#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 1.67 0.57 -0.14 2.02 -1.26 -5.13 118.70 116.42 2q3u s GLU 6 Ca 0.00 -1.22 -0.09 0.00 0.02 0.00 0.00 54.97 53.68 2q3u s GLU 6 Cb 0.00 -2.03 -0.04 0.00 0.10 0.00 0.00 34.13 32.16 2q3u s GLU 6 CO 0.00 0.48 0.94 -1.54 0.02 0.00 0.00 175.26 175.15 2q3u s SER 7 N -1.96 6.25 0.26 -0.19 1.04 -1.26 -4.97 113.70 112.88 2q3u s SER 7 Ca 0.15 1.24 -0.03 0.00 0.48 0.00 0.00 55.95 57.80 2q3u s SER 7 Cb -0.10 -2.39 0.40 0.00 0.10 0.00 0.00 66.02 64.03 2q3u s SER 7 CO 0.07 -0.75 1.88 -0.65 0.98 0.00 0.00 173.24 174.77 2q3u h PRO 8 N -0.09 1.13 -0.87 4.02 0.11 -1.86 -1.30 132.00 133.15 2q3u h PRO 8 Ca -0.45 -0.07 0.10 0.00 0.11 0.00 0.00 66.00 65.69 2q3u h PRO 8 Cb 1.20 -0.25 -0.06 0.00 0.11 0.00 0.00 31.00 31.99 2q3u h PRO 8 CO 0.62 0.75 0.56 0.00 -0.21 0.00 0.00 178.00 179.72 2q3u h ALA 9 N 1.45 1.67 0.00 -0.75 0.00 -0.80 0.37 119.26 121.21 2q3u h ALA 9 Ca 0.43 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.30 2q3u h ALA 9 Cb 0.17 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2q3u h ALA 9 CO -0.17 0.16 -0.17 0.93 0.00 0.00 0.00 179.25 180.00 2q3u h GLU 10 N 0.85 0.00 -0.21 0.00 5.08 -1.51 -2.03 114.58 116.75 2q3u h GLU 10 Ca 0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 2q3u h GLU 10 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2q3u h GLU 10 CO -0.17 0.17 0.00 0.72 -1.00 0.00 0.00 179.01 178.73 2q3u n HIS 11 N -3.96 0.26 -0.39 4.33 8.25 0.02 -4.96 115.22 118.76 2q3u n HIS 11 Ca -0.02 -0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 2q3u n HIS 11 Cb 0.25 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.36 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 1.37 0.72 3.87 -1.41 0.00 -0.58 -4.88 105.19 104.29 2q3u n GLY 12 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.63 3.49 0.00 1.61 2.02 -0.62 -4.28 117.35 116.94 2q3u s TYR 13 Ca 0.00 1.09 0.00 0.00 -0.37 0.00 0.00 57.07 57.79 2q3u s TYR 13 Cb 0.00 -2.49 0.00 0.00 -0.40 0.00 0.00 41.96 39.07 2q3u s TYR 13 CO 0.00 -0.20 0.00 2.48 -1.57 0.00 0.00 175.55 176.26 2q3u n TYR 14 N -1.56 0.00 -3.83 2.71 0.18 0.13 -4.27 117.16 110.51 2q3u n TYR 14 Ca 0.03 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.71 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 2.41 0.80 0.56 -3.48 0.04 -1.26 -0.09 135.00 133.98 2q3u s PRO 16 Ca 0.00 -0.79 -0.19 0.00 0.04 0.00 0.00 61.00 60.06 2q3u s PRO 16 Cb 0.00 0.33 -0.05 0.00 0.04 0.00 0.00 34.50 34.82 2q3u s PRO 16 CO 0.00 -0.25 1.14 0.00 0.04 0.00 0.00 177.00 177.93 2q3u s ALA 17 N -3.31 2.66 0.56 8.56 0.00 -1.26 -4.81 121.76 124.17 2q3u s ALA 17 Ca 0.01 0.84 0.27 0.00 0.00 0.00 0.00 51.96 53.07 2q3u s ALA 17 Cb 0.02 -3.37 1.49 0.00 0.00 0.00 0.00 23.12 21.26 2q3u s ALA 17 CO -0.08 -0.85 2.01 1.49 0.00 0.00 0.00 175.76 178.33 2q3u h GLU 18 N 1.10 0.00 0.00 0.00 4.81 -1.96 0.11 114.58 118.64 2q3u h GLU 18 Ca -0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 2q3u h GLU 18 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 2q3u h GLU 18 CO 0.56 0.00 0.00 -2.67 -0.73 0.00 0.00 179.01 176.17 2q3u n TRP 19 N -4.06 0.00 -1.12 0.92 2.14 -1.26 -4.77 117.44 109.30 2q3u n TRP 19 Ca 0.07 0.00 -0.29 0.00 2.07 0.00 0.00 57.50 59.35 2q3u n TRP 19 Cb 0.52 -0.27 0.20 0.00 -0.81 0.00 0.00 31.31 30.95 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 -2.55 2.09 0.09 -0.67 1.11 0.02 -4.91 116.67 111.86 2q3u s ASP 20 Ca 0.22 1.06 -0.31 0.00 0.18 0.00 0.00 52.55 53.70 2q3u s ASP 20 Cb 0.15 -1.64 -0.07 0.00 1.07 0.00 0.00 42.92 42.43 2q3u s ASP 20 CO 0.34 -3.45 1.34 -0.55 1.18 0.00 0.00 175.17 174.03 2q3u s SER 21 N -3.51 6.90 0.27 0.27 0.15 -1.26 -4.85 113.70 111.67 2q3u s SER 21 Ca 0.67 2.22 0.03 0.00 0.70 0.00 0.00 55.95 59.57 2q3u s SER 21 Cb -0.17 -2.58 -0.03 0.00 -1.71 0.00 0.00 66.02 61.52 2q3u s SER 21 CO 0.58 -0.61 0.43 -1.00 1.20 0.00 0.00 173.24 173.84 2q3u s HIS 22 N 1.19 3.47 -0.18 3.44 3.76 -1.26 -0.04 115.29 125.67 2q3u s HIS 22 Ca 0.63 0.15 0.07 0.00 -0.15 0.00 0.00 55.06 55.75 2q3u s HIS 22 Cb -0.34 -1.71 -0.22 0.00 1.11 0.00 0.00 32.58 31.41 2q3u s HIS 22 CO 0.30 0.32 0.12 0.00 -0.85 0.00 0.00 174.74 174.63 2q3u n ALA 23 N -1.44 1.35 -3.72 -1.40 0.00 -0.60 -4.50 120.51 110.20 2q3u n ALA 23 Ca -0.07 -1.01 0.01 0.00 0.00 0.00 0.00 53.44 52.36 2q3u n ALA 23 Cb 0.56 -0.36 -0.00 0.00 0.00 0.00 0.00 19.45 19.65 2q3u n ALA 23 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2q3u s GLN 24 N -2.53 0.60 0.01 0.00 -2.07 -1.18 -4.29 119.66 110.20 2q3u s GLN 24 Ca -0.20 -0.35 0.05 0.00 -1.82 0.00 0.00 55.36 53.04 2q3u s GLN 24 Cb 0.07 0.19 -0.02 0.00 -1.09 0.00 0.00 33.01 32.17 2q3u s GLN 24 CO 0.74 -0.28 -0.17 0.99 -1.32 0.00 0.00 175.29 175.25 2q3u s THR 25 N -2.48 1.32 -0.12 3.63 2.01 -0.10 -1.75 115.64 118.16 2q3u s THR 25 Ca 0.17 -0.86 -0.02 0.00 0.31 0.00 0.00 61.69 61.29 2q3u s THR 25 Cb 0.02 -1.13 -0.03 0.00 0.01 0.00 0.00 72.50 71.37 2q3u s THR 25 CO -0.02 0.25 -0.06 0.26 -0.69 0.00 0.00 174.62 174.37 2q3u s TRP 26 N -0.57 2.97 -0.01 4.92 0.52 -0.46 -1.19 118.94 125.13 2q3u s TRP 26 Ca 0.06 -0.21 0.01 0.00 0.02 0.00 0.00 56.10 55.97 2q3u s TRP 26 Cb -0.07 -1.85 0.01 0.00 -1.15 0.00 0.00 33.47 30.41 2q3u s TRP 26 CO 0.00 0.09 -0.02 0.42 0.02 0.00 0.00 176.95 177.46 2q3u s ILE 27 N -0.10 0.24 0.72 2.03 1.01 -0.48 -2.15 121.20 122.47 2q3u s ILE 27 Ca 0.01 -0.05 -0.11 0.00 0.00 0.00 0.00 60.65 60.50 2q3u s ILE 27 Cb -0.13 -0.25 0.02 0.00 0.01 0.00 0.00 42.46 42.11 2q3u s ILE 27 CO 0.03 0.11 1.09 -0.83 0.00 0.00 0.00 174.94 175.33 2q3u s GLY 28 N 0.38 1.63 -0.15 6.18 0.00 -1.26 -1.38 107.32 112.72 2q3u s GLY 28 Ca -0.04 -0.23 0.02 0.00 0.00 0.00 0.00 44.72 44.47 2q3u s GLY 28 CO -0.01 0.14 -0.19 0.86 0.00 0.00 0.00 173.10 173.90 2q3u s TRP 29 N -3.24 2.54 0.55 1.90 -0.11 -0.55 -4.80 118.94 115.23 2q3u s TRP 29 Ca 0.59 -1.38 -0.18 0.00 1.22 0.00 0.00 56.10 56.34 2q3u s TRP 29 Cb -0.12 -1.77 -0.06 0.00 -1.50 0.00 0.00 33.47 30.02 2q3u s TRP 29 CO 0.53 -0.67 1.08 -1.25 -4.62 0.00 0.00 176.95 172.02 2q3u s PRO 30 N 1.10 3.43 0.00 5.86 0.04 -1.26 -4.64 135.00 139.53 2q3u s PRO 30 Ca -0.01 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.45 2q3u s PRO 30 Cb -0.14 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2q3u s PRO 30 CO -0.07 -0.75 0.00 -1.91 0.04 0.00 0.00 177.00 174.31 2q3u n GLU 31 N -1.46 0.00 -1.89 4.56 2.13 -1.26 -4.71 120.64 118.00 2q3u n GLU 31 Ca 0.10 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.50 2q3u n GLU 31 Cb 0.52 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.20 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 -0.89 4.19 0.05 5.31 1.70 -1.26 -4.46 118.95 123.59 2q3u s ARG 32 Ca 0.00 2.40 0.27 0.00 -0.47 0.00 0.00 55.73 57.93 2q3u s ARG 32 Cb 0.00 -3.36 1.09 0.00 -0.57 0.00 0.00 34.95 32.11 2q3u s ARG 32 CO 0.00 -0.69 1.85 1.04 -1.08 0.00 0.00 175.30 176.42 2q3u n GLN 33 N 4.76 0.06 -0.07 3.89 6.02 -1.26 -2.22 117.38 128.56 2q3u n GLN 33 Ca 0.15 0.08 0.01 0.00 -0.01 0.00 0.00 57.00 57.23 2q3u n GLN 33 Cb 0.39 -1.58 0.04 0.00 1.02 0.00 0.00 30.24 30.11 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 -1.69 0.86 0.00 1.08 5.75 -1.26 -2.88 116.55 118.42 2q3u n ASP 34 Ca 0.06 -2.04 0.00 0.00 -0.01 0.00 0.00 54.79 52.80 2q3u n ASP 34 Cb 0.34 -0.22 0.00 0.00 -1.03 0.00 0.00 41.12 40.21 2q3u n ASP 34 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2q3u n ASN 35 N -0.13 0.31 -4.47 -1.12 4.05 -0.96 -4.57 115.26 108.37 2q3u n ASN 35 Ca 0.03 0.00 -0.33 0.00 0.45 0.00 0.00 54.58 54.73 2q3u n ASN 35 Cb 0.18 0.02 -0.13 0.00 1.23 0.00 0.00 39.78 41.07 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 -1.07 2.82 0.66 1.20 0.52 -0.94 -4.80 118.94 117.32 2q3u s TRP 36 Ca 0.00 -0.28 -0.16 0.00 0.02 0.00 0.00 56.10 55.68 2q3u s TRP 36 Cb 0.00 -1.75 0.00 0.00 -1.15 0.00 0.00 33.47 30.57 2q3u s TRP 36 CO 0.00 0.07 1.13 -0.98 0.02 0.00 0.00 176.95 177.20 2q3u s ARG 37 N -0.30 2.73 -1.25 4.98 1.70 -1.26 -2.24 118.95 123.31 2q3u s ARG 37 Ca 0.03 1.50 -0.01 0.00 -0.47 0.00 0.00 55.73 56.77 2q3u s ARG 37 Cb -0.13 -1.93 -0.00 0.00 -0.57 0.00 0.00 34.95 32.32 2q3u s ARG 37 CO 0.03 -1.32 0.82 0.72 -1.08 0.00 0.00 175.30 174.46 2q3u n HIS 38 N -2.34 -2.04 -3.14 5.89 8.25 -0.33 -2.07 115.22 119.45 2q3u n HIS 38 Ca 0.11 0.86 -0.22 0.00 -0.26 0.00 0.00 57.72 58.21 2q3u n HIS 38 Cb 0.51 -4.58 0.02 0.00 1.12 0.00 0.00 29.99 27.06 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 -3.08 -5.07 0.00 0.41 5.03 -1.24 -1.24 115.26 110.07 2q3u n ASN 39 Ca -0.28 -0.31 0.00 0.00 0.87 0.00 0.00 54.58 54.87 2q3u n ASN 39 Cb 0.67 -4.14 0.00 0.00 -1.02 0.00 0.00 39.78 35.29 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 -3.49 0.00 -0.19 5.41 0.00 -0.88 -4.88 120.51 116.49 2q3u n ALA 40 Ca -0.08 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.28 2q3u n ALA 40 Cb 0.59 -0.94 0.01 0.00 0.00 0.00 0.00 19.45 19.12 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 0.84 -0.35 0.00 4.07 -1.24 0.45 115.31 119.07 2q3u h LEU 41 Ca 0.00 -0.25 0.01 0.00 0.08 0.00 0.00 57.88 57.72 2q3u h LEU 41 Cb 0.50 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 42.00 2q3u h LEU 41 CO 0.00 0.87 0.23 -0.65 -1.08 0.00 0.00 178.44 177.81 2q3u h PRO 42 N 0.77 0.45 -0.25 1.13 0.11 -1.78 0.15 132.00 132.58 2q3u h PRO 42 Ca 0.17 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 66.29 2q3u h PRO 42 Cb 0.37 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 31.34 2q3u h PRO 42 CO 0.01 0.30 0.00 0.00 -0.21 0.00 0.00 178.00 178.10 2q3u h ALA 43 N 1.14 0.22 -0.43 -0.75 0.00 -1.72 -2.07 119.26 115.65 2q3u h ALA 43 Ca 0.13 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2q3u h ALA 43 Cb -0.04 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2q3u h ALA 43 CO -0.04 -0.42 0.20 1.96 0.00 0.00 0.00 179.25 180.95 2q3u h GLN 44 N 0.08 0.59 -0.06 0.00 4.20 0.30 -1.15 115.11 119.07 2q3u h GLN 44 Ca 0.12 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2q3u h GLN 44 Cb 0.15 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.81 2q3u h GLN 44 CO -0.20 0.47 0.04 0.00 -0.67 0.00 0.00 178.83 178.47 2q3u h ARG 45 N 0.59 0.08 -0.19 1.46 3.08 -0.26 0.15 114.38 119.29 2q3u h ARG 45 Ca 0.15 -0.01 -0.11 0.00 0.07 0.00 0.00 59.98 60.09 2q3u h ARG 45 Cb 0.08 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 2q3u h ARG 45 CO -0.02 0.07 -0.34 0.28 -1.07 0.00 0.00 179.97 178.89 2q3u h VAL 46 N 0.07 1.29 -0.81 2.04 2.07 -1.30 -1.14 116.25 118.47 2q3u h VAL 46 Ca 0.02 -1.41 0.03 0.00 0.82 0.00 0.00 66.70 66.16 2q3u h VAL 46 Cb 0.01 1.51 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 2q3u h VAL 46 CO -0.00 0.44 0.52 -0.26 0.02 0.00 0.00 177.57 178.28 2q3u h PHE 47 N 0.35 0.98 -0.21 1.57 -1.00 -0.77 0.43 116.94 118.28 2q3u h PHE 47 Ca 0.04 0.03 -0.14 0.00 2.81 0.00 0.00 57.97 60.70 2q3u h PHE 47 Cb 0.77 -0.32 -0.01 0.00 3.61 0.00 0.00 35.95 39.99 2q3u h PHE 47 CO 0.02 0.57 -0.46 0.00 -1.61 0.00 0.00 178.31 176.83 2q3u h ALA 48 N 1.33 0.80 -0.50 2.45 0.00 -0.65 0.29 119.26 122.98 2q3u h ALA 48 Ca 0.32 -0.47 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2q3u h ALA 48 Cb -0.02 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2q3u h ALA 48 CO -0.10 0.66 0.01 0.78 0.00 0.00 0.00 179.25 180.60 2q3u h GLY 49 N 1.07 0.90 0.80 0.00 0.00 0.05 0.44 103.07 106.34 2q3u h GLY 49 Ca 0.03 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 46.74 2q3u h GLY 49 CO 0.09 0.56 0.02 -2.08 0.00 0.00 0.00 176.54 175.13 2q3u h VAL 50 N 0.78 1.22 -0.68 4.60 2.07 -0.05 0.12 116.25 124.31 2q3u h VAL 50 Ca 0.15 -0.68 0.02 0.00 0.82 0.00 0.00 66.70 67.01 2q3u h VAL 50 Cb 0.46 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.62 2q3u h VAL 50 CO 0.02 0.20 0.44 0.00 0.02 0.00 0.00 177.57 178.25 2q3u h ALA 51 N 0.80 0.87 -0.61 1.67 0.00 -0.55 -0.29 119.26 121.16 2q3u h ALA 51 Ca 0.04 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2q3u h ALA 51 Cb 0.29 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2q3u h ALA 51 CO 0.00 0.25 -0.00 0.87 0.00 0.00 0.00 179.25 180.37 2q3u h LYS 52 N 0.88 1.08 -0.47 0.00 1.57 0.02 0.12 116.57 119.78 2q3u h LYS 52 Ca 0.26 -0.34 0.03 0.00 -1.87 0.00 0.00 60.65 58.73 2q3u h LYS 52 Cb -0.06 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.12 2q3u h LYS 52 CO -0.08 1.05 0.25 0.00 -0.57 0.00 0.00 179.45 180.10 2q3u h ALA 53 N 1.00 0.59 -0.23 3.86 0.00 -0.32 -2.35 119.26 121.81 2q3u h ALA 53 Ca 0.17 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2q3u h ALA 53 Cb 0.57 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2q3u h ALA 53 CO 0.03 -0.09 -0.27 0.82 0.00 0.00 0.00 179.25 179.75 2q3u h ILE 54 N 0.50 1.27 0.00 0.00 2.04 -0.77 -2.96 117.51 117.58 2q3u h ILE 54 Ca 0.20 -1.28 0.00 0.00 1.00 0.00 0.00 64.86 64.77 2q3u h ILE 54 Cb 0.08 1.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.54 2q3u h ILE 54 CO -0.12 0.40 0.00 0.77 0.00 0.00 0.00 178.15 179.20 2q3u h SER 55 N 0.39 0.00 0.47 1.72 4.64 -0.43 0.11 113.55 120.46 2q3u h SER 55 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2q3u h SER 55 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 2q3u h SER 55 CO 0.05 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.30 2q3u n LYS 56 N -2.47 0.33 -0.00 4.77 4.76 -1.12 -3.60 118.16 120.83 2q3u n LYS 56 Ca 0.00 0.06 -0.00 0.00 -2.87 0.00 0.00 58.31 55.50 2q3u n LYS 56 Cb 0.16 -1.50 -0.01 0.00 -1.84 0.00 0.00 35.03 31.84 2q3u n LYS 56 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2q3u n PHE 57 N -1.29 0.00 -3.64 2.13 3.72 0.27 -5.10 117.46 113.54 2q3u n PHE 57 Ca 0.11 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.48 2q3u n PHE 57 Cb 0.20 -0.04 -0.01 0.00 -0.94 0.00 0.00 39.48 38.69 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 -2.04 0.75 0.32 -1.08 -1.05 -0.47 -4.47 118.70 110.66 2q3u s GLU 58 Ca -0.00 -0.37 -0.29 0.00 -0.15 0.00 0.00 54.97 54.15 2q3u s GLU 58 Cb 0.00 0.28 -0.11 0.00 -0.44 0.00 0.00 34.13 33.86 2q3u s GLU 58 CO 0.04 -0.34 1.53 -2.14 0.95 0.00 0.00 175.26 175.29 2q3u s PRO 59 N -2.87 4.15 -0.04 -4.83 0.02 -1.26 -3.99 135.00 126.18 2q3u s PRO 59 Ca 0.11 2.52 0.05 0.00 0.02 0.00 0.00 61.00 63.71 2q3u s PRO 59 Cb 0.01 -3.02 -0.01 0.00 0.02 0.00 0.00 34.50 31.50 2q3u s PRO 59 CO -0.03 -0.55 -0.20 0.08 -0.33 0.00 0.00 177.00 175.97 2q3u s VAL 60 N -0.43 1.65 -0.10 3.83 1.01 -1.26 -0.93 120.40 124.17 2q3u s VAL 60 Ca 0.59 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.74 2q3u s VAL 60 Cb -0.46 -1.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.51 2q3u s VAL 60 CO 0.53 0.47 -0.19 -0.89 0.00 0.00 0.00 175.10 175.01 2q3u s THR 61 N -0.17 2.53 -0.10 3.92 2.01 -0.33 -0.90 115.64 122.61 2q3u s THR 61 Ca -0.00 -0.86 -0.02 0.00 0.31 0.00 0.00 61.69 61.12 2q3u s THR 61 Cb -0.11 -2.00 -0.03 0.00 0.01 0.00 0.00 72.50 70.36 2q3u s THR 61 CO 0.02 0.55 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.79 2q3u s VAL 62 N 0.16 4.11 -0.13 3.82 1.01 0.30 -1.38 120.40 128.28 2q3u s VAL 62 Ca -0.11 -0.31 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 2q3u s VAL 62 Cb -0.16 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 2q3u s VAL 62 CO 0.06 0.58 -0.09 0.00 0.00 0.00 0.00 175.10 175.65 2q3u s ALA 64 N 0.25 1.14 0.99 0.00 0.00 -0.50 -1.48 121.76 122.16 2q3u s ALA 64 Ca -0.06 -0.81 -0.11 0.00 0.00 0.00 0.00 51.96 50.97 2q3u s ALA 64 Cb -0.15 -0.17 0.18 0.00 0.00 0.00 0.00 23.12 22.98 2q3u s ALA 64 CO 0.04 0.21 1.09 -1.54 0.00 0.00 0.00 175.76 175.56 2q3u s SER 65 N -1.14 2.49 0.54 0.00 1.04 -1.26 -4.38 113.70 110.99 2q3u s SER 65 Ca 0.01 1.73 0.26 0.00 0.48 0.00 0.00 55.95 58.43 2q3u s SER 65 Cb -0.08 -2.35 1.43 0.00 0.10 0.00 0.00 66.02 65.12 2q3u s SER 65 CO 0.01 -3.30 2.00 -0.65 0.98 0.00 0.00 173.24 172.29 2q3u h PRO 66 N -2.00 0.00 0.00 4.02 0.11 -1.97 -1.03 132.00 131.13 2q3u h PRO 66 Ca -0.51 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 2q3u h PRO 66 Cb 1.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.40 2q3u h PRO 66 CO 0.49 0.00 -0.27 0.00 -0.21 0.00 0.00 178.00 178.01 2q3u h ALA 67 N 1.72 0.85 -0.31 -0.75 0.00 -2.04 -3.36 119.26 115.37 2q3u h ALA 67 Ca 0.22 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2q3u h ALA 67 Cb 0.94 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2q3u h ALA 67 CO -0.00 0.34 0.00 1.04 0.00 0.00 0.00 179.25 180.63 2q3u n GLN 68 N -3.20 2.17 0.17 0.00 1.13 -0.42 -4.75 117.38 112.49 2q3u n GLN 68 Ca 0.02 -1.97 -0.14 0.00 -1.94 0.00 0.00 57.00 52.97 2q3u n GLN 68 Cb 0.60 -1.37 -0.08 0.00 0.11 0.00 0.00 30.24 29.50 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 3.16 -0.36 -0.90 1.08 7.01 -1.65 -1.35 115.95 122.94 2q3u h TRP 69 Ca 0.00 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.05 2q3u h TRP 69 Cb 0.79 0.12 -0.06 0.00 -2.10 0.00 0.00 29.16 27.90 2q3u h TRP 69 CO 0.20 -0.17 0.57 0.93 -2.79 0.00 0.00 178.44 177.18 2q3u h GLU 70 N -0.46 1.04 -0.48 2.65 5.08 -1.89 0.33 114.58 120.85 2q3u h GLU 70 Ca -0.04 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 2q3u h GLU 70 Cb 0.35 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2q3u h GLU 70 CO 0.06 0.68 0.12 -0.97 -1.00 0.00 0.00 179.01 177.91 2q3u h ASN 71 N 1.07 0.73 -0.56 1.42 -1.24 -1.83 -0.96 115.58 114.21 2q3u h ASN 71 Ca 0.38 -0.23 -0.07 0.00 0.71 0.00 0.00 56.30 57.10 2q3u h ASN 71 Cb 0.12 -0.19 -0.02 0.00 0.73 0.00 0.00 38.32 38.95 2q3u h ASN 71 CO -0.16 0.77 0.09 0.00 -1.29 0.00 0.00 177.43 176.84 2q3u h ALA 72 N 0.99 0.74 -0.29 1.57 0.00 -0.80 -0.18 119.26 121.29 2q3u h ALA 72 Ca 0.15 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2q3u h ALA 72 Cb 0.32 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2q3u h ALA 72 CO 0.00 0.48 -0.04 -0.09 0.00 0.00 0.00 179.25 179.60 2q3u h ARG 73 N 0.81 0.45 -0.01 0.00 9.65 -0.74 -0.97 114.38 123.56 2q3u h ARG 73 Ca 0.17 -0.10 -0.25 0.00 -1.10 0.00 0.00 59.98 58.70 2q3u h ARG 73 Cb 0.41 -0.06 0.01 0.00 -1.39 0.00 0.00 29.97 28.94 2q3u h ARG 73 CO 0.01 0.51 -0.98 0.87 2.80 0.00 0.00 179.97 183.17 2q3u h LYS 74 N 0.43 0.61 -0.09 0.20 1.57 -0.84 -3.19 116.57 115.26 2q3u h LYS 74 Ca 0.09 -0.64 -0.13 0.00 -1.87 0.00 0.00 60.65 58.10 2q3u h LYS 74 Cb 0.35 0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 2q3u h LYS 74 CO 0.01 1.24 -0.51 1.96 -0.57 0.00 0.00 179.45 181.59 2q3u h GLN 75 N 0.35 0.24 -5.49 3.15 4.20 -0.69 -3.44 115.11 113.43 2q3u h GLN 75 Ca -0.11 -0.14 -0.64 0.00 0.06 0.00 0.00 58.65 57.83 2q3u h GLN 75 Cb 1.63 0.01 -0.11 0.00 0.30 0.00 0.00 27.48 29.30 2q3u h GLN 75 CO 0.19 0.70 -0.52 -0.51 -0.67 0.00 0.00 178.83 178.02 2q3u s LEU 76 N -8.08 4.12 0.44 1.46 1.43 -0.40 -5.07 118.68 112.59 2q3u s LEU 76 Ca -0.04 0.28 -0.24 0.00 -1.03 0.00 0.00 54.13 53.10 2q3u s LEU 76 Cb 0.13 -2.02 -0.09 0.00 0.03 0.00 0.00 46.19 44.23 2q3u s LEU 76 CO 0.79 0.29 1.16 -2.65 0.23 0.00 0.00 176.35 176.16 2q3u n PRO 77 N 2.78 1.61 0.00 1.29 -0.02 -1.26 -4.84 135.00 134.56 2q3u n PRO 77 Ca -0.18 0.58 0.01 0.00 -2.02 0.00 0.00 63.50 61.89 2q3u n PRO 77 Cb 0.53 -2.25 0.05 0.00 -0.02 0.00 0.00 33.50 31.81 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 -0.08 0.01 0.21 -0.52 -0.58 -1.26 -0.89 120.64 117.53 2q3u n GLU 78 Ca 0.08 0.40 0.09 0.00 -0.42 0.00 0.00 57.16 57.31 2q3u n GLU 78 Cb 0.40 -1.50 0.37 0.00 -0.57 0.00 0.00 31.44 30.14 2q3u n GLU 78 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 2q3u h ASP 79 N 0.00 0.00 -3.40 1.62 3.04 -1.98 -3.41 116.42 112.29 2q3u h ASP 79 Ca 0.00 0.00 -0.55 0.00 -3.24 0.00 0.00 57.03 53.24 2q3u h ASP 79 Cb 0.03 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 38.28 2q3u h ASP 79 CO 0.00 0.25 0.19 -0.63 -2.04 0.00 0.00 179.24 177.01 2q3u s ILE 80 N -3.50 4.90 -0.46 4.15 1.01 -0.06 -4.71 121.20 122.53 2q3u s ILE 80 Ca 0.02 1.67 -0.25 0.00 0.00 0.00 0.00 60.65 62.08 2q3u s ILE 80 Cb 0.09 -4.14 0.03 0.00 0.01 0.00 0.00 42.46 38.45 2q3u s ILE 80 CO 0.66 0.26 0.92 -0.60 0.00 0.00 0.00 174.94 176.17 2q3u s ARG 81 N 0.61 3.54 -0.19 2.79 3.52 -0.08 -4.91 118.95 124.24 2q3u s ARG 81 Ca 0.42 0.17 -0.14 0.00 -0.13 0.00 0.00 55.73 56.05 2q3u s ARG 81 Cb -0.19 -3.92 -0.05 0.00 -1.56 0.00 0.00 34.95 29.23 2q3u s ARG 81 CO 0.22 -1.20 0.29 0.08 -0.81 0.00 0.00 175.30 173.88 2q3u s VAL 82 N 3.71 5.29 0.17 7.11 1.01 -1.26 -0.54 120.40 135.89 2q3u s VAL 82 Ca 0.37 0.51 0.07 0.00 0.00 0.00 0.00 61.98 62.92 2q3u s VAL 82 Cb -0.10 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 2q3u s VAL 82 CO 0.26 0.35 -0.14 0.68 0.00 0.00 0.00 175.10 176.24 2q3u s VAL 83 N 0.79 1.57 0.51 2.92 -7.23 0.15 -4.98 120.40 114.12 2q3u s VAL 83 Ca 0.15 -2.05 -0.07 0.00 -1.81 0.00 0.00 61.98 58.21 2q3u s VAL 83 Cb -0.13 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 34.89 2q3u s VAL 83 CO 0.05 -0.55 0.84 -0.70 -0.31 0.00 0.00 175.10 174.42 2q3u s GLU 84 N -3.36 3.57 0.20 4.82 2.12 -1.26 -1.40 118.70 123.39 2q3u s GLU 84 Ca 0.18 0.34 0.03 0.00 0.36 0.00 0.00 54.97 55.88 2q3u s GLU 84 Cb -0.02 -2.31 -0.05 0.00 0.26 0.00 0.00 34.13 32.01 2q3u s GLU 84 CO 0.05 -0.27 -0.03 -1.12 -0.54 0.00 0.00 175.26 173.35 2q3u s SER 86 N -4.06 1.68 -0.08 -1.70 0.01 -1.26 -4.87 113.70 103.42 2q3u s SER 86 Ca 0.49 -1.15 0.18 0.00 1.31 0.00 0.00 55.95 56.78 2q3u s SER 86 Cb -0.10 0.03 -0.27 0.00 0.21 0.00 0.00 66.02 65.89 2q3u s SER 86 CO 0.46 -0.48 0.29 0.59 0.41 0.00 0.00 173.24 174.51 2q3u n ASN 88 N -0.32 0.62 -2.70 2.44 4.13 -1.26 -4.74 115.26 113.43 2q3u n ASN 88 Ca -0.07 0.00 -0.10 0.00 1.68 0.00 0.00 54.58 56.09 2q3u n ASN 88 Cb 0.63 1.53 0.01 0.00 -1.54 0.00 0.00 39.78 40.40 2q3u n ASN 88 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2q3u n ASP 89 N -2.35 -1.77 -3.41 6.41 4.64 -1.26 -4.92 116.55 113.90 2q3u n ASP 89 Ca -0.13 -2.56 -0.31 0.00 -1.38 0.00 0.00 54.79 50.42 2q3u n ASP 89 Cb 0.71 3.05 -0.05 0.00 -1.04 0.00 0.00 41.12 43.79 2q3u n ASP 89 CO 0.00 0.00 0.00 -1.54 -0.82 0.00 0.00 177.20 174.84 2q3u n SER 90 N -1.55 4.63 -3.48 1.67 3.41 -1.26 -4.89 113.62 112.15 2q3u n SER 90 Ca -0.05 -3.52 -0.27 0.00 -0.26 0.00 0.00 58.87 54.77 2q3u n SER 90 Cb 0.54 -0.77 -0.09 0.00 -0.26 0.00 0.00 64.21 63.63 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 0.58 2.22 0.27 7.33 7.02 -1.26 -4.58 117.44 129.01 2q3u n TRP 91 Ca 0.31 -3.98 0.15 0.00 -1.02 0.00 0.00 57.50 52.96 2q3u n TRP 91 Cb 0.38 -0.44 0.71 0.00 -2.42 0.00 0.00 31.31 29.54 2q3u n TRP 91 CO 0.00 0.00 0.00 0.74 -2.02 0.00 0.00 177.69 176.41 2q3u h PHE 92 N 4.58 0.00 -0.90 -5.99 0.05 -1.79 -0.07 116.94 112.82 2q3u h PHE 92 Ca 0.17 0.00 0.26 0.00 3.82 0.00 0.00 57.97 62.22 2q3u h PHE 92 Cb 0.76 0.00 -0.04 0.00 2.00 0.00 0.00 35.95 38.67 2q3u h PHE 92 CO 0.59 0.08 0.67 -0.09 -0.18 0.00 0.00 178.31 179.38 2q3u h ARG 93 N 0.00 0.00 0.00 1.51 9.65 -1.49 0.39 114.38 124.43 2q3u h ARG 93 Ca -0.00 0.00 -0.25 0.00 -1.10 0.00 0.00 59.98 58.63 2q3u h ARG 93 Cb 0.46 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.00 2q3u h ARG 93 CO 0.01 0.00 -1.86 -0.25 2.80 0.00 0.00 179.97 180.67 2q3u n ASP 94 N -4.18 1.71 0.20 -3.80 8.00 -0.56 -2.55 116.55 115.36 2q3u n ASP 94 Ca 0.19 0.10 0.12 0.00 0.71 0.00 0.00 54.79 55.90 2q3u n ASP 94 Cb 0.99 -0.38 0.15 0.00 -0.02 0.00 0.00 41.12 41.86 2q3u n ASP 94 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 2q3u h SER 95 N -0.37 0.00 -3.98 -2.24 4.64 -1.04 -3.42 113.55 107.15 2q3u h SER 95 Ca -0.37 -0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.50 2q3u h SER 95 Cb 1.40 0.00 0.16 0.00 -0.31 0.00 0.00 62.40 63.65 2q3u h SER 95 CO -0.18 0.00 0.33 -0.83 -0.87 0.00 0.00 176.83 175.29 2q3u s GLY 96 N -4.21 1.69 0.79 -0.77 0.00 0.14 -3.13 107.32 101.83 2q3u s GLY 96 Ca 0.06 -0.99 -0.11 0.00 0.00 0.00 0.00 44.72 43.67 2q3u s GLY 96 CO 0.69 -0.25 1.16 2.56 0.00 0.00 0.00 173.10 177.26 2q3u s PRO 97 N -5.65 2.01 -0.39 2.90 0.04 -1.26 -4.83 135.00 127.82 2q3u s PRO 97 Ca 0.71 0.07 0.00 0.00 0.04 0.00 0.00 61.00 61.82 2q3u s PRO 97 Cb -0.07 -1.98 0.11 0.00 0.04 0.00 0.00 34.50 32.59 2q3u s PRO 97 CO 0.53 -1.54 0.14 0.99 0.04 0.00 0.00 177.00 177.16 2q3u s THR 98 N -3.53 2.82 0.64 1.26 2.01 -0.68 -4.90 115.64 113.26 2q3u s THR 98 Ca 0.62 -2.25 -0.16 0.00 0.31 0.00 0.00 61.69 60.21 2q3u s THR 98 Cb -0.11 -2.99 -0.01 0.00 0.01 0.00 0.00 72.50 69.40 2q3u s THR 98 CO 0.49 -0.66 1.12 -0.36 -0.69 0.00 0.00 174.62 174.52 2q3u s PHE 99 N 0.96 2.57 0.09 4.92 0.40 -1.26 -1.79 117.98 123.87 2q3u s PHE 99 Ca 0.10 1.55 -0.05 0.00 -0.60 0.00 0.00 56.93 57.94 2q3u s PHE 99 Cb -0.21 -3.23 -0.02 0.00 0.51 0.00 0.00 43.02 40.07 2q3u s PHE 99 CO -0.06 -1.76 0.10 0.96 0.70 0.00 0.00 175.22 175.17 2q3u s ILE 100 N -2.18 0.15 0.06 0.64 -4.36 0.59 -4.56 121.20 111.54 2q3u s ILE 100 Ca 0.69 -1.55 0.01 0.00 -0.26 0.00 0.00 60.65 59.54 2q3u s ILE 100 Cb -0.22 -1.59 -0.03 0.00 1.25 0.00 0.00 42.46 41.86 2q3u s ILE 100 CO 0.39 -0.69 -0.06 0.68 0.24 0.00 0.00 174.94 175.50 2q3u s VAL 101 N -3.93 0.47 0.17 8.37 -7.23 0.87 -1.68 120.40 117.44 2q3u s VAL 101 Ca 0.11 -1.48 0.03 0.00 -1.81 0.00 0.00 61.98 58.82 2q3u s VAL 101 Cb 0.06 -1.09 -0.05 0.00 0.56 0.00 0.00 36.38 35.86 2q3u s VAL 101 CO -0.07 -0.68 -0.03 0.00 -0.31 0.00 0.00 175.10 174.01 2q3u s ARG 102 N -2.76 1.13 0.17 4.82 1.70 -0.37 0.17 118.95 123.80 2q3u s ARG 102 Ca -0.00 -1.53 0.06 0.00 -0.47 0.00 0.00 55.73 53.78 2q3u s ARG 102 Cb -0.01 -0.43 -0.01 0.00 -0.57 0.00 0.00 34.95 33.93 2q3u s ARG 102 CO -0.03 -0.06 1.38 1.57 -1.08 0.00 0.00 175.30 177.08 2q3u h LYS 103 N 2.69 0.08 -0.32 3.89 2.10 -1.87 -3.41 116.57 119.73 2q3u h LYS 103 Ca -0.37 -0.10 0.25 0.00 -2.00 0.00 0.00 60.65 58.43 2q3u h LYS 103 Cb 1.20 0.03 -0.23 0.00 -0.90 0.00 0.00 32.23 32.33 2q3u h LYS 103 CO 0.63 0.90 0.29 -0.98 -2.00 0.00 0.00 179.45 178.30 2q3u s ARG 104 N -3.09 0.13 -0.22 0.07 1.70 -1.26 -4.88 118.95 111.39 2q3u s ARG 104 Ca -0.01 0.27 -0.06 0.00 -0.47 0.00 0.00 55.73 55.46 2q3u s ARG 104 Cb 0.11 0.15 0.02 0.00 -0.57 0.00 0.00 34.95 34.66 2q3u s ARG 104 CO 0.81 -0.10 0.12 0.09 -1.08 0.00 0.00 175.30 175.14 2q3u n ASN 112 N 5.17 -3.88 -4.44 -2.89 5.03 -1.26 -5.01 115.26 107.98 2q3u n ASN 112 Ca -0.08 1.26 -0.29 0.00 0.87 0.00 0.00 54.58 56.34 2q3u n ASN 112 Cb 0.54 -4.89 0.23 0.00 -1.02 0.00 0.00 39.78 34.64 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 -1.08 -0.64 -0.08 3.52 0.52 -1.26 -4.93 118.95 114.99 2q3u s ARG 113 Ca -0.13 0.55 0.15 0.00 -0.52 0.00 0.00 55.73 55.77 2q3u s ARG 113 Cb 0.01 -1.61 0.57 0.00 0.52 0.00 0.00 34.95 34.44 2q3u s ARG 113 CO 0.72 -3.46 1.45 0.09 0.02 0.00 0.00 175.30 174.11 2q3u n ASN 114 N -4.69 3.81 -4.02 0.23 3.02 -1.26 -4.79 115.26 107.56 2q3u n ASN 114 Ca 0.05 -2.32 -0.20 0.00 -0.03 0.00 0.00 54.58 52.08 2q3u n ASN 114 Cb 0.56 -0.50 -0.15 0.00 -0.61 0.00 0.00 39.78 39.08 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 -1.74 0.77 0.18 2.41 2.07 -1.26 -1.24 121.20 122.38 2q3u s ILE 115 Ca 0.40 -0.39 -0.02 0.00 -1.41 0.00 0.00 60.65 59.24 2q3u s ILE 115 Cb 0.26 -0.66 -0.04 0.00 0.13 0.00 0.00 42.46 42.15 2q3u s ILE 115 CO 0.20 0.23 0.13 0.00 -1.91 0.00 0.00 174.94 173.58 2q3u s ALA 116 N -0.06 0.94 -0.00 1.50 0.00 -0.68 -3.99 121.76 119.48 2q3u s ALA 116 Ca 0.01 -1.55 0.04 0.00 0.00 0.00 0.00 51.96 50.47 2q3u s ALA 116 Cb -0.06 1.16 -0.01 0.00 0.00 0.00 0.00 23.12 24.22 2q3u s ALA 116 CO -0.00 -0.57 -0.14 0.20 0.00 0.00 0.00 175.76 175.25 2q3u s GLY 117 N -3.10 0.69 -0.16 0.00 0.00 0.74 -0.30 107.32 105.19 2q3u s GLY 117 Ca 0.32 -0.63 -0.15 0.00 0.00 0.00 0.00 44.72 44.26 2q3u s GLY 117 CO 0.08 -0.54 0.36 -0.42 0.00 0.00 0.00 173.10 172.58 2q3u s ILE 118 N -0.41 5.25 -0.46 0.90 1.01 -0.74 -0.53 121.20 126.22 2q3u s ILE 118 Ca 0.05 0.69 -0.06 0.00 0.00 0.00 0.00 60.65 61.33 2q3u s ILE 118 Cb -0.06 -3.70 0.12 0.00 0.01 0.00 0.00 42.46 38.83 2q3u s ILE 118 CO -0.00 0.34 0.29 -0.62 0.00 0.00 0.00 174.94 174.95 2q3u s ASP 119 N 0.65 5.47 0.60 3.58 -1.08 -0.42 -1.68 116.67 123.79 2q3u s ASP 119 Ca 0.19 -2.07 -0.11 0.00 -0.52 0.00 0.00 52.55 50.04 2q3u s ASP 119 Cb -0.14 -1.91 -0.05 0.00 -1.46 0.00 0.00 42.92 39.36 2q3u s ASP 119 CO 0.06 -0.59 1.01 0.26 0.52 0.00 0.00 175.17 176.43 2q3u s TRP 120 N 1.10 3.60 0.60 -5.34 0.52 -1.26 -1.47 118.94 116.69 2q3u s TRP 120 Ca 0.08 1.28 -0.17 0.00 0.02 0.00 0.00 56.10 57.32 2q3u s TRP 120 Cb -0.24 -2.70 -0.03 0.00 -1.15 0.00 0.00 33.47 29.35 2q3u s TRP 120 CO -0.03 -0.62 1.09 1.21 0.02 0.00 0.00 176.95 178.63 2q3u s ASN 121 N -4.02 5.55 -0.02 2.95 3.04 -1.01 -4.81 114.94 116.61 2q3u s ASN 121 Ca 0.55 1.99 -0.00 0.00 0.04 0.00 0.00 52.86 55.44 2q3u s ASN 121 Cb -0.11 -2.55 0.03 0.00 -1.54 0.00 0.00 41.25 37.08 2q3u s ASN 121 CO 0.50 -1.33 0.03 0.12 -3.04 0.00 0.00 177.10 173.39 2q3u s PHE 122 N -2.20 0.02 -0.28 0.43 5.36 -1.26 -2.51 117.98 117.54 2q3u s PHE 122 Ca 0.67 0.14 0.16 0.00 -0.96 0.00 0.00 56.93 56.95 2q3u s PHE 122 Cb -0.20 -0.23 0.49 0.00 -0.34 0.00 0.00 43.02 42.74 2q3u s PHE 122 CO 0.35 -0.09 1.14 0.27 -1.46 0.00 0.00 175.22 175.43 2q3u n ASN 123 N 4.17 3.08 -3.85 6.13 2.04 -1.26 -4.82 115.26 120.75 2q3u n ASN 123 Ca -0.28 -2.82 -0.26 0.00 -0.44 0.00 0.00 54.58 50.79 2q3u n ASN 123 Cb 0.50 -0.42 0.02 0.00 -2.53 0.00 0.00 39.78 37.35 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 -0.63 -1.73 -3.75 -2.53 0.00 -1.26 -1.92 120.51 108.69 2q3u n ALA 124 Ca 0.24 -0.06 -0.23 0.00 0.00 0.00 0.00 53.44 53.40 2q3u n ALA 124 Cb 0.87 -2.80 0.03 0.00 0.00 0.00 0.00 19.45 17.55 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 -4.44 -1.93 0.00 0.00 8.01 -1.26 -1.93 117.44 115.89 2q3u n TRP 125 Ca -0.17 0.84 0.00 0.00 -1.31 0.00 0.00 57.50 56.86 2q3u n TRP 125 Cb 0.62 -4.29 0.00 0.00 -2.01 0.00 0.00 31.31 25.62 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 -1.62 0.42 2.36 6.99 0.00 -1.23 -4.03 105.19 108.08 2q3u n GLY 126 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.46 0.23 -0.02 0.00 -0.81 -2.27 105.19 99.87 2q3u n GLY 127 Ca 0.00 -1.66 0.16 0.00 0.00 0.00 0.00 46.02 44.52 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 1.00 -0.01 4.61 0.00 -1.91 0.30 119.26 123.25 2q3u h ALA 128 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2q3u h ALA 128 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2q3u h ALA 128 CO 0.00 0.00 -0.03 0.09 0.00 0.00 0.00 179.25 179.31 2q3u n ASN 129 N -2.71 1.71 -0.47 0.00 3.02 -1.26 -4.74 115.26 110.81 2q3u n ASN 129 Ca 0.00 -1.36 0.00 0.00 -0.03 0.00 0.00 54.58 53.19 2q3u n ASN 129 Cb 0.20 0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.44 2q3u n ASN 129 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2q3u n ASP 130 N 0.42 0.00 -2.08 6.41 2.03 -0.96 -5.13 116.55 117.24 2q3u n ASP 130 Ca 0.05 -1.18 -0.01 0.00 0.52 0.00 0.00 54.79 54.18 2q3u n ASP 130 Cb 0.24 -0.04 0.00 0.00 -0.72 0.00 0.00 41.12 40.60 2q3u n ASP 130 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2q3u n GLY 131 N 0.00 2.01 0.10 0.27 0.00 0.10 -4.36 105.19 103.31 2q3u n GLY 131 Ca 0.00 -2.14 -0.18 0.00 0.00 0.00 0.00 46.02 43.70 2q3u n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q3u n TYR 133 N -4.46 0.62 0.80 0.00 0.18 -1.26 -2.12 117.16 110.93 2q3u n TYR 133 Ca -0.28 -2.24 0.09 0.00 1.88 0.00 0.00 57.90 57.35 2q3u n TYR 133 Cb 0.60 -0.16 -0.02 0.00 -0.38 0.00 0.00 39.34 39.38 2q3u n TYR 133 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 2q3u n ASN 134 N -1.41 1.58 -3.74 9.48 3.02 -0.45 -4.83 115.26 118.91 2q3u n ASN 134 Ca -0.12 -1.29 -0.28 0.00 -0.03 0.00 0.00 54.58 52.86 2q3u n ASN 134 Cb 0.55 0.57 -0.16 0.00 -0.61 0.00 0.00 39.78 40.12 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 -2.18 2.90 -0.22 6.41 -1.08 -1.26 -4.97 116.67 116.27 2q3u s ASP 135 Ca 0.13 -0.81 0.13 0.00 -0.52 0.00 0.00 52.55 51.48 2q3u s ASP 135 Cb 0.14 -0.60 0.46 0.00 -1.46 0.00 0.00 42.92 41.46 2q3u s ASP 135 CO 0.50 -0.30 1.36 -2.67 0.52 0.00 0.00 175.17 174.58 2q3u n TRP 136 N 5.04 0.69 -0.04 -5.34 2.14 -1.26 -4.82 117.44 113.86 2q3u n TRP 136 Ca -0.09 -1.29 -0.11 0.00 2.07 0.00 0.00 57.50 58.08 2q3u n TRP 136 Cb 0.47 -0.35 -0.04 0.00 -0.81 0.00 0.00 31.31 30.58 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 1.03 -1.21 -0.19 -0.67 0.02 -1.96 -1.86 113.55 108.72 2q3u h SER 137 Ca 0.09 0.18 -0.08 0.00 -0.84 0.00 0.00 61.79 61.14 2q3u h SER 137 Cb 1.39 0.51 -0.02 0.00 0.14 0.00 0.00 62.40 64.43 2q3u h SER 137 CO 0.22 -0.38 -0.12 0.45 -1.14 0.00 0.00 176.83 175.85 2q3u h HIS 138 N -0.40 0.61 0.00 3.45 3.86 -1.90 -2.71 115.15 118.06 2q3u h HIS 138 Ca 0.11 -0.10 -0.04 0.00 -1.16 0.00 0.00 60.37 59.18 2q3u h HIS 138 Cb 0.58 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.89 2q3u h HIS 138 CO -0.49 0.67 -0.17 -0.44 0.86 0.00 0.00 177.93 178.36 2q3u h ASP 139 N 0.52 0.00 0.49 2.45 3.45 -1.65 0.66 116.42 122.35 2q3u h ASP 139 Ca 0.09 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.55 2q3u h ASP 139 Cb 0.52 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.29 2q3u h ASP 139 CO 0.03 0.17 0.00 0.18 -1.57 0.00 0.00 179.24 178.05 2q3u n LEU 140 N -4.13 0.00 -0.65 1.55 4.77 -0.93 -2.67 117.00 114.93 2q3u n LEU 140 Ca -0.02 0.37 0.08 0.00 -0.03 0.00 0.00 56.01 56.41 2q3u n LEU 140 Cb 0.25 -0.37 0.07 0.00 -2.33 0.00 0.00 43.42 41.03 2q3u n LEU 140 CO 0.35 -0.12 0.51 0.18 -1.33 0.00 0.00 177.39 176.97 2q3u n LEU 141 N -1.37 2.36 0.04 2.23 4.77 0.23 -4.74 117.00 120.52 2q3u n LEU 141 Ca 0.08 -1.00 -0.20 0.00 -0.03 0.00 0.00 56.01 54.86 2q3u n LEU 141 Cb 0.19 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.15 2q3u n LEU 141 CO 0.16 0.42 0.09 0.58 -1.33 0.00 0.00 177.39 177.31 2q3u h VAL 142 N 3.20 1.44 -0.30 4.08 2.07 -1.27 -2.86 116.25 122.62 2q3u h VAL 142 Ca 0.00 -2.37 -0.01 0.00 0.82 0.00 0.00 66.70 65.14 2q3u h VAL 142 Cb 0.68 2.91 -0.01 0.00 -1.52 0.00 0.00 31.29 33.35 2q3u h VAL 142 CO 0.00 0.69 0.16 0.28 0.02 0.00 0.00 177.57 178.72 2q3u h SER 143 N -0.16 0.37 0.29 0.57 0.02 -1.76 -1.31 113.55 111.55 2q3u h SER 143 Ca -0.13 -0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 60.67 2q3u h SER 143 Cb 1.59 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 64.03 2q3u h SER 143 CO 0.16 0.35 -0.28 -0.09 -1.14 0.00 0.00 176.83 175.82 2q3u h ARG 144 N 0.36 0.00 -0.38 3.45 2.43 -1.88 -1.56 114.38 116.80 2q3u h ARG 144 Ca 0.10 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.13 2q3u h ARG 144 Cb 0.06 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2q3u h ARG 144 CO -0.02 0.28 -0.33 0.87 -1.51 0.00 0.00 179.97 179.27 2q3u h LYS 145 N 0.00 0.89 -0.05 0.20 1.57 -1.13 -0.91 116.57 117.15 2q3u h LYS 145 Ca -0.00 -0.45 -0.17 0.00 -1.87 0.00 0.00 60.65 58.16 2q3u h LYS 145 Cb 0.50 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 2q3u h LYS 145 CO 0.04 1.10 -0.71 0.82 -0.57 0.00 0.00 179.45 180.13 2q3u h ILE 146 N 0.70 1.41 -0.05 1.86 2.04 -1.14 -1.98 117.51 120.36 2q3u h ILE 146 Ca 0.07 -2.19 -0.15 0.00 1.00 0.00 0.00 64.86 63.58 2q3u h ILE 146 Cb 0.91 2.15 -0.01 0.00 -0.74 0.00 0.00 36.82 39.13 2q3u h ILE 146 CO 0.08 0.65 -0.64 -0.07 0.00 0.00 0.00 178.15 178.17 2q3u h LEU 147 N 0.18 0.22 -0.18 1.44 3.38 -1.17 -2.53 115.31 116.65 2q3u h LEU 147 Ca -0.02 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.75 2q3u h LEU 147 Cb 1.26 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 2q3u h LEU 147 CO 0.11 0.80 -0.13 0.00 0.09 0.00 0.00 178.44 179.31 2q3u h ALA 148 N 1.20 0.26 -0.67 1.53 0.00 -1.04 -1.79 119.26 118.75 2q3u h ALA 148 Ca -0.01 -0.31 0.06 0.00 0.00 0.00 0.00 54.91 54.65 2q3u h ALA 148 Cb 1.16 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.85 2q3u h ALA 148 CO 0.10 0.13 0.44 -0.07 0.00 0.00 0.00 179.25 179.85 2q3u h LEU 149 N 0.08 0.59 -1.80 0.00 3.38 -1.21 -1.56 115.31 114.79 2q3u h LEU 149 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2q3u h LEU 149 Cb 0.64 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2q3u h LEU 149 CO 0.04 0.38 0.00 -0.62 0.09 0.00 0.00 178.44 178.32 2q3u n GLU 150 N -4.48 2.21 -3.98 1.13 -0.58 -0.97 -4.98 120.64 109.00 2q3u n GLU 150 Ca 0.10 -1.79 -0.30 0.00 -0.42 0.00 0.00 57.16 54.74 2q3u n GLU 150 Cb 0.24 -1.47 0.01 0.00 -0.57 0.00 0.00 31.44 29.64 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 1.08 -4.60 -4.29 3.49 1.74 -0.59 -4.98 116.66 108.51 2q3u n ARG 151 Ca 0.17 0.52 -0.35 0.00 -0.77 0.00 0.00 57.85 57.42 2q3u n ARG 151 Cb 0.53 -5.24 -0.09 0.00 -1.02 0.00 0.00 32.46 26.63 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 -3.42 4.44 0.34 0.55 1.01 -0.74 -4.99 121.20 118.40 2q3u s ILE 152 Ca 0.53 -0.19 -0.28 0.00 0.00 0.00 0.00 60.65 60.72 2q3u s ILE 152 Cb -0.27 -2.90 -0.12 0.00 0.01 0.00 0.00 42.46 39.17 2q3u s ILE 152 CO 0.86 0.58 1.20 -2.65 0.00 0.00 0.00 174.94 174.93 2q3u n PRO 153 N 2.43 1.87 -4.61 2.79 -0.02 -1.26 -4.68 135.00 131.52 2q3u n PRO 153 Ca -0.18 0.66 -0.33 0.00 -2.02 0.00 0.00 63.50 61.62 2q3u n PRO 153 Cb 0.53 -2.19 -0.14 0.00 -0.02 0.00 0.00 33.50 31.68 2q3u n PRO 153 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2q3u s ARG 154 N -1.83 3.42 -0.14 -0.52 3.52 -1.26 -0.18 118.95 121.96 2q3u s ARG 154 Ca 0.57 -0.66 -0.05 0.00 -0.13 0.00 0.00 55.73 55.46 2q3u s ARG 154 Cb -0.60 -2.71 -0.04 0.00 -1.56 0.00 0.00 34.95 30.04 2q3u s ARG 154 CO 0.61 0.16 0.06 -0.06 -0.81 0.00 0.00 175.30 175.26 2q3u s PHE 155 N 0.50 3.30 0.06 5.12 0.40 0.31 -4.95 117.98 122.73 2q3u s PHE 155 Ca -0.08 0.21 0.04 0.00 -0.60 0.00 0.00 56.93 56.51 2q3u s PHE 155 Cb -0.15 -1.95 -0.04 0.00 0.51 0.00 0.00 43.02 41.39 2q3u s PHE 155 CO 0.04 0.39 -0.00 -1.14 0.70 0.00 0.00 175.22 175.21 2q3u s GLN 156 N -0.37 2.62 -0.05 0.44 0.74 -1.26 -1.30 119.66 120.49 2q3u s GLN 156 Ca 0.09 -0.76 0.01 0.00 0.05 0.00 0.00 55.36 54.75 2q3u s GLN 156 Cb -0.12 -2.58 0.02 0.00 1.10 0.00 0.00 33.01 31.43 2q3u s GLN 156 CO 0.02 0.57 -0.05 -1.58 -0.55 0.00 0.00 175.29 173.69 2q3u s HIS 157 N -1.23 0.85 -1.47 1.67 2.46 -0.54 -4.91 115.29 112.11 2q3u s HIS 157 Ca 0.24 -0.26 -0.12 0.00 0.47 0.00 0.00 55.06 55.39 2q3u s HIS 157 Cb -0.12 -0.74 0.03 0.00 -0.13 0.00 0.00 32.58 31.63 2q3u s HIS 157 CO 0.15 -0.22 2.38 -1.13 -2.47 0.00 0.00 174.74 173.46 2q3u n SER 158 N 4.09 5.58 -3.85 9.88 3.41 -1.26 -2.41 113.62 129.05 2q3u n SER 158 Ca -0.23 -2.83 -0.23 0.00 -0.26 0.00 0.00 58.87 55.32 2q3u n SER 158 Cb 0.51 -1.59 -0.17 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 2.25 0.58 -0.04 -1.33 1.01 -1.26 -4.51 121.20 117.90 2q3u s ILE 160 Ca 0.52 -0.06 -0.13 0.00 0.00 0.00 0.00 60.65 60.98 2q3u s ILE 160 Cb 0.15 -0.66 0.02 0.00 0.01 0.00 0.00 42.46 41.98 2q3u s ILE 160 CO -0.07 0.27 0.28 -0.22 0.00 0.00 0.00 174.94 175.21 2q3u s LEU 161 N 1.49 0.95 -0.01 2.97 2.96 -1.05 -4.78 118.68 121.21 2q3u s LEU 161 Ca -0.02 0.17 0.02 0.00 -0.22 0.00 0.00 54.13 54.08 2q3u s LEU 161 Cb -0.13 1.13 -0.03 0.00 0.50 0.00 0.00 46.19 47.66 2q3u s LEU 161 CO -0.03 -0.36 -0.04 -1.61 -1.32 0.00 0.00 176.35 172.99 2q3u s GLU 162 N -0.99 2.68 0.34 1.98 2.02 -1.26 -4.69 118.70 118.79 2q3u s GLU 162 Ca -0.11 -0.65 0.14 0.00 0.02 0.00 0.00 54.97 54.38 2q3u s GLU 162 Cb -0.05 -2.59 0.58 0.00 0.10 0.00 0.00 34.13 32.17 2q3u s GLU 162 CO 0.03 0.62 1.71 0.78 0.02 0.00 0.00 175.26 178.42 2q3u h GLY 163 N 4.56 0.00 1.35 -1.39 0.00 -1.74 -2.40 103.07 103.44 2q3u h GLY 163 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2q3u h GLY 163 CO 0.55 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.70 2q3u n GLY 164 N 0.07 -0.84 0.54 4.60 0.00 -1.25 -2.89 105.19 105.43 2q3u n GLY 164 Ca -0.01 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.17 2.09 -3.90 1.61 3.41 -0.90 -1.54 113.62 113.21 2q3u n SER 165 Ca 0.12 -1.54 -0.19 0.00 -0.26 0.00 0.00 58.87 57.00 2q3u n SER 165 Cb 0.13 0.39 -0.16 0.00 -0.26 0.00 0.00 64.21 64.30 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 0.48 -0.00 -1.33 -4.36 -1.14 -4.27 121.20 108.17 2q3u s ILE 166 Ca 0.20 -0.12 0.07 0.00 -0.26 0.00 0.00 60.65 60.54 2q3u s ILE 166 Cb 0.18 -0.50 -0.02 0.00 1.25 0.00 0.00 42.46 43.37 2q3u s ILE 166 CO 0.53 0.20 -0.21 -1.00 0.24 0.00 0.00 174.94 174.70 2q3u s HIS 167 N 0.75 1.89 0.11 1.37 3.76 -0.42 -4.94 115.29 117.81 2q3u s HIS 167 Ca -0.10 -0.36 0.08 0.00 -0.15 0.00 0.00 55.06 54.53 2q3u s HIS 167 Cb -0.13 -1.20 -0.04 0.00 1.11 0.00 0.00 32.58 32.33 2q3u s HIS 167 CO 0.00 -0.00 -0.20 0.14 -0.85 0.00 0.00 174.74 173.83 2q3u s VAL 168 N -0.57 1.68 -2.47 -0.90 -7.23 -1.26 -0.16 120.40 109.49 2q3u s VAL 168 Ca 0.08 -1.59 0.23 0.00 -1.81 0.00 0.00 61.98 58.89 2q3u s VAL 168 Cb -0.08 -1.57 0.42 0.00 0.56 0.00 0.00 36.38 35.70 2q3u s VAL 168 CO -0.00 -0.12 1.42 -0.90 -0.31 0.00 0.00 175.10 175.19 2q3u n ASP 169 N 0.96 3.13 0.00 4.85 5.75 -1.09 -4.61 116.55 125.54 2q3u n ASP 169 Ca -0.19 -1.95 0.00 0.00 -0.01 0.00 0.00 54.79 52.65 2q3u n ASP 169 Cb 0.54 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 2q3u n ASP 169 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2q3u n GLY 170 N 1.44 0.42 1.22 6.12 0.00 -1.26 -4.62 105.19 108.50 2q3u n GLY 170 Ca 0.19 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.78 0.66 -0.45 1.61 1.02 -1.26 -4.83 120.64 115.61 2q3u n GLU 171 Ca 0.00 -2.53 0.00 0.00 -0.02 0.00 0.00 57.16 54.61 2q3u n GLU 171 Cb 0.12 -0.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.89 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 -0.12 0.75 3.56 0.62 0.00 -1.26 -4.58 105.19 104.17 2q3u n GLY 172 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.39 3.19 -0.04 2.61 2.01 -1.26 0.93 115.64 120.68 2q3u s THR 173 Ca 0.00 -1.57 -0.01 0.00 0.31 0.00 0.00 61.69 60.42 2q3u s THR 173 Cb 0.00 -2.55 0.03 0.00 0.01 0.00 0.00 72.50 70.00 2q3u s THR 173 CO 0.00 -0.04 0.08 0.00 -0.69 0.00 0.00 174.62 173.96 2q3u s LEU 175 N 1.28 3.74 0.26 0.00 2.96 0.78 0.03 118.68 127.73 2q3u s LEU 175 Ca -0.07 0.12 -0.13 0.00 -0.22 0.00 0.00 54.13 53.83 2q3u s LEU 175 Cb -0.12 -1.91 -0.00 0.00 0.50 0.00 0.00 46.19 44.66 2q3u s LEU 175 CO -0.04 0.26 0.51 0.68 -1.32 0.00 0.00 176.35 176.44 2q3u s VAL 176 N -0.18 0.00 0.11 1.68 -7.23 -0.40 -1.30 120.40 113.08 2q3u s VAL 176 Ca 0.07 -1.37 0.09 0.00 -1.81 0.00 0.00 61.98 58.95 2q3u s VAL 176 Cb -0.12 -2.23 -0.04 0.00 0.56 0.00 0.00 36.38 34.55 2q3u s VAL 176 CO 0.02 0.00 -0.19 0.42 -0.31 0.00 0.00 175.10 175.03 2q3u s THR 177 N -3.92 2.75 0.16 5.32 -4.23 -1.26 -1.13 115.64 113.33 2q3u s THR 177 Ca 0.22 -1.51 -0.02 0.00 -1.18 0.00 0.00 61.69 59.19 2q3u s THR 177 Cb -0.01 -2.25 -0.12 0.00 1.34 0.00 0.00 72.50 71.46 2q3u s THR 177 CO 0.09 0.12 1.40 -0.33 -0.54 0.00 0.00 174.62 175.37 2q3u h GLU 178 N 3.83 0.42 -0.96 3.99 5.08 -1.31 -1.88 114.58 123.75 2q3u h GLU 178 Ca -0.50 -0.37 0.17 0.00 -1.00 0.00 0.00 59.36 57.66 2q3u h GLU 178 Cb 1.17 0.08 -0.10 0.00 0.50 0.00 0.00 28.75 30.40 2q3u h GLU 178 CO 0.45 1.01 0.56 1.49 -1.00 0.00 0.00 179.01 181.52 2q3u h GLU 179 N 0.28 0.73 0.00 2.33 4.81 -1.77 0.40 114.58 121.36 2q3u h GLU 179 Ca -0.04 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.12 2q3u h GLU 179 Cb 1.37 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.58 2q3u h GLU 179 CO 0.13 0.49 -0.65 0.00 -0.73 0.00 0.00 179.01 178.25 2q3u h LEU 181 N -1.00 0.00 -2.84 0.00 -0.00 -1.26 -1.64 115.31 108.57 2q3u h LEU 181 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.84 2q3u h LEU 181 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.30 2q3u h LEU 181 CO -0.03 0.22 0.00 0.18 -0.00 0.00 0.00 178.44 178.81 2q3u n LEU 182 N -3.37 4.29 -4.70 1.67 4.77 0.12 -4.79 117.00 114.99 2q3u n LEU 182 Ca 0.00 -2.16 -0.42 0.00 -0.03 0.00 0.00 56.01 53.40 2q3u n LEU 182 Cb 0.43 -0.53 -0.03 0.00 -2.33 0.00 0.00 43.42 40.96 2q3u n LEU 182 CO 0.33 0.83 1.15 0.21 -1.33 0.00 0.00 177.39 178.58 2q3u s ASN 183 N -0.91 6.76 0.00 -1.43 3.84 -0.62 -4.78 114.94 117.81 2q3u s ASN 183 Ca 0.48 2.32 0.00 0.00 0.21 0.00 0.00 52.86 55.87 2q3u s ASN 183 Cb 0.29 -2.57 0.00 0.00 -0.55 0.00 0.00 41.25 38.42 2q3u s ASN 183 CO 0.26 -0.74 0.91 2.29 -2.79 0.00 0.00 177.10 177.03 2q3u n LYS 184 N 4.76 0.00 -0.10 0.43 2.85 -1.26 -0.64 118.16 124.21 2q3u n LYS 184 Ca 0.13 0.41 0.06 0.00 -1.05 0.00 0.00 58.31 57.87 2q3u n LYS 184 Cb 0.42 -1.53 0.23 0.00 -0.65 0.00 0.00 35.03 33.51 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 -1.41 1.23 0.00 -5.58 0.23 -1.26 -3.83 115.26 104.64 2q3u n ASN 185 Ca 0.00 -1.85 0.00 0.00 -0.53 0.00 0.00 54.58 52.20 2q3u n ASN 185 Cb 0.03 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 37.60 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 0.11 0.00 -3.34 -3.83 5.12 0.19 -4.29 116.66 110.63 2q3u n ARG 186 Ca 0.11 0.00 -0.26 0.00 -1.93 0.00 0.00 57.85 55.77 2q3u n ARG 186 Cb 0.22 0.00 -0.08 0.00 -1.16 0.00 0.00 32.46 31.44 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 -1.02 2.69 -0.20 0.55 4.13 -1.26 -4.81 115.26 115.34 2q3u n ASN 187 Ca 0.00 -3.22 0.28 0.00 1.68 0.00 0.00 54.58 53.32 2q3u n ASN 187 Cb 0.00 -0.66 0.70 0.00 -1.54 0.00 0.00 39.78 38.28 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 4.09 0.05 -2.00 3.52 0.13 -1.82 -3.43 132.00 132.54 2q3u h PRO 188 Ca 0.16 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2q3u h PRO 188 Cb 0.73 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2q3u h PRO 188 CO 0.72 0.03 0.00 0.72 -0.23 0.00 0.00 178.00 179.25 2q3u n HIS 189 N -4.30 0.00 -4.30 1.56 8.25 -1.26 -5.09 115.22 110.08 2q3u n HIS 189 Ca 0.19 -0.70 -0.17 0.00 -0.26 0.00 0.00 57.72 56.78 2q3u n HIS 189 Cb 0.96 -0.42 -0.09 0.00 1.12 0.00 0.00 29.99 31.55 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 2.00 1.24 0.34 0.41 1.04 -1.26 -5.11 113.70 112.35 2q3u s SER 191 Ca 0.00 -1.53 0.07 0.00 0.48 0.00 0.00 55.95 54.98 2q3u s SER 191 Cb 0.00 0.38 0.76 0.00 0.10 0.00 0.00 66.02 67.25 2q3u s SER 191 CO 0.00 -0.88 1.87 0.50 0.98 0.00 0.00 173.24 175.71 2q3u h LYS 192 N 2.31 0.74 -0.29 4.02 3.64 -1.96 -1.80 116.57 123.21 2q3u h LYS 192 Ca -0.34 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 58.89 2q3u h LYS 192 Cb 1.25 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 2q3u h LYS 192 CO 0.52 0.49 -0.23 0.93 -2.27 0.00 0.00 179.45 178.88 2q3u h GLU 193 N 0.76 0.68 -0.28 1.90 3.07 -2.03 -1.10 114.58 117.58 2q3u h GLU 193 Ca 0.44 -0.34 -0.10 0.00 -0.50 0.00 0.00 59.36 58.87 2q3u h GLU 193 Cb 0.62 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.52 2q3u h GLU 193 CO -0.20 0.94 -0.24 1.96 -1.40 0.00 0.00 179.01 180.06 2q3u h GLN 194 N 0.42 0.54 -0.08 2.33 4.20 -1.86 -1.65 115.11 119.02 2q3u h GLN 194 Ca 0.05 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.55 2q3u h GLN 194 Cb 0.79 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.53 2q3u h GLN 194 CO 0.06 0.74 0.02 0.82 -0.67 0.00 0.00 178.83 179.80 2q3u h ILE 195 N 0.47 1.19 -0.99 2.54 2.04 -1.17 -2.78 117.51 118.82 2q3u h ILE 195 Ca 0.07 -0.57 0.04 0.00 1.00 0.00 0.00 64.86 65.40 2q3u h ILE 195 Cb 0.68 1.42 -0.06 0.00 -0.74 0.00 0.00 36.82 38.12 2q3u h ILE 195 CO 0.05 0.16 0.65 -0.33 0.00 0.00 0.00 178.15 178.68 2q3u h GLU 196 N -0.08 1.22 -0.51 2.37 5.08 -1.07 -2.31 114.58 119.28 2q3u h GLU 196 Ca 0.02 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2q3u h GLU 196 Cb 0.23 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2q3u h GLU 196 CO -0.00 0.80 0.24 1.49 -1.00 0.00 0.00 179.01 180.55 2q3u h GLU 197 N 1.25 0.74 -0.41 2.33 4.57 -1.29 -2.29 114.58 119.48 2q3u h GLU 197 Ca 0.39 -0.11 -0.08 0.00 -1.18 0.00 0.00 59.36 58.38 2q3u h GLU 197 Cb -0.01 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.43 2q3u h GLU 197 CO -0.12 0.61 -0.08 0.93 -1.18 0.00 0.00 179.01 179.17 2q3u h GLU 198 N 0.68 0.71 0.00 1.92 4.39 -1.25 -2.05 114.58 118.98 2q3u h GLU 198 Ca 0.18 -0.21 -0.07 0.00 0.34 0.00 0.00 59.36 59.59 2q3u h GLU 198 Cb 0.12 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 2q3u h GLU 198 CO -0.02 0.78 -0.34 -0.07 -1.16 0.00 0.00 179.01 178.20 2q3u h LEU 199 N 0.65 0.00 -0.22 1.33 3.38 -1.34 0.62 115.31 119.74 2q3u h LEU 199 Ca 0.12 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 2q3u h LEU 199 Cb 0.52 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2q3u h LEU 199 CO 0.03 0.34 -0.10 0.11 0.09 0.00 0.00 178.44 178.90 2q3u h LYS 200 N 0.00 0.45 -0.61 1.13 1.57 -0.78 0.11 116.57 118.44 2q3u h LYS 200 Ca -0.00 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 58.55 2q3u h LYS 200 Cb 0.77 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.04 2q3u h LYS 200 CO 0.04 0.73 0.26 0.87 -0.57 0.00 0.00 179.45 180.79 2q3u h LYS 201 N 0.16 0.91 0.05 3.15 1.57 -0.97 0.01 116.57 121.44 2q3u h LYS 201 Ca 0.05 -0.15 -0.32 0.00 -1.87 0.00 0.00 60.65 58.36 2q3u h LYS 201 Cb 0.59 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.71 2q3u h LYS 201 CO 0.03 0.75 -1.81 0.66 -0.57 0.00 0.00 179.45 178.51 2q3u n TYR 202 N -4.47 1.12 0.86 -1.35 4.01 0.21 -0.24 117.16 117.30 2q3u n TYR 202 Ca 0.04 0.33 0.09 0.00 -0.16 0.00 0.00 57.90 58.20 2q3u n TYR 202 Cb 0.15 -1.18 -0.04 0.00 -0.31 0.00 0.00 39.34 37.96 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 -3.22 1.51 -2.31 7.72 4.77 0.02 -4.74 117.00 120.74 2q3u n LEU 203 Ca -0.22 -0.67 -0.16 0.00 -0.03 0.00 0.00 56.01 54.92 2q3u n LEU 203 Cb 1.05 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 42.17 2q3u n LEU 203 CO 0.44 0.30 0.02 0.61 -1.33 0.00 0.00 177.39 177.44 2q3u n GLY 204 N 1.34 -0.18 3.75 -0.72 0.00 -0.02 -4.53 105.19 104.84 2q3u n GLY 204 Ca 0.06 -0.11 -0.23 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.03 4.05 -0.04 1.61 -7.23 -1.19 -4.54 120.40 110.04 2q3u s VAL 205 Ca 0.25 -1.57 0.04 0.00 -1.81 0.00 0.00 61.98 58.89 2q3u s VAL 205 Cb -0.11 -3.17 -0.06 0.00 0.56 0.00 0.00 36.38 33.60 2q3u s VAL 205 CO 0.31 -0.33 0.03 0.00 -0.31 0.00 0.00 175.10 174.80 2q3u n GLN 206 N -0.97 2.76 -4.31 4.82 3.00 0.26 -4.36 117.38 118.59 2q3u n GLN 206 Ca -0.07 -0.01 -0.16 0.00 -0.01 0.00 0.00 57.00 56.74 2q3u n GLN 206 Cb 0.58 -1.11 -0.10 0.00 0.00 0.00 0.00 30.24 29.60 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 -3.39 1.88 -0.00 1.08 1.04 -0.26 -5.04 113.70 109.00 2q3u s SER 207 Ca -0.02 -1.14 -0.00 0.00 0.48 0.00 0.00 55.95 55.26 2q3u s SER 207 Cb 0.02 -0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.13 2q3u s SER 207 CO 0.19 -0.44 0.01 -0.36 0.98 0.00 0.00 173.24 173.62 2q3u s PHE 208 N -3.36 -0.00 -0.27 5.02 0.40 -1.26 -1.34 117.98 117.16 2q3u s PHE 208 Ca 0.24 0.03 -0.00 0.00 -0.60 0.00 0.00 56.93 56.60 2q3u s PHE 208 Cb 0.04 -0.02 0.05 0.00 0.51 0.00 0.00 43.02 43.60 2q3u s PHE 208 CO 0.06 -0.01 -0.05 0.42 0.70 0.00 0.00 175.22 176.34 2q3u s ILE 209 N 0.11 2.68 -0.42 0.64 1.01 0.10 -4.94 121.20 120.38 2q3u s ILE 209 Ca -0.01 -1.39 -0.15 0.00 0.00 0.00 0.00 60.65 59.10 2q3u s ILE 209 Cb -0.01 -2.51 0.02 0.00 0.01 0.00 0.00 42.46 39.98 2q3u s ILE 209 CO -0.00 -0.01 0.31 0.26 0.00 0.00 0.00 174.94 175.50 2q3u s TRP 210 N 1.22 3.24 0.17 3.97 0.52 -1.26 -1.28 118.94 125.51 2q3u s TRP 210 Ca -0.05 -0.61 -0.19 0.00 0.02 0.00 0.00 56.10 55.27 2q3u s TRP 210 Cb -0.19 -2.65 -0.08 0.00 -1.15 0.00 0.00 33.47 29.41 2q3u s TRP 210 CO -0.03 -0.61 0.65 -0.51 0.02 0.00 0.00 176.95 176.46 2q3u s LEU 211 N 1.69 4.40 0.14 2.99 1.43 -0.29 -4.92 118.68 124.13 2q3u s LEU 211 Ca 0.05 1.31 -0.14 0.00 -1.03 0.00 0.00 54.13 54.32 2q3u s LEU 211 Cb -0.19 -3.33 0.02 0.00 0.03 0.00 0.00 46.19 42.71 2q3u s LEU 211 CO 0.10 0.12 1.68 -0.65 0.23 0.00 0.00 176.35 177.82 2q3u h PRO 212 N 3.76 0.71 -4.89 1.29 0.11 -1.91 -1.59 132.00 129.47 2q3u h PRO 212 Ca -0.48 -0.15 -0.37 0.00 0.11 0.00 0.00 66.00 65.11 2q3u h PRO 212 Cb 1.20 -0.11 -0.14 0.00 0.11 0.00 0.00 31.00 32.06 2q3u h PRO 212 CO 0.65 0.67 -0.60 1.03 -0.21 0.00 0.00 178.00 179.54 2q3u s ARG 213 N -5.45 1.46 0.00 1.05 0.52 -1.26 -3.06 118.95 112.21 2q3u s ARG 213 Ca -0.13 -1.80 0.00 0.00 -0.52 0.00 0.00 55.73 53.28 2q3u s ARG 213 Cb 0.11 -0.24 0.00 0.00 0.52 0.00 0.00 34.95 35.34 2q3u s ARG 213 CO 0.77 -0.33 0.00 0.41 0.02 0.00 0.00 175.30 176.17 2q3u n GLY 214 N -0.50 2.53 3.77 -3.53 0.00 -1.26 -4.94 105.19 101.27 2q3u n GLY 214 Ca 0.00 -2.05 -0.38 0.00 0.00 0.00 0.00 46.02 43.59 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 4.15 0.22 0.99 2.96 -1.26 -4.95 118.68 120.79 2q3u s LEU 215 Ca 0.00 2.26 -0.30 0.00 -0.22 0.00 0.00 54.13 55.87 2q3u s LEU 215 Cb 0.00 -4.10 -0.09 0.00 0.50 0.00 0.00 46.19 42.51 2q3u s LEU 215 CO 0.00 -0.67 1.18 -0.47 -1.32 0.00 0.00 176.35 175.07 2q3u s TYR 216 N -1.49 3.44 0.00 5.38 6.14 -1.26 -2.58 117.35 126.98 2q3u s TYR 216 Ca 0.58 1.49 0.00 0.00 0.64 0.00 0.00 57.07 59.78 2q3u s TYR 216 Cb -0.28 -3.41 0.00 0.00 0.42 0.00 0.00 41.96 38.69 2q3u s TYR 216 CO 0.35 -1.08 0.00 0.41 0.64 0.00 0.00 175.55 175.88 2q3u n GLY 217 N 1.87 2.36 3.23 8.97 0.00 -1.26 -4.72 105.19 115.64 2q3u n GLY 217 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 2q3u n GLY 217 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2q3u s ASP 218 N -1.62 6.51 -0.09 1.61 3.68 -1.07 -4.23 116.67 121.46 2q3u s ASP 218 Ca 0.00 -3.38 0.11 0.00 2.13 0.00 0.00 52.55 51.40 2q3u s ASP 218 Cb 0.00 -2.06 -0.24 0.00 -1.45 0.00 0.00 42.92 39.17 2q3u s ASP 218 CO 0.00 -0.31 0.47 1.21 0.13 0.00 0.00 175.17 176.66 2q3u n GLU 219 N 2.91 0.66 0.26 4.34 4.07 -1.26 -2.54 120.64 129.08 2q3u n GLU 219 Ca 0.19 0.23 0.15 0.00 -0.06 0.00 0.00 57.16 57.66 2q3u n GLU 219 Cb 0.40 -1.72 0.65 0.00 -0.06 0.00 0.00 31.44 30.71 2q3u n GLU 219 CO 0.00 0.00 0.00 -0.44 -0.06 0.00 0.00 177.13 176.63 2q3u h ASP 220 N 0.01 0.00 -0.26 4.31 3.32 -1.96 -2.27 116.42 119.57 2q3u h ASP 220 Ca -0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.68 2q3u h ASP 220 Cb 2.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.61 2q3u h ASP 220 CO 0.06 0.09 0.00 0.35 -1.72 0.00 0.00 179.24 178.03 2q3u n THR 221 N -3.26 0.87 -3.76 0.35 -2.24 -1.26 -4.80 114.28 100.18 2q3u n THR 221 Ca -0.00 -0.94 -0.23 0.00 -2.27 0.00 0.00 64.05 60.62 2q3u n THR 221 Cb 0.32 0.59 0.02 0.00 -2.10 0.00 0.00 70.33 69.17 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 0.40 -1.36 -1.65 3.42 4.13 -0.86 -4.17 115.26 115.17 2q3u n ASN 222 Ca 0.09 -0.84 -0.04 0.00 1.68 0.00 0.00 54.58 55.47 2q3u n ASN 222 Cb 0.38 -3.89 0.02 0.00 -1.54 0.00 0.00 39.78 34.75 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 -1.64 0.31 3.65 7.41 0.00 -1.05 -0.01 105.19 113.85 2q3u n GLY 223 Ca -0.27 -0.27 -0.51 0.00 0.00 0.00 0.00 46.02 44.97 2q3u n GLY 223 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2q3u n HIS 224 N -1.77 1.96 -0.31 1.61 8.25 -1.26 -4.18 115.22 119.52 2q3u n HIS 224 Ca -0.05 0.42 0.09 0.00 -0.26 0.00 0.00 57.72 57.91 2q3u n HIS 224 Cb 0.54 -2.47 0.30 0.00 1.12 0.00 0.00 29.99 29.48 2q3u n HIS 224 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 2q3u h ILE 225 N 4.14 0.90 0.00 1.59 6.09 -1.78 -1.94 117.51 126.51 2q3u h ILE 225 Ca -0.47 -0.30 0.00 0.00 -1.37 0.00 0.00 64.86 62.73 2q3u h ILE 225 Cb 1.30 -0.03 0.00 0.00 0.47 0.00 0.00 36.82 38.56 2q3u h ILE 225 CO 0.87 0.16 0.00 -0.90 -3.07 0.00 0.00 178.15 175.21 2q3u n ASP 226 N -4.57 0.00 -1.51 2.19 5.75 -0.59 -0.73 116.55 117.08 2q3u n ASP 226 Ca 0.17 0.30 -0.11 0.00 -0.01 0.00 0.00 54.79 55.15 2q3u n ASP 226 Cb 0.38 -0.38 0.19 0.00 -1.03 0.00 0.00 41.12 40.28 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 -1.38 2.86 -4.75 -1.12 5.15 -0.73 -3.84 115.26 111.46 2q3u n ASN 227 Ca 0.04 -3.74 -0.40 0.00 -0.60 0.00 0.00 54.58 49.88 2q3u n ASN 227 Cb 0.09 -0.70 -0.05 0.00 -0.53 0.00 0.00 39.78 38.59 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 -4.01 3.77 -0.01 0.00 0.08 -1.26 0.21 117.98 116.75 2q3u s PHE 231 Ca 0.22 1.63 -0.04 0.00 0.12 0.00 0.00 56.93 58.86 2q3u s PHE 231 Cb 0.04 -2.94 -0.28 0.00 -0.57 0.00 0.00 43.02 39.27 2q3u s PHE 231 CO 0.03 0.23 0.82 0.00 -0.10 0.00 0.00 175.22 176.20 2q3u h ALA 232 N 5.67 0.27 -1.89 5.36 0.00 -1.56 -3.46 119.26 123.66 2q3u h ALA 232 Ca -0.43 -1.13 0.18 0.00 0.00 0.00 0.00 54.91 53.53 2q3u h ALA 232 Cb 1.21 0.32 -0.17 0.00 0.00 0.00 0.00 17.79 19.15 2q3u h ALA 232 CO 0.71 1.13 0.65 -0.98 0.00 0.00 0.00 179.25 180.77 2q3u s ARG 233 N -2.61 0.57 0.19 0.00 1.70 -1.21 -5.03 118.95 112.55 2q3u s ARG 233 Ca -0.10 -0.21 -0.32 0.00 -0.47 0.00 0.00 55.73 54.63 2q3u s ARG 233 Cb 0.07 0.26 -0.15 0.00 -0.57 0.00 0.00 34.95 34.56 2q3u s ARG 233 CO 0.85 -0.25 1.21 -2.30 -1.08 0.00 0.00 175.30 173.73 2q3u n PRO 234 N -0.17 1.33 0.00 3.89 -0.02 -1.26 -1.05 135.00 137.72 2q3u n PRO 234 Ca -0.04 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2q3u n PRO 234 Cb 0.60 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 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 2.03 1.57 2.87 -1.23 0.00 -1.26 -5.02 105.19 104.16 2q3u n GLY 235 Ca 0.14 0.00 -0.14 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 -2.51 0.14 0.22 1.61 1.01 -0.22 -1.42 120.40 119.23 2q3u s VAL 236 Ca 0.00 -0.02 0.11 0.00 0.00 0.00 0.00 61.98 62.07 2q3u s VAL 236 Cb 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 36.38 36.18 2q3u s VAL 236 CO 0.00 0.07 -0.21 0.68 0.00 0.00 0.00 175.10 175.63 2q3u s VAL 237 N 0.26 2.30 -0.32 2.92 -7.23 -0.85 -1.48 120.40 116.01 2q3u s VAL 237 Ca -0.02 -2.17 -0.05 0.00 -1.81 0.00 0.00 61.98 57.93 2q3u s VAL 237 Cb -0.04 -2.15 0.04 0.00 0.56 0.00 0.00 36.38 34.78 2q3u s VAL 237 CO -0.01 -0.28 0.06 -0.76 -0.31 0.00 0.00 175.10 173.81 2q3u s LEU 238 N -3.02 4.12 -0.17 1.32 1.43 0.55 -1.79 118.68 121.11 2q3u s LEU 238 Ca 0.24 -1.15 -0.04 0.00 -1.03 0.00 0.00 54.13 52.15 2q3u s LEU 238 Cb -0.06 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.32 2q3u s LEU 238 CO 0.11 -0.29 -0.03 -0.22 0.23 0.00 0.00 176.35 176.15 2q3u s LEU 239 N 1.36 3.22 0.28 1.79 2.96 -1.10 -0.70 118.68 126.50 2q3u s LEU 239 Ca -0.03 -0.17 -0.26 0.00 -0.22 0.00 0.00 54.13 53.45 2q3u s LEU 239 Cb -0.19 -1.79 -0.15 0.00 0.50 0.00 0.00 46.19 44.55 2q3u s LEU 239 CO 0.01 0.12 0.58 -0.24 -1.32 0.00 0.00 176.35 175.50 2q3u n SER 240 N 3.84 -0.84 -3.56 3.68 2.88 -1.26 -0.88 113.62 117.49 2q3u n SER 240 Ca -0.17 1.06 -0.17 0.00 -1.33 0.00 0.00 58.87 58.26 2q3u n SER 240 Cb 0.52 -1.04 -0.06 0.00 -0.75 0.00 0.00 64.21 62.87 2q3u n SER 240 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 2q3u s TRP 241 N -1.18 -0.58 0.06 0.66 -0.11 -1.15 -4.65 118.94 112.00 2q3u s TRP 241 Ca 0.62 1.01 -0.04 0.00 1.22 0.00 0.00 56.10 58.91 2q3u s TRP 241 Cb -0.79 0.35 -0.02 0.00 -1.50 0.00 0.00 33.47 31.51 2q3u s TRP 241 CO 0.58 -0.57 0.06 -0.08 -4.62 0.00 0.00 176.95 172.32 2q3u s THR 242 N -1.17 0.18 -0.43 5.86 -1.32 -1.26 -1.39 115.64 116.12 2q3u s THR 242 Ca -0.11 -1.51 0.18 0.00 -1.21 0.00 0.00 61.69 59.04 2q3u s THR 242 Cb -0.01 -1.37 -0.24 0.00 -1.51 0.00 0.00 72.50 69.38 2q3u s THR 242 CO 0.09 -0.83 0.57 0.47 -2.21 0.00 0.00 174.62 172.71 2q3u n ASP 243 N 0.15 0.84 -4.57 8.08 8.00 -1.26 -4.84 116.55 122.95 2q3u n ASP 243 Ca -0.15 -0.46 -0.41 0.00 0.71 0.00 0.00 54.79 54.49 2q3u n ASP 243 Cb 0.61 1.42 -0.03 0.00 -0.02 0.00 0.00 41.12 43.10 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 -3.38 5.79 0.00 -2.24 2.15 -1.26 -4.87 116.67 112.86 2q3u s ASP 244 Ca -0.00 0.43 0.17 0.00 0.43 0.00 0.00 52.55 53.59 2q3u s ASP 244 Cb 0.12 -2.54 0.98 0.00 -0.30 0.00 0.00 42.92 41.19 2q3u s ASP 244 CO 0.74 -1.95 1.48 -0.62 -0.17 0.00 0.00 175.17 174.65 2q3u n GLU 245 N 8.84 0.43 0.00 4.34 1.02 -1.26 -1.37 120.64 132.65 2q3u n GLU 245 Ca 0.16 0.05 0.14 0.00 -0.02 0.00 0.00 57.16 57.49 2q3u n GLU 245 Cb 0.50 -1.50 0.46 0.00 -0.02 0.00 0.00 31.44 30.88 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 -1.11 0.00 -3.58 2.62 -2.24 -1.26 -4.82 114.28 103.88 2q3u n THR 246 Ca 0.11 -0.21 -0.37 0.00 -2.27 0.00 0.00 64.05 61.31 2q3u n THR 246 Cb 0.09 0.48 -0.06 0.00 -2.10 0.00 0.00 70.33 68.74 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 6.56 0.66 3.42 -1.08 -0.47 -4.95 116.67 118.63 2q3u s ASP 247 Ca 0.33 0.66 0.37 0.00 -0.52 0.00 0.00 52.55 53.38 2q3u s ASP 247 Cb 0.20 -2.19 2.00 0.00 -1.46 0.00 0.00 42.92 41.48 2q3u s ASP 247 CO 0.40 0.22 2.14 -0.65 0.52 0.00 0.00 175.17 177.80 2q3u h PRO 248 N 5.75 0.00 0.00 4.34 0.11 -1.87 -0.12 132.00 140.21 2q3u h PRO 248 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2q3u h PRO 248 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2q3u h PRO 248 CO 0.68 0.00 0.00 0.94 -0.21 0.00 0.00 178.00 179.41 2q3u n GLN 249 N -3.01 0.01 -0.03 1.05 -0.06 -1.26 -4.01 117.38 110.07 2q3u n GLN 249 Ca -0.02 0.08 -0.15 0.00 -2.00 0.00 0.00 57.00 54.91 2q3u n GLN 249 Cb 0.24 -1.51 -0.10 0.00 -4.06 0.00 0.00 30.24 24.81 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 0.44 0.00 3.69 5.03 -1.23 -1.41 116.97 123.50 2q3u h TYR 250 Ca 0.00 -0.20 -0.01 0.00 2.58 0.00 0.00 58.73 61.10 2q3u h TYR 250 Cb 0.43 -0.07 -0.00 0.00 1.55 0.00 0.00 36.73 38.65 2q3u h TYR 250 CO 0.00 0.96 -0.05 1.05 -1.32 0.00 0.00 178.16 178.80 2q3u h GLU 251 N -0.20 0.00 0.09 1.82 4.11 -1.76 0.11 114.58 118.75 2q3u h GLU 251 Ca -0.03 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.23 2q3u h GLU 251 Cb 1.01 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.28 2q3u h GLU 251 CO 0.07 0.05 -0.71 0.00 0.07 0.00 0.00 179.01 178.49 2q3u h ARG 252 N 0.00 0.33 -0.50 1.06 3.08 -1.68 -2.30 114.38 114.37 2q3u h ARG 252 Ca -0.00 -0.47 -0.03 0.00 0.07 0.00 0.00 59.98 59.55 2q3u h ARG 252 Cb 0.14 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 2q3u h ARG 252 CO 0.01 1.18 0.20 0.77 -1.07 0.00 0.00 179.97 181.06 2q3u h SER 253 N -0.29 0.69 -0.42 7.04 0.02 -0.55 -0.76 113.55 119.29 2q3u h SER 253 Ca -0.11 -0.17 -0.08 0.00 -0.84 0.00 0.00 61.79 60.59 2q3u h SER 253 Cb 1.50 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.84 2q3u h SER 253 CO 0.14 0.67 -0.02 0.58 -1.14 0.00 0.00 176.83 177.05 2q3u h VAL 254 N 0.67 1.25 -0.63 2.27 2.07 -0.82 0.13 116.25 121.18 2q3u h VAL 254 Ca 0.17 -1.06 -0.03 0.00 0.82 0.00 0.00 66.70 66.60 2q3u h VAL 254 Cb 0.19 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 2q3u h VAL 254 CO -0.01 0.37 0.28 -0.08 0.02 0.00 0.00 177.57 178.14 2q3u h GLU 255 N 0.76 0.93 0.08 1.57 4.81 -1.20 -1.39 114.58 120.14 2q3u h GLU 255 Ca 0.14 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2q3u h GLU 255 Cb 0.49 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.72 2q3u h GLU 255 CO 0.02 0.77 -0.04 0.00 -0.73 0.00 0.00 179.01 179.03 2q3u h ALA 256 N 1.12 -0.10 -0.88 2.92 0.00 -0.74 -2.16 119.26 119.41 2q3u h ALA 256 Ca 0.21 -0.10 0.17 0.00 0.00 0.00 0.00 54.91 55.20 2q3u h ALA 256 Cb 0.17 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 17.93 2q3u h ALA 256 CO -0.02 -0.48 0.57 1.25 0.00 0.00 0.00 179.25 180.58 2q3u h LEU 257 N -0.26 0.51 0.01 0.00 5.85 -0.45 -1.74 115.31 119.22 2q3u h LEU 257 Ca -0.01 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 2q3u h LEU 257 Cb 0.22 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.20 2q3u h LEU 257 CO 0.02 0.23 -0.00 -1.28 -0.34 0.00 0.00 178.44 177.07 2q3u h SER 258 N 0.53 -0.01 0.31 1.25 0.87 -0.95 -1.80 113.55 113.75 2q3u h SER 258 Ca 0.45 -0.33 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 2q3u h SER 258 Cb 0.95 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.88 2q3u h SER 258 CO -0.19 0.32 -0.38 0.58 -0.53 0.00 0.00 176.83 176.63 2q3u h VAL 259 N -0.34 0.22 -0.61 2.23 2.07 -0.84 -2.85 116.25 116.13 2q3u h VAL 259 Ca -0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.61 2q3u h VAL 259 Cb 0.34 0.22 -0.07 0.00 -1.52 0.00 0.00 31.29 30.26 2q3u h VAL 259 CO 0.00 0.00 0.24 -0.07 0.02 0.00 0.00 177.57 177.76 2q3u h LEU 260 N -0.74 0.26 -1.52 2.57 3.38 -1.34 -1.29 115.31 116.63 2q3u h LEU 260 Ca -0.01 0.07 0.18 0.00 0.09 0.00 0.00 57.88 58.21 2q3u h LEU 260 Cb 0.69 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.42 2q3u h LEU 260 CO -0.11 0.16 0.56 0.28 0.09 0.00 0.00 178.44 179.42 2q3u h SER 261 N 0.44 0.42 -0.98 -0.43 0.02 -1.10 -0.60 113.55 111.32 2q3u h SER 261 Ca 0.30 0.03 -0.65 0.00 -0.84 0.00 0.00 61.79 60.63 2q3u h SER 261 Cb 0.36 -0.05 -0.30 0.00 0.14 0.00 0.00 62.40 62.55 2q3u h SER 261 CO -0.29 0.19 0.76 0.59 -1.14 0.00 0.00 176.83 176.94 2q3u n ASN 262 N -4.50 7.16 -4.32 3.07 3.02 -0.51 -4.75 115.26 114.44 2q3u n ASN 262 Ca 0.17 -3.77 -0.27 0.00 -0.03 0.00 0.00 54.58 50.68 2q3u n ASN 262 Cb 0.62 -0.93 -0.14 0.00 -0.61 0.00 0.00 39.78 38.72 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 -1.88 2.90 -0.02 6.41 0.01 -0.23 -4.98 113.70 115.91 2q3u s SER 263 Ca 0.63 -0.64 0.06 0.00 1.31 0.00 0.00 55.95 57.31 2q3u s SER 263 Cb 0.50 -0.21 -0.01 0.00 0.21 0.00 0.00 66.02 66.50 2q3u s SER 263 CO 0.00 0.17 -0.21 -0.63 0.41 0.00 0.00 173.24 172.98 2q3u s ILE 264 N -0.96 1.70 0.20 1.44 1.01 -1.26 -2.68 121.20 120.65 2q3u s ILE 264 Ca 0.10 -0.91 -0.01 0.00 0.00 0.00 0.00 60.65 59.84 2q3u s ILE 264 Cb -0.10 -1.42 0.04 0.00 0.01 0.00 0.00 42.46 41.00 2q3u s ILE 264 CO 0.04 0.48 0.27 -0.90 0.00 0.00 0.00 174.94 174.83 2q3u n ASP 265 N 2.67 0.28 0.02 3.58 5.68 -0.83 -4.91 116.55 123.06 2q3u n ASP 265 Ca -0.16 -1.26 0.07 0.00 -0.50 0.00 0.00 54.79 52.95 2q3u n ASP 265 Cb 0.53 -0.18 0.32 0.00 -1.14 0.00 0.00 41.12 40.64 2q3u n ASP 265 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2q3u n ALA 266 N -3.02 1.61 0.09 2.12 0.00 -1.26 -1.93 120.51 118.12 2q3u n ALA 266 Ca -0.04 -0.02 0.06 0.00 0.00 0.00 0.00 53.44 53.44 2q3u n ALA 266 Cb 0.15 -1.25 0.12 0.00 0.00 0.00 0.00 19.45 18.48 2q3u n ALA 266 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2q3u n ARG 267 N -1.63 2.00 -0.63 0.00 1.74 -1.26 -4.99 116.66 111.89 2q3u n ARG 267 Ca 0.03 -1.77 0.00 0.00 -0.77 0.00 0.00 57.85 55.34 2q3u n ARG 267 Cb 0.17 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 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 0.67 0.64 3.84 -0.13 0.00 -0.81 -5.06 105.19 104.34 2q3u n GLY 268 Ca 0.11 -0.38 -0.37 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.86 3.94 -0.11 1.61 0.52 -1.26 -4.84 118.95 117.94 2q3u s ARG 269 Ca 0.00 0.42 -0.30 0.00 -0.52 0.00 0.00 55.73 55.34 2q3u s ARG 269 Cb 0.00 -3.11 -0.01 0.00 0.52 0.00 0.00 34.95 32.35 2q3u s ARG 269 CO 0.00 0.61 1.08 0.15 0.02 0.00 0.00 175.30 177.16 2q3u s LYS 270 N -1.47 4.37 0.16 3.54 1.02 -1.26 -1.96 119.74 124.14 2q3u s LYS 270 Ca 0.30 1.48 -0.32 0.00 0.02 0.00 0.00 55.97 57.46 2q3u s LYS 270 Cb -0.16 -3.57 -0.11 0.00 -0.52 0.00 0.00 37.83 33.47 2q3u s LYS 270 CO 0.17 -0.42 1.67 0.42 -0.92 0.00 0.00 175.35 176.26 2q3u s ILE 271 N 2.33 2.45 -0.14 2.17 -1.09 -1.09 -4.96 121.20 120.87 2q3u s ILE 271 Ca 0.50 0.24 -0.10 0.00 -2.23 0.00 0.00 60.65 59.06 2q3u s ILE 271 Cb -0.20 -3.16 -0.05 0.00 -1.58 0.00 0.00 42.46 37.48 2q3u s ILE 271 CO 0.17 0.01 0.20 -1.58 -1.23 0.00 0.00 174.94 172.52 2q3u s GLN 272 N 1.58 3.88 -0.17 2.79 0.74 -0.50 -4.63 119.66 123.35 2q3u s GLN 272 Ca 0.74 -0.04 -0.05 0.00 0.05 0.00 0.00 55.36 56.05 2q3u s GLN 272 Cb -0.46 -3.31 -0.03 0.00 1.10 0.00 0.00 33.01 30.31 2q3u s GLN 272 CO 0.32 0.52 -0.00 0.08 -0.55 0.00 0.00 175.29 175.66 2q3u s VAL 273 N -0.33 4.19 -0.21 1.34 1.01 -1.26 -2.01 120.40 123.13 2q3u s VAL 273 Ca 0.14 -0.25 -0.07 0.00 0.00 0.00 0.00 61.98 61.81 2q3u s VAL 273 Cb -0.12 -2.86 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 2q3u s VAL 273 CO 0.03 0.47 0.05 -0.63 0.00 0.00 0.00 175.10 175.03 2q3u s ILE 274 N 0.44 4.43 0.46 2.22 1.01 -0.74 -4.99 121.20 124.03 2q3u s ILE 274 Ca -0.01 -0.15 -0.21 0.00 0.00 0.00 0.00 60.65 60.28 2q3u s ILE 274 Cb -0.14 -3.03 -0.08 0.00 0.01 0.00 0.00 42.46 39.22 2q3u s ILE 274 CO 0.02 0.40 1.05 -0.54 0.00 0.00 0.00 174.94 175.87 2q3u s LYS 275 N 1.02 3.88 -0.42 2.79 1.02 -1.26 -2.70 119.74 124.07 2q3u s LYS 275 Ca 0.04 1.42 0.04 0.00 0.02 0.00 0.00 55.97 57.49 2q3u s LYS 275 Cb -0.14 -2.22 0.17 0.00 -0.52 0.00 0.00 37.83 35.12 2q3u s LYS 275 CO 0.03 -0.37 0.37 -1.17 -0.92 0.00 0.00 175.35 173.28 2q3u s LEU 276 N -3.26 1.17 0.18 3.17 2.96 -0.05 -4.91 118.68 117.93 2q3u s LEU 276 Ca 0.65 -2.95 -0.22 0.00 -0.22 0.00 0.00 54.13 51.39 2q3u s LEU 276 Cb -0.18 -0.25 -0.14 0.00 0.50 0.00 0.00 46.19 46.12 2q3u s LEU 276 CO 0.23 -0.16 0.39 -1.22 -1.32 0.00 0.00 176.35 174.26 2q3u n TYR 277 N 2.87 -0.51 -2.29 5.38 4.01 -1.22 -2.92 117.16 122.48 2q3u n TYR 277 Ca 0.29 0.75 -0.26 0.00 -0.16 0.00 0.00 57.90 58.52 2q3u n TYR 277 Cb 0.48 -1.56 0.05 0.00 -0.31 0.00 0.00 39.34 38.00 2q3u n TYR 277 CO 0.00 0.00 0.00 0.96 -0.46 0.00 0.00 176.86 177.36 2q3u s ILE 278 N -0.85 2.80 1.06 -0.72 -4.36 -0.48 -4.66 121.20 113.98 2q3u s ILE 278 Ca 0.51 -0.19 -0.16 0.00 -0.26 0.00 0.00 60.65 60.56 2q3u s ILE 278 Cb -0.73 -3.17 0.22 0.00 1.25 0.00 0.00 42.46 40.03 2q3u s ILE 278 CO 0.46 -0.17 1.15 -2.16 0.24 0.00 0.00 174.94 174.45 2q3u s PRO 279 N -5.13 -0.05 0.70 0.37 0.04 -1.26 -4.94 135.00 124.73 2q3u s PRO 279 Ca 0.58 0.05 -0.16 0.00 0.04 0.00 0.00 61.00 61.50 2q3u s PRO 279 Cb -0.11 -1.72 -0.00 0.00 0.04 0.00 0.00 34.50 32.71 2q3u s PRO 279 CO 0.45 -2.95 0.99 -0.85 0.04 0.00 0.00 177.00 174.67 2q3u n GLU 280 N -4.24 0.61 -1.67 4.56 0.28 -1.26 -4.78 120.64 114.13 2q3u n GLU 280 Ca 0.11 0.26 -0.42 0.00 -0.16 0.00 0.00 57.16 56.94 2q3u n GLU 280 Cb 0.59 -2.24 -0.03 0.00 1.43 0.00 0.00 31.44 31.19 2q3u n GLU 280 CO 0.00 0.00 0.00 -2.14 -0.16 0.00 0.00 177.13 174.83 2q3u s PRO 281 N -3.25 3.80 -0.01 3.44 0.02 -1.26 -4.94 135.00 132.79 2q3u s PRO 281 Ca 0.75 2.39 -0.15 0.00 0.02 0.00 0.00 61.00 64.00 2q3u s PRO 281 Cb -0.36 -4.23 -0.06 0.00 0.02 0.00 0.00 34.50 29.88 2q3u s PRO 281 CO 0.49 -1.35 0.43 -0.51 -0.33 0.00 0.00 177.00 175.73 2q3u s LEU 282 N 5.76 4.45 0.00 -5.54 1.43 -1.26 -5.03 118.68 118.49 2q3u s LEU 282 Ca 0.92 0.96 0.00 0.00 -1.03 0.00 0.00 54.13 54.98 2q3u s LEU 282 Cb -0.39 -2.62 0.00 0.00 0.03 0.00 0.00 46.19 43.21 2q3u s LEU 282 CO 0.39 0.28 0.00 -1.22 0.23 0.00 0.00 176.35 176.03 2q3u n TYR 283 N 2.07 0.00 -4.34 0.29 4.02 -1.26 -1.06 117.16 116.88 2q3u n TYR 283 Ca -0.13 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.56 2q3u n TYR 283 Cb 0.52 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.76 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 2.00 0.18 0.03 -0.72 -4.23 -1.26 -4.83 115.64 106.82 2q3u s THR 285 Ca 0.00 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.60 2q3u s THR 285 Cb 0.00 -2.46 -0.13 0.00 1.34 0.00 0.00 72.50 71.25 2q3u s THR 285 CO 0.00 0.00 1.32 -0.08 -0.54 0.00 0.00 174.62 175.32 2q3u h GLU 286 N 2.11 0.00 -0.59 3.99 4.57 -1.98 -2.57 114.58 120.11 2q3u h GLU 286 Ca -0.29 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 57.83 2q3u h GLU 286 Cb 1.25 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.81 2q3u h GLU 286 CO 0.45 0.84 0.16 1.49 -1.18 0.00 0.00 179.01 180.77 2q3u h GLU 287 N 0.00 0.91 -0.02 1.92 4.81 -2.02 0.16 114.58 120.34 2q3u h GLU 287 Ca -0.01 -0.19 -0.04 0.00 -0.13 0.00 0.00 59.36 58.99 2q3u h GLU 287 Cb 1.65 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.90 2q3u h GLU 287 CO 0.11 0.80 -0.15 0.93 -0.73 0.00 0.00 179.01 179.97 2q3u h GLU 288 N 0.88 0.13 -0.23 1.92 5.08 -2.02 -3.24 114.58 117.09 2q3u h GLU 288 Ca 0.19 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.37 2q3u h GLU 288 Cb 0.29 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 2q3u h GLU 288 CO -0.00 0.82 -0.13 1.03 -1.00 0.00 0.00 179.01 179.72 2q3u h SER 289 N -0.52 0.36 0.00 1.42 0.87 -1.33 -2.33 113.55 112.02 2q3u h SER 289 Ca -0.01 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2q3u h SER 289 Cb 0.86 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.72 2q3u h SER 289 CO 0.03 0.53 0.00 -1.54 -0.53 0.00 0.00 176.83 175.32 2q3u n SER 290 N -4.23 0.00 -1.16 6.23 3.41 0.54 -2.34 113.62 116.08 2q3u n SER 290 Ca 0.00 -0.66 0.10 0.00 -0.26 0.00 0.00 58.87 58.04 2q3u n SER 290 Cb 0.30 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.53 2q3u n SER 290 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2q3u n GLY 291 N -0.00 2.63 3.57 5.00 0.00 -0.88 -5.01 105.19 110.50 2q3u n GLY 291 Ca 0.08 -0.68 -0.29 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.09 3.32 0.16 -0.61 1.01 -0.99 -1.18 121.20 121.82 2q3u s ILE 292 Ca 0.42 -1.32 -0.30 0.00 0.00 0.00 0.00 60.65 59.45 2q3u s ILE 292 Cb 0.22 -2.56 -0.07 0.00 0.01 0.00 0.00 42.46 40.06 2q3u s ILE 292 CO 0.27 0.09 0.94 -0.89 0.00 0.00 0.00 174.94 175.36 2q3u s THR 293 N -1.25 4.32 -0.33 2.92 2.01 -1.14 -5.05 115.64 117.13 2q3u s THR 293 Ca 0.21 2.06 -0.00 0.00 0.31 0.00 0.00 61.69 64.28 2q3u s THR 293 Cb -0.11 -4.32 0.10 0.00 0.01 0.00 0.00 72.50 68.19 2q3u s THR 293 CO 0.14 0.40 0.11 -1.10 -0.69 0.00 0.00 174.62 173.48 2q3u s GLN 294 N -0.52 0.84 0.00 4.92 -0.21 -1.26 -4.73 119.66 118.70 2q3u s GLN 294 Ca 0.44 -1.26 0.00 0.00 0.02 0.00 0.00 55.36 54.56 2q3u s GLN 294 Cb -0.24 -2.13 0.00 0.00 1.00 0.00 0.00 33.01 31.64 2q3u s GLN 294 CO 0.31 -1.01 0.00 -0.40 -2.12 0.00 0.00 175.29 172.07 2q3u n ASP 295 N 4.63 1.65 0.00 5.90 5.68 -1.26 -5.10 116.55 128.05 2q3u n ASP 295 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 2q3u n ASP 295 Cb 0.41 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.39 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 2.33 -0.35 0.06 6.12 0.00 -1.26 -5.07 105.19 107.01 2q3u n GLY 296 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 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 0.00 0.58 -4.33 1.61 -0.58 -1.26 -4.96 120.64 111.70 2q3u n GLU 297 Ca 0.00 0.06 -0.26 0.00 -0.42 0.00 0.00 57.16 56.54 2q3u n GLU 297 Cb 0.00 -1.26 -0.10 0.00 -0.57 0.00 0.00 31.44 29.52 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 -2.26 2.87 0.35 0.62 0.00 -1.26 -1.34 121.76 120.74 2q3u s ALA 298 Ca -0.16 -1.56 -0.29 0.00 0.00 0.00 0.00 51.96 49.95 2q3u s ALA 298 Cb 0.04 -0.62 -0.11 0.00 0.00 0.00 0.00 23.12 22.43 2q3u s ALA 298 CO 0.31 0.42 1.52 0.44 0.00 0.00 0.00 175.76 178.45 2q3u n ILE 299 N -0.09 1.69 -1.42 0.00 -5.35 -0.90 -4.90 119.36 108.39 2q3u n ILE 299 Ca -0.10 -0.42 -0.43 0.00 -0.27 0.00 0.00 62.75 61.53 2q3u n ILE 299 Cb 0.56 -1.96 -0.00 0.00 -1.74 0.00 0.00 39.64 36.50 2q3u n ILE 299 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 2q3u n PRO 300 N 0.99 0.40 -3.82 6.28 -0.02 -1.26 -4.97 135.00 132.60 2q3u n PRO 300 Ca 0.04 0.15 -0.36 0.00 -2.02 0.00 0.00 63.50 61.30 2q3u n PRO 300 Cb 0.38 -1.32 -0.13 0.00 -0.02 0.00 0.00 33.50 32.41 2q3u n PRO 300 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2q3u s ARG 301 N -1.33 2.32 -0.10 -0.52 1.81 -1.26 -5.10 118.95 114.77 2q3u s ARG 301 Ca 0.62 -1.45 -0.02 0.00 -1.72 0.00 0.00 55.73 53.16 2q3u s ARG 301 Cb -0.69 -3.39 -0.03 0.00 -0.45 0.00 0.00 34.95 30.39 2q3u s ARG 301 CO 0.59 -0.80 -0.01 -0.51 -0.68 0.00 0.00 175.30 173.89 2q3u s LEU 302 N 1.25 3.46 0.43 2.53 1.43 -1.26 -4.95 118.68 121.58 2q3u s LEU 302 Ca 0.01 0.06 -0.26 0.00 -1.03 0.00 0.00 54.13 52.91 2q3u s LEU 302 Cb -0.21 -1.80 -0.09 0.00 0.03 0.00 0.00 46.19 44.13 2q3u s LEU 302 CO -0.01 0.33 1.43 0.00 0.23 0.00 0.00 176.35 178.33 2q3u s ALA 303 N -0.57 3.31 0.00 4.21 0.00 -1.26 -2.97 121.76 124.47 2q3u s ALA 303 Ca 0.09 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.53 2q3u s ALA 303 Cb -0.12 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.41 2q3u s ALA 303 CO 0.02 -1.15 0.00 0.41 0.00 0.00 0.00 175.76 175.04 2q3u n GLY 304 N 0.56 0.63 3.74 0.00 0.00 -1.26 -5.06 105.19 103.80 2q3u n GLY 304 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.22 2.76 0.16 2.61 2.01 -1.16 -4.85 115.64 114.95 2q3u s THR 305 Ca 0.00 0.60 -0.31 0.00 0.31 0.00 0.00 61.69 62.30 2q3u s THR 305 Cb 0.00 -3.39 -0.09 0.00 0.01 0.00 0.00 72.50 69.04 2q3u s THR 305 CO 0.00 0.08 1.43 -0.60 -0.69 0.00 0.00 174.62 174.84 2q3u s ARG 306 N 0.12 4.30 0.18 4.92 6.06 -1.26 -4.23 118.95 129.04 2q3u s ARG 306 Ca 0.62 2.18 -0.14 0.00 -2.50 0.00 0.00 55.73 55.88 2q3u s ARG 306 Cb -0.41 -3.20 -0.07 0.00 0.06 0.00 0.00 34.95 31.33 2q3u s ARG 306 CO 0.39 -0.45 0.58 -0.51 -2.50 0.00 0.00 175.30 172.81 2q3u s LEU 307 N 0.71 4.30 -1.14 -0.88 1.43 -0.22 -4.79 118.68 118.08 2q3u s LEU 307 Ca 0.64 1.11 -0.13 0.00 -1.03 0.00 0.00 54.13 54.71 2q3u s LEU 307 Cb -0.39 -3.41 0.19 0.00 0.03 0.00 0.00 46.19 42.61 2q3u s LEU 307 CO 0.34 0.05 1.30 0.00 0.23 0.00 0.00 176.35 178.27 2q3u s ALA 308 N -1.55 4.11 -0.23 4.21 0.00 -1.26 -4.65 121.76 122.40 2q3u s ALA 308 Ca 0.41 -3.41 -0.08 0.00 0.00 0.00 0.00 51.96 48.87 2q3u s ALA 308 Cb -0.14 -3.97 -0.04 0.00 0.00 0.00 0.00 23.12 18.97 2q3u s ALA 308 CO 0.20 -2.64 0.10 0.00 0.00 0.00 0.00 175.76 173.41 2q3u s ALA 309 N 0.99 3.38 -0.11 0.00 0.00 -1.26 -4.79 121.76 119.97 2q3u s ALA 309 Ca 0.38 -0.94 -0.07 0.00 0.00 0.00 0.00 51.96 51.33 2q3u s ALA 309 Cb -0.05 -2.12 0.04 0.00 0.00 0.00 0.00 23.12 20.99 2q3u s ALA 309 CO -0.03 -0.19 0.27 0.45 0.00 0.00 0.00 175.76 176.26 2q3u s SER 310 N 1.06 -0.29 0.00 0.00 0.15 -1.26 -4.34 113.70 109.03 2q3u s SER 310 Ca 0.05 0.56 0.15 0.00 0.70 0.00 0.00 55.95 57.40 2q3u s SER 310 Cb -0.14 0.50 0.69 0.00 -1.71 0.00 0.00 66.02 65.36 2q3u s SER 310 CO 0.04 -0.13 1.42 -1.22 1.20 0.00 0.00 173.24 174.55 2q3u n TYR 311 N 3.65 0.00 0.27 3.44 4.01 -1.26 -1.46 117.16 125.80 2q3u n TYR 311 Ca -0.19 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.67 2q3u n TYR 311 Cb 0.56 -0.36 0.76 0.00 -0.31 0.00 0.00 39.34 39.98 2q3u n TYR 311 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2q3u h VAL 312 N 0.00 0.65 0.00 -0.72 2.07 -1.86 -3.02 116.25 113.36 2q3u h VAL 312 Ca 0.00 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 2q3u h VAL 312 Cb 0.18 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 2q3u h VAL 312 CO 0.00 0.08 0.03 -3.20 0.02 0.00 0.00 177.57 174.50 2q3u n ASN 313 N -3.84 2.25 -4.91 0.57 5.15 -0.54 -4.84 115.26 109.09 2q3u n ASN 313 Ca -0.02 -1.68 -0.28 0.00 -0.60 0.00 0.00 54.58 52.00 2q3u n ASN 313 Cb 0.18 -0.51 -0.03 0.00 -0.53 0.00 0.00 39.78 38.89 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 1.42 3.49 0.08 1.20 -0.12 -1.14 -1.74 117.98 121.16 2q3u s PHE 314 Ca 0.07 0.60 0.08 0.00 -0.05 0.00 0.00 56.93 57.64 2q3u s PHE 314 Cb 0.04 -2.08 -0.04 0.00 -0.63 0.00 0.00 43.02 40.31 2q3u s PHE 314 CO 0.00 0.13 -0.20 -0.47 -0.05 0.00 0.00 175.22 174.63 2q3u s TYR 315 N -2.18 2.50 -0.21 3.49 5.04 -0.72 -4.60 117.35 120.68 2q3u s TYR 315 Ca 0.43 -0.29 -0.09 0.00 -2.44 0.00 0.00 57.07 54.69 2q3u s TYR 315 Cb -0.10 -1.39 -0.04 0.00 0.35 0.00 0.00 41.96 40.77 2q3u s TYR 315 CO 0.32 0.30 0.11 0.42 -1.34 0.00 0.00 175.55 175.36 2q3u s ILE 316 N -1.01 5.08 0.11 3.14 1.01 -1.26 -0.72 121.20 127.55 2q3u s ILE 316 Ca 0.16 0.08 0.05 0.00 0.00 0.00 0.00 60.65 60.93 2q3u s ILE 316 Cb -0.10 -3.32 -0.04 0.00 0.01 0.00 0.00 42.46 39.00 2q3u s ILE 316 CO 0.07 0.42 -0.11 0.00 0.00 0.00 0.00 174.94 175.31 2q3u s ALA 317 N 0.61 1.31 -0.76 9.38 0.00 -0.88 -4.91 121.76 126.50 2q3u s ALA 317 Ca 0.06 -1.28 -0.07 0.00 0.00 0.00 0.00 51.96 50.67 2q3u s ALA 317 Cb -0.12 -0.00 -0.26 0.00 0.00 0.00 0.00 23.12 22.74 2q3u s ALA 317 CO 0.01 -0.00 1.88 0.09 0.00 0.00 0.00 175.76 177.74 2q3u n ASN 318 N 0.41 -1.57 0.00 0.00 3.02 -1.26 -0.32 115.26 115.54 2q3u n ASN 318 Ca -0.15 -0.77 0.00 0.00 -0.03 0.00 0.00 54.58 53.63 2q3u n ASN 318 Cb 0.58 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 2q3u n ASN 318 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2q3u n GLY 319 N 5.27 0.64 3.01 7.41 0.00 -1.26 -4.70 105.19 115.56 2q3u n GLY 319 Ca 0.52 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.64 0.23 -0.28 -0.02 0.00 0.56 -2.22 107.32 102.95 2q3u s GLY 320 Ca 0.00 -0.59 -0.03 0.00 0.00 0.00 0.00 44.72 44.10 2q3u s GLY 320 CO 0.00 -0.68 0.11 -0.42 0.00 0.00 0.00 173.10 172.11 2q3u s ILE 321 N -1.74 0.26 -0.43 0.90 -1.09 -0.75 -2.06 121.20 116.29 2q3u s ILE 321 Ca -0.13 -0.88 -0.26 0.00 -2.23 0.00 0.00 60.65 57.15 2q3u s ILE 321 Cb -0.08 -1.16 0.02 0.00 -1.58 0.00 0.00 42.46 39.67 2q3u s ILE 321 CO -0.02 -0.63 0.95 -0.63 -1.23 0.00 0.00 174.94 173.38 2q3u s ILE 322 N 1.94 4.48 0.09 2.92 -1.09 0.10 -0.72 121.20 128.92 2q3u s ILE 322 Ca 0.08 0.95 0.10 0.00 -2.23 0.00 0.00 60.65 59.55 2q3u s ILE 322 Cb -0.16 -4.42 -0.03 0.00 -1.58 0.00 0.00 42.46 36.27 2q3u s ILE 322 CO -0.29 -0.75 -0.25 0.00 -1.23 0.00 0.00 174.94 172.42 2q3u s ALA 323 N 3.73 2.20 0.64 9.38 0.00 -0.02 -1.76 121.76 135.93 2q3u s ALA 323 Ca 0.39 -1.33 -0.13 0.00 0.00 0.00 0.00 51.96 50.89 2q3u s ALA 323 Cb -0.10 -0.40 -0.02 0.00 0.00 0.00 0.00 23.12 22.60 2q3u s ALA 323 CO 0.24 0.50 1.05 -1.25 0.00 0.00 0.00 175.76 176.31 2q3u s PRO 324 N -1.63 3.20 -0.09 0.00 0.04 -1.26 0.11 135.00 135.36 2q3u s PRO 324 Ca 0.12 1.05 0.02 0.00 0.04 0.00 0.00 61.00 62.22 2q3u s PRO 324 Cb -0.10 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.43 2q3u s PRO 324 CO 0.04 -0.90 -0.14 -0.65 0.04 0.00 0.00 177.00 175.39 2q3u s GLN 325 N -4.58 2.03 -0.29 4.56 -1.52 -0.91 -4.59 119.66 114.36 2q3u s GLN 325 Ca 0.60 -0.50 0.10 0.00 -1.95 0.00 0.00 55.36 53.61 2q3u s GLN 325 Cb -0.14 -1.72 0.54 0.00 -0.22 0.00 0.00 33.01 31.47 2q3u s GLN 325 CO 0.46 -0.03 1.52 1.19 -0.25 0.00 0.00 175.29 178.17 2q3u n PHE 326 N 4.09 1.32 -0.51 0.91 3.01 -1.26 -3.21 117.46 121.80 2q3u n PHE 326 Ca -0.20 -1.48 0.00 0.00 1.01 0.00 0.00 57.45 56.78 2q3u n PHE 326 Cb 0.51 -0.51 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 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 -0.98 0.88 3.64 1.37 0.00 -1.26 -4.88 105.19 103.96 2q3u n GLY 327 Ca 0.34 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.71 6.94 0.23 1.61 3.68 -1.26 -4.91 116.67 120.25 2q3u s ASP 328 Ca 0.00 1.18 0.03 0.00 2.13 0.00 0.00 52.55 55.89 2q3u s ASP 328 Cb 0.00 -2.54 0.23 0.00 -1.45 0.00 0.00 42.92 39.16 2q3u s ASP 328 CO 0.00 -0.85 1.56 1.55 0.13 0.00 0.00 175.17 177.55 2q3u h PRO 329 N 8.10 0.30 0.00 4.34 0.13 -1.99 -1.65 132.00 141.23 2q3u h PRO 329 Ca -0.21 -0.20 -0.24 0.00 -0.87 0.00 0.00 66.00 64.48 2q3u h PRO 329 Cb 1.07 0.03 -0.04 0.00 0.13 0.00 0.00 31.00 32.19 2q3u h PRO 329 CO 1.02 0.80 -1.24 0.82 -0.23 0.00 0.00 178.00 179.16 2q3u h ILE 330 N 0.23 1.38 0.10 -3.56 2.04 -1.99 -2.65 117.51 113.05 2q3u h ILE 330 Ca -0.00 -3.13 -0.27 0.00 1.00 0.00 0.00 64.86 62.46 2q3u h ILE 330 Cb 1.09 2.68 0.01 0.00 -0.74 0.00 0.00 36.82 39.86 2q3u h ILE 330 CO 0.09 0.79 -1.17 0.03 0.00 0.00 0.00 178.15 177.89 2q3u h ARG 331 N 0.00 0.41 0.01 2.37 2.47 -1.95 -1.29 114.38 116.40 2q3u h ARG 331 Ca -0.11 -0.57 -0.00 0.00 -1.26 0.00 0.00 59.98 58.04 2q3u h ARG 331 Cb 1.85 0.20 0.00 0.00 -1.65 0.00 0.00 29.97 30.36 2q3u h ARG 331 CO 0.11 1.24 -0.00 -0.44 0.56 0.00 0.00 179.97 181.43 2q3u h ASP 332 N 0.17 -0.01 -0.46 7.04 3.32 -1.39 0.67 116.42 125.76 2q3u h ASP 332 Ca -0.14 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 56.83 2q3u h ASP 332 Cb 1.86 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.39 2q3u h ASP 332 CO 0.21 0.04 0.12 0.50 -1.72 0.00 0.00 179.24 178.38 2q3u h LYS 333 N -0.05 0.73 0.00 3.56 3.64 -1.52 0.20 116.57 123.12 2q3u h LYS 333 Ca -0.00 -0.17 -0.10 0.00 -1.27 0.00 0.00 60.65 59.11 2q3u h LYS 333 Cb 0.05 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 2q3u h LYS 333 CO 0.00 0.72 -0.48 1.49 -2.27 0.00 0.00 179.45 178.91 2q3u h GLU 334 N 0.61 0.00 -0.32 1.90 4.57 -0.84 0.42 114.58 120.92 2q3u h GLU 334 Ca 0.15 0.00 -0.15 0.00 -1.18 0.00 0.00 59.36 58.17 2q3u h GLU 334 Cb 0.31 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.90 2q3u h GLU 334 CO -0.00 0.48 -0.39 0.00 -1.18 0.00 0.00 179.01 177.92 2q3u h ALA 335 N 1.52 0.48 -0.35 2.92 0.00 0.72 0.22 119.26 124.77 2q3u h ALA 335 Ca -0.00 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 2q3u h ALA 335 Cb 0.87 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2q3u h ALA 335 CO 0.06 0.58 -0.10 0.82 0.00 0.00 0.00 179.25 180.62 2q3u h ILE 336 N 0.61 1.24 -0.58 0.00 1.08 -0.04 -0.73 117.51 119.09 2q3u h ILE 336 Ca 0.04 -1.04 -0.03 0.00 -0.39 0.00 0.00 64.86 63.45 2q3u h ILE 336 Cb 0.98 1.08 -0.03 0.00 -3.07 0.00 0.00 36.82 35.78 2q3u h ILE 336 CO 0.09 0.35 0.24 -0.09 -0.69 0.00 0.00 178.15 178.05 2q3u h ARG 337 N 0.55 0.86 -0.08 2.37 2.43 0.44 -1.42 114.38 119.53 2q3u h ARG 337 Ca 0.10 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 2q3u h ARG 337 Cb 0.50 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 2q3u h ARG 337 CO 0.03 0.73 0.00 0.28 -1.51 0.00 0.00 179.97 179.50 2q3u h VAL 338 N 0.80 1.25 -0.68 0.20 2.07 -0.34 -1.66 116.25 117.89 2q3u h VAL 338 Ca 0.19 -0.78 0.03 0.00 0.82 0.00 0.00 66.70 66.96 2q3u h VAL 338 Cb 0.18 1.62 -0.04 0.00 -1.52 0.00 0.00 31.29 31.54 2q3u h VAL 338 CO -0.02 0.22 0.45 -0.07 0.02 0.00 0.00 177.57 178.17 2q3u h LEU 339 N -0.14 0.71 -0.58 2.57 3.38 -1.11 -1.29 115.31 118.84 2q3u h LEU 339 Ca 0.02 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 2q3u h LEU 339 Cb 0.34 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2q3u h LEU 339 CO 0.00 0.49 0.22 0.28 0.09 0.00 0.00 178.44 179.53 2q3u h SER 340 N 0.82 0.81 -0.37 -0.43 0.02 -1.01 0.98 113.55 114.38 2q3u h SER 340 Ca 0.27 -0.18 -0.06 0.00 -0.84 0.00 0.00 61.79 60.98 2q3u h SER 340 Cb 0.04 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 2q3u h SER 340 CO -0.07 0.77 -0.01 -0.78 -1.14 0.00 0.00 176.83 175.60 2q3u h ASP 341 N 0.81 0.66 0.14 3.07 1.82 -0.82 -3.04 116.42 119.06 2q3u h ASP 341 Ca 0.19 -0.32 -0.11 0.00 -0.39 0.00 0.00 57.03 56.41 2q3u h ASP 341 Cb 0.22 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.04 2q3u h ASP 341 CO -0.01 0.82 -0.37 0.74 -1.61 0.00 0.00 179.24 178.80 2q3u h THR 342 N 0.49 1.30 -2.27 2.25 2.02 -1.08 -3.32 112.91 112.29 2q3u h THR 342 Ca 0.10 -1.46 -0.60 0.00 0.77 0.00 0.00 66.41 65.22 2q3u h THR 342 Cb 0.49 1.59 -0.42 0.00 -1.74 0.00 0.00 68.15 68.07 2q3u h THR 342 CO 0.02 0.44 -0.65 0.49 0.37 0.00 0.00 175.52 176.20 2q3u n PHE 343 N -4.05 3.14 0.27 3.16 3.01 0.32 -4.93 117.46 118.38 2q3u n PHE 343 Ca -0.01 -4.10 0.15 0.00 1.01 0.00 0.00 57.45 54.50 2q3u n PHE 343 Cb 0.47 -0.53 0.67 0.00 -0.01 0.00 0.00 39.48 40.07 2q3u n PHE 343 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2q3u h PRO 344 N 4.31 0.00 -0.55 -1.08 0.13 -1.64 -2.22 132.00 130.95 2q3u h PRO 344 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2q3u h PRO 344 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 2q3u h PRO 344 CO 0.78 0.07 0.00 0.72 -0.23 0.00 0.00 178.00 179.34 2q3u n HIS 345 N -3.21 0.72 -4.33 1.56 8.25 -1.26 -4.92 115.22 112.03 2q3u n HIS 345 Ca 0.00 -0.36 -0.28 0.00 -0.26 0.00 0.00 57.72 56.82 2q3u n HIS 345 Cb 0.32 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.32 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 -1.28 2.51 -0.44 4.41 3.76 -0.84 -4.93 115.29 118.48 2q3u s HIS 346 Ca 0.39 -0.27 -0.23 0.00 -0.15 0.00 0.00 55.06 54.79 2q3u s HIS 346 Cb 0.20 -1.28 0.02 0.00 1.11 0.00 0.00 32.58 32.64 2q3u s HIS 346 CO 0.27 0.45 0.78 0.45 -0.85 0.00 0.00 174.74 175.84 2q3u s SER 347 N -2.49 6.42 -0.08 1.40 0.15 -0.94 -4.93 113.70 113.23 2q3u s SER 347 Ca 0.21 -0.06 -0.26 0.00 0.70 0.00 0.00 55.95 56.54 2q3u s SER 347 Cb -0.09 -2.38 -0.03 0.00 -1.71 0.00 0.00 66.02 61.80 2q3u s SER 347 CO 0.12 -0.89 0.83 -0.69 1.20 0.00 0.00 173.24 173.81 2q3u s VAL 348 N 3.25 4.94 -0.26 4.45 1.01 -1.26 -1.81 120.40 130.72 2q3u s VAL 348 Ca 0.30 1.71 0.02 0.00 0.00 0.00 0.00 61.98 64.01 2q3u s VAL 348 Cb -0.12 -4.16 0.06 0.00 0.00 0.00 0.00 36.38 32.16 2q3u s VAL 348 CO 0.22 0.15 -0.08 -0.69 0.00 0.00 0.00 175.10 174.70 2q3u s VAL 349 N 1.28 1.97 0.01 2.92 1.01 0.10 -4.96 120.40 122.74 2q3u s VAL 349 Ca 0.42 -1.57 -0.26 0.00 0.00 0.00 0.00 61.98 60.58 2q3u s VAL 349 Cb -0.18 -2.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.99 2q3u s VAL 349 CO 0.19 -0.11 0.79 -0.83 0.00 0.00 0.00 175.10 175.15 2q3u s GLY 350 N 1.18 2.77 -0.32 4.51 0.00 -1.26 -0.84 107.32 113.37 2q3u s GLY 350 Ca -0.06 0.30 -0.16 0.00 0.00 0.00 0.00 44.72 44.80 2q3u s GLY 350 CO -0.06 1.23 0.41 -0.42 0.00 0.00 0.00 173.10 174.26 2q3u s ILE 351 N 0.36 5.13 0.57 0.90 -1.09 0.29 -4.88 121.20 122.48 2q3u s ILE 351 Ca 0.41 0.31 -0.19 0.00 -2.23 0.00 0.00 60.65 58.95 2q3u s ILE 351 Cb -0.20 -3.82 -0.04 0.00 -1.58 0.00 0.00 42.46 36.82 2q3u s ILE 351 CO 0.23 -0.04 1.14 -1.61 -1.23 0.00 0.00 174.94 173.43 2q3u s GLU 352 N 2.13 3.19 -1.66 2.79 0.41 -1.26 -2.14 118.70 122.16 2q3u s GLU 352 Ca 0.15 1.61 0.00 0.00 -0.41 0.00 0.00 54.97 56.32 2q3u s GLU 352 Cb -0.16 -1.98 0.00 0.00 -1.78 0.00 0.00 34.13 30.21 2q3u s GLU 352 CO 0.11 -0.98 0.00 0.09 -0.49 0.00 0.00 175.26 173.99 2q3u n ASN 353 N -1.54 -5.15 0.24 -0.19 5.03 -1.26 -4.85 115.26 107.54 2q3u n ASN 353 Ca 0.12 0.17 0.16 0.00 0.87 0.00 0.00 54.58 55.90 2q3u n ASN 353 Cb 0.51 -4.22 0.79 0.00 -1.02 0.00 0.00 39.78 35.84 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 0.50 1.00 -0.08 5.41 0.00 -1.51 0.14 119.26 124.72 2q3u h ALA 354 Ca -0.40 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.54 2q3u h ALA 354 Cb 1.25 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 2q3u h ALA 354 CO 0.51 0.00 0.08 -0.09 0.00 0.00 0.00 179.25 179.75 2q3u h ARG 355 N 0.00 0.00 0.00 0.00 2.43 -1.89 -1.85 114.38 113.07 2q3u h ARG 355 Ca 0.00 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2q3u h ARG 355 Cb 0.20 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2q3u h ARG 355 CO 0.00 0.00 -0.09 0.93 -1.51 0.00 0.00 179.97 179.30 2q3u h GLU 356 N 0.00 0.00 0.15 0.20 4.39 -1.34 -2.29 114.58 115.69 2q3u h GLU 356 Ca 0.04 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.47 2q3u h GLU 356 Cb 0.20 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 28.88 2q3u h GLU 356 CO -0.00 0.09 -1.16 0.82 -1.16 0.00 0.00 179.01 177.60 2q3u h ILE 357 N 0.00 1.34 0.00 3.13 2.04 -1.52 -3.31 117.51 119.20 2q3u h ILE 357 Ca -0.00 -2.49 -0.00 0.00 1.00 0.00 0.00 64.86 63.36 2q3u h ILE 357 Cb 0.21 2.87 -0.00 0.00 -0.74 0.00 0.00 36.82 39.16 2q3u h ILE 357 CO 0.01 0.74 -0.00 1.62 0.00 0.00 0.00 178.15 180.52 2q3u h VAL 358 N 0.08 0.45 -0.33 1.67 3.04 -0.87 -1.93 116.25 118.36 2q3u h VAL 358 Ca -0.19 -0.02 0.02 0.00 -1.01 0.00 0.00 66.70 65.51 2q3u h VAL 358 Cb 1.87 1.01 -0.02 0.00 -2.01 0.00 0.00 31.29 32.15 2q3u h VAL 358 CO 0.22 0.00 0.22 -0.07 -1.01 0.00 0.00 177.57 176.93 2q3u h LEU 359 N 0.00 0.31 -1.86 3.16 3.38 -1.54 -0.65 115.31 118.10 2q3u h LEU 359 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2q3u h LEU 359 Cb 0.01 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2q3u h LEU 359 CO 0.00 0.21 0.00 0.00 0.09 0.00 0.00 178.44 178.74 2q3u n ALA 360 N -2.51 2.47 0.00 1.53 0.00 -0.74 -4.98 120.51 116.28 2q3u n ALA 360 Ca 0.03 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.71 2q3u n ALA 360 Cb 0.14 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 18.67 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 1.36 1.11 0.00 0.00 0.00 -0.25 -5.11 105.19 102.30 2q3u n GLY 361 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.57 2.94 0.00 -0.02 0.00 -1.21 -4.95 105.19 101.38 2q3u n GLY 362 Ca 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.20 0.00 -0.32 1.61 4.05 -1.26 -2.11 115.26 117.03 2q3u n ASN 363 Ca 0.00 0.00 0.15 0.00 0.45 0.00 0.00 54.58 55.18 2q3u n ASN 363 Cb 0.00 0.00 0.38 0.00 1.23 0.00 0.00 39.78 41.39 2q3u n ASN 363 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 2q3u h ILE 364 N 0.00 0.70 -0.17 -1.44 2.04 -1.92 0.33 117.51 117.05 2q3u h ILE 364 Ca 0.00 -0.22 -0.10 0.00 1.00 0.00 0.00 64.86 65.53 2q3u h ILE 364 Cb 0.00 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.06 2q3u h ILE 364 CO 0.00 0.12 -0.34 -0.74 0.00 0.00 0.00 178.15 177.18 2q3u h HIS 365 N 0.66 0.42 0.00 1.37 2.76 -1.59 -1.18 115.15 117.58 2q3u h HIS 365 Ca 0.54 -0.10 0.00 0.00 -2.20 0.00 0.00 60.37 58.61 2q3u h HIS 365 Cb 0.99 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.85 2q3u h HIS 365 CO -0.00 0.67 0.00 0.00 -1.30 0.00 0.00 177.93 177.29 2q3u n ILE 367 N -1.97 2.03 -4.32 0.00 -5.35 -0.46 -3.42 119.36 105.88 2q3u n ILE 367 Ca 0.04 -1.72 -0.17 0.00 -0.27 0.00 0.00 62.75 60.64 2q3u n ILE 367 Cb 0.28 -0.11 -0.10 0.00 -1.74 0.00 0.00 39.64 37.97 2q3u n ILE 367 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2q3u s THR 368 N -2.48 1.09 -0.24 7.28 -4.23 -1.14 -4.22 115.64 111.70 2q3u s THR 368 Ca 0.38 -2.04 -0.09 0.00 -1.18 0.00 0.00 61.69 58.76 2q3u s THR 368 Cb 0.30 -2.24 0.11 0.00 1.34 0.00 0.00 72.50 72.00 2q3u s THR 368 CO 0.10 -0.41 0.53 -1.58 -0.54 0.00 0.00 174.62 172.71 2q3u s GLN 369 N -3.83 0.45 0.41 3.99 2.00 -0.92 -2.42 119.66 119.34 2q3u s GLN 369 Ca 0.26 1.22 -0.11 0.00 -2.00 0.00 0.00 55.36 54.72 2q3u s GLN 369 Cb 0.05 0.55 -0.07 0.00 0.80 0.00 0.00 33.01 34.34 2q3u s GLN 369 CO 0.07 -0.22 0.79 1.14 -0.50 0.00 0.00 175.29 176.57 2q3u s GLN 370 N 2.66 3.81 -0.34 1.67 0.00 -1.26 -1.35 119.66 124.85 2q3u s GLN 370 Ca -0.04 0.54 0.02 0.00 -0.00 0.00 0.00 55.36 55.87 2q3u s GLN 370 Cb -0.12 -2.37 0.10 0.00 0.00 0.00 0.00 33.01 30.63 2q3u s GLN 370 CO -0.16 -0.04 0.09 -1.14 0.00 0.00 0.00 175.29 174.04 2q3u s GLN 371 N -3.80 1.16 0.67 9.60 0.74 -0.72 -4.59 119.66 122.73 2q3u s GLN 371 Ca 0.52 -1.57 -0.17 0.00 0.05 0.00 0.00 55.36 54.19 2q3u s GLN 371 Cb -0.10 -2.62 -0.01 0.00 1.10 0.00 0.00 33.01 31.37 2q3u s GLN 371 CO 0.30 -0.98 1.07 -2.30 -0.55 0.00 0.00 175.29 172.82 2q3u n PRO 372 N 4.41 0.77 -0.90 1.67 -0.02 -1.26 -1.56 135.00 138.11 2q3u n PRO 372 Ca 0.02 0.32 -0.33 0.00 -2.02 0.00 0.00 63.50 61.49 2q3u n PRO 372 Cb 0.41 -2.30 0.14 0.00 -0.02 0.00 0.00 33.50 31.73 2q3u n PRO 372 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2q3u n ALA 373 N -2.17 -0.84 -2.71 3.55 0.00 0.94 -4.47 120.51 114.82 2q3u n ALA 373 Ca 0.14 -0.46 -0.40 0.00 0.00 0.00 0.00 53.44 52.72 2q3u n ALA 373 Cb 0.49 -2.13 -0.04 0.00 0.00 0.00 0.00 19.45 17.76 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 -4.16 4.48 0.78 0.00 2.12 -1.26 -4.95 118.70 115.71 2q3u s GLU 374 Ca 0.68 1.06 -0.14 0.00 0.36 0.00 0.00 54.97 56.92 2q3u s GLU 374 Cb -0.26 -3.45 0.06 0.00 0.26 0.00 0.00 34.13 30.74 2q3u s GLU 374 CO 0.57 0.03 1.15 -2.30 -0.54 0.00 0.00 175.26 174.17 2q3u n PRO 375 N 3.81 0.33 0.00 4.30 -0.02 -1.26 -5.02 135.00 137.13 2q3u n PRO 375 Ca 0.01 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 2q3u n PRO 375 Cb 0.51 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 2q3u n PRO 375 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11