#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 0.13 -4.05 6.12 9.92 -1.26 -1.34 116.55 126.07 1q3g n ASP 2 Ca 0.00 0.74 -0.10 0.00 -0.53 0.00 0.00 54.79 54.90 1q3g n ASP 2 Cb 0.00 -1.33 -0.08 0.00 -0.64 0.00 0.00 41.12 39.07 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 -2.73 1.08 -0.15 -1.24 1.02 -0.21 -2.85 119.74 114.65 1q3g s LYS 3 Ca 0.73 -1.31 0.00 0.00 0.02 0.00 0.00 55.97 55.42 1q3g s LYS 3 Cb -0.40 0.32 -0.00 0.00 -0.52 0.00 0.00 37.83 37.22 1q3g s LYS 3 CO 0.50 -0.36 -0.15 -0.06 -0.92 0.00 0.00 175.35 174.36 1q3g s PHE 4 N -4.01 2.78 -0.26 3.18 2.99 -0.61 -0.62 117.98 121.43 1q3g s PHE 4 Ca 0.21 -0.97 -0.11 0.00 0.00 0.00 0.00 56.93 56.06 1q3g s PHE 4 Cb 0.05 -1.88 -0.05 0.00 0.00 0.00 0.00 43.02 41.14 1q3g s PHE 4 CO 0.02 -0.43 0.17 0.50 -0.00 0.00 0.00 175.22 175.47 1q3g s ARG 5 N 0.74 3.98 -0.05 0.44 3.52 0.03 -0.96 118.95 126.66 1q3g s ARG 5 Ca -0.06 -0.31 0.04 0.00 -0.13 0.00 0.00 55.73 55.27 1q3g s ARG 5 Cb -0.15 -3.59 -0.00 0.00 -1.56 0.00 0.00 34.95 29.65 1q3g s ARG 5 CO 0.01 -0.08 -0.19 0.08 -0.81 0.00 0.00 175.30 174.32 1q3g s VAL 6 N 1.45 1.55 -0.12 7.11 1.01 0.69 -1.12 120.40 130.97 1q3g s VAL 6 Ca 0.07 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.30 1q3g s VAL 6 Cb -0.15 -1.33 -0.00 0.00 0.00 0.00 0.00 36.38 34.90 1q3g s VAL 6 CO 0.08 0.44 -0.19 -1.58 0.00 0.00 0.00 175.10 173.85 1q3g s GLN 7 N 0.05 3.17 0.31 2.72 0.74 -0.32 0.28 119.66 126.62 1q3g s GLN 7 Ca -0.05 -0.80 0.05 0.00 0.05 0.00 0.00 55.36 54.61 1q3g s GLN 7 Cb -0.12 -2.45 -0.02 0.00 1.10 0.00 0.00 33.01 31.52 1q3g s GLN 7 CO 0.03 0.16 0.19 0.41 -0.55 0.00 0.00 175.29 175.53 1q3g n GLY 8 N 3.61 3.20 3.84 2.59 0.00 0.22 -4.21 105.19 114.44 1q3g n GLY 8 Ca -0.19 -1.96 -0.33 0.00 0.00 0.00 0.00 46.02 43.54 1q3g n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1q3g s PRO 9 N -3.24 4.06 -0.06 1.61 0.04 -0.77 -1.42 135.00 135.23 1q3g s PRO 9 Ca 0.27 0.80 -0.03 0.00 0.04 0.00 0.00 61.00 62.08 1q3g s PRO 9 Cb 0.01 -2.35 0.04 0.00 0.04 0.00 0.00 34.50 32.24 1q3g s PRO 9 CO 0.19 0.09 0.13 0.95 0.04 0.00 0.00 177.00 178.39 1q3g s THR 10 N -2.06 -0.12 -0.30 1.26 -4.23 0.09 -4.99 115.64 105.28 1q3g s THR 10 Ca 0.57 0.26 -0.29 0.00 -1.18 0.00 0.00 61.69 61.05 1q3g s THR 10 Cb -0.10 -0.23 -0.00 0.00 1.34 0.00 0.00 72.50 73.51 1q3g s THR 10 CO 0.17 0.11 1.36 -0.60 -0.54 0.00 0.00 174.62 175.12 1q3g s ARG 11 N 1.60 3.86 -0.26 3.99 3.52 -1.26 -4.59 118.95 125.82 1q3g s ARG 11 Ca -0.04 1.28 -0.29 0.00 -0.13 0.00 0.00 55.73 56.55 1q3g s ARG 11 Cb -0.12 -3.92 0.01 0.00 -1.56 0.00 0.00 34.95 29.36 1q3g s ARG 11 CO -0.05 -1.19 1.06 -0.51 -0.81 0.00 0.00 175.30 173.79 1q3g s LEU 12 N 4.62 4.05 0.04 -0.88 1.43 -1.26 -4.75 118.68 121.92 1q3g s LEU 12 Ca 0.59 1.28 -0.22 0.00 -1.03 0.00 0.00 54.13 54.75 1q3g s LEU 12 Cb -0.18 -3.54 0.05 0.00 0.03 0.00 0.00 46.19 42.55 1q3g s LEU 12 CO 0.25 -0.74 0.50 0.00 0.23 0.00 0.00 176.35 176.58 1q3g s GLN 13 N 3.36 1.00 0.00 1.70 -2.07 0.18 -3.68 119.66 120.14 1q3g s GLN 13 Ca 0.45 -0.23 0.00 0.00 -1.82 0.00 0.00 55.36 53.76 1q3g s GLN 13 Cb -0.14 0.45 0.00 0.00 -1.09 0.00 0.00 33.01 32.23 1q3g s GLN 13 CO 0.09 -0.35 0.00 0.41 -1.32 0.00 0.00 175.29 174.12 1q3g n GLY 14 N 0.50 0.38 3.16 2.60 0.00 -0.07 -4.45 105.19 107.30 1q3g n GLY 14 Ca -0.19 -1.31 -0.12 0.00 0.00 0.00 0.00 46.02 44.40 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 -0.65 0.81 -0.07 1.61 2.02 -1.26 -1.57 118.70 119.58 1q3g s GLU 15 Ca 0.00 -1.22 -0.15 0.00 0.02 0.00 0.00 54.97 53.63 1q3g s GLU 15 Cb 0.00 -0.32 0.03 0.00 0.10 0.00 0.00 34.13 33.94 1q3g s GLU 15 CO 0.00 0.02 0.35 0.54 0.02 0.00 0.00 175.26 176.19 1q3g s VAL 16 N -2.99 0.03 -0.24 2.63 0.11 -0.89 -4.82 120.40 114.23 1q3g s VAL 16 Ca 0.07 -0.24 -0.06 0.00 -2.93 0.00 0.00 61.98 58.82 1q3g s VAL 16 Cb 0.01 -0.58 -0.02 0.00 -1.53 0.00 0.00 36.38 34.25 1q3g s VAL 16 CO -0.02 -0.13 0.03 -0.89 -3.33 0.00 0.00 175.10 170.76 1q3g s THR 17 N -0.63 4.02 0.23 5.04 2.01 -1.26 -0.42 115.64 124.64 1q3g s THR 17 Ca -0.07 -0.27 -0.30 0.00 0.31 0.00 0.00 61.69 61.36 1q3g s THR 17 Cb -0.04 -2.87 -0.09 0.00 0.01 0.00 0.00 72.50 69.52 1q3g s THR 17 CO 0.03 0.37 1.24 -0.63 -0.69 0.00 0.00 174.62 174.93 1q3g s ILE 18 N 1.56 3.27 0.77 1.82 -1.09 -0.16 -4.94 121.20 122.44 1q3g s ILE 18 Ca 0.06 1.12 -0.07 0.00 -2.23 0.00 0.00 60.65 59.54 1q3g s ILE 18 Cb -0.15 -3.72 0.12 0.00 -1.58 0.00 0.00 42.46 37.13 1q3g s ILE 18 CO 0.01 0.21 1.08 -0.44 -1.23 0.00 0.00 174.94 174.58 1q3g s SER 19 N -0.08 4.22 0.62 3.58 0.01 -1.26 -4.82 113.70 115.96 1q3g s SER 19 Ca 0.52 0.12 -0.18 0.00 1.31 0.00 0.00 55.95 57.72 1q3g s SER 19 Cb -0.35 -0.53 -0.02 0.00 0.21 0.00 0.00 66.02 65.33 1q3g s SER 19 CO 0.41 -1.98 1.23 -0.83 0.41 0.00 0.00 173.24 172.48 1q3g s GLY 20 N -4.69 2.74 0.04 3.44 0.00 -1.19 -1.47 107.32 106.19 1q3g s GLY 20 Ca 0.66 1.06 -0.30 0.00 0.00 0.00 0.00 44.72 46.13 1q3g s GLY 20 CO 0.47 1.46 1.63 0.00 0.00 0.00 0.00 173.10 176.65 1q3g s ALA 21 N -1.57 3.66 0.17 3.20 0.00 0.51 -4.32 121.76 123.41 1q3g s ALA 21 Ca 0.79 1.12 -0.15 0.00 0.00 0.00 0.00 51.96 53.72 1q3g s ALA 21 Cb -0.32 -3.70 0.06 0.00 0.00 0.00 0.00 23.12 19.16 1q3g s ALA 21 CO 0.36 -1.15 1.82 -0.22 0.00 0.00 0.00 175.76 176.57 1q3g h LYS 22 N 8.56 0.59 -0.28 0.00 3.64 -1.90 -1.01 116.57 126.17 1q3g h LYS 22 Ca -0.42 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1q3g h LYS 22 Cb 1.20 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1q3g h LYS 22 CO 0.93 0.39 0.00 0.09 -2.27 0.00 0.00 179.45 178.59 1q3g n ASN 23 N -4.78 0.46 -0.02 4.20 3.02 -1.26 -1.90 115.26 114.98 1q3g n ASN 23 Ca 0.02 -2.01 -0.02 0.00 -0.03 0.00 0.00 54.58 52.54 1q3g n ASN 23 Cb 0.04 -0.15 -0.02 0.00 -0.61 0.00 0.00 39.78 39.05 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 -0.28 1.96 -0.19 5.41 0.00 -0.99 -4.51 120.51 121.91 1q3g n ALA 24 Ca 0.01 -0.14 -0.08 0.00 0.00 0.00 0.00 53.44 53.23 1q3g n ALA 24 Cb 0.10 0.42 0.02 0.00 0.00 0.00 0.00 19.45 19.99 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 0.70 0.63 0.00 0.00 -1.11 -2.08 119.26 117.40 1q3g h ALA 25 Ca -0.08 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1q3g h ALA 25 Cb 1.11 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.70 1q3g h ALA 25 CO -0.01 0.32 -0.30 -0.07 0.00 0.00 0.00 179.25 179.19 1q3g h LEU 26 N 0.74 -0.71 -1.65 0.00 3.38 -1.63 0.76 115.31 116.20 1q3g h LEU 26 Ca 0.18 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 1q3g h LEU 26 Cb 0.21 0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1q3g h LEU 26 CO -0.01 -0.48 -0.18 1.55 0.09 0.00 0.00 178.44 179.41 1q3g h PRO 27 N -0.89 0.00 -0.21 1.13 0.13 -1.79 -2.45 132.00 127.93 1q3g h PRO 27 Ca -0.09 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.85 1q3g h PRO 27 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 1q3g h PRO 27 CO 0.14 0.18 -0.63 0.82 -0.23 0.00 0.00 178.00 178.28 1q3g h ILE 28 N 0.00 1.29 -0.79 -3.56 2.04 -1.22 -1.25 117.51 114.02 1q3g h ILE 28 Ca -0.00 -1.85 -0.05 0.00 1.00 0.00 0.00 64.86 63.96 1q3g h ILE 28 Cb 0.32 1.80 -0.04 0.00 -0.74 0.00 0.00 36.82 38.17 1q3g h ILE 28 CO 0.02 0.59 0.31 -0.07 0.00 0.00 0.00 178.15 179.01 1q3g h LEU 29 N 0.55 1.10 -0.60 1.44 3.38 -0.46 -1.55 115.31 119.17 1q3g h LEU 29 Ca -0.01 -0.17 -0.15 0.00 0.09 0.00 0.00 57.88 57.63 1q3g h LEU 29 Cb 1.23 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 1q3g h LEU 29 CO 0.13 0.97 -0.66 -0.26 0.09 0.00 0.00 178.44 178.72 1q3g h PHE 30 N 1.16 0.27 0.00 1.13 -1.00 -1.42 -2.78 116.94 114.29 1q3g h PHE 30 Ca 0.26 -0.11 -0.03 0.00 2.81 0.00 0.00 57.97 60.90 1q3g h PHE 30 Cb 0.22 -0.04 -0.00 0.00 3.61 0.00 0.00 35.95 39.73 1q3g h PHE 30 CO 0.02 0.80 -0.16 0.00 -1.61 0.00 0.00 178.31 177.36 1q3g h ALA 31 N 1.17 1.48 0.00 2.45 0.00 -0.67 -1.86 119.26 121.83 1q3g h ALA 31 Ca -0.01 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1q3g h ALA 31 Cb 1.18 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1q3g h ALA 31 CO 0.10 0.19 -0.01 0.00 0.00 0.00 0.00 179.25 179.54 1q3g h ALA 32 N 1.84 1.08 0.00 0.00 0.00 -1.00 -0.76 119.26 120.42 1q3g h ALA 32 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1q3g h ALA 32 Cb 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1q3g h ALA 32 CO 0.02 0.01 0.00 -0.07 0.00 0.00 0.00 179.25 179.21 1q3g h LEU 33 N 0.00 0.00 0.00 0.00 3.38 -1.47 0.79 115.31 118.01 1q3g h LEU 33 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1q3g h LEU 33 Cb 0.07 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 -0.59 -0.07 0.09 0.00 0.00 178.44 177.87 1q3g h LEU 34 N 0.00 0.00 -9.48 1.67 3.38 -1.35 -3.47 115.31 106.06 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 0.01 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.76 1q3g h LEU 34 CO 0.00 0.13 0.64 0.00 0.09 0.00 0.00 178.44 179.30 1q3g s ALA 35 N -3.20 3.47 -0.17 1.53 0.00 0.27 -4.27 121.76 119.39 1q3g s ALA 35 Ca 0.03 0.92 0.21 0.00 0.00 0.00 0.00 51.96 53.11 1q3g s ALA 35 Cb 0.07 -3.49 -0.10 0.00 0.00 0.00 0.00 23.12 19.61 1q3g s ALA 35 CO 0.74 -0.54 0.86 0.39 0.00 0.00 0.00 175.76 177.21 1q3g n GLU 36 N 4.12 0.62 -3.89 0.00 1.02 -0.49 -4.19 120.64 117.84 1q3g n GLU 36 Ca 0.10 0.10 -0.22 0.00 -0.02 0.00 0.00 57.16 57.13 1q3g n GLU 36 Cb 0.45 -1.77 -0.04 0.00 -0.02 0.00 0.00 31.44 30.06 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 -3.23 2.68 0.44 3.49 2.02 -0.92 -4.10 118.70 119.09 1q3g s GLU 37 Ca -0.03 -1.31 -0.24 0.00 0.02 0.00 0.00 54.97 53.41 1q3g s GLU 37 Cb 0.10 -2.43 -0.10 0.00 0.10 0.00 0.00 34.13 31.80 1q3g s GLU 37 CO 0.82 0.13 1.14 -2.30 0.02 0.00 0.00 175.26 175.06 1q3g n PRO 38 N -1.31 1.58 -4.39 0.39 -0.02 -1.26 -4.33 135.00 125.66 1q3g n PRO 38 Ca -0.03 0.57 -0.20 0.00 -2.02 0.00 0.00 63.50 61.82 1q3g n PRO 38 Cb 0.60 -2.22 -0.14 0.00 -0.02 0.00 0.00 33.50 31.72 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 -1.25 1.02 -0.16 -1.45 1.01 0.15 -2.14 120.40 117.57 1q3g s VAL 39 Ca 0.63 -0.84 -0.00 0.00 0.00 0.00 0.00 61.98 61.77 1q3g s VAL 39 Cb -0.52 -0.91 0.04 0.00 0.00 0.00 0.00 36.38 34.99 1q3g s VAL 39 CO 0.56 0.07 -0.06 -0.70 0.00 0.00 0.00 175.10 174.96 1q3g s GLU 40 N -0.89 1.56 -0.31 2.72 2.12 0.02 0.04 118.70 123.96 1q3g s GLU 40 Ca 0.02 -0.53 -0.09 0.00 0.36 0.00 0.00 54.97 54.73 1q3g s GLU 40 Cb -0.07 -2.02 -0.01 0.00 0.26 0.00 0.00 34.13 32.30 1q3g s GLU 40 CO 0.01 -0.40 0.15 0.42 -0.54 0.00 0.00 175.26 174.89 1q3g s ILE 41 N 1.61 4.55 0.41 -3.70 1.01 -0.20 -1.46 121.20 123.41 1q3g s ILE 41 Ca 0.01 -0.45 -0.02 0.00 0.00 0.00 0.00 60.65 60.20 1q3g s ILE 41 Cb -0.15 -3.32 -0.03 0.00 0.01 0.00 0.00 42.46 38.97 1q3g s ILE 41 CO -0.08 0.06 0.65 -1.10 0.00 0.00 0.00 174.94 174.48 1q3g s GLN 42 N 1.60 3.45 -1.47 2.79 -0.21 0.11 -0.65 119.66 125.30 1q3g s GLN 42 Ca 0.04 -0.15 -0.07 0.00 0.02 0.00 0.00 55.36 55.20 1q3g s GLN 42 Cb -0.17 -2.54 0.01 0.00 1.00 0.00 0.00 33.01 31.31 1q3g s GLN 42 CO 0.06 -0.04 0.89 -1.71 -2.12 0.00 0.00 175.29 172.37 1q3g n ASN 43 N -2.00 -6.20 -4.65 5.90 5.15 -1.03 -1.16 115.26 111.27 1q3g n ASN 43 Ca -0.02 -0.42 -0.41 0.00 -0.60 0.00 0.00 54.58 53.13 1q3g n ASN 43 Cb 0.56 -4.94 -0.05 0.00 -0.53 0.00 0.00 39.78 34.82 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 -3.25 4.91 0.68 3.44 1.01 -0.43 -3.20 120.40 123.56 1q3g s VAL 44 Ca 0.45 1.45 -0.16 0.00 0.00 0.00 0.00 61.98 63.72 1q3g s VAL 44 Cb -0.20 -4.06 0.01 0.00 0.00 0.00 0.00 36.38 32.13 1q3g s VAL 44 CO 0.56 0.02 1.17 -2.16 0.00 0.00 0.00 175.10 174.69 1q3g s PRO 45 N 2.34 2.55 -0.84 2.72 0.04 -1.26 -4.77 135.00 135.78 1q3g s PRO 45 Ca 0.34 1.65 -0.18 0.00 0.04 0.00 0.00 61.00 62.85 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 0.10 -1.50 0.96 0.15 0.04 0.00 0.00 177.00 176.75 1q3g s LYS 46 N -3.84 3.50 0.21 4.56 1.02 -1.26 -4.87 119.74 119.06 1q3g s LYS 46 Ca 0.72 -1.85 0.09 0.00 0.02 0.00 0.00 55.97 54.95 1q3g s LYS 46 Cb -0.26 -4.66 -0.05 0.00 -0.52 0.00 0.00 37.83 32.34 1q3g s LYS 46 CO 0.41 -1.61 -0.16 -0.51 -0.92 0.00 0.00 175.35 172.56 1q3g s LEU 47 N 2.05 2.54 0.26 3.17 1.43 -1.26 -4.58 118.68 122.29 1q3g s LEU 47 Ca 0.25 -0.99 -0.03 0.00 -1.03 0.00 0.00 54.13 52.33 1q3g s LEU 47 Cb -0.10 -0.77 0.39 0.00 0.03 0.00 0.00 46.19 45.75 1q3g s LEU 47 CO -0.06 -0.11 1.87 0.50 0.23 0.00 0.00 176.35 178.78 1q3g h LYS 48 N 2.64 1.08 -0.03 1.70 3.11 -1.57 -1.37 116.57 122.12 1q3g h LYS 48 Ca -0.39 -0.06 -0.05 0.00 -2.81 0.00 0.00 60.65 57.33 1q3g h LYS 48 Cb 1.22 -0.24 -0.01 0.00 -1.00 0.00 0.00 32.23 32.20 1q3g h LYS 48 CO 0.60 0.71 -0.24 -0.44 -2.81 0.00 0.00 179.45 177.27 1q3g h ASP 49 N 1.11 0.04 0.02 4.20 3.32 -1.83 -1.29 116.42 121.98 1q3g h ASP 49 Ca 0.42 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 57.32 1q3g h ASP 49 Cb 0.19 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1q3g h ASP 49 CO -0.18 0.28 -0.47 0.40 -1.72 0.00 0.00 179.24 177.55 1q3g h ILE 50 N 0.04 1.31 -0.18 0.35 1.08 -1.59 -0.60 117.51 117.91 1q3g h ILE 50 Ca 0.01 -1.67 -0.03 0.00 -0.39 0.00 0.00 64.86 62.78 1q3g h ILE 50 Cb 0.44 1.66 -0.01 0.00 -3.07 0.00 0.00 36.82 35.85 1q3g h ILE 50 CO 0.03 0.52 0.02 0.44 -0.69 0.00 0.00 178.15 178.47 1q3g h ASP 51 N 0.42 0.30 -0.97 1.72 3.32 -0.95 -0.81 116.42 119.47 1q3g h ASP 51 Ca 0.03 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.79 1q3g h ASP 51 Cb 0.98 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 40.40 1q3g h ASP 51 CO 0.09 0.51 0.60 0.74 -1.72 0.00 0.00 179.24 179.46 1q3g h THR 52 N 0.09 1.26 -0.36 0.35 2.02 -1.12 0.30 112.91 115.45 1q3g h THR 52 Ca 0.05 -0.53 -0.02 0.00 0.77 0.00 0.00 66.41 66.68 1q3g h THR 52 Cb 0.34 -0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.61 1q3g h THR 52 CO 0.01 0.26 0.13 0.74 0.37 0.00 0.00 175.52 177.03 1q3g h THR 53 N 1.32 1.20 -0.89 3.16 2.02 -0.92 -0.76 112.91 118.04 1q3g h THR 53 Ca 0.35 -0.63 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 1q3g h THR 53 Cb -0.09 0.95 -0.04 0.00 -1.74 0.00 0.00 68.15 67.22 1q3g h THR 53 CO -0.07 0.22 0.50 0.24 0.37 0.00 0.00 175.52 176.79 1q3g h MET 54 N 0.43 1.23 0.09 6.66 2.07 -0.63 0.81 114.93 125.59 1q3g h MET 54 Ca 0.12 -0.13 -0.00 0.00 -2.07 0.00 0.00 59.70 57.61 1q3g h MET 54 Cb 0.22 -0.25 -0.00 0.00 -1.87 0.00 0.00 31.60 29.70 1q3g h MET 54 CO -0.01 0.89 -0.06 -0.22 1.07 0.00 0.00 176.91 178.58 1q3g h LYS 55 N 1.24 -0.14 -0.13 1.72 3.64 -0.58 -0.41 116.57 121.91 1q3g h LYS 55 Ca 0.32 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.72 1q3g h LYS 55 Cb 0.00 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1q3g h LYS 55 CO -0.05 -0.09 0.03 1.25 -2.27 0.00 0.00 179.45 178.32 1q3g h LEU 56 N -0.14 0.02 -0.41 5.20 6.46 -0.70 -0.74 115.31 125.00 1q3g h LEU 56 Ca -0.01 0.02 0.05 0.00 -0.12 0.00 0.00 57.88 57.82 1q3g h LEU 56 Cb 0.12 0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 40.03 1q3g h LEU 56 CO 0.01 0.03 0.14 -0.07 -0.62 0.00 0.00 178.44 177.93 1q3g h LEU 57 N 0.09 0.14 -1.27 2.25 3.38 -0.64 -1.37 115.31 117.89 1q3g h LEU 57 Ca 0.06 0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.09 1q3g h LEU 57 Cb 0.04 0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1q3g h LEU 57 CO -0.07 0.12 0.50 0.74 0.09 0.00 0.00 178.44 179.82 1q3g h THR 58 N 0.30 1.17 0.00 0.22 2.02 -0.76 -0.29 112.91 115.57 1q3g h THR 58 Ca 0.19 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 67.03 1q3g h THR 58 Cb 0.18 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.68 1q3g h THR 58 CO -0.20 0.18 0.00 1.67 0.37 0.00 0.00 175.52 177.54 1q3g n GLN 59 N -4.43 0.10 0.00 6.66 0.00 -0.31 -1.12 117.38 118.28 1q3g n GLN 59 Ca 0.09 0.36 0.12 0.00 -0.00 0.00 0.00 57.00 57.56 1q3g n GLN 59 Cb 0.06 -1.69 0.11 0.00 0.00 0.00 0.00 30.24 28.71 1q3g n GLN 59 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1q3g n LEU 60 N -1.88 1.89 0.00 1.69 4.77 -0.18 -4.83 117.00 118.46 1q3g n LEU 60 Ca 0.03 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.34 1q3g n LEU 60 Cb 0.19 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1q3g n LEU 60 CO 0.16 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 1q3g n GLY 61 N 1.39 1.42 3.91 -0.72 0.00 -0.27 -1.83 105.19 109.08 1q3g n GLY 61 Ca 0.11 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 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 5.22 -0.36 2.61 2.01 -0.83 -4.17 115.64 118.12 1q3g s THR 62 Ca 0.00 -0.11 -0.13 0.00 0.31 0.00 0.00 61.69 61.76 1q3g s THR 62 Cb 0.00 -3.64 -0.01 0.00 0.01 0.00 0.00 72.50 68.86 1q3g s THR 62 CO 0.00 0.03 0.25 -0.54 -0.69 0.00 0.00 174.62 173.67 1q3g s LYS 63 N -2.72 3.34 0.03 4.92 1.02 -0.62 -4.18 119.74 121.54 1q3g s LYS 63 Ca 0.39 -0.75 0.05 0.00 0.02 0.00 0.00 55.97 55.68 1q3g s LYS 63 Cb -0.12 -3.84 -0.02 0.00 -0.52 0.00 0.00 37.83 33.33 1q3g s LYS 63 CO 0.26 -0.53 -0.14 0.08 -0.92 0.00 0.00 175.35 174.11 1q3g s VAL 64 N 1.70 1.09 -0.03 3.17 1.01 -1.26 -1.16 120.40 124.92 1q3g s VAL 64 Ca 0.06 -0.96 -0.29 0.00 0.00 0.00 0.00 61.98 60.79 1q3g s VAL 64 Cb -0.18 -0.99 0.10 0.00 0.00 0.00 0.00 36.38 35.32 1q3g s VAL 64 CO 0.10 0.02 0.86 -1.83 0.00 0.00 0.00 175.10 174.25 1q3g s GLU 65 N -1.07 0.84 0.30 2.72 -1.05 -1.03 -5.01 118.70 114.39 1q3g s GLU 65 Ca 0.02 -0.15 0.00 0.00 -0.15 0.00 0.00 54.97 54.69 1q3g s GLU 65 Cb -0.08 0.39 -0.00 0.00 -0.44 0.00 0.00 34.13 34.01 1q3g s GLU 65 CO 0.01 -0.34 0.37 2.89 0.95 0.00 0.00 175.26 179.15 1q3g n ARG 66 N 0.10 0.54 0.00 -4.83 1.85 -1.26 -0.17 116.66 112.89 1q3g n ARG 66 Ca -0.11 -2.50 0.00 0.00 -1.00 0.00 0.00 57.85 54.23 1q3g n ARG 66 Cb 0.61 2.31 0.00 0.00 -1.05 0.00 0.00 32.46 34.33 1q3g n ARG 66 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 1q3g n ASP 67 N -1.74 0.00 0.07 2.89 5.68 -1.26 -5.00 116.55 117.19 1q3g n ASP 67 Ca 0.02 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.43 1q3g n ASP 67 Cb 0.51 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.52 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 4.59 -1.38 3.76 6.12 0.00 -1.26 -5.08 105.19 111.95 1q3g n GLY 68 Ca 0.00 -0.29 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 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 -4.79 4.65 -0.15 1.61 0.01 -1.26 -1.31 113.70 112.46 1q3g s SER 69 Ca 0.01 -0.88 0.00 0.00 1.31 0.00 0.00 55.95 56.39 1q3g s SER 69 Cb 0.12 -0.61 0.02 0.00 0.21 0.00 0.00 66.02 65.76 1q3g s SER 69 CO 0.78 -0.45 -0.14 -0.69 0.41 0.00 0.00 173.24 173.15 1q3g s VAL 70 N -2.50 1.60 -0.19 3.43 1.01 0.18 -4.36 120.40 119.57 1q3g s VAL 70 Ca 0.41 -0.67 -0.14 0.00 0.00 0.00 0.00 61.98 61.58 1q3g s VAL 70 Cb -0.00 -1.51 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 1q3g s VAL 70 CO 0.24 0.44 0.30 0.26 0.00 0.00 0.00 175.10 176.33 1q3g s TRP 71 N 1.47 3.41 -0.03 5.22 0.51 0.76 -1.04 118.94 129.24 1q3g s TRP 71 Ca 0.05 0.53 0.07 0.00 -2.12 0.00 0.00 56.10 54.62 1q3g s TRP 71 Cb -0.13 -2.38 -0.01 0.00 -0.81 0.00 0.00 33.47 30.13 1q3g s TRP 71 CO -0.11 0.13 -0.23 0.42 -0.51 0.00 0.00 176.95 176.65 1q3g s ILE 72 N 0.83 1.88 -0.35 2.03 -1.09 0.11 -2.48 121.20 122.14 1q3g s ILE 72 Ca 0.15 -1.00 -0.01 0.00 -2.23 0.00 0.00 60.65 57.57 1q3g s ILE 72 Cb -0.14 -1.58 0.12 0.00 -1.58 0.00 0.00 42.46 39.29 1q3g s ILE 72 CO 0.05 0.53 0.17 -0.62 -1.23 0.00 0.00 174.94 173.84 1q3g s ASP 73 N -0.37 3.56 -0.32 3.58 3.68 -0.31 0.31 116.67 126.80 1q3g s ASP 73 Ca 0.04 -1.93 0.10 0.00 2.13 0.00 0.00 52.55 52.89 1q3g s ASP 73 Cb -0.11 -0.67 0.67 0.00 -1.45 0.00 0.00 42.92 41.36 1q3g s ASP 73 CO 0.01 -0.36 1.71 0.00 0.13 0.00 0.00 175.17 176.66 1q3g n ALA 74 N 4.43 4.45 -0.22 3.66 0.00 -1.26 -1.58 120.51 129.99 1q3g n ALA 74 Ca 0.03 -2.55 0.04 0.00 0.00 0.00 0.00 53.44 50.96 1q3g n ALA 74 Cb 0.39 -1.11 0.30 0.00 0.00 0.00 0.00 19.45 19.02 1q3g n ALA 74 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1q3g h SER 75 N 2.05 0.78 -2.22 0.00 4.64 -1.73 -3.25 113.55 113.81 1q3g h SER 75 Ca 0.27 -0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 61.01 1q3g h SER 75 Cb 2.17 -0.17 -0.42 0.00 -0.31 0.00 0.00 62.40 63.68 1q3g h SER 75 CO 0.66 0.51 -0.69 -3.20 -0.87 0.00 0.00 176.83 173.24 1q3g n ASN 76 N -4.47 3.73 -4.69 4.97 4.05 -1.26 -5.01 115.26 112.59 1q3g n ASN 76 Ca 0.11 -3.50 -0.42 0.00 0.45 0.00 0.00 54.58 51.22 1q3g n ASN 76 Cb 0.18 -0.61 -0.03 0.00 1.23 0.00 0.00 39.78 40.55 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 -3.46 3.46 -0.08 3.44 1.01 -1.23 -4.73 120.40 118.82 1q3g s VAL 77 Ca 0.44 0.89 0.12 0.00 0.00 0.00 0.00 61.98 63.43 1q3g s VAL 77 Cb 0.23 -3.57 0.18 0.00 0.00 0.00 0.00 36.38 33.23 1q3g s VAL 77 CO -0.09 0.00 1.09 -0.46 0.00 0.00 0.00 175.10 175.64 1q3g n ASN 78 N 5.34 1.54 -3.79 3.32 2.04 -0.76 -5.00 115.26 117.96 1q3g n ASN 78 Ca 0.14 -2.67 -0.13 0.00 -0.44 0.00 0.00 54.58 51.48 1q3g n ASN 78 Cb 0.42 -0.33 -0.09 0.00 -2.53 0.00 0.00 39.78 37.25 1q3g n ASN 78 CO 0.00 0.00 0.00 0.21 -0.44 0.00 0.00 177.26 177.03 1q3g s ASN 79 N -2.17 -0.13 -0.08 0.53 2.47 -0.93 -4.97 114.94 109.66 1q3g s ASN 79 Ca 0.20 -0.01 0.22 0.00 0.42 0.00 0.00 52.86 53.70 1q3g s ASN 79 Cb 0.18 0.29 0.44 0.00 -1.45 0.00 0.00 41.25 40.70 1q3g s ASN 79 CO 0.02 -0.44 1.17 0.49 -3.72 0.00 0.00 177.10 174.62 1q3g n PHE 80 N 1.26 0.24 -5.06 0.43 3.72 -1.26 -4.75 117.46 112.04 1q3g n PHE 80 Ca -0.22 -0.93 -0.28 0.00 -0.05 0.00 0.00 57.45 55.97 1q3g n PHE 80 Cb 0.56 -0.18 -0.16 0.00 -0.94 0.00 0.00 39.48 38.76 1q3g n PHE 80 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1q3g s SER 81 N -2.50 2.53 -0.50 4.37 0.15 -1.26 -1.13 113.70 115.36 1q3g s SER 81 Ca 0.34 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.61 1q3g s SER 81 Cb 0.38 -0.32 0.13 0.00 -1.71 0.00 0.00 66.02 64.50 1q3g s SER 81 CO -0.13 0.26 0.27 0.00 1.20 0.00 0.00 173.24 174.84 1q3g s ALA 82 N -0.46 3.30 0.42 5.45 0.00 -0.10 -4.84 121.76 125.53 1q3g s ALA 82 Ca 0.07 -3.01 -0.24 0.00 0.00 0.00 0.00 51.96 48.79 1q3g s ALA 82 Cb -0.09 -2.35 -0.11 0.00 0.00 0.00 0.00 23.12 20.58 1q3g s ALA 82 CO -0.00 -1.95 0.89 -0.35 0.00 0.00 0.00 175.76 174.35 1q3g n PRO 83 N 3.71 1.13 -0.05 0.00 -0.04 -1.26 -2.19 135.00 136.29 1q3g n PRO 83 Ca 0.04 0.41 -0.08 0.00 -0.04 0.00 0.00 63.50 63.82 1q3g n PRO 83 Cb 0.37 -1.90 -0.02 0.00 -0.04 0.00 0.00 33.50 31.91 1q3g n PRO 83 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 1q3g h TYR 84 N 1.32 -0.74 0.00 0.54 3.20 -1.97 0.15 116.97 119.47 1q3g h TYR 84 Ca -0.43 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.48 1q3g h TYR 84 Cb 1.35 0.36 0.00 0.00 1.54 0.00 0.00 36.73 39.99 1q3g h TYR 84 CO 0.42 -0.35 0.08 -0.40 -1.64 0.00 0.00 178.16 176.27 1q3g n ASP 85 N -5.39 0.04 -0.13 -2.11 5.75 -1.26 -1.18 116.55 112.27 1q3g n ASP 85 Ca -0.01 0.45 -0.26 0.00 -0.01 0.00 0.00 54.79 54.96 1q3g n ASP 85 Cb 0.31 -0.45 -0.10 0.00 -1.03 0.00 0.00 41.12 39.85 1q3g n ASP 85 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 1q3g n LEU 86 N -1.49 2.01 0.26 -2.12 0.00 -0.04 -4.46 117.00 111.17 1q3g n LEU 86 Ca -0.00 0.24 0.16 0.00 0.00 0.00 0.00 56.01 56.40 1q3g n LEU 86 Cb 0.08 -0.77 0.61 0.00 0.00 0.00 0.00 43.42 43.34 1q3g n LEU 86 CO 0.01 0.60 0.95 -0.37 0.00 0.00 0.00 177.39 178.57 1q3g h VAL 87 N -0.77 0.09 0.00 1.96 -1.51 -0.89 -2.27 116.25 112.86 1q3g h VAL 87 Ca -0.64 -0.65 0.00 0.00 -1.23 0.00 0.00 66.70 64.18 1q3g h VAL 87 Cb 1.62 1.59 0.00 0.00 -2.13 0.00 0.00 31.29 32.37 1q3g h VAL 87 CO -0.34 0.04 0.00 2.29 -1.23 0.00 0.00 177.57 178.32 1q3g n LYS 88 N -3.14 0.13 -0.00 5.19 2.85 -0.32 -1.50 118.16 121.37 1q3g n LYS 88 Ca 0.01 0.42 0.08 0.00 -1.05 0.00 0.00 58.31 57.77 1q3g n LYS 88 Cb 0.34 -1.78 -0.10 0.00 -0.65 0.00 0.00 35.03 32.84 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 -2.03 0.00 -3.15 0.58 -2.24 -0.86 -4.86 114.28 101.72 1q3g n THR 89 Ca 0.02 -0.11 0.04 0.00 -2.27 0.00 0.00 64.05 61.73 1q3g n THR 89 Cb 0.17 0.95 -0.00 0.00 -2.10 0.00 0.00 70.33 69.35 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 -2.68 0.49 0.41 -0.78 -2.45 -0.56 -5.02 119.30 108.72 1q3g s MET 90 Ca 0.06 0.48 0.29 0.00 -1.25 0.00 0.00 55.69 55.26 1q3g s MET 90 Cb 0.13 0.22 1.45 0.00 1.25 0.00 0.00 34.83 37.88 1q3g s MET 90 CO 0.72 -0.92 1.88 0.07 1.05 0.00 0.00 175.02 177.81 1q3g h ARG 91 N 7.87 0.00 0.00 4.11 0.11 -1.86 -2.28 114.38 122.33 1q3g h ARG 91 Ca -0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.06 1q3g h ARG 91 Cb 1.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.27 1q3g h ARG 91 CO 0.11 0.00 0.00 0.00 0.10 0.00 0.00 179.97 180.18 1q3g n ALA 92 N -1.88 1.45 0.49 0.08 0.00 -1.26 -2.00 120.51 117.39 1q3g n ALA 92 Ca -0.01 0.02 0.06 0.00 0.00 0.00 0.00 53.44 53.51 1q3g n ALA 92 Cb 0.12 -1.23 0.28 0.00 0.00 0.00 0.00 19.45 18.61 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 -1.77 0.00 0.29 0.00 3.41 -0.86 -1.59 113.62 113.10 1q3g n SER 93 Ca 0.02 0.27 0.16 0.00 -0.26 0.00 0.00 58.87 59.06 1q3g n SER 93 Cb 0.13 -0.37 0.89 0.00 -0.26 0.00 0.00 64.21 64.60 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 0.35 0.00 -1.33 6.09 -1.67 -1.92 117.51 119.04 1q3g h ILE 94 Ca 0.00 -0.28 0.00 0.00 -1.37 0.00 0.00 64.86 63.21 1q3g h ILE 94 Cb 0.14 1.20 0.00 0.00 0.47 0.00 0.00 36.82 38.64 1q3g h ILE 94 CO 0.00 0.05 0.00 0.79 -3.07 0.00 0.00 178.15 175.92 1q3g n TRP 95 N -3.48 0.00 0.03 2.19 8.01 -0.62 -2.38 117.44 121.18 1q3g n TRP 95 Ca -0.02 0.00 -0.08 0.00 -1.31 0.00 0.00 57.50 56.09 1q3g n TRP 95 Cb 0.17 -0.12 -0.13 0.00 -2.01 0.00 0.00 31.31 29.22 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 2.76 0.52 -0.17 6.99 0.00 -1.58 -3.37 119.26 124.40 1q3g h ALA 96 Ca 0.00 -1.14 0.05 0.00 0.00 0.00 0.00 54.91 53.83 1q3g h ALA 96 Cb 0.05 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 1q3g h ALA 96 CO 0.00 1.38 -0.22 1.25 0.00 0.00 0.00 179.25 181.67 1q3g h LEU 97 N 0.00 -0.68 0.42 0.00 5.85 -1.67 -1.99 115.31 117.24 1q3g h LEU 97 Ca -0.12 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1q3g h LEU 97 Cb 1.87 0.31 -0.03 0.00 0.37 0.00 0.00 40.66 43.19 1q3g h LEU 97 CO 0.11 -0.26 -0.50 1.23 -0.34 0.00 0.00 178.44 178.68 1q3g h GLY 98 N -0.25 -1.19 0.89 3.75 0.00 -1.76 -1.42 103.07 103.09 1q3g h GLY 98 Ca 0.11 0.58 0.02 0.00 0.00 0.00 0.00 47.33 48.05 1q3g h GLY 98 CO -0.32 -0.35 0.40 -2.55 0.00 0.00 0.00 176.54 173.72 1q3g h PRO 99 N -0.94 0.76 -0.30 4.80 0.11 -1.73 -0.95 132.00 133.74 1q3g h PRO 99 Ca -0.05 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 66.04 1q3g h PRO 99 Cb 0.84 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.75 1q3g h PRO 99 CO -0.11 0.51 0.13 -0.07 -0.21 0.00 0.00 178.00 178.25 1q3g h LEU 100 N 0.79 0.17 -0.68 2.35 3.38 -1.26 -0.15 115.31 119.90 1q3g h LEU 100 Ca 0.25 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 58.11 1q3g h LEU 100 Cb 0.00 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1q3g h LEU 100 CO -0.09 0.13 -0.44 1.62 0.09 0.00 0.00 178.44 179.74 1q3g h VAL 101 N 0.27 1.31 -0.17 1.22 3.04 -1.07 0.12 116.25 120.98 1q3g h VAL 101 Ca 0.13 -1.63 -0.15 0.00 -1.01 0.00 0.00 66.70 64.04 1q3g h VAL 101 Cb 0.08 1.64 -0.01 0.00 -2.01 0.00 0.00 31.29 30.99 1q3g h VAL 101 CO -0.11 0.51 -0.52 0.00 -1.01 0.00 0.00 177.57 176.43 1q3g h ALA 102 N 1.12 0.77 0.03 3.17 0.00 -0.83 -1.59 119.26 121.93 1q3g h ALA 102 Ca 0.03 -0.50 -0.37 0.00 0.00 0.00 0.00 54.91 54.07 1q3g h ALA 102 Cb 0.94 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 1q3g h ALA 102 CO 0.08 0.68 -2.30 -2.13 0.00 0.00 0.00 179.25 175.59 1q3g n ARG 103 N -3.96 0.68 -0.13 0.00 0.63 -0.10 -4.58 116.66 109.20 1q3g n ARG 103 Ca -0.03 0.16 0.06 0.00 -0.92 0.00 0.00 57.85 57.13 1q3g n ARG 103 Cb 0.58 -1.58 0.13 0.00 0.45 0.00 0.00 32.46 32.03 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 -3.22 0.33 -0.82 -0.14 3.01 0.42 -4.98 117.46 112.06 1q3g n PHE 104 Ca -0.39 -0.32 0.00 0.00 1.01 0.00 0.00 57.45 57.76 1q3g n PHE 104 Cb 1.03 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 40.49 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 0.67 0.45 3.52 1.37 0.00 -0.60 -4.94 105.19 105.66 1q3g n GLY 105 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.60 1.37 0.00 1.61 -2.07 -1.24 -1.26 119.66 117.47 1q3g s GLN 106 Ca 0.00 -0.79 0.00 0.00 -1.82 0.00 0.00 55.36 52.75 1q3g s GLN 106 Cb 0.00 0.54 0.00 0.00 -1.09 0.00 0.00 33.01 32.46 1q3g s GLN 106 CO 0.00 -0.59 0.00 0.41 -1.32 0.00 0.00 175.29 173.79 1q3g n GLY 107 N -0.35 1.97 2.76 2.60 0.00 -0.58 -2.82 105.19 108.77 1q3g n GLY 107 Ca -0.11 -0.17 -0.19 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.45 0.02 -0.03 1.61 0.00 -0.28 -0.45 119.66 119.07 1q3g s GLN 108 Ca 0.00 0.41 0.06 0.00 -0.00 0.00 0.00 55.36 55.84 1q3g s GLN 108 Cb 0.00 -0.59 -0.02 0.00 0.00 0.00 0.00 33.01 32.40 1q3g s GLN 108 CO 0.00 -0.39 -0.22 0.08 0.00 0.00 0.00 175.29 174.77 1q3g s VAL 109 N 2.25 2.41 0.19 3.63 1.01 -0.97 -0.92 120.40 127.99 1q3g s VAL 109 Ca 0.04 -0.97 -0.32 0.00 0.00 0.00 0.00 61.98 60.73 1q3g s VAL 109 Cb -0.13 -1.88 -0.11 0.00 0.00 0.00 0.00 36.38 34.27 1q3g s VAL 109 CO -0.06 0.58 1.62 -0.55 0.00 0.00 0.00 175.10 176.69 1q3g s SER 110 N -0.61 6.51 -0.13 3.32 0.15 -0.93 -0.64 113.70 121.37 1q3g s SER 110 Ca 0.09 2.72 -0.29 0.00 0.70 0.00 0.00 55.95 59.17 1q3g s SER 110 Cb -0.10 -2.60 -0.05 0.00 -1.71 0.00 0.00 66.02 61.55 1q3g s SER 110 CO -0.00 -0.88 1.85 -0.22 1.20 0.00 0.00 173.24 175.19 1q3g s LEU 111 N 1.05 4.00 0.36 3.45 0.20 0.95 -4.82 118.68 123.87 1q3g s LEU 111 Ca 0.71 2.06 -0.28 0.00 0.69 0.00 0.00 54.13 57.31 1q3g s LEU 111 Cb -0.46 -3.53 -0.10 0.00 -0.43 0.00 0.00 46.19 41.67 1q3g s LEU 111 CO 0.32 -1.31 1.38 -2.16 -0.29 0.00 0.00 176.35 174.29 1q3g s PRO 112 N 4.90 4.22 0.00 0.98 0.04 -1.26 -4.97 135.00 138.90 1q3g s PRO 112 Ca 0.83 2.35 0.00 0.00 0.04 0.00 0.00 61.00 64.22 1q3g s PRO 112 Cb -0.33 -3.00 0.00 0.00 0.04 0.00 0.00 34.50 31.21 1q3g s PRO 112 CO 0.34 -0.36 0.00 0.41 0.04 0.00 0.00 177.00 177.43 1q3g n GLY 113 N 0.65 -0.07 3.79 0.56 0.00 -1.26 -4.99 105.19 103.87 1q3g n GLY 113 Ca 0.01 -1.69 -0.32 0.00 0.00 0.00 0.00 46.02 44.02 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 -0.87 1.86 0.39 -0.02 0.00 -1.26 -4.89 107.32 102.53 1q3g s GLY 114 Ca 0.00 0.31 0.08 0.00 0.00 0.00 0.00 44.72 45.10 1q3g s GLY 114 CO 0.00 0.64 0.09 0.00 0.00 0.00 0.00 173.10 173.83 1q3g h ALA 116 N 1.62 0.21 -0.00 0.00 0.00 -1.95 -3.12 119.26 116.02 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 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1q3g h ALA 116 CO 0.71 -0.23 -0.01 0.44 0.00 0.00 0.00 179.25 180.16 1q3g n ILE 117 N -4.89 0.00 0.00 0.00 -5.35 -1.26 -4.82 119.36 103.04 1q3g n ILE 117 Ca -0.04 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.40 1q3g n ILE 117 Cb 0.10 -0.34 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 1.11 2.03 0.26 3.28 0.00 -1.18 -1.56 105.19 109.13 1q3g n GLY 118 Ca 0.20 -0.84 0.13 0.00 0.00 0.00 0.00 46.02 45.52 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 1.13 -6.87 4.61 0.00 -1.93 -1.99 119.26 114.22 1q3g h ALA 119 Ca 0.00 -0.12 -0.55 0.00 0.00 0.00 0.00 54.91 54.25 1q3g h ALA 119 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1q3g h ALA 119 CO 0.00 0.16 -1.06 0.54 0.00 0.00 0.00 179.25 178.90 1q3g n ARG 120 N -3.44 -0.87 -0.92 0.00 1.74 -1.26 -4.37 116.66 107.54 1q3g n ARG 120 Ca -0.01 0.39 -0.30 0.00 -0.77 0.00 0.00 57.85 57.16 1q3g n ARG 120 Cb 0.30 -2.28 0.17 0.00 -1.02 0.00 0.00 32.46 29.63 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 -6.20 0.81 -0.11 5.56 0.04 -1.26 -4.96 135.00 128.89 1q3g s PRO 121 Ca 0.24 1.08 0.17 0.00 0.04 0.00 0.00 61.00 62.53 1q3g s PRO 121 Cb -0.14 -1.74 0.26 0.00 0.04 0.00 0.00 34.50 32.92 1q3g s PRO 121 CO 0.93 -2.62 1.13 1.55 0.04 0.00 0.00 177.00 178.03 1q3g n VAL 122 N -4.18 1.66 -0.30 -0.36 3.14 -1.26 -4.83 118.33 112.20 1q3g n VAL 122 Ca 0.08 -2.00 0.10 0.00 -2.96 0.00 0.00 64.34 59.55 1q3g n VAL 122 Cb 0.54 -0.15 0.26 0.00 -1.06 0.00 0.00 33.84 33.43 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 0.01 0.45 0.13 6.55 2.03 -2.00 -1.12 116.42 122.47 1q3g h ASP 123 Ca -0.00 0.12 -0.06 0.00 -0.73 0.00 0.00 57.03 56.36 1q3g h ASP 123 Cb 1.05 0.06 -0.01 0.00 -0.83 0.00 0.00 39.33 39.60 1q3g h ASP 123 CO 0.00 0.13 -0.20 -0.07 -1.03 0.00 0.00 179.24 178.07 1q3g h LEU 124 N 0.53 0.13 0.19 0.15 3.38 -1.98 0.16 115.31 117.88 1q3g h LEU 124 Ca 0.50 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.43 1q3g h LEU 124 Cb 0.82 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1q3g h LEU 124 CO -0.43 0.35 -0.09 0.45 0.09 0.00 0.00 178.44 178.81 1q3g h HIS 125 N 0.13 -0.24 -0.35 1.13 3.86 -1.53 -0.26 115.15 117.89 1q3g h HIS 125 Ca 0.02 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1q3g h HIS 125 Cb 0.44 0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.97 1q3g h HIS 125 CO 0.00 -0.05 0.15 0.82 0.86 0.00 0.00 177.93 179.71 1q3g h ILE 126 N -0.37 1.18 -0.63 2.45 2.04 -1.33 -1.89 117.51 118.97 1q3g h ILE 126 Ca -0.03 -0.55 0.08 0.00 1.00 0.00 0.00 64.86 65.36 1q3g h ILE 126 Cb 0.29 0.89 -0.06 0.00 -0.74 0.00 0.00 36.82 37.19 1q3g h ILE 126 CO 0.04 0.20 0.29 0.15 0.00 0.00 0.00 178.15 178.83 1q3g h PHE 127 N 0.43 0.52 -0.06 1.37 3.57 -0.59 -0.05 116.94 122.12 1q3g h PHE 127 Ca 0.12 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.64 1q3g h PHE 127 Cb 0.17 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.77 1q3g h PHE 127 CO -0.01 0.20 0.03 0.78 -2.23 0.00 0.00 178.31 177.08 1q3g h GLY 128 N 0.52 0.09 1.02 2.40 0.00 -0.76 -1.29 103.07 105.06 1q3g h GLY 128 Ca 0.30 -0.05 -0.01 0.00 0.00 0.00 0.00 47.33 47.58 1q3g h GLY 128 CO -0.25 0.04 0.52 1.41 0.00 0.00 0.00 176.54 178.26 1q3g h LEU 129 N -0.02 1.08 -0.95 3.11 3.38 -0.99 -1.93 115.31 118.98 1q3g h LEU 129 Ca 0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1q3g h LEU 129 Cb 0.11 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1q3g h LEU 129 CO -0.00 0.84 0.50 -0.33 0.09 0.00 0.00 178.44 179.54 1q3g h GLU 130 N 1.22 1.23 0.00 1.13 5.08 -0.83 -0.63 114.58 121.79 1q3g h GLU 130 Ca 0.32 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.51 1q3g h GLU 130 Cb -0.02 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 28.98 1q3g h GLU 130 CO -0.06 0.89 -0.13 0.87 -1.00 0.00 0.00 179.01 179.58 1q3g h LYS 131 N 1.24 0.00 -0.03 2.33 1.79 -0.51 -0.89 116.57 120.50 1q3g h LYS 131 Ca 0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.78 1q3g h LYS 131 Cb 0.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 1q3g h LYS 131 CO -0.05 0.13 0.00 1.28 -1.08 0.00 0.00 179.45 179.73 1q3g n LEU 132 N -3.60 1.06 0.00 2.94 4.77 -0.33 -4.69 117.00 117.15 1q3g n LEU 132 Ca -0.02 -0.37 0.00 0.00 -0.03 0.00 0.00 56.01 55.59 1q3g n LEU 132 Cb 0.26 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1q3g n LEU 132 CO 0.30 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1q3g n GLY 133 N 1.10 0.62 3.78 -0.72 0.00 -0.34 -0.53 105.19 109.10 1q3g n GLY 133 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 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 2.89 -0.23 4.61 0.00 -0.67 -4.82 121.76 121.54 1q3g s ALA 134 Ca 0.00 0.76 -0.06 0.00 0.00 0.00 0.00 51.96 52.66 1q3g s ALA 134 Cb 0.00 -3.32 -0.02 0.00 0.00 0.00 0.00 23.12 19.78 1q3g s ALA 134 CO 0.00 -0.49 0.03 -2.00 0.00 0.00 0.00 175.76 173.30 1q3g s GLU 135 N -2.98 3.59 0.08 0.00 2.12 0.82 -4.16 118.70 118.18 1q3g s GLU 135 Ca 0.66 -0.51 0.08 0.00 0.36 0.00 0.00 54.97 55.56 1q3g s GLU 135 Cb -0.22 -3.21 -0.04 0.00 0.26 0.00 0.00 34.13 30.92 1q3g s GLU 135 CO 0.27 -0.14 -0.19 0.42 -0.54 0.00 0.00 175.26 175.08 1q3g s ILE 136 N 1.44 2.77 -0.06 -3.70 1.09 -1.26 -1.47 121.20 120.02 1q3g s ILE 136 Ca 0.05 -1.35 -0.11 0.00 -1.10 0.00 0.00 60.65 58.14 1q3g s ILE 136 Cb -0.15 -2.21 0.02 0.00 -1.06 0.00 0.00 42.46 39.07 1q3g s ILE 136 CO 0.02 0.23 0.26 -1.59 -0.10 0.00 0.00 174.94 173.76 1q3g s LYS 137 N -1.75 0.47 -0.34 2.79 -2.85 -0.30 -4.98 119.74 112.77 1q3g s LYS 137 Ca 0.16 0.05 -0.07 0.00 -1.00 0.00 0.00 55.97 55.11 1q3g s LYS 137 Cb -0.10 0.21 0.03 0.00 -2.06 0.00 0.00 37.83 35.91 1q3g s LYS 137 CO 0.07 -0.10 0.12 -1.17 0.10 0.00 0.00 175.35 174.37 1q3g s LEU 138 N -0.62 4.32 -0.04 2.77 1.98 -1.26 -0.92 118.68 124.92 1q3g s LEU 138 Ca -0.07 -1.03 0.02 0.00 -2.89 0.00 0.00 54.13 50.15 1q3g s LEU 138 Cb -0.04 -1.90 0.02 0.00 0.66 0.00 0.00 46.19 44.92 1q3g s LEU 138 CO 0.02 -0.31 -0.06 -1.83 -1.89 0.00 0.00 176.35 172.27 1q3g s GLU 139 N 1.45 0.91 -1.56 1.98 -1.05 -0.56 -4.79 118.70 115.08 1q3g s GLU 139 Ca -0.00 -0.18 -0.04 0.00 -0.15 0.00 0.00 54.97 54.59 1q3g s GLU 139 Cb -0.19 -0.86 0.01 0.00 -0.44 0.00 0.00 34.13 32.65 1q3g s GLU 139 CO 0.04 -0.01 0.52 0.39 0.95 0.00 0.00 175.26 177.15 1q3g n GLU 140 N 3.76 -4.39 -1.00 -4.83 1.02 -1.26 -1.41 120.64 112.53 1q3g n GLU 140 Ca -0.23 0.88 0.00 0.00 -0.02 0.00 0.00 57.16 57.79 1q3g n GLU 140 Cb 0.52 -5.71 0.00 0.00 -0.02 0.00 0.00 31.44 26.23 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 -1.43 0.74 3.46 0.62 0.00 -1.26 -5.02 105.19 102.30 1q3g n GLY 141 Ca -0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.95 2.95 -0.61 1.61 1.51 -0.50 -0.03 117.35 119.33 1q3g s TYR 142 Ca 0.00 -0.39 -0.23 0.00 -1.01 0.00 0.00 57.07 55.43 1q3g s TYR 142 Cb 0.00 -1.91 0.05 0.00 -0.11 0.00 0.00 41.96 40.00 1q3g s TYR 142 CO 0.00 -0.07 0.96 0.54 -1.11 0.00 0.00 175.55 175.87 1q3g s VAL 143 N 0.30 4.34 -0.26 0.71 0.11 0.19 -1.50 120.40 124.29 1q3g s VAL 143 Ca -0.06 -0.02 -0.12 0.00 -2.93 0.00 0.00 61.98 58.85 1q3g s VAL 143 Cb -0.15 -4.62 -0.05 0.00 -1.53 0.00 0.00 36.38 30.04 1q3g s VAL 143 CO 0.04 -1.30 0.25 -0.54 -3.33 0.00 0.00 175.10 170.22 1q3g s LYS 144 N 4.06 4.03 0.05 1.54 1.02 -0.10 -2.30 119.74 128.05 1q3g s LYS 144 Ca 0.26 -0.15 0.09 0.00 0.02 0.00 0.00 55.97 56.20 1q3g s LYS 144 Cb -0.14 -3.61 -0.03 0.00 -0.52 0.00 0.00 37.83 33.53 1q3g s LYS 144 CO 0.15 -0.11 -0.26 0.00 -0.92 0.00 0.00 175.35 174.20 1q3g s ALA 145 N 1.57 2.29 0.13 5.17 0.00 0.40 -1.15 121.76 130.17 1q3g s ALA 145 Ca 0.11 -1.28 -0.14 0.00 0.00 0.00 0.00 51.96 50.64 1q3g s ALA 145 Cb -0.15 -0.48 0.02 0.00 0.00 0.00 0.00 23.12 22.51 1q3g s ALA 145 CO 0.08 0.54 0.37 -1.54 0.00 0.00 0.00 175.76 175.21 1q3g s SER 146 N -1.32 -0.15 -0.25 0.00 1.04 -0.54 -1.53 113.70 110.95 1q3g s SER 146 Ca 0.12 -0.45 -0.16 0.00 0.48 0.00 0.00 55.95 55.94 1q3g s SER 146 Cb -0.10 0.46 0.07 0.00 0.10 0.00 0.00 66.02 66.55 1q3g s SER 146 CO 0.03 -0.86 0.62 0.54 0.98 0.00 0.00 173.24 174.55 1q3g s VAL 147 N -3.84 -0.01 -0.27 5.02 0.11 -0.39 -0.13 120.40 120.90 1q3g s VAL 147 Ca 0.05 0.02 -0.23 0.00 -2.93 0.00 0.00 61.98 58.89 1q3g s VAL 147 Cb 0.02 -0.90 -0.01 0.00 -1.53 0.00 0.00 36.38 33.96 1q3g s VAL 147 CO -0.09 0.01 0.77 0.21 -3.33 0.00 0.00 175.10 172.66 1q3g s ASN 148 N 1.31 6.72 0.00 3.54 3.04 -1.26 -4.67 114.94 123.61 1q3g s ASN 148 Ca -0.08 0.84 0.00 0.00 0.04 0.00 0.00 52.86 53.66 1q3g s ASN 148 Cb -0.06 -2.40 0.00 0.00 -1.54 0.00 0.00 41.25 37.25 1q3g s ASN 148 CO -0.14 -0.52 0.00 0.61 -3.04 0.00 0.00 177.10 174.01 1q3g n GLY 149 N 3.99 -1.63 3.87 1.21 0.00 -1.26 -4.91 105.19 106.47 1q3g n GLY 149 Ca 0.04 -1.51 -0.29 0.00 0.00 0.00 0.00 46.02 44.25 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 1.34 0.47 1.61 0.52 -1.26 -4.76 118.95 116.86 1q3g s ARG 150 Ca 0.00 0.01 -0.05 0.00 -0.52 0.00 0.00 55.73 55.17 1q3g s ARG 150 Cb 0.00 -1.89 -0.04 0.00 0.52 0.00 0.00 34.95 33.55 1q3g s ARG 150 CO 0.00 -2.01 0.77 -0.51 0.02 0.00 0.00 175.30 173.57 1q3g s LEU 151 N -5.80 3.66 -0.11 2.53 1.43 -1.26 -4.89 118.68 114.24 1q3g s LEU 151 Ca 0.66 0.90 -0.01 0.00 -1.03 0.00 0.00 54.13 54.65 1q3g s LEU 151 Cb -0.10 -3.84 -0.03 0.00 0.03 0.00 0.00 46.19 42.25 1q3g s LEU 151 CO 0.51 -0.55 -0.07 -0.75 0.23 0.00 0.00 176.35 175.72 1q3g s LYS 152 N -4.70 3.14 0.56 1.70 2.20 0.31 0.74 119.74 123.69 1q3g s LYS 152 Ca 0.47 -0.56 -0.21 0.00 -0.36 0.00 0.00 55.97 55.31 1q3g s LYS 152 Cb -0.10 -2.70 -0.05 0.00 -1.51 0.00 0.00 37.83 33.47 1q3g s LYS 152 CO 0.44 0.46 1.21 0.41 -0.36 0.00 0.00 175.35 177.51 1q3g n GLY 153 N 2.85 0.37 3.35 5.54 0.00 0.08 -4.48 105.19 112.89 1q3g n GLY 153 Ca -0.18 -0.03 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.36 -0.36 -0.44 4.61 0.00 -1.12 -4.76 121.76 118.33 1q3g s ALA 154 Ca 0.73 -0.59 -0.17 0.00 0.00 0.00 0.00 51.96 51.94 1q3g s ALA 154 Cb -0.43 0.77 0.03 0.00 0.00 0.00 0.00 23.12 23.49 1q3g s ALA 154 CO 0.48 -0.65 0.45 -1.58 0.00 0.00 0.00 175.76 174.46 1q3g s HIS 155 N -3.91 3.17 -0.20 0.00 2.46 -1.26 -1.35 115.29 114.20 1q3g s HIS 155 Ca 0.11 -0.50 -0.03 0.00 0.47 0.00 0.00 55.06 55.11 1q3g s HIS 155 Cb 0.02 -3.00 -0.01 0.00 -0.13 0.00 0.00 32.58 29.46 1q3g s HIS 155 CO -0.04 -0.75 -0.06 0.42 -2.47 0.00 0.00 174.74 171.83 1q3g s ILE 156 N 2.10 3.31 -0.28 0.89 1.01 0.27 -4.96 121.20 123.54 1q3g s ILE 156 Ca 0.11 -0.53 -0.10 0.00 0.00 0.00 0.00 60.65 60.13 1q3g s ILE 156 Cb -0.19 -2.48 -0.03 0.00 0.01 0.00 0.00 42.46 39.77 1q3g s ILE 156 CO 0.12 0.45 0.14 -0.69 0.00 0.00 0.00 174.94 174.96 1q3g s VAL 157 N 1.21 4.81 -0.64 2.92 1.01 -1.26 -0.24 120.40 128.20 1q3g s VAL 157 Ca 0.02 -0.11 -0.27 0.00 0.00 0.00 0.00 61.98 61.62 1q3g s VAL 157 Cb -0.14 -3.33 0.03 0.00 0.00 0.00 0.00 36.38 32.94 1q3g s VAL 157 CO -0.02 0.22 1.21 -0.04 0.00 0.00 0.00 175.10 176.47 1q3g s MET 158 N 1.68 3.37 0.00 2.72 1.00 -0.37 -4.91 119.30 122.78 1q3g s MET 158 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 55.69 55.75 1q3g s MET 158 Cb -0.16 -4.09 0.00 0.00 0.00 0.00 0.00 34.83 30.58 1q3g s MET 158 CO 0.07 -1.86 1.79 -0.40 0.00 0.00 0.00 175.02 174.62 1q3g n ASP 159 N 8.76 4.80 0.00 3.03 5.68 -1.26 -4.56 116.55 132.99 1q3g n ASP 159 Ca 0.06 -2.27 0.00 0.00 -0.50 0.00 0.00 54.79 52.08 1q3g n ASP 159 Cb 0.49 -1.01 0.00 0.00 -1.14 0.00 0.00 41.12 39.46 1q3g n ASP 159 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1q3g n LYS 160 N 1.54 0.00 -2.74 0.11 4.81 -1.26 -5.12 118.16 115.50 1q3g n LYS 160 Ca 0.00 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.01 1q3g n LYS 160 Cb 0.45 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.47 1q3g n LYS 160 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1q3g s VAL 161 N -0.85 4.61 -0.08 3.15 1.01 -1.26 -4.97 120.40 122.00 1q3g s VAL 161 Ca 0.00 1.55 0.00 0.00 0.00 0.00 0.00 61.98 63.53 1q3g s VAL 161 Cb 0.00 -4.32 0.02 0.00 0.00 0.00 0.00 36.38 32.08 1q3g s VAL 161 CO 0.00 -0.40 -0.06 -0.55 0.00 0.00 0.00 175.10 174.10 1q3g s SER 162 N 1.63 1.70 0.03 3.32 0.15 -1.26 -4.99 113.70 114.28 1q3g s SER 162 Ca 0.41 -0.21 -0.24 0.00 0.70 0.00 0.00 55.95 56.61 1q3g s SER 162 Cb -0.13 -0.65 -0.17 0.00 -1.71 0.00 0.00 66.02 63.36 1q3g s SER 162 CO 0.14 -0.10 1.48 0.58 1.20 0.00 0.00 173.24 176.54 1q3g h VAL 163 N 6.18 1.22 0.17 4.45 2.07 -1.95 -2.00 116.25 126.39 1q3g h VAL 163 Ca -0.29 -0.65 -0.01 0.00 0.82 0.00 0.00 66.70 66.57 1q3g h VAL 163 Cb 1.14 1.62 -0.00 0.00 -1.52 0.00 0.00 31.29 32.53 1q3g h VAL 163 CO 0.39 0.17 -0.09 1.23 0.02 0.00 0.00 177.57 179.29 1q3g h GLY 164 N -0.23 -0.25 1.03 2.17 0.00 -2.00 -2.08 103.07 101.72 1q3g h GLY 164 Ca 0.01 0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.44 1q3g h GLY 164 CO 0.00 -0.10 0.62 0.00 0.00 0.00 0.00 176.54 177.07 1q3g h ALA 165 N 0.58 1.27 -0.83 3.60 0.00 -1.93 -1.02 119.26 120.94 1q3g h ALA 165 Ca -0.02 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1q3g h ALA 165 Cb 0.20 -0.39 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1q3g h ALA 165 CO 0.03 0.66 0.51 1.15 0.00 0.00 0.00 179.25 181.60 1q3g h THR 166 N 1.32 1.23 -0.11 0.00 2.02 -1.17 -1.44 112.91 114.76 1q3g h THR 166 Ca 0.35 -0.48 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 1q3g h THR 166 Cb -0.12 0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 66.34 1q3g h THR 166 CO -0.07 0.23 0.03 0.58 0.37 0.00 0.00 175.52 176.66 1q3g h VAL 167 N 1.13 1.19 0.06 3.16 2.07 -0.66 -0.39 116.25 122.81 1q3g h VAL 167 Ca 0.30 -0.58 0.02 0.00 0.82 0.00 0.00 66.70 67.26 1q3g h VAL 167 Cb -0.06 1.37 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 1q3g h VAL 167 CO -0.06 0.17 -0.26 0.74 0.02 0.00 0.00 177.57 178.19 1q3g h THR 168 N -0.03 0.43 -0.14 2.57 2.02 -0.97 -0.39 112.91 116.40 1q3g h THR 168 Ca 0.03 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 1q3g h THR 168 Cb 0.24 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 1q3g h THR 168 CO -0.00 0.00 0.05 0.40 0.37 0.00 0.00 175.52 176.34 1q3g h ILE 169 N -0.43 1.17 -0.93 3.11 2.04 -1.27 -1.57 117.51 119.63 1q3g h ILE 169 Ca 0.05 -0.50 0.02 0.00 1.00 0.00 0.00 64.86 65.42 1q3g h ILE 169 Cb 0.48 1.24 -0.05 0.00 -0.74 0.00 0.00 36.82 37.75 1q3g h ILE 169 CO -0.19 0.15 0.61 -0.03 0.00 0.00 0.00 178.15 178.70 1q3g h MET 170 N 0.06 1.19 0.03 2.37 4.05 -0.98 -0.87 114.93 120.78 1q3g h MET 170 Ca 0.05 -0.07 -0.00 0.00 -0.28 0.00 0.00 59.70 59.39 1q3g h MET 170 Cb 0.19 -0.27 0.00 0.00 -0.80 0.00 0.00 31.60 30.73 1q3g h MET 170 CO -0.00 0.79 -0.02 0.77 0.23 0.00 0.00 176.91 178.68 1q3g h SER 171 N 1.23 -0.04 -0.34 1.39 0.02 -0.95 -3.15 113.55 111.71 1q3g h SER 171 Ca 0.35 -0.28 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 1q3g h SER 171 Cb -0.09 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 1q3g h SER 171 CO -0.09 0.26 0.11 0.00 -1.14 0.00 0.00 176.83 175.97 1q3g h ALA 172 N 0.61 1.44 0.00 3.77 0.00 -1.11 -2.79 119.26 121.18 1q3g h ALA 172 Ca -0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1q3g h ALA 172 Cb 0.32 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1q3g h ALA 172 CO 0.01 0.42 -0.14 0.00 0.00 0.00 0.00 179.25 179.53 1q3g h ALA 173 N 1.54 1.40 -0.22 0.00 0.00 -1.12 -3.00 119.26 117.85 1q3g h ALA 173 Ca 0.14 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 54.98 1q3g h ALA 173 Cb 0.20 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1q3g h ALA 173 CO -0.01 0.18 0.17 1.79 0.00 0.00 0.00 179.25 181.38 1q3g h THR 174 N 0.00 0.81 -0.46 0.00 1.35 -1.46 -0.91 112.91 112.25 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 0.34 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 67.64 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 -4.35 3.78 -4.90 3.87 4.77 -1.14 -0.81 117.00 118.23 1q3g n LEU 175 Ca 0.02 -2.34 -0.29 0.00 -0.03 0.00 0.00 56.01 53.38 1q3g n LEU 175 Cb 0.31 -0.43 0.04 0.00 -2.33 0.00 0.00 43.42 41.01 1q3g n LEU 175 CO 0.34 0.77 0.67 0.00 -1.33 0.00 0.00 177.39 177.84 1q3g s ALA 176 N -1.62 3.04 -0.44 -1.18 0.00 -0.35 -4.50 121.76 116.72 1q3g s ALA 176 Ca 0.38 -0.48 -0.19 0.00 0.00 0.00 0.00 51.96 51.67 1q3g s ALA 176 Cb 0.24 -2.87 0.03 0.00 0.00 0.00 0.00 23.12 20.52 1q3g s ALA 176 CO 0.19 -1.02 0.54 -2.00 0.00 0.00 0.00 175.76 173.46 1q3g s GLU 177 N -5.23 3.16 0.00 0.00 2.12 0.23 -3.81 118.70 115.17 1q3g s GLU 177 Ca 0.57 -0.64 0.00 0.00 0.36 0.00 0.00 54.97 55.25 1q3g s GLU 177 Cb -0.11 -3.98 0.00 0.00 0.26 0.00 0.00 34.13 30.30 1q3g s GLU 177 CO 0.49 -0.96 0.00 0.41 -0.54 0.00 0.00 175.26 174.66 1q3g n GLY 178 N 5.09 -0.82 3.61 -1.50 0.00 -1.26 -0.74 105.19 109.58 1q3g n GLY 178 Ca -0.05 -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 4.13 -0.00 2.61 2.01 -1.26 -1.03 115.64 122.10 1q3g s THR 179 Ca 0.00 -0.30 0.06 0.00 0.31 0.00 0.00 61.69 61.76 1q3g s THR 179 Cb 0.00 -2.76 -0.03 0.00 0.01 0.00 0.00 72.50 69.73 1q3g s THR 179 CO 0.00 0.57 -0.17 -0.89 -0.69 0.00 0.00 174.62 173.44 1q3g s THR 180 N -0.47 2.85 -0.10 -0.82 2.01 0.17 -2.81 115.64 116.48 1q3g s THR 180 Ca 0.08 -0.98 -0.00 0.00 0.31 0.00 0.00 61.69 61.10 1q3g s THR 180 Cb -0.12 -2.15 0.02 0.00 0.01 0.00 0.00 72.50 70.26 1q3g s THR 180 CO 0.02 0.46 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.72 1q3g s ILE 181 N -0.82 0.91 -0.36 1.82 1.01 -0.45 -0.42 121.20 122.89 1q3g s ILE 181 Ca 0.13 -0.23 -0.12 0.00 0.00 0.00 0.00 60.65 60.43 1q3g s ILE 181 Cb -0.11 -0.94 0.01 0.00 0.01 0.00 0.00 42.46 41.44 1q3g s ILE 181 CO 0.03 0.34 0.21 -0.63 0.00 0.00 0.00 174.94 174.89 1q3g s ILE 182 N 1.61 4.80 0.06 2.92 1.01 0.96 -0.56 121.20 132.00 1q3g s ILE 182 Ca 0.02 -0.61 -0.18 0.00 0.00 0.00 0.00 60.65 59.88 1q3g s ILE 182 Cb -0.13 -3.58 -0.06 0.00 0.01 0.00 0.00 42.46 38.69 1q3g s ILE 182 CO -0.06 -0.13 0.53 -1.61 0.00 0.00 0.00 174.94 173.67 1q3g s GLU 183 N 1.62 4.13 -1.25 2.79 0.41 0.67 -1.51 118.70 125.55 1q3g s GLU 183 Ca 0.04 0.66 -0.07 0.00 -0.41 0.00 0.00 54.97 55.19 1q3g s GLU 183 Cb -0.18 -3.23 0.01 0.00 -1.78 0.00 0.00 34.13 28.95 1q3g s GLU 183 CO 0.08 0.65 1.09 -1.71 -0.49 0.00 0.00 175.26 174.88 1q3g n ASN 184 N 1.72 -5.52 -4.81 -0.19 5.15 0.12 -1.24 115.26 110.50 1q3g n ASN 184 Ca -0.11 -0.52 -0.32 0.00 -0.60 0.00 0.00 54.58 53.03 1q3g n ASN 184 Cb 0.51 -4.78 0.03 0.00 -0.53 0.00 0.00 39.78 35.01 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 -3.31 2.72 0.29 5.20 0.00 0.17 -4.60 121.76 122.22 1q3g s ALA 185 Ca 0.47 0.23 -0.29 0.00 0.00 0.00 0.00 51.96 52.37 1q3g s ALA 185 Cb -0.21 -3.20 -0.10 0.00 0.00 0.00 0.00 23.12 19.62 1q3g s ALA 185 CO 0.69 -1.00 1.15 0.00 0.00 0.00 0.00 175.76 176.59 1q3g s ALA 186 N -2.75 3.43 -0.98 0.00 0.00 -1.26 -4.45 121.76 115.74 1q3g s ALA 186 Ca 0.61 0.98 0.17 0.00 0.00 0.00 0.00 51.96 53.71 1q3g s ALA 186 Cb -0.15 -3.36 0.60 0.00 0.00 0.00 0.00 23.12 20.21 1q3g s ALA 186 CO 0.46 -0.27 1.52 0.54 0.00 0.00 0.00 175.76 178.00 1q3g n ARG 187 N 1.18 3.38 -1.43 0.00 3.00 -1.26 -4.64 116.66 116.88 1q3g n ARG 187 Ca -0.01 -2.70 -0.37 0.00 -0.01 0.00 0.00 57.85 54.77 1q3g n ARG 187 Cb 0.44 -1.74 0.07 0.00 0.00 0.00 0.00 32.46 31.23 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 0.77 0.57 0.07 5.56 4.71 -1.26 -4.65 120.64 126.41 1q3g n GLU 188 Ca 0.22 0.24 0.04 0.00 -0.01 0.00 0.00 57.16 57.66 1q3g n GLU 188 Cb 0.78 -2.05 0.46 0.00 -1.01 0.00 0.00 31.44 29.62 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 0.00 0.39 -0.25 3.49 0.11 -1.96 -1.87 132.00 131.92 1q3g h PRO 189 Ca -0.47 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.54 1q3g h PRO 189 Cb 1.36 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1q3g h PRO 189 CO 0.47 0.29 -0.13 0.93 -0.21 0.00 0.00 178.00 179.35 1q3g h GLU 190 N 0.40 0.42 -0.31 1.05 3.07 -1.90 -0.54 114.58 116.78 1q3g h GLU 190 Ca 0.11 -0.12 -0.02 0.00 -0.50 0.00 0.00 59.36 58.83 1q3g h GLU 190 Cb 0.01 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 27.86 1q3g h GLU 190 CO -0.02 0.55 0.11 0.82 -1.40 0.00 0.00 179.01 179.08 1q3g h ILE 191 N 0.39 1.19 -0.47 3.13 1.08 -1.68 0.22 117.51 121.36 1q3g h ILE 191 Ca 0.07 -0.59 0.01 0.00 -0.39 0.00 0.00 64.86 63.97 1q3g h ILE 191 Cb 0.47 1.00 -0.03 0.00 -3.07 0.00 0.00 36.82 35.20 1q3g h ILE 191 CO 0.03 0.20 0.30 0.58 -0.69 0.00 0.00 178.15 178.57 1q3g h VAL 192 N 0.34 1.10 -0.61 1.67 2.07 -1.28 0.37 116.25 119.91 1q3g h VAL 192 Ca 0.10 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 1q3g h VAL 192 Cb 0.20 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 1q3g h VAL 192 CO -0.01 0.11 0.24 -0.78 0.02 0.00 0.00 177.57 177.16 1q3g h ASP 193 N 0.62 0.84 -0.61 0.57 3.58 -0.73 -0.63 116.42 120.06 1q3g h ASP 193 Ca 0.18 -0.17 -0.10 0.00 0.42 0.00 0.00 57.03 57.36 1q3g h ASP 193 Cb -0.04 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 40.77 1q3g h ASP 193 CO -0.05 0.78 -0.00 0.74 -2.88 0.00 0.00 179.24 177.82 1q3g h THR 194 N 0.85 1.27 -0.17 2.25 2.02 -0.23 -1.69 112.91 117.21 1q3g h THR 194 Ca 0.20 -1.16 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 1q3g h THR 194 Cb 0.20 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 1q3g h THR 194 CO -0.02 0.42 0.10 0.00 0.37 0.00 0.00 175.52 176.40 1q3g h ALA 195 N 1.00 0.22 0.00 6.16 0.00 -0.64 -1.26 119.26 124.74 1q3g h ALA 195 Ca 0.17 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1q3g h ALA 195 Cb 0.56 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1q3g h ALA 195 CO 0.03 -0.28 -0.22 -0.91 0.00 0.00 0.00 179.25 177.87 1q3g h ASN 196 N 0.20 0.00 -0.03 0.00 2.35 -0.97 -0.54 115.58 116.59 1q3g h ASN 196 Ca 0.06 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1q3g h ASN 196 Cb 0.02 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.39 1q3g h ASN 196 CO -0.01 0.22 -0.01 0.15 -1.65 0.00 0.00 177.43 176.14 1q3g h PHE 197 N 0.00 0.07 -0.79 1.19 3.57 -0.79 -1.28 116.94 118.91 1q3g h PHE 197 Ca -0.00 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.54 1q3g h PHE 197 Cb 0.42 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 39.08 1q3g h PHE 197 CO 0.00 0.40 0.48 -0.07 -2.23 0.00 0.00 178.31 176.89 1q3g h LEU 198 N -0.28 0.76 -1.34 0.59 3.38 -0.74 -0.71 115.31 116.96 1q3g h LEU 198 Ca 0.01 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1q3g h LEU 198 Cb 0.38 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1q3g h LEU 198 CO 0.00 0.49 0.26 0.58 0.09 0.00 0.00 178.44 179.86 1q3g h VAL 199 N 0.89 1.17 0.00 1.22 2.07 -0.97 -0.42 116.25 120.21 1q3g h VAL 199 Ca 0.34 -0.46 -0.06 0.00 0.82 0.00 0.00 66.70 67.35 1q3g h VAL 199 Cb 0.15 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 1q3g h VAL 199 CO -0.17 0.19 -0.27 0.00 0.02 0.00 0.00 177.57 177.34 1q3g h ALA 200 N 1.57 1.47 -0.00 1.67 0.00 0.08 -1.29 119.26 122.76 1q3g h ALA 200 Ca 0.18 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1q3g h ALA 200 Cb 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1q3g h ALA 200 CO -0.03 0.34 -0.05 1.28 0.00 0.00 0.00 179.25 180.79 1q3g n LEU 201 N -4.11 0.34 0.00 0.00 4.77 -0.40 -4.81 117.00 112.80 1q3g n LEU 201 Ca -0.02 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1q3g n LEU 201 Cb 0.33 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 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 1.21 0.99 3.74 -0.72 0.00 -0.49 -0.43 105.19 109.49 1q3g n GLY 202 Ca 0.17 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 2.10 -0.38 4.61 0.00 -0.30 -4.95 121.76 120.84 1q3g s ALA 203 Ca 0.00 0.51 -0.01 0.00 0.00 0.00 0.00 51.96 52.45 1q3g s ALA 203 Cb 0.00 -3.36 0.10 0.00 0.00 0.00 0.00 23.12 19.87 1q3g s ALA 203 CO 0.00 -1.91 0.15 0.15 0.00 0.00 0.00 175.76 174.16 1q3g s LYS 204 N -4.50 1.89 0.03 0.00 1.02 -1.26 -4.24 119.74 112.68 1q3g s LYS 204 Ca 0.66 -1.81 0.04 0.00 0.02 0.00 0.00 55.97 54.88 1q3g s LYS 204 Cb -0.21 -3.46 -0.02 0.00 -0.52 0.00 0.00 37.83 33.62 1q3g s LYS 204 CO 0.51 -1.01 -0.11 0.42 -0.92 0.00 0.00 175.35 174.24 1q3g s ILE 205 N 1.08 0.83 0.04 2.17 1.01 -1.26 -1.34 121.20 123.73 1q3g s ILE 205 Ca 0.08 -0.84 -0.12 0.00 0.00 0.00 0.00 60.65 59.77 1q3g s ILE 205 Cb -0.22 -0.77 0.01 0.00 0.01 0.00 0.00 42.46 41.49 1q3g s ILE 205 CO -0.05 -0.05 0.25 -0.94 0.00 0.00 0.00 174.94 174.15 1q3g s SER 206 N -1.00 -0.04 0.00 3.58 1.04 -0.51 -4.90 113.70 111.86 1q3g s SER 206 Ca -0.01 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.14 1q3g s SER 206 Cb -0.07 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.37 1q3g s SER 206 CO 0.01 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.25 1q3g n GLY 207 N 0.64 0.77 3.65 7.32 0.00 -1.26 -0.70 105.19 115.61 1q3g n GLY 207 Ca -0.19 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.37 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 1.88 0.00 1.61 0.00 -1.26 -0.46 117.38 117.14 1q3g n GLN 208 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 57.00 57.67 1q3g n GLN 208 Cb 0.00 -2.34 0.00 0.00 0.00 0.00 0.00 30.24 27.90 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 2.49 1.28 3.85 2.61 0.00 -1.26 -4.89 105.19 109.27 1q3g n GLY 209 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.31 1.58 -2.17 2.61 -4.23 0.39 -4.75 115.64 106.75 1q3g s THR 210 Ca 0.00 -1.64 0.24 0.00 -1.18 0.00 0.00 61.69 59.11 1q3g s THR 210 Cb 0.00 -2.23 0.60 0.00 1.34 0.00 0.00 72.50 72.22 1q3g s THR 210 CO 0.00 0.00 1.80 -0.90 -0.54 0.00 0.00 174.62 174.98 1q3g n ASP 211 N -1.58 0.73 -3.83 3.99 5.68 -1.26 -4.55 116.55 115.73 1q3g n ASP 211 Ca -0.06 -1.41 -0.29 0.00 -0.50 0.00 0.00 54.79 52.52 1q3g n ASP 211 Cb 0.65 -0.03 -0.16 0.00 -1.14 0.00 0.00 41.12 40.44 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 -1.95 1.11 -0.15 0.11 3.52 -1.25 0.14 118.95 120.48 1q3g s ARG 212 Ca 0.36 -0.73 -0.05 0.00 -0.13 0.00 0.00 55.73 55.17 1q3g s ARG 212 Cb 0.18 -2.34 -0.03 0.00 -1.56 0.00 0.00 34.95 31.19 1q3g s ARG 212 CO 0.29 -0.64 0.02 0.42 -0.81 0.00 0.00 175.30 174.57 1q3g s ILE 213 N 1.62 4.42 -0.17 4.11 1.01 -0.57 -4.44 121.20 127.17 1q3g s ILE 213 Ca -0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 60.65 60.44 1q3g s ILE 213 Cb -0.18 -2.95 0.00 0.00 0.01 0.00 0.00 42.46 39.34 1q3g s ILE 213 CO -0.08 0.50 -0.14 -0.89 0.00 0.00 0.00 174.94 174.34 1q3g s THR 214 N 0.10 2.70 -0.10 2.92 2.01 0.12 -0.03 115.64 123.37 1q3g s THR 214 Ca 0.03 -0.74 0.04 0.00 0.31 0.00 0.00 61.69 61.32 1q3g s THR 214 Cb -0.13 -2.16 0.00 0.00 0.01 0.00 0.00 72.50 70.22 1q3g s THR 214 CO 0.02 0.50 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.59 1q3g s ILE 215 N 1.06 1.94 -0.33 1.82 1.09 0.44 -1.42 121.20 125.80 1q3g s ILE 215 Ca -0.00 -0.95 -0.05 0.00 -1.10 0.00 0.00 60.65 58.55 1q3g s ILE 215 Cb -0.15 -1.68 0.05 0.00 -1.06 0.00 0.00 42.46 39.62 1q3g s ILE 215 CO -0.04 0.53 0.08 -0.70 -0.10 0.00 0.00 174.94 174.71 1q3g s GLU 216 N 0.39 2.54 0.73 2.79 2.12 -0.45 0.43 118.70 127.26 1q3g s GLU 216 Ca -0.18 -1.23 -0.16 0.00 0.36 0.00 0.00 54.97 53.76 1q3g s GLU 216 Cb -0.18 -3.38 -0.02 0.00 0.26 0.00 0.00 34.13 30.82 1q3g s GLU 216 CO 0.08 -0.67 0.70 0.41 -0.54 0.00 0.00 175.26 175.24 1q3g n GLY 217 N 4.75 -1.13 3.32 -1.50 0.00 -0.20 -4.11 105.19 106.31 1q3g n GLY 217 Ca -0.12 -0.39 -0.16 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 -1.91 0.82 0.12 1.61 -7.23 0.01 -4.72 120.40 109.10 1q3g s VAL 218 Ca 0.68 -2.01 -0.15 0.00 -1.81 0.00 0.00 61.98 58.69 1q3g s VAL 218 Cb -0.34 -2.42 -0.03 0.00 0.56 0.00 0.00 36.38 34.14 1q3g s VAL 218 CO 0.56 -0.23 1.55 -0.33 -0.31 0.00 0.00 175.10 176.33 1q3g h GLU 219 N 2.46 0.66 -3.33 4.82 5.08 -1.90 -3.40 114.58 118.98 1q3g h GLU 219 Ca -0.38 -0.22 -0.04 0.00 -1.00 0.00 0.00 59.36 57.72 1q3g h GLU 219 Cb 1.23 -0.06 -0.12 0.00 0.50 0.00 0.00 28.75 30.31 1q3g h GLU 219 CO 0.63 0.78 -0.01 -0.98 -1.00 0.00 0.00 179.01 178.44 1q3g s ARG 220 N -4.95 1.22 -0.03 2.33 1.70 -1.26 -4.99 118.95 112.97 1q3g s ARG 220 Ca -0.13 -0.76 0.03 0.00 -0.47 0.00 0.00 55.73 54.40 1q3g s ARG 220 Cb 0.09 0.50 -0.03 0.00 -0.57 0.00 0.00 34.95 34.95 1q3g s ARG 220 CO 0.79 -0.50 -0.10 -0.51 -1.08 0.00 0.00 175.30 173.89 1q3g s LEU 221 N -2.83 2.98 0.00 -1.89 1.43 -1.26 -4.88 118.68 112.22 1q3g s LEU 221 Ca 0.06 -0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 1q3g s LEU 221 Cb 0.00 -1.67 0.00 0.00 0.03 0.00 0.00 46.19 44.56 1q3g s LEU 221 CO -0.08 0.33 0.00 0.61 0.23 0.00 0.00 176.35 177.44 1q3g n GLY 222 N 2.01 0.69 0.00 -3.19 0.00 0.43 -1.39 105.19 103.73 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 3.97 0.00 -0.02 0.00 -1.26 -2.16 105.19 110.72 1q3g n GLY 223 Ca 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.09 3.03 -0.02 0.00 -0.91 -4.51 105.19 102.70 1q3g n GLY 224 Ca 0.00 -1.56 -0.26 0.00 0.00 0.00 0.00 46.02 44.19 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 -2.59 1.28 -0.02 1.61 1.01 -1.26 -0.80 120.40 119.64 1q3g s VAL 225 Ca 0.00 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.45 1q3g s VAL 225 Cb 0.00 -1.17 0.01 0.00 0.00 0.00 0.00 36.38 35.22 1q3g s VAL 225 CO 0.00 0.39 -0.02 -0.47 0.00 0.00 0.00 175.10 175.01 1q3g s TYR 226 N 0.81 0.31 -0.26 5.22 5.04 -0.54 -5.00 117.35 122.94 1q3g s TYR 226 Ca -0.11 -0.03 -0.10 0.00 -2.44 0.00 0.00 57.07 54.38 1q3g s TYR 226 Cb -0.15 -0.31 -0.05 0.00 0.35 0.00 0.00 41.96 41.79 1q3g s TYR 226 CO 0.02 -0.07 0.17 0.50 -1.34 0.00 0.00 175.55 174.82 1q3g s ARG 227 N 0.51 3.98 0.42 4.97 3.52 -1.26 0.09 118.95 131.19 1q3g s ARG 227 Ca -0.05 -0.31 -0.26 0.00 -0.13 0.00 0.00 55.73 54.98 1q3g s ARG 227 Cb -0.08 -3.57 -0.08 0.00 -1.56 0.00 0.00 34.95 29.65 1q3g s ARG 227 CO -0.01 -0.06 1.31 0.08 -0.81 0.00 0.00 175.30 175.81 1q3g s VAL 228 N 1.41 2.55 0.78 7.11 1.01 -0.31 -4.93 120.40 128.02 1q3g s VAL 228 Ca 0.07 0.49 -0.11 0.00 0.00 0.00 0.00 61.98 62.42 1q3g s VAL 228 Cb -0.15 -3.28 0.06 0.00 0.00 0.00 0.00 36.38 33.01 1q3g s VAL 228 CO 0.07 0.06 1.09 -1.48 0.00 0.00 0.00 175.10 174.84 1q3g s LEU 229 N -2.55 2.73 0.50 3.92 2.34 -1.26 -4.72 118.68 119.64 1q3g s LEU 229 Ca 0.58 1.44 -0.23 0.00 0.06 0.00 0.00 54.13 55.98 1q3g s LEU 229 Cb -0.38 -4.10 -0.06 0.00 -0.56 0.00 0.00 46.19 41.08 1q3g s LEU 229 CO 0.49 -1.91 1.38 -2.65 -1.06 0.00 0.00 176.35 172.60 1q3g n PRO 230 N -3.41 1.91 -2.44 1.48 -0.02 -1.26 -0.36 135.00 130.90 1q3g n PRO 230 Ca 0.07 0.69 -0.42 0.00 -2.02 0.00 0.00 63.50 61.82 1q3g n PRO 230 Cb 0.55 -2.58 -0.02 0.00 -0.02 0.00 0.00 33.50 31.43 1q3g n PRO 230 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1q3g s ASP 231 N -0.73 6.24 0.42 2.55 -1.08 -0.54 -4.32 116.67 119.22 1q3g s ASP 231 Ca 0.67 0.31 0.17 0.00 -0.52 0.00 0.00 52.55 53.18 1q3g s ASP 231 Cb -0.43 -2.55 0.93 0.00 -1.46 0.00 0.00 42.92 39.41 1q3g s ASP 231 CO 0.53 -1.61 1.91 0.08 0.52 0.00 0.00 175.17 176.59 1q3g h ARG 232 N 10.63 0.00 -0.03 4.34 0.11 -1.91 -2.20 114.38 125.31 1q3g h ARG 232 Ca -0.26 0.00 -0.21 0.00 0.10 0.00 0.00 59.98 59.61 1q3g h ARG 232 Cb 1.08 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.16 1q3g h ARG 232 CO 1.17 0.28 -0.85 0.82 0.10 0.00 0.00 179.97 181.48 1q3g h ILE 233 N 0.00 1.39 -0.37 0.08 1.08 -1.96 0.06 117.51 117.79 1q3g h ILE 233 Ca -0.00 -2.33 -0.06 0.00 -0.39 0.00 0.00 64.86 62.09 1q3g h ILE 233 Cb 0.54 2.29 -0.01 0.00 -3.07 0.00 0.00 36.82 36.57 1q3g h ILE 233 CO 0.04 0.70 0.02 -0.08 -0.69 0.00 0.00 178.15 178.13 1q3g h GLU 234 N 0.25 0.65 0.09 2.37 4.81 -1.88 0.45 114.58 121.31 1q3g h GLU 234 Ca -0.06 -0.20 0.02 0.00 -0.13 0.00 0.00 59.36 58.99 1q3g h GLU 234 Cb 1.47 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.76 1q3g h GLU 234 CO 0.15 0.74 -0.18 1.15 -0.73 0.00 0.00 179.01 180.14 1q3g h THR 235 N 0.47 0.58 -0.78 0.32 2.02 -1.30 -1.54 112.91 112.69 1q3g h THR 235 Ca 0.11 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.34 1q3g h THR 235 Cb 0.44 0.58 -0.05 0.00 -1.74 0.00 0.00 68.15 67.38 1q3g h THR 235 CO 0.02 0.00 0.51 1.23 0.37 0.00 0.00 175.52 177.65 1q3g h GLY 236 N -0.34 1.08 0.94 2.16 0.00 -0.80 -0.98 103.07 105.13 1q3g h GLY 236 Ca 0.03 -0.36 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 1q3g h GLY 236 CO -0.11 0.29 0.16 -0.84 0.00 0.00 0.00 176.54 176.03 1q3g h THR 237 N 0.89 1.16 -0.07 4.70 2.02 -0.21 -1.29 112.91 120.12 1q3g h THR 237 Ca 0.32 -0.47 -0.13 0.00 0.77 0.00 0.00 66.41 66.91 1q3g h THR 237 Cb 0.14 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 1q3g h THR 237 CO -0.10 0.17 -0.54 -0.26 0.37 0.00 0.00 175.52 175.15 1q3g h PHE 238 N 0.41 0.25 -0.47 3.16 -1.00 -0.70 -1.07 116.94 117.52 1q3g h PHE 238 Ca 0.12 -0.09 -0.09 0.00 2.81 0.00 0.00 57.97 60.72 1q3g h PHE 238 Cb 0.12 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.62 1q3g h PHE 238 CO -0.02 0.70 -0.08 -0.07 -1.61 0.00 0.00 178.31 177.23 1q3g h LEU 239 N 0.15 0.82 -0.78 1.54 3.38 -1.03 -2.08 115.31 117.31 1q3g h LEU 239 Ca 0.00 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 57.61 1q3g h LEU 239 Cb 1.01 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1q3g h LEU 239 CO 0.08 0.93 -0.37 0.58 0.09 0.00 0.00 178.44 179.75 1q3g h VAL 240 N 0.76 1.30 -0.85 1.22 2.07 -0.94 -1.56 116.25 118.25 1q3g h VAL 240 Ca 0.13 -1.50 0.08 0.00 0.82 0.00 0.00 66.70 66.23 1q3g h VAL 240 Cb 0.57 1.53 -0.07 0.00 -1.52 0.00 0.00 31.29 31.80 1q3g h VAL 240 CO 0.03 0.47 0.51 0.00 0.02 0.00 0.00 177.57 178.60 1q3g h ALA 241 N 1.19 1.19 -0.04 1.67 0.00 -0.53 -0.98 119.26 121.76 1q3g h ALA 241 Ca 0.04 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1q3g h ALA 241 Cb 0.84 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1q3g h ALA 241 CO 0.07 0.20 -0.30 0.00 0.00 0.00 0.00 179.25 179.22 1q3g h ALA 242 N 1.43 0.10 -0.61 0.00 0.00 -1.18 -3.15 119.26 115.83 1q3g h ALA 242 Ca 0.39 -0.45 0.11 0.00 0.00 0.00 0.00 54.91 54.96 1q3g h ALA 242 Cb 0.26 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1q3g h ALA 242 CO -0.21 0.15 0.41 0.00 0.00 0.00 0.00 179.25 179.60 1q3g h ALA 243 N 0.38 2.06 -0.01 0.00 0.00 -0.80 -1.71 119.26 119.18 1q3g h ALA 243 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1q3g h ALA 243 Cb 0.97 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1q3g h ALA 243 CO 0.06 -0.20 -0.37 0.44 0.00 0.00 0.00 179.25 179.19 1q3g n ILE 244 N -4.47 0.00 -0.77 0.00 -5.35 -0.42 -4.07 119.36 104.28 1q3g n ILE 244 Ca 0.10 -0.12 0.07 0.00 -0.27 0.00 0.00 62.75 62.53 1q3g n ILE 244 Cb 0.41 0.54 0.13 0.00 -1.74 0.00 0.00 39.64 38.98 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 -0.72 2.61 -0.31 7.28 3.41 -0.70 -4.95 113.62 120.24 1q3g n SER 245 Ca 0.10 -2.77 -0.04 0.00 -0.26 0.00 0.00 58.87 55.90 1q3g n SER 245 Cb 0.36 -0.35 -0.02 0.00 -0.26 0.00 0.00 64.21 63.95 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 -0.93 0.42 0.59 5.00 0.00 -0.99 -4.32 105.19 104.96 1q3g n GLY 246 Ca 0.13 -0.01 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 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 0.50 0.02 3.03 -0.02 0.00 -0.85 -1.80 105.19 106.08 1q3g n GLY 247 Ca -0.04 -1.86 -0.20 0.00 0.00 0.00 0.00 46.02 43.92 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 -3.04 0.90 0.02 1.61 2.20 -1.24 -1.48 119.74 118.71 1q3g s LYS 248 Ca 0.11 -0.35 -0.13 0.00 -0.36 0.00 0.00 55.97 55.23 1q3g s LYS 248 Cb -0.00 -0.86 0.02 0.00 -1.51 0.00 0.00 37.83 35.48 1q3g s LYS 248 CO 0.07 0.19 0.28 -1.50 -0.36 0.00 0.00 175.35 174.03 1q3g s ILE 249 N -0.10 0.08 -0.11 5.43 2.07 0.55 -0.90 121.20 128.23 1q3g s ILE 249 Ca 0.02 -0.65 0.01 0.00 -1.41 0.00 0.00 60.65 58.61 1q3g s ILE 249 Cb -0.06 -0.80 0.02 0.00 0.13 0.00 0.00 42.46 41.75 1q3g s ILE 249 CO -0.00 -0.36 -0.11 -0.69 -1.91 0.00 0.00 174.94 171.87 1q3g s VAL 250 N -2.09 1.23 -0.26 4.00 1.01 -0.61 -0.70 120.40 122.99 1q3g s VAL 250 Ca -0.08 -0.46 -0.13 0.00 0.00 0.00 0.00 61.98 61.31 1q3g s VAL 250 Cb -0.03 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 1q3g s VAL 250 CO -0.01 0.39 0.29 0.00 0.00 0.00 0.00 175.10 175.78 1q3g s ARG 252 N 1.75 3.51 -1.21 0.00 1.81 0.44 -2.15 118.95 123.11 1q3g s ARG 252 Ca 0.12 -0.35 -0.07 0.00 -1.72 0.00 0.00 55.73 53.71 1q3g s ARG 252 Cb -0.15 -2.78 0.01 0.00 -0.45 0.00 0.00 34.95 31.58 1q3g s ARG 252 CO 0.09 0.32 0.89 0.09 -0.68 0.00 0.00 175.30 176.01 1q3g n ASN 253 N -1.07 -5.71 -4.94 0.23 4.13 -0.85 -0.98 115.26 106.07 1q3g n ASN 253 Ca -0.05 -0.40 -0.19 0.00 1.68 0.00 0.00 54.58 55.61 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 -3.22 4.19 -0.43 5.41 0.00 -0.06 -4.50 121.76 123.14 1q3g s ALA 254 Ca 0.44 -1.64 0.02 0.00 0.00 0.00 0.00 51.96 50.78 1q3g s ALA 254 Cb -0.19 -1.42 0.15 0.00 0.00 0.00 0.00 23.12 21.66 1q3g s ALA 254 CO 0.54 -0.13 0.28 -1.14 0.00 0.00 0.00 175.76 175.32 1q3g s GLN 255 N -4.17 1.05 0.30 0.00 0.74 -1.26 -4.11 119.66 112.21 1q3g s GLN 255 Ca 0.47 -1.94 0.04 0.00 0.05 0.00 0.00 55.36 53.98 1q3g s GLN 255 Cb -0.08 -1.84 0.80 0.00 1.10 0.00 0.00 33.01 32.99 1q3g s GLN 255 CO 0.30 -1.25 1.62 -1.35 -0.55 0.00 0.00 175.29 174.05 1q3g h PRO 256 N 6.39 0.12 0.00 1.67 0.11 -1.86 -2.17 132.00 136.25 1q3g h PRO 256 Ca 0.11 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1q3g h PRO 256 Cb 0.92 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1q3g h PRO 256 CO 0.40 0.08 0.00 -0.40 -0.21 0.00 0.00 178.00 177.87 1q3g n ASP 257 N -5.31 0.00 -0.72 -2.05 3.85 -1.26 -1.18 116.55 109.88 1q3g n ASP 257 Ca 0.24 0.44 0.12 0.00 -0.71 0.00 0.00 54.79 54.89 1q3g n ASP 257 Cb 0.78 -0.45 0.33 0.00 -1.35 0.00 0.00 41.12 40.43 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 -1.45 0.11 -1.73 2.12 -2.24 -0.82 -4.31 114.28 105.96 1q3g n THR 258 Ca 0.01 -0.41 0.05 0.00 -2.27 0.00 0.00 64.05 61.44 1q3g n THR 258 Cb 0.04 0.82 0.10 0.00 -2.10 0.00 0.00 70.33 69.18 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 0.71 1.58 -0.14 3.22 4.77 -0.33 -4.89 117.00 121.94 1q3g n LEU 259 Ca 0.17 -2.56 -0.05 0.00 -0.03 0.00 0.00 56.01 53.55 1q3g n LEU 259 Cb 0.45 -0.26 0.02 0.00 -2.33 0.00 0.00 43.42 41.30 1q3g n LEU 259 CO 0.15 0.73 0.72 0.44 -1.33 0.00 0.00 177.39 178.10 1q3g h ASP 260 N 0.46 -0.67 -0.17 -1.43 3.32 -1.75 0.82 116.42 117.00 1q3g h ASP 260 Ca -0.05 0.16 0.02 0.00 0.02 0.00 0.00 57.03 57.18 1q3g h ASP 260 Cb 1.29 0.37 -0.02 0.00 0.22 0.00 0.00 39.33 41.19 1q3g h ASP 260 CO 0.02 -0.23 0.04 0.00 -1.72 0.00 0.00 179.24 177.36 1q3g h ALA 261 N 1.22 0.17 -0.24 3.45 0.00 -1.88 -0.70 119.26 121.29 1q3g h ALA 261 Ca 0.21 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1q3g h ALA 261 Cb 0.43 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1q3g h ALA 261 CO -0.51 -0.39 0.14 0.28 0.00 0.00 0.00 179.25 178.76 1q3g h VAL 262 N 0.12 1.11 -0.62 0.00 2.07 -1.73 -1.57 116.25 115.63 1q3g h VAL 262 Ca 0.07 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 1q3g h VAL 262 Cb 0.06 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1q3g h VAL 262 CO -0.09 0.11 0.26 -0.07 0.02 0.00 0.00 177.57 177.81 1q3g h LEU 263 N 0.29 0.82 -0.68 2.57 3.38 -0.72 -0.38 115.31 120.59 1q3g h LEU 263 Ca 0.09 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1q3g h LEU 263 Cb 0.05 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1q3g h LEU 263 CO -0.01 0.73 0.21 0.00 0.09 0.00 0.00 178.44 179.45 1q3g h ALA 264 N 1.40 0.89 -0.18 1.53 0.00 -0.84 -1.49 119.26 120.56 1q3g h ALA 264 Ca 0.21 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1q3g h ALA 264 Cb 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1q3g h ALA 264 CO -0.02 0.56 -0.50 -0.22 0.00 0.00 0.00 179.25 179.07 1q3g h LYS 265 N 0.99 0.50 -0.39 0.00 1.63 -0.80 -2.03 116.57 116.46 1q3g h LYS 265 Ca 0.22 -0.29 -0.10 0.00 -0.85 0.00 0.00 60.65 59.63 1q3g h LYS 265 Cb 0.30 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.94 1q3g h LYS 265 CO -0.01 0.88 -0.16 -0.07 -3.45 0.00 0.00 179.45 176.64 1q3g h LEU 266 N 0.39 0.72 -0.61 5.20 3.38 -0.78 -1.70 115.31 121.91 1q3g h LEU 266 Ca 0.02 -0.23 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 1q3g h LEU 266 Cb 1.02 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 1q3g h LEU 266 CO 0.09 0.89 0.02 0.03 0.09 0.00 0.00 178.44 179.57 1q3g h ARG 267 N 0.65 1.07 0.00 1.13 3.08 -1.08 -1.07 114.38 118.16 1q3g h ARG 267 Ca 0.10 -0.33 -0.01 0.00 0.07 0.00 0.00 59.98 59.81 1q3g h ARG 267 Cb 0.64 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.58 1q3g h ARG 267 CO 0.04 1.03 -0.06 0.93 -1.07 0.00 0.00 179.97 180.84 1q3g h GLU 268 N 0.97 0.00 -0.00 0.04 5.08 -0.95 0.20 114.58 119.92 1q3g h GLU 268 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1q3g h GLU 268 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1q3g h GLU 268 CO 0.03 0.06 -0.12 0.00 -1.00 0.00 0.00 179.01 177.98 1q3g n ALA 269 N -2.41 2.69 0.00 3.43 0.00 -0.67 -4.75 120.51 118.79 1q3g n ALA 269 Ca -0.03 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1q3g n ALA 269 Cb 0.15 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.22 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 1.40 1.02 3.79 0.00 0.00 0.69 -0.27 105.19 111.83 1q3g n GLY 270 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 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 3.07 -0.48 4.61 0.00 -0.50 -4.89 121.76 121.58 1q3g s ALA 271 Ca 0.00 0.61 -0.16 0.00 0.00 0.00 0.00 51.96 52.41 1q3g s ALA 271 Cb 0.00 -3.23 0.07 0.00 0.00 0.00 0.00 23.12 19.95 1q3g s ALA 271 CO 0.00 -0.10 0.43 0.34 0.00 0.00 0.00 175.76 176.43 1q3g s ASP 272 N -1.74 6.16 -0.10 0.00 2.15 -0.47 -4.41 116.67 118.27 1q3g s ASP 272 Ca 0.58 -1.24 0.01 0.00 0.43 0.00 0.00 52.55 52.33 1q3g s ASP 272 Cb -0.18 -2.20 -0.02 0.00 -0.30 0.00 0.00 42.92 40.21 1q3g s ASP 272 CO 0.23 -0.68 -0.12 -0.63 -0.17 0.00 0.00 175.17 173.80 1q3g s ILE 273 N 1.80 3.20 0.03 4.11 1.01 -1.26 -1.12 121.20 128.98 1q3g s ILE 273 Ca 0.06 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.13 1q3g s ILE 273 Cb -0.23 -2.31 -0.02 0.00 0.01 0.00 0.00 42.46 39.90 1q3g s ILE 273 CO 0.08 0.55 -0.19 -1.61 0.00 0.00 0.00 174.94 173.77 1q3g s GLU 274 N -0.17 1.29 0.09 2.79 0.41 -0.21 -4.99 118.70 117.90 1q3g s GLU 274 Ca 0.00 -0.84 0.04 0.00 -0.41 0.00 0.00 54.97 53.76 1q3g s GLU 274 Cb -0.13 -1.35 -0.03 0.00 -1.78 0.00 0.00 34.13 30.83 1q3g s GLU 274 CO 0.03 0.35 -0.11 0.95 -0.49 0.00 0.00 175.26 175.99 1q3g s THR 275 N -0.74 0.97 0.00 3.63 -4.23 -1.26 -0.09 115.64 113.91 1q3g s THR 275 Ca 0.06 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 59.04 1q3g s THR 275 Cb -0.08 -1.25 0.00 0.00 1.34 0.00 0.00 72.50 72.51 1q3g s THR 275 CO 0.01 -0.46 0.00 0.61 -0.54 0.00 0.00 174.62 174.24 1q3g n GLY 276 N 0.78 5.75 0.25 3.99 0.00 0.51 -5.00 105.19 111.48 1q3g n GLY 276 Ca -0.18 -1.88 -0.09 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 0.85 -0.09 1.61 4.57 -2.01 -3.35 114.58 116.15 1q3g h GLU 277 Ca 0.00 -0.22 -0.18 0.00 -1.18 0.00 0.00 59.36 57.78 1q3g h GLU 277 Cb 0.00 -0.11 -0.35 0.00 -0.16 0.00 0.00 28.75 28.13 1q3g h GLU 277 CO 0.00 0.82 -0.99 -0.40 -1.18 0.00 0.00 179.01 177.26 1q3g n ASP 278 N -4.41 1.27 -3.66 1.04 3.85 -1.26 -4.71 116.55 108.67 1q3g n ASP 278 Ca 0.02 -2.24 -0.12 0.00 -0.71 0.00 0.00 54.79 51.73 1q3g n ASP 278 Cb 0.24 -0.36 -0.06 0.00 -1.35 0.00 0.00 41.12 39.60 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 -1.07 -0.24 -0.02 2.11 1.48 -1.26 -0.89 118.94 119.06 1q3g s TRP 279 Ca 0.34 0.11 0.01 0.00 -1.06 0.00 0.00 56.10 55.50 1q3g s TRP 279 Cb 0.38 0.22 0.01 0.00 -1.16 0.00 0.00 33.47 32.91 1q3g s TRP 279 CO -0.13 -0.60 -0.04 0.42 -4.06 0.00 0.00 176.95 172.54 1q3g s ILE 280 N -2.86 0.37 -0.01 0.66 1.01 -0.91 -0.36 121.20 119.10 1q3g s ILE 280 Ca -0.03 -0.14 0.06 0.00 0.00 0.00 0.00 60.65 60.54 1q3g s ILE 280 Cb 0.00 -0.36 -0.02 0.00 0.01 0.00 0.00 42.46 42.09 1q3g s ILE 280 CO -0.05 0.14 -0.21 -0.94 0.00 0.00 0.00 174.94 173.88 1q3g s SER 281 N 0.27 2.43 -0.03 3.58 1.04 0.87 -0.14 113.70 121.70 1q3g s SER 281 Ca -0.03 -0.38 0.01 0.00 0.48 0.00 0.00 55.95 56.03 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 -0.00 0.25 -0.05 -0.22 0.98 0.00 0.00 173.24 174.20 1q3g s LEU 282 N -0.52 1.47 -0.09 2.42 0.20 0.12 -1.05 118.68 121.24 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 -0.41 0.02 0.00 -0.43 0.00 0.00 46.19 45.29 1q3g s LEU 282 CO -0.01 -0.03 -0.06 -0.62 -0.29 0.00 0.00 176.35 175.34 1q3g s ASP 283 N 0.68 1.83 0.03 3.68 -1.08 -0.27 -0.33 116.67 121.21 1q3g s ASP 283 Ca -0.09 -0.23 0.24 0.00 -0.52 0.00 0.00 52.55 51.95 1q3g s ASP 283 Cb -0.12 -0.71 0.38 0.00 -1.46 0.00 0.00 42.92 41.01 1q3g s ASP 283 CO 0.00 -0.10 1.32 0.23 0.52 0.00 0.00 175.17 177.14 1q3g n MET 284 N 4.68 0.10 -3.75 4.34 2.81 -0.55 -1.36 117.12 123.39 1q3g n MET 284 Ca -0.15 0.02 -0.26 0.00 -1.81 0.00 0.00 57.70 55.50 1q3g n MET 284 Cb 0.50 -1.55 0.05 0.00 -0.71 0.00 0.00 33.22 31.51 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 -1.69 -2.38 -0.81 2.03 8.25 -1.26 -1.05 115.22 118.32 1q3g n HIS 285 Ca 0.04 0.93 0.00 0.00 -0.26 0.00 0.00 57.72 58.43 1q3g n HIS 285 Cb 0.37 -4.43 0.00 0.00 1.12 0.00 0.00 29.99 27.05 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 -1.71 0.20 3.82 -1.41 0.00 -0.74 -4.97 105.19 100.37 1q3g n GLY 286 Ca -0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 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 -1.09 3.75 0.19 1.61 1.02 -0.21 -4.81 119.74 120.20 1q3g s LYS 287 Ca 0.00 1.15 -0.21 0.00 0.02 0.00 0.00 55.97 56.93 1q3g s LYS 287 Cb 0.00 -2.10 -0.08 0.00 -0.52 0.00 0.00 37.83 35.13 1q3g s LYS 287 CO 0.00 -0.45 0.72 0.50 -0.92 0.00 0.00 175.35 175.20 1q3g s ARG 288 N -3.75 4.32 0.58 1.68 3.52 -1.26 -4.17 118.95 119.87 1q3g s ARG 288 Ca 0.63 0.92 -0.18 0.00 -0.13 0.00 0.00 55.73 56.97 1q3g s ARG 288 Cb -0.13 -3.01 -0.04 0.00 -1.56 0.00 0.00 34.95 30.20 1q3g s ARG 288 CO 0.28 0.47 1.12 -1.25 -0.81 0.00 0.00 175.30 175.11 1q3g s PRO 289 N -1.67 3.17 -0.06 5.12 0.04 -1.26 -4.85 135.00 135.49 1q3g s PRO 289 Ca 0.40 1.53 -0.15 0.00 0.04 0.00 0.00 61.00 62.81 1q3g s PRO 289 Cb -0.19 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.32 1q3g s PRO 289 CO 0.22 -0.98 0.40 0.15 0.04 0.00 0.00 177.00 176.83 1q3g s LYS 290 N -3.57 4.05 0.41 4.56 -0.14 0.63 -0.42 119.74 125.27 1q3g s LYS 290 Ca 0.71 0.35 -0.26 0.00 -1.36 0.00 0.00 55.97 55.41 1q3g s LYS 290 Cb -0.23 -3.30 -0.10 0.00 -1.68 0.00 0.00 37.83 32.52 1q3g s LYS 290 CO 0.32 0.50 1.29 0.00 -0.76 0.00 0.00 175.35 176.70 1q3g n ALA 291 N 2.53 1.37 -2.30 5.17 0.00 -0.70 -4.35 120.51 122.24 1q3g n ALA 291 Ca -0.12 0.28 -0.16 0.00 0.00 0.00 0.00 53.44 53.43 1q3g n ALA 291 Cb 0.52 -2.28 -0.10 0.00 0.00 0.00 0.00 19.45 17.59 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 1.21 -0.17 0.00 -7.23 -1.26 -4.87 120.40 106.90 1q3g s VAL 292 Ca 0.60 -2.07 -0.04 0.00 -1.81 0.00 0.00 61.98 58.66 1q3g s VAL 292 Cb -0.51 -2.08 -0.03 0.00 0.56 0.00 0.00 36.38 34.32 1q3g s VAL 292 CO 0.59 -0.56 -0.03 -0.89 -0.31 0.00 0.00 175.10 173.91 1q3g s THR 293 N -3.30 3.92 0.07 5.32 2.01 -1.26 -3.00 115.64 119.39 1q3g s THR 293 Ca 0.22 -0.34 0.06 0.00 0.31 0.00 0.00 61.69 61.94 1q3g s THR 293 Cb 0.03 -2.73 -0.03 0.00 0.01 0.00 0.00 72.50 69.78 1q3g s THR 293 CO 0.05 0.48 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.60 1q3g s VAL 294 N 0.53 1.33 -0.19 3.82 1.01 -0.05 -4.98 120.40 121.87 1q3g s VAL 294 Ca -0.02 -1.26 -0.04 0.00 0.00 0.00 0.00 61.98 60.65 1q3g s VAL 294 Cb -0.14 -1.22 0.07 0.00 0.00 0.00 0.00 36.38 35.08 1q3g s VAL 294 CO 0.02 -0.06 0.08 -0.60 0.00 0.00 0.00 175.10 174.55 1q3g s ARG 295 N -1.53 0.22 0.54 2.72 3.52 -1.26 -0.12 118.95 123.04 1q3g s ARG 295 Ca 0.02 -0.23 -0.20 0.00 -0.13 0.00 0.00 55.73 55.19 1q3g s ARG 295 Cb -0.09 -1.81 -0.06 0.00 -1.56 0.00 0.00 34.95 31.43 1q3g s ARG 295 CO 0.02 -0.72 1.13 0.95 -0.81 0.00 0.00 175.30 175.88 1q3g s THR 296 N 2.06 3.17 0.06 4.11 -4.23 -0.04 -4.29 115.64 116.48 1q3g s THR 296 Ca 0.02 0.73 -0.28 0.00 -1.18 0.00 0.00 61.69 60.99 1q3g s THR 296 Cb -0.16 -3.30 0.10 0.00 1.34 0.00 0.00 72.50 70.47 1q3g s THR 296 CO -0.13 -0.15 1.13 0.00 -0.54 0.00 0.00 174.62 174.93 1q3g s ALA 297 N -1.76 -1.96 0.73 3.99 0.00 -0.62 -4.02 121.76 118.12 1q3g s ALA 297 Ca 0.72 0.47 -0.16 0.00 0.00 0.00 0.00 51.96 53.00 1q3g s ALA 297 Cb -0.24 0.47 0.02 0.00 0.00 0.00 0.00 23.12 23.38 1q3g s ALA 297 CO 0.27 -1.03 1.08 -2.30 0.00 0.00 0.00 175.76 173.79 1q3g n PRO 298 N -0.47 0.52 -1.61 0.00 -0.02 -1.26 -4.43 135.00 127.73 1q3g n PRO 298 Ca -0.07 0.24 -0.38 0.00 -2.02 0.00 0.00 63.50 61.27 1q3g n PRO 298 Cb 0.62 -2.33 0.05 0.00 -0.02 0.00 0.00 33.50 31.81 1q3g n PRO 298 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1q3g n HIS 299 N -2.63 0.77 1.12 6.00 -0.00 -1.26 -1.76 115.22 117.46 1q3g n HIS 299 Ca 0.14 0.45 0.01 0.00 0.46 0.00 0.00 57.72 58.77 1q3g n HIS 299 Cb 0.49 -2.14 0.05 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 -0.82 1.41 -1.15 1.57 -0.04 -1.26 -4.62 135.00 130.09 1q3g n PRO 300 Ca 0.13 -0.40 -0.26 0.00 -0.04 0.00 0.00 63.50 62.93 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 -0.03 -2.48 -1.77 0.55 0.00 -0.72 -4.25 120.51 111.80 1q3g n ALA 301 Ca 0.04 -1.45 -0.42 0.00 0.00 0.00 0.00 53.44 51.60 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 -2.99 2.12 0.17 0.00 5.36 -1.26 -4.81 117.98 116.58 1q3g s PHE 302 Ca 0.63 0.03 -0.30 0.00 -0.96 0.00 0.00 56.93 56.33 1q3g s PHE 302 Cb -0.05 -4.12 -0.08 0.00 -0.34 0.00 0.00 43.02 38.43 1q3g s PHE 302 CO 0.47 -4.65 1.15 -1.25 -1.46 0.00 0.00 175.22 169.48 1q3g s PRO 303 N 2.93 4.53 0.52 10.12 0.04 -1.26 -1.58 135.00 150.29 1q3g s PRO 303 Ca 0.80 1.80 0.23 0.00 0.04 0.00 0.00 61.00 63.86 1q3g s PRO 303 Cb -0.44 -3.27 1.40 0.00 0.04 0.00 0.00 34.50 32.24 1q3g s PRO 303 CO 0.36 -0.03 2.10 0.00 0.04 0.00 0.00 177.00 179.47 1q3g h THR 304 N 3.81 0.76 0.00 1.26 1.03 -1.92 -1.73 112.91 116.12 1q3g h THR 304 Ca -0.44 -0.38 0.00 0.00 -0.01 0.00 0.00 66.41 65.58 1q3g h THR 304 Cb 1.21 1.22 0.00 0.00 -1.07 0.00 0.00 68.15 69.52 1q3g h THR 304 CO 0.74 0.10 0.00 0.00 -0.01 0.00 0.00 175.52 176.35 1q3g n ALA 305 N -2.38 1.56 0.49 0.00 0.00 -1.26 -1.77 120.51 117.15 1q3g n ALA 305 Ca -0.02 -0.04 0.05 0.00 0.00 0.00 0.00 53.44 53.43 1q3g n ALA 305 Cb 0.19 -1.18 -0.02 0.00 0.00 0.00 0.00 19.45 18.44 1q3g n ALA 305 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1q3g n MET 306 N -1.43 2.47 -0.06 0.00 2.00 -0.65 -4.74 117.12 114.72 1q3g n MET 306 Ca 0.04 -0.45 -0.08 0.00 0.00 0.00 0.00 57.70 57.21 1q3g n MET 306 Cb 0.11 -1.08 -0.02 0.00 0.00 0.00 0.00 33.22 32.24 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 0.86 0.07 -0.54 0.03 -0.00 -1.34 -1.46 115.11 112.73 1q3g h GLN 307 Ca 0.00 -0.00 0.03 0.00 -0.00 0.00 0.00 58.65 58.68 1q3g h GLN 307 Cb 0.34 -0.02 -0.04 0.00 0.00 0.00 0.00 27.48 27.76 1q3g h GLN 307 CO 0.00 0.05 0.31 0.00 0.00 0.00 0.00 178.83 179.19 1q3g h ALA 308 N 1.21 0.70 -0.91 3.38 0.00 -1.85 0.53 119.26 122.30 1q3g h ALA 308 Ca 0.11 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1q3g h ALA 308 Cb 0.15 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1q3g h ALA 308 CO -0.19 -0.00 0.60 1.96 0.00 0.00 0.00 179.25 181.61 1q3g h GLN 309 N 0.60 1.21 0.00 0.00 7.50 -1.75 -1.70 115.11 120.98 1q3g h GLN 309 Ca 0.23 -0.08 -0.01 0.00 0.50 0.00 0.00 58.65 59.28 1q3g h GLN 309 Cb 0.07 -0.27 -0.00 0.00 0.05 0.00 0.00 27.48 27.33 1q3g h GLN 309 CO -0.12 0.81 -0.06 0.74 -1.50 0.00 0.00 178.83 178.70 1q3g h PHE 310 N 1.24 0.00 -0.46 2.96 -1.00 -0.63 -2.24 116.94 116.81 1q3g h PHE 310 Ca 0.33 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 61.04 1q3g h PHE 310 Cb -0.13 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.42 1q3g h PHE 310 CO -0.01 0.06 0.00 1.15 -1.61 0.00 0.00 178.31 177.90 1q3g h THR 311 N 0.00 1.26 0.02 -1.55 2.02 -0.00 -1.59 112.91 113.06 1q3g h THR 311 Ca -0.00 -1.05 -0.00 0.00 0.77 0.00 0.00 66.41 66.13 1q3g h THR 311 Cb 0.81 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1q3g h THR 311 CO 0.01 0.36 -0.01 0.25 0.37 0.00 0.00 175.52 176.50 1q3g h LEU 312 N 0.66 -0.02 -0.58 2.58 5.85 -1.16 -0.77 115.31 121.87 1q3g h LEU 312 Ca 0.13 -0.03 0.11 0.00 0.84 0.00 0.00 57.88 58.93 1q3g h LEU 312 Cb 0.50 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.45 1q3g h LEU 312 CO 0.02 0.01 0.11 0.25 -0.34 0.00 0.00 178.44 178.50 1q3g h LEU 313 N -0.05 -0.02 -0.81 2.25 6.46 -1.21 -1.08 115.31 120.86 1q3g h LEU 313 Ca -0.00 0.11 -0.08 0.00 -0.12 0.00 0.00 57.88 57.79 1q3g h LEU 313 Cb 0.05 0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 40.11 1q3g h LEU 313 CO 0.00 0.00 0.03 0.78 -0.62 0.00 0.00 178.44 178.64 1q3g h ASN 314 N 0.24 0.89 0.44 1.25 2.35 -1.03 -2.24 115.58 117.49 1q3g h ASN 314 Ca 0.30 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1q3g h ASN 314 Cb 0.45 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1q3g h ASN 314 CO -0.40 0.94 0.00 0.18 -1.65 0.00 0.00 177.43 176.50 1q3g n LEU 315 N -4.21 0.64 -0.11 1.61 4.77 -0.32 -1.76 117.00 117.63 1q3g n LEU 315 Ca 0.03 0.71 0.07 0.00 -0.03 0.00 0.00 56.01 56.79 1q3g n LEU 315 Cb 0.31 -0.68 0.09 0.00 -2.33 0.00 0.00 43.42 40.81 1q3g n LEU 315 CO 0.42 -0.73 0.51 1.33 -1.33 0.00 0.00 177.39 177.59 1q3g n VAL 316 N -2.26 1.43 -3.10 4.08 0.24 -1.02 -1.64 118.33 116.06 1q3g n VAL 316 Ca 0.01 -1.69 -0.18 0.00 -2.04 0.00 0.00 64.34 60.44 1q3g n VAL 316 Cb 0.15 0.02 0.01 0.00 -1.47 0.00 0.00 33.84 32.55 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 -2.09 4.40 -0.42 2.33 0.00 -0.72 -4.59 121.76 120.66 1q3g s ALA 317 Ca 0.21 -1.58 -0.24 0.00 0.00 0.00 0.00 51.96 50.35 1q3g s ALA 317 Cb 0.19 -1.68 0.02 0.00 0.00 0.00 0.00 23.12 21.64 1q3g s ALA 317 CO 0.02 -0.25 0.85 -2.00 0.00 0.00 0.00 175.76 174.38 1q3g s GLU 318 N -4.34 3.58 0.00 0.00 2.56 0.44 -3.72 118.70 117.22 1q3g s GLU 318 Ca 0.53 0.16 0.00 0.00 0.00 0.00 0.00 54.97 55.66 1q3g s GLU 318 Cb -0.10 -3.89 0.00 0.00 2.00 0.00 0.00 34.13 32.14 1q3g s GLU 318 CO 0.33 -1.07 0.00 0.41 -0.56 0.00 0.00 175.26 174.37 1q3g n GLY 319 N 4.79 -0.25 3.36 -1.50 0.00 -1.26 -1.72 105.19 108.61 1q3g n GLY 319 Ca 0.04 -2.26 -0.40 0.00 0.00 0.00 0.00 46.02 43.41 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 -0.14 4.39 -0.05 2.61 2.01 -1.26 -2.24 115.64 120.96 1q3g s THR 320 Ca 0.00 -0.87 -0.04 0.00 0.31 0.00 0.00 61.69 61.09 1q3g s THR 320 Cb 0.00 -3.43 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 1q3g s THR 320 CO 0.00 -0.19 0.14 -0.83 -0.69 0.00 0.00 174.62 173.06 1q3g s GLY 321 N 1.53 2.12 -0.12 4.40 0.00 -0.47 -4.78 107.32 110.01 1q3g s GLY 321 Ca 0.01 -0.75 0.02 0.00 0.00 0.00 0.00 44.72 44.01 1q3g s GLY 321 CO 0.06 -0.58 -0.16 0.14 0.00 0.00 0.00 173.10 172.55 1q3g s VAL 322 N -1.18 1.60 -0.14 1.40 1.01 -1.16 0.20 120.40 122.13 1q3g s VAL 322 Ca 0.22 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.51 1q3g s VAL 322 Cb -0.12 -1.45 -0.00 0.00 0.00 0.00 0.00 36.38 34.80 1q3g s VAL 322 CO 0.12 0.46 -0.18 -0.63 0.00 0.00 0.00 175.10 174.87 1q3g s ILE 323 N 0.99 2.44 -0.23 2.22 1.01 -0.82 -0.87 121.20 125.94 1q3g s ILE 323 Ca -0.06 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 59.72 1q3g s ILE 323 Cb -0.15 -2.00 0.02 0.00 0.01 0.00 0.00 42.46 40.35 1q3g s ILE 323 CO -0.02 0.53 -0.10 -0.89 0.00 0.00 0.00 174.94 174.46 1q3g s THR 324 N 0.65 2.66 -0.27 2.92 2.01 0.83 -0.59 115.64 123.86 1q3g s THR 324 Ca -0.09 -0.98 -0.15 0.00 0.31 0.00 0.00 61.69 60.78 1q3g s THR 324 Cb -0.16 -2.29 -0.04 0.00 0.01 0.00 0.00 72.50 70.02 1q3g s THR 324 CO 0.02 0.30 0.36 -0.70 -0.69 0.00 0.00 174.62 173.91 1q3g s GLU 325 N 1.32 3.99 0.00 4.92 2.56 -0.34 -0.86 118.70 130.29 1q3g s GLU 325 Ca 0.02 -0.01 0.07 0.00 0.00 0.00 0.00 54.97 55.05 1q3g s GLU 325 Cb -0.16 -3.66 0.06 0.00 2.00 0.00 0.00 34.13 32.37 1q3g s GLU 325 CO -0.07 -0.28 0.74 0.25 -0.56 0.00 0.00 175.26 175.34 1q3g n THR 326 N 5.12 0.01 -0.12 -1.70 -2.24 -1.26 -4.76 114.28 109.33 1q3g n THR 326 Ca -0.09 -0.50 -0.27 0.00 -2.27 0.00 0.00 64.05 60.92 1q3g n THR 326 Cb 0.51 1.15 -0.11 0.00 -2.10 0.00 0.00 70.33 69.78 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 0.41 1.54 -4.82 2.28 2.08 -1.26 -4.95 119.36 114.64 1q3g n ILE 327 Ca 0.04 -0.30 -0.33 0.00 0.56 0.00 0.00 62.75 62.73 1q3g n ILE 327 Cb 0.19 -1.90 -0.16 0.00 -0.75 0.00 0.00 39.64 37.02 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 -2.47 2.68 0.62 1.39 0.40 -1.26 -5.03 117.98 114.32 1q3g s PHE 328 Ca -0.35 -1.08 0.40 0.00 -0.60 0.00 0.00 56.93 55.30 1q3g s PHE 328 Cb 0.12 -1.81 2.23 0.00 0.51 0.00 0.00 43.02 44.07 1q3g s PHE 328 CO 0.54 -0.46 2.33 1.05 0.70 0.00 0.00 175.22 179.37 1q3g h GLU 329 N 7.04 0.00 -1.95 0.44 9.09 -1.92 -3.30 114.58 123.99 1q3g h GLU 329 Ca -0.27 0.00 -0.50 0.00 0.05 0.00 0.00 59.36 58.64 1q3g h GLU 329 Cb 1.21 0.00 -0.41 0.00 -1.65 0.00 0.00 28.75 27.90 1q3g h GLU 329 CO 0.53 0.00 -1.05 -1.71 0.05 0.00 0.00 179.01 176.84 1q3g n ASN 330 N -3.29 1.91 -2.35 3.06 5.15 -0.60 -4.92 115.26 114.21 1q3g n ASN 330 Ca -0.03 -3.17 -0.29 0.00 -0.60 0.00 0.00 54.58 50.50 1q3g n ASN 330 Cb 0.09 -0.59 0.02 0.00 -0.53 0.00 0.00 39.78 38.77 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 0.09 3.30 -0.15 1.20 0.63 -1.24 -4.14 116.66 116.35 1q3g n ARG 331 Ca 0.25 -4.08 0.06 0.00 -0.92 0.00 0.00 57.85 53.16 1q3g n ARG 331 Cb 0.61 -2.27 0.08 0.00 0.45 0.00 0.00 32.46 31.33 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 -0.63 0.00 0.32 -0.14 0.99 -1.26 -4.80 117.46 111.94 1q3g n PHE 332 Ca 0.46 -0.64 0.20 0.00 -0.00 0.00 0.00 57.45 57.47 1q3g n PHE 332 Cb 0.71 -0.10 1.06 0.00 -1.00 0.00 0.00 39.48 40.14 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 -1.87 114.93 112.85 1q3g h MET 333 Ca 0.00 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.51 1q3g h MET 333 Cb 1.01 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.65 1q3g h MET 333 CO 0.00 0.01 -0.64 1.12 1.06 0.00 0.00 176.91 178.47 1q3g h HIS 334 N 0.00 0.00 -0.14 -0.22 2.07 -1.94 -3.35 115.15 111.56 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 0.11 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 30.03 1q3g h HIS 334 CO 0.00 0.64 -0.24 0.28 -3.07 0.00 0.00 177.93 175.54 1q3g h VAL 335 N 0.00 0.42 -0.20 6.12 2.07 -1.72 -0.64 116.25 122.30 1q3g h VAL 335 Ca -0.01 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.53 1q3g h VAL 335 Cb 1.28 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1q3g h VAL 335 CO 0.08 0.00 0.14 -0.65 0.02 0.00 0.00 177.57 177.16 1q3g h PRO 336 N -0.30 0.19 -0.16 1.57 0.11 -1.74 -1.16 132.00 130.52 1q3g h PRO 336 Ca 0.10 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 66.07 1q3g h PRO 336 Cb 0.46 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.53 1q3g h PRO 336 CO -0.32 0.13 -0.41 0.93 -0.21 0.00 0.00 178.00 178.13 1q3g h GLU 337 N 0.20 0.55 -0.12 1.05 4.39 -1.50 -3.00 114.58 116.15 1q3g h GLU 337 Ca 0.08 -0.39 -0.06 0.00 0.34 0.00 0.00 59.36 59.34 1q3g h GLU 337 Cb 0.09 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 1q3g h GLU 337 CO -0.02 1.00 -0.20 -0.07 -1.16 0.00 0.00 179.01 178.57 1q3g h LEU 338 N 0.19 0.19 -1.56 1.33 3.38 -0.58 -1.55 115.31 116.71 1q3g h LEU 338 Ca -0.01 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1q3g h LEU 338 Cb 1.02 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1q3g h LEU 338 CO 0.09 0.40 -0.05 0.40 0.09 0.00 0.00 178.44 179.37 1q3g h ILE 339 N 0.18 1.13 0.00 1.22 2.04 -1.15 0.20 117.51 121.13 1q3g h ILE 339 Ca 0.03 -0.54 -0.03 0.00 1.00 0.00 0.00 64.86 65.32 1q3g h ILE 339 Cb 0.46 1.08 -0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1q3g h ILE 339 CO 0.03 0.17 -0.17 0.03 0.00 0.00 0.00 178.15 178.22 1q3g h ARG 340 N 0.21 0.00 -0.49 2.37 3.08 -1.14 -0.83 114.38 117.58 1q3g h ARG 340 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1q3g h ARG 340 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 1q3g h ARG 340 CO 0.01 0.17 0.00 -1.33 -1.07 0.00 0.00 179.97 177.75 1q3g n MET 341 N -4.05 2.12 -0.18 0.04 2.81 0.65 -4.88 117.12 113.63 1q3g n MET 341 Ca -0.02 -1.33 0.00 0.00 -1.81 0.00 0.00 57.70 54.54 1q3g n MET 341 Cb 0.25 -1.45 0.00 0.00 -0.71 0.00 0.00 33.22 31.31 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 0.83 0.70 3.71 3.03 0.00 -0.32 -0.31 105.19 112.82 1q3g n GLY 342 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.24 1.55 -0.11 4.61 0.00 -0.84 -4.97 121.76 119.77 1q3g s ALA 343 Ca 0.00 0.10 -0.00 0.00 0.00 0.00 0.00 51.96 52.05 1q3g s ALA 343 Cb 0.00 -3.25 0.02 0.00 0.00 0.00 0.00 23.12 19.89 1q3g s ALA 343 CO 0.00 -2.38 -0.07 -1.01 0.00 0.00 0.00 175.76 172.30 1q3g s HIS 344 N -2.85 1.41 -0.03 0.00 0.09 -1.26 -4.55 115.29 108.10 1q3g s HIS 344 Ca 0.64 -0.69 -0.29 0.00 -0.00 0.00 0.00 55.06 54.72 1q3g s HIS 344 Cb -0.19 -1.19 0.10 0.00 -0.00 0.00 0.00 32.58 31.30 1q3g s HIS 344 CO 0.57 -0.49 0.85 0.00 -0.00 0.00 0.00 174.74 175.67 1q3g s ALA 345 N 1.71 -1.81 -0.00 -1.40 0.00 -1.26 -1.69 121.76 117.30 1q3g s ALA 345 Ca 0.05 1.12 0.05 0.00 0.00 0.00 0.00 51.96 53.18 1q3g s ALA 345 Cb -0.13 0.15 -0.01 0.00 0.00 0.00 0.00 23.12 23.13 1q3g s ALA 345 CO -0.08 -0.56 -0.15 -1.21 0.00 0.00 0.00 175.76 173.76 1q3g s GLU 346 N -2.46 1.17 -0.24 0.00 8.01 -0.56 -4.97 118.70 119.65 1q3g s GLU 346 Ca 0.01 -0.58 -0.08 0.00 0.01 0.00 0.00 54.97 54.33 1q3g s GLU 346 Cb -0.01 -1.15 -0.03 0.00 -4.31 0.00 0.00 34.13 28.63 1q3g s GLU 346 CO -0.04 0.31 0.09 0.42 0.01 0.00 0.00 175.26 176.04 1q3g s ILE 347 N -0.44 4.52 -0.33 -1.63 1.01 -1.26 -0.37 121.20 122.70 1q3g s ILE 347 Ca 0.05 -0.10 0.03 0.00 0.00 0.00 0.00 60.65 60.63 1q3g s ILE 347 Cb -0.06 -3.11 0.10 0.00 0.01 0.00 0.00 42.46 39.39 1q3g s ILE 347 CO -0.00 0.34 0.05 -1.61 0.00 0.00 0.00 174.94 173.72 1q3g s GLU 348 N 1.46 1.42 7.78 2.79 0.41 -0.15 -5.01 118.70 127.39 1q3g s GLU 348 Ca 0.06 -1.72 0.00 0.00 -0.41 0.00 0.00 54.97 52.89 1q3g s GLU 348 Cb -0.15 -3.01 0.00 0.00 -1.78 0.00 0.00 34.13 29.19 1q3g s GLU 348 CO 0.04 -0.92 0.00 0.45 -0.49 0.00 0.00 175.26 174.34 1q3g n SER 349 N 4.35 0.00 -2.14 -0.19 2.88 -1.26 -2.07 113.62 115.19 1q3g n SER 349 Ca 0.02 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.37 1q3g n SER 349 Cb 0.42 0.00 0.21 0.00 -0.75 0.00 0.00 64.21 64.09 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 7.83 3.99 -3.92 -3.46 6.94 -1.26 -4.91 115.26 120.47 1q3g n ASN 350 Ca 0.00 -3.46 -0.11 0.00 -0.02 0.00 0.00 54.58 50.99 1q3g n ASN 350 Cb 0.00 -0.81 -0.12 0.00 -2.36 0.00 0.00 39.78 36.49 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 -3.12 0.05 -0.16 5.53 -4.23 -0.88 -1.20 115.64 111.64 1q3g s THR 351 Ca 0.55 -0.45 -0.03 0.00 -1.18 0.00 0.00 61.69 60.57 1q3g s THR 351 Cb 0.46 -0.14 -0.03 0.00 1.34 0.00 0.00 72.50 74.13 1q3g s THR 351 CO 0.11 -0.25 -0.04 0.68 -0.54 0.00 0.00 174.62 174.58 1q3g s VAL 352 N -0.73 3.80 -0.33 2.29 -7.23 0.24 -0.98 120.40 117.46 1q3g s VAL 352 Ca -0.08 -0.39 -0.18 0.00 -1.81 0.00 0.00 61.98 59.52 1q3g s VAL 352 Cb -0.05 -2.66 -0.01 0.00 0.56 0.00 0.00 36.38 34.22 1q3g s VAL 352 CO -0.00 0.49 0.51 -0.63 -0.31 0.00 0.00 175.10 175.16 1q3g s ILE 353 N 0.44 5.02 -0.12 -0.62 -1.09 0.50 -1.94 121.20 123.39 1q3g s ILE 353 Ca -0.04 0.44 -0.05 0.00 -2.23 0.00 0.00 60.65 58.76 1q3g s ILE 353 Cb -0.14 -3.94 -0.04 0.00 -1.58 0.00 0.00 42.46 36.76 1q3g s ILE 353 CO 0.03 -0.17 0.08 0.00 -1.23 0.00 0.00 174.94 173.65 1q3g s HIS 355 N -0.77 2.75 0.47 0.00 3.76 -0.68 -1.36 115.29 119.46 1q3g s HIS 355 Ca 0.13 -2.88 -0.22 0.00 -0.15 0.00 0.00 55.06 51.94 1q3g s HIS 355 Cb -0.12 -2.48 -0.10 0.00 1.11 0.00 0.00 32.58 30.99 1q3g s HIS 355 CO 0.03 -0.77 0.77 0.41 -0.85 0.00 0.00 174.74 174.33 1q3g n GLY 356 N 3.34 -0.87 3.33 -2.22 0.00 -0.95 -4.21 105.19 103.60 1q3g n GLY 356 Ca 0.06 0.02 -0.19 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.44 1.72 0.08 1.61 -7.23 -0.65 -4.73 120.40 109.77 1q3g s VAL 357 Ca 0.66 -2.09 -0.32 0.00 -1.81 0.00 0.00 61.98 58.42 1q3g s VAL 357 Cb -0.54 -1.94 -0.16 0.00 0.56 0.00 0.00 36.38 34.30 1q3g s VAL 357 CO 0.56 -0.50 1.62 -0.08 -0.31 0.00 0.00 175.10 176.38 1q3g h GLU 358 N 2.83 -0.78 -4.57 4.82 4.57 -1.89 -3.40 114.58 116.17 1q3g h GLU 358 Ca -0.39 0.05 -0.21 0.00 -1.18 0.00 0.00 59.36 57.63 1q3g h GLU 358 Cb 1.21 0.18 -0.15 0.00 -0.16 0.00 0.00 28.75 29.83 1q3g h GLU 358 CO 0.58 -0.52 -0.68 0.21 -1.18 0.00 0.00 179.01 177.42 1q3g s LYS 359 N -6.03 0.88 0.24 1.92 2.20 -1.26 -4.99 119.74 112.71 1q3g s LYS 359 Ca -0.17 -1.38 0.08 0.00 -0.36 0.00 0.00 55.97 54.13 1q3g s LYS 359 Cb 0.05 -0.06 -0.04 0.00 -1.51 0.00 0.00 37.83 36.26 1q3g s LYS 359 CO 0.63 -0.11 0.13 -0.51 -0.36 0.00 0.00 175.35 175.13 1q3g s LEU 360 N -3.05 3.62 -0.13 5.43 1.43 -1.26 -4.94 118.68 119.78 1q3g s LEU 360 Ca 0.16 -0.35 -0.02 0.00 -1.03 0.00 0.00 54.13 52.89 1q3g s LEU 360 Cb 0.06 -2.17 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 1q3g s LEU 360 CO -0.02 -0.01 -0.07 -0.44 0.23 0.00 0.00 176.35 176.04 1q3g s SER 361 N -3.67 4.58 0.53 2.29 0.01 0.57 0.91 113.70 118.92 1q3g s SER 361 Ca 0.32 -0.15 -0.22 0.00 1.31 0.00 0.00 55.95 57.21 1q3g s SER 361 Cb -0.08 -1.60 -0.06 0.00 0.21 0.00 0.00 66.02 64.50 1q3g s SER 361 CO 0.23 0.21 1.35 0.61 0.41 0.00 0.00 173.24 176.05 1q3g n GLY 362 N 3.22 0.75 3.83 3.44 0.00 -0.27 -4.42 105.19 111.73 1q3g n GLY 362 Ca -0.18 0.05 -0.03 0.00 0.00 0.00 0.00 46.02 45.86 1q3g n GLY 362 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3g s ALA 363 N -1.28 -1.58 -0.32 4.61 0.00 -1.06 -4.76 121.76 117.37 1q3g s ALA 363 Ca 0.70 -0.17 -0.21 0.00 0.00 0.00 0.00 51.96 52.27 1q3g s ALA 363 Cb -0.43 0.70 -0.00 0.00 0.00 0.00 0.00 23.12 23.39 1q3g s ALA 363 CO 0.51 -1.05 0.68 -0.65 0.00 0.00 0.00 175.76 175.25 1q3g s GLN 364 N -2.58 3.88 0.29 0.00 -0.21 -1.26 -1.95 119.66 117.82 1q3g s GLN 364 Ca 0.18 0.34 0.07 0.00 0.02 0.00 0.00 55.36 55.98 1q3g s GLN 364 Cb -0.02 -3.74 -0.06 0.00 1.00 0.00 0.00 33.01 30.19 1q3g s GLN 364 CO 0.04 -0.64 -0.08 0.14 -2.12 0.00 0.00 175.29 172.63 1q3g s VAL 365 N 2.75 1.80 -0.13 1.09 -7.23 -0.11 -4.97 120.40 113.61 1q3g s VAL 365 Ca 0.27 -2.16 0.02 0.00 -1.81 0.00 0.00 61.98 58.30 1q3g s VAL 365 Cb -0.14 -2.46 0.01 0.00 0.56 0.00 0.00 36.38 34.35 1q3g s VAL 365 CO 0.13 -0.30 -0.18 -0.32 -0.31 0.00 0.00 175.10 174.11 1q3g s MET 366 N -3.69 2.60 0.29 4.82 1.75 -1.26 -1.21 119.30 122.60 1q3g s MET 366 Ca 0.30 -0.70 -0.29 0.00 -1.25 0.00 0.00 55.69 53.75 1q3g s MET 366 Cb 0.03 -2.17 -0.10 0.00 2.84 0.00 0.00 34.83 35.43 1q3g s MET 366 CO 0.13 -0.07 1.29 0.00 -0.65 0.00 0.00 175.02 175.72 1q3g s ALA 367 N 0.97 3.50 -0.03 4.11 0.00 -0.75 -4.92 121.76 124.64 1q3g s ALA 367 Ca -0.05 1.18 0.04 0.00 0.00 0.00 0.00 51.96 53.13 1q3g s ALA 367 Cb -0.15 -3.46 -0.06 0.00 0.00 0.00 0.00 23.12 19.45 1q3g s ALA 367 CO -0.03 -0.55 0.10 0.25 0.00 0.00 0.00 175.76 175.52 1q3g n THR 368 N 1.40 0.00 -3.82 0.00 -2.24 -1.26 -4.85 114.28 103.51 1q3g n THR 368 Ca 0.02 -0.14 -0.06 0.00 -2.27 0.00 0.00 64.05 61.60 1q3g n THR 368 Cb 0.42 0.51 -0.01 0.00 -2.10 0.00 0.00 70.33 69.16 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 -2.25 -0.17 0.07 3.42 1.47 -1.26 -4.94 116.67 113.00 1q3g s ASP 369 Ca -0.01 -0.63 -0.20 0.00 1.18 0.00 0.00 52.55 52.89 1q3g s ASP 369 Cb 0.02 0.65 -0.08 0.00 -0.34 0.00 0.00 42.92 43.18 1q3g s ASP 369 CO 0.16 -1.22 1.32 0.25 0.68 0.00 0.00 175.17 176.35 1q3g h LEU 370 N 2.00 -0.99 -1.23 2.11 5.85 -1.99 -0.39 115.31 120.67 1q3g h LEU 370 Ca -0.23 0.12 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 1q3g h LEU 370 Cb 1.24 0.38 -0.01 0.00 0.37 0.00 0.00 40.66 42.64 1q3g h LEU 370 CO 0.28 -0.29 -0.38 0.03 -0.34 0.00 0.00 178.44 177.74 1q3g h ARG 371 N -0.35 0.00 -0.42 1.25 2.47 -1.91 -2.88 114.38 112.54 1q3g h ARG 371 Ca 0.02 0.00 -0.10 0.00 -1.26 0.00 0.00 59.98 58.64 1q3g h ARG 371 Cb 0.40 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.71 1q3g h ARG 371 CO -0.24 0.38 -0.11 0.00 0.56 0.00 0.00 179.97 180.55 1q3g h ALA 372 N 1.62 0.58 -0.80 0.04 0.00 -1.91 -1.88 119.26 116.92 1q3g h ALA 372 Ca -0.00 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.60 1q3g h ALA 372 Cb 0.70 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1q3g h ALA 372 CO 0.05 0.47 0.51 0.66 0.00 0.00 0.00 179.25 180.94 1q3g h SER 373 N 0.64 0.86 -0.29 0.00 4.64 -0.86 0.86 113.55 119.39 1q3g h SER 373 Ca 0.11 -0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.33 1q3g h SER 373 Cb 0.65 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 1q3g h SER 373 CO 0.04 0.61 -0.10 0.00 -0.87 0.00 0.00 176.83 176.51 1q3g h ALA 374 N 1.32 1.07 -0.36 5.18 0.00 -1.40 -1.32 119.26 123.75 1q3g h ALA 374 Ca 0.31 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1q3g h ALA 374 Cb -0.04 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1q3g h ALA 374 CO -0.10 0.57 0.06 0.77 0.00 0.00 0.00 179.25 180.56 1q3g h SER 375 N 0.64 0.57 -0.06 0.00 0.02 -0.44 -1.19 113.55 113.09 1q3g h SER 375 Ca 0.11 -0.26 -0.06 0.00 -0.84 0.00 0.00 61.79 60.74 1q3g h SER 375 Cb 0.55 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 1q3g h SER 375 CO 0.03 0.69 -0.13 -0.07 -1.14 0.00 0.00 176.83 176.21 1q3g h LEU 376 N 0.44 0.36 -0.27 5.07 3.38 -0.62 -0.04 115.31 123.63 1q3g h LEU 376 Ca 0.11 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1q3g h LEU 376 Cb 0.36 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1q3g h LEU 376 CO 0.01 0.52 -0.18 0.58 0.09 0.00 0.00 178.44 179.46 1q3g h VAL 377 N 0.35 1.30 -0.66 1.22 2.07 -0.98 -1.46 116.25 118.10 1q3g h VAL 377 Ca 0.07 -1.30 -0.04 0.00 0.82 0.00 0.00 66.70 66.25 1q3g h VAL 377 Cb 0.45 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 1q3g h VAL 377 CO 0.03 0.41 0.26 -0.07 0.02 0.00 0.00 177.57 178.21 1q3g h LEU 378 N 0.33 0.88 -0.50 2.57 3.38 -0.87 -2.16 115.31 118.95 1q3g h LEU 378 Ca 0.05 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 57.93 1q3g h LEU 378 Cb 0.71 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 1q3g h LEU 378 CO 0.05 0.79 0.28 0.00 0.09 0.00 0.00 178.44 179.65 1q3g h ALA 379 N 1.33 0.64 -0.57 1.53 0.00 -0.74 -1.37 119.26 120.08 1q3g h ALA 379 Ca 0.22 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.16 1q3g h ALA 379 Cb 0.19 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1q3g h ALA 379 CO -0.02 -0.04 0.37 0.78 0.00 0.00 0.00 179.25 180.34 1q3g h GLY 380 N 0.55 0.76 1.32 0.00 0.00 -0.67 0.12 103.07 105.15 1q3g h GLY 380 Ca 0.21 -0.27 -0.05 0.00 0.00 0.00 0.00 47.33 47.22 1q3g h GLY 380 CO -0.12 0.25 0.14 0.00 0.00 0.00 0.00 176.54 176.81 1q3g n ILE 382 N -4.27 0.00 -1.57 0.00 -5.35 -0.89 -0.74 119.36 106.54 1q3g n ILE 382 Ca 0.04 -0.22 -0.31 0.00 -0.27 0.00 0.00 62.75 62.00 1q3g n ILE 382 Cb 0.22 1.16 0.05 0.00 -1.74 0.00 0.00 39.64 39.34 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 -2.42 2.68 -0.37 -1.28 0.00 0.35 -4.52 121.76 116.20 1q3g s ALA 383 Ca 0.14 0.08 -0.24 0.00 0.00 0.00 0.00 51.96 51.94 1q3g s ALA 383 Cb 0.16 -3.18 0.01 0.00 0.00 0.00 0.00 23.12 20.11 1q3g s ALA 383 CO 0.59 -1.23 0.83 -2.00 0.00 0.00 0.00 175.76 173.96 1q3g s GLU 384 N -5.04 3.76 0.00 0.00 2.56 0.26 -1.84 118.70 118.39 1q3g s GLU 384 Ca 0.58 0.37 0.00 0.00 0.00 0.00 0.00 54.97 55.92 1q3g s GLU 384 Cb -0.14 -3.82 0.00 0.00 2.00 0.00 0.00 34.13 32.17 1q3g s GLU 384 CO 0.55 -0.91 0.00 0.41 -0.56 0.00 0.00 175.26 174.75 1q3g n GLY 385 N 4.52 -0.15 3.61 -1.50 0.00 -0.51 -1.11 105.19 110.05 1q3g n GLY 385 Ca 0.04 -1.98 -0.35 0.00 0.00 0.00 0.00 46.02 43.73 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 4.68 -0.03 2.61 2.01 -1.26 -0.61 115.64 123.04 1q3g s THR 386 Ca 0.00 -0.07 0.06 0.00 0.31 0.00 0.00 61.69 61.99 1q3g s THR 386 Cb 0.00 -3.11 -0.02 0.00 0.01 0.00 0.00 72.50 69.37 1q3g s THR 386 CO 0.00 0.45 -0.21 -0.89 -0.69 0.00 0.00 174.62 173.27 1q3g s THR 387 N 0.51 2.44 -0.21 -0.82 2.01 0.14 -2.57 115.64 117.14 1q3g s THR 387 Ca 0.03 -0.96 0.01 0.00 0.31 0.00 0.00 61.69 61.08 1q3g s THR 387 Cb -0.13 -1.89 0.04 0.00 0.01 0.00 0.00 72.50 70.53 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 -0.63 1.86 -0.47 3.82 1.01 -0.82 -0.22 120.40 124.94 1q3g s VAL 388 Ca 0.10 -1.16 -0.16 0.00 0.00 0.00 0.00 61.98 60.76 1q3g s VAL 388 Cb -0.10 -1.89 0.06 0.00 0.00 0.00 0.00 36.38 34.45 1q3g s VAL 388 CO -0.00 0.18 0.41 -0.69 0.00 0.00 0.00 175.10 175.01 1q3g s VAL 389 N 1.30 5.19 0.46 2.92 1.01 -0.13 -0.94 120.40 130.21 1q3g s VAL 389 Ca -0.02 -0.94 -0.19 0.00 0.00 0.00 0.00 61.98 60.83 1q3g s VAL 389 Cb -0.17 -4.12 -0.10 0.00 0.00 0.00 0.00 36.38 31.99 1q3g s VAL 389 CO -0.08 -0.57 0.95 -0.62 0.00 0.00 0.00 175.10 174.78 1q3g s ASP 390 N 2.50 6.81 -1.13 3.32 2.15 -0.35 -1.58 116.67 128.40 1q3g s ASP 390 Ca 0.06 1.62 -0.06 0.00 0.43 0.00 0.00 52.55 54.60 1q3g s ASP 390 Cb -0.23 -2.52 0.01 0.00 -0.30 0.00 0.00 42.92 39.88 1q3g s ASP 390 CO 0.08 -0.44 0.98 0.54 -0.17 0.00 0.00 175.17 176.15 1q3g n ARG 391 N -1.00 -6.55 0.00 4.34 1.74 -1.13 -1.82 116.66 112.23 1q3g n ARG 391 Ca 0.07 0.71 0.06 0.00 -0.77 0.00 0.00 57.85 57.92 1q3g n ARG 391 Cb 0.54 -5.38 0.37 0.00 -1.02 0.00 0.00 32.46 26.98 1q3g n ARG 391 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1q3g n ILE 392 N -4.43 0.00 0.03 0.55 -6.64 -1.20 -2.82 119.36 104.84 1q3g n ILE 392 Ca -0.05 0.00 0.16 0.00 -1.77 0.00 0.00 62.75 61.10 1q3g n ILE 392 Cb 0.57 -0.69 0.64 0.00 -1.44 0.00 0.00 39.64 38.72 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 0.10 -0.95 4.28 -0.00 -1.90 0.23 116.97 118.73 1q3g h TYR 393 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 58.73 58.85 1q3g h TYR 393 Cb 0.00 -0.03 -0.08 0.00 0.00 0.00 0.00 36.73 36.61 1q3g h TYR 393 CO 0.00 0.05 0.58 0.45 -0.00 0.00 0.00 178.16 179.23 1q3g h HIS 394 N 0.09 1.04 0.00 0.10 3.86 -1.88 -0.74 115.15 117.62 1q3g h HIS 394 Ca 0.21 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.39 1q3g h HIS 394 Cb 0.73 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.86 1q3g h HIS 394 CO -0.00 0.39 -0.32 0.97 0.86 0.00 0.00 177.93 179.83 1q3g h ILE 395 N 0.90 1.09 0.00 2.45 2.10 -0.80 -2.50 117.51 120.75 1q3g h ILE 395 Ca 0.48 -1.15 0.00 0.00 1.08 0.00 0.00 64.86 65.27 1q3g h ILE 395 Cb 0.50 1.65 0.00 0.00 -1.09 0.00 0.00 36.82 37.88 1q3g h ILE 395 CO -0.28 0.31 0.00 0.47 -1.08 0.00 0.00 178.15 177.58 1q3g n ASP 396 N -3.96 0.07 0.08 2.19 8.00 -0.29 -1.81 116.55 120.85 1q3g n ASP 396 Ca -0.02 0.52 -0.09 0.00 0.71 0.00 0.00 54.79 55.91 1q3g n ASP 396 Cb 0.38 -0.53 -0.05 0.00 -0.02 0.00 0.00 41.12 40.90 1q3g n ASP 396 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1q3g h ARG 397 N 0.00 0.14 0.00 -1.24 2.43 -1.46 -2.25 114.38 112.00 1q3g h ARG 397 Ca 0.00 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 1q3g h ARG 397 Cb 0.27 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1q3g h ARG 397 CO 0.00 0.99 0.00 0.41 -1.51 0.00 0.00 179.97 179.86 1q3g n GLY 398 N 1.08 -0.18 2.99 2.80 0.00 -1.12 -4.09 105.19 106.66 1q3g n GLY 398 Ca -0.03 0.00 -0.28 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 -0.13 1.85 -0.34 1.61 1.51 -0.75 -4.89 117.35 116.20 1q3g s TYR 399 Ca 0.00 -0.96 -0.29 0.00 -1.01 0.00 0.00 57.07 54.81 1q3g s TYR 399 Cb 0.00 -1.41 0.02 0.00 -0.11 0.00 0.00 41.96 40.46 1q3g s TYR 399 CO 0.00 -0.56 1.08 -2.00 -1.11 0.00 0.00 175.55 172.96 1q3g s GLU 400 N 1.44 4.01 -1.25 -0.62 2.12 -1.26 -4.17 118.70 118.96 1q3g s GLU 400 Ca 0.02 0.98 -0.27 0.00 0.36 0.00 0.00 54.97 56.06 1q3g s GLU 400 Cb -0.13 -3.76 0.04 0.00 0.26 0.00 0.00 34.13 30.53 1q3g s GLU 400 CO -0.08 -0.97 0.51 2.89 -0.54 0.00 0.00 175.26 177.07 1q3g n ARG 401 N 7.01 -0.37 0.20 4.30 1.85 -1.26 -4.83 116.66 123.56 1q3g n ARG 401 Ca 0.12 0.04 0.04 0.00 -1.00 0.00 0.00 57.85 57.05 1q3g n ARG 401 Cb 0.47 -2.56 0.47 0.00 -1.05 0.00 0.00 32.46 29.79 1q3g n ARG 401 CO 0.00 0.00 0.00 0.97 -0.01 0.00 0.00 177.63 178.59 1q3g h ILE 402 N -2.32 1.15 -0.07 8.89 2.10 -1.95 -2.52 117.51 122.78 1q3g h ILE 402 Ca -0.68 -0.71 0.03 0.00 1.08 0.00 0.00 64.86 64.58 1q3g h ILE 402 Cb 1.36 1.34 -0.04 0.00 -1.09 0.00 0.00 36.82 38.40 1q3g h ILE 402 CO 0.54 0.21 -0.13 -0.08 -1.08 0.00 0.00 178.15 177.61 1q3g h GLU 403 N 0.04 -0.17 -0.21 2.19 4.81 -1.94 0.48 114.58 119.79 1q3g h GLU 403 Ca 0.01 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.22 1q3g h GLU 403 Cb 0.36 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1q3g h GLU 403 CO 0.03 -0.12 0.03 -0.44 -0.73 0.00 0.00 179.01 177.78 1q3g h ASP 404 N -0.18 0.34 -0.83 1.04 3.45 -1.84 -1.45 116.42 116.94 1q3g h ASP 404 Ca 0.07 -0.27 -0.01 0.00 0.43 0.00 0.00 57.03 57.25 1q3g h ASP 404 Cb 0.28 -0.09 -0.04 0.00 -0.56 0.00 0.00 39.33 38.92 1q3g h ASP 404 CO -0.18 0.52 0.50 0.11 -1.57 0.00 0.00 179.24 178.62 1q3g h LYS 405 N 0.14 1.13 -0.41 3.56 1.57 -1.31 -0.19 116.57 121.06 1q3g h LYS 405 Ca 0.06 -0.10 -0.11 0.00 -1.87 0.00 0.00 60.65 58.63 1q3g h LYS 405 Cb 0.33 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1q3g h LYS 405 CO 0.01 0.80 -0.18 -0.07 -0.57 0.00 0.00 179.45 179.43 1q3g h LEU 406 N 1.15 0.88 -0.38 2.94 3.38 -0.85 -2.98 115.31 119.44 1q3g h LEU 406 Ca 0.30 -0.40 0.01 0.00 0.09 0.00 0.00 57.88 57.89 1q3g h LEU 406 Cb -0.04 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1q3g h LEU 406 CO -0.06 1.08 0.23 -0.09 0.09 0.00 0.00 178.44 179.70 1q3g h ARG 407 N 0.67 0.46 0.00 1.13 2.43 -0.85 0.57 114.38 118.79 1q3g h ARG 407 Ca 0.09 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1q3g h ARG 407 Cb 0.74 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 1q3g h ARG 407 CO 0.06 0.31 0.00 0.00 -1.51 0.00 0.00 179.97 178.82 1q3g n ALA 408 N -2.23 1.23 0.43 2.80 0.00 -0.12 -0.29 120.51 122.34 1q3g n ALA 408 Ca 0.01 -0.01 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1q3g n ALA 408 Cb 0.05 -1.04 0.12 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.37 2.77 0.00 0.00 4.77 0.14 -4.72 117.00 118.58 1q3g n LEU 409 Ca 0.01 -1.30 0.00 0.00 -0.03 0.00 0.00 56.01 54.69 1q3g n LEU 409 Cb 0.02 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1q3g n LEU 409 CO 0.02 0.56 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 1q3g n GLY 410 N 1.03 0.90 3.79 -0.72 0.00 0.60 -0.65 105.19 110.13 1q3g n GLY 410 Ca 0.13 0.00 -0.35 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 2.98 -0.72 4.61 0.00 -0.87 -4.83 121.76 120.94 1q3g s ALA 411 Ca 0.00 0.68 -0.08 0.00 0.00 0.00 0.00 51.96 52.56 1q3g s ALA 411 Cb 0.00 -3.27 0.19 0.00 0.00 0.00 0.00 23.12 20.03 1q3g s ALA 411 CO 0.00 -0.30 0.59 1.21 0.00 0.00 0.00 175.76 177.26 1q3g s ASN 412 N -1.73 5.94 0.03 0.00 3.84 -1.26 -4.48 114.94 117.28 1q3g s ASN 412 Ca 0.63 -2.78 0.03 0.00 0.21 0.00 0.00 52.86 50.94 1q3g s ASN 412 Cb -0.20 -2.02 -0.02 0.00 -0.55 0.00 0.00 41.25 38.46 1q3g s ASN 412 CO 0.25 -0.46 -0.10 -0.51 -2.79 0.00 0.00 177.10 173.49 1q3g s ILE 413 N 0.03 0.76 -0.02 -5.21 2.07 -1.26 -1.17 121.20 116.40 1q3g s ILE 413 Ca 0.17 -0.84 -0.05 0.00 -1.41 0.00 0.00 60.65 58.52 1q3g s ILE 413 Cb -0.16 -0.72 0.00 0.00 0.13 0.00 0.00 42.46 41.72 1q3g s ILE 413 CO -0.06 -0.10 0.11 -0.70 -1.91 0.00 0.00 174.94 172.28 1q3g s GLU 414 N -1.04 0.31 -0.39 3.50 2.12 -0.28 -4.99 118.70 117.93 1q3g s GLU 414 Ca -0.02 -0.16 -0.14 0.00 0.36 0.00 0.00 54.97 55.01 1q3g s GLU 414 Cb -0.07 0.13 0.01 0.00 0.26 0.00 0.00 34.13 34.46 1q3g s GLU 414 CO 0.01 -0.06 0.27 0.50 -0.54 0.00 0.00 175.26 175.43 1q3g s ARG 415 N -0.73 3.07 -0.24 4.30 3.52 -1.26 -0.79 118.95 126.82 1q3g s ARG 415 Ca -0.08 -0.94 -0.19 0.00 -0.13 0.00 0.00 55.73 54.39 1q3g s ARG 415 Cb -0.05 -3.89 -0.03 0.00 -1.56 0.00 0.00 34.95 29.43 1q3g s ARG 415 CO 0.01 -0.66 0.54 0.08 -0.81 0.00 0.00 175.30 174.45 1q3g s VAL 416 N 1.67 5.06 1.03 7.11 1.01 0.21 -4.92 120.40 131.57 1q3g s VAL 416 Ca 0.05 0.97 -0.17 0.00 0.00 0.00 0.00 61.98 62.82 1q3g s VAL 416 Cb -0.19 -3.86 0.25 0.00 0.00 0.00 0.00 36.38 32.59 1q3g s VAL 416 CO 0.09 0.11 0.91 0.29 0.00 0.00 0.00 175.10 176.50 1q3g n LYS 417 N 5.29 -2.81 -0.20 2.72 4.76 -1.26 -1.05 118.16 125.62 1q3g n LYS 417 Ca -0.04 -1.45 0.00 0.00 -2.87 0.00 0.00 58.31 53.95 1q3g n LYS 417 Cb 0.50 -1.36 0.00 0.00 -1.84 0.00 0.00 35.03 32.32 1q3g n LYS 417 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1q3g n GLY 418 N -3.57 0.00 3.24 0.72 0.00 -1.26 -4.72 105.19 99.60 1q3g n GLY 418 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1q3g n GLY 418 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50