#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aym s GLN 2 N 0.00 3.18 0.12 0.00 -2.07 -1.26 -5.06 119.66 114.57 2aym s GLN 2 Ca 0.00 1.76 -0.24 0.00 -1.82 0.00 0.00 55.36 55.06 2aym s GLN 2 Cb 0.00 -2.00 0.07 0.00 -1.09 0.00 0.00 33.01 29.99 2aym s GLN 2 CO 0.00 -1.03 0.61 0.99 -1.32 0.00 0.00 175.29 174.54 2aym s THR 3 N -1.64 0.00 0.39 3.63 2.01 -1.26 -5.11 115.64 113.66 2aym s THR 3 Ca 0.75 -0.02 -0.23 0.00 0.31 0.00 0.00 61.69 62.49 2aym s THR 3 Cb -0.28 -1.00 -0.10 0.00 0.01 0.00 0.00 72.50 71.12 2aym s THR 3 CO 0.31 -0.01 0.98 -0.70 -0.69 0.00 0.00 174.62 174.51 2aym s GLU 4 N -3.30 4.31 0.23 4.92 2.12 -1.26 -3.21 118.70 122.50 2aym s GLU 4 Ca -0.01 1.30 -0.08 0.00 0.36 0.00 0.00 54.97 56.54 2aym s GLU 4 Cb -0.01 -2.48 -0.02 0.00 0.26 0.00 0.00 34.13 31.89 2aym s GLU 4 CO -0.09 0.03 0.33 -0.65 -0.54 0.00 0.00 175.26 174.34 2aym s GLN 5 N -2.63 1.40 0.87 4.30 -1.52 -1.26 -4.96 119.66 115.87 2aym s GLN 5 Ca 0.57 -1.41 -0.15 0.00 -1.95 0.00 0.00 55.36 52.42 2aym s GLN 5 Cb -0.16 0.39 -0.06 0.00 -0.22 0.00 0.00 33.01 32.96 2aym s GLN 5 CO 0.21 -0.54 -0.00 -2.30 -0.25 0.00 0.00 175.29 172.40 2aym n PRO 6 N -0.33 -0.03 -1.71 2.91 -0.02 -1.26 -4.89 135.00 129.66 2aym n PRO 6 Ca -0.00 0.02 -0.40 0.00 -2.02 0.00 0.00 63.50 61.09 2aym n PRO 6 Cb 0.64 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.64 2aym n PRO 6 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2aym n PRO 7 N 0.17 1.86 -3.82 0.52 -0.04 -1.26 -5.00 135.00 127.43 2aym n PRO 7 Ca 0.05 0.67 -0.13 0.00 -0.04 0.00 0.00 63.50 64.05 2aym n PRO 7 Cb 0.53 -2.42 -0.14 0.00 -0.04 0.00 0.00 33.50 31.43 2aym n PRO 7 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2aym s ASN 8 N -0.63 -0.06 0.60 3.54 2.47 -1.26 -4.94 114.94 114.66 2aym s ASN 8 Ca 0.64 0.16 0.29 0.00 0.42 0.00 0.00 52.86 54.37 2aym s ASN 8 Cb -0.48 0.13 1.62 0.00 -1.45 0.00 0.00 41.25 41.07 2aym s ASN 8 CO 0.56 -0.06 2.03 -0.61 -3.72 0.00 0.00 177.10 175.30 2aym h GLN 9 N 6.38 0.00 -6.63 0.43 4.15 -1.88 -3.42 115.11 114.15 2aym h GLN 9 Ca -0.30 0.00 -0.67 0.00 0.77 0.00 0.00 58.65 58.45 2aym h GLN 9 Cb 1.18 0.00 -0.26 0.00 0.21 0.00 0.00 27.48 28.61 2aym h GLN 9 CO 0.46 0.00 -0.87 0.42 -1.93 0.00 0.00 178.83 176.91 2aym s ILE 10 N -4.56 2.06 0.10 2.39 1.01 -1.26 -1.35 121.20 119.59 2aym s ILE 10 Ca -0.04 -1.39 0.09 0.00 0.00 0.00 0.00 60.65 59.31 2aym s ILE 10 Cb 0.15 -1.77 -0.04 0.00 0.01 0.00 0.00 42.46 40.81 2aym s ILE 10 CO 0.52 0.31 -0.19 -0.76 0.00 0.00 0.00 174.94 174.81 2aym s LEU 11 N -1.30 2.62 -0.10 2.97 1.43 0.16 -1.28 118.68 123.17 2aym s LEU 11 Ca 0.11 -0.55 0.01 0.00 -1.03 0.00 0.00 54.13 52.67 2aym s LEU 11 Cb -0.10 -1.50 -0.02 0.00 0.03 0.00 0.00 46.19 44.60 2aym s LEU 11 CO 0.02 0.20 -0.12 0.12 0.23 0.00 0.00 176.35 176.80 2aym s PHE 12 N -1.08 2.81 0.09 0.29 5.36 -0.02 -1.41 117.98 124.02 2aym s PHE 12 Ca 0.17 -0.37 0.08 0.00 -0.96 0.00 0.00 56.93 55.85 2aym s PHE 12 Cb -0.10 -1.77 -0.03 0.00 -0.34 0.00 0.00 43.02 40.78 2aym s PHE 12 CO 0.08 0.00 -0.20 -0.51 -1.46 0.00 0.00 175.22 173.14 2aym s LEU 13 N -0.15 2.27 0.28 6.12 1.02 0.26 -0.66 118.68 127.82 2aym s LEU 13 Ca -0.00 -0.64 -0.06 0.00 0.02 0.00 0.00 54.13 53.44 2aym s LEU 13 Cb -0.13 -0.84 -0.01 0.00 0.02 0.00 0.00 46.19 45.23 2aym s LEU 13 CO 0.03 0.05 0.40 0.42 0.02 0.00 0.00 176.35 177.28 2aym s THR 14 N -1.11 0.00 -1.41 5.49 -4.23 -0.30 -1.33 115.64 112.74 2aym s THR 14 Ca 0.05 -1.61 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 2aym s THR 14 Cb -0.10 -2.44 0.00 0.00 1.34 0.00 0.00 72.50 71.31 2aym s THR 14 CO 0.04 0.00 0.00 -3.20 -0.54 0.00 0.00 174.62 170.92 2aym n ASN 15 N -0.77 -4.47 -4.82 3.99 5.15 -0.70 -0.99 115.26 112.65 2aym n ASN 15 Ca 0.00 0.20 -0.29 0.00 -0.60 0.00 0.00 54.58 53.89 2aym n ASN 15 Cb 0.63 -3.85 0.11 0.00 -0.53 0.00 0.00 39.78 36.14 2aym n ASN 15 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2aym s LEU 16 N -5.26 2.32 0.95 1.20 1.43 -0.42 -4.09 118.68 114.80 2aym s LEU 16 Ca 0.00 1.04 -0.14 0.00 -1.03 0.00 0.00 54.13 54.00 2aym s LEU 16 Cb 0.00 -3.50 -0.02 0.00 0.03 0.00 0.00 46.19 42.70 2aym s LEU 16 CO 0.00 -2.20 0.07 -2.65 0.23 0.00 0.00 176.35 171.80 2aym n PRO 17 N -3.54 -0.18 0.00 1.29 -0.02 -1.26 -4.40 135.00 126.88 2aym n PRO 17 Ca 0.07 -0.02 0.05 0.00 -2.02 0.00 0.00 63.50 61.58 2aym n PRO 17 Cb 0.59 -1.61 0.30 0.00 -0.02 0.00 0.00 33.50 32.76 2aym n PRO 17 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2aym n GLU 18 N -0.47 0.89 -0.03 -0.52 1.02 -1.26 -3.01 120.64 117.27 2aym n GLU 18 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2aym n GLU 18 Cb 0.54 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.78 2aym n GLU 18 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2aym n GLU 19 N -0.68 0.31 -1.69 3.49 -0.58 -1.26 -4.85 120.64 115.38 2aym n GLU 19 Ca 0.08 -0.64 -0.39 0.00 -0.42 0.00 0.00 57.16 55.78 2aym n GLU 19 Cb 0.04 -0.56 0.03 0.00 -0.57 0.00 0.00 31.44 30.38 2aym n GLU 19 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2aym n THR 20 N -0.06 3.24 -4.19 2.62 -1.04 -1.23 -5.03 114.28 108.59 2aym n THR 20 Ca 0.00 -0.50 -0.13 0.00 -2.04 0.00 0.00 64.05 61.38 2aym n THR 20 Cb 0.49 -1.50 -0.10 0.00 -1.82 0.00 0.00 70.33 67.39 2aym n THR 20 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 2aym s ASN 21 N -0.82 1.44 0.32 8.00 2.47 -1.26 -4.87 114.94 120.23 2aym s ASN 21 Ca 0.68 -0.90 0.08 0.00 0.42 0.00 0.00 52.86 53.13 2aym s ASN 21 Cb -0.46 0.03 0.78 0.00 -1.45 0.00 0.00 41.25 40.14 2aym s ASN 21 CO 0.53 -0.33 1.81 -0.08 -3.72 0.00 0.00 177.10 175.31 2aym h GLU 22 N 3.25 0.71 -0.52 0.43 4.81 -1.96 -0.77 114.58 120.53 2aym h GLU 22 Ca -0.37 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 58.78 2aym h GLU 22 Cb 1.18 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.38 2aym h GLU 22 CO 0.58 0.47 0.16 1.98 -0.73 0.00 0.00 179.01 181.48 2aym h MET 23 N 0.74 0.78 0.41 1.92 4.05 -1.98 -0.94 114.93 119.90 2aym h MET 23 Ca 0.54 -0.14 -0.02 0.00 -0.28 0.00 0.00 59.70 59.80 2aym h MET 23 Cb 0.87 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.54 2aym h MET 23 CO -0.31 0.67 -0.20 0.52 0.23 0.00 0.00 176.91 177.83 2aym h MET 24 N 0.76 -0.53 -0.06 0.39 2.86 -1.55 -0.73 114.93 116.07 2aym h MET 24 Ca 0.18 0.04 -0.12 0.00 -2.06 0.00 0.00 59.70 57.73 2aym h MET 24 Cb 0.22 0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 2aym h MET 24 CO -0.01 -0.28 -0.51 -0.07 1.06 0.00 0.00 176.91 177.10 2aym h LEU 25 N -0.70 0.16 0.22 1.22 3.38 -1.53 -1.36 115.31 116.70 2aym h LEU 25 Ca -0.06 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 2aym h LEU 25 Cb 0.50 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2aym h LEU 25 CO 0.09 0.64 -0.10 0.28 0.09 0.00 0.00 178.44 179.44 2aym h SER 26 N 0.12 -0.24 0.38 -0.43 0.02 -0.99 0.28 113.55 112.68 2aym h SER 26 Ca 0.00 -0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 60.86 2aym h SER 26 Cb 0.94 0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.53 2aym h SER 26 CO 0.07 -0.13 -0.30 0.00 -1.14 0.00 0.00 176.83 175.33 2aym h MET 27 N -0.34 0.00 0.32 3.45 -0.00 -0.93 -0.14 114.93 117.29 2aym h MET 27 Ca -0.03 0.00 -0.02 0.00 -0.00 0.00 0.00 59.70 59.65 2aym h MET 27 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.86 2aym h MET 27 CO 0.05 0.30 -0.15 -0.07 -0.00 0.00 0.00 176.91 177.03 2aym h LEU 28 N 0.00 -0.36 -0.15 -0.10 3.38 -0.97 -3.36 115.31 113.75 2aym h LEU 28 Ca -0.00 -0.18 -0.11 0.00 0.09 0.00 0.00 57.88 57.68 2aym h LEU 28 Cb 0.57 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 2aym h LEU 28 CO 0.04 0.07 -0.53 -0.26 0.09 0.00 0.00 178.44 177.86 2aym h PHE 29 N -0.90 0.00 0.00 1.13 -1.00 -0.84 -3.29 116.94 112.05 2aym h PHE 29 Ca -0.04 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.74 2aym h PHE 29 Cb 0.52 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.08 2aym h PHE 29 CO 0.04 0.53 0.00 -1.71 -1.61 0.00 0.00 178.31 175.55 2aym n ASN 30 N -3.28 0.40 0.18 2.17 5.15 -0.08 -1.79 115.26 118.01 2aym n ASN 30 Ca 0.01 0.64 0.13 0.00 -0.60 0.00 0.00 54.58 54.77 2aym n ASN 30 Cb 0.72 -0.71 0.69 0.00 -0.53 0.00 0.00 39.78 39.94 2aym n ASN 30 CO 0.00 0.00 0.00 0.06 1.40 0.00 0.00 177.26 178.72 2aym h GLN 31 N 0.00 0.00 -6.45 1.20 3.07 -1.74 -3.42 115.11 107.76 2aym h GLN 31 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 58.65 58.21 2aym h GLN 31 Cb 0.16 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.68 2aym h GLN 31 CO 0.00 0.00 0.15 -0.06 0.09 0.00 0.00 178.83 179.01 2aym s PHE 32 N -4.99 3.87 0.00 0.06 0.08 -0.74 -4.95 117.98 111.31 2aym s PHE 32 Ca -0.05 1.57 -0.02 0.00 0.12 0.00 0.00 56.93 58.55 2aym s PHE 32 Cb 0.18 -2.75 -0.09 0.00 -0.57 0.00 0.00 43.02 39.79 2aym s PHE 32 CO 0.67 0.48 2.20 -0.35 -0.10 0.00 0.00 175.22 178.13 2aym n PRO 33 N 1.81 1.14 0.00 0.24 -0.04 -1.26 -2.94 135.00 133.95 2aym n PRO 33 Ca -0.06 -0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.08 2aym n PRO 33 Cb 0.49 -1.42 0.00 0.00 -0.04 0.00 0.00 33.50 32.54 2aym n PRO 33 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2aym n GLY 34 N 1.99 1.00 3.56 0.55 0.00 -1.26 -5.03 105.19 106.00 2aym n GLY 34 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 2aym n GLY 34 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2aym n PHE 35 N 0.00 0.18 0.05 1.61 7.35 -1.15 -0.19 117.46 125.31 2aym n PHE 35 Ca 0.00 0.40 0.00 0.00 -0.76 0.00 0.00 57.45 57.09 2aym n PHE 35 Cb 0.00 -2.04 0.00 0.00 0.35 0.00 0.00 39.48 37.79 2aym n PHE 35 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 2aym n LYS 36 N -1.17 0.00 -3.86 -4.13 4.76 -0.16 -4.60 118.16 109.00 2aym n LYS 36 Ca 0.12 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.49 2aym n LYS 36 Cb 0.49 -0.21 -0.01 0.00 -1.84 0.00 0.00 35.03 33.46 2aym n LYS 36 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2aym s GLU 37 N -2.00 1.89 0.08 1.97 2.12 -0.64 -5.00 118.70 117.11 2aym s GLU 37 Ca 0.00 -1.12 0.04 0.00 0.36 0.00 0.00 54.97 54.25 2aym s GLU 37 Cb 0.00 0.61 -0.03 0.00 0.26 0.00 0.00 34.13 34.97 2aym s GLU 37 CO 0.00 -0.87 -0.12 0.08 -0.54 0.00 0.00 175.26 173.82 2aym s VAL 38 N -3.53 0.96 -0.34 3.70 1.01 -1.26 -0.69 120.40 120.25 2aym s VAL 38 Ca 0.13 -1.37 -0.00 0.00 0.00 0.00 0.00 61.98 60.73 2aym s VAL 38 Cb -0.05 -1.08 0.11 0.00 0.00 0.00 0.00 36.38 35.36 2aym s VAL 38 CO 0.08 -0.36 0.14 -0.60 0.00 0.00 0.00 175.10 174.36 2aym s ARG 39 N -2.05 0.77 1.02 2.72 3.52 0.01 -4.97 118.95 119.98 2aym s ARG 39 Ca -0.01 -1.24 -0.12 0.00 -0.13 0.00 0.00 55.73 54.23 2aym s ARG 39 Cb -0.08 -1.93 0.20 0.00 -1.56 0.00 0.00 34.95 31.58 2aym s ARG 39 CO 0.01 -1.04 1.08 -1.17 -0.81 0.00 0.00 175.30 173.37 2aym s LEU 40 N 1.35 1.54 -0.59 -0.88 1.98 -1.26 -0.67 118.68 120.16 2aym s LEU 40 Ca 0.12 1.33 0.04 0.00 -2.89 0.00 0.00 54.13 52.73 2aym s LEU 40 Cb -0.19 -3.49 0.14 0.00 0.66 0.00 0.00 46.19 43.31 2aym s LEU 40 CO -0.19 -3.31 0.34 -0.69 -1.89 0.00 0.00 176.35 170.62 2aym s VAL 41 N -2.84 2.70 -0.26 1.68 1.01 -1.24 -4.88 120.40 116.57 2aym s VAL 41 Ca 0.66 -3.67 0.00 0.00 0.00 0.00 0.00 61.98 58.97 2aym s VAL 41 Cb -0.20 -2.83 0.00 0.00 0.00 0.00 0.00 36.38 33.35 2aym s VAL 41 CO 0.59 -0.88 0.60 -0.81 0.00 0.00 0.00 175.10 174.60 2aym n PRO 42 N 2.69 0.68 0.00 2.72 -0.04 -1.26 -0.67 135.00 139.12 2aym n PRO 42 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2aym n PRO 42 Cb 0.33 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 2aym n PRO 42 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2aym n ASN 43 N 0.53 0.39 0.00 3.54 0.23 -1.26 -4.87 115.26 113.81 2aym n ASN 43 Ca 0.00 -0.83 0.00 0.00 -0.53 0.00 0.00 54.58 53.22 2aym n ASN 43 Cb 0.30 0.11 0.00 0.00 -2.08 0.00 0.00 39.78 38.11 2aym n ASN 43 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2aym n ARG 44 N -0.11 0.00 0.00 -3.83 5.12 0.15 -5.04 116.66 112.95 2aym n ARG 44 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2aym n ARG 44 Cb 0.10 -0.58 0.00 0.00 -1.16 0.00 0.00 32.46 30.82 2aym n ARG 44 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2aym n HIS 45 N -2.55 0.00 1.58 -1.55 8.25 0.13 -4.62 115.22 116.46 2aym n HIS 45 Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.60 2aym n HIS 45 Cb 0.35 -0.05 0.79 0.00 1.12 0.00 0.00 29.99 32.20 2aym n HIS 45 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 2aym n ASP 46 N 0.14 0.00 -4.24 0.41 5.75 -1.16 -4.22 116.55 113.22 2aym n ASP 46 Ca 0.00 -0.50 -0.14 0.00 -0.01 0.00 0.00 54.79 54.14 2aym n ASP 46 Cb 0.00 -0.15 -0.10 0.00 -1.03 0.00 0.00 41.12 39.84 2aym n ASP 46 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 2aym s ILE 47 N -2.30 1.10 0.26 2.12 -4.36 -1.26 -1.31 121.20 115.45 2aym s ILE 47 Ca 0.35 -2.04 -0.20 0.00 -0.26 0.00 0.00 60.65 58.50 2aym s ILE 47 Cb 0.20 -1.86 0.07 0.00 1.25 0.00 0.00 42.46 42.12 2aym s ILE 47 CO 0.39 -0.73 0.96 0.00 0.24 0.00 0.00 174.94 175.79 2aym s ALA 48 N -3.37 -1.28 0.10 2.27 0.00 -0.44 -3.65 121.76 115.37 2aym s ALA 48 Ca 0.17 -0.52 0.04 0.00 0.00 0.00 0.00 51.96 51.64 2aym s ALA 48 Cb 0.03 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.85 2aym s ALA 48 CO 0.00 -1.04 -0.10 -0.06 0.00 0.00 0.00 175.76 174.56 2aym s PHE 49 N -2.11 1.08 0.02 0.00 0.40 0.15 -0.57 117.98 116.95 2aym s PHE 49 Ca 0.20 -0.63 0.01 0.00 -0.60 0.00 0.00 56.93 55.91 2aym s PHE 49 Cb -0.04 -0.59 -0.01 0.00 0.51 0.00 0.00 43.02 42.89 2aym s PHE 49 CO 0.08 0.01 -0.05 0.08 0.70 0.00 0.00 175.22 176.04 2aym s VAL 50 N -2.33 0.35 -0.02 -0.44 1.01 -0.50 -0.81 120.40 117.66 2aym s VAL 50 Ca 0.05 -0.64 0.05 0.00 0.00 0.00 0.00 61.98 61.43 2aym s VAL 50 Cb -0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 36.38 35.95 2aym s VAL 50 CO 0.00 -0.20 -0.16 -0.70 0.00 0.00 0.00 175.10 174.05 2aym s GLU 51 N -0.90 1.32 0.28 2.72 2.12 0.13 -0.67 118.70 123.70 2aym s GLU 51 Ca -0.06 -0.56 0.05 0.00 0.36 0.00 0.00 54.97 54.76 2aym s GLU 51 Cb -0.06 -1.25 -0.06 0.00 0.26 0.00 0.00 34.13 33.02 2aym s GLU 51 CO -0.00 0.32 -0.01 -0.06 -0.54 0.00 0.00 175.26 174.97 2aym s PHE 52 N -0.30 1.87 0.04 5.30 0.40 -0.45 -0.99 117.98 123.84 2aym s PHE 52 Ca 0.05 -0.84 -0.21 0.00 -0.60 0.00 0.00 56.93 55.33 2aym s PHE 52 Cb -0.07 -1.13 -0.14 0.00 0.51 0.00 0.00 43.02 42.19 2aym s PHE 52 CO -0.00 0.12 1.37 1.15 0.70 0.00 0.00 175.22 178.55 2aym h THR 53 N 2.27 1.33 -3.88 0.64 2.02 -0.83 -3.45 112.91 111.01 2aym h THR 53 Ca -0.40 -1.19 -0.37 0.00 0.77 0.00 0.00 66.41 65.22 2aym h THR 53 Cb 1.23 1.83 -0.30 0.00 -1.74 0.00 0.00 68.15 69.18 2aym h THR 53 CO 0.68 0.34 -0.77 0.42 0.37 0.00 0.00 175.52 176.56 2aym s THR 54 N -4.44 0.58 0.42 3.16 -4.23 -1.26 -5.05 115.64 104.82 2aym s THR 54 Ca -0.14 -0.28 0.11 0.00 -1.18 0.00 0.00 61.69 60.19 2aym s THR 54 Cb 0.05 -0.51 0.20 0.00 1.34 0.00 0.00 72.50 73.58 2aym s THR 54 CO 0.74 0.18 1.99 -0.33 -0.54 0.00 0.00 174.62 176.65 2aym h GLU 55 N 6.19 0.22 -0.06 3.99 5.08 -1.89 -0.12 114.58 127.99 2aym h GLU 55 Ca -0.31 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 57.92 2aym h GLU 55 Cb 1.18 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 2aym h GLU 55 CO 0.49 0.28 -0.40 -0.07 -1.00 0.00 0.00 179.01 178.32 2aym h LEU 56 N 0.21 0.14 0.15 1.33 4.07 -1.92 -2.16 115.31 117.14 2aym h LEU 56 Ca 0.05 -0.06 -0.29 0.00 0.08 0.00 0.00 57.88 57.66 2aym h LEU 56 Cb 0.23 -0.04 0.01 0.00 1.08 0.00 0.00 40.66 41.94 2aym h LEU 56 CO 0.01 0.53 -1.33 1.56 -1.08 0.00 0.00 178.44 178.13 2aym h GLN 57 N 0.12 0.32 -0.92 1.13 4.20 -1.44 -0.84 115.11 117.68 2aym h GLN 57 Ca 0.01 -0.55 -0.01 0.00 0.06 0.00 0.00 58.65 58.16 2aym h GLN 57 Cb 0.76 0.20 -0.04 0.00 0.30 0.00 0.00 27.48 28.70 2aym h GLN 57 CO 0.06 1.25 0.52 0.66 -0.67 0.00 0.00 178.83 180.65 2aym h SER 58 N 0.09 1.13 -0.41 1.46 4.64 -1.40 -0.30 113.55 118.76 2aym h SER 58 Ca -0.17 -0.09 0.07 0.00 -0.47 0.00 0.00 61.79 61.13 2aym h SER 58 Cb 2.02 -0.29 -0.06 0.00 -0.31 0.00 0.00 62.40 63.76 2aym h SER 58 CO 0.21 0.89 0.07 -1.13 -0.87 0.00 0.00 176.83 176.00 2aym h ASN 59 N 1.28 -0.02 -0.62 4.97 -1.24 -1.29 0.75 115.58 119.41 2aym h ASN 59 Ca 0.33 0.07 -0.03 0.00 0.71 0.00 0.00 56.30 57.38 2aym h ASN 59 Cb -0.01 0.11 -0.03 0.00 0.73 0.00 0.00 38.32 39.13 2aym h ASN 59 CO -0.06 0.02 0.27 0.00 -1.29 0.00 0.00 177.43 176.38 2aym h ALA 60 N 1.32 0.80 -0.51 1.57 0.00 -0.48 -1.00 119.26 120.96 2aym h ALA 60 Ca 0.20 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 2aym h ALA 60 Cb 0.25 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2aym h ALA 60 CO -0.28 0.39 -0.07 0.00 0.00 0.00 0.00 179.25 179.29 2aym h ALA 61 N 1.11 0.92 0.17 0.00 0.00 -0.76 -0.72 119.26 119.97 2aym h ALA 61 Ca 0.21 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.80 2aym h ALA 61 Cb 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2aym h ALA 61 CO -0.02 0.63 -0.18 -0.22 0.00 0.00 0.00 179.25 179.47 2aym h LYS 62 N 0.83 -0.36 -0.79 0.00 3.11 -0.53 -0.69 116.57 118.12 2aym h LYS 62 Ca 0.14 0.02 0.02 0.00 -2.81 0.00 0.00 60.65 58.03 2aym h LYS 62 Cb 0.59 0.08 -0.04 0.00 -1.00 0.00 0.00 32.23 31.86 2aym h LYS 62 CO 0.04 -0.24 0.52 0.93 -2.81 0.00 0.00 179.45 177.89 2aym h GLU 63 N -0.38 0.99 -0.22 1.90 4.39 -0.94 -0.56 114.58 119.77 2aym h GLU 63 Ca 0.01 -0.06 -0.19 0.00 0.34 0.00 0.00 59.36 59.46 2aym h GLU 63 Cb 0.36 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 2aym h GLU 63 CO -0.05 0.66 -0.61 0.00 -1.16 0.00 0.00 179.01 177.85 2aym h ALA 64 N 1.52 0.51 -0.01 3.43 0.00 -0.79 -3.37 119.26 120.57 2aym h ALA 64 Ca 0.31 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2aym h ALA 64 Cb -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2aym h ALA 64 CO -0.08 0.69 -0.08 1.28 0.00 0.00 0.00 179.25 181.06 2aym n LEU 65 N -3.96 1.27 -4.67 0.00 4.77 -0.30 -4.90 117.00 109.20 2aym n LEU 65 Ca -0.05 -0.87 -0.47 0.00 -0.03 0.00 0.00 56.01 54.60 2aym n LEU 65 Cb 0.65 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.70 2aym n LEU 65 CO 0.50 0.26 1.28 0.00 -1.33 0.00 0.00 177.39 178.10 2aym n GLN 66 N -0.00 2.14 -0.77 3.23 6.02 -0.24 -1.32 117.38 126.43 2aym n GLN 66 Ca 0.03 0.77 0.00 0.00 -0.01 0.00 0.00 57.00 57.80 2aym n GLN 66 Cb 0.16 -2.56 0.00 0.00 1.02 0.00 0.00 30.24 28.86 2aym n GLN 66 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2aym n GLY 67 N 3.70 0.87 3.67 1.08 0.00 0.16 -5.00 105.19 109.67 2aym n GLY 67 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2aym n GLY 67 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2aym s PHE 68 N -3.48 2.24 -0.32 1.61 5.36 -0.43 -4.46 117.98 118.50 2aym s PHE 68 Ca 0.00 0.35 -0.28 0.00 -0.96 0.00 0.00 56.93 56.04 2aym s PHE 68 Cb 0.00 -3.87 -0.03 0.00 -0.34 0.00 0.00 43.02 38.77 2aym s PHE 68 CO 0.00 -3.56 2.01 0.15 -1.46 0.00 0.00 175.22 172.36 2aym s LYS 69 N 3.44 3.11 0.07 10.12 3.01 -1.26 -0.47 119.74 137.76 2aym s LYS 69 Ca 0.71 1.60 -0.18 0.00 -1.01 0.00 0.00 55.97 57.09 2aym s LYS 69 Cb -0.34 -4.31 -0.10 0.00 -1.01 0.00 0.00 37.83 32.07 2aym s LYS 69 CO 0.29 -2.13 1.43 0.82 0.51 0.00 0.00 175.35 176.27 2aym h ILE 70 N 7.02 1.30 -3.94 2.17 2.04 -1.53 -3.45 117.51 121.11 2aym h ILE 70 Ca -0.35 -1.21 -0.24 0.00 1.00 0.00 0.00 64.86 64.05 2aym h ILE 70 Cb 1.20 1.59 -0.15 0.00 -0.74 0.00 0.00 36.82 38.73 2aym h ILE 70 CO 1.03 0.38 -0.67 0.42 0.00 0.00 0.00 178.15 179.31 2aym s THR 71 N -4.56 0.53 0.66 -0.27 -4.23 -1.25 -5.04 115.64 101.48 2aym s THR 71 Ca -0.13 -1.95 0.17 0.00 -1.18 0.00 0.00 61.69 58.60 2aym s THR 71 Cb 0.07 -1.98 0.18 0.00 1.34 0.00 0.00 72.50 72.11 2aym s THR 71 CO 0.78 -0.59 1.49 -0.65 -0.54 0.00 0.00 174.62 175.11 2aym h PRO 72 N 2.81 0.00 0.00 3.99 0.11 -2.00 -0.77 132.00 136.14 2aym h PRO 72 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2aym h PRO 72 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2aym h PRO 72 CO 0.63 0.00 -0.04 2.41 -0.21 0.00 0.00 178.00 180.78 2aym n THR 73 N -2.78 1.13 -3.34 -1.15 -1.04 -1.26 -4.86 114.28 100.97 2aym n THR 73 Ca 0.01 -1.27 -0.26 0.00 -2.04 0.00 0.00 64.05 60.49 2aym n THR 73 Cb 0.72 0.29 -0.08 0.00 -1.82 0.00 0.00 70.33 69.43 2aym n THR 73 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2aym n HIS 74 N -0.74 0.67 -1.93 -1.42 8.25 -0.29 -5.01 115.22 114.75 2aym n HIS 74 Ca 0.06 -3.70 -0.42 0.00 -0.26 0.00 0.00 57.72 53.40 2aym n HIS 74 Cb 0.46 -0.29 -0.03 0.00 1.12 0.00 0.00 29.99 31.25 2aym n HIS 74 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2aym s ALA 75 N -1.22 2.66 -0.39 -1.41 0.00 -1.26 -1.25 121.76 118.89 2aym s ALA 75 Ca 0.35 0.17 -0.39 0.00 0.00 0.00 0.00 51.96 52.08 2aym s ALA 75 Cb 0.12 -4.09 -0.15 0.00 0.00 0.00 0.00 23.12 19.00 2aym s ALA 75 CO -0.11 -2.97 2.10 -0.12 0.00 0.00 0.00 175.76 174.66 2aym n MET 76 N 8.62 0.70 -3.35 0.00 1.56 0.38 -4.72 117.12 120.31 2aym n MET 76 Ca 0.24 0.20 -0.38 0.00 -0.27 0.00 0.00 57.70 57.50 2aym n MET 76 Cb 0.48 -2.07 -0.06 0.00 2.15 0.00 0.00 33.22 33.72 2aym n MET 76 CO 0.00 0.00 0.00 0.21 -0.73 0.00 0.00 175.97 175.45 2aym s LYS 77 N 5.73 4.09 0.02 2.12 2.20 -0.16 -0.67 119.74 133.06 2aym s LYS 77 Ca 1.12 0.61 0.03 0.00 -0.36 0.00 0.00 55.97 57.37 2aym s LYS 77 Cb -1.12 -3.19 -0.02 0.00 -1.51 0.00 0.00 37.83 32.00 2aym s LYS 77 CO 0.58 0.63 -0.10 0.42 -0.36 0.00 0.00 175.35 176.52 2aym s ILE 78 N -1.16 0.75 0.05 5.43 1.01 -1.26 -1.15 121.20 124.87 2aym s ILE 78 Ca 0.29 -0.73 -0.02 0.00 0.00 0.00 0.00 60.65 60.18 2aym s ILE 78 Cb -0.18 -0.70 -0.03 0.00 0.01 0.00 0.00 42.46 41.57 2aym s ILE 78 CO 0.18 -0.02 0.02 0.42 0.00 0.00 0.00 174.94 175.53 2aym s THR 79 N -0.69 0.19 0.20 2.92 -4.23 0.17 -4.99 115.64 109.21 2aym s THR 79 Ca -0.01 -1.54 -0.30 0.00 -1.18 0.00 0.00 61.69 58.66 2aym s THR 79 Cb -0.06 -1.29 -0.08 0.00 1.34 0.00 0.00 72.50 72.41 2aym s THR 79 CO 0.00 -0.85 1.07 -0.36 -0.54 0.00 0.00 174.62 173.94 2aym s PHE 80 N -3.50 3.65 1.10 3.99 0.08 -1.20 -0.84 117.98 121.26 2aym s PHE 80 Ca 0.03 1.67 -0.18 0.00 0.12 0.00 0.00 56.93 58.58 2aym s PHE 80 Cb 0.05 -3.23 0.25 0.00 -0.57 0.00 0.00 43.02 39.51 2aym s PHE 80 CO -0.09 -0.42 1.19 0.00 -0.10 0.00 0.00 175.22 175.80 2aym s ALA 81 N -0.55 1.26 -0.48 5.36 0.00 -0.41 -4.47 121.76 122.47 2aym s ALA 81 Ca 0.47 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 51.45 2aym s ALA 81 Cb -0.29 -2.86 0.15 0.00 0.00 0.00 0.00 23.12 20.12 2aym s ALA 81 CO 0.36 -3.09 0.31 0.15 0.00 0.00 0.00 175.76 173.48 2aym s LYS 82 N -5.57 1.44 0.00 0.00 1.02 -1.26 -4.80 119.74 110.57 2aym s LYS 82 Ca 0.72 -2.28 0.00 0.00 0.02 0.00 0.00 55.97 54.43 2aym s LYS 82 Cb -0.08 -2.37 0.00 0.00 -0.52 0.00 0.00 37.83 34.86 2aym s LYS 82 CO 0.55 -1.23 0.45 1.63 -0.92 0.00 0.00 175.35 175.83