#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aym n GLN 2 N 0.00 2.51 -1.62 0.00 10.64 -1.26 -4.98 117.38 122.67 2aym n GLN 2 Ca 0.00 0.91 -0.29 0.00 -1.83 0.00 0.00 57.00 55.80 2aym n GLN 2 Cb 0.00 -2.77 0.12 0.00 -0.86 0.00 0.00 30.24 26.73 2aym n GLN 2 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 2aym s THR 3 N 2.76 2.02 0.04 -0.39 -4.23 -1.26 -5.11 115.64 109.47 2aym s THR 3 Ca 0.84 0.01 0.02 0.00 -1.18 0.00 0.00 61.69 61.38 2aym s THR 3 Cb -0.57 -2.81 -0.02 0.00 1.34 0.00 0.00 72.50 70.44 2aym s THR 3 CO 0.41 -0.01 -0.08 -1.61 -0.54 0.00 0.00 174.62 172.79 2aym s GLU 4 N -5.34 0.55 0.22 3.99 0.41 -1.26 -4.43 118.70 112.83 2aym s GLU 4 Ca 0.63 -0.69 -0.02 0.00 -0.41 0.00 0.00 54.97 54.48 2aym s GLU 4 Cb -0.14 -0.37 -0.03 0.00 -1.78 0.00 0.00 34.13 31.81 2aym s GLU 4 CO 0.52 0.07 0.20 -0.65 -0.49 0.00 0.00 175.26 174.91 2aym s GLN 5 N -1.37 1.29 0.99 1.61 1.11 -1.26 -5.01 119.66 117.02 2aym s GLN 5 Ca -0.07 -1.60 -0.15 0.00 0.01 0.00 0.00 55.36 53.55 2aym s GLN 5 Cb -0.09 0.31 0.02 0.00 -1.01 0.00 0.00 33.01 32.24 2aym s GLN 5 CO 0.00 -0.45 0.13 -2.30 0.01 0.00 0.00 175.29 172.69 2aym n PRO 6 N -0.31 -0.47 -1.55 2.91 -0.02 -1.26 -4.84 135.00 129.46 2aym n PRO 6 Ca 0.02 -0.11 -0.51 0.00 -2.02 0.00 0.00 63.50 60.88 2aym n PRO 6 Cb 0.65 -1.70 -0.05 0.00 -0.02 0.00 0.00 33.50 32.38 2aym n PRO 6 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2aym n PRO 7 N -1.12 0.89 -3.79 0.52 -0.02 -1.26 -4.93 135.00 125.29 2aym n PRO 7 Ca 0.04 0.32 -0.13 0.00 -2.02 0.00 0.00 63.50 61.71 2aym n PRO 7 Cb 0.56 -1.81 -0.14 0.00 -0.02 0.00 0.00 33.50 32.09 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 0.01 -0.06 0.00 2.55 2.47 -1.26 -4.93 114.94 113.72 2aym s ASN 8 Ca 0.77 0.19 0.02 0.00 0.42 0.00 0.00 52.86 54.26 2aym s ASN 8 Cb -0.94 0.12 0.12 0.00 -1.45 0.00 0.00 41.25 39.10 2aym s ASN 8 CO 0.52 -0.10 0.58 0.00 -3.72 0.00 0.00 177.10 174.38 2aym n GLN 9 N 3.77 0.47 -4.41 0.43 10.64 -1.26 -4.50 117.38 122.51 2aym n GLN 9 Ca -0.22 0.00 -0.20 0.00 -1.83 0.00 0.00 57.00 54.76 2aym n GLN 9 Cb 0.54 -1.07 -0.15 0.00 -0.86 0.00 0.00 30.24 28.70 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 0.80 0.11 -0.39 1.01 -1.26 -1.01 121.20 118.46 2aym s ILE 10 Ca 0.03 -0.40 0.10 0.00 0.00 0.00 0.00 60.65 60.39 2aym s ILE 10 Cb 0.01 -0.69 -0.04 0.00 0.01 0.00 0.00 42.46 41.76 2aym s ILE 10 CO 0.02 0.24 -0.26 -0.76 0.00 0.00 0.00 174.94 174.18 2aym s LEU 11 N -0.01 2.31 -0.07 2.97 1.43 0.18 -1.23 118.68 124.26 2aym s LEU 11 Ca 0.00 -0.70 0.03 0.00 -1.03 0.00 0.00 54.13 52.43 2aym s LEU 11 Cb -0.06 -1.26 -0.02 0.00 0.03 0.00 0.00 46.19 44.87 2aym s LEU 11 CO 0.00 0.20 -0.14 0.12 0.23 0.00 0.00 176.35 176.76 2aym s PHE 12 N -1.00 2.71 0.07 0.29 5.36 -0.05 -1.34 117.98 124.02 2aym s PHE 12 Ca 0.14 -0.27 0.05 0.00 -0.96 0.00 0.00 56.93 55.89 2aym s PHE 12 Cb -0.10 -1.67 -0.03 0.00 -0.34 0.00 0.00 43.02 40.88 2aym s PHE 12 CO 0.05 0.10 -0.15 -0.51 -1.46 0.00 0.00 175.22 173.25 2aym s LEU 13 N -0.50 2.25 0.30 6.12 1.02 0.25 -0.55 118.68 127.57 2aym s LEU 13 Ca 0.07 -0.58 -0.00 0.00 0.02 0.00 0.00 54.13 53.63 2aym s LEU 13 Cb -0.12 -0.58 -0.02 0.00 0.02 0.00 0.00 46.19 45.49 2aym s LEU 13 CO 0.02 -0.03 0.34 0.42 0.02 0.00 0.00 176.35 177.11 2aym s THR 14 N -1.15 0.00 -1.31 5.49 -4.23 -0.51 -1.31 115.64 112.62 2aym s THR 14 Ca -0.00 -1.79 -0.00 0.00 -1.18 0.00 0.00 61.69 58.71 2aym s THR 14 Cb -0.09 -2.52 0.00 0.00 1.34 0.00 0.00 72.50 71.23 2aym s THR 14 CO 0.02 0.00 0.03 -3.20 -0.54 0.00 0.00 174.62 170.93 2aym n ASN 15 N -1.09 -4.61 -4.86 3.99 5.15 -0.78 -1.15 115.26 111.91 2aym n ASN 15 Ca 0.03 0.10 -0.30 0.00 -0.60 0.00 0.00 54.58 53.81 2aym n ASN 15 Cb 0.63 -3.88 0.06 0.00 -0.53 0.00 0.00 39.78 36.06 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 -5.81 2.83 0.54 1.20 1.43 -0.40 -3.99 118.68 114.48 2aym s LEU 16 Ca 0.02 1.21 -0.19 0.00 -1.03 0.00 0.00 54.13 54.14 2aym s LEU 16 Cb -0.01 -3.96 -0.09 0.00 0.03 0.00 0.00 46.19 42.15 2aym s LEU 16 CO 0.02 -1.52 0.59 -2.65 0.23 0.00 0.00 176.35 173.02 2aym n PRO 17 N -3.13 0.60 0.00 1.29 -0.02 -1.26 -4.34 135.00 128.14 2aym n PRO 17 Ca 0.07 0.23 0.07 0.00 -2.02 0.00 0.00 63.50 61.85 2aym n PRO 17 Cb 0.57 -1.72 0.40 0.00 -0.02 0.00 0.00 33.50 32.72 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 -0.00 0.56 -0.09 -0.52 1.02 -1.26 -2.70 120.64 117.65 2aym n GLU 18 Ca 0.12 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.27 2aym n GLU 18 Cb 0.46 -1.37 0.02 0.00 -0.02 0.00 0.00 31.44 30.52 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 -0.87 1.04 -1.73 3.49 1.02 -1.26 -4.61 120.64 117.73 2aym n GLU 19 Ca 0.10 -1.12 -0.38 0.00 -0.02 0.00 0.00 57.16 55.74 2aym n GLU 19 Cb 0.05 -0.76 0.05 0.00 -0.02 0.00 0.00 31.44 30.76 2aym n GLU 19 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2aym n THR 20 N -0.31 4.22 -4.15 2.62 -1.04 -1.10 -5.04 114.28 109.48 2aym n THR 20 Ca 0.02 -0.50 -0.10 0.00 -2.04 0.00 0.00 64.05 61.43 2aym n THR 20 Cb 0.47 -1.56 -0.10 0.00 -1.82 0.00 0.00 70.33 67.32 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 -1.10 0.94 0.27 8.00 2.47 -1.26 -4.86 114.94 119.41 2aym s ASN 21 Ca 0.76 -1.01 0.01 0.00 0.42 0.00 0.00 52.86 53.03 2aym s ASN 21 Cb -0.41 0.13 0.62 0.00 -1.45 0.00 0.00 41.25 40.14 2aym s ASN 21 CO 0.46 -0.51 1.72 -0.08 -3.72 0.00 0.00 177.10 174.96 2aym h GLU 22 N 3.01 0.44 -0.49 0.43 4.81 -1.96 -1.23 114.58 119.59 2aym h GLU 22 Ca -0.35 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 58.82 2aym h GLU 22 Cb 1.16 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.42 2aym h GLU 22 CO 0.65 0.29 0.15 0.52 -0.73 0.00 0.00 179.01 179.89 2aym h MET 23 N 0.45 0.72 0.32 1.92 2.86 -1.98 -0.99 114.93 118.24 2aym h MET 23 Ca 0.50 -0.12 -0.02 0.00 -2.06 0.00 0.00 59.70 58.00 2aym h MET 23 Cb 0.86 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.40 2aym h MET 23 CO -0.47 0.63 -0.15 0.52 1.06 0.00 0.00 176.91 178.51 2aym h MET 24 N 0.71 -0.41 -0.07 1.72 2.86 -1.64 -0.43 114.93 117.68 2aym h MET 24 Ca 0.16 0.03 -0.15 0.00 -2.06 0.00 0.00 59.70 57.68 2aym h MET 24 Cb 0.22 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 2aym h MET 24 CO -0.01 -0.12 -0.62 -0.07 1.06 0.00 0.00 176.91 177.16 2aym h LEU 25 N -0.70 0.27 -0.36 1.22 3.38 -1.48 -1.29 115.31 116.34 2aym h LEU 25 Ca -0.04 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 2aym h LEU 25 Cb 0.48 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 2aym h LEU 25 CO 0.07 0.82 0.18 0.28 0.09 0.00 0.00 178.44 179.88 2aym h SER 26 N 0.17 0.47 -0.65 -0.43 0.02 -1.14 0.19 113.55 112.18 2aym h SER 26 Ca -0.01 -0.11 0.03 0.00 -0.84 0.00 0.00 61.79 60.85 2aym h SER 26 Cb 1.13 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 63.51 2aym h SER 26 CO 0.10 0.45 0.40 -0.03 -1.14 0.00 0.00 176.83 176.61 2aym h MET 27 N 0.45 0.77 0.17 3.45 1.85 -0.78 0.07 114.93 120.91 2aym h MET 27 Ca 0.13 -0.05 -0.01 0.00 -0.61 0.00 0.00 59.70 59.16 2aym h MET 27 Cb 0.10 -0.17 0.00 0.00 0.43 0.00 0.00 31.60 31.96 2aym h MET 27 CO -0.02 0.51 -0.08 -0.07 -0.40 0.00 0.00 176.91 176.85 2aym h LEU 28 N 0.79 -0.20 0.00 3.39 3.38 -0.84 -3.33 115.31 118.50 2aym h LEU 28 Ca 0.26 -0.26 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 2aym h LEU 28 Cb 0.01 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2aym h LEU 28 CO -0.10 0.17 -0.69 -0.26 0.09 0.00 0.00 178.44 177.65 2aym h PHE 29 N -0.60 0.00 0.00 1.13 -1.00 -0.93 -3.25 116.94 112.30 2aym h PHE 29 Ca -0.02 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.76 2aym h PHE 29 Cb 0.45 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.01 2aym h PHE 29 CO 0.04 0.60 0.00 -1.71 -1.61 0.00 0.00 178.31 175.63 2aym n ASN 30 N -3.21 0.24 0.09 2.17 5.15 0.00 -1.57 115.26 118.13 2aym n ASN 30 Ca 0.00 0.58 0.16 0.00 -0.60 0.00 0.00 54.58 54.73 2aym n ASN 30 Cb 0.79 -0.63 0.67 0.00 -0.53 0.00 0.00 39.78 40.08 2aym n ASN 30 CO 0.00 0.00 0.00 1.56 1.40 0.00 0.00 177.26 180.22 2aym h GLN 31 N 0.00 0.00 -6.23 1.20 4.20 -1.70 -3.42 115.11 109.17 2aym h GLN 31 Ca 0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 2aym h GLN 31 Cb 0.14 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.87 2aym h GLN 31 CO 0.00 0.00 -0.00 -0.06 -0.67 0.00 0.00 178.83 178.10 2aym s PHE 32 N -5.03 3.78 0.00 2.96 0.08 -0.61 -4.96 117.98 114.20 2aym s PHE 32 Ca -0.05 1.30 0.00 0.00 0.12 0.00 0.00 56.93 58.30 2aym s PHE 32 Cb 0.19 -2.56 0.00 0.00 -0.57 0.00 0.00 43.02 40.08 2aym s PHE 32 CO 0.71 0.51 1.18 -0.35 -0.10 0.00 0.00 175.22 177.17 2aym n PRO 33 N 1.99 0.79 0.00 0.24 -0.04 -1.26 -2.75 135.00 133.97 2aym n PRO 33 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 2aym n PRO 33 Cb 0.51 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.86 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 1.10 1.00 3.63 0.55 0.00 -1.26 -5.03 105.19 105.17 2aym n GLY 34 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 0.91 0.06 1.61 7.35 -1.11 -0.30 117.46 125.99 2aym n PHE 35 Ca 0.00 0.43 0.00 0.00 -0.76 0.00 0.00 57.45 57.12 2aym n PHE 35 Cb 0.09 -2.15 0.00 0.00 0.35 0.00 0.00 39.48 37.78 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 -1.12 0.00 -3.83 -4.13 4.76 -0.29 -4.68 118.16 108.88 2aym n LYS 36 Ca 0.14 0.00 -0.07 0.00 -2.87 0.00 0.00 58.31 55.51 2aym n LYS 36 Cb 0.47 -0.26 0.00 0.00 -1.84 0.00 0.00 35.03 33.41 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 1.81 0.18 1.97 2.12 -0.65 -5.00 118.70 117.12 2aym s GLU 37 Ca 0.00 -1.09 0.01 0.00 0.36 0.00 0.00 54.97 54.25 2aym s GLU 37 Cb 0.00 0.56 -0.04 0.00 0.26 0.00 0.00 34.13 34.90 2aym s GLU 37 CO 0.00 -0.84 0.05 0.14 -0.54 0.00 0.00 175.26 174.07 2aym s VAL 38 N -3.02 0.41 -0.25 3.70 -7.23 -1.26 -0.51 120.40 112.24 2aym s VAL 38 Ca 0.14 -1.96 -0.03 0.00 -1.81 0.00 0.00 61.98 58.32 2aym s VAL 38 Cb -0.05 -2.22 0.10 0.00 0.56 0.00 0.00 36.38 34.77 2aym s VAL 38 CO 0.08 -0.34 0.20 -0.60 -0.31 0.00 0.00 175.10 174.12 2aym s ARG 39 N -4.00 0.21 0.87 4.82 3.52 0.17 -4.96 118.95 119.58 2aym s ARG 39 Ca 0.28 -0.14 -0.12 0.00 -0.13 0.00 0.00 55.73 55.62 2aym s ARG 39 Cb 0.07 -1.14 0.11 0.00 -1.56 0.00 0.00 34.95 32.43 2aym s ARG 39 CO 0.06 -0.86 1.11 -0.51 -0.81 0.00 0.00 175.30 174.28 2aym s LEU 40 N 2.24 2.27 -0.44 -0.88 2.01 -1.26 -0.68 118.68 121.94 2aym s LEU 40 Ca 0.07 1.24 -0.08 0.00 0.01 0.00 0.00 54.13 55.38 2aym s LEU 40 Cb -0.15 -3.69 0.10 0.00 0.01 0.00 0.00 46.19 42.45 2aym s LEU 40 CO -0.24 -2.39 0.28 -0.69 1.01 0.00 0.00 176.35 174.32 2aym s VAL 41 N -3.12 4.03 -0.60 -1.59 1.01 -1.23 -4.92 120.40 113.98 2aym s VAL 41 Ca 0.63 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 60.94 2aym s VAL 41 Cb -0.16 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.64 2aym s VAL 41 CO 0.55 -0.64 0.45 -0.81 0.00 0.00 0.00 175.10 174.65 2aym n PRO 42 N 4.85 0.65 0.00 2.72 -0.04 -1.26 -0.84 135.00 141.08 2aym n PRO 42 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 2aym n PRO 42 Cb 0.42 -1.26 0.00 0.00 -0.04 0.00 0.00 33.50 32.61 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 0.38 0.04 -3.07 3.54 0.23 -1.26 -4.90 115.26 110.22 2aym n ASN 43 Ca 0.00 -0.28 -0.19 0.00 -0.53 0.00 0.00 54.58 53.59 2aym n ASN 43 Cb 0.23 0.19 -0.04 0.00 -2.08 0.00 0.00 39.78 38.08 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 -0.19 0.65 0.10 -3.83 1.74 -0.02 -4.99 116.66 110.11 2aym n ARG 44 Ca 0.00 -2.73 0.06 0.00 -0.77 0.00 0.00 57.85 54.41 2aym n ARG 44 Cb 0.03 -1.36 0.32 0.00 -1.02 0.00 0.00 32.46 30.43 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 1.77 0.39 0.94 -1.55 8.25 -0.91 -1.84 115.22 122.27 2aym n HIS 45 Ca 0.19 0.21 0.09 0.00 -0.26 0.00 0.00 57.72 57.95 2aym n HIS 45 Cb 0.55 -0.79 0.49 0.00 1.12 0.00 0.00 29.99 31.36 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 -1.90 0.00 -4.28 0.41 5.75 -1.20 -4.38 116.55 110.95 2aym n ASP 46 Ca -0.01 -0.07 -0.15 0.00 -0.01 0.00 0.00 54.79 54.55 2aym n ASP 46 Cb 0.07 -0.25 -0.10 0.00 -1.03 0.00 0.00 41.12 39.82 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 -2.49 1.25 0.29 2.12 -4.36 -0.77 -1.27 121.20 115.97 2aym s ILE 47 Ca 0.19 -2.08 -0.19 0.00 -0.26 0.00 0.00 60.65 58.31 2aym s ILE 47 Cb 0.13 -1.97 0.06 0.00 1.25 0.00 0.00 42.46 41.92 2aym s ILE 47 CO 0.28 -0.64 0.87 0.00 0.24 0.00 0.00 174.94 175.69 2aym s ALA 48 N -3.28 -1.16 0.10 2.27 0.00 -0.43 -3.50 121.76 115.75 2aym s ALA 48 Ca 0.20 -0.47 0.05 0.00 0.00 0.00 0.00 51.96 51.74 2aym s ALA 48 Cb 0.03 0.72 -0.03 0.00 0.00 0.00 0.00 23.12 23.83 2aym s ALA 48 CO 0.03 -1.02 -0.13 -0.06 0.00 0.00 0.00 175.76 174.57 2aym s PHE 49 N -2.60 1.27 0.02 0.00 0.40 0.14 -0.58 117.98 116.62 2aym s PHE 49 Ca 0.16 -0.54 0.02 0.00 -0.60 0.00 0.00 56.93 55.98 2aym s PHE 49 Cb -0.04 -0.69 -0.01 0.00 0.51 0.00 0.00 43.02 42.79 2aym s PHE 49 CO 0.08 0.09 -0.07 0.08 0.70 0.00 0.00 175.22 176.10 2aym s VAL 50 N -1.85 0.48 -0.01 -0.44 1.01 -0.45 -0.66 120.40 118.48 2aym s VAL 50 Ca 0.04 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.45 2aym s VAL 50 Cb -0.07 -0.47 -0.00 0.00 0.00 0.00 0.00 36.38 35.84 2aym s VAL 50 CO 0.02 -0.09 -0.10 -0.70 0.00 0.00 0.00 175.10 174.23 2aym s GLU 51 N -0.75 0.87 0.15 2.72 2.12 0.33 -0.65 118.70 123.49 2aym s GLU 51 Ca -0.03 -0.35 0.02 0.00 0.36 0.00 0.00 54.97 54.97 2aym s GLU 51 Cb -0.05 -0.83 -0.04 0.00 0.26 0.00 0.00 34.13 33.46 2aym s GLU 51 CO 0.00 0.19 -0.02 -0.06 -0.54 0.00 0.00 175.26 174.83 2aym s PHE 52 N -0.11 1.11 0.07 5.30 0.40 -0.18 -1.14 117.98 123.44 2aym s PHE 52 Ca 0.02 -0.99 -0.22 0.00 -0.60 0.00 0.00 56.93 55.14 2aym s PHE 52 Cb -0.05 -0.63 -0.12 0.00 0.51 0.00 0.00 43.02 42.72 2aym s PHE 52 CO -0.00 -0.20 1.60 1.15 0.70 0.00 0.00 175.22 178.47 2aym h THR 53 N 2.77 1.16 -3.90 0.64 2.02 -0.93 -3.46 112.91 111.22 2aym h THR 53 Ca -0.36 -0.47 -0.16 0.00 0.77 0.00 0.00 66.41 66.19 2aym h THR 53 Cb 1.19 1.25 -0.20 0.00 -1.74 0.00 0.00 68.15 68.65 2aym h THR 53 CO 0.63 0.14 -0.65 0.42 0.37 0.00 0.00 175.52 176.44 2aym s THR 54 N -5.51 0.11 0.08 3.16 -4.23 -1.26 -5.03 115.64 102.96 2aym s THR 54 Ca -0.14 -0.95 0.21 0.00 -1.18 0.00 0.00 61.69 59.64 2aym s THR 54 Cb 0.06 -0.43 0.19 0.00 1.34 0.00 0.00 72.50 73.66 2aym s THR 54 CO 0.69 -0.52 1.74 -0.33 -0.54 0.00 0.00 174.62 175.66 2aym h GLU 55 N 4.39 0.00 -0.01 3.99 5.08 -1.90 -1.59 114.58 124.54 2aym h GLU 55 Ca -0.32 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 57.87 2aym h GLU 55 Cb 1.20 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.43 2aym h GLU 55 CO 0.43 0.30 -0.76 -0.07 -1.00 0.00 0.00 179.01 177.91 2aym h LEU 56 N 0.00 0.17 0.16 1.33 3.38 -1.92 -2.60 115.31 115.83 2aym h LEU 56 Ca -0.00 -0.12 -0.30 0.00 0.09 0.00 0.00 57.88 57.55 2aym h LEU 56 Cb 0.89 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.61 2aym h LEU 56 CO 0.04 0.86 -1.36 1.56 0.09 0.00 0.00 178.44 179.63 2aym h GLN 57 N 0.09 0.34 -0.83 1.13 4.20 -1.74 -0.89 115.11 117.40 2aym h GLN 57 Ca -0.02 -0.58 -0.00 0.00 0.06 0.00 0.00 58.65 58.11 2aym h GLN 57 Cb 1.34 0.22 -0.04 0.00 0.30 0.00 0.00 27.48 29.29 2aym h GLN 57 CO 0.11 1.26 0.50 0.66 -0.67 0.00 0.00 178.83 180.69 2aym h SER 58 N 0.09 0.99 -0.33 1.46 4.64 -1.42 -0.45 113.55 118.53 2aym h SER 58 Ca -0.19 -0.07 0.04 0.00 -0.47 0.00 0.00 61.79 61.11 2aym h SER 58 Cb 2.03 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 63.83 2aym h SER 58 CO 0.22 0.77 0.11 -1.13 -0.87 0.00 0.00 176.83 175.92 2aym h ASN 59 N 1.14 0.11 -0.62 4.97 -1.24 -1.39 0.14 115.58 118.68 2aym h ASN 59 Ca 0.30 0.04 0.00 0.00 0.71 0.00 0.00 56.30 57.34 2aym h ASN 59 Cb -0.04 0.03 -0.03 0.00 0.73 0.00 0.00 38.32 39.00 2aym h ASN 59 CO -0.06 0.10 0.39 0.00 -1.29 0.00 0.00 177.43 176.58 2aym h ALA 60 N 1.21 0.79 -0.52 1.57 0.00 -0.76 -0.64 119.26 120.91 2aym h ALA 60 Ca 0.15 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2aym h ALA 60 Cb 0.12 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2aym h ALA 60 CO -0.16 0.25 -0.02 0.00 0.00 0.00 0.00 179.25 179.32 2aym h ALA 61 N 1.21 0.98 0.15 0.00 0.00 -0.74 -0.87 119.26 119.99 2aym h ALA 61 Ca 0.23 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2aym h ALA 61 Cb -0.05 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 2aym h ALA 61 CO -0.05 0.62 -0.08 -0.22 0.00 0.00 0.00 179.25 179.52 2aym h LYS 62 N 0.82 -0.21 -0.80 0.00 3.64 -0.34 -0.80 116.57 118.88 2aym h LYS 62 Ca 0.15 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.58 2aym h LYS 62 Cb 0.52 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.34 2aym h LYS 62 CO 0.03 -0.14 0.52 0.93 -2.27 0.00 0.00 179.45 178.52 2aym h GLU 63 N -0.22 0.93 -0.19 1.90 4.39 -0.88 -0.20 114.58 120.31 2aym h GLU 63 Ca -0.02 -0.06 -0.19 0.00 0.34 0.00 0.00 59.36 59.44 2aym h GLU 63 Cb 0.18 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 2aym h GLU 63 CO 0.03 0.62 -0.64 0.00 -1.16 0.00 0.00 179.01 177.85 2aym h ALA 64 N 1.54 0.51 -0.00 3.43 0.00 -0.82 -3.37 119.26 120.54 2aym h ALA 64 Ca 0.32 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2aym h ALA 64 Cb 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2aym h ALA 64 CO -0.10 0.70 -0.03 1.28 0.00 0.00 0.00 179.25 181.10 2aym n LEU 65 N -3.95 1.20 -4.69 0.00 4.77 -0.34 -4.90 117.00 109.10 2aym n LEU 65 Ca -0.05 -0.92 -0.44 0.00 -0.03 0.00 0.00 56.01 54.56 2aym n LEU 65 Cb 0.67 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.72 2aym n LEU 65 CO 0.50 0.26 1.30 0.00 -1.33 0.00 0.00 177.39 178.11 2aym n GLN 66 N 0.05 2.43 -0.96 3.23 6.02 -0.11 -1.46 117.38 126.58 2aym n GLN 66 Ca 0.02 0.88 0.00 0.00 -0.01 0.00 0.00 57.00 57.89 2aym n GLN 66 Cb 0.11 -2.69 0.00 0.00 1.02 0.00 0.00 30.24 28.68 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 3.73 0.78 3.67 1.08 0.00 0.39 -5.01 105.19 109.84 2aym n GLY 67 Ca 0.17 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 -3.09 2.62 -0.34 1.61 5.36 -0.54 -4.51 117.98 119.09 2aym s PHE 68 Ca 0.00 0.71 -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 2.03 0.15 -1.46 0.00 0.00 175.22 173.34 2aym s LYS 69 N 3.15 3.03 0.06 10.12 3.01 -1.26 -0.42 119.74 137.43 2aym s LYS 69 Ca 0.64 1.55 -0.19 0.00 -1.01 0.00 0.00 55.97 56.96 2aym s LYS 69 Cb -0.29 -4.33 -0.12 0.00 -1.01 0.00 0.00 37.83 32.08 2aym s LYS 69 CO 0.24 -2.21 1.38 0.82 0.51 0.00 0.00 175.35 176.08 2aym h ILE 70 N 7.05 1.33 -3.69 2.17 2.04 -1.55 -3.45 117.51 121.40 2aym h ILE 70 Ca -0.34 -1.31 -0.29 0.00 1.00 0.00 0.00 64.86 63.92 2aym h ILE 70 Cb 1.20 1.75 -0.15 0.00 -0.74 0.00 0.00 36.82 38.89 2aym h ILE 70 CO 1.04 0.40 -0.68 0.42 0.00 0.00 0.00 178.15 179.33 2aym s THR 71 N -4.37 0.78 0.65 -0.27 -4.23 -1.25 -5.03 115.64 101.91 2aym s THR 71 Ca -0.14 -1.99 0.19 0.00 -1.18 0.00 0.00 61.69 58.58 2aym s THR 71 Cb 0.06 -2.00 0.21 0.00 1.34 0.00 0.00 72.50 72.11 2aym s THR 71 CO 0.77 -0.59 1.55 -0.65 -0.54 0.00 0.00 174.62 175.16 2aym h PRO 72 N 2.75 0.00 0.00 3.99 0.11 -2.00 -0.67 132.00 136.18 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 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2aym h PRO 72 CO 0.63 0.00 -0.00 0.25 -0.21 0.00 0.00 178.00 178.67 2aym n THR 73 N -2.85 1.03 -3.38 -1.15 -2.24 -1.26 -4.85 114.28 99.58 2aym n THR 73 Ca 0.01 -1.07 -0.26 0.00 -2.27 0.00 0.00 64.05 60.46 2aym n THR 73 Cb 0.70 0.45 -0.09 0.00 -2.10 0.00 0.00 70.33 69.29 2aym n THR 73 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2aym n HIS 74 N -0.57 0.94 -1.93 4.78 8.25 -0.26 -5.02 115.22 121.41 2aym n HIS 74 Ca 0.02 -3.74 -0.41 0.00 -0.26 0.00 0.00 57.72 53.32 2aym n HIS 74 Cb 0.31 -0.30 -0.03 0.00 1.12 0.00 0.00 29.99 31.10 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 -1.25 2.56 -0.19 -1.41 0.00 -1.26 -1.29 121.76 118.92 2aym s ALA 75 Ca 0.34 0.05 -0.39 0.00 0.00 0.00 0.00 51.96 51.96 2aym s ALA 75 Cb 0.11 -4.12 -0.16 0.00 0.00 0.00 0.00 23.12 18.94 2aym s ALA 75 CO -0.11 -3.14 1.65 -0.12 0.00 0.00 0.00 175.76 174.03 2aym n MET 76 N 8.70 1.15 -4.03 0.00 1.56 0.44 -4.73 117.12 120.21 2aym n MET 76 Ca 0.24 0.42 -0.33 0.00 -0.27 0.00 0.00 57.70 57.76 2aym n MET 76 Cb 0.49 -2.09 -0.06 0.00 2.15 0.00 0.00 33.22 33.70 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 2.81 3.19 0.00 2.12 1.02 -0.30 -0.46 119.74 128.13 2aym s LYS 77 Ca 0.95 -0.43 0.01 0.00 0.02 0.00 0.00 55.97 56.52 2aym s LYS 77 Cb -1.04 -2.94 -0.01 0.00 -0.52 0.00 0.00 37.83 33.32 2aym s LYS 77 CO 0.61 0.65 -0.04 0.42 -0.92 0.00 0.00 175.35 176.08 2aym s ILE 78 N -1.25 0.31 0.03 2.17 1.01 -1.26 -1.43 121.20 120.77 2aym s ILE 78 Ca 0.25 -0.32 -0.02 0.00 0.00 0.00 0.00 60.65 60.56 2aym s ILE 78 Cb -0.12 -0.29 -0.02 0.00 0.01 0.00 0.00 42.46 42.04 2aym s ILE 78 CO 0.16 -0.02 0.00 0.42 0.00 0.00 0.00 174.94 175.51 2aym s THR 79 N -0.34 0.13 -0.07 2.92 -4.23 0.29 -5.00 115.64 109.33 2aym s THR 79 Ca -0.01 -1.06 -0.30 0.00 -1.18 0.00 0.00 61.69 59.14 2aym s THR 79 Cb -0.03 -0.57 -0.04 0.00 1.34 0.00 0.00 72.50 73.20 2aym s THR 79 CO -0.00 -0.58 1.37 -0.36 -0.54 0.00 0.00 174.62 174.50 2aym s PHE 80 N -2.01 2.74 0.00 3.99 0.08 -1.26 -0.87 117.98 120.65 2aym s PHE 80 Ca -0.11 0.83 0.00 0.00 0.12 0.00 0.00 56.93 57.77 2aym s PHE 80 Cb -0.06 -3.62 0.00 0.00 -0.57 0.00 0.00 43.02 38.78 2aym s PHE 80 CO -0.03 -2.27 0.00 0.00 -0.10 0.00 0.00 175.22 172.82 2aym n ALA 81 N 6.08 0.00 -4.27 5.36 0.00 -0.37 -4.32 120.51 122.99 2aym n ALA 81 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.37 2aym n ALA 81 Cb 0.44 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.84 2aym n ALA 81 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2aym n LYS 82 N -0.43 0.72 0.00 0.00 5.02 -1.26 -4.81 118.16 117.41 2aym n LYS 82 Ca 0.00 -2.63 0.00 0.00 -2.02 0.00 0.00 58.31 53.66 2aym n LYS 82 Cb 0.00 1.33 0.00 0.00 -0.02 0.00 0.00 35.03 36.34 2aym n LYS 82 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51