#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 0.87 -0.95 0.00 -2.07 -1.26 -5.07 119.66 111.18 2aym s GLN 2 Ca 0.00 -0.41 -0.08 0.00 -1.82 0.00 0.00 55.36 53.06 2aym s GLN 2 Cb 0.00 0.38 -0.11 0.00 -1.09 0.00 0.00 33.01 32.19 2aym s GLN 2 CO 0.00 -0.29 3.10 0.25 -1.32 0.00 0.00 175.29 177.03 2aym n THR 3 N 0.57 3.91 -1.87 3.63 -2.24 -1.26 -4.96 114.28 112.06 2aym n THR 3 Ca -0.19 -2.47 -0.37 0.00 -2.27 0.00 0.00 64.05 58.76 2aym n THR 3 Cb 0.59 -2.26 0.05 0.00 -2.10 0.00 0.00 70.33 66.61 2aym n THR 3 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2aym s GLU 4 N 1.04 2.86 0.26 -0.78 2.12 -1.26 -4.59 118.70 118.35 2aym s GLU 4 Ca 0.66 1.99 -0.05 0.00 0.36 0.00 0.00 54.97 57.93 2aym s GLU 4 Cb 0.24 -1.97 -0.02 0.00 0.26 0.00 0.00 34.13 32.65 2aym s GLU 4 CO -0.06 -1.34 0.34 -0.65 -0.54 0.00 0.00 175.26 173.01 2aym s GLN 5 N -3.26 1.51 0.89 4.30 -1.52 -1.26 -5.01 119.66 115.32 2aym s GLN 5 Ca 0.78 -1.54 -0.12 0.00 -1.95 0.00 0.00 55.36 52.53 2aym s GLN 5 Cb -0.35 0.38 0.09 0.00 -0.22 0.00 0.00 33.01 32.91 2aym s GLN 5 CO 0.38 -0.58 0.90 -0.35 -0.25 0.00 0.00 175.29 175.39 2aym n PRO 6 N -0.39 -0.23 -1.52 2.91 -0.04 -1.26 -4.87 135.00 129.59 2aym n PRO 6 Ca 0.01 -0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.04 2aym n PRO 6 Cb 0.63 -2.20 0.01 0.00 -0.04 0.00 0.00 33.50 31.90 2aym n PRO 6 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2aym n PRO 7 N -3.06 0.91 -3.80 0.54 -0.02 -1.26 -4.97 135.00 123.34 2aym n PRO 7 Ca 0.11 0.33 -0.12 0.00 -2.02 0.00 0.00 63.50 61.79 2aym n PRO 7 Cb 0.52 -1.72 -0.09 0.00 -0.02 0.00 0.00 33.50 32.19 2aym n PRO 7 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2aym s ASN 8 N -0.84 -0.10 0.00 2.55 2.47 -1.26 -4.96 114.94 112.79 2aym s ASN 8 Ca 0.63 -0.06 0.08 0.00 0.42 0.00 0.00 52.86 53.94 2aym s ASN 8 Cb -0.61 0.27 0.48 0.00 -1.45 0.00 0.00 41.25 39.95 2aym s ASN 8 CO 0.57 -0.43 1.08 0.00 -3.72 0.00 0.00 177.10 174.60 2aym n GLN 9 N 1.27 0.72 -4.27 0.43 10.64 -1.26 -4.62 117.38 120.29 2aym n GLN 9 Ca -0.22 0.00 -0.17 0.00 -1.83 0.00 0.00 57.00 54.78 2aym n GLN 9 Cb 0.56 -1.18 -0.14 0.00 -0.86 0.00 0.00 30.24 28.63 2aym n GLN 9 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 2aym s ILE 10 N -2.00 0.72 0.05 -0.39 1.01 -1.26 -0.71 121.20 118.61 2aym s ILE 10 Ca 0.12 -0.63 0.07 0.00 0.00 0.00 0.00 60.65 60.21 2aym s ILE 10 Cb 0.06 -0.65 -0.03 0.00 0.01 0.00 0.00 42.46 41.85 2aym s ILE 10 CO 0.09 0.03 -0.20 -0.76 0.00 0.00 0.00 174.94 174.11 2aym s LEU 11 N -0.67 2.18 -0.08 2.97 1.43 0.19 -0.96 118.68 123.73 2aym s LEU 11 Ca 0.00 -0.52 0.01 0.00 -1.03 0.00 0.00 54.13 52.59 2aym s LEU 11 Cb -0.05 -0.90 -0.03 0.00 0.03 0.00 0.00 46.19 45.24 2aym s LEU 11 CO 0.00 0.13 -0.09 0.12 0.23 0.00 0.00 176.35 176.74 2aym s PHE 12 N -0.84 2.88 0.07 0.29 5.36 0.21 -1.35 117.98 124.61 2aym s PHE 12 Ca 0.06 -0.11 0.07 0.00 -0.96 0.00 0.00 56.93 55.99 2aym s PHE 12 Cb -0.09 -1.73 -0.03 0.00 -0.34 0.00 0.00 43.02 40.83 2aym s PHE 12 CO 0.02 0.21 -0.19 -0.51 -1.46 0.00 0.00 175.22 173.29 2aym s LEU 13 N -0.56 2.23 0.25 6.12 1.02 0.41 -0.36 118.68 127.80 2aym s LEU 13 Ca 0.08 -0.59 -0.05 0.00 0.02 0.00 0.00 54.13 53.60 2aym s LEU 13 Cb -0.12 -0.83 -0.02 0.00 0.02 0.00 0.00 46.19 45.25 2aym s LEU 13 CO 0.02 0.07 0.33 0.42 0.02 0.00 0.00 176.35 177.21 2aym s THR 14 N -1.01 0.00 -1.35 5.49 -4.23 -0.30 -1.32 115.64 112.92 2aym s THR 14 Ca 0.05 -1.72 0.00 0.00 -1.18 0.00 0.00 61.69 58.84 2aym s THR 14 Cb -0.09 -2.42 0.00 0.00 1.34 0.00 0.00 72.50 71.33 2aym s THR 14 CO 0.03 0.00 0.00 -3.20 -0.54 0.00 0.00 174.62 170.91 2aym n ASN 15 N -0.60 -4.02 -4.76 3.99 5.15 -0.70 -1.21 115.26 113.11 2aym n ASN 15 Ca 0.01 0.25 -0.29 0.00 -0.60 0.00 0.00 54.58 53.95 2aym n ASN 15 Cb 0.63 -3.55 0.13 0.00 -0.53 0.00 0.00 39.78 36.47 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 -4.79 2.12 0.95 1.20 1.43 -0.37 -4.12 118.68 115.10 2aym s LEU 16 Ca 0.00 1.19 -0.14 0.00 -1.03 0.00 0.00 54.13 54.15 2aym s LEU 16 Cb 0.00 -3.58 -0.02 0.00 0.03 0.00 0.00 46.19 42.63 2aym s LEU 16 CO 0.00 -2.53 0.09 -2.65 0.23 0.00 0.00 176.35 171.49 2aym n PRO 17 N -3.78 -0.19 0.00 1.29 -0.02 -1.26 -4.41 135.00 126.63 2aym n PRO 17 Ca 0.06 -0.02 0.10 0.00 -2.02 0.00 0.00 63.50 61.62 2aym n PRO 17 Cb 0.57 -1.63 0.62 0.00 -0.02 0.00 0.00 33.50 33.05 2aym n PRO 17 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2aym n GLU 18 N -0.56 0.70 -0.12 -0.52 0.28 -1.26 -3.03 120.64 116.12 2aym n GLU 18 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.05 2aym n GLU 18 Cb 0.54 -1.47 0.00 0.00 1.43 0.00 0.00 31.44 31.94 2aym n GLU 18 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 2aym n GLU 19 N -0.97 0.20 -1.66 3.44 0.28 -1.26 -4.77 120.64 115.90 2aym n GLU 19 Ca 0.16 -0.72 -0.40 0.00 -0.16 0.00 0.00 57.16 56.03 2aym n GLU 19 Cb 0.07 -0.55 0.03 0.00 1.43 0.00 0.00 31.44 32.42 2aym n GLU 19 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 2aym n THR 20 N -0.06 2.94 -4.14 3.84 -1.04 -1.23 -5.03 114.28 109.56 2aym n THR 20 Ca 0.00 -0.50 -0.11 0.00 -2.04 0.00 0.00 64.05 61.40 2aym n THR 20 Cb 0.54 -1.35 -0.10 0.00 -1.82 0.00 0.00 70.33 67.60 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 -0.81 1.09 0.36 8.00 3.84 -1.26 -4.82 114.94 121.33 2aym s ASN 21 Ca 0.66 -0.88 0.14 0.00 0.21 0.00 0.00 52.86 52.99 2aym s ASN 21 Cb -0.49 0.07 0.98 0.00 -0.55 0.00 0.00 41.25 41.26 2aym s ASN 21 CO 0.54 -0.39 1.77 -0.08 -2.79 0.00 0.00 177.10 176.15 2aym h GLU 22 N 3.39 0.50 -0.95 0.43 4.81 -1.97 -0.50 114.58 120.29 2aym h GLU 22 Ca -0.36 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 2aym h GLU 22 Cb 1.18 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 30.40 2aym h GLU 22 CO 0.58 0.33 0.61 1.98 -0.73 0.00 0.00 179.01 181.78 2aym h MET 23 N 0.51 1.27 0.28 1.92 4.05 -1.98 -1.05 114.93 119.92 2aym h MET 23 Ca 0.60 -0.09 -0.01 0.00 -0.28 0.00 0.00 59.70 59.91 2aym h MET 23 Cb 1.30 -0.28 0.00 0.00 -0.80 0.00 0.00 31.60 31.82 2aym h MET 23 CO -0.35 0.85 -0.13 0.52 0.23 0.00 0.00 176.91 178.03 2aym h MET 24 N 1.30 -0.36 -0.12 0.39 2.86 -1.50 -1.46 114.93 116.04 2aym h MET 24 Ca 0.35 0.02 -0.17 0.00 -2.06 0.00 0.00 59.70 57.84 2aym h MET 24 Cb -0.12 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 2aym h MET 24 CO -0.07 -0.09 -0.66 -0.07 1.06 0.00 0.00 176.91 177.09 2aym h LEU 25 N -0.61 0.52 -0.16 1.22 3.38 -1.50 -1.28 115.31 116.89 2aym h LEU 25 Ca -0.04 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.60 2aym h LEU 25 Cb 0.44 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2aym h LEU 25 CO 0.06 1.04 0.04 0.77 0.09 0.00 0.00 178.44 180.44 2aym h SER 26 N 0.33 0.24 0.08 -0.43 4.64 -1.18 0.33 113.55 117.55 2aym h SER 26 Ca -0.02 -0.23 -0.05 0.00 -0.47 0.00 0.00 61.79 61.03 2aym h SER 26 Cb 1.21 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 2aym h SER 26 CO 0.12 0.40 -0.15 0.00 -0.87 0.00 0.00 176.83 176.33 2aym h MET 27 N 0.06 0.15 0.40 4.77 -0.00 -1.16 -0.32 114.93 118.83 2aym h MET 27 Ca 0.05 -0.03 -0.02 0.00 -0.00 0.00 0.00 59.70 59.70 2aym h MET 27 Cb 0.26 -0.02 0.00 0.00 -0.00 0.00 0.00 31.60 31.84 2aym h MET 27 CO 0.00 0.31 -0.19 -0.07 -0.00 0.00 0.00 176.91 176.96 2aym h LEU 28 N 0.14 -0.45 -0.41 -0.10 3.38 -0.89 -3.37 115.31 113.61 2aym h LEU 28 Ca 0.03 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 2aym h LEU 28 Cb 0.36 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2aym h LEU 28 CO 0.02 -0.02 -0.45 -0.26 0.09 0.00 0.00 178.44 177.83 2aym h PHE 29 N -1.04 0.00 0.00 1.13 -1.00 -0.85 -3.25 116.94 111.92 2aym h PHE 29 Ca -0.05 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.73 2aym h PHE 29 Cb 0.51 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.07 2aym h PHE 29 CO 0.02 0.45 0.00 -1.71 -1.61 0.00 0.00 178.31 175.46 2aym n ASN 30 N -3.34 0.27 0.10 2.17 5.15 -0.14 -1.75 115.26 117.73 2aym n ASN 30 Ca 0.01 0.59 0.15 0.00 -0.60 0.00 0.00 54.58 54.74 2aym n ASN 30 Cb 0.64 -0.64 0.67 0.00 -0.53 0.00 0.00 39.78 39.92 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 -6.28 1.20 3.07 -1.75 -3.42 115.11 107.94 2aym h GLN 31 Ca 0.00 0.00 -0.55 0.00 0.09 0.00 0.00 58.65 58.19 2aym h GLN 31 Cb 0.15 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 27.67 2aym h GLN 31 CO 0.00 0.00 0.13 -0.06 0.09 0.00 0.00 178.83 178.99 2aym s PHE 32 N -5.03 3.74 0.00 0.06 0.08 -0.72 -4.95 117.98 111.16 2aym s PHE 32 Ca -0.05 1.44 0.00 0.00 0.12 0.00 0.00 56.93 58.44 2aym s PHE 32 Cb 0.19 -2.78 0.00 0.00 -0.57 0.00 0.00 43.02 39.85 2aym s PHE 32 CO 0.71 0.30 1.18 -0.35 -0.10 0.00 0.00 175.22 176.96 2aym n PRO 33 N 2.71 0.77 0.00 0.24 -0.04 -1.26 -2.66 135.00 134.75 2aym n PRO 33 Ca -0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.43 2aym n PRO 33 Cb 0.50 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.85 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 1.15 1.00 3.63 0.55 0.00 -1.26 -5.03 105.19 105.23 2aym n GLY 34 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 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 0.85 0.00 1.61 -0.00 -1.09 -0.27 117.46 118.56 2aym n PHE 35 Ca 0.00 0.41 0.00 0.00 -0.00 0.00 0.00 57.45 57.86 2aym n PHE 35 Cb 0.07 -2.13 0.00 0.00 -0.00 0.00 0.00 39.48 37.43 2aym n PHE 35 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 2aym n LYS 36 N -1.45 0.00 -3.74 -4.13 5.02 -0.26 -4.70 118.16 108.89 2aym n LYS 36 Ca 0.14 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.33 2aym n LYS 36 Cb 0.48 -0.20 -0.04 0.00 -0.02 0.00 0.00 35.03 35.25 2aym n LYS 36 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2aym s GLU 37 N -1.92 1.41 0.08 1.97 2.56 -0.61 -5.00 118.70 117.18 2aym s GLU 37 Ca 0.00 -0.86 0.06 0.00 0.00 0.00 0.00 54.97 54.17 2aym s GLU 37 Cb 0.00 0.53 -0.03 0.00 2.00 0.00 0.00 34.13 36.63 2aym s GLU 37 CO 0.00 -0.60 -0.16 0.08 -0.56 0.00 0.00 175.26 174.02 2aym s VAL 38 N -3.87 1.29 -0.34 3.70 1.01 -1.26 -0.69 120.40 120.24 2aym s VAL 38 Ca 0.09 -1.34 -0.01 0.00 0.00 0.00 0.00 61.98 60.73 2aym s VAL 38 Cb -0.01 -1.21 0.11 0.00 0.00 0.00 0.00 36.38 35.27 2aym s VAL 38 CO -0.02 -0.14 0.15 -0.13 0.00 0.00 0.00 175.10 174.96 2aym s ARG 39 N -1.71 0.71 1.09 2.72 0.52 0.10 -4.97 118.95 117.41 2aym s ARG 39 Ca 0.01 -1.22 -0.13 0.00 -0.52 0.00 0.00 55.73 53.87 2aym s ARG 39 Cb -0.10 -1.79 0.24 0.00 0.52 0.00 0.00 34.95 33.81 2aym s ARG 39 CO 0.03 -1.07 1.07 -1.17 0.02 0.00 0.00 175.30 174.18 2aym s LEU 40 N 1.34 1.15 -0.60 2.53 1.98 -1.26 -0.81 118.68 123.01 2aym s LEU 40 Ca 0.13 1.19 0.04 0.00 -2.89 0.00 0.00 54.13 52.60 2aym s LEU 40 Cb -0.20 -3.22 0.15 0.00 0.66 0.00 0.00 46.19 43.59 2aym s LEU 40 CO -0.17 -3.63 0.36 -0.69 -1.89 0.00 0.00 176.35 170.33 2aym s VAL 41 N -2.81 2.80 -0.19 1.68 1.01 -1.25 -4.87 120.40 116.77 2aym s VAL 41 Ca 0.67 -3.66 0.00 0.00 0.00 0.00 0.00 61.98 58.99 2aym s VAL 41 Cb -0.20 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.29 2aym s VAL 41 CO 0.60 -0.88 0.56 -0.81 0.00 0.00 0.00 175.10 174.56 2aym n PRO 42 N 2.71 0.62 0.00 2.72 -0.04 -1.26 -0.81 135.00 138.93 2aym n PRO 42 Ca 0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2aym n PRO 42 Cb 0.33 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 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 0.60 0.23 0.00 3.54 0.23 -1.26 -4.89 115.26 113.70 2aym n ASN 43 Ca 0.00 -0.59 0.00 0.00 -0.53 0.00 0.00 54.58 53.46 2aym n ASN 43 Cb 0.28 0.28 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 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 -0.28 0.81 0.00 -3.83 1.74 -0.02 -5.04 116.66 110.04 2aym n ARG 44 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2aym n ARG 44 Cb 0.05 -0.76 0.00 0.00 -1.02 0.00 0.00 32.46 30.73 2aym n ARG 44 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2aym n HIS 45 N -1.74 0.00 1.58 -1.55 8.25 0.01 -4.66 115.22 117.11 2aym n HIS 45 Ca 0.00 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.61 2aym n HIS 45 Cb 0.26 -0.27 0.80 0.00 1.12 0.00 0.00 29.99 31.91 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 0.00 0.00 -4.22 0.41 5.75 -1.17 -4.30 116.55 113.03 2aym n ASP 46 Ca 0.00 -0.45 -0.13 0.00 -0.01 0.00 0.00 54.79 54.20 2aym n ASP 46 Cb 0.00 -0.18 -0.10 0.00 -1.03 0.00 0.00 41.12 39.81 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 -2.35 0.98 0.26 2.12 -4.36 -1.26 -1.24 121.20 115.35 2aym s ILE 47 Ca 0.35 -2.01 -0.20 0.00 -0.26 0.00 0.00 60.65 58.53 2aym s ILE 47 Cb 0.20 -1.79 0.07 0.00 1.25 0.00 0.00 42.46 42.19 2aym s ILE 47 CO 0.41 -0.79 0.96 0.00 0.24 0.00 0.00 174.94 175.76 2aym s ALA 48 N -3.45 -1.30 0.09 2.27 0.00 -0.44 -3.74 121.76 115.19 2aym s ALA 48 Ca 0.15 -0.51 0.04 0.00 0.00 0.00 0.00 51.96 51.64 2aym s ALA 48 Cb 0.04 0.74 -0.03 0.00 0.00 0.00 0.00 23.12 23.86 2aym s ALA 48 CO -0.01 -1.04 -0.11 -0.06 0.00 0.00 0.00 175.76 174.54 2aym s PHE 49 N -2.12 1.09 0.02 0.00 0.40 0.01 -0.44 117.98 116.94 2aym s PHE 49 Ca 0.20 -0.59 0.00 0.00 -0.60 0.00 0.00 56.93 55.94 2aym s PHE 49 Cb -0.04 -0.60 -0.01 0.00 0.51 0.00 0.00 43.02 42.88 2aym s PHE 49 CO 0.08 0.02 -0.03 0.08 0.70 0.00 0.00 175.22 176.07 2aym s VAL 50 N -2.09 0.15 0.01 -0.44 1.01 -0.46 -0.72 120.40 117.86 2aym s VAL 50 Ca 0.03 -0.64 0.03 0.00 0.00 0.00 0.00 61.98 61.40 2aym s VAL 50 Cb -0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 36.38 36.08 2aym s VAL 50 CO 0.01 -0.31 -0.08 -0.70 0.00 0.00 0.00 175.10 174.02 2aym s GLU 51 N -0.99 0.61 0.21 2.72 2.12 0.14 -0.64 118.70 122.87 2aym s GLU 51 Ca -0.10 -0.42 0.02 0.00 0.36 0.00 0.00 54.97 54.83 2aym s GLU 51 Cb -0.07 -0.55 -0.05 0.00 0.26 0.00 0.00 34.13 33.72 2aym s GLU 51 CO -0.01 0.14 0.02 -0.06 -0.54 0.00 0.00 175.26 174.81 2aym s PHE 52 N -0.51 1.42 0.06 5.30 0.40 0.11 -1.11 117.98 123.65 2aym s PHE 52 Ca -0.00 -1.01 -0.20 0.00 -0.60 0.00 0.00 56.93 55.12 2aym s PHE 52 Cb -0.05 -0.82 -0.12 0.00 0.51 0.00 0.00 43.02 42.54 2aym s PHE 52 CO 0.00 -0.17 1.42 1.15 0.70 0.00 0.00 175.22 178.32 2aym h THR 53 N 2.54 1.31 -3.85 0.64 2.02 -0.91 -3.45 112.91 111.21 2aym h THR 53 Ca -0.38 -1.13 -0.19 0.00 0.77 0.00 0.00 66.41 65.48 2aym h THR 53 Cb 1.22 1.67 -0.24 0.00 -1.74 0.00 0.00 68.15 69.06 2aym h THR 53 CO 0.63 0.34 -0.69 0.42 0.37 0.00 0.00 175.52 176.59 2aym s THR 54 N -4.59 0.07 0.41 3.16 -4.23 -1.26 -4.99 115.64 104.21 2aym s THR 54 Ca -0.14 -0.54 0.07 0.00 -1.18 0.00 0.00 61.69 59.90 2aym s THR 54 Cb 0.06 -0.18 0.26 0.00 1.34 0.00 0.00 72.50 73.98 2aym s THR 54 CO 0.75 -0.30 2.05 -0.33 -0.54 0.00 0.00 174.62 176.25 2aym h GLU 55 N 5.22 0.52 -0.19 3.99 5.08 -1.91 -1.08 114.58 126.21 2aym h GLU 55 Ca -0.29 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 57.91 2aym h GLU 55 Cb 1.21 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 2aym h GLU 55 CO 0.45 0.36 -0.40 -0.07 -1.00 0.00 0.00 179.01 178.34 2aym h LEU 56 N 0.53 0.45 0.22 1.33 -0.00 -1.94 -1.44 115.31 114.45 2aym h LEU 56 Ca 0.14 -0.19 -0.32 0.00 -0.00 0.00 0.00 57.88 57.50 2aym h LEU 56 Cb -0.04 -0.13 0.03 0.00 -0.00 0.00 0.00 40.66 40.53 2aym h LEU 56 CO -0.03 0.81 -1.46 1.56 -0.00 0.00 0.00 178.44 179.32 2aym h GLN 57 N 0.35 0.45 -0.87 1.13 4.20 -1.63 -0.76 115.11 117.99 2aym h GLN 57 Ca 0.03 -0.78 -0.03 0.00 0.06 0.00 0.00 58.65 57.94 2aym h GLN 57 Cb 0.86 0.29 -0.04 0.00 0.30 0.00 0.00 27.48 28.89 2aym h GLN 57 CO 0.07 1.37 0.43 0.66 -0.67 0.00 0.00 178.83 180.69 2aym h SER 58 N 0.12 1.13 -0.03 1.46 4.64 -1.41 -0.58 113.55 118.88 2aym h SER 58 Ca -0.24 -0.13 0.02 0.00 -0.47 0.00 0.00 61.79 60.97 2aym h SER 58 Cb 2.12 -0.29 -0.02 0.00 -0.31 0.00 0.00 62.40 63.89 2aym h SER 58 CO 0.25 0.94 -0.09 -1.13 -0.87 0.00 0.00 176.83 175.92 2aym h ASN 59 N 1.23 -0.27 -0.74 4.97 -1.24 -1.19 0.13 115.58 118.47 2aym h ASN 59 Ca 0.30 0.05 -0.00 0.00 0.71 0.00 0.00 56.30 57.36 2aym h ASN 59 Cb 0.10 0.12 -0.04 0.00 0.73 0.00 0.00 38.32 39.24 2aym h ASN 59 CO -0.04 -0.13 0.46 0.00 -1.29 0.00 0.00 177.43 176.43 2aym h ALA 60 N 0.87 0.94 -0.83 1.57 0.00 -0.88 -0.88 119.26 120.05 2aym h ALA 60 Ca 0.05 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2aym h ALA 60 Cb 0.21 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2aym h ALA 60 CO -0.12 0.40 0.40 0.00 0.00 0.00 0.00 179.25 179.93 2aym h ALA 61 N 1.25 1.06 0.43 0.00 0.00 -0.82 -0.78 119.26 120.40 2aym h ALA 61 Ca 0.27 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2aym h ALA 61 Cb -0.06 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.40 2aym h ALA 61 CO -0.05 0.63 -0.25 -0.22 0.00 0.00 0.00 179.25 179.35 2aym h LYS 62 N 1.17 -0.62 -0.12 0.00 3.64 -0.17 -0.69 116.57 119.78 2aym h LYS 62 Ca 0.28 0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.69 2aym h LYS 62 Cb 0.11 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 2aym h LYS 62 CO -0.04 -0.41 -0.02 0.93 -2.27 0.00 0.00 179.45 177.64 2aym h GLU 63 N -0.64 0.17 -0.19 1.90 4.39 -0.91 0.48 114.58 119.77 2aym h GLU 63 Ca -0.05 -0.02 -0.21 0.00 0.34 0.00 0.00 59.36 59.41 2aym h GLU 63 Cb 0.52 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 29.15 2aym h GLU 63 CO 0.06 0.21 -0.71 0.00 -1.16 0.00 0.00 179.01 177.40 2aym h ALA 64 N 1.81 0.35 -0.01 3.43 0.00 -0.91 -3.38 119.26 120.56 2aym h ALA 64 Ca 0.04 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2aym h ALA 64 Cb 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2aym h ALA 64 CO 0.01 0.68 -0.18 1.28 0.00 0.00 0.00 179.25 181.04 2aym n LEU 65 N -3.96 1.25 -4.69 0.00 4.77 -0.29 -4.87 117.00 109.22 2aym n LEU 65 Ca -0.07 -0.79 -0.44 0.00 -0.03 0.00 0.00 56.01 54.68 2aym n LEU 65 Cb 0.72 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.77 2aym n LEU 65 CO 0.52 0.25 1.36 0.00 -1.33 0.00 0.00 177.39 178.19 2aym n GLN 66 N -0.18 2.50 -0.71 3.23 6.02 0.12 -1.43 117.38 126.92 2aym n GLN 66 Ca 0.04 0.91 0.00 0.00 -0.01 0.00 0.00 57.00 57.94 2aym n GLN 66 Cb 0.21 -2.74 0.00 0.00 1.02 0.00 0.00 30.24 28.73 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 3.91 0.84 3.67 1.08 0.00 0.31 -5.01 105.19 109.99 2aym n GLY 67 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -3.30 2.60 -0.35 1.61 5.36 -0.52 -4.52 117.98 118.86 2aym s PHE 68 Ca 0.00 0.70 -0.28 0.00 -0.96 0.00 0.00 56.93 56.40 2aym s PHE 68 Cb 0.00 -3.68 -0.04 0.00 -0.34 0.00 0.00 43.02 38.96 2aym s PHE 68 CO 0.00 -2.59 2.02 0.15 -1.46 0.00 0.00 175.22 173.34 2aym s LYS 69 N 3.22 3.03 0.08 10.12 3.01 -1.26 -0.36 119.74 137.58 2aym s LYS 69 Ca 0.64 1.53 -0.15 0.00 -1.01 0.00 0.00 55.97 56.97 2aym s LYS 69 Cb -0.29 -4.33 -0.15 0.00 -1.01 0.00 0.00 37.83 32.06 2aym s LYS 69 CO 0.23 -2.22 1.30 0.82 0.51 0.00 0.00 175.35 175.99 2aym h ILE 70 N 7.04 1.32 -3.96 2.17 2.04 -1.66 -3.45 117.51 121.01 2aym h ILE 70 Ca -0.34 -1.82 -0.26 0.00 1.00 0.00 0.00 64.86 63.45 2aym h ILE 70 Cb 1.20 1.99 -0.21 0.00 -0.74 0.00 0.00 36.82 39.07 2aym h ILE 70 CO 1.05 0.57 -0.73 -0.89 0.00 0.00 0.00 178.15 178.14 2aym s THR 71 N -3.83 0.50 0.66 -0.27 2.01 -1.24 -5.04 115.64 108.43 2aym s THR 71 Ca -0.12 -1.15 0.14 0.00 0.31 0.00 0.00 61.69 60.87 2aym s THR 71 Cb 0.07 -0.68 0.15 0.00 0.01 0.00 0.00 72.50 72.05 2aym s THR 71 CO 0.86 -0.45 1.42 -0.65 -0.69 0.00 0.00 174.62 175.11 2aym h PRO 72 N 4.35 0.00 0.00 4.92 0.11 -2.00 0.62 132.00 140.01 2aym h PRO 72 Ca -0.35 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.75 2aym h PRO 72 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2aym h PRO 72 CO 0.43 0.00 -0.20 2.41 -0.21 0.00 0.00 178.00 180.43 2aym n THR 73 N -2.72 1.44 -3.40 -1.15 -1.04 -1.26 -4.85 114.28 101.30 2aym n THR 73 Ca 0.00 -1.83 -0.26 0.00 -2.04 0.00 0.00 64.05 59.92 2aym n THR 73 Cb 0.76 -0.03 -0.09 0.00 -1.82 0.00 0.00 70.33 69.14 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 -1.02 0.18 -2.06 -1.42 8.25 0.21 -5.02 115.22 114.34 2aym n HIS 74 Ca 0.12 -3.59 -0.43 0.00 -0.26 0.00 0.00 57.72 53.57 2aym n HIS 74 Cb 0.68 -0.11 -0.03 0.00 1.12 0.00 0.00 29.99 31.66 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 -0.73 3.19 0.12 -1.41 0.00 -1.26 -1.59 121.76 120.08 2aym s ALA 75 Ca 0.33 0.48 -0.35 0.00 0.00 0.00 0.00 51.96 52.41 2aym s ALA 75 Cb 0.08 -3.89 -0.16 0.00 0.00 0.00 0.00 23.12 19.15 2aym s ALA 75 CO -0.15 -2.09 1.33 -0.12 0.00 0.00 0.00 175.76 174.73 2aym n MET 76 N 7.84 1.32 -4.62 0.00 1.56 0.52 -4.66 117.12 119.08 2aym n MET 76 Ca 0.20 0.47 -0.31 0.00 -0.27 0.00 0.00 57.70 57.80 2aym n MET 76 Cb 0.45 -2.10 -0.12 0.00 2.15 0.00 0.00 33.22 33.60 2aym n MET 76 CO 0.00 0.00 0.00 0.15 -0.73 0.00 0.00 175.97 175.39 2aym s LYS 77 N 0.30 2.13 0.01 2.12 1.02 -0.35 -0.53 119.74 124.44 2aym s LYS 77 Ca 0.80 -0.95 0.01 0.00 0.02 0.00 0.00 55.97 55.85 2aym s LYS 77 Cb -0.88 -2.23 -0.01 0.00 -0.52 0.00 0.00 37.83 34.19 2aym s LYS 77 CO 0.47 0.55 -0.05 0.42 -0.92 0.00 0.00 175.35 175.82 2aym s ILE 78 N -0.94 0.37 0.04 2.17 1.01 -1.26 -1.15 121.20 121.44 2aym s ILE 78 Ca 0.15 -0.40 0.01 0.00 0.00 0.00 0.00 60.65 60.41 2aym s ILE 78 Cb -0.11 -0.35 -0.03 0.00 0.01 0.00 0.00 42.46 41.98 2aym s ILE 78 CO 0.06 -0.03 -0.05 -0.89 0.00 0.00 0.00 174.94 174.02 2aym s THR 79 N -0.43 0.37 0.12 2.92 2.01 0.51 -5.00 115.64 116.14 2aym s THR 79 Ca -0.02 -1.23 -0.31 0.00 0.31 0.00 0.00 61.69 60.45 2aym s THR 79 Cb -0.04 -0.75 -0.07 0.00 0.01 0.00 0.00 72.50 71.65 2aym s THR 79 CO -0.00 -0.57 1.31 -0.36 -0.69 0.00 0.00 174.62 174.32 2aym s PHE 80 N -2.03 3.31 0.98 4.92 0.08 -1.26 -0.62 117.98 123.35 2aym s PHE 80 Ca -0.07 1.12 -0.14 0.00 0.12 0.00 0.00 56.93 57.96 2aym s PHE 80 Cb -0.06 -3.58 0.18 0.00 -0.57 0.00 0.00 43.02 38.99 2aym s PHE 80 CO -0.02 -1.93 1.16 0.00 -0.10 0.00 0.00 175.22 174.33 2aym s ALA 81 N 0.86 1.59 -0.26 5.36 0.00 -0.14 -4.60 121.76 124.57 2aym s ALA 81 Ca 0.61 -0.70 0.01 0.00 0.00 0.00 0.00 51.96 51.88 2aym s ALA 81 Cb -0.35 -2.97 0.07 0.00 0.00 0.00 0.00 23.12 19.88 2aym s ALA 81 CO 0.32 -2.57 -0.00 0.15 0.00 0.00 0.00 175.76 173.65 2aym s LYS 82 N -5.38 1.34 0.00 0.00 1.02 -1.26 -4.79 119.74 110.68 2aym s LYS 82 Ca 0.67 -1.06 0.01 0.00 0.02 0.00 0.00 55.97 55.61 2aym s LYS 82 Cb -0.12 -2.51 0.08 0.00 -0.52 0.00 0.00 37.83 34.75 2aym s LYS 82 CO 0.54 -0.72 0.57 1.63 -0.92 0.00 0.00 175.35 176.45