#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q3g n ASP 2 N 0.00 0.43 -4.03 6.12 9.92 -1.26 -0.96 116.55 126.77 1q3g n ASP 2 Ca 0.00 0.74 -0.10 0.00 -0.53 0.00 0.00 54.79 54.91 1q3g n ASP 2 Cb 0.00 -1.37 -0.08 0.00 -0.64 0.00 0.00 41.12 39.03 1q3g n ASP 2 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1q3g s LYS 3 N -2.89 1.09 -0.13 -1.24 1.02 -1.01 -2.96 119.74 113.62 1q3g s LYS 3 Ca 0.75 -1.28 0.00 0.00 0.02 0.00 0.00 55.97 55.46 1q3g s LYS 3 Cb -0.39 0.33 -0.01 0.00 -0.52 0.00 0.00 37.83 37.24 1q3g s LYS 3 CO 0.48 -0.37 -0.14 -0.06 -0.92 0.00 0.00 175.35 174.34 1q3g s PHE 4 N -4.00 2.79 -0.34 3.18 2.99 -0.69 -2.50 117.98 119.41 1q3g s PHE 4 Ca 0.20 -0.72 -0.08 0.00 0.00 0.00 0.00 56.93 56.33 1q3g s PHE 4 Cb 0.05 -1.84 0.03 0.00 0.00 0.00 0.00 43.02 41.26 1q3g s PHE 4 CO 0.01 -0.26 0.14 0.50 -0.00 0.00 0.00 175.22 175.62 1q3g s ARG 5 N 0.40 2.84 -0.08 0.44 3.52 0.23 -1.06 118.95 125.23 1q3g s ARG 5 Ca -0.11 -1.04 0.02 0.00 -0.13 0.00 0.00 55.73 54.46 1q3g s ARG 5 Cb -0.16 -3.55 -0.02 0.00 -1.56 0.00 0.00 34.95 29.66 1q3g s ARG 5 CO 0.05 -0.62 -0.13 0.08 -0.81 0.00 0.00 175.30 173.87 1q3g s VAL 6 N 1.49 3.09 -0.22 7.11 1.01 0.77 -1.51 120.40 132.15 1q3g s VAL 6 Ca 0.01 -0.69 -0.03 0.00 0.00 0.00 0.00 61.98 61.27 1q3g s VAL 6 Cb -0.19 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 1q3g s VAL 6 CO 0.04 0.56 -0.05 -1.10 0.00 0.00 0.00 175.10 174.55 1q3g s GLN 7 N -0.29 3.35 0.40 2.72 -1.52 0.12 0.06 119.66 124.50 1q3g s GLN 7 Ca 0.02 -0.64 0.05 0.00 -1.95 0.00 0.00 55.36 52.84 1q3g s GLN 7 Cb -0.13 -2.98 -0.02 0.00 -0.22 0.00 0.00 33.01 29.66 1q3g s GLN 7 CO 0.03 -0.19 0.17 0.20 -0.25 0.00 0.00 175.29 175.25 1q3g s GLY 8 N 1.45 2.61 0.36 3.09 0.00 0.11 -4.19 107.32 110.75 1q3g s GLY 8 Ca 0.06 -1.37 -0.17 0.00 0.00 0.00 0.00 44.72 43.24 1q3g s GLY 8 CO -0.04 -1.75 0.80 2.56 0.00 0.00 0.00 173.10 174.68 1q3g s PRO 9 N -3.62 4.07 -0.07 2.90 0.04 -0.73 -1.51 135.00 136.09 1q3g s PRO 9 Ca 0.27 0.81 -0.03 0.00 0.04 0.00 0.00 61.00 62.09 1q3g s PRO 9 Cb 0.02 -2.35 0.04 0.00 0.04 0.00 0.00 34.50 32.25 1q3g s PRO 9 CO 0.18 0.09 0.14 0.95 0.04 0.00 0.00 177.00 178.40 1q3g s THR 10 N -2.06 -0.10 0.09 1.26 -4.23 0.13 -4.99 115.64 105.75 1q3g s THR 10 Ca 0.57 0.22 -0.31 0.00 -1.18 0.00 0.00 61.69 60.99 1q3g s THR 10 Cb -0.10 -0.24 -0.07 0.00 1.34 0.00 0.00 72.50 73.43 1q3g s THR 10 CO 0.16 0.09 1.29 -0.60 -0.54 0.00 0.00 174.62 175.02 1q3g s ARG 11 N 1.42 4.38 -0.25 3.99 3.52 -1.26 -4.59 118.95 126.16 1q3g s ARG 11 Ca -0.06 1.92 -0.14 0.00 -0.13 0.00 0.00 55.73 57.31 1q3g s ARG 11 Cb -0.12 -3.30 -0.04 0.00 -1.56 0.00 0.00 34.95 29.93 1q3g s ARG 11 CO -0.06 -0.34 0.34 -0.51 -0.81 0.00 0.00 175.30 173.92 1q3g s LEU 12 N 1.08 4.08 0.17 -0.88 1.43 -1.26 -4.63 118.68 118.66 1q3g s LEU 12 Ca 0.61 0.30 -0.22 0.00 -1.03 0.00 0.00 54.13 53.80 1q3g s LEU 12 Cb -0.33 -2.38 0.06 0.00 0.03 0.00 0.00 46.19 43.57 1q3g s LEU 12 CO 0.30 -0.11 0.58 0.00 0.23 0.00 0.00 176.35 177.35 1q3g s GLN 13 N 1.71 1.30 0.00 1.70 -2.07 -0.46 -3.80 119.66 118.04 1q3g s GLN 13 Ca 0.14 -0.55 0.00 0.00 -1.82 0.00 0.00 55.36 53.13 1q3g s GLN 13 Cb -0.15 0.58 0.00 0.00 -1.09 0.00 0.00 33.01 32.34 1q3g s GLN 13 CO 0.09 -0.56 0.00 0.41 -1.32 0.00 0.00 175.29 173.90 1q3g n GLY 14 N -0.37 0.24 3.15 2.60 0.00 -0.53 -4.41 105.19 105.88 1q3g n GLY 14 Ca -0.16 -1.47 -0.11 0.00 0.00 0.00 0.00 46.02 44.29 1q3g n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q3g s GLU 15 N -0.37 0.78 -0.09 1.61 2.02 -1.26 -1.55 118.70 119.84 1q3g s GLU 15 Ca 0.00 -1.25 -0.17 0.00 0.02 0.00 0.00 54.97 53.57 1q3g s GLU 15 Cb 0.00 -0.20 0.04 0.00 0.10 0.00 0.00 34.13 34.07 1q3g s GLU 15 CO 0.00 -0.01 0.42 0.54 0.02 0.00 0.00 175.26 176.23 1q3g s VAL 16 N -3.33 0.02 -0.25 2.63 0.11 -0.88 -4.81 120.40 113.88 1q3g s VAL 16 Ca 0.09 -0.18 -0.07 0.00 -2.93 0.00 0.00 61.98 58.89 1q3g s VAL 16 Cb 0.03 -0.66 -0.02 0.00 -1.53 0.00 0.00 36.38 34.20 1q3g s VAL 16 CO -0.04 -0.10 0.05 -0.89 -3.33 0.00 0.00 175.10 170.79 1q3g s THR 17 N -0.54 4.09 0.23 5.04 2.01 -1.26 -0.41 115.64 124.79 1q3g s THR 17 Ca -0.07 -0.30 -0.30 0.00 0.31 0.00 0.00 61.69 61.34 1q3g s THR 17 Cb -0.03 -2.93 -0.09 0.00 0.01 0.00 0.00 72.50 69.46 1q3g s THR 17 CO 0.03 0.32 1.31 -0.63 -0.69 0.00 0.00 174.62 174.96 1q3g s ILE 18 N 1.58 3.10 0.76 1.82 -1.09 -0.17 -4.94 121.20 122.26 1q3g s ILE 18 Ca 0.06 0.94 -0.07 0.00 -2.23 0.00 0.00 60.65 59.35 1q3g s ILE 18 Cb -0.15 -3.60 0.11 0.00 -1.58 0.00 0.00 42.46 37.24 1q3g s ILE 18 CO 0.02 0.16 1.07 -0.44 -1.23 0.00 0.00 174.94 174.52 1q3g s SER 19 N 0.14 4.30 0.64 3.58 0.01 -1.26 -4.82 113.70 116.29 1q3g s SER 19 Ca 0.55 0.14 -0.18 0.00 1.31 0.00 0.00 55.95 57.77 1q3g s SER 19 Cb -0.37 -0.58 -0.01 0.00 0.21 0.00 0.00 66.02 65.26 1q3g s SER 19 CO 0.41 -1.92 1.25 -0.83 0.41 0.00 0.00 173.24 172.56 1q3g s GLY 20 N -4.66 2.74 -0.01 3.44 0.00 -1.20 -1.67 107.32 105.96 1q3g s GLY 20 Ca 0.65 1.08 -0.30 0.00 0.00 0.00 0.00 44.72 46.15 1q3g s GLY 20 CO 0.46 1.49 1.65 0.00 0.00 0.00 0.00 173.10 176.70 1q3g s ALA 21 N -1.56 3.63 0.18 3.20 0.00 0.38 -4.34 121.76 123.25 1q3g s ALA 21 Ca 0.79 1.04 -0.13 0.00 0.00 0.00 0.00 51.96 53.66 1q3g s ALA 21 Cb -0.33 -3.72 0.14 0.00 0.00 0.00 0.00 23.12 19.21 1q3g s ALA 21 CO 0.38 -1.28 1.80 -0.22 0.00 0.00 0.00 175.76 176.44 1q3g h LYS 22 N 9.09 0.55 -0.39 0.00 3.64 -1.90 -0.77 116.57 126.79 1q3g h LYS 22 Ca -0.41 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 1q3g h LYS 22 Cb 1.19 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1q3g h LYS 22 CO 0.94 0.36 0.00 0.09 -2.27 0.00 0.00 179.45 178.57 1q3g n ASN 23 N -4.84 0.65 -0.01 4.20 3.02 -1.26 -1.95 115.26 115.07 1q3g n ASN 23 Ca 0.05 -2.02 -0.01 0.00 -0.03 0.00 0.00 54.58 52.56 1q3g n ASN 23 Cb 0.12 -0.21 -0.01 0.00 -0.61 0.00 0.00 39.78 39.08 1q3g n ASN 23 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1q3g n ALA 24 N -0.21 2.06 -0.16 5.41 0.00 -0.91 -4.53 120.51 122.18 1q3g n ALA 24 Ca 0.02 -0.07 -0.08 0.00 0.00 0.00 0.00 53.44 53.30 1q3g n ALA 24 Cb 0.14 0.46 0.01 0.00 0.00 0.00 0.00 19.45 20.06 1q3g n ALA 24 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1q3g h ALA 25 N -0.01 0.59 0.36 0.00 0.00 -1.07 -1.86 119.26 117.27 1q3g h ALA 25 Ca -0.04 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1q3g h ALA 25 Cb 1.06 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1q3g h ALA 25 CO -0.01 0.12 -0.19 -0.07 0.00 0.00 0.00 179.25 179.10 1q3g h LEU 26 N 0.60 -0.47 -1.35 0.00 3.38 -1.64 0.65 115.31 116.48 1q3g h LEU 26 Ca 0.16 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 1q3g h LEU 26 Cb 0.07 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1q3g h LEU 26 CO -0.02 -0.32 -0.31 1.55 0.09 0.00 0.00 178.44 179.43 1q3g h PRO 27 N -0.51 0.03 -0.25 1.13 0.13 -1.79 -2.51 132.00 128.23 1q3g h PRO 27 Ca -0.04 -0.01 -0.19 0.00 -0.87 0.00 0.00 66.00 64.88 1q3g h PRO 27 Cb 0.41 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.54 1q3g h PRO 27 CO 0.06 0.33 -0.60 0.82 -0.23 0.00 0.00 178.00 178.38 1q3g h ILE 28 N 0.03 1.28 -0.86 -3.56 2.04 -1.16 -0.57 117.51 114.71 1q3g h ILE 28 Ca 0.00 -1.79 -0.01 0.00 1.00 0.00 0.00 64.86 64.06 1q3g h ILE 28 Cb 0.56 1.72 -0.04 0.00 -0.74 0.00 0.00 36.82 38.31 1q3g h ILE 28 CO 0.04 0.58 0.50 -0.07 0.00 0.00 0.00 178.15 179.20 1q3g h LEU 29 N 0.63 1.05 -0.49 1.44 3.38 -0.63 -1.15 115.31 119.54 1q3g h LEU 29 Ca -0.00 -0.08 -0.17 0.00 0.09 0.00 0.00 57.88 57.72 1q3g h LEU 29 Cb 1.21 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1q3g h LEU 29 CO 0.13 0.82 -0.68 -0.26 0.09 0.00 0.00 178.44 178.54 1q3g h PHE 30 N 1.19 0.46 0.00 1.13 -1.00 -1.39 -2.76 116.94 114.58 1q3g h PHE 30 Ca 0.31 -0.19 -0.01 0.00 2.81 0.00 0.00 57.97 60.88 1q3g h PHE 30 Cb -0.02 -0.07 -0.00 0.00 3.61 0.00 0.00 35.95 39.46 1q3g h PHE 30 CO 0.00 0.92 -0.07 0.00 -1.61 0.00 0.00 178.31 177.55 1q3g h ALA 31 N 1.03 1.61 0.00 2.45 0.00 -0.48 -1.31 119.26 122.56 1q3g h ALA 31 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1q3g h ALA 31 Cb 1.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1q3g h ALA 31 CO 0.11 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.45 1q3g h ALA 32 N 1.93 1.00 0.00 0.00 0.00 -0.92 -0.80 119.26 120.47 1q3g h ALA 32 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1q3g h ALA 32 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1q3g h ALA 32 CO 0.01 0.00 0.00 -0.07 0.00 0.00 0.00 179.25 179.19 1q3g h LEU 33 N 0.00 0.00 0.00 0.00 3.38 -1.37 -0.49 115.31 116.83 1q3g h LEU 33 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1q3g h LEU 33 Cb 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1q3g h LEU 33 CO 0.00 0.00 -0.47 -0.07 0.09 0.00 0.00 178.44 177.99 1q3g h LEU 34 N 0.00 0.00 -9.50 1.67 3.38 -1.34 -3.47 115.31 106.04 1q3g h LEU 34 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 1q3g h LEU 34 Cb 0.07 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.83 1q3g h LEU 34 CO 0.00 0.23 0.63 0.00 0.09 0.00 0.00 178.44 179.39 1q3g s ALA 35 N -3.12 3.47 -0.35 1.53 0.00 -0.19 -4.26 121.76 118.84 1q3g s ALA 35 Ca 0.04 0.95 0.23 0.00 0.00 0.00 0.00 51.96 53.18 1q3g s ALA 35 Cb 0.07 -3.48 0.02 0.00 0.00 0.00 0.00 23.12 19.72 1q3g s ALA 35 CO 0.73 -0.51 1.01 0.39 0.00 0.00 0.00 175.76 177.37 1q3g n GLU 36 N 3.96 0.49 -4.22 0.00 1.02 -0.42 -4.33 120.64 117.14 1q3g n GLU 36 Ca 0.10 0.05 -0.28 0.00 -0.02 0.00 0.00 57.16 57.01 1q3g n GLU 36 Cb 0.45 -1.71 -0.09 0.00 -0.02 0.00 0.00 31.44 30.07 1q3g n GLU 36 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1q3g s GLU 37 N -3.32 2.27 0.33 3.49 0.41 -0.97 -4.50 118.70 116.41 1q3g s GLU 37 Ca 0.00 -1.10 -0.26 0.00 -0.41 0.00 0.00 54.97 53.20 1q3g s GLU 37 Cb 0.12 -2.31 -0.13 0.00 -1.78 0.00 0.00 34.13 30.02 1q3g s GLU 37 CO 0.80 0.47 0.92 -2.30 -0.49 0.00 0.00 175.26 174.66 1q3g n PRO 38 N 0.18 1.17 -4.61 0.39 -0.02 -1.26 -4.22 135.00 126.63 1q3g n PRO 38 Ca -0.11 0.41 -0.25 0.00 -2.02 0.00 0.00 63.50 61.53 1q3g n PRO 38 Cb 0.54 -1.80 -0.14 0.00 -0.02 0.00 0.00 33.50 32.09 1q3g n PRO 38 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1q3g s VAL 39 N -1.17 1.62 -0.18 -1.45 1.01 0.53 -2.86 120.40 117.91 1q3g s VAL 39 Ca 0.61 -1.19 0.00 0.00 0.00 0.00 0.00 61.98 61.39 1q3g s VAL 39 Cb -0.66 -1.42 0.04 0.00 0.00 0.00 0.00 36.38 34.34 1q3g s VAL 39 CO 0.59 0.18 -0.09 -0.70 0.00 0.00 0.00 175.10 175.07 1q3g s GLU 40 N -1.20 1.89 -0.32 2.72 2.12 -0.36 0.77 118.70 124.32 1q3g s GLU 40 Ca 0.07 -0.67 -0.09 0.00 0.36 0.00 0.00 54.97 54.64 1q3g s GLU 40 Cb -0.09 -2.20 0.01 0.00 0.26 0.00 0.00 34.13 32.11 1q3g s GLU 40 CO 0.02 -0.38 0.14 0.42 -0.54 0.00 0.00 175.26 174.91 1q3g s ILE 41 N 1.49 4.33 0.42 -3.70 1.01 -0.24 -1.39 121.20 123.14 1q3g s ILE 41 Ca 0.01 -0.68 -0.03 0.00 0.00 0.00 0.00 60.65 59.95 1q3g s ILE 41 Cb -0.15 -3.29 -0.03 0.00 0.01 0.00 0.00 42.46 38.99 1q3g s ILE 41 CO -0.09 -0.03 0.68 -1.10 0.00 0.00 0.00 174.94 174.41 1q3g s GLN 42 N 1.55 3.52 -1.44 2.79 -0.21 0.11 -0.81 119.66 125.17 1q3g s GLN 42 Ca 0.03 -0.03 -0.08 0.00 0.02 0.00 0.00 55.36 55.30 1q3g s GLN 42 Cb -0.18 -2.50 0.01 0.00 1.00 0.00 0.00 33.01 31.35 1q3g s GLN 42 CO 0.05 -0.05 0.97 -1.71 -2.12 0.00 0.00 175.29 172.42 1q3g n ASN 43 N -2.05 -6.20 -4.65 5.90 5.15 -1.06 -1.34 115.26 111.02 1q3g n ASN 43 Ca -0.02 -0.46 -0.41 0.00 -0.60 0.00 0.00 54.58 53.09 1q3g n ASN 43 Cb 0.56 -4.92 -0.05 0.00 -0.53 0.00 0.00 39.78 34.84 1q3g n ASN 43 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1q3g s VAL 44 N -3.27 4.89 0.68 3.44 1.01 -0.45 -3.24 120.40 123.47 1q3g s VAL 44 Ca 0.49 1.47 -0.16 0.00 0.00 0.00 0.00 61.98 63.79 1q3g s VAL 44 Cb -0.22 -4.07 0.01 0.00 0.00 0.00 0.00 36.38 32.10 1q3g s VAL 44 CO 0.61 -0.01 1.17 -2.16 0.00 0.00 0.00 175.10 174.70 1q3g s PRO 45 N 2.51 2.51 -0.86 2.72 0.04 -1.26 -4.77 135.00 135.89 1q3g s PRO 45 Ca 0.34 1.62 -0.17 0.00 0.04 0.00 0.00 61.00 62.82 1q3g s PRO 45 Cb -0.16 -1.89 0.15 0.00 0.04 0.00 0.00 34.50 32.64 1q3g s PRO 45 CO 0.09 -1.52 0.97 0.15 0.04 0.00 0.00 177.00 176.73 1q3g s LYS 46 N -3.89 3.54 0.22 4.56 1.02 -1.26 -4.87 119.74 119.05 1q3g s LYS 46 Ca 0.72 -1.91 0.09 0.00 0.02 0.00 0.00 55.97 54.89 1q3g s LYS 46 Cb -0.26 -4.69 -0.05 0.00 -0.52 0.00 0.00 37.83 32.32 1q3g s LYS 46 CO 0.42 -1.61 -0.17 -0.51 -0.92 0.00 0.00 175.35 172.57 1q3g s LEU 47 N 1.95 2.55 0.28 3.17 1.43 -1.26 -4.57 118.68 122.23 1q3g s LEU 47 Ca 0.26 -1.00 -0.01 0.00 -1.03 0.00 0.00 54.13 52.34 1q3g s LEU 47 Cb -0.09 -0.81 0.46 0.00 0.03 0.00 0.00 46.19 45.78 1q3g s LEU 47 CO -0.07 -0.09 1.90 0.50 0.23 0.00 0.00 176.35 178.82 1q3g h LYS 48 N 2.56 1.09 0.00 1.70 3.11 -1.56 -1.46 116.57 122.01 1q3g h LYS 48 Ca -0.39 -0.07 -0.07 0.00 -2.81 0.00 0.00 60.65 57.32 1q3g h LYS 48 Cb 1.23 -0.25 -0.01 0.00 -1.00 0.00 0.00 32.23 32.20 1q3g h LYS 48 CO 0.60 0.72 -0.32 -0.44 -2.81 0.00 0.00 179.45 177.20 1q3g h ASP 49 N 1.12 0.00 -0.00 4.20 3.32 -1.84 -1.55 116.42 121.68 1q3g h ASP 49 Ca 0.40 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.31 1q3g h ASP 49 Cb 0.15 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1q3g h ASP 49 CO -0.15 0.32 -0.47 0.40 -1.72 0.00 0.00 179.24 177.62 1q3g h ILE 50 N 0.00 1.31 -0.12 0.35 1.08 -1.60 -0.51 117.51 118.02 1q3g h ILE 50 Ca -0.00 -1.67 -0.01 0.00 -0.39 0.00 0.00 64.86 62.78 1q3g h ILE 50 Cb 0.58 1.65 -0.00 0.00 -3.07 0.00 0.00 36.82 35.97 1q3g h ILE 50 CO 0.04 0.52 0.02 0.44 -0.69 0.00 0.00 178.15 178.49 1q3g h ASP 51 N 0.44 0.19 -0.97 1.72 3.32 -1.02 -0.69 116.42 119.42 1q3g h ASP 51 Ca 0.03 -0.25 0.01 0.00 0.02 0.00 0.00 57.03 56.83 1q3g h ASP 51 Cb 0.99 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.44 1q3g h ASP 51 CO 0.09 0.39 0.64 0.74 -1.72 0.00 0.00 179.24 179.38 1q3g h THR 52 N -0.02 1.25 -0.42 0.35 2.02 -1.22 0.60 112.91 115.47 1q3g h THR 52 Ca 0.04 -0.46 -0.03 0.00 0.77 0.00 0.00 66.41 66.73 1q3g h THR 52 Cb 0.28 -0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 66.49 1q3g h THR 52 CO 0.00 0.24 0.16 0.74 0.37 0.00 0.00 175.52 177.03 1q3g h THR 53 N 1.32 1.20 -0.65 3.16 2.02 -0.89 -0.66 112.91 118.41 1q3g h THR 53 Ca 0.36 -0.63 -0.03 0.00 0.77 0.00 0.00 66.41 66.88 1q3g h THR 53 Cb -0.15 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 1q3g h THR 53 CO -0.08 0.23 0.28 0.24 0.37 0.00 0.00 175.52 176.56 1q3g h MET 54 N 0.53 0.94 -0.40 6.66 2.07 -0.50 0.98 114.93 125.21 1q3g h MET 54 Ca 0.14 -0.14 -0.01 0.00 -2.07 0.00 0.00 59.70 57.62 1q3g h MET 54 Cb 0.20 -0.17 -0.02 0.00 -1.87 0.00 0.00 31.60 29.74 1q3g h MET 54 CO -0.01 0.75 0.22 0.87 1.07 0.00 0.00 176.91 179.81 1q3g h LYS 55 N 0.93 0.55 -0.05 1.72 1.57 -0.46 -0.33 116.57 120.51 1q3g h LYS 55 Ca 0.22 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 1q3g h LYS 55 Cb 0.15 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 1q3g h LYS 55 CO -0.02 0.44 0.00 1.25 -0.57 0.00 0.00 179.45 180.55 1q3g h LEU 56 N 0.52 0.08 -0.45 2.94 6.46 -0.60 -1.40 115.31 122.85 1q3g h LEU 56 Ca 0.14 -0.28 0.05 0.00 -0.12 0.00 0.00 57.88 57.67 1q3g h LEU 56 Cb 0.05 -0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 39.91 1q3g h LEU 56 CO -0.02 0.34 0.18 -0.07 -0.62 0.00 0.00 178.44 178.24 1q3g h LEU 57 N -0.19 0.21 -0.79 2.25 3.38 -0.68 -1.79 115.31 117.70 1q3g h LEU 57 Ca 0.01 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.06 1q3g h LEU 57 Cb 0.30 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 1q3g h LEU 57 CO 0.00 0.15 0.51 0.74 0.09 0.00 0.00 178.44 179.93 1q3g h THR 58 N 0.36 1.13 0.00 0.22 2.02 -0.99 -0.27 112.91 115.37 1q3g h THR 58 Ca 0.21 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 67.05 1q3g h THR 58 Cb 0.18 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 1q3g h THR 58 CO -0.19 0.18 0.00 -0.61 0.37 0.00 0.00 175.52 175.27 1q3g h GLN 59 N 0.99 0.00 -0.01 6.66 -0.00 -0.43 -0.02 115.11 122.30 1q3g h GLN 59 Ca 0.32 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.97 1q3g h GLN 59 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.48 1q3g h GLN 59 CO -0.11 0.00 -0.29 1.28 0.00 0.00 0.00 178.83 179.71 1q3g n LEU 60 N -2.31 1.27 0.00 -2.39 4.77 -0.17 -4.80 117.00 113.38 1q3g n LEU 60 Ca 0.00 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 1q3g n LEU 60 Cb 0.14 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1q3g n LEU 60 CO 0.16 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 1q3g n GLY 61 N 1.35 1.55 3.91 -0.72 0.00 -0.03 -1.91 105.19 109.34 1q3g n GLY 61 Ca 0.12 -0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1q3g n GLY 61 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q3g s THR 62 N -2.00 5.31 -0.37 2.61 2.01 -0.87 -3.88 115.64 118.45 1q3g s THR 62 Ca 0.00 -0.16 -0.15 0.00 0.31 0.00 0.00 61.69 61.69 1q3g s THR 62 Cb 0.00 -3.61 -0.00 0.00 0.01 0.00 0.00 72.50 68.90 1q3g s THR 62 CO 0.00 0.15 0.35 -0.54 -0.69 0.00 0.00 174.62 173.89 1q3g s LYS 63 N -2.42 3.37 0.04 4.92 1.02 -0.60 -4.17 119.74 121.89 1q3g s LYS 63 Ca 0.36 -0.61 0.05 0.00 0.02 0.00 0.00 55.97 55.79 1q3g s LYS 63 Cb -0.13 -3.87 -0.02 0.00 -0.52 0.00 0.00 37.83 33.29 1q3g s LYS 63 CO 0.25 -0.61 -0.16 0.08 -0.92 0.00 0.00 175.35 173.99 1q3g s VAL 64 N 1.95 1.24 0.12 3.17 1.01 -1.26 -1.19 120.40 125.44 1q3g s VAL 64 Ca 0.10 -1.08 -0.25 0.00 0.00 0.00 0.00 61.98 60.75 1q3g s VAL 64 Cb -0.17 -1.11 0.07 0.00 0.00 0.00 0.00 36.38 35.17 1q3g s VAL 64 CO 0.12 0.02 0.74 -1.83 0.00 0.00 0.00 175.10 174.15 1q3g s GLU 65 N -1.22 1.19 0.38 2.72 -1.05 -1.00 -5.01 118.70 114.71 1q3g s GLU 65 Ca 0.03 -0.50 -0.09 0.00 -0.15 0.00 0.00 54.97 54.26 1q3g s GLU 65 Cb -0.08 0.51 0.03 0.00 -0.44 0.00 0.00 34.13 34.15 1q3g s GLU 65 CO 0.02 -0.53 0.66 -0.98 0.95 0.00 0.00 175.26 175.38 1q3g s ARG 66 N -3.52 2.15 0.00 -4.83 1.70 -1.26 -0.21 118.95 112.98 1q3g s ARG 66 Ca 0.05 -1.64 0.00 0.00 -0.47 0.00 0.00 55.73 53.67 1q3g s ARG 66 Cb -0.02 0.55 0.00 0.00 -0.57 0.00 0.00 34.95 34.91 1q3g s ARG 66 CO -0.08 -0.96 0.00 -0.40 -1.08 0.00 0.00 175.30 172.78 1q3g n ASP 67 N -1.55 0.00 0.08 -2.89 5.68 -1.26 -5.00 116.55 111.62 1q3g n ASP 67 Ca -0.04 0.00 0.11 0.00 -0.50 0.00 0.00 54.79 54.36 1q3g n ASP 67 Cb 0.61 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.59 1q3g n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1q3g n GLY 68 N 4.61 -1.39 3.81 6.12 0.00 -1.26 -5.08 105.19 111.99 1q3g n GLY 68 Ca 0.00 -0.28 -0.22 0.00 0.00 0.00 0.00 46.02 45.52 1q3g n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1q3g s SER 69 N -5.01 4.84 -0.15 1.61 0.01 -1.26 -1.34 113.70 112.40 1q3g s SER 69 Ca -0.00 -0.81 0.00 0.00 1.31 0.00 0.00 55.95 56.45 1q3g s SER 69 Cb 0.11 -0.62 0.03 0.00 0.21 0.00 0.00 66.02 65.74 1q3g s SER 69 CO 0.79 -0.53 -0.13 -0.69 0.41 0.00 0.00 173.24 173.10 1q3g s VAL 70 N -2.48 1.53 -0.20 3.43 1.01 0.01 -4.36 120.40 119.34 1q3g s VAL 70 Ca 0.44 -0.65 -0.15 0.00 0.00 0.00 0.00 61.98 61.62 1q3g s VAL 70 Cb -0.01 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 1q3g s VAL 70 CO 0.25 0.41 0.34 0.26 0.00 0.00 0.00 175.10 176.36 1q3g s TRP 71 N 1.50 3.38 -0.04 5.22 0.51 0.70 -1.08 118.94 129.13 1q3g s TRP 71 Ca 0.04 0.54 0.07 0.00 -2.12 0.00 0.00 56.10 54.63 1q3g s TRP 71 Cb -0.13 -2.45 -0.01 0.00 -0.81 0.00 0.00 33.47 30.06 1q3g s TRP 71 CO -0.10 0.04 -0.24 0.42 -0.51 0.00 0.00 176.95 176.55 1q3g s ILE 72 N 1.15 1.98 -0.38 2.03 -1.09 0.23 -2.38 121.20 122.74 1q3g s ILE 72 Ca 0.17 -1.04 0.00 0.00 -2.23 0.00 0.00 60.65 57.55 1q3g s ILE 72 Cb -0.14 -1.66 0.13 0.00 -1.58 0.00 0.00 42.46 39.21 1q3g s ILE 72 CO 0.07 0.55 0.21 -0.62 -1.23 0.00 0.00 174.94 173.92 1q3g s ASP 73 N -0.30 3.35 -0.29 3.58 3.68 -0.33 0.20 116.67 126.55 1q3g s ASP 73 Ca 0.01 -2.25 0.01 0.00 2.13 0.00 0.00 52.55 52.46 1q3g s ASP 73 Cb -0.12 -0.67 0.35 0.00 -1.45 0.00 0.00 42.92 41.03 1q3g s ASP 73 CO 0.02 -0.31 1.66 0.00 0.13 0.00 0.00 175.17 176.67 1q3g n ALA 74 N 4.00 4.58 0.26 3.66 0.00 -1.26 -1.56 120.51 130.19 1q3g n ALA 74 Ca 0.08 -1.77 -0.16 0.00 0.00 0.00 0.00 53.44 51.60 1q3g n ALA 74 Cb 0.37 -1.31 -0.08 0.00 0.00 0.00 0.00 19.45 18.43 1q3g n ALA 74 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1q3g h SER 75 N 0.85 -0.68 -2.43 0.00 0.02 -1.79 -3.32 113.55 106.20 1q3g h SER 75 Ca 0.37 0.04 -0.70 0.00 -0.84 0.00 0.00 61.79 60.66 1q3g h SER 75 Cb 1.77 0.20 -0.35 0.00 0.14 0.00 0.00 62.40 64.15 1q3g h SER 75 CO 0.72 -0.43 0.09 -3.20 -1.14 0.00 0.00 176.83 172.87 1q3g n ASN 76 N -5.41 5.35 -4.64 3.07 4.05 -1.26 -5.01 115.26 111.41 1q3g n ASN 76 Ca -0.11 -3.54 -0.43 0.00 0.45 0.00 0.00 54.58 50.95 1q3g n ASN 76 Cb 0.31 -0.91 -0.02 0.00 1.23 0.00 0.00 39.78 40.39 1q3g n ASN 76 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1q3g s VAL 77 N -3.34 4.49 -0.50 3.44 1.01 -1.25 -4.60 120.40 119.66 1q3g s VAL 77 Ca 0.39 1.72 0.05 0.00 0.00 0.00 0.00 61.98 64.14 1q3g s VAL 77 Cb 0.16 -4.39 0.01 0.00 0.00 0.00 0.00 36.38 32.16 1q3g s VAL 77 CO -0.02 -0.46 0.51 -0.46 0.00 0.00 0.00 175.10 174.67 1q3g n ASN 78 N 6.89 1.05 -4.37 3.32 6.94 -0.93 -5.00 115.26 123.15 1q3g n ASN 78 Ca 0.12 -1.02 -0.28 0.00 -0.02 0.00 0.00 54.58 53.38 1q3g n ASN 78 Cb 0.47 0.31 -0.13 0.00 -2.36 0.00 0.00 39.78 38.07 1q3g n ASN 78 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1q3g s ASN 79 N -0.73 3.19 -0.18 0.53 2.47 -0.80 -5.03 114.94 114.38 1q3g s ASN 79 Ca 0.05 -0.72 0.20 0.00 0.42 0.00 0.00 52.86 52.80 1q3g s ASN 79 Cb 0.04 -0.22 0.47 0.00 -1.45 0.00 0.00 41.25 40.09 1q3g s ASN 79 CO 0.10 0.17 1.16 0.49 -3.72 0.00 0.00 177.10 175.30 1q3g n PHE 80 N 1.04 1.00 -4.01 0.43 3.72 -1.26 -4.75 117.46 113.63 1q3g n PHE 80 Ca -0.18 -1.60 -0.13 0.00 -0.05 0.00 0.00 57.45 55.49 1q3g n PHE 80 Cb 0.53 -0.23 -0.13 0.00 -0.94 0.00 0.00 39.48 38.71 1q3g n PHE 80 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1q3g s SER 81 N -3.18 0.38 -0.44 4.37 1.04 -1.26 -1.29 113.70 113.33 1q3g s SER 81 Ca 0.35 -0.23 -0.11 0.00 0.48 0.00 0.00 55.95 56.43 1q3g s SER 81 Cb 0.36 0.01 0.08 0.00 0.10 0.00 0.00 66.02 66.57 1q3g s SER 81 CO -0.07 -0.08 0.31 0.00 0.98 0.00 0.00 173.24 174.38 1q3g s ALA 82 N -0.58 3.39 0.51 5.32 0.00 0.49 -4.90 121.76 125.98 1q3g s ALA 82 Ca -0.04 -2.16 -0.22 0.00 0.00 0.00 0.00 51.96 49.54 1q3g s ALA 82 Cb -0.04 -2.80 -0.06 0.00 0.00 0.00 0.00 23.12 20.22 1q3g s ALA 82 CO -0.00 -1.69 1.31 -1.25 0.00 0.00 0.00 175.76 174.13 1q3g s PRO 83 N 1.50 3.38 0.13 0.00 0.04 -1.26 -1.42 135.00 137.37 1q3g s PRO 83 Ca 0.03 2.12 -0.30 0.00 0.04 0.00 0.00 61.00 62.89 1q3g s PRO 83 Cb -0.24 -2.35 -0.09 0.00 0.04 0.00 0.00 34.50 31.86 1q3g s PRO 83 CO 0.03 -0.96 1.51 -0.92 0.04 0.00 0.00 177.00 176.70 1q3g h TYR 84 N 1.73 -1.63 0.00 0.56 3.20 -1.96 0.03 116.97 118.90 1q3g h TYR 84 Ca -0.50 0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.45 1q3g h TYR 84 Cb 1.28 0.78 0.00 0.00 1.54 0.00 0.00 36.73 40.33 1q3g h TYR 84 CO 0.48 -0.43 0.00 -0.40 -1.64 0.00 0.00 178.16 176.17 1q3g n ASP 85 N -5.16 0.00 -0.11 -2.11 5.68 -1.26 -1.30 116.55 112.29 1q3g n ASP 85 Ca -0.02 -0.46 -0.22 0.00 -0.50 0.00 0.00 54.79 53.59 1q3g n ASP 85 Cb 0.30 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.20 1q3g n ASP 85 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 1q3g n LEU 86 N -0.83 1.91 0.24 -2.12 0.00 -0.08 -4.48 117.00 111.63 1q3g n LEU 86 Ca 0.05 0.18 0.16 0.00 0.00 0.00 0.00 56.01 56.40 1q3g n LEU 86 Cb 0.02 -0.68 0.60 0.00 0.00 0.00 0.00 43.42 43.37 1q3g n LEU 86 CO 0.04 0.56 0.95 -0.37 0.00 0.00 0.00 177.39 178.57 1q3g h VAL 87 N -0.62 0.00 0.00 1.96 -1.51 -1.02 -2.19 116.25 112.87 1q3g h VAL 87 Ca -0.55 -0.50 0.00 0.00 -1.23 0.00 0.00 66.70 64.43 1q3g h VAL 87 Cb 1.55 1.44 0.00 0.00 -2.13 0.00 0.00 31.29 32.16 1q3g h VAL 87 CO -0.28 0.00 0.00 2.29 -1.23 0.00 0.00 177.57 178.35 1q3g n LYS 88 N -2.90 0.17 -0.00 5.19 2.85 -0.42 -1.87 118.16 121.18 1q3g n LYS 88 Ca 0.01 0.42 0.09 0.00 -1.05 0.00 0.00 58.31 57.78 1q3g n LYS 88 Cb 0.31 -1.84 -0.11 0.00 -0.65 0.00 0.00 35.03 32.74 1q3g n LYS 88 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1q3g n THR 89 N -2.17 0.00 -3.15 0.58 -2.24 -0.83 -4.86 114.28 101.62 1q3g n THR 89 Ca 0.02 -0.06 0.04 0.00 -2.27 0.00 0.00 64.05 61.78 1q3g n THR 89 Cb 0.21 0.95 -0.00 0.00 -2.10 0.00 0.00 70.33 69.39 1q3g n THR 89 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1q3g s MET 90 N -2.86 0.46 0.40 -0.78 -2.45 -0.78 -5.02 119.30 108.26 1q3g s MET 90 Ca 0.07 0.49 0.29 0.00 -1.25 0.00 0.00 55.69 55.28 1q3g s MET 90 Cb 0.15 0.23 1.26 0.00 1.25 0.00 0.00 34.83 37.72 1q3g s MET 90 CO 0.80 -0.81 1.86 0.07 1.05 0.00 0.00 175.02 177.99 1q3g h ARG 91 N 7.83 0.00 0.00 4.11 0.11 -1.87 -2.38 114.38 122.19 1q3g h ARG 91 Ca -0.05 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.03 1q3g h ARG 91 Cb 1.18 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.26 1q3g h ARG 91 CO 0.10 0.00 0.01 0.00 0.10 0.00 0.00 179.97 180.18 1q3g n ALA 92 N -1.91 1.02 0.39 0.08 0.00 -1.26 -1.11 120.51 117.72 1q3g n ALA 92 Ca 0.01 0.14 0.05 0.00 0.00 0.00 0.00 53.44 53.64 1q3g n ALA 92 Cb 0.22 -1.21 0.22 0.00 0.00 0.00 0.00 19.45 18.69 1q3g n ALA 92 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1q3g n SER 93 N -2.03 0.00 0.27 0.00 3.41 -0.90 -1.63 113.62 112.76 1q3g n SER 93 Ca -0.01 0.32 0.13 0.00 -0.26 0.00 0.00 58.87 59.06 1q3g n SER 93 Cb 0.03 -0.39 0.79 0.00 -0.26 0.00 0.00 64.21 64.38 1q3g n SER 93 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1q3g h ILE 94 N 0.00 0.56 0.00 -1.33 6.09 -1.38 -2.11 117.51 119.34 1q3g h ILE 94 Ca 0.00 -0.35 0.00 0.00 -1.37 0.00 0.00 64.86 63.14 1q3g h ILE 94 Cb 0.13 1.22 0.00 0.00 0.47 0.00 0.00 36.82 38.64 1q3g h ILE 94 CO 0.00 0.08 0.00 0.79 -3.07 0.00 0.00 178.15 175.95 1q3g n TRP 95 N -3.72 0.00 0.06 2.19 8.01 -0.64 -2.16 117.44 121.17 1q3g n TRP 95 Ca -0.02 0.00 -0.04 0.00 -1.31 0.00 0.00 57.50 56.13 1q3g n TRP 95 Cb 0.18 -0.19 -0.08 0.00 -2.01 0.00 0.00 31.31 29.21 1q3g n TRP 95 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1q3g h ALA 96 N 2.57 0.56 -0.03 6.99 0.00 -1.62 -3.36 119.26 124.37 1q3g h ALA 96 Ca 0.00 -0.91 0.03 0.00 0.00 0.00 0.00 54.91 54.03 1q3g h ALA 96 Cb 0.07 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1q3g h ALA 96 CO 0.00 1.12 -0.19 1.25 0.00 0.00 0.00 179.25 181.43 1q3g h LEU 97 N 0.00 -0.57 0.32 0.00 5.85 -1.63 -2.18 115.31 117.10 1q3g h LEU 97 Ca -0.09 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1q3g h LEU 97 Cb 1.70 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.94 1q3g h LEU 97 CO 0.09 -0.25 -0.51 1.23 -0.34 0.00 0.00 178.44 178.66 1q3g h GLY 98 N -0.30 -1.22 0.86 3.75 0.00 -1.76 -1.85 103.07 102.56 1q3g h GLY 98 Ca 0.07 0.61 0.03 0.00 0.00 0.00 0.00 47.33 48.04 1q3g h GLY 98 CO -0.20 -0.33 0.36 -2.55 0.00 0.00 0.00 176.54 173.83 1q3g h PRO 99 N -0.88 0.69 -0.30 4.80 0.11 -1.73 -1.20 132.00 133.49 1q3g h PRO 99 Ca -0.04 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 66.07 1q3g h PRO 99 Cb 0.81 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 31.72 1q3g h PRO 99 CO -0.16 0.46 0.07 -0.07 -0.21 0.00 0.00 178.00 178.09 1q3g h LEU 100 N 0.71 0.04 -0.48 2.35 3.38 -1.26 0.00 115.31 120.05 1q3g h LEU 100 Ca 0.24 0.04 -0.15 0.00 0.09 0.00 0.00 57.88 58.10 1q3g h LEU 100 Cb 0.03 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1q3g h LEU 100 CO -0.11 0.06 -0.42 1.62 0.09 0.00 0.00 178.44 179.68 1q3g h VAL 101 N 0.19 1.29 -0.24 1.22 3.04 -1.16 0.20 116.25 120.79 1q3g h VAL 101 Ca 0.14 -1.61 -0.07 0.00 -1.01 0.00 0.00 66.70 64.15 1q3g h VAL 101 Cb 0.14 1.50 -0.01 0.00 -2.01 0.00 0.00 31.29 30.90 1q3g h VAL 101 CO -0.17 0.52 -0.18 0.00 -1.01 0.00 0.00 177.57 176.73 1q3g h ALA 102 N 0.89 1.26 0.01 3.17 0.00 -0.87 0.52 119.26 124.23 1q3g h ALA 102 Ca 0.04 -0.28 -0.38 0.00 0.00 0.00 0.00 54.91 54.29 1q3g h ALA 102 Cb 0.99 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.59 1q3g h ALA 102 CO 0.09 0.49 -2.40 -2.13 0.00 0.00 0.00 179.25 175.30 1q3g n ARG 103 N -4.18 0.67 -0.08 0.00 0.63 -0.04 -4.60 116.66 109.05 1q3g n ARG 103 Ca -0.00 0.10 0.05 0.00 -0.92 0.00 0.00 57.85 57.09 1q3g n ARG 103 Cb 0.34 -1.54 0.09 0.00 0.45 0.00 0.00 32.46 31.81 1q3g n ARG 103 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1q3g n PHE 104 N -3.09 0.21 -0.90 -0.14 3.01 0.69 -4.98 117.46 112.27 1q3g n PHE 104 Ca -0.40 -0.24 0.00 0.00 1.01 0.00 0.00 57.45 57.83 1q3g n PHE 104 Cb 1.05 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.51 1q3g n PHE 104 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1q3g n GLY 105 N 0.54 0.41 3.51 1.37 0.00 0.17 -4.94 105.19 106.25 1q3g n GLY 105 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 1q3g n GLY 105 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1q3g s GLN 106 N -0.68 1.37 0.00 1.61 -2.07 -1.24 -1.47 119.66 117.18 1q3g s GLN 106 Ca 0.00 -0.65 0.00 0.00 -1.82 0.00 0.00 55.36 52.89 1q3g s GLN 106 Cb 0.00 0.57 0.00 0.00 -1.09 0.00 0.00 33.01 32.49 1q3g s GLN 106 CO 0.00 -0.60 0.00 0.41 -1.32 0.00 0.00 175.29 173.78 1q3g n GLY 107 N -0.37 1.87 3.19 2.60 0.00 -0.60 -2.79 105.19 109.09 1q3g n GLY 107 Ca -0.13 -0.37 -0.11 0.00 0.00 0.00 0.00 46.02 45.40 1q3g n GLY 107 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1q3g s GLN 108 N -1.99 0.33 -0.02 1.61 -2.07 -0.41 -0.42 119.66 116.69 1q3g s GLN 108 Ca 0.00 0.68 0.05 0.00 -1.82 0.00 0.00 55.36 54.27 1q3g s GLN 108 Cb 0.00 -0.05 -0.01 0.00 -1.09 0.00 0.00 33.01 31.86 1q3g s GLN 108 CO 0.00 -0.16 -0.17 0.08 -1.32 0.00 0.00 175.29 173.72 1q3g s VAL 109 N 1.30 1.35 0.18 3.63 1.01 -0.87 -0.38 120.40 126.62 1q3g s VAL 109 Ca -0.09 -0.72 -0.32 0.00 0.00 0.00 0.00 61.98 60.85 1q3g s VAL 109 Cb -0.09 -1.13 -0.11 0.00 0.00 0.00 0.00 36.38 35.05 1q3g s VAL 109 CO -0.11 0.38 1.68 -0.55 0.00 0.00 0.00 175.10 176.51 1q3g s SER 110 N -0.35 6.46 -0.12 3.32 0.15 -0.50 -1.30 113.70 121.36 1q3g s SER 110 Ca 0.05 2.76 -0.29 0.00 0.70 0.00 0.00 55.95 59.17 1q3g s SER 110 Cb -0.07 -2.59 -0.06 0.00 -1.71 0.00 0.00 66.02 61.59 1q3g s SER 110 CO -0.00 -0.92 1.91 -0.22 1.20 0.00 0.00 173.24 175.20 1q3g s LEU 111 N 1.39 3.99 0.40 3.45 0.20 0.12 -4.83 118.68 123.40 1q3g s LEU 111 Ca 0.74 2.10 -0.27 0.00 0.69 0.00 0.00 54.13 57.39 1q3g s LEU 111 Cb -0.47 -3.53 -0.09 0.00 -0.43 0.00 0.00 46.19 41.67 1q3g s LEU 111 CO 0.32 -1.36 1.35 -2.16 -0.29 0.00 0.00 176.35 174.22 1q3g s PRO 112 N 5.02 4.01 0.00 0.98 0.04 -1.26 -4.97 135.00 138.81 1q3g s PRO 112 Ca 0.85 2.28 0.00 0.00 0.04 0.00 0.00 61.00 64.17 1q3g s PRO 112 Cb -0.34 -2.83 0.00 0.00 0.04 0.00 0.00 34.50 31.38 1q3g s PRO 112 CO 0.35 -0.51 0.00 0.41 0.04 0.00 0.00 177.00 177.30 1q3g n GLY 113 N 0.64 0.03 3.80 0.56 0.00 -1.26 -4.99 105.19 103.97 1q3g n GLY 113 Ca 0.03 -1.67 -0.31 0.00 0.00 0.00 0.00 46.02 44.07 1q3g n GLY 113 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1q3g s GLY 114 N -0.78 1.66 0.38 -0.02 0.00 -1.26 -4.88 107.32 102.41 1q3g s GLY 114 Ca 0.00 0.04 0.08 0.00 0.00 0.00 0.00 44.72 44.84 1q3g s GLY 114 CO 0.00 0.39 0.02 0.00 0.00 0.00 0.00 173.10 173.51 1q3g h ALA 116 N 1.77 0.35 -0.00 0.00 0.00 -1.94 -3.08 119.26 116.35 1q3g h ALA 116 Ca -0.43 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1q3g h ALA 116 Cb 1.25 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1q3g h ALA 116 CO 0.73 -0.10 -0.03 0.44 0.00 0.00 0.00 179.25 180.29 1q3g n ILE 117 N -4.81 0.00 0.00 0.00 -5.35 -1.26 -4.79 119.36 103.15 1q3g n ILE 117 Ca -0.02 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 1q3g n ILE 117 Cb 0.09 -0.33 0.00 0.00 -1.74 0.00 0.00 39.64 37.66 1q3g n ILE 117 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1q3g n GLY 118 N 1.17 2.00 0.27 3.28 0.00 -1.17 -0.82 105.19 109.93 1q3g n GLY 118 Ca 0.18 -0.84 0.16 0.00 0.00 0.00 0.00 46.02 45.51 1q3g n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3g h ALA 119 N 0.00 1.08 -6.91 4.61 0.00 -1.93 -1.66 119.26 114.45 1q3g h ALA 119 Ca 0.00 -0.07 -0.52 0.00 0.00 0.00 0.00 54.91 54.32 1q3g h ALA 119 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1q3g h ALA 119 CO 0.00 0.09 -0.94 0.54 0.00 0.00 0.00 179.25 178.94 1q3g n ARG 120 N -3.29 -0.57 -0.70 0.00 1.74 -1.26 -4.42 116.66 108.16 1q3g n ARG 120 Ca -0.01 0.17 -0.30 0.00 -0.77 0.00 0.00 57.85 56.95 1q3g n ARG 120 Cb 0.27 -2.05 0.20 0.00 -1.02 0.00 0.00 32.46 29.86 1q3g n ARG 120 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1q3g s PRO 121 N -6.57 0.20 -0.11 5.56 0.04 -1.26 -4.96 135.00 127.91 1q3g s PRO 121 Ca 0.33 1.15 0.15 0.00 0.04 0.00 0.00 61.00 62.66 1q3g s PRO 121 Cb -0.18 -1.66 0.25 0.00 0.04 0.00 0.00 34.50 32.95 1q3g s PRO 121 CO 0.86 -3.06 1.13 1.55 0.04 0.00 0.00 177.00 177.52 1q3g n VAL 122 N -4.49 1.50 -0.32 -0.36 3.14 -1.26 -4.84 118.33 111.69 1q3g n VAL 122 Ca 0.07 -1.90 0.09 0.00 -2.96 0.00 0.00 64.34 59.64 1q3g n VAL 122 Cb 0.53 -0.06 0.25 0.00 -1.06 0.00 0.00 33.84 33.51 1q3g n VAL 122 CO 0.00 0.00 0.00 -2.24 -6.46 0.00 0.00 176.83 168.13 1q3g h ASP 123 N 0.14 0.69 0.24 6.55 2.03 -2.00 -1.57 116.42 122.50 1q3g h ASP 123 Ca -0.01 0.08 -0.06 0.00 -0.73 0.00 0.00 57.03 56.31 1q3g h ASP 123 Cb 1.11 -0.04 -0.01 0.00 -0.83 0.00 0.00 39.33 39.56 1q3g h ASP 123 CO 0.00 0.30 -0.27 -0.07 -1.03 0.00 0.00 179.24 178.18 1q3g h LEU 124 N 0.75 0.05 0.33 0.15 3.38 -1.98 0.17 115.31 118.15 1q3g h LEU 124 Ca 0.50 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.44 1q3g h LEU 124 Cb 0.68 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1q3g h LEU 124 CO -0.34 0.32 -0.16 0.45 0.09 0.00 0.00 178.44 178.80 1q3g h HIS 125 N 0.05 -0.41 -0.30 1.13 3.86 -1.62 -0.24 115.15 117.62 1q3g h HIS 125 Ca 0.01 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1q3g h HIS 125 Cb 0.50 0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.09 1q3g h HIS 125 CO 0.00 -0.15 0.18 0.82 0.86 0.00 0.00 177.93 179.64 1q3g h ILE 126 N -0.62 1.11 -0.48 2.45 2.04 -1.32 -1.52 117.51 119.18 1q3g h ILE 126 Ca -0.05 -0.26 0.08 0.00 1.00 0.00 0.00 64.86 65.64 1q3g h ILE 126 Cb 0.45 0.73 -0.07 0.00 -0.74 0.00 0.00 36.82 37.19 1q3g h ILE 126 CO 0.07 0.11 0.07 0.15 0.00 0.00 0.00 178.15 178.55 1q3g h PHE 127 N 0.39 0.11 -0.07 1.37 3.57 -0.62 0.27 116.94 121.96 1q3g h PHE 127 Ca 0.11 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.64 1q3g h PHE 127 Cb 0.02 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 38.78 1q3g h PHE 127 CO -0.04 -0.03 0.04 0.78 -2.23 0.00 0.00 178.31 176.83 1q3g h GLY 128 N 0.20 0.11 1.01 2.40 0.00 -0.67 -1.08 103.07 105.03 1q3g h GLY 128 Ca 0.24 -0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 1q3g h GLY 128 CO -0.33 0.04 0.46 1.41 0.00 0.00 0.00 176.54 178.12 1q3g h LEU 129 N 0.07 0.89 -0.95 3.11 3.38 -0.92 -2.13 115.31 118.75 1q3g h LEU 129 Ca 0.03 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 57.98 1q3g h LEU 129 Cb 0.03 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.50 1q3g h LEU 129 CO -0.01 0.68 0.62 -0.33 0.09 0.00 0.00 178.44 179.49 1q3g h GLU 130 N 1.02 1.18 0.00 1.13 5.08 -0.71 -0.26 114.58 122.01 1q3g h GLU 130 Ca 0.27 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 1q3g h GLU 130 Cb -0.06 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 28.93 1q3g h GLU 130 CO -0.05 0.78 -0.09 0.87 -1.00 0.00 0.00 179.01 179.52 1q3g h LYS 131 N 1.21 0.00 -0.04 2.33 1.79 -0.57 -0.39 116.57 120.91 1q3g h LYS 131 Ca 0.38 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.85 1q3g h LYS 131 Cb -0.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 1q3g h LYS 131 CO -0.12 0.09 0.00 1.28 -1.08 0.00 0.00 179.45 179.62 1q3g n LEU 132 N -3.48 1.31 0.00 2.94 4.77 -0.19 -4.69 117.00 117.67 1q3g n LEU 132 Ca -0.02 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.50 1q3g n LEU 132 Cb 0.23 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1q3g n LEU 132 CO 0.28 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1q3g n GLY 133 N 1.14 0.60 3.79 -0.72 0.00 -0.15 -1.06 105.19 108.78 1q3g n GLY 133 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 1q3g n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3g s ALA 134 N -2.00 3.00 -0.25 4.61 0.00 -0.71 -4.80 121.76 121.60 1q3g s ALA 134 Ca 0.00 0.68 -0.08 0.00 0.00 0.00 0.00 51.96 52.56 1q3g s ALA 134 Cb 0.00 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 1q3g s ALA 134 CO 0.00 -0.27 0.09 -2.00 0.00 0.00 0.00 175.76 173.59 1q3g s GLU 135 N -2.78 3.72 -0.08 0.00 2.12 0.86 -4.13 118.70 118.41 1q3g s GLU 135 Ca 0.62 -0.44 0.04 0.00 0.36 0.00 0.00 54.97 55.54 1q3g s GLU 135 Cb -0.20 -3.39 -0.01 0.00 0.26 0.00 0.00 34.13 30.79 1q3g s GLU 135 CO 0.25 -0.18 -0.19 0.42 -0.54 0.00 0.00 175.26 175.02 1q3g s ILE 136 N 1.61 2.55 0.06 -3.70 1.09 -1.26 -1.55 121.20 120.00 1q3g s ILE 136 Ca 0.06 -0.88 0.01 0.00 -1.10 0.00 0.00 60.65 58.75 1q3g s ILE 136 Cb -0.15 -1.99 -0.03 0.00 -1.06 0.00 0.00 42.46 39.23 1q3g s ILE 136 CO 0.05 0.56 -0.06 -1.59 -0.10 0.00 0.00 174.94 173.80 1q3g s LYS 137 N -0.09 0.60 -0.18 2.79 -2.85 -0.59 -5.00 119.74 114.41 1q3g s LYS 137 Ca -0.04 -0.95 -0.04 0.00 -1.00 0.00 0.00 55.97 53.94 1q3g s LYS 137 Cb -0.14 -0.16 -0.02 0.00 -2.06 0.00 0.00 37.83 35.45 1q3g s LYS 137 CO 0.04 0.00 -0.03 -1.17 0.10 0.00 0.00 175.35 174.29 1q3g s LEU 138 N -2.13 3.17 -0.20 2.77 2.96 -1.26 -0.64 118.68 123.34 1q3g s LEU 138 Ca -0.03 -0.21 -0.10 0.00 -0.22 0.00 0.00 54.13 53.58 1q3g s LEU 138 Cb -0.04 -1.78 0.07 0.00 0.50 0.00 0.00 46.19 44.94 1q3g s LEU 138 CO -0.02 0.10 0.48 -1.83 -1.32 0.00 0.00 176.35 173.75 1q3g s GLU 139 N 0.76 0.45 -1.52 1.98 -1.05 -0.82 -4.90 118.70 113.60 1q3g s GLU 139 Ca -0.01 0.95 0.00 0.00 -0.15 0.00 0.00 54.97 55.76 1q3g s GLU 139 Cb -0.14 0.12 0.00 0.00 -0.44 0.00 0.00 34.13 33.67 1q3g s GLU 139 CO 0.02 -0.18 0.00 0.39 0.95 0.00 0.00 175.26 176.44 1q3g n GLU 140 N 4.56 -1.30 -0.77 -4.83 1.02 -1.26 -1.69 120.64 116.37 1q3g n GLU 140 Ca -0.19 0.88 0.00 0.00 -0.02 0.00 0.00 57.16 57.83 1q3g n GLU 140 Cb 0.54 -5.26 0.00 0.00 -0.02 0.00 0.00 31.44 26.71 1q3g n GLU 140 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1q3g n GLY 141 N -0.99 0.66 3.25 0.62 0.00 -1.26 -5.02 105.19 102.44 1q3g n GLY 141 Ca -0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 1q3g n GLY 141 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1q3g s TYR 142 N -2.26 2.88 -0.45 1.61 1.51 -0.68 0.16 117.35 120.11 1q3g s TYR 142 Ca 0.00 -1.15 -0.29 0.00 -1.01 0.00 0.00 57.07 54.62 1q3g s TYR 142 Cb 0.00 -2.01 0.02 0.00 -0.11 0.00 0.00 41.96 39.86 1q3g s TYR 142 CO 0.00 -0.60 1.19 0.54 -1.11 0.00 0.00 175.55 175.56 1q3g s VAL 143 N 1.29 4.18 -0.23 0.71 0.11 -0.42 -1.94 120.40 124.09 1q3g s VAL 143 Ca 0.03 1.22 -0.08 0.00 -2.93 0.00 0.00 61.98 60.22 1q3g s VAL 143 Cb -0.14 -4.51 -0.04 0.00 -1.53 0.00 0.00 36.38 30.16 1q3g s VAL 143 CO -0.06 -0.91 0.10 -0.54 -3.33 0.00 0.00 175.10 170.37 1q3g s LYS 144 N 4.46 3.85 0.05 1.54 1.02 0.18 -2.05 119.74 128.79 1q3g s LYS 144 Ca 0.50 -0.39 0.08 0.00 0.02 0.00 0.00 55.97 56.18 1q3g s LYS 144 Cb -0.09 -3.38 -0.03 0.00 -0.52 0.00 0.00 37.83 33.81 1q3g s LYS 144 CO 0.30 -0.03 -0.21 0.00 -0.92 0.00 0.00 175.35 174.50 1q3g s ALA 145 N 1.22 2.48 0.13 5.17 0.00 0.44 -1.55 121.76 129.65 1q3g s ALA 145 Ca 0.05 -1.24 -0.16 0.00 0.00 0.00 0.00 51.96 50.62 1q3g s ALA 145 Cb -0.14 -0.64 0.03 0.00 0.00 0.00 0.00 23.12 22.37 1q3g s ALA 145 CO 0.04 0.56 0.39 -1.54 0.00 0.00 0.00 175.76 175.22 1q3g s SER 146 N -1.43 -0.21 -0.24 0.00 1.04 -0.59 -1.56 113.70 110.71 1q3g s SER 146 Ca 0.14 -0.36 -0.21 0.00 0.48 0.00 0.00 55.95 56.00 1q3g s SER 146 Cb -0.10 0.47 0.06 0.00 0.10 0.00 0.00 66.02 66.55 1q3g s SER 146 CO 0.04 -0.86 0.64 0.54 0.98 0.00 0.00 173.24 174.58 1q3g s VAL 147 N -3.82 -0.00 -0.51 5.02 0.11 -0.54 -0.10 120.40 120.56 1q3g s VAL 147 Ca 0.04 0.00 -0.22 0.00 -2.93 0.00 0.00 61.98 58.87 1q3g s VAL 147 Cb 0.02 -0.90 0.04 0.00 -1.53 0.00 0.00 36.38 34.01 1q3g s VAL 147 CO -0.11 0.00 0.80 0.21 -3.33 0.00 0.00 175.10 172.67 1q3g s ASN 148 N 0.56 6.31 0.00 3.54 2.47 -1.26 -4.69 114.94 121.88 1q3g s ASN 148 Ca -0.02 -0.49 0.00 0.00 0.42 0.00 0.00 52.86 52.77 1q3g s ASN 148 Cb -0.05 -2.38 0.00 0.00 -1.45 0.00 0.00 41.25 37.38 1q3g s ASN 148 CO -0.03 -1.05 0.00 0.61 -3.72 0.00 0.00 177.10 172.92 1q3g n GLY 149 N 5.11 -1.30 3.88 1.21 0.00 -1.26 -4.92 105.19 107.91 1q3g n GLY 149 Ca -0.01 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 44.11 1q3g n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1q3g s ARG 150 N 0.00 3.36 0.64 1.61 0.52 -1.26 -4.76 118.95 119.06 1q3g s ARG 150 Ca 0.00 0.52 -0.12 0.00 -0.52 0.00 0.00 55.73 55.61 1q3g s ARG 150 Cb 0.00 -2.13 -0.02 0.00 0.52 0.00 0.00 34.95 33.32 1q3g s ARG 150 CO 0.00 -0.62 1.05 -0.51 0.02 0.00 0.00 175.30 175.23 1q3g s LEU 151 N -5.13 3.26 -0.07 2.53 1.43 -1.26 -4.82 118.68 114.62 1q3g s LEU 151 Ca 0.54 1.60 0.02 0.00 -1.03 0.00 0.00 54.13 55.27 1q3g s LEU 151 Cb -0.11 -4.50 -0.03 0.00 0.03 0.00 0.00 46.19 41.59 1q3g s LEU 151 CO 0.51 -1.19 -0.12 -0.54 0.23 0.00 0.00 176.35 175.24 1q3g s LYS 152 N -4.83 2.72 0.62 1.70 1.02 -0.22 0.92 119.74 121.67 1q3g s LYS 152 Ca 0.58 -0.66 -0.18 0.00 0.02 0.00 0.00 55.97 55.74 1q3g s LYS 152 Cb -0.13 -2.48 -0.03 0.00 -0.52 0.00 0.00 37.83 34.67 1q3g s LYS 152 CO 0.50 0.56 1.08 0.41 -0.92 0.00 0.00 175.35 176.98 1q3g n GLY 153 N 2.51 -0.01 3.43 -3.33 0.00 0.13 -4.53 105.19 103.39 1q3g n GLY 153 Ca -0.17 -0.15 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 1q3g n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3g s ALA 154 N -1.47 -0.52 -0.42 4.61 0.00 -1.11 -4.76 121.76 118.08 1q3g s ALA 154 Ca 0.79 -0.51 -0.16 0.00 0.00 0.00 0.00 51.96 52.07 1q3g s ALA 154 Cb -0.40 0.84 0.03 0.00 0.00 0.00 0.00 23.12 23.59 1q3g s ALA 154 CO 0.44 -0.73 0.38 -1.58 0.00 0.00 0.00 175.76 174.27 1q3g s HIS 155 N -3.91 3.20 -0.19 0.00 2.46 -1.26 -1.22 115.29 114.37 1q3g s HIS 155 Ca 0.12 -0.53 -0.03 0.00 0.47 0.00 0.00 55.06 55.10 1q3g s HIS 155 Cb 0.01 -2.80 -0.01 0.00 -0.13 0.00 0.00 32.58 29.64 1q3g s HIS 155 CO -0.02 -0.67 -0.06 0.42 -2.47 0.00 0.00 174.74 171.94 1q3g s ILE 156 N 1.90 3.41 -0.25 0.89 1.01 0.34 -4.96 121.20 123.54 1q3g s ILE 156 Ca 0.08 -0.50 -0.08 0.00 0.00 0.00 0.00 60.65 60.16 1q3g s ILE 156 Cb -0.19 -2.52 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 1q3g s ILE 156 CO 0.11 0.45 0.09 -0.69 0.00 0.00 0.00 174.94 174.91 1q3g s VAL 157 N 1.07 4.50 -0.11 2.92 1.01 -1.26 -0.34 120.40 128.20 1q3g s VAL 157 Ca 0.01 -0.11 -0.26 0.00 0.00 0.00 0.00 61.98 61.62 1q3g s VAL 157 Cb -0.15 -3.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.10 1q3g s VAL 157 CO -0.00 0.33 0.84 -0.04 0.00 0.00 0.00 175.10 176.22 1q3g s MET 158 N 1.58 4.39 0.00 2.72 1.00 -0.66 -4.91 119.30 123.41 1q3g s MET 158 Ca 0.06 1.08 0.29 0.00 0.00 0.00 0.00 55.69 57.13 1q3g s MET 158 Cb -0.15 -3.52 1.34 0.00 0.00 0.00 0.00 34.83 32.50 1q3g s MET 158 CO 0.05 -0.18 1.92 -0.40 0.00 0.00 0.00 175.02 176.40 1q3g n ASP 159 N 4.64 0.62 -3.76 3.03 5.68 -1.26 -4.69 116.55 120.81 1q3g n ASP 159 Ca 0.04 -0.92 -0.13 0.00 -0.50 0.00 0.00 54.79 53.27 1q3g n ASP 159 Cb 0.50 -0.03 -0.09 0.00 -1.14 0.00 0.00 41.12 40.35 1q3g n ASP 159 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1q3g s LYS 160 N -2.24 0.57 -0.27 0.11 2.20 -1.26 -5.13 119.74 113.72 1q3g s LYS 160 Ca 0.36 0.08 -0.27 0.00 -0.36 0.00 0.00 55.97 55.78 1q3g s LYS 160 Cb 0.21 0.26 0.01 0.00 -1.51 0.00 0.00 37.83 36.80 1q3g s LYS 160 CO 0.41 -0.13 0.98 0.08 -0.36 0.00 0.00 175.35 176.33 1q3g s VAL 161 N -0.73 4.67 -0.08 4.02 1.01 -1.26 -4.99 120.40 123.04 1q3g s VAL 161 Ca -0.08 1.72 -0.00 0.00 0.00 0.00 0.00 61.98 63.62 1q3g s VAL 161 Cb -0.04 -4.29 0.02 0.00 0.00 0.00 0.00 36.38 32.08 1q3g s VAL 161 CO 0.03 -0.27 -0.04 -0.55 0.00 0.00 0.00 175.10 174.26 1q3g s SER 162 N 1.44 1.73 0.04 3.32 0.15 -1.26 -5.00 113.70 114.11 1q3g s SER 162 Ca 0.41 -0.19 -0.26 0.00 0.70 0.00 0.00 55.95 56.61 1q3g s SER 162 Cb -0.14 -0.63 -0.17 0.00 -1.71 0.00 0.00 66.02 63.37 1q3g s SER 162 CO 0.10 -0.13 1.46 0.58 1.20 0.00 0.00 173.24 176.46 1q3g h VAL 163 N 6.21 0.85 0.10 4.45 2.07 -1.95 -1.62 116.25 126.37 1q3g h VAL 163 Ca -0.27 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 66.85 1q3g h VAL 163 Cb 1.14 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.98 1q3g h VAL 163 CO 0.36 0.09 -0.15 1.23 0.02 0.00 0.00 177.57 179.13 1q3g h GLY 164 N -0.50 -0.27 0.92 2.17 0.00 -2.00 -1.90 103.07 101.50 1q3g h GLY 164 Ca -0.03 0.17 0.03 0.00 0.00 0.00 0.00 47.33 47.49 1q3g h GLY 164 CO 0.05 -0.14 0.63 0.00 0.00 0.00 0.00 176.54 177.07 1q3g h ALA 165 N 0.57 1.25 -0.92 3.60 0.00 -1.92 -1.01 119.26 120.84 1q3g h ALA 165 Ca 0.02 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1q3g h ALA 165 Cb 0.30 -0.36 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 1q3g h ALA 165 CO -0.07 0.54 0.61 1.15 0.00 0.00 0.00 179.25 181.48 1q3g h THR 166 N 1.25 1.22 -0.03 0.00 2.02 -0.95 -1.13 112.91 115.30 1q3g h THR 166 Ca 0.37 -0.42 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 1q3g h THR 166 Cb -0.05 -0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.24 1q3g h THR 166 CO -0.11 0.22 0.01 0.58 0.37 0.00 0.00 175.52 176.60 1q3g h VAL 167 N 1.23 1.17 -0.11 3.16 2.07 -0.53 -0.63 116.25 122.61 1q3g h VAL 167 Ca 0.34 -0.50 0.04 0.00 0.82 0.00 0.00 66.70 67.40 1q3g h VAL 167 Cb -0.12 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.05 1q3g h VAL 167 CO -0.08 0.13 -0.13 0.74 0.02 0.00 0.00 177.57 178.26 1q3g h THR 168 N -0.15 0.66 -0.10 2.57 2.02 -0.92 0.17 112.91 117.16 1q3g h THR 168 Ca 0.01 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.18 1q3g h THR 168 Cb 0.21 0.66 -0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1q3g h THR 168 CO -0.00 0.00 0.01 0.40 0.37 0.00 0.00 175.52 176.30 1q3g h ILE 169 N -0.16 1.23 -0.82 3.11 2.04 -1.20 -1.79 117.51 119.91 1q3g h ILE 169 Ca 0.08 -0.71 0.03 0.00 1.00 0.00 0.00 64.86 65.26 1q3g h ILE 169 Cb 0.28 1.52 -0.05 0.00 -0.74 0.00 0.00 36.82 37.83 1q3g h ILE 169 CO -0.20 0.20 0.53 -0.03 0.00 0.00 0.00 178.15 178.65 1q3g h MET 170 N -0.09 1.02 0.06 2.37 4.05 -1.00 -0.79 114.93 120.55 1q3g h MET 170 Ca 0.03 -0.06 -0.00 0.00 -0.28 0.00 0.00 59.70 59.38 1q3g h MET 170 Cb 0.31 -0.23 0.00 0.00 -0.80 0.00 0.00 31.60 30.88 1q3g h MET 170 CO 0.00 0.68 -0.03 0.77 0.23 0.00 0.00 176.91 178.56 1q3g h SER 171 N 1.06 -0.07 -0.41 1.39 0.02 -0.88 -3.08 113.55 111.57 1q3g h SER 171 Ca 0.32 -0.21 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 1q3g h SER 171 Cb -0.03 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 1q3g h SER 171 CO -0.10 0.17 0.20 0.00 -1.14 0.00 0.00 176.83 175.96 1q3g h ALA 172 N 0.61 1.50 0.00 3.77 0.00 -1.14 -2.69 119.26 121.32 1q3g h ALA 172 Ca -0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1q3g h ALA 172 Cb 0.27 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1q3g h ALA 172 CO 0.01 0.40 -0.12 0.00 0.00 0.00 0.00 179.25 179.54 1q3g h ALA 173 N 1.58 1.35 -0.07 0.00 0.00 -1.06 -2.99 119.26 118.07 1q3g h ALA 173 Ca 0.16 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1q3g h ALA 173 Cb 0.10 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1q3g h ALA 173 CO -0.02 0.15 0.06 1.79 0.00 0.00 0.00 179.25 181.23 1q3g h THR 174 N 0.00 0.82 -0.44 0.00 1.35 -1.43 -0.89 112.91 112.32 1q3g h THR 174 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1q3g h THR 174 Cb 0.30 0.96 0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1q3g h THR 174 CO 0.02 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.47 1q3g n LEU 175 N -4.30 3.80 -4.89 3.87 4.77 -1.13 -0.90 117.00 118.21 1q3g n LEU 175 Ca -0.01 -2.40 -0.29 0.00 -0.03 0.00 0.00 56.01 53.27 1q3g n LEU 175 Cb 0.16 -0.43 0.04 0.00 -2.33 0.00 0.00 43.42 40.86 1q3g n LEU 175 CO 0.32 0.76 0.69 0.00 -1.33 0.00 0.00 177.39 177.83 1q3g s ALA 176 N -1.73 2.99 -0.45 -1.18 0.00 -0.34 -4.50 121.76 116.55 1q3g s ALA 176 Ca 0.38 -0.46 -0.19 0.00 0.00 0.00 0.00 51.96 51.70 1q3g s ALA 176 Cb 0.25 -2.91 0.03 0.00 0.00 0.00 0.00 23.12 20.50 1q3g s ALA 176 CO 0.18 -1.08 0.53 -2.00 0.00 0.00 0.00 175.76 173.39 1q3g s GLU 177 N -5.27 3.14 0.00 0.00 2.12 0.26 -3.85 118.70 115.10 1q3g s GLU 177 Ca 0.57 -0.72 0.00 0.00 0.36 0.00 0.00 54.97 55.19 1q3g s GLU 177 Cb -0.11 -4.00 0.00 0.00 0.26 0.00 0.00 34.13 30.28 1q3g s GLU 177 CO 0.50 -0.99 0.00 0.41 -0.54 0.00 0.00 175.26 174.64 1q3g n GLY 178 N 5.11 -0.85 3.60 -1.50 0.00 -1.26 -0.69 105.19 109.59 1q3g n GLY 178 Ca -0.06 -2.15 -0.34 0.00 0.00 0.00 0.00 46.02 43.47 1q3g n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q3g s THR 179 N 0.00 4.05 0.01 2.61 2.01 -1.26 -0.99 115.64 122.07 1q3g s THR 179 Ca 0.00 -0.33 0.05 0.00 0.31 0.00 0.00 61.69 61.72 1q3g s THR 179 Cb 0.00 -2.72 -0.03 0.00 0.01 0.00 0.00 72.50 69.76 1q3g s THR 179 CO 0.00 0.56 -0.15 -0.89 -0.69 0.00 0.00 174.62 173.45 1q3g s THR 180 N -0.42 3.03 -0.09 -0.82 2.01 0.19 -2.75 115.64 116.79 1q3g s THR 180 Ca 0.07 -0.96 -0.00 0.00 0.31 0.00 0.00 61.69 61.11 1q3g s THR 180 Cb -0.12 -2.26 0.02 0.00 0.01 0.00 0.00 72.50 70.15 1q3g s THR 180 CO 0.02 0.43 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.68 1q3g s ILE 181 N -0.88 0.90 -0.37 1.82 1.01 -0.36 -0.34 121.20 122.99 1q3g s ILE 181 Ca 0.14 -0.24 -0.12 0.00 0.00 0.00 0.00 60.65 60.44 1q3g s ILE 181 Cb -0.11 -0.92 0.01 0.00 0.01 0.00 0.00 42.46 41.45 1q3g s ILE 181 CO 0.04 0.34 0.22 -0.63 0.00 0.00 0.00 174.94 174.91 1q3g s ILE 182 N 1.54 4.83 0.12 2.92 1.01 0.89 -0.51 121.20 132.00 1q3g s ILE 182 Ca 0.01 -0.65 -0.17 0.00 0.00 0.00 0.00 60.65 59.83 1q3g s ILE 182 Cb -0.13 -3.63 -0.07 0.00 0.01 0.00 0.00 42.46 38.64 1q3g s ILE 182 CO -0.05 -0.17 0.58 -1.61 0.00 0.00 0.00 174.94 173.68 1q3g s GLU 183 N 1.62 4.12 -1.35 2.79 0.41 0.54 -1.59 118.70 125.23 1q3g s GLU 183 Ca 0.04 0.66 -0.07 0.00 -0.41 0.00 0.00 54.97 55.18 1q3g s GLU 183 Cb -0.19 -3.08 0.02 0.00 -1.78 0.00 0.00 34.13 29.10 1q3g s GLU 183 CO 0.08 0.55 1.11 -1.71 -0.49 0.00 0.00 175.26 174.80 1q3g n ASN 184 N 1.25 -5.16 -4.82 -0.19 5.15 0.13 -1.66 115.26 109.97 1q3g n ASN 184 Ca -0.07 -0.60 -0.32 0.00 -0.60 0.00 0.00 54.58 52.99 1q3g n ASN 184 Cb 0.51 -4.88 0.03 0.00 -0.53 0.00 0.00 39.78 34.91 1q3g n ASN 184 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1q3g s ALA 185 N -3.34 2.75 0.31 5.20 0.00 -0.86 -4.60 121.76 121.22 1q3g s ALA 185 Ca 0.46 0.21 -0.28 0.00 0.00 0.00 0.00 51.96 52.35 1q3g s ALA 185 Cb -0.21 -3.19 -0.09 0.00 0.00 0.00 0.00 23.12 19.63 1q3g s ALA 185 CO 0.75 -0.96 1.13 0.00 0.00 0.00 0.00 175.76 176.67 1q3g s ALA 186 N -2.78 3.36 -2.97 0.00 0.00 -1.26 -4.49 121.76 113.62 1q3g s ALA 186 Ca 0.60 0.93 0.24 0.00 0.00 0.00 0.00 51.96 53.74 1q3g s ALA 186 Cb -0.14 -3.35 0.23 0.00 0.00 0.00 0.00 23.12 19.86 1q3g s ALA 186 CO 0.46 -0.27 1.28 0.54 0.00 0.00 0.00 175.76 177.77 1q3g n ARG 187 N 0.89 2.31 -1.36 0.00 3.00 -1.26 -4.64 116.66 115.60 1q3g n ARG 187 Ca 0.00 -1.91 -0.44 0.00 -0.01 0.00 0.00 57.85 55.49 1q3g n ARG 187 Cb 0.45 -1.46 -0.01 0.00 0.00 0.00 0.00 32.46 31.44 1q3g n ARG 187 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1q3g n GLU 188 N 1.31 0.10 -0.07 5.56 4.71 -1.26 -4.53 120.64 126.47 1q3g n GLU 188 Ca 0.14 0.04 0.12 0.00 -0.01 0.00 0.00 57.16 57.45 1q3g n GLU 188 Cb 0.59 -1.08 0.51 0.00 -1.01 0.00 0.00 31.44 30.45 1q3g n GLU 188 CO 0.00 0.00 0.00 -1.35 0.09 0.00 0.00 177.13 175.87 1q3g h PRO 189 N 0.68 0.38 -0.11 3.49 0.11 -1.96 -0.09 132.00 134.51 1q3g h PRO 189 Ca -0.34 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.69 1q3g h PRO 189 Cb 1.44 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.45 1q3g h PRO 189 CO 0.52 0.25 -0.20 0.93 -0.21 0.00 0.00 178.00 179.29 1q3g h GLU 190 N 0.39 0.18 -0.42 1.05 3.07 -1.88 -0.33 114.58 116.65 1q3g h GLU 190 Ca 0.26 -0.05 -0.07 0.00 -0.50 0.00 0.00 59.36 59.01 1q3g h GLU 190 Cb 0.51 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.38 1q3g h GLU 190 CO -0.07 0.38 0.01 0.82 -1.40 0.00 0.00 179.01 178.75 1q3g h ILE 191 N 0.17 1.26 -0.52 3.13 1.08 -1.33 0.10 117.51 121.40 1q3g h ILE 191 Ca 0.03 -1.01 -0.01 0.00 -0.39 0.00 0.00 64.86 63.48 1q3g h ILE 191 Cb 0.45 1.08 -0.02 0.00 -3.07 0.00 0.00 36.82 35.26 1q3g h ILE 191 CO 0.03 0.35 0.27 0.58 -0.69 0.00 0.00 178.15 178.69 1q3g h VAL 192 N 0.58 1.19 -0.55 1.67 2.07 -1.20 -0.17 116.25 119.84 1q3g h VAL 192 Ca 0.12 -0.50 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 1q3g h VAL 192 Cb 0.47 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1q3g h VAL 192 CO 0.02 0.20 0.17 -0.78 0.02 0.00 0.00 177.57 177.21 1q3g h ASP 193 N 0.69 0.79 -0.55 0.57 3.58 -0.75 -0.70 116.42 120.05 1q3g h ASP 193 Ca 0.18 -0.20 -0.09 0.00 0.42 0.00 0.00 57.03 57.33 1q3g h ASP 193 Cb 0.08 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 1q3g h ASP 193 CO -0.03 0.79 -0.01 0.74 -2.88 0.00 0.00 179.24 177.85 1q3g h THR 194 N 0.76 1.26 -0.11 2.25 2.02 -0.59 -1.52 112.91 116.98 1q3g h THR 194 Ca 0.18 -1.14 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 1q3g h THR 194 Cb 0.28 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 1q3g h THR 194 CO -0.01 0.41 0.06 0.00 0.37 0.00 0.00 175.52 176.36 1q3g h ALA 195 N 1.05 0.14 0.00 6.16 0.00 -0.69 -1.57 119.26 124.35 1q3g h ALA 195 Ca 0.16 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1q3g h ALA 195 Cb 0.55 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1q3g h ALA 195 CO 0.03 -0.35 -0.21 -0.91 0.00 0.00 0.00 179.25 177.81 1q3g h ASN 196 N 0.10 0.00 -0.14 0.00 2.35 -0.97 0.16 115.58 117.09 1q3g h ASN 196 Ca 0.04 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.76 1q3g h ASN 196 Cb 0.04 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.40 1q3g h ASN 196 CO -0.01 0.21 -0.01 0.15 -1.65 0.00 0.00 177.43 176.13 1q3g h PHE 197 N 0.00 0.27 -0.71 1.19 3.57 -0.86 -1.33 116.94 119.07 1q3g h PHE 197 Ca -0.00 -0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.47 1q3g h PHE 197 Cb 0.37 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.01 1q3g h PHE 197 CO 0.00 0.49 0.46 -0.07 -2.23 0.00 0.00 178.31 176.96 1q3g h LEU 198 N -0.03 0.79 -1.47 0.59 3.38 -0.52 -1.28 115.31 116.77 1q3g h LEU 198 Ca 0.04 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1q3g h LEU 198 Cb 0.39 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1q3g h LEU 198 CO 0.01 0.56 0.17 0.58 0.09 0.00 0.00 178.44 179.85 1q3g h VAL 199 N 0.93 1.14 0.00 1.22 2.07 -0.86 -0.58 116.25 120.17 1q3g h VAL 199 Ca 0.27 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 67.33 1q3g h VAL 199 Cb -0.06 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 1q3g h VAL 199 CO -0.08 0.16 -0.30 0.00 0.02 0.00 0.00 177.57 177.37 1q3g h ALA 200 N 1.66 1.36 -0.00 1.67 0.00 -0.06 -1.58 119.26 122.31 1q3g h ALA 200 Ca 0.13 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1q3g h ALA 200 Cb 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1q3g h ALA 200 CO -0.02 0.38 -0.06 1.28 0.00 0.00 0.00 179.25 180.84 1q3g n LEU 201 N -3.98 0.33 0.00 0.00 4.77 -0.40 -4.82 117.00 112.90 1q3g n LEU 201 Ca -0.02 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1q3g n LEU 201 Cb 0.37 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1q3g n LEU 201 CO 0.37 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1q3g n GLY 202 N 1.23 1.01 3.74 -0.72 0.00 -0.59 -0.55 105.19 109.31 1q3g n GLY 202 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1q3g n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3g s ALA 203 N -2.00 2.11 -0.36 4.61 0.00 -0.36 -4.95 121.76 120.81 1q3g s ALA 203 Ca 0.00 0.44 -0.01 0.00 0.00 0.00 0.00 51.96 52.39 1q3g s ALA 203 Cb 0.00 -3.34 0.09 0.00 0.00 0.00 0.00 23.12 19.87 1q3g s ALA 203 CO 0.00 -1.91 0.12 0.15 0.00 0.00 0.00 175.76 174.12 1q3g s LYS 204 N -4.62 2.03 0.02 0.00 1.02 -1.26 -4.26 119.74 112.68 1q3g s LYS 204 Ca 0.65 -1.67 0.03 0.00 0.02 0.00 0.00 55.97 54.99 1q3g s LYS 204 Cb -0.20 -3.40 -0.01 0.00 -0.52 0.00 0.00 37.83 33.70 1q3g s LYS 204 CO 0.53 -0.92 -0.08 0.42 -0.92 0.00 0.00 175.35 174.38 1q3g s ILE 205 N 1.13 0.63 0.04 2.17 1.01 -1.26 -1.52 121.20 123.40 1q3g s ILE 205 Ca 0.05 -0.70 -0.12 0.00 0.00 0.00 0.00 60.65 59.87 1q3g s ILE 205 Cb -0.21 -0.60 0.01 0.00 0.01 0.00 0.00 42.46 41.67 1q3g s ILE 205 CO -0.04 -0.07 0.26 -0.94 0.00 0.00 0.00 174.94 174.15 1q3g s SER 206 N -0.85 -0.07 0.00 3.58 1.04 -0.55 -4.90 113.70 111.95 1q3g s SER 206 Ca -0.02 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.18 1q3g s SER 206 Cb -0.06 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.38 1q3g s SER 206 CO 0.00 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.26 1q3g n GLY 207 N 0.71 0.95 3.64 7.32 0.00 -1.26 -0.71 105.19 115.84 1q3g n GLY 207 Ca -0.19 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.36 1q3g n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3g n GLN 208 N -2.00 1.78 0.00 1.61 0.00 -1.26 -0.24 117.38 117.27 1q3g n GLN 208 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 57.00 57.64 1q3g n GLN 208 Cb 0.00 -2.30 0.00 0.00 0.00 0.00 0.00 30.24 27.94 1q3g n GLN 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1q3g n GLY 209 N 2.56 2.10 3.87 2.61 0.00 -1.26 -4.90 105.19 110.17 1q3g n GLY 209 Ca 0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 1q3g n GLY 209 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1q3g s THR 210 N -2.51 1.68 -1.56 2.61 -4.23 0.67 -4.75 115.64 107.55 1q3g s THR 210 Ca 0.00 -1.57 0.06 0.00 -1.18 0.00 0.00 61.69 58.99 1q3g s THR 210 Cb 0.00 -2.25 0.21 0.00 1.34 0.00 0.00 72.50 71.80 1q3g s THR 210 CO 0.00 0.00 1.06 -0.90 -0.54 0.00 0.00 174.62 174.24 1q3g n ASP 211 N -1.64 1.63 -3.57 3.99 5.68 -1.26 -4.57 116.55 116.81 1q3g n ASP 211 Ca -0.04 -2.10 -0.24 0.00 -0.50 0.00 0.00 54.79 51.91 1q3g n ASP 211 Cb 0.65 -0.30 -0.16 0.00 -1.14 0.00 0.00 41.12 40.17 1q3g n ASP 211 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 1q3g s ARG 212 N -1.64 0.11 -0.16 0.11 3.52 -1.25 0.21 118.95 119.84 1q3g s ARG 212 Ca 0.15 -0.04 -0.05 0.00 -0.13 0.00 0.00 55.73 55.67 1q3g s ARG 212 Cb 0.09 -1.61 -0.03 0.00 -1.56 0.00 0.00 34.95 31.84 1q3g s ARG 212 CO 0.08 -0.69 -0.01 0.42 -0.81 0.00 0.00 175.30 174.29 1q3g s ILE 213 N 2.19 4.15 -0.17 4.11 1.01 -0.62 -4.44 121.20 127.42 1q3g s ILE 213 Ca 0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 60.65 60.40 1q3g s ILE 213 Cb -0.16 -2.83 -0.01 0.00 0.01 0.00 0.00 42.46 39.47 1q3g s ILE 213 CO -0.12 0.49 -0.09 -0.89 0.00 0.00 0.00 174.94 174.33 1q3g s THR 214 N 0.33 3.22 -0.09 2.92 2.01 0.11 -0.08 115.64 124.06 1q3g s THR 214 Ca -0.02 -0.57 0.04 0.00 0.31 0.00 0.00 61.69 61.44 1q3g s THR 214 Cb -0.14 -2.41 0.00 0.00 0.01 0.00 0.00 72.50 69.97 1q3g s THR 214 CO 0.02 0.48 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.59 1q3g s ILE 215 N 0.90 1.78 -0.32 1.82 1.09 0.54 -1.48 121.20 125.53 1q3g s ILE 215 Ca -0.02 -0.86 -0.04 0.00 -1.10 0.00 0.00 60.65 58.63 1q3g s ILE 215 Cb -0.15 -1.56 0.05 0.00 -1.06 0.00 0.00 42.46 39.74 1q3g s ILE 215 CO 0.00 0.50 0.06 -0.70 -0.10 0.00 0.00 174.94 174.70 1q3g s GLU 216 N 0.41 2.51 0.75 2.79 2.12 -0.57 0.55 118.70 127.26 1q3g s GLU 216 Ca -0.17 -1.25 -0.16 0.00 0.36 0.00 0.00 54.97 53.76 1q3g s GLU 216 Cb -0.17 -3.34 -0.01 0.00 0.26 0.00 0.00 34.13 30.88 1q3g s GLU 216 CO 0.07 -0.66 0.74 0.41 -0.54 0.00 0.00 175.26 175.28 1q3g n GLY 217 N 4.72 -1.03 3.28 -1.50 0.00 -0.16 -4.11 105.19 106.38 1q3g n GLY 217 Ca -0.12 -0.40 -0.15 0.00 0.00 0.00 0.00 46.02 45.34 1q3g n GLY 217 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1q3g s VAL 218 N -1.93 0.74 0.14 1.61 -7.23 -0.08 -4.72 120.40 108.93 1q3g s VAL 218 Ca 0.68 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.72 1q3g s VAL 218 Cb -0.33 -2.27 0.02 0.00 0.56 0.00 0.00 36.38 34.36 1q3g s VAL 218 CO 0.55 -0.35 1.63 -0.33 -0.31 0.00 0.00 175.10 176.29 1q3g h GLU 219 N 2.59 0.78 -3.28 4.82 5.08 -1.90 -3.40 114.58 119.26 1q3g h GLU 219 Ca -0.37 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 57.75 1q3g h GLU 219 Cb 1.22 -0.09 -0.11 0.00 0.50 0.00 0.00 28.75 30.26 1q3g h GLU 219 CO 0.63 0.78 0.03 -0.98 -1.00 0.00 0.00 179.01 178.46 1q3g s ARG 220 N -5.22 1.26 -0.05 2.33 1.70 -1.26 -4.99 118.95 112.71 1q3g s ARG 220 Ca -0.13 -0.75 0.03 0.00 -0.47 0.00 0.00 55.73 54.41 1q3g s ARG 220 Cb 0.11 0.52 -0.03 0.00 -0.57 0.00 0.00 34.95 34.98 1q3g s ARG 220 CO 0.79 -0.52 -0.12 -0.51 -1.08 0.00 0.00 175.30 173.86 1q3g s LEU 221 N -2.83 2.90 0.00 -1.89 1.43 -1.26 -4.88 118.68 112.15 1q3g s LEU 221 Ca 0.06 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 1q3g s LEU 221 Cb -0.00 -1.61 0.00 0.00 0.03 0.00 0.00 46.19 44.61 1q3g s LEU 221 CO -0.08 0.34 0.00 0.61 0.23 0.00 0.00 176.35 177.46 1q3g n GLY 222 N 2.20 0.70 0.00 -3.19 0.00 0.29 -1.31 105.19 103.89 1q3g n GLY 222 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1q3g n GLY 222 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3g n GLY 223 N 5.00 4.17 0.00 -0.02 0.00 -1.26 -2.30 105.19 110.78 1q3g n GLY 223 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1q3g n GLY 223 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3g n GLY 224 N 0.00 -0.05 2.98 -0.02 0.00 -1.13 -4.51 105.19 102.46 1q3g n GLY 224 Ca 0.00 -1.54 -0.24 0.00 0.00 0.00 0.00 46.02 44.24 1q3g n GLY 224 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q3g s VAL 225 N -2.68 1.01 -0.01 1.61 1.01 -1.26 -1.22 120.40 118.86 1q3g s VAL 225 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1q3g s VAL 225 Cb 0.00 -0.95 0.01 0.00 0.00 0.00 0.00 36.38 35.44 1q3g s VAL 225 CO 0.00 0.33 -0.00 -0.47 0.00 0.00 0.00 175.10 174.96 1q3g s TYR 226 N 0.84 0.18 -0.27 5.22 5.04 -0.48 -5.01 117.35 122.86 1q3g s TYR 226 Ca -0.12 0.01 -0.10 0.00 -2.44 0.00 0.00 57.07 54.42 1q3g s TYR 226 Cb -0.15 -0.21 -0.04 0.00 0.35 0.00 0.00 41.96 41.90 1q3g s TYR 226 CO 0.02 -0.05 0.15 0.50 -1.34 0.00 0.00 175.55 174.83 1q3g s ARG 227 N 0.45 3.87 0.40 4.97 3.52 -1.26 0.08 118.95 130.97 1q3g s ARG 227 Ca -0.04 -0.37 -0.27 0.00 -0.13 0.00 0.00 55.73 54.93 1q3g s ARG 227 Cb -0.06 -3.56 -0.09 0.00 -1.56 0.00 0.00 34.95 29.67 1q3g s ARG 227 CO -0.01 -0.18 1.40 0.08 -0.81 0.00 0.00 175.30 175.78 1q3g s VAL 228 N 1.71 2.28 0.84 7.11 1.01 -0.45 -4.94 120.40 127.96 1q3g s VAL 228 Ca 0.07 0.26 -0.11 0.00 0.00 0.00 0.00 61.98 62.20 1q3g s VAL 228 Cb -0.16 -3.16 0.09 0.00 0.00 0.00 0.00 36.38 33.16 1q3g s VAL 228 CO 0.09 0.05 1.09 -1.48 0.00 0.00 0.00 175.10 174.85 1q3g s LEU 229 N -2.35 2.50 0.65 3.92 2.34 -1.26 -4.71 118.68 119.77 1q3g s LEU 229 Ca 0.56 1.44 -0.18 0.00 0.06 0.00 0.00 54.13 56.01 1q3g s LEU 229 Cb -0.43 -3.98 -0.01 0.00 -0.56 0.00 0.00 46.19 41.21 1q3g s LEU 229 CO 0.56 -2.26 1.29 -2.84 -1.06 0.00 0.00 176.35 172.04 1q3g s PRO 230 N -5.03 2.56 -0.60 1.48 0.02 -1.26 -0.47 135.00 131.70 1q3g s PRO 230 Ca 0.62 2.06 -0.27 0.00 0.02 0.00 0.00 61.00 63.43 1q3g s PRO 230 Cb -0.16 -1.85 0.03 0.00 0.02 0.00 0.00 34.50 32.55 1q3g s PRO 230 CO 0.56 -1.59 1.14 0.34 -0.33 0.00 0.00 177.00 177.11 1q3g s ASP 231 N -1.40 6.36 0.46 2.53 -1.08 -0.67 -4.21 116.67 118.66 1q3g s ASP 231 Ca 0.82 -0.15 0.18 0.00 -0.52 0.00 0.00 52.55 52.89 1q3g s ASP 231 Cb -0.37 -2.52 1.11 0.00 -1.46 0.00 0.00 42.92 39.68 1q3g s ASP 231 CO 0.39 -1.48 2.00 0.08 0.52 0.00 0.00 175.17 176.69 1q3g h ARG 232 N 9.57 0.00 -0.07 4.34 0.11 -1.91 -2.05 114.38 124.37 1q3g h ARG 232 Ca -0.26 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 59.60 1q3g h ARG 232 Cb 1.06 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.15 1q3g h ARG 232 CO 1.18 0.18 -0.85 0.82 0.10 0.00 0.00 179.97 181.40 1q3g h ILE 233 N 0.00 1.33 -0.40 0.08 1.08 -1.95 0.24 117.51 117.88 1q3g h ILE 233 Ca -0.00 -2.18 -0.03 0.00 -0.39 0.00 0.00 64.86 62.26 1q3g h ILE 233 Cb 0.36 2.19 -0.02 0.00 -3.07 0.00 0.00 36.82 36.28 1q3g h ILE 233 CO 0.02 0.67 0.15 -0.08 -0.69 0.00 0.00 178.15 178.22 1q3g h GLU 234 N 0.37 0.61 -0.07 2.37 4.81 -1.86 0.68 114.58 121.49 1q3g h GLU 234 Ca -0.07 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 59.07 1q3g h GLU 234 Cb 1.47 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.73 1q3g h GLU 234 CO 0.16 0.59 -0.08 1.15 -0.73 0.00 0.00 179.01 180.10 1q3g h THR 235 N 0.51 0.76 -0.52 0.32 2.02 -1.27 -1.45 112.91 113.28 1q3g h THR 235 Ca 0.13 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.32 1q3g h THR 235 Cb 0.22 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 1q3g h THR 235 CO -0.01 0.00 0.35 1.23 0.37 0.00 0.00 175.52 177.46 1q3g h GLY 236 N -0.11 0.73 0.95 2.16 0.00 -0.62 -0.89 103.07 105.29 1q3g h GLY 236 Ca 0.06 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.07 1q3g h GLY 236 CO -0.14 0.27 0.10 -0.84 0.00 0.00 0.00 176.54 175.93 1q3g h THR 237 N 0.71 1.24 -0.04 4.70 2.02 -0.02 -1.24 112.91 120.28 1q3g h THR 237 Ca 0.19 -0.83 -0.15 0.00 0.77 0.00 0.00 66.41 66.39 1q3g h THR 237 Cb -0.08 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 1q3g h THR 237 CO -0.04 0.29 -0.67 -0.26 0.37 0.00 0.00 175.52 175.21 1q3g h PHE 238 N 0.57 0.24 -0.54 3.16 -1.00 -0.84 -0.82 116.94 117.71 1q3g h PHE 238 Ca 0.14 -0.10 -0.07 0.00 2.81 0.00 0.00 57.97 60.74 1q3g h PHE 238 Cb 0.33 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.83 1q3g h PHE 238 CO 0.02 0.80 0.04 -0.07 -1.61 0.00 0.00 178.31 177.49 1q3g h LEU 239 N 0.13 0.86 -0.73 1.54 3.38 -1.02 -1.99 115.31 117.48 1q3g h LEU 239 Ca -0.01 -0.20 -0.13 0.00 0.09 0.00 0.00 57.88 57.63 1q3g h LEU 239 Cb 1.20 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1q3g h LEU 239 CO 0.10 0.89 -0.40 0.58 0.09 0.00 0.00 178.44 179.70 1q3g h VAL 240 N 0.84 1.30 -0.66 1.22 2.07 -0.99 -1.58 116.25 118.44 1q3g h VAL 240 Ca 0.17 -1.55 0.09 0.00 0.82 0.00 0.00 66.70 66.22 1q3g h VAL 240 Cb 0.44 1.57 -0.07 0.00 -1.52 0.00 0.00 31.29 31.71 1q3g h VAL 240 CO 0.02 0.49 0.30 0.00 0.02 0.00 0.00 177.57 178.40 1q3g h ALA 241 N 1.15 0.89 -0.05 1.67 0.00 -0.43 -0.71 119.26 121.78 1q3g h ALA 241 Ca 0.04 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1q3g h ALA 241 Cb 0.88 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1q3g h ALA 241 CO 0.08 -0.10 -0.11 0.00 0.00 0.00 0.00 179.25 179.12 1q3g h ALA 242 N 1.42 0.08 -0.67 0.00 0.00 -1.16 -3.13 119.26 115.80 1q3g h ALA 242 Ca 0.33 -0.33 0.15 0.00 0.00 0.00 0.00 54.91 55.06 1q3g h ALA 242 Cb 0.36 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1q3g h ALA 242 CO -0.28 -0.05 0.46 0.00 0.00 0.00 0.00 179.25 179.39 1q3g h ALA 243 N 0.47 2.26 -0.01 0.00 0.00 -0.68 -1.25 119.26 120.06 1q3g h ALA 243 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1q3g h ALA 243 Cb 0.69 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1q3g h ALA 243 CO 0.02 -0.45 -0.37 0.44 0.00 0.00 0.00 179.25 178.90 1q3g n ILE 244 N -4.44 0.00 -0.66 0.00 -5.35 -0.33 -4.09 119.36 104.50 1q3g n ILE 244 Ca 0.13 -0.14 0.06 0.00 -0.27 0.00 0.00 62.75 62.53 1q3g n ILE 244 Cb 0.56 0.63 0.12 0.00 -1.74 0.00 0.00 39.64 39.21 1q3g n ILE 244 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1q3g n SER 245 N -0.61 2.60 -0.13 7.28 3.41 -0.52 -4.95 113.62 120.70 1q3g n SER 245 Ca 0.10 -2.65 -0.02 0.00 -0.26 0.00 0.00 58.87 56.05 1q3g n SER 245 Cb 0.38 -0.31 -0.01 0.00 -0.26 0.00 0.00 64.21 64.01 1q3g n SER 245 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1q3g n GLY 246 N -0.78 0.23 0.00 5.00 0.00 -0.93 -4.34 105.19 104.37 1q3g n GLY 246 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1q3g n GLY 246 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3g n GLY 247 N 0.34 -0.08 2.98 -0.02 0.00 -0.89 -1.65 105.19 105.88 1q3g n GLY 247 Ca -0.02 -1.83 -0.14 0.00 0.00 0.00 0.00 46.02 44.03 1q3g n GLY 247 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1q3g s LYS 248 N -2.54 0.42 0.06 1.61 2.20 -1.25 -1.25 119.74 118.99 1q3g s LYS 248 Ca 0.00 -0.36 -0.15 0.00 -0.36 0.00 0.00 55.97 55.10 1q3g s LYS 248 Cb 0.00 -0.33 0.02 0.00 -1.51 0.00 0.00 37.83 36.02 1q3g s LYS 248 CO 0.00 0.08 0.34 -1.50 -0.36 0.00 0.00 175.35 173.91 1q3g s ILE 249 N -0.54 0.08 -0.09 5.43 2.07 0.11 -1.45 121.20 126.82 1q3g s ILE 249 Ca -0.02 -0.65 0.01 0.00 -1.41 0.00 0.00 60.65 58.58 1q3g s ILE 249 Cb -0.05 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.56 1q3g s ILE 249 CO -0.00 -0.36 -0.09 -0.69 -1.91 0.00 0.00 174.94 171.89 1q3g s VAL 250 N -2.81 1.03 -0.27 4.00 1.01 -0.60 -0.58 120.40 122.18 1q3g s VAL 250 Ca -0.03 -0.35 -0.12 0.00 0.00 0.00 0.00 61.98 61.49 1q3g s VAL 250 Cb -0.00 -1.00 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 1q3g s VAL 250 CO -0.05 0.35 0.22 0.00 0.00 0.00 0.00 175.10 175.62 1q3g s ARG 252 N 1.71 3.52 -1.24 0.00 1.81 0.45 -2.16 118.95 123.05 1q3g s ARG 252 Ca 0.08 -0.32 -0.06 0.00 -1.72 0.00 0.00 55.73 53.71 1q3g s ARG 252 Cb -0.16 -2.76 0.01 0.00 -0.45 0.00 0.00 34.95 31.59 1q3g s ARG 252 CO 0.10 0.29 0.81 0.09 -0.68 0.00 0.00 175.30 175.92 1q3g n ASN 253 N -1.14 -5.67 -4.94 0.23 4.13 -0.85 -1.00 115.26 106.02 1q3g n ASN 253 Ca -0.05 -0.37 -0.20 0.00 1.68 0.00 0.00 54.58 55.65 1q3g n ASN 253 Cb 0.55 -4.38 -0.01 0.00 -1.54 0.00 0.00 39.78 34.40 1q3g n ASN 253 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1q3g s ALA 254 N -3.20 4.13 -0.44 5.41 0.00 -0.17 -4.51 121.76 122.97 1q3g s ALA 254 Ca 0.40 -1.57 0.02 0.00 0.00 0.00 0.00 51.96 50.82 1q3g s ALA 254 Cb -0.18 -1.47 0.15 0.00 0.00 0.00 0.00 23.12 21.62 1q3g s ALA 254 CO 0.50 -0.05 0.29 -1.14 0.00 0.00 0.00 175.76 175.35 1q3g s GLN 255 N -4.13 1.15 0.31 0.00 0.74 -1.26 -4.08 119.66 112.39 1q3g s GLN 255 Ca 0.45 -2.03 0.06 0.00 0.05 0.00 0.00 55.36 53.89 1q3g s GLN 255 Cb -0.08 -1.98 0.85 0.00 1.10 0.00 0.00 33.01 32.91 1q3g s GLN 255 CO 0.30 -1.25 1.62 -1.35 -0.55 0.00 0.00 175.29 174.06 1q3g h PRO 256 N 6.36 0.14 0.00 1.67 0.11 -1.86 -2.32 132.00 136.11 1q3g h PRO 256 Ca 0.10 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1q3g h PRO 256 Cb 0.91 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1q3g h PRO 256 CO 0.43 0.10 0.00 -0.40 -0.21 0.00 0.00 178.00 177.91 1q3g n ASP 257 N -5.27 0.00 -0.80 -2.05 3.85 -1.26 -1.28 116.55 109.74 1q3g n ASP 257 Ca 0.25 0.40 0.12 0.00 -0.71 0.00 0.00 54.79 54.85 1q3g n ASP 257 Cb 0.82 -0.42 0.29 0.00 -1.35 0.00 0.00 41.12 40.46 1q3g n ASP 257 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1q3g n THR 258 N -1.42 0.15 -1.84 2.12 -2.24 -0.87 -4.34 114.28 105.84 1q3g n THR 258 Ca 0.01 -0.46 0.05 0.00 -2.27 0.00 0.00 64.05 61.38 1q3g n THR 258 Cb 0.04 0.91 0.10 0.00 -2.10 0.00 0.00 70.33 69.27 1q3g n THR 258 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1q3g n LEU 259 N 0.87 1.58 -0.13 3.22 4.77 -0.40 -4.89 117.00 122.02 1q3g n LEU 259 Ca 0.17 -2.58 -0.05 0.00 -0.03 0.00 0.00 56.01 53.52 1q3g n LEU 259 Cb 0.49 -0.24 0.01 0.00 -2.33 0.00 0.00 43.42 41.35 1q3g n LEU 259 CO 0.15 0.76 0.73 0.44 -1.33 0.00 0.00 177.39 178.14 1q3g h ASP 260 N 0.59 -0.61 -0.30 -1.43 3.32 -1.76 0.63 116.42 116.86 1q3g h ASP 260 Ca -0.07 0.15 0.02 0.00 0.02 0.00 0.00 57.03 57.15 1q3g h ASP 260 Cb 1.35 0.34 -0.02 0.00 0.22 0.00 0.00 39.33 41.22 1q3g h ASP 260 CO 0.03 -0.21 0.15 0.00 -1.72 0.00 0.00 179.24 177.49 1q3g h ALA 261 N 1.23 0.37 -0.22 3.45 0.00 -1.88 -0.48 119.26 121.73 1q3g h ALA 261 Ca 0.20 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1q3g h ALA 261 Cb 0.41 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1q3g h ALA 261 CO -0.48 -0.23 0.09 0.28 0.00 0.00 0.00 179.25 178.91 1q3g h VAL 262 N 0.32 1.16 -0.64 0.00 2.07 -1.75 -1.63 116.25 115.79 1q3g h VAL 262 Ca 0.12 -0.50 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 1q3g h VAL 262 Cb 0.03 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 1q3g h VAL 262 CO -0.08 0.16 0.28 -0.07 0.02 0.00 0.00 177.57 177.88 1q3g h LEU 263 N 0.21 0.84 -0.64 2.57 3.38 -0.76 -0.32 115.31 120.59 1q3g h LEU 263 Ca 0.07 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 1q3g h LEU 263 Cb 0.17 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1q3g h LEU 263 CO -0.01 0.74 0.20 0.00 0.09 0.00 0.00 178.44 179.46 1q3g h ALA 264 N 1.39 0.84 -0.31 1.53 0.00 -0.87 -1.45 119.26 120.39 1q3g h ALA 264 Ca 0.22 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1q3g h ALA 264 Cb 0.15 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1q3g h ALA 264 CO -0.02 0.52 -0.30 -0.22 0.00 0.00 0.00 179.25 179.22 1q3g h LYS 265 N 0.93 0.66 -0.43 0.00 1.63 -0.76 -1.80 116.57 116.80 1q3g h LYS 265 Ca 0.21 -0.29 -0.09 0.00 -0.85 0.00 0.00 60.65 59.62 1q3g h LYS 265 Cb 0.30 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.89 1q3g h LYS 265 CO -0.01 0.88 -0.12 -0.07 -3.45 0.00 0.00 179.45 176.69 1q3g h LEU 266 N 0.57 0.77 -0.65 5.20 3.38 -0.80 -1.57 115.31 122.20 1q3g h LEU 266 Ca 0.07 -0.23 -0.10 0.00 0.09 0.00 0.00 57.88 57.71 1q3g h LEU 266 Cb 0.80 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1q3g h LEU 266 CO 0.07 0.90 -0.01 0.03 0.09 0.00 0.00 178.44 179.53 1q3g h ARG 267 N 0.70 1.05 0.00 1.13 3.08 -1.00 -1.28 114.38 118.06 1q3g h ARG 267 Ca 0.12 -0.33 -0.01 0.00 0.07 0.00 0.00 59.98 59.82 1q3g h ARG 267 Cb 0.60 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.55 1q3g h ARG 267 CO 0.04 1.02 -0.07 0.93 -1.07 0.00 0.00 179.97 180.82 1q3g h GLU 268 N 0.96 0.00 -0.00 0.04 5.08 -0.87 0.11 114.58 119.89 1q3g h GLU 268 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1q3g h GLU 268 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1q3g h GLU 268 CO 0.03 0.07 -0.02 0.00 -1.00 0.00 0.00 179.01 178.09 1q3g n ALA 269 N -2.48 2.43 0.00 3.43 0.00 -0.58 -4.76 120.51 118.55 1q3g n ALA 269 Ca -0.03 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1q3g n ALA 269 Cb 0.15 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1q3g n ALA 269 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q3g n GLY 270 N 1.41 1.11 3.78 0.00 0.00 0.38 -0.08 105.19 111.79 1q3g n GLY 270 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 1q3g n GLY 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3g s ALA 271 N -2.00 3.20 -0.50 4.61 0.00 -0.60 -4.88 121.76 121.59 1q3g s ALA 271 Ca 0.00 0.61 -0.17 0.00 0.00 0.00 0.00 51.96 52.40 1q3g s ALA 271 Cb 0.00 -3.22 0.07 0.00 0.00 0.00 0.00 23.12 19.97 1q3g s ALA 271 CO 0.00 0.04 0.51 0.34 0.00 0.00 0.00 175.76 176.65 1q3g s ASP 272 N -1.52 6.18 -0.07 0.00 2.15 -0.34 -4.40 116.67 118.68 1q3g s ASP 272 Ca 0.51 -1.19 0.03 0.00 0.43 0.00 0.00 52.55 52.34 1q3g s ASP 272 Cb -0.21 -2.24 -0.02 0.00 -0.30 0.00 0.00 42.92 40.15 1q3g s ASP 272 CO 0.27 -0.79 -0.14 -0.63 -0.17 0.00 0.00 175.17 173.72 1q3g s ILE 273 N 2.11 3.11 0.06 4.11 1.01 -1.26 -1.12 121.20 129.22 1q3g s ILE 273 Ca 0.09 -0.70 0.03 0.00 0.00 0.00 0.00 60.65 60.07 1q3g s ILE 273 Cb -0.22 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.98 1q3g s ILE 273 CO 0.09 0.58 -0.09 -1.61 0.00 0.00 0.00 174.94 173.90 1q3g s GLU 274 N -0.54 0.66 0.08 2.79 2.02 -0.67 -5.00 118.70 118.05 1q3g s GLU 274 Ca 0.07 -0.92 0.03 0.00 0.02 0.00 0.00 54.97 54.17 1q3g s GLU 274 Cb -0.12 -0.42 -0.04 0.00 0.10 0.00 0.00 34.13 33.66 1q3g s GLU 274 CO 0.01 0.07 -0.08 0.95 0.02 0.00 0.00 175.26 176.24 1q3g s THR 275 N -1.76 0.75 0.00 3.63 -4.23 -1.26 -0.64 115.64 112.13 1q3g s THR 275 Ca -0.04 -1.62 0.00 0.00 -1.18 0.00 0.00 61.69 58.85 1q3g s THR 275 Cb -0.07 -1.30 0.00 0.00 1.34 0.00 0.00 72.50 72.46 1q3g s THR 275 CO 0.00 -0.64 0.00 0.61 -0.54 0.00 0.00 174.62 174.05 1q3g n GLY 276 N 0.54 6.25 0.26 3.99 0.00 0.56 -4.99 105.19 111.80 1q3g n GLY 276 Ca -0.16 -1.88 -0.10 0.00 0.00 0.00 0.00 46.02 43.88 1q3g n GLY 276 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1q3g h GLU 277 N 0.00 0.90 -0.12 1.61 4.57 -2.01 -3.36 114.58 116.16 1q3g h GLU 277 Ca 0.00 -0.29 -0.19 0.00 -1.18 0.00 0.00 59.36 57.70 1q3g h GLU 277 Cb 0.00 -0.08 -0.37 0.00 -0.16 0.00 0.00 28.75 28.14 1q3g h GLU 277 CO 0.00 0.93 -1.02 -0.40 -1.18 0.00 0.00 179.01 177.34 1q3g n ASP 278 N -4.31 1.27 -3.62 1.04 3.85 -1.26 -4.71 116.55 108.81 1q3g n ASP 278 Ca 0.01 -2.16 -0.12 0.00 -0.71 0.00 0.00 54.79 51.81 1q3g n ASP 278 Cb 0.32 -0.36 -0.05 0.00 -1.35 0.00 0.00 41.12 39.68 1q3g n ASP 278 CO 0.00 0.00 0.00 -1.66 -1.01 0.00 0.00 177.20 174.53 1q3g s TRP 279 N -1.21 -0.30 -0.01 2.11 1.48 -1.26 -1.00 118.94 118.75 1q3g s TRP 279 Ca 0.33 0.18 0.01 0.00 -1.06 0.00 0.00 56.10 55.56 1q3g s TRP 279 Cb 0.37 0.28 0.01 0.00 -1.16 0.00 0.00 33.47 32.97 1q3g s TRP 279 CO -0.13 -0.65 -0.03 0.42 -4.06 0.00 0.00 176.95 172.51 1q3g s ILE 280 N -2.97 0.29 -0.02 0.66 1.01 -0.92 -0.33 121.20 118.93 1q3g s ILE 280 Ca -0.02 -0.10 0.06 0.00 0.00 0.00 0.00 60.65 60.59 1q3g s ILE 280 Cb 0.00 -0.28 -0.02 0.00 0.01 0.00 0.00 42.46 42.17 1q3g s ILE 280 CO -0.06 0.11 -0.21 -0.94 0.00 0.00 0.00 174.94 173.84 1q3g s SER 281 N 0.26 2.45 -0.03 3.58 1.04 0.19 -0.18 113.70 121.01 1q3g s SER 281 Ca -0.03 -0.38 0.01 0.00 0.48 0.00 0.00 55.95 56.04 1q3g s SER 281 Cb -0.06 -0.27 0.02 0.00 0.10 0.00 0.00 66.02 65.81 1q3g s SER 281 CO -0.01 0.26 -0.05 -0.22 0.98 0.00 0.00 173.24 174.21 1q3g s LEU 282 N -0.49 1.48 -0.08 2.42 0.20 0.25 -1.67 118.68 120.79 1q3g s LEU 282 Ca 0.08 -0.12 0.00 0.00 0.69 0.00 0.00 54.13 54.78 1q3g s LEU 282 Cb -0.08 -0.40 0.02 0.00 -0.43 0.00 0.00 46.19 45.30 1q3g s LEU 282 CO -0.01 -0.03 -0.06 -0.62 -0.29 0.00 0.00 176.35 175.35 1q3g s ASP 283 N 0.67 1.77 0.06 3.68 -1.08 -0.28 0.10 116.67 121.60 1q3g s ASP 283 Ca -0.09 -0.22 0.24 0.00 -0.52 0.00 0.00 52.55 51.96 1q3g s ASP 283 Cb -0.12 -0.68 0.33 0.00 -1.46 0.00 0.00 42.92 40.99 1q3g s ASP 283 CO 0.00 -0.10 1.28 0.23 0.52 0.00 0.00 175.17 177.10 1q3g n MET 284 N 4.66 0.19 -3.70 4.34 2.81 -0.38 -1.20 117.12 123.84 1q3g n MET 284 Ca -0.15 0.03 -0.25 0.00 -1.81 0.00 0.00 57.70 55.53 1q3g n MET 284 Cb 0.50 -1.60 0.06 0.00 -0.71 0.00 0.00 33.22 31.47 1q3g n MET 284 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 1q3g n HIS 285 N -1.86 -2.42 -0.91 2.03 8.25 -1.26 -1.15 115.22 117.90 1q3g n HIS 285 Ca 0.04 0.94 0.00 0.00 -0.26 0.00 0.00 57.72 58.44 1q3g n HIS 285 Cb 0.40 -4.59 0.00 0.00 1.12 0.00 0.00 29.99 26.92 1q3g n HIS 285 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1q3g n GLY 286 N -1.70 0.08 3.76 -1.41 0.00 -0.66 -4.96 105.19 100.31 1q3g n GLY 286 Ca -0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 1q3g n GLY 286 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q3g s LYS 287 N -1.56 4.62 0.32 1.61 -0.14 -0.30 -4.84 119.74 119.44 1q3g s LYS 287 Ca 0.00 1.22 -0.28 0.00 -1.36 0.00 0.00 55.97 55.55 1q3g s LYS 287 Cb 0.00 -3.29 -0.09 0.00 -1.68 0.00 0.00 37.83 32.77 1q3g s LYS 287 CO 0.00 0.50 1.13 0.50 -0.76 0.00 0.00 175.35 176.72 1q3g s ARG 288 N -0.92 4.46 0.64 1.68 3.52 -1.26 -4.40 118.95 122.66 1q3g s ARG 288 Ca 0.38 1.83 -0.16 0.00 -0.13 0.00 0.00 55.73 57.65 1q3g s ARG 288 Cb -0.23 -3.03 -0.01 0.00 -1.56 0.00 0.00 34.95 30.12 1q3g s ARG 288 CO 0.27 0.04 1.13 -1.25 -0.81 0.00 0.00 175.30 174.68 1q3g s PRO 289 N -1.73 2.86 -0.06 5.12 0.04 -1.26 -4.85 135.00 135.12 1q3g s PRO 289 Ca 0.48 1.49 -0.14 0.00 0.04 0.00 0.00 61.00 62.87 1q3g s PRO 289 Cb -0.32 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 32.22 1q3g s PRO 289 CO 0.41 -1.22 0.35 0.15 0.04 0.00 0.00 177.00 176.73 1q3g s LYS 290 N -3.88 3.94 0.42 4.56 -0.14 0.88 -0.61 119.74 124.91 1q3g s LYS 290 Ca 0.69 0.27 -0.26 0.00 -1.36 0.00 0.00 55.97 55.32 1q3g s LYS 290 Cb -0.22 -3.27 -0.09 0.00 -1.68 0.00 0.00 37.83 32.56 1q3g s LYS 290 CO 0.38 0.58 1.36 0.00 -0.76 0.00 0.00 175.35 176.91 1q3g n ALA 291 N 2.32 1.71 -2.35 5.17 0.00 -0.47 -4.37 120.51 122.52 1q3g n ALA 291 Ca -0.14 0.27 -0.18 0.00 0.00 0.00 0.00 53.44 53.39 1q3g n ALA 291 Cb 0.53 -2.33 -0.10 0.00 0.00 0.00 0.00 19.45 17.54 1q3g n ALA 291 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1q3g s VAL 292 N -1.18 1.19 -0.15 0.00 -7.23 -1.26 -4.87 120.40 106.90 1q3g s VAL 292 Ca 0.60 -2.06 -0.01 0.00 -1.81 0.00 0.00 61.98 58.70 1q3g s VAL 292 Cb -0.48 -2.35 -0.02 0.00 0.56 0.00 0.00 36.38 34.09 1q3g s VAL 292 CO 0.59 -0.34 -0.10 -0.89 -0.31 0.00 0.00 175.10 174.05 1q3g s THR 293 N -3.31 3.27 0.06 5.32 2.01 -1.26 -2.83 115.64 118.89 1q3g s THR 293 Ca 0.28 -0.57 0.06 0.00 0.31 0.00 0.00 61.69 61.77 1q3g s THR 293 Cb 0.05 -2.41 -0.03 0.00 0.01 0.00 0.00 72.50 70.13 1q3g s THR 293 CO 0.09 0.50 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.67 1q3g s VAL 294 N 0.52 1.30 -0.26 3.82 1.01 -0.04 -4.98 120.40 121.77 1q3g s VAL 294 Ca -0.07 -1.19 -0.04 0.00 0.00 0.00 0.00 61.98 60.68 1q3g s VAL 294 Cb -0.15 -1.18 0.09 0.00 0.00 0.00 0.00 36.38 35.14 1q3g s VAL 294 CO 0.04 -0.03 0.14 -0.60 0.00 0.00 0.00 175.10 174.65 1q3g s ARG 295 N -1.41 0.17 0.75 2.72 3.52 -1.26 -0.44 118.95 123.00 1q3g s ARG 295 Ca 0.02 -0.39 -0.15 0.00 -0.13 0.00 0.00 55.73 55.09 1q3g s ARG 295 Cb -0.09 -1.26 0.05 0.00 -1.56 0.00 0.00 34.95 32.09 1q3g s ARG 295 CO 0.02 -0.94 1.24 0.95 -0.81 0.00 0.00 175.30 175.76 1q3g s THR 296 N 2.14 2.03 0.03 4.11 -4.23 -0.61 -4.45 115.64 114.67 1q3g s THR 296 Ca 0.08 0.02 -0.28 0.00 -1.18 0.00 0.00 61.69 60.32 1q3g s THR 296 Cb -0.16 -2.63 0.10 0.00 1.34 0.00 0.00 72.50 71.16 1q3g s THR 296 CO -0.30 -0.01 1.20 0.00 -0.54 0.00 0.00 174.62 174.97 1q3g s ALA 297 N -1.88 -2.10 0.73 3.99 0.00 -0.59 -4.10 121.76 117.82 1q3g s ALA 297 Ca 0.77 0.44 -0.15 0.00 0.00 0.00 0.00 51.96 53.01 1q3g s ALA 297 Cb -0.32 0.50 0.04 0.00 0.00 0.00 0.00 23.12 23.34 1q3g s ALA 297 CO 0.47 -1.06 1.25 -2.14 0.00 0.00 0.00 175.76 174.27 1q3g s PRO 298 N -2.54 2.07 0.57 0.00 0.02 -1.26 -4.41 135.00 129.44 1q3g s PRO 298 Ca 0.16 1.90 -0.19 0.00 0.02 0.00 0.00 61.00 62.89 1q3g s PRO 298 Cb 0.03 -1.81 -0.06 0.00 0.02 0.00 0.00 34.50 32.68 1q3g s PRO 298 CO -0.02 -1.93 0.94 1.58 -0.33 0.00 0.00 177.00 177.25 1q3g n HIS 299 N -2.64 0.77 1.12 6.54 -0.00 -1.26 -1.84 115.22 117.91 1q3g n HIS 299 Ca 0.15 0.45 0.01 0.00 0.46 0.00 0.00 57.72 58.79 1q3g n HIS 299 Cb 0.49 -2.14 0.06 0.00 -0.12 0.00 0.00 29.99 28.28 1q3g n HIS 299 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1q3g n PRO 300 N -0.73 1.44 -1.24 1.57 -0.04 -1.26 -4.62 135.00 130.12 1q3g n PRO 300 Ca 0.13 -0.44 -0.27 0.00 -0.04 0.00 0.00 63.50 62.88 1q3g n PRO 300 Cb 0.46 -1.39 0.21 0.00 -0.04 0.00 0.00 33.50 32.74 1q3g n PRO 300 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1q3g n ALA 301 N -0.02 -2.39 -1.75 0.55 0.00 -0.77 -4.24 120.51 111.89 1q3g n ALA 301 Ca 0.04 -1.49 -0.42 0.00 0.00 0.00 0.00 53.44 51.56 1q3g n ALA 301 Cb 0.26 -0.09 -0.03 0.00 0.00 0.00 0.00 19.45 19.59 1q3g n ALA 301 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1q3g s PHE 302 N -3.10 1.76 0.22 0.00 5.36 -1.26 -4.80 117.98 116.16 1q3g s PHE 302 Ca 0.65 -0.16 -0.30 0.00 -0.96 0.00 0.00 56.93 56.16 1q3g s PHE 302 Cb -0.04 -4.16 -0.09 0.00 -0.34 0.00 0.00 43.02 38.39 1q3g s PHE 302 CO 0.48 -4.97 1.21 -1.25 -1.46 0.00 0.00 175.22 169.24 1q3g s PRO 303 N 3.66 4.48 0.50 10.12 0.04 -1.26 -1.53 135.00 151.00 1q3g s PRO 303 Ca 0.83 1.94 0.23 0.00 0.04 0.00 0.00 61.00 64.04 1q3g s PRO 303 Cb -0.42 -3.20 1.30 0.00 0.04 0.00 0.00 34.50 32.22 1q3g s PRO 303 CO 0.37 -0.08 2.04 0.00 0.04 0.00 0.00 177.00 179.38 1q3g h THR 304 N 3.55 0.76 0.00 1.26 1.03 -1.92 -2.24 112.91 115.35 1q3g h THR 304 Ca -0.45 -0.57 0.00 0.00 -0.01 0.00 0.00 66.41 65.37 1q3g h THR 304 Cb 1.21 1.34 0.00 0.00 -1.07 0.00 0.00 68.15 69.64 1q3g h THR 304 CO 0.73 0.14 0.00 0.00 -0.01 0.00 0.00 175.52 176.38 1q3g n ALA 305 N -2.36 1.76 0.14 0.00 0.00 -1.26 -1.81 120.51 116.98 1q3g n ALA 305 Ca -0.02 -0.06 0.02 0.00 0.00 0.00 0.00 53.44 53.38 1q3g n ALA 305 Cb 0.24 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1q3g n ALA 305 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1q3g n MET 306 N -1.20 1.48 -0.08 0.00 0.00 -0.84 -4.75 117.12 111.72 1q3g n MET 306 Ca 0.06 -0.48 -0.09 0.00 0.00 0.00 0.00 57.70 57.20 1q3g n MET 306 Cb 0.07 -0.93 -0.01 0.00 0.00 0.00 0.00 33.22 32.35 1q3g n MET 306 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 175.97 176.34 1q3g h GLN 307 N 0.44 0.34 -0.62 2.12 -0.00 -1.38 -1.31 115.11 114.71 1q3g h GLN 307 Ca 0.00 -0.02 0.01 0.00 -0.00 0.00 0.00 58.65 58.64 1q3g h GLN 307 Cb 0.11 -0.08 -0.03 0.00 0.00 0.00 0.00 27.48 27.48 1q3g h GLN 307 CO 0.00 0.23 0.40 0.00 0.00 0.00 0.00 178.83 179.46 1q3g h ALA 308 N 1.13 0.79 -0.71 3.38 0.00 -1.85 0.48 119.26 122.47 1q3g h ALA 308 Ca 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1q3g h ALA 308 Cb -0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1q3g h ALA 308 CO -0.05 0.18 0.39 1.96 0.00 0.00 0.00 179.25 181.73 1q3g h GLN 309 N 0.81 0.99 0.00 0.00 7.50 -1.76 -1.84 115.11 120.80 1q3g h GLN 309 Ca 0.23 -0.12 -0.01 0.00 0.50 0.00 0.00 58.65 59.26 1q3g h GLN 309 Cb -0.06 -0.19 -0.00 0.00 0.05 0.00 0.00 27.48 27.28 1q3g h GLN 309 CO -0.07 0.74 -0.06 0.74 -1.50 0.00 0.00 178.83 178.69 1q3g h PHE 310 N 0.97 0.00 -0.39 2.96 -1.00 -0.81 -2.29 116.94 116.38 1q3g h PHE 310 Ca 0.25 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.98 1q3g h PHE 310 Cb 0.04 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.58 1q3g h PHE 310 CO -0.00 0.06 0.06 1.15 -1.61 0.00 0.00 178.31 177.96 1q3g h THR 311 N 0.00 1.24 0.25 -1.55 2.02 -0.09 -1.54 112.91 113.24 1q3g h THR 311 Ca -0.00 -0.88 0.00 0.00 0.77 0.00 0.00 66.41 66.30 1q3g h THR 311 Cb 0.74 1.05 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 1q3g h THR 311 CO 0.01 0.30 -0.22 0.25 0.37 0.00 0.00 175.52 176.23 1q3g h LEU 312 N 0.50 -0.57 -0.59 2.58 5.85 -1.09 -0.33 115.31 121.67 1q3g h LEU 312 Ca 0.12 0.05 0.12 0.00 0.84 0.00 0.00 57.88 59.01 1q3g h LEU 312 Cb 0.38 0.19 -0.11 0.00 0.37 0.00 0.00 40.66 41.50 1q3g h LEU 312 CO 0.01 -0.33 -0.09 0.25 -0.34 0.00 0.00 178.44 177.95 1q3g h LEU 313 N -0.48 -0.43 -0.89 2.25 6.46 -1.26 0.53 115.31 121.49 1q3g h LEU 313 Ca -0.01 0.16 -0.05 0.00 -0.12 0.00 0.00 57.88 57.87 1q3g h LEU 313 Cb 0.44 0.32 -0.03 0.00 -0.73 0.00 0.00 40.66 40.66 1q3g h LEU 313 CO -0.03 -0.16 0.24 0.78 -0.62 0.00 0.00 178.44 178.65 1q3g h ASN 314 N 0.04 0.98 0.34 1.25 2.35 -0.94 -1.97 115.58 117.63 1q3g h ASN 314 Ca 0.29 -0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1q3g h ASN 314 Cb 0.46 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.57 1q3g h ASN 314 CO -0.56 0.90 0.00 -0.07 -1.65 0.00 0.00 177.43 176.05 1q3g h LEU 315 N 1.03 0.00 -2.88 1.61 3.38 0.88 -1.47 115.31 117.86 1q3g h LEU 315 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1q3g h LEU 315 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1q3g h LEU 315 CO -0.01 0.00 -0.03 1.33 0.09 0.00 0.00 178.44 179.81 1q3g n VAL 316 N -2.43 1.50 -2.81 1.22 0.24 -0.94 -1.76 118.33 113.36 1q3g n VAL 316 Ca -0.00 -1.76 -0.19 0.00 -2.04 0.00 0.00 64.34 60.35 1q3g n VAL 316 Cb 0.13 0.02 0.03 0.00 -1.47 0.00 0.00 33.84 32.54 1q3g n VAL 316 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1q3g s ALA 317 N -2.16 4.20 -0.34 2.33 0.00 -0.55 -4.61 121.76 120.61 1q3g s ALA 317 Ca 0.21 -1.51 -0.20 0.00 0.00 0.00 0.00 51.96 50.46 1q3g s ALA 317 Cb 0.19 -1.86 -0.00 0.00 0.00 0.00 0.00 23.12 21.45 1q3g s ALA 317 CO 0.02 -0.56 0.62 -2.00 0.00 0.00 0.00 175.76 173.83 1q3g s GLU 318 N -4.59 3.72 0.00 0.00 2.56 0.22 -3.83 118.70 116.78 1q3g s GLU 318 Ca 0.57 0.07 0.00 0.00 0.00 0.00 0.00 54.97 55.61 1q3g s GLU 318 Cb -0.10 -3.79 0.00 0.00 2.00 0.00 0.00 34.13 32.24 1q3g s GLU 318 CO 0.36 -0.69 0.00 0.41 -0.56 0.00 0.00 175.26 174.79 1q3g n GLY 319 N 4.64 -0.49 3.42 -1.50 0.00 -1.26 -1.37 105.19 108.63 1q3g n GLY 319 Ca -0.02 -2.25 -0.40 0.00 0.00 0.00 0.00 46.02 43.35 1q3g n GLY 319 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q3g s THR 320 N -0.36 4.74 -0.04 2.61 2.01 -1.26 -2.37 115.64 120.97 1q3g s THR 320 Ca 0.00 -0.64 -0.02 0.00 0.31 0.00 0.00 61.69 61.33 1q3g s THR 320 Cb 0.00 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 68.92 1q3g s THR 320 CO 0.00 -0.13 0.10 -0.83 -0.69 0.00 0.00 174.62 173.07 1q3g s GLY 321 N 1.60 2.06 -0.11 4.40 0.00 -0.53 -4.77 107.32 109.97 1q3g s GLY 321 Ca 0.04 -0.80 0.02 0.00 0.00 0.00 0.00 44.72 43.98 1q3g s GLY 321 CO 0.07 -0.63 -0.16 0.14 0.00 0.00 0.00 173.10 172.52 1q3g s VAL 322 N -1.15 1.59 -0.15 1.40 1.01 -1.13 0.34 120.40 122.31 1q3g s VAL 322 Ca 0.21 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.51 1q3g s VAL 322 Cb -0.12 -1.44 0.01 0.00 0.00 0.00 0.00 36.38 34.82 1q3g s VAL 322 CO 0.11 0.46 -0.19 -0.63 0.00 0.00 0.00 175.10 174.85 1q3g s ILE 323 N 0.97 2.30 -0.23 2.22 1.01 -0.85 -0.86 121.20 125.76 1q3g s ILE 323 Ca -0.06 -0.89 -0.02 0.00 0.00 0.00 0.00 60.65 59.67 1q3g s ILE 323 Cb -0.15 -1.95 0.02 0.00 0.01 0.00 0.00 42.46 40.39 1q3g s ILE 323 CO -0.02 0.53 -0.07 -0.89 0.00 0.00 0.00 174.94 174.50 1q3g s THR 324 N 0.90 2.93 -0.25 2.92 2.01 0.41 -0.03 115.64 124.53 1q3g s THR 324 Ca -0.04 -0.87 -0.16 0.00 0.31 0.00 0.00 61.69 60.93 1q3g s THR 324 Cb -0.15 -2.42 -0.04 0.00 0.01 0.00 0.00 72.50 69.90 1q3g s THR 324 CO -0.03 0.29 0.41 -0.70 -0.69 0.00 0.00 174.62 173.91 1q3g s GLU 325 N 1.36 4.08 0.00 4.92 2.56 -0.03 -1.57 118.70 130.02 1q3g s GLU 325 Ca 0.02 0.16 0.06 0.00 0.00 0.00 0.00 54.97 55.22 1q3g s GLU 325 Cb -0.16 -3.62 0.06 0.00 2.00 0.00 0.00 34.13 32.41 1q3g s GLU 325 CO -0.05 -0.22 0.72 0.25 -0.56 0.00 0.00 175.26 175.40 1q3g n THR 326 N 4.87 0.04 -0.12 -1.70 -2.24 -1.26 -4.75 114.28 109.12 1q3g n THR 326 Ca -0.07 -0.52 -0.25 0.00 -2.27 0.00 0.00 64.05 60.94 1q3g n THR 326 Cb 0.51 1.11 -0.11 0.00 -2.10 0.00 0.00 70.33 69.73 1q3g n THR 326 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1q3g n ILE 327 N 0.35 1.54 -5.22 2.28 2.08 -1.26 -4.96 119.36 114.17 1q3g n ILE 327 Ca 0.04 -0.41 -0.32 0.00 0.56 0.00 0.00 62.75 62.62 1q3g n ILE 327 Cb 0.17 -1.76 -0.17 0.00 -0.75 0.00 0.00 39.64 37.13 1q3g n ILE 327 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 1q3g s PHE 328 N -2.50 2.55 -0.31 1.39 0.40 -1.26 -5.03 117.98 113.22 1q3g s PHE 328 Ca -0.35 -1.01 0.25 0.00 -0.60 0.00 0.00 56.93 55.22 1q3g s PHE 328 Cb 0.11 -1.70 1.12 0.00 0.51 0.00 0.00 43.02 43.06 1q3g s PHE 328 CO 0.56 -0.40 1.76 1.05 0.70 0.00 0.00 175.22 178.89 1q3g h GLU 329 N 6.65 0.00 -2.06 0.44 9.09 -1.92 -3.32 114.58 123.46 1q3g h GLU 329 Ca -0.20 0.00 -0.51 0.00 0.05 0.00 0.00 59.36 58.70 1q3g h GLU 329 Cb 1.23 0.00 -0.41 0.00 -1.65 0.00 0.00 28.75 27.93 1q3g h GLU 329 CO 0.47 0.00 -1.05 -1.71 0.05 0.00 0.00 179.01 176.77 1q3g n ASN 330 N -2.37 1.82 -2.16 3.06 5.15 0.00 -4.94 115.26 115.82 1q3g n ASN 330 Ca 0.01 -3.19 -0.26 0.00 -0.60 0.00 0.00 54.58 50.54 1q3g n ASN 330 Cb 0.19 -0.60 0.02 0.00 -0.53 0.00 0.00 39.78 38.86 1q3g n ASN 330 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1q3g n ARG 331 N 0.13 3.47 -0.13 1.20 0.63 -1.25 -4.00 116.66 116.72 1q3g n ARG 331 Ca 0.26 -4.13 0.06 0.00 -0.92 0.00 0.00 57.85 53.12 1q3g n ARG 331 Cb 0.59 -2.27 0.08 0.00 0.45 0.00 0.00 32.46 31.31 1q3g n ARG 331 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1q3g n PHE 332 N -0.68 0.00 0.33 -0.14 0.99 -1.26 -4.80 117.46 111.90 1q3g n PHE 332 Ca 0.45 -0.69 0.22 0.00 -0.00 0.00 0.00 57.45 57.42 1q3g n PHE 332 Cb 0.86 -0.11 1.13 0.00 -1.00 0.00 0.00 39.48 40.36 1q3g n PHE 332 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.76 177.28 1q3g h MET 333 N 0.00 0.00 0.00 -1.08 2.86 -1.99 -1.77 114.93 112.95 1q3g h MET 333 Ca 0.00 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.50 1q3g h MET 333 Cb 0.98 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.62 1q3g h MET 333 CO 0.00 0.00 -0.69 1.12 1.06 0.00 0.00 176.91 178.40 1q3g h HIS 334 N 0.00 0.00 -0.19 -0.22 2.07 -1.94 -3.35 115.15 111.51 1q3g h HIS 334 Ca -0.00 0.00 0.05 0.00 -2.85 0.00 0.00 60.37 57.57 1q3g h HIS 334 Cb 0.07 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 29.99 1q3g h HIS 334 CO 0.00 0.69 -0.20 0.28 -3.07 0.00 0.00 177.93 175.63 1q3g h VAL 335 N 0.00 0.48 0.00 6.12 2.07 -1.70 -0.36 116.25 122.86 1q3g h VAL 335 Ca -0.01 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1q3g h VAL 335 Cb 1.39 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1q3g h VAL 335 CO 0.09 0.00 -0.02 -0.65 0.02 0.00 0.00 177.57 177.01 1q3g h PRO 336 N -0.22 0.00 -0.09 1.57 0.11 -1.74 -0.65 132.00 130.97 1q3g h PRO 336 Ca 0.12 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.08 1q3g h PRO 336 Cb 0.40 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.52 1q3g h PRO 336 CO -0.32 0.02 -0.51 0.93 -0.21 0.00 0.00 178.00 177.91 1q3g h GLU 337 N 0.00 0.51 -0.18 1.05 4.39 -1.49 -3.02 114.58 115.84 1q3g h GLU 337 Ca -0.00 -0.43 -0.06 0.00 0.34 0.00 0.00 59.36 59.21 1q3g h GLU 337 Cb 0.04 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1q3g h GLU 337 CO 0.00 1.06 -0.16 -0.07 -1.16 0.00 0.00 179.01 178.68 1q3g h LEU 338 N 0.10 0.28 -1.64 1.33 3.38 -0.53 -1.67 115.31 116.56 1q3g h LEU 338 Ca -0.04 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1q3g h LEU 338 Cb 1.16 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1q3g h LEU 338 CO 0.11 0.47 0.09 0.40 0.09 0.00 0.00 178.44 179.60 1q3g h ILE 339 N 0.28 1.10 0.00 1.22 2.04 -1.09 0.22 117.51 121.28 1q3g h ILE 339 Ca 0.05 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 1q3g h ILE 339 Cb 0.45 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1q3g h ILE 339 CO 0.03 0.11 -0.12 0.03 0.00 0.00 0.00 178.15 178.21 1q3g h ARG 340 N 0.33 0.00 -0.54 2.37 3.08 -1.17 -1.04 114.38 117.41 1q3g h ARG 340 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.13 1q3g h ARG 340 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1q3g h ARG 340 CO -0.01 0.12 0.00 -1.33 -1.07 0.00 0.00 179.97 177.68 1q3g n MET 341 N -3.66 2.40 -0.27 0.04 2.81 0.74 -4.86 117.12 114.31 1q3g n MET 341 Ca -0.02 -1.61 0.00 0.00 -1.81 0.00 0.00 57.70 54.27 1q3g n MET 341 Cb 0.23 -1.54 0.00 0.00 -0.71 0.00 0.00 33.22 31.20 1q3g n MET 341 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1q3g n GLY 342 N 0.89 0.65 3.72 3.03 0.00 -0.39 -0.07 105.19 113.01 1q3g n GLY 342 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1q3g n GLY 342 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3g s ALA 343 N -2.52 1.76 -0.07 4.61 0.00 -0.92 -4.96 121.76 119.66 1q3g s ALA 343 Ca 0.00 0.19 0.01 0.00 0.00 0.00 0.00 51.96 52.17 1q3g s ALA 343 Cb 0.00 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.86 1q3g s ALA 343 CO 0.00 -2.23 -0.09 -1.01 0.00 0.00 0.00 175.76 172.43 1q3g s HIS 344 N -2.85 1.22 -0.14 0.00 0.09 -1.26 -4.48 115.29 107.87 1q3g s HIS 344 Ca 0.63 -0.46 -0.32 0.00 -0.00 0.00 0.00 55.06 54.91 1q3g s HIS 344 Cb -0.19 -0.97 0.13 0.00 -0.00 0.00 0.00 32.58 31.56 1q3g s HIS 344 CO 0.57 -0.29 1.09 0.00 -0.00 0.00 0.00 174.74 176.11 1q3g s ALA 345 N 0.97 -1.98 0.00 -1.40 0.00 -1.26 -2.10 121.76 115.98 1q3g s ALA 345 Ca -0.09 1.44 0.04 0.00 0.00 0.00 0.00 51.96 53.35 1q3g s ALA 345 Cb -0.15 -0.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1q3g s ALA 345 CO 0.00 -0.56 -0.13 -1.21 0.00 0.00 0.00 175.76 173.86 1q3g s GLU 346 N -2.37 1.01 -0.20 0.00 8.01 -0.61 -4.97 118.70 119.58 1q3g s GLU 346 Ca 0.07 -0.52 -0.06 0.00 0.01 0.00 0.00 54.97 54.46 1q3g s GLU 346 Cb -0.01 -0.99 -0.03 0.00 -4.31 0.00 0.00 34.13 28.79 1q3g s GLU 346 CO -0.05 0.27 0.03 0.42 0.01 0.00 0.00 175.26 175.93 1q3g s ILE 347 N -0.42 4.29 -0.22 -1.63 1.01 -1.26 -0.17 121.20 122.79 1q3g s ILE 347 Ca 0.04 -0.20 0.00 0.00 0.00 0.00 0.00 60.65 60.49 1q3g s ILE 347 Cb -0.06 -2.94 0.06 0.00 0.01 0.00 0.00 42.46 39.53 1q3g s ILE 347 CO -0.00 0.43 -0.05 -1.61 0.00 0.00 0.00 174.94 173.71 1q3g s GLU 348 N 0.86 1.52 5.02 2.79 0.41 -0.48 -5.02 118.70 123.80 1q3g s GLU 348 Ca 0.02 -0.86 0.00 0.00 -0.41 0.00 0.00 54.97 53.72 1q3g s GLU 348 Cb -0.14 -2.46 0.00 0.00 -1.78 0.00 0.00 34.13 29.75 1q3g s GLU 348 CO 0.02 -0.57 0.00 0.45 -0.49 0.00 0.00 175.26 174.67 1q3g n SER 349 N 4.74 0.00 -2.20 -0.19 2.88 -1.26 -1.44 113.62 116.15 1q3g n SER 349 Ca -0.12 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.20 1q3g n SER 349 Cb 0.45 0.00 0.19 0.00 -0.75 0.00 0.00 64.21 64.10 1q3g n SER 349 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1q3g n ASN 350 N 5.77 3.82 -3.89 -3.46 6.94 -1.26 -4.92 115.26 118.26 1q3g n ASN 350 Ca 0.00 -3.56 -0.11 0.00 -0.02 0.00 0.00 54.58 50.89 1q3g n ASN 350 Cb 0.00 -0.83 -0.12 0.00 -2.36 0.00 0.00 39.78 36.47 1q3g n ASN 350 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1q3g s THR 351 N -3.23 0.04 -0.16 5.53 -4.23 -0.52 -0.85 115.64 112.21 1q3g s THR 351 Ca 0.56 -0.35 -0.04 0.00 -1.18 0.00 0.00 61.69 60.68 1q3g s THR 351 Cb 0.47 -0.19 -0.03 0.00 1.34 0.00 0.00 72.50 74.09 1q3g s THR 351 CO 0.11 -0.19 -0.03 0.68 -0.54 0.00 0.00 174.62 174.65 1q3g s VAL 352 N -0.58 3.92 -0.33 2.29 -7.23 0.95 -1.38 120.40 118.04 1q3g s VAL 352 Ca -0.06 -0.34 -0.18 0.00 -1.81 0.00 0.00 61.98 59.58 1q3g s VAL 352 Cb -0.04 -2.73 -0.01 0.00 0.56 0.00 0.00 36.38 34.16 1q3g s VAL 352 CO 0.00 0.48 0.51 -0.63 -0.31 0.00 0.00 175.10 175.15 1q3g s ILE 353 N 0.47 5.03 -0.12 -0.62 -1.09 0.76 -2.00 121.20 123.63 1q3g s ILE 353 Ca -0.03 0.43 -0.06 0.00 -2.23 0.00 0.00 60.65 58.76 1q3g s ILE 353 Cb -0.14 -3.93 -0.04 0.00 -1.58 0.00 0.00 42.46 36.77 1q3g s ILE 353 CO 0.03 -0.16 0.10 0.00 -1.23 0.00 0.00 174.94 173.68 1q3g s HIS 355 N -0.75 2.66 0.44 0.00 3.76 -0.89 -1.45 115.29 119.05 1q3g s HIS 355 Ca 0.13 -2.83 -0.23 0.00 -0.15 0.00 0.00 55.06 51.97 1q3g s HIS 355 Cb -0.12 -2.41 -0.10 0.00 1.11 0.00 0.00 32.58 31.06 1q3g s HIS 355 CO 0.03 -0.76 0.90 0.41 -0.85 0.00 0.00 174.74 174.46 1q3g n GLY 356 N 3.33 -0.52 3.41 -2.22 0.00 -1.00 -4.24 105.19 103.96 1q3g n GLY 356 Ca 0.06 0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 1q3g n GLY 356 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1q3g s VAL 357 N -1.34 1.92 0.01 1.61 -7.23 -0.72 -4.73 120.40 109.91 1q3g s VAL 357 Ca 0.64 -2.23 -0.25 0.00 -1.81 0.00 0.00 61.98 58.33 1q3g s VAL 357 Cb -0.55 -2.26 -0.16 0.00 0.56 0.00 0.00 36.38 33.96 1q3g s VAL 357 CO 0.56 -0.44 1.22 -0.08 -0.31 0.00 0.00 175.10 176.06 1q3g h GLU 358 N 2.37 -0.46 -4.61 4.82 4.81 -1.89 -3.39 114.58 116.24 1q3g h GLU 358 Ca -0.39 0.03 -0.33 0.00 -0.13 0.00 0.00 59.36 58.54 1q3g h GLU 358 Cb 1.24 0.10 -0.25 0.00 0.63 0.00 0.00 28.75 30.47 1q3g h GLU 358 CO 0.64 -0.15 -0.75 0.15 -0.73 0.00 0.00 179.01 178.17 1q3g s LYS 359 N -4.68 0.57 0.33 1.92 1.02 -1.26 -4.98 119.74 112.65 1q3g s LYS 359 Ca -0.14 -0.54 -0.01 0.00 0.02 0.00 0.00 55.97 55.30 1q3g s LYS 359 Cb 0.02 -0.46 -0.04 0.00 -0.52 0.00 0.00 37.83 36.83 1q3g s LYS 359 CO 0.53 0.11 0.54 -0.51 -0.92 0.00 0.00 175.35 175.10 1q3g s LEU 360 N -0.93 4.03 -0.11 3.17 1.43 -1.26 -4.96 118.68 120.05 1q3g s LEU 360 Ca -0.03 0.51 -0.01 0.00 -1.03 0.00 0.00 54.13 53.57 1q3g s LEU 360 Cb -0.07 -3.36 -0.03 0.00 0.03 0.00 0.00 46.19 42.77 1q3g s LEU 360 CO 0.00 -0.26 -0.06 -0.44 0.23 0.00 0.00 176.35 175.82 1q3g s SER 361 N -3.80 4.66 0.52 2.29 0.01 0.90 0.47 113.70 118.75 1q3g s SER 361 Ca 0.41 -0.09 -0.22 0.00 1.31 0.00 0.00 55.95 57.35 1q3g s SER 361 Cb -0.10 -1.47 -0.06 0.00 0.21 0.00 0.00 66.02 64.60 1q3g s SER 361 CO 0.35 0.27 1.32 -0.83 0.41 0.00 0.00 173.24 174.76 1q3g s GLY 362 N -0.23 2.87 0.22 3.44 0.00 -0.51 -4.44 107.32 108.67 1q3g s GLY 362 Ca 0.03 1.26 -0.21 0.00 0.00 0.00 0.00 44.72 45.80 1q3g s GLY 362 CO 0.03 1.78 0.97 0.00 0.00 0.00 0.00 173.10 175.87 1q3g s ALA 363 N -1.34 -1.42 -0.29 3.20 0.00 -1.07 -4.76 121.76 116.08 1q3g s ALA 363 Ca 0.69 -0.34 -0.19 0.00 0.00 0.00 0.00 51.96 52.11 1q3g s ALA 363 Cb -0.38 0.72 -0.02 0.00 0.00 0.00 0.00 23.12 23.45 1q3g s ALA 363 CO 0.46 -1.05 0.57 -0.65 0.00 0.00 0.00 175.76 175.09 1q3g s GLN 364 N -2.42 3.96 0.28 0.00 -0.21 -1.26 -1.79 119.66 118.22 1q3g s GLN 364 Ca 0.19 0.28 0.07 0.00 0.02 0.00 0.00 55.36 55.92 1q3g s GLN 364 Cb -0.03 -3.70 -0.06 0.00 1.00 0.00 0.00 33.01 30.22 1q3g s GLN 364 CO 0.06 -0.47 -0.08 0.14 -2.12 0.00 0.00 175.29 172.82 1q3g s VAL 365 N 2.45 1.77 -0.11 1.09 -7.23 -0.13 -4.96 120.40 113.28 1q3g s VAL 365 Ca 0.23 -2.15 0.02 0.00 -1.81 0.00 0.00 61.98 58.27 1q3g s VAL 365 Cb -0.15 -2.45 0.01 0.00 0.56 0.00 0.00 36.38 34.35 1q3g s VAL 365 CO 0.11 -0.31 -0.18 -0.32 -0.31 0.00 0.00 175.10 174.09 1q3g s MET 366 N -3.70 2.50 0.26 4.82 1.75 -1.26 -1.23 119.30 122.45 1q3g s MET 366 Ca 0.29 -0.67 -0.30 0.00 -1.25 0.00 0.00 55.69 53.77 1q3g s MET 366 Cb 0.03 -2.06 -0.09 0.00 2.84 0.00 0.00 34.83 35.55 1q3g s MET 366 CO 0.12 -0.02 1.28 0.00 -0.65 0.00 0.00 175.02 175.76 1q3g s ALA 367 N 0.85 3.50 -0.03 4.11 0.00 -0.66 -4.93 121.76 124.62 1q3g s ALA 367 Ca -0.08 1.14 0.05 0.00 0.00 0.00 0.00 51.96 53.06 1q3g s ALA 367 Cb -0.15 -3.46 -0.08 0.00 0.00 0.00 0.00 23.12 19.43 1q3g s ALA 367 CO -0.00 -0.52 0.12 0.25 0.00 0.00 0.00 175.76 175.60 1q3g n THR 368 N 1.77 0.00 -3.82 0.00 -2.24 -1.26 -4.83 114.28 103.90 1q3g n THR 368 Ca 0.03 -0.14 -0.06 0.00 -2.27 0.00 0.00 64.05 61.61 1q3g n THR 368 Cb 0.43 0.44 -0.00 0.00 -2.10 0.00 0.00 70.33 69.09 1q3g n THR 368 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1q3g s ASP 369 N -2.49 -0.15 0.06 3.42 1.47 -1.26 -4.95 116.67 112.78 1q3g s ASP 369 Ca -0.02 -0.68 -0.19 0.00 1.18 0.00 0.00 52.55 52.84 1q3g s ASP 369 Cb 0.03 0.67 -0.07 0.00 -0.34 0.00 0.00 42.92 43.21 1q3g s ASP 369 CO 0.21 -1.27 1.30 0.25 0.68 0.00 0.00 175.17 176.34 1q3g h LEU 370 N 2.00 -0.92 -1.31 2.11 5.85 -1.99 -0.74 115.31 120.31 1q3g h LEU 370 Ca -0.24 0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.52 1q3g h LEU 370 Cb 1.24 0.35 -0.01 0.00 0.37 0.00 0.00 40.66 42.62 1q3g h LEU 370 CO 0.29 -0.28 -0.31 0.03 -0.34 0.00 0.00 178.44 177.83 1q3g h ARG 371 N -0.35 0.00 -0.32 1.25 2.47 -1.91 -2.73 114.38 112.79 1q3g h ARG 371 Ca 0.01 0.00 -0.14 0.00 -1.26 0.00 0.00 59.98 58.60 1q3g h ARG 371 Cb 0.38 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.70 1q3g h ARG 371 CO -0.21 0.31 -0.33 0.00 0.56 0.00 0.00 179.97 180.30 1q3g h ALA 372 N 1.69 0.47 -0.64 0.04 0.00 -1.91 -2.02 119.26 116.88 1q3g h ALA 372 Ca -0.00 -0.42 0.03 0.00 0.00 0.00 0.00 54.91 54.52 1q3g h ALA 372 Cb 0.66 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1q3g h ALA 372 CO 0.04 0.53 0.39 0.66 0.00 0.00 0.00 179.25 180.86 1q3g h SER 373 N 0.56 0.62 -0.47 0.00 4.64 -0.84 0.11 113.55 118.17 1q3g h SER 373 Ca 0.05 0.01 -0.05 0.00 -0.47 0.00 0.00 61.79 61.32 1q3g h SER 373 Cb 0.91 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.85 1q3g h SER 373 CO 0.08 0.43 0.11 0.00 -0.87 0.00 0.00 176.83 176.57 1q3g h ALA 374 N 1.29 1.20 -0.40 5.18 0.00 -1.41 -1.30 119.26 123.82 1q3g h ALA 374 Ca 0.26 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1q3g h ALA 374 Cb 0.06 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1q3g h ALA 374 CO -0.12 0.54 0.04 0.77 0.00 0.00 0.00 179.25 180.49 1q3g h SER 375 N 0.79 0.66 -0.04 0.00 0.02 -0.45 -1.35 113.55 113.18 1q3g h SER 375 Ca 0.17 -0.28 -0.06 0.00 -0.84 0.00 0.00 61.79 60.78 1q3g h SER 375 Cb 0.32 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 1q3g h SER 375 CO 0.00 0.77 -0.14 -0.07 -1.14 0.00 0.00 176.83 176.25 1q3g h LEU 376 N 0.52 0.33 -0.27 5.07 3.38 -0.49 -0.10 115.31 123.75 1q3g h LEU 376 Ca 0.12 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 1q3g h LEU 376 Cb 0.40 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1q3g h LEU 376 CO 0.01 0.50 -0.19 0.58 0.09 0.00 0.00 178.44 179.43 1q3g h VAL 377 N 0.32 1.30 -0.50 1.22 2.07 -0.98 -1.42 116.25 118.27 1q3g h VAL 377 Ca 0.06 -1.31 -0.04 0.00 0.82 0.00 0.00 66.70 66.23 1q3g h VAL 377 Cb 0.44 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 1q3g h VAL 377 CO 0.03 0.41 0.14 -0.07 0.02 0.00 0.00 177.57 178.10 1q3g h LEU 378 N 0.33 0.69 -0.61 2.57 3.38 -0.87 -2.07 115.31 118.72 1q3g h LEU 378 Ca 0.05 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1q3g h LEU 378 Cb 0.72 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1q3g h LEU 378 CO 0.05 0.67 0.39 0.00 0.09 0.00 0.00 178.44 179.65 1q3g h ALA 379 N 1.42 0.78 -0.65 1.53 0.00 -0.75 -1.73 119.26 119.86 1q3g h ALA 379 Ca 0.17 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1q3g h ALA 379 Cb 0.24 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1q3g h ALA 379 CO -0.01 0.23 0.43 0.78 0.00 0.00 0.00 179.25 180.68 1q3g h GLY 380 N 0.83 0.91 1.43 0.00 0.00 -0.61 0.16 103.07 105.79 1q3g h GLY 380 Ca 0.22 -0.34 -0.03 0.00 0.00 0.00 0.00 47.33 47.18 1q3g h GLY 380 CO -0.05 0.33 0.17 0.00 0.00 0.00 0.00 176.54 177.00 1q3g n ILE 382 N -4.33 0.00 -1.50 0.00 -5.35 -0.92 -0.69 119.36 106.57 1q3g n ILE 382 Ca 0.04 -0.22 -0.30 0.00 -0.27 0.00 0.00 62.75 61.99 1q3g n ILE 382 Cb 0.18 1.13 0.08 0.00 -1.74 0.00 0.00 39.64 39.29 1q3g n ILE 382 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1q3g s ALA 383 N -2.30 2.31 -0.45 -1.28 0.00 0.52 -4.51 121.76 116.04 1q3g s ALA 383 Ca 0.12 -0.07 -0.22 0.00 0.00 0.00 0.00 51.96 51.79 1q3g s ALA 383 Cb 0.14 -3.15 0.03 0.00 0.00 0.00 0.00 23.12 20.14 1q3g s ALA 383 CO 0.56 -1.64 0.72 -2.00 0.00 0.00 0.00 175.76 173.40 1q3g s GLU 384 N -5.08 3.33 0.00 0.00 2.56 0.18 -1.77 118.70 117.92 1q3g s GLU 384 Ca 0.60 -0.27 0.00 0.00 0.00 0.00 0.00 54.97 55.30 1q3g s GLU 384 Cb -0.15 -3.96 0.00 0.00 2.00 0.00 0.00 34.13 32.02 1q3g s GLU 384 CO 0.55 -1.10 0.00 0.41 -0.56 0.00 0.00 175.26 174.56 1q3g n GLY 385 N 5.03 0.03 3.62 -1.50 0.00 -0.57 -1.43 105.19 110.36 1q3g n GLY 385 Ca 0.00 -1.98 -0.35 0.00 0.00 0.00 0.00 46.02 43.69 1q3g n GLY 385 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q3g s THR 386 N 0.00 4.77 -0.03 2.61 2.01 -1.26 -0.71 115.64 123.03 1q3g s THR 386 Ca 0.00 -0.04 0.06 0.00 0.31 0.00 0.00 61.69 62.02 1q3g s THR 386 Cb 0.00 -3.16 -0.02 0.00 0.01 0.00 0.00 72.50 69.33 1q3g s THR 386 CO 0.00 0.45 -0.21 -0.89 -0.69 0.00 0.00 174.62 173.28 1q3g s THR 387 N 0.48 2.50 -0.20 -0.82 2.01 0.11 -2.58 115.64 117.13 1q3g s THR 387 Ca 0.03 -0.95 0.01 0.00 0.31 0.00 0.00 61.69 61.09 1q3g s THR 387 Cb -0.13 -1.92 0.04 0.00 0.01 0.00 0.00 72.50 70.50 1q3g s THR 387 CO 0.01 0.58 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.71 1q3g s VAL 388 N -0.67 1.76 -0.46 3.82 1.01 -0.74 -0.16 120.40 124.96 1q3g s VAL 388 Ca 0.11 -1.07 -0.15 0.00 0.00 0.00 0.00 61.98 60.87 1q3g s VAL 388 Cb -0.10 -1.80 0.06 0.00 0.00 0.00 0.00 36.38 34.54 1q3g s VAL 388 CO -0.00 0.20 0.36 -0.69 0.00 0.00 0.00 175.10 174.97 1q3g s VAL 389 N 1.35 5.15 0.49 2.92 1.01 -0.23 -0.96 120.40 130.13 1q3g s VAL 389 Ca -0.01 -1.01 -0.18 0.00 0.00 0.00 0.00 61.98 60.78 1q3g s VAL 389 Cb -0.16 -4.04 -0.09 0.00 0.00 0.00 0.00 36.38 32.09 1q3g s VAL 389 CO -0.08 -0.52 0.97 -0.62 0.00 0.00 0.00 175.10 174.85 1q3g s ASP 390 N 2.38 6.72 -0.88 3.32 2.15 -0.36 -1.69 116.67 128.30 1q3g s ASP 390 Ca 0.04 1.60 0.00 0.00 0.43 0.00 0.00 52.55 54.62 1q3g s ASP 390 Cb -0.23 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 39.87 1q3g s ASP 390 CO 0.07 -0.52 0.00 0.54 -0.17 0.00 0.00 175.17 175.09 1q3g n ARG 391 N -1.30 -0.67 0.00 4.34 5.12 -1.15 -1.65 116.66 121.35 1q3g n ARG 391 Ca 0.07 0.66 0.00 0.00 -1.93 0.00 0.00 57.85 56.65 1q3g n ARG 391 Cb 0.54 -4.59 0.00 0.00 -1.16 0.00 0.00 32.46 27.25 1q3g n ARG 391 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 1q3g n ILE 392 N -3.26 0.00 0.00 0.55 -6.64 -1.21 -1.91 119.36 106.88 1q3g n ILE 392 Ca -0.10 0.00 0.12 0.00 -1.77 0.00 0.00 62.75 61.00 1q3g n ILE 392 Cb 0.41 -0.96 0.56 0.00 -1.44 0.00 0.00 39.64 38.21 1q3g n ILE 392 CO 0.00 0.00 0.00 0.10 -1.77 0.00 0.00 176.55 174.88 1q3g h TYR 393 N 0.00 0.28 -0.86 4.28 -0.00 -1.90 0.61 116.97 119.38 1q3g h TYR 393 Ca 0.00 0.01 0.15 0.00 0.00 0.00 0.00 58.73 58.89 1q3g h TYR 393 Cb 0.00 -0.09 -0.10 0.00 0.00 0.00 0.00 36.73 36.54 1q3g h TYR 393 CO 0.00 0.14 0.44 0.45 -0.00 0.00 0.00 178.16 179.20 1q3g h HIS 394 N 0.27 0.78 0.00 0.10 3.86 -1.74 -0.40 115.15 118.01 1q3g h HIS 394 Ca 0.21 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.40 1q3g h HIS 394 Cb 0.48 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 1q3g h HIS 394 CO -0.00 0.18 -0.27 0.97 0.86 0.00 0.00 177.93 179.67 1q3g h ILE 395 N 0.63 1.03 0.00 2.45 2.10 -1.12 -2.44 117.51 120.16 1q3g h ILE 395 Ca 0.47 -1.00 0.00 0.00 1.08 0.00 0.00 64.86 65.42 1q3g h ILE 395 Cb 0.67 1.56 0.00 0.00 -1.09 0.00 0.00 36.82 37.97 1q3g h ILE 395 CO -0.37 0.27 0.00 0.47 -1.08 0.00 0.00 178.15 177.44 1q3g n ASP 396 N -3.97 0.38 0.08 2.19 8.00 -0.16 -1.79 116.55 121.28 1q3g n ASP 396 Ca -0.02 0.59 -0.08 0.00 0.71 0.00 0.00 54.79 55.99 1q3g n ASP 396 Cb 0.34 -0.67 0.03 0.00 -0.02 0.00 0.00 41.12 40.80 1q3g n ASP 396 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1q3g h ARG 397 N 0.00 0.22 0.00 -1.24 2.47 -1.44 -2.27 114.38 112.12 1q3g h ARG 397 Ca 0.00 -0.21 0.00 0.00 -1.26 0.00 0.00 59.98 58.51 1q3g h ARG 397 Cb 0.33 0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.71 1q3g h ARG 397 CO 0.00 0.91 0.00 0.41 0.56 0.00 0.00 179.97 181.85 1q3g n GLY 398 N 0.71 -0.19 3.00 0.04 0.00 -1.13 -4.06 105.19 103.56 1q3g n GLY 398 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 1q3g n GLY 398 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1q3g s TYR 399 N -0.14 1.97 -0.29 1.61 1.51 -0.74 -4.89 117.35 116.39 1q3g s TYR 399 Ca 0.00 -1.06 -0.28 0.00 -1.01 0.00 0.00 57.07 54.72 1q3g s TYR 399 Cb 0.00 -1.48 0.01 0.00 -0.11 0.00 0.00 41.96 40.38 1q3g s TYR 399 CO 0.00 -0.61 1.00 -2.00 -1.11 0.00 0.00 175.55 172.83 1q3g s GLU 400 N 1.47 4.11 -1.53 -0.62 2.12 -1.26 -4.16 118.70 118.83 1q3g s GLU 400 Ca 0.03 1.06 -0.06 0.00 0.36 0.00 0.00 54.97 56.36 1q3g s GLU 400 Cb -0.13 -3.70 0.06 0.00 0.26 0.00 0.00 34.13 30.62 1q3g s GLU 400 CO -0.09 -0.76 0.48 0.54 -0.54 0.00 0.00 175.26 174.90 1q3g n ARG 401 N 6.53 -2.91 0.19 4.30 1.74 -1.26 -4.84 116.66 120.42 1q3g n ARG 401 Ca 0.10 0.35 0.07 0.00 -0.77 0.00 0.00 57.85 57.60 1q3g n ARG 401 Cb 0.47 -4.59 0.57 0.00 -1.02 0.00 0.00 32.46 27.89 1q3g n ARG 401 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1q3g h ILE 402 N -1.71 1.04 -0.29 0.55 2.10 -1.95 -1.84 117.51 115.41 1q3g h ILE 402 Ca -0.62 -0.10 0.01 0.00 1.08 0.00 0.00 64.86 65.22 1q3g h ILE 402 Cb 1.38 0.91 -0.02 0.00 -1.09 0.00 0.00 36.82 38.00 1q3g h ILE 402 CO 0.69 0.04 0.18 -0.08 -1.08 0.00 0.00 178.15 177.90 1q3g h GLU 403 N 0.14 0.36 -0.15 2.19 4.81 -1.94 0.49 114.58 120.48 1q3g h GLU 403 Ca 0.04 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.22 1q3g h GLU 403 Cb 0.01 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.31 1q3g h GLU 403 CO -0.01 0.24 -0.02 -0.44 -0.73 0.00 0.00 179.01 178.05 1q3g h ASP 404 N 0.37 0.28 -0.90 1.04 3.45 -1.73 -1.42 116.42 117.50 1q3g h ASP 404 Ca 0.11 -0.35 -0.01 0.00 0.43 0.00 0.00 57.03 57.21 1q3g h ASP 404 Cb -0.02 -0.08 -0.04 0.00 -0.56 0.00 0.00 39.33 38.63 1q3g h ASP 404 CO -0.04 0.56 0.53 0.11 -1.57 0.00 0.00 179.24 178.83 1q3g h LYS 405 N -0.01 1.23 -0.37 3.56 1.57 -1.27 -0.44 116.57 120.84 1q3g h LYS 405 Ca 0.04 -0.12 -0.12 0.00 -1.87 0.00 0.00 60.65 58.57 1q3g h LYS 405 Cb 0.43 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 1q3g h LYS 405 CO 0.01 0.88 -0.25 -0.07 -0.57 0.00 0.00 179.45 179.45 1q3g h LEU 406 N 1.24 0.86 -0.58 2.94 3.38 -0.87 -2.95 115.31 119.33 1q3g h LEU 406 Ca 0.32 -0.43 0.02 0.00 0.09 0.00 0.00 57.88 57.88 1q3g h LEU 406 Cb -0.03 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 1q3g h LEU 406 CO -0.06 1.10 0.37 -0.09 0.09 0.00 0.00 178.44 179.85 1q3g h ARG 407 N 0.62 0.71 0.00 1.13 2.43 -0.89 0.62 114.38 118.99 1q3g h ARG 407 Ca 0.07 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1q3g h ARG 407 Cb 0.81 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1q3g h ARG 407 CO 0.07 0.47 0.00 0.00 -1.51 0.00 0.00 179.97 179.00 1q3g n ALA 408 N -2.28 1.26 0.62 2.80 0.00 -0.21 -0.29 120.51 122.41 1q3g n ALA 408 Ca 0.05 -0.02 0.10 0.00 0.00 0.00 0.00 53.44 53.57 1q3g n ALA 408 Cb 0.06 -1.07 0.11 0.00 0.00 0.00 0.00 19.45 18.55 1q3g n ALA 408 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1q3g n LEU 409 N -1.42 2.77 0.00 0.00 4.77 0.16 -4.73 117.00 118.54 1q3g n LEU 409 Ca 0.01 -1.17 0.00 0.00 -0.03 0.00 0.00 56.01 54.83 1q3g n LEU 409 Cb 0.04 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 1q3g n LEU 409 CO 0.03 0.52 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 1q3g n GLY 410 N 1.11 1.04 3.79 -0.72 0.00 0.60 -1.35 105.19 109.66 1q3g n GLY 410 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 1q3g n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3g s ALA 411 N -2.00 3.06 -0.75 4.61 0.00 -0.89 -4.79 121.76 121.01 1q3g s ALA 411 Ca 0.00 0.61 -0.08 0.00 0.00 0.00 0.00 51.96 52.49 1q3g s ALA 411 Cb 0.00 -3.24 0.20 0.00 0.00 0.00 0.00 23.12 20.08 1q3g s ALA 411 CO 0.00 -0.12 0.63 1.21 0.00 0.00 0.00 175.76 177.49 1q3g s ASN 412 N -1.75 6.05 0.02 0.00 3.84 -1.26 -4.47 114.94 117.38 1q3g s ASN 412 Ca 0.59 -2.84 0.04 0.00 0.21 0.00 0.00 52.86 50.85 1q3g s ASN 412 Cb -0.18 -2.04 -0.02 0.00 -0.55 0.00 0.00 41.25 38.46 1q3g s ASN 412 CO 0.23 -0.45 -0.12 -0.51 -2.79 0.00 0.00 177.10 173.46 1q3g s ILE 413 N -0.06 0.90 -0.05 -5.21 2.07 -1.26 -0.71 121.20 116.88 1q3g s ILE 413 Ca 0.18 -0.77 -0.04 0.00 -1.41 0.00 0.00 60.65 58.62 1q3g s ILE 413 Cb -0.14 -0.81 0.02 0.00 0.13 0.00 0.00 42.46 41.66 1q3g s ILE 413 CO -0.07 0.04 0.14 -0.70 -1.91 0.00 0.00 174.94 172.45 1q3g s GLU 414 N -0.82 0.13 -0.91 3.50 2.12 -0.57 -4.98 118.70 117.18 1q3g s GLU 414 Ca 0.01 0.25 -0.15 0.00 0.36 0.00 0.00 54.97 55.43 1q3g s GLU 414 Cb -0.06 -0.01 0.19 0.00 0.26 0.00 0.00 34.13 34.50 1q3g s GLU 414 CO 0.00 -0.07 0.97 0.50 -0.54 0.00 0.00 175.26 176.13 1q3g s ARG 415 N 0.44 3.68 0.34 4.30 3.52 -1.26 -0.60 118.95 129.36 1q3g s ARG 415 Ca -0.03 -2.27 -0.28 0.00 -0.13 0.00 0.00 55.73 53.02 1q3g s ARG 415 Cb -0.04 -4.66 -0.09 0.00 -1.56 0.00 0.00 34.95 28.59 1q3g s ARG 415 CO -0.02 -1.50 1.20 0.14 -0.81 0.00 0.00 175.30 174.32 1q3g s VAL 416 N 1.08 3.07 0.94 7.11 -7.23 -1.04 -4.89 120.40 119.44 1q3g s VAL 416 Ca 0.26 1.02 -0.14 0.00 -1.81 0.00 0.00 61.98 61.31 1q3g s VAL 416 Cb -0.08 -3.63 0.19 0.00 0.56 0.00 0.00 36.38 33.43 1q3g s VAL 416 CO -0.09 0.20 1.29 -0.54 -0.31 0.00 0.00 175.10 175.66 1q3g s LYS 417 N -1.85 0.72 0.00 4.82 -0.14 -1.26 -2.41 119.74 119.63 1q3g s LYS 417 Ca 0.50 -0.50 0.00 0.00 -1.36 0.00 0.00 55.97 54.61 1q3g s LYS 417 Cb -0.35 -1.90 0.00 0.00 -1.68 0.00 0.00 37.83 33.91 1q3g s LYS 417 CO 0.45 -2.33 0.00 0.41 -0.76 0.00 0.00 175.35 173.12 1q3g n GLY 418 N -3.68 0.00 3.77 -3.33 0.00 -1.26 -4.75 105.19 95.95 1q3g n GLY 418 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1q3g n GLY 418 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50