#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 -0.10 -4.03 6.12 9.92 -1.26 -1.04 116.55 126.16 1q3g n ASP 2 Ca 0.00 0.72 -0.10 0.00 -0.53 0.00 0.00 54.79 54.89 1q3g n ASP 2 Cb 0.00 -1.31 -0.08 0.00 -0.64 0.00 0.00 41.12 39.09 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 -2.70 1.09 -0.14 -1.24 1.02 -0.21 -2.91 119.74 114.67 1q3g s LYS 3 Ca 0.72 -1.27 0.00 0.00 0.02 0.00 0.00 55.97 55.45 1q3g s LYS 3 Cb -0.40 0.33 -0.01 0.00 -0.52 0.00 0.00 37.83 37.24 1q3g s LYS 3 CO 0.51 -0.37 -0.15 -0.06 -0.92 0.00 0.00 175.35 174.36 1q3g s PHE 4 N -4.00 2.77 -0.37 3.18 2.99 -0.64 0.34 117.98 122.25 1q3g s PHE 4 Ca 0.20 -0.82 -0.08 0.00 0.00 0.00 0.00 56.93 56.24 1q3g s PHE 4 Cb 0.05 -1.84 0.05 0.00 0.00 0.00 0.00 43.02 41.28 1q3g s PHE 4 CO 0.01 -0.32 0.17 0.50 -0.00 0.00 0.00 175.22 175.58 1q3g s ARG 5 N 0.51 2.60 -0.12 0.44 3.52 0.01 -0.86 118.95 125.05 1q3g s ARG 5 Ca -0.10 -1.29 -0.02 0.00 -0.13 0.00 0.00 55.73 54.19 1q3g s ARG 5 Cb -0.16 -3.60 -0.03 0.00 -1.56 0.00 0.00 34.95 29.60 1q3g s ARG 5 CO 0.04 -0.78 -0.03 0.08 -0.81 0.00 0.00 175.30 173.80 1q3g s VAL 6 N 1.41 4.00 -0.18 7.11 1.01 0.82 -2.00 120.40 132.57 1q3g s VAL 6 Ca 0.01 -0.34 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 1q3g s VAL 6 Cb -0.21 -2.71 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 1q3g s VAL 6 CO 0.03 0.54 -0.01 -1.10 0.00 0.00 0.00 175.10 174.56 1q3g s GLN 7 N -0.21 3.64 0.33 2.72 -1.52 -0.21 0.08 119.66 124.50 1q3g s GLN 7 Ca 0.04 -0.52 0.05 0.00 -1.95 0.00 0.00 55.36 52.98 1q3g s GLN 7 Cb -0.13 -3.02 -0.03 0.00 -0.22 0.00 0.00 33.01 29.61 1q3g s GLN 7 CO 0.02 0.10 0.20 0.20 -0.25 0.00 0.00 175.29 175.57 1q3g s GLY 8 N 0.75 2.26 0.32 3.09 0.00 0.75 -4.23 107.32 110.26 1q3g s GLY 8 Ca -0.00 -1.77 -0.15 0.00 0.00 0.00 0.00 44.72 42.80 1q3g s GLY 8 CO 0.02 -1.58 0.74 2.56 0.00 0.00 0.00 173.10 174.84 1q3g s PRO 9 N -3.66 4.01 -0.07 2.90 0.04 -0.78 -1.55 135.00 135.89 1q3g s PRO 9 Ca 0.35 0.68 -0.03 0.00 0.04 0.00 0.00 61.00 62.04 1q3g s PRO 9 Cb 0.03 -2.43 0.04 0.00 0.04 0.00 0.00 34.50 32.19 1q3g s PRO 9 CO 0.21 0.16 0.14 0.95 0.04 0.00 0.00 177.00 178.49 1q3g s THR 10 N -1.98 -0.18 0.09 1.26 -4.23 0.07 -4.99 115.64 105.67 1q3g s THR 10 Ca 0.54 0.32 -0.31 0.00 -1.18 0.00 0.00 61.69 61.06 1q3g s THR 10 Cb -0.10 -0.25 -0.07 0.00 1.34 0.00 0.00 72.50 73.42 1q3g s THR 10 CO 0.17 0.13 1.29 0.00 -0.54 0.00 0.00 174.62 175.68 1q3g s ARG 11 N 1.94 4.38 -0.21 3.99 1.70 -1.26 -4.59 118.95 124.90 1q3g s ARG 11 Ca -0.00 1.92 -0.18 0.00 -0.47 0.00 0.00 55.73 57.00 1q3g s ARG 11 Cb -0.12 -3.30 -0.03 0.00 -0.57 0.00 0.00 34.95 30.93 1q3g s ARG 11 CO -0.05 -0.34 0.50 -0.51 -1.08 0.00 0.00 175.30 173.81 1q3g s LEU 12 N 1.06 4.13 0.11 -1.89 1.43 -1.26 -4.71 118.68 117.54 1q3g s LEU 12 Ca 0.61 0.62 -0.23 0.00 -1.03 0.00 0.00 54.13 54.10 1q3g s LEU 12 Cb -0.33 -2.67 0.06 0.00 0.03 0.00 0.00 46.19 43.28 1q3g s LEU 12 CO 0.30 -0.19 0.56 0.00 0.23 0.00 0.00 176.35 177.25 1q3g s GLN 13 N 1.73 1.17 0.00 1.70 0.00 0.01 -3.84 119.66 120.42 1q3g s GLN 13 Ca 0.23 -0.38 0.00 0.00 -0.00 0.00 0.00 55.36 55.21 1q3g s GLN 13 Cb -0.15 0.53 0.00 0.00 0.00 0.00 0.00 33.01 33.39 1q3g s GLN 13 CO 0.09 -0.47 0.00 0.41 0.00 0.00 0.00 175.29 175.32 1q3g n GLY 14 N -0.04 0.26 3.20 2.60 0.00 -0.51 -4.39 105.19 106.31 1q3g n GLY 14 Ca -0.17 -1.49 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 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 -0.69 0.93 -0.05 1.61 2.02 -1.26 -1.53 118.70 119.73 1q3g s GLU 15 Ca 0.00 -1.33 -0.15 0.00 0.02 0.00 0.00 54.97 53.51 1q3g s GLU 15 Cb 0.00 -0.48 0.03 0.00 0.10 0.00 0.00 34.13 33.78 1q3g s GLU 15 CO 0.00 0.05 0.35 0.54 0.02 0.00 0.00 175.26 176.22 1q3g s VAL 16 N -3.12 0.04 -0.25 2.63 0.11 -0.88 -4.82 120.40 114.11 1q3g s VAL 16 Ca 0.12 -0.31 -0.06 0.00 -2.93 0.00 0.00 61.98 58.80 1q3g s VAL 16 Cb 0.01 -0.60 -0.01 0.00 -1.53 0.00 0.00 36.38 34.25 1q3g s VAL 16 CO -0.01 -0.17 0.03 -0.89 -3.33 0.00 0.00 175.10 170.73 1q3g s THR 17 N -0.86 3.92 0.22 5.04 2.01 -1.26 -0.45 115.64 124.26 1q3g s THR 17 Ca -0.09 -0.38 -0.30 0.00 0.31 0.00 0.00 61.69 61.23 1q3g s THR 17 Cb -0.04 -2.86 -0.09 0.00 0.01 0.00 0.00 72.50 69.52 1q3g s THR 17 CO 0.03 0.32 1.30 -0.63 -0.69 0.00 0.00 174.62 174.95 1q3g s ILE 18 N 1.55 3.16 0.79 1.82 -1.09 -0.13 -4.94 121.20 122.36 1q3g s ILE 18 Ca 0.05 0.98 -0.08 0.00 -2.23 0.00 0.00 60.65 59.37 1q3g s ILE 18 Cb -0.15 -3.63 0.12 0.00 -1.58 0.00 0.00 42.46 37.22 1q3g s ILE 18 CO 0.01 0.16 1.11 -0.44 -1.23 0.00 0.00 174.94 174.55 1q3g s SER 19 N 0.20 4.14 0.63 3.58 0.01 -1.26 -4.82 113.70 116.18 1q3g s SER 19 Ca 0.55 0.18 -0.18 0.00 1.31 0.00 0.00 55.95 57.82 1q3g s SER 19 Cb -0.37 -0.57 -0.02 0.00 0.21 0.00 0.00 66.02 65.28 1q3g s SER 19 CO 0.40 -2.04 1.24 -0.83 0.41 0.00 0.00 173.24 172.42 1q3g s GLY 20 N -4.70 2.71 -0.00 3.44 0.00 -1.21 -1.39 107.32 106.17 1q3g s GLY 20 Ca 0.66 1.06 -0.30 0.00 0.00 0.00 0.00 44.72 46.14 1q3g s GLY 20 CO 0.47 1.46 1.71 0.00 0.00 0.00 0.00 173.10 176.74 1q3g s ALA 21 N -1.59 3.63 0.17 3.20 0.00 0.45 -4.33 121.76 123.29 1q3g s ALA 21 Ca 0.79 1.09 -0.14 0.00 0.00 0.00 0.00 51.96 53.69 1q3g s ALA 21 Cb -0.33 -3.75 0.10 0.00 0.00 0.00 0.00 23.12 19.15 1q3g s ALA 21 CO 0.37 -1.33 1.78 -0.22 0.00 0.00 0.00 175.76 176.36 1q3g h LYS 22 N 9.34 0.45 -0.20 0.00 3.64 -1.90 -0.89 116.57 127.01 1q3g h LYS 22 Ca -0.42 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1q3g h LYS 22 Cb 1.20 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 1q3g h LYS 22 CO 0.94 0.30 0.00 0.09 -2.27 0.00 0.00 179.45 178.51 1q3g n ASN 23 N -4.90 0.20 -0.01 4.20 3.02 -1.26 -1.89 115.26 114.62 1q3g n ASN 23 Ca 0.03 -2.00 -0.02 0.00 -0.03 0.00 0.00 54.58 52.57 1q3g n ASN 23 Cb 0.12 -0.10 -0.01 0.00 -0.61 0.00 0.00 39.78 39.17 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 -0.40 1.94 -0.13 5.41 0.00 -0.95 -4.50 120.51 121.87 1q3g n ALA 24 Ca 0.00 -0.13 -0.09 0.00 0.00 0.00 0.00 53.44 53.22 1q3g n ALA 24 Cb 0.05 0.41 -0.01 0.00 0.00 0.00 0.00 19.45 19.91 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 0.51 0.50 0.00 0.00 -1.06 -2.00 119.26 117.23 1q3g h ALA 25 Ca -0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1q3g h ALA 25 Cb 1.10 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1q3g h ALA 25 CO -0.01 0.12 -0.24 -0.07 0.00 0.00 0.00 179.25 179.05 1q3g h LEU 26 N 0.48 -0.57 -1.43 0.00 3.38 -1.62 0.81 115.31 116.36 1q3g h LEU 26 Ca 0.13 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 1q3g h LEU 26 Cb 0.21 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1q3g h LEU 26 CO -0.01 -0.41 -0.19 1.55 0.09 0.00 0.00 178.44 179.48 1q3g h PRO 27 N -0.68 0.14 -0.25 1.13 0.13 -1.78 -2.28 132.00 128.41 1q3g h PRO 27 Ca -0.07 -0.04 -0.17 0.00 -0.87 0.00 0.00 66.00 64.85 1q3g h PRO 27 Cb 0.52 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.63 1q3g h PRO 27 CO 0.11 0.33 -0.53 0.82 -0.23 0.00 0.00 178.00 178.50 1q3g h ILE 28 N 0.14 1.30 -0.75 -3.56 2.04 -1.18 -0.50 117.51 114.99 1q3g h ILE 28 Ca 0.03 -1.74 -0.04 0.00 1.00 0.00 0.00 64.86 64.10 1q3g h ILE 28 Cb 0.41 1.67 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 1q3g h ILE 28 CO 0.03 0.56 0.31 -0.07 0.00 0.00 0.00 178.15 178.97 1q3g h LEU 29 N 0.56 1.04 -0.60 1.44 3.38 -0.46 -1.29 115.31 119.38 1q3g h LEU 29 Ca 0.02 -0.17 -0.15 0.00 0.09 0.00 0.00 57.88 57.66 1q3g h LEU 29 Cb 1.11 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1q3g h LEU 29 CO 0.11 0.92 -0.59 -0.26 0.09 0.00 0.00 178.44 178.71 1q3g h PHE 30 N 1.09 0.44 0.00 1.13 -1.00 -1.34 -2.73 116.94 114.53 1q3g h PHE 30 Ca 0.25 -0.17 -0.02 0.00 2.81 0.00 0.00 57.97 60.85 1q3g h PHE 30 Cb 0.21 -0.08 -0.00 0.00 3.61 0.00 0.00 35.95 39.68 1q3g h PHE 30 CO 0.02 0.85 -0.10 0.00 -1.61 0.00 0.00 178.31 177.47 1q3g h ALA 31 N 1.11 1.76 0.00 2.45 0.00 -0.47 -1.51 119.26 122.60 1q3g h ALA 31 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1q3g h ALA 31 Cb 1.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1q3g h ALA 31 CO 0.10 0.12 0.03 0.00 0.00 0.00 0.00 179.25 179.50 1q3g h ALA 32 N 1.90 1.03 0.00 0.00 0.00 -0.92 -0.15 119.26 121.12 1q3g h ALA 32 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1q3g h ALA 32 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1q3g h ALA 32 CO 0.01 -0.03 0.00 -0.07 0.00 0.00 0.00 179.25 179.16 1q3g h LEU 33 N 0.00 0.00 0.00 0.00 3.38 -1.41 -0.20 115.31 117.08 1q3g h LEU 33 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1q3g h LEU 33 Cb 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1q3g h LEU 33 CO 0.00 0.00 -0.41 -0.07 0.09 0.00 0.00 178.44 178.05 1q3g h LEU 34 N 0.00 0.00 -9.50 1.67 3.38 -1.22 -3.47 115.31 106.17 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 0.09 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.85 1q3g h LEU 34 CO 0.00 0.20 0.63 0.00 0.09 0.00 0.00 178.44 179.36 1q3g s ALA 35 N -3.13 3.48 -0.12 1.53 0.00 -0.09 -4.28 121.76 119.14 1q3g s ALA 35 Ca 0.04 0.95 0.17 0.00 0.00 0.00 0.00 51.96 53.13 1q3g s ALA 35 Cb 0.07 -3.49 -0.19 0.00 0.00 0.00 0.00 23.12 19.51 1q3g s ALA 35 CO 0.72 -0.52 0.62 0.39 0.00 0.00 0.00 175.76 176.97 1q3g n GLU 36 N 3.99 0.64 -3.80 0.00 1.02 -0.70 -4.20 120.64 117.59 1q3g n GLU 36 Ca 0.10 0.14 -0.22 0.00 -0.02 0.00 0.00 57.16 57.16 1q3g n GLU 36 Cb 0.45 -1.72 -0.04 0.00 -0.02 0.00 0.00 31.44 30.11 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 -2.88 2.54 0.54 3.49 2.02 -1.02 -4.19 118.70 119.19 1q3g s GLU 37 Ca -0.05 -1.49 -0.19 0.00 0.02 0.00 0.00 54.97 53.26 1q3g s GLU 37 Cb 0.09 -2.34 -0.09 0.00 0.10 0.00 0.00 34.13 31.89 1q3g s GLU 37 CO 0.83 -0.03 0.57 -2.30 0.02 0.00 0.00 175.26 174.35 1q3g n PRO 38 N -1.38 0.58 -3.82 0.39 -0.02 -1.26 -4.14 135.00 125.34 1q3g n PRO 38 Ca 0.00 0.22 -0.13 0.00 -2.02 0.00 0.00 63.50 61.57 1q3g n PRO 38 Cb 0.61 -1.71 -0.15 0.00 -0.02 0.00 0.00 33.50 32.24 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 -1.65 -0.02 -0.15 -1.45 1.01 -0.27 -0.88 120.40 116.98 1q3g s VAL 39 Ca 0.68 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.75 1q3g s VAL 39 Cb -0.47 -0.07 0.03 0.00 0.00 0.00 0.00 36.38 35.87 1q3g s VAL 39 CO 0.55 0.03 -0.12 -0.70 0.00 0.00 0.00 175.10 174.86 1q3g s GLU 40 N 0.44 2.07 -0.30 2.72 2.12 0.47 0.07 118.70 126.29 1q3g s GLU 40 Ca -0.04 -0.56 -0.08 0.00 0.36 0.00 0.00 54.97 54.65 1q3g s GLU 40 Cb -0.05 -2.08 -0.00 0.00 0.26 0.00 0.00 34.13 32.25 1q3g s GLU 40 CO -0.01 -0.29 0.12 0.42 -0.54 0.00 0.00 175.26 174.95 1q3g s ILE 41 N 1.51 4.37 0.42 -3.70 1.01 -0.11 -1.36 121.20 123.34 1q3g s ILE 41 Ca 0.04 -0.47 -0.02 0.00 0.00 0.00 0.00 60.65 60.19 1q3g s ILE 41 Cb -0.14 -3.21 -0.03 0.00 0.01 0.00 0.00 42.46 39.09 1q3g s ILE 41 CO -0.10 0.10 0.66 -1.10 0.00 0.00 0.00 174.94 174.51 1q3g s GLN 42 N 1.58 3.45 -1.40 2.79 -0.21 0.11 -0.39 119.66 125.59 1q3g s GLN 42 Ca 0.04 -0.14 -0.10 0.00 0.02 0.00 0.00 55.36 55.18 1q3g s GLN 42 Cb -0.17 -2.53 0.03 0.00 1.00 0.00 0.00 33.01 31.34 1q3g s GLN 42 CO 0.05 -0.05 1.15 -1.71 -2.12 0.00 0.00 175.29 172.60 1q3g n ASN 43 N -2.02 -6.07 -4.65 5.90 5.15 -1.03 -1.27 115.26 111.27 1q3g n ASN 43 Ca -0.02 -0.59 -0.41 0.00 -0.60 0.00 0.00 54.58 52.96 1q3g n ASN 43 Cb 0.56 -4.80 -0.05 0.00 -0.53 0.00 0.00 39.78 34.96 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 -3.32 4.94 0.69 3.44 1.01 -0.44 -3.34 120.40 123.38 1q3g s VAL 44 Ca 0.60 1.36 -0.15 0.00 0.00 0.00 0.00 61.98 63.79 1q3g s VAL 44 Cb -0.27 -4.03 0.02 0.00 0.00 0.00 0.00 36.38 32.10 1q3g s VAL 44 CO 0.75 0.03 1.16 -2.16 0.00 0.00 0.00 175.10 174.89 1q3g s PRO 45 N 2.31 2.50 -0.83 2.72 0.04 -1.26 -4.78 135.00 135.70 1q3g s PRO 45 Ca 0.32 1.61 -0.17 0.00 0.04 0.00 0.00 61.00 62.80 1q3g s PRO 45 Cb -0.16 -1.89 0.16 0.00 0.04 0.00 0.00 34.50 32.65 1q3g s PRO 45 CO 0.10 -1.53 0.92 0.15 0.04 0.00 0.00 177.00 176.68 1q3g s LYS 46 N -3.92 3.50 0.20 4.56 1.02 -1.26 -4.87 119.74 118.97 1q3g s LYS 46 Ca 0.71 -1.95 0.09 0.00 0.02 0.00 0.00 55.97 54.85 1q3g s LYS 46 Cb -0.25 -4.62 -0.05 0.00 -0.52 0.00 0.00 37.83 32.39 1q3g s LYS 46 CO 0.42 -1.55 -0.17 -0.51 -0.92 0.00 0.00 175.35 172.62 1q3g s LEU 47 N 1.74 2.51 0.30 3.17 1.43 -1.26 -4.58 118.68 121.99 1q3g s LEU 47 Ca 0.23 -0.96 0.01 0.00 -1.03 0.00 0.00 54.13 52.39 1q3g s LEU 47 Cb -0.10 -0.80 0.54 0.00 0.03 0.00 0.00 46.19 45.86 1q3g s LEU 47 CO -0.06 -0.09 1.89 0.50 0.23 0.00 0.00 176.35 178.82 1q3g h LYS 48 N 2.79 0.99 0.00 1.70 3.11 -1.54 -1.06 116.57 122.56 1q3g h LYS 48 Ca -0.40 -0.06 -0.07 0.00 -2.81 0.00 0.00 60.65 57.31 1q3g h LYS 48 Cb 1.22 -0.22 -0.01 0.00 -1.00 0.00 0.00 32.23 32.22 1q3g h LYS 48 CO 0.57 0.65 -0.31 -0.44 -2.81 0.00 0.00 179.45 177.11 1q3g h ASP 49 N 1.02 0.00 0.16 4.20 3.32 -1.83 -1.53 116.42 121.75 1q3g h ASP 49 Ca 0.42 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.32 1q3g h ASP 49 Cb 0.29 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 1q3g h ASP 49 CO -0.18 0.31 -0.58 0.40 -1.72 0.00 0.00 179.24 177.48 1q3g h ILE 50 N 0.00 1.34 -0.11 0.35 1.08 -1.52 -0.95 117.51 117.70 1q3g h ILE 50 Ca -0.00 -1.87 -0.01 0.00 -0.39 0.00 0.00 64.86 62.58 1q3g h ILE 50 Cb 0.58 1.87 -0.00 0.00 -3.07 0.00 0.00 36.82 36.19 1q3g h ILE 50 CO 0.04 0.57 0.01 0.44 -0.69 0.00 0.00 178.15 178.52 1q3g h ASP 51 N 0.33 0.18 -0.99 1.72 3.32 -1.00 -0.80 116.42 119.18 1q3g h ASP 51 Ca 0.00 -0.28 0.02 0.00 0.02 0.00 0.00 57.03 56.79 1q3g h ASP 51 Cb 1.10 -0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.55 1q3g h ASP 51 CO 0.10 0.42 0.66 0.74 -1.72 0.00 0.00 179.24 179.44 1q3g h THR 52 N -0.07 1.23 -0.43 0.35 2.02 -1.23 0.05 112.91 114.83 1q3g h THR 52 Ca 0.03 -0.45 -0.03 0.00 0.77 0.00 0.00 66.41 66.73 1q3g h THR 52 Cb 0.32 -0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 66.51 1q3g h THR 52 CO 0.00 0.24 0.15 0.74 0.37 0.00 0.00 175.52 177.02 1q3g h THR 53 N 1.32 1.21 -0.82 3.16 2.02 -0.99 -0.86 112.91 117.95 1q3g h THR 53 Ca 0.38 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 1q3g h THR 53 Cb -0.10 0.86 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 1q3g h THR 53 CO -0.10 0.25 0.36 0.24 0.37 0.00 0.00 175.52 176.64 1q3g h MET 54 N 0.56 1.21 -0.23 6.66 2.07 -0.51 0.55 114.93 125.23 1q3g h MET 54 Ca 0.14 -0.20 -0.00 0.00 -2.07 0.00 0.00 59.70 57.56 1q3g h MET 54 Cb 0.24 -0.21 -0.01 0.00 -1.87 0.00 0.00 31.60 29.76 1q3g h MET 54 CO -0.01 0.96 0.12 0.87 1.07 0.00 0.00 176.91 179.92 1q3g h LYS 55 N 1.19 0.32 0.14 1.72 1.57 -0.65 -0.52 116.57 120.33 1q3g h LYS 55 Ca 0.28 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 1q3g h LYS 55 Cb 0.18 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1q3g h LYS 55 CO -0.03 0.30 -0.13 1.25 -0.57 0.00 0.00 179.45 180.28 1q3g h LEU 56 N 0.26 -0.33 -0.41 2.94 6.46 -0.75 -0.27 115.31 123.22 1q3g h LEU 56 Ca 0.08 0.03 0.07 0.00 -0.12 0.00 0.00 57.88 57.94 1q3g h LEU 56 Cb 0.07 0.11 -0.06 0.00 -0.73 0.00 0.00 40.66 40.05 1q3g h LEU 56 CO -0.01 -0.19 0.05 -0.07 -0.62 0.00 0.00 178.44 177.59 1q3g h LEU 57 N -0.28 -0.07 -1.12 2.25 3.38 -0.78 -1.24 115.31 117.44 1q3g h LEU 57 Ca 0.00 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.11 1q3g h LEU 57 Cb 0.27 0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 1q3g h LEU 57 CO -0.03 -0.00 0.60 0.74 0.09 0.00 0.00 178.44 179.84 1q3g h THR 58 N 0.16 1.10 0.00 0.22 2.02 -0.75 -0.09 112.91 115.57 1q3g h THR 58 Ca 0.20 -0.37 -0.03 0.00 0.77 0.00 0.00 66.41 66.98 1q3g h THR 58 Cb 0.26 -0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 66.59 1q3g h THR 58 CO -0.29 0.20 -0.12 -0.61 0.37 0.00 0.00 175.52 175.06 1q3g h GLN 59 N 1.08 0.00 -0.00 6.66 4.15 0.10 -0.81 115.11 126.29 1q3g h GLN 59 Ca 0.39 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.81 1q3g h GLN 59 Cb 0.14 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.83 1q3g h GLN 59 CO -0.14 0.12 -0.06 1.28 -1.93 0.00 0.00 178.83 178.10 1q3g n LEU 60 N -3.48 0.38 0.00 -2.39 4.77 -0.11 -4.72 117.00 111.46 1q3g n LEU 60 Ca -0.01 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1q3g n LEU 60 Cb 0.28 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1q3g n LEU 60 CO 0.30 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1q3g n GLY 61 N 1.22 1.59 3.92 -0.72 0.00 -0.31 -1.96 105.19 108.93 1q3g n GLY 61 Ca 0.16 -0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 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 5.37 -0.38 2.61 2.01 -0.81 -3.91 115.64 118.52 1q3g s THR 62 Ca 0.00 -0.33 -0.15 0.00 0.31 0.00 0.00 61.69 61.52 1q3g s THR 62 Cb 0.00 -3.62 0.01 0.00 0.01 0.00 0.00 72.50 68.89 1q3g s THR 62 CO 0.00 0.14 0.36 -0.54 -0.69 0.00 0.00 174.62 173.89 1q3g s LYS 63 N -2.49 3.27 -0.04 4.92 1.02 -0.63 -4.12 119.74 121.68 1q3g s LYS 63 Ca 0.35 -0.69 0.04 0.00 0.02 0.00 0.00 55.97 55.69 1q3g s LYS 63 Cb -0.13 -3.90 -0.01 0.00 -0.52 0.00 0.00 37.83 33.28 1q3g s LYS 63 CO 0.27 -0.67 -0.17 0.08 -0.92 0.00 0.00 175.35 173.94 1q3g s VAL 64 N 1.94 1.40 -0.19 3.17 1.01 -1.26 -1.18 120.40 125.29 1q3g s VAL 64 Ca 0.10 -0.71 -0.15 0.00 0.00 0.00 0.00 61.98 61.21 1q3g s VAL 64 Cb -0.17 -1.20 0.05 0.00 0.00 0.00 0.00 36.38 35.06 1q3g s VAL 64 CO 0.12 0.40 0.49 -1.83 0.00 0.00 0.00 175.10 174.28 1q3g s GLU 65 N -0.05 0.55 0.38 2.72 -1.05 -0.89 -5.01 118.70 115.34 1q3g s GLU 65 Ca -0.02 0.74 0.05 0.00 -0.15 0.00 0.00 54.97 55.59 1q3g s GLU 65 Cb -0.10 0.21 -0.03 0.00 -0.44 0.00 0.00 34.13 33.77 1q3g s GLU 65 CO 0.02 -0.09 0.18 -0.98 0.95 0.00 0.00 175.26 175.33 1q3g s ARG 66 N 0.56 1.87 0.00 -4.83 1.70 -1.26 0.39 118.95 117.38 1q3g s ARG 66 Ca -0.02 -2.12 0.00 0.00 -0.47 0.00 0.00 55.73 53.11 1q3g s ARG 66 Cb -0.04 -0.30 0.00 0.00 -0.57 0.00 0.00 34.95 34.03 1q3g s ARG 66 CO -0.03 -0.53 0.00 -0.40 -1.08 0.00 0.00 175.30 173.25 1q3g n ASP 67 N -1.37 0.00 0.06 -2.89 5.68 -1.26 -5.00 116.55 111.78 1q3g n ASP 67 Ca -0.02 0.00 0.11 0.00 -0.50 0.00 0.00 54.79 54.39 1q3g n ASP 67 Cb 0.64 0.00 0.02 0.00 -1.14 0.00 0.00 41.12 40.64 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 4.49 -1.34 3.74 6.12 0.00 -1.26 -5.08 105.19 111.86 1q3g n GLY 68 Ca 0.00 -0.31 -0.24 0.00 0.00 0.00 0.00 46.02 45.47 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 -4.67 4.58 -0.16 1.61 0.01 -1.26 -1.33 113.70 112.48 1q3g s SER 69 Ca 0.01 -0.89 0.01 0.00 1.31 0.00 0.00 55.95 56.38 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 0.79 -0.41 -0.16 -0.69 0.41 0.00 0.00 173.24 173.18 1q3g s VAL 70 N -2.50 1.74 -0.22 3.43 1.01 0.48 -4.36 120.40 119.99 1q3g s VAL 70 Ca 0.40 -0.74 -0.13 0.00 0.00 0.00 0.00 61.98 61.50 1q3g s VAL 70 Cb -0.00 -1.61 -0.05 0.00 0.00 0.00 0.00 36.38 34.73 1q3g s VAL 70 CO 0.23 0.49 0.27 0.26 0.00 0.00 0.00 175.10 176.34 1q3g s TRP 71 N 1.38 3.35 -0.04 5.22 0.51 0.16 -0.93 118.94 128.59 1q3g s TRP 71 Ca 0.04 0.41 0.06 0.00 -2.12 0.00 0.00 56.10 54.50 1q3g s TRP 71 Cb -0.13 -2.38 -0.02 0.00 -0.81 0.00 0.00 33.47 30.14 1q3g s TRP 71 CO -0.11 0.05 -0.24 0.42 -0.51 0.00 0.00 176.95 176.56 1q3g s ILE 72 N 1.10 2.18 -0.35 2.03 -1.09 0.11 -2.10 121.20 123.08 1q3g s ILE 72 Ca 0.13 -1.04 -0.00 0.00 -2.23 0.00 0.00 60.65 57.51 1q3g s ILE 72 Cb -0.14 -1.78 0.12 0.00 -1.58 0.00 0.00 42.46 39.07 1q3g s ILE 72 CO 0.06 0.58 0.16 -0.62 -1.23 0.00 0.00 174.94 173.88 1q3g s ASP 73 N -0.40 3.68 -0.35 3.58 3.68 -0.33 -1.12 116.67 125.42 1q3g s ASP 73 Ca 0.03 -1.96 0.08 0.00 2.13 0.00 0.00 52.55 52.84 1q3g s ASP 73 Cb -0.12 -0.76 0.65 0.00 -1.45 0.00 0.00 42.92 41.24 1q3g s ASP 73 CO 0.01 -0.36 1.75 0.00 0.13 0.00 0.00 175.17 176.71 1q3g n ALA 74 N 4.40 4.80 0.22 3.66 0.00 -1.26 -1.60 120.51 130.74 1q3g n ALA 74 Ca 0.03 -2.73 0.11 0.00 0.00 0.00 0.00 53.44 50.86 1q3g n ALA 74 Cb 0.39 -1.18 0.29 0.00 0.00 0.00 0.00 19.45 18.96 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 1.62 0.00 -0.87 0.00 4.64 -1.73 -3.29 113.55 113.91 1q3g h SER 75 Ca 0.38 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 61.10 1q3g h SER 75 Cb 2.34 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 64.04 1q3g h SER 75 CO 0.77 0.11 -0.26 0.59 -0.87 0.00 0.00 176.83 177.17 1q3g n ASN 76 N -3.15 5.83 -4.68 4.97 5.03 -1.26 -5.01 115.26 116.98 1q3g n ASN 76 Ca 0.02 -3.76 -0.42 0.00 0.87 0.00 0.00 54.58 51.29 1q3g n ASN 76 Cb 0.50 -0.55 -0.03 0.00 -1.02 0.00 0.00 39.78 38.68 1q3g n ASN 76 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1q3g s VAL 77 N -4.71 3.61 0.00 2.41 1.01 -1.24 -4.74 120.40 116.73 1q3g s VAL 77 Ca 0.55 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.50 1q3g s VAL 77 Cb 0.44 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 33.20 1q3g s VAL 77 CO 0.01 -0.02 0.00 -0.46 0.00 0.00 0.00 175.10 174.63 1q3g n ASN 78 N 5.70 4.29 -4.87 3.32 6.94 -0.95 -5.02 115.26 124.67 1q3g n ASN 78 Ca 0.14 0.00 -0.33 0.00 -0.02 0.00 0.00 54.58 54.37 1q3g n ASN 78 Cb 0.43 0.60 -0.06 0.00 -2.36 0.00 0.00 39.78 38.40 1q3g n ASN 78 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1q3g s ASN 79 N -2.31 6.16 -0.12 0.53 2.47 -0.83 -5.03 114.94 115.82 1q3g s ASN 79 Ca 0.00 0.29 0.17 0.00 0.42 0.00 0.00 52.86 53.74 1q3g s ASN 79 Cb 0.00 -1.89 0.41 0.00 -1.45 0.00 0.00 41.25 38.31 1q3g s ASN 79 CO 0.00 0.27 1.19 0.49 -3.72 0.00 0.00 177.10 175.34 1q3g n PHE 80 N 1.07 0.00 -4.35 0.43 3.72 -1.26 -4.68 117.46 112.39 1q3g n PHE 80 Ca -0.12 -1.05 -0.26 0.00 -0.05 0.00 0.00 57.45 55.96 1q3g n PHE 80 Cb 0.53 -0.20 -0.13 0.00 -0.94 0.00 0.00 39.48 38.74 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 -2.69 3.01 -0.38 4.37 0.15 -1.26 -0.85 113.70 116.06 1q3g s SER 81 Ca 0.35 -0.75 0.04 0.00 0.70 0.00 0.00 55.95 56.29 1q3g s SER 81 Cb 0.36 -0.19 0.11 0.00 -1.71 0.00 0.00 66.02 64.59 1q3g s SER 81 CO -0.10 0.11 0.10 0.00 1.20 0.00 0.00 173.24 174.55 1q3g s ALA 82 N -1.25 2.89 0.56 5.45 0.00 0.42 -4.86 121.76 124.97 1q3g s ALA 82 Ca 0.12 -2.65 -0.18 0.00 0.00 0.00 0.00 51.96 49.25 1q3g s ALA 82 Cb -0.09 -1.99 -0.10 0.00 0.00 0.00 0.00 23.12 20.94 1q3g s ALA 82 CO 0.06 -1.77 0.39 -0.35 0.00 0.00 0.00 175.76 174.09 1q3g n PRO 83 N 4.02 0.40 0.20 0.00 -0.04 -1.26 -2.52 135.00 135.80 1q3g n PRO 83 Ca 0.04 0.16 -0.15 0.00 -0.04 0.00 0.00 63.50 63.51 1q3g n PRO 83 Cb 0.40 -1.57 -0.07 0.00 -0.04 0.00 0.00 33.50 32.22 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 0.17 -0.89 0.00 0.54 3.20 -1.97 -2.04 116.97 115.98 1q3g h TYR 84 Ca -0.45 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.43 1q3g h TYR 84 Cb 1.41 0.35 0.00 0.00 1.54 0.00 0.00 36.73 40.03 1q3g h TYR 84 CO 0.30 -0.46 0.00 -0.40 -1.64 0.00 0.00 178.16 175.95 1q3g n ASP 85 N -5.44 0.00 -0.13 -2.11 5.75 -1.26 -1.29 116.55 112.07 1q3g n ASP 85 Ca -0.09 0.32 -0.27 0.00 -0.01 0.00 0.00 54.79 54.74 1q3g n ASP 85 Cb 0.34 -0.34 -0.11 0.00 -1.03 0.00 0.00 41.12 39.99 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 -1.34 2.07 0.26 -2.12 0.00 -0.81 -4.37 117.00 110.69 1q3g n LEU 86 Ca 0.01 0.30 0.16 0.00 0.00 0.00 0.00 56.01 56.47 1q3g n LEU 86 Cb 0.01 -0.86 0.60 0.00 0.00 0.00 0.00 43.42 43.17 1q3g n LEU 86 CO 0.01 0.57 0.95 -0.37 0.00 0.00 0.00 177.39 178.55 1q3g h VAL 87 N -0.87 0.08 0.00 1.96 -1.51 -1.07 -2.23 116.25 112.61 1q3g h VAL 87 Ca -0.62 -0.65 0.00 0.00 -1.23 0.00 0.00 66.70 64.20 1q3g h VAL 87 Cb 1.60 1.60 0.00 0.00 -2.13 0.00 0.00 31.29 32.36 1q3g h VAL 87 CO -0.34 0.03 0.00 2.29 -1.23 0.00 0.00 177.57 178.32 1q3g n LYS 88 N -3.13 0.18 -0.00 5.19 2.85 -0.41 -1.47 118.16 121.36 1q3g n LYS 88 Ca 0.01 0.46 0.09 0.00 -1.05 0.00 0.00 58.31 57.82 1q3g n LYS 88 Cb 0.35 -1.87 -0.12 0.00 -0.65 0.00 0.00 35.03 32.74 1q3g n LYS 88 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1q3g n THR 89 N -2.21 0.00 -3.15 0.58 -2.24 -0.84 -4.85 114.28 101.57 1q3g n THR 89 Ca 0.01 -0.11 0.04 0.00 -2.27 0.00 0.00 64.05 61.73 1q3g n THR 89 Cb 0.19 0.85 -0.00 0.00 -2.10 0.00 0.00 70.33 69.27 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 -2.91 0.54 0.58 -0.78 -2.45 -0.54 -5.02 119.30 108.72 1q3g s MET 90 Ca 0.05 0.62 0.38 0.00 -1.25 0.00 0.00 55.69 55.49 1q3g s MET 90 Cb 0.14 0.30 1.88 0.00 1.25 0.00 0.00 34.83 38.41 1q3g s MET 90 CO 0.80 -0.93 2.15 0.07 1.05 0.00 0.00 175.02 178.16 1q3g h ARG 91 N 7.97 0.00 0.00 4.11 0.11 -1.87 -2.30 114.38 122.41 1q3g h ARG 91 Ca -0.06 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.02 1q3g h ARG 91 Cb 1.18 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.26 1q3g h ARG 91 CO 0.16 0.00 0.00 0.00 0.10 0.00 0.00 179.97 180.23 1q3g n ALA 92 N -2.05 1.29 0.33 0.08 0.00 -1.26 -1.92 120.51 116.98 1q3g n ALA 92 Ca -0.01 -0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.64 1q3g n ALA 92 Cb 0.17 -1.13 1.15 0.00 0.00 0.00 0.00 19.45 19.65 1q3g n ALA 92 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1q3g h SER 93 N 0.00 0.00 -0.08 0.00 0.02 -1.76 -1.46 113.55 110.28 1q3g h SER 93 Ca 0.00 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1q3g h SER 93 Cb 0.11 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 1q3g h SER 93 CO 0.00 0.00 0.09 -0.29 -1.14 0.00 0.00 176.83 175.49 1q3g h ILE 94 N 0.00 0.45 0.00 3.27 6.09 -1.65 -1.18 117.51 124.50 1q3g h ILE 94 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1q3g h ILE 94 Cb 0.08 0.92 0.00 0.00 0.47 0.00 0.00 36.82 38.29 1q3g h ILE 94 CO -0.00 0.00 0.00 0.79 -3.07 0.00 0.00 178.15 175.87 1q3g n TRP 95 N -3.75 0.00 0.03 2.19 8.01 -0.55 -2.35 117.44 121.02 1q3g n TRP 95 Ca -0.01 0.00 -0.08 0.00 -1.31 0.00 0.00 57.50 56.10 1q3g n TRP 95 Cb 0.19 -0.09 -0.13 0.00 -2.01 0.00 0.00 31.31 29.27 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 2.79 0.51 -0.13 6.99 0.00 -1.44 -3.38 119.26 124.60 1q3g h ALA 96 Ca 0.00 -1.14 0.05 0.00 0.00 0.00 0.00 54.91 53.82 1q3g h ALA 96 Cb 0.04 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 1q3g h ALA 96 CO 0.00 1.37 -0.22 1.25 0.00 0.00 0.00 179.25 181.65 1q3g h LEU 97 N 0.01 -0.67 0.27 0.00 5.85 -1.66 -2.03 115.31 117.08 1q3g h LEU 97 Ca -0.13 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 1q3g h LEU 97 Cb 1.88 0.30 -0.03 0.00 0.37 0.00 0.00 40.66 43.18 1q3g h LEU 97 CO 0.11 -0.27 -0.46 1.23 -0.34 0.00 0.00 178.44 178.71 1q3g h GLY 98 N -0.27 -1.19 0.80 3.75 0.00 -1.76 -1.81 103.07 102.58 1q3g h GLY 98 Ca 0.10 0.60 0.04 0.00 0.00 0.00 0.00 47.33 48.07 1q3g h GLY 98 CO -0.29 -0.32 0.33 -2.55 0.00 0.00 0.00 176.54 173.71 1q3g h PRO 99 N -0.78 0.63 0.00 4.80 0.11 -1.74 -1.37 132.00 133.66 1q3g h PRO 99 Ca -0.03 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 66.07 1q3g h PRO 99 Cb 0.73 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 31.66 1q3g h PRO 99 CO -0.16 0.41 -0.16 -0.07 -0.21 0.00 0.00 178.00 177.81 1q3g h LEU 100 N 0.65 -0.47 -1.13 2.35 3.38 -1.25 -0.01 115.31 118.83 1q3g h LEU 100 Ca 0.25 0.07 -0.09 0.00 0.09 0.00 0.00 57.88 58.19 1q3g h LEU 100 Cb 0.08 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1q3g h LEU 100 CO -0.13 -0.22 -0.43 1.62 0.09 0.00 0.00 178.44 179.37 1q3g h VAL 101 N -0.27 1.31 -0.04 1.22 3.04 -0.97 0.31 116.25 120.85 1q3g h VAL 101 Ca 0.05 -1.48 -0.18 0.00 -1.01 0.00 0.00 66.70 64.08 1q3g h VAL 101 Cb 0.33 1.79 -0.01 0.00 -2.01 0.00 0.00 31.29 31.40 1q3g h VAL 101 CO -0.15 0.42 -0.77 0.00 -1.01 0.00 0.00 177.57 176.07 1q3g h ALA 102 N 1.56 0.61 0.00 3.17 0.00 -0.84 -1.62 119.26 122.14 1q3g h ALA 102 Ca -0.00 -0.64 -0.38 0.00 0.00 0.00 0.00 54.91 53.89 1q3g h ALA 102 Cb 0.77 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.42 1q3g h ALA 102 CO 0.06 0.81 -2.41 -2.13 0.00 0.00 0.00 179.25 175.58 1q3g n ARG 103 N -3.78 0.67 -0.10 0.00 0.63 -0.05 -4.59 116.66 109.45 1q3g n ARG 103 Ca -0.04 0.07 0.05 0.00 -0.92 0.00 0.00 57.85 57.01 1q3g n ARG 103 Cb 0.73 -1.53 0.10 0.00 0.45 0.00 0.00 32.46 32.21 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 -2.99 0.26 -0.85 -0.14 3.01 0.11 -4.98 117.46 111.87 1q3g n PHE 104 Ca -0.38 -0.33 0.00 0.00 1.01 0.00 0.00 57.45 57.75 1q3g n PHE 104 Cb 1.08 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 40.53 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 0.43 0.36 3.52 1.37 0.00 -0.61 -4.93 105.19 105.32 1q3g n GLY 105 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.78 1.38 0.00 1.61 -2.07 -1.25 -1.33 119.66 117.22 1q3g s GLN 106 Ca 0.00 -0.82 0.00 0.00 -1.82 0.00 0.00 55.36 52.72 1q3g s GLN 106 Cb 0.00 0.53 0.00 0.00 -1.09 0.00 0.00 33.01 32.45 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 2.02 3.08 2.60 0.00 -0.73 -2.40 105.19 109.41 1q3g n GLY 107 Ca -0.11 -0.29 -0.12 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.73 0.21 -0.03 1.61 -2.07 -0.03 -0.65 119.66 116.97 1q3g s GLN 108 Ca 0.00 0.76 0.07 0.00 -1.82 0.00 0.00 55.36 54.37 1q3g s GLN 108 Cb 0.00 0.01 -0.02 0.00 -1.09 0.00 0.00 33.01 31.91 1q3g s GLN 108 CO 0.00 -0.24 -0.24 0.08 -1.32 0.00 0.00 175.29 173.57 1q3g s VAL 109 N 2.12 1.89 0.19 3.63 1.01 -0.85 -0.44 120.40 127.96 1q3g s VAL 109 Ca -0.02 -1.01 -0.32 0.00 0.00 0.00 0.00 61.98 60.62 1q3g s VAL 109 Cb -0.11 -1.58 -0.11 0.00 0.00 0.00 0.00 36.38 34.58 1q3g s VAL 109 CO -0.10 0.53 1.65 -0.55 0.00 0.00 0.00 175.10 176.63 1q3g s SER 110 N -0.46 6.48 -0.16 3.32 0.15 -1.05 -0.80 113.70 121.18 1q3g s SER 110 Ca 0.06 2.75 -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 61.56 1q3g s SER 110 CO 0.00 -0.90 1.88 -0.22 1.20 0.00 0.00 173.24 175.21 1q3g s LEU 111 N 1.13 3.89 0.40 3.45 0.20 0.12 -4.82 118.68 123.05 1q3g s LEU 111 Ca 0.72 1.95 -0.27 0.00 0.69 0.00 0.00 54.13 57.23 1q3g s LEU 111 Cb -0.47 -3.53 -0.10 0.00 -0.43 0.00 0.00 46.19 41.67 1q3g s LEU 111 CO 0.32 -1.42 1.41 -2.16 -0.29 0.00 0.00 176.35 174.20 1q3g s PRO 112 N 5.14 3.99 0.00 0.98 0.04 -1.26 -4.97 135.00 138.91 1q3g s PRO 112 Ca 0.84 2.40 0.00 0.00 0.04 0.00 0.00 61.00 64.28 1q3g s PRO 112 Cb -0.32 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.38 1q3g s PRO 112 CO 0.34 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 177.23 1q3g n GLY 113 N 0.58 0.11 3.80 0.56 0.00 -1.26 -4.99 105.19 104.00 1q3g n GLY 113 Ca 0.03 -1.68 -0.31 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.76 1.74 0.38 -0.02 0.00 -1.26 -4.89 107.32 102.51 1q3g s GLY 114 Ca 0.00 0.20 0.08 0.00 0.00 0.00 0.00 44.72 45.00 1q3g s GLY 114 CO 0.00 0.52 0.05 0.00 0.00 0.00 0.00 173.10 173.68 1q3g h ALA 116 N 1.70 0.35 -0.00 0.00 0.00 -1.95 -3.07 119.26 116.28 1q3g h ALA 116 Ca -0.43 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1q3g h ALA 116 Cb 1.25 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1q3g h ALA 116 CO 0.72 -0.08 -0.01 0.44 0.00 0.00 0.00 179.25 180.31 1q3g n ILE 117 N -4.80 0.00 0.00 0.00 -5.35 -1.26 -4.82 119.36 103.13 1q3g n ILE 117 Ca -0.02 -0.07 0.00 0.00 -0.27 0.00 0.00 62.75 62.38 1q3g n ILE 117 Cb 0.11 -0.19 0.00 0.00 -1.74 0.00 0.00 39.64 37.82 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 1.09 2.26 0.28 3.28 0.00 -1.16 -1.84 105.19 109.10 1q3g n GLY 118 Ca 0.21 -0.84 -0.05 0.00 0.00 0.00 0.00 46.02 45.34 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 0.90 -5.70 4.61 0.00 -1.93 -1.68 119.26 115.46 1q3g h ALA 119 Ca 0.00 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.59 1q3g h ALA 119 Cb 0.00 -0.28 0.10 0.00 0.00 0.00 0.00 17.79 17.61 1q3g h ALA 119 CO 0.00 0.37 -0.65 0.54 0.00 0.00 0.00 179.25 179.50 1q3g n ARG 120 N -4.54 -1.69 -0.93 0.00 1.74 -1.26 -3.85 116.66 106.12 1q3g n ARG 120 Ca 0.06 0.94 -0.30 0.00 -0.77 0.00 0.00 57.85 57.78 1q3g n ARG 120 Cb 0.05 -5.18 0.16 0.00 -1.02 0.00 0.00 32.46 26.48 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 -4.41 0.93 -0.12 5.56 0.04 -1.26 -4.97 135.00 130.77 1q3g s PRO 121 Ca 0.30 1.11 0.15 0.00 0.04 0.00 0.00 61.00 62.61 1q3g s PRO 121 Cb -0.07 -1.75 0.27 0.00 0.04 0.00 0.00 34.50 33.00 1q3g s PRO 121 CO 0.78 -2.55 1.14 1.55 0.04 0.00 0.00 177.00 177.97 1q3g n VAL 122 N -4.13 1.62 -0.30 -0.36 3.14 -1.26 -4.83 118.33 112.21 1q3g n VAL 122 Ca 0.08 -2.07 0.08 0.00 -2.96 0.00 0.00 64.34 59.47 1q3g n VAL 122 Cb 0.54 -0.10 0.24 0.00 -1.06 0.00 0.00 33.84 33.45 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 0.17 0.56 0.28 6.55 2.03 -2.00 -1.36 116.42 122.65 1q3g h ASP 123 Ca -0.01 0.09 -0.05 0.00 -0.73 0.00 0.00 57.03 56.33 1q3g h ASP 123 Cb 1.08 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.57 1q3g h ASP 123 CO 0.00 0.23 -0.25 -0.07 -1.03 0.00 0.00 179.24 178.12 1q3g h LEU 124 N 0.64 0.00 0.19 0.15 3.38 -1.98 0.13 115.31 117.81 1q3g h LEU 124 Ca 0.48 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.44 1q3g h LEU 124 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1q3g h LEU 124 CO -0.37 0.25 -0.09 0.45 0.09 0.00 0.00 178.44 178.78 1q3g h HIS 125 N 0.00 -0.23 -0.26 1.13 3.86 -1.58 -0.79 115.15 117.27 1q3g h HIS 125 Ca -0.00 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1q3g h HIS 125 Cb 0.46 0.08 -0.01 0.00 1.06 0.00 0.00 27.41 29.00 1q3g h HIS 125 CO 0.00 0.01 0.13 0.82 0.86 0.00 0.00 177.93 179.75 1q3g h ILE 126 N -0.45 1.14 -0.65 2.45 2.04 -1.31 -1.82 117.51 118.91 1q3g h ILE 126 Ca -0.03 -0.40 0.10 0.00 1.00 0.00 0.00 64.86 65.53 1q3g h ILE 126 Cb 0.35 0.92 -0.07 0.00 -0.74 0.00 0.00 36.82 37.28 1q3g h ILE 126 CO 0.04 0.14 0.27 0.15 0.00 0.00 0.00 178.15 178.75 1q3g h PHE 127 N 0.30 0.47 -0.17 1.37 3.57 -0.72 0.44 116.94 122.20 1q3g h PHE 127 Ca 0.09 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 1q3g h PHE 127 Cb 0.11 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 1q3g h PHE 127 CO -0.02 0.14 0.09 0.78 -2.23 0.00 0.00 178.31 177.06 1q3g h GLY 128 N 0.47 0.26 1.03 2.40 0.00 -0.79 -1.07 103.07 105.36 1q3g h GLY 128 Ca 0.32 -0.13 -0.04 0.00 0.00 0.00 0.00 47.33 47.49 1q3g h GLY 128 CO -0.30 0.12 0.33 1.41 0.00 0.00 0.00 176.54 178.10 1q3g h LEU 129 N 0.16 1.03 -0.99 3.11 3.38 -0.79 -2.21 115.31 119.00 1q3g h LEU 129 Ca 0.06 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1q3g h LEU 129 Cb 0.10 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1q3g h LEU 129 CO -0.01 0.90 0.52 -0.33 0.09 0.00 0.00 178.44 179.61 1q3g h GLU 130 N 1.09 1.22 0.00 1.13 5.08 -0.71 -0.31 114.58 122.08 1q3g h GLU 130 Ca 0.26 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 1q3g h GLU 130 Cb 0.17 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 1q3g h GLU 130 CO -0.03 0.87 -0.09 0.87 -1.00 0.00 0.00 179.01 179.64 1q3g h LYS 131 N 1.24 0.00 -0.03 2.33 1.79 -0.62 -0.78 116.57 120.50 1q3g h LYS 131 Ca 0.32 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.79 1q3g h LYS 131 Cb -0.02 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.63 1q3g h LYS 131 CO -0.06 0.09 0.00 1.28 -1.08 0.00 0.00 179.45 179.68 1q3g n LEU 132 N -3.45 1.25 0.00 2.94 4.77 -0.22 -4.70 117.00 117.60 1q3g n LEU 132 Ca -0.01 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 1q3g n LEU 132 Cb 0.24 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1q3g n LEU 132 CO 0.28 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 1q3g n GLY 133 N 1.13 0.70 3.78 -0.72 0.00 -0.30 -0.53 105.19 109.26 1q3g n GLY 133 Ca 0.19 0.00 -0.36 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 2.86 -0.23 4.61 0.00 -0.65 -4.82 121.76 121.53 1q3g s ALA 134 Ca 0.00 0.79 -0.06 0.00 0.00 0.00 0.00 51.96 52.69 1q3g s ALA 134 Cb 0.00 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.76 1q3g s ALA 134 CO 0.00 -0.57 0.03 -2.00 0.00 0.00 0.00 175.76 173.23 1q3g s GLU 135 N -3.01 3.62 -0.06 0.00 2.12 0.59 -4.14 118.70 117.82 1q3g s GLU 135 Ca 0.67 -0.51 0.05 0.00 0.36 0.00 0.00 54.97 55.55 1q3g s GLU 135 Cb -0.23 -3.20 -0.01 0.00 0.26 0.00 0.00 34.13 30.95 1q3g s GLU 135 CO 0.27 -0.11 -0.22 0.42 -0.54 0.00 0.00 175.26 175.08 1q3g s ILE 136 N 1.35 2.31 0.07 -3.70 1.01 -1.26 -1.52 121.20 119.45 1q3g s ILE 136 Ca 0.05 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 59.73 1q3g s ILE 136 Cb -0.15 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.43 1q3g s ILE 136 CO 0.02 0.57 -0.07 -1.59 0.00 0.00 0.00 174.94 173.87 1q3g s LYS 137 N -0.26 0.67 -0.32 2.79 -2.85 -0.51 -4.98 119.74 114.28 1q3g s LYS 137 Ca -0.00 -1.05 0.01 0.00 -1.00 0.00 0.00 55.97 53.92 1q3g s LYS 137 Cb -0.13 -0.20 0.08 0.00 -2.06 0.00 0.00 37.83 35.51 1q3g s LYS 137 CO 0.03 0.00 0.02 -1.17 0.10 0.00 0.00 175.35 174.33 1q3g s LEU 138 N -2.35 4.21 -0.05 2.77 1.98 -1.26 -0.72 118.68 123.27 1q3g s LEU 138 Ca 0.01 -1.66 0.02 0.00 -2.89 0.00 0.00 54.13 49.62 1q3g s LEU 138 Cb -0.02 -1.67 0.01 0.00 0.66 0.00 0.00 46.19 45.18 1q3g s LEU 138 CO -0.03 -0.32 -0.10 -1.83 -1.89 0.00 0.00 176.35 172.19 1q3g s GLU 139 N 1.10 1.25 -1.44 1.98 -1.05 -0.51 -4.78 118.70 115.25 1q3g s GLU 139 Ca -0.00 -0.31 -0.08 0.00 -0.15 0.00 0.00 54.97 54.43 1q3g s GLU 139 Cb -0.20 -1.11 0.04 0.00 -0.44 0.00 0.00 34.13 32.42 1q3g s GLU 139 CO -0.04 0.04 0.65 -0.85 0.95 0.00 0.00 175.26 176.01 1q3g n GLU 140 N 3.66 -4.66 -0.92 -4.83 0.28 -1.26 -1.74 120.64 111.16 1q3g n GLU 140 Ca -0.22 0.71 0.00 0.00 -0.16 0.00 0.00 57.16 57.49 1q3g n GLU 140 Cb 0.52 -5.53 0.00 0.00 1.43 0.00 0.00 31.44 27.86 1q3g n GLU 140 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1q3g n GLY 141 N -1.45 0.78 3.45 -1.84 0.00 -1.26 -5.03 105.19 99.84 1q3g n GLY 141 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 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 -3.06 2.88 -0.38 1.61 1.51 -0.71 0.15 117.35 119.36 1q3g s TYR 142 Ca 0.00 -0.38 -0.22 0.00 -1.01 0.00 0.00 57.07 55.46 1q3g s TYR 142 Cb 0.00 -1.83 0.01 0.00 -0.11 0.00 0.00 41.96 40.03 1q3g s TYR 142 CO 0.00 -0.03 0.73 0.54 -1.11 0.00 0.00 175.55 175.68 1q3g s VAL 143 N 0.04 4.77 -0.23 0.71 0.11 0.02 -1.42 120.40 124.40 1q3g s VAL 143 Ca -0.03 0.69 -0.07 0.00 -2.93 0.00 0.00 61.98 59.64 1q3g s VAL 143 Cb -0.14 -4.18 -0.03 0.00 -1.53 0.00 0.00 36.38 30.49 1q3g s VAL 143 CO 0.04 -0.44 0.06 -0.54 -3.33 0.00 0.00 175.10 170.89 1q3g s LYS 144 N 2.99 3.74 0.10 1.54 1.02 0.11 -2.00 119.74 127.23 1q3g s LYS 144 Ca 0.29 -0.45 0.10 0.00 0.02 0.00 0.00 55.97 55.92 1q3g s LYS 144 Cb -0.13 -3.27 -0.04 0.00 -0.52 0.00 0.00 37.83 33.86 1q3g s LYS 144 CO 0.17 -0.05 -0.23 0.00 -0.92 0.00 0.00 175.35 174.32 1q3g s ALA 145 N 1.24 2.46 0.15 5.17 0.00 0.18 -1.42 121.76 129.53 1q3g s ALA 145 Ca 0.05 -1.36 -0.17 0.00 0.00 0.00 0.00 51.96 50.48 1q3g s ALA 145 Cb -0.14 -0.52 0.04 0.00 0.00 0.00 0.00 23.12 22.49 1q3g s ALA 145 CO 0.03 0.56 0.45 -1.54 0.00 0.00 0.00 175.76 175.26 1q3g s SER 146 N -1.81 -0.27 -0.24 0.00 1.04 -0.58 -1.77 113.70 110.07 1q3g s SER 146 Ca 0.15 -0.33 -0.17 0.00 0.48 0.00 0.00 55.95 56.07 1q3g s SER 146 Cb -0.10 0.51 0.07 0.00 0.10 0.00 0.00 66.02 66.60 1q3g s SER 146 CO 0.06 -0.91 0.61 0.54 0.98 0.00 0.00 173.24 174.52 1q3g s VAL 147 N -3.82 -0.00 -0.48 5.02 0.11 -0.44 -0.30 120.40 120.48 1q3g s VAL 147 Ca 0.05 0.02 -0.28 0.00 -2.93 0.00 0.00 61.98 58.83 1q3g s VAL 147 Cb 0.01 -0.87 0.03 0.00 -1.53 0.00 0.00 36.38 34.02 1q3g s VAL 147 CO -0.10 0.01 1.08 0.20 -3.33 0.00 0.00 175.10 172.95 1q3g s ASN 148 N 1.01 6.58 0.00 3.54 0.01 -1.26 -4.70 114.94 120.11 1q3g s ASN 148 Ca -0.05 0.33 0.00 0.00 -0.71 0.00 0.00 52.86 52.42 1q3g s ASN 148 Cb -0.05 -2.52 0.00 0.00 0.41 0.00 0.00 41.25 39.09 1q3g s ASN 148 CO -0.09 -1.21 0.00 0.61 -1.51 0.00 0.00 177.10 174.90 1q3g n GLY 149 N 4.90 -0.48 3.92 0.66 0.00 -1.26 -4.89 105.19 108.04 1q3g n GLY 149 Ca 0.10 -1.21 -0.26 0.00 0.00 0.00 0.00 46.02 44.65 1q3g n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1q3g s ARG 150 N 0.00 3.07 0.58 1.61 0.52 -1.26 -4.76 118.95 118.71 1q3g s ARG 150 Ca 0.00 -0.02 -0.13 0.00 -0.52 0.00 0.00 55.73 55.06 1q3g s ARG 150 Cb 0.00 -2.33 -0.05 0.00 0.52 0.00 0.00 34.95 33.09 1q3g s ARG 150 CO 0.00 -0.55 1.02 -0.51 0.02 0.00 0.00 175.30 175.28 1q3g s LEU 151 N -4.89 3.39 -0.09 2.53 1.43 -1.26 -4.84 118.68 114.95 1q3g s LEU 151 Ca 0.52 1.50 0.00 0.00 -1.03 0.00 0.00 54.13 55.13 1q3g s LEU 151 Cb -0.10 -4.49 -0.03 0.00 0.03 0.00 0.00 46.19 41.60 1q3g s LEU 151 CO 0.44 -0.81 -0.08 -0.75 0.23 0.00 0.00 176.35 175.38 1q3g s LYS 152 N -4.70 2.93 0.61 1.70 2.20 0.31 0.88 119.74 123.66 1q3g s LYS 152 Ca 0.57 -0.59 -0.19 0.00 -0.36 0.00 0.00 55.97 55.40 1q3g s LYS 152 Cb -0.11 -2.61 -0.03 0.00 -1.51 0.00 0.00 37.83 33.57 1q3g s LYS 152 CO 0.45 0.54 1.19 0.41 -0.36 0.00 0.00 175.35 177.58 1q3g n GLY 153 N 2.60 0.30 3.38 5.54 0.00 0.08 -4.49 105.19 112.59 1q3g n GLY 153 Ca -0.18 -0.10 -0.10 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.40 -0.62 -0.44 4.61 0.00 -1.09 -4.76 121.76 118.06 1q3g s ALA 154 Ca 0.78 -0.39 -0.16 0.00 0.00 0.00 0.00 51.96 52.18 1q3g s ALA 154 Cb -0.40 0.77 0.04 0.00 0.00 0.00 0.00 23.12 23.53 1q3g s ALA 154 CO 0.45 -0.69 0.41 -1.58 0.00 0.00 0.00 175.76 174.35 1q3g s HIS 155 N -3.88 3.19 -0.20 0.00 2.46 -1.26 -1.29 115.29 114.32 1q3g s HIS 155 Ca 0.09 -0.59 -0.04 0.00 0.47 0.00 0.00 55.06 55.00 1q3g s HIS 155 Cb 0.02 -2.95 -0.01 0.00 -0.13 0.00 0.00 32.58 29.50 1q3g s HIS 155 CO -0.05 -0.73 -0.05 0.42 -2.47 0.00 0.00 174.74 171.86 1q3g s ILE 156 N 1.95 3.50 -0.25 0.89 1.01 0.52 -4.96 121.20 123.86 1q3g s ILE 156 Ca 0.09 -0.46 -0.08 0.00 0.00 0.00 0.00 60.65 60.19 1q3g s ILE 156 Cb -0.20 -2.57 -0.03 0.00 0.01 0.00 0.00 42.46 39.67 1q3g s ILE 156 CO 0.11 0.45 0.09 -0.69 0.00 0.00 0.00 174.94 174.89 1q3g s VAL 157 N 1.09 4.51 -0.27 2.92 1.01 -1.26 0.10 120.40 128.50 1q3g s VAL 157 Ca 0.01 -0.11 -0.26 0.00 0.00 0.00 0.00 61.98 61.62 1q3g s VAL 157 Cb -0.15 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.13 1q3g s VAL 157 CO -0.00 0.33 0.93 -0.04 0.00 0.00 0.00 175.10 176.32 1q3g s MET 158 N 1.56 4.14 -0.14 2.72 1.00 -0.47 -4.94 119.30 123.18 1q3g s MET 158 Ca 0.06 1.02 0.03 0.00 0.00 0.00 0.00 55.69 56.80 1q3g s MET 158 Cb -0.15 -3.68 0.28 0.00 0.00 0.00 0.00 34.83 31.29 1q3g s MET 158 CO 0.05 -0.65 1.18 -0.40 0.00 0.00 0.00 175.02 175.20 1q3g n ASP 159 N 6.29 3.08 -3.65 3.03 5.75 -1.26 -4.68 116.55 125.11 1q3g n ASP 159 Ca 0.08 -2.50 -0.01 0.00 -0.01 0.00 0.00 54.79 52.35 1q3g n ASP 159 Cb 0.47 -0.60 -0.06 0.00 -1.03 0.00 0.00 41.12 39.89 1q3g n ASP 159 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1q3g s LYS 160 N -1.45 0.25 -0.24 0.11 2.20 -1.26 -5.12 119.74 114.24 1q3g s LYS 160 Ca 0.21 0.40 -0.29 0.00 -0.36 0.00 0.00 55.97 55.94 1q3g s LYS 160 Cb 0.17 0.06 -0.01 0.00 -1.51 0.00 0.00 37.83 36.55 1q3g s LYS 160 CO 0.05 -0.05 1.31 0.08 -0.36 0.00 0.00 175.35 176.39 1q3g s VAL 161 N 1.05 4.16 -0.09 4.02 1.01 -1.26 -4.99 120.40 124.30 1q3g s VAL 161 Ca -0.07 1.35 0.00 0.00 0.00 0.00 0.00 61.98 63.26 1q3g s VAL 161 Cb -0.03 -4.05 0.02 0.00 0.00 0.00 0.00 36.38 32.32 1q3g s VAL 161 CO -0.12 -0.32 -0.07 -0.55 0.00 0.00 0.00 175.10 174.04 1q3g s SER 162 N 2.58 1.86 0.03 3.32 0.15 -1.26 -5.00 113.70 115.38 1q3g s SER 162 Ca 0.57 -0.24 -0.25 0.00 0.70 0.00 0.00 55.95 56.73 1q3g s SER 162 Cb -0.19 -0.72 -0.18 0.00 -1.71 0.00 0.00 66.02 63.22 1q3g s SER 162 CO 0.20 -0.10 1.49 0.58 1.20 0.00 0.00 173.24 176.61 1q3g h VAL 163 N 6.16 1.17 0.21 4.45 2.07 -1.95 -1.95 116.25 126.41 1q3g h VAL 163 Ca -0.29 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 1q3g h VAL 163 Cb 1.14 1.57 -0.01 0.00 -1.52 0.00 0.00 31.29 32.47 1q3g h VAL 163 CO 0.40 0.15 -0.15 1.23 0.02 0.00 0.00 177.57 179.22 1q3g h GLY 164 N -0.28 -0.36 1.15 2.17 0.00 -2.00 -2.08 103.07 101.67 1q3g h GLY 164 Ca -0.00 0.17 0.01 0.00 0.00 0.00 0.00 47.33 47.51 1q3g h GLY 164 CO 0.00 -0.16 0.56 0.00 0.00 0.00 0.00 176.54 176.95 1q3g h ALA 165 N 0.41 1.41 -0.83 3.60 0.00 -1.92 -1.04 119.26 120.88 1q3g h ALA 165 Ca -0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1q3g h ALA 165 Cb 0.32 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1q3g h ALA 165 CO -0.01 0.54 0.41 1.15 0.00 0.00 0.00 179.25 181.35 1q3g h THR 166 N 1.13 1.25 -0.06 0.00 2.02 -1.11 -1.56 112.91 114.59 1q3g h THR 166 Ca 0.32 -0.70 -0.01 0.00 0.77 0.00 0.00 66.41 66.79 1q3g h THR 166 Cb -0.10 0.18 -0.00 0.00 -1.74 0.00 0.00 68.15 66.48 1q3g h THR 166 CO -0.07 0.30 0.01 0.58 0.37 0.00 0.00 175.52 176.71 1q3g h VAL 167 N 1.18 1.20 0.01 3.16 2.07 -0.64 -0.82 116.25 122.40 1q3g h VAL 167 Ca 0.29 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 67.24 1q3g h VAL 167 Cb 0.10 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.31 1q3g h VAL 167 CO -0.04 0.17 -0.20 0.74 0.02 0.00 0.00 177.57 178.26 1q3g h THR 168 N -0.12 0.52 -0.15 2.57 2.02 -0.99 -0.21 112.91 116.56 1q3g h THR 168 Ca 0.02 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.19 1q3g h THR 168 Cb 0.25 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 1q3g h THR 168 CO 0.00 0.00 0.04 0.40 0.37 0.00 0.00 175.52 176.33 1q3g h ILE 169 N -0.33 1.19 -0.99 3.11 2.04 -1.30 -1.67 117.51 119.55 1q3g h ILE 169 Ca 0.06 -0.58 0.01 0.00 1.00 0.00 0.00 64.86 65.34 1q3g h ILE 169 Cb 0.40 1.29 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 1q3g h ILE 169 CO -0.18 0.18 0.66 -0.03 0.00 0.00 0.00 178.15 178.77 1q3g h MET 170 N 0.06 1.30 -0.03 2.37 4.05 -1.04 -0.83 114.93 120.82 1q3g h MET 170 Ca 0.05 -0.08 -0.00 0.00 -0.28 0.00 0.00 59.70 59.39 1q3g h MET 170 Cb 0.23 -0.29 -0.00 0.00 -0.80 0.00 0.00 31.60 30.74 1q3g h MET 170 CO -0.00 0.86 0.00 0.77 0.23 0.00 0.00 176.91 178.77 1q3g h SER 171 N 1.34 0.05 -0.39 1.39 0.02 -0.92 -3.14 113.55 111.90 1q3g h SER 171 Ca 0.36 -0.30 -0.04 0.00 -0.84 0.00 0.00 61.79 60.97 1q3g h SER 171 Cb -0.16 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.35 1q3g h SER 171 CO -0.08 0.33 0.11 0.00 -1.14 0.00 0.00 176.83 176.05 1q3g h ALA 172 N 0.72 1.32 0.00 3.77 0.00 -1.13 -2.86 119.26 121.09 1q3g h ALA 172 Ca 0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1q3g h ALA 172 Cb 0.31 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1q3g h ALA 172 CO 0.00 0.48 -0.11 0.00 0.00 0.00 0.00 179.25 179.62 1q3g h ALA 173 N 1.44 1.36 -0.18 0.00 0.00 -1.11 -2.99 119.26 117.79 1q3g h ALA 173 Ca 0.15 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.01 1q3g h ALA 173 Cb 0.26 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1q3g h ALA 173 CO -0.00 0.14 0.13 1.79 0.00 0.00 0.00 179.25 181.31 1q3g h THR 174 N 0.00 0.92 -0.49 0.00 1.35 -1.47 -0.84 112.91 112.38 1q3g h THR 174 Ca -0.00 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.85 1q3g h THR 174 Cb 0.29 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 67.61 1q3g h THR 174 CO 0.01 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.47 1q3g n LEU 175 N -4.49 4.09 -4.90 3.87 4.77 -1.13 -0.67 117.00 118.54 1q3g n LEU 175 Ca 0.01 -2.44 -0.29 0.00 -0.03 0.00 0.00 56.01 53.27 1q3g n LEU 175 Cb 0.25 -0.48 0.04 0.00 -2.33 0.00 0.00 43.42 40.90 1q3g n LEU 175 CO 0.35 0.77 0.65 0.00 -1.33 0.00 0.00 177.39 177.83 1q3g s ALA 176 N -1.81 3.09 -0.44 -1.18 0.00 -0.32 -4.53 121.76 116.56 1q3g s ALA 176 Ca 0.42 -0.46 -0.19 0.00 0.00 0.00 0.00 51.96 51.72 1q3g s ALA 176 Cb 0.28 -2.85 0.03 0.00 0.00 0.00 0.00 23.12 20.57 1q3g s ALA 176 CO 0.19 -0.94 0.58 -2.00 0.00 0.00 0.00 175.76 173.59 1q3g s GLU 177 N -5.18 3.20 0.00 0.00 2.12 0.25 -3.80 118.70 115.30 1q3g s GLU 177 Ca 0.56 -0.55 0.00 0.00 0.36 0.00 0.00 54.97 55.34 1q3g s GLU 177 Cb -0.11 -3.97 0.00 0.00 0.26 0.00 0.00 34.13 30.31 1q3g s GLU 177 CO 0.49 -0.99 0.00 0.41 -0.54 0.00 0.00 175.26 174.63 1q3g n GLY 178 N 5.08 -0.93 3.61 -1.50 0.00 -1.26 -0.74 105.19 109.44 1q3g n GLY 178 Ca -0.04 -2.14 -0.34 0.00 0.00 0.00 0.00 46.02 43.50 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 4.07 -0.01 2.61 2.01 -1.26 -0.96 115.64 122.11 1q3g s THR 179 Ca 0.00 -0.32 0.06 0.00 0.31 0.00 0.00 61.69 61.74 1q3g s THR 179 Cb 0.00 -2.73 -0.03 0.00 0.01 0.00 0.00 72.50 69.76 1q3g s THR 179 CO 0.00 0.57 -0.18 -0.89 -0.69 0.00 0.00 174.62 173.42 1q3g s THR 180 N -0.48 2.72 -0.09 -0.82 2.01 0.13 -2.67 115.64 116.44 1q3g s THR 180 Ca 0.08 -1.00 -0.00 0.00 0.31 0.00 0.00 61.69 61.08 1q3g s THR 180 Cb -0.12 -2.07 0.02 0.00 0.01 0.00 0.00 72.50 70.34 1q3g s THR 180 CO 0.02 0.49 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.74 1q3g s ILE 181 N -0.78 0.89 -0.36 1.82 1.01 -0.41 -0.30 121.20 123.06 1q3g s ILE 181 Ca 0.12 -0.23 -0.11 0.00 0.00 0.00 0.00 60.65 60.43 1q3g s ILE 181 Cb -0.10 -0.92 0.01 0.00 0.01 0.00 0.00 42.46 41.46 1q3g s ILE 181 CO 0.02 0.34 0.21 -0.63 0.00 0.00 0.00 174.94 174.88 1q3g s ILE 182 N 1.54 4.78 0.08 2.92 1.01 0.73 -0.35 121.20 131.91 1q3g s ILE 182 Ca 0.01 -0.63 -0.20 0.00 0.00 0.00 0.00 60.65 59.83 1q3g s ILE 182 Cb -0.13 -3.58 -0.07 0.00 0.01 0.00 0.00 42.46 38.69 1q3g s ILE 182 CO -0.05 -0.14 0.58 -1.61 0.00 0.00 0.00 174.94 173.72 1q3g s GLU 183 N 1.61 4.22 -1.27 2.79 0.41 0.12 -1.64 118.70 124.93 1q3g s GLU 183 Ca 0.04 0.76 -0.06 0.00 -0.41 0.00 0.00 54.97 55.30 1q3g s GLU 183 Cb -0.18 -3.22 0.01 0.00 -1.78 0.00 0.00 34.13 28.95 1q3g s GLU 183 CO 0.08 0.63 1.10 -1.71 -0.49 0.00 0.00 175.26 174.86 1q3g n ASN 184 N 1.66 -4.76 -4.82 -0.19 5.15 0.93 -1.37 115.26 111.86 1q3g n ASN 184 Ca -0.10 -0.56 -0.32 0.00 -0.60 0.00 0.00 54.58 53.01 1q3g n ASN 184 Cb 0.51 -4.97 0.01 0.00 -0.53 0.00 0.00 39.78 34.80 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 -3.33 2.83 0.33 5.20 0.00 0.13 -4.62 121.76 122.30 1q3g s ALA 185 Ca 0.37 0.21 -0.27 0.00 0.00 0.00 0.00 51.96 52.26 1q3g s ALA 185 Cb -0.16 -3.18 -0.09 0.00 0.00 0.00 0.00 23.12 19.69 1q3g s ALA 185 CO 0.71 -0.81 1.11 0.00 0.00 0.00 0.00 175.76 176.77 1q3g s ALA 186 N -2.74 3.28 -2.74 0.00 0.00 -1.26 -4.47 121.76 113.83 1q3g s ALA 186 Ca 0.60 0.87 0.24 0.00 0.00 0.00 0.00 51.96 53.67 1q3g s ALA 186 Cb -0.14 -3.33 0.17 0.00 0.00 0.00 0.00 23.12 19.83 1q3g s ALA 186 CO 0.43 -0.26 1.23 0.54 0.00 0.00 0.00 175.76 177.71 1q3g n ARG 187 N 0.65 2.02 -1.36 0.00 3.00 -1.26 -4.62 116.66 115.08 1q3g n ARG 187 Ca 0.01 -1.66 -0.48 0.00 -0.01 0.00 0.00 57.85 55.71 1q3g n ARG 187 Cb 0.46 -1.47 -0.04 0.00 0.00 0.00 0.00 32.46 31.42 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 0.96 0.00 -0.23 5.56 4.71 -1.26 -4.55 120.64 125.83 1q3g n GLU 188 Ca 0.13 0.00 0.25 0.00 -0.01 0.00 0.00 57.16 57.52 1q3g n GLU 188 Cb 0.56 -1.05 0.62 0.00 -1.01 0.00 0.00 31.44 30.56 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 1.30 0.20 -0.31 3.49 0.11 -1.96 0.24 132.00 135.07 1q3g h PRO 189 Ca -0.31 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.73 1q3g h PRO 189 Cb 1.38 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.43 1q3g h PRO 189 CO 0.56 0.13 -0.07 0.93 -0.21 0.00 0.00 178.00 179.34 1q3g h GLU 190 N 0.20 0.50 -0.33 1.05 3.07 -1.87 -0.55 114.58 116.65 1q3g h GLU 190 Ca 0.47 -0.13 -0.02 0.00 -0.50 0.00 0.00 59.36 59.18 1q3g h GLU 190 Cb 1.51 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 29.34 1q3g h GLU 190 CO -0.11 0.58 0.12 0.82 -1.40 0.00 0.00 179.01 179.02 1q3g h ILE 191 N 0.47 1.20 -0.47 3.13 1.08 -0.82 0.18 117.51 122.28 1q3g h ILE 191 Ca 0.09 -0.62 0.01 0.00 -0.39 0.00 0.00 64.86 63.96 1q3g h ILE 191 Cb 0.42 0.98 -0.03 0.00 -3.07 0.00 0.00 36.82 35.12 1q3g h ILE 191 CO 0.02 0.21 0.29 0.58 -0.69 0.00 0.00 178.15 178.57 1q3g h VAL 192 N 0.38 1.08 -0.48 1.67 2.07 -1.23 0.46 116.25 120.21 1q3g h VAL 192 Ca 0.11 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 1q3g h VAL 192 Cb 0.22 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 1q3g h VAL 192 CO -0.01 0.11 0.19 -0.78 0.02 0.00 0.00 177.57 177.11 1q3g h ASP 193 N 0.60 0.66 -0.65 0.57 3.58 -0.75 -0.53 116.42 119.89 1q3g h ASP 193 Ca 0.18 -0.17 -0.07 0.00 0.42 0.00 0.00 57.03 57.40 1q3g h ASP 193 Cb -0.03 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 40.83 1q3g h ASP 193 CO -0.06 0.64 0.16 0.74 -2.88 0.00 0.00 179.24 177.84 1q3g h THR 194 N 0.63 1.26 0.01 2.25 2.02 -0.30 -1.66 112.91 117.11 1q3g h THR 194 Ca 0.16 -0.95 -0.00 0.00 0.77 0.00 0.00 66.41 66.39 1q3g h THR 194 Cb 0.19 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1q3g h THR 194 CO -0.01 0.36 -0.00 0.00 0.37 0.00 0.00 175.52 176.23 1q3g h ALA 195 N 1.15 -0.01 -0.03 6.16 0.00 -0.52 -1.69 119.26 124.32 1q3g h ALA 195 Ca 0.21 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1q3g h ALA 195 Cb 0.36 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1q3g h ALA 195 CO 0.00 -0.47 -0.07 -0.91 0.00 0.00 0.00 179.25 177.80 1q3g h ASN 196 N -0.08 0.04 -0.10 0.00 2.35 -0.90 -0.41 115.58 116.48 1q3g h ASN 196 Ca -0.00 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1q3g h ASN 196 Cb 0.07 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 1q3g h ASN 196 CO 0.00 0.12 -0.01 0.15 -1.65 0.00 0.00 177.43 176.04 1q3g h PHE 197 N 0.05 0.21 -0.68 1.19 3.57 -0.91 -1.28 116.94 119.08 1q3g h PHE 197 Ca 0.01 -0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.50 1q3g h PHE 197 Cb 0.16 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 1q3g h PHE 197 CO 0.00 0.47 0.42 -0.07 -2.23 0.00 0.00 178.31 176.91 1q3g h LEU 198 N -0.12 0.70 -1.39 0.59 3.38 -0.57 -0.85 115.31 117.06 1q3g h LEU 198 Ca 0.03 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1q3g h LEU 198 Cb 0.40 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1q3g h LEU 198 CO 0.01 0.49 0.34 0.58 0.09 0.00 0.00 178.44 179.94 1q3g h VAL 199 N 0.83 1.16 -0.01 1.22 2.07 -0.97 -0.09 116.25 120.47 1q3g h VAL 199 Ca 0.27 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 1q3g h VAL 199 Cb 0.01 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 1q3g h VAL 199 CO -0.10 0.16 -0.25 0.00 0.02 0.00 0.00 177.57 177.40 1q3g h ALA 200 N 1.61 1.57 -0.00 1.67 0.00 0.05 -0.62 119.26 123.53 1q3g h ALA 200 Ca 0.20 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1q3g h ALA 200 Cb -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1q3g h ALA 200 CO -0.04 0.32 -0.03 1.28 0.00 0.00 0.00 179.25 180.78 1q3g n LEU 201 N -4.24 0.30 0.00 0.00 4.77 -0.16 -4.82 117.00 112.85 1q3g n LEU 201 Ca -0.02 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 1q3g n LEU 201 Cb 0.31 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1q3g n LEU 201 CO 0.37 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1q3g n GLY 202 N 1.16 0.90 3.72 -0.72 0.00 -0.24 -0.49 105.19 109.52 1q3g n GLY 202 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 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 1.83 -0.34 4.61 0.00 -0.51 -4.95 121.76 120.41 1q3g s ALA 203 Ca 0.00 0.38 0.01 0.00 0.00 0.00 0.00 51.96 52.35 1q3g s ALA 203 Cb 0.00 -3.35 0.09 0.00 0.00 0.00 0.00 23.12 19.86 1q3g s ALA 203 CO 0.00 -2.27 0.06 0.15 0.00 0.00 0.00 175.76 173.70 1q3g s LYS 204 N -4.79 1.94 0.02 0.00 1.02 -1.26 -4.30 119.74 112.37 1q3g s LYS 204 Ca 0.64 -1.65 0.02 0.00 0.02 0.00 0.00 55.97 55.00 1q3g s LYS 204 Cb -0.20 -3.25 -0.01 0.00 -0.52 0.00 0.00 37.83 33.85 1q3g s LYS 204 CO 0.57 -0.85 -0.07 0.42 -0.92 0.00 0.00 175.35 174.50 1q3g s ILE 205 N 1.07 0.50 0.03 2.17 1.01 -1.26 -1.40 121.20 123.33 1q3g s ILE 205 Ca 0.04 -0.64 -0.12 0.00 0.00 0.00 0.00 60.65 59.92 1q3g s ILE 205 Cb -0.20 -0.50 0.02 0.00 0.01 0.00 0.00 42.46 41.79 1q3g s ILE 205 CO -0.05 -0.11 0.27 -0.94 0.00 0.00 0.00 174.94 174.11 1q3g s SER 206 N -0.81 -0.08 0.00 3.58 1.04 -0.61 -4.90 113.70 111.92 1q3g s SER 206 Ca -0.03 -0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.19 1q3g s SER 206 Cb -0.06 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.39 1q3g s SER 206 CO 0.00 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.26 1q3g n GLY 207 N 0.72 1.18 3.63 7.32 0.00 -1.26 -0.59 105.19 116.19 1q3g n GLY 207 Ca -0.19 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.36 1q3g n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3g n GLN 208 N -2.00 1.69 0.00 1.61 0.00 -1.26 -0.23 117.38 117.19 1q3g n GLN 208 Ca 0.00 0.61 0.00 0.00 0.00 0.00 0.00 57.00 57.61 1q3g n GLN 208 Cb 0.00 -2.24 0.00 0.00 0.00 0.00 0.00 30.24 28.00 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 2.44 1.00 3.83 2.61 0.00 -1.26 -4.90 105.19 108.91 1q3g n GLY 209 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.25 1.63 -1.63 2.61 -4.23 0.67 -4.76 115.64 107.68 1q3g s THR 210 Ca 0.00 -1.68 0.31 0.00 -1.18 0.00 0.00 61.69 59.14 1q3g s THR 210 Cb 0.00 -2.31 0.66 0.00 1.34 0.00 0.00 72.50 72.19 1q3g s THR 210 CO 0.00 0.00 2.12 -0.90 -0.54 0.00 0.00 174.62 175.30 1q3g n ASP 211 N -1.52 0.01 -3.88 3.99 5.68 -1.26 -4.58 116.55 114.98 1q3g n ASP 211 Ca -0.07 -0.45 -0.29 0.00 -0.50 0.00 0.00 54.79 53.48 1q3g n ASP 211 Cb 0.65 -0.18 -0.16 0.00 -1.14 0.00 0.00 41.12 40.29 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 -2.37 1.36 -0.17 0.11 3.52 -1.25 0.17 118.95 120.32 1q3g s ARG 212 Ca 0.35 -0.78 -0.05 0.00 -0.13 0.00 0.00 55.73 55.13 1q3g s ARG 212 Cb 0.21 -2.38 -0.03 0.00 -1.56 0.00 0.00 34.95 31.18 1q3g s ARG 212 CO 0.43 -0.58 0.00 0.42 -0.81 0.00 0.00 175.30 174.76 1q3g s ILE 213 N 1.55 4.24 -0.17 4.11 1.01 -0.65 -4.44 121.20 126.83 1q3g s ILE 213 Ca -0.04 -0.23 -0.02 0.00 0.00 0.00 0.00 60.65 60.36 1q3g s ILE 213 Cb -0.18 -2.88 -0.01 0.00 0.01 0.00 0.00 42.46 39.40 1q3g s ILE 213 CO -0.07 0.48 -0.10 -0.89 0.00 0.00 0.00 174.94 174.36 1q3g s THR 214 N 0.40 3.13 -0.09 2.92 2.01 0.24 -0.19 115.64 124.07 1q3g s THR 214 Ca -0.01 -0.60 0.04 0.00 0.31 0.00 0.00 61.69 61.42 1q3g s THR 214 Cb -0.14 -2.37 0.00 0.00 0.01 0.00 0.00 72.50 70.01 1q3g s THR 214 CO 0.02 0.48 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.59 1q3g s ILE 215 N 0.90 1.83 -0.33 1.82 1.09 0.59 -1.57 121.20 125.53 1q3g s ILE 215 Ca -0.02 -0.89 -0.05 0.00 -1.10 0.00 0.00 60.65 58.59 1q3g s ILE 215 Cb -0.15 -1.59 0.05 0.00 -1.06 0.00 0.00 42.46 39.71 1q3g s ILE 215 CO 0.00 0.51 0.08 -0.70 -0.10 0.00 0.00 174.94 174.73 1q3g s GLU 216 N 0.35 2.51 0.74 2.79 2.12 -0.49 0.17 118.70 126.89 1q3g s GLU 216 Ca -0.16 -1.27 -0.16 0.00 0.36 0.00 0.00 54.97 53.74 1q3g s GLU 216 Cb -0.17 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 30.82 1q3g s GLU 216 CO 0.07 -0.69 0.63 0.41 -0.54 0.00 0.00 175.26 175.14 1q3g n GLY 217 N 4.73 -1.30 3.28 -1.50 0.00 -0.13 -4.11 105.19 106.15 1q3g n GLY 217 Ca -0.12 -0.41 -0.15 0.00 0.00 0.00 0.00 46.02 45.34 1q3g n GLY 217 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1q3g s VAL 218 N -1.95 0.73 0.13 1.61 -7.23 0.16 -4.72 120.40 109.13 1q3g s VAL 218 Ca 0.67 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.69 1q3g s VAL 218 Cb -0.33 -2.28 -0.01 0.00 0.56 0.00 0.00 36.38 34.32 1q3g s VAL 218 CO 0.57 -0.34 1.62 -0.33 -0.31 0.00 0.00 175.10 176.31 1q3g h GLU 219 N 2.58 0.69 -3.33 4.82 5.08 -1.90 -3.40 114.58 119.12 1q3g h GLU 219 Ca -0.37 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 57.77 1q3g h GLU 219 Cb 1.22 -0.08 -0.11 0.00 0.50 0.00 0.00 28.75 30.28 1q3g h GLU 219 CO 0.63 0.72 0.00 -0.98 -1.00 0.00 0.00 179.01 178.38 1q3g s ARG 220 N -5.21 1.30 -0.00 2.33 1.70 -1.26 -4.99 118.95 112.81 1q3g s ARG 220 Ca -0.13 -0.83 0.05 0.00 -0.47 0.00 0.00 55.73 54.35 1q3g s ARG 220 Cb 0.10 0.51 -0.03 0.00 -0.57 0.00 0.00 34.95 34.96 1q3g s ARG 220 CO 0.78 -0.54 -0.14 -0.51 -1.08 0.00 0.00 175.30 173.81 1q3g s LEU 221 N -2.86 2.80 0.00 -1.89 1.43 -1.26 -4.87 118.68 112.03 1q3g s LEU 221 Ca 0.08 -0.27 0.00 0.00 -1.03 0.00 0.00 54.13 52.91 1q3g s LEU 221 Cb -0.00 -1.61 0.00 0.00 0.03 0.00 0.00 46.19 44.61 1q3g s LEU 221 CO -0.05 0.30 0.00 0.61 0.23 0.00 0.00 176.35 177.43 1q3g n GLY 222 N 1.83 0.65 0.00 -3.19 0.00 0.35 -1.72 105.19 103.12 1q3g n GLY 222 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 3.84 0.00 -0.02 0.00 -1.26 -2.45 105.19 110.30 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 -0.19 3.02 -0.02 0.00 -0.06 -4.52 105.19 103.42 1q3g n GLY 224 Ca 0.00 -1.50 -0.25 0.00 0.00 0.00 0.00 46.02 44.27 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 -2.72 1.16 -0.02 1.61 1.01 -1.26 -0.39 120.40 119.79 1q3g s VAL 225 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1q3g s VAL 225 Cb 0.00 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.33 1q3g s VAL 225 CO 0.00 0.36 -0.01 -0.47 0.00 0.00 0.00 175.10 174.99 1q3g s TYR 226 N 0.78 0.22 -0.27 5.22 5.04 -0.46 -4.99 117.35 122.89 1q3g s TYR 226 Ca -0.12 0.00 -0.10 0.00 -2.44 0.00 0.00 57.07 54.40 1q3g s TYR 226 Cb -0.15 -0.25 -0.05 0.00 0.35 0.00 0.00 41.96 41.85 1q3g s TYR 226 CO 0.02 -0.07 0.17 0.50 -1.34 0.00 0.00 175.55 174.84 1q3g s ARG 227 N 0.53 3.92 0.46 4.97 3.52 -1.26 0.08 118.95 131.16 1q3g s ARG 227 Ca -0.05 -0.34 -0.24 0.00 -0.13 0.00 0.00 55.73 54.97 1q3g s ARG 227 Cb -0.08 -3.59 -0.07 0.00 -1.56 0.00 0.00 34.95 29.65 1q3g s ARG 227 CO -0.01 -0.15 1.35 0.08 -0.81 0.00 0.00 175.30 175.76 1q3g s VAL 228 N 1.64 2.32 0.81 7.11 1.01 -0.40 -4.93 120.40 127.96 1q3g s VAL 228 Ca 0.07 0.27 -0.12 0.00 0.00 0.00 0.00 61.98 62.20 1q3g s VAL 228 Cb -0.16 -3.15 0.08 0.00 0.00 0.00 0.00 36.38 33.15 1q3g s VAL 228 CO 0.09 0.03 1.10 -1.48 0.00 0.00 0.00 175.10 174.84 1q3g s LEU 229 N -2.85 2.54 0.56 3.92 2.34 -1.26 -4.73 118.68 119.20 1q3g s LEU 229 Ca 0.62 1.31 -0.21 0.00 0.06 0.00 0.00 54.13 55.92 1q3g s LEU 229 Cb -0.40 -3.89 -0.04 0.00 -0.56 0.00 0.00 46.19 41.30 1q3g s LEU 229 CO 0.50 -2.06 1.31 -2.84 -1.06 0.00 0.00 176.35 172.20 1q3g s PRO 230 N -5.14 3.07 -0.65 1.48 0.02 -1.26 -0.41 135.00 132.10 1q3g s PRO 230 Ca 0.61 2.12 -0.27 0.00 0.02 0.00 0.00 61.00 63.48 1q3g s PRO 230 Cb -0.15 -2.16 0.02 0.00 0.02 0.00 0.00 34.50 32.23 1q3g s PRO 230 CO 0.54 -1.21 1.33 0.34 -0.33 0.00 0.00 177.00 177.67 1q3g s ASP 231 N -1.13 6.16 0.49 2.53 -1.08 -0.49 -4.29 116.67 118.86 1q3g s ASP 231 Ca 0.73 -0.10 0.19 0.00 -0.52 0.00 0.00 52.55 52.86 1q3g s ASP 231 Cb -0.38 -2.55 1.24 0.00 -1.46 0.00 0.00 42.92 39.77 1q3g s ASP 231 CO 0.44 -1.76 2.07 0.08 0.52 0.00 0.00 175.17 176.51 1q3g h ARG 232 N 10.47 0.00 -0.00 4.34 0.11 -1.91 -1.97 114.38 125.42 1q3g h ARG 232 Ca -0.27 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 59.59 1q3g h ARG 232 Cb 1.07 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.15 1q3g h ARG 232 CO 1.23 0.12 -0.92 0.82 0.10 0.00 0.00 179.97 181.32 1q3g h ILE 233 N 0.00 1.42 -0.33 0.08 1.08 -1.95 -0.40 117.51 117.41 1q3g h ILE 233 Ca -0.00 -2.47 -0.03 0.00 -0.39 0.00 0.00 64.86 61.96 1q3g h ILE 233 Cb 0.23 2.41 -0.01 0.00 -3.07 0.00 0.00 36.82 36.38 1q3g h ILE 233 CO 0.02 0.73 0.07 -0.08 -0.69 0.00 0.00 178.15 178.20 1q3g h GLU 234 N 0.21 0.54 -0.16 2.37 4.81 -1.82 0.07 114.58 120.59 1q3g h GLU 234 Ca -0.07 -0.13 0.03 0.00 -0.13 0.00 0.00 59.36 59.06 1q3g h GLU 234 Cb 1.55 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.83 1q3g h GLU 234 CO 0.16 0.60 -0.05 1.15 -0.73 0.00 0.00 179.01 180.14 1q3g h THR 235 N 0.38 0.81 -0.59 0.32 2.02 -1.28 -1.29 112.91 113.28 1q3g h THR 235 Ca 0.10 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.27 1q3g h THR 235 Cb 0.31 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 1q3g h THR 235 CO 0.00 0.00 0.30 1.23 0.37 0.00 0.00 175.52 177.42 1q3g h GLY 236 N -0.02 0.88 0.95 2.16 0.00 -0.87 -1.16 103.07 105.01 1q3g h GLY 236 Ca 0.08 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 1q3g h GLY 236 CO -0.17 0.38 0.18 -0.84 0.00 0.00 0.00 176.54 176.09 1q3g h THR 237 N 0.82 1.18 -0.04 4.70 2.02 -0.09 -0.97 112.91 120.54 1q3g h THR 237 Ca 0.21 -0.53 -0.14 0.00 0.77 0.00 0.00 66.41 66.72 1q3g h THR 237 Cb 0.06 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1q3g h THR 237 CO -0.03 0.20 -0.59 -0.26 0.37 0.00 0.00 175.52 175.20 1q3g h PHE 238 N 0.51 0.17 -0.56 3.16 -1.00 -0.91 -1.17 116.94 117.16 1q3g h PHE 238 Ca 0.14 -0.07 -0.09 0.00 2.81 0.00 0.00 57.97 60.76 1q3g h PHE 238 Cb 0.14 -0.03 -0.02 0.00 3.61 0.00 0.00 35.95 39.65 1q3g h PHE 238 CO -0.01 0.70 -0.03 -0.07 -1.61 0.00 0.00 178.31 177.29 1q3g h LEU 239 N 0.10 0.96 -0.90 1.54 3.38 -1.00 -2.00 115.31 117.40 1q3g h LEU 239 Ca -0.01 -0.28 -0.10 0.00 0.09 0.00 0.00 57.88 57.59 1q3g h LEU 239 Cb 1.07 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1q3g h LEU 239 CO 0.09 1.03 -0.27 0.58 0.09 0.00 0.00 178.44 179.96 1q3g h VAL 240 N 0.90 1.27 -0.62 1.22 2.07 -0.95 -1.39 116.25 118.75 1q3g h VAL 240 Ca 0.16 -1.31 0.08 0.00 0.82 0.00 0.00 66.70 66.44 1q3g h VAL 240 Cb 0.56 1.37 -0.06 0.00 -1.52 0.00 0.00 31.29 31.64 1q3g h VAL 240 CO 0.03 0.42 0.29 0.00 0.02 0.00 0.00 177.57 178.33 1q3g h ALA 241 N 1.28 0.82 -0.05 1.67 0.00 -0.49 -1.05 119.26 121.44 1q3g h ALA 241 Ca 0.06 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1q3g h ALA 241 Cb 0.70 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1q3g h ALA 241 CO 0.05 -0.09 -0.10 0.00 0.00 0.00 0.00 179.25 179.11 1q3g h ALA 242 N 1.38 0.08 -0.73 0.00 0.00 -1.17 -3.09 119.26 115.72 1q3g h ALA 242 Ca 0.30 -0.33 0.16 0.00 0.00 0.00 0.00 54.91 55.04 1q3g h ALA 242 Cb 0.29 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1q3g h ALA 242 CO -0.24 -0.06 0.50 0.00 0.00 0.00 0.00 179.25 179.45 1q3g h ALA 243 N 0.47 2.25 -0.00 0.00 0.00 -0.79 -1.44 119.26 119.75 1q3g h ALA 243 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1q3g h ALA 243 Cb 0.68 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1q3g h ALA 243 CO 0.02 -0.45 -0.54 0.44 0.00 0.00 0.00 179.25 178.72 1q3g n ILE 244 N -4.45 0.00 -0.66 0.00 -5.35 -0.44 -4.07 119.36 104.39 1q3g n ILE 244 Ca 0.14 -0.05 0.07 0.00 -0.27 0.00 0.00 62.75 62.64 1q3g n ILE 244 Cb 0.59 0.52 0.16 0.00 -1.74 0.00 0.00 39.64 39.17 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 -1.17 2.98 -0.04 7.28 3.41 -0.59 -4.94 113.62 120.55 1q3g n SER 245 Ca 0.07 -2.64 -0.00 0.00 -0.26 0.00 0.00 58.87 56.04 1q3g n SER 245 Cb 0.35 -0.36 -0.00 0.00 -0.26 0.00 0.00 64.21 63.94 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 -0.50 0.14 0.54 5.00 0.00 -0.93 -4.32 105.19 105.12 1q3g n GLY 246 Ca 0.14 -0.01 -0.04 0.00 0.00 0.00 0.00 46.02 46.12 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 0.21 -0.01 3.09 -0.02 0.00 -0.89 -1.73 105.19 105.83 1q3g n GLY 247 Ca -0.00 -1.85 -0.20 0.00 0.00 0.00 0.00 46.02 43.96 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 -3.01 0.91 0.04 1.61 2.20 -1.25 -1.35 119.74 118.88 1q3g s LYS 248 Ca 0.10 -0.52 -0.14 0.00 -0.36 0.00 0.00 55.97 55.05 1q3g s LYS 248 Cb -0.00 -0.88 0.02 0.00 -1.51 0.00 0.00 37.83 35.46 1q3g s LYS 248 CO 0.07 0.23 0.31 -1.50 -0.36 0.00 0.00 175.35 174.10 1q3g s ILE 249 N -0.48 0.08 -0.10 5.43 2.07 0.76 -1.43 121.20 127.53 1q3g s ILE 249 Ca 0.03 -0.66 0.01 0.00 -1.41 0.00 0.00 60.65 58.62 1q3g s ILE 249 Cb -0.06 -0.93 0.02 0.00 0.13 0.00 0.00 42.46 41.62 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 -2.52 1.15 -0.27 4.00 1.01 -0.58 -0.56 120.40 122.63 1q3g s VAL 250 Ca -0.05 -0.42 -0.12 0.00 0.00 0.00 0.00 61.98 61.39 1q3g s VAL 250 Cb -0.01 -1.10 -0.05 0.00 0.00 0.00 0.00 36.38 35.22 1q3g s VAL 250 CO -0.03 0.37 0.22 0.00 0.00 0.00 0.00 175.10 175.66 1q3g s ARG 252 N 1.61 3.51 -1.23 0.00 1.81 0.41 -2.09 118.95 122.97 1q3g s ARG 252 Ca 0.09 -0.38 -0.06 0.00 -1.72 0.00 0.00 55.73 53.66 1q3g s ARG 252 Cb -0.15 -2.79 0.01 0.00 -0.45 0.00 0.00 34.95 31.57 1q3g s ARG 252 CO 0.09 0.32 0.84 0.09 -0.68 0.00 0.00 175.30 175.96 1q3g n ASN 253 N -1.09 -5.67 -4.91 0.23 4.13 -0.83 -0.95 115.26 106.16 1q3g n ASN 253 Ca -0.05 -0.38 -0.20 0.00 1.68 0.00 0.00 54.58 55.62 1q3g n ASN 253 Cb 0.55 -4.37 -0.02 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 -3.21 4.03 -0.45 5.41 0.00 -0.26 -4.49 121.76 122.80 1q3g s ALA 254 Ca 0.42 -1.59 0.02 0.00 0.00 0.00 0.00 51.96 50.81 1q3g s ALA 254 Cb -0.18 -1.37 0.15 0.00 0.00 0.00 0.00 23.12 21.71 1q3g s ALA 254 CO 0.51 -0.03 0.29 -1.14 0.00 0.00 0.00 175.76 175.39 1q3g s GLN 255 N -4.08 1.19 0.31 0.00 0.74 -1.26 -4.06 119.66 112.50 1q3g s GLN 255 Ca 0.43 -2.05 0.05 0.00 0.05 0.00 0.00 55.36 53.84 1q3g s GLN 255 Cb -0.07 -2.05 0.84 0.00 1.10 0.00 0.00 33.01 32.82 1q3g s GLN 255 CO 0.29 -1.24 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 -2.08 132.00 136.35 1q3g h PRO 256 Ca 0.08 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1q3g h PRO 256 Cb 0.91 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1q3g h PRO 256 CO 0.44 0.08 0.00 -0.40 -0.21 0.00 0.00 178.00 177.91 1q3g n ASP 257 N -5.30 0.03 -0.74 -2.05 3.85 -1.26 -1.10 116.55 109.99 1q3g n ASP 257 Ca 0.25 0.51 0.12 0.00 -0.71 0.00 0.00 54.79 54.96 1q3g n ASP 257 Cb 0.81 -0.52 0.33 0.00 -1.35 0.00 0.00 41.12 40.39 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 -1.54 0.21 -1.70 2.12 -2.24 -0.78 -4.30 114.28 106.05 1q3g n THR 258 Ca 0.01 -0.44 0.05 0.00 -2.27 0.00 0.00 64.05 61.39 1q3g n THR 258 Cb 0.04 0.69 0.08 0.00 -2.10 0.00 0.00 70.33 69.04 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 1.40 -0.16 3.22 4.77 -0.26 -4.89 117.00 121.79 1q3g n LEU 259 Ca 0.17 -2.34 -0.04 0.00 -0.03 0.00 0.00 56.01 53.77 1q3g n LEU 259 Cb 0.44 -0.23 0.02 0.00 -2.33 0.00 0.00 43.42 41.32 1q3g n LEU 259 CO 0.15 0.63 0.71 0.44 -1.33 0.00 0.00 177.39 177.99 1q3g h ASP 260 N 0.32 -0.73 -0.18 -1.43 3.32 -1.75 0.51 116.42 116.48 1q3g h ASP 260 Ca -0.04 0.18 0.02 0.00 0.02 0.00 0.00 57.03 57.21 1q3g h ASP 260 Cb 1.28 0.41 -0.02 0.00 0.22 0.00 0.00 39.33 41.21 1q3g h ASP 260 CO 0.02 -0.24 0.03 0.00 -1.72 0.00 0.00 179.24 177.33 1q3g h ALA 261 N 1.26 0.18 -0.21 3.45 0.00 -1.87 -0.42 119.26 121.64 1q3g h ALA 261 Ca 0.23 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 1q3g h ALA 261 Cb 0.46 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1q3g h ALA 261 CO -0.56 -0.41 0.12 0.28 0.00 0.00 0.00 179.25 178.68 1q3g h VAL 262 N 0.10 1.10 -0.57 0.00 2.07 -1.72 -1.50 116.25 115.73 1q3g h VAL 262 Ca 0.08 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.31 1q3g h VAL 262 Cb 0.08 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1q3g h VAL 262 CO -0.11 0.09 0.22 -0.07 0.02 0.00 0.00 177.57 177.72 1q3g h LEU 263 N 0.24 0.76 -0.67 2.57 3.38 -0.77 0.35 115.31 121.18 1q3g h LEU 263 Ca 0.07 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1q3g h LEU 263 Cb 0.05 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1q3g h LEU 263 CO -0.01 0.70 0.15 0.00 0.09 0.00 0.00 178.44 179.36 1q3g h ALA 264 N 1.42 0.88 -0.28 1.53 0.00 -0.80 -1.54 119.26 120.47 1q3g h ALA 264 Ca 0.19 -0.25 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 1q3g h ALA 264 Cb 0.18 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1q3g h ALA 264 CO -0.02 0.61 -0.43 -0.22 0.00 0.00 0.00 179.25 179.19 1q3g h LYS 265 N 1.00 0.70 -0.47 0.00 1.63 -0.70 -2.11 116.57 116.62 1q3g h LYS 265 Ca 0.21 -0.38 -0.08 0.00 -0.85 0.00 0.00 60.65 59.55 1q3g h LYS 265 Cb 0.38 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.01 1q3g h LYS 265 CO 0.00 0.99 -0.03 -0.07 -3.45 0.00 0.00 179.45 176.90 1q3g h LEU 266 N 0.57 0.77 -0.61 5.20 3.38 -0.69 -1.48 115.31 122.44 1q3g h LEU 266 Ca 0.04 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 1q3g h LEU 266 Cb 0.97 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1q3g h LEU 266 CO 0.09 0.86 0.09 0.03 0.09 0.00 0.00 178.44 179.60 1q3g h ARG 267 N 0.74 1.02 0.00 1.13 3.08 -1.13 -0.75 114.38 118.47 1q3g h ARG 267 Ca 0.14 -0.28 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 1q3g h ARG 267 Cb 0.49 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 1q3g h ARG 267 CO 0.02 0.96 -0.03 0.93 -1.07 0.00 0.00 179.97 180.78 1q3g h GLU 268 N 0.93 0.00 -0.00 0.04 5.08 -0.90 0.21 114.58 119.93 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 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1q3g h GLU 268 CO 0.01 0.03 -0.06 0.00 -1.00 0.00 0.00 179.01 177.99 1q3g n ALA 269 N -2.48 2.53 0.00 3.43 0.00 -0.60 -4.75 120.51 118.64 1q3g n ALA 269 Ca -0.03 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1q3g n ALA 269 Cb 0.12 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1q3g n ALA 269 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q3g n GLY 270 N 1.44 1.05 3.79 0.00 0.00 0.74 -0.22 105.19 111.99 1q3g n GLY 270 Ca 0.09 0.00 -0.35 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 3.04 -0.50 4.61 0.00 -0.38 -4.89 121.76 121.64 1q3g s ALA 271 Ca 0.00 0.62 -0.16 0.00 0.00 0.00 0.00 51.96 52.42 1q3g s ALA 271 Cb 0.00 -3.24 0.09 0.00 0.00 0.00 0.00 23.12 19.97 1q3g s ALA 271 CO 0.00 -0.15 0.43 0.34 0.00 0.00 0.00 175.76 176.38 1q3g s ASP 272 N -1.77 6.16 -0.10 0.00 2.15 -0.37 -4.41 116.67 118.33 1q3g s ASP 272 Ca 0.60 -1.49 -0.00 0.00 0.43 0.00 0.00 52.55 52.09 1q3g s ASP 272 Cb -0.18 -2.19 -0.03 0.00 -0.30 0.00 0.00 42.92 40.22 1q3g s ASP 272 CO 0.23 -0.72 -0.07 -0.63 -0.17 0.00 0.00 175.17 173.81 1q3g s ILE 273 N 1.63 3.66 -0.00 4.11 1.01 -1.26 -1.16 121.20 129.18 1q3g s ILE 273 Ca 0.04 -0.47 0.03 0.00 0.00 0.00 0.00 60.65 60.25 1q3g s ILE 273 Cb -0.26 -2.53 -0.01 0.00 0.01 0.00 0.00 42.46 39.67 1q3g s ILE 273 CO 0.05 0.56 -0.11 -1.61 0.00 0.00 0.00 174.94 173.84 1q3g s GLU 274 N -0.34 0.85 0.15 2.79 2.02 -0.55 -5.00 118.70 118.63 1q3g s GLU 274 Ca 0.05 -0.40 0.07 0.00 0.02 0.00 0.00 54.97 54.71 1q3g s GLU 274 Cb -0.12 -0.82 -0.04 0.00 0.10 0.00 0.00 34.13 33.24 1q3g s GLU 274 CO 0.02 0.22 -0.17 0.95 0.02 0.00 0.00 175.26 176.31 1q3g s THR 275 N -0.30 1.64 0.00 3.63 -4.23 -1.26 -0.10 115.64 115.01 1q3g s THR 275 Ca 0.04 -1.86 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 1q3g s THR 275 Cb -0.04 -1.75 0.00 0.00 1.34 0.00 0.00 72.50 72.05 1q3g s THR 275 CO -0.00 -0.37 0.00 0.61 -0.54 0.00 0.00 174.62 174.32 1q3g n GLY 276 N 0.34 5.58 0.27 3.99 0.00 0.49 -4.99 105.19 110.86 1q3g n GLY 276 Ca -0.14 -1.89 -0.08 0.00 0.00 0.00 0.00 46.02 43.91 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 0.91 -0.12 1.61 4.57 -2.01 -3.35 114.58 116.18 1q3g h GLU 277 Ca 0.00 -0.22 -0.19 0.00 -1.18 0.00 0.00 59.36 57.77 1q3g h GLU 277 Cb 0.00 -0.12 -0.37 0.00 -0.16 0.00 0.00 28.75 28.10 1q3g h GLU 277 CO 0.00 0.84 -1.03 -0.40 -1.18 0.00 0.00 179.01 177.25 1q3g n ASP 278 N -4.39 1.26 -3.66 1.04 3.85 -1.26 -4.70 116.55 108.68 1q3g n ASP 278 Ca 0.03 -2.14 -0.12 0.00 -0.71 0.00 0.00 54.79 51.85 1q3g n ASP 278 Cb 0.23 -0.36 -0.06 0.00 -1.35 0.00 0.00 41.12 39.58 1q3g n ASP 278 CO 0.00 0.00 0.00 -1.66 -1.01 0.00 0.00 177.20 174.53 1q3g s TRP 279 N -1.21 -0.23 -0.01 2.11 1.48 -1.26 -1.10 118.94 118.72 1q3g s TRP 279 Ca 0.33 0.09 0.01 0.00 -1.06 0.00 0.00 56.10 55.46 1q3g s TRP 279 Cb 0.37 0.22 0.01 0.00 -1.16 0.00 0.00 33.47 32.91 1q3g s TRP 279 CO -0.13 -0.61 -0.03 0.42 -4.06 0.00 0.00 176.95 172.55 1q3g s ILE 280 N -2.93 0.29 -0.01 0.66 1.01 -0.89 -0.38 121.20 118.96 1q3g s ILE 280 Ca -0.02 -0.09 0.07 0.00 0.00 0.00 0.00 60.65 60.60 1q3g s ILE 280 Cb 0.00 -0.29 -0.02 0.00 0.01 0.00 0.00 42.46 42.16 1q3g s ILE 280 CO -0.06 0.11 -0.21 -0.94 0.00 0.00 0.00 174.94 173.85 1q3g s SER 281 N 0.29 2.49 -0.04 3.58 1.04 0.85 0.13 113.70 122.06 1q3g s SER 281 Ca -0.03 -0.40 0.01 0.00 0.48 0.00 0.00 55.95 56.01 1q3g s SER 281 Cb -0.06 -0.27 0.02 0.00 0.10 0.00 0.00 66.02 65.81 1q3g s SER 281 CO -0.01 0.25 -0.04 -0.22 0.98 0.00 0.00 173.24 174.20 1q3g s LEU 282 N -0.59 1.37 -0.10 2.42 0.20 0.28 -1.48 118.68 120.78 1q3g s LEU 282 Ca 0.08 -0.11 0.00 0.00 0.69 0.00 0.00 54.13 54.80 1q3g s LEU 282 Cb -0.08 -0.39 0.02 0.00 -0.43 0.00 0.00 46.19 45.31 1q3g s LEU 282 CO -0.00 -0.05 -0.08 -0.62 -0.29 0.00 0.00 176.35 175.31 1q3g s ASP 283 N 0.82 1.99 0.05 3.68 -1.08 -0.31 -0.17 116.67 121.65 1q3g s ASP 283 Ca -0.10 -0.28 0.25 0.00 -0.52 0.00 0.00 52.55 51.89 1q3g s ASP 283 Cb -0.13 -0.79 0.43 0.00 -1.46 0.00 0.00 42.92 40.96 1q3g s ASP 283 CO -0.00 -0.09 1.36 0.23 0.52 0.00 0.00 175.17 177.20 1q3g n MET 284 N 4.66 0.15 -3.72 4.34 2.81 -0.46 -1.24 117.12 123.66 1q3g n MET 284 Ca -0.15 0.04 -0.25 0.00 -1.81 0.00 0.00 57.70 55.53 1q3g n MET 284 Cb 0.50 -1.59 0.05 0.00 -0.71 0.00 0.00 33.22 31.48 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 -1.79 -2.34 -0.86 2.03 8.25 -1.26 -1.23 115.22 118.02 1q3g n HIS 285 Ca 0.04 0.92 0.00 0.00 -0.26 0.00 0.00 57.72 58.43 1q3g n HIS 285 Cb 0.39 -4.51 0.00 0.00 1.12 0.00 0.00 29.99 26.99 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 -1.67 0.04 3.81 -1.41 0.00 -0.71 -4.96 105.19 100.30 1q3g n GLY 286 Ca -0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.60 4.31 0.31 1.61 -0.14 -0.36 -4.82 119.74 119.05 1q3g s LYS 287 Ca 0.00 0.96 -0.28 0.00 -1.36 0.00 0.00 55.97 55.29 1q3g s LYS 287 Cb 0.00 -2.86 -0.09 0.00 -1.68 0.00 0.00 37.83 33.20 1q3g s LYS 287 CO 0.00 0.37 1.09 0.50 -0.76 0.00 0.00 175.35 176.55 1q3g s ARG 288 N -2.01 4.53 0.59 1.68 3.52 -1.26 -4.41 118.95 121.59 1q3g s ARG 288 Ca 0.45 1.75 -0.18 0.00 -0.13 0.00 0.00 55.73 57.62 1q3g s ARG 288 Cb -0.17 -3.05 -0.03 0.00 -1.56 0.00 0.00 34.95 30.14 1q3g s ARG 288 CO 0.21 0.13 1.14 -1.25 -0.81 0.00 0.00 175.30 174.72 1q3g s PRO 289 N -1.67 3.07 -0.05 5.12 0.04 -1.26 -4.84 135.00 135.41 1q3g s PRO 289 Ca 0.47 1.61 -0.15 0.00 0.04 0.00 0.00 61.00 62.97 1q3g s PRO 289 Cb -0.30 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.22 1q3g s PRO 289 CO 0.38 -1.07 0.39 0.15 0.04 0.00 0.00 177.00 176.89 1q3g s LYS 290 N -3.53 4.02 0.40 4.56 -0.14 0.69 -0.29 119.74 125.44 1q3g s LYS 290 Ca 0.72 0.34 -0.26 0.00 -1.36 0.00 0.00 55.97 55.41 1q3g s LYS 290 Cb -0.25 -3.29 -0.10 0.00 -1.68 0.00 0.00 37.83 32.51 1q3g s LYS 290 CO 0.33 0.54 1.32 0.00 -0.76 0.00 0.00 175.35 176.77 1q3g n ALA 291 N 2.41 1.51 -2.33 5.17 0.00 -1.02 -4.35 120.51 121.90 1q3g n ALA 291 Ca -0.13 0.30 -0.17 0.00 0.00 0.00 0.00 53.44 53.44 1q3g n ALA 291 Cb 0.52 -2.30 -0.10 0.00 0.00 0.00 0.00 19.45 17.57 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 -1.16 1.27 -0.16 0.00 -7.23 -1.26 -4.87 120.40 106.99 1q3g s VAL 292 Ca 0.58 -2.08 -0.03 0.00 -1.81 0.00 0.00 61.98 58.64 1q3g s VAL 292 Cb -0.51 -2.21 -0.02 0.00 0.56 0.00 0.00 36.38 34.20 1q3g s VAL 292 CO 0.60 -0.46 -0.05 -0.89 -0.31 0.00 0.00 175.10 173.99 1q3g s THR 293 N -3.26 3.71 0.07 5.32 2.01 -1.26 -2.97 115.64 119.26 1q3g s THR 293 Ca 0.25 -0.42 0.06 0.00 0.31 0.00 0.00 61.69 61.89 1q3g s THR 293 Cb 0.04 -2.63 -0.03 0.00 0.01 0.00 0.00 72.50 69.89 1q3g s THR 293 CO 0.07 0.49 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.63 1q3g s VAL 294 N 0.52 1.35 -0.24 3.82 1.01 -0.03 -4.98 120.40 121.85 1q3g s VAL 294 Ca -0.04 -1.33 -0.03 0.00 0.00 0.00 0.00 61.98 60.58 1q3g s VAL 294 Cb -0.15 -1.25 0.10 0.00 0.00 0.00 0.00 36.38 35.09 1q3g s VAL 294 CO 0.03 -0.11 0.20 -0.60 0.00 0.00 0.00 175.10 174.62 1q3g s ARG 295 N -1.67 0.20 0.64 2.72 3.52 -1.26 -0.22 118.95 122.89 1q3g s ARG 295 Ca 0.02 -0.10 -0.17 0.00 -0.13 0.00 0.00 55.73 55.35 1q3g s ARG 295 Cb -0.10 -1.15 -0.01 0.00 -1.56 0.00 0.00 34.95 32.13 1q3g s ARG 295 CO 0.03 -0.84 1.21 0.95 -0.81 0.00 0.00 175.30 175.84 1q3g s THR 296 N 2.25 2.53 0.01 4.11 -4.23 -0.42 -4.36 115.64 115.53 1q3g s THR 296 Ca 0.07 0.30 -0.30 0.00 -1.18 0.00 0.00 61.69 60.59 1q3g s THR 296 Cb -0.15 -3.02 0.11 0.00 1.34 0.00 0.00 72.50 70.78 1q3g s THR 296 CO -0.23 -0.10 1.21 0.00 -0.54 0.00 0.00 174.62 174.96 1q3g s ALA 297 N -1.73 -2.10 0.71 3.99 0.00 -0.67 -4.06 121.76 117.90 1q3g s ALA 297 Ca 0.76 0.65 -0.16 0.00 0.00 0.00 0.00 51.96 53.21 1q3g s ALA 297 Cb -0.30 0.38 0.01 0.00 0.00 0.00 0.00 23.12 23.22 1q3g s ALA 297 CO 0.38 -1.01 1.09 -2.30 0.00 0.00 0.00 175.76 173.91 1q3g n PRO 298 N -0.45 0.63 -1.60 0.00 -0.02 -1.26 -4.40 135.00 127.89 1q3g n PRO 298 Ca -0.07 0.27 -0.38 0.00 -2.02 0.00 0.00 63.50 61.30 1q3g n PRO 298 Cb 0.62 -2.34 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 -2.45 0.71 1.30 6.00 -0.00 -1.26 -1.72 115.22 117.80 1q3g n HIS 299 Ca 0.14 0.45 0.01 0.00 0.46 0.00 0.00 57.72 58.78 1q3g n HIS 299 Cb 0.49 -2.13 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 -0.76 1.35 -0.92 1.57 -0.04 -1.26 -4.62 135.00 130.32 1q3g n PRO 300 Ca 0.13 -0.39 -0.24 0.00 -0.04 0.00 0.00 63.50 62.96 1q3g n PRO 300 Cb 0.46 -1.29 0.20 0.00 -0.04 0.00 0.00 33.50 32.83 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 -0.09 -2.53 -1.83 0.55 0.00 -0.70 -4.24 120.51 111.66 1q3g n ALA 301 Ca 0.04 -1.31 -0.42 0.00 0.00 0.00 0.00 53.44 51.74 1q3g n ALA 301 Cb 0.20 -0.09 -0.03 0.00 0.00 0.00 0.00 19.45 19.54 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 -2.68 2.00 0.18 0.00 5.36 -1.26 -4.81 117.98 116.77 1q3g s PHE 302 Ca 0.57 0.03 -0.30 0.00 -0.96 0.00 0.00 56.93 56.27 1q3g s PHE 302 Cb -0.05 -4.07 -0.08 0.00 -0.34 0.00 0.00 43.02 38.48 1q3g s PHE 302 CO 0.43 -4.51 1.23 -1.25 -1.46 0.00 0.00 175.22 169.67 1q3g s PRO 303 N 3.36 4.46 0.55 10.12 0.04 -1.26 -1.67 135.00 150.60 1q3g s PRO 303 Ca 0.79 1.93 0.30 0.00 0.04 0.00 0.00 61.00 64.05 1q3g s PRO 303 Cb -0.41 -3.23 1.62 0.00 0.04 0.00 0.00 34.50 32.52 1q3g s PRO 303 CO 0.35 -0.15 2.14 0.00 0.04 0.00 0.00 177.00 179.38 1q3g h THR 304 N 3.78 0.49 0.00 1.26 1.03 -1.92 -2.08 112.91 115.46 1q3g h THR 304 Ca -0.44 -0.36 0.00 0.00 -0.01 0.00 0.00 66.41 65.60 1q3g h THR 304 Cb 1.21 1.24 0.00 0.00 -1.07 0.00 0.00 68.15 69.53 1q3g h THR 304 CO 0.76 0.07 0.00 0.00 -0.01 0.00 0.00 175.52 176.34 1q3g n ALA 305 N -2.27 1.85 0.26 0.00 0.00 -1.26 -2.08 120.51 117.01 1q3g n ALA 305 Ca -0.02 -0.07 0.05 0.00 0.00 0.00 0.00 53.44 53.40 1q3g n ALA 305 Cb 0.19 -1.24 -0.07 0.00 0.00 0.00 0.00 19.45 18.33 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 -1.27 2.19 -0.20 0.00 2.00 -0.79 -4.75 117.12 114.30 1q3g n MET 306 Ca 0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 57.70 57.71 1q3g n MET 306 Cb 0.11 -1.09 0.05 0.00 0.00 0.00 0.00 33.22 32.29 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 0.00 -0.03 -0.60 0.03 -0.00 -1.43 -0.95 115.11 112.12 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 0.01 -0.04 0.00 0.00 0.00 0.00 27.48 27.79 1q3g h GLN 307 CO 0.00 -0.02 0.37 0.00 0.00 0.00 0.00 178.83 179.18 1q3g h ALA 308 N 1.50 0.78 -0.75 3.38 0.00 -1.86 0.62 119.26 122.92 1q3g h ALA 308 Ca 0.28 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.18 1q3g h ALA 308 Cb 0.47 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1q3g h ALA 308 CO -0.63 0.11 0.49 1.96 0.00 0.00 0.00 179.25 181.18 1q3g h GLN 309 N 0.73 1.00 0.00 0.00 7.50 -1.53 -1.61 115.11 121.20 1q3g h GLN 309 Ca 0.24 -0.07 -0.04 0.00 0.50 0.00 0.00 58.65 59.29 1q3g h GLN 309 Cb 0.02 -0.22 -0.01 0.00 0.05 0.00 0.00 27.48 27.32 1q3g h GLN 309 CO -0.10 0.67 -0.19 0.74 -1.50 0.00 0.00 178.83 178.45 1q3g h PHE 310 N 1.02 0.00 -0.49 2.96 -1.00 -0.68 -2.27 116.94 116.48 1q3g h PHE 310 Ca 0.28 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 61.01 1q3g h PHE 310 Cb -0.11 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.43 1q3g h PHE 310 CO -0.02 0.19 0.14 1.15 -1.61 0.00 0.00 178.31 178.16 1q3g h THR 311 N 0.00 1.23 0.09 -1.55 2.02 0.07 -1.42 112.91 113.35 1q3g h THR 311 Ca -0.00 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.38 1q3g h THR 311 Cb 0.80 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 1q3g h THR 311 CO 0.02 0.29 -0.08 0.25 0.37 0.00 0.00 175.52 176.37 1q3g h LEU 312 N 0.67 -0.21 -0.53 2.58 5.85 -1.05 -0.71 115.31 121.91 1q3g h LEU 312 Ca 0.16 0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.99 1q3g h LEU 312 Cb 0.30 0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.33 1q3g h LEU 312 CO -0.00 -0.13 0.09 0.25 -0.34 0.00 0.00 178.44 178.31 1q3g h LEU 313 N -0.19 -0.04 -0.84 2.25 6.46 -1.20 -0.56 115.31 121.19 1q3g h LEU 313 Ca 0.00 0.10 -0.07 0.00 -0.12 0.00 0.00 57.88 57.80 1q3g h LEU 313 Cb 0.18 0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.23 1q3g h LEU 313 CO -0.02 0.00 0.11 0.78 -0.62 0.00 0.00 178.44 178.70 1q3g h ASN 314 N 0.22 0.92 0.32 1.25 2.35 -0.97 -2.08 115.58 117.59 1q3g h ASN 314 Ca 0.27 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1q3g h ASN 314 Cb 0.38 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1q3g h ASN 314 CO -0.37 0.92 0.00 -0.07 -1.65 0.00 0.00 177.43 176.26 1q3g h LEU 315 N 0.92 0.00 -2.94 1.61 3.38 0.44 -1.60 115.31 117.12 1q3g h LEU 315 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1q3g h LEU 315 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1q3g h LEU 315 CO 0.01 0.00 -0.02 1.33 0.09 0.00 0.00 178.44 179.85 1q3g n VAL 316 N -2.64 1.64 -2.99 1.22 0.24 -0.95 -1.33 118.33 113.52 1q3g n VAL 316 Ca -0.01 -1.93 -0.18 0.00 -2.04 0.00 0.00 64.34 60.18 1q3g n VAL 316 Cb 0.13 -0.07 0.01 0.00 -1.47 0.00 0.00 33.84 32.45 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 -2.40 4.44 -0.61 2.33 0.00 -0.60 -4.61 121.76 120.30 1q3g s ALA 317 Ca 0.25 -1.62 -0.24 0.00 0.00 0.00 0.00 51.96 50.35 1q3g s ALA 317 Cb 0.22 -1.69 0.05 0.00 0.00 0.00 0.00 23.12 21.70 1q3g s ALA 317 CO 0.02 -0.33 1.01 -2.00 0.00 0.00 0.00 175.76 174.46 1q3g s GLU 318 N -4.39 3.25 0.00 0.00 2.56 0.60 -3.73 118.70 116.98 1q3g s GLU 318 Ca 0.55 -0.41 0.00 0.00 0.00 0.00 0.00 54.97 55.11 1q3g s GLU 318 Cb -0.10 -4.12 0.00 0.00 2.00 0.00 0.00 34.13 31.91 1q3g s GLU 318 CO 0.34 -1.69 0.00 0.41 -0.56 0.00 0.00 175.26 173.76 1q3g n GLY 319 N 5.21 0.20 3.40 -1.50 0.00 -1.26 -2.44 105.19 108.80 1q3g n GLY 319 Ca 0.00 -2.30 -0.40 0.00 0.00 0.00 0.00 46.02 43.32 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 -0.08 4.65 -0.02 2.61 2.01 -1.26 -2.24 115.64 121.31 1q3g s THR 320 Ca 0.00 -0.74 -0.02 0.00 0.31 0.00 0.00 61.69 61.24 1q3g s THR 320 Cb 0.00 -3.54 -0.04 0.00 0.01 0.00 0.00 72.50 68.93 1q3g s THR 320 CO 0.00 -0.17 0.11 -0.83 -0.69 0.00 0.00 174.62 173.04 1q3g s GLY 321 N 1.58 2.07 -0.11 4.40 0.00 -0.32 -4.77 107.32 110.16 1q3g s GLY 321 Ca 0.03 -0.81 0.02 0.00 0.00 0.00 0.00 44.72 43.96 1q3g s GLY 321 CO 0.07 -0.67 -0.16 0.14 0.00 0.00 0.00 173.10 172.47 1q3g s VAL 322 N -1.20 1.58 -0.14 1.40 1.01 -1.16 0.22 120.40 122.11 1q3g s VAL 322 Ca 0.23 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1q3g s VAL 322 Cb -0.12 -1.43 0.00 0.00 0.00 0.00 0.00 36.38 34.83 1q3g s VAL 322 CO 0.14 0.46 -0.18 -0.63 0.00 0.00 0.00 175.10 174.88 1q3g s ILE 323 N 0.94 2.42 -0.18 2.22 1.01 -0.78 -0.85 121.20 125.97 1q3g s ILE 323 Ca -0.07 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 59.70 1q3g s ILE 323 Cb -0.15 -1.99 -0.00 0.00 0.01 0.00 0.00 42.46 40.32 1q3g s ILE 323 CO -0.01 0.53 -0.11 -0.89 0.00 0.00 0.00 174.94 174.46 1q3g s THR 324 N 0.72 2.96 -0.28 2.92 2.01 0.69 -0.32 115.64 124.35 1q3g s THR 324 Ca -0.08 -0.65 -0.11 0.00 0.31 0.00 0.00 61.69 61.16 1q3g s THR 324 Cb -0.16 -2.29 -0.05 0.00 0.01 0.00 0.00 72.50 70.02 1q3g s THR 324 CO 0.01 0.48 0.18 -0.70 -0.69 0.00 0.00 174.62 173.90 1q3g s GLU 325 N 1.03 3.90 0.00 4.92 2.56 -0.09 -1.30 118.70 129.71 1q3g s GLU 325 Ca -0.01 -0.35 0.09 0.00 0.00 0.00 0.00 54.97 54.70 1q3g s GLU 325 Cb -0.15 -3.64 0.04 0.00 2.00 0.00 0.00 34.13 32.39 1q3g s GLU 325 CO -0.02 -0.19 0.69 0.25 -0.56 0.00 0.00 175.26 175.43 1q3g n THR 326 N 5.05 0.00 -0.10 -1.70 -2.24 -1.26 -4.74 114.28 109.29 1q3g n THR 326 Ca -0.14 -0.46 -0.24 0.00 -2.27 0.00 0.00 64.05 60.94 1q3g n THR 326 Cb 0.52 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 0.15 1.57 -5.18 2.28 2.08 -1.26 -4.96 119.36 114.03 1q3g n ILE 327 Ca 0.05 -0.31 -0.31 0.00 0.56 0.00 0.00 62.75 62.73 1q3g n ILE 327 Cb 0.21 -1.86 -0.17 0.00 -0.75 0.00 0.00 39.64 37.06 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 -2.46 2.43 -2.00 1.39 0.40 -1.26 -5.04 117.98 111.44 1q3g s PHE 328 Ca -0.32 -0.91 0.13 0.00 -0.60 0.00 0.00 56.93 55.23 1q3g s PHE 328 Cb 0.09 -1.62 0.75 0.00 0.51 0.00 0.00 43.02 42.75 1q3g s PHE 328 CO 0.59 -0.35 1.19 -0.85 0.70 0.00 0.00 175.22 176.50 1q3g n GLU 329 N 3.36 0.54 -2.72 0.44 0.00 -1.23 -3.85 120.64 117.18 1q3g n GLU 329 Ca -0.19 0.00 -0.08 0.00 0.00 0.00 0.00 57.16 56.89 1q3g n GLU 329 Cb 0.53 -1.36 0.09 0.00 0.00 0.00 0.00 31.44 30.70 1q3g n GLU 329 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1q3g n ASN 330 N -0.86 -1.33 -2.32 -1.84 4.05 -0.76 -4.97 115.26 107.23 1q3g n ASN 330 Ca 0.09 -2.75 -0.30 0.00 0.45 0.00 0.00 54.58 52.08 1q3g n ASN 330 Cb 0.04 0.87 0.03 0.00 1.23 0.00 0.00 39.78 41.95 1q3g n ASN 330 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 177.26 173.07 1q3g n ARG 331 N -0.30 3.22 -0.17 1.20 0.63 -1.25 -4.19 116.66 115.79 1q3g n ARG 331 Ca 0.02 -3.92 0.07 0.00 -0.92 0.00 0.00 57.85 53.10 1q3g n ARG 331 Cb 0.81 -2.28 0.10 0.00 0.45 0.00 0.00 32.46 31.54 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 -0.70 0.00 0.31 -0.14 0.99 -1.26 -4.80 117.46 111.87 1q3g n PHE 332 Ca 0.49 -0.72 0.20 0.00 -0.00 0.00 0.00 57.45 57.42 1q3g n PHE 332 Cb 0.73 -0.12 1.03 0.00 -1.00 0.00 0.00 39.48 40.12 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 -1.98 -2.06 114.93 112.66 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 1.08 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.72 1q3g h MET 333 CO 0.00 0.01 -0.63 1.12 1.06 0.00 0.00 176.91 178.48 1q3g h HIS 334 N 0.00 0.00 -0.06 -0.22 2.07 -1.94 -3.35 115.15 111.64 1q3g h HIS 334 Ca -0.00 0.00 0.04 0.00 -2.85 0.00 0.00 60.37 57.56 1q3g h HIS 334 Cb 0.14 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 30.07 1q3g h HIS 334 CO 0.00 0.63 -0.30 0.28 -3.07 0.00 0.00 177.93 175.46 1q3g h VAL 335 N 0.00 0.32 -0.49 6.12 2.07 -1.75 -0.19 116.25 122.33 1q3g h VAL 335 Ca -0.01 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.59 1q3g h VAL 335 Cb 1.28 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 1q3g h VAL 335 CO 0.08 0.00 0.33 -0.65 0.02 0.00 0.00 177.57 177.35 1q3g h PRO 336 N -0.42 0.35 -0.18 1.57 0.11 -1.74 -0.93 132.00 130.76 1q3g h PRO 336 Ca 0.08 -0.02 -0.10 0.00 0.11 0.00 0.00 66.00 66.07 1q3g h PRO 336 Cb 0.53 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.56 1q3g h PRO 336 CO -0.30 0.23 -0.28 0.93 -0.21 0.00 0.00 178.00 178.37 1q3g h GLU 337 N 0.36 0.52 -0.13 1.05 4.39 -1.49 -2.96 114.58 116.32 1q3g h GLU 337 Ca 0.22 -0.31 -0.06 0.00 0.34 0.00 0.00 59.36 59.55 1q3g h GLU 337 Cb 0.40 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1q3g h GLU 337 CO -0.05 0.91 -0.17 -0.07 -1.16 0.00 0.00 179.01 178.46 1q3g h LEU 338 N 0.17 0.20 -1.56 1.33 3.38 -0.35 -1.38 115.31 117.10 1q3g h LEU 338 Ca 0.02 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1q3g h LEU 338 Cb 0.86 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1q3g h LEU 338 CO 0.07 0.39 -0.02 0.40 0.09 0.00 0.00 178.44 179.36 1q3g h ILE 339 N 0.20 1.13 0.00 1.22 2.04 -1.08 0.13 117.51 121.14 1q3g h ILE 339 Ca 0.04 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 65.36 1q3g h ILE 339 Cb 0.43 1.03 -0.00 0.00 -0.74 0.00 0.00 36.82 37.53 1q3g h ILE 339 CO 0.03 0.16 -0.16 0.03 0.00 0.00 0.00 178.15 178.21 1q3g h ARG 340 N 0.24 0.00 -0.42 2.37 3.08 -1.09 -0.61 114.38 117.94 1q3g h ARG 340 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1q3g h ARG 340 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1q3g h ARG 340 CO 0.01 0.16 0.00 -1.33 -1.07 0.00 0.00 179.97 177.73 1q3g n MET 341 N -4.04 1.94 -0.14 0.04 2.81 0.40 -4.88 117.12 113.26 1q3g n MET 341 Ca -0.02 -1.21 0.00 0.00 -1.81 0.00 0.00 57.70 54.66 1q3g n MET 341 Cb 0.24 -1.37 0.00 0.00 -0.71 0.00 0.00 33.22 31.38 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 0.87 0.65 3.77 3.03 0.00 -0.24 -0.28 105.19 113.00 1q3g n GLY 342 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.21 2.17 -0.20 4.61 0.00 -0.94 -4.97 121.76 120.22 1q3g s ALA 343 Ca 0.00 0.05 0.01 0.00 0.00 0.00 0.00 51.96 52.02 1q3g s ALA 343 Cb 0.00 -3.20 0.04 0.00 0.00 0.00 0.00 23.12 19.96 1q3g s ALA 343 CO 0.00 -1.79 -0.10 -1.01 0.00 0.00 0.00 175.76 172.86 1q3g s HIS 344 N -2.99 2.42 0.09 0.00 3.76 -1.26 -4.53 115.29 112.78 1q3g s HIS 344 Ca 0.61 -1.59 -0.25 0.00 -0.15 0.00 0.00 55.06 53.67 1q3g s HIS 344 Cb -0.16 -1.64 0.08 0.00 1.11 0.00 0.00 32.58 31.96 1q3g s HIS 344 CO 0.56 -0.74 0.66 0.00 -0.85 0.00 0.00 174.74 174.36 1q3g s ALA 345 N 1.39 -1.67 -0.01 -1.40 0.00 -1.26 -0.95 121.76 117.87 1q3g s ALA 345 Ca -0.01 0.75 0.04 0.00 0.00 0.00 0.00 51.96 52.73 1q3g s ALA 345 Cb -0.16 0.61 -0.01 0.00 0.00 0.00 0.00 23.12 23.56 1q3g s ALA 345 CO -0.08 -0.67 -0.12 -1.21 0.00 0.00 0.00 175.76 173.68 1q3g s GLU 346 N -3.09 0.99 -0.22 0.00 8.01 -0.55 -4.97 118.70 118.87 1q3g s GLU 346 Ca -0.01 -0.46 -0.07 0.00 0.01 0.00 0.00 54.97 54.43 1q3g s GLU 346 Cb -0.01 -0.96 -0.03 0.00 -4.31 0.00 0.00 34.13 28.82 1q3g s GLU 346 CO -0.07 0.26 0.07 0.42 0.01 0.00 0.00 175.26 175.95 1q3g s ILE 347 N -0.33 4.53 -0.29 -1.63 1.01 -1.26 -0.39 121.20 122.83 1q3g s ILE 347 Ca 0.04 -0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.60 1q3g s ILE 347 Cb -0.05 -3.09 0.08 0.00 0.01 0.00 0.00 42.46 39.42 1q3g s ILE 347 CO -0.00 0.38 0.02 -0.70 0.00 0.00 0.00 174.94 174.64 1q3g s GLU 348 N 1.11 1.32 7.69 2.79 2.56 -0.37 -5.01 118.70 128.80 1q3g s GLU 348 Ca 0.04 -1.30 0.00 0.00 0.00 0.00 0.00 54.97 53.71 1q3g s GLU 348 Cb -0.14 -2.62 0.00 0.00 2.00 0.00 0.00 34.13 33.37 1q3g s GLU 348 CO 0.03 -0.82 0.00 0.45 -0.56 0.00 0.00 175.26 174.36 1q3g n SER 349 N 4.58 0.00 -2.19 -1.70 2.88 -1.26 -2.19 113.62 113.74 1q3g n SER 349 Ca -0.04 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.27 1q3g n SER 349 Cb 0.43 0.00 0.18 0.00 -0.75 0.00 0.00 64.21 64.07 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 7.85 3.74 -3.89 -3.46 6.94 -1.26 -4.92 115.26 120.27 1q3g n ASN 350 Ca 0.00 -3.60 -0.11 0.00 -0.02 0.00 0.00 54.58 50.84 1q3g n ASN 350 Cb 0.00 -0.83 -0.12 0.00 -2.36 0.00 0.00 39.78 36.47 1q3g n ASN 350 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1q3g s THR 351 N -3.29 0.05 -0.16 5.53 -4.23 -0.93 -0.92 115.64 111.69 1q3g s THR 351 Ca 0.57 -0.41 -0.03 0.00 -1.18 0.00 0.00 61.69 60.63 1q3g s THR 351 Cb 0.48 -0.23 -0.02 0.00 1.34 0.00 0.00 72.50 74.06 1q3g s THR 351 CO 0.11 -0.23 -0.04 0.68 -0.54 0.00 0.00 174.62 174.60 1q3g s VAL 352 N -0.71 3.77 -0.33 2.29 -7.23 0.57 -1.23 120.40 117.53 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 34.23 1q3g s VAL 352 CO 0.00 0.48 0.51 -0.63 -0.31 0.00 0.00 175.10 175.15 1q3g s ILE 353 N 0.52 5.03 -0.13 -0.62 -1.09 0.48 -1.87 121.20 123.52 1q3g s ILE 353 Ca -0.04 0.44 -0.05 0.00 -2.23 0.00 0.00 60.65 58.77 1q3g s ILE 353 Cb -0.14 -3.93 -0.04 0.00 -1.58 0.00 0.00 42.46 36.77 1q3g s ILE 353 CO 0.03 -0.15 0.07 0.00 -1.23 0.00 0.00 174.94 173.66 1q3g s HIS 355 N -0.50 2.88 0.42 0.00 3.76 -0.13 -1.17 115.29 120.55 1q3g s HIS 355 Ca 0.10 -2.97 -0.24 0.00 -0.15 0.00 0.00 55.06 51.81 1q3g s HIS 355 Cb -0.12 -2.57 -0.11 0.00 1.11 0.00 0.00 32.58 30.88 1q3g s HIS 355 CO 0.02 -0.76 0.84 0.41 -0.85 0.00 0.00 174.74 174.40 1q3g n GLY 356 N 3.27 -0.68 3.41 -2.22 0.00 -0.95 -4.10 105.19 103.92 1q3g n GLY 356 Ca 0.06 0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 1q3g n GLY 356 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1q3g s VAL 357 N -1.34 2.12 0.08 1.61 -7.23 -0.44 -4.72 120.40 110.48 1q3g s VAL 357 Ca 0.64 -2.28 -0.35 0.00 -1.81 0.00 0.00 61.98 58.18 1q3g s VAL 357 Cb -0.58 -2.15 -0.17 0.00 0.56 0.00 0.00 36.38 34.04 1q3g s VAL 357 CO 0.57 -0.46 1.58 -0.08 -0.31 0.00 0.00 175.10 176.39 1q3g h GLU 358 N 2.50 -0.97 -4.33 4.82 4.57 -1.89 -3.40 114.58 115.88 1q3g h GLU 358 Ca -0.40 0.07 -0.17 0.00 -1.18 0.00 0.00 59.36 57.68 1q3g h GLU 358 Cb 1.24 0.22 -0.17 0.00 -0.16 0.00 0.00 28.75 29.88 1q3g h GLU 358 CO 0.60 -0.65 -0.69 0.15 -1.18 0.00 0.00 179.01 177.24 1q3g s LYS 359 N -5.93 0.61 0.16 1.92 -0.14 -1.26 -5.00 119.74 110.09 1q3g s LYS 359 Ca -0.18 -1.10 0.05 0.00 -1.36 0.00 0.00 55.97 53.37 1q3g s LYS 359 Cb 0.04 0.04 -0.04 0.00 -1.68 0.00 0.00 37.83 36.20 1q3g s LYS 359 CO 0.61 -0.06 0.14 -0.51 -0.76 0.00 0.00 175.35 174.77 1q3g s LEU 360 N -2.58 3.82 -0.14 3.17 1.43 -1.26 -4.91 118.68 118.20 1q3g s LEU 360 Ca 0.03 -0.11 -0.03 0.00 -1.03 0.00 0.00 54.13 52.98 1q3g s LEU 360 Cb 0.03 -2.43 -0.03 0.00 0.03 0.00 0.00 46.19 43.78 1q3g s LEU 360 CO -0.06 0.07 -0.03 -0.44 0.23 0.00 0.00 176.35 176.13 1q3g s SER 361 N -3.06 4.91 0.53 2.29 0.01 0.62 0.14 113.70 119.14 1q3g s SER 361 Ca 0.31 -0.07 -0.22 0.00 1.31 0.00 0.00 55.95 57.28 1q3g s SER 361 Cb -0.10 -1.71 -0.06 0.00 0.21 0.00 0.00 66.02 64.36 1q3g s SER 361 CO 0.23 0.21 1.30 0.61 0.41 0.00 0.00 173.24 176.01 1q3g n GLY 362 N 3.26 0.61 3.81 3.44 0.00 -0.09 -4.44 105.19 111.78 1q3g n GLY 362 Ca -0.17 0.03 -0.03 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.30 -1.61 -0.32 4.61 0.00 -1.03 -4.77 121.76 117.34 1q3g s ALA 363 Ca 0.70 -0.10 -0.22 0.00 0.00 0.00 0.00 51.96 52.35 1q3g s ALA 363 Cb -0.43 0.69 -0.00 0.00 0.00 0.00 0.00 23.12 23.37 1q3g s ALA 363 CO 0.50 -1.05 0.70 -0.65 0.00 0.00 0.00 175.76 175.26 1q3g s GLN 364 N -2.69 3.85 0.30 0.00 -0.21 -1.26 -1.90 119.66 117.76 1q3g s GLN 364 Ca 0.17 0.33 0.08 0.00 0.02 0.00 0.00 55.36 55.96 1q3g s GLN 364 Cb -0.02 -3.76 -0.06 0.00 1.00 0.00 0.00 33.01 30.18 1q3g s GLN 364 CO 0.04 -0.68 -0.08 0.14 -2.12 0.00 0.00 175.29 172.59 1q3g s VAL 365 N 2.81 1.93 -0.13 1.09 -7.23 -0.28 -4.96 120.40 113.62 1q3g s VAL 365 Ca 0.28 -2.17 0.02 0.00 -1.81 0.00 0.00 61.98 58.30 1q3g s VAL 365 Cb -0.14 -2.52 0.01 0.00 0.56 0.00 0.00 36.38 34.29 1q3g s VAL 365 CO 0.13 -0.27 -0.19 -0.32 -0.31 0.00 0.00 175.10 174.14 1q3g s MET 366 N -3.67 2.69 0.29 4.82 1.75 -1.26 -1.24 119.30 122.69 1q3g s MET 366 Ca 0.31 -0.73 -0.29 0.00 -1.25 0.00 0.00 55.69 53.72 1q3g s MET 366 Cb 0.03 -2.23 -0.10 0.00 2.84 0.00 0.00 34.83 35.37 1q3g s MET 366 CO 0.14 -0.06 1.27 0.00 -0.65 0.00 0.00 175.02 175.72 1q3g s ALA 367 N 0.95 3.49 -0.02 4.11 0.00 -0.70 -4.92 121.76 124.67 1q3g s ALA 367 Ca -0.05 1.16 0.04 0.00 0.00 0.00 0.00 51.96 53.10 1q3g s ALA 367 Cb -0.15 -3.45 -0.06 0.00 0.00 0.00 0.00 23.12 19.46 1q3g s ALA 367 CO -0.03 -0.52 0.10 0.25 0.00 0.00 0.00 175.76 175.55 1q3g n THR 368 N 1.30 0.00 -3.83 0.00 -2.24 -1.26 -4.83 114.28 103.42 1q3g n THR 368 Ca 0.01 -0.12 -0.07 0.00 -2.27 0.00 0.00 64.05 61.60 1q3g n THR 368 Cb 0.43 0.46 -0.01 0.00 -2.10 0.00 0.00 70.33 69.11 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 -2.37 -0.18 0.06 3.42 1.47 -1.26 -4.95 116.67 112.87 1q3g s ASP 369 Ca -0.01 -0.70 -0.19 0.00 1.18 0.00 0.00 52.55 52.83 1q3g s ASP 369 Cb 0.03 0.71 -0.07 0.00 -0.34 0.00 0.00 42.92 43.25 1q3g s ASP 369 CO 0.17 -1.35 1.30 0.25 0.68 0.00 0.00 175.17 176.22 1q3g h LEU 370 N 2.00 -0.94 -1.19 2.11 5.85 -1.99 -0.56 115.31 120.59 1q3g h LEU 370 Ca -0.23 0.11 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 1q3g h LEU 370 Cb 1.25 0.37 -0.01 0.00 0.37 0.00 0.00 40.66 42.63 1q3g h LEU 370 CO 0.28 -0.27 -0.35 0.03 -0.34 0.00 0.00 178.44 177.79 1q3g h ARG 371 N -0.32 0.09 -0.41 1.25 2.47 -1.92 -2.87 114.38 112.67 1q3g h ARG 371 Ca 0.02 -0.04 -0.06 0.00 -1.26 0.00 0.00 59.98 58.64 1q3g h ARG 371 Cb 0.38 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.67 1q3g h ARG 371 CO -0.24 0.44 0.01 0.00 0.56 0.00 0.00 179.97 180.75 1q3g h ALA 372 N 1.56 0.56 -0.60 0.04 0.00 -1.91 -1.55 119.26 117.36 1q3g h ALA 372 Ca 0.01 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.72 1q3g h ALA 372 Cb 0.66 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 1q3g h ALA 372 CO 0.05 0.33 0.32 0.66 0.00 0.00 0.00 179.25 180.61 1q3g h SER 373 N 0.56 0.48 -0.58 0.00 4.64 -0.89 0.20 113.55 117.96 1q3g h SER 373 Ca 0.12 0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.42 1q3g h SER 373 Cb 0.46 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.46 1q3g h SER 373 CO 0.02 0.32 0.19 0.00 -0.87 0.00 0.00 176.83 176.48 1q3g h ALA 374 N 1.32 1.17 -0.50 5.18 0.00 -1.32 -0.89 119.26 124.22 1q3g h ALA 374 Ca 0.27 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 1q3g h ALA 374 Cb 0.16 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1q3g h ALA 374 CO -0.17 0.58 0.13 0.77 0.00 0.00 0.00 179.25 180.56 1q3g h SER 375 N 0.91 0.75 0.09 0.00 0.02 -0.09 -1.39 113.55 113.84 1q3g h SER 375 Ca 0.20 -0.23 -0.09 0.00 -0.84 0.00 0.00 61.79 60.84 1q3g h SER 375 Cb 0.27 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1q3g h SER 375 CO -0.01 0.78 -0.28 -0.07 -1.14 0.00 0.00 176.83 176.11 1q3g h LEU 376 N 0.68 0.31 -0.31 5.07 3.38 -0.28 -0.84 115.31 123.32 1q3g h LEU 376 Ca 0.16 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 1q3g h LEU 376 Cb 0.32 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1q3g h LEU 376 CO 0.00 0.59 -0.19 0.58 0.09 0.00 0.00 178.44 179.51 1q3g h VAL 377 N 0.27 1.29 -0.55 1.22 2.07 -0.84 -1.60 116.25 118.10 1q3g h VAL 377 Ca 0.04 -1.31 -0.04 0.00 0.82 0.00 0.00 66.70 66.21 1q3g h VAL 377 Cb 0.65 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 1q3g h VAL 377 CO 0.05 0.42 0.19 -0.07 0.02 0.00 0.00 177.57 178.18 1q3g h LEU 378 N 0.44 0.75 -0.49 2.57 3.38 -1.01 -2.19 115.31 118.76 1q3g h LEU 378 Ca 0.06 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1q3g h LEU 378 Cb 0.73 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1q3g h LEU 378 CO 0.05 0.70 0.31 0.00 0.09 0.00 0.00 178.44 179.60 1q3g h ALA 379 N 1.40 0.62 -0.65 1.53 0.00 -0.92 -1.65 119.26 119.59 1q3g h ALA 379 Ca 0.19 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.07 1q3g h ALA 379 Cb 0.21 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1q3g h ALA 379 CO -0.01 0.09 0.43 0.78 0.00 0.00 0.00 179.25 180.53 1q3g h GLY 380 N 0.66 0.89 1.41 0.00 0.00 -0.71 0.15 103.07 105.46 1q3g h GLY 380 Ca 0.18 -0.31 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 1q3g h GLY 380 CO -0.04 0.28 0.16 0.00 0.00 0.00 0.00 176.54 176.95 1q3g n ILE 382 N -4.31 0.00 -1.62 0.00 -5.35 -0.89 -0.75 119.36 106.42 1q3g n ILE 382 Ca 0.04 -0.31 -0.31 0.00 -0.27 0.00 0.00 62.75 61.90 1q3g n ILE 382 Cb 0.19 1.21 0.06 0.00 -1.74 0.00 0.00 39.64 39.36 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 -2.05 2.61 -0.46 -1.28 0.00 0.46 -4.56 121.76 116.48 1q3g s ALA 383 Ca 0.15 -0.07 -0.24 0.00 0.00 0.00 0.00 51.96 51.80 1q3g s ALA 383 Cb 0.14 -3.13 0.03 0.00 0.00 0.00 0.00 23.12 20.16 1q3g s ALA 383 CO 0.45 -1.32 0.85 -2.00 0.00 0.00 0.00 175.76 173.73 1q3g s GLU 384 N -5.12 3.45 0.00 0.00 2.56 0.37 -1.86 118.70 118.10 1q3g s GLU 384 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 54.97 55.56 1q3g s GLU 384 Cb -0.14 -3.94 0.00 0.00 2.00 0.00 0.00 34.13 32.06 1q3g s GLU 384 CO 0.54 -1.17 0.00 0.41 -0.56 0.00 0.00 175.26 174.49 1q3g n GLY 385 N 4.97 0.14 3.61 -1.50 0.00 -0.60 -0.92 105.19 110.89 1q3g n GLY 385 Ca 0.04 -1.93 -0.34 0.00 0.00 0.00 0.00 46.02 43.78 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 4.62 -0.02 2.61 2.01 -1.26 -0.18 115.64 123.41 1q3g s THR 386 Ca 0.00 -0.09 0.07 0.00 0.31 0.00 0.00 61.69 61.98 1q3g s THR 386 Cb 0.00 -3.07 -0.02 0.00 0.01 0.00 0.00 72.50 69.42 1q3g s THR 386 CO 0.00 0.47 -0.24 -0.89 -0.69 0.00 0.00 174.62 173.26 1q3g s THR 387 N 0.38 2.19 -0.23 -0.82 2.01 0.11 -2.47 115.64 116.82 1q3g s THR 387 Ca 0.02 -1.06 0.02 0.00 0.31 0.00 0.00 61.69 60.98 1q3g s THR 387 Cb -0.13 -1.77 0.05 0.00 0.01 0.00 0.00 72.50 70.66 1q3g s THR 387 CO 0.01 0.58 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.72 1q3g s VAL 388 N -0.63 1.85 -0.47 3.82 1.01 -0.80 -0.12 120.40 125.05 1q3g s VAL 388 Ca 0.10 -1.26 -0.17 0.00 0.00 0.00 0.00 61.98 60.65 1q3g s VAL 388 Cb -0.10 -1.94 0.06 0.00 0.00 0.00 0.00 36.38 34.40 1q3g s VAL 388 CO -0.01 0.08 0.46 -0.69 0.00 0.00 0.00 175.10 174.95 1q3g s VAL 389 N 1.28 5.11 0.50 2.92 1.01 -0.04 -1.13 120.40 130.06 1q3g s VAL 389 Ca -0.04 -0.79 -0.17 0.00 0.00 0.00 0.00 61.98 60.98 1q3g s VAL 389 Cb -0.18 -4.15 -0.08 0.00 0.00 0.00 0.00 36.38 31.97 1q3g s VAL 389 CO -0.07 -0.61 0.98 -0.62 0.00 0.00 0.00 175.10 174.78 1q3g s ASP 390 N 2.48 6.63 -1.11 3.32 2.15 -0.37 -1.61 116.67 128.15 1q3g s ASP 390 Ca 0.08 1.61 -0.06 0.00 0.43 0.00 0.00 52.55 54.61 1q3g s ASP 390 Cb -0.22 -2.52 0.01 0.00 -0.30 0.00 0.00 42.92 39.89 1q3g s ASP 390 CO 0.09 -0.58 0.96 0.54 -0.17 0.00 0.00 175.17 176.01 1q3g n ARG 391 N -1.43 -6.44 0.00 4.34 1.74 -1.14 -1.71 116.66 112.01 1q3g n ARG 391 Ca 0.07 0.70 0.08 0.00 -0.77 0.00 0.00 57.85 57.93 1q3g n ARG 391 Cb 0.54 -5.34 0.46 0.00 -1.02 0.00 0.00 32.46 27.10 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 -4.38 0.00 0.04 0.55 -6.64 -1.20 -2.87 119.36 104.86 1q3g n ILE 392 Ca -0.05 0.00 0.14 0.00 -1.77 0.00 0.00 62.75 61.06 1q3g n ILE 392 Cb 0.57 -0.65 0.60 0.00 -1.44 0.00 0.00 39.64 38.73 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 0.17 -0.79 4.28 -0.00 -1.90 0.14 116.97 118.86 1q3g h TYR 393 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 58.73 58.86 1q3g h TYR 393 Cb 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 36.73 36.59 1q3g h TYR 393 CO 0.00 0.08 0.40 0.45 -0.00 0.00 0.00 178.16 179.09 1q3g h HIS 394 N 0.16 0.71 0.00 0.10 3.86 -1.88 -0.82 115.15 117.28 1q3g h HIS 394 Ca 0.19 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.39 1q3g h HIS 394 Cb 0.55 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 1q3g h HIS 394 CO -0.00 0.21 -0.23 0.97 0.86 0.00 0.00 177.93 179.74 1q3g h ILE 395 N 0.62 0.98 0.00 2.45 2.10 -0.98 -2.14 117.51 120.54 1q3g h ILE 395 Ca 0.41 -0.85 0.00 0.00 1.08 0.00 0.00 64.86 65.51 1q3g h ILE 395 Cb 0.52 1.48 0.00 0.00 -1.09 0.00 0.00 36.82 37.73 1q3g h ILE 395 CO -0.32 0.23 0.00 0.47 -1.08 0.00 0.00 178.15 177.44 1q3g n ASP 396 N -3.99 0.44 -0.11 2.19 8.00 -0.32 -1.86 116.55 120.90 1q3g n ASP 396 Ca -0.02 0.60 -0.12 0.00 0.71 0.00 0.00 54.79 55.96 1q3g n ASP 396 Cb 0.31 -0.70 -0.03 0.00 -0.02 0.00 0.00 41.12 40.68 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 0.71 0.00 -1.24 2.43 -1.37 -2.32 114.38 112.59 1q3g h ARG 397 Ca 0.00 -0.33 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 1q3g h ARG 397 Cb 0.35 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1q3g h ARG 397 CO 0.00 0.94 0.00 0.41 -1.51 0.00 0.00 179.97 179.81 1q3g n GLY 398 N 0.03 0.25 2.98 2.80 0.00 -1.16 -3.93 105.19 106.17 1q3g n GLY 398 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 1q3g n GLY 398 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1q3g s TYR 399 N -0.40 1.99 -0.31 1.61 1.51 -0.78 -4.89 117.35 116.08 1q3g s TYR 399 Ca 0.00 -1.12 -0.29 0.00 -1.01 0.00 0.00 57.07 54.64 1q3g s TYR 399 Cb 0.00 -1.49 0.01 0.00 -0.11 0.00 0.00 41.96 40.37 1q3g s TYR 399 CO 0.00 -0.63 1.17 -2.00 -1.11 0.00 0.00 175.55 172.98 1q3g s GLU 400 N 1.54 4.01 -1.15 -0.62 2.12 -1.26 -4.15 118.70 119.20 1q3g s GLU 400 Ca 0.04 1.15 -0.33 0.00 0.36 0.00 0.00 54.97 56.19 1q3g s GLU 400 Cb -0.13 -3.80 0.05 0.00 0.26 0.00 0.00 34.13 30.51 1q3g s GLU 400 CO -0.10 -0.99 0.65 2.89 -0.54 0.00 0.00 175.26 177.17 1q3g n ARG 401 N 7.05 -0.26 0.18 4.30 1.85 -1.26 -4.84 116.66 123.68 1q3g n ARG 401 Ca 0.13 0.05 0.02 0.00 -1.00 0.00 0.00 57.85 57.05 1q3g n ARG 401 Cb 0.47 -2.26 0.35 0.00 -1.05 0.00 0.00 32.46 29.96 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 -2.35 1.26 -0.72 8.89 2.10 -1.95 -2.62 117.51 122.12 1q3g h ILE 402 Ca -0.68 -1.36 0.01 0.00 1.08 0.00 0.00 64.86 63.91 1q3g h ILE 402 Cb 1.34 1.74 -0.04 0.00 -1.09 0.00 0.00 36.82 38.78 1q3g h ILE 402 CO 0.49 0.39 0.47 -0.08 -1.08 0.00 0.00 178.15 178.34 1q3g h GLU 403 N 0.00 0.93 -0.07 2.19 4.81 -1.94 0.49 114.58 120.99 1q3g h GLU 403 Ca -0.00 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.09 1q3g h GLU 403 Cb 0.71 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1q3g h GLU 403 CO 0.05 0.62 -0.25 -0.44 -0.73 0.00 0.00 179.01 178.26 1q3g h ASP 404 N 0.96 0.35 -0.83 1.04 3.45 -1.88 -2.26 116.42 117.25 1q3g h ASP 404 Ca 0.27 -0.62 -0.01 0.00 0.43 0.00 0.00 57.03 57.10 1q3g h ASP 404 Cb -0.09 -0.10 -0.04 0.00 -0.56 0.00 0.00 39.33 38.54 1q3g h ASP 404 CO -0.07 0.91 0.49 0.11 -1.57 0.00 0.00 179.24 179.11 1q3g h LYS 405 N -0.19 1.13 -0.42 3.56 1.57 -1.34 -0.66 116.57 120.22 1q3g h LYS 405 Ca -0.01 -0.11 -0.11 0.00 -1.87 0.00 0.00 60.65 58.55 1q3g h LYS 405 Cb 0.88 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 1q3g h LYS 405 CO 0.05 0.80 -0.18 -0.07 -0.57 0.00 0.00 179.45 179.48 1q3g h LEU 406 N 1.14 0.89 -0.45 2.94 3.38 -0.96 -2.98 115.31 119.25 1q3g h LEU 406 Ca 0.30 -0.40 0.02 0.00 0.09 0.00 0.00 57.88 57.88 1q3g h LEU 406 Cb -0.03 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 1q3g h LEU 406 CO -0.05 1.09 0.28 -0.09 0.09 0.00 0.00 178.44 179.75 1q3g h ARG 407 N 0.68 0.55 0.00 1.13 2.43 -1.08 -0.05 114.38 118.04 1q3g h ARG 407 Ca 0.10 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1q3g h ARG 407 Cb 0.74 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 1q3g h ARG 407 CO 0.06 0.36 0.00 0.00 -1.51 0.00 0.00 179.97 178.88 1q3g n ALA 408 N -2.25 1.18 0.36 2.80 0.00 -0.28 -0.11 120.51 122.21 1q3g n ALA 408 Ca 0.02 -0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.54 1q3g n ALA 408 Cb 0.05 -1.03 0.13 0.00 0.00 0.00 0.00 19.45 18.60 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 -1.40 2.74 0.00 0.00 4.77 -0.10 -4.73 117.00 118.29 1q3g n LEU 409 Ca 0.01 -1.35 0.00 0.00 -0.03 0.00 0.00 56.01 54.63 1q3g n LEU 409 Cb 0.02 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 1q3g n LEU 409 CO 0.02 0.57 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 1q3g n GLY 410 N 0.97 0.98 3.79 -0.72 0.00 0.85 -0.81 105.19 110.24 1q3g n GLY 410 Ca 0.12 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 3.01 -0.74 4.61 0.00 -0.81 -4.83 121.76 121.00 1q3g s ALA 411 Ca 0.00 0.61 -0.08 0.00 0.00 0.00 0.00 51.96 52.50 1q3g s ALA 411 Cb 0.00 -3.24 0.19 0.00 0.00 0.00 0.00 23.12 20.07 1q3g s ALA 411 CO 0.00 -0.17 0.61 1.21 0.00 0.00 0.00 175.76 177.41 1q3g s ASN 412 N -1.81 5.95 0.00 0.00 3.84 -1.26 -4.46 114.94 117.20 1q3g s ASN 412 Ca 0.61 -2.87 0.03 0.00 0.21 0.00 0.00 52.86 50.84 1q3g s ASN 412 Cb -0.18 -2.01 -0.01 0.00 -0.55 0.00 0.00 41.25 38.50 1q3g s ASN 412 CO 0.22 -0.44 -0.09 -0.51 -2.79 0.00 0.00 177.10 173.50 1q3g s ILE 413 N -0.09 0.67 -0.10 -5.21 2.07 -1.26 -1.05 121.20 116.23 1q3g s ILE 413 Ca 0.18 -0.50 -0.05 0.00 -1.41 0.00 0.00 60.65 58.88 1q3g s ILE 413 Cb -0.15 -0.59 0.05 0.00 0.13 0.00 0.00 42.46 41.89 1q3g s ILE 413 CO -0.06 0.10 0.24 -1.83 -1.91 0.00 0.00 174.94 171.48 1q3g s GLU 414 N -0.45 0.20 0.25 3.50 -1.05 -0.85 -4.99 118.70 115.32 1q3g s GLU 414 Ca 0.01 0.52 -0.30 0.00 -0.15 0.00 0.00 54.97 55.05 1q3g s GLU 414 Cb -0.04 -0.12 -0.09 0.00 -0.44 0.00 0.00 34.13 33.44 1q3g s GLU 414 CO -0.00 -0.16 0.99 0.50 0.95 0.00 0.00 175.26 177.54 1q3g s ARG 415 N 1.22 4.79 0.40 -4.83 3.52 -1.26 -0.81 118.95 121.98 1q3g s ARG 415 Ca -0.09 1.58 0.04 0.00 -0.13 0.00 0.00 55.73 57.12 1q3g s ARG 415 Cb -0.10 -3.26 -0.03 0.00 -1.56 0.00 0.00 34.95 30.00 1q3g s ARG 415 CO -0.08 0.42 0.11 0.14 -0.81 0.00 0.00 175.30 175.08 1q3g s VAL 416 N -1.13 0.74 0.05 7.11 -7.23 0.15 -4.92 120.40 115.18 1q3g s VAL 416 Ca 0.42 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.60 1q3g s VAL 416 Cb -0.28 -2.43 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 1q3g s VAL 416 CO 0.34 0.00 0.13 -0.54 -0.31 0.00 0.00 175.10 174.72 1q3g s LYS 417 N -3.76 3.13 0.33 4.82 -0.14 -1.26 -1.04 119.74 121.81 1q3g s LYS 417 Ca 0.25 -0.55 -0.20 0.00 -1.36 0.00 0.00 55.97 54.12 1q3g s LYS 417 Cb 0.04 -2.87 -0.14 0.00 -1.68 0.00 0.00 37.83 33.17 1q3g s LYS 417 CO 0.14 0.60 0.15 0.41 -0.76 0.00 0.00 175.35 175.89 1q3g n GLY 418 N 0.58 -2.28 3.40 -3.33 0.00 -0.21 -4.83 105.19 98.54 1q3g n GLY 418 Ca -0.09 0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1q3g n GLY 418 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50