#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y7n s THR 8 N 0.00 -0.54 -0.19 2.62 -4.23 -1.26 -5.13 115.64 106.90 1y7n s THR 8 Ca 0.00 -0.28 -0.22 0.00 -1.18 0.00 0.00 61.69 60.01 1y7n s THR 8 Cb 0.00 -0.92 -0.02 0.00 1.34 0.00 0.00 72.50 72.89 1y7n s THR 8 CO 0.00 -0.29 0.67 -0.32 -0.54 0.00 0.00 174.62 174.14 1y7n s MET 9 N 2.48 4.23 0.00 3.99 1.75 -1.26 -4.83 119.30 125.66 1y7n s MET 9 Ca 0.10 0.69 0.00 0.00 -1.25 0.00 0.00 55.69 55.23 1y7n s MET 9 Cb -0.14 -3.58 0.00 0.00 2.84 0.00 0.00 34.83 33.96 1y7n s MET 9 CO -0.26 -0.25 0.00 0.41 -0.65 0.00 0.00 175.02 174.27 1y7n n GLY 10 N 3.72 0.77 3.40 2.11 0.00 -1.26 -4.90 105.19 109.04 1y7n n GLY 10 Ca -0.00 -2.04 -0.45 0.00 0.00 0.00 0.00 46.02 43.53 1y7n n GLY 10 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1y7n s ASN 11 N -4.00 6.84 -0.26 1.61 3.84 -1.26 -4.94 114.94 116.77 1y7n s ASN 11 Ca 0.00 -2.63 -0.06 0.00 0.21 0.00 0.00 52.86 50.37 1y7n s ASN 11 Cb 0.00 -2.31 -0.01 0.00 -0.55 0.00 0.00 41.25 38.39 1y7n s ASN 11 CO 0.00 -0.74 0.04 -0.69 -2.79 0.00 0.00 177.10 172.93 1y7n s VAL 12 N 1.09 3.89 -0.25 -5.21 1.01 -1.26 -3.94 120.40 115.73 1y7n s VAL 12 Ca 0.29 -0.49 -0.01 0.00 0.00 0.00 0.00 61.98 61.77 1y7n s VAL 12 Cb -0.07 -2.89 0.03 0.00 0.00 0.00 0.00 36.38 33.45 1y7n s VAL 12 CO -0.08 0.25 -0.07 -0.89 0.00 0.00 0.00 175.10 174.32 1y7n s THR 13 N 1.53 2.81 0.28 3.92 2.01 0.37 -4.93 115.64 121.62 1y7n s THR 13 Ca 0.04 -1.07 -0.28 0.00 0.31 0.00 0.00 61.69 60.69 1y7n s THR 13 Cb -0.16 -2.44 -0.09 0.00 0.01 0.00 0.00 72.50 69.82 1y7n s THR 13 CO 0.01 0.19 0.97 -0.89 -0.69 0.00 0.00 174.62 174.20 1y7n s THR 14 N 1.31 4.03 -0.11 -0.82 2.01 -1.26 -0.28 115.64 120.53 1y7n s THR 14 Ca -0.00 1.89 0.03 0.00 0.31 0.00 0.00 61.69 63.92 1y7n s THR 14 Cb -0.17 -4.14 0.01 0.00 0.01 0.00 0.00 72.50 68.21 1y7n s THR 14 CO -0.05 0.33 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.32 1y7n s VAL 15 N -1.36 1.86 -0.31 3.82 1.01 0.11 -4.92 120.40 120.62 1y7n s VAL 15 Ca 0.45 -0.89 -0.06 0.00 0.00 0.00 0.00 61.98 61.48 1y7n s VAL 15 Cb -0.24 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.53 1y7n s VAL 15 CO 0.30 0.51 0.08 -0.22 0.00 0.00 0.00 175.10 175.78 1y7n s LEU 16 N 0.57 4.04 -0.13 3.92 2.96 -1.25 0.42 118.68 129.22 1y7n s LEU 16 Ca -0.14 -0.93 -0.04 0.00 -0.22 0.00 0.00 54.13 52.80 1y7n s LEU 16 Cb -0.17 -1.86 -0.03 0.00 0.50 0.00 0.00 46.19 44.63 1y7n s LEU 16 CO 0.04 -0.25 0.00 -0.51 -1.32 0.00 0.00 176.35 174.31 1y7n s ILE 17 N 1.44 4.30 -0.44 6.68 -1.16 -0.41 -4.35 121.20 127.25 1y7n s ILE 17 Ca 0.00 -0.23 -0.10 0.00 -0.51 0.00 0.00 60.65 59.81 1y7n s ILE 17 Cb -0.18 -2.86 0.09 0.00 0.61 0.00 0.00 42.46 40.12 1y7n s ILE 17 CO 0.02 0.54 0.31 -0.13 -2.81 0.00 0.00 174.94 172.87 1y7n s ARG 18 N -0.25 2.63 -0.36 3.50 3.00 -1.26 -0.38 118.95 125.84 1y7n s ARG 18 Ca 0.06 -1.54 -0.13 0.00 0.00 0.00 0.00 55.73 54.12 1y7n s ARG 18 Cb -0.12 -3.88 -0.00 0.00 0.00 0.00 0.00 34.95 30.94 1y7n s ARG 18 CO 0.02 -1.04 0.24 0.50 0.00 0.00 0.00 175.30 175.02 1y7n s ARG 19 N 1.44 3.30 0.22 3.54 3.52 -0.01 -4.92 118.95 126.03 1y7n s ARG 19 Ca 0.04 -0.77 -0.09 0.00 -0.13 0.00 0.00 55.73 54.77 1y7n s ARG 19 Cb -0.24 -3.81 0.19 0.00 -1.56 0.00 0.00 34.95 29.52 1y7n s ARG 19 CO 0.02 -0.53 1.88 -1.35 -0.81 0.00 0.00 175.30 174.51 1y7n h PRO 20 N 8.50 1.03 -2.11 5.12 0.11 -1.93 0.43 132.00 143.14 1y7n h PRO 20 Ca -0.30 -0.06 0.28 0.00 0.11 0.00 0.00 66.00 66.03 1y7n h PRO 20 Cb 1.14 -0.23 -0.07 0.00 0.11 0.00 0.00 31.00 31.95 1y7n h PRO 20 CO 0.66 0.68 0.78 0.16 -0.21 0.00 0.00 178.00 180.07 1y7n s ASP 21 N -5.90 -0.02 0.54 -2.05 -4.77 -1.26 -4.70 116.67 98.51 1y7n s ASP 21 Ca -0.13 -0.33 0.31 0.00 -3.30 0.00 0.00 52.55 49.11 1y7n s ASP 21 Cb 0.16 0.26 1.48 0.00 -1.09 0.00 0.00 42.92 43.73 1y7n s ASP 21 CO 0.79 -0.51 2.05 -0.07 0.70 0.00 0.00 175.17 178.12 1y7n h LEU 22 N 2.00 0.00 -0.21 2.11 3.38 -1.91 -2.11 115.31 118.57 1y7n h LEU 22 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1y7n h LEU 22 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1y7n h LEU 22 CO 0.32 0.08 0.00 0.54 0.09 0.00 0.00 178.44 179.47 1y7n n ARG 23 N -3.33 0.07 0.10 1.13 1.74 -1.26 -1.81 116.66 113.30 1y7n n ARG 23 Ca -0.01 0.27 0.10 0.00 -0.77 0.00 0.00 57.85 57.44 1y7n n ARG 23 Cb 0.27 -1.63 -0.00 0.00 -1.02 0.00 0.00 32.46 30.08 1y7n n ARG 23 CO 0.00 0.00 0.00 1.88 -1.52 0.00 0.00 177.63 177.99 1y7n h TYR 24 N 0.00 0.00 -0.25 -1.55 -1.99 -1.80 -3.50 116.97 107.88 1y7n h TYR 24 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1y7n h TYR 24 Cb 0.34 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.07 1y7n h TYR 24 CO 0.00 0.10 0.00 1.04 -0.00 0.00 0.00 178.16 179.30 1y7n n GLN 25 N -2.74 0.00 -0.10 4.88 6.02 -0.75 -4.55 117.38 120.14 1y7n n GLN 25 Ca -0.01 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.85 1y7n n GLN 25 Cb 0.60 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.81 1y7n n GLN 25 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1y7n n LEU 26 N 0.00 1.91 0.00 1.08 7.99 -1.26 -4.90 117.00 121.82 1y7n n LEU 26 Ca 0.00 0.40 0.00 0.00 -0.01 0.00 0.00 56.01 56.40 1y7n n LEU 26 Cb 0.00 -0.79 0.00 0.00 -0.11 0.00 0.00 43.42 42.52 1y7n n LEU 26 CO 0.00 -0.12 0.00 0.61 -1.51 0.00 0.00 177.39 176.37 1y7n n GLY 27 N 1.45 0.87 3.05 -0.72 0.00 -1.26 -1.28 105.19 107.29 1y7n n GLY 27 Ca -0.21 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.70 1y7n n GLY 27 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1y7n s PHE 28 N -2.00 0.53 -0.23 1.61 -0.71 -1.26 -1.03 117.98 114.90 1y7n s PHE 28 Ca 0.00 -0.62 -0.07 0.00 -1.04 0.00 0.00 56.93 55.20 1y7n s PHE 28 Cb 0.00 -0.34 -0.03 0.00 -1.21 0.00 0.00 43.02 41.44 1y7n s PHE 28 CO 0.00 -0.16 0.06 -1.12 -1.34 0.00 0.00 175.22 172.66 1y7n s SER 29 N -1.84 5.21 -0.12 1.98 0.01 -0.38 -4.99 113.70 113.56 1y7n s SER 29 Ca -0.08 -0.14 -0.05 0.00 1.31 0.00 0.00 55.95 56.99 1y7n s SER 29 Cb -0.06 -1.92 -0.04 0.00 0.21 0.00 0.00 66.02 64.21 1y7n s SER 29 CO -0.02 0.02 0.06 0.54 0.41 0.00 0.00 173.24 174.25 1y7n s VAL 30 N 1.28 4.77 -0.25 3.43 0.11 -1.26 -0.04 120.40 128.43 1y7n s VAL 30 Ca 0.05 -0.06 0.02 0.00 -2.93 0.00 0.00 61.98 59.05 1y7n s VAL 30 Cb -0.15 -3.06 0.05 0.00 -1.53 0.00 0.00 36.38 31.69 1y7n s VAL 30 CO 0.03 0.57 -0.11 -1.10 -3.33 0.00 0.00 175.10 171.17 1y7n s GLN 31 N -0.59 2.41 0.00 1.54 -0.21 0.16 -4.70 119.66 118.26 1y7n s GLN 31 Ca 0.11 -1.24 0.00 0.00 0.02 0.00 0.00 55.36 54.25 1y7n s GLN 31 Cb -0.12 -2.88 0.00 0.00 1.00 0.00 0.00 33.01 31.01 1y7n s GLN 31 CO 0.02 -0.51 0.00 0.09 -2.12 0.00 0.00 175.29 172.77 1y7n n ASN 32 N 4.49 -4.67 0.00 5.90 3.02 -1.26 -0.92 115.26 121.82 1y7n n ASN 32 Ca -0.15 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.40 1y7n n ASN 32 Cb 0.44 -2.55 0.00 0.00 -0.61 0.00 0.00 39.78 37.06 1y7n n ASN 32 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1y7n n GLY 33 N -0.33 0.92 3.31 7.41 0.00 -1.26 -4.74 105.19 110.51 1y7n n GLY 33 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1y7n n GLY 33 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y7n s ILE 34 N -2.00 3.23 -0.07 -0.61 1.09 -0.10 -0.09 121.20 122.66 1y7n s ILE 34 Ca 0.00 -0.55 -0.29 0.00 -1.10 0.00 0.00 60.65 58.71 1y7n s ILE 34 Cb 0.00 -2.44 -0.07 0.00 -1.06 0.00 0.00 42.46 38.88 1y7n s ILE 34 CO 0.00 0.45 2.05 -0.63 -0.10 0.00 0.00 174.94 176.72 1y7n s ILE 35 N 1.22 3.03 -0.19 2.92 1.01 0.57 0.37 121.20 130.13 1y7n s ILE 35 Ca 0.03 0.04 0.12 0.00 0.00 0.00 0.00 60.65 60.83 1y7n s ILE 35 Cb -0.14 -3.03 -0.23 0.00 0.01 0.00 0.00 42.46 39.07 1y7n s ILE 35 CO -0.02 -0.01 0.09 0.00 0.00 0.00 0.00 174.94 175.00 1y7n s SER 37 N -5.93 -0.22 -0.01 0.00 1.04 -1.12 -4.83 113.70 102.63 1y7n s SER 37 Ca -0.16 0.06 0.02 0.00 0.48 0.00 0.00 55.95 56.34 1y7n s SER 37 Cb 0.07 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1y7n s SER 37 CO 0.77 -0.52 -0.05 -0.22 0.98 0.00 0.00 173.24 174.19 1y7n s LEU 38 N -1.56 1.86 -0.32 2.42 2.96 -1.26 -1.25 118.68 121.52 1y7n s LEU 38 Ca -0.10 -0.11 -0.18 0.00 -0.22 0.00 0.00 54.13 53.52 1y7n s LEU 38 Cb -0.03 -0.32 -0.01 0.00 0.50 0.00 0.00 46.19 46.32 1y7n s LEU 38 CO 0.02 0.04 0.53 -0.04 -1.32 0.00 0.00 176.35 175.59 1y7n s MET 39 N 0.08 3.80 0.04 1.98 -1.94 -0.19 -5.01 119.30 118.06 1y7n s MET 39 Ca -0.01 0.05 -0.31 0.00 -1.71 0.00 0.00 55.69 53.72 1y7n s MET 39 Cb -0.05 -3.75 -0.07 0.00 2.01 0.00 0.00 34.83 32.98 1y7n s MET 39 CO -0.00 -0.55 1.42 0.50 -0.01 0.00 0.00 175.02 176.38 1y7n s ARG 40 N 2.41 4.29 0.00 2.03 3.00 -1.26 -1.08 118.95 128.34 1y7n s ARG 40 Ca 0.20 2.03 0.00 0.00 -1.00 0.00 0.00 55.73 56.97 1y7n s ARG 40 Cb -0.15 -3.47 0.00 0.00 0.00 0.00 0.00 34.95 31.33 1y7n s ARG 40 CO 0.12 -0.54 0.00 0.41 0.00 0.00 0.00 175.30 175.29 1y7n n GLY 41 N 3.62 3.18 3.85 8.12 0.00 -1.26 -5.06 105.19 117.64 1y7n n GLY 41 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1y7n n GLY 41 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1y7n s GLY 42 N -2.81 1.73 0.51 -0.02 0.00 -0.24 -4.89 107.32 101.61 1y7n s GLY 42 Ca 0.00 -0.00 0.23 0.00 0.00 0.00 0.00 44.72 44.94 1y7n s GLY 42 CO 0.00 0.28 2.00 0.16 0.00 0.00 0.00 173.10 175.53 1y7n h ILE 43 N -0.19 0.77 -0.23 0.90 3.07 -1.85 -1.24 117.51 118.74 1y7n h ILE 43 Ca -0.44 -0.02 -0.01 0.00 1.55 0.00 0.00 64.86 65.93 1y7n h ILE 43 Cb 1.19 0.69 -0.01 0.00 -0.27 0.00 0.00 36.82 38.42 1y7n h ILE 43 CO 0.61 0.01 0.10 0.00 -1.05 0.00 0.00 178.15 177.82 1y7n h ALA 44 N 1.74 0.29 -0.23 0.16 0.00 -1.47 0.15 119.26 119.89 1y7n h ALA 44 Ca 0.25 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.97 1y7n h ALA 44 Cb 0.90 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1y7n h ALA 44 CO -0.02 -0.13 -0.25 1.49 0.00 0.00 0.00 179.25 180.34 1y7n h GLU 45 N 0.23 0.44 0.00 0.00 4.22 -1.43 0.23 114.58 118.27 1y7n h GLU 45 Ca 0.08 -0.16 0.00 0.00 0.08 0.00 0.00 59.36 59.35 1y7n h GLU 45 Cb 0.14 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1y7n h GLU 45 CO -0.01 0.66 0.00 0.00 -2.18 0.00 0.00 179.01 177.49 1y7n h ARG 46 N 0.39 0.00 0.13 1.92 3.08 -1.07 -2.94 114.38 115.89 1y7n h ARG 46 Ca 0.06 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.77 1y7n h ARG 46 Cb 0.65 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.69 1y7n h ARG 46 CO 0.05 0.00 -1.74 0.78 -1.07 0.00 0.00 179.97 177.99 1y7n h GLY 47 N 3.31 0.32 0.00 0.04 0.00 0.43 -3.49 103.07 103.68 1y7n h GLY 47 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 47.33 46.52 1y7n h GLY 47 CO 0.00 0.71 0.00 0.61 0.00 0.00 0.00 176.54 177.86 1y7n n GLY 48 N 1.80 1.70 3.77 4.60 0.00 -0.18 -3.98 105.19 112.91 1y7n n GLY 48 Ca -0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 1y7n n GLY 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y7n s VAL 49 N -1.83 3.18 0.02 1.61 1.01 -0.11 -4.86 120.40 119.42 1y7n s VAL 49 Ca 0.00 1.11 0.01 0.00 0.00 0.00 0.00 61.98 63.10 1y7n s VAL 49 Cb 0.00 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 1y7n s VAL 49 CO 0.00 0.21 -0.05 -0.13 0.00 0.00 0.00 175.10 175.13 1y7n s ARG 50 N -1.86 0.37 0.48 2.72 1.81 -1.26 -4.56 118.95 116.65 1y7n s ARG 50 Ca 0.50 -0.47 -0.22 0.00 -1.72 0.00 0.00 55.73 53.82 1y7n s ARG 50 Cb -0.33 -0.17 -0.07 0.00 -0.45 0.00 0.00 34.95 33.93 1y7n s ARG 50 CO 0.43 0.03 1.17 0.08 -0.68 0.00 0.00 175.30 176.33 1y7n s VAL 51 N -0.90 3.07 0.00 3.52 1.01 -1.26 -3.41 120.40 122.44 1y7n s VAL 51 Ca -0.07 0.78 0.00 0.00 0.00 0.00 0.00 61.98 62.69 1y7n s VAL 51 Cb -0.07 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 32.93 1y7n s VAL 51 CO -0.00 -0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.67 1y7n n GLY 52 N 0.41 0.41 3.12 4.51 0.00 0.21 -5.00 105.19 108.85 1y7n n GLY 52 Ca 0.08 -0.90 -0.29 0.00 0.00 0.00 0.00 46.02 44.92 1y7n n GLY 52 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1y7n s HIS 53 N -2.00 2.09 -0.19 1.61 4.02 -1.22 -3.12 115.29 116.49 1y7n s HIS 53 Ca 0.00 -0.87 -0.21 0.00 1.02 0.00 0.00 55.06 55.01 1y7n s HIS 53 Cb 0.00 -1.45 -0.03 0.00 -1.02 0.00 0.00 32.58 30.09 1y7n s HIS 53 CO 0.00 -0.39 0.62 0.50 1.02 0.00 0.00 174.74 176.49 1y7n s ARG 54 N 0.58 4.23 -0.14 1.40 3.52 -0.19 -0.31 118.95 128.04 1y7n s ARG 54 Ca -0.15 0.62 -0.28 0.00 -0.13 0.00 0.00 55.73 55.79 1y7n s ARG 54 Cb -0.17 -3.56 -0.01 0.00 -1.56 0.00 0.00 34.95 29.65 1y7n s ARG 54 CO 0.05 -0.20 0.95 0.42 -0.81 0.00 0.00 175.30 175.71 1y7n s ILE 55 N 1.78 4.81 -0.51 4.11 1.01 0.87 -0.51 121.20 132.76 1y7n s ILE 55 Ca 0.29 1.90 0.14 0.00 0.00 0.00 0.00 60.65 62.98 1y7n s ILE 55 Cb -0.16 -4.25 -0.17 0.00 0.01 0.00 0.00 42.46 37.89 1y7n s ILE 55 CO 0.11 0.00 0.53 2.30 0.00 0.00 0.00 174.94 177.88 1y7n n ILE 56 N 4.66 0.00 -3.67 2.92 -5.35 0.13 -4.48 119.36 113.56 1y7n n ILE 56 Ca 0.07 -0.21 -0.15 0.00 -0.27 0.00 0.00 62.75 62.20 1y7n n ILE 56 Cb 0.49 0.79 -0.08 0.00 -1.74 0.00 0.00 39.64 39.10 1y7n n ILE 56 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1y7n s GLU 57 N -2.51 0.74 -0.05 6.28 2.12 -1.17 -1.56 118.70 122.55 1y7n s GLU 57 Ca 0.03 0.34 -0.02 0.00 0.36 0.00 0.00 54.97 55.68 1y7n s GLU 57 Cb 0.10 0.35 0.03 0.00 0.26 0.00 0.00 34.13 34.87 1y7n s GLU 57 CO 0.59 -0.17 0.04 0.42 -0.54 0.00 0.00 175.26 175.60 1y7n s ILE 58 N -0.56 0.04 -1.78 -3.70 1.01 0.45 -1.28 121.20 115.38 1y7n s ILE 58 Ca -0.07 0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.89 1y7n s ILE 58 Cb -0.03 -0.25 0.00 0.00 0.01 0.00 0.00 42.46 42.19 1y7n s ILE 58 CO 0.04 0.19 0.00 -3.20 0.00 0.00 0.00 174.94 171.97 1y7n n ASN 59 N 5.10 -5.35 0.00 3.58 2.85 0.11 -1.17 115.26 120.38 1y7n n ASN 59 Ca -0.08 0.18 0.00 0.00 -0.11 0.00 0.00 54.58 54.58 1y7n n ASN 59 Cb 0.50 -4.56 0.00 0.00 1.24 0.00 0.00 39.78 36.96 1y7n n ASN 59 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1y7n n GLY 60 N -0.76 0.24 3.44 8.20 0.00 -1.21 -4.85 105.19 110.25 1y7n n GLY 60 Ca -0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.47 1y7n n GLY 60 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1y7n s GLN 61 N -0.99 3.55 -0.32 1.61 -2.07 -0.32 -5.05 119.66 116.07 1y7n s GLN 61 Ca 0.00 -0.58 -0.29 0.00 -1.82 0.00 0.00 55.36 52.67 1y7n s GLN 61 Cb 0.00 -2.84 -0.01 0.00 -1.09 0.00 0.00 33.01 29.07 1y7n s GLN 61 CO 0.00 0.18 1.49 0.45 -1.32 0.00 0.00 175.29 176.09 1y7n s SER 62 N 0.49 6.38 -0.02 12.60 0.15 -1.26 -0.41 113.70 131.64 1y7n s SER 62 Ca -0.05 1.21 0.20 0.00 0.70 0.00 0.00 55.95 58.01 1y7n s SER 62 Cb -0.15 -2.54 0.60 0.00 -1.71 0.00 0.00 66.02 62.23 1y7n s SER 62 CO 0.03 -1.32 1.50 1.33 1.20 0.00 0.00 173.24 175.98 1y7n n VAL 63 N 6.70 1.13 0.38 4.45 0.24 -0.60 -4.28 118.33 126.35 1y7n n VAL 63 Ca 0.17 -1.04 0.14 0.00 -2.04 0.00 0.00 64.34 61.57 1y7n n VAL 63 Cb 0.47 0.44 0.52 0.00 -1.47 0.00 0.00 33.84 33.80 1y7n n VAL 63 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 1y7n h VAL 64 N 3.86 0.00 -0.31 3.34 3.04 -1.73 -0.86 116.25 123.60 1y7n h VAL 64 Ca 0.00 -0.38 0.00 0.00 -1.01 0.00 0.00 66.70 65.31 1y7n h VAL 64 Cb 1.02 1.23 0.00 0.00 -2.01 0.00 0.00 31.29 31.53 1y7n h VAL 64 CO 0.03 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.59 1y7n n ALA 65 N -1.88 2.16 -2.57 3.17 0.00 -1.26 -4.97 120.51 115.16 1y7n n ALA 65 Ca 0.02 -1.12 -0.38 0.00 0.00 0.00 0.00 53.44 51.96 1y7n n ALA 65 Cb 0.29 -0.39 -0.06 0.00 0.00 0.00 0.00 19.45 19.29 1y7n n ALA 65 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1y7n s THR 66 N -1.00 5.11 0.47 0.00 2.01 -0.33 -5.05 115.64 116.85 1y7n s THR 66 Ca 0.21 0.74 -0.24 0.00 0.31 0.00 0.00 61.69 62.71 1y7n s THR 66 Cb 0.11 -3.66 -0.08 0.00 0.01 0.00 0.00 72.50 68.87 1y7n s THR 66 CO 0.14 0.58 1.26 -2.65 -0.69 0.00 0.00 174.62 173.26 1y7n n PRO 67 N 1.92 1.78 -0.33 4.92 -0.02 -1.26 -4.74 135.00 137.27 1y7n n PRO 67 Ca -0.15 0.64 0.10 0.00 -2.02 0.00 0.00 63.50 62.08 1y7n n PRO 67 Cb 0.53 -2.41 0.28 0.00 -0.02 0.00 0.00 33.50 31.88 1y7n n PRO 67 CO 0.00 0.00 0.00 1.12 1.98 0.00 0.00 175.50 178.60 1y7n h HIS 68 N 1.79 0.94 -0.25 6.00 2.07 -1.93 0.64 115.15 124.41 1y7n h HIS 68 Ca -0.49 0.03 -0.11 0.00 -2.85 0.00 0.00 60.37 56.96 1y7n h HIS 68 Cb 1.30 -0.28 -0.01 0.00 2.57 0.00 0.00 27.41 30.99 1y7n h HIS 68 CO 0.46 0.22 -0.30 1.49 -3.07 0.00 0.00 177.93 176.74 1y7n h GLU 69 N 0.72 0.51 -0.24 5.12 4.81 -1.96 -1.64 114.58 121.90 1y7n h GLU 69 Ca 0.53 -0.21 -0.08 0.00 -0.13 0.00 0.00 59.36 59.47 1y7n h GLU 69 Cb 0.78 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1y7n h GLU 69 CO -0.37 0.75 -0.15 -0.22 -0.73 0.00 0.00 179.01 178.29 1y7n h LYS 70 N 0.44 0.53 -0.67 1.92 3.64 -1.36 0.64 116.57 121.70 1y7n h LYS 70 Ca 0.06 -0.25 0.11 0.00 -1.27 0.00 0.00 60.65 59.30 1y7n h LYS 70 Cb 0.74 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.48 1y7n h LYS 70 CO 0.06 0.81 0.26 0.82 -2.27 0.00 0.00 179.45 179.14 1y7n h ILE 71 N 0.24 0.74 -0.10 2.00 2.04 -0.66 0.26 117.51 122.03 1y7n h ILE 71 Ca 0.05 -0.15 -0.10 0.00 1.00 0.00 0.00 64.86 65.65 1y7n h ILE 71 Cb 0.68 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 1y7n h ILE 71 CO 0.04 0.08 -0.40 0.58 0.00 0.00 0.00 178.15 178.45 1y7n h VAL 72 N 0.44 1.31 -0.18 1.67 2.07 -1.05 0.29 116.25 120.79 1y7n h VAL 72 Ca 0.35 -1.49 -0.20 0.00 0.82 0.00 0.00 66.70 66.17 1y7n h VAL 72 Cb 0.46 1.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 1y7n h VAL 72 CO -0.34 0.45 -0.70 -0.74 0.02 0.00 0.00 177.57 176.26 1y7n h HIS 73 N 0.19 0.99 0.05 1.57 6.17 0.13 0.21 115.15 124.46 1y7n h HIS 73 Ca 0.02 -0.41 -0.00 0.00 0.71 0.00 0.00 60.37 60.69 1y7n h HIS 73 Cb 0.80 -0.16 0.00 0.00 2.52 0.00 0.00 27.41 30.57 1y7n h HIS 73 CO 0.01 1.22 -0.02 0.82 0.71 0.00 0.00 177.93 180.67 1y7n h ILE 74 N 0.54 1.22 -0.10 6.26 2.04 -0.43 -2.46 117.51 124.58 1y7n h ILE 74 Ca -0.03 -0.90 0.00 0.00 1.00 0.00 0.00 64.86 64.94 1y7n h ILE 74 Cb 1.31 1.81 -0.00 0.00 -0.74 0.00 0.00 36.82 39.19 1y7n h ILE 74 CO 0.14 0.23 0.07 -0.07 0.00 0.00 0.00 178.15 178.51 1y7n h LEU 75 N -0.46 0.11 -1.14 1.44 3.38 -0.83 -0.11 115.31 117.70 1y7n h LEU 75 Ca -0.01 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1y7n h LEU 75 Cb 0.42 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1y7n h LEU 75 CO 0.01 0.08 -0.33 -1.28 0.09 0.00 0.00 178.44 177.01 1y7n h SER 76 N 0.13 0.00 0.00 -0.43 0.87 -0.43 -3.35 113.55 110.34 1y7n h SER 76 Ca 0.04 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 1y7n h SER 76 Cb -0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1y7n h SER 76 CO -0.01 0.33 0.00 0.59 -0.53 0.00 0.00 176.83 177.21 1y7n n ASN 77 N -3.61 1.52 -4.62 6.23 3.02 -0.21 -4.92 115.26 112.67 1y7n n ASN 77 Ca -0.01 -1.70 -0.38 0.00 -0.03 0.00 0.00 54.58 52.47 1y7n n ASN 77 Cb 0.45 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.52 1y7n n ASN 77 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1y7n s ALA 78 N -0.70 3.57 0.41 5.41 0.00 -0.30 -5.04 121.76 125.11 1y7n s ALA 78 Ca 0.00 -0.95 0.07 0.00 0.00 0.00 0.00 51.96 51.09 1y7n s ALA 78 Cb 0.00 -2.46 -0.06 0.00 0.00 0.00 0.00 23.12 20.60 1y7n s ALA 78 CO 0.00 -0.42 0.14 0.14 0.00 0.00 0.00 175.76 175.62 1y7n s VAL 79 N 1.51 2.23 0.00 0.00 -7.23 -1.26 -4.91 120.40 110.75 1y7n s VAL 79 Ca 0.09 -1.77 0.00 0.00 -1.81 0.00 0.00 61.98 58.49 1y7n s VAL 79 Cb -0.15 -3.00 0.00 0.00 0.56 0.00 0.00 36.38 33.79 1y7n s VAL 79 CO 0.08 -0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.48 1y7n n GLY 80 N -1.17 -1.72 3.61 2.32 0.00 0.15 -4.82 105.19 103.55 1y7n n GLY 80 Ca -0.02 -2.00 -0.43 0.00 0.00 0.00 0.00 46.02 43.57 1y7n n GLY 80 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y7n s GLU 81 N 0.00 3.80 -0.23 1.61 2.02 -1.26 -0.83 118.70 123.81 1y7n s GLU 81 Ca 0.00 0.66 -0.02 0.00 0.02 0.00 0.00 54.97 55.64 1y7n s GLU 81 Cb 0.00 -3.86 0.02 0.00 0.10 0.00 0.00 34.13 30.39 1y7n s GLU 81 CO 0.00 -1.22 -0.09 0.42 0.02 0.00 0.00 175.26 174.39 1y7n s ILE 82 N 4.14 2.82 -0.41 -1.63 1.01 0.49 -4.94 121.20 122.68 1y7n s ILE 82 Ca 0.46 -0.88 -0.22 0.00 0.00 0.00 0.00 60.65 60.02 1y7n s ILE 82 Cb -0.09 -2.35 0.02 0.00 0.01 0.00 0.00 42.46 40.05 1y7n s ILE 82 CO 0.26 0.33 0.70 -1.00 0.00 0.00 0.00 174.94 175.23 1y7n s HIS 83 N 1.35 3.07 0.27 3.97 3.76 -1.26 -1.29 115.29 125.17 1y7n s HIS 83 Ca 0.03 0.18 0.09 0.00 -0.15 0.00 0.00 55.06 55.20 1y7n s HIS 83 Cb -0.15 -3.39 -0.04 0.00 1.11 0.00 0.00 32.58 30.11 1y7n s HIS 83 CO -0.06 -0.82 0.06 -1.64 -0.85 0.00 0.00 174.74 171.42 1y7n s MET 84 N 2.95 2.46 -0.13 1.40 -1.94 0.17 0.06 119.30 124.28 1y7n s MET 84 Ca 0.26 -1.33 0.02 0.00 -1.71 0.00 0.00 55.69 52.93 1y7n s MET 84 Cb -0.14 -2.27 0.01 0.00 2.01 0.00 0.00 34.83 34.45 1y7n s MET 84 CO 0.19 0.35 -0.19 0.15 -0.01 0.00 0.00 175.02 175.51 1y7n s LYS 85 N -3.73 2.72 0.00 2.03 -0.14 -0.40 0.06 119.74 120.28 1y7n s LYS 85 Ca 0.32 -0.74 0.07 0.00 -1.36 0.00 0.00 55.97 54.26 1y7n s LYS 85 Cb -0.06 -2.23 -0.02 0.00 -1.68 0.00 0.00 37.83 33.83 1y7n s LYS 85 CO 0.21 -0.03 -0.21 0.95 -0.76 0.00 0.00 175.35 175.51 1y7n s THR 86 N 0.88 1.70 0.43 2.17 -4.23 0.62 0.21 115.64 117.42 1y7n s THR 86 Ca -0.07 -1.02 0.06 0.00 -1.18 0.00 0.00 61.69 59.49 1y7n s THR 86 Cb -0.15 -1.44 -0.05 0.00 1.34 0.00 0.00 72.50 72.20 1y7n s THR 86 CO -0.02 0.39 0.11 -0.04 -0.54 0.00 0.00 174.62 174.53 1y7n s MET 87 N -0.73 2.13 0.00 3.99 -1.94 0.33 -0.48 119.30 122.60 1y7n s MET 87 Ca 0.08 -2.01 0.00 0.00 -1.71 0.00 0.00 55.69 52.05 1y7n s MET 87 Cb -0.08 -1.82 0.00 0.00 2.01 0.00 0.00 34.83 34.94 1y7n s MET 87 CO 0.00 -0.15 0.76 -2.30 -0.01 0.00 0.00 175.02 173.33 1y7n n PRO 88 N -1.17 0.78 -3.36 2.03 -0.02 -1.25 -1.02 135.00 130.98 1y7n n PRO 88 Ca -0.04 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.27 1y7n n PRO 88 Cb 0.66 -1.12 0.08 0.00 -0.02 0.00 0.00 33.50 33.09 1y7n n PRO 88 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1y7n n ALA 89 N 0.60 -2.27 1.23 3.55 0.00 -1.18 -4.71 120.51 117.73 1y7n n ALA 89 Ca 0.00 0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.60 1y7n n ALA 89 Cb 0.38 -4.12 0.30 0.00 0.00 0.00 0.00 19.45 16.01 1y7n n ALA 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50