#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aiz s SER 2 N 0.00 1.57 0.03 0.00 0.15 -1.26 -4.79 113.70 109.40 2aiz s SER 2 Ca 0.00 -2.33 0.00 0.00 0.70 0.00 0.00 55.95 54.32 2aiz s SER 2 Cb 0.00 0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.33 2aiz s SER 2 CO 0.00 -0.22 0.00 -1.54 1.20 0.00 0.00 173.24 172.68 2aiz n SER 3 N 3.55 -0.31 0.07 5.45 3.41 -1.26 -4.96 113.62 119.57 2aiz n SER 3 Ca 0.19 0.31 0.06 0.00 -0.26 0.00 0.00 58.87 59.16 2aiz n SER 3 Cb 0.45 0.55 -0.04 0.00 -0.26 0.00 0.00 64.21 64.91 2aiz n SER 3 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2aiz h SER 4 N 0.00 0.00 -3.23 4.04 0.87 -2.05 -3.46 113.55 109.72 2aiz h SER 4 Ca 0.00 0.00 -0.64 0.00 -1.23 0.00 0.00 61.79 59.92 2aiz h SER 4 Cb 0.00 0.00 -0.10 0.00 -0.44 0.00 0.00 62.40 61.86 2aiz h SER 4 CO 0.00 0.30 -0.62 0.20 -0.53 0.00 0.00 176.83 176.18 2aiz s ASN 5 N -5.62 5.40 0.11 6.23 0.01 -1.26 -5.12 114.94 114.69 2aiz s ASN 5 Ca -0.01 -0.05 0.07 0.00 -0.71 0.00 0.00 52.86 52.15 2aiz s ASN 5 Cb 0.09 -1.41 -0.04 0.00 0.41 0.00 0.00 41.25 40.30 2aiz s ASN 5 CO 0.80 0.17 -0.06 0.54 -1.51 0.00 0.00 177.10 177.04 2aiz s ASN 6 N -2.36 4.60 0.18 -1.22 4.22 -1.26 -4.73 114.94 114.37 2aiz s ASN 6 Ca 0.28 -0.34 0.15 0.00 -2.14 0.00 0.00 52.86 50.81 2aiz s ASN 6 Cb -0.12 -0.95 0.74 0.00 1.28 0.00 0.00 41.25 42.20 2aiz s ASN 6 CO 0.21 0.16 1.46 -0.90 -2.04 0.00 0.00 177.10 175.99 2aiz n ASP 7 N 0.53 0.35 0.00 3.54 5.68 -1.26 -4.97 116.55 120.43 2aiz n ASP 7 Ca -0.12 0.64 0.00 0.00 -0.50 0.00 0.00 54.79 54.81 2aiz n ASP 7 Cb 0.53 -0.70 0.00 0.00 -1.14 0.00 0.00 41.12 39.81 2aiz n ASP 7 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2aiz n ALA 8 N -1.67 0.00 0.09 2.12 0.00 -1.26 -4.21 120.51 115.59 2aiz n ALA 8 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 2aiz n ALA 8 Cb 0.07 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.46 2aiz n ALA 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2aiz n ALA 9 N -0.45 2.68 -0.00 0.00 0.00 -1.26 -4.66 120.51 116.82 2aiz n ALA 9 Ca 0.00 -0.35 -0.00 0.00 0.00 0.00 0.00 53.44 53.09 2aiz n ALA 9 Cb 0.00 -0.97 -0.00 0.00 0.00 0.00 0.00 19.45 18.48 2aiz n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aiz n GLY 10 N 1.22 -0.56 1.56 0.00 0.00 -1.26 -5.11 105.19 101.05 2aiz n GLY 10 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2aiz n GLY 10 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2aiz n ASN 11 N -2.41 -8.18 0.00 1.61 3.02 -1.26 -4.84 115.26 103.20 2aiz n ASN 11 Ca -0.00 1.12 0.00 0.00 -0.03 0.00 0.00 54.58 55.66 2aiz n ASN 11 Cb 0.02 -4.04 0.00 0.00 -0.61 0.00 0.00 39.78 35.15 2aiz n ASN 11 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2aiz n GLY 12 N 0.40 -3.05 0.00 7.41 0.00 -1.26 -4.49 105.19 104.20 2aiz n GLY 12 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.42 2aiz n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aiz n ALA 13 N -2.02 0.00 0.00 4.61 0.00 -1.26 -5.02 120.51 116.82 2aiz n ALA 13 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2aiz n ALA 13 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2aiz n ALA 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2aiz n ALA 14 N -1.86 0.00 -2.27 0.00 0.00 -1.26 -5.10 120.51 110.02 2aiz n ALA 14 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2aiz n ALA 14 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2aiz n ALA 14 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2aiz n GLN 15 N 0.00 -4.94 -4.34 0.00 6.02 -1.26 -4.80 117.38 108.06 2aiz n GLN 15 Ca 0.00 3.61 -0.25 0.00 -0.01 0.00 0.00 57.00 60.35 2aiz n GLN 15 Cb 0.00 -4.50 -0.13 0.00 1.02 0.00 0.00 30.24 26.63 2aiz n GLN 15 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2aiz s THR 16 N -0.57 1.85 -0.26 5.09 -4.23 -1.26 -3.83 115.64 112.43 2aiz s THR 16 Ca 0.00 -1.57 -0.03 0.00 -1.18 0.00 0.00 61.69 58.90 2aiz s THR 16 Cb 0.00 -1.66 0.09 0.00 1.34 0.00 0.00 72.50 72.26 2aiz s THR 16 CO 0.00 -0.00 0.10 -0.36 -0.54 0.00 0.00 174.62 173.82 2aiz s PHE 17 N -1.11 0.69 0.00 3.99 0.40 0.53 -4.80 117.98 117.68 2aiz s PHE 17 Ca 0.08 -0.96 0.00 0.00 -0.60 0.00 0.00 56.93 55.45 2aiz s PHE 17 Cb -0.10 -1.06 0.00 0.00 0.51 0.00 0.00 43.02 42.37 2aiz s PHE 17 CO 0.04 -0.76 0.00 0.41 0.70 0.00 0.00 175.22 175.62 2aiz n GLY 18 N 5.14 0.05 0.00 4.36 0.00 -1.26 -2.17 105.19 111.31 2aiz n GLY 18 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2aiz n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aiz n GLY 19 N 0.62 2.19 3.57 -0.02 0.00 -1.26 -4.78 105.19 105.51 2aiz n GLY 19 Ca 0.00 -0.37 -0.24 0.00 0.00 0.00 0.00 46.02 45.42 2aiz n GLY 19 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2aiz s TYR 20 N -0.27 2.52 -0.04 1.61 2.02 -0.92 -4.98 117.35 117.29 2aiz s TYR 20 Ca 0.00 -0.29 -0.08 0.00 -0.37 0.00 0.00 57.07 56.33 2aiz s TYR 20 Cb 0.00 -1.15 -0.05 0.00 -0.40 0.00 0.00 41.96 40.36 2aiz s TYR 20 CO 0.00 0.64 0.25 -1.12 -1.57 0.00 0.00 175.55 173.75 2aiz s SER 21 N -3.62 6.52 0.23 2.29 0.01 -1.25 0.20 113.70 118.09 2aiz s SER 21 Ca 0.31 0.61 -0.16 0.00 1.31 0.00 0.00 55.95 58.02 2aiz s SER 21 Cb -0.05 -2.11 0.27 0.00 0.21 0.00 0.00 66.02 64.33 2aiz s SER 21 CO 0.18 0.32 1.56 0.58 0.41 0.00 0.00 173.24 176.29 2aiz h VAL 22 N 3.51 0.03 0.00 3.43 2.07 -1.90 1.02 116.25 124.41 2aiz h VAL 22 Ca -0.52 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.00 2aiz h VAL 22 Cb 1.21 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 2aiz h VAL 22 CO 0.62 0.00 0.13 0.00 0.02 0.00 0.00 177.57 178.34 2aiz h ALA 23 N 1.46 1.10 0.00 1.67 0.00 -1.94 -1.80 119.26 119.75 2aiz h ALA 23 Ca 0.36 0.00 -0.43 0.00 0.00 0.00 0.00 54.91 54.84 2aiz h ALA 23 Cb 0.61 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.34 2aiz h ALA 23 CO -0.95 -0.10 -2.46 -0.25 0.00 0.00 0.00 179.25 175.48 2aiz n ASP 24 N -2.45 1.97 0.32 0.00 9.92 0.33 -3.52 116.55 123.11 2aiz n ASP 24 Ca -0.02 0.17 0.18 0.00 -0.53 0.00 0.00 54.79 54.59 2aiz n ASP 24 Cb 0.17 -0.68 0.97 0.00 -0.64 0.00 0.00 41.12 40.94 2aiz n ASP 24 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 2aiz h LEU 25 N -0.61 0.00 0.00 0.64 3.38 -0.17 0.78 115.31 119.34 2aiz h LEU 25 Ca -0.64 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.33 2aiz h LEU 25 Cb 1.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.47 2aiz h LEU 25 CO -0.28 0.00 -0.90 0.00 0.09 0.00 0.00 178.44 177.35 2aiz n GLN 26 N -3.09 1.87 -0.01 1.13 6.02 -0.74 -4.04 117.38 118.53 2aiz n GLN 26 Ca -0.02 -0.03 -0.00 0.00 -0.01 0.00 0.00 57.00 56.94 2aiz n GLN 26 Cb 0.27 -1.21 -0.01 0.00 1.02 0.00 0.00 30.24 30.30 2aiz n GLN 26 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 2aiz n GLN 27 N -1.49 3.10 -0.01 -1.09 7.27 -0.30 -4.94 117.38 119.92 2aiz n GLN 27 Ca 0.01 -0.00 -0.04 0.00 0.07 0.00 0.00 57.00 57.05 2aiz n GLN 27 Cb 0.26 -1.03 -0.01 0.00 2.41 0.00 0.00 30.24 31.86 2aiz n GLN 27 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2aiz n ARG 28 N -1.96 0.08 -3.64 3.69 1.74 0.26 -4.97 116.66 111.87 2aiz n ARG 28 Ca -0.02 0.04 -0.39 0.00 -0.77 0.00 0.00 57.85 56.71 2aiz n ARG 28 Cb 0.45 -0.64 -0.09 0.00 -1.02 0.00 0.00 32.46 31.16 2aiz n ARG 28 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2aiz s TYR 29 N -2.09 3.49 0.00 -1.55 2.02 -0.70 -4.72 117.35 113.81 2aiz s TYR 29 Ca -0.05 -2.23 0.00 0.00 -0.37 0.00 0.00 57.07 54.42 2aiz s TYR 29 Cb 0.02 -3.38 0.00 0.00 -0.40 0.00 0.00 41.96 38.20 2aiz s TYR 29 CO 0.07 -0.95 0.12 0.27 -1.57 0.00 0.00 175.55 173.48 2aiz n ASN 30 N 4.42 0.00 -4.21 2.29 2.04 -1.26 -4.41 115.26 114.13 2aiz n ASN 30 Ca -0.01 -0.77 -0.32 0.00 -0.44 0.00 0.00 54.58 53.05 2aiz n ASN 30 Cb 0.41 0.00 -0.17 0.00 -2.53 0.00 0.00 39.78 37.49 2aiz n ASN 30 CO 0.00 0.00 0.00 -0.89 -0.44 0.00 0.00 177.26 175.93 2aiz s THR 31 N 0.00 2.02 -0.05 5.53 2.01 -1.26 -2.05 115.64 121.84 2aiz s THR 31 Ca 0.00 -1.00 0.01 0.00 0.31 0.00 0.00 61.69 61.01 2aiz s THR 31 Cb 0.00 -1.74 -0.03 0.00 0.01 0.00 0.00 72.50 70.73 2aiz s THR 31 CO 0.00 0.55 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.76 2aiz s VAL 32 N 0.35 3.99 -0.22 3.82 1.01 -0.98 -4.98 120.40 123.38 2aiz s VAL 32 Ca -0.19 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.30 2aiz s VAL 32 Cb -0.18 -2.69 0.02 0.00 0.00 0.00 0.00 36.38 33.53 2aiz s VAL 32 CO 0.09 0.52 -0.11 -0.31 0.00 0.00 0.00 175.10 175.29 2aiz s TYR 33 N -0.92 2.95 0.45 5.22 1.51 -1.26 -0.92 117.35 124.38 2aiz s TYR 33 Ca 0.15 -1.48 0.04 0.00 -1.01 0.00 0.00 57.07 54.77 2aiz s TYR 33 Cb -0.11 -2.02 0.01 0.00 -0.11 0.00 0.00 41.96 39.73 2aiz s TYR 33 CO 0.05 -0.72 0.64 -0.06 -1.11 0.00 0.00 175.55 174.35 2aiz s PHE 34 N 1.34 2.98 0.01 2.71 0.08 -0.85 -4.83 117.98 119.41 2aiz s PHE 34 Ca 0.03 -0.09 0.00 0.00 0.12 0.00 0.00 56.93 56.98 2aiz s PHE 34 Cb -0.15 -2.41 0.00 0.00 -0.57 0.00 0.00 43.02 39.89 2aiz s PHE 34 CO -0.07 -0.47 0.01 0.41 -0.10 0.00 0.00 175.22 175.00 2aiz n GLY 35 N -2.02 2.01 3.62 4.36 0.00 -1.26 -4.74 105.19 107.15 2aiz n GLY 35 Ca 0.05 -2.13 -0.46 0.00 0.00 0.00 0.00 46.02 43.47 2aiz n GLY 35 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2aiz n PHE 36 N -0.98 2.14 -2.76 1.61 7.35 -1.26 -1.81 117.46 121.76 2aiz n PHE 36 Ca 0.00 -0.05 -0.12 0.00 -0.76 0.00 0.00 57.45 56.52 2aiz n PHE 36 Cb 0.01 -2.68 -0.01 0.00 0.35 0.00 0.00 39.48 37.15 2aiz n PHE 36 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 2aiz n ASP 37 N 8.67 -2.73 -4.83 -2.13 2.03 -1.26 -4.91 116.55 111.38 2aiz n ASP 37 Ca 0.27 0.11 -0.37 0.00 0.52 0.00 0.00 54.79 55.32 2aiz n ASP 37 Cb 0.34 -2.36 -0.06 0.00 -0.72 0.00 0.00 41.12 38.32 2aiz n ASP 37 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2aiz s LYS 38 N -5.33 3.99 -0.49 -0.67 -0.14 -0.75 -5.02 119.74 111.34 2aiz s LYS 38 Ca 0.12 0.50 0.08 0.00 -1.36 0.00 0.00 55.97 55.31 2aiz s LYS 38 Cb -0.07 -3.14 0.36 0.00 -1.68 0.00 0.00 37.83 33.31 2aiz s LYS 38 CO 0.15 0.62 0.92 0.98 -0.76 0.00 0.00 175.35 177.26 2aiz n TYR 39 N 1.46 2.77 -3.73 3.18 9.36 -1.26 -4.59 117.16 124.36 2aiz n TYR 39 Ca -0.10 -3.73 -0.14 0.00 3.32 0.00 0.00 57.90 57.25 2aiz n TYR 39 Cb 0.52 -0.40 -0.08 0.00 -0.63 0.00 0.00 39.34 38.75 2aiz n TYR 39 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2aiz s ASP 40 N -3.20 -0.24 0.25 2.98 -1.08 -1.26 -4.98 116.67 109.14 2aiz s ASP 40 Ca 0.45 0.12 0.05 0.00 -0.52 0.00 0.00 52.55 52.65 2aiz s ASP 40 Cb 0.33 0.35 -0.03 0.00 -1.46 0.00 0.00 42.92 42.11 2aiz s ASP 40 CO -0.12 -0.50 0.34 -0.63 0.52 0.00 0.00 175.17 174.79 2aiz s ILE 41 N -1.53 5.07 -0.08 4.11 1.01 -1.26 -4.82 121.20 123.71 2aiz s ILE 41 Ca -0.12 -1.05 -0.01 0.00 0.00 0.00 0.00 60.65 59.48 2aiz s ILE 41 Cb -0.04 -3.77 -0.03 0.00 0.01 0.00 0.00 42.46 38.63 2aiz s ILE 41 CO 0.04 -0.32 -0.04 0.42 0.00 0.00 0.00 174.94 175.04 2aiz s THR 42 N -2.01 3.98 0.57 2.92 -4.23 -1.26 -4.98 115.64 110.61 2aiz s THR 42 Ca 0.35 -0.37 0.39 0.00 -1.18 0.00 0.00 61.69 60.88 2aiz s THR 42 Cb -0.09 -2.66 0.58 0.00 1.34 0.00 0.00 72.50 71.67 2aiz s THR 42 CO 0.29 0.59 1.63 1.23 -0.54 0.00 0.00 174.62 177.82 2aiz h GLY 43 N 5.37 0.00 1.82 3.99 0.00 -1.99 1.02 103.07 113.28 2aiz h GLY 43 Ca -0.48 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.78 2aiz h GLY 43 CO 0.54 0.00 -0.26 -2.09 0.00 0.00 0.00 176.54 174.74 2aiz h GLU 44 N 0.00 0.21 -0.29 4.80 4.81 -2.03 -2.90 114.58 119.18 2aiz h GLU 44 Ca 0.65 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.81 2aiz h GLU 44 Cb 2.84 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 32.21 2aiz h GLU 44 CO -0.01 0.46 0.00 0.66 -0.73 0.00 0.00 179.01 179.40 2aiz n TYR 45 N -4.16 0.38 0.12 0.92 4.01 0.34 -4.47 117.16 114.30 2aiz n TYR 45 Ca -0.01 -0.28 -0.02 0.00 -0.16 0.00 0.00 57.90 57.43 2aiz n TYR 45 Cb 0.36 -0.01 0.07 0.00 -0.31 0.00 0.00 39.34 39.45 2aiz n TYR 45 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2aiz h VAL 46 N 3.09 1.39 -0.75 -0.72 2.07 -1.06 -3.26 116.25 117.01 2aiz h VAL 46 Ca 0.00 -2.54 0.07 0.00 0.82 0.00 0.00 66.70 65.05 2aiz h VAL 46 Cb 0.77 2.42 -0.05 0.00 -1.52 0.00 0.00 31.29 32.91 2aiz h VAL 46 CO 0.00 0.70 0.49 0.06 0.02 0.00 0.00 177.57 178.84 2aiz h GLN 47 N 0.00 0.74 -0.40 1.57 -0.00 -1.78 -1.73 115.11 113.50 2aiz h GLN 47 Ca -0.01 -0.04 0.02 0.00 -0.00 0.00 0.00 58.65 58.62 2aiz h GLN 47 Cb 1.36 -0.17 -0.03 0.00 -0.00 0.00 0.00 27.48 28.65 2aiz h GLN 47 CO 0.09 0.49 0.24 0.82 -0.00 0.00 0.00 178.83 180.47 2aiz h ILE 48 N 0.76 1.04 -0.91 1.86 2.04 -1.88 0.76 117.51 121.17 2aiz h ILE 48 Ca 0.33 -0.16 0.01 0.00 1.00 0.00 0.00 64.86 66.04 2aiz h ILE 48 Cb 0.31 0.52 -0.05 0.00 -0.74 0.00 0.00 36.82 36.86 2aiz h ILE 48 CO -0.12 0.09 0.60 -0.07 0.00 0.00 0.00 178.15 178.66 2aiz h LEU 49 N 0.48 1.04 -0.01 1.44 3.38 -1.49 0.45 115.31 120.59 2aiz h LEU 49 Ca 0.16 -0.02 -0.14 0.00 0.09 0.00 0.00 57.88 57.97 2aiz h LEU 49 Cb 0.01 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.52 2aiz h LEU 49 CO -0.08 0.74 -0.55 0.44 0.09 0.00 0.00 178.44 179.09 2aiz h ASP 50 N 1.22 0.49 0.01 -0.43 5.19 -0.78 -1.89 116.42 120.23 2aiz h ASP 50 Ca 0.34 -0.76 -0.00 0.00 -0.62 0.00 0.00 57.03 55.99 2aiz h ASP 50 Cb -0.11 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.25 2aiz h ASP 50 CO -0.08 1.18 -0.00 0.00 -3.12 0.00 0.00 179.24 177.22 2aiz h ALA 51 N 0.32 -0.01 -0.60 3.45 0.00 0.72 -2.31 119.26 120.84 2aiz h ALA 51 Ca -0.07 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.71 2aiz h ALA 51 Cb 1.26 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.02 2aiz h ALA 51 CO 0.11 -0.36 0.39 0.45 0.00 0.00 0.00 179.25 179.84 2aiz h HIS 52 N -0.30 0.73 -0.64 0.00 3.86 -0.22 -1.16 115.15 117.43 2aiz h HIS 52 Ca -0.00 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 2aiz h HIS 52 Cb 0.29 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 28.48 2aiz h HIS 52 CO 0.02 0.45 0.36 0.00 0.86 0.00 0.00 177.93 179.63 2aiz h ALA 53 N 1.63 1.42 -0.43 2.45 0.00 -1.08 1.03 119.26 124.29 2aiz h ALA 53 Ca 0.22 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2aiz h ALA 53 Cb -0.06 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 2aiz h ALA 53 CO -0.05 0.48 -0.22 0.00 0.00 0.00 0.00 179.25 179.46 2aiz h ALA 54 N 1.50 0.60 0.06 0.00 0.00 -0.66 -1.56 119.26 119.20 2aiz h ALA 54 Ca 0.23 -0.39 -0.24 0.00 0.00 0.00 0.00 54.91 54.52 2aiz h ALA 54 Cb 0.01 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2aiz h ALA 54 CO -0.04 0.58 -1.06 -0.92 0.00 0.00 0.00 179.25 177.82 2aiz h TYR 55 N 0.73 0.43 -0.53 0.00 3.20 -0.93 -2.32 116.97 117.55 2aiz h TYR 55 Ca 0.09 -0.28 -0.11 0.00 3.14 0.00 0.00 58.73 61.58 2aiz h TYR 55 Cb 0.79 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 39.01 2aiz h TYR 55 CO 0.06 1.15 -0.08 1.25 -1.64 0.00 0.00 178.16 178.90 2aiz h LEU 56 N 0.11 0.99 -0.48 2.82 5.85 0.11 -2.63 115.31 122.10 2aiz h LEU 56 Ca -0.09 -0.34 -0.17 0.00 0.84 0.00 0.00 57.88 58.12 2aiz h LEU 56 Cb 1.74 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 42.50 2aiz h LEU 56 CO 0.17 1.10 -0.69 -1.13 -0.34 0.00 0.00 178.44 177.56 2aiz h ASN 57 N 0.87 0.42 0.31 1.25 -1.24 -1.35 -2.98 115.58 112.87 2aiz h ASN 57 Ca 0.14 -0.26 -0.01 0.00 0.71 0.00 0.00 56.30 56.88 2aiz h ASN 57 Cb 0.64 -0.12 -0.00 0.00 0.73 0.00 0.00 38.32 39.57 2aiz h ASN 57 CO 0.04 0.98 -0.05 0.00 -1.29 0.00 0.00 177.43 177.12 2aiz h ALA 58 N 1.01 1.18 -3.11 1.57 0.00 -1.20 -3.39 119.26 115.33 2aiz h ALA 58 Ca -0.02 -0.04 -0.67 0.00 0.00 0.00 0.00 54.91 54.17 2aiz h ALA 58 Cb 1.24 -0.01 -0.28 0.00 0.00 0.00 0.00 17.79 18.74 2aiz h ALA 58 CO 0.11 0.06 -0.67 0.95 0.00 0.00 0.00 179.25 179.71 2aiz s THR 59 N -4.15 3.57 0.09 0.00 -4.23 -1.01 -4.90 115.64 105.01 2aiz s THR 59 Ca -0.03 -0.79 -0.27 0.00 -1.18 0.00 0.00 61.69 59.42 2aiz s THR 59 Cb 0.13 -2.82 -0.11 0.00 1.34 0.00 0.00 72.50 71.04 2aiz s THR 59 CO 0.52 0.14 1.44 -0.65 -0.54 0.00 0.00 174.62 175.53 2aiz h PRO 60 N 8.15 -0.48 -0.92 3.99 0.11 -1.81 -2.31 132.00 138.73 2aiz h PRO 60 Ca -0.32 0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.72 2aiz h PRO 60 Cb 1.12 0.11 -0.06 0.00 0.11 0.00 0.00 31.00 32.28 2aiz h PRO 60 CO 0.59 -0.32 0.13 0.00 -0.21 0.00 0.00 178.00 178.19 2aiz n ALA 61 N -2.90 3.37 -2.64 -0.75 0.00 -1.26 -4.87 120.51 111.46 2aiz n ALA 61 Ca -0.05 -0.92 -0.40 0.00 0.00 0.00 0.00 53.44 52.07 2aiz n ALA 61 Cb 0.31 -1.11 -0.07 0.00 0.00 0.00 0.00 19.45 18.58 2aiz n ALA 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2aiz s ALA 62 N -1.46 3.57 -0.05 0.00 0.00 -0.87 -5.05 121.76 117.89 2aiz s ALA 62 Ca 0.21 -0.45 0.03 0.00 0.00 0.00 0.00 51.96 51.76 2aiz s ALA 62 Cb 0.17 -2.90 0.01 0.00 0.00 0.00 0.00 23.12 20.40 2aiz s ALA 62 CO 0.05 -0.61 -0.13 0.15 0.00 0.00 0.00 175.76 175.22 2aiz s LYS 63 N 2.02 1.63 0.08 0.00 1.02 -1.26 -4.79 119.74 118.44 2aiz s LYS 63 Ca 0.24 -0.47 -0.08 0.00 0.02 0.00 0.00 55.97 55.69 2aiz s LYS 63 Cb -0.16 -1.38 -0.05 0.00 -0.52 0.00 0.00 37.83 35.72 2aiz s LYS 63 CO 0.09 0.11 0.36 0.54 -0.92 0.00 0.00 175.35 175.54 2aiz s VAL 64 N 0.38 5.17 -0.40 3.17 0.11 0.14 -4.67 120.40 124.30 2aiz s VAL 64 Ca -0.09 0.26 -0.06 0.00 -2.93 0.00 0.00 61.98 59.16 2aiz s VAL 64 Cb -0.13 -3.62 0.09 0.00 -1.53 0.00 0.00 36.38 31.19 2aiz s VAL 64 CO 0.03 0.23 0.20 -0.22 -3.33 0.00 0.00 175.10 172.02 2aiz s LEU 65 N -2.09 5.02 -0.84 2.54 0.20 0.52 -1.77 118.68 122.27 2aiz s LEU 65 Ca 0.34 -1.68 -0.23 0.00 0.69 0.00 0.00 54.13 53.26 2aiz s LEU 65 Cb -0.13 -1.89 0.07 0.00 -0.43 0.00 0.00 46.19 43.81 2aiz s LEU 65 CO 0.19 -0.51 1.21 -0.69 -0.29 0.00 0.00 176.35 176.27 2aiz s VAL 66 N 1.29 4.16 -0.26 1.68 1.01 0.30 0.12 120.40 128.70 2aiz s VAL 66 Ca 0.04 -0.57 -0.21 0.00 0.00 0.00 0.00 61.98 61.25 2aiz s VAL 66 Cb -0.23 -4.86 -0.02 0.00 0.00 0.00 0.00 36.38 31.27 2aiz s VAL 66 CO -0.01 -1.69 0.64 -0.70 0.00 0.00 0.00 175.10 173.34 2aiz s GLU 67 N 4.39 4.09 0.18 2.72 2.12 -0.16 -1.68 118.70 130.37 2aiz s GLU 67 Ca 0.34 0.55 -0.14 0.00 0.36 0.00 0.00 54.97 56.08 2aiz s GLU 67 Cb -0.07 -3.66 -0.07 0.00 0.26 0.00 0.00 34.13 30.59 2aiz s GLU 67 CO 0.01 -0.44 0.58 0.20 -0.54 0.00 0.00 175.26 175.08 2aiz s GLY 68 N 1.48 2.45 0.08 -1.50 0.00 0.30 0.03 107.32 110.17 2aiz s GLY 68 Ca 0.27 -0.10 -0.04 0.00 0.00 0.00 0.00 44.72 44.85 2aiz s GLY 68 CO 0.09 0.16 0.07 -1.31 0.00 0.00 0.00 173.10 172.11 2aiz s ASN 69 N -1.83 0.32 0.00 1.64 0.02 0.41 -2.02 114.94 113.48 2aiz s ASN 69 Ca 0.41 -0.94 0.00 0.00 -1.02 0.00 0.00 52.86 51.31 2aiz s ASN 69 Cb -0.14 0.27 0.00 0.00 0.02 0.00 0.00 41.25 41.40 2aiz s ASN 69 CO 0.20 -0.68 0.00 0.35 0.02 0.00 0.00 177.10 176.98 2aiz n THR 70 N -0.00 0.00 -0.85 1.60 -2.24 -1.05 -2.43 114.28 109.31 2aiz n THR 70 Ca -0.12 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.34 2aiz n THR 70 Cb 0.62 0.00 0.14 0.00 -2.10 0.00 0.00 70.33 68.99 2aiz n THR 70 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2aiz n ASP 71 N -0.74 0.03 0.08 3.42 9.92 -1.26 -4.49 116.55 123.51 2aiz n ASP 71 Ca 0.00 0.46 -0.07 0.00 -0.53 0.00 0.00 54.79 54.65 2aiz n ASP 71 Cb 0.00 -1.43 -0.04 0.00 -0.64 0.00 0.00 41.12 39.01 2aiz n ASP 71 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2aiz h GLU 72 N -1.48 0.06 -6.56 -1.24 3.07 -1.90 -3.26 114.58 103.28 2aiz h GLU 72 Ca -0.44 -0.08 -0.53 0.00 -0.50 0.00 0.00 59.36 57.81 2aiz h GLU 72 Cb 1.28 0.03 0.03 0.00 -0.84 0.00 0.00 28.75 29.25 2aiz h GLU 72 CO 0.41 0.93 0.85 1.03 -1.40 0.00 0.00 179.01 180.84 2aiz s ARG 73 N -2.99 4.24 0.00 2.33 3.00 -1.26 -4.57 118.95 119.70 2aiz s ARG 73 Ca -0.01 2.27 0.00 0.00 0.00 0.00 0.00 55.73 57.99 2aiz s ARG 73 Cb 0.10 -3.26 0.00 0.00 0.00 0.00 0.00 34.95 31.79 2aiz s ARG 73 CO 0.81 -0.58 0.00 0.41 0.00 0.00 0.00 175.30 175.95 2aiz n GLY 74 N 3.72 -0.23 3.77 -3.53 0.00 -1.26 -4.92 105.19 102.73 2aiz n GLY 74 Ca 0.13 -2.29 -0.33 0.00 0.00 0.00 0.00 46.02 43.53 2aiz n GLY 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2aiz s THR 75 N -1.00 4.67 0.27 2.61 -4.23 -1.26 -4.86 115.64 111.84 2aiz s THR 75 Ca 0.00 -0.37 -0.07 0.00 -1.18 0.00 0.00 61.69 60.07 2aiz s THR 75 Cb 0.00 -3.10 0.44 0.00 1.34 0.00 0.00 72.50 71.18 2aiz s THR 75 CO 0.00 0.40 1.51 -2.65 -0.54 0.00 0.00 174.62 173.35 2aiz n PRO 76 N 1.38 -0.09 -0.26 3.99 -0.02 -1.26 0.12 135.00 138.87 2aiz n PRO 76 Ca -0.14 1.51 0.01 0.00 -2.02 0.00 0.00 63.50 62.85 2aiz n PRO 76 Cb 0.53 -2.26 0.13 0.00 -0.02 0.00 0.00 33.50 31.88 2aiz n PRO 76 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2aiz h GLU 77 N 0.00 0.69 -0.12 -0.52 4.39 -1.97 0.72 114.58 117.77 2aiz h GLU 77 Ca 0.48 -0.04 -0.09 0.00 0.34 0.00 0.00 59.36 60.04 2aiz h GLU 77 Cb 0.76 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 2aiz h GLU 77 CO -0.99 0.46 -0.28 -0.92 -1.16 0.00 0.00 179.01 176.12 2aiz h TYR 78 N 0.71 0.51 0.00 4.33 5.03 -0.72 -2.65 116.97 124.18 2aiz h TYR 78 Ca 0.35 -0.19 0.00 0.00 2.58 0.00 0.00 58.73 61.46 2aiz h TYR 78 Cb 0.29 -0.09 0.00 0.00 1.55 0.00 0.00 36.73 38.47 2aiz h TYR 78 CO -0.08 0.90 0.00 0.09 -1.32 0.00 0.00 178.16 177.75 2aiz n ASN 79 N -4.43 0.00 -0.21 -2.11 4.13 0.27 -1.95 115.26 110.97 2aiz n ASN 79 Ca -0.07 0.39 0.09 0.00 1.68 0.00 0.00 54.58 56.67 2aiz n ASN 79 Cb 0.46 -0.17 0.18 0.00 -1.54 0.00 0.00 39.78 38.71 2aiz n ASN 79 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2aiz n ILE 80 N -1.01 -0.25 0.30 2.41 -0.00 0.25 0.59 119.36 121.64 2aiz n ILE 80 Ca 0.00 1.31 -0.15 0.00 -0.00 0.00 0.00 62.75 63.91 2aiz n ILE 80 Cb 0.00 -1.92 -0.08 0.00 -0.00 0.00 0.00 39.64 37.64 2aiz n ILE 80 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2aiz h ALA 81 N 1.19 -0.76 -0.66 -1.39 0.00 -1.54 0.99 119.26 117.09 2aiz h ALA 81 Ca 0.37 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 55.21 2aiz h ALA 81 Cb 0.76 0.29 -0.10 0.00 0.00 0.00 0.00 17.79 18.75 2aiz h ALA 81 CO -0.56 -0.82 0.13 1.25 0.00 0.00 0.00 179.25 179.25 2aiz h LEU 82 N -0.97 -0.04 -0.32 0.00 7.12 0.82 -0.46 115.31 121.47 2aiz h LEU 82 Ca -0.08 0.13 -0.08 0.00 0.13 0.00 0.00 57.88 57.98 2aiz h LEU 82 Cb 0.65 0.19 -0.01 0.00 -0.53 0.00 0.00 40.66 40.95 2aiz h LEU 82 CO 0.13 -0.03 -0.12 1.23 -0.13 0.00 0.00 178.44 179.52 2aiz h GLY 83 N 0.24 0.71 0.25 3.75 0.00 -0.64 -2.75 103.07 104.63 2aiz h GLY 83 Ca 0.36 -0.61 0.19 0.00 0.00 0.00 0.00 47.33 47.27 2aiz h GLY 83 CO -0.46 0.56 0.61 -1.61 0.00 0.00 0.00 176.54 175.63 2aiz h GLN 84 N 0.42 0.59 0.08 4.80 5.75 0.23 0.72 115.11 127.71 2aiz h GLN 84 Ca 0.08 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.54 2aiz h GLN 84 Cb 0.63 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 29.05 2aiz h GLN 84 CO 0.04 0.39 -0.04 -0.09 -2.65 0.00 0.00 178.83 176.48 2aiz h ARG 85 N 0.60 -0.11 -0.97 1.69 2.43 -0.92 0.15 114.38 117.25 2aiz h ARG 85 Ca 0.52 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.74 2aiz h ARG 85 Cb 1.00 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 30.52 2aiz h ARG 85 CO -0.27 0.15 0.64 0.00 -1.51 0.00 0.00 179.97 178.98 2aiz h ARG 86 N -0.36 1.17 -0.29 0.20 3.08 -0.69 0.41 114.38 117.90 2aiz h ARG 86 Ca -0.01 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2aiz h ARG 86 Cb 0.31 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 2aiz h ARG 86 CO 0.02 0.78 0.19 0.00 -1.07 0.00 0.00 179.97 179.89 2aiz h ALA 87 N 1.44 1.80 -0.09 0.04 0.00 0.70 0.29 119.26 123.44 2aiz h ALA 87 Ca 0.40 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.20 2aiz h ALA 87 Cb 0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2aiz h ALA 87 CO -0.13 0.19 -0.34 -0.44 0.00 0.00 0.00 179.25 178.52 2aiz h ASP 88 N 0.39 0.17 0.54 0.00 5.19 0.27 -1.71 116.42 121.27 2aiz h ASP 88 Ca 0.11 -0.06 -0.03 0.00 -0.62 0.00 0.00 57.03 56.43 2aiz h ASP 88 Cb -0.04 -0.05 0.01 0.00 0.18 0.00 0.00 39.33 39.43 2aiz h ASP 88 CO -0.02 0.51 -0.26 0.00 -3.12 0.00 0.00 179.24 176.35 2aiz h ALA 89 N 1.50 -0.73 -0.41 3.45 0.00 0.97 -0.67 119.26 123.37 2aiz h ALA 89 Ca 0.02 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 2aiz h ALA 89 Cb 0.68 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2aiz h ALA 89 CO 0.05 -0.90 -0.00 0.28 0.00 0.00 0.00 179.25 178.68 2aiz h VAL 90 N -0.75 1.22 -0.90 0.00 2.07 -1.39 -1.78 116.25 114.72 2aiz h VAL 90 Ca -0.07 -0.90 -0.01 0.00 0.82 0.00 0.00 66.70 66.53 2aiz h VAL 90 Cb 0.57 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 31.21 2aiz h VAL 90 CO 0.12 0.31 0.51 0.50 0.02 0.00 0.00 177.57 179.04 2aiz h LYS 91 N 0.62 1.25 0.00 1.57 3.11 -1.10 -1.71 116.57 120.31 2aiz h LYS 91 Ca 0.13 -0.13 -0.07 0.00 -2.81 0.00 0.00 60.65 57.76 2aiz h LYS 91 Cb 0.39 -0.25 -0.01 0.00 -1.00 0.00 0.00 32.23 31.36 2aiz h LYS 91 CO 0.01 0.90 -0.35 0.78 -2.81 0.00 0.00 179.45 177.98 2aiz h GLY 92 N 1.26 0.00 0.86 5.01 0.00 -0.75 -2.30 103.07 107.14 2aiz h GLY 92 Ca 0.32 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.62 2aiz h GLY 92 CO -0.05 0.00 -0.34 -1.82 0.00 0.00 0.00 176.54 174.32 2aiz h TYR 93 N 0.00 -0.89 -0.23 5.60 5.03 -0.45 0.48 116.97 126.52 2aiz h TYR 93 Ca -0.00 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.27 2aiz h TYR 93 Cb 1.06 0.29 -0.01 0.00 1.55 0.00 0.00 36.73 39.63 2aiz h TYR 93 CO 0.00 -0.53 0.09 -0.07 -1.32 0.00 0.00 178.16 176.33 2aiz h LEU 94 N -1.12 0.28 -0.59 2.82 3.38 -1.49 -1.64 115.31 116.95 2aiz h LEU 94 Ca -0.10 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2aiz h LEU 94 Cb 0.76 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 2aiz h LEU 94 CO 0.16 0.27 0.32 0.00 0.09 0.00 0.00 178.44 179.28 2aiz h ALA 95 N 1.78 0.76 0.00 1.53 0.00 -1.11 -1.57 119.26 120.65 2aiz h ALA 95 Ca 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2aiz h ALA 95 Cb 0.08 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 2aiz h ALA 95 CO -0.01 0.28 -0.06 0.78 0.00 0.00 0.00 179.25 180.24 2aiz h GLY 96 N 0.80 0.00 2.00 0.00 0.00 0.01 -2.37 103.07 103.51 2aiz h GLY 96 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 2aiz h GLY 96 CO -0.03 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.79 2aiz n LYS 97 N -3.19 0.04 0.00 4.80 5.02 -0.68 -4.88 118.16 119.27 2aiz n LYS 97 Ca 0.00 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 2aiz n LYS 97 Cb 0.33 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 2aiz n LYS 97 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2aiz n GLY 98 N 1.24 1.13 3.70 0.72 0.00 -0.89 -5.09 105.19 105.99 2aiz n GLY 98 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2aiz n GLY 98 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aiz s VAL 99 N -2.00 4.63 0.41 1.61 1.01 -0.69 -5.00 120.40 120.36 2aiz s VAL 99 Ca 0.00 1.89 -0.26 0.00 0.00 0.00 0.00 61.98 63.62 2aiz s VAL 99 Cb 0.00 -4.22 -0.08 0.00 0.00 0.00 0.00 36.38 32.08 2aiz s VAL 99 CO 0.00 0.08 1.28 -0.62 0.00 0.00 0.00 175.10 175.84 2aiz s ASP 100 N 1.12 6.30 0.42 3.32 -1.08 -1.26 -4.02 116.67 121.47 2aiz s ASP 100 Ca 0.52 2.60 0.20 0.00 -0.52 0.00 0.00 52.55 55.35 2aiz s ASP 100 Cb -0.22 -2.63 1.14 0.00 -1.46 0.00 0.00 42.92 39.75 2aiz s ASP 100 CO 0.24 -0.85 1.80 0.00 0.52 0.00 0.00 175.17 176.88 2aiz h ALA 101 N 2.61 2.30 -0.00 3.66 0.00 -1.94 0.14 119.26 126.03 2aiz h ALA 101 Ca -0.49 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2aiz h ALA 101 Cb 1.25 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 2aiz h ALA 101 CO 0.62 -0.67 0.02 0.78 0.00 0.00 0.00 179.25 180.00 2aiz h GLY 102 N 0.36 0.00 0.54 0.00 0.00 -2.01 -0.58 103.07 101.38 2aiz h GLY 102 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.88 2aiz h GLY 102 CO -0.23 0.00 -0.68 0.28 0.00 0.00 0.00 176.54 175.91 2aiz n LYS 103 N -3.23 0.07 -4.36 4.80 5.02 0.50 -4.89 118.16 116.06 2aiz n LYS 103 Ca -0.03 -0.05 -0.35 0.00 -2.02 0.00 0.00 58.31 55.87 2aiz n LYS 103 Cb 0.09 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.51 2aiz n LYS 103 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2aiz s LEU 104 N -2.97 3.60 -0.08 -0.35 1.43 -0.23 0.29 118.68 120.37 2aiz s LEU 104 Ca 0.11 0.15 -0.12 0.00 -1.03 0.00 0.00 54.13 53.23 2aiz s LEU 104 Cb 0.17 -1.83 0.03 0.00 0.03 0.00 0.00 46.19 44.59 2aiz s LEU 104 CO 0.75 0.38 0.32 -0.83 0.23 0.00 0.00 176.35 177.20 2aiz s GLY 105 N -0.91 -0.21 0.27 -3.19 0.00 -0.73 -4.93 107.32 97.62 2aiz s GLY 105 Ca 0.14 0.70 0.10 0.00 0.00 0.00 0.00 44.72 45.66 2aiz s GLY 105 CO 0.03 0.55 -0.08 -0.51 0.00 0.00 0.00 173.10 173.08 2aiz s THR 106 N -0.35 3.08 -0.30 0.90 -4.23 -1.26 0.11 115.64 113.59 2aiz s THR 106 Ca -0.05 -2.10 -0.09 0.00 -1.18 0.00 0.00 61.69 58.28 2aiz s THR 106 Cb -0.03 -2.63 0.17 0.00 1.34 0.00 0.00 72.50 71.34 2aiz s THR 106 CO 0.02 -0.38 0.78 -0.69 -0.54 0.00 0.00 174.62 173.81 2aiz s VAL 107 N -2.38 -0.77 -0.10 2.29 1.01 -0.68 -4.90 120.40 114.87 2aiz s VAL 107 Ca 0.31 0.00 -0.00 0.00 0.00 0.00 0.00 61.98 62.29 2aiz s VAL 107 Cb -0.06 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.30 2aiz s VAL 107 CO 0.18 0.00 -0.09 -0.94 0.00 0.00 0.00 175.10 174.25 2aiz s SER 108 N 2.80 4.39 -0.09 3.32 1.04 -1.26 0.11 113.70 124.01 2aiz s SER 108 Ca 0.05 -0.17 0.14 0.00 0.48 0.00 0.00 55.95 56.45 2aiz s SER 108 Cb -0.11 -1.39 0.21 0.00 0.10 0.00 0.00 66.02 64.83 2aiz s SER 108 CO -0.18 0.26 1.10 -1.22 0.98 0.00 0.00 173.24 174.17 2aiz n TYR 109 N 2.92 0.00 0.00 5.02 4.01 -0.86 -4.76 117.16 123.50 2aiz n TYR 109 Ca -0.18 -0.75 0.00 0.00 -0.16 0.00 0.00 57.90 56.81 2aiz n TYR 109 Cb 0.53 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.44 2aiz n TYR 109 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2aiz n GLY 110 N -1.06 0.00 0.55 2.72 0.00 -1.26 0.92 105.19 107.06 2aiz n GLY 110 Ca 0.11 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.21 2aiz n GLY 110 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2aiz n GLU 111 N 0.00 1.70 0.21 1.61 -0.00 -1.23 -4.05 120.64 118.88 2aiz n GLU 111 Ca 0.00 -1.08 -0.17 0.00 -0.00 0.00 0.00 57.16 55.91 2aiz n GLU 111 Cb 0.00 -1.30 -0.10 0.00 -0.00 0.00 0.00 31.44 30.04 2aiz n GLU 111 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 2aiz h GLU 112 N 1.91 -0.84 -2.40 3.44 4.57 0.20 -3.39 114.58 118.07 2aiz h GLU 112 Ca 0.00 0.06 -0.53 0.00 -1.18 0.00 0.00 59.36 57.71 2aiz h GLU 112 Cb 0.43 0.19 -0.37 0.00 -0.16 0.00 0.00 28.75 28.84 2aiz h GLU 112 CO 0.00 -0.56 -0.82 0.15 -1.18 0.00 0.00 179.01 176.60 2aiz s LYS 113 N -5.72 0.60 1.10 1.92 1.02 -1.22 -5.15 119.74 112.29 2aiz s LYS 113 Ca -0.17 -1.27 -0.12 0.00 0.02 0.00 0.00 55.97 54.43 2aiz s LYS 113 Cb 0.05 -1.15 0.25 0.00 -0.52 0.00 0.00 37.83 36.46 2aiz s LYS 113 CO 0.59 -1.22 1.06 -2.14 -0.92 0.00 0.00 175.35 172.71 2aiz s PRO 114 N 1.08 -0.46 -0.08 -1.68 0.02 -1.26 -5.03 135.00 127.59 2aiz s PRO 114 Ca 0.19 1.02 -0.10 0.00 0.02 0.00 0.00 61.00 62.13 2aiz s PRO 114 Cb -0.19 -1.59 -0.03 0.00 0.02 0.00 0.00 34.50 32.70 2aiz s PRO 114 CO -0.01 -3.47 -0.19 0.00 -0.33 0.00 0.00 177.00 173.00 2aiz n ALA 115 N -4.76 1.12 -2.56 -1.55 0.00 -1.26 -4.92 120.51 106.58 2aiz n ALA 115 Ca 0.05 -0.51 -0.43 0.00 0.00 0.00 0.00 53.44 52.56 2aiz n ALA 115 Cb 0.54 0.05 -0.06 0.00 0.00 0.00 0.00 19.45 19.98 2aiz n ALA 115 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2aiz s VAL 116 N -2.19 4.74 0.31 0.00 1.01 -1.26 -5.03 120.40 117.98 2aiz s VAL 116 Ca -0.16 0.55 -0.29 0.00 0.00 0.00 0.00 61.98 62.08 2aiz s VAL 116 Cb 0.02 -4.23 -0.10 0.00 0.00 0.00 0.00 36.38 32.07 2aiz s VAL 116 CO 0.23 -0.54 1.40 -0.22 0.00 0.00 0.00 175.10 175.97 2aiz s LEU 117 N 3.06 4.39 0.00 3.92 2.96 -1.26 -4.82 118.68 126.94 2aiz s LEU 117 Ca 0.28 2.75 0.00 0.00 -0.22 0.00 0.00 54.13 56.95 2aiz s LEU 117 Cb -0.13 -3.64 0.00 0.00 0.50 0.00 0.00 46.19 42.92 2aiz s LEU 117 CO 0.19 -0.67 0.00 0.61 -1.32 0.00 0.00 176.35 175.16 2aiz n GLY 118 N 1.31 1.58 2.21 7.98 0.00 -1.26 -4.92 105.19 112.09 2aiz n GLY 118 Ca 0.03 -2.19 -0.18 0.00 0.00 0.00 0.00 46.02 43.68 2aiz n GLY 118 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2aiz n HIS 119 N -1.17 0.03 -4.19 1.61 1.44 -1.26 -4.74 115.22 106.95 2aiz n HIS 119 Ca 0.00 -3.74 -0.15 0.00 -2.01 0.00 0.00 57.72 51.82 2aiz n HIS 119 Cb 0.00 -0.33 -0.11 0.00 0.12 0.00 0.00 29.99 29.67 2aiz n HIS 119 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2aiz s ASP 120 N -2.32 1.56 0.54 4.39 1.11 -1.26 -4.94 116.67 115.76 2aiz s ASP 120 Ca 0.39 -0.82 0.48 0.00 0.18 0.00 0.00 52.55 52.78 2aiz s ASP 120 Cb 0.34 -0.01 1.71 0.00 1.07 0.00 0.00 42.92 46.03 2aiz s ASP 120 CO -0.08 -0.24 1.58 -0.33 1.18 0.00 0.00 175.17 177.28 2aiz h GLU 121 N 3.54 0.00 0.29 8.23 4.39 -1.99 0.60 114.58 129.64 2aiz h GLU 121 Ca -0.38 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.31 2aiz h GLU 121 Cb 1.19 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.84 2aiz h GLU 121 CO 0.53 0.00 -0.14 0.00 -1.16 0.00 0.00 179.01 178.24 2aiz h ALA 122 N 1.09 -0.39 -0.34 3.43 0.00 -1.98 -0.75 119.26 120.32 2aiz h ALA 122 Ca 0.93 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 55.57 2aiz h ALA 122 Cb 3.63 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 21.56 2aiz h ALA 122 CO -0.07 -0.43 -0.14 0.00 0.00 0.00 0.00 179.25 178.61 2aiz h ALA 123 N -0.65 0.48 -0.78 0.00 0.00 -1.07 -2.41 119.26 114.83 2aiz h ALA 123 Ca -0.04 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 2aiz h ALA 123 Cb 0.49 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 2aiz h ALA 123 CO 0.07 0.37 0.35 1.88 0.00 0.00 0.00 179.25 181.92 2aiz h TYR 124 N 0.48 1.15 -0.24 0.00 0.05 -0.08 -1.66 116.97 116.67 2aiz h TYR 124 Ca 0.08 -0.07 -0.06 0.00 0.05 0.00 0.00 58.73 58.73 2aiz h TYR 124 Cb 0.67 -0.35 -0.01 0.00 1.01 0.00 0.00 36.73 38.04 2aiz h TYR 124 CO 0.06 0.85 -0.13 0.77 -1.05 0.00 0.00 178.16 178.66 2aiz h SER 125 N 1.12 0.38 1.08 3.88 0.02 -1.04 -0.06 113.55 118.94 2aiz h SER 125 Ca 0.27 -0.09 -0.07 0.00 -0.84 0.00 0.00 61.79 61.06 2aiz h SER 125 Cb 0.15 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 2aiz h SER 125 CO -0.03 0.54 -0.31 0.11 -1.14 0.00 0.00 176.83 176.00 2aiz h LYS 126 N 0.37 0.00 0.01 3.45 1.57 -0.84 -3.23 116.57 117.90 2aiz h LYS 126 Ca 0.07 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.55 2aiz h LYS 126 Cb 0.45 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.71 2aiz h LYS 126 CO 0.03 0.31 -1.76 0.09 -0.57 0.00 0.00 179.45 177.55 2aiz n ASN 127 N -3.37 0.95 -4.56 0.86 3.02 -0.70 -4.72 115.26 106.74 2aiz n ASN 127 Ca 0.01 0.38 -0.24 0.00 -0.03 0.00 0.00 54.58 54.71 2aiz n ASN 127 Cb 0.52 -0.10 -0.06 0.00 -0.61 0.00 0.00 39.78 39.54 2aiz n ASN 127 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2aiz s ARG 128 N -2.59 2.30 0.09 3.52 0.52 -0.10 -2.54 118.95 120.15 2aiz s ARG 128 Ca -0.06 -0.22 -0.24 0.00 -0.52 0.00 0.00 55.73 54.68 2aiz s ARG 128 Cb 0.08 -5.02 0.07 0.00 0.52 0.00 0.00 34.95 30.59 2aiz s ARG 128 CO 0.82 -3.74 0.60 -0.98 0.02 0.00 0.00 175.30 172.01 2aiz s ARG 129 N 7.40 1.18 -0.34 3.54 1.70 -1.02 -2.00 118.95 129.42 2aiz s ARG 129 Ca 0.75 -0.28 0.02 0.00 -0.47 0.00 0.00 55.73 55.75 2aiz s ARG 129 Cb -0.07 0.55 0.10 0.00 -0.57 0.00 0.00 34.95 34.96 2aiz s ARG 129 CO 0.03 -0.47 0.09 0.00 -1.08 0.00 0.00 175.30 173.86 2aiz s ALA 130 N -2.98 2.28 -0.34 7.88 0.00 -0.10 0.15 121.76 128.66 2aiz s ALA 130 Ca -0.03 -2.19 -0.16 0.00 0.00 0.00 0.00 51.96 49.59 2aiz s ALA 130 Cb -0.01 -1.82 -0.01 0.00 0.00 0.00 0.00 23.12 21.28 2aiz s ALA 130 CO -0.06 -1.71 0.41 0.08 0.00 0.00 0.00 175.76 174.48 2aiz s VAL 131 N 1.15 5.12 -0.18 0.00 1.01 0.10 -2.33 120.40 125.28 2aiz s VAL 131 Ca 0.11 0.20 -0.24 0.00 0.00 0.00 0.00 61.98 62.04 2aiz s VAL 131 Cb -0.19 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 2aiz s VAL 131 CO -0.15 -0.10 0.78 -1.48 0.00 0.00 0.00 175.10 174.15 2aiz s LEU 132 N 2.13 4.17 0.08 3.92 0.05 -0.87 -0.99 118.68 127.17 2aiz s LEU 132 Ca 0.14 1.08 0.05 0.00 0.05 0.00 0.00 54.13 55.45 2aiz s LEU 132 Cb -0.16 -3.14 -0.03 0.00 -2.05 0.00 0.00 46.19 40.81 2aiz s LEU 132 CO 0.12 -0.36 -0.12 0.00 -0.55 0.00 0.00 176.35 175.43 2aiz s ALA 133 N 2.08 1.13 -2.53 1.48 0.00 0.31 -4.83 121.76 119.40 2aiz s ALA 133 Ca 0.36 -1.05 0.28 0.00 0.00 0.00 0.00 51.96 51.54 2aiz s ALA 133 Cb -0.16 -0.05 0.99 0.00 0.00 0.00 0.00 23.12 23.90 2aiz s ALA 133 CO 0.12 0.09 1.71 0.66 0.00 0.00 0.00 175.76 178.34