#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q3u s GLU 6 N 0.00 4.48 0.64 -0.14 2.02 -1.26 -5.03 118.70 119.42 2q3u s GLU 6 Ca 0.00 1.84 -0.10 0.00 0.02 0.00 0.00 54.97 56.73 2q3u s GLU 6 Cb 0.00 -3.27 -0.01 0.00 0.10 0.00 0.00 34.13 30.96 2q3u s GLU 6 CO 0.00 -0.12 1.02 -1.54 0.02 0.00 0.00 175.26 174.64 2q3u s SER 7 N 0.33 5.77 0.27 -0.19 1.04 -1.26 -4.97 113.70 114.68 2q3u s SER 7 Ca 0.54 1.14 -0.05 0.00 0.48 0.00 0.00 55.95 58.06 2q3u s SER 7 Cb -0.32 -2.08 0.32 0.00 0.10 0.00 0.00 66.02 64.04 2q3u s SER 7 CO 0.35 -1.09 1.94 -0.65 0.98 0.00 0.00 173.24 174.76 2q3u h PRO 8 N -0.41 1.25 -0.50 4.02 0.11 -1.70 -1.69 132.00 133.07 2q3u h PRO 8 Ca -0.45 -0.08 0.07 0.00 0.11 0.00 0.00 66.00 65.66 2q3u h PRO 8 Cb 1.23 -0.28 -0.03 0.00 0.11 0.00 0.00 31.00 32.03 2q3u h PRO 8 CO 0.63 0.83 0.34 0.00 -0.21 0.00 0.00 178.00 179.58 2q3u h ALA 9 N 1.41 1.98 0.00 -0.75 0.00 -1.31 0.96 119.26 121.54 2q3u h ALA 9 Ca 0.35 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.20 2q3u h ALA 9 Cb -0.14 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2q3u h ALA 9 CO -0.08 -0.08 -0.23 0.93 0.00 0.00 0.00 179.25 179.80 2q3u h GLU 10 N 0.38 0.00 -0.25 0.00 5.08 -1.58 -2.27 114.58 115.94 2q3u h GLU 10 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2q3u h GLU 10 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2q3u h GLU 10 CO -0.06 0.23 0.00 0.72 -1.00 0.00 0.00 179.01 178.90 2q3u n HIS 11 N -4.11 0.31 -0.46 4.33 8.25 0.25 -4.96 115.22 118.84 2q3u n HIS 11 Ca -0.02 -0.15 0.00 0.00 -0.26 0.00 0.00 57.72 57.28 2q3u n HIS 11 Cb 0.29 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.40 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 1.35 0.76 3.88 -1.41 0.00 -0.72 -4.91 105.19 104.14 2q3u n GLY 12 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.26 3.51 0.00 1.61 2.02 -0.78 -4.30 117.35 117.15 2q3u s TYR 13 Ca 0.00 1.01 0.00 0.00 -0.37 0.00 0.00 57.07 57.71 2q3u s TYR 13 Cb 0.00 -2.43 0.00 0.00 -0.40 0.00 0.00 41.96 39.13 2q3u s TYR 13 CO 0.00 -0.21 0.00 2.48 -1.57 0.00 0.00 175.55 176.25 2q3u n TYR 14 N -1.70 0.00 -3.92 2.71 0.18 -0.12 -4.41 117.16 109.90 2q3u n TYR 14 Ca 0.02 0.00 -0.09 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 2.86 1.10 0.57 -3.48 0.04 -1.26 0.25 135.00 135.08 2q3u s PRO 16 Ca 0.00 -1.11 -0.16 0.00 0.04 0.00 0.00 61.00 59.77 2q3u s PRO 16 Cb 0.00 0.38 -0.05 0.00 0.04 0.00 0.00 34.50 34.87 2q3u s PRO 16 CO 0.00 -0.40 1.04 0.00 0.04 0.00 0.00 177.00 177.69 2q3u s ALA 17 N -3.94 2.81 0.54 8.56 0.00 -1.26 -4.70 121.76 123.77 2q3u s ALA 17 Ca 0.14 0.38 0.26 0.00 0.00 0.00 0.00 51.96 52.75 2q3u s ALA 17 Cb 0.03 -3.22 1.44 0.00 0.00 0.00 0.00 23.12 21.38 2q3u s ALA 17 CO -0.03 -0.66 1.99 1.49 0.00 0.00 0.00 175.76 178.55 2q3u h GLU 18 N 0.64 0.00 0.00 0.00 4.81 -1.93 0.19 114.58 118.30 2q3u h GLU 18 Ca -0.47 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2q3u h GLU 18 Cb 1.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.59 2q3u h GLU 18 CO 0.58 0.00 0.00 -2.67 -0.73 0.00 0.00 179.01 176.19 2q3u n TRP 19 N -4.23 0.00 -1.04 0.92 2.14 -1.26 -4.79 117.44 109.18 2q3u n TRP 19 Ca 0.09 0.00 -0.29 0.00 2.07 0.00 0.00 57.50 59.37 2q3u n TRP 19 Cb 0.60 -0.18 0.18 0.00 -0.81 0.00 0.00 31.31 31.10 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 -2.36 2.45 0.13 -0.67 1.11 0.67 -4.92 116.67 113.08 2q3u s ASP 20 Ca 0.29 1.34 -0.30 0.00 0.18 0.00 0.00 52.55 54.05 2q3u s ASP 20 Cb 0.17 -2.02 -0.07 0.00 1.07 0.00 0.00 42.92 42.06 2q3u s ASP 20 CO 0.34 -3.26 1.19 -0.55 1.18 0.00 0.00 175.17 174.07 2q3u s SER 21 N -3.24 7.09 0.23 0.27 0.15 -1.26 -4.86 113.70 112.08 2q3u s SER 21 Ca 0.66 2.13 0.04 0.00 0.70 0.00 0.00 55.95 59.47 2q3u s SER 21 Cb -0.20 -2.59 -0.03 0.00 -1.71 0.00 0.00 66.02 61.49 2q3u s SER 21 CO 0.59 -0.40 0.37 -1.00 1.20 0.00 0.00 173.24 173.99 2q3u s HIS 22 N 0.42 3.47 -0.06 3.44 3.76 -1.26 -1.39 115.29 123.67 2q3u s HIS 22 Ca 0.55 0.07 0.01 0.00 -0.15 0.00 0.00 55.06 55.54 2q3u s HIS 22 Cb -0.31 -1.64 -0.26 0.00 1.11 0.00 0.00 32.58 31.48 2q3u s HIS 22 CO 0.33 0.42 0.61 0.00 -0.85 0.00 0.00 174.74 175.25 2q3u h ALA 23 N 1.39 0.50 -1.34 -1.40 0.00 -1.19 -3.44 119.26 113.78 2q3u h ALA 23 Ca -0.51 -1.33 0.31 0.00 0.00 0.00 0.00 54.91 53.38 2q3u h ALA 23 Cb 1.22 0.51 -0.16 0.00 0.00 0.00 0.00 17.79 19.36 2q3u h ALA 23 CO 0.63 1.35 0.87 1.14 0.00 0.00 0.00 179.25 183.24 2q3u s GLN 24 N -2.59 0.26 -0.06 0.00 -2.07 -1.24 -4.17 119.66 109.78 2q3u s GLN 24 Ca -0.13 -0.13 0.03 0.00 -1.82 0.00 0.00 55.36 53.31 2q3u s GLN 24 Cb 0.07 0.10 -0.02 0.00 -1.09 0.00 0.00 33.01 32.07 2q3u s GLN 24 CO 0.81 -0.12 -0.13 0.99 -1.32 0.00 0.00 175.29 175.52 2q3u s THR 25 N -2.31 3.13 -0.13 3.63 2.01 0.47 -0.82 115.64 121.61 2q3u s THR 25 Ca 0.12 -0.69 -0.06 0.00 0.31 0.00 0.00 61.69 61.37 2q3u s THR 25 Cb 0.02 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.25 2q3u s THR 25 CO -0.04 0.58 0.10 0.26 -0.69 0.00 0.00 174.62 174.83 2q3u s TRP 26 N -0.56 3.44 -0.02 4.92 0.52 -0.33 -1.45 118.94 125.47 2q3u s TRP 26 Ca 0.08 0.38 -0.01 0.00 0.02 0.00 0.00 56.10 56.56 2q3u s TRP 26 Cb -0.12 -1.96 0.00 0.00 -1.15 0.00 0.00 33.47 30.25 2q3u s TRP 26 CO 0.01 0.55 0.04 0.42 0.02 0.00 0.00 176.95 178.00 2q3u s ILE 27 N -0.64 0.00 0.00 2.03 1.01 -0.52 -0.09 121.20 122.99 2q3u s ILE 27 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.76 2q3u s ILE 27 Cb -0.12 -0.07 0.00 0.00 0.01 0.00 0.00 42.46 42.28 2q3u s ILE 27 CO 0.02 -0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.57 2q3u n GLY 28 N 3.04 0.66 3.29 6.18 0.00 -1.25 -1.72 105.19 115.39 2q3u n GLY 28 Ca -0.12 -1.67 -0.10 0.00 0.00 0.00 0.00 46.02 44.13 2q3u n GLY 28 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2q3u s TRP 29 N 0.74 -0.69 0.45 1.61 -0.11 -1.21 -4.51 118.94 115.21 2q3u s TRP 29 Ca 0.00 1.41 -0.21 0.00 1.22 0.00 0.00 56.10 58.52 2q3u s TRP 29 Cb 0.00 0.30 -0.10 0.00 -1.50 0.00 0.00 33.47 32.17 2q3u s TRP 29 CO 0.00 -0.40 0.98 -1.25 -4.62 0.00 0.00 176.95 171.66 2q3u s PRO 30 N 1.85 4.08 0.00 5.86 0.04 -1.26 -4.57 135.00 140.99 2q3u s PRO 30 Ca -0.07 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.19 2q3u s PRO 30 Cb -0.10 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.28 2q3u s PRO 30 CO -0.13 -0.17 0.00 -1.91 0.04 0.00 0.00 177.00 174.83 2q3u n GLU 31 N -0.72 0.00 -2.19 4.56 2.13 -1.26 -4.83 120.64 118.33 2q3u n GLU 31 Ca 0.08 0.00 -0.41 0.00 0.66 0.00 0.00 57.16 57.49 2q3u n GLU 31 Cb 0.53 -0.10 -0.03 0.00 0.27 0.00 0.00 31.44 32.11 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 -1.00 4.39 0.08 5.31 1.70 -1.26 -4.69 118.95 123.48 2q3u s ARG 32 Ca 0.00 2.11 0.27 0.00 -0.47 0.00 0.00 55.73 57.64 2q3u s ARG 32 Cb 0.00 -3.15 1.06 0.00 -0.57 0.00 0.00 34.95 32.29 2q3u s ARG 32 CO 0.00 -0.21 1.85 1.04 -1.08 0.00 0.00 175.30 176.91 2q3u n GLN 33 N 1.93 0.10 -0.02 3.89 6.02 -1.26 -0.31 117.38 127.73 2q3u n GLN 33 Ca 0.04 0.10 0.13 0.00 -0.01 0.00 0.00 57.00 57.25 2q3u n GLN 33 Cb 0.42 -1.62 0.41 0.00 1.02 0.00 0.00 30.24 30.47 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 -1.80 1.90 0.00 1.08 5.68 -1.26 -0.66 116.55 121.49 2q3u n ASP 34 Ca 0.06 -1.65 0.00 0.00 -0.50 0.00 0.00 54.79 52.70 2q3u n ASP 34 Cb 0.37 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.32 2q3u n ASP 34 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 2q3u n ASN 35 N 0.48 2.85 -4.13 -1.12 4.05 -1.17 -4.82 115.26 111.40 2q3u n ASN 35 Ca 0.18 0.00 -0.34 0.00 0.45 0.00 0.00 54.58 54.87 2q3u n ASN 35 Cb 0.41 0.32 -0.14 0.00 1.23 0.00 0.00 39.78 41.60 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 -1.51 3.36 0.94 1.20 0.52 0.58 -4.65 118.94 119.38 2q3u s TRP 36 Ca 0.00 -2.17 -0.12 0.00 0.02 0.00 0.00 56.10 53.83 2q3u s TRP 36 Cb 0.00 -2.30 0.08 0.00 -1.15 0.00 0.00 33.47 30.10 2q3u s TRP 36 CO 0.00 -0.86 0.65 2.89 0.02 0.00 0.00 176.95 179.65 2q3u n ARG 37 N 4.53 -0.39 -4.24 4.98 1.85 -1.26 -3.15 116.66 118.99 2q3u n ARG 37 Ca -0.10 -0.06 -0.36 0.00 -1.00 0.00 0.00 57.85 56.32 2q3u n ARG 37 Cb 0.43 -2.03 -0.03 0.00 -1.05 0.00 0.00 32.46 29.77 2q3u n ARG 37 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2q3u n HIS 38 N -3.84 -1.68 -2.33 2.89 8.25 0.72 -0.49 115.22 118.74 2q3u n HIS 38 Ca 0.08 0.79 -0.21 0.00 -0.26 0.00 0.00 57.72 58.12 2q3u n HIS 38 Cb 0.53 -2.89 -0.02 0.00 1.12 0.00 0.00 29.99 28.74 2q3u n HIS 38 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2q3u n ASN 39 N -2.66 -5.82 0.00 0.41 4.05 -1.21 -2.00 115.26 108.03 2q3u n ASN 39 Ca 0.06 0.04 0.00 0.00 0.45 0.00 0.00 54.58 55.13 2q3u n ASN 39 Cb 0.50 -4.87 0.00 0.00 1.23 0.00 0.00 39.78 36.64 2q3u n ASN 39 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2q3u n ALA 40 N -1.72 0.00 -0.20 5.20 0.00 0.36 -4.86 120.51 119.29 2q3u n ALA 40 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2q3u n ALA 40 Cb 0.69 -1.25 0.11 0.00 0.00 0.00 0.00 19.45 18.99 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 0.12 -0.90 0.00 4.07 -1.55 0.17 115.31 117.21 2q3u h LEU 41 Ca 0.00 0.09 -0.10 0.00 0.08 0.00 0.00 57.88 57.95 2q3u h LEU 41 Cb 0.58 0.10 -0.01 0.00 1.08 0.00 0.00 40.66 42.41 2q3u h LEU 41 CO 0.00 0.07 -0.24 -0.65 -1.08 0.00 0.00 178.44 176.54 2q3u h PRO 42 N 0.33 0.53 0.00 1.13 0.11 -1.85 -2.77 132.00 129.48 2q3u h PRO 42 Ca 0.31 -0.20 0.00 0.00 0.11 0.00 0.00 66.00 66.22 2q3u h PRO 42 Cb 0.41 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.49 2q3u h PRO 42 CO -0.35 0.73 0.00 0.00 -0.21 0.00 0.00 178.00 178.17 2q3u h ALA 43 N 1.28 1.00 0.06 -0.75 0.00 -1.10 -2.65 119.26 117.09 2q3u h ALA 43 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 2q3u h ALA 43 Cb 0.67 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.47 2q3u h ALA 43 CO 0.05 0.00 -0.48 1.96 0.00 0.00 0.00 179.25 180.78 2q3u h GLN 44 N 0.00 0.23 -0.75 0.00 4.20 -0.80 -0.69 115.11 117.29 2q3u h GLN 44 Ca 0.00 -0.32 0.07 0.00 0.06 0.00 0.00 58.65 58.47 2q3u h GLN 44 Cb 0.35 0.11 -0.05 0.00 0.30 0.00 0.00 27.48 28.19 2q3u h GLN 44 CO 0.00 1.09 0.49 0.00 -0.67 0.00 0.00 178.83 179.74 2q3u h ARG 45 N -0.49 0.73 -0.06 1.46 3.08 -1.52 0.70 114.38 118.28 2q3u h ARG 45 Ca -0.08 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.89 2q3u h ARG 45 Cb 1.31 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 31.19 2q3u h ARG 45 CO 0.09 0.49 -0.11 0.28 -1.07 0.00 0.00 179.97 179.64 2q3u h VAL 46 N 0.76 1.42 -0.51 2.04 2.07 -1.41 0.13 116.25 120.73 2q3u h VAL 46 Ca 0.33 -1.41 0.08 0.00 0.82 0.00 0.00 66.70 66.51 2q3u h VAL 46 Cb 0.30 2.21 -0.06 0.00 -1.52 0.00 0.00 31.29 32.22 2q3u h VAL 46 CO -0.11 0.39 0.16 -0.26 0.02 0.00 0.00 177.57 177.77 2q3u h PHE 47 N -0.31 0.28 -0.88 1.57 -1.00 -0.83 0.10 116.94 115.86 2q3u h PHE 47 Ca 0.00 0.03 0.11 0.00 2.81 0.00 0.00 57.97 60.92 2q3u h PHE 47 Cb 0.69 -0.05 -0.08 0.00 3.61 0.00 0.00 35.95 40.12 2q3u h PHE 47 CO 0.11 0.07 0.52 0.00 -1.61 0.00 0.00 178.31 177.40 2q3u h ALA 48 N 1.36 1.30 -0.33 2.45 0.00 0.46 0.33 119.26 124.83 2q3u h ALA 48 Ca 0.25 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 2q3u h ALA 48 Cb 0.30 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2q3u h ALA 48 CO -0.28 0.10 -0.08 0.78 0.00 0.00 0.00 179.25 179.78 2q3u h GLY 49 N 0.83 0.69 0.90 0.00 0.00 -0.17 0.52 103.07 105.85 2q3u h GLY 49 Ca 0.44 -0.57 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 2q3u h GLY 49 CO -0.27 0.52 0.09 -2.08 0.00 0.00 0.00 176.54 174.80 2q3u h VAL 50 N 0.42 1.15 -0.90 4.60 2.07 0.04 0.71 116.25 124.34 2q3u h VAL 50 Ca 0.08 -0.44 0.10 0.00 0.82 0.00 0.00 66.70 67.27 2q3u h VAL 50 Cb 0.57 1.08 -0.07 0.00 -1.52 0.00 0.00 31.29 31.35 2q3u h VAL 50 CO 0.03 0.14 0.58 0.00 0.02 0.00 0.00 177.57 178.35 2q3u h ALA 51 N 0.94 1.65 0.16 1.67 0.00 -0.75 0.18 119.26 123.11 2q3u h ALA 51 Ca 0.07 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.73 2q3u h ALA 51 Cb 0.15 -0.20 0.03 0.00 0.00 0.00 0.00 17.79 17.77 2q3u h ALA 51 CO -0.01 0.16 -1.05 0.87 0.00 0.00 0.00 179.25 179.22 2q3u h LYS 52 N 0.87 0.42 -0.28 0.00 1.57 -0.81 -1.91 116.57 116.42 2q3u h LYS 52 Ca 0.42 -0.68 -0.00 0.00 -1.87 0.00 0.00 60.65 58.52 2q3u h LYS 52 Cb 0.45 0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 2q3u h LYS 52 CO -0.19 1.31 0.17 0.00 -0.57 0.00 0.00 179.45 180.18 2q3u h ALA 53 N 0.15 0.36 -0.45 3.86 0.00 -0.16 -2.85 119.26 120.18 2q3u h ALA 53 Ca -0.18 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2q3u h ALA 53 Cb 1.81 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 2q3u h ALA 53 CO 0.20 -0.13 0.18 0.82 0.00 0.00 0.00 179.25 180.32 2q3u h ILE 54 N 0.36 1.17 0.00 0.00 2.04 -0.77 -2.92 117.51 117.39 2q3u h ILE 54 Ca 0.10 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.45 2q3u h ILE 54 Cb 0.02 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2q3u h ILE 54 CO -0.02 0.20 0.00 0.77 0.00 0.00 0.00 178.15 179.10 2q3u h SER 55 N 0.63 0.00 1.11 1.72 4.64 -1.10 0.22 113.55 120.78 2q3u h SER 55 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2q3u h SER 55 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 2q3u h SER 55 CO -0.02 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 176.05 2q3u h LYS 56 N 0.00 0.00 0.00 4.77 1.79 -1.46 -3.30 116.57 118.37 2q3u h LYS 56 Ca 0.00 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.26 2q3u h LYS 56 Cb 0.16 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 30.77 2q3u h LYS 56 CO 0.00 0.00 -1.78 1.19 -1.08 0.00 0.00 179.45 177.78 2q3u n PHE 57 N -2.47 0.00 -3.63 -1.35 3.72 0.69 -5.10 117.46 109.33 2q3u n PHE 57 Ca 0.03 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.36 2q3u n PHE 57 Cb 0.33 -0.56 -0.02 0.00 -0.94 0.00 0.00 39.48 38.29 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 -2.28 1.11 0.54 -1.08 -1.05 -0.61 -4.49 118.70 110.84 2q3u s GLU 58 Ca -0.07 -0.53 -0.21 0.00 -0.15 0.00 0.00 54.97 54.00 2q3u s GLU 58 Cb 0.04 0.43 -0.05 0.00 -0.44 0.00 0.00 34.13 34.11 2q3u s GLU 58 CO 0.45 -0.50 1.29 -2.14 0.95 0.00 0.00 175.26 175.31 2q3u s PRO 59 N -3.33 3.20 -0.02 -4.83 0.02 -1.26 -3.57 135.00 125.22 2q3u s PRO 59 Ca 0.08 2.06 0.04 0.00 0.02 0.00 0.00 61.00 63.20 2q3u s PRO 59 Cb -0.02 -2.21 -0.01 0.00 0.02 0.00 0.00 34.50 32.29 2q3u s PRO 59 CO -0.03 -1.09 -0.14 0.08 -0.33 0.00 0.00 177.00 175.48 2q3u s VAL 60 N -1.40 1.16 -0.07 3.83 1.01 -1.26 -0.39 120.40 123.27 2q3u s VAL 60 Ca 0.72 -0.60 0.05 0.00 0.00 0.00 0.00 61.98 62.14 2q3u s VAL 60 Cb -0.36 -0.99 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 2q3u s VAL 60 CO 0.42 0.34 -0.24 -0.89 0.00 0.00 0.00 175.10 174.73 2q3u s THR 61 N -0.15 2.11 -0.10 3.92 2.01 -0.53 -1.03 115.64 121.87 2q3u s THR 61 Ca 0.02 -1.03 -0.01 0.00 0.31 0.00 0.00 61.69 60.97 2q3u s THR 61 Cb -0.08 -1.78 -0.03 0.00 0.01 0.00 0.00 72.50 70.62 2q3u s THR 61 CO 0.00 0.57 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.77 2q3u s VAL 62 N 0.02 3.92 -0.14 3.82 1.01 -0.32 -1.44 120.40 127.27 2q3u s VAL 62 Ca -0.09 -0.38 -0.03 0.00 0.00 0.00 0.00 61.98 61.48 2q3u s VAL 62 Cb -0.15 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 2q3u s VAL 62 CO 0.06 0.56 -0.04 0.00 0.00 0.00 0.00 175.10 175.67 2q3u s ALA 64 N 0.16 0.62 0.88 0.00 0.00 -0.07 -3.36 121.76 119.99 2q3u s ALA 64 Ca -0.02 -1.00 -0.11 0.00 0.00 0.00 0.00 51.96 50.84 2q3u s ALA 64 Cb -0.14 0.13 0.13 0.00 0.00 0.00 0.00 23.12 23.24 2q3u s ALA 64 CO 0.03 -0.17 1.15 -1.54 0.00 0.00 0.00 175.76 175.23 2q3u s SER 65 N -2.25 3.22 0.38 0.00 1.04 -1.26 -4.13 113.70 110.69 2q3u s SER 65 Ca -0.01 2.17 0.05 0.00 0.48 0.00 0.00 55.95 58.63 2q3u s SER 65 Cb -0.02 -2.56 0.74 0.00 0.10 0.00 0.00 66.02 64.27 2q3u s SER 65 CO -0.03 -2.91 2.03 1.55 0.98 0.00 0.00 173.24 174.86 2q3u h PRO 66 N -1.64 0.69 -0.07 4.02 0.13 -1.96 0.37 132.00 133.53 2q3u h PRO 66 Ca -0.44 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2q3u h PRO 66 Cb 1.27 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2q3u h PRO 66 CO 0.43 0.46 0.00 0.00 -0.23 0.00 0.00 178.00 178.67 2q3u n ALA 67 N -2.46 2.54 0.00 -0.56 0.00 -1.26 -3.22 120.51 115.55 2q3u n ALA 67 Ca 0.05 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2q3u n ALA 67 Cb 0.06 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.39 2q3u n ALA 67 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2q3u n GLN 68 N -0.36 1.31 -0.26 0.00 1.13 -0.07 -4.88 117.38 114.25 2q3u n GLN 68 Ca 0.09 0.00 0.07 0.00 -1.94 0.00 0.00 57.00 55.21 2q3u n GLN 68 Cb 0.11 -0.90 0.20 0.00 0.11 0.00 0.00 30.24 29.75 2q3u n GLN 68 CO 0.00 0.00 0.00 2.35 -1.44 0.00 0.00 177.06 177.97 2q3u h TRP 69 N 0.00 0.33 -0.34 1.08 7.01 -0.33 -0.47 115.95 123.22 2q3u h TRP 69 Ca 0.00 0.04 -0.16 0.00 2.11 0.00 0.00 58.89 60.88 2q3u h TRP 69 Cb 0.04 -0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.06 2q3u h TRP 69 CO 0.00 -0.08 -0.41 0.93 -2.79 0.00 0.00 178.44 176.09 2q3u h GLU 70 N 0.29 0.85 -0.43 2.65 5.08 -1.86 -1.24 114.58 119.93 2q3u h GLU 70 Ca 0.43 -0.46 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 2q3u h GLU 70 Cb 0.75 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 2q3u h GLU 70 CO -0.51 1.10 0.20 -0.97 -1.00 0.00 0.00 179.01 177.83 2q3u h ASN 71 N 0.69 0.56 -0.53 1.42 -1.24 -1.50 0.41 115.58 115.39 2q3u h ASN 71 Ca 0.05 -0.13 -0.01 0.00 0.71 0.00 0.00 56.30 56.92 2q3u h ASN 71 Cb 0.99 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.87 2q3u h ASN 71 CO 0.10 0.53 0.28 0.00 -1.29 0.00 0.00 177.43 177.05 2q3u h ALA 72 N 1.05 0.68 -0.11 1.57 0.00 -1.16 -0.37 119.26 120.92 2q3u h ALA 72 Ca 0.15 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2q3u h ALA 72 Cb 0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2q3u h ALA 72 CO -0.02 0.21 -0.20 -0.09 0.00 0.00 0.00 179.25 179.15 2q3u h ARG 73 N 0.71 0.19 -0.05 0.00 9.65 -0.96 -1.44 114.38 122.48 2q3u h ARG 73 Ca 0.19 -0.05 -0.22 0.00 -1.10 0.00 0.00 59.98 58.80 2q3u h ARG 73 Cb 0.06 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.62 2q3u h ARG 73 CO -0.03 0.39 -0.86 0.87 2.80 0.00 0.00 179.97 183.15 2q3u h LYS 74 N 0.18 0.50 -0.11 0.20 1.57 -0.28 -3.24 116.57 115.39 2q3u h LYS 74 Ca 0.03 -0.47 -0.22 0.00 -1.87 0.00 0.00 60.65 58.12 2q3u h LYS 74 Cb 0.46 0.12 0.01 0.00 0.08 0.00 0.00 32.23 32.90 2q3u h LYS 74 CO 0.03 1.11 -0.80 1.96 -0.57 0.00 0.00 179.45 181.18 2q3u h GLN 75 N 0.32 0.65 -5.96 3.15 4.20 -0.74 -3.46 115.11 113.27 2q3u h GLN 75 Ca -0.06 -0.55 -0.60 0.00 0.06 0.00 0.00 58.65 57.50 2q3u h GLN 75 Cb 1.47 0.12 -0.06 0.00 0.30 0.00 0.00 27.48 29.31 2q3u h GLN 75 CO 0.15 1.17 -0.19 -0.51 -0.67 0.00 0.00 178.83 178.78 2q3u s LEU 76 N -8.21 4.44 0.58 1.46 1.43 -0.57 -5.03 118.68 112.77 2q3u s LEU 76 Ca -0.09 0.94 -0.19 0.00 -1.03 0.00 0.00 54.13 53.76 2q3u s LEU 76 Cb 0.09 -2.61 -0.06 0.00 0.03 0.00 0.00 46.19 43.64 2q3u s LEU 76 CO 0.88 0.26 0.97 -2.65 0.23 0.00 0.00 176.35 176.04 2q3u n PRO 77 N 2.19 0.96 0.03 1.29 -0.02 -1.26 -4.82 135.00 133.37 2q3u n PRO 77 Ca -0.13 0.37 0.04 0.00 -2.02 0.00 0.00 63.50 61.77 2q3u n PRO 77 Cb 0.52 -2.15 0.20 0.00 -0.02 0.00 0.00 33.50 32.06 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 -0.84 0.03 0.00 -0.52 -0.58 -1.26 -1.38 120.64 116.09 2q3u n GLU 78 Ca 0.13 0.42 0.14 0.00 -0.42 0.00 0.00 57.16 57.44 2q3u n GLU 78 Cb 0.46 -1.58 0.66 0.00 -0.57 0.00 0.00 31.44 30.42 2q3u n GLU 78 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 2q3u n ASP 79 N -1.64 0.23 -4.61 1.62 3.85 -1.26 -4.52 116.55 110.22 2q3u n ASP 79 Ca 0.01 -0.29 -0.39 0.00 -0.71 0.00 0.00 54.79 53.41 2q3u n ASP 79 Cb 0.08 -0.18 -0.09 0.00 -1.35 0.00 0.00 41.12 39.58 2q3u n ASP 79 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 2q3u s ILE 80 N -2.58 5.19 0.32 2.12 1.01 -0.48 -4.66 121.20 122.12 2q3u s ILE 80 Ca 0.27 0.55 -0.28 0.00 0.00 0.00 0.00 60.65 61.19 2q3u s ILE 80 Cb 0.20 -3.69 -0.09 0.00 0.01 0.00 0.00 42.46 38.89 2q3u s ILE 80 CO 0.48 0.17 1.15 -0.60 0.00 0.00 0.00 174.94 176.15 2q3u s ARG 81 N 1.98 4.43 -0.15 2.79 3.52 -0.20 -4.88 118.95 126.44 2q3u s ARG 81 Ca 0.15 1.87 0.00 0.00 -0.13 0.00 0.00 55.73 57.62 2q3u s ARG 81 Cb -0.16 -3.02 0.03 0.00 -1.56 0.00 0.00 34.95 30.24 2q3u s ARG 81 CO 0.10 0.00 -0.12 0.08 -0.81 0.00 0.00 175.30 174.55 2q3u s VAL 82 N -1.25 1.45 0.34 7.11 1.01 -1.26 -1.17 120.40 126.64 2q3u s VAL 82 Ca 0.49 -0.63 0.09 0.00 0.00 0.00 0.00 61.98 61.93 2q3u s VAL 82 Cb -0.32 -1.42 -0.06 0.00 0.00 0.00 0.00 36.38 34.57 2q3u s VAL 82 CO 0.42 0.37 -0.06 0.68 0.00 0.00 0.00 175.10 176.51 2q3u s VAL 83 N 1.52 2.39 0.60 2.92 -7.23 0.09 -4.97 120.40 115.73 2q3u s VAL 83 Ca 0.04 -2.12 -0.05 0.00 -1.81 0.00 0.00 61.98 58.03 2q3u s VAL 83 Cb -0.13 -2.70 0.02 0.00 0.56 0.00 0.00 36.38 34.13 2q3u s VAL 83 CO -0.10 -0.20 0.90 -0.70 -0.31 0.00 0.00 175.10 174.69 2q3u s GLU 84 N -3.65 2.78 0.51 4.82 2.12 -1.26 -0.90 118.70 123.13 2q3u s GLU 84 Ca 0.33 -0.11 0.09 0.00 0.36 0.00 0.00 54.97 55.64 2q3u s GLU 84 Cb 0.01 -2.28 0.05 0.00 0.26 0.00 0.00 34.13 32.18 2q3u s GLU 84 CO 0.18 -0.77 0.70 -1.12 -0.54 0.00 0.00 175.26 173.70 2q3u s SER 86 N -4.34 5.34 -0.11 -1.70 0.01 -1.26 -4.80 113.70 106.84 2q3u s SER 86 Ca 0.55 -0.65 -0.13 0.00 1.31 0.00 0.00 55.95 57.03 2q3u s SER 86 Cb -0.11 -0.13 -0.27 0.00 0.21 0.00 0.00 66.02 65.73 2q3u s SER 86 CO 0.44 -1.09 0.49 0.78 0.41 0.00 0.00 173.24 174.28 2q3u h ASN 88 N 0.38 0.41 -2.45 2.44 4.21 -1.88 -3.45 115.58 115.24 2q3u h ASN 88 Ca -0.34 -0.87 -0.08 0.00 1.21 0.00 0.00 56.30 56.21 2q3u h ASN 88 Cb 1.28 -0.13 -0.02 0.00 -1.12 0.00 0.00 38.32 38.33 2q3u h ASN 88 CO 0.43 1.71 -0.08 -0.67 -1.29 0.00 0.00 177.43 177.53 2q3u n ASP 89 N -3.77 -0.14 -3.19 5.81 4.64 -1.26 -4.76 116.55 113.87 2q3u n ASP 89 Ca -0.28 -1.39 -0.26 0.00 -1.38 0.00 0.00 54.79 51.49 2q3u n ASP 89 Cb 0.96 0.32 -0.06 0.00 -1.04 0.00 0.00 41.12 41.30 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 -2.67 3.41 -3.80 1.67 3.41 -1.26 -4.89 113.62 109.50 2q3u n SER 90 Ca 0.01 -3.42 -0.30 0.00 -0.26 0.00 0.00 58.87 54.90 2q3u n SER 90 Cb 0.11 -0.62 -0.13 0.00 -0.26 0.00 0.00 64.21 63.30 2q3u n SER 90 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 2q3u s TRP 91 N -2.73 2.44 -0.66 7.33 0.52 -1.26 -4.58 118.94 120.00 2q3u s TRP 91 Ca 0.43 -2.72 0.25 0.00 0.02 0.00 0.00 56.10 54.08 2q3u s TRP 91 Cb 0.22 -2.23 0.50 0.00 -1.15 0.00 0.00 33.47 30.82 2q3u s TRP 91 CO -0.08 -0.76 1.49 0.74 0.02 0.00 0.00 176.95 178.36 2q3u h PHE 92 N 6.60 0.00 -0.95 -1.98 0.05 -1.75 -1.61 116.94 117.30 2q3u h PHE 92 Ca -0.03 0.00 0.12 0.00 3.82 0.00 0.00 57.97 61.88 2q3u h PHE 92 Cb 0.91 0.00 -0.08 0.00 2.00 0.00 0.00 35.95 38.78 2q3u h PHE 92 CO 0.50 0.00 0.61 -0.09 -0.18 0.00 0.00 178.31 179.14 2q3u h ARG 93 N 0.00 0.88 0.02 1.51 9.65 -1.14 -0.29 114.38 125.02 2q3u h ARG 93 Ca 0.00 -0.05 -0.37 0.00 -1.10 0.00 0.00 59.98 58.46 2q3u h ARG 93 Cb 0.76 -0.20 -0.06 0.00 -1.39 0.00 0.00 29.97 29.08 2q3u h ARG 93 CO 0.00 0.58 -2.28 -0.25 2.80 0.00 0.00 179.97 180.82 2q3u n ASP 94 N -4.58 1.36 0.03 -3.80 8.00 -1.07 -2.56 116.55 113.93 2q3u n ASP 94 Ca 0.17 0.02 0.11 0.00 0.71 0.00 0.00 54.79 55.81 2q3u n ASP 94 Cb 0.36 -0.08 0.04 0.00 -0.02 0.00 0.00 41.12 41.42 2q3u n ASP 94 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2q3u n SER 95 N -3.14 0.62 -4.27 -2.24 3.41 -0.63 -3.80 113.62 103.58 2q3u n SER 95 Ca -0.37 -0.14 -0.30 0.00 -0.26 0.00 0.00 58.87 57.81 2q3u n SER 95 Cb 1.05 0.70 0.17 0.00 -0.26 0.00 0.00 64.21 65.87 2q3u n SER 95 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2q3u s GLY 96 N -3.69 1.75 0.50 5.00 0.00 -0.12 -3.30 107.32 107.46 2q3u s GLY 96 Ca 0.04 -1.10 -0.14 0.00 0.00 0.00 0.00 44.72 43.51 2q3u s GLY 96 CO 0.79 -0.38 0.94 2.56 0.00 0.00 0.00 173.10 177.01 2q3u s PRO 97 N -5.83 3.87 -0.55 2.90 0.04 -1.26 -4.78 135.00 129.38 2q3u s PRO 97 Ca 0.72 0.81 -0.17 0.00 0.04 0.00 0.00 61.00 62.40 2q3u s PRO 97 Cb -0.05 -2.19 0.12 0.00 0.04 0.00 0.00 34.50 32.42 2q3u s PRO 97 CO 0.52 -0.25 0.56 0.99 0.04 0.00 0.00 177.00 178.86 2q3u s THR 98 N -2.63 5.10 0.73 1.26 2.01 -0.57 -4.86 115.64 116.68 2q3u s THR 98 Ca 0.57 -1.35 -0.11 0.00 0.31 0.00 0.00 61.69 61.11 2q3u s THR 98 Cb -0.10 -4.38 0.03 0.00 0.01 0.00 0.00 72.50 68.06 2q3u s THR 98 CO 0.34 -0.94 1.08 -0.36 -0.69 0.00 0.00 174.62 174.05 2q3u s PHE 99 N 1.91 2.81 0.23 4.92 0.40 -1.26 -0.63 117.98 126.35 2q3u s PHE 99 Ca 0.05 1.50 -0.02 0.00 -0.60 0.00 0.00 56.93 57.87 2q3u s PHE 99 Cb -0.28 -2.98 -0.03 0.00 0.51 0.00 0.00 43.02 40.23 2q3u s PHE 99 CO 0.04 -1.55 0.22 0.96 0.70 0.00 0.00 175.22 175.59 2q3u s ILE 100 N -2.93 0.00 -0.02 0.64 -4.36 -0.76 -4.62 121.20 109.15 2q3u s ILE 100 Ca 0.60 -1.89 -0.13 0.00 -0.26 0.00 0.00 60.65 58.97 2q3u s ILE 100 Cb -0.16 -2.46 0.02 0.00 1.25 0.00 0.00 42.46 41.11 2q3u s ILE 100 CO 0.55 0.00 0.28 0.68 0.24 0.00 0.00 174.94 176.69 2q3u s VAL 101 N -3.99 0.06 0.27 8.37 -7.23 0.14 -2.89 120.40 115.13 2q3u s VAL 101 Ca 0.36 -0.48 0.05 0.00 -1.81 0.00 0.00 61.98 60.10 2q3u s VAL 101 Cb 0.05 -0.57 -0.06 0.00 0.56 0.00 0.00 36.38 36.36 2q3u s VAL 101 CO 0.14 -0.27 -0.03 0.00 -0.31 0.00 0.00 175.10 174.63 2q3u s ARG 102 N -1.24 1.49 0.21 4.82 1.70 -0.75 -0.94 118.95 124.23 2q3u s ARG 102 Ca -0.13 -1.76 0.07 0.00 -0.47 0.00 0.00 55.73 53.44 2q3u s ARG 102 Cb -0.05 -0.96 0.12 0.00 -0.57 0.00 0.00 34.95 33.48 2q3u s ARG 102 CO 0.04 -0.02 1.47 1.57 -1.08 0.00 0.00 175.30 177.27 2q3u h LYS 103 N 2.33 0.07 -0.30 3.89 2.10 -1.88 -3.40 116.57 119.38 2q3u h LYS 103 Ca -0.39 -0.07 0.24 0.00 -2.00 0.00 0.00 60.65 58.43 2q3u h LYS 103 Cb 1.23 0.02 -0.28 0.00 -0.90 0.00 0.00 32.23 32.30 2q3u h LYS 103 CO 0.67 0.81 0.53 -0.98 -2.00 0.00 0.00 179.45 178.47 2q3u s ARG 104 N -3.31 0.06 0.43 0.07 1.70 -1.26 -4.83 118.95 111.80 2q3u s ARG 104 Ca -0.01 0.15 0.00 0.00 -0.47 0.00 0.00 55.73 55.39 2q3u s ARG 104 Cb 0.11 0.08 0.00 0.00 -0.57 0.00 0.00 34.95 34.58 2q3u s ARG 104 CO 0.80 -0.02 0.00 0.09 -1.08 0.00 0.00 175.30 175.09 2q3u n ASN 112 N 4.44 -0.05 -4.76 -2.89 5.03 -1.26 -5.00 115.26 110.77 2q3u n ASN 112 Ca -0.08 0.00 -0.40 0.00 0.87 0.00 0.00 54.58 54.97 2q3u n ASN 112 Cb 0.55 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 39.26 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 0.00 4.72 -0.02 3.52 1.81 -1.26 -4.95 118.95 122.77 2q3u s ARG 113 Ca 0.00 1.68 0.16 0.00 -1.72 0.00 0.00 55.73 55.85 2q3u s ARG 113 Cb 0.00 -3.22 0.49 0.00 -0.45 0.00 0.00 34.95 31.77 2q3u s ARG 113 CO 0.00 0.33 1.40 0.09 -0.68 0.00 0.00 175.30 176.44 2q3u n ASN 114 N 1.29 3.05 -3.99 0.23 3.02 -1.26 -4.73 115.26 112.88 2q3u n ASN 114 Ca -0.01 -2.06 -0.23 0.00 -0.03 0.00 0.00 54.58 52.25 2q3u n ASN 114 Cb 0.46 -0.39 -0.16 0.00 -0.61 0.00 0.00 39.78 39.07 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 -1.36 0.92 0.32 2.41 2.07 -1.26 -1.81 121.20 122.49 2q3u s ILE 115 Ca 0.37 -0.37 0.02 0.00 -1.41 0.00 0.00 60.65 59.26 2q3u s ILE 115 Cb 0.20 -0.86 -0.01 0.00 0.13 0.00 0.00 42.46 41.92 2q3u s ILE 115 CO 0.24 0.30 0.08 0.00 -1.91 0.00 0.00 174.94 173.65 2q3u n ALA 116 N 3.79 0.39 -3.24 1.50 0.00 -1.14 -4.00 120.51 117.82 2q3u n ALA 116 Ca -0.23 -1.55 -0.13 0.00 0.00 0.00 0.00 53.44 51.53 2q3u n ALA 116 Cb 0.52 1.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.87 2q3u n ALA 116 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2q3u s GLY 117 N -2.88 -0.17 -0.18 0.00 0.00 -0.23 -1.83 107.32 102.02 2q3u s GLY 117 Ca 0.12 0.42 -0.12 0.00 0.00 0.00 0.00 44.72 45.14 2q3u s GLY 117 CO 0.08 0.22 0.20 -0.42 0.00 0.00 0.00 173.10 173.19 2q3u s ILE 118 N -1.10 5.36 -0.70 0.90 1.01 0.20 -0.48 121.20 126.40 2q3u s ILE 118 Ca -0.12 0.35 -0.06 0.00 0.00 0.00 0.00 60.65 60.82 2q3u s ILE 118 Cb -0.05 -3.54 0.18 0.00 0.01 0.00 0.00 42.46 39.06 2q3u s ILE 118 CO 0.04 0.42 0.56 -0.62 0.00 0.00 0.00 174.94 175.33 2q3u s ASP 119 N 0.39 5.74 0.65 3.58 2.15 0.15 -1.52 116.67 127.82 2q3u s ASP 119 Ca 0.12 -2.83 -0.13 0.00 0.43 0.00 0.00 52.55 50.13 2q3u s ASP 119 Cb -0.12 -1.97 -0.01 0.00 -0.30 0.00 0.00 42.92 40.52 2q3u s ASP 119 CO 0.01 -0.43 1.06 0.26 -0.17 0.00 0.00 175.17 175.90 2q3u s TRP 120 N -0.03 2.99 0.82 -5.34 0.52 -1.26 -2.14 118.94 114.48 2q3u s TRP 120 Ca 0.18 1.48 -0.11 0.00 0.02 0.00 0.00 56.10 57.67 2q3u s TRP 120 Cb -0.17 -2.97 0.08 0.00 -1.15 0.00 0.00 33.47 29.27 2q3u s TRP 120 CO -0.05 -1.24 1.09 1.21 0.02 0.00 0.00 176.95 177.98 2q3u s ASN 121 N -3.21 4.17 -0.04 2.95 3.04 -0.81 -4.89 114.94 116.14 2q3u s ASN 121 Ca 0.61 1.63 -0.10 0.00 0.04 0.00 0.00 52.86 55.04 2q3u s ASN 121 Cb -0.15 -2.34 0.02 0.00 -1.54 0.00 0.00 41.25 37.23 2q3u s ASN 121 CO 0.46 -2.22 0.24 0.12 -3.04 0.00 0.00 177.10 172.66 2q3u s PHE 122 N -2.95 -0.16 -0.08 0.43 5.36 -1.26 -2.38 117.98 116.93 2q3u s PHE 122 Ca 0.62 0.34 0.23 0.00 -0.96 0.00 0.00 56.93 57.15 2q3u s PHE 122 Cb -0.17 0.06 0.44 0.00 -0.34 0.00 0.00 43.02 43.01 2q3u s PHE 122 CO 0.56 -0.26 1.17 0.27 -1.46 0.00 0.00 175.22 175.50 2q3u n ASN 123 N 2.01 1.31 -3.79 6.13 2.04 -1.26 -4.93 115.26 116.76 2q3u n ASN 123 Ca -0.18 -2.30 -0.28 0.00 -0.44 0.00 0.00 54.58 51.38 2q3u n ASN 123 Cb 0.57 -0.36 0.05 0.00 -2.53 0.00 0.00 39.78 37.50 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 0.08 -1.32 -3.04 -2.53 0.00 -1.26 -0.70 120.51 111.74 2q3u n ALA 124 Ca 0.09 0.26 -0.03 0.00 0.00 0.00 0.00 53.44 53.76 2q3u n ALA 124 Cb 1.03 -4.80 0.00 0.00 0.00 0.00 0.00 19.45 15.68 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 -4.80 -3.08 0.00 0.00 8.01 -1.26 0.48 117.44 116.79 2q3u n TRP 125 Ca 0.02 1.20 0.00 0.00 -1.31 0.00 0.00 57.50 57.41 2q3u n TRP 125 Cb 0.54 -4.05 0.00 0.00 -2.01 0.00 0.00 31.31 25.80 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 -1.38 1.66 3.53 6.99 0.00 -1.25 -3.28 105.19 111.46 2q3u n GLY 126 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.02 -1.38 0.28 -0.02 0.00 0.13 -3.28 105.19 100.90 2q3u n GLY 127 Ca 0.00 -1.62 0.04 0.00 0.00 0.00 0.00 46.02 44.44 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 1.05 0.00 4.61 0.00 -1.93 0.30 119.26 123.29 2q3u h ALA 128 Ca 0.00 0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.82 2q3u h ALA 128 Cb 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2q3u h ALA 128 CO 0.00 -0.13 -0.98 -0.91 0.00 0.00 0.00 179.25 177.23 2q3u h ASN 129 N 0.53 0.00 0.02 0.00 2.35 -1.98 -3.41 115.58 113.09 2q3u h ASN 129 Ca 0.39 -0.57 0.00 0.00 -0.55 0.00 0.00 56.30 55.57 2q3u h ASN 129 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 2q3u h ASN 129 CO -0.34 1.36 -0.32 0.47 -1.65 0.00 0.00 177.43 176.94 2q3u n ASP 130 N -4.48 2.06 -4.72 5.81 9.92 -1.21 -4.99 116.55 118.95 2q3u n ASP 130 Ca -0.27 -1.53 -0.32 0.00 -0.53 0.00 0.00 54.79 52.15 2q3u n ASP 130 Cb 0.62 0.30 0.12 0.00 -0.64 0.00 0.00 41.12 41.52 2q3u n ASP 130 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2q3u s GLY 131 N -2.36 1.95 0.24 0.44 0.00 0.10 -4.41 107.32 103.29 2q3u s GLY 131 Ca 0.22 0.63 0.25 0.00 0.00 0.00 0.00 44.72 45.82 2q3u s GLY 131 CO 0.50 1.03 1.59 0.00 0.00 0.00 0.00 173.10 176.21 2q3u s TYR 133 N -3.16 -0.01 0.18 0.00 -0.85 -1.26 -2.00 117.35 110.25 2q3u s TYR 133 Ca 0.08 -0.35 0.08 0.00 -0.52 0.00 0.00 57.07 56.36 2q3u s TYR 133 Cb 0.11 0.34 0.00 0.00 0.38 0.00 0.00 41.96 42.79 2q3u s TYR 133 CO 0.65 -0.93 1.41 -0.91 -1.52 0.00 0.00 175.55 174.25 2q3u h ASN 134 N 2.22 0.00 -4.31 -0.18 4.21 -0.47 -3.45 115.58 113.61 2q3u h ASN 134 Ca -0.28 -0.00 -0.54 0.00 1.21 0.00 0.00 56.30 56.69 2q3u h ASN 134 Cb 1.26 -0.00 -0.29 0.00 -1.12 0.00 0.00 38.32 38.16 2q3u h ASN 134 CO 0.37 0.86 -0.83 -0.62 -1.29 0.00 0.00 177.43 175.92 2q3u s ASP 135 N -6.76 2.00 -0.09 5.81 -1.08 -1.26 -5.01 116.67 110.28 2q3u s ASP 135 Ca 0.00 -0.31 0.21 0.00 -0.52 0.00 0.00 52.55 51.93 2q3u s ASP 135 Cb 0.11 -0.23 0.39 0.00 -1.46 0.00 0.00 42.92 41.74 2q3u s ASP 135 CO 0.80 0.21 1.16 -2.67 0.52 0.00 0.00 175.17 175.18 2q3u n TRP 136 N 2.66 0.19 0.00 -5.34 2.14 -1.26 -4.85 117.44 110.99 2q3u n TRP 136 Ca -0.15 -0.99 -0.08 0.00 2.07 0.00 0.00 57.50 58.35 2q3u n TRP 136 Cb 0.54 0.02 0.08 0.00 -0.81 0.00 0.00 31.31 31.14 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 1.27 0.59 0.16 -0.67 0.02 -1.97 -2.26 113.55 110.68 2q3u h SER 137 Ca -0.27 -0.29 -0.21 0.00 -0.84 0.00 0.00 61.79 60.18 2q3u h SER 137 Cb 1.64 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 64.01 2q3u h SER 137 CO 0.05 0.99 -0.81 0.45 -1.14 0.00 0.00 176.83 176.36 2q3u h HIS 138 N 0.43 0.73 -0.25 3.45 3.86 -1.92 -3.22 115.15 118.23 2q3u h HIS 138 Ca 0.02 -0.34 -0.07 0.00 -1.16 0.00 0.00 60.37 58.81 2q3u h HIS 138 Cb 1.02 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.37 2q3u h HIS 138 CO 0.04 1.14 -0.16 -0.44 0.86 0.00 0.00 177.93 179.37 2q3u h ASP 139 N 0.34 0.41 0.20 2.45 3.45 -1.84 -1.04 116.42 120.40 2q3u h ASP 139 Ca -0.05 -0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.29 2q3u h ASP 139 Cb 1.42 -0.11 0.00 0.00 -0.56 0.00 0.00 39.33 40.08 2q3u h ASP 139 CO 0.15 0.60 0.00 -0.07 -1.57 0.00 0.00 179.24 178.35 2q3u h LEU 140 N 0.39 0.00 -1.25 1.55 3.38 -1.41 -2.69 115.31 115.28 2q3u h LEU 140 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2q3u h LEU 140 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2q3u h LEU 140 CO 0.03 0.00 -0.23 0.18 0.09 0.00 0.00 178.44 178.52 2q3u n LEU 141 N -2.91 2.09 -0.12 1.67 4.77 -0.40 -4.65 117.00 117.45 2q3u n LEU 141 Ca -0.02 -0.86 -0.12 0.00 -0.03 0.00 0.00 56.01 54.98 2q3u n LEU 141 Cb 0.11 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.17 2q3u n LEU 141 CO 0.19 0.38 0.68 0.58 -1.33 0.00 0.00 177.39 177.89 2q3u h VAL 142 N 2.70 1.29 -0.12 4.08 2.07 -1.42 -2.60 116.25 122.24 2q3u h VAL 142 Ca 0.00 -1.23 0.02 0.00 0.82 0.00 0.00 66.70 66.31 2q3u h VAL 142 Cb 0.69 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 2q3u h VAL 142 CO 0.00 0.40 -0.01 0.28 0.02 0.00 0.00 177.57 178.26 2q3u h SER 143 N 0.47 -0.07 0.30 0.57 0.02 -1.76 -1.98 113.55 111.10 2q3u h SER 143 Ca 0.08 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 2q3u h SER 143 Cb 0.66 0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.25 2q3u h SER 143 CO 0.04 -0.02 -0.08 0.03 -1.14 0.00 0.00 176.83 175.67 2q3u h ARG 144 N 0.03 0.00 0.14 3.45 3.08 -1.86 -2.25 114.38 116.97 2q3u h ARG 144 Ca 0.06 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.79 2q3u h ARG 144 Cb 0.07 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 2q3u h ARG 144 CO -0.11 0.08 -1.57 0.87 -1.07 0.00 0.00 179.97 178.17 2q3u h LYS 145 N 0.00 0.29 -0.15 0.04 1.57 -1.03 -2.62 116.57 114.66 2q3u h LYS 145 Ca -0.00 -0.49 -0.03 0.00 -1.87 0.00 0.00 60.65 58.26 2q3u h LYS 145 Cb 0.25 0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 2q3u h LYS 145 CO 0.01 1.16 -0.03 0.82 -0.57 0.00 0.00 179.45 180.84 2q3u h ILE 146 N 0.08 1.28 -0.78 1.86 2.04 -1.20 -0.54 117.51 120.24 2q3u h ILE 146 Ca -0.26 -0.95 -0.01 0.00 1.00 0.00 0.00 64.86 64.64 2q3u h ILE 146 Cb 2.04 1.61 -0.04 0.00 -0.74 0.00 0.00 36.82 39.69 2q3u h ILE 146 CO 0.17 0.28 0.46 -0.07 0.00 0.00 0.00 178.15 178.99 2q3u h LEU 147 N -0.01 0.96 -0.23 1.44 3.38 -1.50 -2.04 115.31 117.31 2q3u h LEU 147 Ca 0.04 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2q3u h LEU 147 Cb 0.44 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2q3u h LEU 147 CO 0.01 0.75 0.12 0.00 0.09 0.00 0.00 178.44 179.41 2q3u h ALA 148 N 1.24 0.30 -0.88 1.53 0.00 -1.36 0.16 119.26 120.24 2q3u h ALA 148 Ca 0.28 -0.08 0.16 0.00 0.00 0.00 0.00 54.91 55.27 2q3u h ALA 148 Cb -0.01 -0.09 -0.10 0.00 0.00 0.00 0.00 17.79 17.59 2q3u h ALA 148 CO -0.05 -0.15 0.46 -0.07 0.00 0.00 0.00 179.25 179.44 2q3u h LEU 149 N 0.25 0.56 -1.27 0.00 3.38 -0.77 -0.04 115.31 117.42 2q3u h LEU 149 Ca 0.08 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.15 2q3u h LEU 149 Cb 0.10 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2q3u h LEU 149 CO -0.01 0.21 0.00 -0.62 0.09 0.00 0.00 178.44 178.11 2q3u n GLU 150 N -4.87 1.86 -3.33 1.13 -0.58 -0.80 -4.95 120.64 109.11 2q3u n GLU 150 Ca 0.19 -1.26 -0.24 0.00 -0.42 0.00 0.00 57.16 55.43 2q3u n GLU 150 Cb 0.48 -1.47 0.01 0.00 -0.57 0.00 0.00 31.44 29.89 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 0.52 -4.04 -3.81 3.49 1.74 0.30 -4.96 116.66 109.91 2q3u n ARG 151 Ca 0.18 0.60 -0.36 0.00 -0.77 0.00 0.00 57.85 57.50 2q3u n ARG 151 Cb 0.42 -5.37 -0.07 0.00 -1.02 0.00 0.00 32.46 26.42 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 -3.04 5.45 0.26 0.55 1.01 0.24 -4.98 121.20 120.69 2q3u s ILE 152 Ca 0.40 0.24 -0.30 0.00 0.00 0.00 0.00 60.65 61.00 2q3u s ILE 152 Cb -0.20 -3.44 -0.14 0.00 0.01 0.00 0.00 42.46 38.69 2q3u s ILE 152 CO 0.50 0.56 1.27 -2.65 0.00 0.00 0.00 174.94 174.61 2q3u n PRO 153 N 2.50 1.78 -4.70 2.79 -0.02 -1.26 -4.55 135.00 131.54 2q3u n PRO 153 Ca -0.18 0.63 -0.33 0.00 -2.02 0.00 0.00 63.50 61.60 2q3u n PRO 153 Cb 0.54 -2.19 -0.14 0.00 -0.02 0.00 0.00 33.50 31.69 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 -0.92 3.34 0.17 -0.52 3.52 -1.26 -1.07 118.95 122.22 2q3u s ARG 154 Ca 0.65 -0.64 0.06 0.00 -0.13 0.00 0.00 55.73 55.66 2q3u s ARG 154 Cb -0.68 -2.67 -0.04 0.00 -1.56 0.00 0.00 34.95 30.01 2q3u s ARG 154 CO 0.55 0.28 0.09 -0.06 -0.81 0.00 0.00 175.30 175.35 2q3u s PHE 155 N 0.20 3.04 0.10 5.12 0.40 0.37 -4.95 117.98 122.25 2q3u s PHE 155 Ca -0.07 -0.06 0.07 0.00 -0.60 0.00 0.00 56.93 56.27 2q3u s PHE 155 Cb -0.15 -1.46 -0.03 0.00 0.51 0.00 0.00 43.02 41.89 2q3u s PHE 155 CO 0.04 0.52 -0.17 -1.14 0.70 0.00 0.00 175.22 175.18 2q3u s GLN 156 N -3.10 0.99 -0.01 0.44 0.74 -1.26 0.35 119.66 117.80 2q3u s GLN 156 Ca 0.30 -1.10 0.02 0.00 0.05 0.00 0.00 55.36 54.63 2q3u s GLN 156 Cb -0.10 -1.07 0.00 0.00 1.10 0.00 0.00 33.01 32.94 2q3u s GLN 156 CO 0.22 0.24 -0.05 -1.58 -0.55 0.00 0.00 175.29 173.56 2q3u s HIS 157 N -1.41 0.56 -1.43 1.67 2.46 -0.91 -4.91 115.29 111.32 2q3u s HIS 157 Ca 0.04 -0.11 -0.12 0.00 0.47 0.00 0.00 55.06 55.33 2q3u s HIS 157 Cb -0.09 -0.40 0.06 0.00 -0.13 0.00 0.00 32.58 32.01 2q3u s HIS 157 CO 0.03 -0.04 2.23 -1.13 -2.47 0.00 0.00 174.74 173.36 2q3u n SER 158 N 3.18 4.76 -4.28 9.88 3.41 -1.26 -1.93 113.62 127.37 2q3u n SER 158 Ca -0.16 -2.89 -0.33 0.00 -0.26 0.00 0.00 58.87 55.24 2q3u n SER 158 Cb 0.56 -1.60 -0.15 0.00 -0.26 0.00 0.00 64.21 62.76 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 2.31 2.69 -0.23 -1.33 1.09 -1.26 -4.56 121.20 119.90 2q3u s ILE 160 Ca 0.48 -0.77 -0.16 0.00 -1.10 0.00 0.00 60.65 59.10 2q3u s ILE 160 Cb 0.14 -2.13 0.07 0.00 -1.06 0.00 0.00 42.46 39.47 2q3u s ILE 160 CO -0.07 0.52 0.59 -0.22 -0.10 0.00 0.00 174.94 175.66 2q3u s LEU 161 N 0.73 -0.50 -0.05 2.97 2.96 -1.00 -4.84 118.68 118.95 2q3u s LEU 161 Ca -0.07 1.26 -0.02 0.00 -0.22 0.00 0.00 54.13 55.08 2q3u s LEU 161 Cb -0.16 2.02 -0.04 0.00 0.50 0.00 0.00 46.19 48.52 2q3u s LEU 161 CO 0.01 -0.22 0.06 -1.61 -1.32 0.00 0.00 176.35 173.27 2q3u s GLU 162 N 1.06 3.08 0.50 1.98 8.01 -1.26 -4.72 118.70 127.35 2q3u s GLU 162 Ca -0.06 -0.40 0.21 0.00 0.01 0.00 0.00 54.97 54.73 2q3u s GLU 162 Cb -0.05 -2.88 1.29 0.00 -4.31 0.00 0.00 34.13 28.17 2q3u s GLU 162 CO -0.10 0.69 2.01 0.78 0.01 0.00 0.00 175.26 178.65 2q3u h GLY 163 N 4.65 0.15 0.89 -1.39 0.00 -1.59 -1.40 103.07 104.37 2q3u h GLY 163 Ca -0.51 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 46.78 2q3u h GLY 163 CO 0.58 0.02 0.00 0.61 0.00 0.00 0.00 176.54 177.76 2q3u n GLY 164 N -1.60 -1.00 0.55 4.60 0.00 -1.23 -3.79 105.19 102.72 2q3u n GLY 164 Ca 0.08 -0.18 0.13 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.94 1.84 -4.13 1.61 3.41 -0.53 -1.67 113.62 113.21 2q3u n SER 165 Ca 0.21 -1.50 -0.09 0.00 -0.26 0.00 0.00 58.87 57.23 2q3u n SER 165 Cb 0.10 0.09 -0.10 0.00 -0.26 0.00 0.00 64.21 64.03 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 -2.16 0.30 0.17 -1.33 -5.25 -1.25 -4.04 121.20 107.64 2q3u s ILE 166 Ca 0.30 -1.86 -0.04 0.00 -0.99 0.00 0.00 60.65 58.06 2q3u s ILE 166 Cb 0.20 -1.70 -0.03 0.00 2.95 0.00 0.00 42.46 43.88 2q3u s ILE 166 CO 0.39 -0.83 0.17 -1.00 -1.79 0.00 0.00 174.94 171.89 2q3u s HIS 167 N -3.88 0.82 0.16 1.37 3.76 0.80 -4.71 115.29 113.60 2q3u s HIS 167 Ca 0.13 -1.14 -0.18 0.00 -0.15 0.00 0.00 55.06 53.72 2q3u s HIS 167 Cb 0.07 -0.35 0.04 0.00 1.11 0.00 0.00 32.58 33.45 2q3u s HIS 167 CO -0.06 -0.65 0.48 0.14 -0.85 0.00 0.00 174.74 173.81 2q3u s VAL 168 N -4.07 0.04 -0.46 -0.90 -7.23 -1.26 -1.12 120.40 105.40 2q3u s VAL 168 Ca 0.27 -0.52 0.05 0.00 -1.81 0.00 0.00 61.98 59.97 2q3u s VAL 168 Cb 0.06 -1.27 0.01 0.00 0.56 0.00 0.00 36.38 35.74 2q3u s VAL 168 CO 0.05 -0.19 0.50 -0.90 -0.31 0.00 0.00 175.10 174.26 2q3u n ASP 169 N -0.30 1.01 -0.58 4.85 5.75 -1.23 -4.58 116.55 121.47 2q3u n ASP 169 Ca -0.14 -1.00 -0.06 0.00 -0.01 0.00 0.00 54.79 53.57 2q3u n ASP 169 Cb 0.64 0.32 -0.02 0.00 -1.03 0.00 0.00 41.12 41.03 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 0.53 0.55 0.00 6.12 0.00 -1.26 -4.37 105.19 106.76 2q3u n GLY 170 Ca 0.02 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.31 0.20 0.00 1.61 1.02 -1.26 -4.68 120.64 115.21 2q3u n GLU 171 Ca -0.07 -0.42 0.00 0.00 -0.02 0.00 0.00 57.16 56.65 2q3u n GLU 171 Cb 0.35 -0.57 0.00 0.00 -0.02 0.00 0.00 31.44 31.21 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 -0.04 0.91 3.70 0.62 0.00 -1.26 -4.76 105.19 104.35 2q3u n GLY 172 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.24 3.97 -0.03 2.61 2.01 -1.26 0.11 115.64 121.81 2q3u s THR 173 Ca 0.00 -1.18 0.00 0.00 0.31 0.00 0.00 61.69 60.82 2q3u s THR 173 Cb 0.00 -2.96 0.03 0.00 0.01 0.00 0.00 72.50 69.58 2q3u s THR 173 CO 0.00 -0.01 0.01 0.00 -0.69 0.00 0.00 174.62 173.93 2q3u s LEU 175 N 1.19 3.50 0.26 0.00 2.96 -0.28 -0.87 118.68 125.45 2q3u s LEU 175 Ca -0.07 0.02 -0.13 0.00 -0.22 0.00 0.00 54.13 53.72 2q3u s LEU 175 Cb -0.13 -1.84 0.00 0.00 0.50 0.00 0.00 46.19 44.72 2q3u s LEU 175 CO -0.02 0.24 0.52 0.68 -1.32 0.00 0.00 176.35 176.45 2q3u s VAL 176 N -0.06 0.00 -0.01 1.68 -7.23 -0.59 -0.14 120.40 114.04 2q3u s VAL 176 Ca 0.03 -1.35 0.06 0.00 -1.81 0.00 0.00 61.98 58.91 2q3u s VAL 176 Cb -0.13 -2.23 -0.03 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 0.00 175.10 175.04 2q3u s THR 177 N -3.88 2.71 0.18 5.32 -4.23 -1.26 -1.41 115.64 113.07 2q3u s THR 177 Ca 0.21 -0.98 -0.08 0.00 -1.18 0.00 0.00 61.69 59.67 2q3u s THR 177 Cb -0.02 -2.06 -0.00 0.00 1.34 0.00 0.00 72.50 71.76 2q3u s THR 177 CO 0.10 0.51 1.55 -0.33 -0.54 0.00 0.00 174.62 175.90 2q3u h GLU 178 N 5.12 0.86 -0.79 3.99 5.08 -1.42 0.19 114.58 127.60 2q3u h GLU 178 Ca -0.46 -0.40 0.18 0.00 -1.00 0.00 0.00 59.36 57.67 2q3u h GLU 178 Cb 1.14 -0.01 -0.11 0.00 0.50 0.00 0.00 28.75 30.27 2q3u h GLU 178 CO 0.48 1.05 0.25 1.49 -1.00 0.00 0.00 179.01 181.28 2q3u h GLU 179 N 0.73 0.32 0.00 2.33 4.81 -1.10 -0.86 114.58 120.80 2q3u h GLU 179 Ca 0.08 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2q3u h GLU 179 Cb 0.86 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.17 2q3u h GLU 179 CO 0.08 0.21 -0.31 0.00 -0.73 0.00 0.00 179.01 178.26 2q3u h LEU 181 N -0.98 0.00 -1.16 0.00 -0.00 -0.93 -2.33 115.31 109.91 2q3u h LEU 181 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2q3u h LEU 181 Cb 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.97 2q3u h LEU 181 CO 0.00 0.00 -0.37 0.18 -0.00 0.00 0.00 178.44 178.25 2q3u n LEU 182 N -3.01 2.16 -4.50 1.67 4.77 -0.33 -4.59 117.00 113.16 2q3u n LEU 182 Ca 0.01 -0.81 -0.36 0.00 -0.03 0.00 0.00 56.01 54.82 2q3u n LEU 182 Cb 0.29 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.45 2q3u n LEU 182 CO 0.26 0.39 0.17 -3.20 -1.33 0.00 0.00 177.39 173.69 2q3u n ASN 183 N 0.22 -0.77 0.18 -1.43 2.85 -0.88 -4.80 115.26 110.63 2q3u n ASN 183 Ca 0.10 0.64 0.14 0.00 -0.11 0.00 0.00 54.58 55.34 2q3u n ASN 183 Cb 0.48 -1.25 0.55 0.00 1.24 0.00 0.00 39.78 40.79 2q3u n ASN 183 CO 0.00 0.00 0.00 0.07 -2.11 0.00 0.00 177.26 175.22 2q3u h LYS 184 N -0.21 0.00 -0.00 1.20 2.10 -1.91 -2.80 116.57 114.95 2q3u h LYS 184 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 2q3u h LYS 184 Cb 1.36 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.69 2q3u h LYS 184 CO 0.44 0.00 0.00 0.27 -2.00 0.00 0.00 179.45 178.16 2q3u n ASN 185 N -2.56 0.06 -0.00 7.07 0.23 -1.26 -3.75 115.26 115.04 2q3u n ASN 185 Ca 0.02 -1.13 -0.01 0.00 -0.53 0.00 0.00 54.58 52.93 2q3u n ASN 185 Cb 0.27 -0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 37.97 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 -0.90 0.06 -3.32 -3.83 5.12 -1.05 -4.45 116.66 108.29 2q3u n ARG 186 Ca 0.21 0.02 -0.25 0.00 -1.93 0.00 0.00 57.85 55.90 2q3u n ARG 186 Cb 0.11 -0.41 -0.08 0.00 -1.16 0.00 0.00 32.46 30.92 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 -2.86 1.38 0.27 0.55 4.13 -1.26 -4.57 115.26 112.91 2q3u n ASN 187 Ca -0.02 -2.93 0.14 0.00 1.68 0.00 0.00 54.58 53.46 2q3u n ASN 187 Cb 0.06 -0.65 0.76 0.00 -1.54 0.00 0.00 39.78 38.41 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 4.27 0.00 -2.93 3.52 0.13 -1.78 -3.44 132.00 131.76 2q3u h PRO 188 Ca 0.13 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 64.54 2q3u h PRO 188 Cb 0.81 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.86 2q3u h PRO 188 CO 0.58 0.10 2.88 0.72 -0.23 0.00 0.00 178.00 182.06 2q3u n HIS 189 N -3.55 2.64 -4.24 1.56 8.25 -1.26 -5.06 115.22 113.57 2q3u n HIS 189 Ca -0.02 -2.92 -0.13 0.00 -0.26 0.00 0.00 57.72 54.39 2q3u n HIS 189 Cb 0.23 -2.11 -0.10 0.00 1.12 0.00 0.00 29.99 29.14 2q3u n HIS 189 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2q3u s SER 191 N 1.18 0.80 0.29 0.41 1.04 -1.26 -5.10 113.70 111.06 2q3u s SER 191 Ca 0.57 -1.29 0.04 0.00 0.48 0.00 0.00 55.95 55.75 2q3u s SER 191 Cb 0.17 0.22 0.68 0.00 0.10 0.00 0.00 66.02 67.19 2q3u s SER 191 CO -0.07 -0.71 1.78 0.50 0.98 0.00 0.00 173.24 175.72 2q3u h LYS 192 N 2.62 0.74 -0.15 4.02 3.64 -1.97 0.04 116.57 125.51 2q3u h LYS 192 Ca -0.37 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 58.80 2q3u h LYS 192 Cb 1.23 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.87 2q3u h LYS 192 CO 0.59 0.49 -0.60 0.93 -2.27 0.00 0.00 179.45 178.59 2q3u h GLU 193 N 0.76 0.49 0.00 1.90 3.07 -2.04 -1.59 114.58 117.17 2q3u h GLU 193 Ca 0.55 -0.33 -0.05 0.00 -0.50 0.00 0.00 59.36 59.02 2q3u h GLU 193 Cb 0.81 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.76 2q3u h GLU 193 CO -0.37 0.94 -0.26 1.96 -1.40 0.00 0.00 179.01 179.88 2q3u h GLN 194 N 0.37 0.00 0.01 2.33 4.20 -1.49 -1.82 115.11 118.71 2q3u h GLN 194 Ca -0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 2q3u h GLN 194 Cb 1.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.92 2q3u h GLN 194 CO 0.11 0.26 -0.01 0.82 -0.67 0.00 0.00 178.83 179.34 2q3u h ILE 195 N 0.00 1.39 -0.80 2.54 2.04 -0.81 -3.16 117.51 118.71 2q3u h ILE 195 Ca -0.00 -1.21 0.10 0.00 1.00 0.00 0.00 64.86 64.74 2q3u h ILE 195 Cb 0.51 2.21 -0.07 0.00 -0.74 0.00 0.00 36.82 38.73 2q3u h ILE 195 CO 0.03 0.31 0.44 -0.33 0.00 0.00 0.00 178.15 178.61 2q3u h GLU 196 N -0.54 0.71 -0.42 2.37 5.08 -1.15 -2.88 114.58 117.76 2q3u h GLU 196 Ca -0.00 -0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.40 2q3u h GLU 196 Cb 0.52 -0.16 -0.09 0.00 0.50 0.00 0.00 28.75 29.52 2q3u h GLU 196 CO 0.00 0.47 -0.28 1.49 -1.00 0.00 0.00 179.01 179.70 2q3u h GLU 197 N 0.74 -0.19 -0.33 2.33 4.57 -1.30 -1.89 114.58 118.50 2q3u h GLU 197 Ca 0.39 0.01 -0.07 0.00 -1.18 0.00 0.00 59.36 58.52 2q3u h GLU 197 Cb 0.39 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.00 2q3u h GLU 197 CO -0.26 -0.13 -0.09 0.93 -1.18 0.00 0.00 179.01 178.29 2q3u h GLU 198 N -0.20 0.55 0.00 1.92 4.39 -1.52 -2.53 114.58 117.19 2q3u h GLU 198 Ca 0.19 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.74 2q3u h GLU 198 Cb 0.50 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2q3u h GLU 198 CO -0.53 0.64 0.00 1.28 -1.16 0.00 0.00 179.01 179.23 2q3u n LEU 199 N -4.22 0.00 -0.09 1.33 4.77 -0.76 -1.11 117.00 116.93 2q3u n LEU 199 Ca 0.01 0.19 -0.15 0.00 -0.03 0.00 0.00 56.01 56.02 2q3u n LEU 199 Cb 0.31 -0.19 -0.09 0.00 -2.33 0.00 0.00 43.42 41.12 2q3u n LEU 199 CO 0.40 -0.09 -0.25 0.11 -1.33 0.00 0.00 177.39 176.24 2q3u h LYS 200 N 0.00 0.00 0.00 3.23 1.57 -0.98 -3.22 116.57 117.17 2q3u h LYS 200 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2q3u h LYS 200 Cb 0.10 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 2q3u h LYS 200 CO 0.00 0.75 -0.15 0.87 -0.57 0.00 0.00 179.45 180.36 2q3u h LYS 201 N -1.00 0.00 0.00 3.15 1.57 -1.39 -2.06 116.57 116.84 2q3u h LYS 201 Ca -0.18 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.26 2q3u h LYS 201 Cb 1.00 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.25 2q3u h LYS 201 CO -0.11 0.15 -2.25 0.66 -0.57 0.00 0.00 179.45 177.33 2q3u n TYR 202 N -3.24 0.17 0.12 -1.35 4.01 -0.26 -1.08 117.16 115.52 2q3u n TYR 202 Ca 0.01 0.06 0.01 0.00 -0.16 0.00 0.00 57.90 57.82 2q3u n TYR 202 Cb 0.44 -1.00 -0.01 0.00 -0.31 0.00 0.00 39.34 38.45 2q3u n TYR 202 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2q3u n LEU 203 N -2.77 0.12 -1.25 7.72 4.77 -1.22 -4.75 117.00 119.62 2q3u n LEU 203 Ca -0.28 -0.50 -0.06 0.00 -0.03 0.00 0.00 56.01 55.14 2q3u n LEU 203 Cb 1.10 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 42.21 2q3u n LEU 203 CO 0.43 0.03 0.06 0.61 -1.33 0.00 0.00 177.39 177.19 2q3u n GLY 204 N 1.07 0.58 3.56 -0.72 0.00 -0.77 -4.60 105.19 104.31 2q3u n GLY 204 Ca 0.00 -0.45 -0.29 0.00 0.00 0.00 0.00 46.02 45.28 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 -3.07 3.25 -0.13 1.61 -7.23 -1.22 -4.34 120.40 109.26 2q3u s VAL 205 Ca 0.14 -1.42 0.03 0.00 -1.81 0.00 0.00 61.98 58.93 2q3u s VAL 205 Cb -0.06 -2.54 -0.10 0.00 0.56 0.00 0.00 36.38 34.23 2q3u s VAL 205 CO 0.18 0.04 -0.08 0.00 -0.31 0.00 0.00 175.10 174.93 2q3u n GLN 206 N 0.52 0.82 -4.36 4.82 3.00 0.31 -4.50 117.38 117.98 2q3u n GLN 206 Ca -0.13 0.06 -0.28 0.00 -0.01 0.00 0.00 57.00 56.64 2q3u n GLN 206 Cb 0.53 -1.28 -0.12 0.00 0.00 0.00 0.00 30.24 29.38 2q3u n GLN 206 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2q3u s SER 207 N -5.10 3.65 -0.02 1.08 1.04 -0.89 -5.05 113.70 108.41 2q3u s SER 207 Ca -0.15 -0.71 0.02 0.00 0.48 0.00 0.00 55.95 55.58 2q3u s SER 207 Cb 0.04 -0.39 0.01 0.00 0.10 0.00 0.00 66.02 65.78 2q3u s SER 207 CO 0.35 0.15 -0.05 -0.36 0.98 0.00 0.00 173.24 174.31 2q3u s PHE 208 N -1.36 0.61 -0.28 5.02 0.40 -1.26 -0.98 117.98 120.13 2q3u s PHE 208 Ca 0.19 -0.13 -0.01 0.00 -0.60 0.00 0.00 56.93 56.38 2q3u s PHE 208 Cb -0.09 -0.47 0.05 0.00 0.51 0.00 0.00 43.02 43.01 2q3u s PHE 208 CO 0.10 -0.08 -0.04 0.42 0.70 0.00 0.00 175.22 176.32 2q3u s ILE 209 N 0.28 2.80 -0.22 0.64 1.01 -0.05 -4.97 121.20 120.69 2q3u s ILE 209 Ca -0.03 -1.35 -0.13 0.00 0.00 0.00 0.00 60.65 59.14 2q3u s ILE 209 Cb -0.07 -2.57 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 2q3u s ILE 209 CO -0.00 -0.02 0.29 0.26 0.00 0.00 0.00 174.94 175.46 2q3u s TRP 210 N 1.24 3.35 -0.30 3.97 0.52 -1.26 -1.55 118.94 124.91 2q3u s TRP 210 Ca -0.05 0.44 -0.09 0.00 0.02 0.00 0.00 56.10 56.42 2q3u s TRP 210 Cb -0.19 -2.40 -0.00 0.00 -1.15 0.00 0.00 33.47 29.72 2q3u s TRP 210 CO -0.03 0.03 0.13 -0.51 0.02 0.00 0.00 176.95 176.59 2q3u s LEU 211 N 1.17 4.01 0.50 2.99 1.43 -0.50 -4.91 118.68 123.37 2q3u s LEU 211 Ca 0.14 -0.58 0.29 0.00 -1.03 0.00 0.00 54.13 52.95 2q3u s LEU 211 Cb -0.14 -1.96 1.39 0.00 0.03 0.00 0.00 46.19 45.51 2q3u s LEU 211 CO 0.06 -0.19 1.84 -0.65 0.23 0.00 0.00 176.35 177.64 2q3u h PRO 212 N 8.31 0.12 -4.03 1.29 0.11 -1.92 -1.89 132.00 133.98 2q3u h PRO 212 Ca -0.32 -0.01 -0.32 0.00 0.11 0.00 0.00 66.00 65.46 2q3u h PRO 212 Cb 1.14 -0.03 -0.30 0.00 0.11 0.00 0.00 31.00 31.92 2q3u h PRO 212 CO 0.61 0.08 -0.75 1.03 -0.21 0.00 0.00 178.00 178.76 2q3u s ARG 213 N -5.11 0.34 0.00 1.05 0.52 -1.26 -0.71 118.95 113.78 2q3u s ARG 213 Ca -0.06 -0.08 0.00 0.00 -0.52 0.00 0.00 55.73 55.07 2q3u s ARG 213 Cb 0.23 -0.38 0.00 0.00 0.52 0.00 0.00 34.95 35.31 2q3u s ARG 213 CO 0.79 0.02 0.00 0.41 0.02 0.00 0.00 175.30 176.53 2q3u n GLY 214 N 3.36 -0.27 3.77 -3.53 0.00 -1.26 -4.79 105.19 102.46 2q3u n GLY 214 Ca -0.17 -1.72 -0.39 0.00 0.00 0.00 0.00 46.02 43.74 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 4.14 0.24 0.99 2.96 -1.26 -4.92 118.68 120.83 2q3u s LEU 215 Ca 0.00 2.62 -0.30 0.00 -0.22 0.00 0.00 54.13 56.23 2q3u s LEU 215 Cb 0.00 -3.99 -0.09 0.00 0.50 0.00 0.00 46.19 42.61 2q3u s LEU 215 CO 0.00 -0.94 0.98 -0.47 -1.32 0.00 0.00 176.35 174.60 2q3u s TYR 216 N -1.31 3.89 0.00 5.38 6.14 -1.26 -3.21 117.35 126.98 2q3u s TYR 216 Ca 0.59 1.87 0.00 0.00 0.64 0.00 0.00 57.07 60.17 2q3u s TYR 216 Cb -0.37 -3.05 0.00 0.00 0.42 0.00 0.00 41.96 38.96 2q3u s TYR 216 CO 0.47 0.23 0.00 0.41 0.64 0.00 0.00 175.55 177.29 2q3u n GLY 217 N 1.47 1.22 2.59 8.97 0.00 -1.26 -4.74 105.19 113.43 2q3u n GLY 217 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 2q3u n GLY 217 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2q3u n ASP 218 N 0.00 7.63 0.00 1.61 4.64 -1.20 -4.40 116.55 124.83 2q3u n ASP 218 Ca 0.00 -3.81 0.04 0.00 -1.38 0.00 0.00 54.79 49.64 2q3u n ASP 218 Cb 0.00 -1.02 0.42 0.00 -1.04 0.00 0.00 41.12 39.48 2q3u n ASP 218 CO 0.00 0.00 0.00 -0.08 -0.82 0.00 0.00 177.20 176.30 2q3u h GLU 219 N 2.44 0.54 -0.30 -0.67 4.57 -1.95 -1.86 114.58 117.35 2q3u h GLU 219 Ca 0.59 -0.04 -0.04 0.00 -1.18 0.00 0.00 59.36 58.70 2q3u h GLU 219 Cb 0.46 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.92 2q3u h GLU 219 CO 1.53 0.36 0.02 -0.44 -1.18 0.00 0.00 179.01 179.30 2q3u h ASP 220 N 0.55 0.42 -0.30 1.04 3.32 -1.95 -1.98 116.42 117.52 2q3u h ASP 220 Ca 0.15 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2q3u h ASP 220 Cb -0.05 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.40 2q3u h ASP 220 CO -0.03 0.47 0.00 0.41 -1.72 0.00 0.00 179.24 178.37 2q3u n THR 221 N -4.32 0.41 -3.75 0.35 -1.04 -1.15 -4.75 114.28 100.02 2q3u n THR 221 Ca 0.01 -0.71 -0.27 0.00 -2.04 0.00 0.00 64.05 61.05 2q3u n THR 221 Cb 0.21 1.06 0.05 0.00 -1.82 0.00 0.00 70.33 69.83 2q3u n THR 221 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2q3u n ASN 222 N 1.35 -5.11 -1.40 8.00 4.13 -0.74 -4.05 115.26 117.43 2q3u n ASN 222 Ca 0.17 -0.68 -0.02 0.00 1.68 0.00 0.00 54.58 55.73 2q3u n ASN 222 Cb 0.57 -4.42 0.01 0.00 -1.54 0.00 0.00 39.78 34.41 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 -1.79 0.38 3.58 7.41 0.00 -0.76 -1.00 105.19 113.01 2q3u n GLY 223 Ca -0.01 -0.36 -0.44 0.00 0.00 0.00 0.00 46.02 45.21 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 -1.48 1.17 -0.06 1.61 8.25 -1.26 -4.14 115.22 119.31 2q3u n HIS 224 Ca -0.04 0.71 0.05 0.00 -0.26 0.00 0.00 57.72 58.18 2q3u n HIS 224 Cb 0.52 -2.23 0.41 0.00 1.12 0.00 0.00 29.99 29.81 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 1.91 1.06 0.00 1.59 6.09 -1.73 -2.77 117.51 123.66 2q3u h ILE 225 Ca -0.39 -0.20 0.00 0.00 -1.37 0.00 0.00 64.86 62.89 2q3u h ILE 225 Cb 1.34 0.42 0.00 0.00 0.47 0.00 0.00 36.82 39.05 2q3u h ILE 225 CO 0.60 0.11 0.00 -0.90 -3.07 0.00 0.00 178.15 174.89 2q3u n ASP 226 N -4.47 0.67 -2.03 2.19 5.75 -0.67 -0.90 116.55 117.09 2q3u n ASP 226 Ca 0.06 0.71 -0.21 0.00 -0.01 0.00 0.00 54.79 55.34 2q3u n ASP 226 Cb 0.13 -0.84 0.18 0.00 -1.03 0.00 0.00 41.12 39.56 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 -2.29 3.73 -4.83 -1.12 5.15 -1.05 -3.72 115.26 111.13 2q3u n ASN 227 Ca 0.01 -3.66 -0.33 0.00 -0.60 0.00 0.00 54.58 50.00 2q3u n ASN 227 Cb 0.16 -0.80 -0.06 0.00 -0.53 0.00 0.00 39.78 38.55 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 -2.63 3.35 -0.04 0.00 0.08 -1.26 0.92 117.98 118.40 2q3u s PHE 231 Ca -0.04 1.17 0.12 0.00 0.12 0.00 0.00 56.93 58.30 2q3u s PHE 231 Cb -0.01 -3.51 -0.09 0.00 -0.57 0.00 0.00 43.02 38.85 2q3u s PHE 231 CO -0.03 -1.66 1.26 0.00 -0.10 0.00 0.00 175.22 174.69 2q3u h ALA 232 N 6.86 0.55 0.00 5.36 0.00 -1.63 -3.46 119.26 126.94 2q3u h ALA 232 Ca -0.41 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 53.75 2q3u h ALA 232 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2q3u h ALA 232 CO 0.83 0.97 0.00 2.89 0.00 0.00 0.00 179.25 183.94 2q3u n ARG 233 N -3.23 0.00 -1.58 0.00 1.85 -1.24 -4.94 116.66 107.53 2q3u n ARG 233 Ca -0.01 0.00 -0.47 0.00 -1.00 0.00 0.00 57.85 56.37 2q3u n ARG 233 Cb 0.85 0.00 -0.03 0.00 -1.05 0.00 0.00 32.46 32.23 2q3u n ARG 233 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2q3u n PRO 234 N -0.30 1.22 0.00 2.89 -0.02 -1.26 -1.93 135.00 135.60 2q3u n PRO 234 Ca 0.00 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2q3u n PRO 234 Cb 0.00 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 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 1.62 2.57 2.93 -1.23 0.00 -1.26 -5.03 105.19 104.79 2q3u n GLY 235 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 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 -2.36 0.03 0.26 1.61 1.01 -0.81 -0.62 120.40 119.51 2q3u s VAL 236 Ca 0.00 -0.23 0.12 0.00 0.00 0.00 0.00 61.98 61.86 2q3u s VAL 236 Cb 0.00 -0.12 -0.05 0.00 0.00 0.00 0.00 36.38 36.21 2q3u s VAL 236 CO 0.00 -0.13 -0.20 0.68 0.00 0.00 0.00 175.10 175.45 2q3u s VAL 237 N -0.38 2.49 -0.23 2.92 -7.23 0.46 -1.72 120.40 116.72 2q3u s VAL 237 Ca -0.04 -2.29 -0.05 0.00 -1.81 0.00 0.00 61.98 57.78 2q3u s VAL 237 Cb -0.03 -2.28 -0.02 0.00 0.56 0.00 0.00 36.38 34.61 2q3u s VAL 237 CO -0.00 -0.33 0.01 -0.76 -0.31 0.00 0.00 175.10 173.71 2q3u s LEU 238 N -3.31 3.14 -0.11 1.32 1.43 0.26 0.50 118.68 121.91 2q3u s LEU 238 Ca 0.28 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 53.08 2q3u s LEU 238 Cb -0.06 -1.82 -0.02 0.00 0.03 0.00 0.00 46.19 44.33 2q3u s LEU 238 CO 0.14 -0.03 -0.15 -0.22 0.23 0.00 0.00 176.35 176.32 2q3u s LEU 239 N 1.54 2.63 0.26 1.79 2.96 0.11 -1.16 118.68 126.81 2q3u s LEU 239 Ca 0.06 -0.34 -0.30 0.00 -0.22 0.00 0.00 54.13 53.33 2q3u s LEU 239 Cb -0.15 -1.57 -0.11 0.00 0.50 0.00 0.00 46.19 44.87 2q3u s LEU 239 CO -0.00 0.20 1.55 -0.44 -1.32 0.00 0.00 176.35 176.34 2q3u s SER 240 N 0.14 6.49 0.03 3.68 0.01 -1.26 -1.41 113.70 121.39 2q3u s SER 240 Ca -0.08 2.81 -0.06 0.00 1.31 0.00 0.00 55.95 59.94 2q3u s SER 240 Cb -0.15 -2.62 -0.01 0.00 0.21 0.00 0.00 66.02 63.45 2q3u s SER 240 CO 0.05 -0.84 0.11 0.86 0.41 0.00 0.00 173.24 173.83 2q3u s TRP 241 N 0.22 0.16 -0.03 2.43 -0.11 -0.46 -4.70 118.94 116.45 2q3u s TRP 241 Ca 0.64 -0.43 -0.10 0.00 1.22 0.00 0.00 56.10 57.43 2q3u s TRP 241 Cb -0.46 -0.12 0.02 0.00 -1.50 0.00 0.00 33.47 31.41 2q3u s TRP 241 CO 0.43 -0.36 0.23 -0.08 -4.62 0.00 0.00 176.95 172.56 2q3u s THR 242 N -2.41 0.05 -1.13 5.86 -1.32 -1.26 -1.27 115.64 114.16 2q3u s THR 242 Ca -0.07 -0.41 0.23 0.00 -1.21 0.00 0.00 61.69 60.24 2q3u s THR 242 Cb -0.02 -0.48 -0.10 0.00 -1.51 0.00 0.00 72.50 70.39 2q3u s THR 242 CO -0.04 -0.22 1.14 0.47 -2.21 0.00 0.00 174.62 173.76 2q3u n ASP 243 N 1.84 0.91 -4.57 8.08 8.00 -1.26 -4.80 116.55 124.75 2q3u n ASP 243 Ca -0.19 -0.77 -0.41 0.00 0.71 0.00 0.00 54.79 54.12 2q3u n ASP 243 Cb 0.56 0.64 -0.03 0.00 -0.02 0.00 0.00 41.12 42.28 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 -2.93 5.98 0.00 -2.24 2.15 -1.26 -4.86 116.67 113.51 2q3u s ASP 244 Ca 0.11 0.23 0.17 0.00 0.43 0.00 0.00 52.55 53.49 2q3u s ASP 244 Cb 0.17 -2.54 0.95 0.00 -0.30 0.00 0.00 42.92 41.19 2q3u s ASP 244 CO 0.76 -1.84 1.45 -0.62 -0.17 0.00 0.00 175.17 174.76 2q3u n GLU 245 N 8.85 0.42 0.00 4.34 1.02 -1.26 -1.25 120.64 132.75 2q3u n GLU 245 Ca 0.13 0.05 0.13 0.00 -0.02 0.00 0.00 57.16 57.46 2q3u n GLU 245 Cb 0.50 -1.50 0.44 0.00 -0.02 0.00 0.00 31.44 30.85 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 -1.12 0.00 -3.47 2.62 -2.24 -1.26 -4.84 114.28 103.98 2q3u n THR 246 Ca 0.11 -0.21 -0.37 0.00 -2.27 0.00 0.00 64.05 61.30 2q3u n THR 246 Cb 0.09 0.52 -0.06 0.00 -2.10 0.00 0.00 70.33 68.77 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 -2.21 6.65 0.60 3.42 -1.08 -0.38 -4.94 116.67 118.72 2q3u s ASP 247 Ca 0.32 0.77 0.30 0.00 -0.52 0.00 0.00 52.55 53.41 2q3u s ASP 247 Cb 0.20 -2.23 1.74 0.00 -1.46 0.00 0.00 42.92 41.16 2q3u s ASP 247 CO 0.41 0.16 2.13 -0.65 0.52 0.00 0.00 175.17 177.75 2q3u h PRO 248 N 5.92 0.00 -0.20 4.34 0.11 -1.88 -0.45 132.00 139.83 2q3u h PRO 248 Ca -0.45 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.60 2q3u h PRO 248 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2q3u h PRO 248 CO 0.70 0.00 -0.14 0.37 -0.21 0.00 0.00 178.00 178.72 2q3u h GLN 249 N 0.00 0.33 -0.87 1.05 5.75 -1.92 -3.23 115.11 116.22 2q3u h GLN 249 Ca 0.06 -0.09 0.16 0.00 -0.15 0.00 0.00 58.65 58.63 2q3u h GLN 249 Cb 0.39 -0.04 -0.10 0.00 1.07 0.00 0.00 27.48 28.80 2q3u h GLN 249 CO -0.00 0.48 0.45 -0.92 -2.65 0.00 0.00 178.83 176.19 2q3u h TYR 250 N 0.31 0.79 0.00 3.99 5.03 -1.30 0.75 116.97 126.54 2q3u h TYR 250 Ca 0.06 0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.35 2q3u h TYR 250 Cb 0.44 -0.22 -0.01 0.00 1.55 0.00 0.00 36.73 38.50 2q3u h TYR 250 CO 0.01 0.17 -0.26 1.05 -1.32 0.00 0.00 178.16 177.81 2q3u h GLU 251 N 0.62 0.00 -0.05 1.82 4.11 -1.73 0.17 114.58 119.52 2q3u h GLU 251 Ca 0.48 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.81 2q3u h GLU 251 Cb 0.72 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.97 2q3u h GLU 251 CO -0.38 0.26 -0.36 0.00 0.07 0.00 0.00 179.01 178.60 2q3u h ARG 252 N 0.00 0.33 0.00 1.06 3.08 -1.05 0.40 114.38 118.20 2q3u h ARG 252 Ca -0.00 -0.29 -0.02 0.00 0.07 0.00 0.00 59.98 59.74 2q3u h ARG 252 Cb 0.64 0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.76 2q3u h ARG 252 CO 0.03 0.95 -0.10 0.77 -1.07 0.00 0.00 179.97 180.56 2q3u h SER 253 N -0.19 0.00 -0.06 7.04 0.02 -0.77 -1.25 113.55 118.34 2q3u h SER 253 Ca -0.03 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.78 2q3u h SER 253 Cb 1.04 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.59 2q3u h SER 253 CO 0.07 0.10 -0.49 0.58 -1.14 0.00 0.00 176.83 175.95 2q3u h VAL 254 N 0.00 1.40 0.15 2.27 2.07 -0.72 -3.10 116.25 118.32 2q3u h VAL 254 Ca -0.00 -1.89 0.02 0.00 0.82 0.00 0.00 66.70 65.65 2q3u h VAL 254 Cb 0.18 2.36 -0.03 0.00 -1.52 0.00 0.00 31.29 32.29 2q3u h VAL 254 CO 0.01 0.55 -0.30 -0.08 0.02 0.00 0.00 177.57 177.78 2q3u h GLU 255 N -0.03 -0.52 -0.77 1.57 4.81 0.01 -2.50 114.58 117.16 2q3u h GLU 255 Ca -0.04 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 2q3u h GLU 255 Cb 1.16 0.12 -0.05 0.00 0.63 0.00 0.00 28.75 30.61 2q3u h GLU 255 CO 0.10 -0.34 0.49 0.00 -0.73 0.00 0.00 179.01 178.52 2q3u h ALA 256 N 0.13 1.01 -0.94 2.92 0.00 -1.45 -2.45 119.26 118.48 2q3u h ALA 256 Ca 0.02 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2q3u h ALA 256 Cb 0.55 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 2q3u h ALA 256 CO -0.16 0.28 0.62 1.25 0.00 0.00 0.00 179.25 181.25 2q3u h LEU 257 N 0.94 1.06 0.09 0.00 5.85 -1.43 -1.05 115.31 120.78 2q3u h LEU 257 Ca 0.31 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 59.01 2q3u h LEU 257 Cb 0.03 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.80 2q3u h LEU 257 CO -0.12 0.75 -0.06 -1.28 -0.34 0.00 0.00 178.44 177.40 2q3u h SER 258 N 1.25 -0.14 -0.89 1.25 0.87 -1.01 -0.58 113.55 114.30 2q3u h SER 258 Ca 0.36 0.01 0.09 0.00 -1.23 0.00 0.00 61.79 61.02 2q3u h SER 258 Cb -0.09 0.04 -0.07 0.00 -0.44 0.00 0.00 62.40 61.84 2q3u h SER 258 CO -0.09 -0.09 0.54 0.58 -0.53 0.00 0.00 176.83 177.24 2q3u h VAL 259 N -0.14 0.95 -0.13 2.23 2.07 -1.19 -2.80 116.25 117.24 2q3u h VAL 259 Ca -0.01 -0.31 -0.07 0.00 0.82 0.00 0.00 66.70 67.13 2q3u h VAL 259 Cb 0.12 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.84 2q3u h VAL 259 CO 0.01 0.17 -0.25 -0.07 0.02 0.00 0.00 177.57 177.44 2q3u h LEU 260 N 0.91 0.23 -1.27 2.57 3.38 -0.86 -2.02 115.31 118.25 2q3u h LEU 260 Ca 0.42 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.32 2q3u h LEU 260 Cb 0.34 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2q3u h LEU 260 CO -0.23 0.49 0.00 0.28 0.09 0.00 0.00 178.44 179.06 2q3u h SER 261 N 0.21 0.00 -0.27 -0.43 0.02 -0.85 -3.02 113.55 109.21 2q3u h SER 261 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 2q3u h SER 261 Cb 0.56 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.10 2q3u h SER 261 CO 0.04 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.32 2q3u n ASN 262 N -2.86 3.08 -4.87 3.07 3.02 -0.80 -4.98 115.26 110.92 2q3u n ASN 262 Ca 0.01 -2.34 -0.35 0.00 -0.03 0.00 0.00 54.58 51.88 2q3u n ASN 262 Cb 0.28 -0.30 -0.05 0.00 -0.61 0.00 0.00 39.78 39.10 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 -1.34 6.58 -0.10 6.41 0.01 -0.97 -5.07 113.70 119.22 2q3u s SER 263 Ca 0.26 0.70 0.04 0.00 1.31 0.00 0.00 55.95 58.26 2q3u s SER 263 Cb 0.18 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 64.27 2q3u s SER 263 CO 0.12 0.21 -0.23 -0.63 0.41 0.00 0.00 173.24 173.12 2q3u s ILE 264 N -1.34 1.98 1.02 1.44 1.01 -1.26 -2.70 121.20 121.34 2q3u s ILE 264 Ca 0.30 -0.97 -0.16 0.00 0.00 0.00 0.00 60.65 59.82 2q3u s ILE 264 Cb -0.14 -1.71 0.21 0.00 0.01 0.00 0.00 42.46 40.83 2q3u s ILE 264 CO 0.17 0.54 1.23 1.51 0.00 0.00 0.00 174.94 178.40 2q3u s ASP 265 N 0.39 2.60 0.59 3.58 1.47 0.11 -4.89 116.67 120.52 2q3u s ASP 265 Ca -0.18 0.47 0.32 0.00 1.18 0.00 0.00 52.55 54.34 2q3u s ASP 265 Cb -0.18 -0.65 1.86 0.00 -0.34 0.00 0.00 42.92 43.61 2q3u s ASP 265 CO 0.08 -3.07 2.25 0.00 0.68 0.00 0.00 175.17 175.11 2q3u h ALA 266 N -1.87 1.42 0.01 2.11 0.00 -1.88 -3.04 119.26 116.00 2q3u h ALA 266 Ca -0.45 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.17 2q3u h ALA 266 Cb 1.27 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 2q3u h ALA 266 CO 0.41 0.02 -1.51 0.54 0.00 0.00 0.00 179.25 178.71 2q3u n ARG 267 N -3.71 0.58 0.00 0.00 1.74 -1.26 -4.97 116.66 109.03 2q3u n ARG 267 Ca -0.03 0.51 0.00 0.00 -0.77 0.00 0.00 57.85 57.56 2q3u n ARG 267 Cb 0.10 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 29.84 2q3u n ARG 267 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2q3u n GLY 268 N 1.43 0.25 3.77 -0.13 0.00 -1.15 -5.12 105.19 104.23 2q3u n GLY 268 Ca -0.36 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 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 0.00 4.26 -0.00 1.61 0.52 -1.26 -4.74 118.95 119.34 2q3u s ARG 269 Ca 0.00 1.80 -0.30 0.00 -0.52 0.00 0.00 55.73 56.71 2q3u s ARG 269 Cb 0.00 -2.83 -0.03 0.00 0.52 0.00 0.00 34.95 32.61 2q3u s ARG 269 CO 0.00 -0.13 1.07 0.15 0.02 0.00 0.00 175.30 176.41 2q3u s LYS 270 N -2.05 4.48 0.12 3.54 1.02 -1.26 -0.72 119.74 124.87 2q3u s LYS 270 Ca 0.53 1.54 -0.31 0.00 0.02 0.00 0.00 55.97 57.74 2q3u s LYS 270 Cb -0.30 -3.45 -0.11 0.00 -0.52 0.00 0.00 37.83 33.45 2q3u s LYS 270 CO 0.38 -0.19 1.83 -0.89 -0.92 0.00 0.00 175.35 175.57 2q3u n ILE 271 N 4.08 0.35 -3.42 2.17 2.08 -1.10 -4.96 119.36 118.57 2q3u n ILE 271 Ca 0.08 -0.06 -0.33 0.00 0.56 0.00 0.00 62.75 63.00 2q3u n ILE 271 Cb 0.49 -2.09 -0.05 0.00 -0.75 0.00 0.00 39.64 37.23 2q3u n ILE 271 CO 0.00 0.00 0.00 -1.58 0.56 0.00 0.00 176.55 175.53 2q3u s GLN 272 N 2.68 3.83 -0.06 0.38 0.74 0.21 -4.70 119.66 122.74 2q3u s GLN 272 Ca 0.82 0.30 0.04 0.00 0.05 0.00 0.00 55.36 56.58 2q3u s GLN 272 Cb -0.50 -2.71 -0.00 0.00 1.10 0.00 0.00 33.01 30.90 2q3u s GLN 272 CO 0.38 0.36 -0.20 0.08 -0.55 0.00 0.00 175.29 175.35 2q3u s VAL 273 N -1.74 1.66 -0.12 1.34 1.01 -1.26 -0.40 120.40 120.89 2q3u s VAL 273 Ca 0.45 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 2q3u s VAL 273 Cb -0.12 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 2q3u s VAL 273 CO 0.21 0.47 -0.07 -0.63 0.00 0.00 0.00 175.10 175.08 2q3u s ILE 274 N 0.13 3.66 -0.15 2.22 1.01 0.18 -4.93 121.20 123.32 2q3u s ILE 274 Ca -0.08 -0.46 -0.21 0.00 0.00 0.00 0.00 60.65 59.91 2q3u s ILE 274 Cb -0.14 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.74 2q3u s ILE 274 CO 0.04 0.53 0.60 -0.54 0.00 0.00 0.00 174.94 175.57 2q3u s LYS 275 N -0.02 4.28 -0.32 2.79 1.02 -1.26 -0.71 119.74 125.52 2q3u s LYS 275 Ca -0.00 0.61 0.02 0.00 0.02 0.00 0.00 55.97 56.62 2q3u s LYS 275 Cb -0.13 -3.52 0.08 0.00 -0.52 0.00 0.00 37.83 33.74 2q3u s LYS 275 CO 0.03 -0.08 0.02 -1.17 -0.92 0.00 0.00 175.35 173.22 2q3u s LEU 276 N 1.38 4.31 0.00 3.17 2.96 -0.50 -4.93 118.68 125.07 2q3u s LEU 276 Ca 0.29 -1.76 -0.30 0.00 -0.22 0.00 0.00 54.13 52.14 2q3u s LEU 276 Cb -0.16 -1.65 -0.05 0.00 0.50 0.00 0.00 46.19 44.83 2q3u s LEU 276 CO 0.12 -0.33 1.23 -0.31 -1.32 0.00 0.00 176.35 175.73 2q3u s TYR 277 N 1.06 3.25 0.70 5.38 2.02 -1.26 -1.36 117.35 127.14 2q3u s TYR 277 Ca 0.02 1.20 -0.14 0.00 -0.37 0.00 0.00 57.07 57.78 2q3u s TYR 277 Cb -0.20 -3.45 0.02 0.00 -0.40 0.00 0.00 41.96 37.93 2q3u s TYR 277 CO -0.05 -1.44 1.13 0.96 -1.57 0.00 0.00 175.55 174.58 2q3u s ILE 278 N 1.75 2.98 1.13 2.71 -4.36 -0.40 -4.86 121.20 120.16 2q3u s ILE 278 Ca 0.58 0.44 -0.13 0.00 -0.26 0.00 0.00 60.65 61.28 2q3u s ILE 278 Cb -0.28 -2.94 0.26 0.00 1.25 0.00 0.00 42.46 40.75 2q3u s ILE 278 CO 0.26 -0.30 1.04 -2.16 0.24 0.00 0.00 174.94 174.02 2q3u s PRO 279 N -4.17 -0.63 0.88 0.37 0.04 -1.26 -4.97 135.00 125.26 2q3u s PRO 279 Ca 0.68 0.70 -0.13 0.00 0.04 0.00 0.00 61.00 62.29 2q3u s PRO 279 Cb -0.22 -1.60 0.04 0.00 0.04 0.00 0.00 34.50 32.76 2q3u s PRO 279 CO 0.45 -3.49 0.60 -0.85 0.04 0.00 0.00 177.00 173.75 2q3u n GLU 280 N -4.73 -0.13 -1.75 4.56 0.28 -1.26 -4.85 120.64 112.76 2q3u n GLU 280 Ca 0.03 0.02 -0.42 0.00 -0.16 0.00 0.00 57.16 56.63 2q3u n GLU 280 Cb 0.55 -1.97 -0.00 0.00 1.43 0.00 0.00 31.44 31.45 2q3u n GLU 280 CO 0.00 0.00 0.00 -2.30 -0.16 0.00 0.00 177.13 174.67 2q3u n PRO 281 N -1.94 2.50 -5.13 3.44 -0.02 -1.26 -5.00 135.00 127.60 2q3u n PRO 281 Ca 0.09 0.88 -0.29 0.00 -2.02 0.00 0.00 63.50 62.15 2q3u n PRO 281 Cb 0.52 -2.56 -0.16 0.00 -0.02 0.00 0.00 33.50 31.28 2q3u n PRO 281 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2q3u s LEU 282 N -1.60 2.02 0.00 2.45 1.43 -1.26 -5.04 118.68 116.69 2q3u s LEU 282 Ca 0.55 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 2q3u s LEU 282 Cb -0.51 -1.22 0.00 0.00 0.03 0.00 0.00 46.19 44.49 2q3u s LEU 282 CO 0.62 0.23 0.00 -1.22 0.23 0.00 0.00 176.35 176.22 2q3u n TYR 283 N 2.87 0.00 -3.85 0.29 4.02 -1.26 0.12 117.16 119.34 2q3u n TYR 283 Ca -0.17 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.63 2q3u n TYR 283 Cb 0.52 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.77 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 2.47 0.14 0.36 -0.72 -4.23 -1.26 -4.78 115.64 107.62 2q3u s THR 285 Ca 0.00 -1.17 0.03 0.00 -1.18 0.00 0.00 61.69 59.38 2q3u s THR 285 Cb 0.00 -1.34 0.26 0.00 1.34 0.00 0.00 72.50 72.76 2q3u s THR 285 CO 0.00 -0.64 2.02 -0.08 -0.54 0.00 0.00 174.62 175.38 2q3u h GLU 286 N 2.74 0.77 -0.68 3.99 4.57 -1.96 0.53 114.58 124.54 2q3u h GLU 286 Ca -0.34 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 57.78 2q3u h GLU 286 Cb 1.20 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 29.59 2q3u h GLU 286 CO 0.56 0.51 0.35 1.49 -1.18 0.00 0.00 179.01 180.74 2q3u h GLU 287 N 0.79 0.96 0.04 1.92 4.81 -2.02 0.22 114.58 121.31 2q3u h GLU 287 Ca 0.21 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2q3u h GLU 287 Cb -0.09 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.11 2q3u h GLU 287 CO -0.05 0.74 -0.02 0.93 -0.73 0.00 0.00 179.01 179.88 2q3u h GLU 288 N 0.94 -0.06 -0.27 1.92 5.08 -1.80 -2.92 114.58 117.47 2q3u h GLU 288 Ca 0.24 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.56 2q3u h GLU 288 Cb 0.07 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2q3u h GLU 288 CO -0.03 0.32 -0.03 0.66 -1.00 0.00 0.00 179.01 178.93 2q3u h SER 289 N -0.44 0.39 0.00 1.42 4.64 0.13 -2.10 113.55 117.59 2q3u h SER 289 Ca -0.01 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2q3u h SER 289 Cb 0.40 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2q3u h SER 289 CO 0.01 0.47 0.00 -1.54 -0.87 0.00 0.00 176.83 174.90 2q3u n SER 290 N -4.30 0.00 -1.08 4.97 3.41 0.78 -2.01 113.62 115.38 2q3u n SER 290 Ca 0.01 -0.80 0.12 0.00 -0.26 0.00 0.00 58.87 57.94 2q3u n SER 290 Cb 0.24 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 64.42 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 0.44 1.56 3.63 5.00 0.00 -0.79 -4.96 105.19 110.07 2q3u n GLY 291 Ca 0.16 -0.70 -0.31 0.00 0.00 0.00 0.00 46.02 45.17 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 -1.52 3.74 -0.04 -0.61 1.01 -0.85 -0.20 121.20 122.72 2q3u s ILE 292 Ca 0.38 -0.95 -0.24 0.00 0.00 0.00 0.00 60.65 59.85 2q3u s ILE 292 Cb 0.22 -2.71 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 2q3u s ILE 292 CO 0.31 0.24 0.72 -0.89 0.00 0.00 0.00 174.94 175.32 2q3u s THR 293 N -1.16 4.98 -0.51 2.92 2.01 0.16 -5.01 115.64 119.04 2q3u s THR 293 Ca 0.21 1.49 -0.17 0.00 0.31 0.00 0.00 61.69 63.54 2q3u s THR 293 Cb -0.11 -4.06 0.08 0.00 0.01 0.00 0.00 72.50 68.42 2q3u s THR 293 CO 0.13 0.27 0.51 -1.10 -0.69 0.00 0.00 174.62 173.74 2q3u s GLN 294 N 0.62 3.02 -0.02 4.92 -0.21 -1.26 -4.10 119.66 122.63 2q3u s GLN 294 Ca 0.38 -1.31 0.09 0.00 0.02 0.00 0.00 55.36 54.54 2q3u s GLN 294 Cb -0.18 -4.17 -0.14 0.00 1.00 0.00 0.00 33.01 29.52 2q3u s GLN 294 CO 0.19 -1.20 0.17 -0.40 -2.12 0.00 0.00 175.29 171.94 2q3u n ASP 295 N 5.57 2.93 0.00 5.90 5.68 -1.26 -5.03 116.55 130.34 2q3u n ASP 295 Ca -0.11 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.18 2q3u n ASP 295 Cb 0.43 1.31 0.00 0.00 -1.14 0.00 0.00 41.12 41.72 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 2.06 1.46 0.00 6.12 0.00 -1.26 -4.86 105.19 108.71 2q3u n GLY 296 Ca -0.04 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.11 2q3u n GLY 296 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2q3u n GLU 297 N -2.00 0.07 -4.04 1.61 -0.58 -1.26 -4.74 120.64 109.70 2q3u n GLU 297 Ca 0.00 0.05 -0.12 0.00 -0.42 0.00 0.00 57.16 56.67 2q3u n GLU 297 Cb 0.00 -1.50 -0.11 0.00 -0.57 0.00 0.00 31.44 29.26 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 -2.92 0.45 1.00 0.62 0.00 -1.26 0.31 121.76 119.96 2q3u s ALA 298 Ca 0.15 -0.69 -0.13 0.00 0.00 0.00 0.00 51.96 51.28 2q3u s ALA 298 Cb 0.17 0.07 0.09 0.00 0.00 0.00 0.00 23.12 23.45 2q3u s ALA 298 CO 0.46 -0.05 0.52 0.44 0.00 0.00 0.00 175.76 177.13 2q3u n ILE 299 N 1.57 0.00 -2.20 0.00 -5.35 -0.85 -4.86 119.36 107.66 2q3u n ILE 299 Ca -0.23 -0.20 -0.39 0.00 -0.27 0.00 0.00 62.75 61.67 2q3u n ILE 299 Cb 0.55 -0.72 -0.01 0.00 -1.74 0.00 0.00 39.64 37.72 2q3u n ILE 299 CO 0.00 0.00 0.00 -2.84 -1.76 0.00 0.00 176.55 171.95 2q3u s PRO 300 N -3.85 4.00 -0.27 6.28 0.02 -1.26 -4.96 135.00 134.97 2q3u s PRO 300 Ca 0.60 1.95 0.00 0.00 0.02 0.00 0.00 61.00 63.57 2q3u s PRO 300 Cb -0.20 -2.69 0.05 0.00 0.02 0.00 0.00 34.50 31.68 2q3u s PRO 300 CO 0.65 -0.40 -0.07 1.03 -0.33 0.00 0.00 177.00 177.89 2q3u s ARG 301 N -2.29 2.45 0.02 5.54 0.52 -1.26 -5.10 118.95 118.83 2q3u s ARG 301 Ca 0.57 -1.23 0.07 0.00 -0.52 0.00 0.00 55.73 54.63 2q3u s ARG 301 Cb -0.33 -3.00 -0.03 0.00 0.52 0.00 0.00 34.95 32.11 2q3u s ARG 301 CO 0.42 -0.54 -0.20 -0.51 0.02 0.00 0.00 175.30 174.49 2q3u s LEU 302 N 1.20 2.49 0.29 2.53 1.43 -1.26 -4.85 118.68 120.52 2q3u s LEU 302 Ca -0.05 -0.43 -0.30 0.00 -1.03 0.00 0.00 54.13 52.32 2q3u s LEU 302 Cb -0.19 -1.46 -0.12 0.00 0.03 0.00 0.00 46.19 44.44 2q3u s LEU 302 CO -0.04 0.27 1.43 0.00 0.23 0.00 0.00 176.35 178.25 2q3u n ALA 303 N 1.78 1.64 -0.01 4.21 0.00 -1.26 -1.85 120.51 125.02 2q3u n ALA 303 Ca -0.16 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.66 2q3u n ALA 303 Cb 0.52 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.64 2q3u n ALA 303 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q3u n GLY 304 N 1.63 1.10 3.76 0.00 0.00 -1.26 -5.00 105.19 105.42 2q3u n GLY 304 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2q3u n GLY 304 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q3u s THR 305 N -2.37 2.44 0.45 2.61 2.01 -0.77 -4.85 115.64 115.16 2q3u s THR 305 Ca 0.00 0.41 -0.25 0.00 0.31 0.00 0.00 61.69 62.15 2q3u s THR 305 Cb 0.00 -3.26 -0.08 0.00 0.01 0.00 0.00 72.50 69.17 2q3u s THR 305 CO 0.00 0.08 1.42 -0.60 -0.69 0.00 0.00 174.62 174.83 2q3u s ARG 306 N -1.14 3.71 0.03 4.92 6.06 -1.26 -4.18 118.95 127.08 2q3u s ARG 306 Ca 0.56 2.40 -0.18 0.00 -2.50 0.00 0.00 55.73 56.00 2q3u s ARG 306 Cb -0.43 -2.66 -0.06 0.00 0.06 0.00 0.00 34.95 31.85 2q3u s ARG 306 CO 0.51 -0.79 0.52 -0.51 -2.50 0.00 0.00 175.30 172.53 2q3u s LEU 307 N -2.70 4.48 -1.43 -0.88 1.43 0.32 -4.91 118.68 114.99 2q3u s LEU 307 Ca 0.61 1.14 -0.09 0.00 -1.03 0.00 0.00 54.13 54.76 2q3u s LEU 307 Cb -0.43 -2.80 0.05 0.00 0.03 0.00 0.00 46.19 43.04 2q3u s LEU 307 CO 0.56 0.25 2.46 0.00 0.23 0.00 0.00 176.35 179.84 2q3u n ALA 308 N 2.01 6.63 -2.61 4.21 0.00 -1.26 -4.70 120.51 124.79 2q3u n ALA 308 Ca -0.11 -3.93 -0.41 0.00 0.00 0.00 0.00 53.44 48.99 2q3u n ALA 308 Cb 0.51 -3.10 -0.06 0.00 0.00 0.00 0.00 19.45 16.81 2q3u n ALA 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2q3u s ALA 309 N 0.72 3.55 -0.02 0.00 0.00 -1.26 -4.93 121.76 119.81 2q3u s ALA 309 Ca 0.55 -0.52 -0.01 0.00 0.00 0.00 0.00 51.96 51.99 2q3u s ALA 309 Cb 0.16 -3.17 0.03 0.00 0.00 0.00 0.00 23.12 20.13 2q3u s ALA 309 CO -0.07 -1.08 0.04 -1.12 0.00 0.00 0.00 175.76 173.54 2q3u s SER 310 N 1.60 0.02 0.38 0.00 0.01 -1.26 -4.69 113.70 109.76 2q3u s SER 310 Ca 0.28 0.08 0.20 0.00 1.31 0.00 0.00 55.95 57.82 2q3u s SER 310 Cb -0.15 -0.01 0.56 0.00 0.21 0.00 0.00 66.02 66.64 2q3u s SER 310 CO 0.11 -0.11 1.67 1.88 0.41 0.00 0.00 173.24 177.21 2q3u h TYR 311 N 7.03 0.00 -0.46 2.43 0.05 -1.90 -2.83 116.97 121.29 2q3u h TYR 311 Ca -0.41 0.00 0.13 0.00 0.05 0.00 0.00 58.73 58.50 2q3u h TYR 311 Cb 1.14 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.86 2q3u h TYR 311 CO 0.48 0.32 0.50 0.28 -1.05 0.00 0.00 178.16 178.69 2q3u h VAL 312 N 0.00 0.35 0.00 -2.88 2.07 -1.87 -2.88 116.25 111.03 2q3u h VAL 312 Ca -0.00 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 2q3u h VAL 312 Cb 1.00 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 2q3u h VAL 312 CO 0.04 0.00 -0.06 0.59 0.02 0.00 0.00 177.57 178.16 2q3u n ASN 313 N -3.68 4.02 -4.85 0.57 5.03 -1.07 -4.83 115.26 110.45 2q3u n ASN 313 Ca 0.08 -2.13 -0.35 0.00 0.87 0.00 0.00 54.58 53.05 2q3u n ASN 313 Cb 0.68 -0.94 -0.06 0.00 -1.02 0.00 0.00 39.78 38.45 2q3u n ASN 313 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.26 176.15 2q3u s PHE 314 N 0.85 3.60 -0.14 3.10 -0.12 -1.09 -1.73 117.98 122.45 2q3u s PHE 314 Ca 0.18 0.98 -0.06 0.00 -0.05 0.00 0.00 56.93 57.99 2q3u s PHE 314 Cb 0.09 -2.31 -0.04 0.00 -0.63 0.00 0.00 43.02 40.13 2q3u s PHE 314 CO 0.00 0.46 0.07 -0.47 -0.05 0.00 0.00 175.22 175.22 2q3u s TYR 315 N -1.44 3.32 -0.13 3.49 5.04 -0.90 -4.69 117.35 122.03 2q3u s TYR 315 Ca 0.36 0.23 -0.18 0.00 -2.44 0.00 0.00 57.07 55.03 2q3u s TYR 315 Cb -0.15 -1.96 -0.04 0.00 0.35 0.00 0.00 41.96 40.16 2q3u s TYR 315 CO 0.19 0.39 0.50 0.42 -1.34 0.00 0.00 175.55 175.70 2q3u s ILE 316 N -0.33 5.16 0.45 3.14 1.01 -1.26 0.29 121.20 129.66 2q3u s ILE 316 Ca 0.09 0.97 0.03 0.00 0.00 0.00 0.00 60.65 61.74 2q3u s ILE 316 Cb -0.12 -3.83 0.03 0.00 0.01 0.00 0.00 42.46 38.55 2q3u s ILE 316 CO 0.02 0.29 0.23 0.00 0.00 0.00 0.00 174.94 175.47 2q3u n ALA 317 N 3.93 0.59 -1.85 9.38 0.00 0.73 -4.82 120.51 128.46 2q3u n ALA 317 Ca -0.06 -1.87 -0.38 0.00 0.00 0.00 0.00 53.44 51.13 2q3u n ALA 317 Cb 0.51 0.86 -0.03 0.00 0.00 0.00 0.00 19.45 20.79 2q3u n ALA 317 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2q3u s ASN 318 N -3.58 4.97 -0.14 0.00 0.01 -1.26 -1.81 114.94 113.13 2q3u s ASN 318 Ca 0.17 0.65 0.00 0.00 -0.71 0.00 0.00 52.86 52.98 2q3u s ASN 318 Cb -0.01 -2.52 0.00 0.00 0.41 0.00 0.00 41.25 39.13 2q3u s ASN 318 CO 0.11 -2.55 0.00 0.61 -1.51 0.00 0.00 177.10 173.76 2q3u n GLY 319 N 5.81 0.40 3.24 0.66 0.00 -1.26 -4.70 105.19 109.34 2q3u n GLY 319 Ca 0.27 -0.09 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.13 1.06 -0.14 -0.02 0.00 -0.75 -0.86 107.32 104.48 2q3u s GLY 320 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 44.72 43.35 2q3u s GLY 320 CO 0.00 -1.45 -0.12 -0.42 0.00 0.00 0.00 173.10 171.11 2q3u s ILE 321 N -2.66 1.41 -0.49 0.90 -1.09 -0.57 -0.20 121.20 118.50 2q3u s ILE 321 Ca 0.12 -0.54 -0.14 0.00 -2.23 0.00 0.00 60.65 57.86 2q3u s ILE 321 Cb -0.02 -1.35 0.10 0.00 -1.58 0.00 0.00 42.46 39.62 2q3u s ILE 321 CO 0.02 0.43 0.40 -0.63 -1.23 0.00 0.00 174.94 173.94 2q3u s ILE 322 N 1.50 4.94 0.21 2.92 -1.09 0.15 -0.82 121.20 129.00 2q3u s ILE 322 Ca 0.04 -1.36 0.08 0.00 -2.23 0.00 0.00 60.65 57.17 2q3u s ILE 322 Cb -0.13 -4.07 -0.04 0.00 -1.58 0.00 0.00 42.46 36.64 2q3u s ILE 322 CO -0.09 -0.70 0.05 0.00 -1.23 0.00 0.00 174.94 172.97 2q3u s ALA 323 N 1.56 3.31 0.45 9.38 0.00 -0.35 -2.11 121.76 133.99 2q3u s ALA 323 Ca 0.04 -1.43 -0.18 0.00 0.00 0.00 0.00 51.96 50.39 2q3u s ALA 323 Cb -0.26 -1.04 -0.09 0.00 0.00 0.00 0.00 23.12 21.72 2q3u s ALA 323 CO 0.04 0.39 0.93 -1.25 0.00 0.00 0.00 175.76 175.86 2q3u s PRO 324 N -3.31 4.05 -0.16 0.00 0.04 -1.26 -0.03 135.00 134.32 2q3u s PRO 324 Ca 0.30 0.95 0.00 0.00 0.04 0.00 0.00 61.00 62.29 2q3u s PRO 324 Cb -0.08 -2.21 0.03 0.00 0.04 0.00 0.00 34.50 32.28 2q3u s PRO 324 CO 0.21 -0.11 -0.09 -0.65 0.04 0.00 0.00 177.00 176.39 2q3u s GLN 325 N -3.58 1.86 -0.15 4.56 -1.52 0.29 -4.67 119.66 116.45 2q3u s GLN 325 Ca 0.59 -0.59 0.06 0.00 -1.95 0.00 0.00 55.36 53.47 2q3u s GLN 325 Cb -0.10 -2.09 -0.23 0.00 -0.22 0.00 0.00 33.01 30.37 2q3u s GLN 325 CO 0.22 -0.35 0.24 1.19 -0.25 0.00 0.00 175.29 176.34 2q3u n PHE 326 N 4.80 0.62 0.00 0.91 0.99 -1.26 -1.83 117.46 121.70 2q3u n PHE 326 Ca -0.14 0.17 0.00 0.00 -0.00 0.00 0.00 57.45 57.48 2q3u n PHE 326 Cb 0.48 -1.10 0.00 0.00 -1.00 0.00 0.00 39.48 37.87 2q3u n PHE 326 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2q3u n GLY 327 N 1.89 1.21 3.57 1.37 0.00 -1.26 -4.33 105.19 107.64 2q3u n GLY 327 Ca -0.31 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.21 6.54 0.50 1.61 3.68 -1.26 -4.94 116.67 122.60 2q3u s ASP 328 Ca 0.00 0.24 0.24 0.00 2.13 0.00 0.00 52.55 55.16 2q3u s ASP 328 Cb 0.00 -2.45 1.34 0.00 -1.45 0.00 0.00 42.92 40.37 2q3u s ASP 328 CO 0.00 -0.97 2.06 -0.65 0.13 0.00 0.00 175.17 175.74 2q3u h PRO 329 N 8.88 0.00 0.07 4.34 0.11 -1.99 -2.41 132.00 140.99 2q3u h PRO 329 Ca -0.24 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.77 2q3u h PRO 329 Cb 1.08 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.20 2q3u h PRO 329 CO 1.00 0.13 -0.46 0.82 -0.21 0.00 0.00 178.00 179.28 2q3u h ILE 330 N 0.00 1.61 0.00 4.15 2.04 -2.00 -3.16 117.51 120.15 2q3u h ILE 330 Ca -0.00 -2.43 -0.05 0.00 1.00 0.00 0.00 64.86 63.38 2q3u h ILE 330 Cb 0.31 3.25 -0.01 0.00 -0.74 0.00 0.00 36.82 39.63 2q3u h ILE 330 CO 0.02 0.65 -0.22 0.03 0.00 0.00 0.00 178.15 178.64 2q3u h ARG 331 N -0.69 0.00 -0.26 2.37 2.47 -1.95 -1.78 114.38 114.54 2q3u h ARG 331 Ca -0.09 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.55 2q3u h ARG 331 Cb 1.33 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.65 2q3u h ARG 331 CO 0.07 0.22 -0.15 -0.44 0.56 0.00 0.00 179.97 180.22 2q3u h ASP 332 N 0.00 0.58 -0.30 7.04 3.32 -1.54 -1.10 116.42 124.41 2q3u h ASP 332 Ca -0.00 -0.42 -0.16 0.00 0.02 0.00 0.00 57.03 56.47 2q3u h ASP 332 Cb 0.81 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.20 2q3u h ASP 332 CO 0.03 0.87 -0.42 0.50 -1.72 0.00 0.00 179.24 178.50 2q3u h LYS 333 N 0.28 0.82 -0.42 3.56 3.64 -1.49 -2.51 116.57 120.45 2q3u h LYS 333 Ca 0.05 -0.48 -0.05 0.00 -1.27 0.00 0.00 60.65 58.91 2q3u h LYS 333 Cb 0.67 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.51 2q3u h LYS 333 CO 0.04 1.11 0.06 1.49 -2.27 0.00 0.00 179.45 179.88 2q3u h GLU 334 N 0.59 0.65 -0.07 1.90 4.57 -1.24 -0.66 114.58 120.32 2q3u h GLU 334 Ca 0.03 -0.13 -0.21 0.00 -1.18 0.00 0.00 59.36 57.88 2q3u h GLU 334 Cb 1.02 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.51 2q3u h GLU 334 CO 0.10 0.62 -0.81 0.00 -1.18 0.00 0.00 179.01 177.74 2q3u h ALA 335 N 1.45 0.47 -0.41 2.92 0.00 -1.13 0.78 119.26 123.32 2q3u h ALA 335 Ca 0.14 -0.64 -0.10 0.00 0.00 0.00 0.00 54.91 54.31 2q3u h ALA 335 Cb 0.30 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2q3u h ALA 335 CO 0.00 0.76 -0.13 0.82 0.00 0.00 0.00 179.25 180.70 2q3u h ILE 336 N 0.31 1.26 -0.13 0.00 1.08 -0.99 -1.78 117.51 117.27 2q3u h ILE 336 Ca -0.05 -1.19 -0.01 0.00 -0.39 0.00 0.00 64.86 63.22 2q3u h ILE 336 Cb 1.41 1.09 -0.01 0.00 -3.07 0.00 0.00 36.82 36.25 2q3u h ILE 336 CO 0.14 0.40 0.05 -0.09 -0.69 0.00 0.00 178.15 177.97 2q3u h ARG 337 N 0.68 0.19 -0.26 2.37 2.43 -0.70 0.36 114.38 119.45 2q3u h ARG 337 Ca 0.11 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2q3u h ARG 337 Cb 0.61 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 2q3u h ARG 337 CO 0.04 0.30 0.15 0.28 -1.51 0.00 0.00 179.97 179.23 2q3u h VAL 338 N 0.04 1.11 -0.40 0.20 2.07 -0.81 -2.13 116.25 116.33 2q3u h VAL 338 Ca 0.04 -0.29 -0.08 0.00 0.82 0.00 0.00 66.70 67.19 2q3u h VAL 338 Cb 0.18 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 2q3u h VAL 338 CO -0.00 0.11 -0.09 -0.07 0.02 0.00 0.00 177.57 177.54 2q3u h LEU 339 N 0.32 0.68 -1.17 2.57 3.38 -1.29 -0.22 115.31 119.58 2q3u h LEU 339 Ca 0.09 -0.19 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 2q3u h LEU 339 Cb 0.05 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2q3u h LEU 339 CO -0.02 0.80 -0.39 0.28 0.09 0.00 0.00 178.44 179.21 2q3u h SER 340 N 0.64 0.00 0.59 -0.43 0.02 -0.56 -1.17 113.55 112.63 2q3u h SER 340 Ca 0.12 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.84 2q3u h SER 340 Cb 0.53 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 2q3u h SER 340 CO 0.03 0.39 -1.01 -0.78 -1.14 0.00 0.00 176.83 174.32 2q3u h ASP 341 N 0.00 0.34 0.81 3.07 1.82 -1.07 -3.24 116.42 118.14 2q3u h ASP 341 Ca -0.00 -0.30 -0.13 0.00 -0.39 0.00 0.00 57.03 56.20 2q3u h ASP 341 Cb 0.75 -0.11 -0.02 0.00 0.68 0.00 0.00 39.33 40.64 2q3u h ASP 341 CO 0.05 1.15 -0.62 0.74 -1.61 0.00 0.00 179.24 178.95 2q3u h THR 342 N 0.11 1.31 -2.13 2.25 2.02 -0.67 -3.34 112.91 112.47 2q3u h THR 342 Ca -0.07 -2.22 -0.58 0.00 0.77 0.00 0.00 66.41 64.31 2q3u h THR 342 Cb 1.68 2.24 -0.41 0.00 -1.74 0.00 0.00 68.15 69.92 2q3u h THR 342 CO 0.16 0.61 -0.79 0.49 0.37 0.00 0.00 175.52 176.36 2q3u n PHE 343 N -3.61 2.24 0.28 3.16 3.01 -0.48 -4.94 117.46 117.12 2q3u n PHE 343 Ca -0.00 -3.94 0.14 0.00 1.01 0.00 0.00 57.45 54.65 2q3u n PHE 343 Cb 0.66 -0.48 0.65 0.00 -0.01 0.00 0.00 39.48 40.30 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 4.01 0.00 -0.67 -1.08 0.13 -1.69 -1.92 132.00 130.77 2q3u h PRO 344 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2q3u h PRO 344 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 2q3u h PRO 344 CO 0.70 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.19 2q3u n HIS 345 N -2.45 1.28 -4.28 1.56 8.25 -1.26 -4.94 115.22 113.37 2q3u n HIS 345 Ca -0.00 -0.54 -0.20 0.00 -0.26 0.00 0.00 57.72 56.72 2q3u n HIS 345 Cb 0.13 -0.16 -0.11 0.00 1.12 0.00 0.00 29.99 30.97 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 -1.58 1.60 -0.31 4.41 3.76 -0.72 -4.78 115.29 117.66 2q3u s HIS 346 Ca 0.49 -0.51 -0.16 0.00 -0.15 0.00 0.00 55.06 54.73 2q3u s HIS 346 Cb 0.29 -0.82 -0.02 0.00 1.11 0.00 0.00 32.58 33.14 2q3u s HIS 346 CO 0.27 0.23 0.40 0.45 -0.85 0.00 0.00 174.74 175.23 2q3u s SER 347 N -2.54 6.24 0.03 1.40 0.15 -0.04 -4.89 113.70 114.06 2q3u s SER 347 Ca 0.12 0.02 -0.27 0.00 0.70 0.00 0.00 55.95 56.52 2q3u s SER 347 Cb -0.05 -2.22 -0.05 0.00 -1.71 0.00 0.00 66.02 61.99 2q3u s SER 347 CO 0.05 -0.31 0.86 -0.69 1.20 0.00 0.00 173.24 174.35 2q3u s VAL 348 N 2.12 4.75 -0.18 4.45 1.01 -1.26 -1.52 120.40 129.77 2q3u s VAL 348 Ca 0.15 1.82 0.00 0.00 0.00 0.00 0.00 61.98 63.95 2q3u s VAL 348 Cb -0.16 -4.21 0.04 0.00 0.00 0.00 0.00 36.38 32.05 2q3u s VAL 348 CO 0.11 0.28 -0.09 -0.69 0.00 0.00 0.00 175.10 174.72 2q3u s VAL 349 N 0.35 1.43 0.26 2.92 1.01 -0.00 -4.95 120.40 121.43 2q3u s VAL 349 Ca 0.44 -0.84 -0.20 0.00 0.00 0.00 0.00 61.98 61.38 2q3u s VAL 349 Cb -0.21 -1.54 -0.09 0.00 0.00 0.00 0.00 36.38 34.55 2q3u s VAL 349 CO 0.25 0.17 0.76 -0.83 0.00 0.00 0.00 175.10 175.46 2q3u s GLY 350 N 1.49 2.58 -0.28 4.51 0.00 -1.26 -1.22 107.32 113.14 2q3u s GLY 350 Ca -0.00 0.20 -0.07 0.00 0.00 0.00 0.00 44.72 44.85 2q3u s GLY 350 CO -0.08 0.53 0.07 -0.42 0.00 0.00 0.00 173.10 173.20 2q3u s ILE 351 N -1.65 3.99 0.54 0.90 -1.09 0.95 -4.92 121.20 119.93 2q3u s ILE 351 Ca 0.47 -0.55 -0.18 0.00 -2.23 0.00 0.00 60.65 58.15 2q3u s ILE 351 Cb -0.15 -2.99 -0.06 0.00 -1.58 0.00 0.00 42.46 37.68 2q3u s ILE 351 CO 0.20 0.17 1.07 -1.61 -1.23 0.00 0.00 174.94 173.55 2q3u s GLU 352 N 1.53 3.50 -1.42 2.79 0.41 -1.26 -0.55 118.70 123.69 2q3u s GLU 352 Ca 0.04 1.38 -0.04 0.00 -0.41 0.00 0.00 54.97 55.93 2q3u s GLU 352 Cb -0.16 -2.05 0.00 0.00 -1.78 0.00 0.00 34.13 30.14 2q3u s GLU 352 CO 0.02 -0.69 0.58 0.09 -0.49 0.00 0.00 175.26 174.78 2q3u n ASN 353 N -1.43 -5.79 0.24 -0.19 5.03 -1.19 -4.87 115.26 107.05 2q3u n ASN 353 Ca 0.10 -0.27 0.11 0.00 0.87 0.00 0.00 54.58 55.38 2q3u n ASN 353 Cb 0.52 -4.60 0.56 0.00 -1.02 0.00 0.00 39.78 35.24 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 0.92 1.12 -1.02 5.41 0.00 -1.44 -2.49 119.26 121.76 2q3u h ALA 354 Ca -0.49 -0.18 0.25 0.00 0.00 0.00 0.00 54.91 54.49 2q3u h ALA 354 Cb 1.34 -0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.99 2q3u h ALA 354 CO 0.52 0.24 0.64 -0.09 0.00 0.00 0.00 179.25 180.56 2q3u h ARG 355 N 0.00 0.48 -0.80 0.00 2.43 -1.75 0.57 114.38 115.30 2q3u h ARG 355 Ca -0.00 -0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.23 2q3u h ARG 355 Cb 0.59 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.98 2q3u h ARG 355 CO 0.03 0.32 0.52 0.93 -1.51 0.00 0.00 179.97 180.25 2q3u h GLU 356 N 0.49 0.75 -0.30 0.20 4.39 -1.82 -1.23 114.58 117.07 2q3u h GLU 356 Ca 0.61 -0.05 -0.16 0.00 0.34 0.00 0.00 59.36 60.10 2q3u h GLU 356 Cb 1.35 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.82 2q3u h GLU 356 CO -0.36 0.50 -0.45 0.82 -1.16 0.00 0.00 179.01 178.36 2q3u h ILE 357 N 0.77 1.29 -0.01 3.13 2.04 -1.08 -3.12 117.51 120.54 2q3u h ILE 357 Ca 0.36 -1.63 -0.07 0.00 1.00 0.00 0.00 64.86 64.51 2q3u h ILE 357 Cb 0.38 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 2q3u h ILE 357 CO -0.14 0.53 -0.35 0.58 0.00 0.00 0.00 178.15 178.77 2q3u h VAL 358 N 0.62 1.26 -0.04 1.67 2.07 -0.28 -1.26 116.25 120.28 2q3u h VAL 358 Ca 0.04 -1.22 0.01 0.00 0.82 0.00 0.00 66.70 66.36 2q3u h VAL 358 Cb 1.01 1.65 -0.00 0.00 -1.52 0.00 0.00 31.29 32.43 2q3u h VAL 358 CO 0.10 0.35 0.06 -0.07 0.02 0.00 0.00 177.57 178.03 2q3u h LEU 359 N 0.01 0.00 -1.63 2.57 3.38 -1.19 0.40 115.31 118.85 2q3u h LEU 359 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2q3u h LEU 359 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2q3u h LEU 359 CO 0.05 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.58 2q3u n ALA 360 N -2.27 2.49 -0.68 1.53 0.00 -0.50 -4.94 120.51 116.14 2q3u n ALA 360 Ca -0.02 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.77 2q3u n ALA 360 Cb 0.15 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 1.30 1.09 3.28 0.00 0.00 0.14 -5.06 105.19 105.94 2q3u n GLY 361 Ca 0.17 -0.41 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.55 1.50 1.09 -0.02 0.00 -1.05 -4.98 105.19 100.18 2q3u n GLY 362 Ca 0.00 -1.37 -0.05 0.00 0.00 0.00 0.00 46.02 44.60 2q3u n GLY 362 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2q3u n ASN 363 N -1.55 -0.44 -0.25 1.61 2.85 -1.26 -1.49 115.26 114.73 2q3u n ASN 363 Ca -0.05 -1.62 0.02 0.00 -0.11 0.00 0.00 54.58 52.82 2q3u n ASN 363 Cb 0.54 0.82 0.14 0.00 1.24 0.00 0.00 39.78 42.52 2q3u n ASN 363 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 2q3u h ILE 364 N 1.33 0.84 0.00 -1.44 2.04 -1.93 -1.19 117.51 117.16 2q3u h ILE 364 Ca -0.09 -0.21 -0.05 0.00 1.00 0.00 0.00 64.86 65.51 2q3u h ILE 364 Cb 0.39 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 2q3u h ILE 364 CO 0.12 0.11 -0.26 -0.74 0.00 0.00 0.00 178.15 177.38 2q3u h HIS 365 N 0.61 0.00 0.00 1.37 2.76 -1.61 -2.87 115.15 115.40 2q3u h HIS 365 Ca 0.36 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.53 2q3u h HIS 365 Cb 0.38 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.34 2q3u h HIS 365 CO -0.11 0.26 0.00 0.00 -1.30 0.00 0.00 177.93 176.78 2q3u n ILE 367 N -2.78 0.29 -4.36 0.00 -5.35 -1.09 -1.86 119.36 104.22 2q3u n ILE 367 Ca 0.03 -0.64 -0.26 0.00 -0.27 0.00 0.00 62.75 61.60 2q3u n ILE 367 Cb 0.38 1.19 -0.10 0.00 -1.74 0.00 0.00 39.64 39.37 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 -1.71 2.84 -0.24 7.28 -4.23 -1.19 -3.78 115.64 114.61 2q3u s THR 368 Ca 0.34 -1.89 -0.03 0.00 -1.18 0.00 0.00 61.69 58.93 2q3u s THR 368 Cb 0.22 -2.41 0.10 0.00 1.34 0.00 0.00 72.50 71.75 2q3u s THR 368 CO 0.31 -0.16 0.19 -1.58 -0.54 0.00 0.00 174.62 172.84 2q3u s GLN 369 N -2.91 0.20 0.44 3.99 2.00 0.88 -2.66 119.66 121.60 2q3u s GLN 369 Ca 0.24 -0.12 -0.24 0.00 -2.00 0.00 0.00 55.36 53.24 2q3u s GLN 369 Cb -0.08 -1.17 -0.08 0.00 0.80 0.00 0.00 33.01 32.48 2q3u s GLN 369 CO 0.14 -0.84 1.25 1.14 -0.50 0.00 0.00 175.29 176.47 2q3u s GLN 370 N 2.24 3.79 -0.40 1.67 0.00 -1.26 -1.18 119.66 124.52 2q3u s GLN 370 Ca 0.07 2.00 -0.08 0.00 -0.00 0.00 0.00 55.36 57.35 2q3u s GLN 370 Cb -0.15 -2.56 0.07 0.00 0.00 0.00 0.00 33.01 30.37 2q3u s GLN 370 CO -0.23 -0.59 0.21 -1.14 0.00 0.00 0.00 175.29 173.54 2q3u s GLN 371 N -2.49 2.54 1.04 9.60 0.74 -0.00 -4.65 119.66 126.43 2q3u s GLN 371 Ca 0.61 -1.43 -0.19 0.00 0.05 0.00 0.00 55.36 54.40 2q3u s GLN 371 Cb -0.34 -3.67 -0.01 0.00 1.10 0.00 0.00 33.01 30.09 2q3u s GLN 371 CO 0.43 -0.89 -0.34 -2.30 -0.55 0.00 0.00 175.29 171.64 2q3u n PRO 372 N 4.85 -0.75 -3.29 1.67 -0.02 -1.26 -1.04 135.00 135.16 2q3u n PRO 372 Ca -0.10 -0.20 -0.38 0.00 -2.02 0.00 0.00 63.50 60.80 2q3u n PRO 372 Cb 0.43 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.36 2q3u n PRO 372 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2q3u s ALA 373 N -2.19 3.47 -0.28 3.55 0.00 -0.49 -3.87 121.76 121.94 2q3u s ALA 373 Ca 0.50 -0.15 -0.29 0.00 0.00 0.00 0.00 51.96 52.02 2q3u s ALA 373 Cb -0.10 -2.67 -0.01 0.00 0.00 0.00 0.00 23.12 20.33 2q3u s ALA 373 CO 0.69 0.01 1.53 -2.00 0.00 0.00 0.00 175.76 175.99 2q3u s GLU 374 N 0.58 3.73 0.49 0.00 2.12 -1.26 -4.98 118.70 119.39 2q3u s GLU 374 Ca 0.27 1.42 -0.21 0.00 0.36 0.00 0.00 54.97 56.81 2q3u s GLU 374 Cb -0.15 -4.02 -0.09 0.00 0.26 0.00 0.00 34.13 30.12 2q3u s GLU 374 CO 0.11 -1.37 0.77 -2.30 -0.54 0.00 0.00 175.26 171.93 2q3u n PRO 375 N 7.74 0.86 0.00 4.30 -0.02 -1.26 -4.96 135.00 141.66 2q3u n PRO 375 Ca 0.18 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 2q3u n PRO 375 Cb 0.46 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 2q3u n PRO 375 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11