#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 4.15 -0.37 0.00 0.01 -1.26 -5.09 113.70 111.14 2aiz s SER 2 Ca 0.00 -0.63 -0.25 0.00 1.31 0.00 0.00 55.95 56.38 2aiz s SER 2 Cb 0.00 -0.66 0.01 0.00 0.21 0.00 0.00 66.02 65.59 2aiz s SER 2 CO 0.00 0.10 0.90 -0.44 0.41 0.00 0.00 173.24 174.21 2aiz s SER 3 N -2.86 6.66 -0.18 2.44 0.01 -1.26 -4.92 113.70 113.59 2aiz s SER 3 Ca 0.25 0.54 -0.16 0.00 1.31 0.00 0.00 55.95 57.88 2aiz s SER 3 Cb -0.08 -2.45 -0.12 0.00 0.21 0.00 0.00 66.02 63.57 2aiz s SER 3 CO 0.15 -0.84 0.05 -1.20 0.41 0.00 0.00 173.24 171.80 2aiz n SER 4 N 6.73 1.84 -3.74 2.44 7.64 -1.26 -5.02 113.62 122.24 2aiz n SER 4 Ca 0.06 0.51 -0.14 0.00 1.01 0.00 0.00 58.87 60.32 2aiz n SER 4 Cb 0.48 -0.93 -0.08 0.00 -1.01 0.00 0.00 64.21 62.67 2aiz n SER 4 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2aiz s ASN 5 N -6.40 -0.22 0.02 6.43 -0.87 -1.26 -5.15 114.94 107.49 2aiz s ASN 5 Ca -0.23 0.11 -0.19 0.00 -1.57 0.00 0.00 52.86 50.98 2aiz s ASN 5 Cb 0.04 0.33 -0.06 0.00 -0.02 0.00 0.00 41.25 41.54 2aiz s ASN 5 CO 0.44 -0.47 0.55 0.20 -2.57 0.00 0.00 177.10 175.25 2aiz s ASN 6 N -1.35 6.97 0.12 -1.22 0.01 -1.26 -4.98 114.94 113.23 2aiz s ASN 6 Ca -0.13 1.15 0.19 0.00 -0.71 0.00 0.00 52.86 53.37 2aiz s ASN 6 Cb -0.05 -2.34 -0.08 0.00 0.41 0.00 0.00 41.25 39.19 2aiz s ASN 6 CO 0.04 0.20 0.91 0.47 -1.51 0.00 0.00 177.10 177.22 2aiz n ASP 7 N 2.22 0.84 0.00 -1.22 9.92 -1.26 -4.97 116.55 122.07 2aiz n ASP 7 Ca -0.09 0.35 0.00 0.00 -0.53 0.00 0.00 54.79 54.52 2aiz n ASP 7 Cb 0.51 0.32 0.00 0.00 -0.64 0.00 0.00 41.12 41.31 2aiz n ASP 7 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2aiz n ALA 8 N -2.30 0.00 -0.62 2.24 0.00 -1.26 -4.82 120.51 113.75 2aiz n ALA 8 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.08 2aiz n ALA 8 Cb 0.71 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.35 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 1.13 -1.79 -0.08 0.00 0.00 -1.26 -5.00 120.51 113.52 2aiz n ALA 9 Ca 0.00 -0.79 -0.09 0.00 0.00 0.00 0.00 53.44 52.57 2aiz n ALA 9 Cb 0.00 -2.07 -0.04 0.00 0.00 0.00 0.00 19.45 17.35 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 0.70 -0.88 4.02 0.00 0.00 -1.26 -5.00 105.19 102.77 2aiz n GLY 10 Ca 0.08 -0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 2aiz n GLY 10 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2aiz n ASN 11 N -4.56 -2.64 -0.02 1.61 6.94 -1.26 -4.92 115.26 110.41 2aiz n ASN 11 Ca -0.14 -1.18 -0.02 0.00 -0.02 0.00 0.00 54.58 53.23 2aiz n ASN 11 Cb 0.38 -2.30 -0.01 0.00 -2.36 0.00 0.00 39.78 35.50 2aiz n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2aiz n GLY 12 N -2.09 -0.67 0.09 4.83 0.00 -1.26 -4.83 105.19 101.26 2aiz n GLY 12 Ca -0.19 -0.06 -0.14 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.71 0.63 -1.47 4.61 0.00 -1.26 -4.95 120.51 115.36 2aiz n ALA 13 Ca -0.02 -0.46 -0.37 0.00 0.00 0.00 0.00 53.44 52.58 2aiz n ALA 13 Cb 0.09 -0.28 0.06 0.00 0.00 0.00 0.00 19.45 19.32 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 -3.53 -0.41 -3.04 0.00 0.00 -1.26 -4.97 120.51 107.30 2aiz n ALA 14 Ca -0.21 -0.09 -0.39 0.00 0.00 0.00 0.00 53.44 52.75 2aiz n ALA 14 Cb 0.49 -2.03 -0.12 0.00 0.00 0.00 0.00 19.45 17.80 2aiz n ALA 14 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2aiz s GLN 15 N -2.82 2.71 -0.11 0.00 -1.52 -1.26 -4.87 119.66 111.78 2aiz s GLN 15 Ca 0.73 -1.15 -0.01 0.00 -1.95 0.00 0.00 55.36 52.98 2aiz s GLN 15 Cb -0.39 -3.60 0.03 0.00 -0.22 0.00 0.00 33.01 28.83 2aiz s GLN 15 CO 0.50 -0.69 -0.04 0.95 -0.25 0.00 0.00 175.29 175.76 2aiz s THR 16 N 1.47 0.76 -0.52 -0.19 -4.23 -1.26 -4.42 115.64 107.26 2aiz s THR 16 Ca 0.00 -0.19 -0.22 0.00 -1.18 0.00 0.00 61.69 60.10 2aiz s THR 16 Cb -0.19 -0.88 0.04 0.00 1.34 0.00 0.00 72.50 72.81 2aiz s THR 16 CO 0.05 0.26 0.79 -0.36 -0.54 0.00 0.00 174.62 174.82 2aiz s PHE 17 N 1.81 2.93 0.00 3.99 0.08 0.41 -4.17 117.98 123.03 2aiz s PHE 17 Ca 0.04 -0.18 0.00 0.00 0.12 0.00 0.00 56.93 56.91 2aiz s PHE 17 Cb -0.13 -3.78 0.00 0.00 -0.57 0.00 0.00 43.02 38.54 2aiz s PHE 17 CO -0.07 -1.16 0.00 0.41 -0.10 0.00 0.00 175.22 174.30 2aiz n GLY 18 N 5.12 0.07 0.00 4.36 0.00 -1.26 -2.77 105.19 110.71 2aiz n GLY 18 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.30 4.04 3.60 -0.02 0.00 -1.26 -4.81 105.19 107.04 2aiz n GLY 19 Ca 0.00 -0.70 -0.27 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.02 2.35 0.08 1.61 2.02 -1.11 -4.94 117.35 117.33 2aiz s TYR 20 Ca 0.00 -0.76 0.02 0.00 -0.37 0.00 0.00 57.07 55.96 2aiz s TYR 20 Cb 0.00 -1.66 -0.04 0.00 -0.40 0.00 0.00 41.96 39.86 2aiz s TYR 20 CO 0.00 0.33 0.16 -1.12 -1.57 0.00 0.00 175.55 173.36 2aiz s SER 21 N -3.68 6.00 0.09 2.29 0.01 -1.26 0.16 113.70 117.31 2aiz s SER 21 Ca 0.32 0.14 -0.18 0.00 1.31 0.00 0.00 55.95 57.54 2aiz s SER 21 Cb 0.09 -1.75 -0.04 0.00 0.21 0.00 0.00 66.02 64.53 2aiz s SER 21 CO 0.16 0.16 1.23 0.52 0.41 0.00 0.00 173.24 175.71 2aiz n VAL 22 N 0.25 -0.40 0.13 3.43 0.31 -1.26 0.71 118.33 121.50 2aiz n VAL 22 Ca -0.07 1.91 0.07 0.00 -0.01 0.00 0.00 64.34 66.24 2aiz n VAL 22 Cb 0.52 -2.40 0.38 0.00 -0.91 0.00 0.00 33.84 31.42 2aiz n VAL 22 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2aiz n ALA 23 N -3.17 0.80 -0.13 3.52 0.00 -1.26 -1.10 120.51 119.18 2aiz n ALA 23 Ca 0.01 0.13 -0.25 0.00 0.00 0.00 0.00 53.44 53.33 2aiz n ALA 23 Cb 0.15 -0.98 -0.11 0.00 0.00 0.00 0.00 19.45 18.51 2aiz n ALA 23 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2aiz n ASP 24 N -2.01 1.97 0.29 0.00 2.03 0.22 -3.12 116.55 115.92 2aiz n ASP 24 Ca -0.01 0.19 0.18 0.00 0.52 0.00 0.00 54.79 55.67 2aiz n ASP 24 Cb 0.18 -0.70 0.96 0.00 -0.72 0.00 0.00 41.12 40.83 2aiz n ASP 24 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2aiz h LEU 25 N -0.63 0.00 0.00 -2.67 3.38 0.90 0.85 115.31 117.13 2aiz h LEU 25 Ca -0.63 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.34 2aiz h LEU 25 Cb 1.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.45 2aiz h LEU 25 CO -0.28 0.00 -0.96 0.00 0.09 0.00 0.00 178.44 177.29 2aiz n GLN 26 N -3.32 1.41 -0.02 1.13 10.64 -0.26 -3.42 117.38 123.55 2aiz n GLN 26 Ca -0.01 -0.03 -0.01 0.00 -1.83 0.00 0.00 57.00 55.12 2aiz n GLN 26 Cb 0.25 -1.29 -0.03 0.00 -0.86 0.00 0.00 30.24 28.31 2aiz n GLN 26 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 2aiz n GLN 27 N -1.52 2.45 -0.02 2.61 1.13 -0.34 -4.85 117.38 116.84 2aiz n GLN 27 Ca 0.02 -0.01 -0.06 0.00 -1.94 0.00 0.00 57.00 55.01 2aiz n GLN 27 Cb 0.29 -1.11 -0.02 0.00 0.11 0.00 0.00 30.24 29.51 2aiz n GLN 27 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2aiz n ARG 28 N -2.03 0.18 -3.57 -1.09 1.74 0.28 -4.90 116.66 107.27 2aiz n ARG 28 Ca -0.05 0.08 -0.38 0.00 -0.77 0.00 0.00 57.85 56.72 2aiz n ARG 28 Cb 0.50 -0.82 -0.05 0.00 -1.02 0.00 0.00 32.46 31.07 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 -2.25 3.92 0.00 -1.55 2.02 -0.88 -4.70 117.35 113.91 2aiz s TYR 29 Ca -0.11 -2.88 0.00 0.00 -0.37 0.00 0.00 57.07 53.71 2aiz s TYR 29 Cb 0.03 -3.38 0.00 0.00 -0.40 0.00 0.00 41.96 38.21 2aiz s TYR 29 CO 0.15 -0.80 0.68 -1.71 -1.57 0.00 0.00 175.55 172.30 2aiz n ASN 30 N 2.60 0.00 -3.96 2.29 4.05 -1.22 -4.47 115.26 114.55 2aiz n ASN 30 Ca 0.20 -1.36 -0.18 0.00 0.45 0.00 0.00 54.58 53.69 2aiz n ASN 30 Cb 0.38 -0.07 -0.15 0.00 1.23 0.00 0.00 39.78 41.17 2aiz n ASN 30 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 2aiz s THR 31 N 0.00 0.54 0.11 -0.44 2.01 -1.26 0.09 115.64 116.69 2aiz s THR 31 Ca 0.00 -0.24 0.05 0.00 0.31 0.00 0.00 61.69 61.81 2aiz s THR 31 Cb 0.00 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 71.98 2aiz s THR 31 CO 0.00 0.18 0.01 -0.69 -0.69 0.00 0.00 174.62 173.43 2aiz s VAL 32 N 0.19 4.05 -0.20 3.82 1.01 -1.00 -4.98 120.40 123.29 2aiz s VAL 32 Ca -0.02 -1.04 0.01 0.00 0.00 0.00 0.00 61.98 60.93 2aiz s VAL 32 Cb -0.07 -2.95 0.04 0.00 0.00 0.00 0.00 36.38 33.40 2aiz s VAL 32 CO -0.00 0.07 -0.11 -0.31 0.00 0.00 0.00 175.10 174.75 2aiz s TYR 33 N -1.40 2.50 0.56 5.22 1.51 -1.26 -1.76 117.35 122.72 2aiz s TYR 33 Ca 0.27 -1.65 0.01 0.00 -1.01 0.00 0.00 57.07 54.69 2aiz s TYR 33 Cb -0.11 -1.68 0.04 0.00 -0.11 0.00 0.00 41.96 40.10 2aiz s TYR 33 CO 0.19 -0.76 0.79 -0.06 -1.11 0.00 0.00 175.55 174.60 2aiz s PHE 34 N 1.37 2.76 0.14 2.71 0.08 -0.61 -4.79 117.98 119.63 2aiz s PHE 34 Ca -0.02 -0.05 0.02 0.00 0.12 0.00 0.00 56.93 57.01 2aiz s PHE 34 Cb -0.16 -2.76 0.02 0.00 -0.57 0.00 0.00 43.02 39.55 2aiz s PHE 34 CO -0.08 -0.92 0.19 0.41 -0.10 0.00 0.00 175.22 174.72 2aiz n GLY 35 N -2.36 1.83 3.70 4.36 0.00 -1.26 -4.69 105.19 106.76 2aiz n GLY 35 Ca 0.09 -2.14 -0.42 0.00 0.00 0.00 0.00 46.02 43.55 2aiz n GLY 35 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2aiz s PHE 36 N 0.10 2.36 -1.02 1.61 2.19 -1.26 -1.96 117.98 119.99 2aiz s PHE 36 Ca 0.14 0.11 -0.07 0.00 0.33 0.00 0.00 56.93 57.44 2aiz s PHE 36 Cb -0.01 -4.14 0.06 0.00 -1.31 0.00 0.00 43.02 37.62 2aiz s PHE 36 CO 0.09 -4.60 0.30 -0.40 1.83 0.00 0.00 175.22 172.44 2aiz n ASP 37 N 5.27 -2.91 -4.86 6.13 5.75 -1.26 -4.91 116.55 119.75 2aiz n ASP 37 Ca 0.17 -0.18 -0.37 0.00 -0.01 0.00 0.00 54.79 54.41 2aiz n ASP 37 Cb 0.38 -2.48 -0.06 0.00 -1.03 0.00 0.00 41.12 37.93 2aiz n ASP 37 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2aiz s LYS 38 N -5.74 3.70 -0.37 0.11 1.02 -0.83 -5.01 119.74 112.62 2aiz s LYS 38 Ca 0.29 0.14 0.12 0.00 0.02 0.00 0.00 55.97 56.53 2aiz s LYS 38 Cb -0.16 -3.16 0.45 0.00 -0.52 0.00 0.00 37.83 34.44 2aiz s LYS 38 CO 0.35 0.69 1.05 0.98 -0.92 0.00 0.00 175.35 177.50 2aiz n TYR 39 N 1.62 2.27 -3.74 3.18 9.36 -1.26 -4.67 117.16 123.91 2aiz n TYR 39 Ca -0.14 -2.87 -0.13 0.00 3.32 0.00 0.00 57.90 58.08 2aiz n TYR 39 Cb 0.53 -0.23 -0.08 0.00 -0.63 0.00 0.00 39.34 38.93 2aiz n TYR 39 CO 0.00 0.00 0.00 0.16 0.22 0.00 0.00 176.86 177.24 2aiz s ASP 40 N -3.38 -0.21 0.35 2.98 1.47 -1.26 -4.92 116.67 111.71 2aiz s ASP 40 Ca 0.38 0.07 0.02 0.00 1.18 0.00 0.00 52.55 54.20 2aiz s ASP 40 Cb 0.42 0.33 -0.02 0.00 -0.34 0.00 0.00 42.92 43.31 2aiz s ASP 40 CO -0.07 -0.49 0.53 -0.63 0.68 0.00 0.00 175.17 175.19 2aiz s ILE 41 N -1.57 4.73 0.01 2.11 1.01 -1.26 -4.80 121.20 121.43 2aiz s ILE 41 Ca -0.12 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 59.91 2aiz s ILE 41 Cb -0.04 -3.71 -0.03 0.00 0.01 0.00 0.00 42.46 38.69 2aiz s ILE 41 CO 0.03 -0.40 -0.06 0.42 0.00 0.00 0.00 174.94 174.92 2aiz s THR 42 N -2.28 3.66 0.55 2.92 -4.23 -1.26 -5.00 115.64 110.00 2aiz s THR 42 Ca 0.41 -0.81 0.41 0.00 -1.18 0.00 0.00 61.69 60.53 2aiz s THR 42 Cb -0.10 -2.61 0.61 0.00 1.34 0.00 0.00 72.50 71.75 2aiz s THR 42 CO 0.34 0.37 1.73 1.23 -0.54 0.00 0.00 174.62 177.75 2aiz h GLY 43 N 4.42 0.03 1.87 3.99 0.00 -1.99 0.44 103.07 111.84 2aiz h GLY 43 Ca -0.48 -0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 2aiz h GLY 43 CO 0.54 -0.01 -0.10 -2.09 0.00 0.00 0.00 176.54 174.88 2aiz h GLU 44 N 0.01 0.16 -0.26 4.80 4.57 -2.02 -2.65 114.58 119.19 2aiz h GLU 44 Ca 0.69 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.84 2aiz h GLU 44 Cb 2.74 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 31.30 2aiz h GLU 44 CO -0.02 0.27 0.00 0.66 -1.18 0.00 0.00 179.01 178.75 2aiz n TYR 45 N -4.34 0.34 -0.02 0.92 4.01 0.15 -4.55 117.16 113.67 2aiz n TYR 45 Ca -0.01 -0.24 -0.10 0.00 -0.16 0.00 0.00 57.90 57.39 2aiz n TYR 45 Cb 0.22 -0.01 0.04 0.00 -0.31 0.00 0.00 39.34 39.28 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 3.25 1.31 -0.81 -0.72 2.07 -1.05 -3.17 116.25 117.13 2aiz h VAL 46 Ca 0.00 -1.74 0.21 0.00 0.82 0.00 0.00 66.70 65.99 2aiz h VAL 46 Cb 0.78 1.69 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 2aiz h VAL 46 CO 0.00 0.55 0.56 0.06 0.02 0.00 0.00 177.57 178.76 2aiz h GLN 47 N 0.51 0.16 -0.00 1.57 -0.00 -1.80 -0.66 115.11 114.88 2aiz h GLN 47 Ca 0.02 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.66 2aiz h GLN 47 Cb 1.07 -0.04 -0.00 0.00 -0.00 0.00 0.00 27.48 28.52 2aiz h GLN 47 CO 0.10 0.11 0.00 0.82 -0.00 0.00 0.00 178.83 179.86 2aiz h ILE 48 N 0.17 1.11 -0.91 1.86 2.04 -1.88 0.58 117.51 120.48 2aiz h ILE 48 Ca 0.40 -0.34 0.15 0.00 1.00 0.00 0.00 64.86 66.07 2aiz h ILE 48 Cb 1.31 1.34 -0.07 0.00 -0.74 0.00 0.00 36.82 38.66 2aiz h ILE 48 CO -0.07 0.09 0.59 -0.07 0.00 0.00 0.00 178.15 178.68 2aiz h LEU 49 N -0.14 0.66 -0.05 1.44 4.07 -1.27 1.06 115.31 121.09 2aiz h LEU 49 Ca 0.00 0.05 -0.26 0.00 0.08 0.00 0.00 57.88 57.75 2aiz h LEU 49 Cb 0.14 -0.08 0.02 0.00 1.08 0.00 0.00 40.66 41.82 2aiz h LEU 49 CO -0.00 0.32 -1.00 0.44 -1.08 0.00 0.00 178.44 177.12 2aiz h ASP 50 N 0.69 0.85 0.32 -0.43 3.32 -1.01 -2.16 116.42 118.01 2aiz h ASP 50 Ca 0.47 -0.67 -0.02 0.00 0.02 0.00 0.00 57.03 56.83 2aiz h ASP 50 Cb 0.77 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.06 2aiz h ASP 50 CO -0.23 1.47 -0.15 0.00 -1.72 0.00 0.00 179.24 178.61 2aiz h ALA 51 N 0.48 -0.43 -0.91 3.45 0.00 0.20 -2.42 119.26 119.62 2aiz h ALA 51 Ca -0.11 -0.17 0.13 0.00 0.00 0.00 0.00 54.91 54.76 2aiz h ALA 51 Cb 1.65 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 19.53 2aiz h ALA 51 CO 0.19 -0.45 0.59 0.45 0.00 0.00 0.00 179.25 180.03 2aiz h HIS 52 N -1.00 0.90 -0.65 0.00 3.86 0.95 -0.16 115.15 119.05 2aiz h HIS 52 Ca -0.04 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2aiz h HIS 52 Cb 0.48 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.64 2aiz h HIS 52 CO 0.03 0.34 0.43 0.00 0.86 0.00 0.00 177.93 179.59 2aiz h ALA 53 N 1.58 0.83 -0.77 2.45 0.00 -1.40 0.58 119.26 122.54 2aiz h ALA 53 Ca 0.46 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.31 2aiz h ALA 53 Cb 0.65 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 2aiz h ALA 53 CO -0.22 0.26 0.47 0.00 0.00 0.00 0.00 179.25 179.76 2aiz h ALA 54 N 1.23 0.98 -0.11 0.00 0.00 -0.52 0.70 119.26 121.55 2aiz h ALA 54 Ca 0.24 -0.09 -0.22 0.00 0.00 0.00 0.00 54.91 54.84 2aiz h ALA 54 Cb -0.09 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.40 2aiz h ALA 54 CO -0.05 0.44 -0.80 -0.92 0.00 0.00 0.00 179.25 177.92 2aiz h TYR 55 N 1.05 0.90 -0.46 0.00 3.20 -0.87 -2.19 116.97 118.61 2aiz h TYR 55 Ca 0.28 -0.41 -0.06 0.00 3.14 0.00 0.00 58.73 61.67 2aiz h TYR 55 Cb -0.04 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.08 2aiz h TYR 55 CO -0.01 1.23 0.05 1.25 -1.64 0.00 0.00 178.16 179.04 2aiz h LEU 56 N 0.44 0.74 -0.59 2.82 5.85 0.48 -2.95 115.31 122.10 2aiz h LEU 56 Ca -0.06 -0.27 -0.14 0.00 0.84 0.00 0.00 57.88 58.25 2aiz h LEU 56 Cb 1.42 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.24 2aiz h LEU 56 CO 0.16 0.83 -0.34 -1.13 -0.34 0.00 0.00 178.44 177.61 2aiz h ASN 57 N 0.63 0.79 -0.09 1.25 -1.24 -0.92 -2.81 115.58 113.19 2aiz h ASN 57 Ca 0.14 -0.33 0.03 0.00 0.71 0.00 0.00 56.30 56.84 2aiz h ASN 57 Cb 0.42 -0.22 -0.00 0.00 0.73 0.00 0.00 38.32 39.24 2aiz h ASN 57 CO 0.01 1.06 0.13 0.00 -1.29 0.00 0.00 177.43 177.34 2aiz h ALA 58 N 0.99 1.55 -3.29 1.57 0.00 -1.23 -3.37 119.26 115.47 2aiz h ALA 58 Ca 0.06 -0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.30 2aiz h ALA 58 Cb 0.88 0.01 -0.32 0.00 0.00 0.00 0.00 17.79 18.35 2aiz h ALA 58 CO 0.08 -0.17 -0.75 0.95 0.00 0.00 0.00 179.25 179.36 2aiz s THR 59 N -4.50 2.85 0.15 0.00 -4.23 -1.06 -5.02 115.64 103.83 2aiz s THR 59 Ca -0.05 -1.06 -0.17 0.00 -1.18 0.00 0.00 61.69 59.24 2aiz s THR 59 Cb 0.14 -2.46 0.03 0.00 1.34 0.00 0.00 72.50 71.55 2aiz s THR 59 CO 0.50 0.18 1.72 -0.65 -0.54 0.00 0.00 174.62 175.83 2aiz h PRO 60 N 8.00 0.14 -0.71 3.99 0.11 -1.79 -2.23 132.00 139.52 2aiz h PRO 60 Ca -0.32 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2aiz h PRO 60 Cb 1.10 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2aiz h PRO 60 CO 0.57 0.10 0.00 0.00 -0.21 0.00 0.00 178.00 178.46 2aiz n ALA 61 N -2.42 3.19 -2.59 -0.75 0.00 -1.26 -4.86 120.51 111.82 2aiz n ALA 61 Ca 0.01 -1.07 -0.41 0.00 0.00 0.00 0.00 53.44 51.96 2aiz n ALA 61 Cb 0.16 -1.06 -0.07 0.00 0.00 0.00 0.00 19.45 18.48 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 -1.95 3.51 -0.08 0.00 0.00 -0.84 -5.05 121.76 117.36 2aiz s ALA 62 Ca 0.32 -0.72 0.04 0.00 0.00 0.00 0.00 51.96 51.60 2aiz s ALA 62 Cb 0.23 -3.11 -0.01 0.00 0.00 0.00 0.00 23.12 20.23 2aiz s ALA 62 CO 0.11 -1.15 -0.21 -1.59 0.00 0.00 0.00 175.76 172.92 2aiz s LYS 63 N 2.62 2.79 -0.01 0.00 -2.85 -1.26 -4.83 119.74 116.20 2aiz s LYS 63 Ca 0.25 -0.84 -0.11 0.00 -1.00 0.00 0.00 55.97 54.27 2aiz s LYS 63 Cb -0.15 -2.30 -0.05 0.00 -2.06 0.00 0.00 37.83 33.27 2aiz s LYS 63 CO 0.13 0.34 0.33 0.54 0.10 0.00 0.00 175.35 176.79 2aiz s VAL 64 N -0.05 5.19 -0.44 1.79 0.11 0.19 -4.87 120.40 122.33 2aiz s VAL 64 Ca -0.06 0.53 -0.07 0.00 -2.93 0.00 0.00 61.98 59.45 2aiz s VAL 64 Cb -0.15 -3.61 0.11 0.00 -1.53 0.00 0.00 36.38 31.20 2aiz s VAL 64 CO 0.05 0.51 0.28 -0.22 -3.33 0.00 0.00 175.10 172.38 2aiz s LEU 65 N -1.31 5.43 -0.41 2.54 0.20 0.44 -1.35 118.68 124.22 2aiz s LEU 65 Ca 0.24 -1.87 -0.29 0.00 0.69 0.00 0.00 54.13 52.90 2aiz s LEU 65 Cb -0.15 -1.94 0.02 0.00 -0.43 0.00 0.00 46.19 43.69 2aiz s LEU 65 CO 0.12 -0.61 1.16 -0.69 -0.29 0.00 0.00 176.35 176.04 2aiz s VAL 66 N 1.30 4.26 -0.31 1.68 1.01 0.27 0.14 120.40 128.74 2aiz s VAL 66 Ca 0.06 1.35 -0.12 0.00 0.00 0.00 0.00 61.98 63.27 2aiz s VAL 66 Cb -0.24 -4.49 -0.03 0.00 0.00 0.00 0.00 36.38 31.62 2aiz s VAL 66 CO -0.01 -0.80 0.23 -1.61 0.00 0.00 0.00 175.10 172.90 2aiz s GLU 67 N 4.25 3.72 0.25 2.72 2.02 -0.80 -1.36 118.70 129.49 2aiz s GLU 67 Ca 0.49 -0.47 -0.24 0.00 0.02 0.00 0.00 54.97 54.77 2aiz s GLU 67 Cb -0.10 -3.74 -0.09 0.00 0.10 0.00 0.00 34.13 30.31 2aiz s GLU 67 CO 0.27 -0.33 0.83 0.20 0.02 0.00 0.00 175.26 176.25 2aiz s GLY 68 N 1.74 2.79 0.06 -1.39 0.00 0.20 -0.47 107.32 110.25 2aiz s GLY 68 Ca 0.07 0.38 -0.07 0.00 0.00 0.00 0.00 44.72 45.10 2aiz s GLY 68 CO 0.11 0.82 0.15 -1.31 0.00 0.00 0.00 173.10 172.86 2aiz s ASN 69 N -1.49 0.16 0.13 1.64 0.01 0.33 0.76 114.94 116.48 2aiz s ASN 69 Ca 0.44 -0.61 -0.14 0.00 -0.71 0.00 0.00 52.86 51.84 2aiz s ASN 69 Cb -0.20 0.29 0.05 0.00 0.41 0.00 0.00 41.25 41.81 2aiz s ASN 69 CO 0.24 -0.64 0.69 0.35 -1.51 0.00 0.00 177.10 176.23 2aiz n THR 70 N 0.27 0.00 -1.85 1.60 -2.24 -0.86 -2.30 114.28 108.90 2aiz n THR 70 Ca -0.16 -0.40 -0.33 0.00 -2.27 0.00 0.00 64.05 60.89 2aiz n THR 70 Cb 0.61 0.53 0.03 0.00 -2.10 0.00 0.00 70.33 69.40 2aiz n THR 70 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2aiz s ASP 71 N -2.63 5.43 0.37 3.42 -4.77 -1.26 -4.53 116.67 112.70 2aiz s ASP 71 Ca 0.15 1.87 0.06 0.00 -3.30 0.00 0.00 52.55 51.32 2aiz s ASP 71 Cb -0.02 -2.54 0.71 0.00 -1.09 0.00 0.00 42.92 39.98 2aiz s ASP 71 CO 0.04 -1.41 1.95 1.05 0.70 0.00 0.00 175.17 177.50 2aiz h GLU 72 N 0.10 0.52 -5.60 2.11 9.09 -1.92 -3.39 114.58 115.48 2aiz h GLU 72 Ca -0.46 -0.08 -0.68 0.00 0.05 0.00 0.00 59.36 58.19 2aiz h GLU 72 Cb 1.23 -0.09 -0.05 0.00 -1.65 0.00 0.00 28.75 28.18 2aiz h GLU 72 CO 0.56 0.47 1.43 -2.13 0.05 0.00 0.00 179.01 179.39 2aiz n ARG 73 N -4.36 0.00 0.00 1.06 3.00 -1.26 -4.60 116.66 110.51 2aiz n ARG 73 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.87 2aiz n ARG 73 Cb 0.17 -1.48 0.00 0.00 0.00 0.00 0.00 32.46 31.15 2aiz n ARG 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2aiz n GLY 74 N 7.08 2.24 3.81 5.14 0.00 -1.26 -4.98 105.19 117.22 2aiz n GLY 74 Ca 0.57 -2.07 -0.35 0.00 0.00 0.00 0.00 46.02 44.17 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 -2.17 4.44 0.38 2.61 -4.23 -1.26 -4.82 115.64 110.59 2aiz s THR 75 Ca 0.00 1.44 0.11 0.00 -1.18 0.00 0.00 61.69 62.05 2aiz s THR 75 Cb 0.00 -3.83 0.33 0.00 1.34 0.00 0.00 72.50 70.34 2aiz s THR 75 CO 0.00 0.05 1.88 -0.65 -0.54 0.00 0.00 174.62 175.36 2aiz h PRO 76 N 2.93 0.60 -0.08 3.99 0.11 -1.91 0.37 132.00 138.01 2aiz h PRO 76 Ca -0.48 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2aiz h PRO 76 Cb 1.19 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 2aiz h PRO 76 CO 0.65 0.39 0.02 0.93 -0.21 0.00 0.00 178.00 179.78 2aiz h GLU 77 N 0.61 0.12 -0.00 1.05 5.08 -1.98 1.05 114.58 120.51 2aiz h GLU 77 Ca 0.43 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.60 2aiz h GLU 77 Cb 0.76 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.97 2aiz h GLU 77 CO -0.18 0.29 -0.76 0.10 -1.00 0.00 0.00 179.01 177.46 2aiz h TYR 78 N -0.07 0.03 0.00 4.33 -0.00 -1.89 -2.82 116.97 116.55 2aiz h TYR 78 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.74 2aiz h TYR 78 Cb 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.94 2aiz h TYR 78 CO -0.00 0.77 0.00 0.09 -0.00 0.00 0.00 178.16 179.02 2aiz n ASN 79 N -3.65 0.00 -0.23 0.10 3.02 0.13 -2.29 115.26 112.33 2aiz n ASN 79 Ca -0.01 0.64 0.22 0.00 -0.03 0.00 0.00 54.58 55.40 2aiz n ASN 79 Cb 0.73 -0.27 0.38 0.00 -0.61 0.00 0.00 39.78 40.01 2aiz n ASN 79 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2aiz n ILE 80 N -1.32 -0.22 0.47 2.41 3.06 0.36 0.14 119.36 124.26 2aiz n ILE 80 Ca 0.00 1.19 -0.19 0.00 -2.50 0.00 0.00 62.75 61.25 2aiz n ILE 80 Cb 0.00 -1.95 -0.09 0.00 0.54 0.00 0.00 39.64 38.14 2aiz n ILE 80 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2aiz h ALA 81 N 1.13 -1.19 -0.61 1.51 0.00 -1.41 1.06 119.26 119.76 2aiz h ALA 81 Ca 0.53 -0.26 0.12 0.00 0.00 0.00 0.00 54.91 55.30 2aiz h ALA 81 Cb 1.53 0.46 -0.12 0.00 0.00 0.00 0.00 17.79 19.67 2aiz h ALA 81 CO -0.40 -1.14 -0.19 1.25 0.00 0.00 0.00 179.25 178.77 2aiz h LEU 82 N -1.26 -0.70 -0.28 0.00 7.12 0.17 -0.77 115.31 119.58 2aiz h LEU 82 Ca -0.12 0.19 -0.05 0.00 0.13 0.00 0.00 57.88 58.03 2aiz h LEU 82 Cb 0.92 0.42 -0.01 0.00 -0.53 0.00 0.00 40.66 41.46 2aiz h LEU 82 CO 0.20 -0.23 -0.03 1.23 -0.13 0.00 0.00 178.44 179.48 2aiz h GLY 83 N -0.04 0.55 -0.08 3.75 0.00 -1.29 -2.63 103.07 103.33 2aiz h GLY 83 Ca 0.29 -0.43 0.24 0.00 0.00 0.00 0.00 47.33 47.43 2aiz h GLY 83 CO -0.65 0.39 0.62 -1.61 0.00 0.00 0.00 176.54 175.30 2aiz h GLN 84 N 0.28 0.53 -0.18 4.80 5.75 0.23 0.74 115.11 127.27 2aiz h GLN 84 Ca 0.08 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.50 2aiz h GLN 84 Cb 0.47 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.90 2aiz h GLN 84 CO 0.02 0.35 -0.05 -0.09 -2.65 0.00 0.00 178.83 176.41 2aiz h ARG 85 N 0.55 0.35 -0.95 1.69 9.65 -0.98 -0.86 114.38 123.82 2aiz h ARG 85 Ca 0.61 -0.14 0.04 0.00 -1.10 0.00 0.00 59.98 59.40 2aiz h ARG 85 Cb 1.26 -0.02 -0.06 0.00 -1.39 0.00 0.00 29.97 29.76 2aiz h ARG 85 CO -0.39 0.62 0.61 0.00 2.80 0.00 0.00 179.97 183.61 2aiz h ARG 86 N 0.05 1.14 -0.20 0.20 3.08 -0.18 0.31 114.38 118.78 2aiz h ARG 86 Ca 0.04 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.03 2aiz h ARG 86 Cb 0.50 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 2aiz h ARG 86 CO 0.02 0.75 0.13 0.00 -1.07 0.00 0.00 179.97 179.80 2aiz h ALA 87 N 1.40 1.85 -0.09 0.04 0.00 0.58 0.16 119.26 123.20 2aiz h ALA 87 Ca 0.39 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.17 2aiz h ALA 87 Cb 0.05 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2aiz h ALA 87 CO -0.14 0.14 -0.44 -0.44 0.00 0.00 0.00 179.25 178.37 2aiz h ASP 88 N 0.27 0.22 0.98 0.00 3.32 0.10 -1.14 116.42 120.16 2aiz h ASP 88 Ca 0.07 -0.10 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 2aiz h ASP 88 Cb -0.02 -0.06 0.01 0.00 0.22 0.00 0.00 39.33 39.48 2aiz h ASP 88 CO -0.01 0.64 -0.47 0.00 -1.72 0.00 0.00 179.24 177.67 2aiz h ALA 89 N 1.37 -1.33 -0.43 3.45 0.00 0.68 -0.01 119.26 122.99 2aiz h ALA 89 Ca 0.01 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 2aiz h ALA 89 Cb 0.85 0.51 -0.02 0.00 0.00 0.00 0.00 17.79 19.13 2aiz h ALA 89 CO 0.07 -1.23 0.06 0.28 0.00 0.00 0.00 179.25 178.43 2aiz h VAL 90 N -1.34 1.21 -0.70 0.00 2.07 -1.49 -1.72 116.25 114.28 2aiz h VAL 90 Ca -0.13 -0.79 0.00 0.00 0.82 0.00 0.00 66.70 66.60 2aiz h VAL 90 Cb 1.01 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 2aiz h VAL 90 CO 0.22 0.28 0.44 0.50 0.02 0.00 0.00 177.57 179.03 2aiz h LYS 91 N 0.64 0.94 0.00 1.57 3.11 -1.09 -1.28 116.57 120.46 2aiz h LYS 91 Ca 0.14 -0.07 -0.04 0.00 -2.81 0.00 0.00 60.65 57.87 2aiz h LYS 91 Cb 0.31 -0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 31.33 2aiz h LYS 91 CO 0.00 0.65 -0.17 0.78 -2.81 0.00 0.00 179.45 177.91 2aiz h GLY 92 N 0.95 0.00 0.65 5.01 0.00 -0.62 -2.29 103.07 106.77 2aiz h GLY 92 Ca 0.25 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.55 2aiz h GLY 92 CO -0.05 0.00 -0.31 -1.82 0.00 0.00 0.00 176.54 174.36 2aiz h TYR 93 N 0.00 -0.81 -0.39 5.60 5.03 -0.34 -0.82 116.97 125.24 2aiz h TYR 93 Ca -0.00 -0.02 0.08 0.00 2.58 0.00 0.00 58.73 61.37 2aiz h TYR 93 Cb 0.77 0.27 -0.02 0.00 1.55 0.00 0.00 36.73 39.30 2aiz h TYR 93 CO 0.00 -0.50 0.27 -0.07 -1.32 0.00 0.00 178.16 176.54 2aiz h LEU 94 N -1.03 0.14 -0.84 2.82 3.38 -1.45 0.10 115.31 118.43 2aiz h LEU 94 Ca -0.09 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.89 2aiz h LEU 94 Cb 0.67 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.35 2aiz h LEU 94 CO 0.15 0.09 0.56 0.00 0.09 0.00 0.00 178.44 179.32 2aiz h ALA 95 N 1.80 1.07 0.00 1.53 0.00 -1.13 -0.53 119.26 122.01 2aiz h ALA 95 Ca 0.18 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2aiz h ALA 95 Cb 0.51 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2aiz h ALA 95 CO -0.03 0.48 -0.21 0.78 0.00 0.00 0.00 179.25 180.28 2aiz h GLY 96 N 1.15 0.00 2.00 0.00 0.00 0.67 -2.02 103.07 104.86 2aiz h GLY 96 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.64 2aiz h GLY 96 CO -0.07 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.75 2aiz n LYS 97 N -3.49 0.00 0.00 4.80 4.01 -0.26 -4.85 118.16 118.38 2aiz n LYS 97 Ca -0.01 0.17 0.00 0.00 -0.51 0.00 0.00 58.31 57.97 2aiz n LYS 97 Cb 0.38 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.39 2aiz n LYS 97 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2aiz n GLY 98 N 0.47 0.76 3.71 0.72 0.00 -0.76 -5.07 105.19 105.02 2aiz n GLY 98 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 4.28 0.36 1.61 1.01 -0.86 -4.98 120.40 119.81 2aiz s VAL 99 Ca 0.00 1.62 -0.29 0.00 0.00 0.00 0.00 61.98 63.32 2aiz s VAL 99 Cb 0.00 -4.04 -0.11 0.00 0.00 0.00 0.00 36.38 32.23 2aiz s VAL 99 CO 0.00 0.09 1.52 -0.62 0.00 0.00 0.00 175.10 176.10 2aiz s ASP 100 N 1.15 6.33 0.39 3.32 2.15 -1.26 -4.31 116.67 124.44 2aiz s ASP 100 Ca 0.56 3.04 0.13 0.00 0.43 0.00 0.00 52.55 56.71 2aiz s ASP 100 Cb -0.26 -2.66 0.95 0.00 -0.30 0.00 0.00 42.92 40.64 2aiz s ASP 100 CO 0.27 -0.90 1.87 0.00 -0.17 0.00 0.00 175.17 176.24 2aiz h ALA 101 N 3.50 2.00 0.00 3.66 0.00 -1.94 0.23 119.26 126.72 2aiz h ALA 101 Ca -0.50 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2aiz h ALA 101 Cb 1.23 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2aiz h ALA 101 CO 0.68 -0.26 0.00 0.78 0.00 0.00 0.00 179.25 180.46 2aiz h GLY 102 N 0.55 0.00 0.71 0.00 0.00 -2.02 -1.31 103.07 101.00 2aiz h GLY 102 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.78 2aiz h GLY 102 CO -0.19 0.00 -0.74 0.28 0.00 0.00 0.00 176.54 175.89 2aiz n LYS 103 N -2.38 0.09 -4.10 4.80 5.02 0.81 -4.89 118.16 117.51 2aiz n LYS 103 Ca 0.00 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.95 2aiz n LYS 103 Cb 0.14 -1.53 -0.07 0.00 -0.02 0.00 0.00 35.03 33.54 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 -3.31 3.97 -0.05 -0.35 1.43 -0.50 0.58 118.68 120.45 2aiz s LEU 104 Ca 0.08 0.24 -0.11 0.00 -1.03 0.00 0.00 54.13 53.31 2aiz s LEU 104 Cb 0.16 -2.13 0.02 0.00 0.03 0.00 0.00 46.19 44.27 2aiz s LEU 104 CO 0.76 0.33 0.26 -0.83 0.23 0.00 0.00 176.35 177.10 2aiz s GLY 105 N -1.37 -0.13 0.28 -3.19 0.00 -0.45 -4.94 107.32 97.51 2aiz s GLY 105 Ca 0.19 0.42 0.09 0.00 0.00 0.00 0.00 44.72 45.42 2aiz s GLY 105 CO 0.09 0.27 -0.12 -0.51 0.00 0.00 0.00 173.10 172.83 2aiz s THR 106 N -0.70 2.00 0.00 0.90 -4.23 -1.26 0.94 115.64 113.29 2aiz s THR 106 Ca -0.08 -2.23 0.00 0.00 -1.18 0.00 0.00 61.69 58.20 2aiz s THR 106 Cb -0.04 -2.36 0.00 0.00 1.34 0.00 0.00 72.50 71.43 2aiz s THR 106 CO 0.02 -0.37 0.00 1.33 -0.54 0.00 0.00 174.62 175.06 2aiz n VAL 107 N -0.59 0.00 -3.82 2.29 0.24 -0.47 -4.90 118.33 111.08 2aiz n VAL 107 Ca -0.06 0.00 -0.36 0.00 -2.04 0.00 0.00 64.34 61.89 2aiz n VAL 107 Cb 0.62 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.93 2aiz n VAL 107 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2aiz s SER 108 N 0.00 6.45 -0.06 -1.34 0.15 -1.26 0.62 113.70 118.26 2aiz s SER 108 Ca 0.00 0.52 0.11 0.00 0.70 0.00 0.00 55.95 57.28 2aiz s SER 108 Cb 0.00 -2.08 0.32 0.00 -1.71 0.00 0.00 66.02 62.55 2aiz s SER 108 CO 0.00 0.33 1.25 -1.22 1.20 0.00 0.00 173.24 174.80 2aiz n TYR 109 N 1.51 0.48 0.00 3.44 4.02 0.23 -4.85 117.16 121.99 2aiz n TYR 109 Ca -0.15 -0.66 0.00 0.00 -0.01 0.00 0.00 57.90 57.08 2aiz n TYR 109 Cb 0.54 -0.12 0.00 0.00 -0.02 0.00 0.00 39.34 39.73 2aiz n TYR 109 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2aiz n GLY 110 N -0.14 0.00 1.02 2.72 0.00 -1.25 -2.19 105.19 105.34 2aiz n GLY 110 Ca 0.13 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.23 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 3.18 -0.14 1.61 0.28 -1.26 -4.07 120.64 120.24 2aiz n GLU 111 Ca 0.00 -2.60 -0.09 0.00 -0.16 0.00 0.00 57.16 54.31 2aiz n GLU 111 Cb 0.00 -1.68 -0.01 0.00 1.43 0.00 0.00 31.44 31.18 2aiz n GLU 111 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 2aiz h GLU 112 N 2.52 0.60 -2.05 3.44 -0.00 -1.82 -3.39 114.58 113.88 2aiz h GLU 112 Ca 0.00 -0.11 -0.41 0.00 -0.00 0.00 0.00 59.36 58.84 2aiz h GLU 112 Cb 1.23 -0.10 -0.32 0.00 -0.00 0.00 0.00 28.75 29.56 2aiz h GLU 112 CO 0.16 0.57 -0.73 0.15 -0.00 0.00 0.00 179.01 179.16 2aiz s LYS 113 N -5.55 0.67 1.05 1.06 1.02 -1.25 -5.14 119.74 111.60 2aiz s LYS 113 Ca -0.13 -1.06 -0.11 0.00 0.02 0.00 0.00 55.97 54.68 2aiz s LYS 113 Cb 0.10 -0.85 0.22 0.00 -0.52 0.00 0.00 37.83 36.78 2aiz s LYS 113 CO 0.75 -1.22 1.08 -2.14 -0.92 0.00 0.00 175.35 172.91 2aiz s PRO 114 N 1.22 -0.00 -0.04 -1.68 0.02 -1.26 -5.01 135.00 128.25 2aiz s PRO 114 Ca 0.19 1.19 -0.08 0.00 0.02 0.00 0.00 61.00 62.32 2aiz s PRO 114 Cb -0.15 -1.63 -0.03 0.00 0.02 0.00 0.00 34.50 32.71 2aiz s PRO 114 CO -0.03 -3.21 -0.15 0.00 -0.33 0.00 0.00 177.00 173.28 2aiz n ALA 115 N -4.60 1.78 -2.55 -1.55 0.00 -1.26 -4.94 120.51 107.39 2aiz n ALA 115 Ca 0.07 -0.38 -0.43 0.00 0.00 0.00 0.00 53.44 52.70 2aiz n ALA 115 Cb 0.53 0.11 -0.05 0.00 0.00 0.00 0.00 19.45 20.04 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 -2.20 4.64 0.22 0.00 1.01 -1.26 -5.03 120.40 117.79 2aiz s VAL 116 Ca -0.12 0.41 -0.30 0.00 0.00 0.00 0.00 61.98 61.97 2aiz s VAL 116 Cb 0.02 -4.33 -0.09 0.00 0.00 0.00 0.00 36.38 31.98 2aiz s VAL 116 CO 0.18 -0.74 1.23 -0.76 0.00 0.00 0.00 175.10 175.02 2aiz s LEU 117 N 3.31 4.45 0.00 3.92 1.43 -1.26 -4.88 118.68 125.65 2aiz s LEU 117 Ca 0.30 2.35 0.00 0.00 -1.03 0.00 0.00 54.13 55.74 2aiz s LEU 117 Cb -0.12 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.48 2aiz s LEU 117 CO 0.22 -0.41 0.00 0.61 0.23 0.00 0.00 176.35 177.01 2aiz n GLY 118 N 1.94 2.14 2.51 -3.19 0.00 -1.26 -4.94 105.19 102.39 2aiz n GLY 118 Ca 0.04 -2.11 -0.28 0.00 0.00 0.00 0.00 46.02 43.67 2aiz n GLY 118 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2aiz s HIS 119 N -1.68 0.49 0.04 1.61 -3.43 -1.26 -4.75 115.29 106.31 2aiz s HIS 119 Ca 0.00 -1.32 -0.28 0.00 -0.80 0.00 0.00 55.06 52.67 2aiz s HIS 119 Cb 0.00 -0.85 0.09 0.00 -1.43 0.00 0.00 32.58 30.40 2aiz s HIS 119 CO 0.00 -0.84 0.89 0.34 -2.00 0.00 0.00 174.74 173.12 2aiz s ASP 120 N 1.41 -0.33 0.60 7.38 2.15 -1.26 -4.98 116.67 121.64 2aiz s ASP 120 Ca 0.15 -0.10 0.27 0.00 0.43 0.00 0.00 52.55 53.31 2aiz s ASP 120 Cb -0.20 0.42 1.23 0.00 -0.30 0.00 0.00 42.92 44.06 2aiz s ASP 120 CO -0.10 -0.71 1.63 -0.33 -0.17 0.00 0.00 175.17 175.49 2aiz h GLU 121 N 2.00 0.00 0.56 4.34 4.39 -1.99 0.63 114.58 124.50 2aiz h GLU 121 Ca -0.23 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.44 2aiz h GLU 121 Cb 1.24 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.90 2aiz h GLU 121 CO 0.30 0.00 -0.27 0.00 -1.16 0.00 0.00 179.01 177.88 2aiz h ALA 122 N 1.03 -0.75 -0.23 3.43 0.00 -1.98 -2.09 119.26 118.68 2aiz h ALA 122 Ca 0.31 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 2aiz h ALA 122 Cb 1.89 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 19.96 2aiz h ALA 122 CO -0.00 -0.69 -0.39 0.00 0.00 0.00 0.00 179.25 178.17 2aiz h ALA 123 N -1.20 0.35 -0.23 0.00 0.00 -1.44 -2.34 119.26 114.39 2aiz h ALA 123 Ca -0.08 -0.45 0.05 0.00 0.00 0.00 0.00 54.91 54.44 2aiz h ALA 123 Cb 0.57 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 2aiz h ALA 123 CO 0.13 0.44 -0.09 1.88 0.00 0.00 0.00 179.25 181.61 2aiz h TYR 124 N 0.37 -0.21 -0.24 0.00 0.05 0.06 0.74 116.97 117.74 2aiz h TYR 124 Ca 0.02 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.74 2aiz h TYR 124 Cb 0.98 0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.84 2aiz h TYR 124 CO 0.08 -0.15 -0.18 1.03 -1.05 0.00 0.00 178.16 177.90 2aiz h SER 125 N -0.05 0.41 0.42 3.88 0.87 -1.42 -0.06 113.55 117.60 2aiz h SER 125 Ca 0.12 -0.11 -0.08 0.00 -1.23 0.00 0.00 61.79 60.49 2aiz h SER 125 Cb 0.23 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.07 2aiz h SER 125 CO -0.27 0.61 -0.38 0.11 -0.53 0.00 0.00 176.83 176.36 2aiz h LYS 126 N 0.38 0.00 0.00 2.24 1.57 -0.70 -2.97 116.57 117.09 2aiz h LYS 126 Ca 0.07 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.58 2aiz h LYS 126 Cb 0.53 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.80 2aiz h LYS 126 CO 0.03 0.38 -1.50 -0.91 -0.57 0.00 0.00 179.45 176.89 2aiz h ASN 127 N 0.00 0.00 -0.51 0.86 2.35 -0.38 -3.43 115.58 114.47 2aiz h ASN 127 Ca -0.00 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.58 2aiz h ASN 127 Cb 0.70 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.04 2aiz h ASN 127 CO 0.05 0.97 0.44 -0.13 -1.65 0.00 0.00 177.43 177.12 2aiz s ARG 128 N -2.65 2.08 0.10 0.81 0.52 -0.08 -2.03 118.95 117.70 2aiz s ARG 128 Ca -0.03 -0.10 -0.23 0.00 -0.52 0.00 0.00 55.73 54.85 2aiz s ARG 128 Cb 0.09 -4.97 0.06 0.00 0.52 0.00 0.00 34.95 30.65 2aiz s ARG 128 CO 0.82 -4.01 0.57 -0.98 0.02 0.00 0.00 175.30 171.72 2aiz s ARG 129 N 7.78 1.17 -0.39 3.54 1.70 -0.97 -1.57 118.95 130.20 2aiz s ARG 129 Ca 0.79 -0.35 0.02 0.00 -0.47 0.00 0.00 55.73 55.72 2aiz s ARG 129 Cb -0.08 0.53 0.12 0.00 -0.57 0.00 0.00 34.95 34.95 2aiz s ARG 129 CO 0.05 -0.47 0.16 0.00 -1.08 0.00 0.00 175.30 173.96 2aiz s ALA 130 N -3.12 2.31 -0.41 7.88 0.00 -0.72 0.12 121.76 127.82 2aiz s ALA 130 Ca -0.02 -2.41 -0.27 0.00 0.00 0.00 0.00 51.96 49.26 2aiz s ALA 130 Cb -0.00 -1.87 0.02 0.00 0.00 0.00 0.00 23.12 21.27 2aiz s ALA 130 CO -0.07 -1.85 1.01 0.08 0.00 0.00 0.00 175.76 174.93 2aiz s VAL 131 N 0.76 4.44 -0.39 0.00 1.01 0.37 -2.36 120.40 124.23 2aiz s VAL 131 Ca 0.14 1.20 -0.27 0.00 0.00 0.00 0.00 61.98 63.05 2aiz s VAL 131 Cb -0.21 -4.45 -0.04 0.00 0.00 0.00 0.00 36.38 31.68 2aiz s VAL 131 CO -0.09 -0.72 2.11 -0.76 0.00 0.00 0.00 175.10 175.63 2aiz s LEU 132 N 3.84 3.42 -0.21 3.92 2.01 0.11 -1.91 118.68 129.86 2aiz s LEU 132 Ca 0.42 1.24 -0.10 0.00 0.01 0.00 0.00 54.13 55.70 2aiz s LEU 132 Cb -0.10 -3.05 -0.05 0.00 0.01 0.00 0.00 46.19 43.00 2aiz s LEU 132 CO 0.23 -2.24 0.13 0.00 1.01 0.00 0.00 176.35 175.48 2aiz s ALA 133 N 9.23 3.62 -2.52 4.21 0.00 0.37 -4.82 121.76 131.85 2aiz s ALA 133 Ca 0.89 -0.76 0.28 0.00 0.00 0.00 0.00 51.96 52.36 2aiz s ALA 133 Cb -0.22 -2.18 1.01 0.00 0.00 0.00 0.00 23.12 21.73 2aiz s ALA 133 CO 0.30 0.05 1.72 0.66 0.00 0.00 0.00 175.76 178.49