#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 0.22 -4.05 6.12 9.92 -1.26 -4.62 116.55 122.88 1q3g n ASP 2 Ca 0.00 0.75 -0.10 0.00 -0.53 0.00 0.00 54.79 54.92 1q3g n ASP 2 Cb 0.00 -1.34 -0.08 0.00 -0.64 0.00 0.00 41.12 39.06 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 -2.71 1.10 -0.15 -1.24 1.02 0.72 -2.94 119.74 115.55 1q3g s LYS 3 Ca 0.74 -1.32 0.00 0.00 0.02 0.00 0.00 55.97 55.42 1q3g s LYS 3 Cb -0.41 0.33 -0.00 0.00 -0.52 0.00 0.00 37.83 37.22 1q3g s LYS 3 CO 0.49 -0.38 -0.15 -0.06 -0.92 0.00 0.00 175.35 174.33 1q3g s PHE 4 N -4.02 2.77 -0.31 3.18 2.99 -0.76 -0.59 117.98 121.25 1q3g s PHE 4 Ca 0.22 -0.95 -0.09 0.00 0.00 0.00 0.00 56.93 56.12 1q3g s PHE 4 Cb 0.05 -1.87 -0.00 0.00 0.00 0.00 0.00 43.02 41.20 1q3g s PHE 4 CO 0.02 -0.41 0.13 0.50 -0.00 0.00 0.00 175.22 175.46 1q3g s ARG 5 N 0.69 3.26 -0.08 0.44 3.52 0.05 -0.81 118.95 126.01 1q3g s ARG 5 Ca -0.07 -0.76 0.03 0.00 -0.13 0.00 0.00 55.73 54.79 1q3g s ARG 5 Cb -0.16 -3.50 -0.02 0.00 -1.56 0.00 0.00 34.95 29.71 1q3g s ARG 5 CO 0.02 -0.42 -0.16 0.08 -0.81 0.00 0.00 175.30 174.00 1q3g s VAL 6 N 1.58 2.81 -0.17 7.11 1.01 0.12 -1.74 120.40 131.12 1q3g s VAL 6 Ca 0.04 -0.78 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 1q3g s VAL 6 Cb -0.17 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 1q3g s VAL 6 CO 0.05 0.56 -0.05 -1.10 0.00 0.00 0.00 175.10 174.56 1q3g s GLN 7 N -0.16 3.57 0.35 2.72 -1.52 -0.15 0.09 119.66 124.57 1q3g s GLN 7 Ca -0.01 -0.56 0.05 0.00 -1.95 0.00 0.00 55.36 52.88 1q3g s GLN 7 Cb -0.14 -2.91 -0.03 0.00 -0.22 0.00 0.00 33.01 29.72 1q3g s GLN 7 CO 0.03 0.13 0.20 0.20 -0.25 0.00 0.00 175.29 175.61 1q3g s GLY 8 N 0.64 2.37 0.34 3.09 0.00 0.69 -4.23 107.32 110.23 1q3g s GLY 8 Ca -0.03 -1.70 -0.16 0.00 0.00 0.00 0.00 44.72 42.83 1q3g s GLY 8 CO 0.02 -1.62 0.77 2.56 0.00 0.00 0.00 173.10 174.84 1q3g s PRO 9 N -3.62 4.03 -0.06 2.90 0.04 -0.72 -1.31 135.00 136.27 1q3g s PRO 9 Ca 0.34 0.74 -0.03 0.00 0.04 0.00 0.00 61.00 62.09 1q3g s PRO 9 Cb 0.03 -2.39 0.03 0.00 0.04 0.00 0.00 34.50 32.21 1q3g s PRO 9 CO 0.21 0.12 0.12 0.95 0.04 0.00 0.00 177.00 178.44 1q3g s THR 10 N -2.03 -0.04 0.07 1.26 -4.23 0.26 -4.99 115.64 105.94 1q3g s THR 10 Ca 0.55 0.15 -0.30 0.00 -1.18 0.00 0.00 61.69 60.91 1q3g s THR 10 Cb -0.10 -0.21 -0.06 0.00 1.34 0.00 0.00 72.50 73.48 1q3g s THR 10 CO 0.17 0.06 1.15 -0.60 -0.54 0.00 0.00 174.62 174.86 1q3g s ARG 11 N 0.95 4.48 -0.23 3.99 3.52 -1.26 -4.59 118.95 125.80 1q3g s ARG 11 Ca -0.07 1.71 -0.15 0.00 -0.13 0.00 0.00 55.73 57.08 1q3g s ARG 11 Cb -0.10 -3.35 -0.04 0.00 -1.56 0.00 0.00 34.95 29.90 1q3g s ARG 11 CO -0.04 -0.17 0.39 -0.51 -0.81 0.00 0.00 175.30 174.15 1q3g s LEU 12 N 0.83 4.11 0.12 -0.88 1.43 -1.26 -4.57 118.68 118.46 1q3g s LEU 12 Ca 0.56 0.43 -0.25 0.00 -1.03 0.00 0.00 54.13 53.85 1q3g s LEU 12 Cb -0.28 -2.48 0.08 0.00 0.03 0.00 0.00 46.19 43.54 1q3g s LEU 12 CO 0.30 -0.12 0.68 0.00 0.23 0.00 0.00 176.35 177.45 1q3g s GLN 13 N 1.58 1.16 0.00 1.70 -2.07 0.16 -3.81 119.66 118.39 1q3g s GLN 13 Ca 0.17 -0.44 0.00 0.00 -1.82 0.00 0.00 55.36 53.28 1q3g s GLN 13 Cb -0.15 0.53 0.00 0.00 -1.09 0.00 0.00 33.01 32.30 1q3g s GLN 13 CO 0.08 -0.51 0.00 0.41 -1.32 0.00 0.00 175.29 173.95 1q3g n GLY 14 N -0.34 0.17 3.19 2.60 0.00 -0.27 -4.32 105.19 106.22 1q3g n GLY 14 Ca -0.14 -1.57 -0.13 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.36 0.89 -0.07 1.61 2.02 -1.26 -1.65 118.70 119.87 1q3g s GLU 15 Ca 0.00 -1.28 -0.15 0.00 0.02 0.00 0.00 54.97 53.57 1q3g s GLU 15 Cb 0.00 -0.45 0.03 0.00 0.10 0.00 0.00 34.13 33.81 1q3g s GLU 15 CO 0.00 0.05 0.36 0.54 0.02 0.00 0.00 175.26 176.23 1q3g s VAL 16 N -3.00 0.03 -0.24 2.63 0.11 -0.87 -4.82 120.40 114.24 1q3g s VAL 16 Ca 0.10 -0.24 -0.06 0.00 -2.93 0.00 0.00 61.98 58.85 1q3g s VAL 16 Cb 0.01 -0.60 -0.02 0.00 -1.53 0.00 0.00 36.38 34.24 1q3g s VAL 16 CO -0.01 -0.13 0.04 -0.89 -3.33 0.00 0.00 175.10 170.77 1q3g s THR 17 N -0.64 4.02 0.19 5.04 2.01 -1.26 -0.42 115.64 124.58 1q3g s THR 17 Ca -0.07 -0.29 -0.30 0.00 0.31 0.00 0.00 61.69 61.33 1q3g s THR 17 Cb -0.04 -2.88 -0.08 0.00 0.01 0.00 0.00 72.50 69.51 1q3g s THR 17 CO 0.03 0.35 1.29 -0.63 -0.69 0.00 0.00 174.62 174.97 1q3g s ILE 18 N 1.57 3.31 0.84 1.82 -1.09 -0.17 -4.94 121.20 122.54 1q3g s ILE 18 Ca 0.06 1.07 -0.10 0.00 -2.23 0.00 0.00 60.65 59.46 1q3g s ILE 18 Cb -0.15 -3.68 0.15 0.00 -1.58 0.00 0.00 42.46 37.19 1q3g s ILE 18 CO 0.02 0.16 1.16 -0.44 -1.23 0.00 0.00 174.94 174.61 1q3g s SER 19 N 0.35 3.87 0.60 3.58 0.01 -1.26 -4.82 113.70 116.03 1q3g s SER 19 Ca 0.56 0.15 -0.19 0.00 1.31 0.00 0.00 55.95 57.79 1q3g s SER 19 Cb -0.35 -0.43 -0.03 0.00 0.21 0.00 0.00 66.02 65.41 1q3g s SER 19 CO 0.37 -2.22 1.22 -0.83 0.41 0.00 0.00 173.24 172.19 1q3g s GLY 20 N -4.76 2.75 0.01 3.44 0.00 -1.21 -1.67 107.32 105.89 1q3g s GLY 20 Ca 0.68 1.03 -0.30 0.00 0.00 0.00 0.00 44.72 46.14 1q3g s GLY 20 CO 0.49 1.43 1.74 0.00 0.00 0.00 0.00 173.10 176.76 1q3g s ALA 21 N -1.57 3.63 0.18 3.20 0.00 0.58 -4.31 121.76 123.47 1q3g s ALA 21 Ca 0.78 1.14 -0.13 0.00 0.00 0.00 0.00 51.96 53.74 1q3g s ALA 21 Cb -0.31 -3.76 0.11 0.00 0.00 0.00 0.00 23.12 19.16 1q3g s ALA 21 CO 0.34 -1.35 1.81 -0.22 0.00 0.00 0.00 175.76 176.34 1q3g h LYS 22 N 9.42 0.57 -0.21 0.00 3.64 -1.90 -0.74 116.57 127.36 1q3g h LYS 22 Ca -0.43 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1q3g h LYS 22 Cb 1.20 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1q3g h LYS 22 CO 0.94 0.38 0.00 0.09 -2.27 0.00 0.00 179.45 178.59 1q3g n ASN 23 N -4.82 0.27 -0.02 4.20 3.02 -1.26 -1.89 115.26 114.76 1q3g n ASN 23 Ca 0.04 -2.00 -0.03 0.00 -0.03 0.00 0.00 54.58 52.55 1q3g n ASN 23 Cb 0.09 -0.11 -0.02 0.00 -0.61 0.00 0.00 39.78 39.14 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 -0.37 1.95 -0.10 5.41 0.00 -0.89 -4.52 120.51 121.99 1q3g n ALA 24 Ca 0.00 -0.18 -0.10 0.00 0.00 0.00 0.00 53.44 53.17 1q3g n ALA 24 Cb 0.06 0.40 -0.02 0.00 0.00 0.00 0.00 19.45 19.89 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 0.42 0.40 0.00 0.00 -1.06 -2.03 119.26 116.98 1q3g h ALA 25 Ca -0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1q3g h ALA 25 Cb 1.15 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1q3g h ALA 25 CO -0.02 0.00 -0.29 -0.07 0.00 0.00 0.00 179.25 178.87 1q3g h LEU 26 N 0.38 -0.76 -1.47 0.00 3.38 -1.62 0.14 115.31 115.36 1q3g h LEU 26 Ca 0.11 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1q3g h LEU 26 Cb 0.16 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1q3g h LEU 26 CO -0.01 -0.45 -0.15 1.55 0.09 0.00 0.00 178.44 179.48 1q3g h PRO 27 N -0.69 0.17 -0.34 1.13 0.13 -1.79 -2.40 132.00 128.22 1q3g h PRO 27 Ca -0.04 -0.04 -0.17 0.00 -0.87 0.00 0.00 66.00 64.89 1q3g h PRO 27 Cb 0.59 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.69 1q3g h PRO 27 CO 0.01 0.32 -0.45 0.82 -0.23 0.00 0.00 178.00 178.47 1q3g h ILE 28 N 0.16 1.28 -0.80 -3.56 2.04 -1.08 -0.99 117.51 114.55 1q3g h ILE 28 Ca 0.03 -1.63 -0.03 0.00 1.00 0.00 0.00 64.86 64.24 1q3g h ILE 28 Cb 0.36 1.49 -0.04 0.00 -0.74 0.00 0.00 36.82 37.89 1q3g h ILE 28 CO 0.02 0.54 0.39 -0.07 0.00 0.00 0.00 178.15 179.03 1q3g h LEU 29 N 0.70 1.04 -0.62 1.44 3.38 -0.36 -1.40 115.31 119.50 1q3g h LEU 29 Ca 0.04 -0.13 -0.15 0.00 0.09 0.00 0.00 57.88 57.73 1q3g h LEU 29 Cb 1.04 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 1q3g h LEU 29 CO 0.10 0.88 -0.60 -0.26 0.09 0.00 0.00 178.44 178.65 1q3g h PHE 30 N 1.13 0.39 0.00 1.13 -1.00 -1.37 -2.66 116.94 114.56 1q3g h PHE 30 Ca 0.28 -0.15 -0.03 0.00 2.81 0.00 0.00 57.97 60.88 1q3g h PHE 30 Cb 0.11 -0.07 -0.00 0.00 3.61 0.00 0.00 35.95 39.59 1q3g h PHE 30 CO 0.01 0.83 -0.13 0.00 -1.61 0.00 0.00 178.31 177.41 1q3g h ALA 31 N 1.14 1.55 0.00 2.45 0.00 -0.56 -1.62 119.26 122.22 1q3g h ALA 31 Ca -0.01 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1q3g h ALA 31 Cb 1.12 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1q3g h ALA 31 CO 0.10 0.16 -0.00 0.00 0.00 0.00 0.00 179.25 179.50 1q3g h ALA 32 N 1.87 1.07 0.00 0.00 0.00 -0.90 -0.70 119.26 120.61 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 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1q3g h ALA 32 CO 0.02 0.01 0.00 -0.07 0.00 0.00 0.00 179.25 179.20 1q3g h LEU 33 N 0.00 0.00 0.00 0.00 3.38 -1.42 0.53 115.31 117.79 1q3g h LEU 33 Ca -0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1q3g h LEU 33 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1q3g h LEU 33 CO 0.00 0.00 -0.66 -0.07 0.09 0.00 0.00 178.44 177.80 1q3g h LEU 34 N 0.00 0.00 -9.54 1.67 3.38 -1.33 -3.47 115.31 106.02 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 0.00 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.76 1q3g h LEU 34 CO 0.00 0.22 0.59 0.00 0.09 0.00 0.00 178.44 179.35 1q3g s ALA 35 N -3.14 3.44 -0.55 1.53 0.00 0.17 -4.27 121.76 118.95 1q3g s ALA 35 Ca 0.02 0.93 0.23 0.00 0.00 0.00 0.00 51.96 53.15 1q3g s ALA 35 Cb 0.08 -3.46 0.10 0.00 0.00 0.00 0.00 23.12 19.84 1q3g s ALA 35 CO 0.75 -0.46 1.08 0.39 0.00 0.00 0.00 175.76 177.52 1q3g n GLU 36 N 3.56 0.34 -4.56 0.00 1.02 -0.50 -4.15 120.64 116.35 1q3g n GLU 36 Ca 0.08 0.03 -0.27 0.00 -0.02 0.00 0.00 57.16 56.98 1q3g n GLU 36 Cb 0.45 -1.64 -0.11 0.00 -0.02 0.00 0.00 31.44 30.12 1q3g n GLU 36 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1q3g s GLU 37 N -3.22 1.92 0.12 3.49 2.02 -0.92 -4.17 118.70 117.93 1q3g s GLU 37 Ca 0.03 -2.02 -0.35 0.00 0.02 0.00 0.00 54.97 52.65 1q3g s GLU 37 Cb 0.13 -1.69 -0.16 0.00 0.10 0.00 0.00 34.13 32.51 1q3g s GLU 37 CO 0.78 0.03 1.27 -2.30 0.02 0.00 0.00 175.26 175.06 1q3g n PRO 38 N -0.91 1.14 -5.07 0.39 -0.02 -1.26 -4.31 135.00 124.96 1q3g n PRO 38 Ca -0.05 0.41 -0.29 0.00 -2.02 0.00 0.00 63.50 61.55 1q3g n PRO 38 Cb 0.65 -2.00 -0.16 0.00 -0.02 0.00 0.00 33.50 31.98 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 0.23 1.75 -0.17 -1.45 1.01 0.11 -1.62 120.40 120.26 1q3g s VAL 39 Ca 0.80 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.88 1q3g s VAL 39 Cb -0.92 -1.48 0.03 0.00 0.00 0.00 0.00 36.38 34.01 1q3g s VAL 39 CO 0.49 0.49 -0.12 -0.70 0.00 0.00 0.00 175.10 175.26 1q3g s GLU 40 N -0.20 2.15 -0.34 2.72 2.12 0.03 0.32 118.70 125.50 1q3g s GLU 40 Ca -0.00 -0.70 -0.09 0.00 0.36 0.00 0.00 54.97 54.55 1q3g s GLU 40 Cb -0.11 -2.25 0.02 0.00 0.26 0.00 0.00 34.13 32.04 1q3g s GLU 40 CO 0.02 -0.33 0.14 0.42 -0.54 0.00 0.00 175.26 174.97 1q3g s ILE 41 N 1.45 4.25 0.45 -3.70 1.01 -0.44 -1.33 121.20 122.89 1q3g s ILE 41 Ca 0.02 -0.81 -0.04 0.00 0.00 0.00 0.00 60.65 59.81 1q3g s ILE 41 Cb -0.14 -3.31 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 1q3g s ILE 41 CO -0.09 -0.10 0.74 -1.10 0.00 0.00 0.00 174.94 174.38 1q3g s GLN 42 N 1.52 3.54 -1.41 2.79 -0.21 0.96 -0.80 119.66 126.04 1q3g s GLN 42 Ca 0.02 0.11 -0.08 0.00 0.02 0.00 0.00 55.36 55.43 1q3g s GLN 42 Cb -0.18 -2.43 0.01 0.00 1.00 0.00 0.00 33.01 31.40 1q3g s GLN 42 CO 0.05 -0.13 1.03 -1.71 -2.12 0.00 0.00 175.29 172.41 1q3g n ASN 43 N -2.11 -6.33 -4.66 5.90 5.15 -1.02 -1.23 115.26 110.95 1q3g n ASN 43 Ca -0.00 -0.47 -0.41 0.00 -0.60 0.00 0.00 54.58 53.10 1q3g n ASN 43 Cb 0.55 -5.01 -0.05 0.00 -0.53 0.00 0.00 39.78 34.74 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 -3.28 4.92 0.67 3.44 1.01 -0.42 -3.29 120.40 123.45 1q3g s VAL 44 Ca 0.51 1.45 -0.16 0.00 0.00 0.00 0.00 61.98 63.78 1q3g s VAL 44 Cb -0.22 -4.06 0.01 0.00 0.00 0.00 0.00 36.38 32.10 1q3g s VAL 44 CO 0.63 0.03 1.17 -2.16 0.00 0.00 0.00 175.10 174.77 1q3g s PRO 45 N 2.26 2.60 -0.81 2.72 0.04 -1.26 -4.78 135.00 135.76 1q3g s PRO 45 Ca 0.34 1.64 -0.18 0.00 0.04 0.00 0.00 61.00 62.84 1q3g s PRO 45 Cb -0.16 -1.90 0.14 0.00 0.04 0.00 0.00 34.50 32.62 1q3g s PRO 45 CO 0.10 -1.46 0.93 0.15 0.04 0.00 0.00 177.00 176.76 1q3g s LYS 46 N -3.81 3.45 0.18 4.56 1.02 -1.26 -4.87 119.74 119.01 1q3g s LYS 46 Ca 0.72 -1.80 0.08 0.00 0.02 0.00 0.00 55.97 54.99 1q3g s LYS 46 Cb -0.26 -4.60 -0.04 0.00 -0.52 0.00 0.00 37.83 32.40 1q3g s LYS 46 CO 0.40 -1.60 -0.15 -0.51 -0.92 0.00 0.00 175.35 172.58 1q3g s LEU 47 N 2.09 2.51 0.27 3.17 1.43 -1.26 -4.55 118.68 122.34 1q3g s LEU 47 Ca 0.23 -0.96 -0.01 0.00 -1.03 0.00 0.00 54.13 52.37 1q3g s LEU 47 Cb -0.11 -0.68 0.47 0.00 0.03 0.00 0.00 46.19 45.90 1q3g s LEU 47 CO -0.05 -0.14 1.86 0.50 0.23 0.00 0.00 176.35 178.75 1q3g h LYS 48 N 2.85 1.05 -0.01 1.70 3.11 -1.55 -0.94 116.57 122.77 1q3g h LYS 48 Ca -0.39 -0.06 -0.06 0.00 -2.81 0.00 0.00 60.65 57.32 1q3g h LYS 48 Cb 1.21 -0.24 -0.01 0.00 -1.00 0.00 0.00 32.23 32.20 1q3g h LYS 48 CO 0.58 0.69 -0.30 -0.44 -2.81 0.00 0.00 179.45 177.17 1q3g h ASP 49 N 1.08 0.02 0.09 4.20 3.32 -1.83 -1.59 116.42 121.69 1q3g h ASP 49 Ca 0.46 -0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.37 1q3g h ASP 49 Cb 0.33 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 1q3g h ASP 49 CO -0.22 0.32 -0.49 0.40 -1.72 0.00 0.00 179.24 177.53 1q3g h ILE 50 N 0.02 1.32 -0.22 0.35 1.08 -1.50 -0.92 117.51 117.63 1q3g h ILE 50 Ca -0.00 -1.71 -0.03 0.00 -0.39 0.00 0.00 64.86 62.73 1q3g h ILE 50 Cb 0.54 1.72 -0.01 0.00 -3.07 0.00 0.00 36.82 36.01 1q3g h ILE 50 CO 0.04 0.53 0.03 0.44 -0.69 0.00 0.00 178.15 178.50 1q3g h ASP 51 N 0.37 0.36 -0.87 1.72 3.32 -0.96 -0.90 116.42 119.47 1q3g h ASP 51 Ca 0.02 -0.27 -0.02 0.00 0.02 0.00 0.00 57.03 56.78 1q3g h ASP 51 Cb 0.99 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 40.40 1q3g h ASP 51 CO 0.09 0.54 0.47 0.74 -1.72 0.00 0.00 179.24 179.36 1q3g h THR 52 N 0.17 1.25 -0.34 0.35 2.02 -1.20 0.21 112.91 115.37 1q3g h THR 52 Ca 0.07 -0.63 -0.02 0.00 0.77 0.00 0.00 66.41 66.59 1q3g h THR 52 Cb 0.34 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 1q3g h THR 52 CO 0.01 0.28 0.12 0.74 0.37 0.00 0.00 175.52 177.04 1q3g h THR 53 N 1.21 1.20 -0.73 3.16 2.02 -1.01 -0.05 112.91 118.71 1q3g h THR 53 Ca 0.30 -0.63 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 1q3g h THR 53 Cb 0.03 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 1q3g h THR 53 CO -0.05 0.22 0.36 0.24 0.37 0.00 0.00 175.52 176.66 1q3g h MET 54 N 0.40 1.04 0.14 6.66 2.07 -0.67 0.13 114.93 124.70 1q3g h MET 54 Ca 0.11 -0.14 -0.00 0.00 -2.07 0.00 0.00 59.70 57.60 1q3g h MET 54 Cb 0.22 -0.19 -0.00 0.00 -1.87 0.00 0.00 31.60 29.75 1q3g h MET 54 CO -0.01 0.80 -0.10 -0.22 1.07 0.00 0.00 176.91 178.45 1q3g h LYS 55 N 1.03 -0.23 -0.14 1.72 3.64 -0.03 -0.39 116.57 122.17 1q3g h LYS 55 Ca 0.25 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.65 1q3g h LYS 55 Cb 0.09 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1q3g h LYS 55 CO -0.03 -0.16 0.09 1.25 -2.27 0.00 0.00 179.45 178.33 1q3g h LEU 56 N -0.24 0.17 -0.28 5.20 6.46 -0.49 -1.31 115.31 124.82 1q3g h LEU 56 Ca -0.01 -0.03 0.05 0.00 -0.12 0.00 0.00 57.88 57.77 1q3g h LEU 56 Cb 0.21 -0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 40.05 1q3g h LEU 56 CO 0.00 0.15 0.00 -0.07 -0.62 0.00 0.00 178.44 177.91 1q3g h LEU 57 N 0.17 -0.10 -0.87 2.25 3.38 -0.60 -1.61 115.31 117.93 1q3g h LEU 57 Ca 0.05 0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.15 1q3g h LEU 57 Cb 0.01 0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 1q3g h LEU 57 CO -0.01 -0.02 0.54 0.74 0.09 0.00 0.00 178.44 179.78 1q3g h THR 58 N 0.09 1.04 0.00 0.22 2.02 -0.85 0.09 112.91 115.53 1q3g h THR 58 Ca 0.14 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1q3g h THR 58 Cb 0.18 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.56 1q3g h THR 58 CO -0.22 0.18 0.00 -0.61 0.37 0.00 0.00 175.52 175.24 1q3g h GLN 59 N 0.98 0.00 -0.01 6.66 4.15 -0.32 -0.20 115.11 126.37 1q3g h GLN 59 Ca 0.38 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.80 1q3g h GLN 59 Cb 0.18 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.87 1q3g h GLN 59 CO -0.18 0.00 -0.17 1.28 -1.93 0.00 0.00 178.83 177.83 1q3g n LEU 60 N -2.61 1.31 0.00 -2.39 4.77 -0.04 -4.73 117.00 113.31 1q3g n LEU 60 Ca -0.00 -0.40 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 1q3g n LEU 60 Cb 0.16 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1q3g n LEU 60 CO 0.19 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 1q3g n GLY 61 N 1.29 1.39 3.90 -0.72 0.00 -0.09 -1.75 105.19 109.21 1q3g n GLY 61 Ca 0.14 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 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 5.26 -0.39 2.61 2.01 -0.86 -4.32 115.64 117.96 1q3g s THR 62 Ca 0.00 -0.08 -0.16 0.00 0.31 0.00 0.00 61.69 61.76 1q3g s THR 62 Cb 0.00 -3.62 0.01 0.00 0.01 0.00 0.00 72.50 68.90 1q3g s THR 62 CO 0.00 0.13 0.38 -0.54 -0.69 0.00 0.00 174.62 173.90 1q3g s LYS 63 N -2.45 3.25 -0.01 4.92 1.02 -0.65 -4.12 119.74 121.70 1q3g s LYS 63 Ca 0.37 -0.68 0.05 0.00 0.02 0.00 0.00 55.97 55.73 1q3g s LYS 63 Cb -0.13 -3.91 -0.01 0.00 -0.52 0.00 0.00 37.83 33.26 1q3g s LYS 63 CO 0.24 -0.71 -0.17 0.08 -0.92 0.00 0.00 175.35 173.88 1q3g s VAL 64 N 2.00 1.32 -0.09 3.17 1.01 -1.26 -1.38 120.40 125.17 1q3g s VAL 64 Ca 0.10 -0.72 -0.28 0.00 0.00 0.00 0.00 61.98 61.08 1q3g s VAL 64 Cb -0.17 -1.10 0.07 0.00 0.00 0.00 0.00 36.38 35.18 1q3g s VAL 64 CO 0.12 0.37 0.66 -1.83 0.00 0.00 0.00 175.10 174.42 1q3g s GLU 65 N -0.41 0.98 0.33 2.72 -1.05 -0.92 -5.01 118.70 115.34 1q3g s GLU 65 Ca 0.06 0.39 0.07 0.00 -0.15 0.00 0.00 54.97 55.34 1q3g s GLU 65 Cb -0.06 0.46 -0.03 0.00 -0.44 0.00 0.00 34.13 34.06 1q3g s GLU 65 CO -0.01 -0.27 0.29 -0.98 0.95 0.00 0.00 175.26 175.24 1q3g s ARG 66 N -0.85 1.77 0.00 -4.83 1.70 -1.26 0.29 118.95 115.77 1q3g s ARG 66 Ca -0.09 -2.02 0.00 0.00 -0.47 0.00 0.00 55.73 53.16 1q3g s ARG 66 Cb -0.01 0.33 0.00 0.00 -0.57 0.00 0.00 34.95 34.70 1q3g s ARG 66 CO 0.08 -0.66 0.00 -0.40 -1.08 0.00 0.00 175.30 173.24 1q3g n ASP 67 N -1.56 0.00 0.10 -2.89 5.68 -1.26 -5.00 116.55 111.61 1q3g n ASP 67 Ca 0.07 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.48 1q3g n ASP 67 Cb 0.62 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.61 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 4.53 -1.44 3.80 6.12 0.00 -1.26 -5.08 105.19 111.85 1q3g n GLY 68 Ca 0.00 -0.25 -0.23 0.00 0.00 0.00 0.00 46.02 45.55 1q3g n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1q3g s SER 69 N -5.19 4.70 -0.17 1.61 0.01 -1.26 -1.30 113.70 112.11 1q3g s SER 69 Ca 0.00 -0.93 0.01 0.00 1.31 0.00 0.00 55.95 56.34 1q3g s SER 69 Cb 0.10 -0.53 0.03 0.00 0.21 0.00 0.00 66.02 65.83 1q3g s SER 69 CO 0.79 -0.58 -0.13 -0.69 0.41 0.00 0.00 173.24 173.04 1q3g s VAL 70 N -2.54 1.60 -0.21 3.43 1.01 0.02 -4.38 120.40 119.33 1q3g s VAL 70 Ca 0.44 -0.76 -0.15 0.00 0.00 0.00 0.00 61.98 61.50 1q3g s VAL 70 Cb 0.01 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 1q3g s VAL 70 CO 0.25 0.36 0.38 0.26 0.00 0.00 0.00 175.10 176.35 1q3g s TRP 71 N 1.45 3.36 -0.04 5.22 0.51 0.15 -1.33 118.94 128.26 1q3g s TRP 71 Ca 0.03 0.57 0.07 0.00 -2.12 0.00 0.00 56.10 54.65 1q3g s TRP 71 Cb -0.14 -2.52 -0.02 0.00 -0.81 0.00 0.00 33.47 29.99 1q3g s TRP 71 CO -0.10 -0.03 -0.23 0.42 -0.51 0.00 0.00 176.95 176.50 1q3g s ILE 72 N 1.37 2.25 -0.36 2.03 -1.09 0.15 -2.16 121.20 123.39 1q3g s ILE 72 Ca 0.18 -1.02 -0.00 0.00 -2.23 0.00 0.00 60.65 57.58 1q3g s ILE 72 Cb -0.15 -1.81 0.12 0.00 -1.58 0.00 0.00 42.46 39.05 1q3g s ILE 72 CO 0.08 0.58 0.18 -0.62 -1.23 0.00 0.00 174.94 173.93 1q3g s ASP 73 N -0.49 3.45 -0.39 3.58 3.68 -0.48 0.06 116.67 126.09 1q3g s ASP 73 Ca 0.06 -2.06 0.06 0.00 2.13 0.00 0.00 52.55 52.74 1q3g s ASP 73 Cb -0.11 -0.65 0.57 0.00 -1.45 0.00 0.00 42.92 41.28 1q3g s ASP 73 CO 0.01 -0.34 1.69 0.00 0.13 0.00 0.00 175.17 176.66 1q3g n ALA 74 N 4.25 5.06 0.09 3.66 0.00 -1.26 -1.63 120.51 130.67 1q3g n ALA 74 Ca 0.06 -3.09 0.04 0.00 0.00 0.00 0.00 53.44 50.45 1q3g n ALA 74 Cb 0.38 -1.10 0.46 0.00 0.00 0.00 0.00 19.45 19.19 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 1.10 0.30 -4.10 0.00 4.64 -1.73 -3.41 113.55 110.35 1q3g h SER 75 Ca 0.44 -0.02 -0.69 0.00 -0.47 0.00 0.00 61.79 61.04 1q3g h SER 75 Cb 2.13 -0.08 -0.28 0.00 -0.31 0.00 0.00 62.40 63.87 1q3g h SER 75 CO 0.80 0.28 -0.84 0.21 -0.87 0.00 0.00 176.83 176.41 1q3g s ASN 76 N -6.83 3.45 -0.24 4.97 3.04 -1.26 -5.00 114.94 113.06 1q3g s ASN 76 Ca -0.07 -0.39 -0.04 0.00 0.04 0.00 0.00 52.86 52.41 1q3g s ASN 76 Cb 0.17 -0.79 0.08 0.00 -1.54 0.00 0.00 41.25 39.17 1q3g s ASN 76 CO 0.72 0.29 0.11 -0.69 -3.04 0.00 0.00 177.10 174.48 1q3g s VAL 77 N -0.40 0.02 -0.38 -5.21 1.01 -1.26 -4.19 120.40 110.00 1q3g s VAL 77 Ca 0.04 -0.58 0.11 0.00 0.00 0.00 0.00 61.98 61.55 1q3g s VAL 77 Cb -0.12 -0.89 0.67 0.00 0.00 0.00 0.00 36.38 36.04 1q3g s VAL 77 CO 0.02 -0.54 1.55 -0.46 0.00 0.00 0.00 175.10 175.67 1q3g n ASN 78 N 5.22 4.82 -3.64 3.32 2.04 -0.71 -4.89 115.26 121.42 1q3g n ASN 78 Ca -0.06 -2.81 -0.10 0.00 -0.44 0.00 0.00 54.58 51.17 1q3g n ASN 78 Cb 0.45 -0.66 -0.07 0.00 -2.53 0.00 0.00 39.78 36.96 1q3g n ASN 78 CO 0.00 0.00 0.00 0.21 -0.44 0.00 0.00 177.26 177.03 1q3g s ASN 79 N -0.66 -0.62 -0.26 0.53 2.47 -0.99 -4.91 114.94 110.51 1q3g s ASN 79 Ca 0.45 1.16 0.10 0.00 0.42 0.00 0.00 52.86 54.99 1q3g s ASN 79 Cb 0.35 1.19 0.46 0.00 -1.45 0.00 0.00 41.25 41.79 1q3g s ASN 79 CO 0.13 -0.20 1.19 0.49 -3.72 0.00 0.00 177.10 174.99 1q3g n PHE 80 N 2.72 1.92 -3.96 0.43 3.72 -1.26 -4.64 117.46 116.39 1q3g n PHE 80 Ca -0.14 -2.00 -0.16 0.00 -0.05 0.00 0.00 57.45 55.09 1q3g n PHE 80 Cb 0.56 -0.30 -0.16 0.00 -0.94 0.00 0.00 39.48 38.64 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 -3.49 0.41 -0.38 4.37 0.15 -1.26 -1.15 113.70 112.34 1q3g s SER 81 Ca 0.45 -0.03 -0.13 0.00 0.70 0.00 0.00 55.95 56.94 1q3g s SER 81 Cb 0.39 -0.19 0.02 0.00 -1.71 0.00 0.00 66.02 64.53 1q3g s SER 81 CO 0.00 -0.07 0.24 0.00 1.20 0.00 0.00 173.24 174.61 1q3g s ALA 82 N 0.76 3.38 0.55 5.45 0.00 -0.25 -4.90 121.76 126.76 1q3g s ALA 82 Ca -0.08 -1.66 -0.17 0.00 0.00 0.00 0.00 51.96 50.05 1q3g s ALA 82 Cb -0.11 -2.70 -0.05 0.00 0.00 0.00 0.00 23.12 20.26 1q3g s ALA 82 CO -0.01 -1.34 1.05 -1.25 0.00 0.00 0.00 175.76 174.21 1q3g s PRO 83 N 1.62 3.49 0.10 0.00 0.04 -1.26 -1.77 135.00 137.22 1q3g s PRO 83 Ca 0.04 1.27 -0.24 0.00 0.04 0.00 0.00 61.00 62.11 1q3g s PRO 83 Cb -0.19 -2.05 -0.07 0.00 0.04 0.00 0.00 34.50 32.22 1q3g s PRO 83 CO 0.08 -0.68 1.40 -0.92 0.04 0.00 0.00 177.00 176.92 1q3g h TYR 84 N 0.85 -1.27 0.00 0.56 3.20 -1.96 0.93 116.97 119.27 1q3g h TYR 84 Ca -0.48 0.07 0.00 0.00 3.14 0.00 0.00 58.73 61.46 1q3g h TYR 84 Cb 1.22 0.61 0.00 0.00 1.54 0.00 0.00 36.73 40.10 1q3g h TYR 84 CO 0.58 -0.34 0.18 -0.40 -1.64 0.00 0.00 178.16 176.54 1q3g n ASP 85 N -4.64 0.26 -0.13 -2.11 5.75 -1.26 -0.34 116.55 114.07 1q3g n ASP 85 Ca -0.02 0.53 -0.27 0.00 -0.01 0.00 0.00 54.79 55.02 1q3g n ASP 85 Cb 0.23 -0.52 -0.11 0.00 -1.03 0.00 0.00 41.12 39.70 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 -1.85 2.19 0.26 -2.12 0.00 0.16 -4.39 117.00 111.26 1q3g n LEU 86 Ca -0.01 0.23 0.16 0.00 0.00 0.00 0.00 56.01 56.40 1q3g n LEU 86 Cb 0.20 -0.85 0.60 0.00 0.00 0.00 0.00 43.42 43.36 1q3g n LEU 86 CO 0.05 0.65 0.95 -0.37 0.00 0.00 0.00 177.39 178.66 1q3g h VAL 87 N -0.76 0.07 0.00 1.96 -1.51 -0.39 -2.20 116.25 113.43 1q3g h VAL 87 Ca -0.66 -0.65 0.00 0.00 -1.23 0.00 0.00 66.70 64.16 1q3g h VAL 87 Cb 1.67 1.60 0.00 0.00 -2.13 0.00 0.00 31.29 32.44 1q3g h VAL 87 CO -0.33 0.03 0.00 2.29 -1.23 0.00 0.00 177.57 178.32 1q3g n LYS 88 N -3.13 0.17 -0.00 5.19 2.85 0.53 -1.52 118.16 122.25 1q3g n LYS 88 Ca 0.01 0.45 0.09 0.00 -1.05 0.00 0.00 58.31 57.81 1q3g n LYS 88 Cb 0.35 -1.86 -0.11 0.00 -0.65 0.00 0.00 35.03 32.76 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 -2.19 0.00 -3.15 0.58 -2.24 -0.83 -4.85 114.28 101.60 1q3g n THR 89 Ca 0.02 -0.07 0.04 0.00 -2.27 0.00 0.00 64.05 61.77 1q3g n THR 89 Cb 0.19 0.97 -0.00 0.00 -2.10 0.00 0.00 70.33 69.39 1q3g n THR 89 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1q3g s MET 90 N -2.80 0.52 0.17 -0.78 -2.45 -0.57 -5.02 119.30 108.37 1q3g s MET 90 Ca 0.07 0.56 0.18 0.00 -1.25 0.00 0.00 55.69 55.25 1q3g s MET 90 Cb 0.14 0.27 0.81 0.00 1.25 0.00 0.00 34.83 37.30 1q3g s MET 90 CO 0.78 -0.91 1.55 2.89 1.05 0.00 0.00 175.02 180.38 1q3g n ARG 91 N 5.39 0.11 0.00 4.11 1.85 -1.18 -1.99 116.66 124.95 1q3g n ARG 91 Ca 0.05 0.43 0.07 0.00 -1.00 0.00 0.00 57.85 57.39 1q3g n ARG 91 Cb 0.54 -1.75 0.32 0.00 -1.05 0.00 0.00 32.46 30.52 1q3g n ARG 91 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1q3g n ALA 92 N -1.67 1.69 0.31 2.89 0.00 -1.26 -2.29 120.51 120.17 1q3g n ALA 92 Ca 0.02 -0.05 0.20 0.00 0.00 0.00 0.00 53.44 53.60 1q3g n ALA 92 Cb 0.15 -1.23 1.06 0.00 0.00 0.00 0.00 19.45 19.44 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 -0.09 0.00 0.02 -1.75 -1.43 113.55 110.30 1q3g h SER 93 Ca 0.00 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1q3g h SER 93 Cb 0.21 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.74 1q3g h SER 93 CO 0.00 0.00 0.12 -0.29 -1.14 0.00 0.00 176.83 175.52 1q3g h ILE 94 N 0.00 0.42 0.00 3.27 6.09 -1.72 -0.83 117.51 124.74 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 0.06 0.90 0.00 0.00 0.47 0.00 0.00 36.82 38.25 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 -3.71 0.00 0.05 2.19 8.01 -0.54 -2.36 117.44 121.08 1q3g n TRP 95 Ca -0.01 0.00 -0.05 0.00 -1.31 0.00 0.00 57.50 56.13 1q3g n TRP 95 Cb 0.22 -0.18 -0.10 0.00 -2.01 0.00 0.00 31.31 29.23 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 2.70 0.51 -0.14 6.99 0.00 -1.38 -3.37 119.26 124.58 1q3g h ALA 96 Ca 0.00 -0.94 0.04 0.00 0.00 0.00 0.00 54.91 54.01 1q3g h ALA 96 Cb 0.08 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 1q3g h ALA 96 CO 0.00 1.19 -0.14 1.25 0.00 0.00 0.00 179.25 181.56 1q3g h LEU 97 N 0.00 -0.43 0.41 0.00 5.85 -1.66 -2.19 115.31 117.29 1q3g h LEU 97 Ca -0.07 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1q3g h LEU 97 Cb 1.74 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 42.96 1q3g h LEU 97 CO 0.10 -0.18 -0.52 1.23 -0.34 0.00 0.00 178.44 178.73 1q3g h GLY 98 N -0.17 -1.25 0.93 3.75 0.00 -1.76 -1.81 103.07 102.77 1q3g h GLY 98 Ca 0.09 0.61 0.02 0.00 0.00 0.00 0.00 47.33 48.05 1q3g h GLY 98 CO -0.24 -0.35 0.44 -2.55 0.00 0.00 0.00 176.54 173.85 1q3g h PRO 99 N -0.95 0.85 -0.15 4.80 0.11 -1.74 -1.14 132.00 133.78 1q3g h PRO 99 Ca -0.05 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 66.03 1q3g h PRO 99 Cb 0.86 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 1q3g h PRO 99 CO -0.12 0.56 0.01 -0.07 -0.21 0.00 0.00 178.00 178.17 1q3g h LEU 100 N 0.88 -0.04 -0.73 2.35 3.38 -1.29 0.13 115.31 119.98 1q3g h LEU 100 Ca 0.26 0.03 -0.12 0.00 0.09 0.00 0.00 57.88 58.14 1q3g h LEU 100 Cb -0.04 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1q3g h LEU 100 CO -0.08 0.00 -0.36 1.62 0.09 0.00 0.00 178.44 179.71 1q3g h VAL 101 N 0.06 1.29 -0.12 1.22 3.04 -1.10 0.23 116.25 120.87 1q3g h VAL 101 Ca 0.07 -1.49 -0.13 0.00 -1.01 0.00 0.00 66.70 64.14 1q3g h VAL 101 Cb 0.08 1.49 -0.01 0.00 -2.01 0.00 0.00 31.29 30.84 1q3g h VAL 101 CO -0.11 0.47 -0.48 0.00 -1.01 0.00 0.00 177.57 176.44 1q3g h ALA 102 N 1.14 0.95 0.01 3.17 0.00 -0.85 -0.71 119.26 122.98 1q3g h ALA 102 Ca 0.05 -0.47 -0.37 0.00 0.00 0.00 0.00 54.91 54.12 1q3g h ALA 102 Cb 0.84 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 1q3g h ALA 102 CO 0.07 0.65 -2.35 -2.13 0.00 0.00 0.00 179.25 175.49 1q3g n ARG 103 N -3.97 0.67 -0.08 0.00 0.63 0.00 -4.60 116.66 109.32 1q3g n ARG 103 Ca -0.02 0.11 0.05 0.00 -0.92 0.00 0.00 57.85 57.07 1q3g n ARG 103 Cb 0.54 -1.56 0.09 0.00 0.45 0.00 0.00 32.46 31.98 1q3g n ARG 103 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1q3g n PHE 104 N -3.08 0.20 -0.87 -0.14 3.01 0.81 -4.98 117.46 112.40 1q3g n PHE 104 Ca -0.38 -0.25 0.00 0.00 1.01 0.00 0.00 57.45 57.83 1q3g n PHE 104 Cb 1.06 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.52 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 0.46 0.47 3.49 1.37 0.00 -0.27 -4.94 105.19 105.76 1q3g n GLY 105 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 1q3g n GLY 105 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1q3g s GLN 106 N -0.58 1.35 0.00 1.61 -2.07 -1.24 -1.38 119.66 117.34 1q3g s GLN 106 Ca 0.00 -0.74 0.00 0.00 -1.82 0.00 0.00 55.36 52.80 1q3g s GLN 106 Cb 0.00 0.54 0.00 0.00 -1.09 0.00 0.00 33.01 32.46 1q3g s GLN 106 CO 0.00 -0.58 0.00 0.41 -1.32 0.00 0.00 175.29 173.80 1q3g n GLY 107 N -0.35 1.92 3.18 2.60 0.00 -0.69 -2.67 105.19 109.18 1q3g n GLY 107 Ca -0.12 -0.39 -0.12 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.00 0.33 -0.01 1.61 -2.07 -0.30 -0.66 119.66 116.55 1q3g s GLN 108 Ca 0.00 0.57 0.04 0.00 -1.82 0.00 0.00 55.36 54.15 1q3g s GLN 108 Cb 0.00 0.03 -0.01 0.00 -1.09 0.00 0.00 33.01 31.94 1q3g s GLN 108 CO 0.00 -0.11 -0.12 0.08 -1.32 0.00 0.00 175.29 173.81 1q3g s VAL 109 N 0.86 0.98 0.15 3.63 1.01 -0.71 -1.08 120.40 125.24 1q3g s VAL 109 Ca -0.06 -0.54 -0.31 0.00 0.00 0.00 0.00 61.98 61.07 1q3g s VAL 109 Cb -0.07 -0.82 -0.10 0.00 0.00 0.00 0.00 36.38 35.40 1q3g s VAL 109 CO -0.06 0.27 1.62 -0.55 0.00 0.00 0.00 175.10 176.38 1q3g s SER 110 N -0.30 6.54 -0.13 3.32 0.15 -0.73 -0.57 113.70 121.99 1q3g s SER 110 Ca 0.05 2.65 -0.29 0.00 0.70 0.00 0.00 55.95 59.05 1q3g s SER 110 Cb -0.05 -2.59 -0.06 0.00 -1.71 0.00 0.00 66.02 61.62 1q3g s SER 110 CO -0.00 -0.87 1.96 -0.22 1.20 0.00 0.00 173.24 175.30 1q3g s LEU 111 N 1.48 3.94 0.41 3.45 0.20 0.83 -4.83 118.68 124.15 1q3g s LEU 111 Ca 0.72 2.10 -0.26 0.00 0.69 0.00 0.00 54.13 57.38 1q3g s LEU 111 Cb -0.44 -3.52 -0.09 0.00 -0.43 0.00 0.00 46.19 41.70 1q3g s LEU 111 CO 0.32 -1.43 1.38 -2.16 -0.29 0.00 0.00 176.35 174.17 1q3g s PRO 112 N 5.18 3.95 0.00 0.98 0.04 -1.26 -4.97 135.00 138.92 1q3g s PRO 112 Ca 0.88 2.33 0.00 0.00 0.04 0.00 0.00 61.00 64.25 1q3g s PRO 112 Cb -0.34 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 31.40 1q3g s PRO 112 CO 0.36 -0.57 0.00 0.41 0.04 0.00 0.00 177.00 177.23 1q3g n GLY 113 N 0.61 0.45 3.81 0.56 0.00 -1.26 -4.99 105.19 104.37 1q3g n GLY 113 Ca 0.03 -1.66 -0.32 0.00 0.00 0.00 0.00 46.02 44.08 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 -0.53 1.88 0.36 -0.02 0.00 -1.26 -4.89 107.32 102.86 1q3g s GLY 114 Ca 0.00 0.24 0.08 0.00 0.00 0.00 0.00 44.72 45.05 1q3g s GLY 114 CO 0.00 0.56 0.07 0.00 0.00 0.00 0.00 173.10 173.73 1q3g h ALA 116 N 1.68 0.50 -0.00 0.00 0.00 -1.96 -3.09 119.26 116.39 1q3g h ALA 116 Ca -0.43 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1q3g h ALA 116 Cb 1.25 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1q3g h ALA 116 CO 0.68 0.01 -0.05 0.44 0.00 0.00 0.00 179.25 180.34 1q3g n ILE 117 N -4.75 0.00 0.00 0.00 -5.35 -1.26 -4.83 119.36 103.17 1q3g n ILE 117 Ca 0.00 -0.06 0.00 0.00 -0.27 0.00 0.00 62.75 62.42 1q3g n ILE 117 Cb 0.07 -0.17 0.00 0.00 -1.74 0.00 0.00 39.64 37.80 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 1.18 2.02 0.24 3.28 0.00 -1.17 -1.71 105.19 109.03 1q3g n GLY 118 Ca 0.18 -0.84 0.07 0.00 0.00 0.00 0.00 46.02 45.43 1q3g n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3g h ALA 119 N 0.00 1.78 -6.81 4.61 0.00 -1.93 -1.91 119.26 115.00 1q3g h ALA 119 Ca 0.00 -0.10 -0.56 0.00 0.00 0.00 0.00 54.91 54.25 1q3g h ALA 119 Cb 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1q3g h ALA 119 CO 0.00 0.14 -1.01 0.54 0.00 0.00 0.00 179.25 178.92 1q3g n ARG 120 N -4.35 -0.58 -0.87 0.00 1.74 -1.26 -4.33 116.66 107.00 1q3g n ARG 120 Ca -0.03 0.25 -0.30 0.00 -0.77 0.00 0.00 57.85 57.00 1q3g n ARG 120 Cb 0.19 -2.69 0.17 0.00 -1.02 0.00 0.00 32.46 29.10 1q3g n ARG 120 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1q3g s PRO 121 N -6.79 0.84 -0.12 5.56 0.04 -1.26 -4.96 135.00 128.31 1q3g s PRO 121 Ca 0.40 1.16 0.17 0.00 0.04 0.00 0.00 61.00 62.77 1q3g s PRO 121 Cb -0.21 -1.74 0.26 0.00 0.04 0.00 0.00 34.50 32.86 1q3g s PRO 121 CO 0.95 -2.62 1.14 1.55 0.04 0.00 0.00 177.00 178.05 1q3g n VAL 122 N -4.19 1.68 -0.29 -0.36 3.14 -1.26 -4.83 118.33 112.22 1q3g n VAL 122 Ca 0.08 -2.04 0.08 0.00 -2.96 0.00 0.00 64.34 59.51 1q3g n VAL 122 Cb 0.53 -0.15 0.24 0.00 -1.06 0.00 0.00 33.84 33.40 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 0.03 0.40 0.20 6.55 2.03 -2.00 -1.25 116.42 122.37 1q3g h ASP 123 Ca -0.00 0.12 -0.05 0.00 -0.73 0.00 0.00 57.03 56.36 1q3g h ASP 123 Cb 1.05 0.07 -0.01 0.00 -0.83 0.00 0.00 39.33 39.61 1q3g h ASP 123 CO 0.00 0.12 -0.22 -0.07 -1.03 0.00 0.00 179.24 178.04 1q3g h LEU 124 N 0.51 0.05 0.14 0.15 3.38 -1.98 0.12 115.31 117.67 1q3g h LEU 124 Ca 0.48 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.43 1q3g h LEU 124 Cb 0.77 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1q3g h LEU 124 CO -0.43 0.28 -0.07 0.45 0.09 0.00 0.00 178.44 178.77 1q3g h HIS 125 N 0.05 -0.17 -0.23 1.13 3.86 -1.56 -0.52 115.15 117.70 1q3g h HIS 125 Ca 0.01 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1q3g h HIS 125 Cb 0.43 0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.95 1q3g h HIS 125 CO 0.00 0.04 0.10 0.82 0.86 0.00 0.00 177.93 179.75 1q3g h ILE 126 N -0.36 1.16 -0.67 2.45 2.04 -1.32 -1.67 117.51 119.13 1q3g h ILE 126 Ca -0.02 -0.48 0.10 0.00 1.00 0.00 0.00 64.86 65.47 1q3g h ILE 126 Cb 0.29 1.04 -0.08 0.00 -0.74 0.00 0.00 36.82 37.34 1q3g h ILE 126 CO 0.03 0.16 0.28 0.15 0.00 0.00 0.00 178.15 178.77 1q3g h PHE 127 N 0.23 0.49 -0.06 1.37 3.57 -0.72 0.28 116.94 122.11 1q3g h PHE 127 Ca 0.08 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 1q3g h PHE 127 Cb 0.16 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 38.78 1q3g h PHE 127 CO -0.01 0.13 0.03 0.78 -2.23 0.00 0.00 178.31 177.00 1q3g h GLY 128 N 0.47 0.09 1.01 2.40 0.00 -0.75 -1.55 103.07 104.74 1q3g h GLY 128 Ca 0.34 -0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.61 1q3g h GLY 128 CO -0.31 0.04 0.44 1.41 0.00 0.00 0.00 176.54 178.12 1q3g h LEU 129 N -0.03 0.96 -1.14 3.11 3.38 -0.77 -1.85 115.31 118.97 1q3g h LEU 129 Ca 0.02 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1q3g h LEU 129 Cb 0.12 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 1q3g h LEU 129 CO -0.00 0.77 0.56 -0.33 0.09 0.00 0.00 178.44 179.53 1q3g h GLU 130 N 1.07 1.14 0.00 1.13 5.08 -0.81 -0.55 114.58 121.64 1q3g h GLU 130 Ca 0.27 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.53 1q3g h GLU 130 Cb 0.01 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.00 1q3g h GLU 130 CO -0.05 0.76 -0.17 0.87 -1.00 0.00 0.00 179.01 179.43 1q3g h LYS 131 N 1.17 0.00 -0.01 2.33 1.79 -0.48 -0.78 116.57 120.58 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 -0.12 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.53 1q3g h LYS 131 CO -0.07 0.17 0.00 1.28 -1.08 0.00 0.00 179.45 179.75 1q3g n LEU 132 N -3.57 1.05 0.00 2.94 4.77 -0.31 -4.70 117.00 117.18 1q3g n LEU 132 Ca -0.01 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.61 1q3g n LEU 132 Cb 0.31 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 1q3g n LEU 132 CO 0.31 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1q3g n GLY 133 N 1.12 0.73 3.79 -0.72 0.00 -0.30 -0.49 105.19 109.31 1q3g n GLY 133 Ca 0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.87 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 2.94 -0.18 4.61 0.00 -0.62 -4.82 121.76 121.69 1q3g s ALA 134 Ca 0.00 0.71 -0.05 0.00 0.00 0.00 0.00 51.96 52.62 1q3g s ALA 134 Cb 0.00 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 1q3g s ALA 134 CO 0.00 -0.38 -0.00 -2.00 0.00 0.00 0.00 175.76 173.38 1q3g s GLU 135 N -2.90 3.69 -0.02 0.00 2.12 0.57 -4.11 118.70 118.06 1q3g s GLU 135 Ca 0.64 -0.49 0.04 0.00 0.36 0.00 0.00 54.97 55.52 1q3g s GLU 135 Cb -0.21 -3.04 -0.01 0.00 0.26 0.00 0.00 34.13 31.13 1q3g s GLU 135 CO 0.26 0.13 -0.14 0.42 -0.54 0.00 0.00 175.26 175.39 1q3g s ILE 136 N 0.68 1.15 0.12 -3.70 1.01 -1.26 -1.38 121.20 117.82 1q3g s ILE 136 Ca -0.00 -0.61 0.03 0.00 0.00 0.00 0.00 60.65 60.07 1q3g s ILE 136 Cb -0.14 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.32 1q3g s ILE 136 CO 0.02 0.33 -0.08 -1.59 0.00 0.00 0.00 174.94 173.61 1q3g s LYS 137 N -0.27 0.95 -0.38 2.79 -2.85 0.11 -4.96 119.74 115.14 1q3g s LYS 137 Ca 0.04 -1.39 -0.02 0.00 -1.00 0.00 0.00 55.97 53.60 1q3g s LYS 137 Cb -0.06 -0.42 0.10 0.00 -2.06 0.00 0.00 37.83 35.38 1q3g s LYS 137 CO -0.00 0.03 0.14 -1.17 0.10 0.00 0.00 175.35 174.45 1q3g s LEU 138 N -3.10 4.93 -0.05 2.77 2.96 -1.26 -0.48 118.68 124.45 1q3g s LEU 138 Ca 0.14 -1.90 0.03 0.00 -0.22 0.00 0.00 54.13 52.19 1q3g s LEU 138 Cb 0.04 -1.78 0.00 0.00 0.50 0.00 0.00 46.19 44.95 1q3g s LEU 138 CO -0.02 -0.47 -0.14 -1.83 -1.32 0.00 0.00 176.35 172.58 1q3g s GLU 139 N 1.13 1.56 -1.46 1.98 -1.05 -0.42 -4.76 118.70 115.67 1q3g s GLU 139 Ca 0.06 -0.47 -0.07 0.00 -0.15 0.00 0.00 54.97 54.34 1q3g s GLU 139 Cb -0.22 -1.34 0.05 0.00 -0.44 0.00 0.00 34.13 32.18 1q3g s GLU 139 CO -0.04 0.14 0.74 -0.85 0.95 0.00 0.00 175.26 176.20 1q3g n GLU 140 N 3.40 -4.49 -0.95 -4.83 0.28 -1.26 -1.51 120.64 111.27 1q3g n GLU 140 Ca -0.20 0.53 0.00 0.00 -0.16 0.00 0.00 57.16 57.33 1q3g n GLU 140 Cb 0.53 -5.12 0.00 0.00 1.43 0.00 0.00 31.44 28.28 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 -1.69 0.47 3.52 -1.84 0.00 -1.26 -5.01 105.19 99.38 1q3g n GLY 141 Ca -0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 1q3g n GLY 141 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1q3g s TYR 142 N -2.17 2.76 -0.38 1.61 1.51 -0.57 -0.12 117.35 119.98 1q3g s TYR 142 Ca 0.00 -0.12 -0.18 0.00 -1.01 0.00 0.00 57.07 55.76 1q3g s TYR 142 Cb 0.00 -1.61 0.01 0.00 -0.11 0.00 0.00 41.96 40.24 1q3g s TYR 142 CO 0.00 0.26 0.49 0.14 -1.11 0.00 0.00 175.55 175.32 1q3g s VAL 143 N -0.83 5.03 -0.22 0.71 -7.23 0.27 -1.30 120.40 116.83 1q3g s VAL 143 Ca 0.13 0.04 -0.07 0.00 -1.81 0.00 0.00 61.98 60.27 1q3g s VAL 143 Cb -0.11 -4.00 -0.03 0.00 0.56 0.00 0.00 36.38 32.80 1q3g s VAL 143 CO 0.03 -0.32 0.06 -0.54 -0.31 0.00 0.00 175.10 174.02 1q3g s LYS 144 N 2.32 3.74 0.07 4.82 1.02 0.36 -1.74 119.74 130.34 1q3g s LYS 144 Ca 0.16 -0.45 0.09 0.00 0.02 0.00 0.00 55.97 55.80 1q3g s LYS 144 Cb -0.16 -3.27 -0.03 0.00 -0.52 0.00 0.00 37.83 33.85 1q3g s LYS 144 CO 0.14 -0.04 -0.24 0.00 -0.92 0.00 0.00 175.35 174.29 1q3g s ALA 145 N 1.20 2.38 0.15 5.17 0.00 0.16 -0.71 121.76 130.11 1q3g s ALA 145 Ca 0.04 -1.32 -0.16 0.00 0.00 0.00 0.00 51.96 50.52 1q3g s ALA 145 Cb -0.14 -0.51 0.03 0.00 0.00 0.00 0.00 23.12 22.50 1q3g s ALA 145 CO 0.03 0.55 0.43 -1.54 0.00 0.00 0.00 175.76 175.23 1q3g s SER 146 N -1.58 -0.23 -0.26 0.00 1.04 -0.48 -1.71 113.70 110.48 1q3g s SER 146 Ca 0.13 -0.39 -0.19 0.00 0.48 0.00 0.00 55.95 55.98 1q3g s SER 146 Cb -0.10 0.50 0.07 0.00 0.10 0.00 0.00 66.02 66.59 1q3g s SER 146 CO 0.04 -0.91 0.67 0.54 0.98 0.00 0.00 173.24 174.57 1q3g s VAL 147 N -3.83 -0.00 -0.53 5.02 0.11 -0.48 -0.31 120.40 120.37 1q3g s VAL 147 Ca 0.05 0.01 -0.27 0.00 -2.93 0.00 0.00 61.98 58.83 1q3g s VAL 147 Cb 0.01 -0.96 0.03 0.00 -1.53 0.00 0.00 36.38 33.93 1q3g s VAL 147 CO -0.09 0.00 1.10 0.20 -3.33 0.00 0.00 175.10 172.99 1q3g s ASN 148 N 1.06 6.49 0.00 3.54 -0.87 -1.26 -4.70 114.94 119.20 1q3g s ASN 148 Ca -0.05 0.15 0.00 0.00 -1.57 0.00 0.00 52.86 51.38 1q3g s ASN 148 Cb -0.05 -2.52 0.00 0.00 -0.02 0.00 0.00 41.25 38.66 1q3g s ASN 148 CO -0.10 -1.32 0.00 0.61 -2.57 0.00 0.00 177.10 173.72 1q3g n GLY 149 N 4.99 -0.81 3.89 0.66 0.00 -1.26 -4.90 105.19 107.75 1q3g n GLY 149 Ca 0.08 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 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 3.05 0.57 1.61 0.52 -1.26 -4.78 118.95 118.67 1q3g s ARG 150 Ca 0.00 0.46 -0.09 0.00 -0.52 0.00 0.00 55.73 55.58 1q3g s ARG 150 Cb 0.00 -2.07 -0.04 0.00 0.52 0.00 0.00 34.95 33.36 1q3g s ARG 150 CO 0.00 -0.87 0.95 -0.51 0.02 0.00 0.00 175.30 174.90 1q3g s LEU 151 N -5.26 3.36 -0.06 2.53 1.43 -1.26 -4.85 118.68 114.56 1q3g s LEU 151 Ca 0.57 1.27 0.03 0.00 -1.03 0.00 0.00 54.13 54.97 1q3g s LEU 151 Cb -0.11 -4.29 -0.02 0.00 0.03 0.00 0.00 46.19 41.80 1q3g s LEU 151 CO 0.51 -0.77 -0.15 -0.54 0.23 0.00 0.00 176.35 175.62 1q3g s LYS 152 N -5.02 2.65 0.59 1.70 1.02 0.35 0.72 119.74 121.75 1q3g s LYS 152 Ca 0.53 -0.72 -0.19 0.00 0.02 0.00 0.00 55.97 55.61 1q3g s LYS 152 Cb -0.11 -2.39 -0.05 0.00 -0.52 0.00 0.00 37.83 34.76 1q3g s LYS 152 CO 0.51 0.53 1.03 0.41 -0.92 0.00 0.00 175.35 176.91 1q3g n GLY 153 N 2.58 -0.13 3.41 -3.33 0.00 -0.18 -4.49 105.19 103.04 1q3g n GLY 153 Ca -0.17 -0.11 -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 -1.47 -0.53 -0.44 4.61 0.00 -1.10 -4.77 121.76 118.05 1q3g s ALA 154 Ca 0.76 -0.48 -0.16 0.00 0.00 0.00 0.00 51.96 52.07 1q3g s ALA 154 Cb -0.42 0.81 0.04 0.00 0.00 0.00 0.00 23.12 23.55 1q3g s ALA 154 CO 0.47 -0.71 0.41 -1.58 0.00 0.00 0.00 175.76 174.35 1q3g s HIS 155 N -3.90 3.20 -0.20 0.00 2.46 -1.26 -1.35 115.29 114.23 1q3g s HIS 155 Ca 0.11 -0.62 -0.04 0.00 0.47 0.00 0.00 55.06 54.98 1q3g s HIS 155 Cb 0.01 -2.96 -0.02 0.00 -0.13 0.00 0.00 32.58 29.49 1q3g s HIS 155 CO -0.03 -0.73 -0.03 0.42 -2.47 0.00 0.00 174.74 171.89 1q3g s ILE 156 N 1.91 3.60 -0.31 0.89 1.01 0.25 -4.96 121.20 123.60 1q3g s ILE 156 Ca 0.08 -0.43 -0.10 0.00 0.00 0.00 0.00 60.65 60.21 1q3g s ILE 156 Cb -0.20 -2.63 -0.01 0.00 0.01 0.00 0.00 42.46 39.64 1q3g s ILE 156 CO 0.10 0.43 0.15 -0.69 0.00 0.00 0.00 174.94 174.94 1q3g s VAL 157 N 1.17 4.61 -0.18 2.92 1.01 -1.26 -0.15 120.40 128.52 1q3g s VAL 157 Ca 0.02 -0.41 -0.29 0.00 0.00 0.00 0.00 61.98 61.30 1q3g s VAL 157 Cb -0.14 -3.35 -0.01 0.00 0.00 0.00 0.00 36.38 32.88 1q3g s VAL 157 CO -0.00 0.07 1.16 -0.04 0.00 0.00 0.00 175.10 176.29 1q3g s MET 158 N 1.62 4.26 -0.37 2.72 1.00 -0.48 -4.91 119.30 123.14 1q3g s MET 158 Ca 0.05 1.54 -0.01 0.00 0.00 0.00 0.00 55.69 57.26 1q3g s MET 158 Cb -0.17 -3.70 0.26 0.00 0.00 0.00 0.00 34.83 31.23 1q3g s MET 158 CO 0.06 -0.65 1.98 -0.40 0.00 0.00 0.00 175.02 176.01 1q3g n ASP 159 N 6.35 6.39 0.00 3.03 5.68 -1.26 -4.74 116.55 132.00 1q3g n ASP 159 Ca 0.13 -3.16 0.00 0.00 -0.50 0.00 0.00 54.79 51.26 1q3g n ASP 159 Cb 0.46 -1.01 0.00 0.00 -1.14 0.00 0.00 41.12 39.42 1q3g n ASP 159 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1q3g n LYS 160 N 0.09 0.00 -2.90 0.11 4.81 -1.26 -5.13 118.16 113.88 1q3g n LYS 160 Ca 0.35 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.37 1q3g n LYS 160 Cb 0.64 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.65 1q3g n LYS 160 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1q3g s VAL 161 N -1.33 4.76 -0.07 3.15 1.01 -1.26 -4.97 120.40 121.68 1q3g s VAL 161 Ca 0.00 1.30 -0.00 0.00 0.00 0.00 0.00 61.98 63.28 1q3g s VAL 161 Cb 0.00 -4.18 0.02 0.00 0.00 0.00 0.00 36.38 32.22 1q3g s VAL 161 CO 0.00 -0.26 -0.03 -0.55 0.00 0.00 0.00 175.10 174.26 1q3g s SER 162 N 1.59 1.58 0.02 3.32 0.15 -1.26 -5.00 113.70 114.10 1q3g s SER 162 Ca 0.34 -0.16 -0.25 0.00 0.70 0.00 0.00 55.95 56.59 1q3g s SER 162 Cb -0.14 -0.55 -0.18 0.00 -1.71 0.00 0.00 66.02 63.43 1q3g s SER 162 CO 0.12 -0.13 1.44 0.58 1.20 0.00 0.00 173.24 176.45 1q3g h VAL 163 N 6.23 1.22 0.28 4.45 2.07 -1.95 -1.65 116.25 126.89 1q3g h VAL 163 Ca -0.27 -0.70 -0.00 0.00 0.82 0.00 0.00 66.70 66.55 1q3g h VAL 163 Cb 1.14 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.58 1q3g h VAL 163 CO 0.36 0.18 -0.21 1.23 0.02 0.00 0.00 177.57 179.15 1q3g h GLY 164 N -0.32 -0.50 1.12 2.17 0.00 -2.00 -2.01 103.07 101.53 1q3g h GLY 164 Ca -0.00 0.23 0.02 0.00 0.00 0.00 0.00 47.33 47.58 1q3g h GLY 164 CO 0.00 -0.20 0.57 0.00 0.00 0.00 0.00 176.54 176.91 1q3g h ALA 165 N 0.19 1.41 -0.81 3.60 0.00 -1.92 -0.94 119.26 120.78 1q3g h ALA 165 Ca -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1q3g h ALA 165 Cb 0.43 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1q3g h ALA 165 CO -0.00 0.54 0.41 1.15 0.00 0.00 0.00 179.25 181.35 1q3g h THR 166 N 1.15 1.25 -0.06 0.00 2.02 -1.07 -1.52 112.91 114.67 1q3g h THR 166 Ca 0.32 -0.66 -0.01 0.00 0.77 0.00 0.00 66.41 66.84 1q3g h THR 166 Cb -0.09 0.18 -0.00 0.00 -1.74 0.00 0.00 68.15 66.50 1q3g h THR 166 CO -0.08 0.29 -0.01 0.58 0.37 0.00 0.00 175.52 176.67 1q3g h VAL 167 N 1.14 1.27 0.04 3.16 2.07 -0.62 -0.97 116.25 122.34 1q3g h VAL 167 Ca 0.28 -0.84 0.03 0.00 0.82 0.00 0.00 66.70 66.99 1q3g h VAL 167 Cb 0.08 1.70 -0.04 0.00 -1.52 0.00 0.00 31.29 31.51 1q3g h VAL 167 CO -0.04 0.23 -0.26 0.74 0.02 0.00 0.00 177.57 178.26 1q3g h THR 168 N -0.19 0.42 -0.18 2.57 2.02 -0.99 -0.17 112.91 116.38 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 0.37 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 1q3g h THR 168 CO 0.00 0.00 0.07 0.40 0.37 0.00 0.00 175.52 176.37 1q3g h ILE 169 N -0.42 1.16 -0.97 3.11 2.04 -1.32 -1.62 117.51 119.50 1q3g h ILE 169 Ca 0.05 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 1q3g h ILE 169 Cb 0.49 1.15 -0.05 0.00 -0.74 0.00 0.00 36.82 37.68 1q3g h ILE 169 CO -0.20 0.16 0.60 -0.03 0.00 0.00 0.00 178.15 178.67 1q3g h MET 170 N 0.14 1.30 -0.11 2.37 4.05 -1.06 -1.22 114.93 120.39 1q3g h MET 170 Ca 0.06 -0.11 -0.02 0.00 -0.28 0.00 0.00 59.70 59.35 1q3g h MET 170 Cb 0.18 -0.28 -0.00 0.00 -0.80 0.00 0.00 31.60 30.70 1q3g h MET 170 CO -0.00 0.90 -0.01 0.77 0.23 0.00 0.00 176.91 178.80 1q3g h SER 171 N 1.33 0.20 -0.61 1.39 0.02 -0.90 -3.14 113.55 111.83 1q3g h SER 171 Ca 0.35 -0.32 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 1q3g h SER 171 Cb -0.08 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 1q3g h SER 171 CO -0.07 0.48 0.23 0.00 -1.14 0.00 0.00 176.83 176.32 1q3g h ALA 172 N 0.73 1.18 0.00 3.77 0.00 -1.14 -2.89 119.26 120.92 1q3g h ALA 172 Ca 0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1q3g h ALA 172 Cb 0.38 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1q3g h ALA 172 CO 0.01 0.58 -0.07 0.00 0.00 0.00 0.00 179.25 179.77 1q3g h ALA 173 N 1.30 1.39 -0.14 0.00 0.00 -1.19 -2.91 119.26 117.71 1q3g h ALA 173 Ca 0.21 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1q3g h ALA 173 Cb 0.23 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1q3g h ALA 173 CO -0.01 0.09 0.11 1.79 0.00 0.00 0.00 179.25 181.23 1q3g h THR 174 N 0.00 0.79 -0.43 0.00 1.35 -1.47 -0.80 112.91 112.35 1q3g h THR 174 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1q3g h THR 174 Cb 0.20 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 67.53 1q3g h THR 174 CO 0.01 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.46 1q3g n LEU 175 N -4.28 3.72 -4.90 3.87 4.77 -1.10 -0.71 117.00 118.37 1q3g n LEU 175 Ca 0.00 -2.38 -0.29 0.00 -0.03 0.00 0.00 56.01 53.32 1q3g n LEU 175 Cb 0.24 -0.42 0.04 0.00 -2.33 0.00 0.00 43.42 40.95 1q3g n LEU 175 CO 0.33 0.75 0.66 0.00 -1.33 0.00 0.00 177.39 177.80 1q3g s ALA 176 N -1.69 3.07 -0.44 -1.18 0.00 -0.31 -4.52 121.76 116.70 1q3g s ALA 176 Ca 0.37 -0.47 -0.19 0.00 0.00 0.00 0.00 51.96 51.67 1q3g s ALA 176 Cb 0.24 -2.86 0.03 0.00 0.00 0.00 0.00 23.12 20.53 1q3g s ALA 176 CO 0.17 -0.98 0.54 -2.00 0.00 0.00 0.00 175.76 173.49 1q3g s GLU 177 N -5.20 3.17 0.00 0.00 2.12 0.22 -3.81 118.70 115.20 1q3g s GLU 177 Ca 0.56 -0.62 0.00 0.00 0.36 0.00 0.00 54.97 55.27 1q3g s GLU 177 Cb -0.11 -3.98 0.00 0.00 0.26 0.00 0.00 34.13 30.31 1q3g s GLU 177 CO 0.49 -0.96 0.00 0.41 -0.54 0.00 0.00 175.26 174.67 1q3g n GLY 178 N 5.09 -0.85 3.59 -1.50 0.00 -1.26 -1.01 105.19 109.25 1q3g n GLY 178 Ca -0.05 -2.15 -0.34 0.00 0.00 0.00 0.00 46.02 43.48 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 4.04 -0.00 2.61 2.01 -1.26 -0.78 115.64 122.26 1q3g s THR 179 Ca 0.00 -0.33 0.06 0.00 0.31 0.00 0.00 61.69 61.72 1q3g s THR 179 Cb 0.00 -2.72 -0.03 0.00 0.01 0.00 0.00 72.50 69.76 1q3g s THR 179 CO 0.00 0.56 -0.17 -0.89 -0.69 0.00 0.00 174.62 173.43 1q3g s THR 180 N -0.40 2.87 -0.09 -0.82 2.01 0.17 -2.73 115.64 116.66 1q3g s THR 180 Ca 0.07 -0.96 0.00 0.00 0.31 0.00 0.00 61.69 61.10 1q3g s THR 180 Cb -0.12 -2.16 0.02 0.00 0.01 0.00 0.00 72.50 70.25 1q3g s THR 180 CO 0.02 0.47 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.73 1q3g s ILE 181 N -0.82 0.88 -0.33 1.82 1.01 -0.46 -0.46 121.20 122.84 1q3g s ILE 181 Ca 0.13 -0.23 -0.11 0.00 0.00 0.00 0.00 60.65 60.44 1q3g s ILE 181 Cb -0.11 -0.90 -0.00 0.00 0.01 0.00 0.00 42.46 41.46 1q3g s ILE 181 CO 0.03 0.33 0.19 -0.63 0.00 0.00 0.00 174.94 174.86 1q3g s ILE 182 N 1.49 4.79 0.02 2.92 1.01 0.91 -0.58 121.20 131.76 1q3g s ILE 182 Ca -0.00 -0.45 -0.17 0.00 0.00 0.00 0.00 60.65 60.03 1q3g s ILE 182 Cb -0.13 -3.49 -0.06 0.00 0.01 0.00 0.00 42.46 38.79 1q3g s ILE 182 CO -0.05 -0.02 0.48 -1.61 0.00 0.00 0.00 174.94 173.75 1q3g s GLU 183 N 1.63 4.07 -1.19 2.79 0.41 0.78 -1.51 118.70 125.69 1q3g s GLU 183 Ca 0.05 0.55 -0.07 0.00 -0.41 0.00 0.00 54.97 55.08 1q3g s GLU 183 Cb -0.18 -3.25 0.01 0.00 -1.78 0.00 0.00 34.13 28.94 1q3g s GLU 183 CO 0.07 0.63 1.04 -1.71 -0.49 0.00 0.00 175.26 174.80 1q3g n ASN 184 N 1.94 -5.56 -4.80 -0.19 5.15 0.82 -1.38 115.26 111.24 1q3g n ASN 184 Ca -0.12 -0.48 -0.32 0.00 -0.60 0.00 0.00 54.58 53.06 1q3g n ASN 184 Cb 0.52 -4.52 0.03 0.00 -0.53 0.00 0.00 39.78 35.28 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 -3.29 2.66 0.29 5.20 0.00 0.04 -4.60 121.76 122.07 1q3g s ALA 185 Ca 0.48 0.33 -0.29 0.00 0.00 0.00 0.00 51.96 52.47 1q3g s ALA 185 Cb -0.21 -3.23 -0.10 0.00 0.00 0.00 0.00 23.12 19.58 1q3g s ALA 185 CO 0.64 -1.03 1.15 0.00 0.00 0.00 0.00 175.76 176.52 1q3g s ALA 186 N -2.62 3.43 -1.60 0.00 0.00 -1.26 -4.52 121.76 115.19 1q3g s ALA 186 Ca 0.62 0.99 0.20 0.00 0.00 0.00 0.00 51.96 53.77 1q3g s ALA 186 Cb -0.16 -3.36 0.63 0.00 0.00 0.00 0.00 23.12 20.22 1q3g s ALA 186 CO 0.43 -0.28 1.53 0.54 0.00 0.00 0.00 175.76 177.99 1q3g n ARG 187 N 1.10 3.02 -1.57 0.00 3.00 -1.26 -4.64 116.66 116.31 1q3g n ARG 187 Ca -0.01 -2.66 -0.42 0.00 -0.01 0.00 0.00 57.85 54.75 1q3g n ARG 187 Cb 0.44 -1.63 0.01 0.00 0.00 0.00 0.00 32.46 31.28 1q3g n ARG 187 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1q3g n GLU 188 N 1.35 1.14 -0.11 5.56 4.71 -1.26 -4.58 120.64 127.45 1q3g n GLU 188 Ca 0.23 0.41 0.17 0.00 -0.01 0.00 0.00 57.16 57.97 1q3g n GLU 188 Cb 0.68 -1.89 0.57 0.00 -1.01 0.00 0.00 31.44 29.79 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 1.37 0.25 -0.24 3.49 0.11 -1.96 0.12 132.00 135.14 1q3g h PRO 189 Ca -0.43 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.59 1q3g h PRO 189 Cb 1.35 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 1q3g h PRO 189 CO 0.56 0.17 -0.17 0.93 -0.21 0.00 0.00 178.00 179.27 1q3g h GLU 190 N 0.26 0.42 -0.47 1.05 3.07 -1.89 -0.71 114.58 116.31 1q3g h GLU 190 Ca 0.33 -0.13 -0.04 0.00 -0.50 0.00 0.00 59.36 59.03 1q3g h GLU 190 Cb 0.93 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.77 1q3g h GLU 190 CO -0.07 0.58 0.15 0.82 -1.40 0.00 0.00 179.01 179.09 1q3g h ILE 191 N 0.38 1.22 -0.48 3.13 1.08 -1.10 0.22 117.51 121.96 1q3g h ILE 191 Ca 0.07 -0.73 -0.01 0.00 -0.39 0.00 0.00 64.86 63.80 1q3g h ILE 191 Cb 0.53 0.82 -0.02 0.00 -3.07 0.00 0.00 36.82 35.07 1q3g h ILE 191 CO 0.03 0.27 0.27 0.58 -0.69 0.00 0.00 178.15 178.61 1q3g h VAL 192 N 0.62 1.17 -0.57 1.67 2.07 -1.21 0.41 116.25 120.40 1q3g h VAL 192 Ca 0.15 -0.42 -0.05 0.00 0.82 0.00 0.00 66.70 67.21 1q3g h VAL 192 Cb 0.25 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1q3g h VAL 192 CO -0.01 0.18 0.18 -0.78 0.02 0.00 0.00 177.57 177.16 1q3g h ASP 193 N 0.64 0.84 -0.48 0.57 3.58 -0.72 -0.52 116.42 120.33 1q3g h ASP 193 Ca 0.17 -0.21 -0.10 0.00 0.42 0.00 0.00 57.03 57.32 1q3g h ASP 193 Cb 0.04 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 40.85 1q3g h ASP 193 CO -0.03 0.82 -0.06 0.74 -2.88 0.00 0.00 179.24 177.84 1q3g h THR 194 N 0.81 1.26 -0.08 2.25 2.02 -0.29 -1.59 112.91 117.28 1q3g h THR 194 Ca 0.18 -1.17 -0.00 0.00 0.77 0.00 0.00 66.41 66.20 1q3g h THR 194 Cb 0.29 0.92 -0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1q3g h THR 194 CO -0.01 0.41 0.05 0.00 0.37 0.00 0.00 175.52 176.35 1q3g h ALA 195 N 1.07 0.11 0.00 6.16 0.00 -0.54 -1.71 119.26 124.35 1q3g h ALA 195 Ca 0.15 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1q3g h ALA 195 Cb 0.58 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1q3g h ALA 195 CO 0.04 -0.37 -0.19 -0.91 0.00 0.00 0.00 179.25 177.82 1q3g h ASN 196 N 0.06 0.00 -0.01 0.00 2.35 -0.94 -0.93 115.58 116.12 1q3g h ASN 196 Ca 0.03 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1q3g h ASN 196 Cb 0.05 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.42 1q3g h ASN 196 CO -0.01 0.19 -0.00 0.15 -1.65 0.00 0.00 177.43 176.11 1q3g h PHE 197 N 0.00 0.01 -0.86 1.19 3.57 -0.87 -1.47 116.94 118.51 1q3g h PHE 197 Ca -0.00 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.55 1q3g h PHE 197 Cb 0.37 -0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.05 1q3g h PHE 197 CO 0.00 0.38 0.54 -0.07 -2.23 0.00 0.00 178.31 176.93 1q3g h LEU 198 N -0.36 0.87 -1.34 0.59 3.38 -0.84 -0.45 115.31 117.16 1q3g h LEU 198 Ca 0.00 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1q3g h LEU 198 Cb 0.38 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1q3g h LEU 198 CO 0.00 0.57 0.23 0.58 0.09 0.00 0.00 178.44 179.91 1q3g h VAL 199 N 1.01 1.17 0.00 1.22 2.07 -1.08 -0.19 116.25 120.45 1q3g h VAL 199 Ca 0.37 -0.48 -0.06 0.00 0.82 0.00 0.00 66.70 67.35 1q3g h VAL 199 Cb 0.12 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1q3g h VAL 199 CO -0.15 0.20 -0.29 0.00 0.02 0.00 0.00 177.57 177.34 1q3g h ALA 200 N 1.57 1.40 -0.00 1.67 0.00 0.01 -0.94 119.26 122.97 1q3g h ALA 200 Ca 0.17 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1q3g h ALA 200 Cb 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1q3g h ALA 200 CO -0.02 0.36 -0.06 1.28 0.00 0.00 0.00 179.25 180.81 1q3g n LEU 201 N -4.02 0.24 0.00 0.00 4.77 -0.44 -4.80 117.00 112.75 1q3g n LEU 201 Ca -0.02 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1q3g n LEU 201 Cb 0.35 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1q3g n LEU 201 CO 0.37 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 1q3g n GLY 202 N 1.26 0.99 3.74 -0.72 0.00 -0.36 -0.64 105.19 109.45 1q3g n GLY 202 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 1q3g n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3g s ALA 203 N -2.00 2.04 -0.38 4.61 0.00 -0.21 -4.95 121.76 120.88 1q3g s ALA 203 Ca 0.00 0.45 -0.01 0.00 0.00 0.00 0.00 51.96 52.40 1q3g s ALA 203 Cb 0.00 -3.35 0.10 0.00 0.00 0.00 0.00 23.12 19.87 1q3g s ALA 203 CO 0.00 -2.01 0.14 0.15 0.00 0.00 0.00 175.76 174.04 1q3g s LYS 204 N -4.65 1.92 0.03 0.00 1.02 -1.26 -4.26 119.74 112.54 1q3g s LYS 204 Ca 0.65 -1.76 0.04 0.00 0.02 0.00 0.00 55.97 54.91 1q3g s LYS 204 Cb -0.20 -3.43 -0.02 0.00 -0.52 0.00 0.00 37.83 33.66 1q3g s LYS 204 CO 0.54 -0.98 -0.11 0.42 -0.92 0.00 0.00 175.35 174.30 1q3g s ILE 205 N 1.09 0.88 0.03 2.17 1.01 -1.26 -1.53 121.20 123.58 1q3g s ILE 205 Ca 0.07 -0.88 -0.12 0.00 0.00 0.00 0.00 60.65 59.72 1q3g s ILE 205 Cb -0.21 -0.81 0.01 0.00 0.01 0.00 0.00 42.46 41.46 1q3g s ILE 205 CO -0.05 -0.05 0.26 -0.94 0.00 0.00 0.00 174.94 174.16 1q3g s SER 206 N -1.04 -0.08 0.00 3.58 1.04 -0.44 -4.90 113.70 111.85 1q3g s SER 206 Ca -0.01 -0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.24 1q3g s SER 206 Cb -0.07 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.36 1q3g s SER 206 CO 0.01 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.29 1q3g n GLY 207 N 0.83 0.63 3.66 7.32 0.00 -1.26 -0.54 105.19 115.84 1q3g n GLY 207 Ca -0.20 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.37 1q3g n GLY 207 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3g n GLN 208 N -2.00 1.98 0.00 1.61 0.00 -1.26 -0.45 117.38 117.27 1q3g n GLN 208 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 57.00 57.71 1q3g n GLN 208 Cb 0.00 -2.40 0.00 0.00 0.00 0.00 0.00 30.24 27.84 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 2.67 0.17 3.81 2.61 0.00 -1.26 -4.89 105.19 108.29 1q3g n GLY 209 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.01 1.30 -0.12 2.61 -4.23 0.41 -4.76 115.64 108.84 1q3g s THR 210 Ca 0.00 -1.83 0.30 0.00 -1.18 0.00 0.00 61.69 58.98 1q3g s THR 210 Cb 0.00 -2.13 0.33 0.00 1.34 0.00 0.00 72.50 72.04 1q3g s THR 210 CO 0.00 0.00 1.88 0.44 -0.54 0.00 0.00 174.62 176.40 1q3g h ASP 211 N 1.14 0.00 -3.33 3.99 3.45 -1.81 -3.42 116.42 116.44 1q3g h ASP 211 Ca -0.42 0.00 -0.53 0.00 0.43 0.00 0.00 57.03 56.51 1q3g h ASP 211 Cb 1.31 0.00 -0.39 0.00 -0.56 0.00 0.00 39.33 39.70 1q3g h ASP 211 CO 0.68 0.00 -0.78 -0.60 -1.57 0.00 0.00 179.24 176.98 1q3g s ARG 212 N -3.54 1.07 -0.17 3.56 3.52 -1.26 -0.13 118.95 122.00 1q3g s ARG 212 Ca 0.02 -0.45 -0.06 0.00 -0.13 0.00 0.00 55.73 55.11 1q3g s ARG 212 Cb 0.09 -1.98 -0.04 0.00 -1.56 0.00 0.00 34.95 31.47 1q3g s ARG 212 CO 0.47 -0.51 0.03 0.42 -0.81 0.00 0.00 175.30 174.90 1q3g s ILE 213 N 1.73 4.46 -0.17 4.11 1.01 -0.57 -4.44 121.20 127.34 1q3g s ILE 213 Ca -0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 60.65 60.48 1q3g s ILE 213 Cb -0.16 -3.00 -0.01 0.00 0.01 0.00 0.00 42.46 39.31 1q3g s ILE 213 CO -0.07 0.47 -0.11 -0.89 0.00 0.00 0.00 174.94 174.34 1q3g s THR 214 N 0.40 3.02 -0.09 2.92 2.01 0.30 -0.06 115.64 124.15 1q3g s THR 214 Ca 0.01 -0.64 0.04 0.00 0.31 0.00 0.00 61.69 61.40 1q3g s THR 214 Cb -0.13 -2.32 0.00 0.00 0.01 0.00 0.00 72.50 70.07 1q3g s THR 214 CO 0.01 0.49 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.59 1q3g s ILE 215 N 0.95 1.78 -0.33 1.82 1.09 0.40 -1.33 121.20 125.59 1q3g s ILE 215 Ca -0.02 -0.86 -0.05 0.00 -1.10 0.00 0.00 60.65 58.63 1q3g s ILE 215 Cb -0.15 -1.55 0.05 0.00 -1.06 0.00 0.00 42.46 39.74 1q3g s ILE 215 CO -0.01 0.50 0.07 -0.70 -0.10 0.00 0.00 174.94 174.70 1q3g s GLU 216 N 0.41 2.53 0.73 2.79 2.12 -0.58 0.42 118.70 127.12 1q3g s GLU 216 Ca -0.17 -1.24 -0.16 0.00 0.36 0.00 0.00 54.97 53.76 1q3g s GLU 216 Cb -0.17 -3.37 -0.02 0.00 0.26 0.00 0.00 34.13 30.83 1q3g s GLU 216 CO 0.07 -0.67 0.71 0.41 -0.54 0.00 0.00 175.26 175.24 1q3g n GLY 217 N 4.74 -1.09 3.30 -1.50 0.00 0.04 -4.13 105.19 106.54 1q3g n GLY 217 Ca -0.12 -0.38 -0.16 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.90 0.90 0.13 1.61 -7.23 0.11 -4.72 120.40 109.30 1q3g s VAL 218 Ca 0.68 -2.02 -0.15 0.00 -1.81 0.00 0.00 61.98 58.69 1q3g s VAL 218 Cb -0.34 -2.26 -0.01 0.00 0.56 0.00 0.00 36.38 34.33 1q3g s VAL 218 CO 0.55 -0.37 1.62 -0.33 -0.31 0.00 0.00 175.10 176.26 1q3g h GLU 219 N 2.55 0.68 -3.34 4.82 5.08 -1.91 -3.40 114.58 119.07 1q3g h GLU 219 Ca -0.38 -0.17 -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 30.27 1q3g h GLU 219 CO 0.64 0.71 -0.01 -0.98 -1.00 0.00 0.00 179.01 178.37 1q3g s ARG 220 N -5.24 1.26 -0.04 2.33 1.70 -1.26 -4.99 118.95 112.71 1q3g s ARG 220 Ca -0.13 -0.80 0.03 0.00 -0.47 0.00 0.00 55.73 54.37 1q3g s ARG 220 Cb 0.10 0.50 -0.03 0.00 -0.57 0.00 0.00 34.95 34.96 1q3g s ARG 220 CO 0.78 -0.52 -0.12 -0.51 -1.08 0.00 0.00 175.30 173.85 1q3g s LEU 221 N -2.85 2.90 0.00 -1.89 1.43 -1.26 -4.88 118.68 112.13 1q3g s LEU 221 Ca 0.07 -0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 1q3g s LEU 221 Cb 0.00 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.60 1q3g s LEU 221 CO -0.07 0.33 0.00 0.61 0.23 0.00 0.00 176.35 177.46 1q3g n GLY 222 N 2.09 0.69 0.00 -3.19 0.00 0.18 -1.42 105.19 103.55 1q3g n GLY 222 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1q3g n GLY 222 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3g n GLY 223 N 5.00 3.89 0.00 -0.02 0.00 -1.26 -2.17 105.19 110.63 1q3g n GLY 223 Ca 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.75 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 -0.11 3.01 -0.02 0.00 -0.64 -4.49 105.19 102.93 1q3g n GLY 224 Ca 0.00 -1.52 -0.25 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.69 1.10 -0.01 1.61 1.01 -1.26 -0.79 120.40 119.37 1q3g s VAL 225 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.54 1q3g s VAL 225 Cb 0.00 -1.03 0.02 0.00 0.00 0.00 0.00 36.38 35.37 1q3g s VAL 225 CO 0.00 0.35 0.01 -0.47 0.00 0.00 0.00 175.10 174.99 1q3g s TYR 226 N 0.79 0.11 -0.27 5.22 5.04 -0.44 -4.99 117.35 122.81 1q3g s TYR 226 Ca -0.12 0.05 -0.11 0.00 -2.44 0.00 0.00 57.07 54.44 1q3g s TYR 226 Cb -0.15 -0.20 -0.05 0.00 0.35 0.00 0.00 41.96 41.90 1q3g s TYR 226 CO 0.02 -0.06 0.20 0.50 -1.34 0.00 0.00 175.55 174.87 1q3g s ARG 227 N 0.65 3.99 0.43 4.97 3.52 -1.26 -0.03 118.95 131.22 1q3g s ARG 227 Ca -0.06 -0.27 -0.25 0.00 -0.13 0.00 0.00 55.73 55.02 1q3g s ARG 227 Cb -0.08 -3.63 -0.08 0.00 -1.56 0.00 0.00 34.95 29.60 1q3g s ARG 227 CO -0.02 -0.13 1.33 0.08 -0.81 0.00 0.00 175.30 175.75 1q3g s VAL 228 N 1.60 2.49 0.76 7.11 1.01 -0.37 -4.93 120.40 128.08 1q3g s VAL 228 Ca 0.08 0.43 -0.11 0.00 0.00 0.00 0.00 61.98 62.38 1q3g s VAL 228 Cb -0.15 -3.25 0.05 0.00 0.00 0.00 0.00 36.38 33.02 1q3g s VAL 228 CO 0.09 0.06 1.08 -1.48 0.00 0.00 0.00 175.10 174.85 1q3g s LEU 229 N -2.59 2.84 0.56 3.92 2.34 -1.26 -4.72 118.68 119.77 1q3g s LEU 229 Ca 0.59 1.51 -0.21 0.00 0.06 0.00 0.00 54.13 56.08 1q3g s LEU 229 Cb -0.39 -4.23 -0.05 0.00 -0.56 0.00 0.00 46.19 40.97 1q3g s LEU 229 CO 0.50 -1.82 1.33 -2.65 -1.06 0.00 0.00 176.35 172.65 1q3g n PRO 230 N -3.36 1.59 -2.52 1.48 -0.02 -1.26 -0.31 135.00 130.61 1q3g n PRO 230 Ca 0.07 0.59 -0.42 0.00 -2.02 0.00 0.00 63.50 61.72 1q3g n PRO 230 Cb 0.55 -2.54 -0.03 0.00 -0.02 0.00 0.00 33.50 31.46 1q3g n PRO 230 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1q3g s ASP 231 N -0.97 6.32 0.43 2.55 -1.08 -0.67 -4.28 116.67 118.96 1q3g s ASP 231 Ca 0.73 0.11 0.16 0.00 -0.52 0.00 0.00 52.55 53.03 1q3g s ASP 231 Cb -0.42 -2.55 0.95 0.00 -1.46 0.00 0.00 42.92 39.45 1q3g s ASP 231 CO 0.48 -1.59 1.93 0.08 0.52 0.00 0.00 175.17 176.59 1q3g h ARG 232 N 10.09 0.00 -0.03 4.34 0.11 -1.91 -2.09 114.38 124.90 1q3g h ARG 232 Ca -0.26 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 59.63 1q3g h ARG 232 Cb 1.07 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.14 1q3g h ARG 232 CO 1.19 0.25 -0.83 0.82 0.10 0.00 0.00 179.97 181.51 1q3g h ILE 233 N 0.00 1.43 -0.40 0.08 1.08 -1.95 -0.51 117.51 117.24 1q3g h ILE 233 Ca -0.00 -2.38 -0.08 0.00 -0.39 0.00 0.00 64.86 62.01 1q3g h ILE 233 Cb 0.48 2.31 -0.01 0.00 -3.07 0.00 0.00 36.82 36.53 1q3g h ILE 233 CO 0.03 0.70 -0.07 -0.08 -0.69 0.00 0.00 178.15 178.05 1q3g h GLU 234 N 0.19 0.75 -0.03 2.37 4.81 -1.86 -0.39 114.58 120.42 1q3g h GLU 234 Ca -0.05 -0.27 0.01 0.00 -0.13 0.00 0.00 59.36 58.92 1q3g h GLU 234 Cb 1.43 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.75 1q3g h GLU 234 CO 0.14 0.87 -0.05 1.15 -0.73 0.00 0.00 179.01 180.39 1q3g h THR 235 N 0.56 0.87 -0.45 0.32 2.02 -1.26 -1.71 112.91 113.26 1q3g h THR 235 Ca 0.10 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.27 1q3g h THR 235 Cb 0.58 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 1q3g h THR 235 CO 0.03 0.00 0.22 1.23 0.37 0.00 0.00 175.52 177.37 1q3g h GLY 236 N -0.07 0.67 0.91 2.16 0.00 -0.94 -1.19 103.07 104.61 1q3g h GLY 236 Ca 0.03 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 1q3g h GLY 236 CO -0.07 0.29 0.11 -0.84 0.00 0.00 0.00 176.54 176.02 1q3g h THR 237 N 0.63 1.18 -0.07 4.70 2.02 -0.39 -1.24 112.91 119.74 1q3g h THR 237 Ca 0.16 -0.57 -0.12 0.00 0.77 0.00 0.00 66.41 66.64 1q3g h THR 237 Cb 0.06 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1q3g h THR 237 CO -0.02 0.19 -0.51 -0.26 0.37 0.00 0.00 175.52 175.29 1q3g h PHE 238 N 0.31 0.23 -0.55 3.16 -1.00 -1.01 -0.73 116.94 117.35 1q3g h PHE 238 Ca 0.09 -0.07 -0.09 0.00 2.81 0.00 0.00 57.97 60.71 1q3g h PHE 238 Cb 0.20 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.69 1q3g h PHE 238 CO -0.00 0.66 -0.00 -0.07 -1.61 0.00 0.00 178.31 177.29 1q3g h LEU 239 N 0.15 0.91 -0.79 1.54 3.38 -1.05 -1.97 115.31 117.48 1q3g h LEU 239 Ca 0.00 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 57.61 1q3g h LEU 239 Cb 0.96 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1q3g h LEU 239 CO 0.08 0.97 -0.42 0.58 0.09 0.00 0.00 178.44 179.74 1q3g h VAL 240 N 0.86 1.31 -0.64 1.22 2.07 -0.96 -1.61 116.25 118.51 1q3g h VAL 240 Ca 0.16 -1.57 0.07 0.00 0.82 0.00 0.00 66.70 66.18 1q3g h VAL 240 Cb 0.51 1.63 -0.06 0.00 -1.52 0.00 0.00 31.29 31.86 1q3g h VAL 240 CO 0.03 0.48 0.32 0.00 0.02 0.00 0.00 177.57 178.42 1q3g h ALA 241 N 1.22 0.85 -0.09 1.67 0.00 -0.41 -1.23 119.26 121.27 1q3g h ALA 241 Ca 0.03 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1q3g h ALA 241 Cb 0.88 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1q3g h ALA 241 CO 0.07 -0.05 -0.22 0.00 0.00 0.00 0.00 179.25 179.05 1q3g h ALA 242 N 1.37 0.15 -0.65 0.00 0.00 -1.19 -3.13 119.26 115.80 1q3g h ALA 242 Ca 0.30 -0.39 0.13 0.00 0.00 0.00 0.00 54.91 54.95 1q3g h ALA 242 Cb 0.26 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1q3g h ALA 242 CO -0.22 0.12 0.44 0.00 0.00 0.00 0.00 179.25 179.59 1q3g h ALA 243 N 0.49 2.13 -0.01 0.00 0.00 -0.82 -1.66 119.26 119.39 1q3g h ALA 243 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1q3g h ALA 243 Cb 0.83 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1q3g h ALA 243 CO 0.05 -0.30 -0.35 0.44 0.00 0.00 0.00 179.25 179.09 1q3g n ILE 244 N -4.46 0.00 -0.91 0.00 -5.35 -0.51 -4.05 119.36 104.08 1q3g n ILE 244 Ca 0.12 -0.16 0.08 0.00 -0.27 0.00 0.00 62.75 62.52 1q3g n ILE 244 Cb 0.48 0.67 0.14 0.00 -1.74 0.00 0.00 39.64 39.18 1q3g n ILE 244 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1q3g n SER 245 N -0.51 2.55 -0.21 7.28 3.41 -0.69 -4.95 113.62 120.50 1q3g n SER 245 Ca 0.11 -2.92 -0.03 0.00 -0.26 0.00 0.00 58.87 55.77 1q3g n SER 245 Cb 0.38 -0.39 -0.01 0.00 -0.26 0.00 0.00 64.21 63.93 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 -1.14 0.28 0.65 5.00 0.00 -0.98 -4.37 105.19 104.63 1q3g n GLY 246 Ca 0.15 -0.00 -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 0.71 0.07 3.01 -0.02 0.00 -0.84 -1.80 105.19 106.32 1q3g n GLY 247 Ca -0.03 -1.87 -0.20 0.00 0.00 0.00 0.00 46.02 43.93 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 -3.07 0.85 0.03 1.61 2.20 -1.25 -1.32 119.74 118.79 1q3g s LYS 248 Ca 0.12 -0.31 -0.12 0.00 -0.36 0.00 0.00 55.97 55.30 1q3g s LYS 248 Cb -0.01 -0.81 0.01 0.00 -1.51 0.00 0.00 37.83 35.52 1q3g s LYS 248 CO 0.08 0.15 0.25 -1.50 -0.36 0.00 0.00 175.35 173.96 1q3g s ILE 249 N 0.02 0.09 -0.11 5.43 2.07 0.73 -1.11 121.20 128.31 1q3g s ILE 249 Ca -0.00 -0.74 0.01 0.00 -1.41 0.00 0.00 60.65 58.51 1q3g s ILE 249 Cb -0.06 -0.83 0.02 0.00 0.13 0.00 0.00 42.46 41.72 1q3g s ILE 249 CO 0.00 -0.41 -0.11 -0.69 -1.91 0.00 0.00 174.94 171.82 1q3g s VAL 250 N -2.25 1.23 -0.27 4.00 1.01 -0.66 -0.59 120.40 122.87 1q3g s VAL 250 Ca -0.07 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.33 1q3g s VAL 250 Cb -0.02 -1.17 -0.05 0.00 0.00 0.00 0.00 36.38 35.14 1q3g s VAL 250 CO -0.02 0.39 0.25 0.00 0.00 0.00 0.00 175.10 175.72 1q3g s ARG 252 N 1.69 3.53 -1.20 0.00 1.81 0.44 -2.04 118.95 123.18 1q3g s ARG 252 Ca 0.10 -0.28 -0.06 0.00 -1.72 0.00 0.00 55.73 53.77 1q3g s ARG 252 Cb -0.15 -2.76 0.01 0.00 -0.45 0.00 0.00 34.95 31.59 1q3g s ARG 252 CO 0.09 0.30 0.77 0.09 -0.68 0.00 0.00 175.30 175.88 1q3g n ASN 253 N -1.01 -5.53 -4.93 0.23 4.13 -0.83 -1.00 115.26 106.31 1q3g n ASN 253 Ca -0.04 -0.35 -0.20 0.00 1.68 0.00 0.00 54.58 55.67 1q3g n ASN 253 Cb 0.54 -4.24 -0.02 0.00 -1.54 0.00 0.00 39.78 34.53 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 -3.18 4.12 -0.46 5.41 0.00 0.03 -4.52 121.76 123.16 1q3g s ALA 254 Ca 0.38 -1.59 0.03 0.00 0.00 0.00 0.00 51.96 50.78 1q3g s ALA 254 Cb -0.17 -1.43 0.15 0.00 0.00 0.00 0.00 23.12 21.67 1q3g s ALA 254 CO 0.47 -0.06 0.30 -1.14 0.00 0.00 0.00 175.76 175.33 1q3g s GLN 255 N -4.13 1.23 0.29 0.00 0.74 -1.26 -4.07 119.66 112.47 1q3g s GLN 255 Ca 0.45 -2.11 0.01 0.00 0.05 0.00 0.00 55.36 53.75 1q3g s GLN 255 Cb -0.08 -2.07 0.70 0.00 1.10 0.00 0.00 33.01 32.66 1q3g s GLN 255 CO 0.29 -1.25 1.60 -1.35 -0.55 0.00 0.00 175.29 174.03 1q3g h PRO 256 N 6.30 0.06 0.00 1.67 0.11 -1.86 -2.01 132.00 136.27 1q3g h PRO 256 Ca 0.10 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 1q3g h PRO 256 Cb 0.90 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1q3g h PRO 256 CO 0.45 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 177.88 1q3g n ASP 257 N -5.41 0.22 -0.59 -2.05 3.85 -1.26 -1.06 116.55 110.26 1q3g n ASP 257 Ca 0.21 0.60 0.13 0.00 -0.71 0.00 0.00 54.79 55.02 1q3g n ASP 257 Cb 0.70 -0.63 0.42 0.00 -1.35 0.00 0.00 41.12 40.26 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 -1.80 0.06 -1.76 2.12 -2.24 -0.75 -4.27 114.28 105.64 1q3g n THR 258 Ca -0.00 -0.33 0.05 0.00 -2.27 0.00 0.00 64.05 61.50 1q3g n THR 258 Cb 0.02 0.64 0.11 0.00 -2.10 0.00 0.00 70.33 69.00 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 0.43 1.72 -0.12 3.22 4.77 -0.22 -4.89 117.00 121.90 1q3g n LEU 259 Ca 0.18 -2.72 -0.05 0.00 -0.03 0.00 0.00 56.01 53.39 1q3g n LEU 259 Cb 0.40 -0.28 0.01 0.00 -2.33 0.00 0.00 43.42 41.22 1q3g n LEU 259 CO 0.16 0.81 0.75 0.44 -1.33 0.00 0.00 177.39 178.21 1q3g h ASP 260 N 0.57 -0.55 -0.09 -1.43 3.32 -1.74 0.81 116.42 117.32 1q3g h ASP 260 Ca -0.06 0.14 0.02 0.00 0.02 0.00 0.00 57.03 57.15 1q3g h ASP 260 Cb 1.29 0.32 -0.02 0.00 0.22 0.00 0.00 39.33 41.14 1q3g h ASP 260 CO 0.02 -0.19 -0.02 0.00 -1.72 0.00 0.00 179.24 177.33 1q3g h ALA 261 N 1.27 0.06 -0.37 3.45 0.00 -1.88 -0.64 119.26 121.15 1q3g h ALA 261 Ca 0.20 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1q3g h ALA 261 Cb 0.38 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1q3g h ALA 261 CO -0.46 -0.49 0.21 0.28 0.00 0.00 0.00 179.25 178.79 1q3g h VAL 262 N 0.00 1.14 -0.45 0.00 2.07 -1.78 -1.35 116.25 115.87 1q3g h VAL 262 Ca 0.04 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.16 1q3g h VAL 262 Cb 0.06 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1q3g h VAL 262 CO -0.09 0.14 0.05 -0.07 0.02 0.00 0.00 177.57 177.62 1q3g h LEU 263 N 0.47 0.67 -0.61 2.57 3.38 -0.70 -0.09 115.31 121.00 1q3g h LEU 263 Ca 0.13 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1q3g h LEU 263 Cb 0.04 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1q3g h LEU 263 CO -0.02 0.71 0.10 0.00 0.09 0.00 0.00 178.44 179.32 1q3g h ALA 264 N 1.38 0.81 -0.26 1.53 0.00 -0.76 -1.50 119.26 120.46 1q3g h ALA 264 Ca 0.14 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 1q3g h ALA 264 Cb 0.35 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1q3g h ALA 264 CO 0.01 0.56 -0.42 -0.22 0.00 0.00 0.00 179.25 179.18 1q3g h LYS 265 N 0.91 0.63 -0.44 0.00 1.63 -0.75 -1.99 116.57 116.56 1q3g h LYS 265 Ca 0.19 -0.33 -0.09 0.00 -0.85 0.00 0.00 60.65 59.56 1q3g h LYS 265 Cb 0.42 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 32.04 1q3g h LYS 265 CO 0.01 0.93 -0.10 -0.07 -3.45 0.00 0.00 179.45 176.77 1q3g h LEU 266 N 0.51 0.77 -0.68 5.20 3.38 -0.78 -1.68 115.31 122.02 1q3g h LEU 266 Ca 0.04 -0.23 -0.08 0.00 0.09 0.00 0.00 57.88 57.70 1q3g h LEU 266 Cb 0.94 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 1q3g h LEU 266 CO 0.08 0.90 0.08 0.03 0.09 0.00 0.00 178.44 179.62 1q3g h ARG 267 N 0.71 1.10 0.00 1.13 3.08 -1.06 -1.11 114.38 118.23 1q3g h ARG 267 Ca 0.12 -0.31 -0.02 0.00 0.07 0.00 0.00 59.98 59.85 1q3g h ARG 267 Cb 0.58 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 1q3g h ARG 267 CO 0.04 1.02 -0.08 0.93 -1.07 0.00 0.00 179.97 180.81 1q3g h GLU 268 N 1.02 0.00 -0.00 0.04 5.08 -0.94 0.13 114.58 119.90 1q3g h GLU 268 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1q3g h GLU 268 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1q3g h GLU 268 CO 0.02 0.08 -0.10 0.00 -1.00 0.00 0.00 179.01 178.01 1q3g n ALA 269 N -2.41 2.66 0.00 3.43 0.00 -0.65 -4.75 120.51 118.78 1q3g n ALA 269 Ca -0.03 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1q3g n ALA 269 Cb 0.16 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.23 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 1.39 1.07 3.79 0.00 0.00 0.44 -0.10 105.19 111.78 1q3g n GLY 270 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1q3g n GLY 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3g s ALA 271 N -2.00 3.14 -0.51 4.61 0.00 -0.51 -4.88 121.76 121.60 1q3g s ALA 271 Ca 0.00 0.58 -0.17 0.00 0.00 0.00 0.00 51.96 52.37 1q3g s ALA 271 Cb 0.00 -3.22 0.09 0.00 0.00 0.00 0.00 23.12 19.99 1q3g s ALA 271 CO 0.00 0.01 0.50 0.34 0.00 0.00 0.00 175.76 176.61 1q3g s ASP 272 N -1.67 6.18 -0.11 0.00 2.15 -0.44 -4.40 116.67 118.38 1q3g s ASP 272 Ca 0.55 -1.36 -0.00 0.00 0.43 0.00 0.00 52.55 52.16 1q3g s ASP 272 Cb -0.19 -2.23 -0.02 0.00 -0.30 0.00 0.00 42.92 40.18 1q3g s ASP 272 CO 0.24 -0.80 -0.09 -0.63 -0.17 0.00 0.00 175.17 173.72 1q3g s ILE 273 N 1.96 3.45 0.02 4.11 1.01 -1.26 -1.24 121.20 129.26 1q3g s ILE 273 Ca 0.07 -0.54 0.04 0.00 0.00 0.00 0.00 60.65 60.22 1q3g s ILE 273 Cb -0.25 -2.44 -0.02 0.00 0.01 0.00 0.00 42.46 39.76 1q3g s ILE 273 CO 0.07 0.55 -0.13 -1.61 0.00 0.00 0.00 174.94 173.81 1q3g s GLU 274 N -0.12 0.94 0.15 2.79 2.02 -0.63 -5.00 118.70 118.86 1q3g s GLU 274 Ca 0.00 -0.64 0.06 0.00 0.02 0.00 0.00 54.97 54.42 1q3g s GLU 274 Cb -0.13 -0.93 -0.04 0.00 0.10 0.00 0.00 34.13 33.13 1q3g s GLU 274 CO 0.03 0.24 -0.14 0.95 0.02 0.00 0.00 175.26 176.36 1q3g s THR 275 N -0.66 1.43 0.00 3.63 -4.23 -1.26 -0.44 115.64 114.11 1q3g s THR 275 Ca 0.02 -1.93 0.00 0.00 -1.18 0.00 0.00 61.69 58.61 1q3g s THR 275 Cb -0.07 -1.75 0.00 0.00 1.34 0.00 0.00 72.50 72.02 1q3g s THR 275 CO 0.01 -0.52 0.00 0.61 -0.54 0.00 0.00 174.62 174.17 1q3g n GLY 276 N 0.13 5.80 0.27 3.99 0.00 0.57 -4.99 105.19 110.96 1q3g n GLY 276 Ca -0.12 -1.85 -0.08 0.00 0.00 0.00 0.00 46.02 43.96 1q3g n GLY 276 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1q3g h GLU 277 N 0.00 0.90 -0.06 1.61 4.57 -2.01 -3.35 114.58 116.24 1q3g h GLU 277 Ca 0.00 -0.22 -0.18 0.00 -1.18 0.00 0.00 59.36 57.78 1q3g h GLU 277 Cb 0.00 -0.12 -0.36 0.00 -0.16 0.00 0.00 28.75 28.12 1q3g h GLU 277 CO 0.00 0.85 -1.00 -0.40 -1.18 0.00 0.00 179.01 177.28 1q3g n ASP 278 N -4.38 1.19 -3.69 1.04 3.85 -1.26 -4.71 116.55 108.58 1q3g n ASP 278 Ca 0.02 -2.20 -0.11 0.00 -0.71 0.00 0.00 54.79 51.79 1q3g n ASP 278 Cb 0.24 -0.34 -0.06 0.00 -1.35 0.00 0.00 41.12 39.61 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 -0.79 -0.17 -0.01 2.11 1.48 -1.26 -0.79 118.94 119.50 1q3g s TRP 279 Ca 0.34 -0.01 0.01 0.00 -1.06 0.00 0.00 56.10 55.38 1q3g s TRP 279 Cb 0.38 0.18 0.01 0.00 -1.16 0.00 0.00 33.47 32.87 1q3g s TRP 279 CO -0.14 -0.59 -0.03 0.42 -4.06 0.00 0.00 176.95 172.54 1q3g s ILE 280 N -3.03 0.32 -0.01 0.66 1.01 -0.87 -0.31 121.20 118.98 1q3g s ILE 280 Ca -0.02 -0.12 0.07 0.00 0.00 0.00 0.00 60.65 60.58 1q3g s ILE 280 Cb 0.01 -0.31 -0.02 0.00 0.01 0.00 0.00 42.46 42.15 1q3g s ILE 280 CO -0.06 0.12 -0.21 -0.94 0.00 0.00 0.00 174.94 173.84 1q3g s SER 281 N 0.23 2.49 -0.04 3.58 1.04 0.41 -0.07 113.70 121.34 1q3g s SER 281 Ca -0.02 -0.40 0.01 0.00 0.48 0.00 0.00 55.95 56.02 1q3g s SER 281 Cb -0.05 -0.27 0.02 0.00 0.10 0.00 0.00 66.02 65.82 1q3g s SER 281 CO -0.00 0.25 -0.04 -0.22 0.98 0.00 0.00 173.24 174.21 1q3g s LEU 282 N -0.57 1.37 -0.10 2.42 0.20 0.25 -1.60 118.68 120.64 1q3g s LEU 282 Ca 0.08 -0.11 0.00 0.00 0.69 0.00 0.00 54.13 54.79 1q3g s LEU 282 Cb -0.08 -0.41 0.02 0.00 -0.43 0.00 0.00 46.19 45.29 1q3g s LEU 282 CO -0.01 -0.05 -0.09 -0.62 -0.29 0.00 0.00 176.35 175.30 1q3g s ASP 283 N 0.83 2.02 0.04 3.68 -1.08 -0.37 -0.20 116.67 121.60 1q3g s ASP 283 Ca -0.11 -0.30 0.24 0.00 -0.52 0.00 0.00 52.55 51.87 1q3g s ASP 283 Cb -0.14 -0.83 0.37 0.00 -1.46 0.00 0.00 42.92 40.87 1q3g s ASP 283 CO 0.00 -0.07 1.32 0.23 0.52 0.00 0.00 175.17 177.17 1q3g n MET 284 N 4.57 0.12 -3.75 4.34 2.81 -0.44 -1.33 117.12 123.44 1q3g n MET 284 Ca -0.16 0.02 -0.26 0.00 -1.81 0.00 0.00 57.70 55.49 1q3g n MET 284 Cb 0.51 -1.56 0.05 0.00 -0.71 0.00 0.00 33.22 31.51 1q3g n MET 284 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 1q3g n HIS 285 N -1.72 -2.45 -0.97 2.03 8.25 -1.26 -0.91 115.22 118.20 1q3g n HIS 285 Ca 0.04 0.94 0.00 0.00 -0.26 0.00 0.00 57.72 58.44 1q3g n HIS 285 Cb 0.38 -4.47 0.00 0.00 1.12 0.00 0.00 29.99 27.02 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 -1.75 0.19 3.83 -1.41 0.00 -0.74 -4.97 105.19 100.33 1q3g n GLY 286 Ca -0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.26 4.13 0.17 1.61 1.02 -0.09 -4.80 119.74 120.52 1q3g s LYS 287 Ca 0.00 1.06 -0.23 0.00 0.02 0.00 0.00 55.97 56.82 1q3g s LYS 287 Cb 0.00 -2.17 -0.08 0.00 -0.52 0.00 0.00 37.83 35.06 1q3g s LYS 287 CO 0.00 -0.11 0.73 0.50 -0.92 0.00 0.00 175.35 175.55 1q3g s ARG 288 N -3.48 4.42 0.55 1.68 3.52 -1.26 -4.12 118.95 120.25 1q3g s ARG 288 Ca 0.61 1.01 -0.19 0.00 -0.13 0.00 0.00 55.73 57.02 1q3g s ARG 288 Cb -0.09 -3.15 -0.06 0.00 -1.56 0.00 0.00 34.95 30.09 1q3g s ARG 288 CO 0.19 0.53 1.13 -1.25 -0.81 0.00 0.00 175.30 175.09 1q3g s PRO 289 N -1.38 3.34 -0.04 5.12 0.04 -1.26 -4.85 135.00 135.98 1q3g s PRO 289 Ca 0.37 1.60 -0.18 0.00 0.04 0.00 0.00 61.00 62.83 1q3g s PRO 289 Cb -0.21 -2.00 -0.05 0.00 0.04 0.00 0.00 34.50 32.28 1q3g s PRO 289 CO 0.24 -0.86 0.49 0.15 0.04 0.00 0.00 177.00 177.06 1q3g s LYS 290 N -3.32 4.20 0.42 4.56 -0.14 0.85 -0.72 119.74 125.59 1q3g s LYS 290 Ca 0.72 0.53 -0.25 0.00 -1.36 0.00 0.00 55.97 55.62 1q3g s LYS 290 Cb -0.24 -3.33 -0.10 0.00 -1.68 0.00 0.00 37.83 32.49 1q3g s LYS 290 CO 0.27 0.42 1.21 0.00 -0.76 0.00 0.00 175.35 176.49 1q3g n ALA 291 N 2.69 1.00 -2.33 5.17 0.00 -0.87 -4.34 120.51 121.84 1q3g n ALA 291 Ca -0.09 0.25 -0.17 0.00 0.00 0.00 0.00 53.44 53.43 1q3g n ALA 291 Cb 0.52 -2.22 -0.10 0.00 0.00 0.00 0.00 19.45 17.64 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 -1.22 1.17 -0.15 0.00 -7.23 -1.26 -4.87 120.40 106.84 1q3g s VAL 292 Ca 0.62 -2.06 -0.03 0.00 -1.81 0.00 0.00 61.98 58.70 1q3g s VAL 292 Cb -0.52 -2.26 -0.02 0.00 0.56 0.00 0.00 36.38 34.14 1q3g s VAL 292 CO 0.57 -0.41 -0.07 -0.89 -0.31 0.00 0.00 175.10 174.00 1q3g s THR 293 N -3.33 3.59 0.04 5.32 2.01 -1.26 -2.92 115.64 119.09 1q3g s THR 293 Ca 0.26 -0.46 0.06 0.00 0.31 0.00 0.00 61.69 61.85 1q3g s THR 293 Cb 0.05 -2.56 -0.02 0.00 0.01 0.00 0.00 72.50 69.97 1q3g s THR 293 CO 0.08 0.50 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.65 1q3g s VAL 294 N 0.44 1.30 -0.25 3.82 1.01 0.23 -4.98 120.40 121.97 1q3g s VAL 294 Ca -0.06 -1.09 -0.03 0.00 0.00 0.00 0.00 61.98 60.80 1q3g s VAL 294 Cb -0.15 -1.16 0.08 0.00 0.00 0.00 0.00 36.38 35.16 1q3g s VAL 294 CO 0.03 0.05 0.09 -0.60 0.00 0.00 0.00 175.10 174.68 1q3g s ARG 295 N -1.21 0.40 0.63 2.72 3.52 -1.26 -0.36 118.95 123.38 1q3g s ARG 295 Ca 0.03 -0.55 -0.18 0.00 -0.13 0.00 0.00 55.73 54.90 1q3g s ARG 295 Cb -0.08 -1.69 -0.02 0.00 -1.56 0.00 0.00 34.95 31.60 1q3g s ARG 295 CO 0.02 -0.86 1.20 0.95 -0.81 0.00 0.00 175.30 175.79 1q3g s THR 296 N 1.94 2.63 0.05 4.11 -4.23 -0.36 -4.36 115.64 115.42 1q3g s THR 296 Ca 0.06 0.37 -0.28 0.00 -1.18 0.00 0.00 61.69 60.65 1q3g s THR 296 Cb -0.17 -3.07 0.10 0.00 1.34 0.00 0.00 72.50 70.71 1q3g s THR 296 CO -0.23 -0.11 1.17 0.00 -0.54 0.00 0.00 174.62 174.91 1q3g s ALA 297 N -1.75 -2.02 0.75 3.99 0.00 -0.62 -4.06 121.76 118.04 1q3g s ALA 297 Ca 0.76 0.46 -0.15 0.00 0.00 0.00 0.00 51.96 53.02 1q3g s ALA 297 Cb -0.29 0.48 0.04 0.00 0.00 0.00 0.00 23.12 23.35 1q3g s ALA 297 CO 0.36 -1.05 1.19 -2.30 0.00 0.00 0.00 175.76 173.96 1q3g n PRO 298 N -0.50 0.51 -1.61 0.00 -0.02 -1.26 -4.40 135.00 127.72 1q3g n PRO 298 Ca -0.07 0.24 -0.38 0.00 -2.02 0.00 0.00 63.50 61.27 1q3g n PRO 298 Cb 0.62 -2.43 0.05 0.00 -0.02 0.00 0.00 33.50 31.72 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 -2.76 0.75 1.35 6.00 -0.00 -1.26 -1.68 115.22 117.62 1q3g n HIS 299 Ca 0.14 0.44 0.01 0.00 0.46 0.00 0.00 57.72 58.77 1q3g n HIS 299 Cb 0.50 -2.13 0.04 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 -0.94 1.30 -1.11 1.57 -0.04 -1.26 -4.63 135.00 129.89 1q3g n PRO 300 Ca 0.13 -0.33 -0.27 0.00 -0.04 0.00 0.00 63.50 62.99 1q3g n PRO 300 Cb 0.47 -1.28 0.22 0.00 -0.04 0.00 0.00 33.50 32.87 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 -0.12 -2.77 -1.73 0.55 0.00 -0.67 -4.25 120.51 111.50 1q3g n ALA 301 Ca 0.03 -1.50 -0.42 0.00 0.00 0.00 0.00 53.44 51.55 1q3g n ALA 301 Cb 0.19 -0.10 -0.03 0.00 0.00 0.00 0.00 19.45 19.51 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 -2.98 1.76 0.14 0.00 5.36 -1.26 -4.80 117.98 116.19 1q3g s PHE 302 Ca 0.65 -0.18 -0.30 0.00 -0.96 0.00 0.00 56.93 56.14 1q3g s PHE 302 Cb -0.05 -4.17 -0.07 0.00 -0.34 0.00 0.00 43.02 38.38 1q3g s PHE 302 CO 0.49 -5.04 1.24 -1.25 -1.46 0.00 0.00 175.22 169.20 1q3g s PRO 303 N 3.62 4.44 0.56 10.12 0.04 -1.26 -1.60 135.00 150.92 1q3g s PRO 303 Ca 0.83 1.89 0.28 0.00 0.04 0.00 0.00 61.00 64.04 1q3g s PRO 303 Cb -0.43 -3.27 1.67 0.00 0.04 0.00 0.00 34.50 32.52 1q3g s PRO 303 CO 0.38 -0.20 2.20 0.00 0.04 0.00 0.00 177.00 179.41 1q3g h THR 304 N 4.05 0.59 0.00 1.26 1.03 -1.92 -1.09 112.91 116.83 1q3g h THR 304 Ca -0.43 -0.15 0.00 0.00 -0.01 0.00 0.00 66.41 65.82 1q3g h THR 304 Cb 1.21 1.09 0.00 0.00 -1.07 0.00 0.00 68.15 69.39 1q3g h THR 304 CO 0.78 0.03 0.00 0.00 -0.01 0.00 0.00 175.52 176.33 1q3g n ALA 305 N -2.33 1.73 0.45 0.00 0.00 -1.26 -1.79 120.51 117.30 1q3g n ALA 305 Ca -0.03 -0.06 0.05 0.00 0.00 0.00 0.00 53.44 53.40 1q3g n ALA 305 Cb 0.12 -1.21 -0.03 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 -1.32 3.17 -0.03 0.00 2.00 -0.41 -4.74 117.12 115.78 1q3g n MET 306 Ca 0.06 -0.24 -0.09 0.00 0.00 0.00 0.00 57.70 57.43 1q3g n MET 306 Cb 0.11 -1.00 -0.03 0.00 0.00 0.00 0.00 33.22 32.30 1q3g n MET 306 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 175.97 176.34 1q3g h GLN 307 N 0.44 0.07 -0.31 0.03 -0.00 -1.36 -1.75 115.11 112.23 1q3g h GLN 307 Ca 0.00 -0.00 0.03 0.00 -0.00 0.00 0.00 58.65 58.67 1q3g h GLN 307 Cb 0.27 -0.02 -0.03 0.00 0.00 0.00 0.00 27.48 27.71 1q3g h GLN 307 CO 0.00 0.05 0.13 0.00 0.00 0.00 0.00 178.83 179.00 1q3g h ALA 308 N 1.14 0.36 -0.80 3.38 0.00 -1.85 0.64 119.26 122.12 1q3g h ALA 308 Ca 0.08 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.07 1q3g h ALA 308 Cb 0.09 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 1q3g h ALA 308 CO -0.13 -0.26 0.49 1.96 0.00 0.00 0.00 179.25 181.31 1q3g h GLN 309 N 0.28 0.89 0.00 0.00 7.50 -1.78 -0.90 115.11 121.10 1q3g h GLN 309 Ca 0.13 -0.05 0.00 0.00 0.50 0.00 0.00 58.65 59.23 1q3g h GLN 309 Cb 0.08 -0.20 0.00 0.00 0.05 0.00 0.00 27.48 27.41 1q3g h GLN 309 CO -0.12 0.59 0.00 0.74 -1.50 0.00 0.00 178.83 178.54 1q3g h PHE 310 N 0.91 0.00 -0.41 2.96 -1.00 -0.77 -2.23 116.94 116.40 1q3g h PHE 310 Ca 0.34 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 61.04 1q3g h PHE 310 Cb 0.14 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.68 1q3g h PHE 310 CO -0.04 0.00 -0.07 1.15 -1.61 0.00 0.00 178.31 177.74 1q3g h THR 311 N 0.00 1.27 0.12 -1.55 2.02 0.50 -1.88 112.91 113.40 1q3g h THR 311 Ca 0.00 -1.14 -0.00 0.00 0.77 0.00 0.00 66.41 66.04 1q3g h THR 311 Cb 0.71 1.18 -0.00 0.00 -1.74 0.00 0.00 68.15 68.30 1q3g h THR 311 CO 0.00 0.38 -0.08 0.25 0.37 0.00 0.00 175.52 176.44 1q3g h LEU 312 N 0.59 -0.21 -0.56 2.58 5.85 -1.07 -0.63 115.31 121.86 1q3g h LEU 312 Ca 0.11 0.02 0.11 0.00 0.84 0.00 0.00 57.88 58.95 1q3g h LEU 312 Cb 0.58 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.59 1q3g h LEU 312 CO 0.03 -0.14 0.05 0.25 -0.34 0.00 0.00 178.44 178.30 1q3g h LEU 313 N -0.21 -0.14 -0.80 2.25 6.46 -1.28 -0.69 115.31 120.91 1q3g h LEU 313 Ca -0.01 0.12 -0.07 0.00 -0.12 0.00 0.00 57.88 57.81 1q3g h LEU 313 Cb 0.18 0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.28 1q3g h LEU 313 CO 0.00 -0.05 0.15 0.78 -0.62 0.00 0.00 178.44 178.71 1q3g h ASN 314 N 0.17 1.00 0.35 1.25 2.35 -1.11 -1.92 115.58 117.67 1q3g h ASN 314 Ca 0.29 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1q3g h ASN 314 Cb 0.44 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.55 1q3g h ASN 314 CO -0.43 0.97 0.00 -0.07 -1.65 0.00 0.00 177.43 176.25 1q3g h LEU 315 N 1.00 0.00 -2.82 1.61 3.38 0.44 -1.61 115.31 117.31 1q3g h LEU 315 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1q3g h LEU 315 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1q3g h LEU 315 CO 0.00 0.00 -0.06 1.33 0.09 0.00 0.00 178.44 179.81 1q3g n VAL 316 N -2.31 1.43 -3.19 1.22 0.24 -0.99 -1.61 118.33 113.12 1q3g n VAL 316 Ca 0.00 -1.68 -0.20 0.00 -2.04 0.00 0.00 64.34 60.42 1q3g n VAL 316 Cb 0.13 0.04 0.01 0.00 -1.47 0.00 0.00 33.84 32.54 1q3g n VAL 316 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1q3g s ALA 317 N -2.08 4.13 -0.40 2.33 0.00 -0.61 -4.60 121.76 120.54 1q3g s ALA 317 Ca 0.21 -1.38 -0.24 0.00 0.00 0.00 0.00 51.96 50.54 1q3g s ALA 317 Cb 0.18 -1.83 0.02 0.00 0.00 0.00 0.00 23.12 21.49 1q3g s ALA 317 CO 0.02 -0.23 0.86 -2.00 0.00 0.00 0.00 175.76 174.40 1q3g s GLU 318 N -4.36 3.69 0.00 0.00 2.56 0.10 -3.71 118.70 116.98 1q3g s GLU 318 Ca 0.49 0.31 0.00 0.00 0.00 0.00 0.00 54.97 55.77 1q3g s GLU 318 Cb -0.10 -3.85 0.00 0.00 2.00 0.00 0.00 34.13 32.18 1q3g s GLU 318 CO 0.34 -0.99 0.00 0.41 -0.56 0.00 0.00 175.26 174.46 1q3g n GLY 319 N 4.62 0.06 3.40 -1.50 0.00 -1.26 -2.04 105.19 108.47 1q3g n GLY 319 Ca 0.05 -2.29 -0.39 0.00 0.00 0.00 0.00 46.02 43.39 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 -0.34 4.54 -0.02 2.61 2.01 -1.26 -2.14 115.64 121.04 1q3g s THR 320 Ca 0.00 -0.66 -0.01 0.00 0.31 0.00 0.00 61.69 61.33 1q3g s THR 320 Cb 0.00 -3.43 -0.04 0.00 0.01 0.00 0.00 72.50 69.05 1q3g s THR 320 CO 0.00 -0.08 0.07 -0.83 -0.69 0.00 0.00 174.62 173.08 1q3g s GLY 321 N 1.57 1.99 -0.12 4.40 0.00 -0.30 -4.77 107.32 110.10 1q3g s GLY 321 Ca 0.03 -0.86 0.02 0.00 0.00 0.00 0.00 44.72 43.91 1q3g s GLY 321 CO 0.06 -0.71 -0.17 0.14 0.00 0.00 0.00 173.10 172.41 1q3g s VAL 322 N -1.14 1.67 -0.14 1.40 1.01 -1.15 0.33 120.40 122.37 1q3g s VAL 322 Ca 0.21 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.46 1q3g s VAL 322 Cb -0.12 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.77 1q3g s VAL 322 CO 0.12 0.47 -0.20 -0.63 0.00 0.00 0.00 175.10 174.86 1q3g s ILE 323 N 0.91 2.20 -0.19 2.22 1.01 -0.86 -0.60 121.20 125.90 1q3g s ILE 323 Ca -0.07 -0.93 -0.01 0.00 0.00 0.00 0.00 60.65 59.63 1q3g s ILE 323 Cb -0.15 -1.89 -0.00 0.00 0.01 0.00 0.00 42.46 40.42 1q3g s ILE 323 CO -0.01 0.54 -0.11 -0.89 0.00 0.00 0.00 174.94 174.47 1q3g s THR 324 N 0.83 2.90 -0.28 2.92 2.01 0.51 -0.30 115.64 124.23 1q3g s THR 324 Ca -0.06 -0.67 -0.11 0.00 0.31 0.00 0.00 61.69 61.16 1q3g s THR 324 Cb -0.15 -2.27 -0.04 0.00 0.01 0.00 0.00 72.50 70.04 1q3g s THR 324 CO -0.02 0.48 0.18 -0.70 -0.69 0.00 0.00 174.62 173.87 1q3g s GLU 325 N 1.14 3.88 0.00 4.92 2.56 -0.21 -1.22 118.70 129.76 1q3g s GLU 325 Ca 0.01 -0.37 0.09 0.00 0.00 0.00 0.00 54.97 54.70 1q3g s GLU 325 Cb -0.14 -3.64 0.06 0.00 2.00 0.00 0.00 34.13 32.41 1q3g s GLU 325 CO -0.04 -0.20 0.76 0.25 -0.56 0.00 0.00 175.26 175.47 1q3g n THR 326 N 5.05 0.00 -0.12 -1.70 -2.24 -1.26 -4.74 114.28 109.27 1q3g n THR 326 Ca -0.14 -0.49 -0.26 0.00 -2.27 0.00 0.00 64.05 60.89 1q3g n THR 326 Cb 0.52 1.18 -0.11 0.00 -2.10 0.00 0.00 70.33 69.81 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 0.42 1.54 -5.13 2.28 2.08 -1.26 -4.96 119.36 114.33 1q3g n ILE 327 Ca 0.05 -0.27 -0.32 0.00 0.56 0.00 0.00 62.75 62.77 1q3g n ILE 327 Cb 0.22 -1.91 -0.16 0.00 -0.75 0.00 0.00 39.64 37.04 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 2.59 -0.21 1.39 0.40 -1.26 -5.03 117.98 113.40 1q3g s PHE 328 Ca -0.34 -0.87 0.25 0.00 -0.60 0.00 0.00 56.93 55.37 1q3g s PHE 328 Cb 0.11 -1.71 1.22 0.00 0.51 0.00 0.00 43.02 43.15 1q3g s PHE 328 CO 0.55 -0.32 1.75 1.05 0.70 0.00 0.00 175.22 178.96 1q3g h GLU 329 N 6.53 0.00 -1.69 0.44 9.09 -1.92 -3.32 114.58 123.71 1q3g h GLU 329 Ca -0.24 0.00 -0.44 0.00 0.05 0.00 0.00 59.36 58.73 1q3g h GLU 329 Cb 1.22 0.00 -0.37 0.00 -1.65 0.00 0.00 28.75 27.95 1q3g h GLU 329 CO 0.49 0.00 -1.11 -1.71 0.05 0.00 0.00 179.01 176.73 1q3g n ASN 330 N -2.37 0.50 -2.36 3.06 2.85 -0.69 -4.94 115.26 111.32 1q3g n ASN 330 Ca -0.00 -3.06 -0.30 0.00 -0.11 0.00 0.00 54.58 51.11 1q3g n ASN 330 Cb 0.12 -0.32 0.03 0.00 1.24 0.00 0.00 39.78 40.85 1q3g n ASN 330 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 1q3g n ARG 331 N 0.25 3.23 -0.16 1.20 0.63 -1.25 -4.21 116.66 116.34 1q3g n ARG 331 Ca 0.21 -3.96 0.07 0.00 -0.92 0.00 0.00 57.85 53.25 1q3g n ARG 331 Cb 0.68 -2.27 0.09 0.00 0.45 0.00 0.00 32.46 31.41 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 -0.67 0.00 0.32 -0.14 0.99 -1.26 -4.80 117.46 111.90 1q3g n PHE 332 Ca 0.48 -0.71 0.20 0.00 -0.00 0.00 0.00 57.45 57.43 1q3g n PHE 332 Cb 0.70 -0.12 1.05 0.00 -1.00 0.00 0.00 39.48 40.11 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 -1.99 114.93 112.74 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 1.06 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.70 1q3g h MET 333 CO 0.00 0.01 -0.61 1.12 1.06 0.00 0.00 176.91 178.49 1q3g h HIS 334 N 0.00 0.00 -0.09 -0.22 2.07 -1.94 -3.35 115.15 111.62 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 0.13 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.06 1q3g h HIS 334 CO 0.00 0.61 -0.25 0.28 -3.07 0.00 0.00 177.93 175.51 1q3g h VAL 335 N 0.00 0.42 -0.38 6.12 2.07 -1.74 -0.82 116.25 121.92 1q3g h VAL 335 Ca -0.01 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.56 1q3g h VAL 335 Cb 1.30 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1q3g h VAL 335 CO 0.08 0.00 0.26 -0.65 0.02 0.00 0.00 177.57 177.28 1q3g h PRO 336 N -0.33 0.31 -0.18 1.57 0.11 -1.74 -1.25 132.00 130.49 1q3g h PRO 336 Ca 0.09 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 66.06 1q3g h PRO 336 Cb 0.46 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.50 1q3g h PRO 336 CO -0.28 0.20 -0.35 0.93 -0.21 0.00 0.00 178.00 178.29 1q3g h GLU 337 N 0.31 0.55 -0.10 1.05 4.39 -1.56 -2.94 114.58 116.29 1q3g h GLU 337 Ca 0.16 -0.36 -0.06 0.00 0.34 0.00 0.00 59.36 59.45 1q3g h GLU 337 Cb 0.25 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1q3g h GLU 337 CO -0.04 0.97 -0.21 -0.07 -1.16 0.00 0.00 179.01 178.50 1q3g h LEU 338 N 0.20 0.16 -1.54 1.33 3.38 -0.64 -1.46 115.31 116.74 1q3g h LEU 338 Ca 0.01 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1q3g h LEU 338 Cb 0.95 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1q3g h LEU 338 CO 0.08 0.38 -0.01 0.40 0.09 0.00 0.00 178.44 179.38 1q3g h ILE 339 N 0.15 1.13 0.00 1.22 2.04 -1.14 0.84 117.51 121.75 1q3g h ILE 339 Ca 0.03 -0.51 -0.04 0.00 1.00 0.00 0.00 64.86 65.34 1q3g h ILE 339 Cb 0.47 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1q3g h ILE 339 CO 0.03 0.17 -0.18 0.03 0.00 0.00 0.00 178.15 178.21 1q3g h ARG 340 N 0.28 0.00 -0.44 2.37 3.08 -1.09 -1.03 114.38 117.56 1q3g h ARG 340 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 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 0.00 0.18 0.00 -1.33 -1.07 0.00 0.00 179.97 177.75 1q3g n MET 341 N -4.03 1.95 -0.22 0.04 2.81 0.25 -4.88 117.12 113.05 1q3g n MET 341 Ca -0.02 -1.18 0.00 0.00 -1.81 0.00 0.00 57.70 54.68 1q3g n MET 341 Cb 0.26 -1.38 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 0.83 0.75 3.81 3.03 0.00 -0.39 -0.14 105.19 113.08 1q3g n GLY 342 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.23 2.57 -0.14 4.61 0.00 -0.94 -4.97 121.76 120.67 1q3g s ALA 343 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.01 1q3g s ALA 343 Cb 0.00 -3.17 0.02 0.00 0.00 0.00 0.00 23.12 19.97 1q3g s ALA 343 CO 0.00 -1.35 -0.12 -1.01 0.00 0.00 0.00 175.76 173.28 1q3g s HIS 344 N -3.05 1.93 0.06 0.00 0.09 -1.26 -4.47 115.29 108.59 1q3g s HIS 344 Ca 0.59 -1.07 -0.26 0.00 -0.00 0.00 0.00 55.06 54.32 1q3g s HIS 344 Cb -0.14 -1.47 0.09 0.00 -0.00 0.00 0.00 32.58 31.06 1q3g s HIS 344 CO 0.55 -0.62 0.74 0.00 -0.00 0.00 0.00 174.74 175.41 1q3g s ALA 345 N 1.56 -1.72 -0.00 -1.40 0.00 -1.26 -1.29 121.76 117.65 1q3g s ALA 345 Ca 0.05 0.83 0.04 0.00 0.00 0.00 0.00 51.96 52.88 1q3g s ALA 345 Cb -0.13 0.53 -0.01 0.00 0.00 0.00 0.00 23.12 23.51 1q3g s ALA 345 CO -0.10 -0.67 -0.13 -1.21 0.00 0.00 0.00 175.76 173.65 1q3g s GLU 346 N -3.11 1.04 -0.22 0.00 8.01 -0.59 -4.97 118.70 118.87 1q3g s GLU 346 Ca 0.01 -0.50 -0.07 0.00 0.01 0.00 0.00 54.97 54.42 1q3g s GLU 346 Cb -0.01 -1.01 -0.03 0.00 -4.31 0.00 0.00 34.13 28.77 1q3g s GLU 346 CO -0.08 0.27 0.06 0.42 0.01 0.00 0.00 175.26 175.94 1q3g s ILE 347 N -0.37 4.48 -0.28 -1.63 1.01 -1.26 -0.18 121.20 122.97 1q3g s ILE 347 Ca 0.05 -0.13 0.01 0.00 0.00 0.00 0.00 60.65 60.58 1q3g s ILE 347 Cb -0.05 -3.06 0.08 0.00 0.01 0.00 0.00 42.46 39.44 1q3g s ILE 347 CO -0.00 0.39 0.02 -1.61 0.00 0.00 0.00 174.94 173.73 1q3g s GLU 348 N 1.10 1.27 7.64 2.79 0.41 -0.32 -5.01 118.70 126.57 1q3g s GLU 348 Ca 0.04 -1.19 0.00 0.00 -0.41 0.00 0.00 54.97 53.41 1q3g s GLU 348 Cb -0.14 -2.53 0.00 0.00 -1.78 0.00 0.00 34.13 29.68 1q3g s GLU 348 CO 0.03 -0.79 0.00 0.45 -0.49 0.00 0.00 175.26 174.46 1q3g n SER 349 N 4.64 0.00 -2.16 -0.19 2.88 -1.26 -2.05 113.62 115.49 1q3g n SER 349 Ca -0.05 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.29 1q3g n SER 349 Cb 0.43 0.00 0.20 0.00 -0.75 0.00 0.00 64.21 64.09 1q3g n SER 349 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1q3g n ASN 350 N 7.38 3.93 -3.90 -3.46 6.94 -1.26 -4.91 115.26 119.98 1q3g n ASN 350 Ca 0.00 -3.50 -0.11 0.00 -0.02 0.00 0.00 54.58 50.95 1q3g n ASN 350 Cb 0.00 -0.82 -0.12 0.00 -2.36 0.00 0.00 39.78 36.48 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 -3.16 0.05 -0.16 5.53 -4.23 -0.87 -1.05 115.64 111.75 1q3g s THR 351 Ca 0.55 -0.38 -0.04 0.00 -1.18 0.00 0.00 61.69 60.64 1q3g s THR 351 Cb 0.46 -0.17 -0.03 0.00 1.34 0.00 0.00 72.50 74.10 1q3g s THR 351 CO 0.11 -0.21 -0.02 0.68 -0.54 0.00 0.00 174.62 174.65 1q3g s VAL 352 N -0.62 4.07 -0.33 2.29 -7.23 0.59 -1.18 120.40 117.99 1q3g s VAL 352 Ca -0.07 -0.29 -0.18 0.00 -1.81 0.00 0.00 61.98 59.63 1q3g s VAL 352 Cb -0.04 -2.80 -0.01 0.00 0.56 0.00 0.00 36.38 34.09 1q3g s VAL 352 CO -0.00 0.48 0.49 -0.63 -0.31 0.00 0.00 175.10 175.13 1q3g s ILE 353 N 0.40 5.05 -0.14 -0.62 -1.09 0.74 -2.02 121.20 123.53 1q3g s ILE 353 Ca -0.02 0.43 -0.06 0.00 -2.23 0.00 0.00 60.65 58.76 1q3g s ILE 353 Cb -0.14 -3.91 -0.04 0.00 -1.58 0.00 0.00 42.46 36.79 1q3g s ILE 353 CO 0.02 -0.13 0.09 0.00 -1.23 0.00 0.00 174.94 173.69 1q3g s HIS 355 N -0.47 2.99 0.40 0.00 3.76 -0.41 -1.16 115.29 120.40 1q3g s HIS 355 Ca 0.11 -3.03 -0.24 0.00 -0.15 0.00 0.00 55.06 51.74 1q3g s HIS 355 Cb -0.12 -2.66 -0.12 0.00 1.11 0.00 0.00 32.58 30.80 1q3g s HIS 355 CO 0.02 -0.76 0.85 0.41 -0.85 0.00 0.00 174.74 174.41 1q3g n GLY 356 N 3.24 -0.66 3.40 -2.22 0.00 -0.91 -4.16 105.19 103.87 1q3g n GLY 356 Ca 0.06 0.13 -0.21 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.31 2.03 0.07 1.61 -7.23 -0.63 -4.71 120.40 110.23 1q3g s VAL 357 Ca 0.63 -2.29 -0.33 0.00 -1.81 0.00 0.00 61.98 58.18 1q3g s VAL 357 Cb -0.59 -2.16 -0.17 0.00 0.56 0.00 0.00 36.38 34.01 1q3g s VAL 357 CO 0.57 -0.51 1.51 -0.08 -0.31 0.00 0.00 175.10 176.29 1q3g h GLU 358 N 2.43 -1.00 -4.03 4.82 4.57 -1.89 -3.40 114.58 116.09 1q3g h GLU 358 Ca -0.39 0.07 -0.13 0.00 -1.18 0.00 0.00 59.36 57.73 1q3g h GLU 358 Cb 1.24 0.23 -0.17 0.00 -0.16 0.00 0.00 28.75 29.88 1q3g h GLU 358 CO 0.61 -0.66 -0.61 0.15 -1.18 0.00 0.00 179.01 177.32 1q3g s LYS 359 N -5.63 0.56 0.22 1.92 1.02 -1.26 -4.99 119.74 111.59 1q3g s LYS 359 Ca -0.17 -0.94 0.03 0.00 0.02 0.00 0.00 55.97 54.91 1q3g s LYS 359 Cb 0.03 0.21 -0.03 0.00 -0.52 0.00 0.00 37.83 37.51 1q3g s LYS 359 CO 0.54 -0.12 0.37 -0.51 -0.92 0.00 0.00 175.35 174.71 1q3g s LEU 360 N -2.40 4.27 -0.13 3.17 1.43 -1.26 -4.95 118.68 118.81 1q3g s LEU 360 Ca -0.01 0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 53.25 1q3g s LEU 360 Cb 0.02 -2.97 -0.03 0.00 0.03 0.00 0.00 46.19 43.24 1q3g s LEU 360 CO -0.07 -0.06 -0.05 -0.44 0.23 0.00 0.00 176.35 175.96 1q3g s SER 361 N -3.68 4.75 0.49 2.29 0.01 0.81 0.68 113.70 119.05 1q3g s SER 361 Ca 0.35 -0.09 -0.24 0.00 1.31 0.00 0.00 55.95 57.28 1q3g s SER 361 Cb -0.10 -1.61 -0.07 0.00 0.21 0.00 0.00 66.02 64.45 1q3g s SER 361 CO 0.30 0.23 1.37 0.61 0.41 0.00 0.00 173.24 176.15 1q3g n GLY 362 N 3.12 0.81 3.83 3.44 0.00 -0.75 -4.44 105.19 111.20 1q3g n GLY 362 Ca -0.18 0.12 -0.05 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.24 -1.35 -0.32 4.61 0.00 -1.11 -4.76 121.76 117.58 1q3g s ALA 363 Ca 0.65 -0.31 -0.21 0.00 0.00 0.00 0.00 51.96 52.09 1q3g s ALA 363 Cb -0.45 0.72 -0.00 0.00 0.00 0.00 0.00 23.12 23.39 1q3g s ALA 363 CO 0.54 -1.04 0.69 -0.65 0.00 0.00 0.00 175.76 175.30 1q3g s GLN 364 N -2.70 3.84 0.30 0.00 -0.21 -1.26 -2.00 119.66 117.63 1q3g s GLN 364 Ca 0.16 0.31 0.08 0.00 0.02 0.00 0.00 55.36 55.93 1q3g s GLN 364 Cb -0.03 -3.76 -0.06 0.00 1.00 0.00 0.00 33.01 30.16 1q3g s GLN 364 CO 0.06 -0.67 -0.09 0.14 -2.12 0.00 0.00 175.29 172.61 1q3g s VAL 365 N 2.77 1.94 -0.13 1.09 -7.23 -0.26 -4.97 120.40 113.61 1q3g s VAL 365 Ca 0.27 -2.18 0.02 0.00 -1.81 0.00 0.00 61.98 58.28 1q3g s VAL 365 Cb -0.14 -2.49 0.01 0.00 0.56 0.00 0.00 36.38 34.32 1q3g s VAL 365 CO 0.13 -0.29 -0.20 -0.32 -0.31 0.00 0.00 175.10 174.12 1q3g s MET 366 N -3.66 2.76 0.29 4.82 1.75 -1.26 -1.12 119.30 122.87 1q3g s MET 366 Ca 0.30 -0.76 -0.29 0.00 -1.25 0.00 0.00 55.69 53.69 1q3g s MET 366 Cb 0.02 -2.28 -0.10 0.00 2.84 0.00 0.00 34.83 35.32 1q3g s MET 366 CO 0.14 -0.05 1.27 0.00 -0.65 0.00 0.00 175.02 175.72 1q3g s ALA 367 N 0.93 3.49 -0.02 4.11 0.00 -0.64 -4.93 121.76 124.71 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 -0.05 0.00 0.00 0.00 0.00 23.12 19.46 1q3g s ALA 367 CO -0.03 -0.52 0.09 0.25 0.00 0.00 0.00 175.76 175.54 1q3g n THR 368 N 1.34 0.00 -3.82 0.00 -2.24 -1.26 -4.83 114.28 103.46 1q3g n THR 368 Ca 0.01 -0.12 -0.06 0.00 -2.27 0.00 0.00 64.05 61.61 1q3g n THR 368 Cb 0.43 0.48 -0.01 0.00 -2.10 0.00 0.00 70.33 69.13 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 -2.30 -0.17 0.06 3.42 1.47 -1.26 -4.94 116.67 112.94 1q3g s ASP 369 Ca -0.01 -0.65 -0.17 0.00 1.18 0.00 0.00 52.55 52.90 1q3g s ASP 369 Cb 0.02 0.67 -0.07 0.00 -0.34 0.00 0.00 42.92 43.21 1q3g s ASP 369 CO 0.15 -1.26 1.27 0.25 0.68 0.00 0.00 175.17 176.26 1q3g h LEU 370 N 2.00 -0.83 -1.38 2.11 5.85 -1.99 -0.64 115.31 120.43 1q3g h LEU 370 Ca -0.23 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.52 1q3g h LEU 370 Cb 1.24 0.32 -0.01 0.00 0.37 0.00 0.00 40.66 42.58 1q3g h LEU 370 CO 0.28 -0.25 -0.31 0.03 -0.34 0.00 0.00 178.44 177.85 1q3g h ARG 371 N -0.31 0.00 -0.45 1.25 2.47 -1.91 -2.73 114.38 112.69 1q3g h ARG 371 Ca 0.01 0.00 -0.14 0.00 -1.26 0.00 0.00 59.98 58.59 1q3g h ARG 371 Cb 0.34 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.65 1q3g h ARG 371 CO -0.19 0.31 -0.26 0.00 0.56 0.00 0.00 179.97 180.39 1q3g h ALA 372 N 1.69 0.69 -0.67 0.04 0.00 -1.91 -1.81 119.26 117.28 1q3g h ALA 372 Ca -0.00 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 1q3g h ALA 372 Cb 0.58 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1q3g h ALA 372 CO 0.04 0.67 0.41 0.66 0.00 0.00 0.00 179.25 181.03 1q3g h SER 373 N 0.82 0.81 -0.47 0.00 4.64 -0.82 0.15 113.55 118.67 1q3g h SER 373 Ca 0.10 -0.06 -0.06 0.00 -0.47 0.00 0.00 61.79 61.29 1q3g h SER 373 Cb 0.83 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.70 1q3g h SER 373 CO 0.07 0.63 0.07 0.00 -0.87 0.00 0.00 176.83 176.73 1q3g h ALA 374 N 1.21 1.13 -0.47 5.18 0.00 -1.37 -1.12 119.26 123.82 1q3g h ALA 374 Ca 0.24 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1q3g h ALA 374 Cb -0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1q3g h ALA 374 CO -0.05 0.57 0.08 0.77 0.00 0.00 0.00 179.25 180.63 1q3g h SER 375 N 0.80 0.74 0.18 0.00 0.02 -0.39 -1.22 113.55 113.68 1q3g h SER 375 Ca 0.17 -0.26 -0.08 0.00 -0.84 0.00 0.00 61.79 60.78 1q3g h SER 375 Cb 0.38 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 1q3g h SER 375 CO 0.01 0.81 -0.28 -0.07 -1.14 0.00 0.00 176.83 176.16 1q3g h LEU 376 N 0.64 0.18 -0.29 5.07 3.38 -0.40 -0.35 115.31 123.54 1q3g h LEU 376 Ca 0.14 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.92 1q3g h LEU 376 Cb 0.38 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1q3g h LEU 376 CO 0.01 0.46 -0.36 0.58 0.09 0.00 0.00 178.44 179.22 1q3g h VAL 377 N 0.16 1.30 -0.39 1.22 2.07 -0.88 -1.80 116.25 117.92 1q3g h VAL 377 Ca 0.02 -1.55 -0.07 0.00 0.82 0.00 0.00 66.70 65.93 1q3g h VAL 377 Cb 0.59 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 1q3g h VAL 377 CO 0.04 0.50 -0.04 -0.07 0.02 0.00 0.00 177.57 178.02 1q3g h LEU 378 N 0.50 0.62 -0.61 2.57 3.38 -0.89 -2.26 115.31 118.62 1q3g h LEU 378 Ca 0.04 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1q3g h LEU 378 Cb 0.95 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 1q3g h LEU 378 CO 0.09 0.73 0.36 0.00 0.09 0.00 0.00 178.44 179.70 1q3g h ALA 379 N 1.34 0.77 -0.60 1.53 0.00 -0.86 -1.92 119.26 119.53 1q3g h ALA 379 Ca 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1q3g h ALA 379 Cb 0.45 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1q3g h ALA 379 CO 0.02 0.26 0.39 0.78 0.00 0.00 0.00 179.25 180.70 1q3g h GLY 380 N 0.82 0.85 1.53 0.00 0.00 -0.78 0.74 103.07 106.23 1q3g h GLY 380 Ca 0.22 -0.32 -0.04 0.00 0.00 0.00 0.00 47.33 47.18 1q3g h GLY 380 CO -0.04 0.32 0.05 0.00 0.00 0.00 0.00 176.54 176.87 1q3g n ILE 382 N -4.30 0.00 -1.61 0.00 -5.35 -0.93 -0.58 119.36 106.60 1q3g n ILE 382 Ca 0.02 -0.26 -0.31 0.00 -0.27 0.00 0.00 62.75 61.93 1q3g n ILE 382 Cb 0.22 1.17 0.06 0.00 -1.74 0.00 0.00 39.64 39.35 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 -2.21 2.61 -0.47 -1.28 0.00 0.21 -4.53 121.76 116.09 1q3g s ALA 383 Ca 0.13 -0.03 -0.23 0.00 0.00 0.00 0.00 51.96 51.83 1q3g s ALA 383 Cb 0.14 -3.14 0.03 0.00 0.00 0.00 0.00 23.12 20.15 1q3g s ALA 383 CO 0.52 -1.31 0.79 -2.00 0.00 0.00 0.00 175.76 173.76 1q3g s GLU 384 N -5.10 3.37 0.00 0.00 2.56 0.21 -1.76 118.70 117.98 1q3g s GLU 384 Ca 0.58 -0.19 0.00 0.00 0.00 0.00 0.00 54.97 55.36 1q3g s GLU 384 Cb -0.14 -3.97 0.00 0.00 2.00 0.00 0.00 34.13 32.03 1q3g s GLU 384 CO 0.55 -1.18 0.00 0.41 -0.56 0.00 0.00 175.26 174.48 1q3g n GLY 385 N 5.02 0.05 3.62 -1.50 0.00 -0.42 -1.81 105.19 110.15 1q3g n GLY 385 Ca 0.01 -2.02 -0.35 0.00 0.00 0.00 0.00 46.02 43.66 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 4.85 -0.04 2.61 2.01 -1.26 -0.22 115.64 123.59 1q3g s THR 386 Ca 0.00 -0.01 0.05 0.00 0.31 0.00 0.00 61.69 62.05 1q3g s THR 386 Cb 0.00 -3.21 -0.02 0.00 0.01 0.00 0.00 72.50 69.28 1q3g s THR 386 CO 0.00 0.42 -0.20 -0.89 -0.69 0.00 0.00 174.62 173.26 1q3g s THR 387 N 0.67 2.59 -0.23 -0.82 2.01 0.11 -2.75 115.64 117.23 1q3g s THR 387 Ca 0.04 -0.90 0.02 0.00 0.31 0.00 0.00 61.69 61.16 1q3g s THR 387 Cb -0.13 -1.97 0.05 0.00 0.01 0.00 0.00 72.50 70.46 1q3g s THR 387 CO 0.02 0.58 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.73 1q3g s VAL 388 N -0.58 1.87 -0.48 3.82 1.01 -0.85 0.12 120.40 125.31 1q3g s VAL 388 Ca 0.08 -1.27 -0.17 0.00 0.00 0.00 0.00 61.98 60.62 1q3g s VAL 388 Cb -0.11 -1.96 0.06 0.00 0.00 0.00 0.00 36.38 34.38 1q3g s VAL 388 CO 0.00 0.09 0.49 -0.69 0.00 0.00 0.00 175.10 175.00 1q3g s VAL 389 N 1.27 5.08 0.50 2.92 1.01 0.01 -1.10 120.40 130.09 1q3g s VAL 389 Ca -0.04 -0.79 -0.18 0.00 0.00 0.00 0.00 61.98 60.97 1q3g s VAL 389 Cb -0.18 -4.19 -0.08 0.00 0.00 0.00 0.00 36.38 31.93 1q3g s VAL 389 CO -0.07 -0.66 0.99 -0.62 0.00 0.00 0.00 175.10 174.74 1q3g s ASP 390 N 2.58 6.59 -1.10 3.32 2.15 -0.28 -1.82 116.67 128.11 1q3g s ASP 390 Ca 0.09 1.66 -0.02 0.00 0.43 0.00 0.00 52.55 54.71 1q3g s ASP 390 Cb -0.22 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 39.88 1q3g s ASP 390 CO 0.09 -0.61 0.93 0.54 -0.17 0.00 0.00 175.17 175.95 1q3g n ARG 391 N -1.34 -6.18 0.00 4.34 1.74 -1.15 -1.61 116.66 112.45 1q3g n ARG 391 Ca 0.07 0.75 0.10 0.00 -0.77 0.00 0.00 57.85 58.00 1q3g n ARG 391 Cb 0.54 -5.50 0.57 0.00 -1.02 0.00 0.00 32.46 27.06 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 -4.01 0.00 0.02 0.55 -6.64 -1.20 -3.15 119.36 104.94 1q3g n ILE 392 Ca -0.19 0.00 0.13 0.00 -1.77 0.00 0.00 62.75 60.92 1q3g n ILE 392 Cb 0.63 -0.48 0.58 0.00 -1.44 0.00 0.00 39.64 38.93 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 0.22 -0.88 4.28 -0.00 -1.90 0.14 116.97 118.83 1q3g h TYR 393 Ca 0.00 0.01 0.14 0.00 0.00 0.00 0.00 58.73 58.87 1q3g h TYR 393 Cb 0.00 -0.07 -0.09 0.00 0.00 0.00 0.00 36.73 36.57 1q3g h TYR 393 CO 0.00 0.11 0.48 0.45 -0.00 0.00 0.00 178.16 179.20 1q3g h HIS 394 N 0.21 0.86 0.00 0.10 3.86 -1.91 -0.39 115.15 117.88 1q3g h HIS 394 Ca 0.20 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.39 1q3g h HIS 394 Cb 0.53 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.74 1q3g h HIS 394 CO -0.00 0.25 -0.26 0.97 0.86 0.00 0.00 177.93 179.75 1q3g h ILE 395 N 0.71 0.97 0.00 2.45 2.10 -0.98 -2.60 117.51 120.16 1q3g h ILE 395 Ca 0.47 -0.96 0.00 0.00 1.08 0.00 0.00 64.86 65.44 1q3g h ILE 395 Cb 0.61 1.55 0.00 0.00 -1.09 0.00 0.00 36.82 37.89 1q3g h ILE 395 CO -0.33 0.25 0.00 0.47 -1.08 0.00 0.00 178.15 177.46 1q3g n ASP 396 N -3.92 0.37 0.06 2.19 8.00 -0.16 -1.79 116.55 121.31 1q3g n ASP 396 Ca -0.02 0.59 -0.13 0.00 0.71 0.00 0.00 54.79 55.94 1q3g n ASP 396 Cb 0.34 -0.67 -0.04 0.00 -0.02 0.00 0.00 41.12 40.74 1q3g n ASP 396 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1q3g h ARG 397 N 0.00 0.41 0.00 -1.24 3.08 -1.48 -2.23 114.38 112.91 1q3g h ARG 397 Ca 0.00 -0.42 0.00 0.00 0.07 0.00 0.00 59.98 59.63 1q3g h ARG 397 Cb 0.33 0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1q3g h ARG 397 CO 0.00 1.09 0.00 0.41 -1.07 0.00 0.00 179.97 180.40 1q3g n GLY 398 N 0.89 -0.29 2.99 0.04 0.00 -1.14 -4.06 105.19 103.62 1q3g n GLY 398 Ca -0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.18 1.93 -0.38 1.61 1.51 -0.74 -4.90 117.35 116.21 1q3g s TYR 399 Ca 0.00 -1.04 -0.29 0.00 -1.01 0.00 0.00 57.07 54.73 1q3g s TYR 399 Cb 0.00 -1.46 0.02 0.00 -0.11 0.00 0.00 41.96 40.41 1q3g s TYR 399 CO 0.00 -0.60 1.09 -2.00 -1.11 0.00 0.00 175.55 172.93 1q3g s GLU 400 N 1.50 3.94 -1.22 -0.62 2.12 -1.26 -4.16 118.70 119.00 1q3g s GLU 400 Ca 0.04 0.88 -0.21 0.00 0.36 0.00 0.00 54.97 56.04 1q3g s GLU 400 Cb -0.13 -3.80 0.01 0.00 0.26 0.00 0.00 34.13 30.47 1q3g s GLU 400 CO -0.09 -1.07 0.67 0.54 -0.54 0.00 0.00 175.26 174.76 1q3g n ARG 401 N 7.21 -1.22 0.15 4.30 1.74 -1.26 -4.84 116.66 122.74 1q3g n ARG 401 Ca 0.12 0.31 -0.00 0.00 -0.77 0.00 0.00 57.85 57.51 1q3g n ARG 401 Cb 0.48 -3.67 0.25 0.00 -1.02 0.00 0.00 32.46 28.50 1q3g n ARG 401 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1q3g h ILE 402 N -2.11 1.35 -0.02 0.55 2.10 -1.95 -2.61 117.51 114.81 1q3g h ILE 402 Ca -0.68 -1.67 0.02 0.00 1.08 0.00 0.00 64.86 63.62 1q3g h ILE 402 Cb 1.38 1.87 -0.03 0.00 -1.09 0.00 0.00 36.82 38.95 1q3g h ILE 402 CO 0.52 0.48 -0.13 -0.08 -1.08 0.00 0.00 178.15 177.87 1q3g h GLU 403 N 0.05 -0.20 -0.27 2.19 4.81 -1.94 0.11 114.58 119.32 1q3g h GLU 403 Ca -0.00 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.20 1q3g h GLU 403 Cb 0.87 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.29 1q3g h GLU 403 CO 0.07 -0.13 0.00 -0.44 -0.73 0.00 0.00 179.01 177.77 1q3g h ASP 404 N -0.21 0.47 -0.84 1.04 3.45 -1.91 -1.31 116.42 117.12 1q3g h ASP 404 Ca 0.05 -0.31 -0.02 0.00 0.43 0.00 0.00 57.03 57.19 1q3g h ASP 404 Cb 0.27 -0.13 -0.04 0.00 -0.56 0.00 0.00 39.33 38.88 1q3g h ASP 404 CO -0.14 0.66 0.45 0.11 -1.57 0.00 0.00 179.24 178.75 1q3g h LYS 405 N 0.27 1.17 -0.41 3.56 1.57 -1.30 -0.73 116.57 120.70 1q3g h LYS 405 Ca 0.08 -0.14 -0.13 0.00 -1.87 0.00 0.00 60.65 58.59 1q3g h LYS 405 Cb 0.42 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 1q3g h LYS 405 CO 0.01 0.87 -0.24 -0.07 -0.57 0.00 0.00 179.45 179.45 1q3g h LEU 406 N 1.17 0.92 -0.46 2.94 3.38 -0.72 -2.99 115.31 119.55 1q3g h LEU 406 Ca 0.29 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 57.86 1q3g h LEU 406 Cb 0.04 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1q3g h LEU 406 CO -0.05 1.14 0.29 -0.09 0.09 0.00 0.00 178.44 179.82 1q3g h ARG 407 N 0.70 0.56 0.00 1.13 2.43 -0.90 0.06 114.38 118.37 1q3g h ARG 407 Ca 0.09 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 1q3g h ARG 407 Cb 0.81 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 1q3g h ARG 407 CO 0.07 0.37 0.00 0.00 -1.51 0.00 0.00 179.97 178.90 1q3g n ALA 408 N -2.24 1.16 0.49 2.80 0.00 -0.31 -0.14 120.51 122.27 1q3g n ALA 408 Ca 0.02 -0.01 0.09 0.00 0.00 0.00 0.00 53.44 53.55 1q3g n ALA 408 Cb 0.04 -1.04 0.13 0.00 0.00 0.00 0.00 19.45 18.58 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 -1.44 2.85 0.00 0.00 4.77 -0.05 -4.72 117.00 118.40 1q3g n LEU 409 Ca 0.01 -1.27 0.00 0.00 -0.03 0.00 0.00 56.01 54.71 1q3g n LEU 409 Cb 0.02 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 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 1.11 1.04 3.79 -0.72 0.00 0.80 -0.66 105.19 110.55 1q3g n GLY 410 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 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 3.03 -0.77 4.61 0.00 -0.84 -4.76 121.76 121.03 1q3g s ALA 411 Ca 0.00 0.62 -0.06 0.00 0.00 0.00 0.00 51.96 52.52 1q3g s ALA 411 Cb 0.00 -3.24 0.20 0.00 0.00 0.00 0.00 23.12 20.07 1q3g s ALA 411 CO 0.00 -0.17 0.65 1.21 0.00 0.00 0.00 175.76 177.45 1q3g s ASN 412 N -1.78 5.96 0.03 0.00 3.84 -1.26 -4.47 114.94 117.26 1q3g s ASN 412 Ca 0.61 -3.03 0.04 0.00 0.21 0.00 0.00 52.86 50.68 1q3g s ASN 412 Cb -0.18 -1.99 -0.02 0.00 -0.55 0.00 0.00 41.25 38.51 1q3g s ASN 412 CO 0.23 -0.38 -0.12 -0.51 -2.79 0.00 0.00 177.10 173.52 1q3g s ILE 413 N -0.34 0.94 -0.19 -5.21 2.07 -1.26 -0.98 121.20 116.24 1q3g s ILE 413 Ca 0.20 -0.87 -0.13 0.00 -1.41 0.00 0.00 60.65 58.44 1q3g s ILE 413 Cb -0.14 -0.86 0.06 0.00 0.13 0.00 0.00 42.46 41.65 1q3g s ILE 413 CO -0.07 -0.00 0.47 -1.83 -1.91 0.00 0.00 174.94 171.60 1q3g s GLU 414 N -0.99 0.50 -0.07 3.50 -1.05 -0.71 -4.99 118.70 114.89 1q3g s GLU 414 Ca 0.00 0.78 -0.23 0.00 -0.15 0.00 0.00 54.97 55.37 1q3g s GLU 414 Cb -0.07 0.12 -0.04 0.00 -0.44 0.00 0.00 34.13 33.71 1q3g s GLU 414 CO 0.01 -0.12 0.70 0.50 0.95 0.00 0.00 175.26 177.30 1q3g s ARG 415 N 0.92 4.43 0.24 -4.83 3.52 -1.26 -0.77 118.95 121.20 1q3g s ARG 415 Ca -0.05 0.87 0.09 0.00 -0.13 0.00 0.00 55.73 56.51 1q3g s ARG 415 Cb -0.06 -3.45 -0.05 0.00 -1.56 0.00 0.00 34.95 29.83 1q3g s ARG 415 CO -0.08 0.05 -0.15 0.14 -0.81 0.00 0.00 175.30 174.45 1q3g s VAL 416 N 0.86 2.00 -0.20 7.11 -7.23 0.24 -4.94 120.40 118.24 1q3g s VAL 416 Ca 0.37 -2.27 -0.22 0.00 -1.81 0.00 0.00 61.98 58.05 1q3g s VAL 416 Cb -0.18 -2.19 -0.20 0.00 0.56 0.00 0.00 36.38 34.38 1q3g s VAL 416 CO 0.18 -0.49 0.27 0.11 -0.31 0.00 0.00 175.10 174.86 1q3g h LYS 417 N 2.42 0.00 -5.90 4.82 6.56 -1.86 0.21 116.57 122.81 1q3g h LYS 417 Ca -0.39 0.00 -0.35 0.00 -1.06 0.00 0.00 60.65 58.85 1q3g h LYS 417 Cb 1.24 0.00 -0.15 0.00 -0.57 0.00 0.00 32.23 32.74 1q3g h LYS 417 CO 0.62 0.99 -0.54 0.41 -2.06 0.00 0.00 179.45 178.88 1q3g n GLY 418 N 1.45 -0.12 1.92 3.86 0.00 -1.26 -4.17 105.19 106.88 1q3g n GLY 418 Ca -0.30 0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1q3g n GLY 418 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48