#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h1q n MET 1 N 0.00 2.19 -0.26 -1.46 2.81 -1.26 -4.72 117.12 114.41 1h1q n MET 1 Ca 0.00 -1.83 0.00 0.00 -1.81 0.00 0.00 57.70 54.06 1h1q n MET 1 Cb 0.00 -1.42 0.07 0.00 -0.71 0.00 0.00 33.22 31.16 1h1q n MET 1 CO 0.00 0.00 0.00 1.05 1.51 0.00 0.00 175.97 178.53 1h1q h GLU 2 N 3.14 -0.03 0.00 0.03 4.11 -2.06 0.87 114.58 120.64 1h1q h GLU 2 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1h1q h GLU 2 Cb 0.71 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1h1q h GLU 2 CO 0.00 -0.02 0.00 0.09 0.07 0.00 0.00 179.01 179.15 1h1q n ASN 3 N -5.49 0.00 -4.75 3.06 3.02 -1.26 -4.80 115.26 105.04 1h1q n ASN 3 Ca 0.10 -0.41 -0.36 0.00 -0.03 0.00 0.00 54.58 53.88 1h1q n ASN 3 Cb 0.39 -0.11 -0.08 0.00 -0.61 0.00 0.00 39.78 39.37 1h1q n ASN 3 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1h1q s PHE 4 N -2.22 3.40 -0.21 3.10 0.08 0.30 -0.36 117.98 122.05 1h1q s PHE 4 Ca 0.27 0.31 -0.07 0.00 0.12 0.00 0.00 56.93 57.56 1h1q s PHE 4 Cb 0.14 -2.01 -0.03 0.00 -0.57 0.00 0.00 43.02 40.55 1h1q s PHE 4 CO 0.27 0.43 0.06 -1.14 -0.10 0.00 0.00 175.22 174.75 1h1q s GLN 5 N -0.30 3.79 0.03 0.44 2.00 0.21 -4.93 119.66 120.90 1h1q s GLN 5 Ca 0.10 -0.43 -0.29 0.00 -2.00 0.00 0.00 55.36 52.74 1h1q s GLN 5 Cb -0.12 -3.25 -0.04 0.00 0.80 0.00 0.00 33.01 30.40 1h1q s GLN 5 CO 0.01 0.04 0.92 0.15 -0.50 0.00 0.00 175.29 175.92 1h1q s LYS 6 N 1.00 4.58 -0.26 1.67 1.02 -1.26 -1.30 119.74 125.19 1h1q s LYS 6 Ca 0.04 1.34 -0.12 0.00 0.02 0.00 0.00 55.97 57.24 1h1q s LYS 6 Cb -0.14 -3.43 -0.11 0.00 -0.52 0.00 0.00 37.83 33.63 1h1q s LYS 6 CO 0.03 0.06 -0.33 0.28 -0.92 0.00 0.00 175.35 174.48 1h1q n VAL 7 N 3.49 1.42 -3.57 3.17 0.31 -0.14 -4.95 118.33 118.06 1h1q n VAL 7 Ca 0.03 -0.37 -0.13 0.00 -0.01 0.00 0.00 64.34 63.86 1h1q n VAL 7 Cb 0.50 -1.82 -0.06 0.00 -0.91 0.00 0.00 33.84 31.56 1h1q n VAL 7 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1h1q s GLU 8 N -2.47 0.77 0.27 5.55 -1.05 -1.22 -4.98 118.70 115.57 1h1q s GLU 8 Ca -0.36 0.31 -0.29 0.00 -0.15 0.00 0.00 54.97 54.47 1h1q s GLU 8 Cb 0.14 0.36 -0.09 0.00 -0.44 0.00 0.00 34.13 34.10 1h1q s GLU 8 CO 0.46 -0.21 1.14 0.21 0.95 0.00 0.00 175.26 177.81 1h1q s LYS 9 N -0.86 4.58 -0.24 -4.83 2.20 -1.26 -0.16 119.74 119.17 1h1q s LYS 9 Ca -0.04 1.87 0.07 0.00 -0.36 0.00 0.00 55.97 57.50 1h1q s LYS 9 Cb -0.01 -3.18 -0.19 0.00 -1.51 0.00 0.00 37.83 32.94 1h1q s LYS 9 CO 0.04 0.12 -0.14 -0.89 -0.36 0.00 0.00 175.35 174.12 1h1q n ILE 10 N 1.34 1.42 -2.62 5.43 5.41 0.16 -4.82 119.36 125.68 1h1q n ILE 10 Ca -0.00 -0.64 0.00 0.00 1.00 0.00 0.00 62.75 63.11 1h1q n ILE 10 Cb 0.44 -1.12 0.00 0.00 -0.71 0.00 0.00 39.64 38.26 1h1q n ILE 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1h1q n GLY 11 N 2.14 -1.91 2.81 7.39 0.00 -1.04 -5.04 105.19 109.55 1h1q n GLY 11 Ca -0.41 -1.25 -0.21 0.00 0.00 0.00 0.00 46.02 44.15 1h1q n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h1q s GLU 12 N -1.97 0.58 0.00 1.61 2.02 -1.26 -1.37 118.70 118.31 1h1q s GLU 12 Ca 0.00 0.05 0.00 0.00 0.02 0.00 0.00 54.97 55.04 1h1q s GLU 12 Cb 0.00 -0.81 0.00 0.00 0.10 0.00 0.00 34.13 33.42 1h1q s GLU 12 CO 0.00 -0.21 0.00 0.41 0.02 0.00 0.00 175.26 175.48 1h1q n GLY 13 N 4.63 2.16 0.39 -1.39 0.00 -1.26 -4.97 105.19 104.75 1h1q n GLY 13 Ca -0.16 -1.87 0.21 0.00 0.00 0.00 0.00 46.02 44.20 1h1q n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h1q h THR 14 N 0.00 0.58 -3.62 2.61 1.03 -1.96 -3.42 112.91 108.12 1h1q h THR 14 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 66.41 66.34 1h1q h THR 14 Cb 0.00 0.70 -0.10 0.00 -1.07 0.00 0.00 68.15 67.68 1h1q h THR 14 CO 0.00 0.00 -0.12 -0.72 -0.01 0.00 0.00 175.52 174.67 1h1q s TYR 15 N -4.85 0.28 0.03 0.00 1.13 -1.26 -5.08 117.35 107.61 1h1q s TYR 15 Ca -0.05 -0.64 0.00 0.00 -1.41 0.00 0.00 57.07 54.98 1h1q s TYR 15 Cb 0.18 0.19 0.00 0.00 -1.10 0.00 0.00 41.96 41.23 1h1q s TYR 15 CO 0.66 -0.93 0.00 0.41 -2.51 0.00 0.00 175.55 173.17 1h1q n GLY 16 N -0.35 -0.50 3.26 5.49 0.00 -1.26 -4.90 105.19 106.93 1h1q n GLY 16 Ca -0.04 -0.45 -0.27 0.00 0.00 0.00 0.00 46.02 45.25 1h1q n GLY 16 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h1q s VAL 17 N -0.31 1.76 -0.15 1.61 1.01 -0.70 -4.12 120.40 119.49 1h1q s VAL 17 Ca 0.00 -1.13 -0.02 0.00 0.00 0.00 0.00 61.98 60.83 1h1q s VAL 17 Cb 0.00 -1.50 -0.02 0.00 0.00 0.00 0.00 36.38 34.86 1h1q s VAL 17 CO 0.00 0.33 -0.09 -0.69 0.00 0.00 0.00 175.10 174.65 1h1q s VAL 18 N -0.69 3.34 0.21 2.92 1.01 -0.47 -0.25 120.40 126.46 1h1q s VAL 18 Ca 0.08 -0.55 0.11 0.00 0.00 0.00 0.00 61.98 61.63 1h1q s VAL 18 Cb -0.09 -2.44 -0.05 0.00 0.00 0.00 0.00 36.38 33.81 1h1q s VAL 18 CO 0.01 0.50 -0.21 -0.31 0.00 0.00 0.00 175.10 175.08 1h1q s TYR 19 N 0.53 2.34 0.11 5.22 1.51 -0.47 0.36 117.35 126.94 1h1q s TYR 19 Ca -0.06 -0.34 -0.25 0.00 -1.01 0.00 0.00 57.07 55.40 1h1q s TYR 19 Cb -0.15 -1.12 -0.07 0.00 -0.11 0.00 0.00 41.96 40.51 1h1q s TYR 19 CO 0.03 0.55 0.78 0.21 -1.11 0.00 0.00 175.55 176.02 1h1q s LYS 20 N -2.87 4.55 0.05 -0.62 2.20 0.77 -2.08 119.74 121.74 1h1q s LYS 20 Ca 0.23 1.14 -0.03 0.00 -0.36 0.00 0.00 55.97 56.95 1h1q s LYS 20 Cb -0.07 -3.31 -0.03 0.00 -1.51 0.00 0.00 37.83 32.91 1h1q s LYS 20 CO 0.12 0.42 0.02 0.00 -0.36 0.00 0.00 175.35 175.55 1h1q s ALA 21 N -0.60 0.28 -0.16 3.13 0.00 -0.32 -0.96 121.76 123.13 1h1q s ALA 21 Ca 0.38 -0.97 -0.02 0.00 0.00 0.00 0.00 51.96 51.35 1h1q s ALA 21 Cb -0.22 0.29 -0.02 0.00 0.00 0.00 0.00 23.12 23.17 1h1q s ALA 21 CO 0.25 -0.36 -0.08 1.03 0.00 0.00 0.00 175.76 176.60 1h1q s ARG 22 N -3.47 3.49 -0.28 0.00 0.52 -0.42 0.50 118.95 119.30 1h1q s ARG 22 Ca 0.03 -0.61 -0.28 0.00 -0.52 0.00 0.00 55.73 54.35 1h1q s ARG 22 Cb 0.04 -2.82 0.01 0.00 0.52 0.00 0.00 34.95 32.71 1h1q s ARG 22 CO -0.08 0.14 0.99 1.21 0.02 0.00 0.00 175.30 177.58 1h1q s ASN 23 N 0.58 6.94 0.39 0.23 3.84 0.17 0.68 114.94 127.76 1h1q s ASN 23 Ca -0.05 1.10 0.26 0.00 0.21 0.00 0.00 52.86 54.38 1h1q s ASN 23 Cb -0.15 -2.51 0.69 0.00 -0.55 0.00 0.00 41.25 38.73 1h1q s ASN 23 CO 0.03 -0.73 1.73 0.11 -2.79 0.00 0.00 177.10 175.45 1h1q h LYS 24 N 7.83 0.00 0.14 0.43 1.57 -1.02 0.41 116.57 125.93 1h1q h LYS 24 Ca -0.21 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.31 1h1q h LYS 24 Cb 1.07 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.39 1h1q h LYS 24 CO 0.97 0.00 -1.26 -0.07 -0.57 0.00 0.00 179.45 178.52 1h1q h LEU 25 N 0.00 0.48 0.00 2.94 3.38 -1.92 -3.41 115.31 116.79 1h1q h LEU 25 Ca 0.00 -0.90 -0.35 0.00 0.09 0.00 0.00 57.88 56.72 1h1q h LEU 25 Cb 0.80 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.33 1h1q h LEU 25 CO 0.00 1.57 -2.19 0.35 0.09 0.00 0.00 178.44 178.27 1h1q n THR 26 N -3.94 1.47 0.00 0.22 -2.24 -1.24 -5.03 114.28 103.53 1h1q n THR 26 Ca -0.21 -0.82 0.00 0.00 -2.27 0.00 0.00 64.05 60.75 1h1q n THR 26 Cb 0.91 -0.71 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 1h1q n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h1q n GLY 27 N 1.73 2.06 3.71 3.38 0.00 0.14 -5.03 105.19 111.18 1h1q n GLY 27 Ca -0.29 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 1h1q n GLY 27 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1h1q n GLU 28 N -2.00 2.23 -3.96 1.61 2.13 -1.25 -4.53 120.64 114.88 1h1q n GLU 28 Ca 0.00 0.79 -0.35 0.00 0.66 0.00 0.00 57.16 58.25 1h1q n GLU 28 Cb 0.00 -2.42 -0.11 0.00 0.27 0.00 0.00 31.44 29.18 1h1q n GLU 28 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1h1q s VAL 29 N -0.78 4.42 0.36 6.31 1.01 -1.26 0.42 120.40 130.88 1h1q s VAL 29 Ca 0.59 -0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.45 1h1q s VAL 29 Cb -0.57 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 1h1q s VAL 29 CO 0.59 0.41 0.12 0.68 0.00 0.00 0.00 175.10 176.89 1h1q s VAL 30 N 0.97 0.64 -0.25 2.92 -7.23 0.18 -3.99 120.40 113.65 1h1q s VAL 30 Ca 0.03 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.23 1h1q s VAL 30 Cb -0.14 -2.49 0.06 0.00 0.56 0.00 0.00 36.38 34.36 1h1q s VAL 30 CO 0.03 0.00 -0.12 0.00 -0.31 0.00 0.00 175.10 174.70 1h1q s ALA 31 N -3.35 2.54 -0.08 1.32 0.00 0.53 -1.17 121.76 121.54 1h1q s ALA 31 Ca 0.30 -1.70 -0.19 0.00 0.00 0.00 0.00 51.96 50.37 1h1q s ALA 31 Cb 0.05 -1.54 -0.04 0.00 0.00 0.00 0.00 23.12 21.58 1h1q s ALA 31 CO 0.16 -1.10 0.51 -0.51 0.00 0.00 0.00 175.76 174.82 1h1q s LEU 32 N 1.12 4.32 -0.45 0.00 1.43 -0.88 -1.02 118.68 123.20 1h1q s LEU 32 Ca -0.07 0.92 -0.09 0.00 -1.03 0.00 0.00 54.13 53.85 1h1q s LEU 32 Cb -0.19 -2.76 0.10 0.00 0.03 0.00 0.00 46.19 43.37 1h1q s LEU 32 CO -0.06 0.04 0.32 -0.75 0.23 0.00 0.00 176.35 176.12 1h1q s LYS 33 N 0.35 2.55 -0.25 1.70 2.20 -0.65 -1.37 119.74 124.28 1h1q s LYS 33 Ca 0.28 -1.63 -0.23 0.00 -0.36 0.00 0.00 55.97 54.03 1h1q s LYS 33 Cb -0.16 -3.88 -0.01 0.00 -1.51 0.00 0.00 37.83 32.27 1h1q s LYS 33 CO 0.12 -1.09 0.77 0.21 -0.36 0.00 0.00 175.35 175.00 1h1q s LYS 34 N 1.40 4.14 -0.36 4.03 2.36 0.65 -0.16 119.74 131.79 1h1q s LYS 34 Ca 0.04 0.80 0.02 0.00 -2.55 0.00 0.00 55.97 54.29 1h1q s LYS 34 Cb -0.25 -3.66 0.10 0.00 -1.05 0.00 0.00 37.83 32.98 1h1q s LYS 34 CO 0.01 -0.51 0.09 0.42 1.55 0.00 0.00 175.35 176.91 1h1q s ILE 35 N 2.77 2.52 -0.12 5.43 1.01 -0.02 -1.72 121.20 131.07 1h1q s ILE 35 Ca 0.32 -2.33 -0.33 0.00 0.00 0.00 0.00 60.65 58.32 1h1q s ILE 35 Cb -0.15 -2.82 -0.10 0.00 0.01 0.00 0.00 42.46 39.40 1h1q s ILE 35 CO 0.08 -0.63 2.00 0.54 0.00 0.00 0.00 174.94 176.93 1h1q n ARG 36 N 4.27 2.13 -2.31 2.79 1.74 -1.26 -1.71 116.66 122.31 1h1q n ARG 36 Ca 0.03 0.74 -0.28 0.00 -0.77 0.00 0.00 57.85 57.57 1h1q n ARG 36 Cb 0.41 -2.79 0.02 0.00 -1.02 0.00 0.00 32.46 29.09 1h1q n ARG 36 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1h1q s LEU 37 N 5.29 3.27 -0.37 0.55 1.43 0.10 -4.93 118.68 124.03 1h1q s LEU 37 Ca 0.96 0.90 0.01 0.00 -1.03 0.00 0.00 54.13 54.96 1h1q s LEU 37 Cb -0.61 -3.77 0.15 0.00 0.03 0.00 0.00 46.19 41.99 1h1q s LEU 37 CO 0.47 -0.98 0.27 -1.81 0.23 0.00 0.00 176.35 174.52 1h1q s ASP 38 N -4.26 2.35 0.64 2.29 1.01 -1.26 -4.83 116.67 112.61 1h1q s ASP 38 Ca 0.53 -2.21 -0.17 0.00 0.71 0.00 0.00 52.55 51.41 1h1q s ASP 38 Cb -0.11 -0.20 -0.01 0.00 1.01 0.00 0.00 42.92 43.62 1h1q s ASP 38 CO 0.47 -0.28 1.20 -0.89 0.21 0.00 0.00 175.17 175.88 1h1q s THR 39 N 0.98 2.59 -1.34 -1.27 2.01 -1.26 -2.84 115.64 114.51 1h1q s THR 39 Ca 0.20 0.34 -0.02 0.00 0.31 0.00 0.00 61.69 62.52 1h1q s THR 39 Cb -0.17 -3.03 -0.00 0.00 0.01 0.00 0.00 72.50 69.31 1h1q s THR 39 CO -0.03 -0.11 0.55 -1.84 -0.69 0.00 0.00 174.62 172.51 1h1q n GLU 40 N -1.99 -3.67 0.00 4.92 -0.00 -1.26 -4.89 120.64 113.75 1h1q n GLU 40 Ca 0.13 0.49 0.00 0.00 -0.00 0.00 0.00 57.16 57.78 1h1q n GLU 40 Cb 0.50 -4.73 0.00 0.00 -0.00 0.00 0.00 31.44 27.21 1h1q n GLU 40 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1h1q n THR 41 N -4.33 0.00 0.41 3.84 -1.04 -1.23 -5.01 114.28 106.93 1h1q n THR 41 Ca -0.29 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 61.78 1h1q n THR 41 Cb 0.67 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 69.25 1h1q n THR 41 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1h1q n GLU 42 N 0.00 0.93 0.00 -2.82 4.07 -1.26 -5.09 120.64 116.47 1h1q n GLU 42 Ca 0.00 -1.32 0.00 0.00 -0.06 0.00 0.00 57.16 55.78 1h1q n GLU 42 Cb 0.00 -1.24 0.00 0.00 -0.06 0.00 0.00 31.44 30.14 1h1q n GLU 42 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1h1q n GLY 43 N 0.66 0.16 3.65 8.31 0.00 -1.13 -4.76 105.19 112.07 1h1q n GLY 43 Ca 0.08 -1.02 -0.43 0.00 0.00 0.00 0.00 46.02 44.65 1h1q n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h1q s VAL 44 N 0.00 4.21 0.58 1.61 1.01 -1.26 -4.23 120.40 122.33 1h1q s VAL 44 Ca 0.00 1.43 -0.20 0.00 0.00 0.00 0.00 61.98 63.21 1h1q s VAL 44 Cb 0.00 -4.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 1h1q s VAL 44 CO 0.00 -0.29 1.20 -0.81 0.00 0.00 0.00 175.10 175.20 1h1q n PRO 45 N 6.93 1.27 0.18 2.72 -0.04 -1.26 -4.86 135.00 139.94 1h1q n PRO 45 Ca 0.14 0.48 0.02 0.00 -0.04 0.00 0.00 63.50 64.10 1h1q n PRO 45 Cb 0.46 -2.41 0.32 0.00 -0.04 0.00 0.00 33.50 31.83 1h1q n PRO 45 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1h1q h SER 46 N 0.91 0.00 -0.96 3.54 4.64 -1.95 -1.87 113.55 117.86 1h1q h SER 46 Ca -0.50 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 60.93 1h1q h SER 46 Cb 1.33 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.35 1h1q h SER 46 CO 0.54 0.42 0.61 0.00 -0.87 0.00 0.00 176.83 177.54 1h1q h THR 47 N 0.00 0.95 0.07 2.95 1.03 -1.90 0.25 112.91 116.25 1h1q h THR 47 Ca -0.00 -0.33 -0.10 0.00 -0.01 0.00 0.00 66.41 65.97 1h1q h THR 47 Cb 0.75 -0.10 0.01 0.00 -1.07 0.00 0.00 68.15 67.75 1h1q h THR 47 CO 0.05 0.17 -0.43 0.00 -0.01 0.00 0.00 175.52 175.31 1h1q h ALA 48 N 1.54 -0.04 -0.86 0.00 0.00 -1.83 -2.09 119.26 115.98 1h1q h ALA 48 Ca 0.46 -0.59 0.21 0.00 0.00 0.00 0.00 54.91 54.99 1h1q h ALA 48 Cb 0.45 0.05 -0.12 0.00 0.00 0.00 0.00 17.79 18.17 1h1q h ALA 48 CO -0.22 0.20 0.34 0.82 0.00 0.00 0.00 179.25 180.38 1h1q h ILE 49 N -0.63 0.48 0.01 0.00 2.04 -0.49 0.26 117.51 119.18 1h1q h ILE 49 Ca -0.07 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 1h1q h ILE 49 Cb 1.32 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.47 1h1q h ILE 49 CO 0.08 0.07 -0.01 0.03 0.00 0.00 0.00 178.15 178.32 1h1q h ARG 50 N 0.37 -0.02 -0.77 2.37 3.08 -0.59 -2.93 114.38 115.88 1h1q h ARG 50 Ca 0.53 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.68 1h1q h ARG 50 Cb 0.98 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.96 1h1q h ARG 50 CO -0.53 0.67 0.40 1.49 -1.07 0.00 0.00 179.97 180.94 1h1q h GLU 51 N -0.73 0.64 0.10 0.04 4.81 -0.69 -0.82 114.58 117.93 1h1q h GLU 51 Ca -0.00 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1h1q h GLU 51 Cb 0.70 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1h1q h GLU 51 CO 0.00 0.42 -0.05 0.82 -0.73 0.00 0.00 179.01 179.48 1h1q h ILE 52 N 0.66 1.11 -0.43 2.32 2.04 -0.61 -1.68 117.51 120.94 1h1q h ILE 52 Ca 0.39 -1.04 -0.12 0.00 1.00 0.00 0.00 64.86 65.09 1h1q h ILE 52 Cb 0.42 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 1h1q h ILE 52 CO -0.28 0.24 -0.20 0.77 0.00 0.00 0.00 178.15 178.69 1h1q h SER 53 N -0.64 0.91 -0.18 1.72 4.64 -1.45 -2.70 113.55 115.84 1h1q h SER 53 Ca -0.01 -0.40 -0.06 0.00 -0.47 0.00 0.00 61.79 60.84 1h1q h SER 53 Cb 0.51 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1h1q h SER 53 CO 0.02 1.11 -0.14 -0.07 -0.87 0.00 0.00 176.83 176.88 1h1q h LEU 54 N 0.71 0.43 -0.20 5.97 3.38 -1.26 -3.12 115.31 121.22 1h1q h LEU 54 Ca 0.10 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1h1q h LEU 54 Cb 0.76 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1h1q h LEU 54 CO 0.06 0.79 0.00 -0.11 0.09 0.00 0.00 178.44 179.27 1h1q n LEU 55 N -4.53 0.19 0.16 1.67 7.94 -0.63 -1.36 117.00 120.45 1h1q n LEU 55 Ca -0.05 0.55 0.06 0.00 -1.11 0.00 0.00 56.01 55.45 1h1q n LEU 55 Cb 0.36 -0.52 0.07 0.00 0.53 0.00 0.00 43.42 43.86 1h1q n LEU 55 CO 0.40 -0.34 0.57 0.11 -1.11 0.00 0.00 177.39 177.02 1h1q h LYS 56 N 0.00 0.00 0.13 1.96 1.57 -1.42 -3.31 116.57 115.50 1h1q h LYS 56 Ca 0.00 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.48 1h1q h LYS 56 Cb 0.29 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 1h1q h LYS 56 CO 0.00 0.33 -1.52 0.93 -0.57 0.00 0.00 179.45 178.62 1h1q h GLU 57 N 0.00 0.29 -6.15 3.15 5.08 -1.18 -3.45 114.58 112.33 1h1q h GLU 57 Ca -0.01 -0.49 -0.57 0.00 -1.00 0.00 0.00 59.36 57.29 1h1q h GLU 57 Cb 1.26 0.18 -0.05 0.00 0.50 0.00 0.00 28.75 30.63 1h1q h GLU 57 CO 0.04 1.23 0.85 -0.51 -1.00 0.00 0.00 179.01 179.62 1h1q s LEU 58 N -7.47 4.09 -0.43 1.33 1.43 -0.97 -4.95 118.68 111.71 1h1q s LEU 58 Ca -0.19 1.41 0.03 0.00 -1.03 0.00 0.00 54.13 54.35 1h1q s LEU 58 Cb 0.05 -3.54 0.16 0.00 0.03 0.00 0.00 46.19 42.88 1h1q s LEU 58 CO 0.79 -0.75 0.31 0.21 0.23 0.00 0.00 176.35 177.14 1h1q s ASN 59 N 1.58 2.46 0.11 2.29 3.04 -1.26 -4.86 114.94 118.30 1h1q s ASN 59 Ca 0.48 -2.84 0.05 0.00 0.04 0.00 0.00 52.86 50.59 1h1q s ASN 59 Cb -0.17 -0.62 -0.04 0.00 -1.54 0.00 0.00 41.25 38.89 1h1q s ASN 59 CO 0.11 -0.21 -0.14 -2.28 -3.04 0.00 0.00 177.10 171.54 1h1q s HIS 60 N 0.23 1.33 0.59 0.43 2.46 -1.26 -5.03 115.29 114.05 1h1q s HIS 60 Ca 0.26 -0.56 0.29 0.00 0.47 0.00 0.00 55.06 55.53 1h1q s HIS 60 Cb -0.08 -0.71 1.67 0.00 -0.13 0.00 0.00 32.58 33.33 1h1q s HIS 60 CO -0.11 0.11 2.09 -1.00 -2.47 0.00 0.00 174.74 173.36 1h1q h PRO 61 N 3.63 0.00 -0.54 2.88 0.13 -1.98 -1.41 132.00 134.70 1h1q h PRO 61 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1h1q h PRO 61 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1h1q h PRO 61 CO 0.49 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.35 1h1q n ASN 62 N -3.74 3.86 -4.25 1.44 4.13 -1.26 -4.88 115.26 110.55 1h1q n ASN 62 Ca 0.02 -2.23 -0.35 0.00 1.68 0.00 0.00 54.58 53.70 1h1q n ASN 62 Cb 0.34 -0.44 -0.14 0.00 -1.54 0.00 0.00 39.78 38.00 1h1q n ASN 62 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1h1q s ILE 63 N -1.43 3.15 0.38 2.41 1.01 -0.53 -0.30 121.20 125.89 1h1q s ILE 63 Ca 0.41 -0.77 -0.23 0.00 0.00 0.00 0.00 60.65 60.05 1h1q s ILE 63 Cb 0.24 -2.52 -0.14 0.00 0.01 0.00 0.00 42.46 40.05 1h1q s ILE 63 CO 0.23 0.29 0.46 0.52 0.00 0.00 0.00 174.94 176.44 1h1q n VAL 64 N 4.74 1.54 -3.15 2.92 0.31 -0.59 -4.47 118.33 119.63 1h1q n VAL 64 Ca -0.17 -0.50 -0.40 0.00 -0.01 0.00 0.00 64.34 63.26 1h1q n VAL 64 Cb 0.49 -0.37 -0.06 0.00 -0.91 0.00 0.00 33.84 32.99 1h1q n VAL 64 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1h1q s LYS 65 N -1.36 4.25 -0.53 5.55 2.20 -1.26 -4.96 119.74 123.62 1h1q s LYS 65 Ca 0.62 0.59 -0.25 0.00 -0.36 0.00 0.00 55.97 56.57 1h1q s LYS 65 Cb -0.66 -3.55 0.03 0.00 -1.51 0.00 0.00 37.83 32.15 1h1q s LYS 65 CO 0.59 -0.15 0.99 -1.17 -0.36 0.00 0.00 175.35 175.26 1h1q s LEU 66 N 1.61 3.93 -0.01 5.43 2.96 -1.26 -0.95 118.68 130.38 1h1q s LEU 66 Ca 0.28 -0.10 -0.15 0.00 -0.22 0.00 0.00 54.13 53.95 1h1q s LEU 66 Cb -0.16 -3.03 -0.34 0.00 0.50 0.00 0.00 46.19 43.17 1h1q s LEU 66 CO 0.11 -1.23 0.87 -0.07 -1.32 0.00 0.00 176.35 174.71 1h1q h LEU 67 N 11.05 0.73 -7.32 -0.68 3.38 0.15 -3.48 115.31 119.14 1h1q h LEU 67 Ca -0.25 -0.93 -0.02 0.00 0.09 0.00 0.00 57.88 56.78 1h1q h LEU 67 Cb 1.07 -0.24 -0.11 0.00 0.09 0.00 0.00 40.66 41.47 1h1q h LEU 67 CO 1.09 1.70 0.12 -0.62 0.09 0.00 0.00 178.44 180.83 1h1q s ASP 68 N -7.42 -0.41 -0.31 -0.43 2.15 -0.97 -4.96 116.67 104.31 1h1q s ASP 68 Ca -0.12 -0.23 0.02 0.00 0.43 0.00 0.00 52.55 52.66 1h1q s ASP 68 Cb 0.04 0.59 0.09 0.00 -0.30 0.00 0.00 42.92 43.34 1h1q s ASP 68 CO 0.90 -1.01 0.04 -0.69 -0.17 0.00 0.00 175.17 174.25 1h1q s VAL 69 N -3.80 1.75 -0.30 1.11 1.01 -1.26 -0.18 120.40 118.73 1h1q s VAL 69 Ca 0.04 -1.87 -0.24 0.00 0.00 0.00 0.00 61.98 59.90 1h1q s VAL 69 Cb -0.01 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.13 1h1q s VAL 69 CO -0.09 -0.52 0.83 -0.63 0.00 0.00 0.00 175.10 174.69 1h1q s ILE 70 N 1.19 4.76 -1.02 2.22 1.01 0.45 -4.91 121.20 124.90 1h1q s ILE 70 Ca 0.07 1.32 -0.09 0.00 0.00 0.00 0.00 60.65 61.96 1h1q s ILE 70 Cb -0.18 -4.18 0.26 0.00 0.01 0.00 0.00 42.46 38.37 1h1q s ILE 70 CO -0.13 -0.25 0.99 -2.28 0.00 0.00 0.00 174.94 173.27 1h1q s HIS 71 N 3.03 4.11 0.88 3.97 2.46 -1.26 -1.39 115.29 127.09 1h1q s HIS 71 Ca 0.34 -2.62 -0.13 0.00 0.47 0.00 0.00 55.06 53.13 1h1q s HIS 71 Cb -0.14 -3.74 0.15 0.00 -0.13 0.00 0.00 32.58 28.72 1h1q s HIS 71 CO 0.12 -0.93 1.23 0.99 -2.47 0.00 0.00 174.74 173.69 1h1q s THR 72 N -1.00 2.03 0.00 0.89 2.01 -0.78 -5.01 115.64 113.78 1h1q s THR 72 Ca 0.28 -0.06 -0.19 0.00 0.31 0.00 0.00 61.69 62.03 1h1q s THR 72 Cb -0.10 -2.97 -0.31 0.00 0.01 0.00 0.00 72.50 69.13 1h1q s THR 72 CO -0.09 0.00 0.99 -0.08 -0.69 0.00 0.00 174.62 174.76 1h1q h GLU 73 N -1.31 0.45 0.00 4.92 4.81 -2.02 -3.40 114.58 118.03 1h1q h GLU 73 Ca -0.44 -0.69 0.00 0.00 -0.13 0.00 0.00 59.36 58.10 1h1q h GLU 73 Cb 1.27 0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.90 1h1q h GLU 73 CO 0.48 1.31 -0.29 -0.91 -0.73 0.00 0.00 179.01 178.88 1h1q h ASN 74 N -0.06 0.00 -1.94 1.04 4.21 -1.95 -3.46 115.58 113.43 1h1q h ASN 74 Ca -0.18 0.00 -0.59 0.00 1.21 0.00 0.00 56.30 56.75 1h1q h ASN 74 Cb 1.81 0.00 -0.11 0.00 -1.12 0.00 0.00 38.32 38.90 1h1q h ASN 74 CO 0.20 0.61 -0.63 -0.54 -1.29 0.00 0.00 177.43 175.78 1h1q s LYS 75 N -1.90 2.05 -0.08 0.81 3.01 -1.26 0.03 119.74 122.40 1h1q s LYS 75 Ca -0.08 -1.75 0.01 0.00 -1.01 0.00 0.00 55.97 53.13 1h1q s LYS 75 Cb 0.01 -1.91 0.02 0.00 -1.01 0.00 0.00 37.83 34.94 1h1q s LYS 75 CO 0.12 0.15 -0.08 -1.17 0.51 0.00 0.00 175.35 174.88 1h1q s LEU 76 N -3.70 1.33 -0.09 3.17 2.96 -0.69 -1.87 118.68 119.78 1h1q s LEU 76 Ca 0.34 -0.25 -0.00 0.00 -0.22 0.00 0.00 54.13 54.00 1h1q s LEU 76 Cb -0.00 -0.74 -0.03 0.00 0.50 0.00 0.00 46.19 45.92 1h1q s LEU 76 CO 0.19 -0.06 -0.06 -0.31 -1.32 0.00 0.00 176.35 174.79 1h1q s TYR 77 N 1.21 2.96 -0.19 5.38 2.02 -0.49 -0.84 117.35 127.40 1h1q s TYR 77 Ca -0.05 -0.08 -0.09 0.00 -0.37 0.00 0.00 57.07 56.48 1h1q s TYR 77 Cb -0.14 -1.77 -0.05 0.00 -0.40 0.00 0.00 41.96 39.60 1h1q s TYR 77 CO -0.02 0.23 0.11 -0.51 -1.57 0.00 0.00 175.55 173.78 1h1q s LEU 78 N -0.50 4.09 -0.30 -1.29 1.43 0.77 -0.41 118.68 122.47 1h1q s LEU 78 Ca 0.07 0.20 -0.09 0.00 -1.03 0.00 0.00 54.13 53.29 1h1q s LEU 78 Cb -0.12 -2.05 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 1h1q s LEU 78 CO 0.02 0.19 0.13 -0.69 0.23 0.00 0.00 176.35 176.23 1h1q s VAL 79 N 0.26 4.43 0.18 -1.59 1.01 0.74 -1.63 120.40 123.81 1h1q s VAL 79 Ca 0.07 -0.46 0.10 0.00 0.00 0.00 0.00 61.98 61.69 1h1q s VAL 79 Cb -0.11 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 1h1q s VAL 79 CO -0.01 0.09 -0.17 -0.36 0.00 0.00 0.00 175.10 174.65 1h1q s PHE 80 N 1.59 2.46 0.53 5.22 0.40 -0.19 0.18 117.98 128.16 1h1q s PHE 80 Ca 0.04 -0.29 -0.22 0.00 -0.60 0.00 0.00 56.93 55.86 1h1q s PHE 80 Cb -0.17 -1.21 -0.06 0.00 0.51 0.00 0.00 43.02 42.09 1h1q s PHE 80 CO 0.05 0.50 1.33 -0.85 0.70 0.00 0.00 175.22 176.95 1h1q n GLU 81 N 0.19 1.70 -3.69 0.44 0.28 -0.13 -0.35 120.64 119.08 1h1q n GLU 81 Ca -0.12 0.62 -0.36 0.00 -0.16 0.00 0.00 57.16 57.15 1h1q n GLU 81 Cb 0.56 -2.53 -0.09 0.00 1.43 0.00 0.00 31.44 30.81 1h1q n GLU 81 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 1h1q s PHE 82 N -1.29 3.37 0.40 -1.84 5.36 -1.26 -4.29 117.98 118.44 1h1q s PHE 82 Ca 0.70 0.29 0.08 0.00 -0.96 0.00 0.00 56.93 57.04 1h1q s PHE 82 Cb -0.43 -2.22 -0.03 0.00 -0.34 0.00 0.00 43.02 40.01 1h1q s PHE 82 CO 0.50 0.18 0.31 -0.51 -1.46 0.00 0.00 175.22 174.25 1h1q s LEU 83 N 0.69 3.37 0.02 6.12 1.02 -1.26 -4.93 118.68 123.71 1h1q s LEU 83 Ca 0.08 -0.76 -0.21 0.00 0.02 0.00 0.00 54.13 53.26 1h1q s LEU 83 Cb -0.12 -1.95 -0.16 0.00 0.02 0.00 0.00 46.19 43.97 1h1q s LEU 83 CO 0.01 -0.56 1.28 -0.74 0.02 0.00 0.00 176.35 176.36 1h1q h HIS 84 N 1.17 0.41 -2.47 0.29 2.76 -1.82 -3.49 115.15 112.01 1h1q h HIS 84 Ca -0.42 -0.14 0.18 0.00 -2.20 0.00 0.00 60.37 57.79 1h1q h HIS 84 Cb 1.26 -0.08 -0.04 0.00 1.55 0.00 0.00 27.41 30.10 1h1q h HIS 84 CO 0.54 0.80 0.62 1.14 -1.30 0.00 0.00 177.93 179.73 1h1q s GLN 85 N -4.05 1.20 0.32 5.26 -2.07 -1.05 -4.97 119.66 114.31 1h1q s GLN 85 Ca -0.14 -0.77 0.07 0.00 -1.82 0.00 0.00 55.36 52.70 1h1q s GLN 85 Cb 0.04 0.34 -0.02 0.00 -1.09 0.00 0.00 33.01 32.28 1h1q s GLN 85 CO 0.76 -0.56 0.38 0.16 -1.32 0.00 0.00 175.29 174.70 1h1q s ASP 86 N -3.42 5.70 0.19 12.60 1.47 -1.26 0.40 116.67 132.34 1h1q s ASP 86 Ca 0.22 -0.30 -0.08 0.00 1.18 0.00 0.00 52.55 53.57 1h1q s ASP 86 Cb -0.02 -1.18 0.09 0.00 -0.34 0.00 0.00 42.92 41.47 1h1q s ASP 86 CO 0.04 -0.35 1.64 0.25 0.68 0.00 0.00 175.17 177.43 1h1q h LEU 87 N 1.09 1.01 0.90 2.11 5.85 0.98 -2.31 115.31 124.93 1h1q h LEU 87 Ca -0.46 -0.30 -0.04 0.00 0.84 0.00 0.00 57.88 57.91 1h1q h LEU 87 Cb 1.25 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.01 1h1q h LEU 87 CO 0.56 1.09 -0.47 0.50 -0.34 0.00 0.00 178.44 179.78 1h1q h LYS 88 N 0.92 -1.21 -0.97 1.25 3.64 -1.64 -0.26 116.57 118.31 1h1q h LYS 88 Ca 0.16 0.08 0.24 0.00 -1.27 0.00 0.00 60.65 59.86 1h1q h LYS 88 Cb 0.60 0.27 -0.13 0.00 -0.41 0.00 0.00 32.23 32.57 1h1q h LYS 88 CO 0.04 -0.81 0.53 0.87 -2.27 0.00 0.00 179.45 177.81 1h1q h LYS 89 N -1.25 0.50 -0.00 1.90 1.57 -1.86 -1.53 116.57 115.90 1h1q h LYS 89 Ca -0.12 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1h1q h LYS 89 Cb 0.98 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 33.17 1h1q h LYS 89 CO 0.17 0.33 0.00 0.35 -0.57 0.00 0.00 179.45 179.74 1h1q h PHE 90 N 0.52 0.01 -0.04 -1.35 3.57 -1.08 -3.22 116.94 115.34 1h1q h PHE 90 Ca 0.62 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 62.13 1h1q h PHE 90 Cb 1.19 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.92 1h1q h PHE 90 CO -0.05 0.21 -0.07 0.52 -2.23 0.00 0.00 178.31 176.70 1h1q h MET 91 N -0.20 -0.05 -1.11 1.11 2.86 0.01 -2.48 114.93 115.06 1h1q h MET 91 Ca 0.00 0.00 0.32 0.00 -2.06 0.00 0.00 59.70 57.97 1h1q h MET 91 Cb 0.21 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.84 1h1q h MET 91 CO -0.00 -0.04 1.05 -0.44 1.06 0.00 0.00 176.91 178.55 1h1q h ASP 92 N -0.06 0.00 -0.15 1.22 3.32 -1.53 1.15 116.42 120.38 1h1q h ASP 92 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1h1q h ASP 92 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1h1q h ASP 92 CO -0.07 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.45 1h1q n ALA 93 N -2.46 2.38 0.63 3.45 0.00 -1.18 -3.91 120.51 119.41 1h1q n ALA 93 Ca 0.24 -0.80 0.07 0.00 0.00 0.00 0.00 53.44 52.95 1h1q n ALA 93 Cb 1.40 -0.44 0.02 0.00 0.00 0.00 0.00 19.45 20.43 1h1q n ALA 93 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1h1q n SER 94 N 0.67 1.71 0.04 0.00 2.88 0.38 -4.68 113.62 114.63 1h1q n SER 94 Ca 0.09 -1.35 0.07 0.00 -1.33 0.00 0.00 58.87 56.35 1h1q n SER 94 Cb 0.36 0.33 0.50 0.00 -0.75 0.00 0.00 64.21 64.65 1h1q n SER 94 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h1q h ALA 95 N 2.59 1.87 0.06 -1.46 0.00 -1.10 1.48 119.26 122.70 1h1q h ALA 95 Ca 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1h1q h ALA 95 Cb 0.52 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1h1q h ALA 95 CO 0.00 0.09 -0.03 -0.07 0.00 0.00 0.00 179.25 179.24 1h1q h LEU 96 N 0.38 -0.07 -1.43 0.00 3.38 -1.88 -3.35 115.31 112.34 1h1q h LEU 96 Ca 0.14 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1h1q h LEU 96 Cb 0.11 0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1h1q h LEU 96 CO -0.03 0.61 0.00 0.41 0.09 0.00 0.00 178.44 179.52 1h1q n THR 97 N -4.80 0.13 -1.35 0.22 -1.04 -1.17 -5.07 114.28 101.20 1h1q n THR 97 Ca -0.08 -0.41 0.17 0.00 -2.04 0.00 0.00 64.05 61.69 1h1q n THR 97 Cb 0.31 0.78 -0.06 0.00 -1.82 0.00 0.00 70.33 69.54 1h1q n THR 97 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1h1q n GLY 98 N 1.26 -2.19 3.64 3.41 0.00 0.51 -4.77 105.19 107.04 1h1q n GLY 98 Ca 0.17 -0.98 -0.38 0.00 0.00 0.00 0.00 46.02 44.83 1h1q n GLY 98 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h1q s ILE 99 N -2.95 5.26 0.43 -0.61 1.01 -1.26 -4.86 121.20 118.22 1h1q s ILE 99 Ca 0.00 0.43 -0.24 0.00 0.00 0.00 0.00 60.65 60.84 1h1q s ILE 99 Cb 0.00 -3.62 -0.10 0.00 0.01 0.00 0.00 42.46 38.75 1h1q s ILE 99 CO 0.00 0.26 1.03 -2.65 0.00 0.00 0.00 174.94 173.58 1h1q n PRO 100 N 4.71 1.38 -0.04 2.79 -0.02 -1.26 -4.82 135.00 137.74 1h1q n PRO 100 Ca -0.11 0.50 -0.08 0.00 -2.02 0.00 0.00 63.50 61.78 1h1q n PRO 100 Cb 0.51 -2.09 -0.02 0.00 -0.02 0.00 0.00 33.50 31.88 1h1q n PRO 100 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1h1q h LEU 101 N 1.52 -0.04 -0.68 2.45 -0.00 -1.97 -2.31 115.31 114.28 1h1q h LEU 101 Ca -0.45 0.04 0.12 0.00 -0.00 0.00 0.00 57.88 57.58 1h1q h LEU 101 Cb 1.33 0.07 -0.12 0.00 -0.00 0.00 0.00 40.66 41.94 1h1q h LEU 101 CO 0.57 0.01 -0.35 -0.65 -0.00 0.00 0.00 178.44 178.01 1h1q h PRO 102 N 0.09 -0.12 -0.53 1.13 0.11 -1.99 -0.14 132.00 130.54 1h1q h PRO 102 Ca 0.10 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.20 1h1q h PRO 102 Cb 0.11 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.22 1h1q h PRO 102 CO -0.15 -0.08 0.27 1.25 -0.21 0.00 0.00 178.00 179.08 1h1q h LEU 103 N -0.13 0.66 0.31 2.35 5.85 -1.85 0.73 115.31 123.23 1h1q h LEU 103 Ca 0.26 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 1h1q h LEU 103 Cb 0.56 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1h1q h LEU 103 CO -0.75 0.55 -0.15 0.40 -0.34 0.00 0.00 178.44 178.16 1h1q h ILE 104 N 0.74 0.00 -1.10 4.05 2.04 -0.50 0.56 117.51 123.29 1h1q h ILE 104 Ca 0.19 -0.26 0.33 0.00 1.00 0.00 0.00 64.86 66.13 1h1q h ILE 104 Cb 0.06 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.01 1h1q h ILE 104 CO -0.03 0.00 0.68 0.50 0.00 0.00 0.00 178.15 179.30 1h1q h LYS 105 N -0.67 0.28 0.27 2.37 3.64 -1.38 3.13 116.57 124.21 1h1q h LYS 105 Ca -0.04 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 1h1q h LYS 105 Cb 0.32 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1h1q h LYS 105 CO 0.07 0.19 -0.13 1.03 -2.27 0.00 0.00 179.45 178.33 1h1q h SER 106 N 0.29 -0.31 0.80 4.20 0.87 -0.74 0.47 113.55 119.12 1h1q h SER 106 Ca 0.71 -0.18 -0.05 0.00 -1.23 0.00 0.00 61.79 61.05 1h1q h SER 106 Cb 1.86 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 63.89 1h1q h SER 106 CO -0.45 0.03 -0.23 1.88 -0.53 0.00 0.00 176.83 177.52 1h1q h TYR 107 N -0.68 0.00 0.07 2.24 0.05 0.62 0.32 116.97 119.59 1h1q h TYR 107 Ca -0.04 0.00 -0.24 0.00 0.05 0.00 0.00 58.73 58.50 1h1q h TYR 107 Cb 0.47 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.20 1h1q h TYR 107 CO 0.02 0.23 -1.11 1.25 -1.05 0.00 0.00 178.16 177.50 1h1q h LEU 108 N 0.00 0.27 0.68 3.88 5.85 0.52 -2.53 115.31 123.98 1h1q h LEU 108 Ca -0.00 -0.28 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 1h1q h LEU 108 Cb 0.69 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.63 1h1q h LEU 108 CO 0.03 1.19 -0.40 0.15 -0.34 0.00 0.00 178.44 179.08 1h1q h PHE 109 N 0.06 -1.05 0.00 1.25 3.57 0.19 -2.42 116.94 118.54 1h1q h PHE 109 Ca -0.08 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.38 1h1q h PHE 109 Cb 1.84 0.37 -0.00 0.00 2.79 0.00 0.00 35.95 40.94 1h1q h PHE 109 CO 0.04 -0.61 -0.14 1.96 -2.23 0.00 0.00 178.31 177.33 1h1q h GLN 110 N -1.01 0.00 -0.19 1.11 4.20 -1.16 -1.90 115.11 116.16 1h1q h GLN 110 Ca -0.09 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.48 1h1q h GLN 110 Cb 0.81 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.58 1h1q h GLN 110 CO 0.10 0.14 -0.47 -0.07 -0.67 0.00 0.00 178.83 177.86 1h1q h LEU 111 N 0.00 0.53 -0.17 1.46 3.38 -1.12 0.63 115.31 120.03 1h1q h LEU 111 Ca -0.00 -0.26 -0.22 0.00 0.09 0.00 0.00 57.88 57.49 1h1q h LEU 111 Cb 0.41 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1h1q h LEU 111 CO 0.02 0.92 -0.96 -0.07 0.09 0.00 0.00 178.44 178.44 1h1q h LEU 112 N 0.40 0.32 -0.17 1.67 3.38 -0.87 0.56 115.31 120.60 1h1q h LEU 112 Ca 0.02 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 1h1q h LEU 112 Cb 0.97 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 1h1q h LEU 112 CO 0.09 1.11 0.02 1.56 0.09 0.00 0.00 178.44 181.31 1h1q h GLN 113 N 0.12 0.28 -0.68 1.13 4.20 -1.45 0.67 115.11 119.38 1h1q h GLN 113 Ca -0.06 -0.08 0.02 0.00 0.06 0.00 0.00 58.65 58.59 1h1q h GLN 113 Cb 1.62 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 29.33 1h1q h GLN 113 CO 0.15 0.46 0.44 0.78 -0.67 0.00 0.00 178.83 179.99 1h1q h GLY 114 N 0.06 0.98 1.91 3.46 0.00 -0.57 -2.07 103.07 106.83 1h1q h GLY 114 Ca 0.05 -0.34 -0.14 0.00 0.00 0.00 0.00 47.33 46.90 1h1q h GLY 114 CO 0.00 0.30 -0.64 -2.00 0.00 0.00 0.00 176.54 174.20 1h1q h LEU 115 N 0.87 0.11 -0.73 3.11 5.85 0.60 -3.03 115.31 122.08 1h1q h LEU 115 Ca 0.27 -0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.86 1h1q h LEU 115 Cb -0.03 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1h1q h LEU 115 CO -0.09 0.72 -0.27 0.00 -0.34 0.00 0.00 178.44 178.47 1h1q h ALA 116 N 1.28 0.93 -0.41 1.25 0.00 0.54 0.19 119.26 123.03 1h1q h ALA 116 Ca -0.01 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 1h1q h ALA 116 Cb 1.15 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1h1q h ALA 116 CO 0.09 0.33 -0.01 0.35 0.00 0.00 0.00 179.25 180.01 1h1q h PHE 117 N 0.00 0.81 0.45 0.00 3.57 -1.25 -2.51 116.94 118.00 1h1q h PHE 117 Ca -0.00 -0.15 -0.02 0.00 3.53 0.00 0.00 57.97 61.33 1h1q h PHE 117 Cb 0.93 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.46 1h1q h PHE 117 CO 0.00 0.82 -0.22 0.00 -2.23 0.00 0.00 178.31 176.68 1h1q h HIS 119 N -0.98 0.95 -0.76 0.00 3.86 -0.63 0.12 115.15 117.71 1h1q h HIS 119 Ca -0.06 0.03 0.14 0.00 -1.16 0.00 0.00 60.37 59.32 1h1q h HIS 119 Cb 0.57 -0.29 -0.09 0.00 1.06 0.00 0.00 27.41 28.66 1h1q h HIS 119 CO 0.02 0.34 0.33 1.03 0.86 0.00 0.00 177.93 180.50 1h1q h SER 120 N 0.82 0.34 -0.99 2.45 0.87 -1.44 -0.59 113.55 115.01 1h1q h SER 120 Ca 0.46 0.10 -0.66 0.00 -1.23 0.00 0.00 61.79 60.46 1h1q h SER 120 Cb 0.50 0.06 -0.29 0.00 -0.44 0.00 0.00 62.40 62.23 1h1q h SER 120 CO -0.29 0.14 0.85 1.41 -0.53 0.00 0.00 176.83 178.42 1h1q n HIS 121 N -4.97 3.21 -3.98 2.24 8.25 0.06 -4.90 115.22 115.13 1h1q n HIS 121 Ca 0.14 -2.91 -0.30 0.00 -0.26 0.00 0.00 57.72 54.39 1h1q n HIS 121 Cb 0.40 -1.40 0.01 0.00 1.12 0.00 0.00 29.99 30.12 1h1q n HIS 121 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1h1q n ARG 122 N -0.93 -4.61 -4.54 -0.41 -4.01 -0.23 -4.90 116.66 97.02 1h1q n ARG 122 Ca 0.62 0.52 -0.31 0.00 -1.04 0.00 0.00 57.85 57.64 1h1q n ARG 122 Cb 0.76 -5.25 -0.17 0.00 -3.04 0.00 0.00 32.46 24.77 1h1q n ARG 122 CO 0.00 0.00 0.00 0.08 -3.04 0.00 0.00 177.63 174.67 1h1q s VAL 123 N -3.41 1.84 -0.03 8.89 1.01 0.19 -0.23 120.40 128.67 1h1q s VAL 123 Ca 0.54 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 1h1q s VAL 123 Cb -0.28 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.41 1h1q s VAL 123 CO 0.86 0.51 0.10 -0.76 0.00 0.00 0.00 175.10 175.81 1h1q s LEU 124 N 0.93 4.03 -0.13 3.92 1.43 -0.95 -3.36 118.68 124.54 1h1q s LEU 124 Ca -0.06 0.23 -0.17 0.00 -1.03 0.00 0.00 54.13 53.10 1h1q s LEU 124 Cb -0.15 -2.28 -0.25 0.00 0.03 0.00 0.00 46.19 43.54 1h1q s LEU 124 CO -0.03 0.30 0.47 -0.74 0.23 0.00 0.00 176.35 176.58 1h1q h HIS 125 N 4.23 0.31 -2.27 0.29 -0.00 -1.89 0.17 115.15 115.99 1h1q h HIS 125 Ca -0.50 -0.23 -0.26 0.00 -0.00 0.00 0.00 60.37 59.38 1h1q h HIS 125 Cb 1.19 -0.01 0.01 0.00 -0.00 0.00 0.00 27.41 28.59 1h1q h HIS 125 CO 0.66 1.53 -0.35 0.54 -0.00 0.00 0.00 177.93 180.30 1h1q n ARG 126 N -4.04 -1.79 -1.82 5.26 1.74 -1.26 -2.27 116.66 112.48 1h1q n ARG 126 Ca -0.26 0.61 -0.01 0.00 -0.77 0.00 0.00 57.85 57.41 1h1q n ARG 126 Cb 0.84 -4.82 0.04 0.00 -1.02 0.00 0.00 32.46 27.51 1h1q n ARG 126 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1h1q n ASP 127 N -0.66 -0.66 -4.79 0.55 2.03 -1.26 -2.39 116.55 109.37 1h1q n ASP 127 Ca -0.13 -1.47 -0.35 0.00 0.52 0.00 0.00 54.79 53.36 1h1q n ASP 127 Cb 0.60 0.30 -0.05 0.00 -0.72 0.00 0.00 41.12 41.25 1h1q n ASP 127 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1h1q s LEU 128 N -1.62 4.03 -0.18 -2.67 1.43 -1.26 -4.84 118.68 113.57 1h1q s LEU 128 Ca 0.04 1.91 -0.30 0.00 -1.03 0.00 0.00 54.13 54.75 1h1q s LEU 128 Cb 0.18 -4.35 0.14 0.00 0.03 0.00 0.00 46.19 42.18 1h1q s LEU 128 CO -0.05 -0.51 1.08 -1.59 0.23 0.00 0.00 176.35 175.51 1h1q s LYS 129 N -2.81 0.47 0.63 1.70 -2.85 -1.26 -4.84 119.74 110.78 1h1q s LYS 129 Ca 0.61 0.10 0.35 0.00 -1.00 0.00 0.00 55.97 56.02 1h1q s LYS 129 Cb -0.17 0.22 1.97 0.00 -2.06 0.00 0.00 37.83 37.79 1h1q s LYS 129 CO 0.22 -0.15 2.22 -1.00 0.10 0.00 0.00 175.35 176.73 1h1q h PRO 130 N 2.42 0.00 0.00 1.78 0.13 -1.94 -2.06 132.00 132.33 1h1q h PRO 130 Ca -0.16 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.88 1h1q h PRO 130 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 1h1q h PRO 130 CO 0.29 0.00 -0.45 -0.56 -0.23 0.00 0.00 178.00 177.05 1h1q h GLN 131 N 0.00 0.00 -0.03 0.86 -0.00 -1.94 -0.79 115.11 113.20 1h1q h GLN 131 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.67 1h1q h GLN 131 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.69 1h1q h GLN 131 CO -0.00 0.45 0.00 0.09 -0.00 0.00 0.00 178.83 179.37 1h1q n ASN 132 N -3.80 0.27 -3.93 0.06 4.13 -0.77 -4.65 115.26 106.57 1h1q n ASN 132 Ca -0.01 -1.60 -0.29 0.00 1.68 0.00 0.00 54.58 54.36 1h1q n ASN 132 Cb 0.50 -0.02 -0.16 0.00 -1.54 0.00 0.00 39.78 38.56 1h1q n ASN 132 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1h1q s LEU 133 N -1.44 1.83 0.08 3.41 1.43 -1.14 -1.16 118.68 121.69 1h1q s LEU 133 Ca 0.23 -0.72 0.01 0.00 -1.03 0.00 0.00 54.13 52.62 1h1q s LEU 133 Cb 0.11 -1.03 -0.04 0.00 0.03 0.00 0.00 46.19 45.25 1h1q s LEU 133 CO 0.17 -0.16 0.17 -0.76 0.23 0.00 0.00 176.35 176.00 1h1q s LEU 134 N 1.55 4.16 0.02 1.79 1.43 -0.41 -0.02 118.68 127.19 1h1q s LEU 134 Ca 0.00 0.16 0.02 0.00 -1.03 0.00 0.00 54.13 53.28 1h1q s LEU 134 Cb -0.15 -2.78 -0.02 0.00 0.03 0.00 0.00 46.19 43.27 1h1q s LEU 134 CO -0.08 0.16 -0.07 0.27 0.23 0.00 0.00 176.35 176.86 1h1q s ILE 135 N -1.50 0.48 0.72 -0.59 -4.36 0.16 0.20 121.20 116.31 1h1q s ILE 135 Ca 0.33 -0.74 -0.01 0.00 -0.26 0.00 0.00 60.65 59.97 1h1q s ILE 135 Cb -0.12 -0.50 0.14 0.00 1.25 0.00 0.00 42.46 43.23 1h1q s ILE 135 CO 0.26 -0.19 0.99 -0.46 0.24 0.00 0.00 174.94 175.78 1h1q n ASN 136 N 2.04 1.29 -0.13 4.36 0.23 -0.58 -2.29 115.26 120.18 1h1q n ASN 136 Ca -0.19 -2.10 0.15 0.00 -0.53 0.00 0.00 54.58 51.91 1h1q n ASN 136 Cb 0.56 -0.65 0.75 0.00 -2.08 0.00 0.00 39.78 38.36 1h1q n ASN 136 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1h1q n THR 137 N -2.87 0.00 1.07 5.53 -2.24 -1.26 -3.65 114.28 110.87 1h1q n THR 137 Ca 0.16 -0.07 0.12 0.00 -2.27 0.00 0.00 64.05 61.99 1h1q n THR 137 Cb 0.58 -0.18 0.11 0.00 -2.10 0.00 0.00 70.33 68.74 1h1q n THR 137 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1h1q n GLU 138 N -0.79 1.32 0.00 -0.78 1.02 -1.26 -4.62 120.64 115.53 1h1q n GLU 138 Ca 0.19 -1.04 0.00 0.00 -0.02 0.00 0.00 57.16 56.30 1h1q n GLU 138 Cb 0.22 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 1h1q n GLU 138 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h1q n GLY 139 N 1.38 1.16 3.87 0.62 0.00 -1.24 -4.60 105.19 106.39 1h1q n GLY 139 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 1h1q n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h1q s ALA 140 N -2.06 3.40 0.01 4.61 0.00 -1.26 -4.86 121.76 121.59 1h1q s ALA 140 Ca 0.00 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 51.76 1h1q s ALA 140 Cb 0.00 -2.64 -0.01 0.00 0.00 0.00 0.00 23.12 20.47 1h1q s ALA 140 CO 0.00 0.13 -0.03 -1.50 0.00 0.00 0.00 175.76 174.36 1h1q s ILE 141 N -2.22 0.20 0.05 0.00 2.07 -1.26 -1.53 121.20 118.50 1h1q s ILE 141 Ca 0.50 -0.39 0.02 0.00 -1.41 0.00 0.00 60.65 59.37 1h1q s ILE 141 Cb -0.10 -0.23 -0.03 0.00 0.13 0.00 0.00 42.46 42.23 1h1q s ILE 141 CO 0.28 -0.13 -0.07 -0.54 -1.91 0.00 0.00 174.94 172.57 1h1q s LYS 142 N -0.55 0.53 -0.06 3.50 1.02 0.52 -4.66 119.74 120.04 1h1q s LYS 142 Ca -0.04 -0.83 -0.30 0.00 0.02 0.00 0.00 55.97 54.82 1h1q s LYS 142 Cb -0.04 -0.19 -0.04 0.00 -0.52 0.00 0.00 37.83 37.04 1h1q s LYS 142 CO -0.00 0.02 1.35 -0.51 -0.92 0.00 0.00 175.35 175.29 1h1q s LEU 143 N -1.80 4.28 0.20 3.17 1.43 0.59 -1.29 118.68 125.25 1h1q s LEU 143 Ca -0.08 1.96 0.00 0.00 -1.03 0.00 0.00 54.13 54.99 1h1q s LEU 143 Cb -0.07 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 1h1q s LEU 143 CO -0.01 -0.72 0.08 0.00 0.23 0.00 0.00 176.35 175.93 1h1q s ALA 144 N 2.80 1.29 -0.34 4.21 0.00 -0.31 -1.54 121.76 127.87 1h1q s ALA 144 Ca 0.61 -1.68 -0.12 0.00 0.00 0.00 0.00 51.96 50.78 1h1q s ALA 144 Cb -0.28 1.03 0.01 0.00 0.00 0.00 0.00 23.12 23.89 1h1q s ALA 144 CO 0.23 -0.48 0.44 -3.47 0.00 0.00 0.00 175.76 172.48 1h1q n ASP 145 N -0.28 -6.86 -0.84 0.00 -0.08 -1.26 -4.69 116.55 102.54 1h1q n ASP 145 Ca -0.02 0.51 0.04 0.00 -1.51 0.00 0.00 54.79 53.82 1h1q n ASP 145 Cb 0.65 -4.58 0.16 0.00 2.34 0.00 0.00 41.12 39.69 1h1q n ASP 145 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1h1q n PHE 146 N -0.25 0.66 0.24 -0.67 3.01 -1.26 -4.39 117.46 114.80 1h1q n PHE 146 Ca 0.09 -0.26 0.17 0.00 1.01 0.00 0.00 57.45 58.45 1h1q n PHE 146 Cb 0.34 -0.13 0.86 0.00 -0.01 0.00 0.00 39.48 40.54 1h1q n PHE 146 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1h1q h GLY 147 N 4.96 0.00 -1.98 1.37 0.00 -1.90 -1.50 103.07 104.02 1h1q h GLY 147 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1h1q h GLY 147 CO 0.10 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.68 1h1q n LEU 148 N -3.77 3.80 -4.90 3.11 7.99 -1.26 -4.76 117.00 117.20 1h1q n LEU 148 Ca 0.00 -2.40 -0.28 0.00 -0.01 0.00 0.00 56.01 53.33 1h1q n LEU 148 Cb 0.25 -0.43 -0.00 0.00 -0.11 0.00 0.00 43.42 43.13 1h1q n LEU 148 CO 0.27 0.76 0.45 0.00 -1.51 0.00 0.00 177.39 177.35 1h1q s ALA 149 N -1.72 3.39 -0.04 -1.18 0.00 -0.57 -4.33 121.76 117.32 1h1q s ALA 149 Ca 0.38 -0.49 -0.01 0.00 0.00 0.00 0.00 51.96 51.84 1h1q s ALA 149 Cb 0.25 -2.60 0.03 0.00 0.00 0.00 0.00 23.12 20.80 1h1q s ALA 149 CO 0.18 -0.35 0.07 0.50 0.00 0.00 0.00 175.76 176.16 1h1q s ARG 150 N -4.72 -0.00 0.52 0.00 3.52 0.59 -4.85 118.95 114.01 1h1q s ARG 150 Ca 0.48 0.29 -0.22 0.00 -0.13 0.00 0.00 55.73 56.15 1h1q s ARG 150 Cb -0.10 -0.27 -0.06 0.00 -1.56 0.00 0.00 34.95 32.96 1h1q s ARG 150 CO 0.45 -0.20 1.21 0.00 -0.81 0.00 0.00 175.30 175.95 1h1q n ALA 151 N 4.41 1.04 -2.36 6.12 0.00 -1.26 -2.24 120.51 126.22 1h1q n ALA 151 Ca -0.23 0.13 -0.19 0.00 0.00 0.00 0.00 53.44 53.16 1h1q n ALA 151 Cb 0.50 -2.25 -0.10 0.00 0.00 0.00 0.00 19.45 17.60 1h1q n ALA 151 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1h1q s PHE 152 N -1.32 1.72 0.47 0.00 -0.71 0.69 -4.87 117.98 113.95 1h1q s PHE 152 Ca 0.70 -0.66 0.06 0.00 -1.04 0.00 0.00 56.93 55.99 1h1q s PHE 152 Cb -0.45 -0.88 -0.01 0.00 -1.21 0.00 0.00 43.02 40.47 1h1q s PHE 152 CO 0.51 0.27 0.29 0.20 -1.34 0.00 0.00 175.22 175.15 1h1q s GLY 153 N -3.34 2.35 -0.10 1.99 0.00 -1.26 -4.92 107.32 102.04 1h1q s GLY 153 Ca 0.25 -1.65 0.01 0.00 0.00 0.00 0.00 44.72 43.33 1h1q s GLY 153 CO 0.08 -1.90 -0.14 0.14 0.00 0.00 0.00 173.10 171.29 1h1q s VAL 154 N -2.65 3.05 0.50 1.40 1.01 -1.26 -2.72 120.40 119.73 1h1q s VAL 154 Ca 0.38 -0.68 -0.14 0.00 0.00 0.00 0.00 61.98 61.53 1h1q s VAL 154 Cb 0.00 -2.25 -0.12 0.00 0.00 0.00 0.00 36.38 34.01 1h1q s VAL 154 CO 0.22 0.55 -0.24 -0.81 0.00 0.00 0.00 175.10 174.81 1h1q n PRO 155 N 3.13 0.00 -0.67 2.72 -0.05 -1.26 -5.11 135.00 133.76 1h1q n PRO 155 Ca -0.18 0.00 -0.29 0.00 -0.05 0.00 0.00 63.50 62.98 1h1q n PRO 155 Cb 0.53 -0.79 0.26 0.00 -0.05 0.00 0.00 33.50 33.44 1h1q n PRO 155 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 175.50 175.59 1h1q s VAL 156 N -1.57 1.63 0.18 0.52 -7.23 -1.10 -5.07 120.40 107.76 1h1q s VAL 156 Ca 0.41 0.00 0.06 0.00 -1.81 0.00 0.00 61.98 60.64 1h1q s VAL 156 Cb -0.33 -2.21 -0.05 0.00 0.56 0.00 0.00 36.38 34.36 1h1q s VAL 156 CO 0.56 0.00 -0.12 -0.13 -0.31 0.00 0.00 175.10 175.10 1h1q s ARG 157 N -4.94 1.23 0.11 4.82 0.52 -1.26 -4.97 118.95 114.46 1h1q s ARG 157 Ca 0.69 -1.54 -0.34 0.00 -0.52 0.00 0.00 55.73 54.01 1h1q s ARG 157 Cb -0.17 -0.90 -0.14 0.00 0.52 0.00 0.00 34.95 34.27 1h1q s ARG 157 CO 0.60 0.13 1.62 2.41 0.02 0.00 0.00 175.30 180.07 1h1q n THR 158 N -0.31 0.10 -0.02 0.02 -1.04 -1.21 -4.74 114.28 107.08 1h1q n THR 158 Ca -0.09 -0.02 -0.05 0.00 -2.04 0.00 0.00 64.05 61.85 1h1q n THR 158 Cb 0.61 -1.57 -0.02 0.00 -1.82 0.00 0.00 70.33 67.53 1h1q n THR 158 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1h1q n TYR 159 N 3.96 0.00 0.00 -1.42 4.01 -1.26 -5.06 117.16 117.38 1h1q n TYR 159 Ca 0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.92 1h1q n TYR 159 Cb 0.29 -0.24 0.00 0.00 -0.31 0.00 0.00 39.34 39.08 1h1q n TYR 159 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1h1q n HIS 161 N -3.83 0.00 -2.43 -0.72 -0.00 -1.26 -5.06 115.22 101.91 1h1q n HIS 161 Ca -0.08 0.00 -0.39 0.00 0.46 0.00 0.00 57.72 57.70 1h1q n HIS 161 Cb 0.28 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 30.12 1h1q n HIS 161 CO 0.00 0.00 0.00 -1.21 0.46 0.00 0.00 176.34 175.59 1h1q s GLU 162 N -1.28 3.16 0.09 1.57 8.01 -1.26 -4.90 118.70 124.09 1h1q s GLU 162 Ca 0.00 -0.36 -0.20 0.00 0.01 0.00 0.00 54.97 54.42 1h1q s GLU 162 Cb 0.00 -4.61 0.05 0.00 -4.31 0.00 0.00 34.13 25.25 1h1q s GLU 162 CO 0.00 -2.36 0.49 0.08 0.01 0.00 0.00 175.26 173.48 1h1q s VAL 163 N 6.41 0.04 0.32 2.63 1.01 -1.26 -5.12 120.40 124.42 1h1q s VAL 163 Ca 0.46 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1h1q s VAL 163 Cb -0.06 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.28 1h1q s VAL 163 CO 0.08 -0.17 0.00 0.52 0.00 0.00 0.00 175.10 175.53 1h1q n VAL 164 N 0.08 -4.01 -1.65 2.92 0.31 -1.00 -4.71 118.33 110.26 1h1q n VAL 164 Ca -0.17 1.85 -0.44 0.00 -0.01 0.00 0.00 64.34 65.57 1h1q n VAL 164 Cb 0.62 -2.45 -0.01 0.00 -0.91 0.00 0.00 33.84 31.09 1h1q n VAL 164 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1h1q n THR 165 N 0.00 1.91 -0.19 2.52 -1.04 -1.26 -4.77 114.28 111.45 1h1q n THR 165 Ca 0.00 -0.48 -0.00 0.00 -2.04 0.00 0.00 64.05 61.53 1h1q n THR 165 Cb 0.00 -1.33 0.10 0.00 -1.82 0.00 0.00 70.33 67.28 1h1q n THR 165 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1h1q h LEU 166 N 2.46 0.01 -0.79 -4.42 5.85 -1.97 -2.73 115.31 113.72 1h1q h LEU 166 Ca -0.43 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1h1q h LEU 166 Cb 1.31 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.48 1h1q h LEU 166 CO 0.63 0.02 0.00 0.79 -0.34 0.00 0.00 178.44 179.54 1h1q n TRP 167 N -5.12 0.48 -0.93 1.25 7.02 -1.26 -2.26 117.44 116.62 1h1q n TRP 167 Ca 0.08 0.23 0.06 0.00 -1.02 0.00 0.00 57.50 56.86 1h1q n TRP 167 Cb 0.30 -0.87 0.09 0.00 -2.42 0.00 0.00 31.31 28.40 1h1q n TRP 167 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1h1q n TYR 168 N -1.98 0.00 -3.31 -5.99 4.01 -1.04 -4.43 117.16 104.42 1h1q n TYR 168 Ca 0.00 -0.74 -0.37 0.00 -0.16 0.00 0.00 57.90 56.63 1h1q n TYR 168 Cb 0.07 -0.11 -0.06 0.00 -0.31 0.00 0.00 39.34 38.93 1h1q n TYR 168 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1h1q s ARG 169 N -2.04 4.10 0.53 -0.72 3.52 -0.96 -3.40 118.95 119.99 1h1q s ARG 169 Ca 0.20 0.63 -0.14 0.00 -0.13 0.00 0.00 55.73 56.29 1h1q s ARG 169 Cb 0.18 -3.10 -0.07 0.00 -1.56 0.00 0.00 34.95 30.41 1h1q s ARG 169 CO 0.02 0.56 0.97 0.00 -0.81 0.00 0.00 175.30 176.04 1h1q s ALA 170 N -1.27 3.12 0.09 6.12 0.00 -1.26 -4.96 121.76 123.59 1h1q s ALA 170 Ca 0.33 0.04 -0.35 0.00 0.00 0.00 0.00 51.96 51.98 1h1q s ALA 170 Cb -0.17 -3.05 -0.17 0.00 0.00 0.00 0.00 23.12 19.73 1h1q s ALA 170 CO 0.19 -0.34 1.57 -1.00 0.00 0.00 0.00 175.76 176.18 1h1q h PRO 171 N 0.58 -0.95 -0.54 0.00 0.13 -1.98 -2.57 132.00 126.67 1h1q h PRO 171 Ca -0.46 0.06 0.20 0.00 -0.87 0.00 0.00 66.00 64.93 1h1q h PRO 171 Cb 1.19 0.22 -0.07 0.00 0.13 0.00 0.00 31.00 32.46 1h1q h PRO 171 CO 0.62 -0.63 0.33 0.39 -0.23 0.00 0.00 178.00 178.47 1h1q n GLU 172 N -5.56 -0.02 -0.09 0.86 4.71 -1.26 -0.87 120.64 118.41 1h1q n GLU 172 Ca -0.12 0.57 -0.18 0.00 -0.01 0.00 0.00 57.16 57.43 1h1q n GLU 172 Cb 0.45 -1.09 -0.10 0.00 -1.01 0.00 0.00 31.44 29.70 1h1q n GLU 172 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 1h1q h ILE 173 N 0.00 0.83 -0.42 -3.67 2.04 -1.78 -1.22 117.51 113.29 1h1q h ILE 173 Ca 0.38 -1.97 0.05 0.00 1.00 0.00 0.00 64.86 64.33 1h1q h ILE 173 Cb 1.14 1.91 -0.02 0.00 -0.74 0.00 0.00 36.82 39.11 1h1q h ILE 173 CO -0.26 0.28 0.28 -0.07 0.00 0.00 0.00 178.15 178.38 1h1q h LEU 174 N -1.00 0.31 -0.02 1.44 3.38 -0.69 0.25 115.31 118.98 1h1q h LEU 174 Ca -0.25 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1h1q h LEU 174 Cb 1.10 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1h1q h LEU 174 CO -0.15 0.20 -0.21 0.18 0.09 0.00 0.00 178.44 178.56 1h1q n LEU 175 N -4.48 0.23 0.00 1.67 4.77 -0.53 -4.77 117.00 113.89 1h1q n LEU 175 Ca 0.05 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 1h1q n LEU 175 Cb 0.23 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1h1q n LEU 175 CO 0.35 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 1h1q n GLY 176 N 1.48 0.65 3.63 -0.72 0.00 0.89 0.53 105.19 111.66 1h1q n GLY 176 Ca 0.07 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 1h1q n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h1q n LYS 178 N 0.46 0.22 -3.75 0.00 2.85 -1.26 -4.55 118.16 112.14 1h1q n LYS 178 Ca 0.08 0.30 -0.29 0.00 -1.05 0.00 0.00 58.31 57.35 1h1q n LYS 178 Cb 0.36 -1.82 -0.15 0.00 -0.65 0.00 0.00 35.03 32.76 1h1q n LYS 178 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 1h1q s TYR 179 N -3.19 1.64 0.55 5.58 2.02 -1.26 -3.32 117.35 119.37 1h1q s TYR 179 Ca 0.08 -1.59 0.06 0.00 -0.37 0.00 0.00 57.07 55.25 1h1q s TYR 179 Cb 0.11 -1.59 0.05 0.00 -0.40 0.00 0.00 41.96 40.13 1h1q s TYR 179 CO 0.50 -0.83 0.47 1.52 -1.57 0.00 0.00 175.55 175.64 1h1q s TYR 180 N 1.64 1.58 0.00 2.71 -0.85 -1.26 -5.05 117.35 116.12 1h1q s TYR 180 Ca 0.07 -0.83 0.00 0.00 -0.52 0.00 0.00 57.07 55.79 1h1q s TYR 180 Cb -0.17 -1.96 0.00 0.00 0.38 0.00 0.00 41.96 40.21 1h1q s TYR 180 CO -0.21 -0.59 0.00 0.45 -1.52 0.00 0.00 175.55 173.68 1h1q n SER 181 N -1.85 0.00 -0.28 -0.18 2.88 -1.26 -4.88 113.62 108.05 1h1q n SER 181 Ca 0.01 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.71 1h1q n SER 181 Cb 0.64 0.00 0.43 0.00 -0.75 0.00 0.00 64.21 64.53 1h1q n SER 181 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1h1q h THR 182 N 0.00 0.72 -0.97 2.46 1.35 -1.99 0.67 112.91 115.15 1h1q h THR 182 Ca 0.00 -0.20 0.29 0.00 -0.55 0.00 0.00 66.41 65.96 1h1q h THR 182 Cb 0.00 0.11 -0.15 0.00 -1.73 0.00 0.00 68.15 66.38 1h1q h THR 182 CO 0.00 0.10 0.49 0.00 -0.25 0.00 0.00 175.52 175.86 1h1q h ALA 183 N 1.61 1.78 -0.86 6.62 0.00 -1.91 -1.79 119.26 124.71 1h1q h ALA 183 Ca 0.49 0.19 0.11 0.00 0.00 0.00 0.00 54.91 55.70 1h1q h ALA 183 Cb 0.99 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.89 1h1q h ALA 183 CO -0.23 -0.52 0.49 -0.39 0.00 0.00 0.00 179.25 178.60 1h1q h VAL 184 N 0.32 0.89 0.00 0.00 -1.51 -1.27 -1.50 116.25 113.18 1h1q h VAL 184 Ca 0.68 -0.28 -0.09 0.00 -1.23 0.00 0.00 66.70 65.78 1h1q h VAL 184 Cb 1.50 0.01 -0.01 0.00 -2.13 0.00 0.00 31.29 30.66 1h1q h VAL 184 CO -0.61 0.15 -0.44 0.44 -1.23 0.00 0.00 177.57 175.87 1h1q h ASP 185 N 0.80 0.00 -0.61 4.19 3.32 -1.48 -2.67 116.42 119.97 1h1q h ASP 185 Ca 0.42 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.41 1h1q h ASP 185 Cb 0.42 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 1h1q h ASP 185 CO -0.27 0.44 0.15 0.40 -1.72 0.00 0.00 179.24 178.25 1h1q h ILE 186 N 0.00 1.25 0.00 0.35 1.08 -1.32 -2.09 117.51 116.79 1h1q h ILE 186 Ca -0.00 -0.91 0.01 0.00 -0.39 0.00 0.00 64.86 63.57 1h1q h ILE 186 Cb 0.87 0.68 -0.02 0.00 -3.07 0.00 0.00 36.82 35.28 1h1q h ILE 186 CO 0.06 0.34 -0.07 -0.25 -0.69 0.00 0.00 178.15 177.54 1h1q h TRP 187 N 0.89 -0.18 -0.43 1.37 2.91 -1.09 0.20 115.95 119.61 1h1q h TRP 187 Ca 0.19 0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.30 1h1q h TRP 187 Cb 0.35 0.08 -0.07 0.00 -0.51 0.00 0.00 29.16 29.02 1h1q h TRP 187 CO 0.03 -0.11 0.02 0.77 -1.03 0.00 0.00 178.44 178.11 1h1q h SER 188 N -0.13 -0.13 -0.85 2.65 0.02 -1.24 0.70 113.55 114.57 1h1q h SER 188 Ca 0.03 0.09 0.04 0.00 -0.84 0.00 0.00 61.79 61.11 1h1q h SER 188 Cb 0.16 0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.81 1h1q h SER 188 CO -0.07 -0.03 0.54 -0.07 -1.14 0.00 0.00 176.83 176.05 1h1q h LEU 189 N 0.13 0.89 0.13 5.07 3.38 -0.69 0.85 115.31 125.08 1h1q h LEU 189 Ca 0.21 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.19 1h1q h LEU 189 Cb 0.30 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1h1q h LEU 189 CO -0.34 0.60 -0.16 1.23 0.09 0.00 0.00 178.44 179.86 1h1q h GLY 190 N 1.04 -0.32 0.60 0.83 0.00 0.64 -0.51 103.07 105.35 1h1q h GLY 190 Ca 0.34 0.19 0.10 0.00 0.00 0.00 0.00 47.33 47.96 1h1q h GLY 190 CO -0.13 -0.16 0.63 0.00 0.00 0.00 0.00 176.54 176.88 1h1q h ILE 192 N 1.04 1.24 -0.55 0.00 2.04 0.22 -3.02 117.51 118.48 1h1q h ILE 192 Ca 0.46 -0.86 -0.09 0.00 1.00 0.00 0.00 64.86 65.38 1h1q h ILE 192 Cb 0.38 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1h1q h ILE 192 CO -0.22 0.30 -0.02 0.15 0.00 0.00 0.00 178.15 178.36 1h1q h PHE 193 N 0.61 1.03 -0.35 1.37 3.57 -0.98 -2.21 116.94 119.99 1h1q h PHE 193 Ca 0.14 -0.17 0.08 0.00 3.53 0.00 0.00 57.97 61.54 1h1q h PHE 193 Cb 0.35 -0.27 -0.08 0.00 2.79 0.00 0.00 35.95 38.74 1h1q h PHE 193 CO 0.02 0.94 -0.24 0.00 -2.23 0.00 0.00 178.31 176.80 1h1q h ALA 194 N 1.09 -0.03 -0.83 2.41 0.00 -1.37 0.70 119.26 121.23 1h1q h ALA 194 Ca 0.16 0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.26 1h1q h ALA 194 Cb 0.54 0.53 -0.06 0.00 0.00 0.00 0.00 17.79 18.81 1h1q h ALA 194 CO 0.03 -0.63 0.54 0.93 0.00 0.00 0.00 179.25 180.12 1h1q h GLU 195 N -0.19 0.81 -0.44 0.00 5.08 -1.47 0.55 114.58 118.92 1h1q h GLU 195 Ca 0.17 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1h1q h GLU 195 Cb 0.46 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1h1q h GLU 195 CO -0.46 0.54 0.29 0.52 -1.00 0.00 0.00 179.01 178.89 1h1q h MET 196 N 0.84 0.55 0.00 2.33 2.86 -0.25 -2.52 114.93 118.74 1h1q h MET 196 Ca 0.37 -0.03 -0.19 0.00 -2.06 0.00 0.00 59.70 57.79 1h1q h MET 196 Cb 0.34 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.85 1h1q h MET 196 CO -0.14 0.37 -1.40 0.28 1.06 0.00 0.00 176.91 177.07 1h1q n VAL 197 N -4.47 1.50 0.40 -2.22 0.31 0.46 -4.46 118.33 109.85 1h1q n VAL 197 Ca 0.04 -0.03 0.11 0.00 -0.01 0.00 0.00 64.34 64.44 1h1q n VAL 197 Cb 0.07 -2.15 0.45 0.00 -0.91 0.00 0.00 33.84 31.30 1h1q n VAL 197 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1h1q n THR 198 N -4.43 0.89 -1.74 2.52 -2.24 0.16 -4.89 114.28 104.55 1h1q n THR 198 Ca -0.28 0.26 -0.14 0.00 -2.27 0.00 0.00 64.05 61.62 1h1q n THR 198 Cb 0.61 -1.16 -0.04 0.00 -2.10 0.00 0.00 70.33 67.64 1h1q n THR 198 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1h1q n ARG 199 N -2.07 -1.01 -3.56 -0.78 1.74 -0.95 -4.96 116.66 105.07 1h1q n ARG 199 Ca 0.02 0.86 -0.07 0.00 -0.77 0.00 0.00 57.85 57.89 1h1q n ARG 199 Cb 0.21 -5.01 -0.02 0.00 -1.02 0.00 0.00 32.46 26.62 1h1q n ARG 199 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1h1q s ARG 200 N -3.76 0.90 0.73 5.56 3.03 -1.25 -5.05 118.95 119.10 1h1q s ARG 200 Ca 0.00 -0.38 -0.14 0.00 2.03 0.00 0.00 55.73 57.23 1h1q s ARG 200 Cb 0.00 0.38 0.04 0.00 -1.03 0.00 0.00 34.95 34.34 1h1q s ARG 200 CO 0.00 -0.40 1.17 0.00 -1.13 0.00 0.00 175.30 174.94 1h1q s ALA 201 N -3.16 2.17 -0.07 7.88 0.00 -1.26 -3.92 121.76 123.41 1h1q s ALA 201 Ca 0.07 0.73 -0.16 0.00 0.00 0.00 0.00 51.96 52.59 1h1q s ALA 201 Cb -0.01 -3.41 -0.30 0.00 0.00 0.00 0.00 23.12 19.40 1h1q s ALA 201 CO -0.07 -1.77 0.69 1.25 0.00 0.00 0.00 175.76 175.87 1h1q h LEU 202 N -0.37 0.48 -6.01 0.00 5.85 -1.90 -3.42 115.31 109.95 1h1q h LEU 202 Ca -0.47 -0.90 -0.57 0.00 0.84 0.00 0.00 57.88 56.79 1h1q h LEU 202 Cb 1.28 -0.16 -0.40 0.00 0.37 0.00 0.00 40.66 41.74 1h1q h LEU 202 CO 0.50 1.61 -0.90 0.49 -0.34 0.00 0.00 178.44 179.80 1h1q n PHE 203 N -3.90 1.48 -0.76 1.25 3.72 -1.26 -4.99 117.46 113.01 1h1q n PHE 203 Ca -0.22 -3.84 -0.25 0.00 -0.05 0.00 0.00 57.45 53.10 1h1q n PHE 203 Cb 0.93 -0.44 -0.02 0.00 -0.94 0.00 0.00 39.48 39.00 1h1q n PHE 203 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1h1q n PRO 204 N 0.95 1.78 -1.75 -1.08 -0.04 -1.26 -4.49 135.00 129.10 1h1q n PRO 204 Ca 0.25 -1.45 -0.33 0.00 -0.04 0.00 0.00 63.50 61.93 1h1q n PRO 204 Cb 0.49 -2.51 0.05 0.00 -0.04 0.00 0.00 33.50 31.49 1h1q n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1h1q s GLY 205 N 3.89 2.15 0.07 0.55 0.00 -1.26 -4.95 107.32 107.77 1h1q s GLY 205 Ca 0.40 0.54 0.23 0.00 0.00 0.00 0.00 44.72 45.89 1h1q s GLY 205 CO 0.00 0.90 1.06 1.22 0.00 0.00 0.00 173.10 176.28 1h1q n ASP 206 N -2.43 0.62 -3.56 1.64 9.92 -1.26 -4.82 116.55 116.67 1h1q n ASP 206 Ca 0.10 -0.10 -0.02 0.00 -0.53 0.00 0.00 54.79 54.25 1h1q n ASP 206 Cb 0.52 0.69 0.00 0.00 -0.64 0.00 0.00 41.12 41.70 1h1q n ASP 206 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1h1q s SER 207 N -4.12 -0.06 0.62 -2.24 1.04 -1.26 -4.94 113.70 102.75 1h1q s SER 207 Ca 0.03 -0.47 0.38 0.00 0.48 0.00 0.00 55.95 56.38 1h1q s SER 207 Cb 0.14 0.41 2.09 0.00 0.10 0.00 0.00 66.02 68.76 1h1q s SER 207 CO 0.79 -0.79 2.28 -0.33 0.98 0.00 0.00 173.24 176.17 1h1q h GLU 208 N 2.00 0.00 0.05 4.02 5.08 -1.97 2.29 114.58 126.05 1h1q h GLU 208 Ca -0.26 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 57.74 1h1q h GLU 208 Cb 1.22 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.42 1h1q h GLU 208 CO 0.31 0.01 -2.10 1.51 -1.00 0.00 0.00 179.01 177.74 1h1q n ILE 209 N -3.34 1.62 -0.02 3.13 0.13 -1.26 -3.18 119.36 116.43 1h1q n ILE 209 Ca -0.03 -0.70 -0.10 0.00 -1.10 0.00 0.00 62.75 60.83 1h1q n ILE 209 Cb 0.11 -1.31 -0.04 0.00 -0.84 0.00 0.00 39.64 37.56 1h1q n ILE 209 CO 0.00 0.00 0.00 -0.78 2.80 0.00 0.00 176.55 178.57 1h1q h ASP 210 N 0.03 0.06 -0.13 9.51 3.58 -1.16 -2.49 116.42 125.82 1h1q h ASP 210 Ca -0.45 0.01 0.02 0.00 0.42 0.00 0.00 57.03 57.04 1h1q h ASP 210 Cb 2.03 0.01 -0.05 0.00 1.72 0.00 0.00 39.33 43.04 1h1q h ASP 210 CO 0.04 0.06 -0.41 -0.61 -2.88 0.00 0.00 179.24 175.44 1h1q h GLN 211 N 0.13 -0.40 -0.38 0.28 5.75 0.35 0.20 115.11 121.04 1h1q h GLN 211 Ca 0.06 0.03 0.08 0.00 -0.15 0.00 0.00 58.65 58.67 1h1q h GLN 211 Cb 0.03 0.09 -0.07 0.00 1.07 0.00 0.00 27.48 28.60 1h1q h GLN 211 CO -0.06 -0.27 -0.11 -0.07 -2.65 0.00 0.00 178.83 175.67 1h1q h LEU 212 N -0.41 -0.41 -0.80 -2.39 3.38 -1.46 -1.88 115.31 111.34 1h1q h LEU 212 Ca 0.03 0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1h1q h LEU 212 Cb 0.50 0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.47 1h1q h LEU 212 CO -0.34 -0.15 0.41 -0.26 0.09 0.00 0.00 178.44 178.19 1h1q h PHE 213 N -0.03 1.13 -0.78 1.13 0.04 -1.15 0.87 116.94 118.15 1h1q h PHE 213 Ca 0.18 -0.04 0.08 0.00 2.80 0.00 0.00 57.97 60.99 1h1q h PHE 213 Cb 0.31 -0.36 -0.05 0.00 2.20 0.00 0.00 35.95 38.05 1h1q h PHE 213 CO -0.36 0.81 0.51 0.00 -0.60 0.00 0.00 178.31 178.68 1h1q h ARG 214 N 1.13 0.74 -0.45 1.51 3.08 0.15 1.32 114.38 121.86 1h1q h ARG 214 Ca 0.28 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.24 1h1q h ARG 214 Cb 0.08 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 1h1q h ARG 214 CO -0.04 0.49 0.12 0.82 -1.07 0.00 0.00 179.97 180.29 1h1q h ILE 215 N 0.77 1.23 -0.40 2.04 1.08 0.75 -2.13 117.51 120.84 1h1q h ILE 215 Ca 0.35 -0.79 -0.08 0.00 -0.39 0.00 0.00 64.86 63.95 1h1q h ILE 215 Cb 0.36 0.90 -0.02 0.00 -3.07 0.00 0.00 36.82 34.99 1h1q h ILE 215 CO -0.13 0.28 -0.07 -0.26 -0.69 0.00 0.00 178.15 177.28 1h1q h PHE 216 N 0.59 0.73 0.00 1.37 0.04 0.22 0.47 116.94 120.36 1h1q h PHE 216 Ca 0.14 -0.11 0.00 0.00 2.80 0.00 0.00 57.97 60.80 1h1q h PHE 216 Cb 0.31 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 38.26 1h1q h PHE 216 CO 0.02 0.73 0.00 0.00 -0.60 0.00 0.00 178.31 178.46 1h1q h ARG 217 N 0.63 0.00 0.00 1.51 3.08 0.23 0.28 114.38 120.11 1h1q h ARG 217 Ca 0.12 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.91 1h1q h ARG 217 Cb 0.50 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.50 1h1q h ARG 217 CO 0.03 0.00 -1.96 2.41 -1.07 0.00 0.00 179.97 179.38 1h1q n THR 218 N -2.44 0.96 0.01 2.04 -1.04 -0.81 -4.58 114.28 108.43 1h1q n THR 218 Ca 0.02 -0.55 0.10 0.00 -2.04 0.00 0.00 64.05 61.59 1h1q n THR 218 Cb 0.27 -0.73 -0.16 0.00 -1.82 0.00 0.00 70.33 67.89 1h1q n THR 218 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1h1q n LEU 219 N -2.61 0.02 -0.30 -4.42 4.77 0.16 -3.62 117.00 111.00 1h1q n LEU 219 Ca -0.24 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 1h1q n LEU 219 Cb 0.93 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.02 1h1q n LEU 219 CO 0.27 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1h1q n GLY 220 N 1.35 -2.98 3.10 -0.72 0.00 0.08 -4.14 105.19 101.89 1h1q n GLY 220 Ca -0.04 -0.89 -0.56 0.00 0.00 0.00 0.00 46.02 44.54 1h1q n GLY 220 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1h1q n THR 221 N 0.20 0.00 -1.29 2.61 -1.04 -1.21 -4.77 114.28 108.77 1h1q n THR 221 Ca 0.00 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.70 1h1q n THR 221 Cb 0.00 -0.38 0.09 0.00 -1.82 0.00 0.00 70.33 68.21 1h1q n THR 221 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1h1q s PRO 222 N 2.30 2.33 0.23 -2.82 0.04 -1.26 -4.80 135.00 131.01 1h1q s PRO 222 Ca 0.86 1.15 0.00 0.00 0.04 0.00 0.00 61.00 63.06 1h1q s PRO 222 Cb -1.23 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 31.35 1h1q s PRO 222 CO 0.67 -1.59 0.10 0.16 0.04 0.00 0.00 177.00 176.38 1h1q s ASP 223 N -3.43 0.79 0.66 6.66 1.47 -1.26 -4.97 116.67 116.60 1h1q s ASP 223 Ca 0.61 -1.37 0.20 0.00 1.18 0.00 0.00 52.55 53.16 1h1q s ASP 223 Cb -0.17 0.24 1.07 0.00 -0.34 0.00 0.00 42.92 43.72 1h1q s ASP 223 CO 0.56 -0.76 1.60 -0.33 0.68 0.00 0.00 175.17 176.92 1h1q h GLU 224 N 2.49 0.00 0.00 2.11 4.39 -1.98 0.11 114.58 121.71 1h1q h GLU 224 Ca -0.37 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.33 1h1q h GLU 224 Cb 1.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 1h1q h GLU 224 CO 0.58 0.00 0.00 0.28 -1.16 0.00 0.00 179.01 178.71 1h1q n VAL 225 N -2.77 0.00 0.00 3.13 0.31 -1.26 -3.10 118.33 114.64 1h1q n VAL 225 Ca -0.01 0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 1h1q n VAL 225 Cb 0.60 -0.63 0.00 0.00 -0.91 0.00 0.00 33.84 32.91 1h1q n VAL 225 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 1h1q n VAL 226 N 0.00 0.00 -3.49 2.52 3.14 -0.86 -3.04 118.33 116.60 1h1q n VAL 226 Ca 0.00 0.00 -0.28 0.00 -2.96 0.00 0.00 64.34 61.10 1h1q n VAL 226 Cb 0.00 0.00 -0.13 0.00 -1.06 0.00 0.00 33.84 32.65 1h1q n VAL 226 CO 0.00 0.00 0.00 0.86 -6.46 0.00 0.00 176.83 171.23 1h1q s TRP 227 N -4.90 0.47 0.16 1.45 -0.00 0.33 -4.59 118.94 111.87 1h1q s TRP 227 Ca 0.00 -1.23 -0.34 0.00 -0.00 0.00 0.00 56.10 54.53 1h1q s TRP 227 Cb 0.00 -0.87 -0.14 0.00 -0.00 0.00 0.00 33.47 32.46 1h1q s TRP 227 CO 0.00 -0.84 1.52 -2.30 -0.00 0.00 0.00 176.95 175.33 1h1q n PRO 228 N 4.60 2.00 0.00 5.86 -0.02 -1.17 -0.89 135.00 145.38 1h1q n PRO 228 Ca 0.04 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 1h1q n PRO 228 Cb 0.40 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 1h1q n PRO 228 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h1q n GLY 229 N 3.09 2.08 0.22 -1.23 0.00 -1.26 -4.95 105.19 103.13 1h1q n GLY 229 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.12 1h1q n GLY 229 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1h1q h VAL 230 N 0.00 0.00 0.00 1.61 2.07 -1.36 0.61 116.25 119.18 1h1q h VAL 230 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1h1q h VAL 230 Cb 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 1h1q h VAL 230 CO 0.00 0.00 0.04 0.35 0.02 0.00 0.00 177.57 177.98 1h1q n THR 231 N -3.98 1.26 0.82 2.57 -2.24 -1.26 -0.79 114.28 110.66 1h1q n THR 231 Ca -0.02 0.66 0.07 0.00 -2.27 0.00 0.00 64.05 62.50 1h1q n THR 231 Cb 0.16 -1.66 0.22 0.00 -2.10 0.00 0.00 70.33 66.95 1h1q n THR 231 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1h1q n SER 232 N -1.98 2.08 -4.84 3.42 2.88 0.20 -4.87 113.62 110.50 1h1q n SER 232 Ca -0.01 -1.94 -0.32 0.00 -1.33 0.00 0.00 58.87 55.27 1h1q n SER 232 Cb 0.06 -0.23 -0.06 0.00 -0.75 0.00 0.00 64.21 63.23 1h1q n SER 232 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1h1q s MET 233 N -1.53 4.05 0.41 -1.46 -1.94 0.03 -5.00 119.30 113.85 1h1q s MET 233 Ca 0.28 0.85 0.22 0.00 -1.71 0.00 0.00 55.69 55.34 1h1q s MET 233 Cb 0.15 -2.28 1.20 0.00 2.01 0.00 0.00 34.83 35.90 1h1q s MET 233 CO 0.20 -0.01 1.73 -1.35 -0.01 0.00 0.00 175.02 175.59 1h1q h PRO 234 N 1.78 0.29 -0.52 2.03 0.11 -1.84 -1.56 132.00 132.30 1h1q h PRO 234 Ca -0.48 -0.02 -0.31 0.00 0.11 0.00 0.00 66.00 65.31 1h1q h PRO 234 Cb 1.18 -0.07 -0.41 0.00 0.11 0.00 0.00 31.00 31.82 1h1q h PRO 234 CO 0.63 0.19 -1.06 -0.25 -0.21 0.00 0.00 178.00 177.30 1h1q n ASP 235 N -4.64 2.22 -4.68 -2.05 8.00 0.19 -4.96 116.55 110.63 1h1q n ASP 235 Ca 0.28 -2.39 -0.41 0.00 0.71 0.00 0.00 54.79 52.99 1h1q n ASP 235 Cb 1.03 -0.46 -0.04 0.00 -0.02 0.00 0.00 41.12 41.63 1h1q n ASP 235 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1h1q s TYR 236 N -3.74 3.48 -0.11 1.24 6.14 -0.59 -4.75 117.35 119.01 1h1q s TYR 236 Ca 0.32 1.30 0.02 0.00 0.64 0.00 0.00 57.07 59.35 1h1q s TYR 236 Cb 0.34 -2.98 -0.01 0.00 0.42 0.00 0.00 41.96 39.73 1h1q s TYR 236 CO -0.02 -0.15 -0.19 0.15 0.64 0.00 0.00 175.55 175.98 1h1q s LYS 237 N 1.76 3.21 0.29 4.97 -0.14 -1.26 -4.87 119.74 123.70 1h1q s LYS 237 Ca 0.39 -0.78 0.25 0.00 -1.36 0.00 0.00 55.97 54.47 1h1q s LYS 237 Cb -0.17 -2.46 1.02 0.00 -1.68 0.00 0.00 37.83 34.54 1h1q s LYS 237 CO 0.15 0.20 1.75 -1.00 -0.76 0.00 0.00 175.35 175.68 1h1q h PRO 238 N 6.71 0.00 0.00 -1.68 0.13 -1.97 -1.37 132.00 133.82 1h1q h PRO 238 Ca -0.22 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.82 1h1q h PRO 238 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1h1q h PRO 238 CO 0.51 0.00 -0.41 0.66 -0.23 0.00 0.00 178.00 178.53 1h1q h SER 239 N 0.00 0.00 -1.12 1.44 4.64 -2.04 -3.46 113.55 113.01 1h1q h SER 239 Ca 0.00 0.00 -0.83 0.00 -0.47 0.00 0.00 61.79 60.49 1h1q h SER 239 Cb 0.39 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.50 1h1q h SER 239 CO 0.00 0.41 0.60 0.49 -0.87 0.00 0.00 176.83 177.46 1h1q n PHE 240 N -3.35 1.59 -1.54 4.77 3.72 -0.52 -4.79 117.46 117.34 1h1q n PHE 240 Ca 0.01 1.01 -0.42 0.00 -0.05 0.00 0.00 57.45 58.00 1h1q n PHE 240 Cb 0.61 -2.25 0.01 0.00 -0.94 0.00 0.00 39.48 36.91 1h1q n PHE 240 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1h1q n PRO 241 N 3.69 1.00 -3.43 -1.08 -0.02 -1.26 -4.86 135.00 129.03 1h1q n PRO 241 Ca 0.28 0.36 -0.42 0.00 -2.02 0.00 0.00 63.50 61.69 1h1q n PRO 241 Cb 0.01 -1.78 -0.10 0.00 -0.02 0.00 0.00 33.50 31.61 1h1q n PRO 241 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1h1q s LYS 242 N -1.78 3.17 0.29 -0.52 1.02 -1.26 -4.83 119.74 115.83 1h1q s LYS 242 Ca 0.63 -0.82 0.04 0.00 0.02 0.00 0.00 55.97 55.84 1h1q s LYS 242 Cb -0.60 -3.92 0.05 0.00 -0.52 0.00 0.00 37.83 32.83 1h1q s LYS 242 CO 0.57 -0.69 0.39 0.91 -0.92 0.00 0.00 175.35 175.62 1h1q n TRP 243 N 5.28 -2.74 -3.68 3.18 8.01 -1.26 -4.92 117.44 121.29 1h1q n TRP 243 Ca -0.10 -0.98 -0.14 0.00 -1.31 0.00 0.00 57.50 54.97 1h1q n TRP 243 Cb 0.48 -0.27 -0.14 0.00 -2.01 0.00 0.00 31.31 29.36 1h1q n TRP 243 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1h1q s ALA 244 N -2.43 -0.38 -0.95 6.99 0.00 -1.26 -3.45 121.76 120.28 1h1q s ALA 244 Ca 0.29 0.78 -0.31 0.00 0.00 0.00 0.00 51.96 52.72 1h1q s ALA 244 Cb -0.02 -0.82 -0.21 0.00 0.00 0.00 0.00 23.12 22.07 1h1q s ALA 244 CO 0.19 -0.49 2.66 -2.13 0.00 0.00 0.00 175.76 176.00 1h1q n ARG 245 N 5.03 0.06 -1.67 0.00 0.63 -1.26 -4.75 116.66 114.70 1h1q n ARG 245 Ca -0.11 0.00 -0.48 0.00 -0.92 0.00 0.00 57.85 56.34 1h1q n ARG 245 Cb 0.50 -1.61 -0.05 0.00 0.45 0.00 0.00 32.46 31.76 1h1q n ARG 245 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 1h1q n GLN 246 N 8.50 2.11 -1.66 -0.14 7.27 -1.24 -4.84 117.38 127.37 1h1q n GLN 246 Ca 0.64 0.77 -0.42 0.00 0.07 0.00 0.00 57.00 58.05 1h1q n GLN 246 Cb 0.06 -2.57 -0.03 0.00 2.41 0.00 0.00 30.24 30.10 1h1q n GLN 246 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1h1q s ASP 247 N 2.69 6.22 0.15 1.69 3.68 -1.26 -4.82 116.67 125.02 1h1q s ASP 247 Ca 0.87 2.48 -0.05 0.00 2.13 0.00 0.00 52.55 57.98 1h1q s ASP 247 Cb -0.71 -2.53 0.24 0.00 -1.45 0.00 0.00 42.92 38.47 1h1q s ASP 247 CO 0.46 -1.26 0.85 0.49 0.13 0.00 0.00 175.17 175.84 1h1q n PHE 248 N 8.49 0.17 -0.63 -5.34 3.01 -1.26 -1.29 117.46 120.61 1h1q n PHE 248 Ca 0.22 0.67 0.49 0.00 1.01 0.00 0.00 57.45 59.84 1h1q n PHE 248 Cb 0.42 -0.80 0.80 0.00 -0.01 0.00 0.00 39.48 39.89 1h1q n PHE 248 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1h1q h SER 249 N 0.00 0.03 0.07 4.37 4.64 -1.89 0.63 113.55 121.39 1h1q h SER 249 Ca 0.25 0.02 -0.38 0.00 -0.47 0.00 0.00 61.79 61.21 1h1q h SER 249 Cb 0.39 0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.45 1h1q h SER 249 CO -0.56 -0.03 -2.22 0.29 -0.87 0.00 0.00 176.83 173.45 1h1q n LYS 250 N -4.06 0.71 -0.06 4.77 5.02 -0.41 -2.93 118.16 121.20 1h1q n LYS 250 Ca 0.41 0.21 -0.04 0.00 -2.02 0.00 0.00 58.31 56.88 1h1q n LYS 250 Cb 1.85 -1.62 -0.03 0.00 -0.02 0.00 0.00 35.03 35.21 1h1q n LYS 250 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1h1q h VAL 251 N 0.03 0.00 -3.79 -0.18 2.07 0.14 -3.19 116.25 111.33 1h1q h VAL 251 Ca -0.50 0.00 -0.68 0.00 0.82 0.00 0.00 66.70 66.35 1h1q h VAL 251 Cb 1.97 0.00 -0.34 0.00 -1.52 0.00 0.00 31.29 31.40 1h1q h VAL 251 CO 0.00 0.00 -0.74 -0.69 0.02 0.00 0.00 177.57 176.16 1h1q s VAL 252 N -3.73 2.68 0.00 2.57 1.01 0.05 -5.00 120.40 117.98 1h1q s VAL 252 Ca -0.04 -1.46 -0.24 0.00 0.00 0.00 0.00 61.98 60.24 1h1q s VAL 252 Cb 0.03 -2.54 -0.14 0.00 0.00 0.00 0.00 36.38 33.73 1h1q s VAL 252 CO 0.17 -0.06 1.03 -0.65 0.00 0.00 0.00 175.10 175.59 1h1q h PRO 253 N 7.91 -0.79 -1.05 2.72 0.11 -1.52 -3.37 132.00 136.01 1h1q h PRO 253 Ca -0.21 0.05 0.28 0.00 0.11 0.00 0.00 66.00 66.23 1h1q h PRO 253 Cb 1.06 0.18 -0.11 0.00 0.11 0.00 0.00 31.00 32.23 1h1q h PRO 253 CO 0.51 -0.50 0.65 -1.35 -0.21 0.00 0.00 178.00 177.10 1h1q h PRO 254 N -1.18 0.41 -6.96 1.05 0.11 -1.94 -3.44 132.00 120.05 1h1q h PRO 254 Ca -0.08 -0.02 -0.53 0.00 0.11 0.00 0.00 66.00 65.48 1h1q h PRO 254 Cb 0.65 -0.09 0.09 0.00 0.11 0.00 0.00 31.00 31.75 1h1q h PRO 254 CO 0.14 0.27 0.60 -1.17 -0.21 0.00 0.00 178.00 177.63 1h1q s LEU 255 N -9.91 4.16 0.00 2.35 2.96 -1.26 -5.05 118.68 111.93 1h1q s LEU 255 Ca -0.09 2.64 -0.16 0.00 -0.22 0.00 0.00 54.13 56.29 1h1q s LEU 255 Cb 0.27 -3.97 0.24 0.00 0.50 0.00 0.00 46.19 43.23 1h1q s LEU 255 CO 0.80 -0.92 0.76 -0.90 -1.32 0.00 0.00 176.35 174.77 1h1q n ASP 256 N -0.03 -2.32 -0.03 3.68 3.85 -1.26 -4.68 116.55 115.75 1h1q n ASP 256 Ca 0.05 -0.90 -0.12 0.00 -0.71 0.00 0.00 54.79 53.11 1h1q n ASP 256 Cb 0.44 -0.74 -0.07 0.00 -1.35 0.00 0.00 41.12 39.40 1h1q n ASP 256 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1h1q h GLU 257 N 0.00 0.20 0.45 0.11 4.81 -1.98 0.27 114.58 118.45 1h1q h GLU 257 Ca -0.30 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 58.86 1h1q h GLU 257 Cb 0.95 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.29 1h1q h GLU 257 CO 0.19 0.43 -0.42 -0.44 -0.73 0.00 0.00 179.01 178.05 1h1q h ASP 258 N -0.06 -1.12 -0.31 1.04 3.32 -1.98 0.26 116.42 117.57 1h1q h ASP 258 Ca 0.03 0.09 0.05 0.00 0.02 0.00 0.00 57.03 57.22 1h1q h ASP 258 Cb 0.34 0.37 -0.08 0.00 0.22 0.00 0.00 39.33 40.18 1h1q h ASP 258 CO 0.00 -0.58 -0.51 1.23 -1.72 0.00 0.00 179.24 177.67 1h1q h GLY 259 N -0.88 -0.87 -0.52 2.75 0.00 -1.91 0.56 103.07 102.21 1h1q h GLY 259 Ca -0.04 0.64 0.11 0.00 0.00 0.00 0.00 47.33 48.03 1h1q h GLY 259 CO -0.04 -0.17 -0.37 3.21 0.00 0.00 0.00 176.54 179.17 1h1q h ARG 260 N -0.44 -0.15 -0.68 4.80 3.08 0.10 -1.29 114.38 119.80 1h1q h ARG 260 Ca 0.08 0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.28 1h1q h ARG 260 Cb 0.62 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.66 1h1q h ARG 260 CO -0.53 -0.10 0.46 1.03 -1.07 0.00 0.00 179.97 179.76 1h1q h SER 261 N -0.16 0.34 0.07 7.04 0.87 0.37 -2.21 113.55 119.87 1h1q h SER 261 Ca 0.23 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.81 1h1q h SER 261 Cb 0.56 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 1h1q h SER 261 CO -0.72 0.18 -0.03 0.25 -0.53 0.00 0.00 176.83 175.98 1h1q h LEU 262 N 0.36 -0.08 -0.63 2.23 5.85 -0.38 -3.00 115.31 119.65 1h1q h LEU 262 Ca 0.33 0.00 0.07 0.00 0.84 0.00 0.00 57.88 59.12 1h1q h LEU 262 Cb 0.79 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.75 1h1q h LEU 262 CO -0.09 0.02 -0.34 -0.11 -0.34 0.00 0.00 178.44 177.58 1h1q n LEU 263 N -2.66 -0.60 -0.18 2.25 7.94 -1.05 0.21 117.00 122.92 1h1q n LEU 263 Ca -0.01 1.12 -0.02 0.00 -1.11 0.00 0.00 56.01 55.99 1h1q n LEU 263 Cb 0.04 -0.18 0.06 0.00 0.53 0.00 0.00 43.42 43.87 1h1q n LEU 263 CO 0.03 -0.94 0.79 0.77 -1.11 0.00 0.00 177.39 176.92 1h1q h SER 264 N 0.00 -0.41 0.05 1.96 4.64 -1.54 1.05 113.55 119.30 1h1q h SER 264 Ca 0.14 0.15 -0.16 0.00 -0.47 0.00 0.00 61.79 61.45 1h1q h SER 264 Cb 0.29 0.30 -0.01 0.00 -0.31 0.00 0.00 62.40 62.68 1h1q h SER 264 CO -0.60 -0.15 -0.55 1.56 -0.87 0.00 0.00 176.83 176.22 1h1q h GLN 265 N 0.04 0.53 -0.97 4.77 4.20 0.26 -1.73 115.11 122.21 1h1q h GLN 265 Ca 0.27 -0.33 0.10 0.00 0.06 0.00 0.00 58.65 58.75 1h1q h GLN 265 Cb 0.41 0.04 -0.08 0.00 0.30 0.00 0.00 27.48 28.16 1h1q h GLN 265 CO -0.52 0.94 0.62 0.52 -0.67 0.00 0.00 178.83 179.71 1h1q h MET 266 N 0.40 0.96 -0.00 1.46 2.86 0.29 -2.46 114.93 118.44 1h1q h MET 266 Ca 0.01 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1h1q h MET 266 Cb 1.08 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.53 1h1q h MET 266 CO 0.10 0.63 -0.18 1.28 1.06 0.00 0.00 176.91 179.81 1h1q n LEU 267 N -4.57 0.64 -3.58 1.22 4.77 0.34 -4.35 117.00 111.48 1h1q n LEU 267 Ca 0.17 -0.06 -0.51 0.00 -0.03 0.00 0.00 56.01 55.58 1h1q n LEU 267 Cb 0.32 -0.18 -0.08 0.00 -2.33 0.00 0.00 43.42 41.15 1h1q n LEU 267 CO 0.29 0.12 0.99 1.57 -1.33 0.00 0.00 177.39 179.03 1h1q n HIS 268 N -0.90 1.25 -0.22 -1.77 -0.00 -0.84 -4.85 115.22 107.90 1h1q n HIS 268 Ca 0.13 0.82 0.00 0.00 0.46 0.00 0.00 57.72 59.13 1h1q n HIS 268 Cb 0.31 -1.73 0.08 0.00 -0.12 0.00 0.00 29.99 28.52 1h1q n HIS 268 CO 0.00 0.00 0.00 1.88 0.46 0.00 0.00 176.34 178.68 1h1q h TYR 269 N 4.57 -0.26 -3.02 1.57 0.05 -1.92 -3.37 116.97 114.58 1h1q h TYR 269 Ca -0.28 0.06 -0.57 0.00 0.05 0.00 0.00 58.73 57.98 1h1q h TYR 269 Cb 1.07 0.22 -0.05 0.00 1.01 0.00 0.00 36.73 38.98 1h1q h TYR 269 CO 0.56 -0.25 0.82 0.34 -1.05 0.00 0.00 178.16 178.58 1h1q s ASP 270 N -5.23 7.04 0.19 3.88 2.15 -1.26 -4.78 116.67 118.66 1h1q s ASP 270 Ca -0.14 1.55 -0.24 0.00 0.43 0.00 0.00 52.55 54.14 1h1q s ASP 270 Cb 0.20 -2.54 0.07 0.00 -0.30 0.00 0.00 42.92 40.34 1h1q s ASP 270 CO 0.74 -0.69 1.51 -2.65 -0.17 0.00 0.00 175.17 173.91 1h1q n PRO 271 N 6.27 -0.34 0.31 4.34 -0.02 -1.26 -0.02 135.00 144.29 1h1q n PRO 271 Ca 0.12 1.49 0.19 0.00 -2.02 0.00 0.00 63.50 63.29 1h1q n PRO 271 Cb 0.46 -2.20 1.06 0.00 -0.02 0.00 0.00 33.50 32.80 1h1q n PRO 271 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1h1q h ASN 272 N 0.00 0.00 0.00 2.55 2.35 -1.93 -2.62 115.58 115.94 1h1q h ASN 272 Ca 0.24 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.89 1h1q h ASN 272 Cb 0.49 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.84 1h1q h ASN 272 CO -0.94 0.00 -0.89 0.29 -1.65 0.00 0.00 177.43 174.24 1h1q n LYS 273 N -3.35 0.50 -0.34 0.81 4.76 0.98 -4.90 118.16 116.61 1h1q n LYS 273 Ca -0.02 0.53 -0.15 0.00 -2.87 0.00 0.00 58.31 55.79 1h1q n LYS 273 Cb 0.13 -1.70 -0.03 0.00 -1.84 0.00 0.00 35.03 31.59 1h1q n LYS 273 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1h1q n ARG 274 N -4.53 0.00 -1.59 1.97 0.63 0.91 -4.57 116.66 109.49 1h1q n ARG 274 Ca -0.19 0.00 -0.54 0.00 -0.92 0.00 0.00 57.85 56.21 1h1q n ARG 274 Cb 0.46 -0.40 -0.06 0.00 0.45 0.00 0.00 32.46 32.90 1h1q n ARG 274 CO 0.00 0.00 0.00 1.51 -2.51 0.00 0.00 177.63 176.63 1h1q n ILE 275 N 1.78 0.03 -0.87 5.15 3.06 -1.17 -4.92 119.36 122.42 1h1q n ILE 275 Ca 0.15 -0.00 -0.33 0.00 -2.50 0.00 0.00 62.75 60.06 1h1q n ILE 275 Cb -0.01 -0.72 0.11 0.00 0.54 0.00 0.00 39.64 39.56 1h1q n ILE 275 CO 0.00 0.00 0.00 -0.24 -2.50 0.00 0.00 176.55 173.81 1h1q n SER 276 N 2.63 -2.04 -0.07 9.51 2.88 -1.26 -4.74 113.62 120.53 1h1q n SER 276 Ca 0.20 0.36 -0.13 0.00 -1.33 0.00 0.00 58.87 57.97 1h1q n SER 276 Cb 0.16 -1.20 -0.06 0.00 -0.75 0.00 0.00 64.21 62.37 1h1q n SER 276 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h1q h ALA 277 N -1.38 0.31 -0.11 -1.46 0.00 -1.93 -0.80 119.26 113.88 1h1q h ALA 277 Ca -0.44 -0.34 0.05 0.00 0.00 0.00 0.00 54.91 54.17 1h1q h ALA 277 Cb 1.29 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 1h1q h ALA 277 CO 0.35 0.22 -0.30 -0.22 0.00 0.00 0.00 179.25 179.31 1h1q h LYS 278 N 0.18 -0.36 -0.03 0.00 3.64 -1.90 -2.45 116.57 115.64 1h1q h LYS 278 Ca 0.04 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1h1q h LYS 278 Cb 0.72 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1h1q h LYS 278 CO 0.05 -0.24 -0.01 0.00 -2.27 0.00 0.00 179.45 176.97 1h1q h ALA 279 N 0.47 0.04 0.00 5.00 0.00 -1.92 -2.89 119.26 119.97 1h1q h ALA 279 Ca 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1h1q h ALA 279 Cb 0.52 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1h1q h ALA 279 CO -0.33 -0.23 0.00 0.00 0.00 0.00 0.00 179.25 178.69 1h1q n ALA 280 N -2.32 0.65 0.85 0.00 0.00 -0.31 -0.88 120.51 118.51 1h1q n ALA 280 Ca -0.08 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.47 1h1q n ALA 280 Cb 0.23 -0.43 0.09 0.00 0.00 0.00 0.00 19.45 19.34 1h1q n ALA 280 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1h1q n LEU 281 N -0.71 2.80 -2.10 0.00 4.32 -1.09 -4.07 117.00 116.14 1h1q n LEU 281 Ca 0.00 -1.03 -0.24 0.00 -0.02 0.00 0.00 56.01 54.73 1h1q n LEU 281 Cb 0.00 -0.01 0.16 0.00 -1.62 0.00 0.00 43.42 41.94 1h1q n LEU 281 CO 0.00 0.48 1.21 0.00 -1.22 0.00 0.00 177.39 177.87 1h1q n ALA 282 N 1.20 5.58 -2.80 -1.18 0.00 -0.06 -4.83 120.51 118.42 1h1q n ALA 282 Ca 0.13 -3.09 -0.36 0.00 0.00 0.00 0.00 53.44 50.12 1h1q n ALA 282 Cb 0.53 -1.39 -0.07 0.00 0.00 0.00 0.00 19.45 18.52 1h1q n ALA 282 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1h1q s HIS 283 N -3.42 3.42 0.29 0.00 5.04 -1.26 -4.96 115.29 114.41 1h1q s HIS 283 Ca 0.57 0.38 0.15 0.00 -1.54 0.00 0.00 55.06 54.62 1h1q s HIS 283 Cb 0.47 -1.87 1.02 0.00 0.04 0.00 0.00 32.58 32.24 1h1q s HIS 283 CO 0.07 0.63 1.28 -2.30 -2.34 0.00 0.00 174.74 172.07 1h1q n PRO 284 N 1.94 -0.05 -0.33 2.88 -0.01 -1.26 0.16 135.00 138.33 1h1q n PRO 284 Ca -0.19 1.13 0.26 0.00 -0.01 0.00 0.00 63.50 64.70 1h1q n PRO 284 Cb 0.54 -2.00 0.50 0.00 -0.01 0.00 0.00 33.50 32.53 1h1q n PRO 284 CO 0.00 0.00 0.00 0.35 -0.01 0.00 0.00 175.50 175.84 1h1q h PHE 285 N 0.00 0.83 0.00 6.00 3.57 -1.93 0.73 116.94 126.14 1h1q h PHE 285 Ca 0.66 0.04 0.00 0.00 3.53 0.00 0.00 57.97 62.20 1h1q h PHE 285 Cb 1.69 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 40.23 1h1q h PHE 285 CO -0.07 -0.30 0.00 1.19 -2.23 0.00 0.00 178.31 176.90 1h1q n PHE 286 N -5.15 0.40 -0.30 0.41 3.72 0.43 -4.32 117.46 112.65 1h1q n PHE 286 Ca 0.33 0.12 -0.02 0.00 -0.05 0.00 0.00 57.45 57.83 1h1q n PHE 286 Cb 1.07 -0.70 0.02 0.00 -0.94 0.00 0.00 39.48 38.93 1h1q n PHE 286 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1h1q n GLN 287 N -1.83 -0.20 -1.21 -1.08 10.64 0.25 -0.47 117.38 123.49 1h1q n GLN 287 Ca 0.06 1.18 -0.23 0.00 -1.83 0.00 0.00 57.00 56.18 1h1q n GLN 287 Cb 0.35 -1.74 0.18 0.00 -0.86 0.00 0.00 30.24 28.17 1h1q n GLN 287 CO 0.00 0.00 0.00 -0.40 -1.83 0.00 0.00 177.06 174.83 1h1q n ASP 288 N -5.10 3.71 -4.69 2.61 5.75 -1.26 -4.99 116.55 112.58 1h1q n ASP 288 Ca 0.07 -3.61 -0.42 0.00 -0.01 0.00 0.00 54.79 50.82 1h1q n ASP 288 Cb 0.29 -0.83 -0.03 0.00 -1.03 0.00 0.00 41.12 39.53 1h1q n ASP 288 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1h1q s VAL 289 N -3.29 2.94 0.00 2.12 0.11 0.38 -5.00 120.40 117.67 1h1q s VAL 289 Ca 0.56 0.46 0.00 0.00 -2.93 0.00 0.00 61.98 60.07 1h1q s VAL 289 Cb 0.48 -3.29 0.00 0.00 -1.53 0.00 0.00 36.38 32.03 1h1q s VAL 289 CO 0.11 0.00 0.00 0.35 -3.33 0.00 0.00 175.10 172.23 1h1q n THR 290 N 4.61 0.00 -3.53 5.04 -2.24 -1.26 -5.07 114.28 111.83 1h1q n THR 290 Ca 0.16 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.66 1h1q n THR 290 Cb 0.40 -0.01 -0.10 0.00 -2.10 0.00 0.00 70.33 68.52 1h1q n THR 290 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1h1q n LYS 291 N -0.00 0.74 -1.65 -0.78 4.81 -1.26 -4.64 118.16 115.39 1h1q n LYS 291 Ca 0.00 -3.59 -0.32 0.00 -0.87 0.00 0.00 58.31 53.53 1h1q n LYS 291 Cb 0.00 -1.84 0.05 0.00 0.02 0.00 0.00 35.03 33.26 1h1q n LYS 291 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1h1q s PRO 292 N -0.51 2.84 -0.31 1.64 0.05 -1.26 -4.91 135.00 132.54 1h1q s PRO 292 Ca 0.31 1.15 -0.11 0.00 0.05 0.00 0.00 61.00 62.41 1h1q s PRO 292 Cb 0.02 -1.97 -0.02 0.00 0.05 0.00 0.00 34.50 32.59 1h1q s PRO 292 CO -0.18 -1.19 0.18 0.08 0.05 0.00 0.00 177.00 175.93 1h1q s VAL 293 N -2.72 4.89 1.09 -0.36 1.01 -1.26 -4.36 120.40 118.68 1h1q s VAL 293 Ca 0.62 -0.26 -0.16 0.00 0.00 0.00 0.00 61.98 62.18 1h1q s VAL 293 Cb -0.17 -3.46 0.12 0.00 0.00 0.00 0.00 36.38 32.88 1h1q s VAL 293 CO 0.48 0.09 0.30 -0.81 0.00 0.00 0.00 175.10 175.16 1h1q n PRO 294 N 5.03 -1.43 -2.96 2.72 -0.04 -1.26 -4.96 135.00 132.09 1h1q n PRO 294 Ca -0.14 -0.39 -0.40 0.00 -0.04 0.00 0.00 63.50 62.53 1h1q n PRO 294 Cb 0.50 -1.84 -0.05 0.00 -0.04 0.00 0.00 33.50 32.07 1h1q n PRO 294 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1h1q s HIS 295 N -2.31 3.74 0.00 0.54 5.65 -1.26 -4.99 115.29 116.66 1h1q s HIS 295 Ca 0.59 1.50 0.00 0.00 0.25 0.00 0.00 55.06 57.39 1h1q s HIS 295 Cb -0.16 -2.84 0.00 0.00 -1.18 0.00 0.00 32.58 28.40 1h1q s HIS 295 CO 0.66 0.27 0.00 1.28 -0.65 0.00 0.00 174.74 176.30