#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i82 s ASN 5 N 0.00 5.23 -0.53 4.31 0.01 -1.26 -5.05 114.94 117.65 2i82 s ASN 5 Ca 0.00 -1.99 -0.26 0.00 -0.71 0.00 0.00 52.86 49.89 2i82 s ASN 5 Cb 0.00 -1.82 -0.04 0.00 0.41 0.00 0.00 41.25 39.80 2i82 s ASN 5 CO 0.00 -0.52 2.11 -0.47 -1.51 0.00 0.00 177.10 176.70 2i82 s TYR 6 N 1.14 1.40 -0.52 2.20 5.04 -1.26 -4.89 117.35 120.46 2i82 s TYR 6 Ca 0.08 1.11 0.04 0.00 -2.44 0.00 0.00 57.07 55.86 2i82 s TYR 6 Cb -0.22 -3.86 0.16 0.00 0.35 0.00 0.00 41.96 38.38 2i82 s TYR 6 CO -0.04 -2.49 0.37 -0.80 -1.34 0.00 0.00 175.55 171.24 2i82 s ASN 7 N 9.79 3.12 0.43 4.32 0.01 -1.26 -5.05 114.94 126.30 2i82 s ASN 7 Ca 0.82 -3.23 -0.24 0.00 -0.71 0.00 0.00 52.86 49.50 2i82 s ASN 7 Cb -0.16 -0.98 -0.08 0.00 0.41 0.00 0.00 41.25 40.44 2i82 s ASN 7 CO 0.24 -0.16 1.15 -2.84 -1.51 0.00 0.00 177.10 173.98 2i82 s PRO 8 N -0.38 3.92 0.51 -0.60 0.02 -1.26 -4.96 135.00 132.25 2i82 s PRO 8 Ca 0.26 1.77 -0.21 0.00 0.02 0.00 0.00 61.00 62.84 2i82 s PRO 8 Cb -0.06 -2.53 -0.08 0.00 0.02 0.00 0.00 34.50 31.86 2i82 s PRO 8 CO -0.14 -0.41 0.98 -0.35 -0.33 0.00 0.00 177.00 176.75 2i82 n PRO 9 N -0.22 1.16 -0.00 5.54 -0.04 -1.26 -4.92 135.00 135.25 2i82 n PRO 9 Ca 0.06 0.43 0.06 0.00 -0.04 0.00 0.00 63.50 64.00 2i82 n PRO 9 Cb 0.48 -2.11 -0.07 0.00 -0.04 0.00 0.00 33.50 31.75 2i82 n PRO 9 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2i82 n GLN 10 N -0.38 2.18 -3.87 0.54 1.13 -1.26 -4.87 117.38 110.85 2i82 n GLN 10 Ca 0.11 -0.04 -0.28 0.00 -1.94 0.00 0.00 57.00 54.85 2i82 n GLN 10 Cb 0.43 -1.12 -0.16 0.00 0.11 0.00 0.00 30.24 29.50 2i82 n GLN 10 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2i82 s GLU 11 N -2.34 1.34 0.79 -1.09 2.02 -1.26 -2.18 118.70 115.98 2i82 s GLU 11 Ca 0.01 -0.58 -0.11 0.00 0.02 0.00 0.00 54.97 54.30 2i82 s GLU 11 Cb 0.08 -2.12 0.07 0.00 0.10 0.00 0.00 34.13 32.26 2i82 s GLU 11 CO 0.47 -0.49 1.10 -2.14 0.02 0.00 0.00 175.26 174.22 2i82 s PRO 12 N 1.63 2.11 -0.02 0.39 0.02 -1.26 -5.09 135.00 132.78 2i82 s PRO 12 Ca -0.01 0.62 -0.23 0.00 0.02 0.00 0.00 61.00 61.40 2i82 s PRO 12 Cb -0.16 -1.92 -0.21 0.00 0.02 0.00 0.00 34.50 32.22 2i82 s PRO 12 CO -0.07 -1.60 1.13 2.35 -0.33 0.00 0.00 177.00 178.47 2i82 h TRP 13 N -1.07 0.36 -3.05 6.54 7.01 -1.77 -3.45 115.95 120.51 2i82 h TRP 13 Ca -0.47 -0.17 -0.19 0.00 2.11 0.00 0.00 58.89 60.18 2i82 h TRP 13 Cb 1.27 -0.05 -0.29 0.00 -2.10 0.00 0.00 29.16 27.99 2i82 h TRP 13 CO 0.46 0.92 -0.47 -0.51 -2.79 0.00 0.00 178.44 176.05 2i82 s LEU 14 N -8.65 0.57 -0.44 0.65 1.43 -1.26 -4.98 118.68 105.99 2i82 s LEU 14 Ca -0.15 0.52 -0.09 0.00 -1.03 0.00 0.00 54.13 53.38 2i82 s LEU 14 Cb 0.02 0.76 0.10 0.00 0.03 0.00 0.00 46.19 47.10 2i82 s LEU 14 CO 0.76 -0.15 0.30 -0.69 0.23 0.00 0.00 176.35 176.80 2i82 s VAL 15 N 1.00 4.21 -0.14 -1.59 1.01 -1.26 -5.07 120.40 118.55 2i82 s VAL 15 Ca -0.07 -1.59 -0.23 0.00 0.00 0.00 0.00 61.98 60.10 2i82 s VAL 15 Cb -0.08 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 2i82 s VAL 15 CO -0.07 -0.63 0.69 -0.63 0.00 0.00 0.00 175.10 174.47 2i82 s ILE 16 N 1.39 5.00 -0.13 2.22 1.01 -1.26 -1.16 121.20 128.27 2i82 s ILE 16 Ca 0.04 1.37 0.18 0.00 0.00 0.00 0.00 60.65 62.24 2i82 s ILE 16 Cb -0.24 -4.02 -0.19 0.00 0.01 0.00 0.00 42.46 38.02 2i82 s ILE 16 CO 0.01 0.15 0.61 0.18 0.00 0.00 0.00 174.94 175.88 2i82 n LEU 17 N 4.62 0.52 -3.60 2.97 4.77 0.14 -4.95 117.00 121.47 2i82 n LEU 17 Ca -0.00 0.22 -0.09 0.00 -0.03 0.00 0.00 56.01 56.11 2i82 n LEU 17 Cb 0.50 0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.68 2i82 n LEU 17 CO 0.46 0.18 0.82 -0.47 -1.33 0.00 0.00 177.39 177.04 2i82 s TYR 18 N -2.97 -0.35 -0.09 -1.77 5.04 -1.16 -4.96 117.35 111.08 2i82 s TYR 18 Ca -0.05 0.70 -0.30 0.00 -2.44 0.00 0.00 57.07 54.97 2i82 s TYR 18 Cb 0.09 0.43 0.07 0.00 0.35 0.00 0.00 41.96 42.91 2i82 s TYR 18 CO 0.83 -0.27 0.70 1.14 -1.34 0.00 0.00 175.55 176.61 2i82 s GLN 19 N -0.70 1.01 0.00 4.97 1.03 -1.26 0.02 119.66 124.72 2i82 s GLN 19 Ca 0.01 0.38 0.00 0.00 0.04 0.00 0.00 55.36 55.79 2i82 s GLN 19 Cb -0.02 0.48 0.00 0.00 0.03 0.00 0.00 33.01 33.50 2i82 s GLN 19 CO -0.02 -0.29 0.00 -0.40 -2.54 0.00 0.00 175.29 172.04 2i82 n ASP 20 N 1.21 0.00 0.00 12.60 5.68 -0.82 -5.01 116.55 130.20 2i82 n ASP 20 Ca -0.18 -0.20 0.11 0.00 -0.50 0.00 0.00 54.79 54.03 2i82 n ASP 20 Cb 0.57 0.00 0.54 0.00 -1.14 0.00 0.00 41.12 41.09 2i82 n ASP 20 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2i82 n ASP 21 N -0.36 0.00 -0.03 -1.12 8.00 -1.26 -3.98 116.55 117.81 2i82 n ASP 21 Ca 0.00 0.26 -0.03 0.00 0.71 0.00 0.00 54.79 55.73 2i82 n ASP 21 Cb 0.00 -0.41 -0.04 0.00 -0.02 0.00 0.00 41.12 40.66 2i82 n ASP 21 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2i82 n HIS 22 N -1.41 0.00 -2.70 1.24 8.25 -1.26 -4.66 115.22 114.68 2i82 n HIS 22 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2i82 n HIS 22 Cb 0.24 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 31.09 2i82 n HIS 22 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 2i82 n ILE 23 N -2.32 0.00 -3.64 1.59 -5.35 -1.26 -1.03 119.36 107.36 2i82 n ILE 23 Ca -0.09 0.00 -0.07 0.00 -0.27 0.00 0.00 62.75 62.32 2i82 n ILE 23 Cb 0.66 0.00 -0.07 0.00 -1.74 0.00 0.00 39.64 38.49 2i82 n ILE 23 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2i82 s VAL 25 N -0.37 0.00 0.07 7.28 1.01 0.10 -1.95 120.40 126.54 2i82 s VAL 25 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.06 2i82 s VAL 25 Cb 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 2i82 s VAL 25 CO 0.00 0.00 -0.23 -0.69 0.00 0.00 0.00 175.10 174.18 2i82 s VAL 26 N 1.48 1.86 -0.76 2.92 1.01 -0.14 0.27 120.40 127.04 2i82 s VAL 26 Ca -0.09 -1.40 -0.15 0.00 0.00 0.00 0.00 61.98 60.34 2i82 s VAL 26 Cb -0.05 -1.64 0.20 0.00 0.00 0.00 0.00 36.38 34.89 2i82 s VAL 26 CO -0.18 0.16 0.72 0.21 0.00 0.00 0.00 175.10 176.01 2i82 s ASN 27 N -1.49 6.63 0.11 3.32 3.84 -0.31 -1.66 114.94 125.38 2i82 s ASN 27 Ca 0.09 -2.46 -0.30 0.00 0.21 0.00 0.00 52.86 50.40 2i82 s ASN 27 Cb -0.09 -2.22 -0.07 0.00 -0.55 0.00 0.00 41.25 38.32 2i82 s ASN 27 CO 0.03 -0.65 1.24 -0.75 -2.79 0.00 0.00 177.10 174.17 2i82 s LYS 28 N 0.57 4.43 0.52 0.43 2.20 0.10 -4.51 119.74 123.48 2i82 s LYS 28 Ca 0.15 1.87 -0.11 0.00 -0.36 0.00 0.00 55.97 57.51 2i82 s LYS 28 Cb -0.15 -3.29 -0.06 0.00 -1.51 0.00 0.00 37.83 32.83 2i82 s LYS 28 CO -0.06 -0.24 0.91 -1.25 -0.36 0.00 0.00 175.35 174.36 2i82 s PRO 29 N 0.63 3.73 0.32 4.03 0.04 -1.26 -0.37 135.00 142.12 2i82 s PRO 29 Ca 0.58 0.65 -0.29 0.00 0.04 0.00 0.00 61.00 61.98 2i82 s PRO 29 Cb -0.32 -2.22 -0.10 0.00 0.04 0.00 0.00 34.50 31.90 2i82 s PRO 29 CO 0.32 -0.30 1.33 0.45 0.04 0.00 0.00 177.00 178.84 2i82 s SER 30 N -3.62 6.74 0.00 6.66 0.15 -1.26 -3.09 113.70 119.29 2i82 s SER 30 Ca 0.54 2.70 0.00 0.00 0.70 0.00 0.00 55.95 59.89 2i82 s SER 30 Cb -0.10 -2.65 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 2i82 s SER 30 CO 0.41 -0.57 0.00 0.61 1.20 0.00 0.00 173.24 174.89 2i82 n GLY 31 N 0.94 2.30 3.67 9.45 0.00 -1.26 -4.85 105.19 115.44 2i82 n GLY 31 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 2i82 n GLY 31 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2i82 s LEU 32 N 0.00 3.88 0.44 0.99 2.96 -1.18 -4.51 118.68 121.26 2i82 s LEU 32 Ca 0.00 0.14 -0.23 0.00 -0.22 0.00 0.00 54.13 53.82 2i82 s LEU 32 Cb 0.00 -1.97 -0.08 0.00 0.50 0.00 0.00 46.19 44.64 2i82 s LEU 32 CO 0.00 0.22 1.15 -0.76 -1.32 0.00 0.00 176.35 175.64 2i82 s LEU 33 N 0.09 4.06 0.04 -0.68 1.43 -1.26 -4.78 118.68 117.57 2i82 s LEU 33 Ca 0.06 2.28 -0.17 0.00 -1.03 0.00 0.00 54.13 55.26 2i82 s LEU 33 Cb -0.12 -4.20 -0.20 0.00 0.03 0.00 0.00 46.19 41.70 2i82 s LEU 33 CO 0.01 -0.82 1.19 0.28 0.23 0.00 0.00 176.35 177.23 2i82 h SER 34 N 2.20 0.67 -2.91 2.29 0.02 -1.88 -0.27 113.55 113.68 2i82 h SER 34 Ca -0.49 -0.69 -0.50 0.00 -0.84 0.00 0.00 61.79 59.27 2i82 h SER 34 Cb 1.24 -0.20 -0.14 0.00 0.14 0.00 0.00 62.40 63.44 2i82 h SER 34 CO 0.61 1.26 -0.73 0.68 -1.14 0.00 0.00 176.83 177.51 2i82 s VAL 35 N -3.49 1.90 0.27 2.27 -7.23 -1.26 -3.03 120.40 109.83 2i82 s VAL 35 Ca -0.12 -2.24 -0.30 0.00 -1.81 0.00 0.00 61.98 57.51 2i82 s VAL 35 Cb 0.05 -2.18 -0.10 0.00 0.56 0.00 0.00 36.38 34.72 2i82 s VAL 35 CO 0.85 -0.50 1.39 -2.16 -0.31 0.00 0.00 175.10 174.37 2i82 s PRO 36 N -3.63 4.30 0.34 4.82 0.04 -1.26 -4.84 135.00 134.77 2i82 s PRO 36 Ca 0.25 2.26 -0.06 0.00 0.04 0.00 0.00 61.00 63.50 2i82 s PRO 36 Cb -0.01 -3.10 0.08 0.00 0.04 0.00 0.00 34.50 31.51 2i82 s PRO 36 CO 0.10 -0.35 0.42 0.41 0.04 0.00 0.00 177.00 177.62 2i82 n GLY 37 N 1.80 -1.52 0.09 0.56 0.00 0.34 -4.97 105.19 101.50 2i82 n GLY 37 Ca 0.05 -1.64 -0.11 0.00 0.00 0.00 0.00 46.02 44.32 2i82 n GLY 37 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2i82 h ARG 38 N 0.00 -0.09 -7.05 1.61 2.43 -1.96 -3.43 114.38 105.89 2i82 h ARG 38 Ca -0.14 0.01 -0.50 0.00 -0.81 0.00 0.00 59.98 58.53 2i82 h ARG 38 Cb 0.40 0.02 0.07 0.00 -0.42 0.00 0.00 29.97 30.03 2i82 h ARG 38 CO 0.10 0.49 0.45 -0.51 -1.51 0.00 0.00 179.97 178.99 2i82 s LEU 39 N -8.69 3.86 0.41 3.80 1.43 -1.26 -4.91 118.68 113.31 2i82 s LEU 39 Ca -0.13 2.23 0.13 0.00 -1.03 0.00 0.00 54.13 55.32 2i82 s LEU 39 Cb -0.01 -4.44 0.97 0.00 0.03 0.00 0.00 46.19 42.74 2i82 s LEU 39 CO 0.51 -1.10 1.95 -0.08 0.23 0.00 0.00 176.35 177.86 2i82 h GLU 40 N 1.54 0.48 0.00 1.70 4.57 -2.03 0.37 114.58 121.22 2i82 h GLU 40 Ca -0.50 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.65 2i82 h GLU 40 Cb 1.26 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.74 2i82 h GLU 40 CO 0.58 0.32 0.00 0.39 -1.18 0.00 0.00 179.01 179.12 2i82 n GLU 41 N -4.48 0.01 -1.26 1.92 4.71 -1.26 -2.85 120.64 117.42 2i82 n GLU 41 Ca 0.12 0.24 -0.13 0.00 -0.01 0.00 0.00 57.16 57.37 2i82 n GLU 41 Cb 0.40 -1.52 0.12 0.00 -1.01 0.00 0.00 31.44 29.44 2i82 n GLU 41 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 2i82 n HIS 42 N -1.53 1.74 -0.04 -0.32 8.25 0.13 -4.69 115.22 118.77 2i82 n HIS 42 Ca 0.04 -1.98 -0.15 0.00 -0.26 0.00 0.00 57.72 55.37 2i82 n HIS 42 Cb 0.19 -0.51 -0.14 0.00 1.12 0.00 0.00 29.99 30.64 2i82 n HIS 42 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2i82 n LYS 43 N -0.96 0.69 -1.68 -0.41 4.76 -1.13 0.13 118.16 119.55 2i82 n LYS 43 Ca 0.38 0.23 -0.45 0.00 -2.87 0.00 0.00 58.31 55.60 2i82 n LYS 43 Cb 0.92 -1.69 -0.04 0.00 -1.84 0.00 0.00 35.03 32.38 2i82 n LYS 43 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2i82 n ASP 44 N -3.20 3.56 -2.43 4.39 2.03 -1.26 -4.38 116.55 115.26 2i82 n ASP 44 Ca -0.28 1.03 -0.05 0.00 0.52 0.00 0.00 54.79 56.01 2i82 n ASP 44 Cb 1.06 -1.47 0.02 0.00 -0.72 0.00 0.00 41.12 40.01 2i82 n ASP 44 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2i82 n SER 45 N 4.87 -1.49 -0.48 1.67 3.41 -1.26 -4.39 113.62 115.94 2i82 n SER 45 Ca 0.18 -1.95 0.00 0.00 -0.26 0.00 0.00 58.87 56.85 2i82 n SER 45 Cb 0.32 2.47 0.00 0.00 -0.26 0.00 0.00 64.21 66.74 2i82 n SER 45 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2i82 n VAL 46 N -0.44 0.00 0.00 -3.33 0.31 -0.11 -1.91 118.33 112.85 2i82 n VAL 46 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 2i82 n VAL 46 Cb 0.42 -0.04 0.00 0.00 -0.91 0.00 0.00 33.84 33.31 2i82 n VAL 46 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2i82 n THR 48 N 0.44 0.00 -0.12 2.52 -2.24 -1.26 -1.51 114.28 112.11 2i82 n THR 48 Ca 0.00 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 2i82 n THR 48 Cb 0.01 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.23 2i82 n THR 48 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2i82 h ARG 49 N 0.00 0.93 -0.14 -0.78 3.08 -1.74 -2.95 114.38 112.78 2i82 h ARG 49 Ca 0.00 -0.47 -0.06 0.00 0.07 0.00 0.00 59.98 59.51 2i82 h ARG 49 Cb 0.00 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.06 2i82 h ARG 49 CO 0.00 1.13 -0.17 0.82 -1.07 0.00 0.00 179.97 180.69 2i82 h ILE 50 N 0.77 1.35 0.00 2.04 2.04 -1.53 -3.04 117.51 119.15 2i82 h ILE 50 Ca 0.07 -1.35 0.00 0.00 1.00 0.00 0.00 64.86 64.58 2i82 h ILE 50 Cb 0.95 1.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.94 2i82 h ILE 50 CO 0.09 0.40 0.00 0.00 0.00 0.00 0.00 178.15 178.64 2i82 n GLN 51 N -4.54 0.14 -0.22 2.37 6.02 -1.22 -0.36 117.38 119.58 2i82 n GLN 51 Ca -0.06 0.61 -0.06 0.00 -0.01 0.00 0.00 57.00 57.48 2i82 n GLN 51 Cb 0.38 -1.93 0.04 0.00 1.02 0.00 0.00 30.24 29.74 2i82 n GLN 51 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 2i82 h ARG 52 N 0.00 0.83 0.00 -1.09 1.12 -1.39 -2.51 114.38 111.34 2i82 h ARG 52 Ca 0.00 -0.07 -0.03 0.00 -1.11 0.00 0.00 59.98 58.78 2i82 h ARG 52 Cb 0.04 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 29.81 2i82 h ARG 52 CO 0.00 0.58 -1.94 -0.25 -3.11 0.00 0.00 179.97 175.25 2i82 n ASP 53 N -4.62 0.44 -3.54 -3.80 8.00 -0.50 -4.71 116.55 107.82 2i82 n ASP 53 Ca 0.05 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.28 2i82 n ASP 53 Cb 0.04 1.84 -0.10 0.00 -0.02 0.00 0.00 41.12 42.88 2i82 n ASP 53 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2i82 n TYR 54 N -2.23 1.14 0.03 1.24 4.02 0.51 -4.97 117.16 116.90 2i82 n TYR 54 Ca -0.06 -3.79 0.21 0.00 -0.01 0.00 0.00 57.90 54.25 2i82 n TYR 54 Cb 0.57 -0.22 0.72 0.00 -0.02 0.00 0.00 39.34 40.38 2i82 n TYR 54 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2i82 h PRO 55 N 5.15 0.00 0.00 -0.72 0.13 -1.69 -0.41 132.00 134.45 2i82 h PRO 55 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2i82 h PRO 55 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 2i82 h PRO 55 CO 0.56 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.37 2i82 n GLN 56 N -4.14 0.13 -1.73 0.86 1.13 -1.26 -4.90 117.38 107.47 2i82 n GLN 56 Ca 0.09 0.02 -0.37 0.00 -1.94 0.00 0.00 57.00 54.80 2i82 n GLN 56 Cb 0.61 -1.50 0.07 0.00 0.11 0.00 0.00 30.24 29.52 2i82 n GLN 56 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2i82 s ALA 57 N -2.86 2.39 -0.05 -1.58 0.00 -0.16 -4.55 121.76 114.95 2i82 s ALA 57 Ca 0.18 1.23 -0.10 0.00 0.00 0.00 0.00 51.96 53.27 2i82 s ALA 57 Cb 0.19 -3.56 0.02 0.00 0.00 0.00 0.00 23.12 19.76 2i82 s ALA 57 CO 0.49 -1.61 0.23 -1.21 0.00 0.00 0.00 175.76 173.66 2i82 s GLU 58 N -3.36 0.45 0.49 0.00 0.41 -0.35 -4.95 118.70 111.39 2i82 s GLU 58 Ca 0.83 -0.01 -0.19 0.00 -0.41 0.00 0.00 54.97 55.19 2i82 s GLU 58 Cb -0.38 0.20 -0.08 0.00 -1.78 0.00 0.00 34.13 32.09 2i82 s GLU 58 CO 0.40 -0.10 1.00 -1.54 -0.49 0.00 0.00 175.26 174.53 2i82 s SER 59 N -0.68 6.54 0.00 -0.19 1.04 -1.26 -1.15 113.70 118.00 2i82 s SER 59 Ca -0.08 1.73 0.00 0.00 0.48 0.00 0.00 55.95 58.08 2i82 s SER 59 Cb -0.04 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.54 2i82 s SER 59 CO 0.02 -0.64 0.00 1.33 0.98 0.00 0.00 173.24 174.93 2i82 n VAL 60 N -1.20 0.00 -3.75 5.02 0.24 -1.26 -4.83 118.33 112.55 2i82 n VAL 60 Ca 0.08 0.00 -0.10 0.00 -2.04 0.00 0.00 64.34 62.28 2i82 n VAL 60 Cb 0.53 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.86 2i82 n VAL 60 CO 0.00 0.00 0.00 -1.38 -2.14 0.00 0.00 176.83 173.31 2i82 s HIS 61 N -1.86 -0.03 0.07 6.34 -3.43 -1.26 -4.76 115.29 110.36 2i82 s HIS 61 Ca 0.00 -0.32 0.05 0.00 -0.80 0.00 0.00 55.06 54.00 2i82 s HIS 61 Cb 0.00 0.21 -0.03 0.00 -1.43 0.00 0.00 32.58 31.33 2i82 s HIS 61 CO 0.00 -0.75 -0.15 1.03 -2.00 0.00 0.00 174.74 172.87 2i82 s ARG 62 N -3.86 0.89 0.06 -0.38 0.52 -1.26 -4.86 118.95 110.05 2i82 s ARG 62 Ca 0.08 -0.93 0.05 0.00 -0.52 0.00 0.00 55.73 54.40 2i82 s ARG 62 Cb 0.02 -0.93 -0.04 0.00 0.52 0.00 0.00 34.95 34.52 2i82 s ARG 62 CO -0.07 0.21 -0.05 -0.51 0.02 0.00 0.00 175.30 174.90 2i82 s LEU 63 N -1.61 3.24 0.00 2.53 1.02 -1.26 -5.10 118.68 117.49 2i82 s LEU 63 Ca -0.00 -0.22 0.00 0.00 0.02 0.00 0.00 54.13 53.93 2i82 s LEU 63 Cb -0.09 -1.95 0.00 0.00 0.02 0.00 0.00 46.19 44.17 2i82 s LEU 63 CO 0.02 0.22 0.00 0.47 0.02 0.00 0.00 176.35 177.08 2i82 n ASP 64 N 1.01 0.00 0.00 2.29 8.00 -1.26 -4.14 116.55 122.44 2i82 n ASP 64 Ca -0.13 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.37 2i82 n ASP 64 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 2i82 n ASP 64 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2i82 n ALA 66 N -3.00 0.00 -1.85 2.24 0.00 -1.26 -4.70 120.51 111.93 2i82 n ALA 66 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 2i82 n ALA 66 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 2i82 n ALA 66 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2i82 s THR 67 N 0.00 4.34 0.28 0.00 2.01 -1.26 -4.40 115.64 116.61 2i82 s THR 67 Ca 0.00 1.60 0.11 0.00 0.31 0.00 0.00 61.69 63.71 2i82 s THR 67 Cb 0.00 -3.83 -0.05 0.00 0.01 0.00 0.00 72.50 68.63 2i82 s THR 67 CO 0.00 -0.02 -0.15 -0.94 -0.69 0.00 0.00 174.62 172.82 2i82 s SER 68 N -1.85 3.82 0.00 3.53 1.04 -1.15 -4.06 113.70 115.03 2i82 s SER 68 Ca 0.53 -0.95 0.00 0.00 0.48 0.00 0.00 55.95 56.01 2i82 s SER 68 Cb -0.15 -0.43 0.00 0.00 0.10 0.00 0.00 66.02 65.55 2i82 s SER 68 CO 0.20 0.01 0.00 0.61 0.98 0.00 0.00 173.24 175.04 2i82 n GLY 69 N -0.70 0.72 3.71 7.32 0.00 0.50 0.19 105.19 116.94 2i82 n GLY 69 Ca -0.05 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 2i82 n GLY 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2i82 s VAL 70 N -1.39 3.60 -0.04 1.61 1.01 -0.23 0.01 120.40 124.97 2i82 s VAL 70 Ca 0.00 1.10 -0.02 0.00 0.00 0.00 0.00 61.98 63.06 2i82 s VAL 70 Cb 0.00 -3.71 0.03 0.00 0.00 0.00 0.00 36.38 32.71 2i82 s VAL 70 CO 0.00 0.05 0.09 -0.51 0.00 0.00 0.00 175.10 174.74 2i82 s ILE 71 N 1.56 -0.05 -0.11 2.22 2.07 -0.66 -4.92 121.20 121.31 2i82 s ILE 71 Ca 0.63 0.19 -0.05 0.00 -1.41 0.00 0.00 60.65 60.01 2i82 s ILE 71 Cb -0.33 -0.17 -0.04 0.00 0.13 0.00 0.00 42.46 42.05 2i82 s ILE 71 CO 0.29 0.08 0.08 0.54 -1.91 0.00 0.00 174.94 174.02 2i82 s VAL 72 N 1.09 5.03 -0.02 4.00 0.11 -1.26 -0.97 120.40 128.37 2i82 s VAL 72 Ca -0.09 0.03 0.06 0.00 -2.93 0.00 0.00 61.98 59.05 2i82 s VAL 72 Cb -0.12 -3.17 -0.01 0.00 -1.53 0.00 0.00 36.38 31.55 2i82 s VAL 72 CO -0.04 0.60 -0.20 -0.69 -3.33 0.00 0.00 175.10 171.44 2i82 s VAL 73 N -0.88 1.57 0.25 2.04 1.01 -1.26 -4.14 120.40 118.99 2i82 s VAL 73 Ca 0.14 -0.84 -0.22 0.00 0.00 0.00 0.00 61.98 61.06 2i82 s VAL 73 Cb -0.12 -1.31 -0.09 0.00 0.00 0.00 0.00 36.38 34.87 2i82 s VAL 73 CO 0.03 0.44 0.79 0.00 0.00 0.00 0.00 175.10 176.36 2i82 s ALA 74 N -0.39 3.36 -0.53 5.51 0.00 -0.30 -4.47 121.76 124.95 2i82 s ALA 74 Ca 0.06 0.28 0.12 0.00 0.00 0.00 0.00 51.96 52.41 2i82 s ALA 74 Cb -0.08 -2.93 -0.13 0.00 0.00 0.00 0.00 23.12 19.98 2i82 s ALA 74 CO -0.00 0.28 0.49 1.28 0.00 0.00 0.00 175.76 177.81 2i82 n LEU 75 N 0.75 0.53 -4.14 0.00 4.77 -0.20 -1.21 117.00 117.50 2i82 n LEU 75 Ca -0.01 -0.48 -0.12 0.00 -0.03 0.00 0.00 56.01 55.37 2i82 n LEU 75 Cb 0.51 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.49 2i82 n LEU 75 CO 0.44 0.13 -0.40 0.42 -1.33 0.00 0.00 177.39 176.65 2i82 s THR 76 N -2.13 0.72 0.30 -5.08 -4.23 -1.25 -4.25 115.64 99.72 2i82 s THR 76 Ca 0.04 -1.64 -0.01 0.00 -1.18 0.00 0.00 61.69 58.90 2i82 s THR 76 Cb 0.09 -1.32 0.23 0.00 1.34 0.00 0.00 72.50 72.84 2i82 s THR 76 CO 0.48 -0.67 1.94 0.50 -0.54 0.00 0.00 174.62 176.33 2i82 h LYS 77 N 3.52 0.96 -0.37 3.99 1.63 -1.95 -0.37 116.57 123.97 2i82 h LYS 77 Ca -0.36 -0.09 -0.03 0.00 -0.85 0.00 0.00 60.65 59.32 2i82 h LYS 77 Cb 1.18 -0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 32.60 2i82 h LYS 77 CO 0.55 0.69 0.11 0.00 -3.45 0.00 0.00 179.45 177.36 2i82 h ALA 78 N 1.47 0.49 -0.57 5.00 0.00 -1.99 -1.61 119.26 122.05 2i82 h ALA 78 Ca 0.25 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 2i82 h ALA 78 Cb -0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2i82 h ALA 78 CO -0.04 0.14 0.23 0.00 0.00 0.00 0.00 179.25 179.57 2i82 h ALA 79 N 0.96 0.74 -0.57 0.00 0.00 -1.76 -1.33 119.26 117.30 2i82 h ALA 79 Ca 0.12 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.89 2i82 h ALA 79 Cb 0.26 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2i82 h ALA 79 CO -0.00 0.35 0.36 1.49 0.00 0.00 0.00 179.25 181.45 2i82 h GLU 80 N 0.78 0.69 -0.30 0.00 4.81 -0.93 0.10 114.58 119.73 2i82 h GLU 80 Ca 0.19 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.36 2i82 h GLU 80 Cb 0.20 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 2i82 h GLU 80 CO -0.02 0.46 0.11 0.00 -0.73 0.00 0.00 179.01 178.83 2i82 h ARG 81 N 0.71 0.47 -0.41 1.92 3.08 -0.92 -1.45 114.38 117.77 2i82 h ARG 81 Ca 0.22 -0.09 -0.10 0.00 0.07 0.00 0.00 59.98 60.08 2i82 h ARG 81 Cb -0.01 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 2i82 h ARG 81 CO -0.08 0.50 -0.12 1.49 -1.07 0.00 0.00 179.97 180.69 2i82 h GLU 82 N 0.34 0.81 -0.59 0.04 4.57 -0.99 -2.38 114.58 116.38 2i82 h GLU 82 Ca 0.10 -0.32 -0.08 0.00 -1.18 0.00 0.00 59.36 57.89 2i82 h GLU 82 Cb 0.22 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 2i82 h GLU 82 CO -0.01 0.94 0.07 -0.07 -1.18 0.00 0.00 179.01 178.76 2i82 h LEU 83 N 0.62 0.96 -1.15 1.64 3.38 -0.73 -1.88 115.31 118.16 2i82 h LEU 83 Ca 0.10 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 2i82 h LEU 83 Cb 0.65 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2i82 h LEU 83 CO 0.04 1.00 -0.07 0.11 0.09 0.00 0.00 178.44 179.61 2i82 h LYS 84 N 0.90 0.51 -0.43 1.13 1.57 -1.25 -1.98 116.57 117.01 2i82 h LYS 84 Ca 0.18 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 2i82 h LYS 84 Cb 0.46 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 2i82 h LYS 84 CO 0.02 0.59 0.25 -0.09 -0.57 0.00 0.00 179.45 179.64 2i82 h ARG 85 N 0.48 0.58 -0.12 3.15 2.43 -1.00 -0.24 114.38 119.67 2i82 h ARG 85 Ca 0.09 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.24 2i82 h ARG 85 Cb 0.43 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.81 2i82 h ARG 85 CO 0.02 0.45 -0.14 1.96 -1.51 0.00 0.00 179.97 180.75 2i82 h GLN 86 N 0.56 -0.17 -0.55 0.20 4.20 -0.70 0.21 115.11 118.86 2i82 h GLN 86 Ca 0.15 0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.85 2i82 h GLN 86 Cb 0.02 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 2i82 h GLN 86 CO -0.03 -0.12 0.25 0.74 -0.67 0.00 0.00 178.83 179.01 2i82 h PHE 87 N -0.18 0.77 -0.53 2.96 -1.00 -1.14 -0.74 116.94 117.07 2i82 h PHE 87 Ca 0.09 -0.03 -0.07 0.00 2.81 0.00 0.00 57.97 60.77 2i82 h PHE 87 Cb 0.31 -0.24 -0.02 0.00 3.61 0.00 0.00 35.95 39.60 2i82 h PHE 87 CO -0.25 0.58 0.05 -0.09 -1.61 0.00 0.00 178.31 176.98 2i82 h ARG 88 N 0.78 0.87 -0.21 1.51 2.43 -0.08 -2.31 114.38 117.36 2i82 h ARG 88 Ca 0.19 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2i82 h ARG 88 Cb 0.11 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2i82 h ARG 88 CO -0.02 0.84 0.00 0.39 -1.51 0.00 0.00 179.97 179.66 2i82 n GLU 89 N -4.22 1.57 -2.79 0.20 -0.58 0.65 -4.90 120.64 110.56 2i82 n GLU 89 Ca 0.03 -0.87 -0.22 0.00 -0.42 0.00 0.00 57.16 55.68 2i82 n GLU 89 Cb 0.29 -1.26 0.02 0.00 -0.57 0.00 0.00 31.44 29.92 2i82 n GLU 89 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2i82 n ARG 90 N 0.17 -3.70 0.07 3.49 5.12 -0.63 -4.90 116.66 116.27 2i82 n ARG 90 Ca 0.11 0.95 -0.18 0.00 -1.93 0.00 0.00 57.85 56.80 2i82 n ARG 90 Cb 0.23 -5.74 -0.14 0.00 -1.16 0.00 0.00 32.46 25.65 2i82 n ARG 90 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 2i82 h GLU 91 N -0.87 0.28 -7.07 5.56 5.08 -1.43 -3.46 114.58 112.67 2i82 h GLU 91 Ca -0.52 -0.49 -0.50 0.00 -1.00 0.00 0.00 59.36 56.85 2i82 h GLU 91 Cb 1.37 0.18 0.07 0.00 0.50 0.00 0.00 28.75 30.87 2i82 h GLU 91 CO 0.58 1.16 0.44 -1.25 -1.00 0.00 0.00 179.01 178.94 2i82 s PRO 92 N -2.61 3.41 -0.21 2.33 0.04 -1.26 -4.92 135.00 131.78 2i82 s PRO 92 Ca -0.10 1.64 -0.05 0.00 0.04 0.00 0.00 61.00 62.53 2i82 s PRO 92 Cb 0.06 -2.06 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 2i82 s PRO 92 CO 0.85 -0.81 -0.01 0.15 0.04 0.00 0.00 177.00 177.22 2i82 s LYS 93 N -3.20 3.51 -0.08 4.56 1.02 -0.65 -4.97 119.74 119.94 2i82 s LYS 93 Ca 0.71 -0.56 0.01 0.00 0.02 0.00 0.00 55.97 56.15 2i82 s LYS 93 Cb -0.25 -3.07 -0.03 0.00 -0.52 0.00 0.00 37.83 33.97 2i82 s LYS 93 CO 0.28 -0.10 -0.10 0.15 -0.92 0.00 0.00 175.35 174.66 2i82 s LYS 94 N 1.27 2.85 -0.06 1.68 1.02 -1.26 -1.27 119.74 123.97 2i82 s LYS 94 Ca 0.04 -0.62 0.01 0.00 0.02 0.00 0.00 55.97 55.42 2i82 s LYS 94 Cb -0.15 -2.55 0.02 0.00 -0.52 0.00 0.00 37.83 34.63 2i82 s LYS 94 CO 0.00 0.54 -0.06 -1.14 -0.92 0.00 0.00 175.35 173.77 2i82 s GLN 95 N -0.50 1.08 0.36 1.68 0.74 -1.26 -4.14 119.66 117.63 2i82 s GLN 95 Ca 0.07 -0.18 0.08 0.00 0.05 0.00 0.00 55.36 55.38 2i82 s GLN 95 Cb -0.12 -1.04 -0.07 0.00 1.10 0.00 0.00 33.01 32.88 2i82 s GLN 95 CO 0.02 -0.08 -0.06 0.71 -0.55 0.00 0.00 175.29 175.33 2i82 s TYR 96 N 0.97 2.42 0.01 1.67 1.51 0.36 -1.67 117.35 122.61 2i82 s TYR 96 Ca -0.10 -0.57 0.02 0.00 -1.01 0.00 0.00 57.07 55.41 2i82 s TYR 96 Cb -0.14 -1.50 -0.01 0.00 -0.11 0.00 0.00 41.96 40.19 2i82 s TYR 96 CO 0.00 0.52 -0.06 0.54 -1.11 0.00 0.00 175.55 175.44 2i82 s VAL 97 N -2.67 0.43 0.07 0.71 0.11 -0.21 -1.06 120.40 117.77 2i82 s VAL 97 Ca 0.33 -0.44 -0.14 0.00 -2.93 0.00 0.00 61.98 58.80 2i82 s VAL 97 Cb 0.05 -0.40 0.02 0.00 -1.53 0.00 0.00 36.38 34.52 2i82 s VAL 97 CO 0.17 -0.02 0.33 0.00 -3.33 0.00 0.00 175.10 172.25 2i82 s ALA 98 N -0.45 -0.75 -0.13 1.54 0.00 0.01 -0.94 121.76 121.04 2i82 s ALA 98 Ca -0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.91 2i82 s ALA 98 Cb -0.04 0.44 -0.02 0.00 0.00 0.00 0.00 23.12 23.50 2i82 s ALA 98 CO -0.00 -0.49 -0.11 1.03 0.00 0.00 0.00 175.76 176.19 2i82 s ARG 99 N -3.03 3.44 0.38 0.00 0.52 -0.89 0.45 118.95 119.83 2i82 s ARG 99 Ca -0.02 -0.65 0.06 0.00 -0.52 0.00 0.00 55.73 54.60 2i82 s ARG 99 Cb 0.01 -2.69 -0.07 0.00 0.52 0.00 0.00 34.95 32.72 2i82 s ARG 99 CO -0.06 0.22 0.01 0.14 0.02 0.00 0.00 175.30 175.63 2i82 s VAL 100 N 0.35 1.83 0.03 3.52 -7.23 -0.00 -1.47 120.40 117.42 2i82 s VAL 100 Ca -0.10 -2.02 -0.27 0.00 -1.81 0.00 0.00 61.98 57.79 2i82 s VAL 100 Cb -0.16 -2.91 -0.05 0.00 0.56 0.00 0.00 36.38 33.83 2i82 s VAL 100 CO 0.05 -0.02 0.84 0.86 -0.31 0.00 0.00 175.10 176.51 2i82 s TRP 101 N -2.84 3.70 0.00 2.82 -0.11 0.40 -2.09 118.94 120.82 2i82 s TRP 101 Ca 0.35 1.54 0.00 0.00 1.22 0.00 0.00 56.10 59.21 2i82 s TRP 101 Cb 0.09 -2.93 0.00 0.00 -1.50 0.00 0.00 33.47 29.13 2i82 s TRP 101 CO 0.17 0.16 0.00 0.41 -4.62 0.00 0.00 176.95 173.08 2i82 n GLY 102 N 2.61 -2.12 3.01 5.86 0.00 0.60 -4.38 105.19 110.76 2i82 n GLY 102 Ca 0.01 -1.44 -0.31 0.00 0.00 0.00 0.00 46.02 44.27 2i82 n GLY 102 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2i82 s HIS 103 N -0.10 3.48 0.33 1.61 3.76 -1.26 -3.17 115.29 119.94 2i82 s HIS 103 Ca 0.00 -2.74 -0.29 0.00 -0.15 0.00 0.00 55.06 51.88 2i82 s HIS 103 Cb 0.00 -2.59 -0.12 0.00 1.11 0.00 0.00 32.58 30.98 2i82 s HIS 103 CO 0.00 -0.92 1.50 -2.30 -0.85 0.00 0.00 174.74 172.16 2i82 n PRO 104 N 4.34 2.56 -3.71 8.40 -0.02 -1.26 -5.01 135.00 140.31 2i82 n PRO 104 Ca -0.01 0.91 -0.16 0.00 -2.02 0.00 0.00 63.50 62.22 2i82 n PRO 104 Cb 0.42 -2.63 -0.16 0.00 -0.02 0.00 0.00 33.50 31.11 2i82 n PRO 104 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2i82 s SER 105 N 0.13 0.46 0.82 2.55 0.15 -1.26 -3.95 113.70 112.60 2i82 s SER 105 Ca 0.59 0.25 -0.11 0.00 0.70 0.00 0.00 55.95 57.38 2i82 s SER 105 Cb -0.51 0.14 0.09 0.00 -1.71 0.00 0.00 66.02 64.03 2i82 s SER 105 CO 0.56 -0.20 1.13 -2.16 1.20 0.00 0.00 173.24 173.77 2i82 s PRO 106 N 1.78 1.74 0.17 5.44 0.04 -1.26 -5.05 135.00 137.86 2i82 s PRO 106 Ca -0.02 1.41 0.17 0.00 0.04 0.00 0.00 61.00 62.60 2i82 s PRO 106 Cb -0.12 -1.82 0.77 0.00 0.04 0.00 0.00 34.50 33.37 2i82 s PRO 106 CO -0.05 -2.07 1.52 0.00 0.04 0.00 0.00 177.00 176.44 2i82 n ALA 107 N -3.68 1.39 -3.10 8.56 0.00 -1.25 -4.66 120.51 117.77 2i82 n ALA 107 Ca 0.11 0.07 -0.11 0.00 0.00 0.00 0.00 53.44 53.50 2i82 n ALA 107 Cb 0.52 -1.27 -0.10 0.00 0.00 0.00 0.00 19.45 18.60 2i82 n ALA 107 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2i82 s GLU 108 N -3.25 0.44 0.00 0.00 2.12 -1.26 0.38 118.70 117.13 2i82 s GLU 108 Ca 0.02 -0.32 0.00 0.00 0.36 0.00 0.00 54.97 55.03 2i82 s GLU 108 Cb 0.07 0.18 0.00 0.00 0.26 0.00 0.00 34.13 34.64 2i82 s GLU 108 CO 0.24 -0.10 0.00 0.41 -0.54 0.00 0.00 175.26 175.27 2i82 n GLY 109 N 1.65 -1.15 2.98 -1.50 0.00 -0.80 -5.01 105.19 101.36 2i82 n GLY 109 Ca -0.21 -0.96 -0.20 0.00 0.00 0.00 0.00 46.02 44.64 2i82 n GLY 109 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2i82 s LEU 110 N 0.00 1.74 -0.27 0.99 2.96 -1.26 -1.47 118.68 121.37 2i82 s LEU 110 Ca 0.00 -0.17 -0.07 0.00 -0.22 0.00 0.00 54.13 53.67 2i82 s LEU 110 Cb 0.00 -0.52 -0.00 0.00 0.50 0.00 0.00 46.19 46.16 2i82 s LEU 110 CO 0.00 0.05 0.06 -0.69 -1.32 0.00 0.00 176.35 174.45 2i82 s VAL 111 N 0.28 4.00 -0.52 1.68 1.01 0.42 -4.96 120.40 122.32 2i82 s VAL 111 Ca -0.04 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.47 2i82 s VAL 111 Cb -0.09 -2.98 0.13 0.00 0.00 0.00 0.00 36.38 33.44 2i82 s VAL 111 CO 0.00 0.20 0.26 -0.62 0.00 0.00 0.00 175.10 174.95 2i82 s ASP 112 N 1.53 4.30 -0.04 3.32 -1.08 -1.26 -1.27 116.67 122.17 2i82 s ASP 112 Ca 0.04 -3.02 0.00 0.00 -0.52 0.00 0.00 52.55 49.05 2i82 s ASP 112 Cb -0.16 -1.62 0.03 0.00 -1.46 0.00 0.00 42.92 39.71 2i82 s ASP 112 CO 0.02 -0.23 -0.01 -0.76 0.52 0.00 0.00 175.17 174.72 2i82 s LEU 113 N -0.30 1.11 0.26 -1.34 1.43 -1.01 -4.97 118.68 113.86 2i82 s LEU 113 Ca 0.17 -0.05 -0.30 0.00 -1.03 0.00 0.00 54.13 52.93 2i82 s LEU 113 Cb -0.25 -0.29 -0.09 0.00 0.03 0.00 0.00 46.19 45.58 2i82 s LEU 113 CO -0.00 -0.10 1.25 -2.16 0.23 0.00 0.00 176.35 175.57 2i82 s PRO 114 N 1.12 4.44 0.15 1.29 0.04 -1.26 -3.82 135.00 136.96 2i82 s PRO 114 Ca -0.08 2.04 0.10 0.00 0.04 0.00 0.00 61.00 63.09 2i82 s PRO 114 Cb -0.14 -3.16 -0.04 0.00 0.04 0.00 0.00 34.50 31.21 2i82 s PRO 114 CO -0.02 -0.12 -0.23 -0.51 0.04 0.00 0.00 177.00 176.16 2i82 s LEU 115 N -0.94 2.37 0.10 -3.56 1.43 -0.48 -1.42 118.68 116.17 2i82 s LEU 115 Ca 0.51 -0.79 -0.17 0.00 -1.03 0.00 0.00 54.13 52.65 2i82 s LEU 115 Cb -0.36 -1.06 0.04 0.00 0.03 0.00 0.00 46.19 44.83 2i82 s LEU 115 CO 0.43 0.10 0.42 -0.51 0.23 0.00 0.00 176.35 177.02 2i82 s ILE 116 N -1.43 0.06 0.29 -0.59 2.07 -0.63 0.31 121.20 121.27 2i82 s ILE 116 Ca 0.15 -0.51 -0.29 0.00 -1.41 0.00 0.00 60.65 58.58 2i82 s ILE 116 Cb -0.09 -1.09 -0.10 0.00 0.13 0.00 0.00 42.46 41.31 2i82 s ILE 116 CO 0.07 -0.28 1.14 0.00 -1.91 0.00 0.00 174.94 173.96 2i82 s ASP 118 N -0.80 7.16 0.20 0.00 2.15 -0.51 -4.82 116.67 120.05 2i82 s ASP 118 Ca 0.46 -3.23 -0.19 0.00 0.43 0.00 0.00 52.55 50.01 2i82 s ASP 118 Cb -0.34 -2.29 0.15 0.00 -0.30 0.00 0.00 42.92 40.15 2i82 s ASP 118 CO 0.44 -0.52 1.44 1.87 -0.17 0.00 0.00 175.17 178.23 2i82 n TRP 119 N 4.07 -0.08 0.15 -5.34 -0.00 -1.26 -0.29 117.44 114.69 2i82 n TRP 119 Ca 0.28 1.15 0.17 0.00 -0.00 0.00 0.00 57.50 59.09 2i82 n TRP 119 Cb 0.42 -0.78 0.76 0.00 -0.00 0.00 0.00 31.31 31.70 2i82 n TRP 119 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 2i82 h PRO 120 N 0.00 0.00 -0.37 5.87 0.11 -1.96 -0.72 132.00 134.93 2i82 h PRO 120 Ca 0.28 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.29 2i82 h PRO 120 Cb 0.51 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.57 2i82 h PRO 120 CO -0.91 0.00 0.03 0.09 -0.21 0.00 0.00 178.00 177.00 2i82 n ASN 121 N -4.09 3.57 -4.49 -2.05 3.02 0.60 -5.03 115.26 106.79 2i82 n ASN 121 Ca 0.03 -3.29 -0.39 0.00 -0.03 0.00 0.00 54.58 50.90 2i82 n ASN 121 Cb 0.37 -0.61 0.03 0.00 -0.61 0.00 0.00 39.78 38.97 2i82 n ASN 121 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 2i82 n ARG 122 N -0.68 0.60 -0.11 3.52 1.85 -0.28 -1.42 116.66 120.15 2i82 n ARG 122 Ca 0.29 0.23 0.02 0.00 -1.00 0.00 0.00 57.85 57.38 2i82 n ARG 122 Cb 1.02 -1.74 0.07 0.00 -1.05 0.00 0.00 32.46 30.76 2i82 n ARG 122 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 2i82 n PRO 123 N -0.07 1.48 -1.91 2.89 -0.04 -1.26 -5.07 135.00 131.01 2i82 n PRO 123 Ca 0.12 -0.52 -0.36 0.00 -0.04 0.00 0.00 63.50 62.69 2i82 n PRO 123 Cb 0.46 -1.32 0.05 0.00 -0.04 0.00 0.00 33.50 32.64 2i82 n PRO 123 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2i82 s LYS 124 N -1.62 2.82 0.42 0.54 1.02 -0.50 -4.89 119.74 117.54 2i82 s LYS 124 Ca 0.09 1.88 0.06 0.00 0.02 0.00 0.00 55.97 58.03 2i82 s LYS 124 Cb 0.06 -1.90 -0.07 0.00 -0.52 0.00 0.00 37.83 35.40 2i82 s LYS 124 CO 0.05 -1.34 0.03 -0.65 -0.92 0.00 0.00 175.35 172.52 2i82 s GLN 125 N -3.38 2.02 0.18 1.68 -1.52 -1.26 -1.42 119.66 115.96 2i82 s GLN 125 Ca 0.79 -2.12 -0.19 0.00 -1.95 0.00 0.00 55.36 51.88 2i82 s GLN 125 Cb -0.32 -1.66 0.04 0.00 -0.22 0.00 0.00 33.01 30.85 2i82 s GLN 125 CO 0.35 -0.10 0.54 -1.59 -0.25 0.00 0.00 175.29 174.24 2i82 s LYS 126 N -3.75 1.34 0.17 2.91 -2.85 -0.06 -4.72 119.74 112.77 2i82 s LYS 126 Ca 0.32 -0.74 -0.30 0.00 -1.00 0.00 0.00 55.97 54.24 2i82 s LYS 126 Cb 0.08 0.54 -0.07 0.00 -2.06 0.00 0.00 37.83 36.32 2i82 s LYS 126 CO 0.16 -0.57 1.01 0.08 0.10 0.00 0.00 175.35 176.13 2i82 s VAL 127 N -3.83 4.15 -0.27 1.79 1.01 -1.26 -1.61 120.40 120.38 2i82 s VAL 127 Ca 0.06 1.91 -0.02 0.00 0.00 0.00 0.00 61.98 63.93 2i82 s VAL 127 Cb -0.01 -4.22 0.15 0.00 0.00 0.00 0.00 36.38 32.31 2i82 s VAL 127 CO -0.06 0.35 0.46 0.00 0.00 0.00 0.00 175.10 175.85 2i82 h TYR 129 N 8.12 0.00 0.01 0.00 -1.99 -1.93 0.32 116.97 121.50 2i82 h TYR 129 Ca -0.20 0.00 -0.14 0.00 2.00 0.00 0.00 58.73 60.39 2i82 h TYR 129 Cb 1.16 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.90 2i82 h TYR 129 CO 0.12 0.20 -0.55 0.93 -0.00 0.00 0.00 178.16 178.87 2i82 h GLU 130 N 0.00 0.36 0.00 4.88 5.08 -1.96 -3.41 114.58 119.53 2i82 h GLU 130 Ca -0.00 -0.40 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 2i82 h GLU 130 Cb 0.77 0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.14 2i82 h GLU 130 CO 0.03 1.08 0.00 0.25 -1.00 0.00 0.00 179.01 179.37 2i82 n THR 131 N -4.26 0.00 -2.07 1.13 -2.24 -1.22 -5.09 114.28 100.52 2i82 n THR 131 Ca -0.10 -0.36 -0.36 0.00 -2.27 0.00 0.00 64.05 60.96 2i82 n THR 131 Cb 0.65 1.23 0.03 0.00 -2.10 0.00 0.00 70.33 70.14 2i82 n THR 131 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2i82 s GLY 132 N -0.13 2.72 0.10 3.38 0.00 0.11 -4.84 107.32 108.67 2i82 s GLY 132 Ca 0.00 0.98 -0.26 0.00 0.00 0.00 0.00 44.72 45.43 2i82 s GLY 132 CO 0.00 1.36 0.82 0.54 0.00 0.00 0.00 173.10 175.82 2i82 s LYS 133 N -3.29 4.58 0.32 2.90 1.02 0.15 -4.57 119.74 120.84 2i82 s LYS 133 Ca 0.76 1.19 -0.29 0.00 0.02 0.00 0.00 55.97 57.65 2i82 s LYS 133 Cb -0.29 -3.33 -0.12 0.00 -0.52 0.00 0.00 37.83 33.57 2i82 s LYS 133 CO 0.32 0.37 1.43 -0.35 -0.92 0.00 0.00 175.35 176.19 2i82 n PRO 134 N 2.38 2.36 -3.81 -1.68 -0.04 -1.26 -1.38 135.00 131.57 2i82 n PRO 134 Ca -0.02 0.83 -0.12 0.00 -0.04 0.00 0.00 63.50 64.15 2i82 n PRO 134 Cb 0.49 -2.51 -0.12 0.00 -0.04 0.00 0.00 33.50 31.32 2i82 n PRO 134 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2i82 s ALA 135 N -0.63 -0.48 -0.03 0.55 0.00 -1.25 -4.87 121.76 115.05 2i82 s ALA 135 Ca 0.59 0.51 0.03 0.00 0.00 0.00 0.00 51.96 53.09 2i82 s ALA 135 Cb -0.55 -0.29 0.00 0.00 0.00 0.00 0.00 23.12 22.28 2i82 s ALA 135 CO 0.57 -0.10 -0.10 -0.65 0.00 0.00 0.00 175.76 175.48 2i82 s GLN 136 N 0.02 1.06 -0.04 0.00 1.11 -1.26 -2.41 119.66 118.14 2i82 s GLN 136 Ca -0.01 -0.33 0.02 0.00 0.01 0.00 0.00 55.36 55.05 2i82 s GLN 136 Cb -0.02 -0.97 0.01 0.00 -1.01 0.00 0.00 33.01 31.02 2i82 s GLN 136 CO 0.00 0.12 -0.07 0.99 0.01 0.00 0.00 175.29 176.34 2i82 s THR 137 N 0.21 0.71 -0.16 -0.19 2.01 -0.40 -1.45 115.64 116.37 2i82 s THR 137 Ca -0.04 -0.26 -0.10 0.00 0.31 0.00 0.00 61.69 61.61 2i82 s THR 137 Cb -0.09 -0.68 -0.05 0.00 0.01 0.00 0.00 72.50 71.69 2i82 s THR 137 CO 0.01 0.25 0.16 -1.61 -0.69 0.00 0.00 174.62 172.74 2i82 s GLU 138 N 0.64 3.95 0.10 4.92 2.02 -0.54 -0.44 118.70 129.35 2i82 s GLU 138 Ca -0.10 -0.14 0.06 0.00 0.02 0.00 0.00 54.97 54.81 2i82 s GLU 138 Cb -0.13 -3.34 -0.03 0.00 0.10 0.00 0.00 34.13 30.73 2i82 s GLU 138 CO 0.01 0.46 -0.16 1.52 0.02 0.00 0.00 175.26 177.11 2i82 s TYR 139 N -0.11 1.42 -0.15 1.61 -0.85 -0.54 -0.16 117.35 118.57 2i82 s TYR 139 Ca 0.12 -0.48 -0.05 0.00 -0.52 0.00 0.00 57.07 56.14 2i82 s TYR 139 Cb -0.12 -0.77 0.08 0.00 0.38 0.00 0.00 41.96 41.53 2i82 s TYR 139 CO 0.01 0.12 0.28 -2.00 -1.52 0.00 0.00 175.55 172.44 2i82 s GLU 140 N -2.08 0.18 -0.10 -3.49 2.12 -0.73 -1.91 118.70 112.70 2i82 s GLU 140 Ca 0.04 0.68 -0.30 0.00 0.36 0.00 0.00 54.97 55.74 2i82 s GLU 140 Cb -0.08 -0.21 -0.02 0.00 0.26 0.00 0.00 34.13 34.08 2i82 s GLU 140 CO 0.03 -0.36 1.10 0.08 -0.54 0.00 0.00 175.26 175.56 2i82 s VAL 141 N 2.43 4.55 -1.65 3.70 1.01 0.16 -0.95 120.40 129.64 2i82 s VAL 141 Ca 0.03 1.84 0.14 0.00 0.00 0.00 0.00 61.98 63.98 2i82 s VAL 141 Cb -0.13 -4.18 0.13 0.00 0.00 0.00 0.00 36.38 32.20 2i82 s VAL 141 CO -0.10 -0.02 0.96 1.33 0.00 0.00 0.00 175.10 177.27 2i82 n VAL 142 N 4.67 0.08 -3.44 2.92 0.24 0.14 -4.94 118.33 118.01 2i82 n VAL 142 Ca 0.10 -0.54 0.01 0.00 -2.04 0.00 0.00 64.34 61.87 2i82 n VAL 142 Cb 0.47 1.22 -0.04 0.00 -1.47 0.00 0.00 33.84 34.02 2i82 n VAL 142 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2i82 s GLU 143 N -1.12 0.31 -0.42 7.34 2.12 -1.15 -4.94 118.70 120.84 2i82 s GLU 143 Ca 0.17 0.75 -0.14 0.00 0.36 0.00 0.00 54.97 56.11 2i82 s GLU 143 Cb 0.12 0.42 0.04 0.00 0.26 0.00 0.00 34.13 34.96 2i82 s GLU 143 CO 0.17 -0.10 0.31 0.71 -0.54 0.00 0.00 175.26 175.81 2i82 s TYR 144 N 2.34 3.25 0.36 5.30 1.51 -1.26 -0.45 117.35 128.40 2i82 s TYR 144 Ca -0.03 -0.82 -0.14 0.00 -1.01 0.00 0.00 57.07 55.06 2i82 s TYR 144 Cb -0.06 -2.76 -0.08 0.00 -0.11 0.00 0.00 41.96 38.95 2i82 s TYR 144 CO -0.17 -0.68 0.77 0.00 -1.11 0.00 0.00 175.55 174.36 2i82 s ALA 145 N 1.63 3.30 0.40 3.71 0.00 0.19 -4.99 121.76 126.00 2i82 s ALA 145 Ca 0.04 -0.00 0.35 0.00 0.00 0.00 0.00 51.96 52.35 2i82 s ALA 145 Cb -0.21 -2.79 1.75 0.00 0.00 0.00 0.00 23.12 21.87 2i82 s ALA 145 CO 0.08 0.19 2.14 0.00 0.00 0.00 0.00 175.76 178.17 2i82 h ALA 146 N 1.86 1.10 -0.16 0.00 0.00 -1.98 -2.88 119.26 117.21 2i82 h ALA 146 Ca -0.48 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 2i82 h ALA 146 Cb 1.18 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2i82 h ALA 146 CO 0.64 0.05 0.02 -0.40 0.00 0.00 0.00 179.25 179.57 2i82 n ASP 147 N -3.29 2.33 -2.46 0.00 5.75 -1.26 -4.84 116.55 112.77 2i82 n ASP 147 Ca -0.01 -2.26 -0.15 0.00 -0.01 0.00 0.00 54.79 52.36 2i82 n ASP 147 Cb 0.20 -0.55 0.05 0.00 -1.03 0.00 0.00 41.12 39.79 2i82 n ASP 147 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2i82 n ASN 148 N 0.15 -4.71 -4.22 -1.12 5.15 -1.09 -4.95 115.26 104.47 2i82 n ASN 148 Ca 0.08 -0.34 -0.18 0.00 -0.60 0.00 0.00 54.58 53.54 2i82 n ASN 148 Cb 0.53 -3.38 -0.10 0.00 -0.53 0.00 0.00 39.78 36.31 2i82 n ASN 148 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2i82 s THR 149 N -3.20 0.51 0.00 -0.44 -4.23 -1.23 -0.29 115.64 106.75 2i82 s THR 149 Ca 0.36 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.75 2i82 s THR 149 Cb -0.16 -2.59 0.02 0.00 1.34 0.00 0.00 72.50 71.10 2i82 s THR 149 CO 0.46 0.00 0.26 0.00 -0.54 0.00 0.00 174.62 174.80 2i82 s ALA 150 N -3.69 -0.63 -0.23 3.99 0.00 -0.89 -0.64 121.76 119.68 2i82 s ALA 150 Ca 0.37 0.12 -0.10 0.00 0.00 0.00 0.00 51.96 52.35 2i82 s ALA 150 Cb 0.07 0.14 -0.05 0.00 0.00 0.00 0.00 23.12 23.28 2i82 s ALA 150 CO 0.15 -0.28 0.14 0.50 0.00 0.00 0.00 175.76 176.27 2i82 s ARG 151 N -1.63 4.07 0.02 0.00 3.52 0.40 -0.82 118.95 124.52 2i82 s ARG 151 Ca -0.12 -0.27 0.07 0.00 -0.13 0.00 0.00 55.73 55.28 2i82 s ARG 151 Cb -0.05 -3.47 -0.02 0.00 -1.56 0.00 0.00 34.95 29.85 2i82 s ARG 151 CO 0.02 0.13 -0.22 0.08 -0.81 0.00 0.00 175.30 174.50 2i82 s VAL 152 N 0.86 1.75 -0.20 7.11 1.01 0.17 -0.68 120.40 130.42 2i82 s VAL 152 Ca 0.07 -1.14 -0.09 0.00 0.00 0.00 0.00 61.98 60.83 2i82 s VAL 152 Cb -0.13 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 2i82 s VAL 152 CO 0.03 0.32 0.09 -0.69 0.00 0.00 0.00 175.10 174.85 2i82 s VAL 153 N -0.71 5.02 -0.06 2.92 1.01 -0.13 -0.81 120.40 127.65 2i82 s VAL 153 Ca 0.08 0.05 0.05 0.00 0.00 0.00 0.00 61.98 62.17 2i82 s VAL 153 Cb -0.09 -3.29 -0.00 0.00 0.00 0.00 0.00 36.38 33.00 2i82 s VAL 153 CO 0.01 0.43 -0.22 -0.76 0.00 0.00 0.00 175.10 174.57 2i82 s LEU 154 N 0.51 2.00 -0.45 3.92 1.43 -0.23 -1.78 118.68 124.08 2i82 s LEU 154 Ca 0.05 -0.46 0.04 0.00 -1.03 0.00 0.00 54.13 52.73 2i82 s LEU 154 Cb -0.12 -1.22 0.12 0.00 0.03 0.00 0.00 46.19 45.00 2i82 s LEU 154 CO 0.00 0.19 0.19 -0.54 0.23 0.00 0.00 176.35 176.42 2i82 s LYS 155 N 0.04 1.71 -0.13 1.70 1.02 0.78 -0.49 119.74 124.37 2i82 s LYS 155 Ca -0.07 -2.29 -0.29 0.00 0.02 0.00 0.00 55.97 53.34 2i82 s LYS 155 Cb -0.14 -3.12 -0.02 0.00 -0.52 0.00 0.00 37.83 34.03 2i82 s LYS 155 CO 0.04 -1.06 1.34 -1.25 -0.92 0.00 0.00 175.35 173.49 2i82 s PRO 156 N 0.18 4.23 -0.11 -1.68 0.04 -1.26 -1.47 135.00 134.94 2i82 s PRO 156 Ca 0.15 1.77 -0.21 0.00 0.04 0.00 0.00 61.00 62.75 2i82 s PRO 156 Cb -0.24 -3.78 -0.18 0.00 0.04 0.00 0.00 34.50 30.33 2i82 s PRO 156 CO -0.03 -0.71 0.67 0.82 0.04 0.00 0.00 177.00 177.78 2i82 h ILE 157 N 5.46 1.24 -4.75 0.56 1.08 -1.62 -3.42 117.51 116.05 2i82 h ILE 157 Ca -0.30 -1.77 -0.45 0.00 -0.39 0.00 0.00 64.86 61.95 2i82 h ILE 157 Cb 1.12 2.27 0.13 0.00 -3.07 0.00 0.00 36.82 37.27 2i82 h ILE 157 CO 0.96 0.39 0.26 0.35 -0.69 0.00 0.00 178.15 179.43 2i82 n THR 158 N -4.72 0.00 -2.62 -0.27 -2.24 -1.23 -4.95 114.28 98.26 2i82 n THR 158 Ca -0.07 -1.30 -0.13 0.00 -2.27 0.00 0.00 64.05 60.27 2i82 n THR 158 Cb 0.33 -1.18 0.02 0.00 -2.10 0.00 0.00 70.33 67.40 2i82 n THR 158 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i82 n GLY 159 N -3.21 2.61 3.80 3.38 0.00 -1.26 -4.91 105.19 105.59 2i82 n GLY 159 Ca 0.17 -1.65 -0.34 0.00 0.00 0.00 0.00 46.02 44.20 2i82 n GLY 159 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i82 s ARG 160 N -3.23 3.76 0.15 1.61 3.00 -1.26 -4.94 118.95 118.03 2i82 s ARG 160 Ca 0.32 1.37 -0.34 0.00 0.00 0.00 0.00 55.73 57.08 2i82 s ARG 160 Cb 0.44 -2.09 -0.14 0.00 0.00 0.00 0.00 34.95 33.17 2i82 s ARG 160 CO -0.02 -0.47 1.59 0.45 0.00 0.00 0.00 175.30 176.85 2i82 n SER 161 N -1.03 3.09 -1.84 0.23 2.88 -1.26 -1.35 113.62 114.34 2i82 n SER 161 Ca 0.09 1.08 -0.18 0.00 -1.33 0.00 0.00 58.87 58.53 2i82 n SER 161 Cb 0.52 -1.42 -0.05 0.00 -0.75 0.00 0.00 64.21 62.51 2i82 n SER 161 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2i82 n HIS 162 N 3.57 -0.49 -0.11 0.66 8.25 -1.26 -4.89 115.22 120.95 2i82 n HIS 162 Ca 0.17 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.58 2i82 n HIS 162 Cb 0.29 -3.30 0.01 0.00 1.12 0.00 0.00 29.99 28.11 2i82 n HIS 162 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 2i82 h GLN 163 N 0.00 0.02 -0.23 -0.41 4.15 -1.59 -1.29 115.11 115.75 2i82 h GLN 163 Ca -0.39 -0.00 -0.15 0.00 0.77 0.00 0.00 58.65 58.88 2i82 h GLN 163 Cb 1.23 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.90 2i82 h GLN 163 CO 0.53 0.01 -0.45 -0.07 -1.93 0.00 0.00 178.83 176.92 2i82 h LEU 164 N 0.02 0.64 -0.80 -2.39 3.38 -1.90 -0.28 115.31 113.98 2i82 h LEU 164 Ca 0.18 -0.31 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 2i82 h LEU 164 Cb 0.28 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2i82 h LEU 164 CO -0.37 1.00 -0.17 0.03 0.09 0.00 0.00 178.44 179.02 2i82 h ARG 165 N 0.48 0.71 0.14 1.13 3.08 -1.89 -3.20 114.38 114.83 2i82 h ARG 165 Ca 0.03 -0.26 -0.31 0.00 0.07 0.00 0.00 59.98 59.52 2i82 h ARG 165 Cb 0.98 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.98 2i82 h ARG 165 CO 0.09 0.84 -1.47 0.28 -1.07 0.00 0.00 179.97 178.64 2i82 h VAL 166 N 0.64 1.23 0.00 2.04 2.07 -1.17 -2.74 116.25 118.31 2i82 h VAL 166 Ca 0.10 -2.83 0.00 0.00 0.82 0.00 0.00 66.70 64.79 2i82 h VAL 166 Cb 0.65 2.83 0.00 0.00 -1.52 0.00 0.00 31.29 33.25 2i82 h VAL 166 CO 0.05 0.84 0.00 1.41 0.02 0.00 0.00 177.57 179.88 2i82 n HIS 167 N -3.51 0.00 0.00 1.57 8.25 -0.12 -0.92 115.22 120.49 2i82 n HIS 167 Ca -0.15 -0.09 0.00 0.00 -0.26 0.00 0.00 57.72 57.22 2i82 n HIS 167 Cb 1.05 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 32.06 2i82 n HIS 167 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2i82 n LEU 169 N 0.65 0.00 0.07 2.41 7.94 -1.04 -2.13 117.00 124.89 2i82 n LEU 169 Ca 0.00 0.00 0.08 0.00 -1.11 0.00 0.00 56.01 54.98 2i82 n LEU 169 Cb 0.12 0.00 0.53 0.00 0.53 0.00 0.00 43.42 44.60 2i82 n LEU 169 CO 0.00 0.00 1.14 0.00 -1.11 0.00 0.00 177.39 177.42 2i82 h ALA 170 N 0.00 1.92 0.00 1.96 0.00 -1.32 0.96 119.26 122.79 2i82 h ALA 170 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2i82 h ALA 170 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2i82 h ALA 170 CO 0.00 0.03 0.00 -0.07 0.00 0.00 0.00 179.25 179.21 2i82 h LEU 171 N 0.31 0.00 0.00 0.00 3.38 -1.70 -3.45 115.31 113.84 2i82 h LEU 171 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2i82 h LEU 171 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2i82 h LEU 171 CO -0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.11 2i82 n GLY 172 N 0.57 1.00 2.38 0.83 0.00 0.33 -5.01 105.19 105.29 2i82 n GLY 172 Ca 0.03 -0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 2i82 n GLY 172 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2i82 n HIS 173 N -2.01 0.63 -1.60 1.61 8.25 -1.25 -4.86 115.22 116.00 2i82 n HIS 173 Ca 0.00 -3.68 -0.34 0.00 -0.26 0.00 0.00 57.72 53.43 2i82 n HIS 173 Cb 0.00 -0.24 0.07 0.00 1.12 0.00 0.00 29.99 30.95 2i82 n HIS 173 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2i82 s PRO 174 N -1.08 2.41 0.22 -0.41 0.04 -1.26 -4.09 135.00 130.84 2i82 s PRO 174 Ca 0.34 1.70 -0.30 0.00 0.04 0.00 0.00 61.00 62.78 2i82 s PRO 174 Cb 0.10 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 32.68 2i82 s PRO 174 CO -0.13 -1.61 1.20 0.42 0.04 0.00 0.00 177.00 176.92 2i82 s ILE 175 N -1.98 3.41 0.31 0.56 1.01 -1.26 -0.46 121.20 122.80 2i82 s ILE 175 Ca 0.73 1.26 -0.30 0.00 0.00 0.00 0.00 60.65 62.35 2i82 s ILE 175 Cb -0.28 -3.80 -0.11 0.00 0.01 0.00 0.00 42.46 38.28 2i82 s ILE 175 CO 0.42 0.23 1.58 -0.76 0.00 0.00 0.00 174.94 176.42 2i82 s LEU 176 N -0.66 4.33 0.00 2.97 1.43 -0.54 -2.14 118.68 124.07 2i82 s LEU 176 Ca 0.51 2.99 0.00 0.00 -1.03 0.00 0.00 54.13 56.60 2i82 s LEU 176 Cb -0.34 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.24 2i82 s LEU 176 CO 0.40 -0.92 0.00 0.61 0.23 0.00 0.00 176.35 176.66 2i82 n GLY 177 N 1.79 0.85 3.56 -3.19 0.00 -0.56 -1.13 105.19 106.51 2i82 n GLY 177 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 2i82 n GLY 177 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2i82 s ASP 178 N -2.70 5.74 0.43 1.61 3.68 -0.91 -3.64 116.67 120.88 2i82 s ASP 178 Ca 0.00 0.21 0.10 0.00 2.13 0.00 0.00 52.55 54.99 2i82 s ASP 178 Cb 0.00 -2.54 0.94 0.00 -1.45 0.00 0.00 42.92 39.87 2i82 s ASP 178 CO 0.00 -2.04 2.05 -0.09 0.13 0.00 0.00 175.17 175.23 2i82 h ARG 179 N 12.69 0.35 0.20 4.34 2.43 -1.91 -0.42 114.38 132.06 2i82 h ARG 179 Ca -0.27 -0.03 -0.32 0.00 -0.81 0.00 0.00 59.98 58.55 2i82 h ARG 179 Cb 1.12 -0.07 0.02 0.00 -0.42 0.00 0.00 29.97 30.62 2i82 h ARG 179 CO 1.21 0.27 -1.42 0.74 -1.51 0.00 0.00 179.97 179.26 2i82 h PHE 180 N 0.35 0.77 0.00 2.20 0.04 -1.99 -3.42 116.94 114.89 2i82 h PHE 180 Ca 0.09 -0.56 0.00 0.00 2.80 0.00 0.00 57.97 60.30 2i82 h PHE 180 Cb 0.04 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.16 2i82 h PHE 180 CO 0.00 1.46 -0.20 0.66 -0.60 0.00 0.00 178.31 179.64 2i82 n TYR 181 N -3.63 0.00 -2.95 -0.55 4.02 -1.18 -5.06 117.16 107.81 2i82 n TYR 181 Ca -0.14 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.43 2i82 n TYR 181 Cb 1.07 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 40.34 2i82 n TYR 181 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2i82 s ALA 182 N -1.02 3.29 0.92 -0.72 0.00 -0.17 -4.93 121.76 119.12 2i82 s ALA 182 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 51.96 51.83 2i82 s ALA 182 Cb 0.00 -2.80 0.14 0.00 0.00 0.00 0.00 23.12 20.46 2i82 s ALA 182 CO 0.00 0.14 1.09 -1.54 0.00 0.00 0.00 175.76 175.46 2i82 s SER 183 N -2.66 3.28 0.27 0.00 1.04 -1.26 -4.70 113.70 109.68 2i82 s SER 183 Ca 0.54 1.41 -0.01 0.00 0.48 0.00 0.00 55.95 58.37 2i82 s SER 183 Cb -0.10 -2.09 0.45 0.00 0.10 0.00 0.00 66.02 64.39 2i82 s SER 183 CO 0.23 -2.75 1.87 -0.65 0.98 0.00 0.00 173.24 172.93 2i82 h PRO 184 N -1.63 1.09 0.13 4.02 0.11 -1.97 0.03 132.00 133.79 2i82 h PRO 184 Ca -0.51 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 65.53 2i82 h PRO 184 Cb 1.29 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 2i82 h PRO 184 CO 0.55 0.72 -0.08 1.49 -0.21 0.00 0.00 178.00 180.48 2i82 h GLU 185 N 1.13 -0.20 -0.10 1.05 4.81 -2.00 -1.09 114.58 118.18 2i82 h GLU 185 Ca 0.45 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.62 2i82 h GLU 185 Cb 0.26 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 2i82 h GLU 185 CO -0.20 -0.13 -0.28 0.00 -0.73 0.00 0.00 179.01 177.67 2i82 h ALA 186 N 0.66 1.35 -0.54 2.92 0.00 -1.83 -2.78 119.26 119.03 2i82 h ALA 186 Ca -0.01 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 2i82 h ALA 186 Cb 0.17 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2i82 h ALA 186 CO 0.02 0.46 -0.02 0.00 0.00 0.00 0.00 179.25 179.70 2i82 h ARG 187 N 0.16 0.94 -2.99 0.00 3.08 -0.65 -1.48 114.38 113.44 2i82 h ARG 187 Ca 0.02 -0.29 -0.16 0.00 0.07 0.00 0.00 59.98 59.62 2i82 h ARG 187 Cb 0.59 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 2i82 h ARG 187 CO 0.04 0.95 0.96 0.00 -1.07 0.00 0.00 179.97 180.85 2i82 n ALA 188 N -2.48 3.42 -0.50 0.04 0.00 -0.44 -3.84 120.51 116.71 2i82 n ALA 188 Ca 0.03 -1.04 -0.17 0.00 0.00 0.00 0.00 53.44 52.26 2i82 n ALA 188 Cb 0.34 -2.51 -0.01 0.00 0.00 0.00 0.00 19.45 17.27 2i82 n ALA 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2i82 n ALA 190 N 3.45 -1.78 0.96 0.00 0.00 -1.26 -5.02 120.51 116.85 2i82 n ALA 190 Ca 0.24 0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.91 2i82 n ALA 190 Cb 0.26 -0.57 0.54 0.00 0.00 0.00 0.00 19.45 19.69 2i82 n ALA 190 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2i82 n PRO 191 N 0.41 0.18 -3.74 0.00 -0.02 -1.26 -4.49 135.00 126.07 2i82 n PRO 191 Ca 0.06 0.08 -0.10 0.00 -2.02 0.00 0.00 63.50 61.52 2i82 n PRO 191 Cb 0.11 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.04 2i82 n PRO 191 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2i82 s ARG 192 N -2.78 1.21 0.05 -0.52 1.70 -1.26 -5.10 118.95 112.25 2i82 s ARG 192 Ca 0.17 -0.86 -0.30 0.00 -0.47 0.00 0.00 55.73 54.27 2i82 s ARG 192 Cb 0.15 0.47 -0.09 0.00 -0.57 0.00 0.00 34.95 34.92 2i82 s ARG 192 CO 0.39 -0.49 1.84 -1.17 -1.08 0.00 0.00 175.30 174.80 2i82 s LEU 193 N -2.86 4.40 -1.34 -1.89 2.96 -1.24 -4.27 118.68 114.44 2i82 s LEU 193 Ca 0.08 2.61 -0.09 0.00 -0.22 0.00 0.00 54.13 56.51 2i82 s LEU 193 Cb 0.01 -3.54 0.12 0.00 0.50 0.00 0.00 46.19 43.28 2i82 s LEU 193 CO -0.06 -1.00 2.13 0.18 -1.32 0.00 0.00 176.35 176.28 2i82 n LEU 194 N 6.72 7.21 -3.94 -0.68 4.77 -0.29 -4.84 117.00 125.96 2i82 n LEU 194 Ca 0.18 -4.64 -0.20 0.00 -0.03 0.00 0.00 56.01 51.32 2i82 n LEU 194 Cb 0.40 -1.47 -0.16 0.00 -2.33 0.00 0.00 43.42 39.86 2i82 n LEU 194 CO 0.66 1.59 -0.42 -0.22 -1.33 0.00 0.00 177.39 177.66 2i82 s LEU 195 N -0.40 1.50 -0.02 2.23 2.96 -1.26 -2.08 118.68 121.61 2i82 s LEU 195 Ca 0.46 -0.16 -0.00 0.00 -0.22 0.00 0.00 54.13 54.21 2i82 s LEU 195 Cb 0.13 -0.52 0.03 0.00 0.50 0.00 0.00 46.19 46.33 2i82 s LEU 195 CO -0.04 -0.01 0.03 -2.28 -1.32 0.00 0.00 176.35 172.73 2i82 s HIS 196 N 0.69 0.02 -0.85 5.38 5.65 -0.11 -2.94 115.29 123.12 2i82 s HIS 196 Ca -0.10 0.13 -0.23 0.00 0.25 0.00 0.00 55.06 55.11 2i82 s HIS 196 Cb -0.13 -0.20 0.07 0.00 -1.18 0.00 0.00 32.58 31.14 2i82 s HIS 196 CO 0.01 -0.08 1.22 0.00 -0.65 0.00 0.00 174.74 175.24 2i82 s ALA 197 N 0.92 2.97 -1.55 1.58 0.00 0.13 -1.05 121.76 124.76 2i82 s ALA 197 Ca -0.08 -2.09 0.29 0.00 0.00 0.00 0.00 51.96 50.09 2i82 s ALA 197 Cb -0.11 -4.20 1.55 0.00 0.00 0.00 0.00 23.12 20.36 2i82 s ALA 197 CO -0.03 -3.20 2.04 -1.91 0.00 0.00 0.00 175.76 172.67 2i82 n GLU 198 N 8.17 0.53 0.00 0.00 2.13 -0.67 -1.07 120.64 129.72 2i82 n GLU 198 Ca 0.16 0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.98 2i82 n GLU 198 Cb 0.49 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.70 2i82 n GLU 198 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 2i82 n LEU 200 N -1.23 0.00 -4.08 4.31 7.94 -0.46 -1.08 117.00 122.40 2i82 n LEU 200 Ca 0.16 0.00 -0.27 0.00 -1.11 0.00 0.00 56.01 54.79 2i82 n LEU 200 Cb 0.21 0.00 -0.17 0.00 0.53 0.00 0.00 43.42 43.99 2i82 n LEU 200 CO 0.21 0.00 -0.50 -0.89 -1.11 0.00 0.00 177.39 175.11 2i82 s THR 201 N -0.38 1.42 0.32 1.96 2.01 -0.39 -0.34 115.64 120.24 2i82 s THR 201 Ca 0.00 -0.65 0.00 0.00 0.31 0.00 0.00 61.69 61.36 2i82 s THR 201 Cb 0.00 -1.27 -0.01 0.00 0.01 0.00 0.00 72.50 71.23 2i82 s THR 201 CO 0.00 0.42 0.38 0.27 -0.69 0.00 0.00 174.62 175.00 2i82 s ILE 202 N 0.57 0.00 -0.09 1.82 -4.36 -1.26 -1.64 121.20 116.25 2i82 s ILE 202 Ca -0.16 -1.76 0.02 0.00 -0.26 0.00 0.00 60.65 58.49 2i82 s ILE 202 Cb -0.16 -2.56 -0.02 0.00 1.25 0.00 0.00 42.46 40.96 2i82 s ILE 202 CO 0.05 0.00 -0.13 0.42 0.24 0.00 0.00 174.94 175.52 2i82 s THR 203 N -3.32 3.11 0.09 8.37 -4.23 -1.26 -4.43 115.64 113.97 2i82 s THR 203 Ca 0.34 -0.68 -0.36 0.00 -1.18 0.00 0.00 61.69 59.82 2i82 s THR 203 Cb 0.01 -2.26 -0.15 0.00 1.34 0.00 0.00 72.50 71.44 2i82 s THR 203 CO 0.22 0.56 1.48 1.57 -0.54 0.00 0.00 174.62 177.91 2i82 n HIS 204 N 2.87 1.88 0.01 3.99 -0.00 0.12 -4.80 115.22 119.28 2i82 n HIS 204 Ca -0.18 0.46 0.11 0.00 0.46 0.00 0.00 57.72 58.57 2i82 n HIS 204 Cb 0.52 -2.44 0.54 0.00 -0.12 0.00 0.00 29.99 28.49 2i82 n HIS 204 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 2i82 h PRO 205 N 5.45 0.30 0.00 1.57 0.11 -1.92 0.17 132.00 137.68 2i82 h PRO 205 Ca -0.47 -0.02 -0.30 0.00 0.11 0.00 0.00 66.00 65.33 2i82 h PRO 205 Cb 1.30 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.29 2i82 h PRO 205 CO 0.84 0.20 -2.11 0.00 -0.21 0.00 0.00 178.00 176.72 2i82 n ALA 206 N -2.53 1.60 0.35 -0.75 0.00 -1.26 -4.65 120.51 113.28 2i82 n ALA 206 Ca 0.06 -1.07 0.07 0.00 0.00 0.00 0.00 53.44 52.51 2i82 n ALA 206 Cb 0.29 -0.09 -0.10 0.00 0.00 0.00 0.00 19.45 19.55 2i82 n ALA 206 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2i82 n TYR 207 N -2.61 0.00 -0.88 0.00 0.53 -1.22 -5.02 117.16 107.96 2i82 n TYR 207 Ca -0.26 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.62 2i82 n TYR 207 Cb 1.02 -0.17 0.00 0.00 -1.03 0.00 0.00 39.34 39.16 2i82 n TYR 207 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2i82 n GLY 208 N 1.49 0.59 3.81 2.72 0.00 0.58 -4.94 105.19 109.44 2i82 n GLY 208 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2i82 n GLY 208 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i82 s ASN 209 N -2.51 7.03 1.05 1.61 4.22 -1.26 -4.50 114.94 120.58 2i82 s ASN 209 Ca 0.00 1.68 -0.15 0.00 -2.14 0.00 0.00 52.86 52.25 2i82 s ASN 209 Cb 0.00 -2.53 0.21 0.00 1.28 0.00 0.00 41.25 40.21 2i82 s ASN 209 CO 0.00 -0.26 1.15 -0.55 -2.04 0.00 0.00 177.10 175.40 2i82 s SER 210 N -2.03 2.30 -0.29 3.54 0.15 -1.26 -0.70 113.70 115.41 2i82 s SER 210 Ca 0.58 0.76 -0.16 0.00 0.70 0.00 0.00 55.95 57.83 2i82 s SER 210 Cb -0.12 -1.15 0.15 0.00 -1.71 0.00 0.00 66.02 63.19 2i82 s SER 210 CO 0.16 -3.29 0.99 -0.89 1.20 0.00 0.00 173.24 171.41 2i82 s THR 212 N -3.22 0.00 -0.01 6.45 2.01 -1.26 -4.92 115.64 114.69 2i82 s THR 212 Ca 0.68 0.00 0.06 0.00 0.31 0.00 0.00 61.69 62.74 2i82 s THR 212 Cb -0.12 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.36 2i82 s THR 212 CO 0.55 0.00 -0.18 -0.36 -0.69 0.00 0.00 174.62 173.94 2i82 s PHE 213 N 1.28 2.58 0.09 4.92 0.40 0.53 -4.97 117.98 122.82 2i82 s PHE 213 Ca -0.08 -0.25 0.03 0.00 -0.60 0.00 0.00 56.93 56.03 2i82 s PHE 213 Cb -0.04 -1.55 -0.04 0.00 0.51 0.00 0.00 43.02 41.91 2i82 s PHE 213 CO -0.14 0.17 -0.10 0.15 0.70 0.00 0.00 175.22 176.00 2i82 s LYS 214 N -0.96 0.82 -0.23 0.44 1.02 -1.26 -1.36 119.74 118.21 2i82 s LYS 214 Ca 0.12 -1.14 -0.06 0.00 0.02 0.00 0.00 55.97 54.91 2i82 s LYS 214 Cb -0.10 -0.49 0.11 0.00 -0.52 0.00 0.00 37.83 36.83 2i82 s LYS 214 CO 0.02 0.07 0.46 0.00 -0.92 0.00 0.00 175.35 174.98 2i82 s ALA 215 N -2.44 -1.34 0.37 5.17 0.00 -0.24 -5.04 121.76 118.24 2i82 s ALA 215 Ca 0.05 1.56 -0.27 0.00 0.00 0.00 0.00 51.96 53.30 2i82 s ALA 215 Cb -0.03 -1.49 -0.09 0.00 0.00 0.00 0.00 23.12 21.51 2i82 s ALA 215 CO -0.00 -0.89 1.24 -1.25 0.00 0.00 0.00 175.76 174.86 2i82 s PRO 216 N 2.66 4.19 0.68 0.00 0.04 -1.26 -4.43 135.00 136.88 2i82 s PRO 216 Ca 0.01 2.05 -0.15 0.00 0.04 0.00 0.00 61.00 62.95 2i82 s PRO 216 Cb -0.13 -2.89 0.01 0.00 0.04 0.00 0.00 34.50 31.54 2i82 s PRO 216 CO -0.15 -0.27 1.13 0.00 0.04 0.00 0.00 177.00 177.76 2i82 s ALA 217 N -1.25 2.38 -2.10 8.56 0.00 -1.26 -4.94 121.76 123.15 2i82 s ALA 217 Ca 0.53 0.63 0.28 0.00 0.00 0.00 0.00 51.96 53.39 2i82 s ALA 217 Cb -0.36 -3.35 0.98 0.00 0.00 0.00 0.00 23.12 20.39 2i82 s ALA 217 CO 0.46 -1.42 1.70 -0.25 0.00 0.00 0.00 175.76 176.26 2i82 n ASP 218 N -2.49 1.15 0.00 0.00 9.92 -1.26 -5.20 116.55 118.67 2i82 n ASP 218 Ca 0.11 -1.15 0.00 0.00 -0.53 0.00 0.00 54.79 53.22 2i82 n ASP 218 Cb 0.52 0.05 0.00 0.00 -0.64 0.00 0.00 41.12 41.04 2i82 n ASP 218 CO 0.00 0.00 0.00 2.22 0.13 0.00 0.00 177.20 179.55