#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ize n ALA 2 N 0.00 3.28 -2.32 0.00 0.00 -1.26 -4.84 120.51 115.36 1ize n ALA 2 Ca 0.00 -0.34 -0.08 0.00 0.00 0.00 0.00 53.44 53.02 1ize n ALA 2 Cb 0.00 -1.16 -0.09 0.00 0.00 0.00 0.00 19.45 18.20 1ize n ALA 2 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1ize s THR 3 N -2.82 0.17 -0.06 0.00 -4.23 -1.26 -0.98 115.64 106.46 1ize s THR 3 Ca 0.16 -1.54 -0.30 0.00 -1.18 0.00 0.00 61.69 58.83 1ize s THR 3 Cb 0.18 -1.52 0.11 0.00 1.34 0.00 0.00 72.50 72.62 1ize s THR 3 CO 0.62 -0.76 0.96 -0.83 -0.54 0.00 0.00 174.62 174.06 1ize s GLY 4 N -2.91 -0.41 0.05 3.99 0.00 -0.42 -4.77 107.32 102.86 1ize s GLY 4 Ca 0.08 1.27 -0.02 0.00 0.00 0.00 0.00 44.72 46.06 1ize s GLY 4 CO -0.09 0.48 0.01 -1.35 0.00 0.00 0.00 173.10 172.15 1ize s SER 5 N -2.21 0.37 -0.12 1.64 1.04 -1.24 0.26 113.70 113.43 1ize s SER 5 Ca 0.05 -0.81 -0.20 0.00 0.48 0.00 0.00 55.95 55.46 1ize s SER 5 Cb -0.01 0.20 0.05 0.00 0.10 0.00 0.00 66.02 66.36 1ize s SER 5 CO -0.07 -0.54 0.51 0.54 0.98 0.00 0.00 173.24 174.66 1ize s VAL 6 N -3.29 0.01 0.32 5.02 0.11 -0.71 -4.43 120.40 117.44 1ize s VAL 6 Ca 0.01 -0.12 -0.27 0.00 -2.93 0.00 0.00 61.98 58.67 1ize s VAL 6 Cb 0.03 -0.76 -0.09 0.00 -1.53 0.00 0.00 36.38 34.03 1ize s VAL 6 CO -0.08 -0.07 1.01 -0.89 -3.33 0.00 0.00 175.10 171.75 1ize s THR 7 N -0.46 3.85 -0.04 5.04 2.01 -1.26 -1.63 115.64 123.15 1ize s THR 7 Ca -0.06 1.63 0.03 0.00 0.31 0.00 0.00 61.69 63.60 1ize s THR 7 Cb -0.03 -3.95 0.01 0.00 0.01 0.00 0.00 72.50 68.54 1ize s THR 7 CO 0.04 0.22 -0.11 0.28 -0.69 0.00 0.00 174.62 174.35 1ize s THR 8 N -1.44 1.00 -0.05 -0.82 -1.32 -0.90 -4.33 115.64 107.78 1ize s THR 8 Ca 0.49 -0.44 0.06 0.00 -1.21 0.00 0.00 61.69 60.59 1ize s THR 8 Cb -0.24 -0.90 -0.01 0.00 -1.51 0.00 0.00 72.50 69.83 1ize s THR 8 CO 0.31 0.31 -0.24 0.20 -2.21 0.00 0.00 174.62 172.99 1ize s ASN 9 N 0.40 2.95 0.55 8.08 -0.87 -0.08 -0.90 114.94 125.08 1ize s ASN 9 Ca -0.08 -0.49 -0.17 0.00 -1.57 0.00 0.00 52.86 50.55 1ize s ASN 9 Cb -0.12 -0.73 -0.06 0.00 -0.02 0.00 0.00 41.25 40.32 1ize s ASN 9 CO 0.02 0.25 1.04 -2.16 -2.57 0.00 0.00 177.10 173.67 1ize s PRO 10 N -0.22 3.56 0.48 -0.60 0.04 -1.26 -0.40 135.00 136.60 1ize s PRO 10 Ca -0.01 1.21 -0.02 0.00 0.04 0.00 0.00 61.00 62.21 1ize s PRO 10 Cb -0.13 -2.07 0.10 0.00 0.04 0.00 0.00 34.50 32.44 1ize s PRO 10 CO 0.03 -0.61 0.65 0.25 0.04 0.00 0.00 177.00 177.36 1ize n THR 11 N -1.65 0.00 -1.64 1.26 -2.24 0.17 -4.88 114.28 105.30 1ize n THR 11 Ca 0.09 -0.87 -0.41 0.00 -2.27 0.00 0.00 64.05 60.58 1ize n THR 11 Cb 0.53 -1.23 0.01 0.00 -2.10 0.00 0.00 70.33 67.54 1ize n THR 11 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1ize n SER 12 N -3.07 1.75 -0.93 3.42 7.64 -1.26 -1.56 113.62 119.60 1ize n SER 12 Ca 0.10 1.07 -0.12 0.00 1.01 0.00 0.00 58.87 60.93 1ize n SER 12 Cb 0.36 -1.41 -0.05 0.00 -1.01 0.00 0.00 64.21 62.10 1ize n SER 12 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1ize n ASN 13 N 0.42 -5.60 -3.56 6.43 5.03 -1.26 -2.03 115.26 114.68 1ize n ASN 13 Ca 0.08 0.30 -0.26 0.00 0.87 0.00 0.00 54.58 55.57 1ize n ASN 13 Cb 0.39 -4.17 0.03 0.00 -1.02 0.00 0.00 39.78 35.00 1ize n ASN 13 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1ize n ASP 14 N -1.13 -5.04 -0.14 6.41 8.00 -0.60 -4.87 116.55 119.18 1ize n ASP 14 Ca -0.12 -0.56 -0.08 0.00 0.71 0.00 0.00 54.79 54.74 1ize n ASP 14 Cb 0.59 -4.05 0.08 0.00 -0.02 0.00 0.00 41.12 37.72 1ize n ASP 14 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1ize h GLU 15 N -1.75 0.90 -3.38 -1.24 4.81 -1.54 -3.46 114.58 108.92 1ize h GLU 15 Ca -0.53 -0.31 -0.03 0.00 -0.13 0.00 0.00 59.36 58.36 1ize h GLU 15 Cb 1.35 -0.07 -0.10 0.00 0.63 0.00 0.00 28.75 30.56 1ize h GLU 15 CO 0.61 0.95 -0.01 -1.83 -0.73 0.00 0.00 179.01 178.00 1ize s GLU 16 N -4.85 1.39 -0.09 1.92 -1.05 -1.26 -4.36 118.70 110.40 1ize s GLU 16 Ca -0.10 -0.93 0.03 0.00 -0.15 0.00 0.00 54.97 53.82 1ize s GLU 16 Cb 0.14 0.51 -0.01 0.00 -0.44 0.00 0.00 34.13 34.32 1ize s GLU 16 CO 0.84 -0.58 -0.18 0.71 0.95 0.00 0.00 175.26 176.99 1ize s TYR 17 N -3.90 2.64 -0.09 4.83 1.51 -1.26 -0.66 117.35 120.43 1ize s TYR 17 Ca 0.11 -0.62 0.00 0.00 -1.01 0.00 0.00 57.07 55.55 1ize s TYR 17 Cb -0.01 -1.71 -0.03 0.00 -0.11 0.00 0.00 41.96 40.11 1ize s TYR 17 CO -0.01 -0.16 -0.08 0.42 -1.11 0.00 0.00 175.55 174.61 1ize s ILE 18 N -0.03 3.61 -0.07 2.71 -1.09 0.47 -4.10 121.20 122.70 1ize s ILE 18 Ca -0.05 -0.50 0.02 0.00 -2.23 0.00 0.00 60.65 57.89 1ize s ILE 18 Cb -0.14 -2.49 0.01 0.00 -1.58 0.00 0.00 42.46 38.26 1ize s ILE 18 CO 0.04 0.57 -0.12 -0.89 -1.23 0.00 0.00 174.94 173.32 1ize s THR 19 N -0.50 1.13 0.11 2.92 2.01 0.08 -0.90 115.64 120.49 1ize s THR 19 Ca 0.07 -0.47 -0.30 0.00 0.31 0.00 0.00 61.69 61.30 1ize s THR 19 Cb -0.12 -1.04 -0.06 0.00 0.01 0.00 0.00 72.50 71.29 1ize s THR 19 CO 0.02 0.35 1.16 -1.10 -0.69 0.00 0.00 174.62 174.36 1ize s GLN 20 N 0.69 4.49 0.03 4.92 -1.52 -1.26 -0.52 119.66 126.49 1ize s GLN 20 Ca -0.14 1.76 0.01 0.00 -1.95 0.00 0.00 55.36 55.04 1ize s GLN 20 Cb -0.16 -3.31 -0.02 0.00 -0.22 0.00 0.00 33.01 29.30 1ize s GLN 20 CO 0.03 -0.13 -0.05 0.08 -0.25 0.00 0.00 175.29 174.98 1ize s VAL 21 N 0.51 0.32 -0.32 1.09 1.01 0.44 -4.74 120.40 118.70 1ize s VAL 21 Ca 0.55 -0.97 -0.11 0.00 0.00 0.00 0.00 61.98 61.45 1ize s VAL 21 Cb -0.30 -0.42 -0.01 0.00 0.00 0.00 0.00 36.38 35.65 1ize s VAL 21 CO 0.32 -0.43 0.19 -0.89 0.00 0.00 0.00 175.10 174.29 1ize s THR 22 N -1.38 4.89 -0.31 3.92 2.01 -0.77 -0.23 115.64 123.77 1ize s THR 22 Ca -0.13 -0.34 -0.02 0.00 0.31 0.00 0.00 61.69 61.51 1ize s THR 22 Cb -0.10 -3.50 0.05 0.00 0.01 0.00 0.00 72.50 68.96 1ize s THR 22 CO -0.00 0.03 0.03 -0.69 -0.69 0.00 0.00 174.62 173.29 1ize s VAL 23 N 1.66 3.11 0.00 3.82 1.01 0.25 -1.11 120.40 129.14 1ize s VAL 23 Ca 0.05 -1.41 0.00 0.00 0.00 0.00 0.00 61.98 60.63 1ize s VAL 23 Cb -0.17 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.39 1ize s VAL 23 CO 0.08 -0.16 0.00 0.61 0.00 0.00 0.00 175.10 175.63 1ize n GLY 24 N 4.64 3.00 0.67 4.51 0.00 -0.19 -1.35 105.19 116.47 1ize n GLY 24 Ca -0.12 -0.12 0.08 0.00 0.00 0.00 0.00 46.02 45.86 1ize n GLY 24 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ize n ASP 25 N 9.35 2.42 -4.70 1.61 8.00 -1.26 -4.93 116.55 127.04 1ize n ASP 25 Ca 0.00 -1.70 -0.35 0.00 0.71 0.00 0.00 54.79 53.45 1ize n ASP 25 Cb 0.00 -0.02 -0.09 0.00 -0.02 0.00 0.00 41.12 40.99 1ize n ASP 25 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1ize s ASP 26 N -1.33 5.39 -0.28 -2.24 -0.00 -0.45 -5.09 116.67 112.66 1ize s ASP 26 Ca 0.20 0.17 -0.10 0.00 -0.00 0.00 0.00 52.55 52.82 1ize s ASP 26 Cb 0.14 -1.59 -0.04 0.00 -0.00 0.00 0.00 42.92 41.43 1ize s ASP 26 CO 0.21 0.36 0.16 -0.89 -0.00 0.00 0.00 175.17 175.00 1ize s THR 27 N -0.77 4.95 0.18 -1.27 2.01 -1.26 0.86 115.64 120.33 1ize s THR 27 Ca 0.12 -0.01 0.08 0.00 0.31 0.00 0.00 61.69 62.19 1ize s THR 27 Cb -0.12 -3.38 -0.04 0.00 0.01 0.00 0.00 72.50 68.97 1ize s THR 27 CO 0.02 0.24 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.27 1ize s LEU 28 N 1.70 2.49 -0.33 4.42 1.43 0.68 -4.92 118.68 124.16 1ize s LEU 28 Ca 0.07 -0.93 -0.16 0.00 -1.03 0.00 0.00 54.13 52.08 1ize s LEU 28 Cb -0.16 -0.75 -0.01 0.00 0.03 0.00 0.00 46.19 45.30 1ize s LEU 28 CO 0.08 -0.10 0.43 -0.83 0.23 0.00 0.00 176.35 176.17 1ize s GLY 29 N -2.93 1.86 0.13 -3.19 0.00 -1.26 -0.42 107.32 101.51 1ize s GLY 29 Ca 0.18 -1.03 0.09 0.00 0.00 0.00 0.00 44.72 43.96 1ize s GLY 29 CO 0.07 1.11 -0.16 1.08 0.00 0.00 0.00 173.10 175.19 1ize s LEU 30 N 2.19 2.76 -0.46 0.66 1.43 0.32 -0.57 118.68 125.00 1ize s LEU 30 Ca 0.16 -0.56 -0.21 0.00 -1.03 0.00 0.00 54.13 52.49 1ize s LEU 30 Cb -0.16 -1.57 0.03 0.00 0.03 0.00 0.00 46.19 44.52 1ize s LEU 30 CO 0.12 0.17 0.66 -0.62 0.23 0.00 0.00 176.35 176.90 1ize s ASP 31 N -2.25 6.30 -0.29 2.29 -1.08 -0.25 -0.74 116.67 120.64 1ize s ASP 31 Ca 0.19 -0.49 -0.29 0.00 -0.52 0.00 0.00 52.55 51.44 1ize s ASP 31 Cb -0.10 -2.32 -0.01 0.00 -1.46 0.00 0.00 42.92 39.03 1ize s ASP 31 CO 0.11 -0.84 1.42 -0.36 0.52 0.00 0.00 175.17 176.02 1ize s PHE 32 N 2.85 2.46 -0.31 -5.34 0.40 -1.26 -1.88 117.98 114.89 1ize s PHE 32 Ca 0.21 0.74 0.03 0.00 -0.60 0.00 0.00 56.93 57.31 1ize s PHE 32 Cb -0.15 -3.98 0.08 0.00 0.51 0.00 0.00 43.02 39.48 1ize s PHE 32 CO 0.17 -2.14 -0.00 0.34 0.70 0.00 0.00 175.22 174.28 1ize s ASP 33 N 3.42 4.68 0.00 1.36 2.15 -0.42 -4.24 116.67 123.63 1ize s ASP 33 Ca 0.62 -1.83 0.11 0.00 0.43 0.00 0.00 52.55 51.88 1ize s ASP 33 Cb -0.19 -1.61 0.66 0.00 -0.30 0.00 0.00 42.92 41.48 1ize s ASP 33 CO 0.26 -0.31 1.24 0.35 -0.17 0.00 0.00 175.17 176.54 1ize n THR 34 N 4.35 0.00 -0.19 1.71 -2.24 -1.26 -0.79 114.28 115.86 1ize n THR 34 Ca -0.04 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.85 1ize n THR 34 Cb 0.42 -0.36 0.27 0.00 -2.10 0.00 0.00 70.33 68.56 1ize n THR 34 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ize n GLY 35 N 0.37 2.34 3.51 3.38 0.00 -1.26 -3.77 105.19 109.75 1ize n GLY 35 Ca 0.08 -0.70 -0.10 0.00 0.00 0.00 0.00 46.02 45.31 1ize n GLY 35 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ize s SER 36 N -1.09 -0.23 -0.14 1.61 1.04 -1.12 -4.94 113.70 108.83 1ize s SER 36 Ca 0.42 -0.53 0.14 0.00 0.48 0.00 0.00 55.95 56.46 1ize s SER 36 Cb 0.22 0.57 0.36 0.00 0.10 0.00 0.00 66.02 67.27 1ize s SER 36 CO 0.30 -1.04 1.18 0.00 0.98 0.00 0.00 173.24 174.65 1ize n ALA 37 N -0.33 3.02 -3.08 5.32 0.00 -1.26 -0.88 120.51 123.29 1ize n ALA 37 Ca -0.09 -2.84 -0.32 0.00 0.00 0.00 0.00 53.44 50.18 1ize n ALA 37 Cb 0.62 -0.43 -0.16 0.00 0.00 0.00 0.00 19.45 19.49 1ize n ALA 37 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ize s ASP 38 N -2.81 3.52 -0.47 0.00 1.11 -1.26 -4.49 116.67 112.26 1ize s ASP 38 Ca 0.33 -0.44 -0.13 0.00 0.18 0.00 0.00 52.55 52.49 1ize s ASP 38 Cb 0.33 -1.42 0.09 0.00 1.07 0.00 0.00 42.92 42.99 1ize s ASP 38 CO -0.06 0.18 0.37 -0.22 1.18 0.00 0.00 175.17 176.63 1ize s LEU 39 N 0.25 5.62 0.11 1.23 0.20 -1.26 -2.57 118.68 122.26 1ize s LEU 39 Ca -0.13 -1.53 0.09 0.00 0.69 0.00 0.00 54.13 53.25 1ize s LEU 39 Cb -0.16 -2.12 -0.04 0.00 -0.43 0.00 0.00 46.19 43.44 1ize s LEU 39 CO 0.07 -0.66 -0.21 -1.66 -0.29 0.00 0.00 176.35 173.59 1ize s TRP 40 N 1.54 1.86 0.09 5.38 1.48 -0.47 -0.93 118.94 127.90 1ize s TRP 40 Ca 0.04 -0.42 0.02 0.00 -1.06 0.00 0.00 56.10 54.68 1ize s TRP 40 Cb -0.25 -1.01 -0.04 0.00 -1.16 0.00 0.00 33.47 31.01 1ize s TRP 40 CO 0.04 0.23 -0.07 0.14 -4.06 0.00 0.00 176.95 173.23 1ize s VAL 41 N -1.23 0.72 0.34 -0.66 -7.23 -0.38 -1.37 120.40 110.58 1ize s VAL 41 Ca 0.08 -1.82 -0.27 0.00 -1.81 0.00 0.00 61.98 58.16 1ize s VAL 41 Cb -0.10 -1.54 -0.09 0.00 0.56 0.00 0.00 36.38 35.21 1ize s VAL 41 CO 0.05 -0.79 1.14 -0.36 -0.31 0.00 0.00 175.10 174.83 1ize s PHE 42 N -3.26 3.31 0.11 2.82 0.40 -0.59 -2.06 117.98 118.72 1ize s PHE 42 Ca 0.09 1.61 0.01 0.00 -0.60 0.00 0.00 56.93 58.04 1ize s PHE 42 Cb 0.03 -3.35 -0.00 0.00 0.51 0.00 0.00 43.02 40.20 1ize s PHE 42 CO -0.04 -0.98 0.12 -1.13 0.70 0.00 0.00 175.22 173.90 1ize n SER 43 N 0.62 -0.32 0.08 1.36 3.41 -1.26 -0.89 113.62 116.62 1ize n SER 43 Ca 0.02 -1.69 0.10 0.00 -0.26 0.00 0.00 58.87 57.04 1ize n SER 43 Cb 0.46 0.67 0.42 0.00 -0.26 0.00 0.00 64.21 65.49 1ize n SER 43 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ize n SER 44 N -2.33 0.41 0.04 4.04 3.41 -0.19 -1.72 113.62 117.28 1ize n SER 44 Ca 0.02 0.60 0.12 0.00 -0.26 0.00 0.00 58.87 59.35 1ize n SER 44 Cb 0.20 -0.69 0.12 0.00 -0.26 0.00 0.00 64.21 63.58 1ize n SER 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ize n GLN 45 N -1.95 0.26 -2.34 4.33 6.02 -1.26 -4.87 117.38 117.56 1ize n GLN 45 Ca 0.02 0.04 -0.42 0.00 -0.01 0.00 0.00 57.00 56.64 1ize n GLN 45 Cb 0.20 -1.63 -0.03 0.00 1.02 0.00 0.00 30.24 29.79 1ize n GLN 45 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1ize s THR 46 N -3.16 3.67 0.26 5.09 2.01 -0.70 -4.61 115.64 118.19 1ize s THR 46 Ca 0.06 1.28 -0.30 0.00 0.31 0.00 0.00 61.69 63.04 1ize s THR 46 Cb 0.14 -3.82 -0.14 0.00 0.01 0.00 0.00 72.50 68.69 1ize s THR 46 CO 0.75 0.14 1.19 -2.65 -0.69 0.00 0.00 174.62 173.37 1ize n PRO 47 N 3.32 1.61 -0.27 4.92 -0.02 -1.26 -4.73 135.00 138.57 1ize n PRO 47 Ca 0.08 0.57 0.15 0.00 -2.02 0.00 0.00 63.50 62.27 1ize n PRO 47 Cb 0.45 -2.08 0.42 0.00 -0.02 0.00 0.00 33.50 32.28 1ize n PRO 47 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1ize h SER 48 N 3.00 0.57 0.32 2.55 4.64 -1.94 -0.21 113.55 122.47 1ize h SER 48 Ca -0.43 0.05 -0.07 0.00 -0.47 0.00 0.00 61.79 60.87 1ize h SER 48 Cb 1.32 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 1ize h SER 48 CO 0.67 0.26 -0.32 -1.28 -0.87 0.00 0.00 176.83 175.29 1ize h SER 49 N 0.59 0.00 0.79 4.97 0.87 -2.00 -2.63 113.55 116.15 1ize h SER 49 Ca 0.47 -0.00 -0.20 0.00 -1.23 0.00 0.00 61.79 60.83 1ize h SER 49 Cb 0.91 -0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.84 1ize h SER 49 CO -0.22 0.33 -1.31 -0.33 -0.53 0.00 0.00 176.83 174.77 1ize h GLU 50 N 0.00 0.00 -0.30 2.24 5.08 -1.41 -3.34 114.58 116.85 1ize h GLU 50 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ize h GLU 50 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1ize h GLU 50 CO 0.04 0.47 0.00 2.89 -1.00 0.00 0.00 179.01 181.41 1ize n ARG 51 N -3.04 2.23 -1.68 2.33 1.85 -0.77 -4.65 116.66 112.93 1ize n ARG 51 Ca -0.09 -1.86 -0.52 0.00 -1.00 0.00 0.00 57.85 54.39 1ize n ARG 51 Cb 0.90 -1.47 -0.06 0.00 -1.05 0.00 0.00 32.46 30.78 1ize n ARG 51 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1ize n SER 52 N 1.08 2.78 0.00 2.89 2.88 -1.00 -1.15 113.62 121.09 1ize n SER 52 Ca 0.18 1.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.76 1ize n SER 52 Cb 0.51 -1.28 0.00 0.00 -0.75 0.00 0.00 64.21 62.69 1ize n SER 52 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ize n GLY 53 N 3.90 1.41 3.84 0.46 0.00 -1.26 -4.95 105.19 108.59 1ize n GLY 53 Ca 0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.96 1ize n GLY 53 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ize s HIS 54 N -2.86 3.28 0.34 1.61 4.02 -0.30 -4.82 115.29 116.56 1ize s HIS 54 Ca 0.00 0.08 -0.18 0.00 1.02 0.00 0.00 55.06 55.98 1ize s HIS 54 Cb 0.00 -1.61 -0.10 0.00 -1.02 0.00 0.00 32.58 29.85 1ize s HIS 54 CO 0.00 0.53 0.81 -0.51 1.02 0.00 0.00 174.74 176.59 1ize s ASP 55 N -2.80 6.89 0.14 1.40 -0.00 -1.26 -5.04 116.67 116.00 1ize s ASP 55 Ca 0.32 1.45 -0.02 0.00 -0.00 0.00 0.00 52.55 54.29 1ize s ASP 55 Cb -0.11 -2.44 -0.04 0.00 -0.00 0.00 0.00 42.92 40.33 1ize s ASP 55 CO 0.25 -0.21 0.09 -0.72 -0.00 0.00 0.00 175.17 174.57 1ize s TYR 56 N -1.96 0.84 -0.09 4.23 1.13 -1.26 -4.77 117.35 115.46 1ize s TYR 56 Ca 0.55 -1.20 -0.20 0.00 -1.41 0.00 0.00 57.07 54.81 1ize s TYR 56 Cb -0.11 -0.44 -0.04 0.00 -1.10 0.00 0.00 41.96 40.26 1ize s TYR 56 CO 0.17 -0.55 0.55 -0.47 -2.51 0.00 0.00 175.55 172.73 1ize s TYR 57 N -4.05 3.55 -0.20 -3.49 5.04 -0.07 -4.90 117.35 113.23 1ize s TYR 57 Ca 0.25 1.01 0.01 0.00 -2.44 0.00 0.00 57.07 55.90 1ize s TYR 57 Cb 0.07 -2.62 0.04 0.00 0.35 0.00 0.00 41.96 39.80 1ize s TYR 57 CO 0.03 0.17 -0.14 0.99 -1.34 0.00 0.00 175.55 175.25 1ize s THR 58 N 0.58 1.92 0.00 4.34 2.01 -1.26 -1.02 115.64 122.21 1ize s THR 58 Ca 0.29 -1.11 -0.34 0.00 0.31 0.00 0.00 61.69 60.85 1ize s THR 58 Cb -0.16 -1.89 -0.12 0.00 0.01 0.00 0.00 72.50 70.34 1ize s THR 58 CO 0.13 0.28 1.81 -2.65 -0.69 0.00 0.00 174.62 173.49 1ize n PRO 59 N 4.61 2.27 0.00 4.92 -0.02 -1.26 -4.80 135.00 140.72 1ize n PRO 59 Ca -0.17 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1ize n PRO 59 Cb 0.47 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 1ize n PRO 59 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ize n GLY 60 N 4.14 2.97 0.25 -1.23 0.00 -1.26 -4.96 105.19 105.10 1ize n GLY 60 Ca 0.21 -1.96 0.13 0.00 0.00 0.00 0.00 46.02 44.40 1ize n GLY 60 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ize h SER 61 N 0.00 0.00 0.06 1.61 0.02 -2.03 -2.79 113.55 110.42 1ize h SER 61 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ize h SER 61 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1ize h SER 61 CO 0.00 0.10 -0.05 -1.54 -1.14 0.00 0.00 176.83 174.20 1ize n SER 62 N -3.22 1.18 -4.86 3.07 3.41 -1.26 -4.87 113.62 107.07 1ize n SER 62 Ca 0.01 -1.27 -0.36 0.00 -0.26 0.00 0.00 58.87 56.99 1ize n SER 62 Cb 0.39 0.02 -0.06 0.00 -0.26 0.00 0.00 64.21 64.30 1ize n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ize s ALA 63 N -2.12 3.72 -0.08 7.33 0.00 -1.06 -4.57 121.76 124.98 1ize s ALA 63 Ca 0.36 -0.34 -0.02 0.00 0.00 0.00 0.00 51.96 51.97 1ize s ALA 63 Cb 0.21 -2.30 0.03 0.00 0.00 0.00 0.00 23.12 21.06 1ize s ALA 63 CO 0.38 0.54 0.01 -0.65 0.00 0.00 0.00 175.76 176.04 1ize s GLN 64 N -1.62 0.51 0.28 0.00 -0.21 -0.62 -4.88 119.66 113.12 1ize s GLN 64 Ca 0.30 0.09 -0.29 0.00 0.02 0.00 0.00 55.36 55.47 1ize s GLN 64 Cb -0.15 -1.04 -0.10 0.00 1.00 0.00 0.00 33.01 32.72 1ize s GLN 64 CO 0.16 -0.35 1.12 0.21 -2.12 0.00 0.00 175.29 174.32 1ize s LYS 65 N 1.99 4.61 -0.74 2.91 2.20 -1.26 -0.75 119.74 128.70 1ize s LYS 65 Ca 0.04 1.85 -0.18 0.00 -0.36 0.00 0.00 55.97 57.32 1ize s LYS 65 Cb -0.13 -3.18 0.14 0.00 -1.51 0.00 0.00 37.83 33.15 1ize s LYS 65 CO -0.05 0.16 0.85 0.42 -0.36 0.00 0.00 175.35 176.36 1ize s ILE 66 N -1.11 4.96 0.28 5.43 1.01 -0.43 -4.93 121.20 126.42 1ize s ILE 66 Ca 0.45 -1.48 -0.30 0.00 0.00 0.00 0.00 60.65 59.32 1ize s ILE 66 Cb -0.33 -4.57 -0.13 0.00 0.01 0.00 0.00 42.46 37.44 1ize s ILE 66 CO 0.42 -1.22 1.26 0.47 0.00 0.00 0.00 174.94 175.87 1ize n ASP 67 N 5.88 2.29 0.00 3.58 8.00 -1.26 -2.09 116.55 132.96 1ize n ASP 67 Ca 0.05 1.17 0.00 0.00 0.71 0.00 0.00 54.79 56.73 1ize n ASP 67 Cb 0.45 -1.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.16 1ize n ASP 67 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ize n GLY 68 N 1.48 1.18 3.80 0.44 0.00 -1.26 -5.00 105.19 105.83 1ize n GLY 68 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1ize n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ize s ALA 69 N -3.19 3.57 0.10 4.61 0.00 -0.89 -4.46 121.76 121.51 1ize s ALA 69 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 51.96 51.94 1ize s ALA 69 Cb 0.00 -2.64 -0.03 0.00 0.00 0.00 0.00 23.12 20.45 1ize s ALA 69 CO 0.00 0.34 0.06 0.95 0.00 0.00 0.00 175.76 177.11 1ize s THR 70 N -0.82 0.15 0.01 0.00 -4.23 -0.45 -3.84 115.64 106.46 1ize s THR 70 Ca 0.29 -1.73 -0.09 0.00 -1.18 0.00 0.00 61.69 58.97 1ize s THR 70 Cb -0.19 -1.74 0.01 0.00 1.34 0.00 0.00 72.50 71.92 1ize s THR 70 CO 0.18 -0.68 0.19 -1.66 -0.54 0.00 0.00 174.62 172.11 1ize s TRP 71 N -3.97 -0.00 -0.25 3.99 1.48 -0.96 -0.54 118.94 118.70 1ize s TRP 71 Ca 0.14 -0.08 -0.12 0.00 -1.06 0.00 0.00 56.10 54.99 1ize s TRP 71 Cb 0.07 -0.01 0.09 0.00 -1.16 0.00 0.00 33.47 32.46 1ize s TRP 71 CO -0.04 -0.34 0.57 0.45 -4.06 0.00 0.00 176.95 173.52 1ize s SER 72 N -1.55 -0.79 0.05 -2.66 0.15 -1.26 -1.87 113.70 105.77 1ize s SER 72 Ca -0.12 1.31 0.03 0.00 0.70 0.00 0.00 55.95 57.87 1ize s SER 72 Cb -0.05 1.48 -0.02 0.00 -1.71 0.00 0.00 66.02 65.71 1ize s SER 72 CO 0.01 -0.22 -0.10 -0.51 1.20 0.00 0.00 173.24 173.61 1ize s ILE 73 N 2.07 0.75 -0.07 6.45 2.07 -0.48 -4.91 121.20 127.09 1ize s ILE 73 Ca -0.08 -1.11 0.02 0.00 -1.41 0.00 0.00 60.65 58.08 1ize s ILE 73 Cb -0.09 -0.77 0.02 0.00 0.13 0.00 0.00 42.46 41.75 1ize s ILE 73 CO -0.17 -0.28 -0.10 -0.55 -1.91 0.00 0.00 174.94 171.92 1ize s SER 74 N -1.53 1.71 0.40 4.50 0.15 -1.26 -2.57 113.70 115.09 1ize s SER 74 Ca -0.06 -0.27 0.07 0.00 0.70 0.00 0.00 55.95 56.39 1ize s SER 74 Cb -0.09 -0.77 0.01 0.00 -1.71 0.00 0.00 66.02 63.45 1ize s SER 74 CO 0.01 0.00 0.55 -0.31 1.20 0.00 0.00 173.24 174.69 1ize s TYR 75 N 0.84 2.90 0.57 3.44 2.02 -0.31 -5.01 117.35 121.81 1ize s TYR 75 Ca -0.11 -0.33 0.27 0.00 -0.37 0.00 0.00 57.07 56.52 1ize s TYR 75 Cb -0.15 -2.29 1.64 0.00 -0.40 0.00 0.00 41.96 40.76 1ize s TYR 75 CO 0.02 -0.32 2.16 0.78 -1.57 0.00 0.00 175.55 176.62 1ize h GLY 76 N 0.69 0.00 -1.86 0.71 0.00 -2.00 -1.15 103.07 99.46 1ize h GLY 76 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.91 1ize h GLY 76 CO 0.47 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.10 1ize n ASP 77 N -3.99 2.72 0.00 0.19 5.68 -1.26 -4.92 116.55 114.98 1ize n ASP 77 Ca -0.00 -1.99 0.00 0.00 -0.50 0.00 0.00 54.79 52.30 1ize n ASP 77 Cb 0.21 -0.33 0.00 0.00 -1.14 0.00 0.00 41.12 39.86 1ize n ASP 77 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ize n GLY 78 N 1.32 1.20 3.76 6.12 0.00 -0.44 -5.05 105.19 112.10 1ize n GLY 78 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 1ize n GLY 78 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ize s SER 79 N -2.94 4.16 0.27 1.61 1.04 -1.26 -4.76 113.70 111.82 1ize s SER 79 Ca 0.00 1.54 -0.21 0.00 0.48 0.00 0.00 55.95 57.76 1ize s SER 79 Cb 0.00 -2.26 0.02 0.00 0.10 0.00 0.00 66.02 63.88 1ize s SER 79 CO 0.00 -2.21 0.71 -0.94 0.98 0.00 0.00 173.24 171.77 1ize s SER 80 N -3.56 -0.27 -0.05 7.02 1.04 -1.26 -1.16 113.70 115.46 1ize s SER 80 Ca 0.62 -0.59 -0.29 0.00 0.48 0.00 0.00 55.95 56.16 1ize s SER 80 Cb -0.17 0.72 0.11 0.00 0.10 0.00 0.00 66.02 66.78 1ize s SER 80 CO 0.56 -1.33 0.92 0.00 0.98 0.00 0.00 173.24 174.37 1ize s ALA 81 N -3.92 -1.86 0.13 5.32 0.00 -1.06 -1.61 121.76 118.76 1ize s ALA 81 Ca 0.11 1.18 -0.25 0.00 0.00 0.00 0.00 51.96 53.00 1ize s ALA 81 Cb -0.06 0.13 0.07 0.00 0.00 0.00 0.00 23.12 23.27 1ize s ALA 81 CO 0.06 -0.59 0.77 -1.54 0.00 0.00 0.00 175.76 174.46 1ize s SER 82 N -2.13 -0.39 0.00 0.00 1.04 -0.76 -1.38 113.70 110.09 1ize s SER 82 Ca 0.03 -0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.28 1ize s SER 82 Cb -0.01 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.65 1ize s SER 82 CO -0.06 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 173.85 1ize n GLY 83 N -0.37 -0.67 1.82 7.32 0.00 -0.78 0.07 105.19 112.58 1ize n GLY 83 Ca -0.10 -0.48 -0.14 0.00 0.00 0.00 0.00 46.02 45.29 1ize n GLY 83 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ize n ASP 84 N 0.00 2.23 -4.11 1.61 5.68 -0.82 -2.26 116.55 118.88 1ize n ASP 84 Ca 0.00 -2.00 -0.22 0.00 -0.50 0.00 0.00 54.79 52.08 1ize n ASP 84 Cb 0.00 0.07 -0.15 0.00 -1.14 0.00 0.00 41.12 39.90 1ize n ASP 84 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1ize s VAL 85 N -1.58 1.10 0.15 2.12 1.01 -1.25 -1.11 120.40 120.83 1ize s VAL 85 Ca 0.08 -0.68 0.05 0.00 0.00 0.00 0.00 61.98 61.43 1ize s VAL 85 Cb -0.01 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 1ize s VAL 85 CO 0.05 0.24 -0.12 -0.31 0.00 0.00 0.00 175.10 174.96 1ize s TYR 86 N -0.44 1.38 -0.09 5.22 1.51 -0.43 -1.31 117.35 123.18 1ize s TYR 86 Ca 0.05 -0.65 0.01 0.00 -1.01 0.00 0.00 57.07 55.46 1ize s TYR 86 Cb -0.06 -0.70 -0.02 0.00 -0.11 0.00 0.00 41.96 41.07 1ize s TYR 86 CO -0.00 0.15 -0.12 0.15 -1.11 0.00 0.00 175.55 174.62 1ize s LYS 87 N -3.33 2.96 0.31 -0.62 1.02 0.07 0.76 119.74 120.91 1ize s LYS 87 Ca 0.15 -0.65 -0.19 0.00 0.02 0.00 0.00 55.97 55.29 1ize s LYS 87 Cb -0.01 -2.55 0.04 0.00 -0.52 0.00 0.00 37.83 34.79 1ize s LYS 87 CO 0.02 0.45 0.79 0.34 -0.92 0.00 0.00 175.35 176.04 1ize s ASP 88 N -0.27 -0.13 0.09 2.83 -1.08 -0.56 -1.59 116.67 115.97 1ize s ASP 88 Ca 0.02 -0.81 -0.28 0.00 -0.52 0.00 0.00 52.55 50.96 1ize s ASP 88 Cb -0.13 0.75 -0.06 0.00 -1.46 0.00 0.00 42.92 42.02 1ize s ASP 88 CO 0.03 -1.43 0.89 -0.75 0.52 0.00 0.00 175.17 174.43 1ize s LYS 89 N -3.12 4.63 -0.07 4.34 2.20 -1.20 -1.77 119.74 124.75 1ize s LYS 89 Ca 0.14 1.32 0.02 0.00 -0.36 0.00 0.00 55.97 57.08 1ize s LYS 89 Cb -0.05 -3.37 0.02 0.00 -1.51 0.00 0.00 37.83 32.92 1ize s LYS 89 CO 0.08 0.25 -0.11 0.08 -0.36 0.00 0.00 175.35 175.30 1ize s VAL 90 N -0.08 1.08 -0.10 4.02 1.01 -0.32 -1.02 120.40 124.99 1ize s VAL 90 Ca 0.44 -0.42 0.04 0.00 0.00 0.00 0.00 61.98 62.03 1ize s VAL 90 Cb -0.22 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.14 1ize s VAL 90 CO 0.28 0.35 -0.23 -0.89 0.00 0.00 0.00 175.10 174.61 1ize s THR 91 N 0.89 1.98 -0.24 3.92 2.01 -0.26 -1.94 115.64 122.01 1ize s THR 91 Ca -0.10 -0.97 0.01 0.00 0.31 0.00 0.00 61.69 60.94 1ize s THR 91 Cb -0.15 -1.72 0.06 0.00 0.01 0.00 0.00 72.50 70.70 1ize s THR 91 CO 0.01 0.54 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.74 1ize s VAL 92 N 0.42 1.55 -1.54 3.82 1.01 0.15 -1.84 120.40 123.96 1ize s VAL 92 Ca -0.17 -1.24 -0.04 0.00 0.00 0.00 0.00 61.98 60.52 1ize s VAL 92 Cb -0.18 -1.81 0.04 0.00 0.00 0.00 0.00 36.38 34.43 1ize s VAL 92 CO 0.07 -0.11 0.31 0.61 0.00 0.00 0.00 175.10 175.99 1ize n GLY 93 N 4.66 -0.22 0.99 4.51 0.00 -1.26 -0.83 105.19 113.04 1ize n GLY 93 Ca -0.12 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1ize n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ize n GLY 94 N -2.08 3.09 3.69 -0.02 0.00 -1.26 -3.71 105.19 104.90 1ize n GLY 94 Ca -0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.39 1ize n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ize s VAL 95 N -2.36 5.07 0.13 1.61 1.01 -0.01 -3.48 120.40 122.37 1ize s VAL 95 Ca 0.00 1.20 0.04 0.00 0.00 0.00 0.00 61.98 63.22 1ize s VAL 95 Cb 0.00 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 1ize s VAL 95 CO 0.00 0.21 -0.09 -0.44 0.00 0.00 0.00 175.10 174.78 1ize s SER 96 N 0.93 1.62 -0.10 3.32 0.01 -1.26 0.29 113.70 118.50 1ize s SER 96 Ca 0.31 -0.99 -0.05 0.00 1.31 0.00 0.00 55.95 56.53 1ize s SER 96 Cb -0.16 0.01 0.05 0.00 0.21 0.00 0.00 66.02 66.13 1ize s SER 96 CO 0.13 -0.35 0.22 -0.47 0.41 0.00 0.00 173.24 173.18 1ize s TYR 97 N -3.29 -0.31 -0.77 2.43 6.14 -0.82 -4.98 117.35 115.76 1ize s TYR 97 Ca 0.14 0.76 0.26 0.00 0.64 0.00 0.00 57.07 58.87 1ize s TYR 97 Cb 0.03 -0.02 0.72 0.00 0.42 0.00 0.00 41.96 43.10 1ize s TYR 97 CO -0.01 -0.25 1.64 -0.25 0.64 0.00 0.00 175.55 177.32 1ize n ASP 98 N 4.56 0.64 -1.39 4.32 9.92 -1.26 -1.18 116.55 132.16 1ize n ASP 98 Ca -0.20 0.37 -0.10 0.00 -0.53 0.00 0.00 54.79 54.34 1ize n ASP 98 Cb 0.52 -0.40 0.11 0.00 -0.64 0.00 0.00 41.12 40.70 1ize n ASP 98 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1ize n SER 99 N -2.05 3.38 -4.75 -2.24 7.64 -1.25 -3.22 113.62 111.13 1ize n SER 99 Ca 0.05 -3.77 -0.41 0.00 1.01 0.00 0.00 58.87 55.76 1ize n SER 99 Cb 0.41 -0.43 -0.03 0.00 -1.01 0.00 0.00 64.21 63.15 1ize n SER 99 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1ize s GLN 100 N -3.39 4.51 -0.24 1.43 2.00 -0.73 -4.68 119.66 118.56 1ize s GLN 100 Ca 0.45 1.91 -0.29 0.00 -2.00 0.00 0.00 55.36 55.42 1ize s GLN 100 Cb 0.39 -3.21 -0.01 0.00 0.80 0.00 0.00 33.01 30.99 1ize s GLN 100 CO -0.01 -0.04 1.30 0.00 -0.50 0.00 0.00 175.29 176.04 1ize s ALA 101 N -0.44 3.48 -0.25 1.58 0.00 -1.26 -1.49 121.76 123.38 1ize s ALA 101 Ca 0.51 0.27 -0.07 0.00 0.00 0.00 0.00 51.96 52.66 1ize s ALA 101 Cb -0.34 -3.72 -0.02 0.00 0.00 0.00 0.00 23.12 19.05 1ize s ALA 101 CO 0.40 -1.54 0.05 0.08 0.00 0.00 0.00 175.76 174.75 1ize s VAL 102 N 4.07 4.10 -0.46 0.00 1.01 0.23 -4.68 120.40 124.66 1ize s VAL 102 Ca 0.56 -0.29 -0.21 0.00 0.00 0.00 0.00 61.98 62.04 1ize s VAL 102 Cb -0.19 -2.93 0.03 0.00 0.00 0.00 0.00 36.38 33.29 1ize s VAL 102 CO 0.20 0.32 0.69 -1.61 0.00 0.00 0.00 175.10 174.71 1ize s GLU 103 N 1.58 3.28 -0.20 2.72 2.02 -0.11 -1.32 118.70 126.67 1ize s GLU 103 Ca 0.06 -0.39 -0.28 0.00 0.02 0.00 0.00 54.97 54.37 1ize s GLU 103 Cb -0.15 -3.98 0.00 0.00 0.10 0.00 0.00 34.13 30.10 1ize s GLU 103 CO 0.02 -1.11 0.98 0.45 0.02 0.00 0.00 175.26 175.62 1ize s SER 104 N 2.21 7.07 -0.02 -0.19 0.15 -0.27 -1.26 113.70 121.40 1ize s SER 104 Ca 0.23 1.33 -0.30 0.00 0.70 0.00 0.00 55.95 57.91 1ize s SER 104 Cb -0.14 -2.52 -0.04 0.00 -1.71 0.00 0.00 66.02 61.61 1ize s SER 104 CO 0.19 -0.58 1.11 0.00 1.20 0.00 0.00 173.24 175.16 1ize s ALA 105 N 2.83 3.37 -0.06 5.45 0.00 -0.87 -1.95 121.76 130.53 1ize s ALA 105 Ca 0.43 0.62 0.16 0.00 0.00 0.00 0.00 51.96 53.17 1ize s ALA 105 Cb -0.16 -3.44 -0.24 0.00 0.00 0.00 0.00 23.12 19.29 1ize s ALA 105 CO 0.09 -0.51 0.28 0.39 0.00 0.00 0.00 175.76 176.01 1ize n GLU 106 N 4.48 0.77 -3.83 0.00 1.02 0.11 -2.67 120.64 120.52 1ize n GLU 106 Ca 0.09 -0.11 -0.13 0.00 -0.02 0.00 0.00 57.16 56.99 1ize n GLU 106 Cb 0.48 -1.39 -0.14 0.00 -0.02 0.00 0.00 31.44 30.37 1ize n GLU 106 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1ize s LYS 107 N -2.93 0.07 -0.07 3.49 1.02 -0.80 -4.27 119.74 116.25 1ize s LYS 107 Ca -0.06 0.13 -0.06 0.00 0.02 0.00 0.00 55.97 55.99 1ize s LYS 107 Cb 0.09 -0.00 0.02 0.00 -0.52 0.00 0.00 37.83 37.42 1ize s LYS 107 CO 0.66 -0.03 0.18 0.54 -0.92 0.00 0.00 175.35 175.78 1ize s VAL 108 N 0.21 -0.01 0.77 3.17 0.11 -1.26 -1.83 120.40 121.57 1ize s VAL 108 Ca -0.01 0.03 -0.12 0.00 -2.93 0.00 0.00 61.98 58.95 1ize s VAL 108 Cb -0.02 -0.26 0.06 0.00 -1.53 0.00 0.00 36.38 34.62 1ize s VAL 108 CO -0.01 0.01 1.13 -0.94 -3.33 0.00 0.00 175.10 171.97 1ize s SER 109 N 0.29 4.82 0.43 3.54 1.04 -0.63 -4.89 113.70 118.29 1ize s SER 109 Ca -0.02 1.01 0.13 0.00 0.48 0.00 0.00 55.95 57.55 1ize s SER 109 Cb -0.03 -1.67 1.00 0.00 0.10 0.00 0.00 66.02 65.42 1ize s SER 109 CO -0.01 -1.73 1.99 0.77 0.98 0.00 0.00 173.24 175.23 1ize h SER 110 N -0.93 0.39 -0.79 7.02 4.64 -1.99 -2.66 113.55 119.23 1ize h SER 110 Ca -0.46 0.01 0.10 0.00 -0.47 0.00 0.00 61.79 60.97 1ize h SER 110 Cb 1.29 -0.08 -0.05 0.00 -0.31 0.00 0.00 62.40 63.25 1ize h SER 110 CO 0.64 0.24 0.52 -0.08 -0.87 0.00 0.00 176.83 177.27 1ize h GLU 111 N 0.44 0.66 0.16 4.77 4.81 -1.96 -2.56 114.58 120.90 1ize h GLU 111 Ca 0.27 -0.04 -0.33 0.00 -0.13 0.00 0.00 59.36 59.13 1ize h GLU 111 Cb 0.48 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1ize h GLU 111 CO -0.07 0.44 -1.62 0.74 -0.73 0.00 0.00 179.01 177.76 1ize h PHE 112 N 0.68 0.62 0.00 0.92 0.04 -1.86 -3.37 116.94 113.98 1ize h PHE 112 Ca 0.37 -0.45 -0.07 0.00 2.80 0.00 0.00 57.97 60.62 1ize h PHE 112 Cb 0.51 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.62 1ize h PHE 112 CO -0.00 1.53 -0.34 1.79 -0.60 0.00 0.00 178.31 180.69 1ize h THR 113 N 0.09 1.07 -0.12 -1.55 1.35 -1.39 -3.17 112.91 109.19 1ize h THR 113 Ca -0.29 -1.23 -0.20 0.00 -0.55 0.00 0.00 66.41 64.14 1ize h THR 113 Cb 2.07 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 70.19 1ize h THR 113 CO 0.18 0.33 -0.74 1.56 -0.25 0.00 0.00 175.52 176.60 1ize h GLN 114 N 0.00 0.60 -5.63 4.72 1.08 -1.63 -3.40 115.11 110.86 1ize h GLN 114 Ca -0.00 -0.49 -0.63 0.00 -1.45 0.00 0.00 58.65 56.08 1ize h GLN 114 Cb 0.67 0.10 -0.13 0.00 -0.05 0.00 0.00 27.48 28.07 1ize h GLN 114 CO 0.04 1.11 1.07 0.34 -0.95 0.00 0.00 178.83 180.45 1ize s ASP 115 N -7.03 6.47 0.61 1.46 2.15 -1.20 -4.88 116.67 114.25 1ize s ASP 115 Ca -0.08 -1.52 0.35 0.00 0.43 0.00 0.00 52.55 51.74 1ize s ASP 115 Cb 0.10 -2.48 1.93 0.00 -0.30 0.00 0.00 42.92 42.16 1ize s ASP 115 CO 0.87 -1.36 2.08 0.71 -0.17 0.00 0.00 175.17 177.30 1ize h THR 116 N 6.25 0.00 0.00 1.71 1.35 -1.82 -1.90 112.91 118.49 1ize h THR 116 Ca 0.07 0.00 -0.10 0.00 -0.55 0.00 0.00 66.41 65.83 1ize h THR 116 Cb 1.03 0.79 -0.01 0.00 -1.73 0.00 0.00 68.15 68.22 1ize h THR 116 CO 1.26 0.00 -0.46 0.00 -0.25 0.00 0.00 175.52 176.07 1ize h ALA 117 N 1.73 0.74 -2.25 6.62 0.00 -1.89 -3.42 119.26 120.79 1ize h ALA 117 Ca 0.00 -0.42 -0.62 0.00 0.00 0.00 0.00 54.91 53.87 1ize h ALA 117 Cb 0.25 -0.07 -0.12 0.00 0.00 0.00 0.00 17.79 17.85 1ize h ALA 117 CO 0.00 0.57 0.25 1.21 0.00 0.00 0.00 179.25 181.29 1ize s ASN 118 N -6.43 6.49 -0.14 0.00 3.84 -0.72 -4.55 114.94 113.44 1ize s ASN 118 Ca 0.03 0.26 0.15 0.00 0.21 0.00 0.00 52.86 53.52 1ize s ASN 118 Cb 0.08 -2.36 0.50 0.00 -0.55 0.00 0.00 41.25 38.92 1ize s ASN 118 CO 0.73 -0.65 1.41 0.47 -2.79 0.00 0.00 177.10 176.26 1ize n ASP 119 N 6.21 3.78 0.00 -4.21 8.00 0.26 -4.94 116.55 125.66 1ize n ASP 119 Ca 0.01 -2.76 0.00 0.00 0.71 0.00 0.00 54.79 52.75 1ize n ASP 119 Cb 0.48 -0.48 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1ize n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ize n GLY 120 N -0.16 1.00 3.30 0.44 0.00 -1.25 -1.54 105.19 106.97 1ize n GLY 120 Ca 0.19 -1.97 -0.22 0.00 0.00 0.00 0.00 46.02 44.03 1ize n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ize s LEU 121 N 0.00 2.38 -0.25 0.99 1.02 -0.47 -1.09 118.68 121.26 1ize s LEU 121 Ca 0.00 -0.79 0.02 0.00 0.02 0.00 0.00 54.13 53.38 1ize s LEU 121 Cb 0.00 -0.79 0.06 0.00 0.02 0.00 0.00 46.19 45.48 1ize s LEU 121 CO 0.00 -0.02 -0.07 -0.22 0.02 0.00 0.00 176.35 176.05 1ize s LEU 122 N -2.35 3.05 0.10 1.79 0.20 -0.79 -1.37 118.68 119.31 1ize s LEU 122 Ca 0.11 -1.32 -0.30 0.00 0.69 0.00 0.00 54.13 53.31 1ize s LEU 122 Cb -0.07 -1.36 -0.06 0.00 -0.43 0.00 0.00 46.19 44.26 1ize s LEU 122 CO 0.05 -0.22 1.13 -0.83 -0.29 0.00 0.00 176.35 176.19 1ize s GLY 123 N 1.24 2.65 -0.04 7.98 0.00 -1.06 -1.30 107.32 116.80 1ize s GLY 123 Ca -0.07 0.79 0.05 0.00 0.00 0.00 0.00 44.72 45.50 1ize s GLY 123 CO -0.06 1.84 1.01 1.04 0.00 0.00 0.00 173.10 176.93 1ize n LEU 124 N 3.32 1.92 0.00 0.66 4.77 0.03 -4.45 117.00 123.24 1ize n LEU 124 Ca 0.06 -2.15 -0.15 0.00 -0.03 0.00 0.00 56.01 53.74 1ize n LEU 124 Cb 0.47 -0.12 0.10 0.00 -2.33 0.00 0.00 43.42 41.54 1ize n LEU 124 CO 0.54 0.52 0.44 0.00 -1.33 0.00 0.00 177.39 177.57 1ize n ALA 125 N -0.72 -0.69 -1.83 -1.18 0.00 -0.06 -4.75 120.51 111.28 1ize n ALA 125 Ca 0.05 -0.93 -0.40 0.00 0.00 0.00 0.00 53.44 52.16 1ize n ALA 125 Cb 0.39 -0.02 -0.05 0.00 0.00 0.00 0.00 19.45 19.77 1ize n ALA 125 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1ize s PHE 126 N -2.40 3.75 0.20 0.00 0.40 -0.48 -4.72 117.98 114.72 1ize s PHE 126 Ca 0.39 1.78 0.21 0.00 -0.60 0.00 0.00 56.93 58.70 1ize s PHE 126 Cb -0.01 -3.15 1.14 0.00 0.51 0.00 0.00 43.02 41.50 1ize s PHE 126 CO 0.27 -0.13 1.59 0.77 0.70 0.00 0.00 175.22 178.42 1ize h SER 127 N 4.22 0.00 0.00 1.36 0.02 -1.90 -2.45 113.55 114.81 1ize h SER 127 Ca -0.46 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 1ize h SER 127 Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1ize h SER 127 CO 0.68 0.00 0.04 0.77 -1.14 0.00 0.00 176.83 177.18 1ize h SER 128 N 0.00 0.00 -0.37 3.07 4.64 -1.90 -1.91 113.55 117.08 1ize h SER 128 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ize h SER 128 Cb 0.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1ize h SER 128 CO 0.00 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.26 1ize n ILE 129 N -2.94 1.49 -1.85 0.95 -5.35 -0.92 -4.99 119.36 105.74 1ize n ILE 129 Ca -0.03 -1.29 -0.40 0.00 -0.27 0.00 0.00 62.75 60.76 1ize n ILE 129 Cb 0.10 0.23 0.01 0.00 -1.74 0.00 0.00 39.64 38.23 1ize n ILE 129 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1ize s ASN 130 N -1.27 6.15 0.00 7.28 3.84 -0.72 -4.67 114.94 125.55 1ize s ASN 130 Ca 0.33 2.92 0.22 0.00 0.21 0.00 0.00 52.86 56.54 1ize s ASN 130 Cb 0.22 -2.66 0.54 0.00 -0.55 0.00 0.00 41.25 38.80 1ize s ASN 130 CO 0.15 -0.99 1.45 0.35 -2.79 0.00 0.00 177.10 175.27 1ize n THR 131 N 0.14 0.40 -1.99 -5.21 -2.24 -1.26 -4.79 114.28 99.32 1ize n THR 131 Ca 0.03 -0.59 -0.41 0.00 -2.27 0.00 0.00 64.05 60.81 1ize n THR 131 Cb 0.41 0.71 -0.02 0.00 -2.10 0.00 0.00 70.33 69.33 1ize n THR 131 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1ize s VAL 132 N -1.60 2.49 0.12 2.28 1.01 -1.26 -4.38 120.40 119.06 1ize s VAL 132 Ca 0.36 0.48 0.07 0.00 0.00 0.00 0.00 61.98 62.88 1ize s VAL 132 Cb 0.20 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 1ize s VAL 132 CO 0.29 0.10 -0.17 -1.10 0.00 0.00 0.00 175.10 174.23 1ize s GLN 133 N -1.54 1.07 0.43 2.72 -0.21 0.30 -2.91 119.66 119.52 1ize s GLN 133 Ca 0.53 -1.21 0.26 0.00 0.02 0.00 0.00 55.36 54.96 1ize s GLN 133 Cb -0.42 -1.11 0.73 0.00 1.00 0.00 0.00 33.01 33.20 1ize s GLN 133 CO 0.54 0.23 1.74 -1.00 -2.12 0.00 0.00 175.29 174.68 1ize h PRO 134 N 3.72 0.00 -5.13 2.91 0.13 -1.86 -1.19 132.00 130.59 1ize h PRO 134 Ca -0.42 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.06 1ize h PRO 134 Cb 1.19 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.08 1ize h PRO 134 CO 0.46 0.00 -0.68 0.99 -0.23 0.00 0.00 178.00 178.54 1ize s THR 135 N -3.33 3.74 0.43 1.56 2.01 -1.26 -5.10 115.64 113.69 1ize s THR 135 Ca 0.06 -0.39 -0.25 0.00 0.31 0.00 0.00 61.69 61.42 1ize s THR 135 Cb 0.07 -2.68 -0.08 0.00 0.01 0.00 0.00 72.50 69.83 1ize s THR 135 CO 0.61 0.44 1.25 -2.84 -0.69 0.00 0.00 174.62 173.39 1ize s PRO 136 N 0.99 3.86 0.35 4.92 0.02 -1.14 -4.69 135.00 139.30 1ize s PRO 136 Ca 0.01 2.02 0.07 0.00 0.02 0.00 0.00 61.00 63.12 1ize s PRO 136 Cb -0.14 -2.62 -0.02 0.00 0.02 0.00 0.00 34.50 31.74 1ize s PRO 136 CO 0.01 -0.54 0.36 -0.65 -0.33 0.00 0.00 177.00 175.85 1ize s GLN 137 N -2.41 2.82 0.15 5.54 -1.52 -1.26 -4.99 119.66 117.98 1ize s GLN 137 Ca 0.60 -1.24 -0.04 0.00 -1.95 0.00 0.00 55.36 52.73 1ize s GLN 137 Cb -0.35 -2.57 -0.05 0.00 -0.22 0.00 0.00 33.01 29.82 1ize s GLN 137 CO 0.44 0.04 0.37 0.15 -0.25 0.00 0.00 175.29 176.04 1ize s LYS 138 N -4.07 3.60 0.82 2.91 1.02 -1.26 -4.70 119.74 118.06 1ize s LYS 138 Ca 0.43 -0.12 -0.11 0.00 0.02 0.00 0.00 55.97 56.19 1ize s LYS 138 Cb -0.07 -2.85 0.08 0.00 -0.52 0.00 0.00 37.83 34.48 1ize s LYS 138 CO 0.28 0.46 1.09 0.95 -0.92 0.00 0.00 175.35 177.21 1ize s THR 139 N -1.68 3.06 0.24 2.17 -4.23 -1.26 -4.67 115.64 109.26 1ize s THR 139 Ca 0.41 0.34 -0.06 0.00 -1.18 0.00 0.00 61.69 61.20 1ize s THR 139 Cb -0.12 -2.92 0.20 0.00 1.34 0.00 0.00 72.50 71.00 1ize s THR 139 CO 0.25 -0.45 1.84 0.15 -0.54 0.00 0.00 174.62 175.87 1ize h PHE 140 N -1.25 0.91 -0.34 3.99 3.57 -1.94 -2.08 116.94 119.80 1ize h PHE 140 Ca -0.47 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.05 1ize h PHE 140 Cb 1.26 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.69 1ize h PHE 140 CO 0.49 0.45 0.16 0.35 -2.23 0.00 0.00 178.31 177.53 1ize h PHE 141 N 0.89 0.49 -0.11 0.41 3.57 -1.92 -2.39 116.94 117.88 1ize h PHE 141 Ca 0.36 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.80 1ize h PHE 141 Cb 0.19 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 1ize h PHE 141 CO -0.04 0.43 -0.08 -0.44 -2.23 0.00 0.00 178.31 175.95 1ize h ASP 142 N 0.41 0.14 0.55 0.41 3.32 -1.83 0.16 116.42 119.59 1ize h ASP 142 Ca 0.12 -0.02 -0.16 0.00 0.02 0.00 0.00 57.03 56.99 1ize h ASP 142 Cb 0.13 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1ize h ASP 142 CO -0.01 0.25 -0.70 0.78 -1.72 0.00 0.00 179.24 177.84 1ize h ASN 143 N 0.15 0.15 0.00 6.45 -0.26 -1.05 -3.36 115.58 117.66 1ize h ASN 143 Ca 0.03 -0.10 0.00 0.00 -0.56 0.00 0.00 56.30 55.68 1ize h ASN 143 Cb 0.24 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.46 1ize h ASN 143 CO 0.01 0.80 -1.59 1.33 -1.06 0.00 0.00 177.43 176.92 1ize n VAL 144 N -3.76 0.00 -0.29 2.81 0.24 -0.93 -4.64 118.33 111.76 1ize n VAL 144 Ca -0.02 -0.34 0.26 0.00 -2.04 0.00 0.00 64.34 62.20 1ize n VAL 144 Cb 0.68 0.29 0.59 0.00 -1.47 0.00 0.00 33.84 33.93 1ize n VAL 144 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 1ize h LYS 145 N 0.00 0.25 0.00 7.34 2.10 -1.12 0.15 116.57 125.29 1ize h LYS 145 Ca 0.00 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.63 1ize h LYS 145 Cb 0.72 -0.06 -0.00 0.00 -0.90 0.00 0.00 32.23 31.99 1ize h LYS 145 CO 0.00 0.16 -0.04 0.66 -2.00 0.00 0.00 179.45 178.23 1ize h SER 146 N 0.25 0.00 0.13 7.07 4.64 -1.82 -2.65 113.55 121.17 1ize h SER 146 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 1ize h SER 146 Cb 1.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.75 1ize h SER 146 CO -0.18 0.04 -0.45 -1.54 -0.87 0.00 0.00 176.83 173.84 1ize n SER 147 N -3.16 1.39 -4.87 4.97 3.41 0.51 -4.94 113.62 110.94 1ize n SER 147 Ca 0.00 -1.11 -0.31 0.00 -0.26 0.00 0.00 58.87 57.20 1ize n SER 147 Cb 0.32 0.38 -0.03 0.00 -0.26 0.00 0.00 64.21 64.61 1ize n SER 147 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ize s LEU 148 N -2.59 3.76 0.25 1.04 1.43 -1.00 -4.51 118.68 117.07 1ize s LEU 148 Ca 0.19 1.27 -0.04 0.00 -1.03 0.00 0.00 54.13 54.52 1ize s LEU 148 Cb 0.18 -4.17 0.39 0.00 0.03 0.00 0.00 46.19 42.63 1ize s LEU 148 CO 0.59 -0.46 1.85 -1.28 0.23 0.00 0.00 176.35 177.28 1ize h SER 149 N 1.14 0.86 -3.96 2.29 0.87 -1.22 -3.41 113.55 110.10 1ize h SER 149 Ca -0.47 0.03 -0.28 0.00 -1.23 0.00 0.00 61.79 59.84 1ize h SER 149 Cb 1.19 -0.15 -0.27 0.00 -0.44 0.00 0.00 62.40 62.72 1ize h SER 149 CO 0.63 0.52 -0.74 -1.61 -0.53 0.00 0.00 176.83 175.11 1ize s GLU 150 N -6.04 0.26 -1.26 2.24 2.02 -1.10 -5.06 118.70 109.76 1ize s GLU 150 Ca -0.12 -0.18 -0.13 0.00 0.02 0.00 0.00 54.97 54.56 1ize s GLU 150 Cb 0.19 -0.21 -0.05 0.00 0.10 0.00 0.00 34.13 34.15 1ize s GLU 150 CO 0.80 0.06 2.35 -0.35 0.02 0.00 0.00 175.26 178.13 1ize n PRO 151 N 2.81 2.67 -3.88 0.39 -0.04 -1.26 -4.02 135.00 131.67 1ize n PRO 151 Ca -0.14 -2.10 -0.09 0.00 -0.04 0.00 0.00 63.50 61.13 1ize n PRO 151 Cb 0.58 -2.91 -0.07 0.00 -0.04 0.00 0.00 33.50 31.07 1ize n PRO 151 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1ize s ILE 152 N 3.31 0.09 -0.03 0.52 -4.36 -1.26 -1.82 121.20 117.66 1ize s ILE 152 Ca 0.54 -1.21 -0.05 0.00 -0.26 0.00 0.00 60.65 59.67 1ize s ILE 152 Cb 0.14 -1.58 0.01 0.00 1.25 0.00 0.00 42.46 42.28 1ize s ILE 152 CO -0.03 -0.43 0.11 0.72 0.24 0.00 0.00 174.94 175.55 1ize s PHE 153 N -3.91 -0.06 0.16 1.37 -0.71 -0.96 -0.62 117.98 113.25 1ize s PHE 153 Ca 0.11 0.15 0.07 0.00 -1.04 0.00 0.00 56.93 56.22 1ize s PHE 153 Cb 0.04 0.00 -0.04 0.00 -1.21 0.00 0.00 43.02 41.81 1ize s PHE 153 CO -0.05 -0.12 -0.16 0.00 -1.34 0.00 0.00 175.22 173.54 1ize s ALA 154 N -0.39 1.83 0.00 1.99 0.00 0.28 -0.49 121.76 124.98 1ize s ALA 154 Ca -0.05 -1.46 0.02 0.00 0.00 0.00 0.00 51.96 50.48 1ize s ALA 154 Cb -0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 1ize s ALA 154 CO 0.00 0.16 -0.06 0.54 0.00 0.00 0.00 175.76 176.40 1ize s VAL 155 N -2.26 0.46 -0.46 0.00 0.11 -0.17 -0.11 120.40 117.98 1ize s VAL 155 Ca 0.15 -0.40 0.03 0.00 -2.93 0.00 0.00 61.98 58.83 1ize s VAL 155 Cb -0.04 -0.42 0.15 0.00 -1.53 0.00 0.00 36.38 34.53 1ize s VAL 155 CO 0.05 0.03 0.29 0.00 -3.33 0.00 0.00 175.10 172.15 1ize s ALA 156 N -0.36 2.03 0.27 1.54 0.00 -0.11 -1.80 121.76 123.32 1ize s ALA 156 Ca -0.00 -2.63 -0.26 0.00 0.00 0.00 0.00 51.96 49.07 1ize s ALA 156 Cb -0.04 -1.82 -0.09 0.00 0.00 0.00 0.00 23.12 21.18 1ize s ALA 156 CO -0.00 -2.05 0.89 -0.51 0.00 0.00 0.00 175.76 174.08 1ize s LEU 157 N 0.14 4.46 0.21 0.00 1.43 -1.26 -1.77 118.68 121.88 1ize s LEU 157 Ca 0.22 1.78 0.10 0.00 -1.03 0.00 0.00 54.13 55.21 1ize s LEU 157 Cb -0.15 -3.75 -0.05 0.00 0.03 0.00 0.00 46.19 42.27 1ize s LEU 157 CO -0.07 0.04 -0.20 -0.54 0.23 0.00 0.00 176.35 175.82 1ize s LYS 158 N -1.69 1.47 -0.30 1.70 -0.14 -1.26 -4.36 119.74 115.15 1ize s LYS 158 Ca 0.45 -1.58 -0.26 0.00 -1.36 0.00 0.00 55.97 53.22 1ize s LYS 158 Cb -0.21 -1.56 0.01 0.00 -1.68 0.00 0.00 37.83 34.39 1ize s LYS 158 CO 0.26 0.31 0.92 -1.58 -0.76 0.00 0.00 175.35 174.50 1ize s HIS 159 N -2.24 3.20 -1.57 3.18 5.65 -1.26 -4.09 115.29 118.14 1ize s HIS 159 Ca 0.22 1.03 -0.10 0.00 0.25 0.00 0.00 55.06 56.46 1ize s HIS 159 Cb -0.05 -3.40 0.09 0.00 -1.18 0.00 0.00 32.58 28.03 1ize s HIS 159 CO 0.10 -0.63 0.63 -1.71 -0.65 0.00 0.00 174.74 172.47 1ize n ASN 160 N 6.47 -2.08 -3.45 9.88 5.15 -1.26 -4.94 115.26 125.03 1ize n ASN 160 Ca 0.08 -1.01 -0.11 0.00 -0.60 0.00 0.00 54.58 52.94 1ize n ASN 160 Cb 0.47 -2.89 -0.02 0.00 -0.53 0.00 0.00 39.78 36.81 1ize n ASN 160 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ize s ALA 161 N -3.59 -1.69 0.35 5.20 0.00 -1.26 -5.07 121.76 115.70 1ize s ALA 161 Ca 0.42 0.71 -0.28 0.00 0.00 0.00 0.00 51.96 52.81 1ize s ALA 161 Cb -0.23 0.69 -0.10 0.00 0.00 0.00 0.00 23.12 23.47 1ize s ALA 161 CO 0.91 -0.73 1.37 -2.14 0.00 0.00 0.00 175.76 175.17 1ize s PRO 162 N -3.46 4.25 0.00 0.00 0.02 -1.26 -4.36 135.00 130.19 1ize s PRO 162 Ca 0.02 2.35 0.00 0.00 0.02 0.00 0.00 61.00 63.39 1ize s PRO 162 Cb -0.01 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.49 1ize s PRO 162 CO -0.11 -0.33 0.00 0.41 -0.33 0.00 0.00 177.00 176.64 1ize n GLY 163 N 0.66 5.30 3.23 0.52 0.00 -0.07 -4.73 105.19 110.11 1ize n GLY 163 Ca 0.00 -1.92 -0.11 0.00 0.00 0.00 0.00 46.02 43.99 1ize n GLY 163 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ize s VAL 164 N -0.67 0.10 -0.14 1.61 0.11 -0.73 -2.12 120.40 118.55 1ize s VAL 164 Ca 0.00 -0.80 0.02 0.00 -2.93 0.00 0.00 61.98 58.26 1ize s VAL 164 Cb 0.00 -1.02 0.01 0.00 -1.53 0.00 0.00 36.38 33.84 1ize s VAL 164 CO 0.00 -0.44 -0.19 -0.31 -3.33 0.00 0.00 175.10 170.83 1ize s TYR 165 N -2.89 2.43 -0.12 1.54 2.02 -0.64 -0.94 117.35 118.75 1ize s TYR 165 Ca -0.03 -1.27 -0.03 0.00 -0.37 0.00 0.00 57.07 55.38 1ize s TYR 165 Cb 0.00 -1.70 -0.03 0.00 -0.40 0.00 0.00 41.96 39.84 1ize s TYR 165 CO -0.06 -0.62 -0.01 -0.51 -1.57 0.00 0.00 175.55 172.79 1ize s ASP 166 N 1.04 5.13 -0.14 2.29 1.01 0.85 -1.73 116.67 125.11 1ize s ASP 166 Ca -0.03 0.05 0.02 0.00 0.71 0.00 0.00 52.55 53.30 1ize s ASP 166 Cb -0.15 -1.61 0.01 0.00 1.01 0.00 0.00 42.92 42.18 1ize s ASP 166 CO -0.05 0.29 -0.21 -0.36 0.21 0.00 0.00 175.17 175.05 1ize s PHE 167 N -0.35 2.68 0.00 4.23 0.40 0.14 -0.56 117.98 124.52 1ize s PHE 167 Ca 0.07 -1.33 0.00 0.00 -0.60 0.00 0.00 56.93 55.06 1ize s PHE 167 Cb -0.12 -1.82 0.00 0.00 0.51 0.00 0.00 43.02 41.58 1ize s PHE 167 CO 0.02 -0.61 0.00 0.41 0.70 0.00 0.00 175.22 175.74 1ize n GLY 168 N 4.08 1.08 3.70 4.36 0.00 0.21 -1.30 105.19 117.33 1ize n GLY 168 Ca -0.20 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.78 1ize n GLY 168 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ize s TYR 169 N -3.09 -0.16 -0.10 1.61 1.13 -1.26 -2.72 117.35 112.75 1ize s TYR 169 Ca 0.00 -0.10 -0.00 0.00 -1.41 0.00 0.00 57.07 55.56 1ize s TYR 169 Cb 0.00 0.62 -0.02 0.00 -1.10 0.00 0.00 41.96 41.45 1ize s TYR 169 CO 0.00 -0.74 -0.09 0.95 -2.51 0.00 0.00 175.55 173.16 1ize s THR 170 N -3.20 3.50 -0.54 -3.49 -4.23 -1.26 -4.60 115.64 101.81 1ize s THR 170 Ca 0.11 -0.53 -0.18 0.00 -1.18 0.00 0.00 61.69 59.91 1ize s THR 170 Cb -0.01 -2.46 0.09 0.00 1.34 0.00 0.00 72.50 71.45 1ize s THR 170 CO -0.00 0.55 0.63 -0.62 -0.54 0.00 0.00 174.62 174.64 1ize s ASP 171 N -0.22 6.20 0.20 3.99 -1.08 -1.26 -4.94 116.67 119.56 1ize s ASP 171 Ca 0.02 -1.25 0.13 0.00 -0.52 0.00 0.00 52.55 50.93 1ize s ASP 171 Cb -0.13 -2.28 0.68 0.00 -1.46 0.00 0.00 42.92 39.73 1ize s ASP 171 CO 0.03 -0.97 1.37 -1.54 0.52 0.00 0.00 175.17 174.57 1ize n SER 172 N 6.09 0.33 -0.37 -0.34 3.41 -1.26 -0.76 113.62 120.72 1ize n SER 172 Ca -0.09 0.64 0.14 0.00 -0.26 0.00 0.00 58.87 59.29 1ize n SER 172 Cb 0.43 -0.67 0.48 0.00 -0.26 0.00 0.00 64.21 64.20 1ize n SER 172 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ize n SER 173 N -1.94 1.25 -0.24 4.04 3.41 -1.26 -3.82 113.62 115.06 1ize n SER 173 Ca -0.01 -1.22 0.10 0.00 -0.26 0.00 0.00 58.87 57.48 1ize n SER 173 Cb 0.05 0.05 -0.06 0.00 -0.26 0.00 0.00 64.21 63.99 1ize n SER 173 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ize n LYS 174 N -0.20 0.98 -3.91 4.33 4.76 0.06 -4.76 118.16 119.41 1ize n LYS 174 Ca 0.16 -0.49 -0.09 0.00 -2.87 0.00 0.00 58.31 55.03 1ize n LYS 174 Cb 0.34 -1.42 -0.08 0.00 -1.84 0.00 0.00 35.03 32.04 1ize n LYS 174 CO 0.00 0.00 0.00 1.52 -1.37 0.00 0.00 177.40 177.55 1ize s TYR 175 N -2.56 0.25 0.19 2.13 1.13 -1.25 -1.49 117.35 115.75 1ize s TYR 175 Ca 0.12 -0.69 0.10 0.00 -1.41 0.00 0.00 57.07 55.19 1ize s TYR 175 Cb 0.16 -0.12 -0.04 0.00 -1.10 0.00 0.00 41.96 40.86 1ize s TYR 175 CO 0.66 -0.54 -0.14 0.95 -2.51 0.00 0.00 175.55 173.97 1ize s THR 176 N -3.89 2.93 0.00 -3.49 -4.23 -0.48 -4.63 115.64 101.85 1ize s THR 176 Ca 0.07 -1.80 0.00 0.00 -1.18 0.00 0.00 61.69 58.78 1ize s THR 176 Cb 0.05 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.44 1ize s THR 176 CO -0.09 -0.13 0.00 0.61 -0.54 0.00 0.00 174.62 174.47 1ize n GLY 177 N 0.06 -0.38 3.65 3.99 0.00 -1.26 -4.01 105.19 107.24 1ize n GLY 177 Ca -0.11 -1.07 -0.24 0.00 0.00 0.00 0.00 46.02 44.60 1ize n GLY 177 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ize s SER 178 N -4.00 4.33 -0.04 1.61 1.04 -1.26 -5.04 113.70 110.34 1ize s SER 178 Ca 0.00 -0.90 -0.22 0.00 0.48 0.00 0.00 55.95 55.31 1ize s SER 178 Cb 0.00 -0.61 -0.04 0.00 0.10 0.00 0.00 66.02 65.47 1ize s SER 178 CO 0.00 -0.22 0.64 -0.63 0.98 0.00 0.00 173.24 174.01 1ize s ILE 179 N -2.47 4.98 -0.19 -1.02 1.01 -1.26 -4.67 121.20 117.58 1ize s ILE 179 Ca 0.35 1.34 -0.05 0.00 0.00 0.00 0.00 60.65 62.28 1ize s ILE 179 Cb -0.01 -3.98 -0.03 0.00 0.01 0.00 0.00 42.46 38.44 1ize s ILE 179 CO 0.20 0.33 0.01 -0.89 0.00 0.00 0.00 174.94 174.59 1ize s THR 180 N 0.35 4.14 0.17 2.92 2.01 -0.43 -4.88 115.64 119.91 1ize s THR 180 Ca 0.34 -0.26 0.04 0.00 0.31 0.00 0.00 61.69 62.12 1ize s THR 180 Cb -0.18 -2.86 -0.04 0.00 0.01 0.00 0.00 72.50 69.44 1ize s THR 180 CO 0.17 0.44 0.23 -0.31 -0.69 0.00 0.00 174.62 174.47 1ize s TYR 181 N 0.76 3.35 -0.00 4.92 2.02 -1.26 -0.98 117.35 126.16 1ize s TYR 181 Ca 0.01 0.05 -0.06 0.00 -0.37 0.00 0.00 57.07 56.69 1ize s TYR 181 Cb -0.14 -1.59 0.00 0.00 -0.40 0.00 0.00 41.96 39.83 1ize s TYR 181 CO 0.02 0.51 0.12 -0.08 -1.57 0.00 0.00 175.55 174.55 1ize s THR 182 N -1.78 0.07 0.54 -0.71 -1.32 -0.29 -4.93 115.64 107.22 1ize s THR 182 Ca 0.33 -0.62 -0.21 0.00 -1.21 0.00 0.00 61.69 59.98 1ize s THR 182 Cb -0.10 -0.39 -0.05 0.00 -1.51 0.00 0.00 72.50 70.45 1ize s THR 182 CO 0.27 -0.34 1.23 -1.81 -2.21 0.00 0.00 174.62 171.76 1ize s ASP 183 N -1.19 5.54 -0.09 8.08 1.01 -1.26 -1.56 116.67 127.20 1ize s ASP 183 Ca -0.13 2.46 -0.00 0.00 0.71 0.00 0.00 52.55 55.59 1ize s ASP 183 Cb -0.07 -2.61 -0.03 0.00 1.01 0.00 0.00 42.92 41.22 1ize s ASP 183 CO 0.01 -1.36 -0.06 -0.69 0.21 0.00 0.00 175.17 173.28 1ize s VAL 184 N -1.50 3.75 -0.43 -1.27 1.01 -0.99 -4.61 120.40 116.35 1ize s VAL 184 Ca 0.71 -0.45 -0.09 0.00 0.00 0.00 0.00 61.98 62.15 1ize s VAL 184 Cb -0.32 -2.56 0.08 0.00 0.00 0.00 0.00 36.38 33.58 1ize s VAL 184 CO 0.37 0.58 0.28 -0.62 0.00 0.00 0.00 175.10 175.70 1ize s ASP 185 N -0.53 5.67 -0.31 3.32 2.15 0.78 -4.74 116.67 123.00 1ize s ASP 185 Ca 0.08 -1.55 0.10 0.00 0.43 0.00 0.00 52.55 51.61 1ize s ASP 185 Cb -0.12 -2.00 0.68 0.00 -0.30 0.00 0.00 42.92 41.18 1ize s ASP 185 CO 0.02 -0.56 1.72 -0.46 -0.17 0.00 0.00 175.17 175.72 1ize n ASN 186 N 4.93 4.28 0.26 -0.34 6.94 -1.26 -2.74 115.26 127.32 1ize n ASN 186 Ca -0.10 -3.31 0.10 0.00 -0.02 0.00 0.00 54.58 51.25 1ize n ASN 186 Cb 0.43 -0.71 0.67 0.00 -2.36 0.00 0.00 39.78 37.81 1ize n ASN 186 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 1ize h SER 187 N 2.16 0.00 -0.52 0.53 4.64 -1.92 -2.17 113.55 116.26 1ize h SER 187 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1ize h SER 187 Cb 2.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.27 1ize h SER 187 CO 0.66 0.10 0.00 0.00 -0.87 0.00 0.00 176.83 176.72 1ize n GLN 188 N -4.05 2.96 -0.37 4.77 1.13 -1.26 -4.95 117.38 115.61 1ize n GLN 188 Ca -0.02 -2.45 0.00 0.00 -1.94 0.00 0.00 57.00 52.59 1ize n GLN 188 Cb 0.19 -1.51 0.00 0.00 0.11 0.00 0.00 30.24 29.03 1ize n GLN 188 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ize n GLY 189 N 0.93 1.04 3.90 1.08 0.00 -0.82 -4.94 105.19 106.39 1ize n GLY 189 Ca 0.19 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.00 1ize n GLY 189 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ize s PHE 190 N -2.91 2.44 -1.23 1.61 0.08 -1.26 -1.38 117.98 115.34 1ize s PHE 190 Ca 0.00 -0.56 -0.11 0.00 0.12 0.00 0.00 56.93 56.38 1ize s PHE 190 Cb 0.00 -2.15 0.19 0.00 -0.57 0.00 0.00 43.02 40.49 1ize s PHE 190 CO 0.00 -0.28 1.62 0.91 -0.10 0.00 0.00 175.22 177.37 1ize n TRP 191 N -1.66 3.88 -3.11 0.36 7.02 -1.26 -4.03 117.44 118.64 1ize n TRP 191 Ca 0.04 -3.08 -0.36 0.00 -1.02 0.00 0.00 57.50 53.08 1ize n TRP 191 Cb 0.62 -1.98 -0.06 0.00 -2.42 0.00 0.00 31.31 27.47 1ize n TRP 191 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 1ize s GLY 192 N 1.49 2.57 0.30 6.99 0.00 -1.11 -1.83 107.32 115.73 1ize s GLY 192 Ca 0.40 0.14 -0.12 0.00 0.00 0.00 0.00 44.72 45.13 1ize s GLY 192 CO 0.01 0.47 0.56 -0.11 0.00 0.00 0.00 173.10 174.03 1ize s PHE 193 N -1.59 0.39 -0.08 1.90 -0.12 0.21 -0.16 117.98 118.52 1ize s PHE 193 Ca 0.45 -0.79 0.01 0.00 -0.05 0.00 0.00 56.93 56.55 1ize s PHE 193 Cb -0.16 0.32 0.02 0.00 -0.63 0.00 0.00 43.02 42.57 1ize s PHE 193 CO 0.20 -1.16 -0.10 0.99 -0.05 0.00 0.00 175.22 175.11 1ize s THR 194 N -3.52 1.05 0.12 -4.49 2.01 -1.26 -1.40 115.64 108.16 1ize s THR 194 Ca 0.21 -0.38 -0.17 0.00 0.31 0.00 0.00 61.69 61.65 1ize s THR 194 Cb -0.02 -1.01 -0.07 0.00 0.01 0.00 0.00 72.50 71.41 1ize s THR 194 CO 0.11 0.35 0.58 0.00 -0.69 0.00 0.00 174.62 174.98 1ize s ALA 195 N 1.06 3.56 -1.17 7.40 0.00 0.13 -4.93 121.76 127.82 1ize s ALA 195 Ca -0.07 -0.01 0.24 0.00 0.00 0.00 0.00 51.96 52.11 1ize s ALA 195 Cb -0.14 -2.62 1.09 0.00 0.00 0.00 0.00 23.12 21.45 1ize s ALA 195 CO -0.01 0.41 1.77 -0.25 0.00 0.00 0.00 175.76 177.69 1ize n ASP 196 N 1.22 0.00 0.00 0.00 10.43 0.99 -1.88 116.55 127.31 1ize n ASP 196 Ca -0.07 0.28 0.00 0.00 2.57 0.00 0.00 54.79 57.57 1ize n ASP 196 Cb 0.51 -0.42 0.00 0.00 1.84 0.00 0.00 41.12 43.06 1ize n ASP 196 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1ize n GLY 197 N 0.87 -1.71 3.48 0.44 0.00 -1.21 -4.45 105.19 102.61 1ize n GLY 197 Ca 0.08 -1.10 -0.10 0.00 0.00 0.00 0.00 46.02 44.91 1ize n GLY 197 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ize s TYR 198 N -2.31 -0.00 -0.02 1.61 1.13 -0.96 -0.55 117.35 116.24 1ize s TYR 198 Ca 0.00 -0.34 0.00 0.00 -1.41 0.00 0.00 57.07 55.32 1ize s TYR 198 Cb 0.00 0.29 0.02 0.00 -1.10 0.00 0.00 41.96 41.17 1ize s TYR 198 CO 0.00 -0.88 0.01 -1.12 -2.51 0.00 0.00 175.55 171.05 1ize s SER 199 N -2.89 0.21 -0.45 -0.18 0.01 0.06 0.54 113.70 111.00 1ize s SER 199 Ca 0.11 -0.00 -0.10 0.00 1.31 0.00 0.00 55.95 57.27 1ize s SER 199 Cb -0.00 -0.11 0.10 0.00 0.21 0.00 0.00 66.02 66.22 1ize s SER 199 CO -0.02 -0.08 0.31 -0.63 0.41 0.00 0.00 173.24 173.23 1ize s ILE 200 N 0.73 4.32 0.00 1.44 1.01 -0.21 -1.18 121.20 127.30 1ize s ILE 200 Ca -0.07 -1.54 0.00 0.00 0.00 0.00 0.00 60.65 59.04 1ize s ILE 200 Cb -0.10 -3.73 0.00 0.00 0.01 0.00 0.00 42.46 38.65 1ize s ILE 200 CO -0.02 -0.64 0.00 0.61 0.00 0.00 0.00 174.94 174.90 1ize n GLY 201 N 4.94 3.07 0.78 6.18 0.00 -0.05 -1.64 105.19 118.47 1ize n GLY 201 Ca -0.09 -0.20 0.09 0.00 0.00 0.00 0.00 46.02 45.82 1ize n GLY 201 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ize n SER 202 N 8.47 2.66 -4.52 1.61 7.64 -1.26 -4.85 113.62 123.38 1ize n SER 202 Ca 0.00 -1.80 -0.42 0.00 1.01 0.00 0.00 58.87 57.66 1ize n SER 202 Cb 0.00 -0.04 -0.03 0.00 -1.01 0.00 0.00 64.21 63.13 1ize n SER 202 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1ize s ASP 203 N -1.51 6.18 0.05 6.43 -0.00 -0.65 -5.00 116.67 122.17 1ize s ASP 203 Ca 0.24 -0.60 -0.10 0.00 -0.00 0.00 0.00 52.55 52.08 1ize s ASP 203 Cb 0.16 -2.51 -0.06 0.00 -0.00 0.00 0.00 42.92 40.52 1ize s ASP 203 CO 0.24 -1.66 0.37 -0.94 -0.00 0.00 0.00 175.17 173.18 1ize s SER 204 N 3.65 6.64 0.07 0.27 1.04 -1.26 -1.05 113.70 123.06 1ize s SER 204 Ca 0.31 0.78 0.09 0.00 0.48 0.00 0.00 55.95 57.61 1ize s SER 204 Cb -0.11 -2.18 -0.03 0.00 0.10 0.00 0.00 66.02 63.80 1ize s SER 204 CO 0.14 0.22 -0.24 -0.55 0.98 0.00 0.00 173.24 173.79 1ize s SER 205 N -1.60 2.85 0.00 7.02 0.15 0.19 -4.98 113.70 117.34 1ize s SER 205 Ca 0.30 -0.60 0.25 0.00 0.70 0.00 0.00 55.95 56.60 1ize s SER 205 Cb -0.14 -0.23 0.94 0.00 -1.71 0.00 0.00 66.02 64.88 1ize s SER 205 CO 0.16 0.18 1.67 -1.54 1.20 0.00 0.00 173.24 174.92 1ize n SER 206 N 1.57 1.54 -4.76 5.45 3.41 -1.26 -2.26 113.62 117.31 1ize n SER 206 Ca -0.17 -1.58 -0.41 0.00 -0.26 0.00 0.00 58.87 56.45 1ize n SER 206 Cb 0.53 -0.04 -0.02 0.00 -0.26 0.00 0.00 64.21 64.42 1ize n SER 206 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ize s ASP 207 N -1.82 6.55 0.33 4.04 2.15 -1.26 -4.64 116.67 122.01 1ize s ASP 207 Ca 0.36 2.83 -0.11 0.00 0.43 0.00 0.00 52.55 56.05 1ize s ASP 207 Cb 0.19 -2.64 -0.07 0.00 -0.30 0.00 0.00 42.92 40.10 1ize s ASP 207 CO 0.30 -0.75 0.68 -0.55 -0.17 0.00 0.00 175.17 174.69 1ize s SER 208 N 0.06 6.62 -0.07 -0.34 0.15 -1.26 -3.41 113.70 115.44 1ize s SER 208 Ca 0.56 1.08 0.00 0.00 0.70 0.00 0.00 55.95 58.29 1ize s SER 208 Cb -0.44 -2.29 0.02 0.00 -1.71 0.00 0.00 66.02 61.60 1ize s SER 208 CO 0.52 -0.24 -0.06 -0.63 1.20 0.00 0.00 173.24 174.03 1ize s ILE 209 N -2.09 0.73 -0.13 6.45 1.01 -0.79 -4.96 121.20 121.42 1ize s ILE 209 Ca 0.50 -0.17 -0.01 0.00 0.00 0.00 0.00 60.65 60.98 1ize s ILE 209 Cb -0.10 -0.77 -0.02 0.00 0.01 0.00 0.00 42.46 41.58 1ize s ILE 209 CO 0.24 0.29 -0.11 -0.89 0.00 0.00 0.00 174.94 174.48 1ize s THR 210 N 1.33 3.24 0.00 2.92 2.01 -1.26 0.19 115.64 124.07 1ize s THR 210 Ca -0.04 -0.59 0.00 0.00 0.31 0.00 0.00 61.69 61.37 1ize s THR 210 Cb -0.14 -2.37 0.00 0.00 0.01 0.00 0.00 72.50 70.00 1ize s THR 210 CO -0.03 0.52 0.00 0.61 -0.69 0.00 0.00 174.62 175.03 1ize n GLY 211 N 3.51 1.73 3.34 4.40 0.00 -0.49 -2.93 105.19 114.75 1ize n GLY 211 Ca -0.18 -0.81 -0.25 0.00 0.00 0.00 0.00 46.02 44.79 1ize n GLY 211 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ize s ILE 212 N -2.60 1.96 -0.40 -0.61 -4.36 -0.63 -0.62 121.20 113.93 1ize s ILE 212 Ca 0.00 -1.79 -0.21 0.00 -0.26 0.00 0.00 60.65 58.39 1ize s ILE 212 Cb 0.00 -1.83 0.01 0.00 1.25 0.00 0.00 42.46 41.90 1ize s ILE 212 CO 0.00 -0.12 0.66 0.00 0.24 0.00 0.00 174.94 175.72 1ize s ALA 213 N -1.51 3.39 -0.26 2.27 0.00 -0.76 -0.86 121.76 124.02 1ize s ALA 213 Ca 0.13 -1.02 -0.00 0.00 0.00 0.00 0.00 51.96 51.07 1ize s ALA 213 Cb -0.08 -3.27 0.08 0.00 0.00 0.00 0.00 23.12 19.84 1ize s ALA 213 CO 0.06 -1.61 0.02 0.34 0.00 0.00 0.00 175.76 174.57 1ize s ASP 214 N 1.93 3.81 0.59 0.00 2.15 -0.85 -4.64 116.67 119.65 1ize s ASP 214 Ca 0.25 -1.35 0.37 0.00 0.43 0.00 0.00 52.55 52.25 1ize s ASP 214 Cb -0.14 -1.01 1.74 0.00 -0.30 0.00 0.00 42.92 43.21 1ize s ASP 214 CO 0.18 -0.32 2.12 0.71 -0.17 0.00 0.00 175.17 177.68 1ize h THR 215 N 6.58 0.00 -0.11 1.71 1.35 -1.85 -2.73 112.91 117.86 1ize h THR 215 Ca -0.15 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 1ize h THR 215 Cb 1.06 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.80 1ize h THR 215 CO 0.43 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.31 1ize n GLY 216 N -0.36 -0.10 3.37 5.82 0.00 -1.26 -4.70 105.19 107.95 1ize n GLY 216 Ca -0.01 -0.33 -0.33 0.00 0.00 0.00 0.00 46.02 45.35 1ize n GLY 216 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ize s THR 217 N -1.86 2.97 0.02 2.61 2.01 -1.03 -5.04 115.64 115.32 1ize s THR 217 Ca 0.32 -0.70 -0.25 0.00 0.31 0.00 0.00 61.69 61.36 1ize s THR 217 Cb 0.16 -2.23 -0.17 0.00 0.01 0.00 0.00 72.50 70.27 1ize s THR 217 CO 0.26 0.54 1.36 0.74 -0.69 0.00 0.00 174.62 176.83 1ize h THR 218 N 5.26 0.91 -1.19 -0.82 2.02 -1.87 0.17 112.91 117.39 1ize h THR 218 Ca -0.28 -0.59 -0.49 0.00 0.77 0.00 0.00 66.41 65.82 1ize h THR 218 Cb 1.21 1.26 0.05 0.00 -1.74 0.00 0.00 68.15 68.93 1ize h THR 218 CO 0.54 0.13 0.01 -0.76 0.37 0.00 0.00 175.52 175.81 1ize s LEU 219 N -9.60 2.98 -0.38 2.58 1.43 -1.26 -1.87 118.68 112.55 1ize s LEU 219 Ca -0.15 -0.75 -0.10 0.00 -1.03 0.00 0.00 54.13 52.11 1ize s LEU 219 Cb 0.03 -1.57 0.04 0.00 0.03 0.00 0.00 46.19 44.72 1ize s LEU 219 CO 0.60 -1.66 0.21 -0.22 0.23 0.00 0.00 176.35 175.51 1ize s LEU 220 N -4.91 4.78 -0.27 1.79 2.96 -0.86 -2.05 118.68 120.12 1ize s LEU 220 Ca 0.65 -1.15 -0.08 0.00 -0.22 0.00 0.00 54.13 53.33 1ize s LEU 220 Cb -0.05 -1.99 -0.02 0.00 0.50 0.00 0.00 46.19 44.63 1ize s LEU 220 CO 0.42 -0.42 0.10 -0.76 -1.32 0.00 0.00 176.35 174.37 1ize s LEU 221 N 1.50 3.71 0.42 -0.68 1.43 -0.49 -2.01 118.68 122.57 1ize s LEU 221 Ca 0.02 -0.35 0.04 0.00 -1.03 0.00 0.00 54.13 52.81 1ize s LEU 221 Cb -0.20 -1.95 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 1ize s LEU 221 CO 0.05 -0.10 0.13 -0.76 0.23 0.00 0.00 176.35 175.90 1ize s LEU 222 N 1.61 2.00 0.52 1.79 1.43 -0.60 -1.16 118.68 124.27 1ize s LEU 222 Ca 0.05 -1.71 -0.23 0.00 -1.03 0.00 0.00 54.13 51.22 1ize s LEU 222 Cb -0.16 -0.11 -0.06 0.00 0.03 0.00 0.00 46.19 45.90 1ize s LEU 222 CO 0.05 -0.96 1.36 -1.81 0.23 0.00 0.00 176.35 175.21 1ize s ASP 223 N -3.64 5.48 0.40 2.29 -0.00 -1.26 -0.72 116.67 119.22 1ize s ASP 223 Ca 0.22 2.76 0.13 0.00 -0.00 0.00 0.00 52.55 55.66 1ize s ASP 223 Cb 0.02 -2.64 0.97 0.00 -0.00 0.00 0.00 42.92 41.27 1ize s ASP 223 CO 0.14 -1.43 1.91 0.44 -0.00 0.00 0.00 175.17 176.23 1ize h ASP 224 N 1.70 0.48 -0.51 0.27 3.32 -1.97 -0.75 116.42 118.96 1ize h ASP 224 Ca -0.51 0.03 -0.06 0.00 0.02 0.00 0.00 57.03 56.51 1ize h ASP 224 Cb 1.29 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 1ize h ASP 224 CO 0.58 0.25 0.10 0.77 -1.72 0.00 0.00 179.24 179.22 1ize h SER 225 N 0.51 0.84 -0.03 6.45 4.64 -1.99 0.14 113.55 124.11 1ize h SER 225 Ca 0.38 -0.17 -0.16 0.00 -0.47 0.00 0.00 61.79 61.37 1ize h SER 225 Cb 0.77 -0.22 0.01 0.00 -0.31 0.00 0.00 62.40 62.65 1ize h SER 225 CO -0.14 0.85 -0.62 0.40 -0.87 0.00 0.00 176.83 176.44 1ize h ILE 226 N 0.85 1.40 0.03 0.95 2.04 -1.61 -2.24 117.51 118.92 1ize h ILE 226 Ca 0.18 -2.04 0.01 0.00 1.00 0.00 0.00 64.86 64.01 1ize h ILE 226 Cb 0.37 2.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.91 1ize h ILE 226 CO 0.01 0.60 -0.08 0.58 0.00 0.00 0.00 178.15 179.26 1ize h VAL 227 N 0.00 0.80 -0.70 1.67 2.07 -1.01 0.06 116.25 119.14 1ize h VAL 227 Ca -0.07 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.48 1ize h VAL 227 Cb 1.31 0.80 -0.05 0.00 -1.52 0.00 0.00 31.29 31.84 1ize h VAL 227 CO 0.12 0.00 0.43 0.44 0.02 0.00 0.00 177.57 178.59 1ize h ASP 228 N -0.16 0.70 -0.58 0.57 3.45 -0.80 -1.93 116.42 117.69 1ize h ASP 228 Ca 0.02 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.46 1ize h ASP 228 Cb 0.18 -0.15 -0.03 0.00 -0.56 0.00 0.00 39.33 38.78 1ize h ASP 228 CO -0.06 0.48 0.27 0.00 -1.57 0.00 0.00 179.24 178.36 1ize h ALA 229 N 1.31 1.34 0.01 3.45 0.00 -0.98 -2.17 119.26 122.22 1ize h ALA 229 Ca 0.29 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ize h ALA 229 Cb 0.05 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1ize h ALA 229 CO -0.12 0.51 -0.00 -0.92 0.00 0.00 0.00 179.25 178.71 1ize h TYR 230 N 0.86 -0.01 0.00 0.00 3.20 -0.23 -3.08 116.97 117.72 1ize h TYR 230 Ca 0.21 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.08 1ize h TYR 230 Cb 0.12 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.39 1ize h TYR 230 CO 0.01 0.25 0.00 0.66 -1.64 0.00 0.00 178.16 177.44 1ize n TYR 231 N -4.97 0.09 0.27 -3.82 4.02 -0.94 -2.24 117.16 109.58 1ize n TYR 231 Ca -0.08 0.03 0.17 0.00 -0.01 0.00 0.00 57.90 58.01 1ize n TYR 231 Cb 0.15 -0.55 0.65 0.00 -0.02 0.00 0.00 39.34 39.56 1ize n TYR 231 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 1ize h GLU 232 N 0.00 0.00 -0.21 -0.72 5.08 -1.29 -1.86 114.58 115.58 1ize h GLU 232 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ize h GLU 232 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1ize h GLU 232 CO 0.00 0.02 0.00 1.04 -1.00 0.00 0.00 179.01 179.07 1ize n GLN 233 N -3.12 2.10 -3.77 2.33 1.13 -0.95 -4.72 117.38 110.38 1ize n GLN 233 Ca 0.01 -1.64 -0.36 0.00 -1.94 0.00 0.00 57.00 53.07 1ize n GLN 233 Cb 0.32 -1.46 -0.12 0.00 0.11 0.00 0.00 30.24 29.10 1ize n GLN 233 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1ize s VAL 234 N -1.74 3.30 0.21 5.09 1.01 -0.70 -4.84 120.40 122.73 1ize s VAL 234 Ca 0.35 -2.07 -0.32 0.00 0.00 0.00 0.00 61.98 59.93 1ize s VAL 234 Cb 0.20 -3.26 -0.12 0.00 0.00 0.00 0.00 36.38 33.19 1ize s VAL 234 CO 0.30 -0.70 1.70 0.59 0.00 0.00 0.00 175.10 176.99 1ize n ASN 235 N 4.57 3.90 0.00 3.32 4.13 -1.26 -1.92 115.26 127.99 1ize n ASN 235 Ca -0.02 1.07 0.00 0.00 1.68 0.00 0.00 54.58 57.31 1ize n ASN 235 Cb 0.41 -1.56 0.00 0.00 -1.54 0.00 0.00 39.78 37.09 1ize n ASN 235 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ize n GLY 236 N 3.75 1.33 3.77 7.41 0.00 -1.26 -4.62 105.19 115.57 1ize n GLY 236 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 1ize n GLY 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ize s ALA 237 N -2.31 3.09 0.03 4.61 0.00 -0.81 -4.48 121.76 121.89 1ize s ALA 237 Ca 0.00 1.01 -0.27 0.00 0.00 0.00 0.00 51.96 52.70 1ize s ALA 237 Cb 0.00 -3.40 0.08 0.00 0.00 0.00 0.00 23.12 19.80 1ize s ALA 237 CO 0.00 -0.65 0.71 -1.54 0.00 0.00 0.00 175.76 174.28 1ize s SER 238 N -1.14 -0.55 -0.02 0.00 1.04 -0.71 -5.00 113.70 107.31 1ize s SER 238 Ca 0.60 0.29 -0.30 0.00 0.48 0.00 0.00 55.95 57.02 1ize s SER 238 Cb -0.31 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.29 1ize s SER 238 CO 0.39 -0.73 1.06 -0.47 0.98 0.00 0.00 173.24 174.47 1ize s TYR 239 N -2.50 3.51 -0.35 5.02 5.04 -1.26 -1.59 117.35 125.23 1ize s TYR 239 Ca -0.03 1.52 -0.07 0.00 -2.44 0.00 0.00 57.07 56.05 1ize s TYR 239 Cb -0.01 -3.24 0.04 0.00 0.35 0.00 0.00 41.96 39.10 1ize s TYR 239 CO -0.03 -0.51 0.12 0.34 -1.34 0.00 0.00 175.55 174.13 1ize s ASP 240 N 1.11 5.38 0.32 4.32 3.68 0.53 -4.96 116.67 127.05 1ize s ASP 240 Ca 0.53 -1.14 0.01 0.00 2.13 0.00 0.00 52.55 54.09 1ize s ASP 240 Cb -0.23 -1.89 0.54 0.00 -1.45 0.00 0.00 42.92 39.89 1ize s ASP 240 CO 0.25 -0.34 1.94 -1.28 0.13 0.00 0.00 175.17 175.87 1ize h SER 241 N 8.25 0.74 -0.50 -0.34 0.87 -1.95 0.47 113.55 121.09 1ize h SER 241 Ca -0.23 -0.06 -0.10 0.00 -1.23 0.00 0.00 61.79 60.17 1ize h SER 241 Cb 1.08 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.84 1ize h SER 241 CO 0.62 0.61 -0.07 0.77 -0.53 0.00 0.00 176.83 178.24 1ize h SER 242 N 0.83 0.93 0.98 6.23 4.64 -1.95 -3.06 113.55 122.16 1ize h SER 242 Ca 0.21 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1ize h SER 242 Cb 0.05 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 61.89 1ize h SER 242 CO -0.03 1.05 -0.55 1.56 -0.87 0.00 0.00 176.83 177.98 1ize h GLN 243 N 0.79 0.00 -1.18 4.77 1.08 -1.96 -3.48 115.11 115.14 1ize h GLN 243 Ca 0.13 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.27 1ize h GLN 243 Cb 0.61 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.05 1ize h GLN 243 CO 0.04 0.00 -0.10 0.41 -0.95 0.00 0.00 178.83 178.23 1ize n GLY 244 N 1.32 0.49 0.00 3.46 0.00 0.12 -5.02 105.19 105.55 1ize n GLY 244 Ca 0.03 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1ize n GLY 244 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ize n GLY 245 N -0.87 -1.02 3.75 -0.02 0.00 -0.97 -5.00 105.19 101.07 1ize n GLY 245 Ca -0.02 -1.00 -0.40 0.00 0.00 0.00 0.00 46.02 44.60 1ize n GLY 245 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ize s TYR 246 N -2.00 3.73 0.20 1.61 2.02 -1.26 -0.35 117.35 121.31 1ize s TYR 246 Ca 0.00 1.77 0.02 0.00 -0.37 0.00 0.00 57.07 58.49 1ize s TYR 246 Cb 0.00 -3.17 -0.05 0.00 -0.40 0.00 0.00 41.96 38.34 1ize s TYR 246 CO 0.00 -0.18 0.02 0.14 -1.57 0.00 0.00 175.55 173.96 1ize s VAL 247 N -1.05 0.75 0.12 0.71 -7.23 -0.62 -1.89 120.40 111.19 1ize s VAL 247 Ca 0.44 -2.00 -0.25 0.00 -1.81 0.00 0.00 61.98 58.36 1ize s VAL 247 Cb -0.29 -2.28 0.08 0.00 0.56 0.00 0.00 36.38 34.45 1ize s VAL 247 CO 0.37 -0.35 0.69 0.72 -0.31 0.00 0.00 175.10 176.22 1ize s PHE 248 N -3.61 -0.47 0.19 2.82 -0.71 -0.44 -1.75 117.98 114.01 1ize s PHE 248 Ca 0.28 0.28 -0.33 0.00 -1.04 0.00 0.00 56.93 56.12 1ize s PHE 248 Cb 0.06 0.56 -0.14 0.00 -1.21 0.00 0.00 43.02 42.29 1ize s PHE 248 CO 0.07 -0.77 1.44 -2.30 -1.34 0.00 0.00 175.22 172.32 1ize n PRO 249 N -0.35 1.91 0.34 1.99 -0.02 -1.26 -0.16 135.00 137.44 1ize n PRO 249 Ca -0.14 0.68 0.21 0.00 -2.02 0.00 0.00 63.50 62.23 1ize n PRO 249 Cb 0.64 -2.37 1.12 0.00 -0.02 0.00 0.00 33.50 32.88 1ize n PRO 249 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1ize h SER 250 N 4.82 0.00 0.54 2.55 0.02 -1.34 0.48 113.55 120.62 1ize h SER 250 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1ize h SER 250 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 1ize h SER 250 CO 0.80 0.00 -0.38 -1.54 -1.14 0.00 0.00 176.83 174.57 1ize n SER 251 N -3.05 0.47 -4.75 3.07 3.41 -1.26 -4.94 113.62 106.56 1ize n SER 251 Ca -0.03 -0.21 -0.38 0.00 -0.26 0.00 0.00 58.87 57.99 1ize n SER 251 Cb 0.15 0.11 0.04 0.00 -0.26 0.00 0.00 64.21 64.24 1ize n SER 251 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ize s ALA 252 N -2.92 2.83 -0.14 7.33 0.00 0.16 -4.98 121.76 124.03 1ize s ALA 252 Ca 0.14 1.34 -0.24 0.00 0.00 0.00 0.00 51.96 53.20 1ize s ALA 252 Cb 0.18 -3.57 -0.02 0.00 0.00 0.00 0.00 23.12 19.71 1ize s ALA 252 CO 0.64 -1.37 0.76 0.45 0.00 0.00 0.00 175.76 176.24 1ize s SER 253 N -0.94 6.92 -0.21 0.00 0.15 -1.26 -5.04 113.70 113.32 1ize s SER 253 Ca 0.71 1.12 -0.06 0.00 0.70 0.00 0.00 55.95 58.42 1ize s SER 253 Cb -0.41 -2.42 -0.03 0.00 -1.71 0.00 0.00 66.02 61.45 1ize s SER 253 CO 0.48 -0.30 0.04 -0.76 1.20 0.00 0.00 173.24 173.90 1ize s LEU 254 N 1.72 3.47 0.59 3.45 1.43 -1.26 -4.79 118.68 123.29 1ize s LEU 254 Ca 0.36 -0.12 -0.15 0.00 -1.03 0.00 0.00 54.13 53.20 1ize s LEU 254 Cb -0.17 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1ize s LEU 254 CO 0.14 0.08 1.04 -2.16 0.23 0.00 0.00 176.35 175.67 1ize s PRO 255 N 0.95 3.42 0.66 1.29 0.04 -1.26 -4.36 135.00 135.73 1ize s PRO 255 Ca 0.03 1.10 -0.15 0.00 0.04 0.00 0.00 61.00 62.01 1ize s PRO 255 Cb -0.14 -2.05 -0.00 0.00 0.04 0.00 0.00 34.50 32.35 1ize s PRO 255 CO 0.02 -0.72 1.11 -0.51 0.04 0.00 0.00 177.00 176.95 1ize s ASP 256 N -3.04 5.09 -0.09 6.66 -0.00 -1.26 -4.22 116.67 119.81 1ize s ASP 256 Ca 0.61 2.02 0.03 0.00 -0.00 0.00 0.00 52.55 55.21 1ize s ASP 256 Cb -0.14 -2.55 0.01 0.00 -0.00 0.00 0.00 42.92 40.23 1ize s ASP 256 CO 0.39 -1.64 -0.17 0.12 -0.00 0.00 0.00 175.17 173.86 1ize s PHE 257 N -2.30 2.01 0.13 4.23 2.19 -0.78 -0.87 117.98 122.59 1ize s PHE 257 Ca 0.67 -0.85 0.07 0.00 0.33 0.00 0.00 56.93 57.16 1ize s PHE 257 Cb -0.21 -1.41 -0.04 0.00 -1.31 0.00 0.00 43.02 40.05 1ize s PHE 257 CO 0.41 -0.39 -0.17 -1.12 1.83 0.00 0.00 175.22 175.78 1ize s SER 258 N 0.65 2.35 -0.03 6.13 0.01 -0.32 0.11 113.70 122.60 1ize s SER 258 Ca -0.14 -0.80 0.05 0.00 1.31 0.00 0.00 55.95 56.37 1ize s SER 258 Cb -0.16 -0.12 -0.01 0.00 0.21 0.00 0.00 66.02 65.95 1ize s SER 258 CO 0.04 -0.06 -0.17 0.68 0.41 0.00 0.00 173.24 174.14 1ize s VAL 259 N -1.89 1.38 -0.22 3.43 -7.23 -0.47 -0.76 120.40 114.64 1ize s VAL 259 Ca 0.11 -0.71 -0.15 0.00 -1.81 0.00 0.00 61.98 59.42 1ize s VAL 259 Cb -0.06 -1.17 -0.04 0.00 0.56 0.00 0.00 36.38 35.66 1ize s VAL 259 CO 0.05 0.40 0.34 -0.89 -0.31 0.00 0.00 175.10 174.68 1ize s THR 260 N -0.11 5.23 -0.39 5.32 2.01 0.28 -1.18 115.64 126.81 1ize s THR 260 Ca -0.00 0.58 0.03 0.00 0.31 0.00 0.00 61.69 62.60 1ize s THR 260 Cb -0.10 -3.67 0.11 0.00 0.01 0.00 0.00 72.50 68.85 1ize s THR 260 CO 0.01 0.26 0.13 -0.63 -0.69 0.00 0.00 174.62 173.70 1ize s ILE 261 N 1.32 1.98 0.00 1.82 1.01 0.32 -0.01 121.20 127.65 1ize s ILE 261 Ca 0.16 -2.42 0.00 0.00 0.00 0.00 0.00 60.65 58.39 1ize s ILE 261 Cb -0.15 -2.44 0.00 0.00 0.01 0.00 0.00 42.46 39.89 1ize s ILE 261 CO 0.07 -0.69 0.00 0.61 0.00 0.00 0.00 174.94 174.93 1ize n GLY 262 N 4.02 2.34 1.00 6.18 0.00 -1.26 -1.64 105.19 115.83 1ize n GLY 262 Ca 0.04 -0.34 0.11 0.00 0.00 0.00 0.00 46.02 45.83 1ize n GLY 262 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ize n ASP 263 N 7.27 2.98 -4.79 1.61 5.75 -1.26 -4.91 116.55 123.20 1ize n ASP 263 Ca 0.00 -1.93 -0.36 0.00 -0.01 0.00 0.00 54.79 52.49 1ize n ASP 263 Cb 0.00 -0.22 -0.07 0.00 -1.03 0.00 0.00 41.12 39.80 1ize n ASP 263 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 1ize s TYR 264 N -1.56 3.40 -0.28 2.11 6.14 -0.65 -5.09 117.35 121.43 1ize s TYR 264 Ca 0.37 0.38 -0.04 0.00 0.64 0.00 0.00 57.07 58.41 1ize s TYR 264 Cb 0.21 -1.87 0.02 0.00 0.42 0.00 0.00 41.96 40.75 1ize s TYR 264 CO 0.30 0.62 0.01 0.99 0.64 0.00 0.00 175.55 178.11 1ize s THR 265 N -0.98 3.37 -0.43 4.34 2.01 -1.26 -0.52 115.64 122.17 1ize s THR 265 Ca 0.15 -0.94 -0.19 0.00 0.31 0.00 0.00 61.69 61.02 1ize s THR 265 Cb -0.12 -2.76 0.02 0.00 0.01 0.00 0.00 72.50 69.66 1ize s THR 265 CO 0.04 0.10 0.54 0.00 -0.69 0.00 0.00 174.62 174.61 1ize s ALA 266 N 1.39 3.39 -0.16 7.40 0.00 -0.33 -4.94 121.76 128.50 1ize s ALA 266 Ca 0.00 -1.37 -0.06 0.00 0.00 0.00 0.00 51.96 50.53 1ize s ALA 266 Cb -0.17 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 1ize s ALA 266 CO -0.01 -1.70 0.05 0.99 0.00 0.00 0.00 175.76 175.10 1ize s THR 267 N 2.48 4.72 -0.31 0.00 2.01 -1.26 -1.37 115.64 121.91 1ize s THR 267 Ca 0.17 -0.07 -0.12 0.00 0.31 0.00 0.00 61.69 61.98 1ize s THR 267 Cb -0.16 -3.10 -0.03 0.00 0.01 0.00 0.00 72.50 69.22 1ize s THR 267 CO 0.16 0.49 0.24 -0.69 -0.69 0.00 0.00 174.62 174.14 1ize s VAL 268 N 0.10 5.27 0.34 3.82 1.01 0.12 -4.89 120.40 126.16 1ize s VAL 268 Ca 0.05 0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.80 1ize s VAL 268 Cb -0.12 -3.64 -0.11 0.00 0.00 0.00 0.00 36.38 32.51 1ize s VAL 268 CO 0.01 0.12 1.51 -2.84 0.00 0.00 0.00 175.10 173.90 1ize s PRO 269 N 1.81 4.14 0.44 2.72 0.02 -1.26 -1.86 135.00 141.00 1ize s PRO 269 Ca 0.08 2.54 0.17 0.00 0.02 0.00 0.00 61.00 63.81 1ize s PRO 269 Cb -0.17 -3.00 1.10 0.00 0.02 0.00 0.00 34.50 32.45 1ize s PRO 269 CO 0.11 -0.54 1.93 0.78 -0.33 0.00 0.00 177.00 178.95 1ize h GLY 270 N 3.76 0.60 1.39 0.52 0.00 -1.76 -0.28 103.07 107.30 1ize h GLY 270 Ca -0.49 -0.15 0.07 0.00 0.00 0.00 0.00 47.33 46.76 1ize h GLY 270 CO 0.70 0.05 0.25 1.05 0.00 0.00 0.00 176.54 178.59 1ize h GLU 271 N 0.36 0.17 0.00 4.80 9.09 -1.89 -0.45 114.58 126.65 1ize h GLU 271 Ca 0.35 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.75 1ize h GLU 271 Cb 0.87 -0.04 0.00 0.00 -1.65 0.00 0.00 28.75 27.93 1ize h GLU 271 CO -0.10 0.11 0.00 1.88 0.05 0.00 0.00 179.01 180.95 1ize h TYR 272 N 0.17 0.00 0.00 2.06 0.05 -1.40 -3.00 116.97 114.85 1ize h TYR 272 Ca 0.16 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.94 1ize h TYR 272 Cb 0.43 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.17 1ize h TYR 272 CO -0.00 0.00 0.00 0.82 -1.05 0.00 0.00 178.16 177.93 1ize h ILE 273 N 0.00 0.00 -1.61 -2.88 1.08 -1.12 -3.38 117.51 109.60 1ize h ILE 273 Ca 0.00 -0.45 -0.62 0.00 -0.39 0.00 0.00 64.86 63.39 1ize h ILE 273 Cb 0.66 1.40 -0.12 0.00 -3.07 0.00 0.00 36.82 35.69 1ize h ILE 273 CO 0.00 0.00 1.25 -0.55 -0.69 0.00 0.00 178.15 178.16 1ize s SER 274 N -4.57 6.51 -0.10 1.72 0.15 -1.13 0.41 113.70 116.69 1ize s SER 274 Ca 0.09 -1.55 -0.14 0.00 0.70 0.00 0.00 55.95 55.05 1ize s SER 274 Cb 0.11 -2.51 -0.12 0.00 -1.71 0.00 0.00 66.02 61.79 1ize s SER 274 CO 0.56 -1.39 0.45 0.15 1.20 0.00 0.00 173.24 174.21 1ize h PHE 275 N 9.52 -0.07 -2.88 3.44 3.57 -1.54 -3.47 116.94 125.51 1ize h PHE 275 Ca 0.14 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.58 1ize h PHE 275 Cb 1.02 0.02 -0.16 0.00 2.79 0.00 0.00 35.95 39.62 1ize h PHE 275 CO 1.23 0.33 0.01 0.00 -2.23 0.00 0.00 178.31 177.65 1ize s ALA 276 N -2.77 -1.24 0.29 2.41 0.00 -1.16 -4.93 121.76 114.36 1ize s ALA 276 Ca -0.09 0.48 -0.29 0.00 0.00 0.00 0.00 51.96 52.06 1ize s ALA 276 Cb -0.01 0.42 -0.10 0.00 0.00 0.00 0.00 23.12 23.43 1ize s ALA 276 CO 0.32 -0.51 1.11 -0.51 0.00 0.00 0.00 175.76 176.17 1ize s ASP 277 N -2.07 7.21 -0.05 0.00 1.01 -1.26 -0.21 116.67 121.31 1ize s ASP 277 Ca -0.04 2.29 0.07 0.00 0.71 0.00 0.00 52.55 55.57 1ize s ASP 277 Cb -0.01 -2.63 0.10 0.00 1.01 0.00 0.00 42.92 41.40 1ize s ASP 277 CO -0.03 -0.18 0.98 1.33 0.21 0.00 0.00 175.17 177.47 1ize n VAL 278 N 1.11 0.82 0.00 -1.27 0.24 -0.82 -4.84 118.33 113.57 1ize n VAL 278 Ca -0.01 -0.95 0.00 0.00 -2.04 0.00 0.00 64.34 61.34 1ize n VAL 278 Cb 0.45 0.32 0.00 0.00 -1.47 0.00 0.00 33.84 33.13 1ize n VAL 278 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ize n GLY 279 N -0.58 -1.52 2.39 7.63 0.00 -1.25 -4.85 105.19 107.00 1ize n GLY 279 Ca 0.06 -1.56 -0.18 0.00 0.00 0.00 0.00 46.02 44.34 1ize n GLY 279 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ize n ASN 280 N -2.09 -4.96 -0.92 1.61 4.13 -1.26 -1.23 115.26 110.53 1ize n ASN 280 Ca 0.00 0.26 -0.11 0.00 1.68 0.00 0.00 54.58 56.41 1ize n ASN 280 Cb 0.00 -4.30 -0.04 0.00 -1.54 0.00 0.00 39.78 33.90 1ize n ASN 280 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ize n GLY 281 N -0.63 0.87 3.58 7.41 0.00 -1.26 -4.99 105.19 110.17 1ize n GLY 281 Ca -0.20 -0.51 -0.26 0.00 0.00 0.00 0.00 46.02 45.05 1ize n GLY 281 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ize s GLN 282 N -3.33 2.07 0.03 1.61 -0.21 -0.37 -0.95 119.66 118.51 1ize s GLN 282 Ca 0.00 -1.32 0.08 0.00 0.02 0.00 0.00 55.36 54.14 1ize s GLN 282 Cb 0.00 -2.14 -0.02 0.00 1.00 0.00 0.00 33.01 31.85 1ize s GLN 282 CO 0.00 0.42 -0.24 0.99 -2.12 0.00 0.00 175.29 174.33 1ize s THR 283 N -1.85 1.95 -0.05 -0.19 2.01 0.77 -1.94 115.64 116.33 1ize s THR 283 Ca 0.26 -1.24 -0.23 0.00 0.31 0.00 0.00 61.69 60.79 1ize s THR 283 Cb -0.08 -1.66 -0.04 0.00 0.01 0.00 0.00 72.50 70.73 1ize s THR 283 CO 0.16 0.37 0.68 0.12 -0.69 0.00 0.00 174.62 175.26 1ize s PHE 284 N -0.74 3.60 0.51 4.92 5.36 0.71 -1.33 117.98 131.02 1ize s PHE 284 Ca 0.10 1.23 -0.20 0.00 -0.96 0.00 0.00 56.93 57.10 1ize s PHE 284 Cb -0.09 -2.76 -0.07 0.00 -0.34 0.00 0.00 43.02 39.75 1ize s PHE 284 CO 0.01 0.14 1.09 0.20 -1.46 0.00 0.00 175.22 175.20 1ize s GLY 285 N 0.61 2.59 0.19 13.12 0.00 -0.79 -1.80 107.32 121.23 1ize s GLY 285 Ca 0.36 0.74 0.26 0.00 0.00 0.00 0.00 44.72 46.08 1ize s GLY 285 CO 0.18 1.08 1.79 0.61 0.00 0.00 0.00 173.10 176.75 1ize n GLY 286 N -0.00 -1.68 3.39 0.20 0.00 0.17 -4.66 105.19 102.60 1ize n GLY 286 Ca 0.10 -0.03 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 1ize n GLY 286 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ize s ILE 287 N -3.09 3.64 0.27 -0.61 1.01 -1.26 -2.02 121.20 119.14 1ize s ILE 287 Ca 0.11 -0.42 0.03 0.00 0.00 0.00 0.00 60.65 60.37 1ize s ILE 287 Cb 0.13 -2.64 -0.04 0.00 0.01 0.00 0.00 42.46 39.93 1ize s ILE 287 CO 0.59 0.44 0.19 -1.10 0.00 0.00 0.00 174.94 175.06 1ize s GLN 288 N 1.06 1.48 0.41 2.79 -1.52 -0.85 -4.81 119.66 118.22 1ize s GLN 288 Ca 0.01 -1.82 -0.24 0.00 -1.95 0.00 0.00 55.36 51.36 1ize s GLN 288 Cb -0.15 0.23 -0.08 0.00 -0.22 0.00 0.00 33.01 32.79 1ize s GLN 288 CO 0.01 -0.50 1.10 0.45 -0.25 0.00 0.00 175.29 176.10 1ize s SER 289 N -3.28 6.58 -0.05 5.90 0.15 -1.26 -1.56 113.70 120.18 1ize s SER 289 Ca 0.39 2.16 0.14 0.00 0.70 0.00 0.00 55.95 59.35 1ize s SER 289 Cb 0.05 -2.60 0.49 0.00 -1.71 0.00 0.00 66.02 62.26 1ize s SER 289 CO 0.19 -0.62 1.38 -0.46 1.20 0.00 0.00 173.24 174.92 1ize n ASN 290 N -0.12 3.24 -3.90 5.45 0.23 0.10 -4.65 115.26 115.61 1ize n ASN 290 Ca 0.05 -2.20 -0.56 0.00 -0.53 0.00 0.00 54.58 51.35 1ize n ASN 290 Cb 0.49 -0.43 -0.08 0.00 -2.08 0.00 0.00 39.78 37.67 1ize n ASN 290 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 1ize n SER 291 N 0.84 0.98 0.00 0.53 2.88 -1.26 -0.97 113.62 116.61 1ize n SER 291 Ca 0.18 0.96 0.00 0.00 -1.33 0.00 0.00 58.87 58.68 1ize n SER 291 Cb 0.58 -0.73 0.00 0.00 -0.75 0.00 0.00 64.21 63.32 1ize n SER 291 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ize n GLY 292 N 3.48 2.74 0.32 0.46 0.00 -1.26 -4.84 105.19 106.08 1ize n GLY 292 Ca 0.27 -0.69 0.11 0.00 0.00 0.00 0.00 46.02 45.71 1ize n GLY 292 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ize h ILE 293 N 0.00 0.62 0.00 -0.61 2.04 -1.46 -3.45 117.51 114.64 1ize h ILE 293 Ca 0.00 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1ize h ILE 293 Cb 0.00 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.09 1ize h ILE 293 CO 0.00 0.10 0.00 0.61 0.00 0.00 0.00 178.15 178.86 1ize n GLY 294 N -1.33 1.30 3.55 5.37 0.00 -1.25 -5.01 105.19 107.82 1ize n GLY 294 Ca 0.21 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.13 1ize n GLY 294 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ize s PHE 295 N -2.31 -0.17 0.37 1.61 -0.12 -1.26 -5.13 117.98 110.98 1ize s PHE 295 Ca 0.00 -0.17 -0.18 0.00 -0.05 0.00 0.00 56.93 56.52 1ize s PHE 295 Cb 0.00 0.44 -0.10 0.00 -0.63 0.00 0.00 43.02 42.73 1ize s PHE 295 CO 0.00 -0.95 0.84 -1.12 -0.05 0.00 0.00 175.22 173.95 1ize s SER 296 N -2.87 6.88 -0.19 1.98 0.01 -1.15 -4.88 113.70 113.49 1ize s SER 296 Ca 0.09 1.50 0.01 0.00 1.31 0.00 0.00 55.95 58.85 1ize s SER 296 Cb -0.02 -2.46 0.04 0.00 0.21 0.00 0.00 66.02 63.79 1ize s SER 296 CO -0.03 -0.27 -0.11 -0.63 0.41 0.00 0.00 173.24 172.62 1ize s ILE 297 N -2.05 1.61 -0.91 1.44 1.01 -0.31 -1.60 121.20 120.39 1ize s ILE 297 Ca 0.57 -0.91 -0.20 0.00 0.00 0.00 0.00 60.65 60.12 1ize s ILE 297 Cb -0.10 -1.65 0.12 0.00 0.01 0.00 0.00 42.46 40.84 1ize s ILE 297 CO 0.16 0.23 1.14 -0.36 0.00 0.00 0.00 174.94 176.11 1ize s PHE 298 N 1.43 3.01 0.00 3.97 0.40 -0.04 -1.40 117.98 125.34 1ize s PHE 298 Ca 0.00 -1.24 0.00 0.00 -0.60 0.00 0.00 56.93 55.09 1ize s PHE 298 Cb -0.15 -4.33 0.00 0.00 0.51 0.00 0.00 43.02 39.05 1ize s PHE 298 CO -0.09 -1.55 0.00 0.41 0.70 0.00 0.00 175.22 174.69 1ize n GLY 299 N 5.63 -0.05 0.36 4.36 0.00 -0.87 -2.01 105.19 112.61 1ize n GLY 299 Ca 0.22 -1.76 0.05 0.00 0.00 0.00 0.00 46.02 44.53 1ize n GLY 299 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ize h ASP 300 N 0.00 0.86 -0.99 1.61 3.32 -0.50 -1.01 116.42 119.71 1ize h ASP 300 Ca 0.00 0.01 0.19 0.00 0.02 0.00 0.00 57.03 57.25 1ize h ASP 300 Cb 0.00 -0.17 -0.10 0.00 0.22 0.00 0.00 39.33 39.28 1ize h ASP 300 CO 0.00 0.54 0.61 0.58 -1.72 0.00 0.00 179.24 179.25 1ize h VAL 301 N 0.97 0.72 0.00 -1.35 2.07 -1.61 0.41 116.25 117.47 1ize h VAL 301 Ca 0.39 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.60 1ize h VAL 301 Cb 0.26 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.95 1ize h VAL 301 CO -0.15 0.13 -0.35 0.15 0.02 0.00 0.00 177.57 177.37 1ize h PHE 302 N 0.73 0.01 -0.05 1.57 3.57 -1.65 -3.38 116.94 117.74 1ize h PHE 302 Ca 0.56 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 62.05 1ize h PHE 302 Cb 0.91 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.64 1ize h PHE 302 CO -0.00 1.14 0.03 -0.07 -2.23 0.00 0.00 178.31 177.18 1ize h LEU 303 N -0.98 0.03 0.00 0.59 3.38 -0.82 -2.84 115.31 114.67 1ize h LEU 303 Ca -0.10 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1ize h LEU 303 Cb 1.10 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1ize h LEU 303 CO -0.05 0.02 0.00 2.29 0.09 0.00 0.00 178.44 180.79 1ize n LYS 304 N -4.53 0.29 0.00 1.13 2.85 0.10 -1.53 118.16 116.46 1ize n LYS 304 Ca -0.02 0.06 0.06 0.00 -1.05 0.00 0.00 58.31 57.36 1ize n LYS 304 Cb 0.11 -1.50 0.04 0.00 -0.65 0.00 0.00 35.03 33.03 1ize n LYS 304 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 1ize n SER 305 N -1.10 1.91 -4.31 -5.58 3.41 -1.07 -4.58 113.62 102.31 1ize n SER 305 Ca 0.07 -1.46 -0.17 0.00 -0.26 0.00 0.00 58.87 57.06 1ize n SER 305 Cb 0.05 0.03 -0.10 0.00 -0.26 0.00 0.00 64.21 63.93 1ize n SER 305 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1ize s GLN 306 N -0.99 1.26 -0.32 4.33 -1.52 -0.58 -3.74 119.66 118.10 1ize s GLN 306 Ca 0.13 -1.59 -0.07 0.00 -1.95 0.00 0.00 55.36 51.88 1ize s GLN 306 Cb 0.10 -0.76 0.02 0.00 -0.22 0.00 0.00 33.01 32.14 1ize s GLN 306 CO 0.15 0.03 0.10 -0.47 -0.25 0.00 0.00 175.29 174.85 1ize s TYR 307 N -3.27 3.20 -0.14 0.91 6.14 -0.09 -4.45 117.35 119.65 1ize s TYR 307 Ca 0.23 -1.16 -0.03 0.00 0.64 0.00 0.00 57.07 56.76 1ize s TYR 307 Cb 0.03 -2.27 -0.03 0.00 0.42 0.00 0.00 41.96 40.11 1ize s TYR 307 CO 0.06 -0.64 -0.05 0.08 0.64 0.00 0.00 175.55 175.64 1ize s VAL 308 N 1.46 3.83 -0.22 3.14 1.01 -0.75 -1.99 120.40 126.89 1ize s VAL 308 Ca 0.01 -0.39 -0.05 0.00 0.00 0.00 0.00 61.98 61.55 1ize s VAL 308 Cb -0.18 -2.66 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 1ize s VAL 308 CO 0.03 0.52 0.01 -0.69 0.00 0.00 0.00 175.10 174.96 1ize s VAL 309 N 0.13 3.90 -0.49 2.92 1.01 0.25 -1.00 120.40 127.13 1ize s VAL 309 Ca -0.02 -0.32 -0.14 0.00 0.00 0.00 0.00 61.98 61.51 1ize s VAL 309 Cb -0.14 -2.79 0.10 0.00 0.00 0.00 0.00 36.38 33.56 1ize s VAL 309 CO 0.03 0.40 0.40 -0.36 0.00 0.00 0.00 175.10 175.57 1ize s PHE 310 N 1.31 3.29 -0.39 5.22 0.40 0.35 -0.50 117.98 127.66 1ize s PHE 310 Ca 0.04 -1.29 -0.13 0.00 -0.60 0.00 0.00 56.93 54.95 1ize s PHE 310 Cb -0.15 -3.40 0.01 0.00 0.51 0.00 0.00 43.02 40.00 1ize s PHE 310 CO 0.01 -0.91 0.26 0.34 0.70 0.00 0.00 175.22 175.62 1ize s ASP 311 N 2.87 5.98 0.10 1.36 -1.08 -0.32 -2.27 116.67 123.32 1ize s ASP 311 Ca 0.04 -0.83 0.26 0.00 -0.52 0.00 0.00 52.55 51.49 1ize s ASP 311 Cb -0.26 -2.12 0.98 0.00 -1.46 0.00 0.00 42.92 40.07 1ize s ASP 311 CO 0.04 -0.39 1.80 0.00 0.52 0.00 0.00 175.17 177.13 1ize n ALA 312 N 5.10 2.16 0.22 3.66 0.00 -0.75 -0.89 120.51 130.02 1ize n ALA 312 Ca -0.12 -0.05 0.08 0.00 0.00 0.00 0.00 53.44 53.36 1ize n ALA 312 Cb 0.47 -1.43 0.51 0.00 0.00 0.00 0.00 19.45 19.00 1ize n ALA 312 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ize h SER 313 N 0.00 0.00 0.00 0.00 4.64 -1.94 -3.36 113.55 112.90 1ize h SER 313 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ize h SER 313 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1ize h SER 313 CO 0.00 0.25 0.00 0.61 -0.87 0.00 0.00 176.83 176.82 1ize n GLY 314 N -0.33 0.00 3.78 -0.77 0.00 -1.23 -4.95 105.19 101.68 1ize n GLY 314 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1ize n GLY 314 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ize s PRO 315 N -0.76 3.70 0.05 1.61 0.04 -1.26 -5.05 135.00 133.33 1ize s PRO 315 Ca 0.00 1.64 -0.09 0.00 0.04 0.00 0.00 61.00 62.58 1ize s PRO 315 Cb 0.00 -2.27 0.00 0.00 0.04 0.00 0.00 34.50 32.28 1ize s PRO 315 CO 0.00 -0.57 0.20 -0.98 0.04 0.00 0.00 177.00 175.69 1ize s ARG 316 N -2.91 0.73 -0.04 4.56 1.70 -0.06 -2.35 118.95 120.57 1ize s ARG 316 Ca 0.66 -0.70 0.06 0.00 -0.47 0.00 0.00 55.73 55.28 1ize s ARG 316 Cb -0.25 0.30 -0.02 0.00 -0.57 0.00 0.00 34.95 34.42 1ize s ARG 316 CO 0.29 -0.22 -0.24 -0.51 -1.08 0.00 0.00 175.30 173.55 1ize s LEU 317 N -2.26 2.15 0.06 -1.89 1.43 -0.60 -1.17 118.68 116.39 1ize s LEU 317 Ca -0.03 -0.46 0.09 0.00 -1.03 0.00 0.00 54.13 52.71 1ize s LEU 317 Cb 0.00 -1.39 -0.03 0.00 0.03 0.00 0.00 46.19 44.81 1ize s LEU 317 CO -0.05 0.28 -0.26 -0.83 0.23 0.00 0.00 176.35 175.72 1ize s GLY 318 N -0.37 1.45 0.02 -3.19 0.00 0.35 -1.14 107.32 104.44 1ize s GLY 318 Ca 0.03 -1.29 0.04 0.00 0.00 0.00 0.00 44.72 43.49 1ize s GLY 318 CO 0.02 -1.19 -0.12 -1.36 0.00 0.00 0.00 173.10 170.44 1ize s PHE 319 N -0.85 1.07 0.05 1.90 0.40 -0.15 -0.58 117.98 119.81 1ize s PHE 319 Ca 0.12 -0.30 -0.19 0.00 -0.60 0.00 0.00 56.93 55.96 1ize s PHE 319 Cb -0.10 -0.65 0.04 0.00 0.51 0.00 0.00 43.02 42.82 1ize s PHE 319 CO 0.03 0.01 0.44 0.00 0.70 0.00 0.00 175.22 176.40 1ize s ALA 320 N -0.67 -1.10 0.33 5.36 0.00 -0.84 -1.31 121.76 123.53 1ize s ALA 320 Ca 0.01 0.38 -0.27 0.00 0.00 0.00 0.00 51.96 52.08 1ize s ALA 320 Cb -0.07 0.38 -0.09 0.00 0.00 0.00 0.00 23.12 23.34 1ize s ALA 320 CO 0.01 -0.48 1.10 0.00 0.00 0.00 0.00 175.76 176.38 1ize s ALA 321 N -2.54 3.28 0.50 0.00 0.00 -1.26 -0.92 121.76 120.83 1ize s ALA 321 Ca -0.05 0.85 -0.21 0.00 0.00 0.00 0.00 51.96 52.56 1ize s ALA 321 Cb -0.01 -3.32 -0.07 0.00 0.00 0.00 0.00 23.12 19.72 1ize s ALA 321 CO -0.03 -0.23 1.10 -0.65 0.00 0.00 0.00 175.76 175.95 1ize s GLN 322 N -1.88 3.62 0.00 0.00 -0.21 -1.25 -1.39 119.66 118.56 1ize s GLN 322 Ca 0.50 1.55 0.31 0.00 0.02 0.00 0.00 55.36 57.74 1ize s GLN 322 Cb -0.29 -2.13 1.78 0.00 1.00 0.00 0.00 33.01 33.37 1ize s GLN 322 CO 0.37 -0.62 2.16 0.00 -2.12 0.00 0.00 175.29 175.08