#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q3u s GLU 6 N 0.00 4.28 0.59 -0.14 2.02 -1.26 -5.07 118.70 119.11 2q3u s GLU 6 Ca 0.00 1.15 -0.05 0.00 0.02 0.00 0.00 54.97 56.10 2q3u s GLU 6 Cb 0.00 -2.28 0.01 0.00 0.10 0.00 0.00 34.13 31.97 2q3u s GLU 6 CO 0.00 0.02 0.88 -1.54 0.02 0.00 0.00 175.26 174.64 2q3u s SER 7 N -2.09 5.51 0.22 -0.19 1.04 -1.26 -5.00 113.70 111.93 2q3u s SER 7 Ca 0.60 0.60 -0.07 0.00 0.48 0.00 0.00 55.95 57.56 2q3u s SER 7 Cb -0.11 -1.57 0.17 0.00 0.10 0.00 0.00 66.02 64.62 2q3u s SER 7 CO 0.15 -1.09 1.74 -0.65 0.98 0.00 0.00 173.24 174.37 2q3u h PRO 8 N -0.15 1.09 -0.83 4.02 0.11 -1.88 -2.67 132.00 131.70 2q3u h PRO 8 Ca -0.45 -0.25 0.11 0.00 0.11 0.00 0.00 66.00 65.52 2q3u h PRO 8 Cb 1.26 -0.15 -0.06 0.00 0.11 0.00 0.00 31.00 32.16 2q3u h PRO 8 CO 0.60 0.96 0.54 0.00 -0.21 0.00 0.00 178.00 179.88 2q3u h ALA 9 N 1.15 1.80 0.00 -0.75 0.00 -1.67 0.83 119.26 120.61 2q3u h ALA 9 Ca 0.22 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2q3u h ALA 9 Cb 0.35 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2q3u h ALA 9 CO -0.00 0.01 -0.06 0.93 0.00 0.00 0.00 179.25 180.13 2q3u h GLU 10 N 0.71 0.00 -0.20 0.00 5.08 -1.79 -2.18 114.58 116.20 2q3u h GLU 10 Ca 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.75 2q3u h GLU 10 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2q3u h GLU 10 CO -0.16 0.06 0.00 0.72 -1.00 0.00 0.00 179.01 178.63 2q3u n HIS 11 N -3.36 0.25 -0.31 4.33 8.25 0.20 -4.98 115.22 119.59 2q3u n HIS 11 Ca -0.01 -0.17 0.00 0.00 -0.26 0.00 0.00 57.72 57.27 2q3u n HIS 11 Cb 0.22 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.32 2q3u n HIS 11 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2q3u n GLY 12 N 1.03 0.75 3.84 -1.41 0.00 -0.68 -5.01 105.19 103.70 2q3u n GLY 12 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2q3u n GLY 12 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2q3u s TYR 13 N -2.67 3.39 0.00 1.61 2.02 -0.83 -4.58 117.35 116.28 2q3u s TYR 13 Ca 0.00 1.39 0.00 0.00 -0.37 0.00 0.00 57.07 58.09 2q3u s TYR 13 Cb 0.00 -2.70 0.00 0.00 -0.40 0.00 0.00 41.96 38.86 2q3u s TYR 13 CO 0.00 -0.14 0.00 2.48 -1.57 0.00 0.00 175.55 176.32 2q3u n TYR 14 N -0.95 0.00 -3.88 2.71 0.18 -0.32 -4.27 117.16 110.63 2q3u n TYR 14 Ca 0.05 0.00 -0.09 0.00 1.88 0.00 0.00 57.90 59.74 2q3u n TYR 14 Cb 0.54 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.43 2q3u n TYR 14 CO 0.00 0.00 0.00 -1.25 -2.08 0.00 0.00 176.86 173.53 2q3u s PRO 16 N 2.86 1.06 0.65 -3.48 0.04 -1.26 -1.39 135.00 133.47 2q3u s PRO 16 Ca 0.00 -1.04 -0.15 0.00 0.04 0.00 0.00 61.00 59.84 2q3u s PRO 16 Cb 0.00 0.38 -0.01 0.00 0.04 0.00 0.00 34.50 34.91 2q3u s PRO 16 CO 0.00 -0.38 1.11 0.00 0.04 0.00 0.00 177.00 177.77 2q3u s ALA 17 N -3.91 2.50 -0.19 8.56 0.00 -1.26 -4.68 121.76 122.78 2q3u s ALA 17 Ca 0.11 0.57 0.26 0.00 0.00 0.00 0.00 51.96 52.90 2q3u s ALA 17 Cb 0.03 -3.32 1.25 0.00 0.00 0.00 0.00 23.12 21.08 2q3u s ALA 17 CO -0.05 -1.21 1.79 1.49 0.00 0.00 0.00 175.76 177.78 2q3u h GLU 18 N 0.15 0.00 -0.62 0.00 4.81 -1.94 -2.05 114.58 114.93 2q3u h GLU 18 Ca -0.47 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2q3u h GLU 18 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 2q3u h GLU 18 CO 0.54 0.00 0.00 -2.67 -0.73 0.00 0.00 179.01 176.15 2q3u n TRP 19 N -2.43 1.01 -2.42 0.92 2.14 -1.26 -4.78 117.44 110.62 2q3u n TRP 19 Ca 0.00 -0.39 -0.24 0.00 2.07 0.00 0.00 57.50 58.94 2q3u n TRP 19 Cb 0.15 -0.20 0.06 0.00 -0.81 0.00 0.00 31.31 30.51 2q3u n TRP 19 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2q3u s ASP 20 N -0.72 4.89 0.17 -0.67 1.11 -0.77 -5.01 116.67 115.68 2q3u s ASP 20 Ca 0.33 0.16 -0.31 0.00 0.18 0.00 0.00 52.55 52.91 2q3u s ASP 20 Cb 0.22 -0.86 -0.09 0.00 1.07 0.00 0.00 42.92 43.26 2q3u s ASP 20 CO 0.15 -1.48 1.41 -0.55 1.18 0.00 0.00 175.17 175.88 2q3u s SER 21 N -4.52 6.77 -0.08 0.27 0.15 -1.26 -4.92 113.70 110.12 2q3u s SER 21 Ca 0.60 2.46 -0.05 0.00 0.70 0.00 0.00 55.95 59.66 2q3u s SER 21 Cb -0.10 -2.60 -0.04 0.00 -1.71 0.00 0.00 66.02 61.57 2q3u s SER 21 CO 0.42 -0.66 0.14 -1.00 1.20 0.00 0.00 173.24 173.35 2q3u s HIS 22 N 0.62 3.53 0.03 3.44 3.76 -1.26 0.13 115.29 125.54 2q3u s HIS 22 Ca 0.62 0.44 -0.18 0.00 -0.15 0.00 0.00 55.06 55.79 2q3u s HIS 22 Cb -0.39 -1.88 -0.22 0.00 1.11 0.00 0.00 32.58 31.20 2q3u s HIS 22 CO 0.35 0.68 1.15 0.00 -0.85 0.00 0.00 174.74 176.07 2q3u h ALA 23 N 4.59 0.11 -2.35 -1.40 0.00 -0.95 -3.41 119.26 115.85 2q3u h ALA 23 Ca -0.53 -0.60 0.19 0.00 0.00 0.00 0.00 54.91 53.98 2q3u h ALA 23 Cb 1.21 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 2q3u h ALA 23 CO 0.61 0.46 0.60 1.14 0.00 0.00 0.00 179.25 182.06 2q3u s GLN 24 N -3.32 1.14 -0.19 0.00 -2.07 -1.21 -4.43 119.66 109.57 2q3u s GLN 24 Ca -0.12 -0.70 -0.01 0.00 -1.82 0.00 0.00 55.36 52.71 2q3u s GLN 24 Cb 0.05 0.34 0.01 0.00 -1.09 0.00 0.00 33.01 32.32 2q3u s GLN 24 CO 0.85 -0.53 -0.13 0.99 -1.32 0.00 0.00 175.29 175.15 2q3u s THR 25 N -2.48 2.62 0.17 3.63 2.01 -0.62 -1.49 115.64 119.48 2q3u s THR 25 Ca 0.19 -0.75 -0.26 0.00 0.31 0.00 0.00 61.69 61.18 2q3u s THR 25 Cb -0.01 -2.15 -0.08 0.00 0.01 0.00 0.00 72.50 70.27 2q3u s THR 25 CO 0.03 0.49 0.82 0.26 -0.69 0.00 0.00 174.62 175.53 2q3u s TRP 26 N 1.34 3.92 0.03 4.92 0.52 -0.49 -1.23 118.94 127.94 2q3u s TRP 26 Ca 0.05 1.69 0.01 0.00 0.02 0.00 0.00 56.10 57.87 2q3u s TRP 26 Cb -0.14 -2.82 -0.02 0.00 -1.15 0.00 0.00 33.47 29.34 2q3u s TRP 26 CO -0.08 0.48 -0.05 0.42 0.02 0.00 0.00 176.95 177.74 2q3u s ILE 27 N -1.07 0.33 0.00 2.03 1.01 -0.09 -0.04 121.20 123.37 2q3u s ILE 27 Ca 0.37 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 60.11 2q3u s ILE 27 Cb -0.24 -0.42 0.00 0.00 0.01 0.00 0.00 42.46 41.82 2q3u s ILE 27 CO 0.27 -0.39 0.00 0.61 0.00 0.00 0.00 174.94 175.44 2q3u n GLY 28 N 1.68 1.23 3.01 6.18 0.00 -1.22 0.28 105.19 116.35 2q3u n GLY 28 Ca -0.22 -1.99 -0.13 0.00 0.00 0.00 0.00 46.02 43.67 2q3u n GLY 28 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2q3u s TRP 29 N 0.87 -0.33 0.41 1.61 -0.11 -0.70 -4.32 118.94 116.37 2q3u s TRP 29 Ca 0.00 0.81 -0.21 0.00 1.22 0.00 0.00 56.10 57.92 2q3u s TRP 29 Cb 0.00 -0.01 -0.11 0.00 -1.50 0.00 0.00 33.47 31.85 2q3u s TRP 29 CO 0.00 -0.27 0.94 -1.25 -4.62 0.00 0.00 176.95 171.75 2q3u s PRO 30 N 1.69 4.26 0.00 5.86 0.04 -1.26 -4.71 135.00 140.87 2q3u s PRO 30 Ca -0.05 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.11 2q3u s PRO 30 Cb -0.11 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.17 2q3u s PRO 30 CO -0.08 0.01 0.00 -1.91 0.04 0.00 0.00 177.00 175.06 2q3u n GLU 31 N -0.50 0.00 -2.46 4.56 2.13 -1.26 -4.74 120.64 118.37 2q3u n GLU 31 Ca 0.06 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.50 2q3u n GLU 31 Cb 0.54 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.21 2q3u n GLU 31 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2q3u s ARG 32 N -0.13 4.33 0.03 5.31 1.70 -1.26 -4.67 118.95 124.26 2q3u s ARG 32 Ca 0.00 1.70 0.26 0.00 -0.47 0.00 0.00 55.73 57.22 2q3u s ARG 32 Cb 0.00 -2.83 0.66 0.00 -0.57 0.00 0.00 34.95 32.20 2q3u s ARG 32 CO 0.00 -0.04 1.53 1.04 -1.08 0.00 0.00 175.30 176.75 2q3u n GLN 33 N 0.47 0.06 -0.06 3.89 6.02 -1.26 -2.46 117.38 124.04 2q3u n GLN 33 Ca 0.02 0.02 0.12 0.00 -0.01 0.00 0.00 57.00 57.16 2q3u n GLN 33 Cb 0.47 -1.54 0.32 0.00 1.02 0.00 0.00 30.24 30.51 2q3u n GLN 33 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 2q3u n ASP 34 N -1.64 2.29 0.00 1.08 5.68 -1.26 -0.59 116.55 122.12 2q3u n ASP 34 Ca 0.05 -1.78 0.00 0.00 -0.50 0.00 0.00 54.79 52.57 2q3u n ASP 34 Cb 0.36 -0.08 0.00 0.00 -1.14 0.00 0.00 41.12 40.25 2q3u n ASP 34 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 2q3u n ASN 35 N 0.75 2.57 -4.34 -1.12 4.05 -1.24 -4.80 115.26 111.14 2q3u n ASN 35 Ca 0.17 0.00 -0.30 0.00 0.45 0.00 0.00 54.58 54.90 2q3u n ASN 35 Cb 0.45 0.51 -0.15 0.00 1.23 0.00 0.00 39.78 41.82 2q3u n ASN 35 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 2q3u s TRP 36 N -1.04 2.32 0.36 1.20 0.52 -1.03 -4.43 118.94 116.85 2q3u s TRP 36 Ca 0.00 -0.42 -0.13 0.00 0.02 0.00 0.00 56.10 55.57 2q3u s TRP 36 Cb 0.00 -1.41 -0.08 0.00 -1.15 0.00 0.00 33.47 30.83 2q3u s TRP 36 CO 0.00 0.10 0.75 -0.98 0.02 0.00 0.00 176.95 176.84 2q3u s ARG 37 N -1.14 3.90 -1.29 4.98 1.70 -1.26 -4.13 118.95 121.70 2q3u s ARG 37 Ca 0.11 0.58 -0.01 0.00 -0.47 0.00 0.00 55.73 55.95 2q3u s ARG 37 Cb -0.10 -2.41 0.00 0.00 -0.57 0.00 0.00 34.95 31.87 2q3u s ARG 37 CO 0.02 0.07 0.80 0.72 -1.08 0.00 0.00 175.30 175.82 2q3u n HIS 38 N -0.79 -2.02 -2.57 5.89 8.25 -0.45 -1.69 115.22 121.84 2q3u n HIS 38 Ca 0.03 0.87 -0.18 0.00 -0.26 0.00 0.00 57.72 58.19 2q3u n HIS 38 Cb 0.53 -4.57 -0.00 0.00 1.12 0.00 0.00 29.99 27.07 2q3u n HIS 38 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2q3u n ASN 39 N -3.07 -4.90 -0.20 0.41 5.03 -1.26 -1.65 115.26 109.62 2q3u n ASN 39 Ca -0.28 0.01 -0.03 0.00 0.87 0.00 0.00 54.58 55.16 2q3u n ASN 39 Cb 0.67 -4.09 -0.01 0.00 -1.02 0.00 0.00 39.78 35.32 2q3u n ASN 39 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2q3u n ALA 40 N -2.41 -0.04 -0.24 5.41 0.00 -0.68 -4.89 120.51 117.65 2q3u n ALA 40 Ca -0.17 0.04 -0.06 0.00 0.00 0.00 0.00 53.44 53.25 2q3u n ALA 40 Cb 0.64 -1.43 0.04 0.00 0.00 0.00 0.00 19.45 18.70 2q3u n ALA 40 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2q3u h LEU 41 N 0.00 0.89 -0.58 0.00 4.07 -1.42 0.39 115.31 118.66 2q3u h LEU 41 Ca -0.05 -0.14 -0.01 0.00 0.08 0.00 0.00 57.88 57.76 2q3u h LEU 41 Cb 0.95 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 42.43 2q3u h LEU 41 CO 0.08 0.77 0.31 -0.65 -1.08 0.00 0.00 178.44 177.88 2q3u h PRO 42 N 0.94 0.81 -0.60 1.13 0.11 -1.80 -1.37 132.00 131.22 2q3u h PRO 42 Ca 0.23 -0.10 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 2q3u h PRO 42 Cb 0.13 -0.16 -0.03 0.00 0.11 0.00 0.00 31.00 31.05 2q3u h PRO 42 CO -0.03 0.63 0.34 0.00 -0.21 0.00 0.00 178.00 178.73 2q3u h ALA 43 N 1.14 0.77 -0.37 -0.75 0.00 -1.69 -1.52 119.26 116.84 2q3u h ALA 43 Ca 0.20 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 2q3u h ALA 43 Cb 0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2q3u h ALA 43 CO -0.03 0.27 0.14 1.96 0.00 0.00 0.00 179.25 181.59 2q3u h GLN 44 N 0.81 0.52 0.00 0.00 4.20 0.21 0.91 115.11 121.77 2q3u h GLN 44 Ca 0.21 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.86 2q3u h GLN 44 Cb 0.02 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.70 2q3u h GLN 44 CO -0.04 0.44 0.00 0.00 -0.67 0.00 0.00 178.83 178.57 2q3u h ARG 45 N 0.52 0.00 0.09 1.46 3.08 -0.89 0.50 114.38 119.14 2q3u h ARG 45 Ca 0.13 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.97 2q3u h ARG 45 Cb 0.12 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.17 2q3u h ARG 45 CO -0.01 0.00 -1.06 0.28 -1.07 0.00 0.00 179.97 178.11 2q3u h VAL 46 N 0.00 1.22 0.03 2.04 2.07 -0.13 -2.54 116.25 118.93 2q3u h VAL 46 Ca 0.00 -2.39 0.03 0.00 0.82 0.00 0.00 66.70 65.16 2q3u h VAL 46 Cb 0.75 2.84 -0.05 0.00 -1.52 0.00 0.00 31.29 33.31 2q3u h VAL 46 CO 0.00 0.63 -0.34 -0.26 0.02 0.00 0.00 177.57 177.63 2q3u h PHE 47 N -0.52 -0.93 -0.96 1.57 -1.00 0.10 -1.89 116.94 113.31 2q3u h PHE 47 Ca -0.23 0.03 0.20 0.00 2.81 0.00 0.00 57.97 60.78 2q3u h PHE 47 Cb 1.56 0.41 -0.09 0.00 3.61 0.00 0.00 35.95 41.44 2q3u h PHE 47 CO 0.16 -0.43 0.61 0.00 -1.61 0.00 0.00 178.31 177.04 2q3u h ALA 48 N 0.17 1.97 -0.58 2.45 0.00 -0.13 0.00 119.26 123.14 2q3u h ALA 48 Ca 0.05 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2q3u h ALA 48 Cb 0.58 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2q3u h ALA 48 CO -0.26 -0.30 0.25 0.78 0.00 0.00 0.00 179.25 179.72 2q3u h GLY 49 N 0.57 0.92 0.86 0.00 0.00 -0.92 -0.33 103.07 104.18 2q3u h GLY 49 Ca 0.53 -0.49 0.01 0.00 0.00 0.00 0.00 47.33 47.38 2q3u h GLY 49 CO -0.27 0.46 -0.07 -2.08 0.00 0.00 0.00 176.54 174.57 2q3u h VAL 50 N 0.79 0.82 -0.57 4.60 2.07 -0.46 0.13 116.25 123.63 2q3u h VAL 50 Ca 0.19 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.70 2q3u h VAL 50 Cb 0.17 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 2q3u h VAL 50 CO -0.02 0.00 0.31 0.00 0.02 0.00 0.00 177.57 177.88 2q3u h ALA 51 N 0.80 1.47 -0.28 1.67 0.00 -0.83 -1.24 119.26 120.85 2q3u h ALA 51 Ca 0.02 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.66 2q3u h ALA 51 Cb 0.16 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2q3u h ALA 51 CO -0.05 0.44 -0.53 0.87 0.00 0.00 0.00 179.25 179.99 2q3u h LYS 52 N 0.80 0.82 -0.29 0.00 1.57 -0.64 -0.99 116.57 117.84 2q3u h LYS 52 Ca 0.20 -0.51 0.06 0.00 -1.87 0.00 0.00 60.65 58.53 2q3u h LYS 52 Cb 0.02 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.33 2q3u h LYS 52 CO -0.03 1.14 -0.06 0.00 -0.57 0.00 0.00 179.45 179.93 2q3u h ALA 53 N 0.76 0.20 -0.04 3.86 0.00 -0.14 -2.14 119.26 121.76 2q3u h ALA 53 Ca 0.02 0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2q3u h ALA 53 Cb 1.12 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 2q3u h ALA 53 CO 0.11 -0.46 -0.42 0.82 0.00 0.00 0.00 179.25 179.31 2q3u h ILE 54 N 0.01 1.31 0.00 0.00 2.04 -1.23 -3.11 117.51 116.53 2q3u h ILE 54 Ca 0.14 -1.47 0.00 0.00 1.00 0.00 0.00 64.86 64.53 2q3u h ILE 54 Cb 0.21 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 2q3u h ILE 54 CO -0.29 0.43 0.00 -1.54 0.00 0.00 0.00 178.15 176.75 2q3u n SER 55 N -4.03 0.36 0.22 1.72 3.41 -0.38 -0.84 113.62 114.08 2q3u n SER 55 Ca -0.02 0.60 0.10 0.00 -0.26 0.00 0.00 58.87 59.30 2q3u n SER 55 Cb 0.46 -0.67 0.45 0.00 -0.26 0.00 0.00 64.21 64.18 2q3u n SER 55 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2q3u h LYS 56 N 0.00 0.00 0.02 4.33 1.79 -1.47 -3.34 116.57 117.90 2q3u h LYS 56 Ca 0.00 0.00 -0.39 0.00 -2.18 0.00 0.00 60.65 58.08 2q3u h LYS 56 Cb 0.24 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 30.83 2q3u h LYS 56 CO 0.00 0.21 -2.34 1.19 -1.08 0.00 0.00 179.45 177.44 2q3u n PHE 57 N -3.36 0.27 -3.91 -1.35 3.72 -0.02 -5.06 117.46 107.76 2q3u n PHE 57 Ca 0.00 0.07 -0.09 0.00 -0.05 0.00 0.00 57.45 57.39 2q3u n PHE 57 Cb 0.44 -1.03 -0.05 0.00 -0.94 0.00 0.00 39.48 37.90 2q3u n PHE 57 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 176.76 174.88 2q3u s GLU 58 N -2.51 1.50 1.14 -1.08 -1.05 -0.78 -4.69 118.70 111.23 2q3u s GLU 58 Ca -0.34 -1.11 -0.18 0.00 -0.15 0.00 0.00 54.97 53.20 2q3u s GLU 58 Cb 0.10 0.49 0.26 0.00 -0.44 0.00 0.00 34.13 34.54 2q3u s GLU 58 CO 0.60 -0.63 1.14 -2.14 0.95 0.00 0.00 175.26 175.17 2q3u s PRO 59 N -3.96 -0.74 0.05 -4.83 0.02 -1.26 -3.77 135.00 120.50 2q3u s PRO 59 Ca 0.17 -0.04 -0.11 0.00 0.02 0.00 0.00 61.00 61.03 2q3u s PRO 59 Cb -0.01 -1.65 0.01 0.00 0.02 0.00 0.00 34.50 32.87 2q3u s PRO 59 CO 0.05 -3.40 0.24 0.08 -0.33 0.00 0.00 177.00 173.64 2q3u s VAL 60 N -3.13 0.10 -0.44 3.83 1.01 -1.26 -1.60 120.40 118.91 2q3u s VAL 60 Ca 0.70 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.87 2q3u s VAL 60 Cb -0.10 -0.96 0.14 0.00 0.00 0.00 0.00 36.38 35.46 2q3u s VAL 60 CO 0.56 -0.46 0.26 -0.89 0.00 0.00 0.00 175.10 174.57 2q3u s THR 61 N -2.70 1.25 0.12 3.92 2.01 -0.36 -2.28 115.64 117.60 2q3u s THR 61 Ca -0.04 -2.56 -0.30 0.00 0.31 0.00 0.00 61.69 59.10 2q3u s THR 61 Cb -0.00 -1.87 -0.06 0.00 0.01 0.00 0.00 72.50 70.57 2q3u s THR 61 CO -0.04 -0.94 1.10 -0.69 -0.69 0.00 0.00 174.62 173.36 2q3u s VAL 62 N 0.31 4.08 -0.18 3.82 1.01 -0.72 -0.91 120.40 127.81 2q3u s VAL 62 Ca 0.19 1.65 -0.06 0.00 0.00 0.00 0.00 61.98 63.77 2q3u s VAL 62 Cb -0.21 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 2q3u s VAL 62 CO -0.02 0.22 0.02 0.00 0.00 0.00 0.00 175.10 175.32 2q3u s ALA 64 N 0.48 1.63 0.96 0.00 0.00 -0.91 -1.73 121.76 122.19 2q3u s ALA 64 Ca 0.00 -1.54 -0.13 0.00 0.00 0.00 0.00 51.96 50.29 2q3u s ALA 64 Cb -0.13 0.01 0.16 0.00 0.00 0.00 0.00 23.12 23.16 2q3u s ALA 64 CO 0.02 -0.05 1.14 -1.54 0.00 0.00 0.00 175.76 175.33 2q3u s SER 65 N -3.21 3.10 0.22 0.00 1.04 -1.26 -4.29 113.70 109.30 2q3u s SER 65 Ca 0.18 0.90 -0.08 0.00 0.48 0.00 0.00 55.95 57.43 2q3u s SER 65 Cb 0.01 -1.41 0.31 0.00 0.10 0.00 0.00 66.02 65.03 2q3u s SER 65 CO 0.02 -2.80 1.77 -0.65 0.98 0.00 0.00 173.24 172.57 2q3u h PRO 66 N -1.67 0.53 0.00 4.02 0.11 -1.94 0.14 132.00 133.18 2q3u h PRO 66 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2q3u h PRO 66 Cb 1.32 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2q3u h PRO 66 CO 0.57 0.35 0.00 0.00 -0.21 0.00 0.00 178.00 178.71 2q3u h ALA 67 N 1.42 1.00 -0.00 -0.75 0.00 -2.04 -3.08 119.26 115.81 2q3u h ALA 67 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2q3u h ALA 67 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2q3u h ALA 67 CO -0.27 0.00 -0.70 1.04 0.00 0.00 0.00 179.25 179.32 2q3u n GLN 68 N -3.09 1.35 -0.24 0.00 1.13 -0.69 -4.68 117.38 111.17 2q3u n GLN 68 Ca 0.00 -0.25 0.01 0.00 -1.94 0.00 0.00 57.00 54.82 2q3u n GLN 68 Cb 0.29 -1.32 0.24 0.00 0.11 0.00 0.00 30.24 29.55 2q3u n GLN 68 CO 0.00 0.00 0.00 2.35 -1.44 0.00 0.00 177.06 177.97 2q3u h TRP 69 N 0.57 0.97 -0.45 1.08 7.01 -0.66 -0.59 115.95 123.88 2q3u h TRP 69 Ca 0.00 0.02 -0.11 0.00 2.11 0.00 0.00 58.89 60.91 2q3u h TRP 69 Cb 0.47 -0.33 -0.02 0.00 -2.10 0.00 0.00 29.16 27.18 2q3u h TRP 69 CO 0.00 0.60 -0.18 0.93 -2.79 0.00 0.00 178.44 177.01 2q3u h GLU 70 N 1.04 0.88 -0.01 2.65 5.08 -1.83 -0.30 114.58 122.08 2q3u h GLU 70 Ca 0.29 -0.34 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2q3u h GLU 70 Cb -0.09 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 2q3u h GLU 70 CO -0.07 0.98 0.00 -0.97 -1.00 0.00 0.00 179.01 177.96 2q3u h ASN 71 N 0.77 0.01 -0.72 1.42 -1.24 -1.65 -1.11 115.58 113.06 2q3u h ASN 71 Ca 0.11 -0.21 -0.03 0.00 0.71 0.00 0.00 56.30 56.88 2q3u h ASN 71 Cb 0.71 -0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.72 2q3u h ASN 71 CO 0.05 0.22 0.32 0.00 -1.29 0.00 0.00 177.43 176.73 2q3u h ALA 72 N 0.80 0.93 -0.49 1.57 0.00 -1.12 0.00 119.26 120.95 2q3u h ALA 72 Ca 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2q3u h ALA 72 Cb 0.21 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2q3u h ALA 72 CO -0.00 0.53 0.25 -0.09 0.00 0.00 0.00 179.25 179.94 2q3u h ARG 73 N 1.02 0.68 0.02 0.00 9.65 -0.79 -1.63 114.38 123.33 2q3u h ARG 73 Ca 0.24 -0.07 -0.22 0.00 -1.10 0.00 0.00 59.98 58.83 2q3u h ARG 73 Cb 0.17 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.60 2q3u h ARG 73 CO -0.03 0.52 -0.96 0.87 2.80 0.00 0.00 179.97 183.17 2q3u h LYS 74 N 0.69 0.26 -0.23 0.20 1.57 -0.85 -3.28 116.57 114.93 2q3u h LYS 74 Ca 0.18 -0.31 -0.15 0.00 -1.87 0.00 0.00 60.65 58.50 2q3u h LYS 74 Cb 0.05 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2q3u h LYS 74 CO -0.03 1.04 -0.48 1.96 -0.57 0.00 0.00 179.45 181.38 2q3u h GLN 75 N 0.13 0.60 -5.99 3.15 4.20 -0.67 -3.45 115.11 113.08 2q3u h GLN 75 Ca -0.07 -0.34 -0.60 0.00 0.06 0.00 0.00 58.65 57.70 2q3u h GLN 75 Cb 1.61 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 29.36 2q3u h GLN 75 CO 0.15 0.94 -0.17 -0.51 -0.67 0.00 0.00 178.83 178.57 2q3u s LEU 76 N -8.47 4.45 0.88 1.46 1.43 -0.64 -5.05 118.68 112.74 2q3u s LEU 76 Ca -0.08 0.97 -0.12 0.00 -1.03 0.00 0.00 54.13 53.87 2q3u s LEU 76 Cb 0.12 -2.64 0.08 0.00 0.03 0.00 0.00 46.19 43.77 2q3u s LEU 76 CO 0.84 0.27 0.85 -2.65 0.23 0.00 0.00 176.35 175.89 2q3u n PRO 77 N 2.10 -0.17 0.03 1.29 -0.02 -1.26 -4.88 135.00 132.09 2q3u n PRO 77 Ca -0.12 0.01 0.09 0.00 -2.02 0.00 0.00 63.50 61.45 2q3u n PRO 77 Cb 0.52 -2.16 0.37 0.00 -0.02 0.00 0.00 33.50 32.21 2q3u n PRO 77 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2q3u n GLU 78 N -2.78 0.04 -0.01 -0.52 -0.58 -1.26 -2.62 120.64 112.90 2q3u n GLU 78 Ca 0.10 0.26 0.07 0.00 -0.42 0.00 0.00 57.16 57.18 2q3u n GLU 78 Cb 0.52 -1.58 0.39 0.00 -0.57 0.00 0.00 31.44 30.21 2q3u n GLU 78 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2q3u n ASP 79 N -1.65 0.25 -4.39 1.62 3.85 -1.26 -4.68 116.55 110.28 2q3u n ASP 79 Ca 0.04 -1.60 -0.34 0.00 -0.71 0.00 0.00 54.79 52.17 2q3u n ASP 79 Cb 0.20 -0.02 -0.13 0.00 -1.35 0.00 0.00 41.12 39.81 2q3u n ASP 79 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 2q3u s ILE 80 N -1.96 3.46 0.41 2.12 1.01 -1.08 -4.69 121.20 120.47 2q3u s ILE 80 Ca 0.22 -0.49 -0.23 0.00 0.00 0.00 0.00 60.65 60.14 2q3u s ILE 80 Cb 0.10 -2.52 -0.09 0.00 0.01 0.00 0.00 42.46 39.96 2q3u s ILE 80 CO 0.17 0.47 1.04 -0.60 0.00 0.00 0.00 174.94 176.02 2q3u s ARG 81 N 0.80 4.12 -0.15 2.79 3.52 -0.96 -4.92 118.95 124.14 2q3u s ARG 81 Ca -0.02 1.45 -0.02 0.00 -0.13 0.00 0.00 55.73 57.01 2q3u s ARG 81 Cb -0.15 -2.44 0.05 0.00 -1.56 0.00 0.00 34.95 30.84 2q3u s ARG 81 CO 0.01 -0.17 0.01 0.08 -0.81 0.00 0.00 175.30 174.43 2q3u s VAL 82 N -1.75 0.59 -0.04 7.11 1.01 -1.26 -1.75 120.40 124.30 2q3u s VAL 82 Ca 0.59 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 62.23 2q3u s VAL 82 Cb -0.20 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.23 2q3u s VAL 82 CO 0.25 0.00 -0.06 0.68 0.00 0.00 0.00 175.10 175.97 2q3u s VAL 83 N 1.85 3.73 0.60 2.92 -7.23 -0.91 -5.01 120.40 116.35 2q3u s VAL 83 Ca 0.01 -0.57 -0.15 0.00 -1.81 0.00 0.00 61.98 59.47 2q3u s VAL 83 Cb -0.15 -2.56 -0.04 0.00 0.56 0.00 0.00 36.38 34.19 2q3u s VAL 83 CO -0.07 0.53 1.05 -0.70 -0.31 0.00 0.00 175.10 175.59 2q3u s GLU 84 N -1.04 3.37 0.30 4.82 2.12 -1.26 -2.13 118.70 124.89 2q3u s GLU 84 Ca 0.14 1.12 0.10 0.00 0.36 0.00 0.00 54.97 56.69 2q3u s GLU 84 Cb -0.11 -2.04 -0.05 0.00 0.26 0.00 0.00 34.13 32.19 2q3u s GLU 84 CO 0.04 -0.76 -0.03 -1.12 -0.54 0.00 0.00 175.26 172.85 2q3u s SER 86 N -3.01 4.18 -0.03 -1.70 0.01 -1.26 -4.91 113.70 106.98 2q3u s SER 86 Ca 0.62 -0.88 0.02 0.00 1.31 0.00 0.00 55.95 57.01 2q3u s SER 86 Cb -0.15 -0.59 -0.04 0.00 0.21 0.00 0.00 66.02 65.46 2q3u s SER 86 CO 0.39 -0.10 -0.00 0.59 0.41 0.00 0.00 173.24 174.52 2q3u n ASN 88 N -0.87 4.06 -4.31 2.44 4.13 -1.26 -4.68 115.26 114.76 2q3u n ASN 88 Ca -0.05 -0.01 -0.16 0.00 1.68 0.00 0.00 54.58 56.04 2q3u n ASN 88 Cb 0.61 0.39 -0.10 0.00 -1.54 0.00 0.00 39.78 39.13 2q3u n ASN 88 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 2q3u s ASP 89 N -3.69 1.84 -0.51 6.41 -0.00 -1.26 -4.83 116.67 114.64 2q3u s ASP 89 Ca -0.03 -1.16 0.02 0.00 -0.00 0.00 0.00 52.55 51.39 2q3u s ASP 89 Cb 0.01 -0.00 0.45 0.00 -0.00 0.00 0.00 42.92 43.38 2q3u s ASP 89 CO 0.12 -0.45 1.65 -1.54 -0.00 0.00 0.00 175.17 174.95 2q3u n SER 90 N -0.36 6.44 -4.08 0.27 3.41 -1.26 -4.83 113.62 113.21 2q3u n SER 90 Ca -0.07 -3.77 -0.38 0.00 -0.26 0.00 0.00 58.87 54.40 2q3u n SER 90 Cb 0.63 -0.70 -0.05 0.00 -0.26 0.00 0.00 64.21 63.83 2q3u n SER 90 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2q3u n TRP 91 N -0.80 4.15 0.55 7.33 7.02 -1.26 -4.53 117.44 129.91 2q3u n TRP 91 Ca 0.54 -3.92 0.09 0.00 -1.02 0.00 0.00 57.50 53.19 2q3u n TRP 91 Cb 0.77 -1.21 0.39 0.00 -2.42 0.00 0.00 31.31 28.85 2q3u n TRP 91 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 2q3u n PHE 92 N 2.13 0.21 0.03 -5.99 0.99 -1.21 -0.00 117.46 113.62 2q3u n PHE 92 Ca 0.23 0.08 -0.00 0.00 -0.00 0.00 0.00 57.45 57.76 2q3u n PHE 92 Cb 0.37 -0.62 0.29 0.00 -1.00 0.00 0.00 39.48 38.52 2q3u n PHE 92 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.76 176.67 2q3u h ARG 93 N 0.00 0.44 0.00 -1.08 9.65 -1.40 -0.15 114.38 121.84 2q3u h ARG 93 Ca 0.00 -0.12 -0.11 0.00 -1.10 0.00 0.00 59.98 58.65 2q3u h ARG 93 Cb 0.33 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.84 2q3u h ARG 93 CO 0.00 0.55 -1.74 -0.25 2.80 0.00 0.00 179.97 181.34 2q3u n ASP 94 N -4.23 0.38 -0.00 -3.80 8.00 1.00 -3.14 116.55 114.76 2q3u n ASP 94 Ca 0.00 0.16 0.06 0.00 0.71 0.00 0.00 54.79 55.72 2q3u n ASP 94 Cb 0.30 1.04 -0.08 0.00 -0.02 0.00 0.00 41.12 42.36 2q3u n ASP 94 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2q3u n SER 95 N -2.60 1.18 -4.54 -2.24 3.41 -1.04 -4.28 113.62 103.52 2q3u n SER 95 Ca -0.10 -0.49 -0.29 0.00 -0.26 0.00 0.00 58.87 57.73 2q3u n SER 95 Cb 0.75 1.21 0.13 0.00 -0.26 0.00 0.00 64.21 66.04 2q3u n SER 95 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2q3u s GLY 96 N -2.58 1.69 0.61 5.00 0.00 -0.07 -3.36 107.32 108.60 2q3u s GLY 96 Ca 0.01 -0.95 -0.14 0.00 0.00 0.00 0.00 44.72 43.64 2q3u s GLY 96 CO 0.49 -0.34 1.04 2.56 0.00 0.00 0.00 173.10 176.85 2q3u s PRO 97 N -5.69 3.36 -0.50 2.90 0.04 -1.26 -4.83 135.00 129.01 2q3u s PRO 97 Ca 0.68 1.06 -0.17 0.00 0.04 0.00 0.00 61.00 62.61 2q3u s PRO 97 Cb -0.08 -2.04 0.08 0.00 0.04 0.00 0.00 34.50 32.50 2q3u s PRO 97 CO 0.50 -0.77 0.50 0.99 0.04 0.00 0.00 177.00 178.27 2q3u s THR 98 N -2.69 5.10 0.24 1.26 2.01 0.16 -4.89 115.64 116.82 2q3u s THR 98 Ca 0.61 -1.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.31 2q3u s THR 98 Cb -0.14 -4.24 -0.09 0.00 0.01 0.00 0.00 72.50 68.04 2q3u s THR 98 CO 0.42 -0.74 1.14 -0.36 -0.69 0.00 0.00 174.62 174.39 2q3u s PHE 99 N 1.98 3.51 0.06 4.92 0.40 -1.26 -1.98 117.98 125.60 2q3u s PHE 99 Ca 0.07 1.60 0.04 0.00 -0.60 0.00 0.00 56.93 58.04 2q3u s PHE 99 Cb -0.24 -3.34 -0.03 0.00 0.51 0.00 0.00 43.02 39.92 2q3u s PHE 99 CO 0.07 -0.81 -0.11 0.96 0.70 0.00 0.00 175.22 176.03 2q3u s ILE 100 N -0.74 0.85 0.36 0.64 -4.36 0.12 -4.55 121.20 113.53 2q3u s ILE 100 Ca 0.48 -1.20 0.04 0.00 -0.26 0.00 0.00 60.65 59.70 2q3u s ILE 100 Cb -0.32 -0.86 -0.06 0.00 1.25 0.00 0.00 42.46 42.47 2q3u s ILE 100 CO 0.40 -0.30 0.06 0.68 0.24 0.00 0.00 174.94 176.02 2q3u s VAL 101 N -1.32 1.22 0.13 8.37 -7.23 -0.48 -0.01 120.40 121.06 2q3u s VAL 101 Ca -0.06 -2.00 -0.10 0.00 -1.81 0.00 0.00 61.98 58.01 2q3u s VAL 101 Cb -0.10 -2.72 0.00 0.00 0.56 0.00 0.00 36.38 34.12 2q3u s VAL 101 CO 0.01 0.00 0.27 0.00 -0.31 0.00 0.00 175.10 175.08 2q3u s ARG 102 N -3.84 1.02 0.13 4.82 1.70 -0.55 -1.18 118.95 121.05 2q3u s ARG 102 Ca 0.33 -0.99 -0.18 0.00 -0.47 0.00 0.00 55.73 54.42 2q3u s ARG 102 Cb 0.08 0.38 -0.03 0.00 -0.57 0.00 0.00 34.95 34.81 2q3u s ARG 102 CO 0.15 -0.36 1.77 1.57 -1.08 0.00 0.00 175.30 177.35 2q3u h LYS 103 N 2.59 0.41 -1.25 3.89 -0.00 -1.88 -3.40 116.57 116.93 2q3u h LYS 103 Ca -0.33 -0.03 0.16 0.00 -0.00 0.00 0.00 60.65 60.45 2q3u h LYS 103 Cb 1.22 -0.09 -0.29 0.00 -0.00 0.00 0.00 32.23 33.08 2q3u h LYS 103 CO 0.51 0.30 0.49 -0.98 -0.00 0.00 0.00 179.45 179.77 2q3u s ARG 104 N -6.05 0.24 0.35 0.07 1.70 -1.26 -4.65 118.95 109.35 2q3u s ARG 104 Ca -0.13 0.45 0.00 0.00 -0.47 0.00 0.00 55.73 55.58 2q3u s ARG 104 Cb 0.09 0.09 0.00 0.00 -0.57 0.00 0.00 34.95 34.57 2q3u s ARG 104 CO 0.71 -0.06 0.00 0.09 -1.08 0.00 0.00 175.30 174.97 2q3u n ASN 112 N 3.69 -8.25 -4.51 -2.89 5.03 -1.26 -5.06 115.26 102.02 2q3u n ASN 112 Ca -0.16 0.63 -0.25 0.00 0.87 0.00 0.00 54.58 55.67 2q3u n ASN 112 Cb 0.56 -4.28 -0.10 0.00 -1.02 0.00 0.00 39.78 34.94 2q3u n ASN 112 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2q3u s ARG 113 N -2.37 1.74 -0.24 3.52 0.52 -1.26 -5.01 118.95 115.86 2q3u s ARG 113 Ca 0.00 -1.88 0.07 0.00 -0.52 0.00 0.00 55.73 53.40 2q3u s ARG 113 Cb 0.00 -1.61 0.54 0.00 0.52 0.00 0.00 34.95 34.40 2q3u s ARG 113 CO 0.00 0.15 1.52 0.09 0.02 0.00 0.00 175.30 177.08 2q3u n ASN 114 N -0.72 4.02 -3.88 0.23 3.02 -1.26 -4.78 115.26 111.88 2q3u n ASN 114 Ca -0.05 -2.89 -0.14 0.00 -0.03 0.00 0.00 54.58 51.47 2q3u n ASN 114 Cb 0.63 -0.69 -0.15 0.00 -0.61 0.00 0.00 39.78 38.97 2q3u n ASN 114 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2q3u s ILE 115 N -2.31 0.13 0.04 2.41 2.07 -1.26 -1.49 121.20 120.79 2q3u s ILE 115 Ca 0.40 -0.03 0.01 0.00 -1.41 0.00 0.00 60.65 59.62 2q3u s ILE 115 Cb 0.32 -0.14 -0.03 0.00 0.13 0.00 0.00 42.46 42.74 2q3u s ILE 115 CO 0.10 0.06 -0.06 0.00 -1.91 0.00 0.00 174.94 173.13 2q3u s ALA 116 N 0.19 0.46 -0.07 1.50 0.00 0.98 -4.24 121.76 120.58 2q3u s ALA 116 Ca -0.02 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.14 2q3u s ALA 116 Cb -0.03 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 2q3u s ALA 116 CO -0.01 -0.13 -0.08 0.20 0.00 0.00 0.00 175.76 175.75 2q3u s GLY 117 N -1.84 1.67 -0.18 0.00 0.00 0.92 0.16 107.32 108.05 2q3u s GLY 117 Ca -0.08 -0.90 -0.09 0.00 0.00 0.00 0.00 44.72 43.66 2q3u s GLY 117 CO -0.02 -0.63 0.12 -0.42 0.00 0.00 0.00 173.10 172.15 2q3u s ILE 118 N -0.69 5.29 -0.31 0.90 1.01 -0.84 -1.15 121.20 125.41 2q3u s ILE 118 Ca 0.10 0.14 -0.06 0.00 0.00 0.00 0.00 60.65 60.84 2q3u s ILE 118 Cb -0.11 -3.38 0.03 0.00 0.01 0.00 0.00 42.46 39.01 2q3u s ILE 118 CO 0.02 0.49 0.07 -0.62 0.00 0.00 0.00 174.94 174.90 2q3u s ASP 119 N 0.01 5.12 0.07 3.58 2.15 0.58 -0.67 116.67 127.52 2q3u s ASP 119 Ca 0.09 -0.98 -0.06 0.00 0.43 0.00 0.00 52.55 52.03 2q3u s ASP 119 Cb -0.11 -1.84 -0.05 0.00 -0.30 0.00 0.00 42.92 40.61 2q3u s ASP 119 CO -0.00 -0.26 0.32 0.26 -0.17 0.00 0.00 175.17 175.32 2q3u s TRP 120 N 1.42 3.54 1.33 -5.34 0.52 -1.26 -0.92 118.94 118.22 2q3u s TRP 120 Ca -0.00 0.57 -0.18 0.00 0.02 0.00 0.00 56.10 56.51 2q3u s TRP 120 Cb -0.18 -2.00 0.34 0.00 -1.15 0.00 0.00 33.47 30.48 2q3u s TRP 120 CO 0.02 0.53 0.96 1.21 0.02 0.00 0.00 176.95 179.69 2q3u s ASN 121 N -2.05 -0.37 -0.12 2.95 3.04 -0.30 -4.87 114.94 113.23 2q3u s ASN 121 Ca 0.34 1.22 -0.30 0.00 0.04 0.00 0.00 52.86 54.16 2q3u s ASN 121 Cb -0.13 -1.84 0.11 0.00 -1.54 0.00 0.00 41.25 37.85 2q3u s ASN 121 CO 0.21 -4.99 0.91 0.12 -3.04 0.00 0.00 177.10 170.31 2q3u s PHE 122 N -2.27 -0.44 -0.34 0.43 5.36 -1.26 -2.36 117.98 117.09 2q3u s PHE 122 Ca 0.69 0.72 0.15 0.00 -0.96 0.00 0.00 56.93 57.52 2q3u s PHE 122 Cb -0.20 0.45 0.44 0.00 -0.34 0.00 0.00 43.02 43.36 2q3u s PHE 122 CO 0.62 -0.42 1.20 0.27 -1.46 0.00 0.00 175.22 175.43 2q3u n ASN 123 N 0.69 -0.11 -3.66 6.13 2.04 -1.26 -5.00 115.26 114.09 2q3u n ASN 123 Ca -0.12 -2.46 -0.22 0.00 -0.44 0.00 0.00 54.58 51.34 2q3u n ASN 123 Cb 0.58 0.19 0.05 0.00 -2.53 0.00 0.00 39.78 38.07 2q3u n ASN 123 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2q3u n ALA 124 N -0.53 -1.80 -4.13 -2.53 0.00 -1.26 0.23 120.51 110.48 2q3u n ALA 124 Ca 0.01 -0.01 -0.31 0.00 0.00 0.00 0.00 53.44 53.14 2q3u n ALA 124 Cb 0.84 -2.95 -0.04 0.00 0.00 0.00 0.00 19.45 17.29 2q3u n ALA 124 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2q3u n TRP 125 N -4.40 -1.58 0.00 0.00 8.01 -1.26 -1.78 117.44 116.43 2q3u n TRP 125 Ca -0.20 0.73 0.00 0.00 -1.31 0.00 0.00 57.50 56.72 2q3u n TRP 125 Cb 0.63 -3.23 0.00 0.00 -2.01 0.00 0.00 31.31 26.70 2q3u n TRP 125 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2q3u n GLY 126 N -1.89 1.06 0.24 6.99 0.00 -0.92 -4.38 105.19 106.28 2q3u n GLY 126 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2q3u n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q3u n GLY 127 N 0.00 -1.72 0.30 -0.02 0.00 0.62 -4.01 105.19 100.36 2q3u n GLY 127 Ca 0.00 -1.97 0.10 0.00 0.00 0.00 0.00 46.02 44.15 2q3u n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q3u h ALA 128 N 0.00 1.23 0.04 4.61 0.00 -1.92 0.79 119.26 124.00 2q3u h ALA 128 Ca 0.00 0.15 -0.36 0.00 0.00 0.00 0.00 54.91 54.71 2q3u h ALA 128 Cb 0.00 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2q3u h ALA 128 CO 0.00 -0.31 -2.03 0.09 0.00 0.00 0.00 179.25 177.00 2q3u n ASN 129 N -5.06 1.99 -0.36 0.00 3.02 -1.26 -4.57 115.26 109.01 2q3u n ASN 129 Ca 0.18 0.22 0.11 0.00 -0.03 0.00 0.00 54.58 55.06 2q3u n ASN 129 Cb 0.55 -0.78 -0.01 0.00 -0.61 0.00 0.00 39.78 38.93 2q3u n ASN 129 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2q3u n ASP 130 N -3.85 1.73 -4.68 6.41 9.92 -1.22 -4.98 116.55 119.88 2q3u n ASP 130 Ca -0.40 -1.35 -0.31 0.00 -0.53 0.00 0.00 54.79 52.20 2q3u n ASP 130 Cb 0.90 0.58 0.15 0.00 -0.64 0.00 0.00 41.12 42.12 2q3u n ASP 130 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2q3u s GLY 131 N -2.61 1.67 0.00 0.44 0.00 0.27 -4.54 107.32 102.55 2q3u s GLY 131 Ca 0.16 0.39 0.26 0.00 0.00 0.00 0.00 44.72 45.53 2q3u s GLY 131 CO 0.64 0.82 1.52 0.00 0.00 0.00 0.00 173.10 176.08 2q3u s TYR 133 N -2.62 -0.13 -1.04 0.00 -0.85 -1.26 -2.06 117.35 109.38 2q3u s TYR 133 Ca 0.21 -0.23 0.22 0.00 -0.52 0.00 0.00 57.07 56.75 2q3u s TYR 133 Cb 0.19 0.47 0.02 0.00 0.38 0.00 0.00 41.96 43.01 2q3u s TYR 133 CO 0.57 -1.00 1.07 0.09 -1.52 0.00 0.00 175.55 174.76 2q3u n ASN 134 N -0.38 0.88 -3.81 -0.18 3.02 -0.06 -4.85 115.26 109.88 2q3u n ASN 134 Ca -0.08 -0.79 -0.22 0.00 -0.03 0.00 0.00 54.58 53.46 2q3u n ASN 134 Cb 0.62 0.74 -0.17 0.00 -0.61 0.00 0.00 39.78 40.36 2q3u n ASN 134 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2q3u s ASP 135 N -2.98 1.40 -0.09 6.41 2.15 -1.26 -4.99 116.67 117.32 2q3u s ASP 135 Ca 0.09 -0.10 0.13 0.00 0.43 0.00 0.00 52.55 53.11 2q3u s ASP 135 Cb 0.17 -0.45 0.26 0.00 -0.30 0.00 0.00 42.92 42.60 2q3u s ASP 135 CO 0.80 -0.15 1.13 -2.67 -0.17 0.00 0.00 175.17 174.11 2q3u n TRP 136 N 4.82 0.00 0.11 -5.34 2.14 -1.26 -4.83 117.44 113.08 2q3u n TRP 136 Ca -0.13 -0.74 0.05 0.00 2.07 0.00 0.00 57.50 58.75 2q3u n TRP 136 Cb 0.50 -0.14 0.48 0.00 -0.81 0.00 0.00 31.31 31.34 2q3u n TRP 136 CO 0.00 0.00 0.00 0.77 2.07 0.00 0.00 177.69 180.53 2q3u h SER 137 N 0.39 0.26 0.44 -0.67 0.02 -2.00 0.25 113.55 112.24 2q3u h SER 137 Ca -0.04 -0.02 -0.30 0.00 -0.84 0.00 0.00 61.79 60.59 2q3u h SER 137 Cb 1.27 -0.07 0.02 0.00 0.14 0.00 0.00 62.40 63.76 2q3u h SER 137 CO 0.02 0.25 -1.35 0.45 -1.14 0.00 0.00 176.83 175.06 2q3u h HIS 138 N 0.30 0.74 -0.77 3.45 3.86 -1.91 -3.23 115.15 117.59 2q3u h HIS 138 Ca 0.08 -0.53 0.01 0.00 -1.16 0.00 0.00 60.37 58.76 2q3u h HIS 138 Cb 0.07 -0.03 -0.04 0.00 1.06 0.00 0.00 27.41 28.47 2q3u h HIS 138 CO 0.00 1.41 0.51 -0.44 0.86 0.00 0.00 177.93 180.27 2q3u h ASP 139 N 0.12 0.87 -0.97 2.45 3.45 -1.71 -1.79 116.42 118.83 2q3u h ASP 139 Ca -0.19 -0.02 0.24 0.00 0.43 0.00 0.00 57.03 57.49 2q3u h ASP 139 Cb 2.06 -0.22 -0.07 0.00 -0.56 0.00 0.00 39.33 40.54 2q3u h ASP 139 CO 0.24 0.63 0.65 -0.07 -1.57 0.00 0.00 179.24 179.11 2q3u h LEU 140 N 1.03 0.35 -0.17 1.55 3.38 -0.98 -1.46 115.31 119.01 2q3u h LEU 140 Ca 0.28 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.30 2q3u h LEU 140 Cb -0.10 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2q3u h LEU 140 CO -0.06 0.11 -0.42 0.18 0.09 0.00 0.00 178.44 178.34 2q3u n LEU 141 N -4.50 0.68 -0.19 1.67 4.77 -0.68 -4.48 117.00 114.27 2q3u n LEU 141 Ca 0.22 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 2q3u n LEU 141 Cb 0.82 -0.20 0.10 0.00 -2.33 0.00 0.00 43.42 41.81 2q3u n LEU 141 CO 0.30 0.15 0.86 0.58 -1.33 0.00 0.00 177.39 177.95 2q3u h VAL 142 N 0.42 0.56 -0.40 4.08 2.07 -1.23 -0.33 116.25 121.42 2q3u h VAL 142 Ca 0.00 -0.05 -0.05 0.00 0.82 0.00 0.00 66.70 67.41 2q3u h VAL 142 Cb 0.50 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 2q3u h VAL 142 CO 0.00 0.03 0.04 0.28 0.02 0.00 0.00 177.57 177.94 2q3u h SER 143 N 0.16 0.66 -0.03 0.57 0.02 -1.78 -1.06 113.55 112.10 2q3u h SER 143 Ca 0.31 -0.28 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2q3u h SER 143 Cb 0.48 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 2q3u h SER 143 CO -0.47 0.78 -0.21 -0.09 -1.14 0.00 0.00 176.83 175.70 2q3u h ARG 144 N 0.52 -0.23 -0.66 3.45 2.43 -1.36 0.12 114.38 118.65 2q3u h ARG 144 Ca 0.12 0.02 0.14 0.00 -0.81 0.00 0.00 59.98 59.45 2q3u h ARG 144 Cb 0.42 0.05 -0.11 0.00 -0.42 0.00 0.00 29.97 29.91 2q3u h ARG 144 CO 0.01 -0.15 0.01 0.87 -1.51 0.00 0.00 179.97 179.20 2q3u h LYS 145 N -0.24 0.12 -0.75 0.20 1.57 -1.31 0.11 116.57 116.26 2q3u h LYS 145 Ca 0.01 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2q3u h LYS 145 Cb 0.27 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 2q3u h LYS 145 CO -0.15 0.08 0.48 0.82 -0.57 0.00 0.00 179.45 180.10 2q3u h ILE 146 N 0.12 1.20 -0.08 1.86 2.04 -1.03 -0.57 117.51 121.05 2q3u h ILE 146 Ca 0.35 -0.41 0.02 0.00 1.00 0.00 0.00 64.86 65.83 2q3u h ILE 146 Cb 0.58 0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 36.78 2q3u h ILE 146 CO -0.57 0.20 0.07 -0.07 0.00 0.00 0.00 178.15 177.79 2q3u h LEU 147 N 1.03 0.00 0.10 1.44 3.38 0.17 -2.85 115.31 118.57 2q3u h LEU 147 Ca 0.27 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.10 2q3u h LEU 147 Cb -0.08 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.68 2q3u h LEU 147 CO -0.06 0.00 -0.66 0.00 0.09 0.00 0.00 178.44 177.81 2q3u h ALA 148 N 1.94 -0.04 -0.79 1.53 0.00 -0.15 0.21 119.26 121.96 2q3u h ALA 148 Ca 0.04 -0.69 0.14 0.00 0.00 0.00 0.00 54.91 54.41 2q3u h ALA 148 Cb 0.18 0.12 -0.09 0.00 0.00 0.00 0.00 17.79 17.99 2q3u h ALA 148 CO -0.00 0.32 0.35 -0.07 0.00 0.00 0.00 179.25 179.85 2q3u h LEU 149 N -0.54 0.36 -0.11 0.00 3.38 -1.05 0.39 115.31 117.75 2q3u h LEU 149 Ca -0.12 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2q3u h LEU 149 Cb 1.49 0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.30 2q3u h LEU 149 CO 0.10 0.14 -0.13 -0.62 0.09 0.00 0.00 178.44 178.02 2q3u n GLU 150 N -4.96 0.37 -2.12 1.13 -0.58 -1.09 -4.90 120.64 108.49 2q3u n GLU 150 Ca 0.15 -0.11 -0.15 0.00 -0.42 0.00 0.00 57.16 56.63 2q3u n GLU 150 Cb 0.42 -1.50 -0.02 0.00 -0.57 0.00 0.00 31.44 29.77 2q3u n GLU 150 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2q3u n ARG 151 N -1.22 -1.83 -2.79 3.49 1.74 0.14 -4.95 116.66 111.24 2q3u n ARG 151 Ca 0.11 0.78 -0.40 0.00 -0.77 0.00 0.00 57.85 57.57 2q3u n ARG 151 Cb 0.30 -5.30 -0.05 0.00 -1.02 0.00 0.00 32.46 26.39 2q3u n ARG 151 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2q3u s ILE 152 N -2.61 4.40 0.62 0.55 1.01 0.62 -4.98 121.20 120.81 2q3u s ILE 152 Ca 0.00 1.99 -0.19 0.00 0.00 0.00 0.00 60.65 62.45 2q3u s ILE 152 Cb 0.00 -4.28 -0.02 0.00 0.01 0.00 0.00 42.46 38.17 2q3u s ILE 152 CO 0.00 0.39 1.30 -2.84 0.00 0.00 0.00 174.94 173.79 2q3u s PRO 153 N -0.44 2.73 -0.10 2.79 0.02 -1.26 -4.65 135.00 134.09 2q3u s PRO 153 Ca 0.43 2.08 0.04 0.00 0.02 0.00 0.00 61.00 63.57 2q3u s PRO 153 Cb -0.24 -1.95 -0.00 0.00 0.02 0.00 0.00 34.50 32.33 2q3u s PRO 153 CO 0.29 -1.46 -0.23 0.50 -0.33 0.00 0.00 177.00 175.77 2q3u s ARG 154 N -3.27 3.00 -0.38 5.54 3.52 -1.26 -0.06 118.95 126.05 2q3u s ARG 154 Ca 0.80 -0.86 -0.03 0.00 -0.13 0.00 0.00 55.73 55.51 2q3u s ARG 154 Cb -0.37 -2.32 0.09 0.00 -1.56 0.00 0.00 34.95 30.79 2q3u s ARG 154 CO 0.41 0.22 0.15 -0.06 -0.81 0.00 0.00 175.30 175.21 2q3u s PHE 155 N 0.24 3.48 0.27 5.12 0.40 -0.30 -4.94 117.98 122.25 2q3u s PHE 155 Ca -0.15 -2.19 -0.30 0.00 -0.60 0.00 0.00 56.93 53.70 2q3u s PHE 155 Cb -0.17 -2.87 -0.09 0.00 0.51 0.00 0.00 43.02 40.40 2q3u s PHE 155 CO 0.08 -0.91 1.06 -1.14 0.70 0.00 0.00 175.22 175.01 2q3u s GLN 156 N 1.19 4.69 -0.07 0.44 0.74 -1.25 -0.31 119.66 125.11 2q3u s GLN 156 Ca 0.04 1.72 0.05 0.00 0.05 0.00 0.00 55.36 57.23 2q3u s GLN 156 Cb -0.22 -3.21 -0.01 0.00 1.10 0.00 0.00 33.01 30.67 2q3u s GLN 156 CO -0.03 0.29 -0.22 -1.58 -0.55 0.00 0.00 175.29 173.19 2q3u s HIS 157 N -1.14 2.27 -1.30 1.67 5.65 -0.10 -4.91 115.29 117.43 2q3u s HIS 157 Ca 0.44 -0.75 -0.17 0.00 0.25 0.00 0.00 55.06 54.83 2q3u s HIS 157 Cb -0.30 -1.51 0.02 0.00 -1.18 0.00 0.00 32.58 29.61 2q3u s HIS 157 CO 0.39 -0.26 1.95 -1.13 -0.65 0.00 0.00 174.74 175.04 2q3u n SER 158 N 3.17 4.13 -4.50 9.88 3.41 -1.26 -1.14 113.62 127.32 2q3u n SER 158 Ca -0.18 -2.85 -0.31 0.00 -0.26 0.00 0.00 58.87 55.28 2q3u n SER 158 Cb 0.52 -1.66 -0.12 0.00 -0.26 0.00 0.00 64.21 62.70 2q3u n SER 158 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2q3u s ILE 160 N 4.66 2.99 -0.26 -1.33 1.01 -1.26 -4.63 121.20 122.38 2q3u s ILE 160 Ca 0.53 -1.19 -0.26 0.00 0.00 0.00 0.00 60.65 59.73 2q3u s ILE 160 Cb 0.08 -2.30 0.15 0.00 0.01 0.00 0.00 42.46 40.40 2q3u s ILE 160 CO 0.03 0.28 1.16 -0.22 0.00 0.00 0.00 174.94 176.19 2q3u s LEU 161 N -1.64 -0.29 -0.06 2.97 2.96 -1.00 -4.90 118.68 116.73 2q3u s LEU 161 Ca 0.16 0.50 0.03 0.00 -0.22 0.00 0.00 54.13 54.60 2q3u s LEU 161 Cb -0.11 1.60 -0.02 0.00 0.50 0.00 0.00 46.19 48.16 2q3u s LEU 161 CO 0.07 -0.14 -0.15 -1.61 -1.32 0.00 0.00 176.35 173.20 2q3u s GLU 162 N -0.21 2.60 0.57 1.98 8.01 -1.26 -4.67 118.70 125.72 2q3u s GLU 162 Ca 0.04 -0.70 0.29 0.00 0.01 0.00 0.00 54.97 54.61 2q3u s GLU 162 Cb -0.04 -2.40 1.71 0.00 -4.31 0.00 0.00 34.13 29.10 2q3u s GLU 162 CO -0.07 0.57 2.20 0.78 0.01 0.00 0.00 175.26 178.74 2q3u h GLY 163 N 5.53 0.00 1.61 -1.39 0.00 -1.73 0.49 103.07 107.58 2q3u h GLY 163 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2q3u h GLY 163 CO 0.51 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.66 2q3u n GLY 164 N -1.11 -0.96 0.43 4.60 0.00 -1.26 -2.89 105.19 104.01 2q3u n GLY 164 Ca -0.03 -0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.02 2q3u n GLY 164 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2q3u n SER 165 N -1.30 1.65 -4.05 1.61 3.41 0.16 -1.24 113.62 113.85 2q3u n SER 165 Ca 0.09 -1.30 -0.20 0.00 -0.26 0.00 0.00 58.87 57.20 2q3u n SER 165 Cb 0.16 0.26 -0.15 0.00 -0.26 0.00 0.00 64.21 64.22 2q3u n SER 165 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2q3u s ILE 166 N -2.41 0.88 0.02 -1.33 -4.36 -1.14 -4.35 121.20 108.51 2q3u s ILE 166 Ca 0.23 -0.46 0.04 0.00 -0.26 0.00 0.00 60.65 60.21 2q3u s ILE 166 Cb 0.19 -0.74 -0.02 0.00 1.25 0.00 0.00 42.46 43.14 2q3u s ILE 166 CO 0.51 0.25 -0.12 -1.00 0.24 0.00 0.00 174.94 174.82 2q3u s HIS 167 N -0.14 1.03 0.09 1.37 3.76 -0.64 -4.85 115.29 115.91 2q3u s HIS 167 Ca 0.02 -0.30 0.04 0.00 -0.15 0.00 0.00 55.06 54.67 2q3u s HIS 167 Cb -0.06 -0.63 -0.03 0.00 1.11 0.00 0.00 32.58 32.97 2q3u s HIS 167 CO -0.00 0.00 -0.12 0.14 -0.85 0.00 0.00 174.74 173.91 2q3u s VAL 168 N -0.70 1.03 -2.80 -0.90 -7.23 -1.26 -0.51 120.40 108.03 2q3u s VAL 168 Ca 0.01 -1.50 0.25 0.00 -1.81 0.00 0.00 61.98 58.93 2q3u s VAL 168 Cb -0.07 -1.24 0.32 0.00 0.56 0.00 0.00 36.38 35.96 2q3u s VAL 168 CO 0.01 -0.41 1.44 -0.90 -0.31 0.00 0.00 175.10 174.92 2q3u n ASP 169 N 0.85 2.43 -0.41 4.85 5.68 -1.11 -4.56 116.55 124.27 2q3u n ASP 169 Ca -0.18 -1.81 -0.05 0.00 -0.50 0.00 0.00 54.79 52.25 2q3u n ASP 169 Cb 0.56 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.52 2q3u n ASP 169 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2q3u n GLY 170 N 1.29 0.74 0.58 6.12 0.00 -1.26 -4.43 105.19 108.23 2q3u n GLY 170 Ca 0.16 -0.30 0.04 0.00 0.00 0.00 0.00 46.02 45.92 2q3u n GLY 170 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2q3u n GLU 171 N -1.92 0.51 -0.26 1.61 1.02 -1.26 -4.74 120.64 115.60 2q3u n GLU 171 Ca -0.05 -1.85 0.00 0.00 -0.02 0.00 0.00 57.16 55.23 2q3u n GLU 171 Cb 0.29 -0.79 0.00 0.00 -0.02 0.00 0.00 31.44 30.92 2q3u n GLU 171 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2q3u n GLY 172 N -0.41 0.84 3.53 0.62 0.00 -1.26 -4.63 105.19 103.88 2q3u n GLY 172 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 2q3u n GLY 172 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q3u s THR 173 N -2.07 2.92 -0.06 2.61 2.01 -1.26 0.25 115.64 120.03 2q3u s THR 173 Ca 0.00 -1.89 -0.05 0.00 0.31 0.00 0.00 61.69 60.06 2q3u s THR 173 Cb 0.00 -2.46 0.02 0.00 0.01 0.00 0.00 72.50 70.07 2q3u s THR 173 CO 0.00 -0.19 0.16 0.00 -0.69 0.00 0.00 174.62 173.91 2q3u s LEU 175 N 0.39 3.26 0.28 0.00 2.96 0.33 0.20 118.68 126.11 2q3u s LEU 175 Ca -0.03 -0.09 -0.11 0.00 -0.22 0.00 0.00 54.13 53.69 2q3u s LEU 175 Cb -0.04 -1.77 0.00 0.00 0.50 0.00 0.00 46.19 44.88 2q3u s LEU 175 CO -0.02 0.22 0.50 0.68 -1.32 0.00 0.00 176.35 176.41 2q3u s VAL 176 N 0.03 0.00 0.02 1.68 -7.23 -0.18 -1.63 120.40 113.09 2q3u s VAL 176 Ca 0.00 -1.43 0.07 0.00 -1.81 0.00 0.00 61.98 58.82 2q3u s VAL 176 Cb -0.13 -2.35 -0.03 0.00 0.56 0.00 0.00 36.38 34.43 2q3u s VAL 176 CO 0.03 0.00 -0.21 0.42 -0.31 0.00 0.00 175.10 175.03 2q3u s THR 177 N -3.69 2.57 0.23 5.32 -4.23 -1.26 -0.83 115.64 113.75 2q3u s THR 177 Ca 0.24 -1.15 -0.02 0.00 -1.18 0.00 0.00 61.69 59.58 2q3u s THR 177 Cb -0.01 -2.02 0.03 0.00 1.34 0.00 0.00 72.50 71.83 2q3u s THR 177 CO 0.12 0.42 1.63 -0.33 -0.54 0.00 0.00 174.62 175.92 2q3u h GLU 178 N 4.86 0.64 -1.00 3.99 5.08 -1.14 -2.62 114.58 124.40 2q3u h GLU 178 Ca -0.46 -0.28 0.21 0.00 -1.00 0.00 0.00 59.36 57.82 2q3u h GLU 178 Cb 1.15 -0.02 -0.11 0.00 0.50 0.00 0.00 28.75 30.27 2q3u h GLU 178 CO 0.47 0.86 0.61 1.49 -1.00 0.00 0.00 179.01 181.44 2q3u h GLU 179 N 0.55 0.66 0.00 2.33 4.81 -1.71 -0.84 114.58 120.38 2q3u h GLU 179 Ca 0.07 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2q3u h GLU 179 Cb 0.79 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.02 2q3u h GLU 179 CO 0.06 0.44 -0.39 0.00 -0.73 0.00 0.00 179.01 178.39 2q3u h LEU 181 N -0.95 0.00 -1.89 0.00 3.38 -1.46 -1.55 115.31 112.84 2q3u h LEU 181 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2q3u h LEU 181 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2q3u h LEU 181 CO 0.00 0.02 0.00 0.18 0.09 0.00 0.00 178.44 178.73 2q3u n LEU 182 N -3.13 2.67 -4.74 1.67 4.77 -0.32 -4.65 117.00 113.26 2q3u n LEU 182 Ca 0.00 -1.17 -0.39 0.00 -0.03 0.00 0.00 56.01 54.42 2q3u n LEU 182 Cb 0.30 -0.06 0.04 0.00 -2.33 0.00 0.00 43.42 41.37 2q3u n LEU 182 CO 0.27 0.51 0.98 -3.20 -1.33 0.00 0.00 177.39 174.63 2q3u n ASN 183 N 1.04 2.74 0.04 -1.43 2.85 -0.58 -4.78 115.26 115.14 2q3u n ASN 183 Ca 0.12 1.00 0.08 0.00 -0.11 0.00 0.00 54.58 55.67 2q3u n ASN 183 Cb 0.47 -1.58 0.35 0.00 1.24 0.00 0.00 39.78 40.26 2q3u n ASN 183 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 2q3u n LYS 184 N -0.86 0.06 -0.01 1.20 2.85 -1.26 -1.21 118.16 118.93 2q3u n LYS 184 Ca 0.10 0.32 0.13 0.00 -1.05 0.00 0.00 58.31 57.80 2q3u n LYS 184 Cb 0.44 -1.61 0.64 0.00 -0.65 0.00 0.00 35.03 33.85 2q3u n LYS 184 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 2q3u n ASN 185 N -1.72 0.75 0.00 -5.58 0.23 -1.26 -4.19 115.26 103.48 2q3u n ASN 185 Ca 0.03 -1.36 0.00 0.00 -0.53 0.00 0.00 54.58 52.72 2q3u n ASN 185 Cb 0.18 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.86 2q3u n ASN 185 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2q3u n ARG 186 N -0.37 0.00 -3.19 -3.83 5.12 -0.35 -4.04 116.66 110.00 2q3u n ARG 186 Ca 0.19 0.00 -0.25 0.00 -1.93 0.00 0.00 57.85 55.86 2q3u n ARG 186 Cb 0.21 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.45 2q3u n ARG 186 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2q3u n ASN 187 N -0.94 3.17 -0.03 0.55 4.13 -1.25 -4.74 115.26 116.15 2q3u n ASN 187 Ca 0.00 -3.37 0.24 0.00 1.68 0.00 0.00 54.58 53.13 2q3u n ASN 187 Cb 0.00 -0.62 0.70 0.00 -1.54 0.00 0.00 39.78 38.32 2q3u n ASN 187 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2q3u h PRO 188 N 3.59 0.00 -2.92 3.52 0.13 -1.78 -3.44 132.00 131.10 2q3u h PRO 188 Ca 0.15 0.00 -0.76 0.00 -0.87 0.00 0.00 66.00 64.51 2q3u h PRO 188 Cb 0.67 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 31.63 2q3u h PRO 188 CO 0.74 0.00 1.93 0.72 -0.23 0.00 0.00 178.00 181.16 2q3u n HIS 189 N -3.77 2.68 -4.27 1.56 8.25 -1.26 -5.05 115.22 113.36 2q3u n HIS 189 Ca 0.13 -2.75 -0.15 0.00 -0.26 0.00 0.00 57.72 54.70 2q3u n HIS 189 Cb 0.87 -1.73 -0.10 0.00 1.12 0.00 0.00 29.99 30.14 2q3u n HIS 189 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2q3u s SER 191 N 0.07 0.95 0.40 0.41 1.04 -1.26 -5.08 113.70 110.23 2q3u s SER 191 Ca 0.44 -1.34 0.16 0.00 0.48 0.00 0.00 55.95 55.70 2q3u s SER 191 Cb 0.14 0.20 1.04 0.00 0.10 0.00 0.00 66.02 67.50 2q3u s SER 191 CO -0.04 -0.72 1.84 0.50 0.98 0.00 0.00 173.24 175.80 2q3u h LYS 192 N 2.51 0.45 0.07 4.02 3.64 -1.97 0.16 116.57 125.44 2q3u h LYS 192 Ca -0.37 -0.03 -0.25 0.00 -1.27 0.00 0.00 60.65 58.73 2q3u h LYS 192 Cb 1.24 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 2q3u h LYS 192 CO 0.60 0.29 -1.09 0.93 -2.27 0.00 0.00 179.45 177.91 2q3u h GLU 193 N 0.46 0.32 -0.56 1.90 3.07 -2.04 0.09 114.58 117.82 2q3u h GLU 193 Ca 0.50 -0.44 -0.06 0.00 -0.50 0.00 0.00 59.36 58.86 2q3u h GLU 193 Cb 1.17 0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 29.20 2q3u h GLU 193 CO -0.21 1.15 0.11 1.96 -1.40 0.00 0.00 179.01 180.62 2q3u h GLN 194 N 0.14 0.91 -0.03 2.33 4.20 -1.24 -0.17 115.11 121.26 2q3u h GLN 194 Ca -0.11 -0.23 -0.00 0.00 0.06 0.00 0.00 58.65 58.37 2q3u h GLN 194 Cb 1.78 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 29.44 2q3u h GLN 194 CO 0.18 0.87 0.01 0.82 -0.67 0.00 0.00 178.83 180.04 2q3u h ILE 195 N 0.81 1.13 -0.35 2.54 2.04 -0.89 -2.75 117.51 120.04 2q3u h ILE 195 Ca 0.17 -0.40 0.07 0.00 1.00 0.00 0.00 64.86 65.71 2q3u h ILE 195 Cb 0.38 1.36 -0.08 0.00 -0.74 0.00 0.00 36.82 37.74 2q3u h ILE 195 CO 0.01 0.11 -0.16 -0.33 0.00 0.00 0.00 178.15 177.77 2q3u h GLU 196 N -0.12 -0.10 -0.87 2.37 5.08 -0.86 -0.90 114.58 119.18 2q3u h GLU 196 Ca 0.01 0.01 0.17 0.00 -1.00 0.00 0.00 59.36 58.54 2q3u h GLU 196 Cb 0.16 0.02 -0.16 0.00 0.50 0.00 0.00 28.75 29.28 2q3u h GLU 196 CO -0.00 -0.07 -0.26 1.49 -1.00 0.00 0.00 179.01 179.18 2q3u h GLU 197 N -0.10 -0.02 0.49 2.33 4.57 -0.74 0.12 114.58 121.24 2q3u h GLU 197 Ca 0.18 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.33 2q3u h GLU 197 Cb 0.37 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 2q3u h GLU 197 CO -0.42 -0.01 -0.24 0.93 -1.18 0.00 0.00 179.01 178.10 2q3u h GLU 198 N -0.02 -0.64 -0.80 1.92 4.39 -1.31 -2.56 114.58 115.57 2q3u h GLU 198 Ca 0.39 0.04 0.14 0.00 0.34 0.00 0.00 59.36 60.28 2q3u h GLU 198 Cb 0.63 0.15 -0.14 0.00 -0.10 0.00 0.00 28.75 29.28 2q3u h GLU 198 CO -0.90 -0.34 -0.27 1.28 -1.16 0.00 0.00 179.01 177.62 2q3u n LEU 199 N -5.25 -0.43 -0.20 1.33 4.77 -0.26 0.10 117.00 117.06 2q3u n LEU 199 Ca -0.10 1.39 -0.01 0.00 -0.03 0.00 0.00 56.01 57.27 2q3u n LEU 199 Cb 0.31 -0.36 0.07 0.00 -2.33 0.00 0.00 43.42 41.11 2q3u n LEU 199 CO 0.28 -1.28 0.78 0.11 -1.33 0.00 0.00 177.39 175.94 2q3u h LYS 200 N 0.00 0.04 0.00 3.23 1.57 -0.85 0.61 116.57 121.17 2q3u h LYS 200 Ca 0.32 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.08 2q3u h LYS 200 Cb 0.52 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 2q3u h LYS 200 CO -0.81 0.03 -0.08 0.87 -0.57 0.00 0.00 179.45 178.88 2q3u h LYS 201 N 0.04 0.00 0.00 3.15 1.57 0.11 -2.04 116.57 119.40 2q3u h LYS 201 Ca 0.30 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.82 2q3u h LYS 201 Cb 0.46 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.73 2q3u h LYS 201 CO -0.57 0.08 -1.98 0.66 -0.57 0.00 0.00 179.45 177.07 2q3u n TYR 202 N -3.18 0.00 1.53 -1.35 4.01 -0.97 -2.55 117.16 114.65 2q3u n TYR 202 Ca 0.01 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.89 2q3u n TYR 202 Cb 0.40 -0.67 0.56 0.00 -0.31 0.00 0.00 39.34 39.32 2q3u n TYR 202 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2q3u n LEU 203 N -2.95 1.34 -0.63 7.72 4.77 0.21 -4.80 117.00 122.65 2q3u n LEU 203 Ca -0.30 -0.44 -0.08 0.00 -0.03 0.00 0.00 56.01 55.16 2q3u n LEU 203 Cb 0.84 -0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.89 2q3u n LEU 203 CO 0.19 0.22 -0.08 0.61 -1.33 0.00 0.00 177.39 177.00 2q3u n GLY 204 N 1.17 0.94 3.93 -0.72 0.00 -0.77 -4.64 105.19 105.10 2q3u n GLY 204 Ca 0.19 -0.26 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 2q3u n GLY 204 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2q3u s VAL 205 N -2.07 5.03 -0.17 1.61 -7.23 -1.24 -4.69 120.40 111.65 2q3u s VAL 205 Ca 0.00 -0.19 0.14 0.00 -1.81 0.00 0.00 61.98 60.12 2q3u s VAL 205 Cb 0.00 -3.85 -0.20 0.00 0.56 0.00 0.00 36.38 32.89 2q3u s VAL 205 CO 0.00 -0.63 0.05 0.00 -0.31 0.00 0.00 175.10 174.21 2q3u n GLN 206 N -1.85 1.25 -4.21 4.82 3.00 0.68 -4.59 117.38 116.48 2q3u n GLN 206 Ca -0.03 -0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 56.81 2q3u n GLN 206 Cb 0.56 -1.43 -0.08 0.00 0.00 0.00 0.00 30.24 29.28 2q3u n GLN 206 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2q3u s SER 207 N -5.08 0.85 0.15 1.08 1.04 0.30 -5.02 113.70 107.01 2q3u s SER 207 Ca -0.09 -1.53 0.02 0.00 0.48 0.00 0.00 55.95 54.84 2q3u s SER 207 Cb 0.05 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.62 2q3u s SER 207 CO 0.68 -1.00 -0.04 -0.36 0.98 0.00 0.00 173.24 173.50 2q3u s PHE 208 N -3.74 1.15 -0.25 5.02 0.40 -1.26 -1.23 117.98 118.06 2q3u s PHE 208 Ca 0.38 -0.93 -0.03 0.00 -0.60 0.00 0.00 56.93 55.75 2q3u s PHE 208 Cb 0.04 -0.64 0.08 0.00 0.51 0.00 0.00 43.02 43.01 2q3u s PHE 208 CO 0.19 -0.12 0.10 0.42 0.70 0.00 0.00 175.22 176.51 2q3u s ILE 209 N -3.57 0.19 -0.40 0.64 1.01 0.13 -4.84 121.20 114.36 2q3u s ILE 209 Ca 0.19 -0.71 -0.19 0.00 0.00 0.00 0.00 60.65 59.94 2q3u s ILE 209 Cb 0.05 -1.02 0.01 0.00 0.01 0.00 0.00 42.46 41.51 2q3u s ILE 209 CO 0.01 -0.54 0.54 0.26 0.00 0.00 0.00 174.94 175.21 2q3u s TRP 210 N 1.98 3.14 0.15 3.97 0.52 -1.26 -1.01 118.94 126.43 2q3u s TRP 210 Ca 0.06 -0.02 -0.17 0.00 0.02 0.00 0.00 56.10 55.99 2q3u s TRP 210 Cb -0.16 -3.06 -0.07 0.00 -1.15 0.00 0.00 33.47 29.02 2q3u s TRP 210 CO -0.24 -0.69 0.59 -0.51 0.02 0.00 0.00 176.95 176.12 2q3u s LEU 211 N 2.48 4.39 0.13 2.99 1.43 -0.01 -4.89 118.68 125.21 2q3u s LEU 211 Ca 0.19 1.20 -0.18 0.00 -1.03 0.00 0.00 54.13 54.31 2q3u s LEU 211 Cb -0.15 -3.25 -0.03 0.00 0.03 0.00 0.00 46.19 42.79 2q3u s LEU 211 CO 0.15 0.13 1.75 -0.65 0.23 0.00 0.00 176.35 177.96 2q3u h PRO 212 N 3.77 0.44 -4.99 1.29 0.11 -1.88 -0.59 132.00 130.15 2q3u h PRO 212 Ca -0.49 -0.04 -0.32 0.00 0.11 0.00 0.00 66.00 65.26 2q3u h PRO 212 Cb 1.20 -0.09 -0.16 0.00 0.11 0.00 0.00 31.00 32.06 2q3u h PRO 212 CO 0.65 0.35 -0.72 1.03 -0.21 0.00 0.00 178.00 179.10 2q3u s ARG 213 N -5.95 0.93 0.00 1.05 0.52 -1.26 -2.43 118.95 111.81 2q3u s ARG 213 Ca -0.13 -1.29 0.00 0.00 -0.52 0.00 0.00 55.73 53.79 2q3u s ARG 213 Cb 0.09 -0.55 0.00 0.00 0.52 0.00 0.00 34.95 35.02 2q3u s ARG 213 CO 0.72 0.07 0.00 0.41 0.02 0.00 0.00 175.30 176.52 2q3u n GLY 214 N 0.20 1.22 3.73 -3.53 0.00 -1.26 -4.95 105.19 100.60 2q3u n GLY 214 Ca -0.13 -1.93 -0.34 0.00 0.00 0.00 0.00 46.02 43.62 2q3u n GLY 214 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2q3u s LEU 215 N 0.00 3.27 0.01 0.99 2.96 -1.26 -4.96 118.68 119.69 2q3u s LEU 215 Ca 0.00 2.27 -0.29 0.00 -0.22 0.00 0.00 54.13 55.89 2q3u s LEU 215 Cb 0.00 -4.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.08 2q3u s LEU 215 CO 0.00 -2.24 0.94 -0.47 -1.32 0.00 0.00 176.35 173.25 2q3u s TYR 216 N -2.13 3.67 0.00 5.38 6.14 -1.26 -2.99 117.35 126.16 2q3u s TYR 216 Ca 0.72 1.65 0.00 0.00 0.64 0.00 0.00 57.07 60.08 2q3u s TYR 216 Cb -0.27 -3.07 0.00 0.00 0.42 0.00 0.00 41.96 39.05 2q3u s TYR 216 CO 0.46 0.04 0.00 0.41 0.64 0.00 0.00 175.55 177.10 2q3u n GLY 217 N 2.83 0.29 2.10 8.97 0.00 -1.26 -4.53 105.19 113.58 2q3u n GLY 217 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 2q3u n GLY 217 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2q3u n ASP 218 N 0.00 4.22 0.01 1.61 4.64 -1.16 -4.45 116.55 121.42 2q3u n ASP 218 Ca 0.00 -3.44 -0.02 0.00 -1.38 0.00 0.00 54.79 49.96 2q3u n ASP 218 Cb 0.00 -0.79 0.25 0.00 -1.04 0.00 0.00 41.12 39.54 2q3u n ASP 218 CO 0.00 0.00 0.00 -0.08 -0.82 0.00 0.00 177.20 176.30 2q3u h GLU 219 N 1.78 0.49 -0.74 -0.67 4.57 -1.93 -0.25 114.58 117.83 2q3u h GLU 219 Ca 0.46 -0.14 -0.02 0.00 -1.18 0.00 0.00 59.36 58.48 2q3u h GLU 219 Cb 2.60 -0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 31.10 2q3u h GLU 219 CO 0.92 0.62 0.39 -0.44 -1.18 0.00 0.00 179.01 179.31 2q3u h ASP 220 N 0.46 0.92 -0.21 1.04 3.32 -1.96 -1.81 116.42 118.18 2q3u h ASP 220 Ca 0.08 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2q3u h ASP 220 Cb 0.49 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.81 2q3u h ASP 220 CO 0.03 0.76 0.00 0.35 -1.72 0.00 0.00 179.24 178.66 2q3u n THR 221 N -4.35 0.25 -3.37 0.35 -2.24 -1.13 -4.75 114.28 99.05 2q3u n THR 221 Ca 0.07 -0.57 -0.18 0.00 -2.27 0.00 0.00 64.05 61.10 2q3u n THR 221 Cb 0.11 1.03 0.07 0.00 -2.10 0.00 0.00 70.33 69.44 2q3u n THR 221 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2q3u n ASN 222 N 1.18 -4.20 -1.27 3.42 4.13 -0.19 -4.51 115.26 113.81 2q3u n ASN 222 Ca 0.17 -0.50 0.00 0.00 1.68 0.00 0.00 54.58 55.93 2q3u n ASN 222 Cb 0.55 -4.49 0.00 0.00 -1.54 0.00 0.00 39.78 34.29 2q3u n ASN 222 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2q3u n GLY 223 N -1.52 0.36 3.80 7.41 0.00 -0.67 -2.08 105.19 112.49 2q3u n GLY 223 Ca -0.10 -0.32 -0.34 0.00 0.00 0.00 0.00 46.02 45.25 2q3u n GLY 223 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2q3u s HIS 224 N -2.85 3.25 0.23 1.61 3.76 -1.26 -4.06 115.29 115.97 2q3u s HIS 224 Ca 0.00 1.62 -0.06 0.00 -0.15 0.00 0.00 55.06 56.48 2q3u s HIS 224 Cb 0.00 -2.97 0.22 0.00 1.11 0.00 0.00 32.58 30.94 2q3u s HIS 224 CO 0.00 -0.38 1.76 0.97 -0.85 0.00 0.00 174.74 176.24 2q3u h ILE 225 N 1.92 1.25 0.00 0.60 6.09 -1.75 -2.28 117.51 123.34 2q3u h ILE 225 Ca -0.49 -0.92 0.00 0.00 -1.37 0.00 0.00 64.86 62.08 2q3u h ILE 225 Cb 1.20 0.57 0.00 0.00 0.47 0.00 0.00 36.82 39.06 2q3u h ILE 225 CO 0.61 0.35 0.00 -0.90 -3.07 0.00 0.00 178.15 175.14 2q3u n ASP 226 N -4.24 0.09 -1.89 2.19 5.75 -0.38 0.45 116.55 118.52 2q3u n ASP 226 Ca 0.05 0.53 -0.22 0.00 -0.01 0.00 0.00 54.79 55.14 2q3u n ASP 226 Cb 0.25 -0.55 0.09 0.00 -1.03 0.00 0.00 41.12 39.88 2q3u n ASP 226 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2q3u n ASN 227 N -1.61 5.05 -4.87 -1.12 5.15 -0.86 -4.22 115.26 112.79 2q3u n ASN 227 Ca 0.02 -3.77 -0.35 0.00 -0.60 0.00 0.00 54.58 49.89 2q3u n ASN 227 Cb 0.13 -0.62 -0.05 0.00 -0.53 0.00 0.00 39.78 38.71 2q3u n ASN 227 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2q3u s PHE 231 N -3.91 3.37 -0.14 0.00 0.08 -1.26 -1.20 117.98 114.92 2q3u s PHE 231 Ca 0.13 1.48 0.06 0.00 0.12 0.00 0.00 56.93 58.71 2q3u s PHE 231 Cb 0.01 -2.83 -0.08 0.00 -0.57 0.00 0.00 43.02 39.56 2q3u s PHE 231 CO -0.02 -0.49 0.18 0.00 -0.10 0.00 0.00 175.22 174.79 2q3u n ALA 232 N -1.65 2.47 0.00 5.36 0.00 -0.68 -4.82 120.51 121.20 2q3u n ALA 232 Ca 0.07 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2q3u n ALA 232 Cb 0.54 -0.20 0.00 0.00 0.00 0.00 0.00 19.45 19.79 2q3u n ALA 232 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2q3u n ARG 233 N -1.42 0.00 -1.60 0.00 1.85 -1.18 -4.98 116.66 109.33 2q3u n ARG 233 Ca -0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 57.85 56.36 2q3u n ARG 233 Cb 0.12 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.49 2q3u n ARG 233 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2q3u n PRO 234 N -0.34 1.35 -0.69 2.89 -0.02 -1.26 -0.30 135.00 136.63 2q3u n PRO 234 Ca 0.00 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2q3u n PRO 234 Cb 0.00 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 2q3u n PRO 234 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q3u n GLY 235 N 2.22 1.49 2.96 -1.23 0.00 -1.26 -4.99 105.19 104.37 2q3u n GLY 235 Ca 0.15 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.02 2q3u n GLY 235 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q3u s VAL 236 N -3.65 0.38 0.03 1.61 1.01 0.59 -1.45 120.40 118.92 2q3u s VAL 236 Ca 0.00 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.70 2q3u s VAL 236 Cb 0.00 -0.34 -0.02 0.00 0.00 0.00 0.00 36.38 36.02 2q3u s VAL 236 CO 0.00 0.05 -0.05 0.68 0.00 0.00 0.00 175.10 175.78 2q3u s VAL 237 N -0.24 0.32 -0.11 2.92 -7.23 -0.98 -1.68 120.40 113.39 2q3u s VAL 237 Ca 0.00 -0.87 -0.08 0.00 -1.81 0.00 0.00 61.98 59.22 2q3u s VAL 237 Cb -0.03 -0.41 -0.04 0.00 0.56 0.00 0.00 36.38 36.46 2q3u s VAL 237 CO -0.00 -0.36 0.17 -0.76 -0.31 0.00 0.00 175.10 173.83 2q3u s LEU 238 N -1.31 4.39 -0.10 1.32 1.43 -0.34 -2.00 118.68 122.07 2q3u s LEU 238 Ca -0.11 0.50 0.02 0.00 -1.03 0.00 0.00 54.13 53.52 2q3u s LEU 238 Cb -0.09 -2.12 0.01 0.00 0.03 0.00 0.00 46.19 44.02 2q3u s LEU 238 CO -0.00 0.38 -0.16 -0.22 0.23 0.00 0.00 176.35 176.58 2q3u s LEU 239 N -0.93 1.78 0.33 1.79 2.96 -1.15 -2.30 118.68 121.16 2q3u s LEU 239 Ca 0.15 -0.44 -0.29 0.00 -0.22 0.00 0.00 54.13 53.34 2q3u s LEU 239 Cb -0.12 -1.11 -0.11 0.00 0.50 0.00 0.00 46.19 45.35 2q3u s LEU 239 CO 0.05 0.04 1.44 -0.44 -1.32 0.00 0.00 176.35 176.12 2q3u s SER 240 N 0.85 6.52 -0.17 3.68 0.01 -1.26 -0.33 113.70 123.00 2q3u s SER 240 Ca -0.09 2.87 -0.19 0.00 1.31 0.00 0.00 55.95 59.85 2q3u s SER 240 Cb -0.15 -2.65 0.05 0.00 0.21 0.00 0.00 66.02 63.48 2q3u s SER 240 CO 0.00 -0.76 0.53 0.86 0.41 0.00 0.00 173.24 174.29 2q3u s TRP 241 N -0.77 -0.56 0.17 2.43 -0.11 -0.93 -4.74 118.94 114.42 2q3u s TRP 241 Ca 0.54 1.32 0.01 0.00 1.22 0.00 0.00 56.10 59.19 2q3u s TRP 241 Cb -0.44 0.21 -0.04 0.00 -1.50 0.00 0.00 33.47 31.69 2q3u s TRP 241 CO 0.55 -0.32 0.02 -0.08 -4.62 0.00 0.00 176.95 172.50 2q3u s THR 242 N 0.03 0.52 -0.86 5.86 -1.32 -1.26 -1.67 115.64 116.94 2q3u s THR 242 Ca -0.02 -1.96 0.08 0.00 -1.21 0.00 0.00 61.69 58.57 2q3u s THR 242 Cb -0.04 -2.14 0.04 0.00 -1.51 0.00 0.00 72.50 68.85 2q3u s THR 242 CO 0.02 -0.44 0.67 0.47 -2.21 0.00 0.00 174.62 173.13 2q3u n ASP 243 N -0.22 1.41 -4.58 8.08 8.00 -1.26 -4.87 116.55 123.11 2q3u n ASP 243 Ca -0.06 -1.21 -0.42 0.00 0.71 0.00 0.00 54.79 53.82 2q3u n ASP 243 Cb 0.64 0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.89 2q3u n ASP 243 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2q3u s ASP 244 N -0.83 6.10 0.04 -2.24 -1.08 -1.26 -4.84 116.67 112.56 2q3u s ASP 244 Ca 0.08 0.47 0.15 0.00 -0.52 0.00 0.00 52.55 52.73 2q3u s ASP 244 Cb 0.06 -2.54 0.63 0.00 -1.46 0.00 0.00 42.92 39.61 2q3u s ASP 244 CO 0.13 -1.69 1.47 -0.62 0.52 0.00 0.00 175.17 174.97 2q3u n GLU 245 N 8.55 0.03 0.00 4.34 1.02 -1.26 -1.28 120.64 132.04 2q3u n GLU 245 Ca 0.14 0.30 0.13 0.00 -0.02 0.00 0.00 57.16 57.72 2q3u n GLU 245 Cb 0.49 -1.56 0.42 0.00 -0.02 0.00 0.00 31.44 30.76 2q3u n GLU 245 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2q3u n THR 246 N -1.62 0.00 -2.74 2.62 -2.24 -1.26 -4.88 114.28 104.15 2q3u n THR 246 Ca 0.03 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.16 2q3u n THR 246 Cb 0.16 0.57 -0.03 0.00 -2.10 0.00 0.00 70.33 68.94 2q3u n THR 246 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2q3u s ASP 247 N -2.19 7.23 0.63 3.42 -1.08 -0.41 -4.91 116.67 119.36 2q3u s ASP 247 Ca 0.32 1.50 0.35 0.00 -0.52 0.00 0.00 52.55 54.20 2q3u s ASP 247 Cb 0.20 -2.54 2.00 0.00 -1.46 0.00 0.00 42.92 41.12 2q3u s ASP 247 CO 0.41 -0.36 2.22 -0.65 0.52 0.00 0.00 175.17 177.30 2q3u h PRO 248 N 7.01 0.00 0.00 4.34 0.11 -1.89 0.74 132.00 142.31 2q3u h PRO 248 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2q3u h PRO 248 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2q3u h PRO 248 CO 0.82 0.00 0.00 0.94 -0.21 0.00 0.00 178.00 179.55 2q3u n GLN 249 N -3.41 0.12 -0.16 1.05 -0.06 -1.26 -3.96 117.38 109.69 2q3u n GLN 249 Ca -0.02 0.24 -0.09 0.00 -2.00 0.00 0.00 57.00 55.13 2q3u n GLN 249 Cb 0.18 -1.68 0.00 0.00 -4.06 0.00 0.00 30.24 24.68 2q3u n GLN 249 CO 0.00 0.00 0.00 -0.92 -0.20 0.00 0.00 177.06 175.94 2q3u h TYR 250 N 0.00 0.73 0.00 3.69 5.03 0.27 -2.50 116.97 124.19 2q3u h TYR 250 Ca 0.00 -0.07 0.00 0.00 2.58 0.00 0.00 58.73 61.24 2q3u h TYR 250 Cb 0.45 -0.21 0.00 0.00 1.55 0.00 0.00 36.73 38.52 2q3u h TYR 250 CO 0.00 0.66 0.00 1.05 -1.32 0.00 0.00 178.16 178.55 2q3u h GLU 251 N 0.60 0.00 -0.01 1.82 4.11 -1.72 -2.70 114.58 116.68 2q3u h GLU 251 Ca 0.15 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.41 2q3u h GLU 251 Cb 0.27 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 2q3u h GLU 251 CO -0.00 0.00 -0.77 0.00 0.07 0.00 0.00 179.01 178.31 2q3u h ARG 252 N 0.00 0.13 0.00 1.06 3.08 -1.63 -3.26 114.38 113.76 2q3u h ARG 252 Ca 0.00 -0.12 -0.10 0.00 0.07 0.00 0.00 59.98 59.83 2q3u h ARG 252 Cb 0.74 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.80 2q3u h ARG 252 CO 0.00 0.83 -0.56 0.77 -1.07 0.00 0.00 179.97 179.94 2q3u h SER 253 N 0.08 0.00 -0.37 7.04 0.02 -1.31 -2.95 113.55 116.06 2q3u h SER 253 Ca -0.02 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.78 2q3u h SER 253 Cb 1.35 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.88 2q3u h SER 253 CO 0.11 0.47 -0.34 0.58 -1.14 0.00 0.00 176.83 176.51 2q3u h VAL 254 N 0.00 1.28 0.00 2.27 2.07 -1.60 0.37 116.25 120.64 2q3u h VAL 254 Ca -0.02 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 66.00 2q3u h VAL 254 Cb 1.37 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.54 2q3u h VAL 254 CO 0.06 0.50 0.00 1.21 0.02 0.00 0.00 177.57 179.36 2q3u n GLU 255 N -4.13 0.06 -0.09 1.57 2.13 -1.23 -0.59 120.64 118.37 2q3u n GLU 255 Ca -0.02 0.07 -0.14 0.00 0.66 0.00 0.00 57.16 57.73 2q3u n GLU 255 Cb 0.51 -1.58 -0.08 0.00 0.27 0.00 0.00 31.44 30.57 2q3u n GLU 255 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2q3u h ALA 256 N 2.84 0.14 -0.87 4.31 0.00 -1.14 -3.27 119.26 121.28 2q3u h ALA 256 Ca 0.00 -0.85 0.01 0.00 0.00 0.00 0.00 54.91 54.06 2q3u h ALA 256 Cb 0.53 0.56 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 2q3u h ALA 256 CO 0.00 0.54 0.57 1.25 0.00 0.00 0.00 179.25 181.61 2q3u h LEU 257 N -1.00 1.01 -0.25 0.00 5.85 -0.17 0.74 115.31 121.48 2q3u h LEU 257 Ca -0.19 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.46 2q3u h LEU 257 Cb 0.94 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 2q3u h LEU 257 CO -0.11 0.74 -0.00 -1.28 -0.34 0.00 0.00 178.44 177.45 2q3u h SER 258 N 1.18 0.43 0.73 1.25 0.87 -1.05 0.54 113.55 117.51 2q3u h SER 258 Ca 0.32 -0.31 -0.03 0.00 -1.23 0.00 0.00 61.79 60.54 2q3u h SER 258 Cb -0.12 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 61.73 2q3u h SER 258 CO -0.07 0.63 -0.40 0.58 -0.53 0.00 0.00 176.83 177.04 2q3u h VAL 259 N 0.21 0.18 -0.32 2.23 2.07 -1.52 -3.01 116.25 116.10 2q3u h VAL 259 Ca 0.07 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.66 2q3u h VAL 259 Cb 0.41 0.18 -0.07 0.00 -1.52 0.00 0.00 31.29 30.30 2q3u h VAL 259 CO 0.01 0.00 -0.12 -0.07 0.02 0.00 0.00 177.57 177.42 2q3u h LEU 260 N -1.05 -0.41 -1.58 2.57 3.38 -0.83 -2.11 115.31 115.27 2q3u h LEU 260 Ca -0.10 0.11 0.23 0.00 0.09 0.00 0.00 57.88 58.21 2q3u h LEU 260 Cb 0.83 0.24 -0.07 0.00 0.09 0.00 0.00 40.66 41.76 2q3u h LEU 260 CO 0.13 -0.15 0.63 0.28 0.09 0.00 0.00 178.44 179.41 2q3u h SER 261 N -0.06 0.33 -0.43 -0.43 0.02 -0.85 0.39 113.55 112.52 2q3u h SER 261 Ca 0.16 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 2q3u h SER 261 Cb 0.30 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2q3u h SER 261 CO -0.36 0.11 0.00 0.59 -1.14 0.00 0.00 176.83 176.04 2q3u n ASN 262 N -4.48 3.22 -4.90 3.07 3.02 -0.83 -4.72 115.26 109.64 2q3u n ASN 262 Ca 0.20 -2.26 -0.31 0.00 -0.03 0.00 0.00 54.58 52.18 2q3u n ASN 262 Cb 0.79 -0.45 -0.04 0.00 -0.61 0.00 0.00 39.78 39.47 2q3u n ASN 262 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2q3u s SER 263 N -0.78 6.28 -0.10 6.41 0.01 0.14 -5.07 113.70 120.59 2q3u s SER 263 Ca 0.34 0.26 -0.00 0.00 1.31 0.00 0.00 55.95 57.85 2q3u s SER 263 Cb 0.21 -1.92 0.02 0.00 0.21 0.00 0.00 66.02 64.54 2q3u s SER 263 CO 0.17 0.19 -0.06 -0.63 0.41 0.00 0.00 173.24 173.32 2q3u s ILE 264 N -1.46 0.87 1.01 1.44 1.01 -1.26 -2.58 121.20 120.23 2q3u s ILE 264 Ca 0.33 -0.20 -0.17 0.00 0.00 0.00 0.00 60.65 60.61 2q3u s ILE 264 Cb -0.13 -0.91 0.25 0.00 0.01 0.00 0.00 42.46 41.67 2q3u s ILE 264 CO 0.25 0.34 0.98 -0.90 0.00 0.00 0.00 174.94 175.61 2q3u n ASP 265 N 4.89 -1.51 0.24 3.58 5.68 -0.87 -4.84 116.55 123.70 2q3u n ASP 265 Ca -0.12 -1.14 0.16 0.00 -0.50 0.00 0.00 54.79 53.18 2q3u n ASP 265 Cb 0.50 -0.86 0.75 0.00 -1.14 0.00 0.00 41.12 40.37 2q3u n ASP 265 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2q3u h ALA 266 N -2.47 1.00 -0.29 2.12 0.00 -1.86 -0.87 119.26 116.89 2q3u h ALA 266 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2q3u h ALA 266 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2q3u h ALA 266 CO 0.24 0.00 0.00 0.54 0.00 0.00 0.00 179.25 180.03 2q3u n ARG 267 N -2.72 2.23 -0.32 0.00 1.74 -1.26 -4.98 116.66 111.34 2q3u n ARG 267 Ca -0.00 -2.05 0.00 0.00 -0.77 0.00 0.00 57.85 55.02 2q3u n ARG 267 Cb 0.18 -1.43 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 2q3u n ARG 267 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2q3u n GLY 268 N 1.23 0.83 3.85 -0.13 0.00 -0.33 -5.08 105.19 105.56 2q3u n GLY 268 Ca 0.16 -0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2q3u n GLY 268 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2q3u s ARG 269 N -0.67 3.94 0.13 1.61 0.52 -1.26 -4.81 118.95 118.41 2q3u s ARG 269 Ca 0.00 0.45 -0.30 0.00 -0.52 0.00 0.00 55.73 55.36 2q3u s ARG 269 Cb 0.00 -2.84 -0.06 0.00 0.52 0.00 0.00 34.95 32.57 2q3u s ARG 269 CO 0.00 0.42 1.06 0.15 0.02 0.00 0.00 175.30 176.95 2q3u s LYS 270 N -2.21 4.60 0.16 3.54 1.02 -1.26 -2.05 119.74 123.54 2q3u s LYS 270 Ca 0.41 1.62 -0.30 0.00 0.02 0.00 0.00 55.97 57.72 2q3u s LYS 270 Cb -0.14 -3.33 -0.07 0.00 -0.52 0.00 0.00 37.83 33.77 2q3u s LYS 270 CO 0.20 0.07 1.12 0.42 -0.92 0.00 0.00 175.35 176.23 2q3u s ILE 271 N 0.09 3.88 -0.15 2.17 -1.09 -1.07 -4.93 121.20 120.10 2q3u s ILE 271 Ca 0.50 1.57 -0.07 0.00 -2.23 0.00 0.00 60.65 60.42 2q3u s ILE 271 Cb -0.27 -4.00 -0.04 0.00 -1.58 0.00 0.00 42.46 36.57 2q3u s ILE 271 CO 0.32 0.25 0.08 -1.58 -1.23 0.00 0.00 174.94 172.78 2q3u s GLN 272 N -0.13 3.64 -0.16 2.79 0.74 -0.53 -4.72 119.66 121.29 2q3u s GLN 272 Ca 0.51 -0.27 -0.02 0.00 0.05 0.00 0.00 55.36 55.63 2q3u s GLN 272 Cb -0.30 -3.15 -0.01 0.00 1.10 0.00 0.00 33.01 30.65 2q3u s GLN 272 CO 0.34 0.52 -0.10 0.08 -0.55 0.00 0.00 175.29 175.59 2q3u s VAL 273 N -0.32 3.17 -0.50 1.34 1.01 -1.26 -2.33 120.40 121.51 2q3u s VAL 273 Ca 0.09 -0.60 -0.02 0.00 0.00 0.00 0.00 61.98 61.46 2q3u s VAL 273 Cb -0.12 -2.37 0.13 0.00 0.00 0.00 0.00 36.38 34.02 2q3u s VAL 273 CO 0.01 0.49 0.29 -0.63 0.00 0.00 0.00 175.10 175.26 2q3u s ILE 274 N 0.77 3.33 0.28 2.22 1.01 -0.84 -5.03 121.20 122.93 2q3u s ILE 274 Ca -0.04 -2.53 -0.30 0.00 0.00 0.00 0.00 60.65 57.78 2q3u s ILE 274 Cb -0.15 -3.25 -0.12 0.00 0.01 0.00 0.00 42.46 38.95 2q3u s ILE 274 CO 0.01 -0.77 1.54 0.29 0.00 0.00 0.00 174.94 176.02 2q3u n LYS 275 N 4.02 2.51 -3.94 2.79 5.02 -1.26 -2.92 118.16 124.37 2q3u n LYS 275 Ca 0.03 0.89 -0.30 0.00 -2.02 0.00 0.00 58.31 56.90 2q3u n LYS 275 Cb 0.39 -2.64 -0.15 0.00 -0.02 0.00 0.00 35.03 32.61 2q3u n LYS 275 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2q3u s LEU 276 N -0.28 2.72 0.13 -0.35 2.96 0.55 -4.87 118.68 119.54 2q3u s LEU 276 Ca 0.65 -1.26 -0.30 0.00 -0.22 0.00 0.00 54.13 53.00 2q3u s LEU 276 Cb -0.54 -1.21 -0.07 0.00 0.50 0.00 0.00 46.19 44.87 2q3u s LEU 276 CO 0.49 -0.25 1.18 -0.31 -1.32 0.00 0.00 176.35 176.14 2q3u s TYR 277 N 1.36 3.47 0.81 5.38 2.02 -1.26 -2.19 117.35 126.95 2q3u s TYR 277 Ca -0.05 1.41 -0.11 0.00 -0.37 0.00 0.00 57.07 57.95 2q3u s TYR 277 Cb -0.19 -3.39 0.09 0.00 -0.40 0.00 0.00 41.96 38.06 2q3u s TYR 277 CO -0.07 -1.10 1.13 0.96 -1.57 0.00 0.00 175.55 174.90 2q3u s ILE 278 N 0.38 2.69 1.13 2.71 -4.36 -0.67 -4.70 121.20 118.37 2q3u s ILE 278 Ca 0.55 0.24 -0.15 0.00 -0.26 0.00 0.00 60.65 61.03 2q3u s ILE 278 Cb -0.31 -2.56 0.25 0.00 1.25 0.00 0.00 42.46 41.10 2q3u s ILE 278 CO 0.33 -0.27 1.08 -2.16 0.24 0.00 0.00 174.94 174.15 2q3u s PRO 279 N -4.61 -0.61 0.96 0.37 0.04 -1.26 -4.98 135.00 124.90 2q3u s PRO 279 Ca 0.65 0.32 -0.13 0.00 0.04 0.00 0.00 61.00 61.89 2q3u s PRO 279 Cb -0.21 -1.63 0.03 0.00 0.04 0.00 0.00 34.50 32.72 2q3u s PRO 279 CO 0.54 -3.39 0.32 -0.85 0.04 0.00 0.00 177.00 173.66 2q3u n GLU 280 N -4.60 -0.31 -1.71 4.56 0.28 -1.26 -4.85 120.64 112.75 2q3u n GLU 280 Ca 0.08 -0.05 -0.43 0.00 -0.16 0.00 0.00 57.16 56.59 2q3u n GLU 280 Cb 0.58 -1.80 -0.03 0.00 1.43 0.00 0.00 31.44 31.62 2q3u n GLU 280 CO 0.00 0.00 0.00 -2.30 -0.16 0.00 0.00 177.13 174.67 2q3u n PRO 281 N -1.45 2.44 -5.00 3.44 -0.02 -1.26 -4.98 135.00 128.17 2q3u n PRO 281 Ca 0.06 0.87 -0.31 0.00 -2.02 0.00 0.00 63.50 62.10 2q3u n PRO 281 Cb 0.54 -2.63 -0.15 0.00 -0.02 0.00 0.00 33.50 31.24 2q3u n PRO 281 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2q3u s LEU 282 N 0.21 2.28 0.00 2.45 1.43 -1.26 -5.05 118.68 118.74 2q3u s LEU 282 Ca 0.70 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 53.33 2q3u s LEU 282 Cb -0.57 -1.38 0.00 0.00 0.03 0.00 0.00 46.19 44.27 2q3u s LEU 282 CO 0.44 0.29 0.00 -1.22 0.23 0.00 0.00 176.35 176.09 2q3u n TYR 283 N 2.04 0.00 -4.02 0.29 4.02 -1.26 -0.09 117.16 118.14 2q3u n TYR 283 Ca -0.16 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.62 2q3u n TYR 283 Cb 0.52 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.79 2q3u n TYR 283 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2q3u s THR 285 N 3.73 0.00 0.37 -0.72 -4.23 -1.26 -4.79 115.64 108.74 2q3u s THR 285 Ca 0.00 -1.46 0.13 0.00 -1.18 0.00 0.00 61.69 59.18 2q3u s THR 285 Cb 0.00 -2.38 0.10 0.00 1.34 0.00 0.00 72.50 71.56 2q3u s THR 285 CO 0.00 0.00 1.84 -0.08 -0.54 0.00 0.00 174.62 175.84 2q3u h GLU 286 N 2.22 0.00 0.00 3.99 4.57 -1.95 -1.16 114.58 122.25 2q3u h GLU 286 Ca -0.28 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 57.87 2q3u h GLU 286 Cb 1.25 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.83 2q3u h GLU 286 CO 0.38 0.36 -0.14 1.49 -1.18 0.00 0.00 179.01 179.91 2q3u h GLU 287 N 0.00 0.00 0.00 1.92 4.81 -2.02 0.30 114.58 119.59 2q3u h GLU 287 Ca -0.00 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2q3u h GLU 287 Cb 0.64 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 2q3u h GLU 287 CO 0.05 0.14 -0.34 0.93 -0.73 0.00 0.00 179.01 179.06 2q3u h GLU 288 N 0.00 0.00 -0.06 1.92 5.08 -1.95 -3.38 114.58 116.20 2q3u h GLU 288 Ca -0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 2q3u h GLU 288 Cb 0.43 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 2q3u h GLU 288 CO 0.02 0.75 -0.32 1.03 -1.00 0.00 0.00 179.01 179.49 2q3u h SER 289 N -1.00 0.11 0.13 1.42 0.87 -1.13 -2.83 113.55 111.12 2q3u h SER 289 Ca -0.08 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2q3u h SER 289 Cb 0.86 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.79 2q3u h SER 289 CO -0.05 0.43 0.00 -1.28 -0.53 0.00 0.00 176.83 175.40 2q3u h SER 290 N 0.09 0.00 -0.08 6.23 0.87 -1.10 -1.59 113.55 117.98 2q3u h SER 290 Ca 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2q3u h SER 290 Cb 0.62 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 2q3u h SER 290 CO 0.05 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.96 2q3u n GLY 291 N -1.00 -0.22 3.71 5.77 0.00 -1.07 -4.82 105.19 107.57 2q3u n GLY 291 Ca -0.02 -0.33 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 2q3u n GLY 291 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2q3u s ILE 292 N -1.90 5.24 0.36 -0.61 1.01 -0.60 -1.34 121.20 123.36 2q3u s ILE 292 Ca 0.34 0.13 -0.25 0.00 0.00 0.00 0.00 60.65 60.87 2q3u s ILE 292 Cb 0.17 -3.38 -0.10 0.00 0.01 0.00 0.00 42.46 39.16 2q3u s ILE 292 CO 0.28 0.45 0.96 -0.89 0.00 0.00 0.00 174.94 175.73 2q3u s THR 293 N 0.33 4.21 -0.54 2.92 2.01 0.25 -4.99 115.64 119.82 2q3u s THR 293 Ca 0.07 1.69 -0.05 0.00 0.31 0.00 0.00 61.69 63.71 2q3u s THR 293 Cb -0.11 -3.87 0.14 0.00 0.01 0.00 0.00 72.50 68.67 2q3u s THR 293 CO -0.01 0.01 0.37 -1.10 -0.69 0.00 0.00 174.62 173.19 2q3u s GLN 294 N -2.40 2.43 0.00 4.92 -0.21 -1.26 -4.16 119.66 118.98 2q3u s GLN 294 Ca 0.54 -2.17 0.23 0.00 0.02 0.00 0.00 55.36 53.98 2q3u s GLN 294 Cb -0.16 -3.76 0.14 0.00 1.00 0.00 0.00 33.01 30.23 2q3u s GLN 294 CO 0.21 -1.15 1.19 -0.40 -2.12 0.00 0.00 175.29 173.02 2q3u n ASP 295 N 4.10 2.01 0.00 5.90 5.68 -1.26 -4.99 116.55 127.99 2q3u n ASP 295 Ca 0.02 -1.50 0.00 0.00 -0.50 0.00 0.00 54.79 52.82 2q3u n ASP 295 Cb 0.40 0.36 0.00 0.00 -1.14 0.00 0.00 41.12 40.74 2q3u n ASP 295 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2q3u n GLY 296 N 1.40 0.57 0.00 6.12 0.00 -1.26 -4.91 105.19 107.11 2q3u n GLY 296 Ca 0.10 -0.27 0.05 0.00 0.00 0.00 0.00 46.02 45.91 2q3u n GLY 296 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2q3u n GLU 297 N -2.80 0.32 -4.24 1.61 -0.58 -1.26 -4.96 120.64 108.74 2q3u n GLU 297 Ca 0.00 -0.10 -0.20 0.00 -0.42 0.00 0.00 57.16 56.44 2q3u n GLU 297 Cb 0.00 -1.25 -0.12 0.00 -0.57 0.00 0.00 31.44 29.50 2q3u n GLU 297 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2q3u s ALA 298 N -2.74 1.51 0.74 0.62 0.00 -1.26 -0.89 121.76 119.74 2q3u s ALA 298 Ca -0.04 -1.19 -0.15 0.00 0.00 0.00 0.00 51.96 50.58 2q3u s ALA 298 Cb 0.07 -0.14 0.03 0.00 0.00 0.00 0.00 23.12 23.08 2q3u s ALA 298 CO 0.44 0.21 1.16 0.44 0.00 0.00 0.00 175.76 178.01 2q3u n ILE 299 N 0.95 3.14 -1.90 0.00 -5.35 -0.88 -4.92 119.36 110.40 2q3u n ILE 299 Ca -0.19 -0.34 -0.39 0.00 -0.27 0.00 0.00 62.75 61.56 2q3u n ILE 299 Cb 0.55 -1.25 0.02 0.00 -1.74 0.00 0.00 39.64 37.21 2q3u n ILE 299 CO 0.00 0.00 0.00 -2.84 -1.76 0.00 0.00 176.55 171.95 2q3u s PRO 300 N -3.65 3.61 -0.09 6.28 0.02 -1.26 -4.95 135.00 134.95 2q3u s PRO 300 Ca 0.76 2.24 0.03 0.00 0.02 0.00 0.00 61.00 64.06 2q3u s PRO 300 Cb -0.33 -2.54 -0.01 0.00 0.02 0.00 0.00 34.50 31.63 2q3u s PRO 300 CO 0.48 -0.82 -0.19 1.03 -0.33 0.00 0.00 177.00 177.16 2q3u s ARG 301 N -2.55 2.96 0.07 5.54 1.81 -1.26 -5.13 118.95 120.39 2q3u s ARG 301 Ca 0.63 -0.80 0.03 0.00 -1.72 0.00 0.00 55.73 53.87 2q3u s ARG 301 Cb -0.40 -2.38 -0.03 0.00 -0.45 0.00 0.00 34.95 31.69 2q3u s ARG 301 CO 0.50 0.30 -0.09 -0.51 -0.68 0.00 0.00 175.30 174.82 2q3u s LEU 302 N 0.07 2.34 0.29 2.53 1.43 -1.26 -4.97 118.68 119.11 2q3u s LEU 302 Ca -0.08 -0.70 -0.30 0.00 -1.03 0.00 0.00 54.13 52.02 2q3u s LEU 302 Cb -0.15 -0.22 -0.12 0.00 0.03 0.00 0.00 46.19 45.73 2q3u s LEU 302 CO 0.05 -0.25 1.59 0.00 0.23 0.00 0.00 176.35 177.97 2q3u n ALA 303 N 0.96 2.50 -0.09 4.21 0.00 -1.26 -2.71 120.51 124.12 2q3u n ALA 303 Ca -0.19 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2q3u n ALA 303 Cb 0.56 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.56 2q3u n ALA 303 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q3u n GLY 304 N 2.14 0.77 3.73 0.00 0.00 -1.26 -4.97 105.19 105.59 2q3u n GLY 304 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2q3u n GLY 304 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q3u s THR 305 N -2.36 2.85 0.20 2.61 2.01 -1.10 -4.85 115.64 114.99 2q3u s THR 305 Ca 0.00 0.65 -0.31 0.00 0.31 0.00 0.00 61.69 62.34 2q3u s THR 305 Cb 0.00 -3.41 -0.10 0.00 0.01 0.00 0.00 72.50 68.99 2q3u s THR 305 CO 0.00 0.07 1.53 -0.60 -0.69 0.00 0.00 174.62 174.93 2q3u s ARG 306 N 0.49 4.23 0.18 4.92 6.06 -1.26 -4.14 118.95 129.42 2q3u s ARG 306 Ca 0.64 2.36 -0.28 0.00 -2.50 0.00 0.00 55.73 55.94 2q3u s ARG 306 Cb -0.41 -3.13 -0.08 0.00 0.06 0.00 0.00 34.95 31.39 2q3u s ARG 306 CO 0.36 -0.55 0.88 -0.51 -2.50 0.00 0.00 175.30 172.98 2q3u s LEU 307 N 0.56 4.59 -1.23 -0.88 1.43 0.87 -4.81 118.68 119.22 2q3u s LEU 307 Ca 0.66 1.79 -0.09 0.00 -1.03 0.00 0.00 54.13 55.47 2q3u s LEU 307 Cb -0.43 -3.48 0.20 0.00 0.03 0.00 0.00 46.19 42.50 2q3u s LEU 307 CO 0.36 0.12 1.73 0.00 0.23 0.00 0.00 176.35 178.79 2q3u n ALA 308 N 1.86 5.14 -2.84 4.21 0.00 -1.26 -4.73 120.51 122.89 2q3u n ALA 308 Ca -0.02 -4.42 -0.35 0.00 0.00 0.00 0.00 53.44 48.64 2q3u n ALA 308 Cb 0.48 -2.84 -0.11 0.00 0.00 0.00 0.00 19.45 16.98 2q3u n ALA 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2q3u s ALA 309 N -0.21 3.37 -0.13 0.00 0.00 -1.26 -4.80 121.76 118.72 2q3u s ALA 309 Ca 0.38 -0.89 -0.15 0.00 0.00 0.00 0.00 51.96 51.30 2q3u s ALA 309 Cb 0.07 -2.04 0.04 0.00 0.00 0.00 0.00 23.12 21.18 2q3u s ALA 309 CO 0.02 -0.09 0.40 0.45 0.00 0.00 0.00 175.76 176.54 2q3u s SER 310 N 0.88 -0.40 0.22 0.00 0.15 -1.26 -4.56 113.70 108.73 2q3u s SER 310 Ca 0.04 0.72 0.25 0.00 0.70 0.00 0.00 55.95 57.67 2q3u s SER 310 Cb -0.14 0.76 0.87 0.00 -1.71 0.00 0.00 66.02 65.80 2q3u s SER 310 CO 0.03 -0.20 1.76 -1.22 1.20 0.00 0.00 173.24 174.81 2q3u n TYR 311 N 2.60 0.89 0.34 3.44 4.01 -1.26 -3.17 117.16 124.00 2q3u n TYR 311 Ca -0.14 0.29 0.04 0.00 -0.16 0.00 0.00 57.90 57.92 2q3u n TYR 311 Cb 0.57 -0.96 0.18 0.00 -0.31 0.00 0.00 39.34 38.82 2q3u n TYR 311 CO 0.00 0.00 0.00 1.55 -0.46 0.00 0.00 176.86 177.95 2q3u n VAL 312 N -2.25 0.89 -3.11 -0.72 3.14 -1.26 -3.85 118.33 111.16 2q3u n VAL 312 Ca 0.04 0.22 -0.41 0.00 -2.96 0.00 0.00 64.34 61.23 2q3u n VAL 312 Cb 0.37 -1.10 -0.00 0.00 -1.06 0.00 0.00 33.84 32.04 2q3u n VAL 312 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 2q3u n ASN 313 N -1.29 5.97 -4.63 6.55 5.15 -1.19 -4.84 115.26 120.98 2q3u n ASN 313 Ca 0.03 -3.36 -0.26 0.00 -0.60 0.00 0.00 54.58 50.39 2q3u n ASN 313 Cb 0.06 -1.21 -0.09 0.00 -0.53 0.00 0.00 39.78 38.00 2q3u n ASN 313 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 2q3u s PHE 314 N -2.54 2.52 -0.30 1.20 -0.12 -1.25 -3.50 117.98 114.00 2q3u s PHE 314 Ca 0.32 -0.53 0.02 0.00 -0.05 0.00 0.00 56.93 56.69 2q3u s PHE 314 Cb 0.04 -1.62 0.07 0.00 -0.63 0.00 0.00 43.02 40.88 2q3u s PHE 314 CO 0.06 0.44 -0.03 -0.47 -0.05 0.00 0.00 175.22 175.18 2q3u s TYR 315 N -2.59 3.44 0.30 3.49 5.04 -0.22 -4.04 117.35 122.75 2q3u s TYR 315 Ca 0.35 -2.48 -0.29 0.00 -2.44 0.00 0.00 57.07 52.22 2q3u s TYR 315 Cb 0.03 -2.32 -0.10 0.00 0.35 0.00 0.00 41.96 39.92 2q3u s TYR 315 CO 0.19 -0.90 1.41 0.42 -1.34 0.00 0.00 175.55 175.34 2q3u s ILE 316 N 1.06 2.54 0.02 3.14 1.01 -1.26 -1.39 121.20 126.32 2q3u s ILE 316 Ca -0.02 0.49 0.00 0.00 0.00 0.00 0.00 60.65 61.13 2q3u s ILE 316 Cb -0.20 -3.31 -0.00 0.00 0.01 0.00 0.00 42.46 38.96 2q3u s ILE 316 CO -0.05 0.10 0.00 0.00 0.00 0.00 0.00 174.94 174.99 2q3u n ALA 317 N 1.51 0.02 -2.42 9.38 0.00 0.17 -4.91 120.51 124.26 2q3u n ALA 317 Ca 0.04 -0.10 -0.40 0.00 0.00 0.00 0.00 53.44 52.97 2q3u n ALA 317 Cb 0.40 0.06 -0.03 0.00 0.00 0.00 0.00 19.45 19.88 2q3u n ALA 317 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2q3u s ASN 318 N -1.12 5.93 0.00 0.00 -0.87 -1.26 -2.74 114.94 114.88 2q3u s ASN 318 Ca 0.00 -0.27 0.00 0.00 -1.57 0.00 0.00 52.86 51.03 2q3u s ASN 318 Cb 0.00 -2.55 0.00 0.00 -0.02 0.00 0.00 41.25 38.68 2q3u s ASN 318 CO 0.00 -1.98 0.00 0.61 -2.57 0.00 0.00 177.10 173.16 2q3u n GLY 319 N 5.50 0.78 3.19 0.66 0.00 -1.26 -4.74 105.19 109.32 2q3u n GLY 319 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 2q3u n GLY 319 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2q3u s GLY 320 N -1.93 0.82 -0.12 -0.02 0.00 -1.11 -2.16 107.32 102.80 2q3u s GLY 320 Ca 0.00 -1.30 0.00 0.00 0.00 0.00 0.00 44.72 43.42 2q3u s GLY 320 CO 0.00 -1.22 -0.12 -0.42 0.00 0.00 0.00 173.10 171.34 2q3u s ILE 321 N -4.02 1.33 -0.53 0.90 -1.09 -1.26 0.45 121.20 116.98 2q3u s ILE 321 Ca 0.21 -0.50 -0.13 0.00 -2.23 0.00 0.00 60.65 58.00 2q3u s ILE 321 Cb 0.06 -1.27 0.13 0.00 -1.58 0.00 0.00 42.46 39.80 2q3u s ILE 321 CO 0.01 0.42 0.45 -0.63 -1.23 0.00 0.00 174.94 173.95 2q3u s ILE 322 N 1.42 4.81 0.15 2.92 -1.09 -0.49 -1.32 121.20 127.61 2q3u s ILE 322 Ca 0.02 -1.68 0.07 0.00 -2.23 0.00 0.00 60.65 56.82 2q3u s ILE 322 Cb -0.13 -4.11 -0.04 0.00 -1.58 0.00 0.00 42.46 36.60 2q3u s ILE 322 CO -0.07 -0.84 -0.01 0.00 -1.23 0.00 0.00 174.94 172.79 2q3u s ALA 323 N 1.41 3.20 0.49 9.38 0.00 0.15 -1.06 121.76 135.33 2q3u s ALA 323 Ca 0.05 -1.29 -0.20 0.00 0.00 0.00 0.00 51.96 50.52 2q3u s ALA 323 Cb -0.27 -1.04 -0.08 0.00 0.00 0.00 0.00 23.12 21.73 2q3u s ALA 323 CO 0.01 0.55 1.04 -1.25 0.00 0.00 0.00 175.76 176.11 2q3u s PRO 324 N -2.71 3.80 -0.11 0.00 0.04 -1.26 -1.19 135.00 133.57 2q3u s PRO 324 Ca 0.26 1.34 0.03 0.00 0.04 0.00 0.00 61.00 62.68 2q3u s PRO 324 Cb -0.10 -2.10 0.01 0.00 0.04 0.00 0.00 34.50 32.35 2q3u s PRO 324 CO 0.18 -0.43 -0.20 -0.65 0.04 0.00 0.00 177.00 175.94 2q3u s GLN 325 N -3.27 2.68 0.00 4.56 -1.52 -0.67 -4.71 119.66 116.74 2q3u s GLN 325 Ca 0.67 -0.74 0.18 0.00 -1.95 0.00 0.00 55.36 53.51 2q3u s GLN 325 Cb -0.16 -2.12 0.09 0.00 -0.22 0.00 0.00 33.01 30.60 2q3u s GLN 325 CO 0.20 0.06 1.01 1.19 -0.25 0.00 0.00 175.29 177.51 2q3u n PHE 326 N 3.83 0.00 -1.62 0.91 3.01 -1.26 -2.68 117.46 119.65 2q3u n PHE 326 Ca -0.20 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.26 2q3u n PHE 326 Cb 0.52 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.99 2q3u n PHE 326 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2q3u n GLY 327 N 1.08 0.97 2.60 1.37 0.00 -1.26 -4.68 105.19 105.27 2q3u n GLY 327 Ca 0.09 -0.44 -0.28 0.00 0.00 0.00 0.00 46.02 45.40 2q3u n GLY 327 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2q3u s ASP 328 N -2.65 2.85 0.66 1.61 3.68 -1.26 -5.04 116.67 116.52 2q3u s ASP 328 Ca 0.00 -3.26 0.16 0.00 2.13 0.00 0.00 52.55 51.58 2q3u s ASP 328 Cb 0.00 -0.90 0.86 0.00 -1.45 0.00 0.00 42.92 41.43 2q3u s ASP 328 CO 0.00 -0.16 1.48 -0.65 0.13 0.00 0.00 175.17 175.97 2q3u h PRO 329 N 5.72 0.00 0.00 4.34 0.11 -1.98 0.06 132.00 140.25 2q3u h PRO 329 Ca 0.19 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.30 2q3u h PRO 329 Cb 0.86 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 2q3u h PRO 329 CO 0.50 0.00 -0.06 0.82 -0.21 0.00 0.00 178.00 179.05 2q3u h ILE 330 N 0.00 0.27 0.00 4.15 2.04 -2.00 -3.19 117.51 118.77 2q3u h ILE 330 Ca 0.01 -1.21 -0.03 0.00 1.00 0.00 0.00 64.86 64.64 2q3u h ILE 330 Cb 1.34 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 37.92 2q3u h ILE 330 CO -0.00 0.09 -0.12 0.03 0.00 0.00 0.00 178.15 178.15 2q3u h ARG 331 N -1.00 0.00 0.11 2.37 2.47 -1.73 -2.22 114.38 114.37 2q3u h ARG 331 Ca -0.01 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 2q3u h ARG 331 Cb 0.20 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.52 2q3u h ARG 331 CO -0.00 0.12 -0.05 -0.44 0.56 0.00 0.00 179.97 180.16 2q3u h ASP 332 N 0.00 -0.12 -0.76 7.04 3.32 -1.17 -0.93 116.42 123.79 2q3u h ASP 332 Ca -0.00 -0.40 -0.04 0.00 0.02 0.00 0.00 57.03 56.61 2q3u h ASP 332 Cb 0.76 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.31 2q3u h ASP 332 CO 0.02 0.37 0.32 0.50 -1.72 0.00 0.00 179.24 178.73 2q3u h LYS 333 N -0.66 1.13 -0.42 3.56 3.64 -1.54 -2.20 116.57 120.10 2q3u h LYS 333 Ca -0.01 -0.20 -0.06 0.00 -1.27 0.00 0.00 60.65 59.11 2q3u h LYS 333 Cb 0.51 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 2q3u h LYS 333 CO 0.02 0.92 0.01 1.49 -2.27 0.00 0.00 179.45 179.62 2q3u h GLU 334 N 1.10 0.67 -0.08 1.90 4.57 -1.34 -1.77 114.58 119.62 2q3u h GLU 334 Ca 0.26 -0.16 -0.20 0.00 -1.18 0.00 0.00 59.36 58.08 2q3u h GLU 334 Cb 0.19 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 2q3u h GLU 334 CO -0.02 0.68 -0.78 0.00 -1.18 0.00 0.00 179.01 177.70 2q3u h ALA 335 N 1.38 0.48 -0.31 2.92 0.00 -0.81 -0.22 119.26 122.71 2q3u h ALA 335 Ca 0.13 -0.62 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 2q3u h ALA 335 Cb 0.38 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2q3u h ALA 335 CO 0.01 0.75 -0.03 0.82 0.00 0.00 0.00 179.25 180.80 2q3u h ILE 336 N 0.34 1.20 -0.16 0.00 1.08 -0.96 -0.75 117.51 118.27 2q3u h ILE 336 Ca -0.05 -0.80 -0.04 0.00 -0.39 0.00 0.00 64.86 63.58 2q3u h ILE 336 Cb 1.38 1.00 -0.00 0.00 -3.07 0.00 0.00 36.82 36.13 2q3u h ILE 336 CO 0.14 0.27 -0.08 -0.09 -0.69 0.00 0.00 178.15 177.70 2q3u h ARG 337 N 0.46 0.33 -0.58 2.37 2.43 -0.94 -0.52 114.38 117.93 2q3u h ARG 337 Ca 0.10 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2q3u h ARG 337 Cb 0.35 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.86 2q3u h ARG 337 CO 0.01 0.65 0.36 0.28 -1.51 0.00 0.00 179.97 179.76 2q3u h VAL 338 N 0.00 1.16 0.00 0.20 2.07 -0.84 -1.89 116.25 116.95 2q3u h VAL 338 Ca 0.03 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2q3u h VAL 338 Cb 0.55 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 2q3u h VAL 338 CO 0.02 0.16 0.00 -0.07 0.02 0.00 0.00 177.57 177.71 2q3u h LEU 339 N 0.78 0.00 0.11 2.57 3.38 -1.08 -1.26 115.31 119.82 2q3u h LEU 339 Ca 0.21 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.89 2q3u h LEU 339 Cb -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2q3u h LEU 339 CO -0.04 0.00 -1.43 0.28 0.09 0.00 0.00 178.44 177.34 2q3u h SER 340 N 0.00 0.37 -0.45 -0.43 0.02 -0.35 -2.92 113.55 109.80 2q3u h SER 340 Ca 0.00 -0.48 -0.13 0.00 -0.84 0.00 0.00 61.79 60.35 2q3u h SER 340 Cb 0.67 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 2q3u h SER 340 CO 0.00 1.39 -0.22 -0.78 -1.14 0.00 0.00 176.83 176.08 2q3u h ASP 341 N 0.07 0.97 0.62 3.07 1.82 -1.21 -2.69 116.42 119.06 2q3u h ASP 341 Ca -0.20 -0.40 -0.07 0.00 -0.39 0.00 0.00 57.03 55.97 2q3u h ASP 341 Cb 1.99 -0.27 -0.01 0.00 0.68 0.00 0.00 39.33 41.73 2q3u h ASP 341 CO 0.17 1.16 -0.31 0.74 -1.61 0.00 0.00 179.24 179.38 2q3u h THR 342 N 0.78 0.90 -2.11 2.25 2.02 -1.31 -3.22 112.91 112.23 2q3u h THR 342 Ca 0.10 -1.23 -0.53 0.00 0.77 0.00 0.00 66.41 65.52 2q3u h THR 342 Cb 0.79 1.73 -0.41 0.00 -1.74 0.00 0.00 68.15 68.53 2q3u h THR 342 CO 0.07 0.31 -0.97 0.49 0.37 0.00 0.00 175.52 175.78 2q3u n PHE 343 N -3.69 1.61 0.07 3.16 3.01 -1.10 -4.95 117.46 115.56 2q3u n PHE 343 Ca -0.01 -3.87 0.01 0.00 1.01 0.00 0.00 57.45 54.58 2q3u n PHE 343 Cb 0.42 -0.44 0.04 0.00 -0.01 0.00 0.00 39.48 39.48 2q3u n PHE 343 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2q3u n PRO 344 N 0.27 0.03 0.02 -1.08 -0.04 -1.02 -1.67 135.00 131.50 2q3u n PRO 344 Ca 0.27 0.20 0.10 0.00 -0.04 0.00 0.00 63.50 64.03 2q3u n PRO 344 Cb 0.54 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.38 2q3u n PRO 344 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2q3u n HIS 345 N -1.21 0.29 -3.27 0.54 8.25 -1.26 -4.98 115.22 113.58 2q3u n HIS 345 Ca 0.01 0.08 -0.18 0.00 -0.26 0.00 0.00 57.72 57.37 2q3u n HIS 345 Cb 0.01 -0.66 0.00 0.00 1.12 0.00 0.00 29.99 30.46 2q3u n HIS 345 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2q3u s HIS 346 N -3.42 3.00 -0.86 4.41 3.76 -0.67 -4.89 115.29 116.62 2q3u s HIS 346 Ca -0.06 -0.27 -0.11 0.00 -0.15 0.00 0.00 55.06 54.47 2q3u s HIS 346 Cb 0.12 -2.16 0.22 0.00 1.11 0.00 0.00 32.58 31.88 2q3u s HIS 346 CO 0.87 -0.19 0.79 0.45 -0.85 0.00 0.00 174.74 175.81 2q3u s SER 347 N -4.25 6.62 0.26 1.40 0.15 -0.92 -4.91 113.70 112.06 2q3u s SER 347 Ca 0.49 -2.95 -0.29 0.00 0.70 0.00 0.00 55.95 53.90 2q3u s SER 347 Cb -0.10 -2.15 -0.14 0.00 -1.71 0.00 0.00 66.02 61.92 2q3u s SER 347 CO 0.32 -0.47 1.09 0.52 1.20 0.00 0.00 173.24 175.90 2q3u n VAL 348 N 3.57 1.64 -4.06 4.45 0.31 -1.26 -4.22 118.33 118.76 2q3u n VAL 348 Ca 0.15 -0.41 -0.12 0.00 -0.01 0.00 0.00 64.34 63.95 2q3u n VAL 348 Cb 0.44 -1.02 -0.11 0.00 -0.91 0.00 0.00 33.84 32.23 2q3u n VAL 348 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2q3u s VAL 349 N -0.76 0.49 0.09 2.52 1.01 -0.43 -4.95 120.40 118.36 2q3u s VAL 349 Ca 0.63 -1.16 0.06 0.00 0.00 0.00 0.00 61.98 61.51 2q3u s VAL 349 Cb -0.73 -0.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 2q3u s VAL 349 CO 0.57 -0.46 -0.09 -0.83 0.00 0.00 0.00 175.10 174.29 2q3u s GLY 350 N -1.74 1.79 -0.40 4.51 0.00 -1.26 -0.67 107.32 109.55 2q3u s GLY 350 Ca -0.08 -1.20 -0.05 0.00 0.00 0.00 0.00 44.72 43.38 2q3u s GLY 350 CO -0.01 -1.16 0.20 -0.42 0.00 0.00 0.00 173.10 171.71 2q3u s ILE 351 N -1.18 3.65 0.60 0.90 -1.09 -0.33 -4.94 121.20 118.81 2q3u s ILE 351 Ca 0.21 -1.66 -0.19 0.00 -2.23 0.00 0.00 60.65 56.78 2q3u s ILE 351 Cb -0.11 -3.32 -0.03 0.00 -1.58 0.00 0.00 42.46 37.42 2q3u s ILE 351 CO 0.13 -0.52 1.21 -1.61 -1.23 0.00 0.00 174.94 172.92 2q3u s GLU 352 N 1.28 2.92 -0.22 2.79 0.41 -1.26 -1.67 118.70 122.95 2q3u s GLU 352 Ca 0.04 1.83 0.00 0.00 -0.41 0.00 0.00 54.97 56.42 2q3u s GLU 352 Cb -0.22 -1.92 0.00 0.00 -1.78 0.00 0.00 34.13 30.20 2q3u s GLU 352 CO -0.01 -1.25 0.00 0.09 -0.49 0.00 0.00 175.26 173.60 2q3u n ASN 353 N -1.66 -3.76 0.14 -0.19 5.03 -1.23 -4.89 115.26 108.70 2q3u n ASN 353 Ca 0.14 0.05 0.19 0.00 0.87 0.00 0.00 54.58 55.83 2q3u n ASN 353 Cb 0.50 -1.44 0.78 0.00 -1.02 0.00 0.00 39.78 38.59 2q3u n ASN 353 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2q3u h ALA 354 N 0.00 1.97 -1.02 5.41 0.00 -1.53 0.28 119.26 124.37 2q3u h ALA 354 Ca -0.04 -0.01 0.25 0.00 0.00 0.00 0.00 54.91 55.10 2q3u h ALA 354 Cb 0.31 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.03 2q3u h ALA 354 CO 0.06 -0.50 0.65 -0.09 0.00 0.00 0.00 179.25 179.37 2q3u h ARG 355 N 0.00 0.44 -0.12 0.00 2.43 -1.84 0.37 114.38 115.65 2q3u h ARG 355 Ca 0.15 -0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.33 2q3u h ARG 355 Cb 0.83 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.28 2q3u h ARG 355 CO -0.00 0.29 0.10 0.93 -1.51 0.00 0.00 179.97 179.78 2q3u h GLU 356 N 0.45 0.00 0.03 0.20 4.39 -0.83 -0.04 114.58 118.78 2q3u h GLU 356 Ca 0.58 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 60.17 2q3u h GLU 356 Cb 1.37 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.03 2q3u h GLU 356 CO -0.30 0.00 -0.43 0.82 -1.16 0.00 0.00 179.01 177.94 2q3u h ILE 357 N 0.00 1.54 -0.51 3.13 2.04 -0.45 -3.32 117.51 119.95 2q3u h ILE 357 Ca 0.06 -2.14 -0.04 0.00 1.00 0.00 0.00 64.86 63.74 2q3u h ILE 357 Cb 0.26 2.88 -0.02 0.00 -0.74 0.00 0.00 36.82 39.20 2q3u h ILE 357 CO -0.00 0.60 0.16 0.58 0.00 0.00 0.00 178.15 179.48 2q3u h VAL 358 N -0.43 1.20 -1.05 1.67 2.07 -0.76 -0.79 116.25 118.17 2q3u h VAL 358 Ca -0.06 -0.69 0.28 0.00 0.82 0.00 0.00 66.70 67.04 2q3u h VAL 358 Cb 1.21 0.65 -0.08 0.00 -1.52 0.00 0.00 31.29 31.55 2q3u h VAL 358 CO 0.08 0.26 0.69 -0.07 0.02 0.00 0.00 177.57 178.56 2q3u h LEU 359 N 0.74 0.36 -2.01 2.57 3.38 -1.11 0.80 115.31 120.03 2q3u h LEU 359 Ca 0.17 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2q3u h LEU 359 Cb 0.22 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2q3u h LEU 359 CO -0.01 0.07 0.00 0.00 0.09 0.00 0.00 178.44 178.59 2q3u n ALA 360 N -2.53 2.44 -0.41 1.53 0.00 -0.32 -5.00 120.51 116.21 2q3u n ALA 360 Ca 0.25 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.78 2q3u n ALA 360 Cb 0.93 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 19.43 2q3u n ALA 360 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q3u n GLY 361 N 1.40 -0.65 0.00 0.00 0.00 0.28 -5.01 105.19 101.21 2q3u n GLY 361 Ca 0.19 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.63 2q3u n GLY 361 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q3u n GLY 362 N -0.03 0.81 0.00 -0.02 0.00 -1.25 -4.91 105.19 99.79 2q3u n GLY 362 Ca 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.96 2q3u n GLY 362 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2q3u n ASN 363 N 1.96 0.00 0.08 1.61 2.85 -1.26 -1.68 115.26 118.82 2q3u n ASN 363 Ca 0.00 -0.32 -0.02 0.00 -0.11 0.00 0.00 54.58 54.13 2q3u n ASN 363 Cb 0.00 0.00 0.22 0.00 1.24 0.00 0.00 39.78 41.24 2q3u n ASN 363 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 2q3u h ILE 364 N 0.32 1.30 -0.39 -1.44 2.04 -1.92 -2.60 117.51 114.81 2q3u h ILE 364 Ca 0.00 -1.46 -0.07 0.00 1.00 0.00 0.00 64.86 64.33 2q3u h ILE 364 Cb 0.00 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 2q3u h ILE 364 CO 0.00 0.44 -0.03 -0.74 0.00 0.00 0.00 178.15 177.82 2q3u h HIS 365 N 0.24 0.78 0.00 1.37 2.76 -1.70 -3.06 115.15 115.54 2q3u h HIS 365 Ca 0.02 -0.15 0.00 0.00 -2.20 0.00 0.00 60.37 58.05 2q3u h HIS 365 Cb 0.79 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 29.55 2q3u h HIS 365 CO 0.02 0.81 0.00 0.00 -1.30 0.00 0.00 177.93 177.46 2q3u h ILE 367 N 0.00 0.00 -2.52 0.00 3.07 -1.35 -2.51 117.51 114.19 2q3u h ILE 367 Ca 0.00 -0.51 -0.51 0.00 1.55 0.00 0.00 64.86 65.38 2q3u h ILE 367 Cb 0.21 1.41 -0.14 0.00 -0.27 0.00 0.00 36.82 38.03 2q3u h ILE 367 CO 0.00 0.00 -0.64 0.42 -1.05 0.00 0.00 178.15 176.88 2q3u s THR 368 N -3.12 1.55 -0.02 0.16 -4.23 -1.26 -3.45 115.64 105.27 2q3u s THR 368 Ca 0.09 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 58.55 2q3u s THR 368 Cb 0.12 -2.69 0.03 0.00 1.34 0.00 0.00 72.50 71.30 2q3u s THR 368 CO 0.63 -0.13 0.02 -1.58 -0.54 0.00 0.00 174.62 173.02 2q3u s GLN 369 N -3.78 0.11 -0.10 3.99 2.00 0.94 -3.16 119.66 119.65 2q3u s GLN 369 Ca 0.33 0.13 -0.25 0.00 -2.00 0.00 0.00 55.36 53.57 2q3u s GLN 369 Cb 0.07 -0.33 -0.03 0.00 0.80 0.00 0.00 33.01 33.52 2q3u s GLN 369 CO 0.15 -0.14 0.78 1.14 -0.50 0.00 0.00 175.29 176.72 2q3u s GLN 370 N 0.98 4.40 -0.41 1.67 0.00 -1.26 -1.40 119.66 123.64 2q3u s GLN 370 Ca -0.09 1.00 -0.17 0.00 -0.00 0.00 0.00 55.36 56.10 2q3u s GLN 370 Cb -0.12 -3.50 0.02 0.00 0.00 0.00 0.00 33.01 29.40 2q3u s GLN 370 CO -0.02 -0.10 0.43 -1.14 0.00 0.00 0.00 175.29 174.45 2q3u s GLN 371 N 1.35 3.16 0.57 9.60 0.74 -0.55 -4.65 119.66 129.88 2q3u s GLN 371 Ca 0.40 -0.71 -0.19 0.00 0.05 0.00 0.00 55.36 54.90 2q3u s GLN 371 Cb -0.18 -3.95 -0.04 0.00 1.10 0.00 0.00 33.01 29.94 2q3u s GLN 371 CO 0.17 -0.81 1.20 -2.14 -0.55 0.00 0.00 175.29 173.16 2q3u s PRO 372 N 2.13 3.12 0.51 1.67 0.02 -1.26 -0.46 135.00 140.73 2q3u s PRO 372 Ca 0.12 1.81 -0.23 0.00 0.02 0.00 0.00 61.00 62.72 2q3u s PRO 372 Cb -0.17 -2.00 -0.06 0.00 0.02 0.00 0.00 34.50 32.28 2q3u s PRO 372 CO 0.13 -1.08 1.36 0.00 -0.33 0.00 0.00 177.00 177.08 2q3u n ALA 373 N -1.40 1.65 -2.29 -1.55 0.00 0.34 -4.28 120.51 112.98 2q3u n ALA 373 Ca 0.13 0.17 -0.42 0.00 0.00 0.00 0.00 53.44 53.32 2q3u n ALA 373 Cb 0.49 -2.35 -0.03 0.00 0.00 0.00 0.00 19.45 17.56 2q3u n ALA 373 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2q3u s GLU 374 N -2.71 4.48 0.53 0.00 2.12 -1.26 -4.94 118.70 116.92 2q3u s GLU 374 Ca 0.68 1.77 -0.20 0.00 0.36 0.00 0.00 54.97 57.58 2q3u s GLU 374 Cb -0.43 -3.31 -0.06 0.00 0.26 0.00 0.00 34.13 30.59 2q3u s GLU 374 CO 0.52 -0.16 1.18 -2.14 -0.54 0.00 0.00 175.26 174.12 2q3u s PRO 375 N 0.54 3.34 0.00 4.30 0.02 -1.26 -5.05 135.00 136.89 2q3u s PRO 375 Ca 0.56 1.77 0.27 0.00 0.02 0.00 0.00 61.00 63.62 2q3u s PRO 375 Cb -0.30 -2.12 0.86 0.00 0.02 0.00 0.00 34.50 32.96 2q3u s PRO 375 CO 0.32 -0.90 1.64 -2.37 -0.33 0.00 0.00 177.00 175.35