#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r3c s ARG 5 N 0.00 4.64 0.94 3.44 3.52 -1.26 -5.03 118.95 125.20 1r3c s ARG 5 Ca 0.00 1.68 -0.12 0.00 -0.13 0.00 0.00 55.73 57.16 1r3c s ARG 5 Cb 0.00 -3.28 0.15 0.00 -1.56 0.00 0.00 34.95 30.27 1r3c s ARG 5 CO 0.00 0.16 1.09 -2.14 -0.81 0.00 0.00 175.30 173.60 1r3c s PRO 6 N -0.58 0.92 -0.11 5.12 0.02 -1.26 -5.00 135.00 134.12 1r3c s PRO 6 Ca 0.47 0.80 -0.17 0.00 0.02 0.00 0.00 61.00 62.12 1r3c s PRO 6 Cb -0.29 -1.77 -0.04 0.00 0.02 0.00 0.00 34.50 32.42 1r3c s PRO 6 CO 0.35 -2.47 0.45 0.99 -0.33 0.00 0.00 177.00 176.00 1r3c s THR 7 N -2.89 5.17 0.10 0.99 2.01 -1.26 -4.99 115.64 114.77 1r3c s THR 7 Ca 0.64 0.91 0.03 0.00 0.31 0.00 0.00 61.69 63.58 1r3c s THR 7 Cb -0.19 -3.79 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 1r3c s THR 7 CO 0.58 0.36 0.11 -0.36 -0.69 0.00 0.00 174.62 174.62 1r3c s PHE 8 N 0.40 3.21 0.07 4.92 0.40 -1.26 -0.81 117.98 124.92 1r3c s PHE 8 Ca 0.25 0.07 0.05 0.00 -0.60 0.00 0.00 56.93 56.69 1r3c s PHE 8 Cb -0.15 -1.61 -0.03 0.00 0.51 0.00 0.00 43.02 41.74 1r3c s PHE 8 CO 0.10 0.53 -0.13 1.52 0.70 0.00 0.00 175.22 177.93 1r3c s TYR 9 N -1.50 1.16 0.07 0.36 1.13 -0.41 -4.91 117.35 113.24 1r3c s TYR 9 Ca 0.30 -0.46 0.01 0.00 -1.41 0.00 0.00 57.07 55.51 1r3c s TYR 9 Cb -0.12 -0.65 -0.04 0.00 -1.10 0.00 0.00 41.96 40.05 1r3c s TYR 9 CO 0.23 0.04 0.15 1.03 -2.51 0.00 0.00 175.55 174.50 1r3c s ARG 10 N -1.70 3.21 -0.23 -3.49 0.52 -1.26 -2.16 118.95 113.84 1r3c s ARG 10 Ca -0.03 -0.54 -0.21 0.00 -0.52 0.00 0.00 55.73 54.44 1r3c s ARG 10 Cb -0.10 -2.91 0.06 0.00 0.52 0.00 0.00 34.95 32.52 1r3c s ARG 10 CO 0.02 0.59 0.60 -1.14 0.02 0.00 0.00 175.30 175.40 1r3c s GLN 11 N -2.44 0.70 -0.50 3.54 0.74 0.11 -4.96 119.66 116.85 1r3c s GLN 11 Ca 0.32 0.84 -0.23 0.00 0.05 0.00 0.00 55.36 56.35 1r3c s GLN 11 Cb -0.13 0.34 0.04 0.00 1.10 0.00 0.00 33.01 34.36 1r3c s GLN 11 CO 0.25 -0.09 0.81 -2.00 -0.55 0.00 0.00 175.29 173.72 1r3c s GLU 12 N 0.35 3.32 0.05 1.67 2.12 -1.26 0.30 118.70 125.25 1r3c s GLU 12 Ca -0.00 -0.32 0.03 0.00 0.36 0.00 0.00 54.97 55.03 1r3c s GLU 12 Cb -0.04 -4.01 -0.03 0.00 0.26 0.00 0.00 34.13 30.31 1r3c s GLU 12 CO 0.00 -1.28 -0.09 -0.51 -0.54 0.00 0.00 175.26 172.85 1r3c s LEU 13 N 3.41 2.26 -1.36 2.70 1.02 0.58 -4.82 118.68 122.46 1r3c s LEU 13 Ca 0.27 -0.56 -0.02 0.00 0.02 0.00 0.00 54.13 53.83 1r3c s LEU 13 Cb -0.14 -0.24 0.02 0.00 0.02 0.00 0.00 46.19 45.85 1r3c s LEU 13 CO 0.19 -0.18 0.71 0.59 0.02 0.00 0.00 176.35 177.69 1r3c n ASN 14 N 1.42 -1.68 0.00 2.29 3.02 -1.26 -0.54 115.26 118.51 1r3c n ASN 14 Ca -0.22 -0.84 0.00 0.00 -0.03 0.00 0.00 54.58 53.49 1r3c n ASN 14 Cb 0.54 -3.91 0.00 0.00 -0.61 0.00 0.00 39.78 35.81 1r3c n ASN 14 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1r3c n LYS 15 N -4.36 -1.81 -4.28 3.52 2.85 -1.26 -4.88 118.16 107.94 1r3c n LYS 15 Ca -0.24 0.25 -0.17 0.00 -1.05 0.00 0.00 58.31 57.10 1r3c n LYS 15 Cb 0.65 -3.78 -0.10 0.00 -0.65 0.00 0.00 35.03 31.15 1r3c n LYS 15 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 177.40 177.27 1r3c s THR 16 N -0.55 1.40 -0.10 0.58 -1.32 0.30 -5.12 115.64 110.82 1r3c s THR 16 Ca 0.00 -2.01 -0.26 0.00 -1.21 0.00 0.00 61.69 58.21 1r3c s THR 16 Cb 0.00 -1.82 -0.02 0.00 -1.51 0.00 0.00 72.50 69.15 1r3c s THR 16 CO 0.00 -0.60 0.84 -0.63 -2.21 0.00 0.00 174.62 172.01 1r3c s ILE 17 N -2.87 4.92 -0.17 5.08 1.01 -1.26 -0.31 121.20 127.59 1r3c s ILE 17 Ca 0.16 1.69 -0.05 0.00 0.00 0.00 0.00 60.65 62.46 1r3c s ILE 17 Cb -0.01 -4.16 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 1r3c s ILE 17 CO 0.03 0.11 -0.01 0.26 0.00 0.00 0.00 174.94 175.34 1r3c s TRP 18 N 1.55 3.07 -0.26 3.97 0.52 0.15 -4.93 118.94 123.01 1r3c s TRP 18 Ca 0.41 -0.26 0.03 0.00 0.02 0.00 0.00 56.10 56.30 1r3c s TRP 18 Cb -0.18 -2.02 0.06 0.00 -1.15 0.00 0.00 33.47 30.19 1r3c s TRP 18 CO 0.17 -0.05 -0.08 -2.00 0.02 0.00 0.00 176.95 175.01 1r3c s GLU 19 N 0.53 2.01 0.14 4.98 2.12 -1.26 -0.71 118.70 126.52 1r3c s GLU 19 Ca -0.01 -1.33 0.03 0.00 0.36 0.00 0.00 54.97 54.01 1r3c s GLU 19 Cb -0.14 -2.85 -0.04 0.00 0.26 0.00 0.00 34.13 31.36 1r3c s GLU 19 CO 0.02 -0.62 -0.05 0.14 -0.54 0.00 0.00 175.26 174.21 1r3c s VAL 20 N 1.15 0.83 0.46 3.70 -7.23 -0.92 -4.63 120.40 113.76 1r3c s VAL 20 Ca -0.06 -1.99 -0.24 0.00 -1.81 0.00 0.00 61.98 57.88 1r3c s VAL 20 Cb -0.20 -1.90 -0.07 0.00 0.56 0.00 0.00 36.38 34.77 1r3c s VAL 20 CO -0.06 -0.68 1.34 -2.84 -0.31 0.00 0.00 175.10 172.55 1r3c s PRO 21 N -3.84 3.64 0.54 4.82 0.02 -1.26 -1.29 135.00 137.63 1r3c s PRO 21 Ca 0.18 2.20 0.33 0.00 0.02 0.00 0.00 61.00 63.73 1r3c s PRO 21 Cb 0.05 -2.55 1.50 0.00 0.02 0.00 0.00 34.50 33.52 1r3c s PRO 21 CO 0.00 -0.78 1.85 0.93 -0.33 0.00 0.00 177.00 178.68 1r3c h GLU 22 N 2.18 0.00 -0.38 5.54 5.08 -1.32 -0.33 114.58 125.34 1r3c h GLU 22 Ca -0.50 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 57.97 1r3c h GLU 22 Cb 1.27 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.50 1r3c h GLU 22 CO 0.60 0.00 0.29 0.07 -1.00 0.00 0.00 179.01 178.97 1r3c h ARG 23 N 0.00 0.00 -5.61 2.33 0.11 -1.89 -3.38 114.38 105.94 1r3c h ARG 23 Ca 0.46 0.00 -0.62 0.00 0.10 0.00 0.00 59.98 59.92 1r3c h ARG 23 Cb 1.90 0.00 -0.12 0.00 1.11 0.00 0.00 29.97 32.86 1r3c h ARG 23 CO -0.00 0.00 0.24 0.71 0.10 0.00 0.00 179.97 181.01 1r3c s TYR 24 N -4.98 3.15 0.25 4.08 2.02 -0.14 -1.41 117.35 120.32 1r3c s TYR 24 Ca -0.05 0.49 0.11 0.00 -0.37 0.00 0.00 57.07 57.25 1r3c s TYR 24 Cb 0.19 -3.21 -0.05 0.00 -0.40 0.00 0.00 41.96 38.49 1r3c s TYR 24 CO 0.70 -0.63 -0.19 -0.65 -1.57 0.00 0.00 175.55 173.20 1r3c s GLN 25 N 2.84 1.56 -1.26 -0.62 -1.52 -0.25 -4.83 119.66 115.58 1r3c s GLN 25 Ca 0.27 -1.68 -0.03 0.00 -1.95 0.00 0.00 55.36 51.97 1r3c s GLN 25 Cb -0.14 -1.62 0.00 0.00 -0.22 0.00 0.00 33.01 31.04 1r3c s GLN 25 CO 0.15 0.30 1.06 0.09 -0.25 0.00 0.00 175.29 176.64 1r3c n ASN 26 N -0.41 -3.54 -4.72 5.90 3.02 -1.26 -0.27 115.26 113.97 1r3c n ASN 26 Ca -0.07 -0.60 -0.42 0.00 -0.03 0.00 0.00 54.58 53.46 1r3c n ASN 26 Cb 0.59 -5.05 -0.03 0.00 -0.61 0.00 0.00 39.78 34.68 1r3c n ASN 26 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1r3c s LEU 27 N -6.71 4.37 -0.13 3.41 1.02 -1.26 -4.47 118.68 114.92 1r3c s LEU 27 Ca 0.21 2.75 -0.03 0.00 0.02 0.00 0.00 54.13 57.08 1r3c s LEU 27 Cb -0.09 -3.60 0.05 0.00 0.02 0.00 0.00 46.19 42.56 1r3c s LEU 27 CO 0.73 -0.89 0.05 -0.55 0.02 0.00 0.00 176.35 175.71 1r3c s SER 28 N 1.07 2.07 0.26 2.29 0.15 -0.16 -4.95 113.70 114.43 1r3c s SER 28 Ca 0.71 -0.40 -0.31 0.00 0.70 0.00 0.00 55.95 56.66 1r3c s SER 28 Cb -0.46 -0.37 -0.13 0.00 -1.71 0.00 0.00 66.02 63.35 1r3c s SER 28 CO 0.33 -0.28 1.47 -0.81 1.20 0.00 0.00 173.24 175.16 1r3c n PRO 29 N 5.18 2.27 0.00 5.44 -0.04 -1.26 -0.93 135.00 145.66 1r3c n PRO 29 Ca -0.07 0.81 0.00 0.00 -0.04 0.00 0.00 63.50 64.20 1r3c n PRO 29 Cb 0.49 -2.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.44 1r3c n PRO 29 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1r3c n VAL 30 N 1.96 0.00 0.00 0.52 0.24 -0.70 -4.85 118.33 115.51 1r3c n VAL 30 Ca 0.10 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.21 1r3c n VAL 30 Cb 0.33 1.53 0.00 0.00 -1.47 0.00 0.00 33.84 34.23 1r3c n VAL 30 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1r3c n GLY 31 N 0.05 1.33 3.63 7.63 0.00 -1.18 -5.01 105.19 111.64 1r3c n GLY 31 Ca 0.00 -0.80 -0.11 0.00 0.00 0.00 0.00 46.02 45.11 1r3c n GLY 31 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1r3c s SER 32 N 0.00 -0.66 0.25 1.61 1.04 -1.26 -0.47 113.70 114.21 1r3c s SER 32 Ca 0.00 1.24 0.04 0.00 0.48 0.00 0.00 55.95 57.71 1r3c s SER 32 Cb 0.00 1.26 -0.01 0.00 0.10 0.00 0.00 66.02 67.37 1r3c s SER 32 CO 0.00 -0.21 0.13 0.61 0.98 0.00 0.00 173.24 174.75 1r3c n GLY 33 N 2.75 3.43 0.32 7.32 0.00 0.48 -4.99 105.19 114.50 1r3c n GLY 33 Ca -0.14 -1.95 0.20 0.00 0.00 0.00 0.00 46.02 44.13 1r3c n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r3c h ALA 34 N 1.56 1.07 0.04 4.61 0.00 -2.02 -2.59 119.26 121.93 1r3c h ALA 34 Ca -0.19 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.44 1r3c h ALA 34 Cb 0.81 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1r3c h ALA 34 CO 0.29 0.01 -1.44 0.10 0.00 0.00 0.00 179.25 178.22 1r3c h TYR 35 N 0.00 0.16 0.00 0.00 -0.00 -1.95 -3.45 116.97 111.73 1r3c h TYR 35 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 58.73 58.61 1r3c h TYR 35 Cb 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 36.73 36.86 1r3c h TYR 35 CO 0.00 1.15 0.00 0.41 -0.00 0.00 0.00 178.16 179.72 1r3c n GLY 36 N 1.54 -0.31 3.79 0.10 0.00 -0.98 -1.59 105.19 107.74 1r3c n GLY 36 Ca -0.12 -1.14 -0.32 0.00 0.00 0.00 0.00 46.02 44.45 1r3c n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1r3c s SER 37 N 0.00 5.68 -0.01 1.61 0.01 -0.16 -0.39 113.70 120.45 1r3c s SER 37 Ca 0.00 0.11 0.07 0.00 1.31 0.00 0.00 55.95 57.44 1r3c s SER 37 Cb 0.00 -1.61 -0.02 0.00 0.21 0.00 0.00 66.02 64.60 1r3c s SER 37 CO 0.00 0.23 -0.22 -0.69 0.41 0.00 0.00 173.24 172.98 1r3c s VAL 38 N -1.28 1.71 -0.02 3.43 1.01 0.38 -0.22 120.40 125.42 1r3c s VAL 38 Ca 0.26 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.29 1r3c s VAL 38 Cb -0.12 -1.43 -0.00 0.00 0.00 0.00 0.00 36.38 34.82 1r3c s VAL 38 CO 0.17 0.44 -0.10 0.00 0.00 0.00 0.00 175.10 175.61 1r3c s ALA 40 N -0.07 3.25 0.27 0.00 0.00 -0.11 0.48 121.76 125.59 1r3c s ALA 40 Ca 0.01 0.11 -0.18 0.00 0.00 0.00 0.00 51.96 51.90 1r3c s ALA 40 Cb -0.06 -2.86 0.01 0.00 0.00 0.00 0.00 23.12 20.21 1r3c s ALA 40 CO 0.00 0.25 0.64 0.00 0.00 0.00 0.00 175.76 176.65 1r3c s ALA 41 N -2.08 -0.91 -0.20 0.00 0.00 0.30 -0.98 121.76 117.88 1r3c s ALA 41 Ca 0.56 -0.49 -0.04 0.00 0.00 0.00 0.00 51.96 51.99 1r3c s ALA 41 Cb -0.10 0.92 -0.01 0.00 0.00 0.00 0.00 23.12 23.93 1r3c s ALA 41 CO 0.18 -0.98 -0.04 0.12 0.00 0.00 0.00 175.76 175.04 1r3c s PHE 42 N -3.95 2.97 -0.51 0.00 5.36 0.62 -0.69 117.98 121.78 1r3c s PHE 42 Ca 0.15 -0.75 -0.20 0.00 -0.96 0.00 0.00 56.93 55.17 1r3c s PHE 42 Cb -0.04 -2.07 0.05 0.00 -0.34 0.00 0.00 43.02 40.62 1r3c s PHE 42 CO 0.08 -0.41 0.69 0.34 -1.46 0.00 0.00 175.22 174.45 1r3c s ASP 43 N 1.18 6.25 0.54 6.13 2.15 -0.23 -1.09 116.67 131.60 1r3c s ASP 43 Ca 0.02 -0.76 0.29 0.00 0.43 0.00 0.00 52.55 52.53 1r3c s ASP 43 Cb -0.14 -2.32 1.52 0.00 -0.30 0.00 0.00 42.92 41.67 1r3c s ASP 43 CO -0.01 -0.95 2.09 0.71 -0.17 0.00 0.00 175.17 176.85 1r3c h THR 44 N 5.89 0.51 -0.03 1.71 1.35 -1.54 0.49 112.91 121.29 1r3c h THR 44 Ca -0.27 -0.47 -0.22 0.00 -0.55 0.00 0.00 66.41 64.90 1r3c h THR 44 Cb 1.09 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 1r3c h THR 44 CO 0.98 0.10 -0.89 0.50 -0.25 0.00 0.00 175.52 175.96 1r3c h LYS 45 N 0.00 0.44 0.00 4.72 3.64 -1.91 -3.36 116.57 120.10 1r3c h LYS 45 Ca -0.00 -0.43 -0.04 0.00 -1.27 0.00 0.00 60.65 58.91 1r3c h LYS 45 Cb 0.31 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1r3c h LYS 45 CO 0.01 1.09 -1.76 0.25 -2.27 0.00 0.00 179.45 176.77 1r3c n THR 46 N -3.78 0.14 -0.87 1.00 -2.24 -1.05 -4.98 114.28 102.51 1r3c n THR 46 Ca -0.06 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 1r3c n THR 46 Cb 0.80 0.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 1r3c n THR 46 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r3c n GLY 47 N 1.67 0.55 3.92 3.38 0.00 0.17 -5.03 105.19 109.85 1r3c n GLY 47 Ca -0.06 -0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 1r3c n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r3c s LEU 48 N 0.00 4.33 -0.01 0.99 1.43 -1.18 -4.89 118.68 119.35 1r3c s LEU 48 Ca 0.00 0.31 -0.25 0.00 -1.03 0.00 0.00 54.13 53.16 1r3c s LEU 48 Cb 0.00 -3.02 -0.04 0.00 0.03 0.00 0.00 46.19 43.16 1r3c s LEU 48 CO 0.00 0.12 0.77 -0.13 0.23 0.00 0.00 176.35 177.34 1r3c s ARG 49 N -2.69 4.48 0.14 1.70 1.81 -1.26 -1.07 118.95 122.06 1r3c s ARG 49 Ca 0.36 1.04 0.03 0.00 -1.72 0.00 0.00 55.73 55.44 1r3c s ARG 49 Cb -0.12 -3.41 -0.04 0.00 -0.45 0.00 0.00 34.95 30.92 1r3c s ARG 49 CO 0.28 0.15 -0.06 0.14 -0.68 0.00 0.00 175.30 175.13 1r3c s VAL 50 N 0.45 0.89 -0.22 3.52 -7.23 0.14 -1.47 120.40 116.47 1r3c s VAL 50 Ca 0.40 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.51 1r3c s VAL 50 Cb -0.19 -1.90 -0.02 0.00 0.56 0.00 0.00 36.38 34.82 1r3c s VAL 50 CO 0.22 -0.69 0.02 0.00 -0.31 0.00 0.00 175.10 174.34 1r3c s ALA 51 N -3.51 3.07 -0.27 1.32 0.00 0.36 -0.54 121.76 122.19 1r3c s ALA 51 Ca 0.18 -1.04 -0.06 0.00 0.00 0.00 0.00 51.96 51.03 1r3c s ALA 51 Cb 0.05 -1.88 -0.01 0.00 0.00 0.00 0.00 23.12 21.28 1r3c s ALA 51 CO 0.00 -0.28 0.06 0.08 0.00 0.00 0.00 175.76 175.62 1r3c s VAL 52 N 1.22 3.99 -0.24 0.00 1.01 0.18 -1.62 120.40 124.93 1r3c s VAL 52 Ca 0.04 -0.47 -0.06 0.00 0.00 0.00 0.00 61.98 61.48 1r3c s VAL 52 Cb -0.15 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 1r3c s VAL 52 CO 0.02 0.23 0.03 -0.75 0.00 0.00 0.00 175.10 174.63 1r3c s LYS 53 N 1.54 3.56 -0.29 2.72 2.20 0.50 -0.45 119.74 129.51 1r3c s LYS 53 Ca 0.05 -0.53 -0.12 0.00 -0.36 0.00 0.00 55.97 55.00 1r3c s LYS 53 Cb -0.16 -3.21 -0.04 0.00 -1.51 0.00 0.00 37.83 32.91 1r3c s LYS 53 CO 0.02 -0.19 0.25 0.21 -0.36 0.00 0.00 175.35 175.28 1r3c s LYS 54 N 1.56 3.91 0.45 4.03 2.20 0.70 -0.34 119.74 132.24 1r3c s LYS 54 Ca 0.06 -0.26 -0.22 0.00 -0.36 0.00 0.00 55.97 55.19 1r3c s LYS 54 Cb -0.15 -3.68 -0.08 0.00 -1.51 0.00 0.00 37.83 32.41 1r3c s LYS 54 CO 0.01 -0.25 1.08 -0.51 -0.36 0.00 0.00 175.35 175.33 1r3c s LEU 55 N 1.85 3.99 -0.27 5.43 1.43 -0.57 -0.99 118.68 129.56 1r3c s LEU 55 Ca 0.09 2.08 -0.11 0.00 -1.03 0.00 0.00 54.13 55.16 1r3c s LEU 55 Cb -0.16 -4.34 -0.05 0.00 0.03 0.00 0.00 46.19 41.67 1r3c s LEU 55 CO 0.11 -0.73 0.18 -0.94 0.23 0.00 0.00 176.35 175.19 1r3c s SER 56 N -1.65 6.02 -0.99 2.29 1.04 -0.62 -4.54 113.70 115.25 1r3c s SER 56 Ca 0.63 0.02 -0.14 0.00 0.48 0.00 0.00 55.95 56.94 1r3c s SER 56 Cb -0.22 -2.11 0.02 0.00 0.10 0.00 0.00 66.02 63.81 1r3c s SER 56 CO 0.27 -0.01 0.66 0.54 0.98 0.00 0.00 173.24 175.67 1r3c n ARG 57 N 4.82 -1.03 0.30 4.02 1.74 -1.26 -4.81 116.66 120.43 1r3c n ARG 57 Ca -0.14 0.53 0.19 0.00 -0.77 0.00 0.00 57.85 57.65 1r3c n ARG 57 Cb 0.52 -2.73 0.90 0.00 -1.02 0.00 0.00 32.46 30.12 1r3c n ARG 57 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1r3c h PRO 58 N -1.24 0.00 -0.56 5.56 0.13 -1.82 -3.06 132.00 131.01 1r3c h PRO 58 Ca -0.63 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.09 1r3c h PRO 58 Cb 1.38 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 32.16 1r3c h PRO 58 CO 0.43 0.02 -0.80 1.19 -0.23 0.00 0.00 178.00 178.61 1r3c n PHE 59 N -3.17 2.02 0.25 1.56 3.72 -1.26 -2.34 117.46 118.25 1r3c n PHE 59 Ca -0.01 -2.03 0.13 0.00 -0.05 0.00 0.00 57.45 55.49 1r3c n PHE 59 Cb 0.21 -0.31 0.28 0.00 -0.94 0.00 0.00 39.48 38.72 1r3c n PHE 59 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1r3c h GLN 60 N 1.97 0.00 -3.34 -1.08 3.07 -1.88 -3.46 115.11 110.39 1r3c h GLN 60 Ca 0.24 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.97 1r3c h GLN 60 Cb 1.42 0.00 -0.07 0.00 0.08 0.00 0.00 27.48 28.92 1r3c h GLN 60 CO 0.55 0.00 0.06 -1.54 0.09 0.00 0.00 178.83 177.98 1r3c s SER 61 N -6.03 -0.13 0.15 0.06 1.04 -1.26 -5.01 113.70 102.52 1r3c s SER 61 Ca 0.06 -0.81 -0.16 0.00 0.48 0.00 0.00 55.95 55.52 1r3c s SER 61 Cb 0.06 0.67 0.01 0.00 0.10 0.00 0.00 66.02 66.86 1r3c s SER 61 CO 0.64 -1.27 1.77 0.40 0.98 0.00 0.00 173.24 175.76 1r3c h ILE 62 N 2.12 1.14 -0.40 -1.02 2.04 -1.94 0.85 117.51 120.30 1r3c h ILE 62 Ca -0.23 -0.34 0.06 0.00 1.00 0.00 0.00 64.86 65.34 1r3c h ILE 62 Cb 1.25 0.63 -0.05 0.00 -0.74 0.00 0.00 36.82 37.91 1r3c h ILE 62 CO 0.30 0.14 0.11 0.40 0.00 0.00 0.00 178.15 179.10 1r3c h ILE 63 N 0.53 0.83 -0.40 -0.67 1.08 -1.97 0.56 117.51 117.48 1r3c h ILE 63 Ca 0.14 -0.09 -0.14 0.00 -0.39 0.00 0.00 64.86 64.39 1r3c h ILE 63 Cb 0.02 0.56 -0.01 0.00 -3.07 0.00 0.00 36.82 34.33 1r3c h ILE 63 CO -0.03 0.05 -0.30 0.45 -0.69 0.00 0.00 178.15 177.63 1r3c h HIS 64 N 0.25 1.07 -0.53 1.37 3.86 -1.78 -1.72 115.15 117.66 1r3c h HIS 64 Ca 0.19 -0.30 -0.01 0.00 -1.16 0.00 0.00 60.37 59.09 1r3c h HIS 64 Cb 0.20 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.42 1r3c h HIS 64 CO -0.18 1.11 0.30 0.00 0.86 0.00 0.00 177.93 180.02 1r3c h ALA 65 N 0.79 0.68 -0.33 2.45 0.00 -0.43 0.11 119.26 122.54 1r3c h ALA 65 Ca 0.08 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1r3c h ALA 65 Cb 0.88 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1r3c h ALA 65 CO 0.08 0.19 -0.17 -0.22 0.00 0.00 0.00 179.25 179.12 1r3c h LYS 66 N 0.71 0.59 -0.51 0.00 3.64 -0.86 -1.31 116.57 118.84 1r3c h LYS 66 Ca 0.19 -0.20 -0.11 0.00 -1.27 0.00 0.00 60.65 59.25 1r3c h LYS 66 Cb 0.02 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 1r3c h LYS 66 CO -0.03 0.74 -0.13 -0.09 -2.27 0.00 0.00 179.45 177.67 1r3c h ARG 67 N 0.53 0.98 -0.29 1.90 2.43 -0.75 0.28 114.38 119.46 1r3c h ARG 67 Ca 0.09 -0.37 -0.02 0.00 -0.81 0.00 0.00 59.98 58.87 1r3c h ARG 67 Cb 0.60 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1r3c h ARG 67 CO 0.04 1.04 0.11 1.15 -1.51 0.00 0.00 179.97 180.80 1r3c h THR 68 N 0.86 1.19 -0.33 0.20 2.02 -0.40 0.12 112.91 116.57 1r3c h THR 68 Ca 0.13 -0.58 0.01 0.00 0.77 0.00 0.00 66.41 66.74 1r3c h THR 68 Cb 0.69 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 68.10 1r3c h THR 68 CO 0.05 0.20 0.21 0.22 0.37 0.00 0.00 175.52 176.57 1r3c h TYR 69 N 0.32 0.40 0.07 3.16 3.20 -1.06 -1.35 116.97 121.71 1r3c h TYR 69 Ca 0.10 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.00 1r3c h TYR 69 Cb 0.20 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.31 1r3c h TYR 69 CO -0.00 0.25 -0.23 -0.09 -1.64 0.00 0.00 178.16 176.45 1r3c h ARG 70 N 0.43 -0.38 -0.68 1.82 2.43 -0.08 0.02 114.38 117.94 1r3c h ARG 70 Ca 0.12 0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.34 1r3c h ARG 70 Cb -0.04 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.56 1r3c h ARG 70 CO -0.03 -0.26 0.43 1.49 -1.51 0.00 0.00 179.97 180.09 1r3c h GLU 71 N -0.40 0.82 -0.24 0.20 4.81 -0.85 -0.96 114.58 117.97 1r3c h GLU 71 Ca 0.04 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1r3c h GLU 71 Cb 0.44 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1r3c h GLU 71 CO -0.16 0.55 0.08 1.25 -0.73 0.00 0.00 179.01 180.00 1r3c h LEU 72 N 0.85 0.34 -0.85 1.64 5.85 -0.90 -0.83 115.31 121.41 1r3c h LEU 72 Ca 0.27 -0.19 0.03 0.00 0.84 0.00 0.00 57.88 58.82 1r3c h LEU 72 Cb -0.01 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 40.88 1r3c h LEU 72 CO -0.09 0.44 0.55 0.03 -0.34 0.00 0.00 178.44 179.03 1r3c h ARG 73 N 0.22 1.06 0.16 1.25 2.47 -0.77 -0.63 114.38 118.13 1r3c h ARG 73 Ca 0.08 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 58.73 1r3c h ARG 73 Cb 0.22 -0.24 0.00 0.00 -1.65 0.00 0.00 29.97 28.30 1r3c h ARG 73 CO -0.00 0.70 -0.08 1.25 0.56 0.00 0.00 179.97 182.40 1r3c h LEU 74 N 1.09 -0.18 -1.36 3.04 5.85 -0.99 -2.31 115.31 120.44 1r3c h LEU 74 Ca 0.33 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 1r3c h LEU 74 Cb -0.03 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 1r3c h LEU 74 CO -0.10 0.12 0.07 -0.07 -0.34 0.00 0.00 178.44 178.12 1r3c h LEU 75 N -0.49 0.46 -1.29 2.25 3.38 -1.01 -1.74 115.31 116.87 1r3c h LEU 75 Ca -0.02 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 1r3c h LEU 75 Cb 0.38 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1r3c h LEU 75 CO 0.04 0.48 -0.33 0.11 0.09 0.00 0.00 178.44 178.82 1r3c h LYS 76 N 0.50 0.00 0.15 1.13 1.57 -1.03 -3.14 116.57 115.74 1r3c h LYS 76 Ca 0.12 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.61 1r3c h LYS 76 Cb 0.21 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.53 1r3c h LYS 76 CO -0.00 0.33 -1.27 1.25 -0.57 0.00 0.00 179.45 179.19 1r3c h HIS 77 N 0.00 0.61 -2.43 -1.35 2.76 -0.74 -3.45 115.15 110.54 1r3c h HIS 77 Ca -0.00 -0.44 -0.56 0.00 -2.20 0.00 0.00 60.37 57.17 1r3c h HIS 77 Cb 0.67 -0.03 -0.02 0.00 1.55 0.00 0.00 27.41 29.58 1r3c h HIS 77 CO 0.00 1.33 1.34 -1.64 -1.30 0.00 0.00 177.93 177.66 1r3c s MET 78 N -2.69 3.15 -0.56 5.26 -1.94 -1.00 -4.91 119.30 116.60 1r3c s MET 78 Ca -0.05 1.41 0.05 0.00 -1.71 0.00 0.00 55.69 55.39 1r3c s MET 78 Cb 0.07 -4.27 0.18 0.00 2.01 0.00 0.00 34.83 32.82 1r3c s MET 78 CO 0.90 -2.08 0.45 1.63 -0.01 0.00 0.00 175.02 175.91 1r3c n LYS 79 N 8.60 1.10 -3.72 2.03 4.76 -1.26 -4.40 118.16 125.27 1r3c n LYS 79 Ca 0.24 -3.86 -0.13 0.00 -2.87 0.00 0.00 58.31 51.69 1r3c n LYS 79 Cb 0.48 -1.96 -0.09 0.00 -1.84 0.00 0.00 35.03 31.61 1r3c n LYS 79 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1r3c s HIS 80 N -0.86 -0.44 0.35 2.13 2.46 -1.26 -5.05 115.29 112.62 1r3c s HIS 80 Ca 0.30 1.03 0.11 0.00 0.47 0.00 0.00 55.06 56.97 1r3c s HIS 80 Cb 0.02 0.17 0.89 0.00 -0.13 0.00 0.00 32.58 33.52 1r3c s HIS 80 CO -0.17 -0.27 1.81 0.93 -2.47 0.00 0.00 174.74 174.56 1r3c h GLU 81 N 5.08 0.60 -0.61 2.88 5.08 -1.98 -1.97 114.58 123.66 1r3c h GLU 81 Ca -0.27 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1r3c h GLU 81 Cb 1.18 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1r3c h GLU 81 CO 0.27 0.39 0.00 0.09 -1.00 0.00 0.00 179.01 178.76 1r3c n ASN 82 N -4.65 5.49 -4.00 1.42 4.13 -1.26 -4.74 115.26 111.64 1r3c n ASN 82 Ca 0.22 -2.87 -0.17 0.00 1.68 0.00 0.00 54.58 53.44 1r3c n ASN 82 Cb 0.63 -0.68 -0.14 0.00 -1.54 0.00 0.00 39.78 38.05 1r3c n ASN 82 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1r3c s VAL 83 N -2.65 0.58 0.29 2.41 1.01 -0.74 -0.37 120.40 120.93 1r3c s VAL 83 Ca 0.52 -0.38 -0.29 0.00 0.00 0.00 0.00 61.98 61.82 1r3c s VAL 83 Cb 0.39 -0.50 -0.10 0.00 0.00 0.00 0.00 36.38 36.17 1r3c s VAL 83 CO 0.15 0.12 1.42 -0.51 0.00 0.00 0.00 175.10 176.28 1r3c s ILE 84 N -0.27 2.56 0.42 2.22 2.07 -0.42 -4.49 121.20 123.28 1r3c s ILE 84 Ca 0.02 0.51 0.05 0.00 -1.41 0.00 0.00 60.65 59.81 1r3c s ILE 84 Cb -0.03 -3.32 -0.06 0.00 0.13 0.00 0.00 42.46 39.18 1r3c s ILE 84 CO -0.00 0.10 0.03 -0.83 -1.91 0.00 0.00 174.94 172.32 1r3c s GLY 85 N 0.08 2.56 -0.34 1.50 0.00 -1.26 -4.81 107.32 105.06 1r3c s GLY 85 Ca 0.56 -1.72 -0.18 0.00 0.00 0.00 0.00 44.72 43.37 1r3c s GLY 85 CO 0.49 -2.05 0.54 -2.27 0.00 0.00 0.00 173.10 169.80 1r3c s LEU 86 N -3.70 4.29 0.08 0.66 2.96 -1.19 -4.54 118.68 117.24 1r3c s LEU 86 Ca 0.27 0.07 -0.05 0.00 -0.22 0.00 0.00 54.13 54.21 1r3c s LEU 86 Cb 0.07 -2.63 -0.27 0.00 0.50 0.00 0.00 46.19 43.86 1r3c s LEU 86 CO 0.14 -0.48 1.15 -0.07 -1.32 0.00 0.00 176.35 175.77 1r3c h LEU 87 N 9.11 0.44 -7.00 -0.68 3.38 -1.19 -3.43 115.31 115.94 1r3c h LEU 87 Ca -0.28 -0.46 0.07 0.00 0.09 0.00 0.00 57.88 57.30 1r3c h LEU 87 Cb 1.12 -0.14 -0.18 0.00 0.09 0.00 0.00 40.66 41.55 1r3c h LEU 87 CO 0.78 1.35 0.45 -0.62 0.09 0.00 0.00 178.44 180.49 1r3c s ASP 88 N -7.15 -0.42 -0.04 -0.43 2.15 -1.01 -4.54 116.67 105.21 1r3c s ASP 88 Ca -0.04 0.21 -0.02 0.00 0.43 0.00 0.00 52.55 53.12 1r3c s ASP 88 Cb 0.07 0.40 0.03 0.00 -0.30 0.00 0.00 42.92 43.11 1r3c s ASP 88 CO 0.88 -0.56 0.10 0.54 -0.17 0.00 0.00 175.17 175.96 1r3c s VAL 89 N -2.33 -0.03 0.16 1.11 0.11 -1.26 -0.22 120.40 117.93 1r3c s VAL 89 Ca 0.01 0.12 -0.11 0.00 -2.93 0.00 0.00 61.98 59.07 1r3c s VAL 89 Cb -0.01 -0.17 -0.00 0.00 -1.53 0.00 0.00 36.38 34.67 1r3c s VAL 89 CO -0.04 0.05 0.32 0.72 -3.33 0.00 0.00 175.10 172.82 1r3c s PHE 90 N 0.73 0.27 -0.02 1.54 -0.12 -0.76 -4.95 117.98 114.67 1r3c s PHE 90 Ca -0.06 -0.63 -0.05 0.00 -0.05 0.00 0.00 56.93 56.14 1r3c s PHE 90 Cb -0.08 0.03 0.01 0.00 -0.63 0.00 0.00 43.02 42.35 1r3c s PHE 90 CO -0.03 -0.74 0.11 -0.08 -0.05 0.00 0.00 175.22 174.44 1r3c s THR 91 N -3.94 0.04 -0.74 -4.49 -1.32 -1.26 -1.63 115.64 102.31 1r3c s THR 91 Ca 0.14 -0.32 0.24 0.00 -1.21 0.00 0.00 61.69 60.54 1r3c s THR 91 Cb 0.03 -0.27 0.25 0.00 -1.51 0.00 0.00 72.50 70.99 1r3c s THR 91 CO -0.02 -0.18 1.75 -0.81 -2.21 0.00 0.00 174.62 173.15 1r3c n PRO 92 N 2.35 0.17 -1.76 7.08 -0.04 -1.26 -4.83 135.00 136.70 1r3c n PRO 92 Ca -0.17 0.24 -0.40 0.00 -0.04 0.00 0.00 63.50 63.14 1r3c n PRO 92 Cb 0.57 -1.74 0.03 0.00 -0.04 0.00 0.00 33.50 32.32 1r3c n PRO 92 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1r3c n ALA 93 N -1.70 1.94 0.64 0.55 0.00 -1.26 -4.92 120.51 115.76 1r3c n ALA 93 Ca 0.05 0.21 0.08 0.00 0.00 0.00 0.00 53.44 53.78 1r3c n ALA 93 Cb 0.32 -2.39 0.07 0.00 0.00 0.00 0.00 19.45 17.45 1r3c n ALA 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1r3c n ARG 94 N -0.44 1.22 -3.58 0.00 1.74 -1.26 -4.96 116.66 109.39 1r3c n ARG 94 Ca 0.07 -1.46 -0.10 0.00 -0.77 0.00 0.00 57.85 55.59 1r3c n ARG 94 Cb 0.42 -1.30 -0.02 0.00 -1.02 0.00 0.00 32.46 30.54 1r3c n ARG 94 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1r3c s SER 95 N -1.31 -0.45 0.24 0.55 1.04 -1.26 -5.03 113.70 107.47 1r3c s SER 95 Ca 0.19 -0.21 -0.07 0.00 0.48 0.00 0.00 55.95 56.34 1r3c s SER 95 Cb 0.13 0.63 0.22 0.00 0.10 0.00 0.00 66.02 67.11 1r3c s SER 95 CO 0.20 -1.08 1.88 0.25 0.98 0.00 0.00 173.24 175.47 1r3c h LEU 96 N 2.00 1.12 -1.71 2.42 5.85 -1.96 -1.04 115.31 122.00 1r3c h LEU 96 Ca -0.28 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 1r3c h LEU 96 Cb 1.29 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 1r3c h LEU 96 CO 0.32 0.86 0.05 -0.33 -0.34 0.00 0.00 178.44 179.01 1r3c h GLU 97 N 1.28 0.24 -0.00 1.25 3.07 -2.02 -1.34 114.58 117.05 1r3c h GLU 97 Ca 0.33 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.17 1r3c h GLU 97 Cb -0.05 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 1r3c h GLU 97 CO -0.06 0.22 -0.34 -1.91 -1.40 0.00 0.00 179.01 175.52 1r3c n GLU 98 N -4.45 0.41 -2.05 2.33 2.13 -0.76 -4.91 120.64 113.33 1r3c n GLU 98 Ca -0.00 -0.22 -0.42 0.00 0.66 0.00 0.00 57.16 57.17 1r3c n GLU 98 Cb 0.13 -1.50 -0.03 0.00 0.27 0.00 0.00 31.44 30.32 1r3c n GLU 98 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 1r3c s PHE 99 N -2.74 2.05 0.00 4.31 5.36 -0.47 -4.67 117.98 121.83 1r3c s PHE 99 Ca 0.18 0.34 0.00 0.00 -0.96 0.00 0.00 56.93 56.49 1r3c s PHE 99 Cb 0.19 -3.90 0.00 0.00 -0.34 0.00 0.00 43.02 38.97 1r3c s PHE 99 CO 0.60 -3.49 0.00 0.09 -1.46 0.00 0.00 175.22 170.96 1r3c n ASN 100 N 7.49 0.00 -4.45 6.13 3.02 -1.26 -5.03 115.26 121.16 1r3c n ASN 100 Ca 0.18 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.43 1r3c n ASN 100 Cb 0.44 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.48 1r3c n ASN 100 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1r3c s ASP 101 N -0.92 3.73 -0.07 6.41 1.01 -1.26 -4.65 116.67 120.92 1r3c s ASP 101 Ca 0.00 -0.52 0.01 0.00 0.71 0.00 0.00 52.55 52.76 1r3c s ASP 101 Cb 0.00 -0.52 0.02 0.00 1.01 0.00 0.00 42.92 43.42 1r3c s ASP 101 CO 0.00 0.22 -0.09 -0.69 0.21 0.00 0.00 175.17 174.82 1r3c s VAL 102 N -1.00 0.93 -0.09 -1.27 1.01 -1.26 -4.55 120.40 114.17 1r3c s VAL 102 Ca 0.15 -0.32 0.05 0.00 0.00 0.00 0.00 61.98 61.86 1r3c s VAL 102 Cb -0.10 -0.89 -0.01 0.00 0.00 0.00 0.00 36.38 35.38 1r3c s VAL 102 CO 0.07 0.32 -0.24 -0.31 0.00 0.00 0.00 175.10 174.94 1r3c s TYR 103 N 0.99 2.53 -0.11 5.22 1.51 -0.65 -1.52 117.35 125.32 1r3c s TYR 103 Ca -0.09 -0.89 -0.00 0.00 -1.01 0.00 0.00 57.07 55.07 1r3c s TYR 103 Cb -0.15 -1.67 -0.02 0.00 -0.11 0.00 0.00 41.96 40.01 1r3c s TYR 103 CO 0.00 -0.32 -0.10 -0.51 -1.11 0.00 0.00 175.55 173.51 1r3c s LEU 104 N 0.14 2.94 -0.14 -1.29 1.43 0.54 -1.83 118.68 120.46 1r3c s LEU 104 Ca -0.12 -0.20 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1r3c s LEU 104 Cb -0.16 -1.66 0.00 0.00 0.03 0.00 0.00 46.19 44.40 1r3c s LEU 104 CO 0.07 0.23 -0.18 -0.69 0.23 0.00 0.00 176.35 176.01 1r3c s VAL 105 N -0.03 2.47 0.22 -1.59 1.01 0.69 -0.37 120.40 122.79 1r3c s VAL 105 Ca -0.01 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.12 1r3c s VAL 105 Cb -0.14 -2.02 -0.05 0.00 0.00 0.00 0.00 36.38 34.18 1r3c s VAL 105 CO 0.03 0.53 0.09 0.42 0.00 0.00 0.00 175.10 176.17 1r3c s THR 106 N 0.72 0.36 0.32 3.92 -4.23 -0.64 -0.56 115.64 115.53 1r3c s THR 106 Ca -0.08 -1.99 -0.29 0.00 -1.18 0.00 0.00 61.69 58.15 1r3c s THR 106 Cb -0.16 -2.47 -0.11 0.00 1.34 0.00 0.00 72.50 71.10 1r3c s THR 106 CO 0.01 -0.11 1.54 -1.00 -0.54 0.00 0.00 174.62 174.52 1r3c s HIS 107 N -3.90 2.70 -0.28 3.99 3.76 -1.26 -0.48 115.29 119.82 1r3c s HIS 107 Ca 0.35 0.95 -0.26 0.00 -0.15 0.00 0.00 55.06 55.96 1r3c s HIS 107 Cb 0.07 -4.04 0.00 0.00 1.11 0.00 0.00 32.58 29.73 1r3c s HIS 107 CO 0.11 -3.30 0.89 -1.17 -0.85 0.00 0.00 174.74 170.42 1r3c s LEU 108 N -1.14 4.06 -0.15 0.89 2.96 -0.54 -4.44 118.68 120.32 1r3c s LEU 108 Ca 0.59 0.94 -0.11 0.00 -0.22 0.00 0.00 54.13 55.33 1r3c s LEU 108 Cb -0.47 -3.26 -0.05 0.00 0.50 0.00 0.00 46.19 42.92 1r3c s LEU 108 CO 0.54 -0.64 0.21 -0.04 -1.32 0.00 0.00 176.35 175.09 1r3c s MET 109 N 3.09 3.97 0.08 1.98 -1.94 -1.26 -4.85 119.30 120.36 1r3c s MET 109 Ca 0.37 -0.04 -0.20 0.00 -1.71 0.00 0.00 55.69 54.11 1r3c s MET 109 Cb -0.14 -3.34 -0.06 0.00 2.01 0.00 0.00 34.83 33.30 1r3c s MET 109 CO 0.11 0.46 1.33 0.78 -0.01 0.00 0.00 175.02 177.69 1r3c h GLY 110 N 5.99 -1.43 -1.96 -0.03 0.00 -1.96 -3.46 103.07 100.21 1r3c h GLY 110 Ca -0.46 0.81 0.02 0.00 0.00 0.00 0.00 47.33 47.70 1r3c h GLY 110 CO 0.69 -0.37 0.14 0.00 0.00 0.00 0.00 176.54 177.00 1r3c s ALA 111 N -4.89 -0.88 0.50 3.60 0.00 -1.24 -5.06 121.76 113.78 1r3c s ALA 111 Ca -0.08 -0.53 0.05 0.00 0.00 0.00 0.00 51.96 51.40 1r3c s ALA 111 Cb 0.06 0.90 0.03 0.00 0.00 0.00 0.00 23.12 24.10 1r3c s ALA 111 CO 0.37 -0.98 0.69 0.16 0.00 0.00 0.00 175.76 176.00 1r3c s ASP 112 N -2.97 5.40 0.40 0.00 1.47 -1.26 -1.19 116.67 118.52 1r3c s ASP 112 Ca 0.15 -0.32 0.07 0.00 1.18 0.00 0.00 52.55 53.63 1r3c s ASP 112 Cb -0.04 -0.60 0.82 0.00 -0.34 0.00 0.00 42.92 42.76 1r3c s ASP 112 CO 0.08 -1.01 2.01 0.25 0.68 0.00 0.00 175.17 177.18 1r3c h LEU 113 N 0.33 0.42 0.90 2.11 5.85 -0.61 -3.15 115.31 121.17 1r3c h LEU 113 Ca -0.39 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.25 1r3c h LEU 113 Cb 1.29 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 42.22 1r3c h LEU 113 CO 0.47 0.38 -0.43 -1.13 -0.34 0.00 0.00 178.44 177.38 1r3c h ASN 114 N 0.47 -1.02 0.00 1.25 -0.00 -1.83 -0.69 115.58 113.75 1r3c h ASN 114 Ca 0.12 0.04 0.00 0.00 -0.00 0.00 0.00 56.30 56.45 1r3c h ASN 114 Cb 0.08 0.26 0.00 0.00 -0.00 0.00 0.00 38.32 38.67 1r3c h ASN 114 CO -0.01 -0.68 0.00 0.59 -0.00 0.00 0.00 177.43 177.33 1r3c n ASN 115 N -5.53 0.37 0.00 1.15 5.03 -1.19 -2.14 115.26 112.95 1r3c n ASN 115 Ca -0.15 -0.86 0.00 0.00 0.87 0.00 0.00 54.58 54.44 1r3c n ASN 115 Cb 0.48 -0.19 0.00 0.00 -1.02 0.00 0.00 39.78 39.05 1r3c n ASN 115 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05 1r3c n ILE 116 N 0.18 0.00 -0.50 2.41 5.41 -1.09 -4.85 119.36 120.92 1r3c n ILE 116 Ca 0.00 0.00 0.11 0.00 1.00 0.00 0.00 62.75 63.86 1r3c n ILE 116 Cb 0.09 -0.67 0.34 0.00 -0.71 0.00 0.00 39.64 38.69 1r3c n ILE 116 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 1r3c n VAL 117 N -2.44 1.43 -1.66 1.39 0.24 -0.29 -4.93 118.33 112.07 1r3c n VAL 117 Ca 0.00 -1.11 -0.54 0.00 -2.04 0.00 0.00 64.34 60.65 1r3c n VAL 117 Cb 0.20 0.31 -0.06 0.00 -1.47 0.00 0.00 33.84 32.82 1r3c n VAL 117 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1r3c n LYS 118 N 1.36 1.26 -2.38 7.34 4.81 -0.91 0.28 118.16 129.92 1r3c n LYS 118 Ca 0.25 0.46 -0.11 0.00 -0.87 0.00 0.00 58.31 58.03 1r3c n LYS 118 Cb 0.76 -2.14 -0.01 0.00 0.02 0.00 0.00 35.03 33.66 1r3c n LYS 118 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1r3c s GLN 120 N -4.91 1.38 -0.19 0.00 -1.52 0.14 -4.98 119.66 109.58 1r3c s GLN 120 Ca 0.00 -0.69 -0.07 0.00 -1.95 0.00 0.00 55.36 52.65 1r3c s GLN 120 Cb 0.00 -1.36 -0.04 0.00 -0.22 0.00 0.00 33.01 31.39 1r3c s GLN 120 CO 0.00 0.37 0.06 0.21 -0.25 0.00 0.00 175.29 175.67 1r3c s LYS 121 N -0.58 3.91 0.15 2.91 2.20 -1.26 -3.93 119.74 123.14 1r3c s LYS 121 Ca 0.06 -0.38 0.02 0.00 -0.36 0.00 0.00 55.97 55.32 1r3c s LYS 121 Cb -0.07 -3.21 -0.04 0.00 -1.51 0.00 0.00 37.83 33.00 1r3c s LYS 121 CO -0.00 0.21 0.30 -0.51 -0.36 0.00 0.00 175.35 174.98 1r3c s LEU 122 N 0.55 4.32 0.86 5.43 1.02 -0.57 -5.00 118.68 125.28 1r3c s LEU 122 Ca 0.03 0.22 -0.10 0.00 0.02 0.00 0.00 54.13 54.30 1r3c s LEU 122 Cb -0.13 -2.96 0.11 0.00 0.02 0.00 0.00 46.19 43.23 1r3c s LEU 122 CO 0.01 0.04 1.12 0.42 0.02 0.00 0.00 176.35 177.97 1r3c s THR 123 N -1.74 2.56 0.21 5.49 -4.23 -1.26 -4.67 115.64 112.00 1r3c s THR 123 Ca 0.35 0.18 -0.09 0.00 -1.18 0.00 0.00 61.69 60.95 1r3c s THR 123 Cb -0.11 -2.39 0.16 0.00 1.34 0.00 0.00 72.50 71.50 1r3c s THR 123 CO 0.29 -0.24 1.84 -0.78 -0.54 0.00 0.00 174.62 175.19 1r3c h ASP 124 N -1.59 0.97 -0.78 3.99 3.58 -1.97 -1.36 116.42 119.26 1r3c h ASP 124 Ca -0.44 -0.08 -0.02 0.00 0.42 0.00 0.00 57.03 56.91 1r3c h ASP 124 Cb 1.25 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 42.02 1r3c h ASP 124 CO 0.46 0.77 0.41 0.44 -2.88 0.00 0.00 179.24 178.43 1r3c h ASP 125 N 1.09 1.00 -0.48 2.28 3.45 -1.99 0.49 116.42 122.25 1r3c h ASP 125 Ca 0.28 -0.10 -0.10 0.00 0.43 0.00 0.00 57.03 57.55 1r3c h ASP 125 Cb -0.00 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 38.50 1r3c h ASP 125 CO -0.05 0.82 -0.08 -0.74 -1.57 0.00 0.00 179.24 177.63 1r3c h HIS 126 N 1.11 1.00 -0.66 4.55 2.76 -1.82 -2.44 115.15 119.65 1r3c h HIS 126 Ca 0.28 -0.20 -0.06 0.00 -2.20 0.00 0.00 60.37 58.18 1r3c h HIS 126 Cb 0.07 -0.25 -0.03 0.00 1.55 0.00 0.00 27.41 28.75 1r3c h HIS 126 CO 0.01 0.96 0.18 0.28 -1.30 0.00 0.00 177.93 178.06 1r3c h VAL 127 N 0.75 1.26 -0.29 5.26 2.07 -0.72 -1.64 116.25 122.92 1r3c h VAL 127 Ca 0.13 -0.91 0.04 0.00 0.82 0.00 0.00 66.70 66.77 1r3c h VAL 127 Cb 0.62 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 1r3c h VAL 127 CO 0.04 0.35 0.08 1.56 0.02 0.00 0.00 177.57 179.61 1r3c h GLN 128 N 0.97 0.19 -0.29 1.57 4.20 -0.75 -0.18 115.11 120.83 1r3c h GLN 128 Ca 0.21 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.88 1r3c h GLN 128 Cb 0.34 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1r3c h GLN 128 CO -0.00 0.13 0.07 0.35 -0.67 0.00 0.00 178.83 178.70 1r3c h PHE 129 N 0.20 0.49 0.15 2.96 3.57 -1.18 0.05 116.94 123.17 1r3c h PHE 129 Ca 0.13 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 1r3c h PHE 129 Cb 0.13 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1r3c h PHE 129 CO -0.15 0.53 -0.07 -0.07 -2.23 0.00 0.00 178.31 176.32 1r3c h LEU 130 N 0.30 -0.17 -1.07 0.59 3.38 -1.17 -2.22 115.31 114.95 1r3c h LEU 130 Ca 0.09 -0.16 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 1r3c h LEU 130 Cb 0.30 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 1r3c h LEU 130 CO 0.00 0.06 0.18 0.40 0.09 0.00 0.00 178.44 179.17 1r3c h ILE 131 N -0.40 1.22 -0.36 1.22 1.08 -1.05 -1.62 117.51 117.60 1r3c h ILE 131 Ca -0.02 -0.74 0.05 0.00 -0.39 0.00 0.00 64.86 63.76 1r3c h ILE 131 Cb 0.32 0.59 -0.04 0.00 -3.07 0.00 0.00 36.82 34.62 1r3c h ILE 131 CO 0.03 0.28 0.11 0.22 -0.69 0.00 0.00 178.15 178.10 1r3c h TYR 132 N 0.82 0.19 -0.62 1.37 3.20 -0.85 -0.21 116.97 120.87 1r3c h TYR 132 Ca 0.19 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.01 1r3c h TYR 132 Cb 0.23 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 1r3c h TYR 132 CO 0.01 0.06 0.13 1.96 -1.64 0.00 0.00 178.16 178.69 1r3c h GLN 133 N 0.25 0.99 -0.21 1.82 4.20 -0.93 0.84 115.11 122.06 1r3c h GLN 133 Ca 0.17 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 1r3c h GLN 133 Cb 0.16 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 1r3c h GLN 133 CO -0.19 0.89 0.09 0.82 -0.67 0.00 0.00 178.83 179.78 1r3c h ILE 134 N 0.94 1.14 -0.25 2.54 2.04 -0.58 -1.00 117.51 122.34 1r3c h ILE 134 Ca 0.20 -0.42 -0.06 0.00 1.00 0.00 0.00 64.86 65.58 1r3c h ILE 134 Cb 0.37 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1r3c h ILE 134 CO 0.00 0.14 -0.09 -0.07 0.00 0.00 0.00 178.15 178.14 1r3c h LEU 135 N 0.20 0.38 -0.28 1.44 3.38 -0.75 0.13 115.31 119.80 1r3c h LEU 135 Ca 0.07 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1r3c h LEU 135 Cb 0.14 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1r3c h LEU 135 CO -0.01 0.51 0.05 -0.09 0.09 0.00 0.00 178.44 178.99 1r3c h ARG 136 N 0.38 0.46 -0.56 1.13 2.43 -0.54 0.15 114.38 117.84 1r3c h ARG 136 Ca 0.08 -0.12 -0.09 0.00 -0.81 0.00 0.00 59.98 59.04 1r3c h ARG 136 Cb 0.39 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 1r3c h ARG 136 CO 0.02 0.57 0.01 0.78 -1.51 0.00 0.00 179.97 179.85 1r3c h GLY 137 N 0.28 1.05 1.22 2.80 0.00 -0.83 -2.91 103.07 104.68 1r3c h GLY 137 Ca 0.08 -0.76 -0.05 0.00 0.00 0.00 0.00 47.33 46.60 1r3c h GLY 137 CO 0.01 0.70 0.18 1.41 0.00 0.00 0.00 176.54 178.84 1r3c h LEU 138 N 0.86 0.92 -0.57 3.11 3.38 -0.53 0.32 115.31 122.79 1r3c h LEU 138 Ca 0.16 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.98 1r3c h LEU 138 Cb 0.52 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1r3c h LEU 138 CO 0.03 0.87 0.37 0.50 0.09 0.00 0.00 178.44 180.29 1r3c h LYS 139 N 0.94 0.72 0.47 1.13 3.64 -0.60 0.08 116.57 122.94 1r3c h LYS 139 Ca 0.21 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1r3c h LYS 139 Cb 0.29 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1r3c h LYS 139 CO -0.01 0.47 -0.22 -0.92 -2.27 0.00 0.00 179.45 176.50 1r3c h TYR 140 N 0.74 -0.58 -0.19 1.91 3.20 -1.23 -1.59 116.97 119.22 1r3c h TYR 140 Ca 0.22 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.13 1r3c h TYR 140 Cb -0.04 0.19 -0.05 0.00 1.54 0.00 0.00 36.73 38.37 1r3c h TYR 140 CO -0.05 -0.34 -0.14 0.82 -1.64 0.00 0.00 178.16 176.81 1r3c h ILE 141 N -0.67 0.59 0.00 1.81 2.04 -0.70 -2.32 117.51 118.26 1r3c h ILE 141 Ca -0.06 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.75 1r3c h ILE 141 Cb 0.50 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1r3c h ILE 141 CO 0.11 0.00 -0.22 0.45 0.00 0.00 0.00 178.15 178.48 1r3c h HIS 142 N -0.15 0.00 0.00 1.37 3.86 -0.97 -2.05 115.15 117.22 1r3c h HIS 142 Ca 0.11 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 1r3c h HIS 142 Cb 0.32 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.79 1r3c h HIS 142 CO -0.29 0.22 0.00 0.66 0.86 0.00 0.00 177.93 179.38 1r3c h SER 143 N 0.00 0.00 -0.67 2.45 4.64 -0.71 0.20 113.55 119.46 1r3c h SER 143 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1r3c h SER 143 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1r3c h SER 143 CO 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.99 1r3c n ALA 144 N -2.08 2.45 -2.75 5.18 0.00 -0.79 -4.76 120.51 117.76 1r3c n ALA 144 Ca -0.02 -1.21 -0.20 0.00 0.00 0.00 0.00 53.44 52.02 1r3c n ALA 144 Cb 0.17 -0.95 0.02 0.00 0.00 0.00 0.00 19.45 18.68 1r3c n ALA 144 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1r3c n ASP 145 N 1.45 -5.58 -4.66 0.00 8.00 0.71 -4.21 116.55 112.26 1r3c n ASP 145 Ca 0.23 -0.18 -0.35 0.00 0.71 0.00 0.00 54.79 55.20 1r3c n ASP 145 Cb 0.60 -4.49 -0.10 0.00 -0.02 0.00 0.00 41.12 37.11 1r3c n ASP 145 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1r3c s ILE 146 N -3.05 4.17 -0.15 0.53 1.01 -1.07 -5.03 121.20 117.61 1r3c s ILE 146 Ca 0.18 -0.30 -0.01 0.00 0.00 0.00 0.00 60.65 60.52 1r3c s ILE 146 Cb -0.08 -2.74 -0.01 0.00 0.01 0.00 0.00 42.46 39.64 1r3c s ILE 146 CO 0.23 0.60 -0.11 -0.63 0.00 0.00 0.00 174.94 175.02 1r3c s ILE 147 N -0.85 3.10 0.02 2.92 1.01 -1.26 -3.79 121.20 122.35 1r3c s ILE 147 Ca 0.13 -0.63 -0.25 0.00 0.00 0.00 0.00 60.65 59.89 1r3c s ILE 147 Cb -0.11 -2.32 -0.17 0.00 0.01 0.00 0.00 42.46 39.86 1r3c s ILE 147 CO 0.02 0.51 1.38 -0.74 0.00 0.00 0.00 174.94 176.11 1r3c h HIS 148 N 7.01 -0.25 0.00 3.97 -0.00 -1.95 -3.43 115.15 120.50 1r3c h HIS 148 Ca -0.30 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.07 1r3c h HIS 148 Cb 1.20 0.08 0.00 0.00 -0.00 0.00 0.00 27.41 28.69 1r3c h HIS 148 CO 0.52 0.05 0.00 0.54 -0.00 0.00 0.00 177.93 179.03 1r3c n ARG 149 N -5.09 0.00 -2.81 5.26 1.74 -1.26 -0.71 116.66 113.79 1r3c n ARG 149 Ca -0.09 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 56.98 1r3c n ARG 149 Cb 0.22 -1.93 0.06 0.00 -1.02 0.00 0.00 32.46 29.78 1r3c n ARG 149 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1r3c n ASP 150 N 0.00 1.18 -4.70 0.55 2.03 -1.26 -4.90 116.55 109.46 1r3c n ASP 150 Ca 0.00 -2.08 -0.42 0.00 0.52 0.00 0.00 54.79 52.81 1r3c n ASP 150 Cb 0.00 -0.34 -0.03 0.00 -0.72 0.00 0.00 41.12 40.04 1r3c n ASP 150 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1r3c s LEU 151 N -3.81 4.33 0.12 -2.67 1.43 -1.26 -4.82 118.68 112.00 1r3c s LEU 151 Ca 0.25 2.07 -0.25 0.00 -1.03 0.00 0.00 54.13 55.17 1r3c s LEU 151 Cb 0.34 -3.57 0.07 0.00 0.03 0.00 0.00 46.19 43.07 1r3c s LEU 151 CO -0.05 -0.64 0.74 -1.59 0.23 0.00 0.00 176.35 175.04 1r3c s LYS 152 N 1.96 1.19 0.28 1.70 -2.85 -1.26 -4.85 119.74 115.90 1r3c s LYS 152 Ca 0.62 -0.50 0.01 0.00 -1.00 0.00 0.00 55.97 55.10 1r3c s LYS 152 Cb -0.31 0.51 0.66 0.00 -2.06 0.00 0.00 37.83 36.63 1r3c s LYS 152 CO 0.27 -0.53 1.69 -1.35 0.10 0.00 0.00 175.35 175.52 1r3c h PRO 153 N 2.00 0.33 0.00 1.78 0.11 -1.94 0.29 132.00 134.56 1r3c h PRO 153 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1r3c h PRO 153 Cb 1.27 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1r3c h PRO 153 CO 0.33 0.22 0.00 -1.13 -0.21 0.00 0.00 178.00 177.20 1r3c n SER 154 N -5.10 0.53 -1.51 -2.05 3.41 -1.26 -1.79 113.62 105.85 1r3c n SER 154 Ca 0.20 0.67 0.08 0.00 -0.26 0.00 0.00 58.87 59.57 1r3c n SER 154 Cb 0.61 -0.77 0.35 0.00 -0.26 0.00 0.00 64.21 64.13 1r3c n SER 154 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1r3c n ASN 155 N -2.13 4.81 -4.04 4.04 3.02 0.09 -4.84 115.26 116.21 1r3c n ASN 155 Ca 0.01 -2.65 -0.31 0.00 -0.03 0.00 0.00 54.58 51.60 1r3c n ASN 155 Cb 0.15 -0.58 -0.16 0.00 -0.61 0.00 0.00 39.78 38.57 1r3c n ASN 155 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1r3c s LEU 156 N -2.21 2.37 -0.02 3.41 1.43 -0.74 -1.13 118.68 121.79 1r3c s LEU 156 Ca 0.49 -0.87 -0.08 0.00 -1.03 0.00 0.00 54.13 52.64 1r3c s LEU 156 Cb 0.34 -1.34 -0.05 0.00 0.03 0.00 0.00 46.19 45.18 1r3c s LEU 156 CO 0.19 -0.11 0.27 0.00 0.23 0.00 0.00 176.35 176.93 1r3c s ALA 157 N 1.33 3.82 -0.00 4.21 0.00 -0.07 -0.56 121.76 130.49 1r3c s ALA 157 Ca -0.00 -0.52 0.01 0.00 0.00 0.00 0.00 51.96 51.45 1r3c s ALA 157 Cb -0.16 -2.11 -0.00 0.00 0.00 0.00 0.00 23.12 20.85 1r3c s ALA 157 CO -0.09 0.61 -0.04 0.08 0.00 0.00 0.00 175.76 176.33 1r3c s VAL 158 N -1.22 0.29 0.29 0.00 1.01 -0.33 -0.65 120.40 119.79 1r3c s VAL 158 Ca 0.25 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.12 1r3c s VAL 158 Cb -0.14 -0.26 0.05 0.00 0.00 0.00 0.00 36.38 36.04 1r3c s VAL 158 CO 0.13 0.09 0.40 -0.46 0.00 0.00 0.00 175.10 175.26 1r3c n ASN 159 N 3.06 0.91 -0.07 3.32 0.23 -0.44 -3.72 115.26 118.55 1r3c n ASN 159 Ca -0.14 -1.68 0.12 0.00 -0.53 0.00 0.00 54.58 52.35 1r3c n ASN 159 Cb 0.58 -0.22 0.50 0.00 -2.08 0.00 0.00 39.78 38.56 1r3c n ASN 159 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 1r3c h GLU 160 N 0.00 0.39 -0.51 -3.83 4.81 -2.00 -0.24 114.58 113.20 1r3c h GLU 160 Ca -0.13 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.07 1r3c h GLU 160 Cb 0.58 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.87 1r3c h GLU 160 CO 0.18 0.25 0.00 -0.25 -0.73 0.00 0.00 179.01 178.46 1r3c n ASP 161 N -4.47 2.27 -0.69 1.04 8.00 -1.26 -4.88 116.55 116.56 1r3c n ASP 161 Ca 0.09 -2.15 -0.09 0.00 0.71 0.00 0.00 54.79 53.35 1r3c n ASP 161 Cb 0.36 -0.36 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 1r3c n ASP 161 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1r3c n SER 162 N 0.40 -4.77 -4.74 -2.24 7.64 -0.10 -4.97 113.62 104.85 1r3c n SER 162 Ca 0.12 0.22 -0.41 0.00 1.01 0.00 0.00 58.87 59.81 1r3c n SER 162 Cb 0.43 -3.06 -0.04 0.00 -1.01 0.00 0.00 64.21 60.53 1r3c n SER 162 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1r3c s GLU 163 N -2.53 4.54 0.07 1.43 2.02 -1.26 -4.77 118.70 118.20 1r3c s GLU 163 Ca 0.00 1.79 0.09 0.00 0.02 0.00 0.00 54.97 56.86 1r3c s GLU 163 Cb 0.00 -3.27 -0.03 0.00 0.10 0.00 0.00 34.13 30.93 1r3c s GLU 163 CO 0.00 -0.02 -0.21 -1.17 0.02 0.00 0.00 175.26 173.88 1r3c s LEU 164 N -0.20 2.49 -0.02 1.80 0.20 -1.26 -1.33 118.68 120.36 1r3c s LEU 164 Ca 0.51 -0.54 0.02 0.00 0.69 0.00 0.00 54.13 54.82 1r3c s LEU 164 Cb -0.31 -1.43 0.00 0.00 -0.43 0.00 0.00 46.19 44.03 1r3c s LEU 164 CO 0.35 0.23 -0.06 -0.54 -0.29 0.00 0.00 176.35 176.04 1r3c s LYS 165 N -1.63 0.65 0.03 1.98 1.02 0.17 -4.27 119.74 117.69 1r3c s LYS 165 Ca 0.15 -0.20 -0.22 0.00 0.02 0.00 0.00 55.97 55.72 1r3c s LYS 165 Cb -0.10 -0.64 -0.06 0.00 -0.52 0.00 0.00 37.83 36.51 1r3c s LYS 165 CO 0.06 0.07 0.65 0.42 -0.92 0.00 0.00 175.35 175.63 1r3c s ILE 166 N 0.20 4.79 0.10 2.17 1.01 0.50 -0.89 121.20 129.09 1r3c s ILE 166 Ca -0.02 1.39 0.01 0.00 0.00 0.00 0.00 60.65 62.02 1r3c s ILE 166 Cb -0.07 -4.00 -0.00 0.00 0.01 0.00 0.00 42.46 38.40 1r3c s ILE 166 CO -0.00 0.43 0.12 0.00 0.00 0.00 0.00 174.94 175.49 1r3c n LEU 167 N 2.53 0.00 -3.75 2.97 -0.00 -0.28 -1.30 117.00 117.16 1r3c n LEU 167 Ca -0.06 -0.90 -0.25 0.00 -0.00 0.00 0.00 56.01 54.81 1r3c n LEU 167 Cb 0.51 0.66 0.02 0.00 -0.00 0.00 0.00 43.42 44.61 1r3c n LEU 167 CO 0.44 -0.18 -0.11 0.47 -0.00 0.00 0.00 177.39 178.01 1r3c n ASP 168 N -2.24 -2.14 -4.59 1.45 9.92 -1.26 -4.80 116.55 112.89 1r3c n ASP 168 Ca 0.01 -0.92 -0.36 0.00 -0.53 0.00 0.00 54.79 52.99 1r3c n ASP 168 Cb 0.18 -3.66 0.08 0.00 -0.64 0.00 0.00 41.12 37.07 1r3c n ASP 168 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1r3c n PHE 169 N -4.24 0.45 -2.17 1.24 3.01 -1.26 -4.82 117.46 109.67 1r3c n PHE 169 Ca -0.24 0.39 -0.42 0.00 1.01 0.00 0.00 57.45 58.19 1r3c n PHE 169 Cb 0.66 -2.06 -0.03 0.00 -0.01 0.00 0.00 39.48 38.04 1r3c n PHE 169 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1r3c s GLY 170 N -1.54 0.73 -0.24 1.37 0.00 0.11 -4.80 107.32 102.95 1r3c s GLY 170 Ca 0.73 -0.27 0.04 0.00 0.00 0.00 0.00 44.72 45.22 1r3c s GLY 170 CO 0.51 3.09 -0.18 1.04 0.00 0.00 0.00 173.10 177.56 1r3c n LEU 171 N 10.43 2.60 -3.95 0.66 4.77 -1.26 -4.94 117.00 125.29 1r3c n LEU 171 Ca 0.18 -0.12 -0.23 0.00 -0.03 0.00 0.00 56.01 55.82 1r3c n LEU 171 Cb 0.49 -0.69 -0.17 0.00 -2.33 0.00 0.00 43.42 40.72 1r3c n LEU 171 CO 0.70 0.86 -0.44 0.00 -1.33 0.00 0.00 177.39 177.18 1r3c s ALA 172 N -2.49 1.00 0.19 -1.18 0.00 -1.26 -4.97 121.76 113.05 1r3c s ALA 172 Ca -0.30 -0.26 -0.32 0.00 0.00 0.00 0.00 51.96 51.08 1r3c s ALA 172 Cb 0.08 -0.53 -0.16 0.00 0.00 0.00 0.00 23.12 22.52 1r3c s ALA 172 CO 0.60 0.01 1.07 0.54 0.00 0.00 0.00 175.76 177.98 1r3c n ARG 173 N 4.01 1.04 -1.01 0.00 3.00 -1.26 -4.90 116.66 117.53 1r3c n ARG 173 Ca -0.23 0.37 -0.31 0.00 -0.01 0.00 0.00 57.85 57.66 1r3c n ARG 173 Cb 0.51 -1.79 0.13 0.00 0.00 0.00 0.00 32.46 31.31 1r3c n ARG 173 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1r3c s HIS 174 N -0.43 2.01 0.51 -1.55 3.76 -1.26 -4.99 115.29 113.34 1r3c s HIS 174 Ca 0.70 1.69 -0.15 0.00 -0.15 0.00 0.00 55.06 57.15 1r3c s HIS 174 Cb -0.85 -3.26 -0.07 0.00 1.11 0.00 0.00 32.58 29.51 1r3c s HIS 174 CO 0.54 -2.42 0.95 0.99 -0.85 0.00 0.00 174.74 173.95 1r3c s THR 175 N -2.64 4.59 0.32 1.30 2.01 -1.26 -4.95 115.64 115.01 1r3c s THR 175 Ca 0.66 1.08 0.00 0.00 0.31 0.00 0.00 61.69 63.74 1r3c s THR 175 Cb -0.22 -3.74 0.27 0.00 0.01 0.00 0.00 72.50 68.82 1r3c s THR 175 CO 0.55 -0.71 1.97 0.44 -0.69 0.00 0.00 174.62 176.18 1r3c h ASP 176 N 0.84 0.86 -0.02 3.53 3.32 -1.98 -0.80 116.42 122.18 1r3c h ASP 176 Ca -0.47 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.50 1r3c h ASP 176 Cb 1.19 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.51 1r3c h ASP 176 CO 0.62 0.61 -0.17 -0.78 -1.72 0.00 0.00 179.24 177.80 1r3c h ASP 177 N 1.01 0.34 0.36 6.45 1.82 -1.96 -2.41 116.42 122.03 1r3c h ASP 177 Ca 0.30 -0.09 -0.05 0.00 -0.39 0.00 0.00 57.03 56.80 1r3c h ASP 177 Cb -0.05 -0.09 -0.01 0.00 0.68 0.00 0.00 39.33 39.86 1r3c h ASP 177 CO -0.07 0.54 -0.22 -0.33 -1.61 0.00 0.00 179.24 177.54 1r3c h GLU 178 N 0.33 0.00 -0.71 0.28 5.08 -1.52 -2.64 114.58 115.39 1r3c h GLU 178 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1r3c h GLU 178 Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1r3c h GLU 178 CO 0.03 0.22 0.00 -0.12 -1.00 0.00 0.00 179.01 178.15 1r3c n MET 179 N -3.93 2.94 -3.38 2.33 1.56 -0.93 -4.74 117.12 110.97 1r3c n MET 179 Ca -0.02 -2.70 -0.38 0.00 -0.27 0.00 0.00 57.70 54.33 1r3c n MET 179 Cb 0.31 -1.63 -0.06 0.00 2.15 0.00 0.00 33.22 33.99 1r3c n MET 179 CO 0.00 0.00 0.00 0.99 -0.73 0.00 0.00 175.97 176.23 1r3c s THR 180 N -1.17 5.08 0.00 1.12 2.01 -1.00 -4.78 115.64 116.89 1r3c s THR 180 Ca 0.49 0.94 0.00 0.00 0.31 0.00 0.00 61.69 63.43 1r3c s THR 180 Cb 0.27 -3.79 0.00 0.00 0.01 0.00 0.00 72.50 68.99 1r3c s THR 180 CO 0.31 0.45 0.00 0.61 -0.69 0.00 0.00 174.62 175.30 1r3c n GLY 181 N 2.56 -0.98 3.30 4.40 0.00 -1.25 -4.48 105.19 108.75 1r3c n GLY 181 Ca -0.10 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.19 1r3c n GLY 181 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1r3c n TYR 182 N 0.00 4.32 -4.53 1.61 9.36 -0.98 -3.73 117.16 123.20 1r3c n TYR 182 Ca 0.00 -2.96 -0.22 0.00 3.32 0.00 0.00 57.90 58.03 1r3c n TYR 182 Cb 0.00 -2.48 -0.16 0.00 -0.63 0.00 0.00 39.34 36.07 1r3c n TYR 182 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 1r3c s VAL 183 N 3.17 1.00 0.50 2.97 -7.23 -1.26 -5.01 120.40 114.54 1r3c s VAL 183 Ca 0.49 -0.47 0.33 0.00 -1.81 0.00 0.00 61.98 60.52 1r3c s VAL 183 Cb 0.06 -0.89 0.36 0.00 0.56 0.00 0.00 36.38 36.47 1r3c s VAL 183 CO 0.02 0.31 2.19 0.00 -0.31 0.00 0.00 175.10 177.31 1r3c h ALA 184 N 6.43 1.27 0.00 1.32 0.00 -1.94 -1.13 119.26 125.22 1r3c h ALA 184 Ca -0.33 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1r3c h ALA 184 Cb 1.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1r3c h ALA 184 CO 0.48 0.06 0.00 0.25 0.00 0.00 0.00 179.25 180.04 1r3c n THR 185 N -3.53 1.31 0.00 0.00 -2.24 -1.26 -2.83 114.28 105.73 1r3c n THR 185 Ca -0.02 0.61 0.00 0.00 -2.27 0.00 0.00 64.05 62.36 1r3c n THR 185 Cb 0.16 -1.59 0.00 0.00 -2.10 0.00 0.00 70.33 66.79 1r3c n THR 185 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1r3c n ARG 186 N -2.00 0.22 0.28 -0.78 0.63 -0.44 -4.78 116.66 109.80 1r3c n ARG 186 Ca -0.01 0.00 0.18 0.00 -0.92 0.00 0.00 57.85 57.11 1r3c n ARG 186 Cb 0.04 -0.98 0.95 0.00 0.45 0.00 0.00 32.46 32.92 1r3c n ARG 186 CO 0.00 0.00 0.00 -1.49 -2.51 0.00 0.00 177.63 173.63 1r3c h TRP 187 N 0.00 0.00 -0.29 -0.14 6.55 -1.43 -2.24 115.95 118.40 1r3c h TRP 187 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1r3c h TRP 187 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.30 1r3c h TRP 187 CO 0.00 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 178.05 1r3c n TYR 188 N -3.48 0.38 -2.98 0.49 4.01 -1.26 -4.52 117.16 109.79 1r3c n TYR 188 Ca -0.01 -0.25 -0.38 0.00 -0.16 0.00 0.00 57.90 57.10 1r3c n TYR 188 Cb 0.22 -0.01 -0.06 0.00 -0.31 0.00 0.00 39.34 39.18 1r3c n TYR 188 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1r3c s ARG 189 N -1.26 4.49 0.45 -0.72 1.81 -0.84 -3.89 118.95 118.99 1r3c s ARG 189 Ca 0.30 1.11 -0.24 0.00 -1.72 0.00 0.00 55.73 55.18 1r3c s ARG 189 Cb 0.17 -3.09 -0.07 0.00 -0.45 0.00 0.00 34.95 31.51 1r3c s ARG 189 CO 0.24 0.48 1.25 0.00 -0.68 0.00 0.00 175.30 176.60 1r3c s ALA 190 N -1.32 3.06 0.27 2.13 0.00 -1.26 -4.82 121.76 119.83 1r3c s ALA 190 Ca 0.40 1.12 -0.01 0.00 0.00 0.00 0.00 51.96 53.47 1r3c s ALA 190 Cb -0.21 -3.46 0.47 0.00 0.00 0.00 0.00 23.12 19.92 1r3c s ALA 190 CO 0.25 -0.84 1.86 -1.00 0.00 0.00 0.00 175.76 176.03 1r3c h PRO 191 N 2.22 1.07 0.00 0.00 0.13 -1.96 -1.19 132.00 132.26 1r3c h PRO 191 Ca -0.50 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 64.56 1r3c h PRO 191 Cb 1.26 -0.24 -0.00 0.00 0.13 0.00 0.00 31.00 32.14 1r3c h PRO 191 CO 0.61 0.71 -0.02 1.05 -0.23 0.00 0.00 178.00 180.11 1r3c h GLU 192 N 1.10 0.00 0.00 0.86 9.09 -1.91 -2.03 114.58 121.68 1r3c h GLU 192 Ca 0.46 0.00 -0.22 0.00 0.05 0.00 0.00 59.36 59.64 1r3c h GLU 192 Cb 0.30 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.36 1r3c h GLU 192 CO -0.21 0.02 -2.03 0.44 0.05 0.00 0.00 179.01 177.28 1r3c n ILE 193 N -4.13 1.00 -0.05 -1.06 -5.35 -0.91 0.23 119.36 109.09 1r3c n ILE 193 Ca -0.03 -0.73 0.00 0.00 -0.27 0.00 0.00 62.75 61.73 1r3c n ILE 193 Cb 0.11 -0.43 0.29 0.00 -1.74 0.00 0.00 39.64 37.86 1r3c n ILE 193 CO 0.00 0.00 0.00 -0.03 -1.76 0.00 0.00 176.55 174.76 1r3c h MET 194 N 0.00 0.64 -0.03 6.28 4.05 -0.57 -2.97 114.93 122.33 1r3c h MET 194 Ca -0.31 -0.11 -0.01 0.00 -0.28 0.00 0.00 59.70 59.00 1r3c h MET 194 Cb 1.77 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 32.45 1r3c h MET 194 CO 0.03 0.57 -0.22 1.28 0.23 0.00 0.00 176.91 178.80 1r3c n LEU 195 N -4.32 2.66 -4.22 3.39 4.77 -0.83 -5.01 117.00 113.44 1r3c n LEU 195 Ca 0.03 -3.47 -0.34 0.00 -0.03 0.00 0.00 56.01 52.20 1r3c n LEU 195 Cb 0.19 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.73 1r3c n LEU 195 CO 0.38 1.03 -0.38 0.59 -1.33 0.00 0.00 177.39 177.68 1r3c n ASN 196 N -1.25 -0.35 0.06 -1.43 3.02 -1.05 -4.85 115.26 109.42 1r3c n ASN 196 Ca 0.18 -1.25 -0.05 0.00 -0.03 0.00 0.00 54.58 53.43 1r3c n ASN 196 Cb 0.69 -1.79 0.15 0.00 -0.61 0.00 0.00 39.78 38.23 1r3c n ASN 196 CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 1r3c h TRP 197 N -1.98 0.40 -2.57 3.10 6.55 -0.48 -3.44 115.95 117.53 1r3c h TRP 197 Ca -0.67 -0.13 0.13 0.00 0.95 0.00 0.00 58.89 59.18 1r3c h TRP 197 Cb 1.40 -0.08 -0.05 0.00 -0.86 0.00 0.00 29.16 29.57 1r3c h TRP 197 CO 0.48 0.76 0.48 0.00 -1.05 0.00 0.00 178.44 179.10 1r3c s MET 198 N -4.01 1.45 -0.33 0.49 0.23 -1.24 -1.50 119.30 114.39 1r3c s MET 198 Ca -0.05 -0.88 -0.28 0.00 -1.03 0.00 0.00 55.69 53.44 1r3c s MET 198 Cb 0.12 0.44 -0.03 0.00 -1.53 0.00 0.00 34.83 33.84 1r3c s MET 198 CO 0.80 -0.67 1.90 -1.01 -2.03 0.00 0.00 175.02 174.00 1r3c s HIS 199 N -2.71 1.66 0.74 3.16 3.76 -1.26 -4.84 115.29 115.80 1r3c s HIS 199 Ca 0.17 0.65 -0.11 0.00 -0.15 0.00 0.00 55.06 55.62 1r3c s HIS 199 Cb -0.03 -4.07 0.05 0.00 1.11 0.00 0.00 32.58 29.64 1r3c s HIS 199 CO 0.05 -3.10 1.11 1.52 -0.85 0.00 0.00 174.74 173.47 1r3c s TYR 200 N 7.43 3.12 0.00 1.40 -0.85 -1.26 -5.10 117.35 122.08 1r3c s TYR 200 Ca 0.83 0.82 0.00 0.00 -0.52 0.00 0.00 57.07 58.21 1r3c s TYR 200 Cb -0.24 -3.24 0.00 0.00 0.38 0.00 0.00 41.96 38.87 1r3c s TYR 200 CO 0.33 -1.43 0.00 0.27 -1.52 0.00 0.00 175.55 173.20 1r3c n ASN 201 N -3.09 0.00 0.31 -0.18 0.23 -1.26 -5.02 115.26 106.24 1r3c n ASN 201 Ca 0.07 -0.98 0.17 0.00 -0.53 0.00 0.00 54.58 53.31 1r3c n ASN 201 Cb 0.59 0.00 0.87 0.00 -2.08 0.00 0.00 39.78 39.16 1r3c n ASN 201 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 1r3c h GLN 202 N 0.00 0.00 0.00 -3.83 3.07 -1.99 -1.59 115.11 110.78 1r3c h GLN 202 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.74 1r3c h GLN 202 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.56 1r3c h GLN 202 CO 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 178.83 178.91 1r3c h THR 203 N 0.00 0.11 -0.20 1.86 1.03 -1.95 -1.76 112.91 112.00 1r3c h THR 203 Ca 0.02 -0.17 -0.03 0.00 -0.01 0.00 0.00 66.41 66.21 1r3c h THR 203 Cb 0.60 1.15 -0.01 0.00 -1.07 0.00 0.00 68.15 68.81 1r3c h THR 203 CO -0.00 0.01 -0.02 -0.37 -0.01 0.00 0.00 175.52 175.13 1r3c h VAL 204 N 0.00 1.14 -0.25 0.00 -1.51 -1.68 -1.81 116.25 112.15 1r3c h VAL 204 Ca -0.00 -0.57 -0.08 0.00 -1.23 0.00 0.00 66.70 64.81 1r3c h VAL 204 Cb 0.15 1.02 -0.01 0.00 -2.13 0.00 0.00 31.29 30.32 1r3c h VAL 204 CO 0.00 0.19 -0.20 0.44 -1.23 0.00 0.00 177.57 176.77 1r3c h ASP 205 N 0.29 0.43 -0.01 4.19 3.32 -1.54 -2.73 116.42 120.37 1r3c h ASP 205 Ca 0.07 -0.13 -0.12 0.00 0.02 0.00 0.00 57.03 56.87 1r3c h ASP 205 Cb 0.24 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1r3c h ASP 205 CO 0.01 0.65 -0.34 0.40 -1.72 0.00 0.00 179.24 178.23 1r3c h ILE 206 N 0.40 1.29 -0.62 0.35 1.08 -1.44 -1.91 117.51 116.66 1r3c h ILE 206 Ca 0.07 -1.45 0.01 0.00 -0.39 0.00 0.00 64.86 63.10 1r3c h ILE 206 Cb 0.58 1.49 -0.03 0.00 -3.07 0.00 0.00 36.82 35.78 1r3c h ILE 206 CO 0.04 0.46 0.40 -0.25 -0.69 0.00 0.00 178.15 178.10 1r3c h TRP 207 N 0.42 0.75 -0.60 1.37 2.91 -1.22 -1.55 115.95 118.02 1r3c h TRP 207 Ca 0.05 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.10 1r3c h TRP 207 Cb 0.80 -0.25 -0.03 0.00 -0.51 0.00 0.00 29.16 29.17 1r3c h TRP 207 CO 0.03 0.46 0.39 0.77 -1.03 0.00 0.00 178.44 179.05 1r3c h SER 208 N 0.80 0.66 -0.78 2.65 0.02 -1.28 -1.58 113.55 114.05 1r3c h SER 208 Ca 0.24 -0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.18 1r3c h SER 208 Cb -0.05 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.29 1r3c h SER 208 CO -0.07 0.48 0.52 0.58 -1.14 0.00 0.00 176.83 177.19 1r3c h VAL 209 N 0.79 1.20 -0.60 2.27 2.07 -0.96 -0.28 116.25 120.73 1r3c h VAL 209 Ca 0.23 -0.36 0.03 0.00 0.82 0.00 0.00 66.70 67.41 1r3c h VAL 209 Cb -0.06 0.05 -0.04 0.00 -1.52 0.00 0.00 31.29 29.73 1r3c h VAL 209 CO -0.06 0.19 0.37 1.23 0.02 0.00 0.00 177.57 179.32 1r3c h GLY 210 N 1.05 0.86 1.07 2.17 0.00 -0.71 0.38 103.07 107.89 1r3c h GLY 210 Ca 0.29 -0.28 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 1r3c h GLY 210 CO -0.06 0.24 0.08 0.00 0.00 0.00 0.00 176.54 176.79 1r3c h ILE 212 N 0.99 1.23 -0.52 0.00 2.04 -0.58 -2.24 117.51 118.43 1r3c h ILE 212 Ca 0.19 -0.72 0.05 0.00 1.00 0.00 0.00 64.86 65.39 1r3c h ILE 212 Cb 0.47 1.45 -0.05 0.00 -0.74 0.00 0.00 36.82 37.95 1r3c h ILE 212 CO 0.02 0.21 0.24 -0.03 0.00 0.00 0.00 178.15 178.59 1r3c h MET 213 N -0.01 0.45 -0.87 2.37 4.05 -0.09 -0.27 114.93 120.56 1r3c h MET 213 Ca 0.04 -0.03 -0.02 0.00 -0.28 0.00 0.00 59.70 59.41 1r3c h MET 213 Cb 0.31 -0.10 -0.04 0.00 -0.80 0.00 0.00 31.60 30.97 1r3c h MET 213 CO 0.00 0.30 0.46 0.00 0.23 0.00 0.00 176.91 177.90 1r3c h ALA 214 N 1.30 1.17 -0.45 0.39 0.00 -1.21 -1.79 119.26 118.68 1r3c h ALA 214 Ca 0.24 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1r3c h ALA 214 Cb 0.19 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1r3c h ALA 214 CO -0.19 0.66 -0.16 1.49 0.00 0.00 0.00 179.25 181.05 1r3c h GLU 215 N 1.23 0.86 -0.56 0.00 4.81 -0.72 -0.64 114.58 119.56 1r3c h GLU 215 Ca 0.30 -0.32 -0.06 0.00 -0.13 0.00 0.00 59.36 59.16 1r3c h GLU 215 Cb 0.05 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 1r3c h GLU 215 CO -0.05 0.96 0.12 -0.07 -0.73 0.00 0.00 179.01 179.24 1r3c h LEU 216 N 0.76 0.82 -0.30 1.64 3.38 -0.61 0.60 115.31 121.60 1r3c h LEU 216 Ca 0.12 -0.16 -0.20 0.00 0.09 0.00 0.00 57.88 57.72 1r3c h LEU 216 Cb 0.68 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1r3c h LEU 216 CO 0.05 0.82 -0.77 -0.07 0.09 0.00 0.00 178.44 178.56 1r3c h LEU 217 N 0.84 0.65 0.00 1.67 3.38 -1.10 -1.53 115.31 119.23 1r3c h LEU 217 Ca 0.18 -0.44 -0.15 0.00 0.09 0.00 0.00 57.88 57.57 1r3c h LEU 217 Cb 0.33 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1r3c h LEU 217 CO 0.00 1.20 -2.03 0.35 0.09 0.00 0.00 178.44 178.05 1r3c n THR 218 N -3.86 0.55 -0.74 0.22 -2.24 -0.27 -4.64 114.28 103.30 1r3c n THR 218 Ca -0.06 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 1r3c n THR 218 Cb 0.73 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 1r3c n THR 218 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r3c n GLY 219 N 1.63 0.75 3.29 3.38 0.00 0.21 -4.68 105.19 109.77 1r3c n GLY 219 Ca -0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 1r3c n GLY 219 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r3c s ARG 220 N -0.26 1.26 0.21 1.61 1.81 -1.23 -3.96 118.95 118.39 1r3c s ARG 220 Ca 0.00 -1.11 -0.31 0.00 -1.72 0.00 0.00 55.73 52.60 1r3c s ARG 220 Cb 0.00 -1.49 -0.10 0.00 -0.45 0.00 0.00 34.95 32.90 1r3c s ARG 220 CO 0.00 0.36 1.55 0.99 -0.68 0.00 0.00 175.30 177.52 1r3c s THR 221 N -1.02 2.50 -0.02 0.02 2.01 -1.26 -3.95 115.64 113.92 1r3c s THR 221 Ca 0.08 0.38 -0.26 0.00 0.31 0.00 0.00 61.69 62.20 1r3c s THR 221 Cb -0.10 -3.25 -0.20 0.00 0.01 0.00 0.00 72.50 68.97 1r3c s THR 221 CO 0.04 0.04 1.28 0.25 -0.69 0.00 0.00 174.62 175.54 1r3c h LEU 222 N 6.00 -0.02 -6.29 4.42 5.85 -1.92 -3.38 115.31 119.98 1r3c h LEU 222 Ca -0.44 -0.45 -0.60 0.00 0.84 0.00 0.00 57.88 57.23 1r3c h LEU 222 Cb 1.21 0.00 -0.41 0.00 0.37 0.00 0.00 40.66 41.83 1r3c h LEU 222 CO 0.86 0.44 -0.69 0.49 -0.34 0.00 0.00 178.44 179.20 1r3c n PHE 223 N -4.88 2.75 -1.50 1.25 3.72 -1.26 -5.00 117.46 112.54 1r3c n PHE 223 Ca -0.08 -4.05 -0.40 0.00 -0.05 0.00 0.00 57.45 52.86 1r3c n PHE 223 Cb 0.24 -0.50 -0.01 0.00 -0.94 0.00 0.00 39.48 38.26 1r3c n PHE 223 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1r3c n PRO 224 N 1.17 2.93 -2.19 -1.08 -0.04 -1.26 -4.63 135.00 129.91 1r3c n PRO 224 Ca 0.27 -2.36 -0.38 0.00 -0.04 0.00 0.00 63.50 60.99 1r3c n PRO 224 Cb 0.42 -3.07 -0.01 0.00 -0.04 0.00 0.00 33.50 30.80 1r3c n PRO 224 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1r3c s GLY 225 N 3.08 2.84 0.01 0.55 0.00 -1.26 -4.92 107.32 107.62 1r3c s GLY 225 Ca 0.54 1.04 0.28 0.00 0.00 0.00 0.00 44.72 46.58 1r3c s GLY 225 CO -0.06 1.54 1.83 -1.30 0.00 0.00 0.00 173.10 175.11 1r3c n THR 226 N -0.23 0.01 -3.69 0.90 -2.24 -1.26 -4.20 114.28 103.57 1r3c n THR 226 Ca 0.06 -0.01 -0.02 0.00 -2.27 0.00 0.00 64.05 61.81 1r3c n THR 226 Cb 0.46 -0.37 -0.01 0.00 -2.10 0.00 0.00 70.33 68.32 1r3c n THR 226 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1r3c s ASP 227 N -3.04 -0.14 0.28 3.42 1.47 -1.24 -2.32 116.67 115.10 1r3c s ASP 227 Ca 0.13 -0.29 0.02 0.00 1.18 0.00 0.00 52.55 53.60 1r3c s ASP 227 Cb 0.19 0.36 0.68 0.00 -0.34 0.00 0.00 42.92 43.80 1r3c s ASP 227 CO 0.56 -0.66 1.70 0.45 0.68 0.00 0.00 175.17 177.90 1r3c h HIS 228 N 2.00 0.59 -0.13 2.11 3.86 -1.86 -0.03 115.15 121.69 1r3c h HIS 228 Ca -0.26 0.04 -0.08 0.00 -1.16 0.00 0.00 60.37 58.91 1r3c h HIS 228 Cb 1.22 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 29.56 1r3c h HIS 228 CO 0.35 -0.04 -0.24 0.82 0.86 0.00 0.00 177.93 179.69 1r3c h ILE 229 N 0.39 1.37 -0.64 2.45 1.08 -1.99 -1.52 117.51 118.65 1r3c h ILE 229 Ca 0.53 -1.50 0.01 0.00 -0.39 0.00 0.00 64.86 63.52 1r3c h ILE 229 Cb 0.98 2.03 -0.03 0.00 -3.07 0.00 0.00 36.82 36.73 1r3c h ILE 229 CO -0.52 0.44 0.41 -0.78 -0.69 0.00 0.00 178.15 177.01 1r3c h ASP 230 N -0.02 0.70 -0.76 1.72 3.58 -1.86 -1.32 116.42 118.46 1r3c h ASP 230 Ca 0.01 -0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.42 1r3c h ASP 230 Cb 0.82 -0.17 -0.04 0.00 1.72 0.00 0.00 39.33 41.67 1r3c h ASP 230 CO 0.05 0.50 0.38 -0.61 -2.88 0.00 0.00 179.24 176.68 1r3c h GLN 231 N 0.83 1.09 -0.77 0.28 4.15 -0.97 -1.03 115.11 118.69 1r3c h GLN 231 Ca 0.24 -0.15 -0.01 0.00 0.77 0.00 0.00 58.65 59.50 1r3c h GLN 231 Cb -0.05 -0.20 -0.04 0.00 0.21 0.00 0.00 27.48 27.40 1r3c h GLN 231 CO -0.07 0.83 0.43 1.25 -1.93 0.00 0.00 178.83 179.34 1r3c h LEU 232 N 1.07 0.95 -0.78 -2.39 5.85 -0.78 -0.90 115.31 118.34 1r3c h LEU 232 Ca 0.26 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.83 1r3c h LEU 232 Cb 0.09 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1r3c h LEU 232 CO -0.04 0.77 0.20 0.11 -0.34 0.00 0.00 178.44 179.14 1r3c h LYS 233 N 1.06 1.12 -0.77 1.25 1.57 -0.67 0.65 116.57 120.78 1r3c h LYS 233 Ca 0.27 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 1r3c h LYS 233 Cb 0.02 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 1r3c h LYS 233 CO -0.04 0.97 0.34 -0.07 -0.57 0.00 0.00 179.45 180.07 1r3c h LEU 234 N 1.07 1.03 -0.02 2.94 3.38 -0.62 -1.31 115.31 121.77 1r3c h LEU 234 Ca 0.23 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1r3c h LEU 234 Cb 0.33 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1r3c h LEU 234 CO -0.00 0.90 -0.00 0.40 0.09 0.00 0.00 178.44 179.82 1r3c h ILE 235 N 1.09 1.27 0.00 1.22 2.04 -0.68 -2.97 117.51 119.49 1r3c h ILE 235 Ca 0.26 -0.81 -0.03 0.00 1.00 0.00 0.00 64.86 65.27 1r3c h ILE 235 Cb 0.16 1.78 -0.00 0.00 -0.74 0.00 0.00 36.82 38.02 1r3c h ILE 235 CO -0.03 0.22 -0.16 -0.07 0.00 0.00 0.00 178.15 178.10 1r3c h LEU 236 N -0.29 0.00 -0.77 1.44 3.38 -0.79 -0.13 115.31 118.15 1r3c h LEU 236 Ca 0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 1r3c h LEU 236 Cb 0.35 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1r3c h LEU 236 CO 0.00 0.16 -0.02 -0.09 0.09 0.00 0.00 178.44 178.59 1r3c h ARG 237 N 0.00 0.91 0.00 1.13 9.65 -1.16 0.34 114.38 125.24 1r3c h ARG 237 Ca -0.00 -0.27 -0.02 0.00 -1.10 0.00 0.00 59.98 58.58 1r3c h ARG 237 Cb 0.37 -0.09 -0.00 0.00 -1.39 0.00 0.00 29.97 28.86 1r3c h ARG 237 CO 0.02 0.91 -0.14 1.25 2.80 0.00 0.00 179.97 184.81 1r3c h LEU 238 N 0.84 0.00 -0.81 3.80 5.85 -1.12 -3.39 115.31 120.47 1r3c h LEU 238 Ca 0.15 -0.69 0.00 0.00 0.84 0.00 0.00 57.88 58.18 1r3c h LEU 238 Cb 0.52 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.55 1r3c h LEU 238 CO 0.03 0.93 -0.18 1.33 -0.34 0.00 0.00 178.44 180.21 1r3c n VAL 239 N -4.63 0.00 0.00 1.05 0.24 -0.16 -0.90 118.33 113.92 1r3c n VAL 239 Ca -0.10 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 1r3c n VAL 239 Cb 0.38 0.61 0.00 0.00 -1.47 0.00 0.00 33.84 33.36 1r3c n VAL 239 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1r3c n GLY 240 N 1.30 -1.01 3.83 7.63 0.00 0.12 -4.22 105.19 112.83 1r3c n GLY 240 Ca 0.14 -1.60 -0.32 0.00 0.00 0.00 0.00 46.02 44.25 1r3c n GLY 240 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1r3c s THR 241 N -3.01 4.17 0.42 2.61 -4.23 -0.38 -4.64 115.64 110.59 1r3c s THR 241 Ca 0.00 0.85 -0.26 0.00 -1.18 0.00 0.00 61.69 61.10 1r3c s THR 241 Cb 0.00 -3.53 -0.09 0.00 1.34 0.00 0.00 72.50 70.22 1r3c s THR 241 CO 0.00 -0.77 1.43 -2.65 -0.54 0.00 0.00 174.62 172.08 1r3c n PRO 242 N -2.47 2.34 -2.63 3.99 -0.02 -1.26 -4.88 135.00 130.06 1r3c n PRO 242 Ca 0.07 0.83 -0.22 0.00 -2.02 0.00 0.00 63.50 62.16 1r3c n PRO 242 Cb 0.53 -2.60 0.07 0.00 -0.02 0.00 0.00 33.50 31.48 1r3c n PRO 242 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1r3c s GLY 243 N -0.37 1.79 0.36 -1.23 0.00 -1.26 -4.85 107.32 101.77 1r3c s GLY 243 Ca 0.58 -1.53 0.07 0.00 0.00 0.00 0.00 44.72 43.84 1r3c s GLY 243 CO 0.60 -1.12 1.95 0.00 0.00 0.00 0.00 173.10 174.52 1r3c h ALA 244 N -0.18 1.73 -0.17 3.20 0.00 -1.99 0.61 119.26 122.46 1r3c h ALA 244 Ca -0.39 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1r3c h ALA 244 Cb 1.28 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1r3c h ALA 244 CO 0.47 0.14 0.08 1.49 0.00 0.00 0.00 179.25 181.42 1r3c h GLU 245 N 0.74 0.24 -0.23 0.00 4.81 -2.01 -2.80 114.58 115.33 1r3c h GLU 245 Ca 0.33 -0.04 -0.18 0.00 -0.13 0.00 0.00 59.36 59.35 1r3c h GLU 245 Cb 0.33 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.67 1r3c h GLU 245 CO -0.12 0.28 -0.55 1.25 -0.73 0.00 0.00 179.01 179.15 1r3c h LEU 246 N 0.14 0.87 -0.89 1.64 5.85 -1.79 -3.21 115.31 117.93 1r3c h LEU 246 Ca 0.06 -0.56 0.20 0.00 0.84 0.00 0.00 57.88 58.41 1r3c h LEU 246 Cb 0.12 -0.25 -0.11 0.00 0.37 0.00 0.00 40.66 40.78 1r3c h LEU 246 CO -0.01 1.28 0.43 -0.07 -0.34 0.00 0.00 178.44 179.73 1r3c h LEU 247 N 0.51 0.44 -1.49 2.25 3.38 -0.82 0.66 115.31 120.23 1r3c h LEU 247 Ca -0.00 0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1r3c h LEU 247 Cb 1.16 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 1r3c h LEU 247 CO 0.12 0.09 -0.01 0.11 0.09 0.00 0.00 178.44 178.85 1r3c h LYS 248 N 0.51 0.31 0.00 1.13 1.57 -1.50 -2.12 116.57 116.47 1r3c h LYS 248 Ca 0.53 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1r3c h LYS 248 Cb 0.93 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.18 1r3c h LYS 248 CO -0.46 0.35 0.00 1.63 -0.57 0.00 0.00 179.45 180.40 1r3c n LYS 249 N -4.35 0.04 -2.73 3.15 5.02 0.21 -4.66 118.16 114.84 1r3c n LYS 249 Ca 0.00 0.11 -0.43 0.00 -2.02 0.00 0.00 58.31 55.97 1r3c n LYS 249 Cb 0.20 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.67 1r3c n LYS 249 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1r3c s ILE 250 N -2.95 4.25 0.10 -0.18 1.01 -0.80 -4.80 121.20 117.84 1r3c s ILE 250 Ca 0.12 0.63 -0.35 0.00 0.00 0.00 0.00 60.65 61.05 1r3c s ILE 250 Cb 0.15 -4.60 -0.15 0.00 0.01 0.00 0.00 42.46 37.87 1r3c s ILE 250 CO 0.40 -1.15 1.56 0.28 0.00 0.00 0.00 174.94 176.03 1r3c h SER 251 N 9.36 -1.49 -2.48 3.58 0.02 -1.53 -3.43 113.55 117.57 1r3c h SER 251 Ca -0.25 0.15 -0.54 0.00 -0.84 0.00 0.00 61.79 60.30 1r3c h SER 251 Cb 1.07 0.54 0.05 0.00 0.14 0.00 0.00 62.40 64.20 1r3c h SER 251 CO 1.12 -0.58 0.98 -0.24 -1.14 0.00 0.00 176.83 176.97 1r3c n SER 252 N -5.51 3.74 0.09 3.07 2.88 -1.24 -4.87 113.62 111.77 1r3c n SER 252 Ca -0.09 1.04 -0.07 0.00 -1.33 0.00 0.00 58.87 58.42 1r3c n SER 252 Cb 0.43 -1.52 -0.03 0.00 -0.75 0.00 0.00 64.21 62.34 1r3c n SER 252 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1r3c h GLU 253 N 7.09 0.07 0.18 -1.46 4.81 -1.97 -2.36 114.58 120.94 1r3c h GLU 253 Ca -0.45 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 58.69 1r3c h GLU 253 Cb 1.22 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1r3c h GLU 253 CO 0.94 0.92 -0.09 0.77 -0.73 0.00 0.00 179.01 180.82 1r3c h SER 254 N 0.03 -0.21 -0.09 1.04 0.02 -1.96 0.23 113.55 112.61 1r3c h SER 254 Ca -0.03 -0.16 0.03 0.00 -0.84 0.00 0.00 61.79 60.80 1r3c h SER 254 Cb 1.56 0.05 -0.03 0.00 0.14 0.00 0.00 62.40 64.13 1r3c h SER 254 CO 0.12 0.04 -0.08 0.00 -1.14 0.00 0.00 176.83 175.77 1r3c h ALA 255 N 0.32 -0.01 -0.70 3.77 0.00 -1.94 0.49 119.26 121.19 1r3c h ALA 255 Ca -0.02 0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.99 1r3c h ALA 255 Cb 0.35 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1r3c h ALA 255 CO 0.04 -0.55 0.38 -0.09 0.00 0.00 0.00 179.25 179.04 1r3c h ARG 256 N -0.10 0.67 -0.74 0.00 2.43 -1.35 0.19 114.38 115.47 1r3c h ARG 256 Ca 0.06 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.14 1r3c h ARG 256 Cb 0.19 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 1r3c h ARG 256 CO -0.15 0.44 0.25 -0.97 -1.51 0.00 0.00 179.97 178.03 1r3c h ASN 257 N 0.69 1.05 -0.36 -3.80 -1.24 0.21 -2.07 115.58 110.07 1r3c h ASN 257 Ca 0.32 -0.19 -0.08 0.00 0.71 0.00 0.00 56.30 57.06 1r3c h ASN 257 Cb 0.23 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 39.00 1r3c h ASN 257 CO -0.20 0.96 -0.10 0.22 -1.29 0.00 0.00 177.43 177.02 1r3c h TYR 258 N 1.09 0.78 -0.82 0.67 3.20 -0.03 -3.06 116.97 118.80 1r3c h TYR 258 Ca 0.24 -0.17 0.11 0.00 3.14 0.00 0.00 58.73 62.05 1r3c h TYR 258 Cb 0.27 -0.19 -0.08 0.00 1.54 0.00 0.00 36.73 38.27 1r3c h TYR 258 CO 0.02 0.86 0.45 0.82 -1.64 0.00 0.00 178.16 178.67 1r3c h ILE 259 N 0.49 0.84 0.00 1.81 2.04 -0.69 0.69 117.51 122.69 1r3c h ILE 259 Ca 0.09 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1r3c h ILE 259 Cb 0.61 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 1r3c h ILE 259 CO 0.04 0.13 0.00 0.00 0.00 0.00 0.00 178.15 178.32 1r3c n GLN 260 N -4.79 0.13 0.13 2.37 6.02 -0.81 -1.86 117.38 118.57 1r3c n GLN 260 Ca 0.15 0.44 0.13 0.00 -0.01 0.00 0.00 57.00 57.70 1r3c n GLN 260 Cb 0.33 -1.79 0.31 0.00 1.02 0.00 0.00 30.24 30.11 1r3c n GLN 260 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1r3c h SER 261 N 0.00 0.00 -3.62 1.08 4.64 -0.79 -3.46 113.55 111.40 1r3c h SER 261 Ca 0.00 -0.02 -0.51 0.00 -0.47 0.00 0.00 61.79 60.79 1r3c h SER 261 Cb 0.25 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.31 1r3c h SER 261 CO 0.00 0.01 0.23 -0.76 -0.87 0.00 0.00 176.83 175.44 1r3c s LEU 262 N -4.96 4.56 0.24 5.97 1.43 -0.78 -5.00 118.68 120.14 1r3c s LEU 262 Ca 0.09 1.72 -0.31 0.00 -1.03 0.00 0.00 54.13 54.60 1r3c s LEU 262 Cb 0.10 -3.47 -0.11 0.00 0.03 0.00 0.00 46.19 42.74 1r3c s LEU 262 CO 0.63 0.15 1.56 -0.89 0.23 0.00 0.00 176.35 178.04 1r3c s THR 263 N -1.24 2.37 0.57 5.49 2.01 -1.26 -4.93 115.64 118.65 1r3c s THR 263 Ca 0.39 0.29 -0.19 0.00 0.31 0.00 0.00 61.69 62.49 1r3c s THR 263 Cb -0.23 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.05 1r3c s THR 263 CO 0.27 0.04 1.21 -1.10 -0.69 0.00 0.00 174.62 174.34 1r3c s GLN 264 N 0.20 3.08 -0.05 4.92 -0.21 -1.26 -4.94 119.66 121.40 1r3c s GLN 264 Ca 0.66 1.83 -0.04 0.00 0.02 0.00 0.00 55.36 57.82 1r3c s GLN 264 Cb -0.45 -1.99 0.01 0.00 1.00 0.00 0.00 33.01 31.58 1r3c s GLN 264 CO 0.40 -1.12 0.12 -1.64 -2.12 0.00 0.00 175.29 170.93 1r3c s MET 265 N -3.25 0.13 0.53 2.91 -1.94 -1.26 -4.99 119.30 111.43 1r3c s MET 265 Ca 0.76 0.18 -0.09 0.00 -1.71 0.00 0.00 55.69 54.83 1r3c s MET 265 Cb -0.30 0.04 -0.05 0.00 2.01 0.00 0.00 34.83 36.53 1r3c s MET 265 CO 0.33 -0.03 0.90 -1.25 -0.01 0.00 0.00 175.02 174.96 1r3c s PRO 266 N 0.19 3.63 0.36 2.03 0.04 -1.26 -1.24 135.00 138.75 1r3c s PRO 266 Ca -0.01 0.52 -0.28 0.00 0.04 0.00 0.00 61.00 61.27 1r3c s PRO 266 Cb -0.02 -2.24 -0.10 0.00 0.04 0.00 0.00 34.50 32.18 1r3c s PRO 266 CO -0.01 -0.33 1.37 0.21 0.04 0.00 0.00 177.00 178.28 1r3c s LYS 267 N -4.73 4.19 0.75 4.56 2.20 -1.26 -4.11 119.74 121.34 1r3c s LYS 267 Ca 0.52 2.33 -0.10 0.00 -0.36 0.00 0.00 55.97 58.36 1r3c s LYS 267 Cb -0.11 -2.98 0.06 0.00 -1.51 0.00 0.00 37.83 33.30 1r3c s LYS 267 CO 0.45 -0.37 1.11 -1.64 -0.36 0.00 0.00 175.35 174.54 1r3c s MET 268 N -1.98 2.27 -0.50 4.03 -1.94 -0.08 -4.91 119.30 116.18 1r3c s MET 268 Ca 0.52 0.09 -0.25 0.00 -1.71 0.00 0.00 55.69 54.33 1r3c s MET 268 Cb -0.42 -2.04 0.03 0.00 2.01 0.00 0.00 34.83 34.42 1r3c s MET 268 CO 0.56 -1.34 0.96 1.21 -0.01 0.00 0.00 175.02 176.40 1r3c s ASN 269 N -4.50 6.44 0.54 3.03 3.84 -1.26 -4.90 114.94 118.12 1r3c s ASN 269 Ca 0.60 -0.05 0.20 0.00 0.21 0.00 0.00 52.86 53.82 1r3c s ASN 269 Cb -0.11 -2.46 1.43 0.00 -0.55 0.00 0.00 41.25 39.57 1r3c s ASN 269 CO 0.48 -1.16 2.17 -0.26 -2.79 0.00 0.00 177.10 175.55 1r3c h PHE 270 N 9.21 0.00 0.00 0.43 -1.00 -1.94 -0.94 116.94 122.70 1r3c h PHE 270 Ca -0.25 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.51 1r3c h PHE 270 Cb 1.07 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.63 1r3c h PHE 270 CO 0.90 0.00 -0.11 0.00 -1.61 0.00 0.00 178.31 177.49 1r3c h ALA 271 N 1.99 1.15 -0.01 2.45 0.00 -1.90 0.26 119.26 123.20 1r3c h ALA 271 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1r3c h ALA 271 Cb 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1r3c h ALA 271 CO -0.00 0.14 -0.32 0.09 0.00 0.00 0.00 179.25 179.17 1r3c n ASN 272 N -3.44 1.29 -0.13 0.00 3.02 -0.38 -3.82 115.26 111.80 1r3c n ASN 272 Ca -0.01 -1.06 -0.27 0.00 -0.03 0.00 0.00 54.58 53.21 1r3c n ASN 272 Cb 0.28 0.23 -0.10 0.00 -0.61 0.00 0.00 39.78 39.58 1r3c n ASN 272 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1r3c n VAL 273 N -0.48 1.53 -2.80 2.41 0.31 -0.34 -4.56 118.33 114.40 1r3c n VAL 273 Ca 0.11 -0.30 -0.43 0.00 -0.01 0.00 0.00 64.34 63.72 1r3c n VAL 273 Cb 0.38 -1.93 0.01 0.00 -0.91 0.00 0.00 33.84 31.39 1r3c n VAL 273 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1r3c n PHE 274 N -4.29 2.42 -1.71 3.52 3.72 0.78 -5.01 117.46 116.89 1r3c n PHE 274 Ca -0.49 -2.61 -0.43 0.00 -0.05 0.00 0.00 57.45 53.87 1r3c n PHE 274 Cb 0.83 -1.38 -0.03 0.00 -0.94 0.00 0.00 39.48 37.96 1r3c n PHE 274 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1r3c n ILE 275 N 1.46 0.01 -0.59 4.37 5.41 -1.25 -1.90 119.36 126.87 1r3c n ILE 275 Ca 0.33 -0.00 0.00 0.00 1.00 0.00 0.00 62.75 64.08 1r3c n ILE 275 Cb 0.32 -1.90 0.00 0.00 -0.71 0.00 0.00 39.64 37.35 1r3c n ILE 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1r3c n GLY 276 N 3.87 1.71 3.79 7.39 0.00 -1.26 -5.01 105.19 115.67 1r3c n GLY 276 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 1r3c n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r3c s ALA 277 N -3.54 2.75 0.10 4.61 0.00 -0.80 -4.94 121.76 119.94 1r3c s ALA 277 Ca 0.00 0.63 -0.35 0.00 0.00 0.00 0.00 51.96 52.24 1r3c s ALA 277 Cb 0.00 -3.29 -0.15 0.00 0.00 0.00 0.00 23.12 19.68 1r3c s ALA 277 CO 0.00 -0.66 1.53 -1.71 0.00 0.00 0.00 175.76 174.92 1r3c n ASN 278 N -1.44 2.63 -0.07 0.00 2.85 -1.26 -4.81 115.26 113.16 1r3c n ASN 278 Ca 0.10 1.09 0.17 0.00 -0.11 0.00 0.00 54.58 55.83 1r3c n ASN 278 Cb 0.52 -1.34 0.60 0.00 1.24 0.00 0.00 39.78 40.80 1r3c n ASN 278 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1r3c h PRO 279 N 5.76 0.19 -0.06 1.20 0.11 -1.98 0.10 132.00 137.33 1r3c h PRO 279 Ca -0.46 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.50 1r3c h PRO 279 Cb 1.28 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1r3c h PRO 279 CO 0.86 0.13 -0.58 -0.07 -0.21 0.00 0.00 178.00 178.13 1r3c h LEU 280 N 0.20 0.21 -0.25 2.35 3.38 -1.99 -1.38 115.31 117.83 1r3c h LEU 280 Ca 0.29 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 1r3c h LEU 280 Cb 0.89 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1r3c h LEU 280 CO -0.05 0.74 -0.12 0.00 0.09 0.00 0.00 178.44 179.10 1r3c h ALA 281 N 1.26 0.35 -0.32 1.53 0.00 -1.19 -1.96 119.26 118.92 1r3c h ALA 281 Ca -0.00 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.62 1r3c h ALA 281 Cb 1.06 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 1r3c h ALA 281 CO 0.09 0.21 0.15 0.28 0.00 0.00 0.00 179.25 179.98 1r3c h VAL 282 N 0.25 0.96 -0.49 0.00 2.07 -1.10 -1.30 116.25 116.63 1r3c h VAL 282 Ca 0.06 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.49 1r3c h VAL 282 Cb 0.63 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 1r3c h VAL 282 CO 0.04 0.06 0.31 -0.78 0.02 0.00 0.00 177.57 177.21 1r3c h ASP 283 N 0.31 0.51 -0.55 0.57 3.58 -1.20 -1.59 116.42 118.06 1r3c h ASP 283 Ca 0.14 -0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.56 1r3c h ASP 283 Cb 0.07 -0.11 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 1r3c h ASP 283 CO -0.11 0.36 0.26 0.25 -2.88 0.00 0.00 179.24 177.12 1r3c h LEU 284 N 0.62 0.72 -0.74 2.28 5.85 -1.00 -2.17 115.31 120.86 1r3c h LEU 284 Ca 0.19 -0.13 0.05 0.00 0.84 0.00 0.00 57.88 58.83 1r3c h LEU 284 Cb -0.02 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.77 1r3c h LEU 284 CO -0.07 0.65 0.45 -0.07 -0.34 0.00 0.00 178.44 179.06 1r3c h LEU 285 N 0.74 0.70 -1.42 2.25 3.38 -0.86 0.17 115.31 120.27 1r3c h LEU 285 Ca 0.19 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1r3c h LEU 285 Cb 0.13 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1r3c h LEU 285 CO -0.02 0.46 0.12 -0.33 0.09 0.00 0.00 178.44 178.76 1r3c h GLU 286 N 0.84 0.51 0.00 1.13 5.08 -0.97 0.27 114.58 121.43 1r3c h GLU 286 Ca 0.32 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.49 1r3c h GLU 286 Cb 0.13 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1r3c h GLU 286 CO -0.16 0.44 -0.59 0.87 -1.00 0.00 0.00 179.01 178.58 1r3c h LYS 287 N 0.51 0.00 0.13 2.33 1.79 -0.50 -3.31 116.57 117.51 1r3c h LYS 287 Ca 0.12 0.00 -0.35 0.00 -2.18 0.00 0.00 60.65 58.24 1r3c h LYS 287 Cb 0.14 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.78 1r3c h LYS 287 CO -0.01 0.59 -1.88 0.52 -1.08 0.00 0.00 179.45 177.58 1r3c h MET 288 N 0.00 0.28 -2.35 3.15 2.86 -0.49 -1.67 114.93 116.70 1r3c h MET 288 Ca -0.01 -0.48 -0.63 0.00 -2.06 0.00 0.00 59.70 56.53 1r3c h MET 288 Cb 1.29 0.18 -0.14 0.00 0.06 0.00 0.00 31.60 32.99 1r3c h MET 288 CO 0.08 1.18 1.54 1.28 1.06 0.00 0.00 176.91 182.05 1r3c n LEU 289 N -3.47 7.35 -4.75 1.22 4.77 0.89 -4.40 117.00 118.60 1r3c n LEU 289 Ca -0.28 -4.50 -0.35 0.00 -0.03 0.00 0.00 56.01 50.85 1r3c n LEU 289 Cb 1.06 -1.31 -0.08 0.00 -2.33 0.00 0.00 43.42 40.75 1r3c n LEU 289 CO 0.46 1.92 -0.19 -0.69 -1.33 0.00 0.00 177.39 177.55 1r3c s VAL 290 N -1.50 5.30 0.14 4.08 1.01 -1.26 -4.87 120.40 123.31 1r3c s VAL 290 Ca 0.57 0.15 -0.15 0.00 0.00 0.00 0.00 61.98 62.54 1r3c s VAL 290 Cb 0.27 -3.38 0.01 0.00 0.00 0.00 0.00 36.38 33.28 1r3c s VAL 290 CO -0.14 0.49 1.73 0.25 0.00 0.00 0.00 175.10 177.42 1r3c h LEU 291 N 6.24 0.56 -8.72 3.92 5.85 -1.90 -3.39 115.31 117.87 1r3c h LEU 291 Ca -0.44 -0.12 -0.56 0.00 0.84 0.00 0.00 57.88 57.60 1r3c h LEU 291 Cb 1.17 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 42.00 1r3c h LEU 291 CO 0.70 0.52 0.99 -0.62 -0.34 0.00 0.00 178.44 179.70 1r3c s ASP 292 N -5.79 6.48 0.49 1.25 -1.08 -1.26 -4.88 116.67 111.88 1r3c s ASP 292 Ca -0.13 0.53 0.19 0.00 -0.52 0.00 0.00 52.55 52.62 1r3c s ASP 292 Cb 0.11 -2.55 1.23 0.00 -1.46 0.00 0.00 42.92 40.25 1r3c s ASP 292 CO 0.75 -1.37 2.03 0.77 0.52 0.00 0.00 175.17 177.86 1r3c h SER 293 N 9.89 0.13 -0.04 -0.34 4.64 -1.98 0.52 113.55 126.38 1r3c h SER 293 Ca -0.25 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.08 1r3c h SER 293 Cb 1.08 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1r3c h SER 293 CO 1.13 0.08 0.04 0.44 -0.87 0.00 0.00 176.83 177.64 1r3c h ASP 294 N 0.15 0.00 -0.02 4.97 3.32 -1.94 -2.81 116.42 120.09 1r3c h ASP 294 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1r3c h ASP 294 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1r3c h ASP 294 CO -0.03 0.00 -0.26 0.29 -1.72 0.00 0.00 179.24 177.52 1r3c n LYS 295 N -3.98 1.68 -2.01 3.56 5.02 0.17 -4.98 118.16 117.61 1r3c n LYS 295 Ca -0.02 -1.37 -0.35 0.00 -2.02 0.00 0.00 58.31 54.55 1r3c n LYS 295 Cb 0.13 -1.45 0.03 0.00 -0.02 0.00 0.00 35.03 33.72 1r3c n LYS 295 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1r3c s ARG 296 N -2.21 3.01 0.45 1.97 0.52 -1.06 -4.98 118.95 116.65 1r3c s ARG 296 Ca 0.22 1.68 -0.23 0.00 -0.52 0.00 0.00 55.73 56.88 1r3c s ARG 296 Cb 0.18 -1.95 -0.08 0.00 0.52 0.00 0.00 34.95 33.62 1r3c s ARG 296 CO 0.44 -1.14 1.13 -1.50 0.02 0.00 0.00 175.30 174.25 1r3c s ILE 297 N -1.80 3.30 0.53 1.52 2.07 -0.63 -5.03 121.20 121.16 1r3c s ILE 297 Ca 0.74 0.96 -0.01 0.00 -1.41 0.00 0.00 60.65 60.93 1r3c s ILE 297 Cb -0.26 -3.48 0.02 0.00 0.13 0.00 0.00 42.46 38.87 1r3c s ILE 297 CO 0.33 -0.03 0.78 0.42 -1.91 0.00 0.00 174.94 174.53 1r3c s THR 298 N -1.61 3.33 0.18 4.00 -4.23 -1.26 -4.89 115.64 111.15 1r3c s THR 298 Ca 0.63 -0.44 -0.13 0.00 -1.18 0.00 0.00 61.69 60.58 1r3c s THR 298 Cb -0.26 -3.27 0.08 0.00 1.34 0.00 0.00 72.50 70.39 1r3c s THR 298 CO 0.32 -0.22 1.79 0.00 -0.54 0.00 0.00 174.62 175.97 1r3c h ALA 299 N 0.09 0.76 -0.73 3.99 0.00 -1.92 0.21 119.26 121.65 1r3c h ALA 299 Ca -0.44 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.33 1r3c h ALA 299 Cb 1.27 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 1r3c h ALA 299 CO 0.56 0.27 0.30 0.00 0.00 0.00 0.00 179.25 180.39 1r3c h ALA 300 N 1.15 1.14 -0.27 0.00 0.00 -1.93 -1.74 119.26 117.62 1r3c h ALA 300 Ca 0.21 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1r3c h ALA 300 Cb 0.04 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1r3c h ALA 300 CO -0.03 0.62 -0.17 1.96 0.00 0.00 0.00 179.25 181.62 1r3c h GLN 301 N 1.06 0.59 -0.75 0.00 4.20 -1.83 -3.18 115.11 115.21 1r3c h GLN 301 Ca 0.25 -0.28 0.04 0.00 0.06 0.00 0.00 58.65 58.72 1r3c h GLN 301 Cb 0.19 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.92 1r3c h GLN 301 CO -0.02 0.86 0.49 0.00 -0.67 0.00 0.00 178.83 179.49 1r3c h ALA 302 N 0.72 1.60 -0.00 3.87 0.00 -0.22 -1.64 119.26 123.59 1r3c h ALA 302 Ca 0.05 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1r3c h ALA 302 Cb 0.71 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1r3c h ALA 302 CO 0.05 0.31 -0.05 -0.07 0.00 0.00 0.00 179.25 179.49 1r3c h LEU 303 N 0.87 0.00 -0.71 0.00 3.38 -1.30 -0.89 115.31 116.67 1r3c h LEU 303 Ca 0.31 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 1r3c h LEU 303 Cb 0.12 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1r3c h LEU 303 CO -0.09 0.06 0.00 0.00 0.09 0.00 0.00 178.44 178.49 1r3c n ALA 304 N -2.53 2.57 -1.76 1.53 0.00 -0.62 -4.73 120.51 114.96 1r3c n ALA 304 Ca -0.03 -0.38 -0.39 0.00 0.00 0.00 0.00 53.44 52.64 1r3c n ALA 304 Cb 0.13 -1.20 -0.04 0.00 0.00 0.00 0.00 19.45 18.34 1r3c n ALA 304 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1r3c s HIS 305 N -1.91 3.48 0.59 0.00 5.04 -0.34 -4.92 115.29 117.22 1r3c s HIS 305 Ca 0.35 1.68 0.29 0.00 -1.54 0.00 0.00 55.06 55.83 1r3c s HIS 305 Cb 0.18 -3.26 1.48 0.00 0.04 0.00 0.00 32.58 31.01 1r3c s HIS 305 CO 0.28 -0.62 1.90 0.00 -2.34 0.00 0.00 174.74 173.95 1r3c h ALA 306 N 3.46 2.20 -0.21 1.58 0.00 -1.90 -0.87 119.26 123.53 1r3c h ALA 306 Ca -0.47 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.48 1r3c h ALA 306 Cb 1.21 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1r3c h ALA 306 CO 0.66 -0.73 0.18 -0.92 0.00 0.00 0.00 179.25 178.43 1r3c h TYR 307 N 0.00 0.00 -0.61 0.00 3.20 -1.91 -1.54 116.97 116.11 1r3c h TYR 307 Ca 0.22 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.09 1r3c h TYR 307 Cb 1.20 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.47 1r3c h TYR 307 CO 0.00 0.00 0.00 1.19 -1.64 0.00 0.00 178.16 177.71 1r3c n PHE 308 N -4.16 1.17 -0.33 -3.82 3.72 -0.33 -4.69 117.46 109.02 1r3c n PHE 308 Ca 0.02 -0.58 0.27 0.00 -0.05 0.00 0.00 57.45 57.11 1r3c n PHE 308 Cb 0.31 -0.15 0.52 0.00 -0.94 0.00 0.00 39.48 39.22 1r3c n PHE 308 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1r3c h ALA 309 N 3.70 2.04 0.00 4.37 0.00 -1.38 0.32 119.26 128.31 1r3c h ALA 309 Ca 0.00 0.22 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1r3c h ALA 309 Cb 1.23 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 1r3c h ALA 309 CO 0.14 -0.71 -0.16 0.37 0.00 0.00 0.00 179.25 178.88 1r3c h GLN 310 N 0.21 0.00 0.00 0.00 4.15 -1.84 -3.33 115.11 114.29 1r3c h GLN 310 Ca 0.78 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 60.18 1r3c h GLN 310 Cb 1.89 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 29.57 1r3c h GLN 310 CO -0.66 0.16 -1.20 0.66 -1.93 0.00 0.00 178.83 175.86 1r3c n TYR 311 N -3.54 0.00 -1.71 3.99 4.01 0.91 -5.04 117.16 115.77 1r3c n TYR 311 Ca -0.01 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.30 1r3c n TYR 311 Cb 0.31 -0.11 -0.03 0.00 -0.31 0.00 0.00 39.34 39.20 1r3c n TYR 311 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1r3c n HIS 312 N -1.75 2.62 -3.31 -0.72 -0.00 0.09 -4.98 115.22 107.19 1r3c n HIS 312 Ca -0.02 0.16 -0.09 0.00 0.46 0.00 0.00 57.72 58.23 1r3c n HIS 312 Cb 0.21 -2.62 -0.06 0.00 -0.12 0.00 0.00 29.99 27.41 1r3c n HIS 312 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 1r3c s ASP 313 N 0.92 0.45 0.66 0.26 -1.08 -1.26 -4.99 116.67 111.63 1r3c s ASP 313 Ca 0.73 -0.46 0.34 0.00 -0.52 0.00 0.00 52.55 52.64 1r3c s ASP 313 Cb -0.55 1.07 1.87 0.00 -1.46 0.00 0.00 42.92 43.84 1r3c s ASP 313 CO 0.38 -0.35 2.06 1.55 0.52 0.00 0.00 175.17 179.33 1r3c h PRO 314 N 8.10 0.00 -0.12 4.34 0.13 -1.96 0.16 132.00 142.66 1r3c h PRO 314 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1r3c h PRO 314 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1r3c h PRO 314 CO 0.26 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.78 1r3c n ASP 315 N -2.99 2.39 -2.36 1.44 8.00 -1.26 -4.24 116.55 117.54 1r3c n ASP 315 Ca -0.02 -1.80 -0.08 0.00 0.71 0.00 0.00 54.79 53.61 1r3c n ASP 315 Cb 0.29 -0.07 0.04 0.00 -0.02 0.00 0.00 41.12 41.37 1r3c n ASP 315 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1r3c n ASP 316 N 0.84 2.69 -3.23 -2.24 2.03 0.57 -4.85 116.55 112.35 1r3c n ASP 316 Ca 0.17 -2.70 -0.25 0.00 0.52 0.00 0.00 54.79 52.53 1r3c n ASP 316 Cb 0.48 -0.42 -0.08 0.00 -0.72 0.00 0.00 41.12 40.38 1r3c n ASP 316 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1r3c n GLU 317 N -0.58 0.69 -1.55 -0.67 1.02 -1.21 -4.89 120.64 113.45 1r3c n GLU 317 Ca 0.20 -3.26 -0.35 0.00 -0.02 0.00 0.00 57.16 53.73 1r3c n GLU 317 Cb 0.88 -1.32 0.08 0.00 -0.02 0.00 0.00 31.44 31.06 1r3c n GLU 317 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1r3c s PRO 318 N -1.04 2.30 0.34 3.49 0.04 -1.26 -4.95 135.00 133.92 1r3c s PRO 318 Ca 0.35 1.82 0.07 0.00 0.04 0.00 0.00 61.00 63.28 1r3c s PRO 318 Cb 0.15 -1.85 -0.02 0.00 0.04 0.00 0.00 34.50 32.82 1r3c s PRO 318 CO -0.12 -1.72 0.35 0.14 0.04 0.00 0.00 177.00 175.68 1r3c s VAL 319 N -1.84 3.70 0.42 -0.36 -7.23 -1.26 -4.16 120.40 109.68 1r3c s VAL 319 Ca 0.76 -1.25 -0.00 0.00 -1.81 0.00 0.00 61.98 59.68 1r3c s VAL 319 Cb -0.31 -3.26 -0.01 0.00 0.56 0.00 0.00 36.38 33.36 1r3c s VAL 319 CO 0.43 -0.17 0.64 0.00 -0.31 0.00 0.00 175.10 175.70 1r3c s ALA 320 N -2.26 3.71 0.68 1.32 0.00 -1.25 -5.02 121.76 118.93 1r3c s ALA 320 Ca 0.42 -0.97 -0.14 0.00 0.00 0.00 0.00 51.96 51.27 1r3c s ALA 320 Cb -0.07 -2.16 0.01 0.00 0.00 0.00 0.00 23.12 20.89 1r3c s ALA 320 CO 0.28 -0.27 1.09 -0.51 0.00 0.00 0.00 175.76 176.34 1r3c s ASP 321 N -4.16 5.14 0.34 0.00 1.01 -1.26 -4.76 116.67 112.99 1r3c s ASP 321 Ca 0.46 1.87 -0.28 0.00 0.71 0.00 0.00 52.55 55.31 1r3c s ASP 321 Cb -0.10 -2.53 -0.12 0.00 1.01 0.00 0.00 42.92 41.18 1r3c s ASP 321 CO 0.38 -1.61 1.31 -2.65 0.21 0.00 0.00 175.17 172.82 1r3c n PRO 322 N -2.69 2.19 -4.06 8.23 -0.02 -1.26 -4.73 135.00 132.66 1r3c n PRO 322 Ca 0.09 0.77 -0.33 0.00 -2.02 0.00 0.00 63.50 62.01 1r3c n PRO 322 Cb 0.53 -2.37 -0.15 0.00 -0.02 0.00 0.00 33.50 31.49 1r3c n PRO 322 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1r3c s TYR 323 N -1.08 3.14 -0.55 6.00 5.04 -1.26 -5.08 117.35 123.57 1r3c s TYR 323 Ca 0.55 -2.09 -0.28 0.00 -2.44 0.00 0.00 57.07 52.82 1r3c s TYR 323 Cb -0.56 -1.95 0.03 0.00 0.35 0.00 0.00 41.96 39.83 1r3c s TYR 323 CO 0.62 -0.85 1.13 0.34 -1.34 0.00 0.00 175.55 175.45 1r3c s ASP 324 N 1.17 6.47 -0.32 4.32 2.15 -1.26 -4.89 116.67 124.32 1r3c s ASP 324 Ca -0.05 0.11 0.08 0.00 0.43 0.00 0.00 52.55 53.12 1r3c s ASP 324 Cb -0.18 -2.53 0.50 0.00 -0.30 0.00 0.00 42.92 40.41 1r3c s ASP 324 CO -0.07 -1.37 1.48 0.00 -0.17 0.00 0.00 175.17 175.04 1r3c n GLN 325 N 8.09 2.07 0.31 4.34 10.64 -1.26 -4.60 117.38 136.97 1r3c n GLN 325 Ca 0.08 -3.31 0.20 0.00 -1.83 0.00 0.00 57.00 52.14 1r3c n GLN 325 Cb 0.49 -1.90 1.00 0.00 -0.86 0.00 0.00 30.24 28.97 1r3c n GLN 325 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1r3c h SER 326 N 1.19 0.00 0.23 2.61 4.64 -2.02 -1.44 113.55 118.76 1r3c h SER 326 Ca 0.27 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.57 1r3c h SER 326 Cb 1.61 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.69 1r3c h SER 326 CO 0.51 0.01 -0.09 2.19 -0.87 0.00 0.00 176.83 178.59 1r3c h PHE 327 N 0.00 0.00 -0.10 4.77 -0.00 -1.97 -2.30 116.94 117.34 1r3c h PHE 327 Ca -0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.97 58.00 1r3c h PHE 327 Cb 0.18 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.13 1r3c h PHE 327 CO 0.00 0.09 0.14 0.93 -0.00 0.00 0.00 178.31 179.47 1r3c h GLU 328 N 0.00 0.00 -0.17 6.09 4.39 -1.64 0.29 114.58 123.54 1r3c h GLU 328 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1r3c h GLU 328 Cb 0.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1r3c h GLU 328 CO 0.01 0.00 0.00 0.43 -1.16 0.00 0.00 179.01 178.29 1r3c n SER 329 N -3.59 3.13 -4.74 1.42 7.64 -0.87 -4.96 113.62 111.64 1r3c n SER 329 Ca -0.00 -1.97 -0.41 0.00 1.01 0.00 0.00 58.87 57.50 1r3c n SER 329 Cb 0.24 -0.10 -0.05 0.00 -1.01 0.00 0.00 64.21 63.29 1r3c n SER 329 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1r3c s ARG 330 N -1.73 4.69 -0.62 1.43 1.81 0.10 -5.00 118.95 119.64 1r3c s ARG 330 Ca 0.31 1.62 -0.11 0.00 -1.72 0.00 0.00 55.73 55.83 1r3c s ARG 330 Cb 0.20 -3.29 0.16 0.00 -0.45 0.00 0.00 34.95 31.58 1r3c s ARG 330 CO 0.30 0.24 0.52 0.34 -0.68 0.00 0.00 175.30 176.02 1r3c s ASP 331 N -0.48 6.04 0.28 0.23 -1.08 -1.26 -5.05 116.67 115.35 1r3c s ASP 331 Ca 0.46 -2.31 0.12 0.00 -0.52 0.00 0.00 52.55 50.30 1r3c s ASP 331 Cb -0.28 -2.08 -0.05 0.00 -1.46 0.00 0.00 42.92 39.05 1r3c s ASP 331 CO 0.34 -0.63 -0.19 -0.76 0.52 0.00 0.00 175.17 174.45 1r3c s LEU 332 N 0.77 2.60 0.51 -1.34 1.43 -1.26 -5.15 118.68 116.24 1r3c s LEU 332 Ca 0.11 -1.04 -0.08 0.00 -1.03 0.00 0.00 54.13 52.09 1r3c s LEU 332 Cb -0.21 -1.09 -0.04 0.00 0.03 0.00 0.00 46.19 44.88 1r3c s LEU 332 CO -0.03 0.02 0.86 -0.76 0.23 0.00 0.00 176.35 176.67 1r3c s LEU 333 N -3.52 3.54 0.21 1.79 1.43 -1.26 -4.87 118.68 116.00 1r3c s LEU 333 Ca 0.30 1.13 -0.16 0.00 -1.03 0.00 0.00 54.13 54.37 1r3c s LEU 333 Cb -0.04 -4.10 0.21 0.00 0.03 0.00 0.00 46.19 42.28 1r3c s LEU 333 CO 0.15 -0.64 1.60 0.40 0.23 0.00 0.00 176.35 178.09 1r3c h ILE 334 N 0.23 0.23 0.00 -0.59 2.04 -1.92 0.77 117.51 118.27 1r3c h ILE 334 Ca -0.46 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 1r3c h ILE 334 Cb 1.20 0.23 -0.00 0.00 -0.74 0.00 0.00 36.82 37.51 1r3c h ILE 334 CO 0.62 0.00 -0.04 0.44 0.00 0.00 0.00 178.15 179.17 1r3c h ASP 335 N -0.08 0.00 -0.07 1.72 3.32 -1.95 0.14 116.42 119.50 1r3c h ASP 335 Ca 0.29 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.13 1r3c h ASP 335 Cb 0.54 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.10 1r3c h ASP 335 CO -0.71 0.04 -0.80 -0.33 -1.72 0.00 0.00 179.24 175.72 1r3c h GLU 336 N 0.00 0.66 -0.35 3.56 5.08 -1.26 0.92 114.58 123.18 1r3c h GLU 336 Ca -0.00 -0.62 -0.08 0.00 -1.00 0.00 0.00 59.36 57.66 1r3c h GLU 336 Cb 0.07 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1r3c h GLU 336 CO 0.00 1.23 -0.11 -1.49 -1.00 0.00 0.00 179.01 177.64 1r3c h TRP 337 N 0.32 0.67 -0.24 4.33 -0.00 -0.50 -1.07 115.95 119.45 1r3c h TRP 337 Ca -0.08 -0.11 -0.05 0.00 -0.00 0.00 0.00 58.89 58.65 1r3c h TRP 337 Cb 1.45 -0.18 -0.01 0.00 -0.00 0.00 0.00 29.16 30.43 1r3c h TRP 337 CO 0.11 0.71 -0.05 -0.22 -0.00 0.00 0.00 178.44 178.99 1r3c h LYS 338 N 0.56 0.46 -0.49 0.49 3.64 -0.64 -1.01 116.57 119.59 1r3c h LYS 338 Ca 0.10 -0.17 -0.06 0.00 -1.27 0.00 0.00 60.65 59.26 1r3c h LYS 338 Cb 0.53 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 1r3c h LYS 338 CO 0.03 0.68 0.08 1.03 -2.27 0.00 0.00 179.45 178.99 1r3c h SER 339 N 0.20 0.72 -0.50 4.20 0.87 -0.58 -0.41 113.55 118.05 1r3c h SER 339 Ca 0.06 -0.14 -0.05 0.00 -1.23 0.00 0.00 61.79 60.44 1r3c h SER 339 Cb 0.50 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.25 1r3c h SER 339 CO 0.02 0.74 0.13 -0.07 -0.53 0.00 0.00 176.83 177.12 1r3c h LEU 340 N 0.73 0.75 -0.60 2.23 3.38 -1.02 -1.89 115.31 118.90 1r3c h LEU 340 Ca 0.16 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1r3c h LEU 340 Cb 0.34 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1r3c h LEU 340 CO 0.01 0.78 0.36 0.74 0.09 0.00 0.00 178.44 180.41 1r3c h THR 341 N 0.68 1.18 -0.23 0.22 2.02 -0.76 -2.45 112.91 113.57 1r3c h THR 341 Ca 0.16 -0.41 0.04 0.00 0.77 0.00 0.00 66.41 66.97 1r3c h THR 341 Cb 0.31 0.37 -0.04 0.00 -1.74 0.00 0.00 68.15 67.06 1r3c h THR 341 CO -0.00 0.19 -0.02 0.22 0.37 0.00 0.00 175.52 176.28 1r3c h TYR 342 N 0.81 -0.05 -0.88 3.16 3.20 -0.75 -0.08 116.97 122.39 1r3c h TYR 342 Ca 0.21 0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.15 1r3c h TYR 342 Cb -0.01 0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.26 1r3c h TYR 342 CO -0.02 -0.06 0.57 -0.44 -1.64 0.00 0.00 178.16 176.58 1r3c h ASP 343 N 0.05 0.90 -0.04 -2.11 3.32 -1.12 -0.47 116.42 116.95 1r3c h ASP 343 Ca 0.11 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 1r3c h ASP 343 Cb 0.15 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1r3c h ASP 343 CO -0.20 0.60 -0.24 -0.33 -1.72 0.00 0.00 179.24 177.34 1r3c h GLU 344 N 1.03 0.46 0.23 3.56 4.39 -0.83 -0.81 114.58 122.60 1r3c h GLU 344 Ca 0.37 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.89 1r3c h GLU 344 Cb 0.13 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1r3c h GLU 344 CO -0.13 0.67 -0.11 0.28 -1.16 0.00 0.00 179.01 178.56 1r3c h VAL 345 N 0.41 0.82 0.00 3.13 2.07 0.47 -2.86 116.25 120.28 1r3c h VAL 345 Ca 0.06 -0.76 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 1r3c h VAL 345 Cb 0.65 1.23 -0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1r3c h VAL 345 CO 0.05 0.16 -0.02 0.16 0.02 0.00 0.00 177.57 177.93 1r3c h ILE 346 N -0.73 0.06 -0.01 4.57 3.07 -1.14 -2.55 117.51 120.78 1r3c h ILE 346 Ca -0.03 -0.53 0.00 0.00 1.55 0.00 0.00 64.86 65.85 1r3c h ILE 346 Cb 0.49 1.50 0.00 0.00 -0.27 0.00 0.00 36.82 38.54 1r3c h ILE 346 CO 0.05 0.02 -0.18 -1.54 -1.05 0.00 0.00 178.15 175.45 1r3c n SER 347 N -3.13 1.31 -4.69 2.16 3.41 -0.32 -4.93 113.62 107.42 1r3c n SER 347 Ca 0.00 -1.16 -0.44 0.00 -0.26 0.00 0.00 58.87 57.02 1r3c n SER 347 Cb 0.30 0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 64.33 1r3c n SER 347 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1r3c n PHE 348 N -0.28 2.45 -4.02 7.33 7.35 -0.96 -4.98 117.46 124.35 1r3c n PHE 348 Ca 0.14 0.28 -0.34 0.00 -0.76 0.00 0.00 57.45 56.77 1r3c n PHE 348 Cb 0.37 -2.55 -0.15 0.00 0.35 0.00 0.00 39.48 37.50 1r3c n PHE 348 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1r3c s VAL 349 N 0.44 2.68 0.39 -2.13 1.01 -1.26 -5.07 120.40 116.46 1r3c s VAL 349 Ca 0.71 -0.76 -0.25 0.00 0.00 0.00 0.00 61.98 61.69 1r3c s VAL 349 Cb -0.60 -2.19 -0.12 0.00 0.00 0.00 0.00 36.38 33.47 1r3c s VAL 349 CO 0.43 0.46 0.90 -2.65 0.00 0.00 0.00 175.10 174.25 1r3c n PRO 350 N 4.70 1.15 -2.19 2.72 -0.02 -1.26 -4.95 135.00 135.16 1r3c n PRO 350 Ca -0.19 0.41 -0.33 0.00 -2.02 0.00 0.00 63.50 61.37 1r3c n PRO 350 Cb 0.50 -1.87 -0.00 0.00 -0.02 0.00 0.00 33.50 32.11 1r3c n PRO 350 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1r3c s PRO 351 N -1.83 3.42 0.00 0.52 0.04 -1.26 -5.17 135.00 130.73 1r3c s PRO 351 Ca 0.63 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.96 1r3c s PRO 351 Cb -0.60 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 31.90 1r3c s PRO 351 CO 0.57 -0.74 0.37 -2.30 0.04 0.00 0.00 177.00 174.94