#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y2w s TYR 3 N 0.00 3.19 0.05 -1.42 1.51 -0.37 -4.81 117.35 115.49 1y2w s TYR 3 Ca 0.00 0.15 0.07 0.00 -1.01 0.00 0.00 57.07 56.28 1y2w s TYR 3 Cb 0.00 -1.71 -0.02 0.00 -0.11 0.00 0.00 41.96 40.11 1y2w s TYR 3 CO 0.00 0.51 -0.19 0.95 -1.11 0.00 0.00 175.55 175.71 1y2w s THR 4 N -1.13 1.55 -0.20 -0.71 -4.23 -0.29 -0.83 115.64 109.80 1y2w s THR 4 Ca 0.21 -1.18 0.01 0.00 -1.18 0.00 0.00 61.69 59.54 1y2w s THR 4 Cb -0.12 -1.36 0.04 0.00 1.34 0.00 0.00 72.50 72.41 1y2w s THR 4 CO 0.11 0.14 -0.09 -0.63 -0.54 0.00 0.00 174.62 173.62 1y2w s ILE 5 N -0.84 1.58 -0.24 2.99 1.01 0.30 -0.18 121.20 125.82 1y2w s ILE 5 Ca 0.06 -1.00 -0.12 0.00 0.00 0.00 0.00 60.65 59.59 1y2w s ILE 5 Cb -0.09 -1.69 -0.05 0.00 0.01 0.00 0.00 42.46 40.65 1y2w s ILE 5 CO 0.02 0.13 0.22 -0.44 0.00 0.00 0.00 174.94 174.87 1y2w s SER 6 N 1.42 6.17 -0.17 3.58 0.01 -0.26 -1.01 113.70 123.44 1y2w s SER 6 Ca -0.02 0.18 0.00 0.00 1.31 0.00 0.00 55.95 57.43 1y2w s SER 6 Cb -0.16 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 63.93 1y2w s SER 6 CO -0.08 0.01 -0.16 -0.63 0.41 0.00 0.00 173.24 172.80 1y2w s ILE 7 N 1.24 2.54 -0.23 1.44 1.01 0.14 -1.03 121.20 126.30 1y2w s ILE 7 Ca 0.10 -0.80 -0.11 0.00 0.00 0.00 0.00 60.65 59.84 1y2w s ILE 7 Cb -0.14 -2.08 -0.05 0.00 0.01 0.00 0.00 42.46 40.20 1y2w s ILE 7 CO 0.06 0.51 0.18 -0.13 0.00 0.00 0.00 174.94 175.56 1y2w s ARG 8 N 1.07 4.09 -0.23 2.79 0.52 -0.51 -1.23 118.95 125.45 1y2w s ARG 8 Ca -0.01 -0.22 -0.11 0.00 -0.52 0.00 0.00 55.73 54.88 1y2w s ARG 8 Cb -0.14 -3.53 -0.05 0.00 0.52 0.00 0.00 34.95 31.75 1y2w s ARG 8 CO -0.05 0.07 0.16 0.08 0.02 0.00 0.00 175.30 175.58 1y2w s VAL 9 N 1.03 5.36 -0.30 3.52 1.01 -1.26 -0.26 120.40 129.50 1y2w s VAL 9 Ca 0.09 0.20 -0.01 0.00 0.00 0.00 0.00 61.98 62.26 1y2w s VAL 9 Cb -0.13 -3.50 0.06 0.00 0.00 0.00 0.00 36.38 32.80 1y2w s VAL 9 CO 0.04 0.36 -0.01 -0.31 0.00 0.00 0.00 175.10 175.19 1y2w s TYR 10 N 0.93 3.31 -0.45 5.22 1.51 0.53 -4.97 117.35 123.43 1y2w s TYR 10 Ca 0.08 -2.07 -0.18 0.00 -1.01 0.00 0.00 57.07 53.89 1y2w s TYR 10 Cb -0.13 -2.19 0.04 0.00 -0.11 0.00 0.00 41.96 39.56 1y2w s TYR 10 CO 0.03 -0.84 0.52 -1.14 -1.11 0.00 0.00 175.55 173.01 1y2w s GLN 11 N 1.19 3.11 0.01 -0.62 0.74 -1.26 -0.38 119.66 122.45 1y2w s GLN 11 Ca -0.04 -0.81 0.22 0.00 0.05 0.00 0.00 55.36 54.78 1y2w s GLN 11 Cb -0.20 -4.02 -0.06 0.00 1.10 0.00 0.00 33.01 29.83 1y2w s GLN 11 CO -0.02 -1.00 0.98 0.25 -0.55 0.00 0.00 175.29 174.94 1y2w n THR 12 N 5.52 0.03 -3.87 -0.34 -2.24 -0.56 -4.88 114.28 107.94 1y2w n THR 12 Ca -0.07 -0.08 -0.26 0.00 -2.27 0.00 0.00 64.05 61.37 1y2w n THR 12 Cb 0.46 0.66 -0.17 0.00 -2.10 0.00 0.00 70.33 69.18 1y2w n THR 12 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1y2w s THR 13 N -3.07 0.88 -0.14 4.28 2.01 -1.26 -5.02 115.64 113.31 1y2w s THR 13 Ca 0.07 -0.25 -0.06 0.00 0.31 0.00 0.00 61.69 61.76 1y2w s THR 13 Cb 0.16 -0.96 -0.23 0.00 0.01 0.00 0.00 72.50 71.48 1y2w s THR 13 CO 0.83 0.30 3.26 -2.65 -0.69 0.00 0.00 174.62 175.68 1y2w n PRO 14 N 4.98 1.95 -3.98 4.92 -0.02 -1.26 -4.61 135.00 136.98 1y2w n PRO 14 Ca -0.11 -1.01 -0.30 0.00 -2.02 0.00 0.00 63.50 60.06 1y2w n PRO 14 Cb 0.50 -2.02 -0.16 0.00 -0.02 0.00 0.00 33.50 31.79 1y2w n PRO 14 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1y2w s LYS 15 N 1.32 1.96 0.10 -0.52 2.36 -1.26 -5.04 119.74 118.66 1y2w s LYS 15 Ca 0.61 -0.83 0.00 0.00 -2.55 0.00 0.00 55.97 53.20 1y2w s LYS 15 Cb 0.28 -2.40 0.00 0.00 -1.05 0.00 0.00 37.83 34.66 1y2w s LYS 15 CO -0.01 -0.44 0.00 0.41 1.55 0.00 0.00 175.35 176.87 1y2w n GLY 16 N 4.70 -1.65 3.13 5.54 0.00 -1.26 -4.97 105.19 110.68 1y2w n GLY 16 Ca -0.14 -1.43 -0.08 0.00 0.00 0.00 0.00 46.02 44.37 1y2w n GLY 16 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1y2w s PHE 17 N -1.63 -0.85 -0.08 1.61 5.36 -1.26 -5.03 117.98 116.10 1y2w s PHE 17 Ca 0.00 1.28 -0.21 0.00 -0.96 0.00 0.00 56.93 57.04 1y2w s PHE 17 Cb 0.00 0.21 -0.04 0.00 -0.34 0.00 0.00 43.02 42.85 1y2w s PHE 17 CO 0.00 -0.59 0.60 -0.06 -1.46 0.00 0.00 175.22 173.71 1y2w s PHE 18 N 2.60 3.56 0.10 10.12 0.40 -1.26 -3.93 117.98 129.57 1y2w s PHE 18 Ca 0.05 1.10 0.10 0.00 -0.60 0.00 0.00 56.93 57.57 1y2w s PHE 18 Cb -0.13 -2.68 -0.04 0.00 0.51 0.00 0.00 43.02 40.68 1y2w s PHE 18 CO -0.14 0.15 -0.25 -0.98 0.70 0.00 0.00 175.22 174.70 1y2w s ARG 19 N 0.60 1.42 0.16 0.44 1.70 -0.25 -4.87 118.95 118.16 1y2w s ARG 19 Ca 0.32 -1.22 -0.30 0.00 -0.47 0.00 0.00 55.73 54.05 1y2w s ARG 19 Cb -0.17 -1.77 -0.08 0.00 -0.57 0.00 0.00 34.95 32.36 1y2w s ARG 19 CO 0.15 0.43 1.32 -1.25 -1.08 0.00 0.00 175.30 174.87 1y2w s PRO 20 N -1.78 4.38 0.00 3.89 0.04 -1.26 -1.39 135.00 138.88 1y2w s PRO 20 Ca 0.11 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.18 1y2w s PRO 20 Cb -0.10 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.22 1y2w s PRO 20 CO 0.04 -0.30 0.01 1.33 0.04 0.00 0.00 177.00 178.12 1y2w n VAL 21 N 3.10 0.00 -3.63 -0.36 0.24 -0.40 -4.94 118.33 112.34 1y2w n VAL 21 Ca 0.08 -0.27 -0.11 0.00 -2.04 0.00 0.00 64.34 62.00 1y2w n VAL 21 Cb 0.43 1.01 -0.07 0.00 -1.47 0.00 0.00 33.84 33.74 1y2w n VAL 21 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1y2w s GLU 22 N -0.52 0.64 -0.07 7.34 2.12 -1.22 -4.98 118.70 122.00 1y2w s GLU 22 Ca 0.00 0.69 -0.03 0.00 0.36 0.00 0.00 54.97 56.00 1y2w s GLU 22 Cb 0.00 0.31 0.04 0.00 0.26 0.00 0.00 34.13 34.74 1y2w s GLU 22 CO 0.00 -0.09 0.13 -0.98 -0.54 0.00 0.00 175.26 173.78 1y2w s ARG 23 N 0.15 0.02 0.22 4.30 1.70 -1.26 -1.58 118.95 122.51 1y2w s ARG 23 Ca 0.01 0.48 0.11 0.00 -0.47 0.00 0.00 55.73 55.86 1y2w s ARG 23 Cb -0.05 -0.30 -0.05 0.00 -0.57 0.00 0.00 34.95 33.98 1y2w s ARG 23 CO -0.03 -0.28 -0.21 0.95 -1.08 0.00 0.00 175.30 174.65 1y2w s THR 24 N 2.03 2.29 -0.10 4.99 -4.23 -0.24 -4.96 115.64 115.42 1y2w s THR 24 Ca 0.01 -2.16 0.02 0.00 -1.18 0.00 0.00 61.69 58.38 1y2w s THR 24 Cb -0.12 -2.14 0.01 0.00 1.34 0.00 0.00 72.50 71.59 1y2w s THR 24 CO -0.05 -0.27 -0.14 0.20 -0.54 0.00 0.00 174.62 173.81 1y2w s ASN 25 N -3.00 2.35 0.59 3.99 0.01 -1.26 -2.10 114.94 115.51 1y2w s ASN 25 Ca 0.23 -0.41 -0.17 0.00 -0.71 0.00 0.00 52.86 51.81 1y2w s ASN 25 Cb -0.06 -1.04 -0.04 0.00 0.41 0.00 0.00 41.25 40.52 1y2w s ASN 25 CO 0.11 0.01 1.09 0.86 -1.51 0.00 0.00 177.10 177.66 1y2w s TRP 26 N 0.98 2.81 -0.73 2.20 -0.00 -0.44 -4.92 118.94 118.83 1y2w s TRP 26 Ca -0.07 1.54 0.26 0.00 -0.00 0.00 0.00 56.10 57.82 1y2w s TRP 26 Cb -0.15 -3.13 0.66 0.00 -0.00 0.00 0.00 33.47 30.85 1y2w s TRP 26 CO -0.01 -1.35 1.61 0.36 -0.00 0.00 0.00 176.95 177.55 1y2w n LYS 27 N -1.83 0.24 -1.34 5.86 2.85 -1.26 -4.24 118.16 118.45 1y2w n LYS 27 Ca 0.10 0.14 -0.30 0.00 -1.05 0.00 0.00 58.31 57.20 1y2w n LYS 27 Cb 0.52 -1.72 0.13 0.00 -0.65 0.00 0.00 35.03 33.31 1y2w n LYS 27 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1y2w s TYR 28 N -3.11 2.46 -1.56 5.58 4.12 -1.26 -3.27 117.35 120.31 1y2w s TYR 28 Ca 0.09 1.16 -0.14 0.00 0.02 0.00 0.00 57.07 58.19 1y2w s TYR 28 Cb 0.13 -3.18 0.10 0.00 -1.52 0.00 0.00 41.96 37.49 1y2w s TYR 28 CO 0.64 -2.27 0.95 0.00 0.02 0.00 0.00 175.55 174.89 1y2w n ALA 29 N -3.77 -1.29 -1.98 3.71 0.00 -1.26 -0.78 120.51 115.13 1y2w n ALA 29 Ca 0.07 0.15 -0.17 0.00 0.00 0.00 0.00 53.44 53.49 1y2w n ALA 29 Cb 0.56 -4.28 -0.04 0.00 0.00 0.00 0.00 19.45 15.70 1y2w n ALA 29 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1y2w n ASN 30 N -2.81 -5.05 0.00 0.00 3.02 -1.26 -3.31 115.26 105.86 1y2w n ASN 30 Ca 0.04 0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.76 1y2w n ASN 30 Cb 0.52 -4.11 0.00 0.00 -0.61 0.00 0.00 39.78 35.59 1y2w n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1y2w n GLY 31 N -0.96 0.47 0.00 7.41 0.00 0.04 -4.68 105.19 107.47 1y2w n GLY 31 Ca -0.19 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1y2w n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y2w n GLY 32 N 0.00 -1.16 3.11 -0.02 0.00 -1.26 -3.07 105.19 102.80 1y2w n GLY 32 Ca 0.00 -0.98 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 1y2w n GLY 32 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1y2w s THR 33 N -2.19 0.48 -0.13 2.61 -4.23 -0.05 -4.88 115.64 107.25 1y2w s THR 33 Ca 0.00 -1.69 -0.01 0.00 -1.18 0.00 0.00 61.69 58.81 1y2w s THR 33 Cb 0.00 -1.36 -0.02 0.00 1.34 0.00 0.00 72.50 72.46 1y2w s THR 33 CO 0.00 -0.81 -0.10 0.26 -0.54 0.00 0.00 174.62 173.43 1y2w s TRP 34 N -3.22 2.87 0.07 3.99 0.52 -1.26 -1.08 118.94 120.84 1y2w s TRP 34 Ca 0.05 -0.48 0.06 0.00 0.02 0.00 0.00 56.10 55.75 1y2w s TRP 34 Cb 0.03 -1.85 -0.03 0.00 -1.15 0.00 0.00 33.47 30.47 1y2w s TRP 34 CO -0.05 -0.11 -0.16 -0.51 0.02 0.00 0.00 176.95 176.14 1y2w s ASP 35 N 0.21 1.92 -0.25 2.95 1.01 -0.12 -4.98 116.67 117.42 1y2w s ASP 35 Ca -0.06 -0.60 -0.14 0.00 0.71 0.00 0.00 52.55 52.45 1y2w s ASP 35 Cb -0.15 -0.09 -0.04 0.00 1.01 0.00 0.00 42.92 43.65 1y2w s ASP 35 CO 0.04 -0.02 0.33 -1.61 0.21 0.00 0.00 175.17 174.13 1y2w s GLU 36 N -1.66 4.07 -0.16 8.23 2.02 -1.26 -0.16 118.70 129.77 1y2w s GLU 36 Ca 0.01 0.01 -0.03 0.00 0.02 0.00 0.00 54.97 54.99 1y2w s GLU 36 Cb -0.10 -3.60 0.05 0.00 0.10 0.00 0.00 34.13 30.58 1y2w s GLU 36 CO 0.03 -0.15 0.03 0.08 0.02 0.00 0.00 175.26 175.27 1y2w s VAL 37 N 1.67 0.46 -1.55 2.63 1.01 0.02 -4.88 120.40 119.76 1y2w s VAL 37 Ca 0.14 -0.38 -0.13 0.00 0.00 0.00 0.00 61.98 61.61 1y2w s VAL 37 Cb -0.15 -0.90 0.09 0.00 0.00 0.00 0.00 36.38 35.42 1y2w s VAL 37 CO 0.09 -0.10 0.90 0.54 0.00 0.00 0.00 175.10 176.52 1y2w n ARG 38 N 5.08 -4.92 -0.72 2.72 1.74 -1.26 -1.11 116.66 118.20 1y2w n ARG 38 Ca -0.08 0.55 0.00 0.00 -0.77 0.00 0.00 57.85 57.54 1y2w n ARG 38 Cb 0.48 -5.34 0.00 0.00 -1.02 0.00 0.00 32.46 26.57 1y2w n ARG 38 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1y2w n GLY 39 N -1.64 0.82 3.61 -0.13 0.00 -1.26 -5.04 105.19 101.55 1y2w n GLY 39 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.77 1y2w n GLY 39 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y2w s GLU 40 N -0.28 2.22 -0.21 1.61 2.02 -0.27 -4.77 118.70 119.02 1y2w s GLU 40 Ca 0.00 -1.25 -0.16 0.00 0.02 0.00 0.00 54.97 53.59 1y2w s GLU 40 Cb 0.00 -2.22 -0.04 0.00 0.10 0.00 0.00 34.13 31.97 1y2w s GLU 40 CO 0.00 0.43 0.39 0.71 0.02 0.00 0.00 175.26 176.80 1y2w s TYR 41 N -1.84 3.36 -0.25 1.61 1.51 -0.36 -0.80 117.35 120.57 1y2w s TYR 41 Ca 0.27 0.58 -0.01 0.00 -1.01 0.00 0.00 57.07 56.90 1y2w s TYR 41 Cb -0.08 -2.52 0.03 0.00 -0.11 0.00 0.00 41.96 39.28 1y2w s TYR 41 CO 0.17 -0.03 -0.07 0.08 -1.11 0.00 0.00 175.55 174.59 1y2w s VAL 42 N 1.38 2.74 -0.27 0.71 1.01 0.78 0.24 120.40 127.00 1y2w s VAL 42 Ca 0.18 -1.16 -0.17 0.00 0.00 0.00 0.00 61.98 60.83 1y2w s VAL 42 Cb -0.15 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 1y2w s VAL 42 CO 0.08 0.14 0.46 -0.22 0.00 0.00 0.00 175.10 175.56 1y2w s LEU 43 N 1.28 4.05 -0.11 3.92 2.96 -0.18 -0.94 118.68 129.66 1y2w s LEU 43 Ca -0.02 0.42 -0.01 0.00 -0.22 0.00 0.00 54.13 54.31 1y2w s LEU 43 Cb -0.17 -2.57 -0.03 0.00 0.50 0.00 0.00 46.19 43.92 1y2w s LEU 43 CO -0.05 -0.25 -0.06 -0.89 -1.32 0.00 0.00 176.35 173.79 1y2w s THR 44 N 2.22 3.75 0.02 3.68 2.01 -0.24 -0.54 115.64 126.55 1y2w s THR 44 Ca 0.19 -0.43 0.03 0.00 0.31 0.00 0.00 61.69 61.78 1y2w s THR 44 Cb -0.16 -2.59 -0.02 0.00 0.01 0.00 0.00 72.50 69.75 1y2w s THR 44 CO 0.09 0.55 -0.10 -0.04 -0.69 0.00 0.00 174.62 174.44 1y2w s MET 45 N -0.23 0.68 0.37 4.92 -1.94 -0.01 -0.87 119.30 122.22 1y2w s MET 45 Ca 0.03 -0.54 0.11 0.00 -1.71 0.00 0.00 55.69 53.59 1y2w s MET 45 Cb -0.13 -0.62 0.73 0.00 2.01 0.00 0.00 34.83 36.82 1y2w s MET 45 CO 0.03 0.15 1.85 0.78 -0.01 0.00 0.00 175.02 177.82 1y2w h GLY 46 N 5.28 0.10 0.00 -0.03 0.00 -1.55 -0.97 103.07 105.89 1y2w h GLY 46 Ca -0.34 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 46.92 1y2w h GLY 46 CO 0.46 0.07 0.00 0.61 0.00 0.00 0.00 176.54 177.68 1y2w n GLY 47 N -0.58 1.20 3.77 4.60 0.00 -1.21 -3.81 105.19 109.16 1y2w n GLY 47 Ca -0.02 -0.89 -0.38 0.00 0.00 0.00 0.00 46.02 44.73 1y2w n GLY 47 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1y2w s SER 48 N -0.86 7.12 0.00 1.61 0.15 -1.26 -4.34 113.70 116.12 1y2w s SER 48 Ca 0.00 2.04 0.00 0.00 0.70 0.00 0.00 55.95 58.69 1y2w s SER 48 Cb 0.00 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 1y2w s SER 48 CO 0.00 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.82 1y2w n GLY 49 N 0.73 1.39 1.44 9.45 0.00 0.46 -4.69 105.19 113.96 1y2w n GLY 49 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 1y2w n GLY 49 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1y2w n THR 50 N -0.61 0.00 -3.80 2.61 5.66 -1.20 -4.59 114.28 112.35 1y2w n THR 50 Ca 0.00 -1.04 -0.04 0.00 -3.05 0.00 0.00 64.05 59.91 1y2w n THR 50 Cb 0.00 0.43 -0.01 0.00 -1.55 0.00 0.00 70.33 69.21 1y2w n THR 50 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1y2w s SER 51 N -2.06 -0.14 0.02 1.09 1.04 -1.26 -2.19 113.70 110.19 1y2w s SER 51 Ca 0.12 -0.55 -0.06 0.00 0.48 0.00 0.00 55.95 55.94 1y2w s SER 51 Cb 0.01 0.56 -0.01 0.00 0.10 0.00 0.00 66.02 66.68 1y2w s SER 51 CO 0.09 -1.06 0.10 -0.83 0.98 0.00 0.00 173.24 172.51 1y2w s GLY 52 N -3.02 0.12 0.03 7.32 0.00 -0.02 -1.32 107.32 110.41 1y2w s GLY 52 Ca 0.14 -0.35 0.08 0.00 0.00 0.00 0.00 44.72 44.59 1y2w s GLY 52 CO 0.04 -0.48 -0.24 -0.56 0.00 0.00 0.00 173.10 171.87 1y2w s SER 53 N -1.68 2.80 -0.11 1.64 0.01 -0.89 -1.39 113.70 114.07 1y2w s SER 53 Ca -0.11 -0.52 0.02 0.00 1.31 0.00 0.00 55.95 56.65 1y2w s SER 53 Cb -0.05 -0.26 -0.01 0.00 0.21 0.00 0.00 66.02 65.91 1y2w s SER 53 CO -0.01 0.23 -0.19 -0.76 0.41 0.00 0.00 173.24 172.92 1y2w s LEU 54 N -1.03 2.38 -0.10 2.44 1.43 0.22 -1.08 118.68 122.94 1y2w s LEU 54 Ca 0.09 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 52.73 1y2w s LEU 54 Cb -0.09 -1.50 -0.03 0.00 0.03 0.00 0.00 46.19 44.60 1y2w s LEU 54 CO 0.01 0.17 -0.02 -0.60 0.23 0.00 0.00 176.35 176.14 1y2w s ARG 55 N 0.31 3.11 0.00 1.70 3.52 -0.61 -0.50 118.95 126.48 1y2w s ARG 55 Ca -0.14 -0.45 0.07 0.00 -0.13 0.00 0.00 55.73 55.07 1y2w s ARG 55 Cb -0.17 -2.80 -0.02 0.00 -1.56 0.00 0.00 34.95 30.41 1y2w s ARG 55 CO 0.07 0.59 -0.20 -0.06 -0.81 0.00 0.00 175.30 174.89 1y2w s PHE 56 N -0.58 1.81 -0.04 5.12 0.40 -0.60 -1.28 117.98 122.82 1y2w s PHE 56 Ca 0.09 -0.35 0.02 0.00 -0.60 0.00 0.00 56.93 56.09 1y2w s PHE 56 Cb -0.12 -1.14 0.01 0.00 0.51 0.00 0.00 43.02 42.28 1y2w s PHE 56 CO 0.02 0.01 -0.10 0.08 0.70 0.00 0.00 175.22 175.93 1y2w s VAL 57 N -0.58 0.89 -0.58 -0.44 1.01 -0.48 -1.83 120.40 118.39 1y2w s VAL 57 Ca 0.08 -0.38 -0.09 0.00 0.00 0.00 0.00 61.98 61.59 1y2w s VAL 57 Cb -0.08 -0.81 0.15 0.00 0.00 0.00 0.00 36.38 35.64 1y2w s VAL 57 CO 0.00 0.29 0.46 -0.55 0.00 0.00 0.00 175.10 175.29 1y2w s SER 58 N 0.43 5.83 0.35 3.32 0.15 0.91 -1.09 113.70 123.61 1y2w s SER 58 Ca -0.08 -2.27 0.05 0.00 0.70 0.00 0.00 55.95 54.35 1y2w s SER 58 Cb -0.12 -2.02 0.66 0.00 -1.71 0.00 0.00 66.02 62.83 1y2w s SER 58 CO 0.01 -0.61 1.92 0.28 1.20 0.00 0.00 173.24 176.05 1y2w h SER 59 N 8.03 0.50 0.47 5.45 0.02 -1.80 -1.43 113.55 124.78 1y2w h SER 59 Ca -0.11 -0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 60.73 1y2w h SER 59 Cb 1.04 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.45 1y2w h SER 59 CO 0.82 0.51 -0.21 0.44 -1.14 0.00 0.00 176.83 177.24 1y2w h ASP 60 N 0.53 0.00 0.00 3.07 5.19 -1.93 -3.21 116.42 120.07 1y2w h ASP 60 Ca 0.12 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.53 1y2w h ASP 60 Cb 0.22 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.73 1y2w h ASP 60 CO -0.00 0.21 0.00 0.35 -3.12 0.00 0.00 179.24 176.68 1y2w n THR 61 N -3.74 0.71 -3.76 0.35 -2.24 -1.08 -5.02 114.28 99.52 1y2w n THR 61 Ca -0.01 -0.80 -0.25 0.00 -2.27 0.00 0.00 64.05 60.72 1y2w n THR 61 Cb 0.32 0.67 0.04 0.00 -2.10 0.00 0.00 70.33 69.26 1y2w n THR 61 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1y2w n ASP 62 N -0.36 -3.23 -4.42 3.42 8.00 -0.59 -5.00 116.55 114.38 1y2w n ASP 62 Ca 0.00 -0.76 -0.27 0.00 0.71 0.00 0.00 54.79 54.47 1y2w n ASP 62 Cb 0.23 -4.17 -0.12 0.00 -0.02 0.00 0.00 41.12 37.04 1y2w n ASP 62 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1y2w s GLU 63 N -6.23 1.50 0.03 -1.24 2.02 -0.90 -5.01 118.70 108.87 1y2w s GLU 63 Ca 0.33 -1.51 -0.28 0.00 0.02 0.00 0.00 54.97 53.53 1y2w s GLU 63 Cb -0.16 -1.82 0.09 0.00 0.10 0.00 0.00 34.13 32.35 1y2w s GLU 63 CO 0.80 0.39 0.87 -1.54 0.02 0.00 0.00 175.26 175.81 1y2w s SER 64 N -2.64 -0.36 0.11 -0.19 1.04 -1.26 -0.06 113.70 110.34 1y2w s SER 64 Ca 0.20 -0.05 -0.21 0.00 0.48 0.00 0.00 55.95 56.37 1y2w s SER 64 Cb -0.08 0.42 0.06 0.00 0.10 0.00 0.00 66.02 66.51 1y2w s SER 64 CO 0.09 -0.69 0.52 0.72 0.98 0.00 0.00 173.24 174.87 1y2w s PHE 65 N -3.20 -0.42 -0.16 5.02 -0.12 -0.76 -4.14 117.98 114.20 1y2w s PHE 65 Ca 0.06 0.27 0.01 0.00 -0.05 0.00 0.00 56.93 57.21 1y2w s PHE 65 Cb -0.01 0.41 0.01 0.00 -0.63 0.00 0.00 43.02 42.80 1y2w s PHE 65 CO -0.08 -0.74 -0.17 0.08 -0.05 0.00 0.00 175.22 174.25 1y2w s VAL 66 N -3.33 2.43 -0.19 -2.49 1.01 0.18 -1.56 120.40 116.44 1y2w s VAL 66 Ca -0.01 -0.84 -0.06 0.00 0.00 0.00 0.00 61.98 61.08 1y2w s VAL 66 Cb -0.00 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 1y2w s VAL 66 CO -0.09 0.52 0.02 0.00 0.00 0.00 0.00 175.10 175.55 1y2w s ALA 67 N 0.95 3.15 -0.05 5.51 0.00 0.34 -1.15 121.76 130.52 1y2w s ALA 67 Ca -0.03 -0.90 0.06 0.00 0.00 0.00 0.00 51.96 51.08 1y2w s ALA 67 Cb -0.15 -1.81 -0.02 0.00 0.00 0.00 0.00 23.12 21.14 1y2w s ALA 67 CO -0.03 -0.02 -0.22 0.99 0.00 0.00 0.00 175.76 176.48 1y2w s THR 68 N 0.77 2.41 0.01 0.00 2.01 -0.20 -0.61 115.64 120.02 1y2w s THR 68 Ca 0.01 -0.96 0.03 0.00 0.31 0.00 0.00 61.69 61.08 1y2w s THR 68 Cb -0.14 -1.89 -0.01 0.00 0.01 0.00 0.00 72.50 70.47 1y2w s THR 68 CO 0.02 0.58 -0.10 -0.36 -0.69 0.00 0.00 174.62 174.07 1y2w s PHE 69 N -0.47 0.88 0.00 4.92 0.40 -0.49 -1.79 117.98 121.43 1y2w s PHE 69 Ca 0.06 -0.22 0.00 0.00 -0.60 0.00 0.00 56.93 56.16 1y2w s PHE 69 Cb -0.12 -0.55 0.00 0.00 0.51 0.00 0.00 43.02 42.86 1y2w s PHE 69 CO 0.01 -0.01 0.00 0.41 0.70 0.00 0.00 175.22 176.33 1y2w n GLY 70 N 2.54 0.95 2.97 4.36 0.00 -0.93 -0.84 105.19 114.23 1y2w n GLY 70 Ca -0.15 -0.86 -0.26 0.00 0.00 0.00 0.00 46.02 44.74 1y2w n GLY 70 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y2w s VAL 71 N -2.34 1.13 -0.15 1.61 1.01 -0.93 -0.44 120.40 120.30 1y2w s VAL 71 Ca 0.00 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1y2w s VAL 71 Cb 0.00 -1.08 0.02 0.00 0.00 0.00 0.00 36.38 35.32 1y2w s VAL 71 CO 0.00 0.37 -0.17 -2.28 0.00 0.00 0.00 175.10 173.02 1y2w s HIS 72 N 1.21 2.40 -1.46 5.22 5.04 0.42 -0.41 115.29 127.71 1y2w s HIS 72 Ca -0.04 -1.30 -0.04 0.00 -1.54 0.00 0.00 55.06 52.13 1y2w s HIS 72 Cb -0.14 -1.69 0.03 0.00 0.04 0.00 0.00 32.58 30.82 1y2w s HIS 72 CO -0.03 -0.66 0.53 0.09 -2.34 0.00 0.00 174.74 172.33 1y2w n ASN 73 N 4.48 -1.15 -0.73 9.88 3.02 -1.26 -2.04 115.26 127.46 1y2w n ASN 73 Ca -0.19 -0.99 -0.09 0.00 -0.03 0.00 0.00 54.58 53.28 1y2w n ASN 73 Cb 0.51 -3.09 -0.04 0.00 -0.61 0.00 0.00 39.78 36.54 1y2w n ASN 73 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1y2w n TYR 74 N -4.41 0.00 -4.65 3.10 4.02 -1.26 -4.99 117.16 108.97 1y2w n TYR 74 Ca -0.22 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.44 1y2w n TYR 74 Cb 0.64 -2.02 -0.15 0.00 -0.02 0.00 0.00 39.34 37.79 1y2w n TYR 74 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 1y2w s LYS 75 N -2.61 1.23 0.60 -0.72 1.02 -0.87 -5.01 119.74 113.39 1y2w s LYS 75 Ca 0.00 -0.49 -0.19 0.00 0.02 0.00 0.00 55.97 55.31 1y2w s LYS 75 Cb 0.00 -1.16 -0.03 0.00 -0.52 0.00 0.00 37.83 36.12 1y2w s LYS 75 CO 0.00 0.27 1.26 -0.98 -0.92 0.00 0.00 175.35 174.98 1y2w s ARG 76 N -0.19 2.85 0.14 1.68 3.03 -1.26 -0.43 118.95 124.77 1y2w s ARG 76 Ca 0.03 1.98 -0.01 0.00 2.03 0.00 0.00 55.73 59.76 1y2w s ARG 76 Cb -0.07 -1.96 -0.04 0.00 -1.03 0.00 0.00 34.95 31.85 1y2w s ARG 76 CO 0.00 -1.34 0.05 1.67 -1.13 0.00 0.00 175.30 174.55 1y2w s TRP 77 N -1.46 0.94 0.15 5.89 1.48 0.42 -3.84 118.94 122.52 1y2w s TRP 77 Ca 0.78 -1.21 -0.18 0.00 -1.06 0.00 0.00 56.10 54.44 1y2w s TRP 77 Cb -0.35 -0.52 0.04 0.00 -1.16 0.00 0.00 33.47 31.48 1y2w s TRP 77 CO 0.38 -0.47 0.48 0.00 -4.06 0.00 0.00 176.95 173.27 1y2w s ASP 79 N -2.81 -0.59 -0.04 0.00 2.15 -0.74 -4.70 116.67 109.93 1y2w s ASP 79 Ca 0.04 0.26 0.03 0.00 0.43 0.00 0.00 52.55 53.31 1y2w s ASP 79 Cb 0.00 0.57 0.01 0.00 -0.30 0.00 0.00 42.92 43.20 1y2w s ASP 79 CO -0.10 -0.82 -0.11 -0.63 -0.17 0.00 0.00 175.17 173.33 1y2w s ILE 80 N -2.79 1.02 -0.10 4.11 1.01 -1.26 -1.03 121.20 122.15 1y2w s ILE 80 Ca -0.03 -0.45 0.03 0.00 0.00 0.00 0.00 60.65 60.19 1y2w s ILE 80 Cb -0.01 -0.91 -0.01 0.00 0.01 0.00 0.00 42.46 41.54 1y2w s ILE 80 CO -0.04 0.32 -0.20 -0.69 0.00 0.00 0.00 174.94 174.32 1y2w s VAL 81 N 0.38 2.41 0.04 2.92 1.01 -0.30 -4.97 120.40 121.89 1y2w s VAL 81 Ca -0.08 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.00 1y2w s VAL 81 Cb -0.12 -1.95 -0.00 0.00 0.00 0.00 0.00 36.38 34.31 1y2w s VAL 81 CO 0.02 0.55 0.02 1.07 0.00 0.00 0.00 175.10 176.76 1y2w n THR 82 N 3.43 0.00 -3.63 3.92 5.66 -1.26 -0.65 114.28 121.74 1y2w n THR 82 Ca -0.19 -0.24 -0.21 0.00 -3.05 0.00 0.00 64.05 60.37 1y2w n THR 82 Cb 0.53 0.09 0.04 0.00 -1.55 0.00 0.00 70.33 69.45 1y2w n THR 82 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1y2w n ASN 83 N -2.19 -1.75 -4.75 1.09 3.02 -1.26 -4.93 115.26 104.48 1y2w n ASN 83 Ca -0.00 -0.79 -0.40 0.00 -0.03 0.00 0.00 54.58 53.36 1y2w n ASN 83 Cb 0.06 -4.25 -0.06 0.00 -0.61 0.00 0.00 39.78 34.92 1y2w n ASN 83 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1y2w s LEU 84 N -6.55 4.64 0.80 3.41 1.43 -1.26 -5.07 118.68 116.08 1y2w s LEU 84 Ca 0.05 1.90 -0.12 0.00 -1.03 0.00 0.00 54.13 54.93 1y2w s LEU 84 Cb -0.01 -3.57 0.07 0.00 0.03 0.00 0.00 46.19 42.71 1y2w s LEU 84 CO 0.80 0.16 1.13 0.42 0.23 0.00 0.00 176.35 179.09 1y2w s THR 85 N -1.13 2.61 0.46 5.49 -4.23 -1.26 -4.96 115.64 112.62 1y2w s THR 85 Ca 0.40 0.20 0.35 0.00 -1.18 0.00 0.00 61.69 61.47 1y2w s THR 85 Cb -0.25 -3.10 0.38 0.00 1.34 0.00 0.00 72.50 70.86 1y2w s THR 85 CO 0.31 -0.26 2.19 0.78 -0.54 0.00 0.00 174.62 177.10 1y2w h ASN 86 N -1.04 0.00 0.84 3.99 2.35 -2.04 -2.27 115.58 117.41 1y2w h ASN 86 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 1y2w h ASN 86 Cb 1.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.67 1y2w h ASN 86 CO 0.63 0.04 -0.33 -0.62 -1.65 0.00 0.00 177.43 175.50 1y2w n GLU 87 N -3.34 0.10 -2.58 0.81 4.71 -1.26 -4.48 120.64 114.60 1y2w n GLU 87 Ca -0.02 0.05 -0.43 0.00 -0.01 0.00 0.00 57.16 56.75 1y2w n GLU 87 Cb 0.17 -1.58 0.01 0.00 -1.01 0.00 0.00 31.44 29.03 1y2w n GLU 87 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1y2w n GLN 88 N -1.73 3.77 -1.66 3.49 6.02 -0.85 -4.83 117.38 121.58 1y2w n GLN 88 Ca 0.05 -3.81 -0.29 0.00 -0.01 0.00 0.00 57.00 52.95 1y2w n GLN 88 Cb 0.37 -2.84 0.12 0.00 1.02 0.00 0.00 30.24 28.91 1y2w n GLN 88 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1y2w s THR 89 N -0.20 2.00 0.35 5.09 -4.23 -1.26 -4.83 115.64 112.56 1y2w s THR 89 Ca 0.38 0.00 0.05 0.00 -1.18 0.00 0.00 61.69 60.94 1y2w s THR 89 Cb 0.07 -2.84 0.18 0.00 1.34 0.00 0.00 72.50 71.24 1y2w s THR 89 CO 0.02 0.00 1.91 0.00 -0.54 0.00 0.00 174.62 176.01 1y2w h ALA 90 N -1.36 1.44 -0.61 3.99 0.00 -1.95 -0.95 119.26 119.82 1y2w h ALA 90 Ca -0.49 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.32 1y2w h ALA 90 Cb 1.33 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.92 1y2w h ALA 90 CO 0.62 0.40 0.30 1.25 0.00 0.00 0.00 179.25 181.82 1y2w h LEU 91 N 0.49 0.41 0.26 0.00 6.46 -1.95 0.97 115.31 121.94 1y2w h LEU 91 Ca 0.11 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.90 1y2w h LEU 91 Cb 0.26 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.17 1y2w h LEU 91 CO 0.00 0.26 -0.12 0.58 -0.62 0.00 0.00 178.44 178.54 1y2w h VAL 92 N 0.55 0.79 -0.30 1.05 2.07 -1.75 -3.22 116.25 115.44 1y2w h VAL 92 Ca 0.28 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 1y2w h VAL 92 Cb 0.23 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 1y2w h VAL 92 CO -0.21 0.13 0.14 0.40 0.02 0.00 0.00 177.57 178.04 1y2w h ILE 93 N -0.69 1.16 -0.72 4.57 1.08 -0.98 -2.63 117.51 119.31 1y2w h ILE 93 Ca -0.04 -0.48 0.13 0.00 -0.39 0.00 0.00 64.86 64.08 1y2w h ILE 93 Cb 0.48 0.92 -0.09 0.00 -3.07 0.00 0.00 36.82 35.06 1y2w h ILE 93 CO 0.06 0.17 0.28 -1.13 -0.69 0.00 0.00 178.15 176.84 1y2w h ASN 94 N 0.35 0.27 0.23 1.72 -0.00 -0.93 -1.79 115.58 115.43 1y2w h ASN 94 Ca 0.10 0.10 -0.09 0.00 -0.00 0.00 0.00 56.30 56.42 1y2w h ASN 94 Cb 0.14 0.08 -0.01 0.00 -0.00 0.00 0.00 38.32 38.53 1y2w h ASN 94 CO -0.01 0.12 -0.35 -0.61 -0.00 0.00 0.00 177.43 176.58 1y2w h GLN 95 N 0.44 0.17 0.00 6.67 4.15 -1.50 -3.07 115.11 121.97 1y2w h GLN 95 Ca 0.39 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.74 1y2w h GLN 95 Cb 0.55 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.23 1y2w h GLN 95 CO -0.38 0.50 0.00 0.93 -1.93 0.00 0.00 178.83 177.95 1y2w h GLU 96 N 0.15 0.00 0.00 1.69 5.08 -0.96 -2.13 114.58 118.41 1y2w h GLU 96 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1y2w h GLU 96 Cb 0.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.94 1y2w h GLU 96 CO 0.05 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.72 1y2w n TYR 97 N -2.97 0.00 -2.97 4.33 4.02 -1.16 -1.76 117.16 116.65 1y2w n TYR 97 Ca -0.01 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.69 1y2w n TYR 97 Cb 0.20 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.50 1y2w n TYR 97 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1y2w n TYR 98 N -0.90 1.56 0.00 -0.72 4.02 -0.80 -4.33 117.16 115.98 1y2w n TYR 98 Ca 0.13 -3.61 0.00 0.00 -0.01 0.00 0.00 57.90 54.41 1y2w n TYR 98 Cb 0.06 -0.40 0.00 0.00 -0.02 0.00 0.00 39.34 38.98 1y2w n TYR 98 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1y2w n GLY 99 N 0.03 0.65 3.53 2.72 0.00 -1.24 -5.10 105.19 105.78 1y2w n GLY 99 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 1y2w n GLY 99 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y2w s VAL 100 N 0.00 4.99 0.27 1.61 1.01 -0.72 -4.98 120.40 122.58 1y2w s VAL 100 Ca 0.00 0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.13 1y2w s VAL 100 Cb 0.00 -4.03 0.26 0.00 0.00 0.00 0.00 36.38 32.61 1y2w s VAL 100 CO 0.00 -0.34 1.71 -0.65 0.00 0.00 0.00 175.10 175.82 1y2w h PRO 101 N 8.61 0.41 0.00 2.72 0.11 -1.99 0.20 132.00 142.07 1y2w h PRO 101 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1y2w h PRO 101 Cb 1.12 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1y2w h PRO 101 CO 0.80 0.27 0.00 0.97 -0.21 0.00 0.00 178.00 179.84 1y2w h ILE 102 N 0.42 0.00 0.04 4.15 6.09 -1.93 -2.14 117.51 124.13 1y2w h ILE 102 Ca 0.50 -0.32 -0.38 0.00 -1.37 0.00 0.00 64.86 63.29 1y2w h ILE 102 Cb 0.88 1.27 -0.05 0.00 0.47 0.00 0.00 36.82 39.39 1y2w h ILE 102 CO -0.48 0.00 -2.25 0.54 -3.07 0.00 0.00 178.15 172.89 1y2w n ARG 103 N -2.97 0.66 -0.22 2.19 5.12 0.11 -4.21 116.66 117.33 1y2w n ARG 103 Ca -0.00 0.24 0.01 0.00 -1.93 0.00 0.00 57.85 56.17 1y2w n ARG 103 Cb 0.22 -1.59 0.10 0.00 -1.16 0.00 0.00 32.46 30.03 1y2w n ARG 103 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 1y2w h ASP 104 N -0.23 -0.41 -0.22 0.55 3.32 -0.53 -1.86 116.42 117.05 1y2w h ASP 104 Ca -0.54 0.18 -0.04 0.00 0.02 0.00 0.00 57.03 56.65 1y2w h ASP 104 Cb 1.84 0.33 -0.02 0.00 0.22 0.00 0.00 39.33 41.71 1y2w h ASP 104 CO -0.11 -0.17 0.02 0.06 -1.72 0.00 0.00 179.24 177.33 1y2w h GLN 105 N 0.07 0.48 -0.43 3.56 -0.00 -1.60 -0.91 115.11 116.28 1y2w h GLN 105 Ca 0.34 -0.09 -0.06 0.00 -0.00 0.00 0.00 58.65 58.84 1y2w h GLN 105 Cb 0.55 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.48 27.93 1y2w h GLN 105 CO -0.60 0.50 0.04 0.00 -0.00 0.00 0.00 178.83 178.76 1y2w h ALA 106 N 1.56 0.57 -0.30 0.06 0.00 -1.52 -2.00 119.26 117.63 1y2w h ALA 106 Ca 0.10 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1y2w h ALA 106 Cb 0.28 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1y2w h ALA 106 CO 0.01 0.32 0.19 -0.09 0.00 0.00 0.00 179.25 179.68 1y2w h ARG 107 N 0.58 0.39 0.00 0.00 2.43 -0.96 -2.73 114.38 114.09 1y2w h ARG 107 Ca 0.13 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1y2w h ARG 107 Cb 0.43 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1y2w h ARG 107 CO 0.01 0.27 -0.01 0.93 -1.51 0.00 0.00 179.97 179.66 1y2w h GLU 108 N 0.39 0.00 0.00 0.20 5.08 -1.02 -2.18 114.58 117.05 1y2w h GLU 108 Ca 0.11 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1y2w h GLU 108 Cb -0.03 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 1y2w h GLU 108 CO -0.02 0.01 -0.01 -0.91 -1.00 0.00 0.00 179.01 177.08 1y2w h ASN 109 N 0.00 0.00 -6.52 1.42 -0.26 -1.03 -3.47 115.58 105.72 1y2w h ASN 109 Ca -0.00 0.00 -0.50 0.00 -0.56 0.00 0.00 56.30 55.24 1y2w h ASN 109 Cb 0.17 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 37.38 1y2w h ASN 109 CO 0.00 0.01 -0.90 0.00 -1.06 0.00 0.00 177.43 175.48 1y2w n GLN 110 N -3.12 -2.92 -2.46 0.81 6.02 -0.82 -4.89 117.38 110.00 1y2w n GLN 110 Ca -0.00 0.38 -0.40 0.00 -0.01 0.00 0.00 57.00 56.97 1y2w n GLN 110 Cb 0.25 -4.39 -0.04 0.00 1.02 0.00 0.00 30.24 27.08 1y2w n GLN 110 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1y2w s LEU 111 N -6.96 4.53 0.18 1.08 1.43 -1.25 -4.73 118.68 112.97 1y2w s LEU 111 Ca 0.05 2.25 0.24 0.00 -1.03 0.00 0.00 54.13 55.64 1y2w s LEU 111 Cb -0.02 -3.62 0.29 0.00 0.03 0.00 0.00 46.19 42.87 1y2w s LEU 111 CO 0.89 -0.18 1.31 0.71 0.23 0.00 0.00 176.35 179.31 1y2w h THR 112 N 3.26 0.00 -2.67 5.49 1.35 -1.90 -3.31 112.91 115.13 1y2w h THR 112 Ca -0.46 -0.68 -0.10 0.00 -0.55 0.00 0.00 66.41 64.62 1y2w h THR 112 Cb 1.21 1.32 -0.21 0.00 -1.73 0.00 0.00 68.15 68.74 1y2w h THR 112 CO 0.68 0.00 -0.13 -0.94 -0.25 0.00 0.00 175.52 174.88 1y2w s SER 113 N -4.77 -0.39 -0.11 5.36 1.04 -1.26 -0.41 113.70 113.15 1y2w s SER 113 Ca 0.05 0.48 -0.16 0.00 0.48 0.00 0.00 55.95 56.80 1y2w s SER 113 Cb 0.11 0.55 0.04 0.00 0.10 0.00 0.00 66.02 66.82 1y2w s SER 113 CO 0.72 -0.40 0.42 -0.47 0.98 0.00 0.00 173.24 174.49 1y2w s TYR 114 N -0.85 -0.41 0.01 5.02 5.04 -0.36 -5.00 117.35 120.80 1y2w s TYR 114 Ca -0.09 0.92 -0.03 0.00 -2.44 0.00 0.00 57.07 55.43 1y2w s TYR 114 Cb -0.03 0.16 -0.01 0.00 0.35 0.00 0.00 41.96 42.43 1y2w s TYR 114 CO 0.05 -0.30 0.04 0.54 -1.34 0.00 0.00 175.55 174.54 1y2w s ASN 115 N -0.29 0.12 0.09 4.32 2.20 -1.26 -0.53 114.94 119.59 1y2w s ASN 115 Ca -0.04 -0.31 -0.14 0.00 -0.94 0.00 0.00 52.86 51.43 1y2w s ASN 115 Cb -0.03 0.14 0.02 0.00 -2.00 0.00 0.00 41.25 39.38 1y2w s ASN 115 CO 0.02 -0.28 0.32 0.54 -2.94 0.00 0.00 177.10 174.76 1y2w s VAL 116 N -1.21 0.09 0.11 3.54 0.11 -0.41 -4.99 120.40 117.64 1y2w s VAL 116 Ca -0.13 -0.76 0.10 0.00 -2.93 0.00 0.00 61.98 58.26 1y2w s VAL 116 Cb -0.08 -1.14 -0.04 0.00 -1.53 0.00 0.00 36.38 33.60 1y2w s VAL 116 CO 0.00 -0.42 -0.26 0.00 -3.33 0.00 0.00 175.10 171.09 1y2w s ALA 117 N -3.38 2.25 0.85 1.54 0.00 -1.26 -0.03 121.76 121.73 1y2w s ALA 117 Ca 0.01 -1.38 -0.07 0.00 0.00 0.00 0.00 51.96 50.52 1y2w s ALA 117 Cb 0.02 -0.38 0.18 0.00 0.00 0.00 0.00 23.12 22.93 1y2w s ALA 117 CO -0.09 0.51 1.16 0.54 0.00 0.00 0.00 175.76 177.88 1y2w s ASN 118 N -1.83 3.65 0.61 0.00 2.20 -0.47 -4.92 114.94 114.16 1y2w s ASN 118 Ca 0.12 -0.23 0.35 0.00 -0.94 0.00 0.00 52.86 52.17 1y2w s ASN 118 Cb -0.10 0.08 1.96 0.00 -2.00 0.00 0.00 41.25 41.19 1y2w s ASN 118 CO 0.05 -2.35 2.25 0.00 -2.94 0.00 0.00 177.10 174.11 1y2w h ALA 119 N -1.07 1.27 -0.00 3.54 0.00 -1.97 -0.96 119.26 120.06 1y2w h ALA 119 Ca -0.38 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1y2w h ALA 119 Cb 1.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1y2w h ALA 119 CO 0.35 0.03 -0.20 1.63 0.00 0.00 0.00 179.25 181.06 1y2w n LYS 120 N -3.50 0.42 -0.32 0.00 5.02 -1.26 -4.94 118.16 113.59 1y2w n LYS 120 Ca -0.03 -0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.09 1y2w n LYS 120 Cb 0.12 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 1y2w n LYS 120 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1y2w n GLY 121 N 1.38 0.75 3.70 0.72 0.00 -0.37 -5.06 105.19 106.32 1y2w n GLY 121 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1y2w n GLY 121 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1y2w s ARG 122 N -0.68 4.49 0.12 1.61 3.52 -1.26 -4.80 118.95 121.94 1y2w s ARG 122 Ca 0.00 1.49 -0.13 0.00 -0.13 0.00 0.00 55.73 56.96 1y2w s ARG 122 Cb 0.00 -3.47 -0.06 0.00 -1.56 0.00 0.00 34.95 29.85 1y2w s ARG 122 CO 0.00 -0.18 0.50 1.03 -0.81 0.00 0.00 175.30 175.84 1y2w s ARG 123 N 1.36 3.91 -0.02 5.12 0.52 -1.26 -1.37 118.95 127.21 1y2w s ARG 123 Ca 0.52 0.39 0.04 0.00 -0.52 0.00 0.00 55.73 56.16 1y2w s ARG 123 Cb -0.22 -2.97 -0.01 0.00 0.52 0.00 0.00 34.95 32.27 1y2w s ARG 123 CO 0.25 0.52 -0.14 -0.06 0.02 0.00 0.00 175.30 175.89 1y2w s PHE 124 N -1.42 1.27 0.01 -0.53 0.40 0.96 -0.29 117.98 118.38 1y2w s PHE 124 Ca 0.36 -0.27 0.01 0.00 -0.60 0.00 0.00 56.93 56.43 1y2w s PHE 124 Cb -0.15 -0.83 -0.01 0.00 0.51 0.00 0.00 43.02 42.54 1y2w s PHE 124 CO 0.19 -0.05 -0.05 0.00 0.70 0.00 0.00 175.22 176.01 1y2w s ALA 125 N -0.21 0.34 -0.12 5.36 0.00 0.00 -1.29 121.76 125.84 1y2w s ALA 125 Ca 0.03 -0.41 0.01 0.00 0.00 0.00 0.00 51.96 51.59 1y2w s ALA 125 Cb -0.07 0.00 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 1y2w s ALA 125 CO -0.00 0.00 -0.17 0.42 0.00 0.00 0.00 175.76 176.01 1y2w s ILE 126 N -0.71 2.65 -0.13 0.00 1.01 0.31 -0.28 121.20 124.05 1y2w s ILE 126 Ca -0.05 -0.80 -0.01 0.00 0.00 0.00 0.00 60.65 59.79 1y2w s ILE 126 Cb -0.05 -2.08 0.03 0.00 0.01 0.00 0.00 42.46 40.37 1y2w s ILE 126 CO -0.00 0.54 -0.05 -1.83 0.00 0.00 0.00 174.94 173.60 1y2w s GLU 127 N 0.36 1.28 -0.01 2.79 -1.05 -0.53 -1.22 118.70 120.32 1y2w s GLU 127 Ca -0.14 -0.32 -0.30 0.00 -0.15 0.00 0.00 54.97 54.06 1y2w s GLU 127 Cb -0.17 -1.70 -0.05 0.00 -0.44 0.00 0.00 34.13 31.78 1y2w s GLU 127 CO 0.07 -0.37 1.27 0.71 0.95 0.00 0.00 175.26 177.89 1y2w s TYR 128 N 1.73 3.12 -0.13 4.83 1.51 0.45 -0.56 117.35 128.31 1y2w s TYR 128 Ca 0.03 1.09 0.19 0.00 -1.01 0.00 0.00 57.07 57.37 1y2w s TYR 128 Cb -0.14 -3.51 -0.23 0.00 -0.11 0.00 0.00 41.96 37.97 1y2w s TYR 128 CO -0.08 -1.71 0.48 0.25 -1.11 0.00 0.00 175.55 173.38 1y2w n THR 129 N 4.49 0.92 -4.06 -0.71 -2.24 0.80 -4.74 114.28 108.75 1y2w n THR 129 Ca 0.11 -0.69 -0.32 0.00 -2.27 0.00 0.00 64.05 60.88 1y2w n THR 129 Cb 0.45 -0.44 -0.16 0.00 -2.10 0.00 0.00 70.33 68.09 1y2w n THR 129 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1y2w s VAL 130 N -2.95 1.86 -1.45 2.28 1.01 -1.04 -4.95 120.40 115.17 1y2w s VAL 130 Ca -0.07 -0.97 0.12 0.00 0.00 0.00 0.00 61.98 61.06 1y2w s VAL 130 Cb 0.09 -1.79 0.11 0.00 0.00 0.00 0.00 36.38 34.79 1y2w s VAL 130 CO 0.84 0.36 0.89 0.35 0.00 0.00 0.00 175.10 177.55 1y2w n THR 131 N 4.65 0.05 -4.16 3.92 -2.24 -1.26 -2.84 114.28 112.39 1y2w n THR 131 Ca -0.18 -0.53 -0.11 0.00 -2.27 0.00 0.00 64.05 60.97 1y2w n THR 131 Cb 0.48 1.21 -0.10 0.00 -2.10 0.00 0.00 70.33 69.82 1y2w n THR 131 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1y2w s GLU 132 N -0.98 0.81 0.54 -0.78 2.02 -1.26 -4.73 118.70 114.32 1y2w s GLU 132 Ca 0.14 -1.27 0.00 0.00 0.02 0.00 0.00 54.97 53.86 1y2w s GLU 132 Cb 0.10 -0.25 0.00 0.00 0.10 0.00 0.00 34.13 34.08 1y2w s GLU 132 CO 0.15 -0.00 0.00 0.41 0.02 0.00 0.00 175.26 175.84 1y2w n GLY 133 N 0.13 -2.05 0.11 -1.39 0.00 -1.26 -4.57 105.19 96.16 1y2w n GLY 133 Ca -0.13 -1.69 -0.10 0.00 0.00 0.00 0.00 46.02 44.10 1y2w n GLY 133 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1y2w h ASP 134 N 0.00 0.24 -3.97 1.61 3.32 -1.94 -3.42 116.42 112.27 1y2w h ASP 134 Ca 0.00 -0.21 -0.70 0.00 0.02 0.00 0.00 57.03 56.14 1y2w h ASP 134 Cb 0.00 -0.07 -0.35 0.00 0.22 0.00 0.00 39.33 39.13 1y2w h ASP 134 CO 0.00 1.07 -0.41 0.20 -1.72 0.00 0.00 179.24 178.38 1y2w s ASN 135 N -6.93 5.25 0.36 6.45 0.01 -1.26 -1.14 114.94 117.68 1y2w s ASN 135 Ca -0.02 -2.64 -0.09 0.00 -0.71 0.00 0.00 52.86 49.40 1y2w s ASN 135 Cb 0.10 -1.85 -0.06 0.00 0.41 0.00 0.00 41.25 39.84 1y2w s ASN 135 CO 0.84 -0.42 0.69 -0.76 -1.51 0.00 0.00 177.10 175.94 1y2w s LEU 136 N 0.25 3.92 -0.00 0.60 1.43 0.74 -4.94 118.68 120.68 1y2w s LEU 136 Ca 0.15 0.99 0.02 0.00 -1.03 0.00 0.00 54.13 54.26 1y2w s LEU 136 Cb -0.21 -3.85 -0.01 0.00 0.03 0.00 0.00 46.19 42.16 1y2w s LEU 136 CO -0.04 -0.32 -0.07 -0.54 0.23 0.00 0.00 176.35 175.61 1y2w s LYS 137 N -3.70 0.59 -0.00 1.70 1.02 -1.13 -1.10 119.74 117.12 1y2w s LYS 137 Ca 0.49 -0.30 -0.06 0.00 0.02 0.00 0.00 55.97 56.11 1y2w s LYS 137 Cb -0.10 -0.56 0.00 0.00 -0.52 0.00 0.00 37.83 36.64 1y2w s LYS 137 CO 0.30 0.15 0.12 0.00 -0.92 0.00 0.00 175.35 175.00 1y2w s ALA 138 N -0.26 -0.27 -0.14 5.17 0.00 -0.19 -0.14 121.76 125.91 1y2w s ALA 138 Ca 0.02 -0.12 -0.12 0.00 0.00 0.00 0.00 51.96 51.74 1y2w s ALA 138 Cb -0.03 0.07 -0.05 0.00 0.00 0.00 0.00 23.12 23.11 1y2w s ALA 138 CO -0.00 -0.18 0.25 -0.80 0.00 0.00 0.00 175.76 175.02 1y2w s ASN 139 N -1.21 6.42 -0.32 0.00 0.02 0.28 -1.42 114.94 118.71 1y2w s ASN 139 Ca -0.13 0.49 -0.09 0.00 -1.02 0.00 0.00 52.86 52.12 1y2w s ASN 139 Cb -0.07 -2.15 0.01 0.00 0.02 0.00 0.00 41.25 39.05 1y2w s ASN 139 CO 0.01 0.19 0.13 -0.22 0.02 0.00 0.00 177.10 177.23 1y2w s LEU 140 N 0.03 4.11 -0.23 0.60 2.96 0.64 -1.45 118.68 125.34 1y2w s LEU 140 Ca 0.15 -0.71 -0.04 0.00 -0.22 0.00 0.00 54.13 53.31 1y2w s LEU 140 Cb -0.13 -1.95 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 1y2w s LEU 140 CO 0.04 -0.23 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.18 1y2w s ILE 141 N 1.55 3.52 -0.30 6.68 1.01 0.61 -0.34 121.20 133.92 1y2w s ILE 141 Ca 0.03 -0.48 -0.13 0.00 0.00 0.00 0.00 60.65 60.08 1y2w s ILE 141 Cb -0.18 -2.63 -0.03 0.00 0.01 0.00 0.00 42.46 39.64 1y2w s ILE 141 CO 0.05 0.39 0.26 -0.63 0.00 0.00 0.00 174.94 175.00 1y2w s ILE 142 N 1.49 5.26 -2.05 2.92 1.01 0.49 -0.82 121.20 129.50 1y2w s ILE 142 Ca 0.06 0.12 0.32 0.00 0.00 0.00 0.00 60.65 61.14 1y2w s ILE 142 Cb -0.15 -3.65 0.87 0.00 0.01 0.00 0.00 42.46 39.54 1y2w s ILE 142 CO -0.02 0.11 2.18 0.61 0.00 0.00 0.00 174.94 177.82