46.19 44.26 2ize s LEU 110 CO 0.01 -0.15 -0.04 -0.89 -0.29 0.00 0.00 176.35 174.99 2ize s THR 111 N 1.29 3.93 0.07 3.68 2.01 0.02 -0.65 115.64 126.00 2ize s THR 111 Ca -0.03 -0.37 0.04 0.00 0.31 0.00 0.00 61.69 61.64 2ize s THR 111 Cb -0.17 -2.66 -0.04 0.00 0.01 0.00 0.00 72.50 69.63 2ize s THR 111 CO -0.08 0.56 -0.01 -0.44 -0.69 0.00 0.00 174.62 173.96 2ize s SER 112 N -0.36 4.99 0.28 3.53 0.01 -0.60 -0.55 113.70 120.99 2ize s SER 112 Ca 0.06 -0.16 -0.29 0.00 1.31 0.00 0.00 55.95 56.87 2ize s SER 112 Cb -0.12 -1.19 -0.09 0.00 0.21 0.00 0.00 66.02 64.82 2ize s SER 112 CO 0.02 0.20 1.02 -0.83 0.41 0.00 0.00 173.24 174.05 2ize s GLY 113 N -2.15 3.05 0.34 3.44 0.00 -0.01 -4.86 107.32 107.13 2ize s GLY 113 Ca 0.24 0.74 -0.01 0.00 0.00 0.00 0.00 44.72 45.69 2ize s GLY 113 CO 0.16 1.30 0.44 -0.51 0.00 0.00 0.00 173.10 174.49 2ize s THR 114 N -1.24 0.00 0.47 0.90 -4.23 -1.26 -5.01 115.64 105.26 2ize s THR 114 Ca 0.44 -1.66 -0.06 0.00 -1.18 0.00 0.00 61.69 59.23 2ize s THR 114 Cb -0.28 -2.61 -0.04 0.00 1.34 0.00 0.00 72.50 70.92 2ize s THR 114 CO 0.35 0.00 0.78 0.42 -0.54 0.00 0.00 174.62 175.63 2ize s THR 115 N -3.16 4.89 0.30 3.99 -4.23 -1.26 -4.90 115.64 111.27 2ize s THR 115 Ca 0.32 0.27 0.05 0.00 -1.18 0.00 0.00 61.69 61.15 2ize s THR 115 Cb 0.00 -3.84 0.29 0.00 1.34 0.00 0.00 72.50 70.29 2ize s THR 115 CO 0.21 -0.79 1.74 -0.08 -0.54 0.00 0.00 174.62 175.15 2ize h GLU 116 N 0.41 0.56 -1.00 3.99 4.81 -2.01 -1.20 114.58 120.14 2ize h GLU 116 Ca -0.47 -0.03 0.15 0.00 -0.13 0.00 0.00 59.36 58.88 2ize h GLU 116 Cb 1.20 -0.13 -0.09 0.00 0.63 0.00 0.00 28.75 30.36 2ize h GLU 116 CO 0.62 0.37 0.61 0.00 -0.73 0.00 0.00 179.01 179.89 2ize h ALA 117 N 1.68 1.57 -0.49 2.92 0.00 -2.06 -2.69 119.26 120.18 2ize h ALA 117 Ca 0.58 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.54 2ize h ALA 117 Cb 1.01 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2ize h ALA 117 CO -0.45 0.09 0.00 0.09 0.00 0.00 0.00 179.25 178.98 2ize n ASN 118 N -4.70 3.32 -0.16 0.00 3.02 -0.50 -4.54 115.26 111.71 2ize n ASN 118 Ca 0.21 -1.99 0.13 0.00 -0.03 0.00 0.00 54.58 52.89 2ize n ASN 118 Cb 0.45 -0.33 0.46 0.00 -0.61 0.00 0.00 39.78 39.75 2ize n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ize h ALA 119 N 2.97 1.98 -0.14 5.41 0.00 -1.08 -1.73 119.26 126.68 2ize h ALA 119 Ca 0.00 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.95 2ize h ALA 119 Cb 0.83 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2ize h ALA 119 CO 0.00 -0.16 0.12 0.11 0.00 0.00 0.00 179.25 179.32 2ize h TRP 120 N 0.51 0.00 -0.69 0.00 5.08 -1.80 -1.75 115.95 117.30 2ize h TRP 120 Ca 0.35 0.00 -0.45 0.00 1.08 0.00 0.00 58.89 59.87 2ize h TRP 120 Cb 0.66 0.00 -0.27 0.00 -3.00 0.00 0.00 29.16 26.55 2ize h TRP 120 CO -0.00 0.00 0.03 0.36 -1.28 0.00 0.00 178.44 177.55 2ize n LYS 121 N -4.14 2.60 0.09 0.12 2.85 -0.65 -4.68 118.16 114.35 2ize n LYS 121 Ca 0.00 -3.48 0.12 0.00 -1.05 0.00 0.00 58.31 53.90 2ize n LYS 121 Cb 0.24 -2.11 0.07 0.00 -0.65 0.00 0.00 35.03 32.58 2ize n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2ize h SER 122 N 1.60 0.00 -3.26 -5.58 4.64 -1.35 -3.47 113.55 106.12 2ize h SER 122 Ca 0.41 -0.10 -0.67 0.00 -0.47 0.00 0.00 61.79 60.96 2ize h SER 122 Cb 1.51 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 63.29 2ize h SER 122 CO 0.88 0.05 -0.82 -0.89 -0.87 0.00 0.00 176.83 175.17 2ize s THR 123 N -3.28 2.49 0.13 2.95 2.01 -1.26 -1.56 115.64 117.12 2ize s THR 123 Ca 0.02 -0.84 0.03 0.00 0.31 0.00 0.00 61.69 61.22 2ize s THR 123 Cb 0.11 -2.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.55 2ize s THR 123 CO 0.76 0.53 0.19 -0.76 -0.69 0.00 0.00 174.62 174.65 2ize s LEU 124 N 0.76 4.09 0.04 4.42 1.43 0.17 -4.90 118.68 124.70 2ize s LEU 124 Ca -0.07 0.07 0.04 0.00 -1.03 0.00 0.00 54.13 53.14 2ize s LEU 124 Cb -0.16 -2.69 -0.02 0.00 0.03 0.00 0.00 46.19 43.35 2ize s LEU 124 CO 0.00 0.10 -0.12 0.54 0.23 0.00 0.00 176.35 177.10 2ize s VAL 125 N -1.64 0.95 0.00 -1.59 0.11 -1.26 -0.49 120.40 116.48 2ize s VAL 125 Ca 0.33 -0.99 0.00 0.00 -2.93 0.00 0.00 61.98 58.39 2ize s VAL 125 Cb -0.11 -0.89 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 2ize s VAL 125 CO 0.26 -0.09 0.00 0.61 -3.33 0.00 0.00 175.10 172.55 2ize n GLY 126 N 1.83 1.95 3.20 6.54 0.00 -0.97 -4.98 105.19 112.75 2ize n GLY 126 Ca -0.19 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.81 2ize n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2ize s HIS 127 N -6.06 -0.28 0.04 1.61 -3.43 -1.26 -1.54 115.29 104.37 2ize s HIS 127 Ca 0.00 0.64 0.04 0.00 -0.80 0.00 0.00 55.06 54.93 2ize s HIS 127 Cb 0.00 0.10 -0.02 0.00 -1.43 0.00 0.00 32.58 31.23 2ize s HIS 127 CO 0.00 -0.22 -0.11 -0.51 -2.00 0.00 0.00 174.74 171.90 2ize s ASP 128 N -0.26 1.31 -0.07 7.38 1.01 -0.92 -4.98 116.67 120.15 2ize s ASP 128 Ca -0.04 -0.49 0.04 0.00 0.71 0.00 0.00 52.55 52.78 2ize s ASP 128 Cb -0.03 -0.05 -0.00 0.00 1.01 0.00 0.00 42.92 43.85 2ize s ASP 128 CO 0.01 -0.06 -0.19 -0.89 0.21 0.00 0.00 175.17 174.25 2ize s THR 129 N -1.03 1.65 -0.02 -1.27 2.01 -1.26 -1.10 115.64 114.61 2ize s THR 129 Ca -0.03 -0.81 0.04 0.00 0.31 0.00 0.00 61.69 61.20 2ize s THR 129 Cb -0.08 -1.43 -0.03 0.00 0.01 0.00 0.00 72.50 70.97 2ize s THR 129 CO 0.01 0.47 -0.11 -0.36 -0.69 0.00 0.00 174.62 173.93 2ize s PHE 130 N 0.22 2.77 -0.03 4.92 0.40 -0.29 -3.41 117.98 122.55 2ize s PHE 130 Ca -0.10 -0.11 0.07 0.00 -0.60 0.00 0.00 56.93 56.18 2ize s PHE 130 Cb -0.15 -1.60 -0.02 0.00 0.51 0.00 0.00 43.02 41.76 2ize s PHE 130 CO 0.05 0.28 -0.23 0.99 0.70 0.00 0.00 175.22 177.01 2ize s THR 131 N -0.87 2.27 0.16 0.64 2.01 0.18 -2.12 115.64 117.91 2ize s THR 131 Ca 0.14 -1.02 -0.17 0.00 0.31 0.00 0.00 61.69 60.95 2ize s THR 131 Cb -0.11 -1.81 -0.07 0.00 0.01 0.00 0.00 72.50 70.52 2ize s THR 131 CO 0.04 0.58 0.61 -0.75 -0.69 0.00 0.00 174.62 174.41 2ize s LYS 132 N -0.56 4.10 -0.09 4.92 2.20 -1.17 -1.21 119.74 127.92 2ize s LYS 132 Ca 0.08 0.65 0.02 0.00 -0.36 0.00 0.00 55.97 56.36 2ize s LYS 132 Cb -0.11 -2.95 -0.02 0.00 -1.51 0.00 0.00 37.83 33.25 2ize s LYS 132 CO 0.00 0.47 -0.16 0.54 -0.36 0.00 0.00 175.35 175.84 2ize s VAL 133 N -1.45 2.88 0.00 4.02 0.11 -0.82 -4.91 120.40 120.24 2ize s VAL 133 Ca 0.39 -0.75 0.00 0.00 -2.93 0.00 0.00 61.98 58.68 2ize s VAL 133 Cb -0.16 -2.16 0.00 0.00 -1.53 0.00 0.00 36.38 32.53 2ize s VAL 133 CO 0.20 0.56 0.00 1.17 -3.33 0.00 0.00 175.10 173.69