#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 2.74 -0.35 -0.14 2.02 -1.26 -5.05 118.70 116.66 2q3u s GLU 6 Ca 0.00 1.30 -0.03 0.00 0.02 0.00 0.00 54.97 56.25 2q3u s GLU 6 Cb 0.00 -1.95 0.07 0.00 0.10 0.00 0.00 34.13 32.35 2q3u s GLU 6 CO 0.00 -1.28 0.10 0.45 0.02 0.00 0.00 175.26 174.55 2q3u s SER 7 N -2.85 5.12 0.23 -0.19 0.15 -1.26 -5.01 113.70 109.90 2q3u s SER 7 Ca 0.65 -1.53 -0.07 0.00 0.70 0.00 0.00 55.95 55.70 2q3u s SER 7 Cb -0.19 -1.79 0.40 0.00 -1.71 0.00 0.00 66.02 62.73 2q3u s SER 7 CO 0.45 -0.38 1.70 -0.65 1.20 0.00 0.00 173.24 175.55 2q3u h PRO 8 N 8.07 0.28 -0.81 5.44 0.11 -1.90 -3.06 132.00 140.14 2q3u h PRO 8 Ca -0.19 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.93 2q3u h PRO 8 Cb 1.06 -0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.06 2q3u h PRO 8 CO 0.61 0.19 0.53 0.00 -0.21 0.00 0.00 178.00 179.12 2q3u h ALA 9 N 1.56 1.47 0.00 -0.75 0.00 -0.97 0.15 119.26 120.71 2q3u h ALA 9 Ca 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2q3u h ALA 9 Cb 0.61 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2q3u h ALA 9 CO -0.46 0.47 0.00 0.39 0.00 0.00 0.00 179.25 179.65 2q3u n GLU 10 N -4.43 0.66 -0.02 0.00 1.02 -1.15 -0.69 120.64 116.02 2q3u n GLU 10 Ca 0.10 0.01 0.01 0.00 -0.02 0.00 0.00 57.16 57.26 2q3u n GLU 10 Cb 0.07 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.01 2q3u n GLU 10 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2q3u n HIS 11 N -1.06 0.04 -0.76 -0.32 8.25 -0.63 -4.99 115.22 115.75 2q3u n HIS 11 Ca 0.16 -0.27 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 2q3u n HIS 11 Cb 0.10 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.19 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 -0.13 0.68 3.81 -1.41 0.00 0.13 -4.86 105.19 103.41 2q3u n GLY 12 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.33 3.16 0.00 1.61 2.02 0.43 -4.59 117.35 117.66 2q3u s TYR 13 Ca 0.00 1.57 0.00 0.00 -0.37 0.00 0.00 57.07 58.27 2q3u s TYR 13 Cb 0.00 -2.95 0.00 0.00 -0.40 0.00 0.00 41.96 38.61 2q3u s TYR 13 CO 0.00 -0.53 0.00 2.48 -1.57 0.00 0.00 175.55 175.93 2q3u n TYR 14 N -0.99 0.00 -4.44 2.71 0.18 -0.80 -4.02 117.16 109.80 2q3u n TYR 14 Ca 0.08 0.00 -0.21 0.00 1.88 0.00 0.00 57.90 59.65 2q3u n TYR 14 Cb 0.53 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.39 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 2.66 1.62 0.53 -3.48 0.04 -1.26 -2.52 135.00 132.59 2q3u s PRO 16 Ca 0.00 -1.88 -0.17 0.00 0.04 0.00 0.00 61.00 58.99 2q3u s PRO 16 Cb 0.00 -0.93 -0.07 0.00 0.04 0.00 0.00 34.50 33.55 2q3u s PRO 16 CO 0.00 -0.14 1.01 0.00 0.04 0.00 0.00 177.00 177.91 2q3u s ALA 17 N -3.24 2.94 0.25 8.56 0.00 -1.26 -4.61 121.76 124.41 2q3u s ALA 17 Ca 0.35 0.31 0.32 0.00 0.00 0.00 0.00 51.96 52.94 2q3u s ALA 17 Cb 0.08 -3.17 1.76 0.00 0.00 0.00 0.00 23.12 21.79 2q3u s ALA 17 CO 0.14 -0.39 1.99 1.49 0.00 0.00 0.00 175.76 178.99 2q3u h GLU 18 N 0.91 0.00 -0.39 0.00 4.81 -1.96 -1.46 114.58 116.49 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 1.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.58 2q3u h GLU 18 CO 0.60 0.00 0.00 -2.67 -0.73 0.00 0.00 179.01 176.21 2q3u n TRP 19 N -2.66 0.52 -3.25 0.92 2.14 -1.26 -4.72 117.44 109.13 2q3u n TRP 19 Ca -0.02 -0.26 -0.23 0.00 2.07 0.00 0.00 57.50 59.06 2q3u n TRP 19 Cb 0.08 0.00 -0.00 0.00 -0.81 0.00 0.00 31.31 30.58 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 -1.06 6.12 0.04 -0.67 1.11 -0.55 -4.97 116.67 116.68 2q3u s ASP 20 Ca 0.28 0.36 -0.38 0.00 0.18 0.00 0.00 52.55 52.99 2q3u s ASP 20 Cb 0.15 -1.82 -0.19 0.00 1.07 0.00 0.00 42.92 42.13 2q3u s ASP 20 CO 0.20 -0.44 1.17 -0.24 1.18 0.00 0.00 175.17 177.04 2q3u n SER 21 N -1.88 0.66 -4.66 0.27 2.88 -1.26 -4.89 113.62 104.74 2q3u n SER 21 Ca -0.02 1.14 -0.35 0.00 -1.33 0.00 0.00 58.87 58.31 2q3u n SER 21 Cb 0.57 -1.03 -0.10 0.00 -0.75 0.00 0.00 64.21 62.90 2q3u n SER 21 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2q3u s HIS 22 N 0.17 3.23 0.05 0.66 3.76 -1.26 0.12 115.29 122.01 2q3u s HIS 22 Ca 0.88 0.10 -0.17 0.00 -0.15 0.00 0.00 55.06 55.72 2q3u s HIS 22 Cb -1.13 -1.95 -0.20 0.00 1.11 0.00 0.00 32.58 30.41 2q3u s HIS 22 CO 0.53 0.29 1.21 0.00 -0.85 0.00 0.00 174.74 175.91 2q3u h ALA 23 N 6.02 0.18 -2.42 -1.40 0.00 -0.23 -3.39 119.26 118.01 2q3u h ALA 23 Ca -0.42 -0.57 0.15 0.00 0.00 0.00 0.00 54.91 54.07 2q3u h ALA 23 Cb 1.19 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.90 2q3u h ALA 23 CO 0.63 0.49 0.45 1.14 0.00 0.00 0.00 179.25 181.96 2q3u s GLN 24 N -3.52 1.22 -0.05 0.00 -2.07 -0.86 -4.25 119.66 110.13 2q3u s GLN 24 Ca -0.12 -0.65 0.05 0.00 -1.82 0.00 0.00 55.36 52.82 2q3u s GLN 24 Cb 0.06 0.43 -0.02 0.00 -1.09 0.00 0.00 33.01 32.39 2q3u s GLN 24 CO 0.86 -0.56 -0.21 0.99 -1.32 0.00 0.00 175.29 175.05 2q3u s THR 25 N -3.35 2.45 -0.11 3.63 2.01 0.13 0.08 115.64 120.48 2q3u s THR 25 Ca 0.11 -0.94 -0.03 0.00 0.31 0.00 0.00 61.69 61.14 2q3u s THR 25 Cb -0.02 -1.92 -0.03 0.00 0.01 0.00 0.00 72.50 70.54 2q3u s THR 25 CO 0.01 0.58 0.02 0.26 -0.69 0.00 0.00 174.62 174.79 2q3u s TRP 26 N -0.42 3.19 -0.00 4.92 0.52 0.42 -1.42 118.94 126.15 2q3u s TRP 26 Ca 0.04 0.14 -0.02 0.00 0.02 0.00 0.00 56.10 56.29 2q3u s TRP 26 Cb -0.12 -1.86 -0.00 0.00 -1.15 0.00 0.00 33.47 30.33 2q3u s TRP 26 CO 0.01 0.38 0.03 0.42 0.02 0.00 0.00 176.95 177.81 2q3u s ILE 27 N -0.55 0.04 0.00 2.03 1.01 -0.74 -0.90 121.20 122.09 2q3u s ILE 27 Ca 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 60.65 60.41 2q3u s ILE 27 Cb -0.12 -0.16 0.00 0.00 0.01 0.00 0.00 42.46 42.19 2q3u s ILE 27 CO 0.02 -0.18 0.00 0.61 0.00 0.00 0.00 174.94 175.39 2q3u n GLY 28 N 2.47 1.52 3.64 6.18 0.00 -1.26 -0.71 105.19 117.03 2q3u n GLY 28 Ca -0.17 -1.44 -0.06 0.00 0.00 0.00 0.00 46.02 44.35 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 3.64 -0.86 0.44 1.61 -0.11 -1.12 -4.38 118.94 118.15 2q3u s TRP 29 Ca 0.00 1.77 -0.18 0.00 1.22 0.00 0.00 56.10 58.92 2q3u s TRP 29 Cb 0.00 0.50 -0.09 0.00 -1.50 0.00 0.00 33.47 32.38 2q3u s TRP 29 CO 0.00 -0.43 0.91 -1.25 -4.62 0.00 0.00 176.95 171.56 2q3u s PRO 30 N 1.35 4.06 0.00 5.86 0.04 -1.26 -4.57 135.00 140.49 2q3u s PRO 30 Ca -0.08 0.93 0.00 0.00 0.04 0.00 0.00 61.00 61.89 2q3u s PRO 30 Cb -0.05 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.26 2q3u s PRO 30 CO -0.16 -0.07 0.00 -1.91 0.04 0.00 0.00 177.00 174.90 2q3u n GLU 31 N -0.95 0.00 -2.49 4.56 2.13 -1.26 -4.84 120.64 117.80 2q3u n GLU 31 Ca 0.06 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.45 2q3u n GLU 31 Cb 0.54 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.22 2q3u n GLU 31 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2q3u s ARG 32 N -0.60 4.38 0.35 5.31 1.70 -1.26 -4.71 118.95 124.11 2q3u s ARG 32 Ca 0.00 1.64 0.27 0.00 -0.47 0.00 0.00 55.73 57.17 2q3u s ARG 32 Cb 0.00 -3.53 1.11 0.00 -0.57 0.00 0.00 34.95 31.96 2q3u s ARG 32 CO 0.00 -0.40 1.80 1.96 -1.08 0.00 0.00 175.30 177.58 2q3u h GLN 33 N 7.33 0.00 -0.08 3.89 4.20 -1.97 -2.02 115.11 126.46 2q3u h GLN 33 Ca -0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.36 2q3u h GLN 33 Cb 1.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.95 2q3u h GLN 33 CO 0.87 0.00 0.00 -0.40 -0.67 0.00 0.00 178.83 178.63 2q3u n ASP 34 N -2.51 1.23 0.00 1.46 5.68 -1.26 -1.33 116.55 119.82 2q3u n ASP 34 Ca 0.02 -1.53 0.00 0.00 -0.50 0.00 0.00 54.79 52.78 2q3u n ASP 34 Cb 0.25 -0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.19 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 -0.00 2.61 -4.34 -1.12 4.05 -0.90 -4.77 115.26 110.78 2q3u n ASN 35 Ca 0.18 0.00 -0.30 0.00 0.45 0.00 0.00 54.58 54.91 2q3u n ASN 35 Cb 0.28 0.42 -0.15 0.00 1.23 0.00 0.00 39.78 41.57 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 -1.23 2.30 0.48 1.20 0.52 -0.81 -4.57 118.94 116.83 2q3u s TRP 36 Ca 0.00 -0.41 -0.04 0.00 0.02 0.00 0.00 56.10 55.67 2q3u s TRP 36 Cb 0.00 -1.38 -0.03 0.00 -1.15 0.00 0.00 33.47 30.91 2q3u s TRP 36 CO 0.00 0.13 0.76 -0.98 0.02 0.00 0.00 176.95 176.88 2q3u s ARG 37 N -1.27 3.44 -1.34 4.98 1.70 -1.26 -4.24 118.95 120.96 2q3u s ARG 37 Ca 0.12 0.07 -0.06 0.00 -0.47 0.00 0.00 55.73 55.39 2q3u s ARG 37 Cb -0.10 -2.41 -0.00 0.00 -0.57 0.00 0.00 34.95 31.87 2q3u s ARG 37 CO 0.02 -0.22 0.51 0.72 -1.08 0.00 0.00 175.30 175.25 2q3u n HIS 38 N -2.23 -1.70 -2.13 5.89 8.25 -1.15 -1.54 115.22 120.61 2q3u n HIS 38 Ca 0.00 0.66 -0.19 0.00 -0.26 0.00 0.00 57.72 57.94 2q3u n HIS 38 Cb 0.56 -3.66 -0.03 0.00 1.12 0.00 0.00 29.99 27.97 2q3u n HIS 38 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2q3u n ASN 39 N -2.90 -5.35 0.00 0.41 5.03 -1.26 -1.94 115.26 109.25 2q3u n ASN 39 Ca -0.26 0.11 0.00 0.00 0.87 0.00 0.00 54.58 55.30 2q3u n ASN 39 Cb 0.66 -4.43 0.00 0.00 -1.02 0.00 0.00 39.78 34.99 2q3u n ASN 39 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2q3u n ALA 40 N -1.00 0.00 -0.24 5.41 0.00 -0.59 -4.90 120.51 119.18 2q3u n ALA 40 Ca -0.21 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.19 2q3u n ALA 40 Cb 0.65 -0.40 0.13 0.00 0.00 0.00 0.00 19.45 19.83 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 0.98 0.89 0.00 4.07 -1.50 1.00 115.31 120.74 2q3u h LEU 41 Ca 0.00 -0.14 -0.04 0.00 0.08 0.00 0.00 57.88 57.78 2q3u h LEU 41 Cb 0.00 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.49 2q3u h LEU 41 CO 0.00 0.86 -0.48 -0.65 -1.08 0.00 0.00 178.44 177.10 2q3u h PRO 42 N 1.05 -1.21 -0.37 1.13 0.11 -1.77 -2.25 132.00 128.69 2q3u h PRO 42 Ca 0.25 0.08 0.03 0.00 0.11 0.00 0.00 66.00 66.47 2q3u h PRO 42 Cb 0.18 0.27 -0.02 0.00 0.11 0.00 0.00 31.00 31.54 2q3u h PRO 42 CO -0.02 -0.81 0.25 0.00 -0.21 0.00 0.00 178.00 177.21 2q3u h ALA 43 N -1.30 1.87 -0.49 -0.75 0.00 -1.80 -2.77 119.26 114.02 2q3u h ALA 43 Ca -0.12 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 2q3u h ALA 43 Cb 0.98 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2q3u h ALA 43 CO 0.17 0.08 0.05 1.96 0.00 0.00 0.00 179.25 181.51 2q3u h GLN 44 N 0.38 0.78 0.00 0.00 4.20 -0.66 0.18 115.11 119.99 2q3u h GLN 44 Ca 0.15 -0.19 -0.14 0.00 0.06 0.00 0.00 58.65 58.53 2q3u h GLN 44 Cb 0.13 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 2q3u h GLN 44 CO -0.03 0.76 -0.68 0.00 -0.67 0.00 0.00 178.83 178.21 2q3u h ARG 45 N 0.74 0.00 0.03 1.46 3.08 -1.16 -1.29 114.38 117.24 2q3u h ARG 45 Ca 0.15 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.96 2q3u h ARG 45 Cb 0.39 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.44 2q3u h ARG 45 CO 0.01 0.68 -1.03 0.28 -1.07 0.00 0.00 179.97 178.84 2q3u h VAL 46 N 0.00 1.38 -0.87 2.04 2.07 -0.97 -1.36 116.25 118.54 2q3u h VAL 46 Ca -0.01 -2.50 -0.01 0.00 0.82 0.00 0.00 66.70 65.00 2q3u h VAL 46 Cb 1.33 2.52 -0.04 0.00 -1.52 0.00 0.00 31.29 33.57 2q3u h VAL 46 CO 0.09 0.75 0.52 -0.26 0.02 0.00 0.00 177.57 178.69 2q3u h PHE 47 N 0.24 1.16 -0.30 1.57 -1.00 -0.66 -0.58 116.94 117.37 2q3u h PHE 47 Ca -0.11 -0.01 -0.12 0.00 2.81 0.00 0.00 57.97 60.55 2q3u h PHE 47 Cb 1.68 -0.38 -0.01 0.00 3.61 0.00 0.00 35.95 40.85 2q3u h PHE 47 CO 0.07 0.77 -0.32 0.00 -1.61 0.00 0.00 178.31 177.23 2q3u h ALA 48 N 1.36 0.89 -0.34 2.45 0.00 -1.17 -1.61 119.26 120.84 2q3u h ALA 48 Ca 0.31 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2q3u h ALA 48 Cb -0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2q3u h ALA 48 CO -0.06 0.63 0.09 0.78 0.00 0.00 0.00 179.25 180.69 2q3u h GLY 49 N 1.01 0.53 0.98 0.00 0.00 -0.38 -0.63 103.07 104.58 2q3u h GLY 49 Ca 0.06 -0.26 -0.17 0.00 0.00 0.00 0.00 47.33 46.96 2q3u h GLY 49 CO 0.07 0.25 -0.56 -2.08 0.00 0.00 0.00 176.54 174.22 2q3u h VAL 50 N 0.48 1.33 -0.56 4.60 2.07 -0.69 -1.62 116.25 121.86 2q3u h VAL 50 Ca 0.12 -1.83 -0.05 0.00 0.82 0.00 0.00 66.70 65.76 2q3u h VAL 50 Cb 0.18 2.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 2q3u h VAL 50 CO -0.00 0.56 0.16 0.00 0.02 0.00 0.00 177.57 178.31 2q3u h ALA 51 N 0.52 0.74 -0.33 1.67 0.00 -1.04 -0.86 119.26 119.96 2q3u h ALA 51 Ca -0.03 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 2q3u h ALA 51 Cb 1.19 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2q3u h ALA 51 CO 0.12 0.42 -0.23 0.87 0.00 0.00 0.00 179.25 180.43 2q3u h LYS 52 N 0.79 0.74 -0.53 0.00 1.57 -1.17 0.24 116.57 118.21 2q3u h LYS 52 Ca 0.18 -0.35 0.01 0.00 -1.87 0.00 0.00 60.65 58.62 2q3u h LYS 52 Cb 0.30 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 2q3u h LYS 52 CO -0.00 0.97 0.35 0.00 -0.57 0.00 0.00 179.45 180.19 2q3u h ALA 53 N 0.75 0.68 -0.73 3.86 0.00 -1.16 -2.90 119.26 119.76 2q3u h ALA 53 Ca 0.07 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2q3u h ALA 53 Cb 0.78 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2q3u h ALA 53 CO 0.06 0.10 0.28 0.82 0.00 0.00 0.00 179.25 180.51 2q3u h ILE 54 N 0.70 1.25 0.00 0.00 2.04 -0.73 -2.60 117.51 118.17 2q3u h ILE 54 Ca 0.20 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.27 2q3u h ILE 54 Cb -0.06 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.40 2q3u h ILE 54 CO -0.05 0.32 0.00 0.77 0.00 0.00 0.00 178.15 179.19 2q3u h SER 55 N 1.06 0.00 0.67 1.72 4.64 -0.34 0.30 113.55 121.58 2q3u h SER 55 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2q3u h SER 55 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2q3u h SER 55 CO -0.02 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.23 2q3u n LYS 56 N -2.99 0.09 -0.04 4.77 4.76 -0.98 -3.73 118.16 120.04 2q3u n LYS 56 Ca -0.03 0.11 -0.06 0.00 -2.87 0.00 0.00 58.31 55.46 2q3u n LYS 56 Cb 0.08 -1.50 -0.05 0.00 -1.84 0.00 0.00 35.03 31.72 2q3u n LYS 56 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2q3u n PHE 57 N -1.44 0.00 -3.71 2.13 3.72 0.89 -5.11 117.46 113.94 2q3u n PHE 57 Ca 0.07 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.39 2q3u n PHE 57 Cb 0.24 -0.36 -0.02 0.00 -0.94 0.00 0.00 39.48 38.40 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 -2.18 1.53 0.55 -1.08 -1.05 -0.27 -4.71 118.70 111.48 2q3u s GLU 58 Ca -0.10 -0.77 -0.21 0.00 -0.15 0.00 0.00 54.97 53.74 2q3u s GLU 58 Cb 0.03 0.57 -0.04 0.00 -0.44 0.00 0.00 34.13 34.24 2q3u s GLU 58 CO 0.24 -0.69 1.31 -2.14 0.95 0.00 0.00 175.26 174.93 2q3u s PRO 59 N -3.75 3.12 -0.05 -4.83 0.02 -1.26 -3.68 135.00 124.56 2q3u s PRO 59 Ca 0.08 2.11 0.03 0.00 0.02 0.00 0.00 61.00 63.24 2q3u s PRO 59 Cb -0.04 -2.18 0.01 0.00 0.02 0.00 0.00 34.50 32.30 2q3u s PRO 59 CO 0.00 -1.17 -0.12 0.08 -0.33 0.00 0.00 177.00 175.46 2q3u s VAL 60 N -1.38 1.10 -0.13 3.83 1.01 -1.26 -0.70 120.40 122.88 2q3u s VAL 60 Ca 0.73 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.21 2q3u s VAL 60 Cb -0.37 -0.99 -0.01 0.00 0.00 0.00 0.00 36.38 35.01 2q3u s VAL 60 CO 0.43 0.34 -0.14 -0.89 0.00 0.00 0.00 175.10 174.85 2q3u s THR 61 N 0.39 2.97 -0.21 3.92 2.01 -0.51 -1.18 115.64 123.03 2q3u s THR 61 Ca -0.09 -0.69 -0.09 0.00 0.31 0.00 0.00 61.69 61.13 2q3u s THR 61 Cb -0.13 -2.25 -0.05 0.00 0.01 0.00 0.00 72.50 70.09 2q3u s THR 61 CO 0.02 0.52 0.12 -0.69 -0.69 0.00 0.00 174.62 173.91 2q3u s VAL 62 N 0.41 5.20 0.09 3.82 1.01 -0.36 -1.80 120.40 128.77 2q3u s VAL 62 Ca -0.11 0.12 -0.04 0.00 0.00 0.00 0.00 61.98 61.95 2q3u s VAL 62 Cb -0.16 -3.39 -0.05 0.00 0.00 0.00 0.00 36.38 32.78 2q3u s VAL 62 CO 0.05 0.41 0.31 0.00 0.00 0.00 0.00 175.10 175.87 2q3u s ALA 64 N -1.52 -1.27 0.97 0.00 0.00 -0.65 -2.80 121.76 116.49 2q3u s ALA 64 Ca 0.36 1.10 -0.12 0.00 0.00 0.00 0.00 51.96 53.30 2q3u s ALA 64 Cb -0.13 -0.36 0.17 0.00 0.00 0.00 0.00 23.12 22.80 2q3u s ALA 64 CO 0.23 -0.28 1.08 -1.54 0.00 0.00 0.00 175.76 175.25 2q3u s SER 65 N -0.57 2.78 0.27 0.00 1.04 -1.26 -4.25 113.70 111.71 2q3u s SER 65 Ca -0.07 1.50 -0.01 0.00 0.48 0.00 0.00 55.95 57.86 2q3u s SER 65 Cb -0.03 -2.17 0.57 0.00 0.10 0.00 0.00 66.02 64.49 2q3u s SER 65 CO 0.04 -3.07 1.72 -0.65 0.98 0.00 0.00 173.24 172.26 2q3u h PRO 66 N -1.85 0.44 0.00 4.02 0.11 -1.97 -0.84 132.00 131.92 2q3u h PRO 66 Ca -0.52 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.51 2q3u h PRO 66 Cb 1.30 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2q3u h PRO 66 CO 0.53 0.29 -0.27 0.00 -0.21 0.00 0.00 178.00 178.35 2q3u h ALA 67 N 1.61 1.26 -0.58 -0.75 0.00 -2.05 -3.25 119.26 115.51 2q3u h ALA 67 Ca 0.48 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2q3u h ALA 67 Cb 0.80 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2q3u h ALA 67 CO -0.45 0.34 0.00 1.04 0.00 0.00 0.00 179.25 180.18 2q3u n GLN 68 N -3.79 2.67 0.15 0.00 1.13 -0.38 -4.73 117.38 112.42 2q3u n GLN 68 Ca -0.01 -2.44 -0.13 0.00 -1.94 0.00 0.00 57.00 52.48 2q3u n GLN 68 Cb 0.36 -1.49 -0.08 0.00 0.11 0.00 0.00 30.24 29.15 2q3u n GLN 68 CO 0.00 0.00 0.00 2.35 -1.44 0.00 0.00 177.06 177.97 2q3u h TRP 69 N 3.79 -0.36 -0.59 1.08 7.01 -1.42 -2.02 115.95 123.46 2q3u h TRP 69 Ca 0.00 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.99 2q3u h TRP 69 Cb 0.92 0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 28.07 2q3u h TRP 69 CO 0.38 -0.03 0.36 0.93 -2.79 0.00 0.00 178.44 177.30 2q3u h GLU 70 N -0.72 0.78 -0.46 2.65 5.08 -1.85 -0.65 114.58 119.42 2q3u h GLU 70 Ca -0.04 -0.06 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 2q3u h GLU 70 Cb 0.49 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 2q3u h GLU 70 CO 0.06 0.54 -0.00 -0.97 -1.00 0.00 0.00 179.01 177.64 2q3u h ASN 71 N 0.80 0.79 -0.61 1.42 -1.24 -1.86 -1.06 115.58 113.83 2q3u h ASN 71 Ca 0.21 -0.31 -0.04 0.00 0.71 0.00 0.00 56.30 56.88 2q3u h ASN 71 Cb -0.05 -0.21 -0.03 0.00 0.73 0.00 0.00 38.32 38.76 2q3u h ASN 71 CO -0.04 0.91 0.24 0.00 -1.29 0.00 0.00 177.43 177.25 2q3u h ALA 72 N 0.91 0.79 0.00 1.57 0.00 -0.91 0.50 119.26 122.12 2q3u h ALA 72 Ca 0.13 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2q3u h ALA 72 Cb 0.50 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2q3u h ALA 72 CO 0.02 0.41 -0.31 -0.09 0.00 0.00 0.00 179.25 179.28 2q3u h ARG 73 N 0.85 0.00 0.07 0.00 9.65 -0.97 -1.18 114.38 122.80 2q3u h ARG 73 Ca 0.20 0.00 -0.27 0.00 -1.10 0.00 0.00 59.98 58.81 2q3u h ARG 73 Cb 0.21 0.00 0.02 0.00 -1.39 0.00 0.00 29.97 28.80 2q3u h ARG 73 CO -0.02 0.31 -1.13 0.87 2.80 0.00 0.00 179.97 182.80 2q3u h LYS 74 N 0.00 0.51 -0.07 0.20 1.57 -0.58 -3.22 116.57 114.98 2q3u h LYS 74 Ca -0.00 -0.64 -0.15 0.00 -1.87 0.00 0.00 60.65 57.99 2q3u h LYS 74 Cb 0.56 0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 2q3u h LYS 74 CO 0.04 1.26 -0.62 1.96 -0.57 0.00 0.00 179.45 181.53 2q3u h GLN 75 N 0.24 0.24 -5.53 3.15 4.20 -0.57 -3.45 115.11 113.38 2q3u h GLN 75 Ca -0.14 -0.17 -0.65 0.00 0.06 0.00 0.00 58.65 57.76 2q3u h GLN 75 Cb 1.80 0.03 -0.10 0.00 0.30 0.00 0.00 27.48 29.51 2q3u h GLN 75 CO 0.21 0.78 -0.50 -0.51 -0.67 0.00 0.00 178.83 178.13 2q3u s LEU 76 N -7.90 4.22 0.45 1.46 1.43 -0.48 -5.06 118.68 112.81 2q3u s LEU 76 Ca -0.04 0.34 -0.23 0.00 -1.03 0.00 0.00 54.13 53.18 2q3u s LEU 76 Cb 0.12 -2.05 -0.10 0.00 0.03 0.00 0.00 46.19 44.19 2q3u s LEU 76 CO 0.80 0.32 0.84 -2.65 0.23 0.00 0.00 176.35 175.89 2q3u n PRO 77 N 2.57 1.02 0.13 1.29 -0.02 -1.26 -4.85 135.00 133.87 2q3u n PRO 77 Ca -0.18 0.37 0.10 0.00 -2.02 0.00 0.00 63.50 61.77 2q3u n PRO 77 Cb 0.54 -1.89 0.48 0.00 -0.02 0.00 0.00 33.50 32.61 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 0.10 0.14 0.19 -0.52 -0.58 -1.26 -1.94 120.64 116.77 2q3u n GLU 78 Ca 0.11 0.53 0.07 0.00 -0.42 0.00 0.00 57.16 57.45 2q3u n GLU 78 Cb 0.41 -1.86 0.32 0.00 -0.57 0.00 0.00 31.44 29.74 2q3u n GLU 78 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 2q3u h ASP 79 N 0.00 0.00 -3.21 1.62 -0.00 -1.98 -3.40 116.42 109.45 2q3u h ASP 79 Ca 0.00 0.00 -0.56 0.00 -0.00 0.00 0.00 57.03 56.47 2q3u h ASP 79 Cb 0.14 0.00 -0.04 0.00 -0.00 0.00 0.00 39.33 39.43 2q3u h ASP 79 CO 0.00 0.33 0.62 -0.63 -0.00 0.00 0.00 179.24 179.56 2q3u s ILE 80 N -3.49 4.70 0.27 4.15 1.01 -0.82 -4.75 121.20 122.27 2q3u s ILE 80 Ca 0.01 1.98 -0.30 0.00 0.00 0.00 0.00 60.65 62.34 2q3u s ILE 80 Cb 0.10 -4.27 -0.09 0.00 0.01 0.00 0.00 42.46 38.20 2q3u s ILE 80 CO 0.68 -0.02 1.06 -0.60 0.00 0.00 0.00 174.94 176.06 2q3u s ARG 81 N 2.20 4.69 -0.13 2.79 3.52 -0.33 -4.90 118.95 126.79 2q3u s ARG 81 Ca 0.49 1.73 0.03 0.00 -0.13 0.00 0.00 55.73 57.85 2q3u s ARG 81 Cb -0.19 -3.21 0.01 0.00 -1.56 0.00 0.00 34.95 30.00 2q3u s ARG 81 CO 0.17 0.28 -0.22 0.08 -0.81 0.00 0.00 175.30 174.80 2q3u s VAL 82 N -1.16 2.01 0.07 7.11 1.01 -1.26 -1.23 120.40 126.95 2q3u s VAL 82 Ca 0.44 -0.96 0.08 0.00 0.00 0.00 0.00 61.98 61.54 2q3u s VAL 82 Cb -0.31 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.27 2q3u s VAL 82 CO 0.39 0.54 -0.21 0.68 0.00 0.00 0.00 175.10 176.50 2q3u s VAL 83 N 0.76 1.70 0.43 2.92 -7.23 0.02 -4.98 120.40 114.03 2q3u s VAL 83 Ca -0.09 -1.38 -0.06 0.00 -1.81 0.00 0.00 61.98 58.65 2q3u s VAL 83 Cb -0.16 -1.51 -0.04 0.00 0.56 0.00 0.00 36.38 35.23 2q3u s VAL 83 CO -0.00 0.07 0.74 -0.70 -0.31 0.00 0.00 175.10 174.90 2q3u s GLU 84 N -1.55 3.61 0.46 4.82 2.12 -1.26 -1.63 118.70 125.27 2q3u s GLU 84 Ca 0.07 0.21 0.07 0.00 0.36 0.00 0.00 54.97 55.69 2q3u s GLU 84 Cb -0.09 -2.43 0.00 0.00 0.26 0.00 0.00 34.13 31.87 2q3u s GLU 84 CO 0.03 -0.10 0.40 -1.12 -0.54 0.00 0.00 175.26 173.94 2q3u s SER 86 N -3.77 4.90 -0.17 -1.70 0.01 -1.26 -4.87 113.70 106.84 2q3u s SER 86 Ca 0.47 -0.91 0.16 0.00 1.31 0.00 0.00 55.95 56.98 2q3u s SER 86 Cb -0.10 -0.24 -0.24 0.00 0.21 0.00 0.00 66.02 65.64 2q3u s SER 86 CO 0.39 -0.82 0.16 0.59 0.41 0.00 0.00 173.24 173.98 2q3u n ASN 88 N -1.64 0.33 -3.01 2.44 4.13 -1.26 -4.75 115.26 111.50 2q3u n ASN 88 Ca 0.03 0.07 -0.10 0.00 1.68 0.00 0.00 54.58 56.26 2q3u n ASN 88 Cb 0.63 0.68 0.01 0.00 -1.54 0.00 0.00 39.78 39.56 2q3u n ASN 88 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2q3u s ASP 89 N -5.69 0.17 -0.51 6.41 3.68 -1.26 -4.84 116.67 114.63 2q3u s ASP 89 Ca -0.11 -1.20 0.07 0.00 2.13 0.00 0.00 52.55 53.45 2q3u s ASP 89 Cb 0.07 0.81 0.35 0.00 -1.45 0.00 0.00 42.92 42.70 2q3u s ASP 89 CO 0.81 -1.61 0.91 -1.54 0.13 0.00 0.00 175.17 173.87 2q3u n SER 90 N -1.39 3.50 -4.12 -0.34 3.41 -1.26 -4.95 113.62 108.47 2q3u n SER 90 Ca -0.07 -3.49 -0.38 0.00 -0.26 0.00 0.00 58.87 54.68 2q3u n SER 90 Cb 0.60 -0.57 -0.08 0.00 -0.26 0.00 0.00 64.21 63.90 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 -3.21 3.52 -0.81 7.33 0.52 -1.26 -4.42 118.94 120.62 2q3u s TRP 91 Ca 0.46 -2.69 0.23 0.00 0.02 0.00 0.00 56.10 54.12 2q3u s TRP 91 Cb 0.31 -3.28 0.90 0.00 -1.15 0.00 0.00 33.47 30.26 2q3u s TRP 91 CO -0.12 -0.84 1.71 1.19 0.02 0.00 0.00 176.95 178.90 2q3u n PHE 92 N 3.33 0.41 0.23 -1.98 0.99 -1.10 -1.93 117.46 117.40 2q3u n PHE 92 Ca 0.11 0.14 0.12 0.00 -0.00 0.00 0.00 57.45 57.82 2q3u n PHE 92 Cb 0.39 -0.73 0.35 0.00 -1.00 0.00 0.00 39.48 38.49 2q3u n PHE 92 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.76 176.67 2q3u h ARG 93 N 0.00 0.00 0.00 -1.08 9.65 -1.14 -2.82 114.38 118.99 2q3u h ARG 93 Ca 0.00 0.00 -0.15 0.00 -1.10 0.00 0.00 59.98 58.73 2q3u h ARG 93 Cb 0.44 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.99 2q3u h ARG 93 CO 0.00 0.12 -1.57 -0.25 2.80 0.00 0.00 179.97 181.06 2q3u n ASP 94 N -3.17 3.19 0.07 -3.80 8.00 -0.96 -1.24 116.55 118.63 2q3u n ASP 94 Ca 0.02 -0.05 0.12 0.00 0.71 0.00 0.00 54.79 55.59 2q3u n ASP 94 Cb 0.48 -0.03 0.04 0.00 -0.02 0.00 0.00 41.12 41.59 2q3u n ASP 94 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2q3u n SER 95 N -2.72 0.72 -3.65 -2.24 3.41 -0.81 -3.22 113.62 105.11 2q3u n SER 95 Ca -0.17 0.15 -0.26 0.00 -0.26 0.00 0.00 58.87 58.33 2q3u n SER 95 Cb 0.70 0.51 0.18 0.00 -0.26 0.00 0.00 64.21 65.35 2q3u n SER 95 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2q3u n GLY 96 N 1.26 -1.55 3.79 5.00 0.00 -1.06 -4.21 105.19 108.41 2q3u n GLY 96 Ca 0.01 -1.69 -0.38 0.00 0.00 0.00 0.00 46.02 43.96 2q3u n GLY 96 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2q3u s PRO 97 N -5.52 4.43 -0.45 1.61 0.04 -1.26 -4.73 135.00 129.12 2q3u s PRO 97 Ca 0.66 1.02 -0.25 0.00 0.04 0.00 0.00 61.00 62.47 2q3u s PRO 97 Cb -0.02 -3.16 0.02 0.00 0.04 0.00 0.00 34.50 31.38 2q3u s PRO 97 CO 0.46 0.54 0.88 0.95 0.04 0.00 0.00 177.00 179.88 2q3u s THR 98 N -1.23 4.54 0.55 1.26 -4.23 -1.20 -4.88 115.64 110.45 2q3u s THR 98 Ca 0.36 0.71 -0.15 0.00 -1.18 0.00 0.00 61.69 61.43 2q3u s THR 98 Cb -0.21 -4.39 -0.06 0.00 1.34 0.00 0.00 72.50 69.18 2q3u s THR 98 CO 0.24 -0.76 1.01 -0.36 -0.54 0.00 0.00 174.62 174.21 2q3u s PHE 99 N 3.59 3.35 0.07 3.99 0.40 -1.26 -1.67 117.98 126.45 2q3u s PHE 99 Ca 0.35 1.45 0.01 0.00 -0.60 0.00 0.00 56.93 58.15 2q3u s PHE 99 Cb -0.11 -2.84 -0.04 0.00 0.51 0.00 0.00 43.02 40.55 2q3u s PHE 99 CO 0.24 -0.62 -0.06 0.96 0.70 0.00 0.00 175.22 176.44 2q3u s ILE 100 N -2.67 0.52 0.28 0.64 -4.36 0.22 -4.79 121.20 111.04 2q3u s ILE 100 Ca 0.59 -1.61 0.05 0.00 -0.26 0.00 0.00 60.65 59.43 2q3u s ILE 100 Cb -0.12 -1.26 -0.06 0.00 1.25 0.00 0.00 42.46 42.28 2q3u s ILE 100 CO 0.36 -0.74 -0.02 0.68 0.24 0.00 0.00 174.94 175.47 2q3u s VAL 101 N -2.91 1.43 0.20 8.37 -7.23 -1.05 -0.68 120.40 118.53 2q3u s VAL 101 Ca 0.03 -2.08 -0.10 0.00 -1.81 0.00 0.00 61.98 58.02 2q3u s VAL 101 Cb 0.01 -2.51 -0.01 0.00 0.56 0.00 0.00 36.38 34.43 2q3u s VAL 101 CO -0.04 -0.24 0.36 0.00 -0.31 0.00 0.00 175.10 174.87 2q3u s ARG 102 N -3.79 1.33 0.10 4.82 1.70 0.68 -1.91 118.95 121.88 2q3u s ARG 102 Ca 0.31 -1.23 0.11 0.00 -0.47 0.00 0.00 55.73 54.45 2q3u s ARG 102 Cb 0.05 0.41 -0.15 0.00 -0.57 0.00 0.00 34.95 34.69 2q3u s ARG 102 CO 0.12 -0.52 1.08 1.57 -1.08 0.00 0.00 175.30 176.47 2q3u h LYS 103 N 2.41 0.00 -0.35 3.89 -0.00 -1.86 -3.41 116.57 117.25 2q3u h LYS 103 Ca -0.30 0.00 0.24 0.00 -0.00 0.00 0.00 60.65 60.59 2q3u h LYS 103 Cb 1.24 0.00 -0.26 0.00 -0.00 0.00 0.00 32.23 33.22 2q3u h LYS 103 CO 0.43 0.66 0.41 -0.98 -0.00 0.00 0.00 179.45 179.97 2q3u s ARG 104 N -2.76 0.11 0.00 0.07 1.70 -1.26 -4.92 118.95 111.89 2q3u s ARG 104 Ca -0.01 0.26 0.00 0.00 -0.47 0.00 0.00 55.73 55.52 2q3u s ARG 104 Cb 0.09 0.16 0.00 0.00 -0.57 0.00 0.00 34.95 34.63 2q3u s ARG 104 CO 0.81 -0.05 0.00 0.09 -1.08 0.00 0.00 175.30 175.07 2q3u n ASN 112 N 4.81 0.00 -4.35 -2.89 5.03 -1.26 -5.00 115.26 111.60 2q3u n ASN 112 Ca -0.07 0.00 -0.19 0.00 0.87 0.00 0.00 54.58 55.19 2q3u n ASN 112 Cb 0.55 0.00 -0.10 0.00 -1.02 0.00 0.00 39.78 39.21 2q3u n ASN 112 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2q3u s ARG 113 N -2.11 1.35 -0.51 3.52 0.52 -1.26 -5.03 118.95 115.44 2q3u s ARG 113 Ca 0.00 -1.60 -0.02 0.00 -0.52 0.00 0.00 55.73 53.59 2q3u s ARG 113 Cb 0.00 -1.16 0.34 0.00 0.52 0.00 0.00 34.95 34.65 2q3u s ARG 113 CO 0.00 0.19 2.03 0.09 0.02 0.00 0.00 175.30 177.63 2q3u n ASN 114 N -0.40 7.14 -3.62 0.23 3.02 -1.26 -4.85 115.26 115.53 2q3u n ASN 114 Ca -0.08 -3.45 -0.13 0.00 -0.03 0.00 0.00 54.58 50.89 2q3u n ASN 114 Cb 0.60 -1.02 -0.07 0.00 -0.61 0.00 0.00 39.78 38.69 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 -3.66 0.00 0.05 2.41 2.07 -1.26 -0.23 121.20 120.59 2q3u s ILE 115 Ca 0.49 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.66 2q3u s ILE 115 Cb 0.39 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.97 2q3u s ILE 115 CO -0.01 0.00 0.14 0.00 -1.91 0.00 0.00 174.94 173.16 2q3u s ALA 116 N 0.11 -0.14 -0.16 1.50 0.00 0.14 -4.11 121.76 119.10 2q3u s ALA 116 Ca -0.00 -0.56 -0.05 0.00 0.00 0.00 0.00 51.96 51.35 2q3u s ALA 116 Cb -0.04 0.33 -0.03 0.00 0.00 0.00 0.00 23.12 23.37 2q3u s ALA 116 CO -0.00 -0.39 0.01 0.20 0.00 0.00 0.00 175.76 175.58 2q3u s GLY 117 N -2.41 1.82 0.07 0.00 0.00 0.23 0.70 107.32 107.74 2q3u s GLY 117 Ca -0.01 -0.78 -0.19 0.00 0.00 0.00 0.00 44.72 43.74 2q3u s GLY 117 CO -0.07 -0.07 0.56 -0.42 0.00 0.00 0.00 173.10 173.10 2q3u s ILE 118 N 0.21 4.76 -0.46 0.90 1.01 -0.67 -0.02 121.20 126.93 2q3u s ILE 118 Ca 0.01 1.19 -0.02 0.00 0.00 0.00 0.00 60.65 61.84 2q3u s ILE 118 Cb -0.13 -3.89 0.12 0.00 0.01 0.00 0.00 42.46 38.58 2q3u s ILE 118 CO 0.02 0.55 0.25 -0.62 0.00 0.00 0.00 174.94 175.13 2q3u s ASP 119 N -1.12 5.13 0.59 3.58 -1.08 -0.42 -3.22 116.67 120.13 2q3u s ASP 119 Ca 0.29 -2.31 -0.13 0.00 -0.52 0.00 0.00 52.55 49.88 2q3u s ASP 119 Cb -0.19 -1.80 -0.05 0.00 -1.46 0.00 0.00 42.92 39.42 2q3u s ASP 119 CO 0.19 -0.46 1.01 0.26 0.52 0.00 0.00 175.17 176.69 2q3u s TRP 120 N 0.73 3.58 0.89 -5.34 0.52 -1.26 -0.76 118.94 117.29 2q3u s TRP 120 Ca 0.11 1.34 -0.11 0.00 0.02 0.00 0.00 56.10 57.46 2q3u s TRP 120 Cb -0.22 -2.74 0.12 0.00 -1.15 0.00 0.00 33.47 29.49 2q3u s TRP 120 CO -0.04 -0.59 1.09 1.21 0.02 0.00 0.00 176.95 178.64 2q3u s ASN 121 N -3.85 3.49 -0.14 2.95 3.04 -1.16 -4.74 114.94 114.52 2q3u s ASN 121 Ca 0.56 1.62 -0.13 0.00 0.04 0.00 0.00 52.86 54.96 2q3u s ASN 121 Cb -0.11 -2.29 0.04 0.00 -1.54 0.00 0.00 41.25 37.36 2q3u s ASN 121 CO 0.47 -2.65 0.38 0.12 -3.04 0.00 0.00 177.10 172.38 2q3u s PHE 122 N -2.87 -0.44 -0.06 0.43 5.36 -1.26 0.39 117.98 119.52 2q3u s PHE 122 Ca 0.64 1.04 0.23 0.00 -0.96 0.00 0.00 56.93 57.88 2q3u s PHE 122 Cb -0.19 0.15 0.44 0.00 -0.34 0.00 0.00 43.02 43.09 2q3u s PHE 122 CO 0.57 -0.22 1.17 0.27 -1.46 0.00 0.00 175.22 175.55 2q3u n ASN 123 N 3.06 1.24 -3.69 6.13 2.04 -1.26 -4.99 115.26 117.78 2q3u n ASN 123 Ca -0.14 -2.27 -0.22 0.00 -0.44 0.00 0.00 54.58 51.51 2q3u n ASN 123 Cb 0.57 -0.35 0.04 0.00 -2.53 0.00 0.00 39.78 37.51 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 0.14 -1.88 -3.56 -2.53 0.00 -1.26 -0.24 120.51 111.18 2q3u n ALA 124 Ca 0.08 -0.07 -0.21 0.00 0.00 0.00 0.00 53.44 53.25 2q3u n ALA 124 Cb 1.05 -2.54 0.07 0.00 0.00 0.00 0.00 19.45 18.03 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 -4.35 -2.31 0.00 0.00 8.01 -1.26 0.83 117.44 118.36 2q3u n TRP 125 Ca -0.23 0.94 0.00 0.00 -1.31 0.00 0.00 57.50 56.89 2q3u n TRP 125 Cb 0.65 -4.86 0.00 0.00 -2.01 0.00 0.00 31.31 25.09 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 -1.47 0.53 1.61 6.99 0.00 -1.22 -4.03 105.19 107.59 2q3u n GLY 126 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2q3u n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q3u n GLY 127 N 0.00 -2.61 0.24 -0.02 0.00 0.66 -2.00 105.19 101.46 2q3u n GLY 127 Ca 0.00 -1.83 0.07 0.00 0.00 0.00 0.00 46.02 44.26 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 1.74 0.00 4.61 0.00 -1.89 -0.12 119.26 123.60 2q3u h ALA 128 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2q3u h ALA 128 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2q3u h ALA 128 CO 0.00 0.15 -1.49 0.09 0.00 0.00 0.00 179.25 178.00 2q3u n ASN 129 N -4.31 0.50 -0.96 0.00 3.02 -1.26 -4.69 115.26 107.56 2q3u n ASN 129 Ca -0.03 -0.50 0.00 0.00 -0.03 0.00 0.00 54.58 54.02 2q3u n ASN 129 Cb 0.20 1.49 -0.01 0.00 -0.61 0.00 0.00 39.78 40.85 2q3u n ASN 129 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2q3u n ASP 130 N -1.88 0.16 -3.99 6.41 2.03 -0.85 -5.11 116.55 113.33 2q3u n ASP 130 Ca 0.00 -1.84 -0.14 0.00 0.52 0.00 0.00 54.79 53.32 2q3u n ASP 130 Cb 0.45 -0.10 0.06 0.00 -0.72 0.00 0.00 41.12 40.80 2q3u n ASP 130 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2q3u n GLY 131 N 0.18 1.61 0.05 0.27 0.00 -0.07 -4.04 105.19 103.19 2q3u n GLY 131 Ca -0.03 -2.15 0.11 0.00 0.00 0.00 0.00 46.02 43.95 2q3u n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q3u s TYR 133 N -3.39 -0.48 -0.37 0.00 -0.85 -1.26 -2.68 117.35 108.32 2q3u s TYR 133 Ca -0.03 0.51 0.11 0.00 -0.52 0.00 0.00 57.07 57.14 2q3u s TYR 133 Cb 0.13 0.41 0.68 0.00 0.38 0.00 0.00 41.96 43.56 2q3u s TYR 133 CO 0.85 -0.70 1.57 0.09 -1.52 0.00 0.00 175.55 175.83 2q3u n ASN 134 N 0.23 4.90 -3.37 -0.18 3.02 -1.14 -4.69 115.26 114.03 2q3u n ASN 134 Ca -0.18 -2.82 -0.13 0.00 -0.03 0.00 0.00 54.58 51.42 2q3u n ASN 134 Cb 0.61 -0.67 -0.08 0.00 -0.61 0.00 0.00 39.78 39.03 2q3u n ASN 134 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2q3u s ASP 135 N -0.67 0.97 -0.23 6.41 -1.08 -1.26 -4.97 116.67 115.84 2q3u s ASP 135 Ca 0.46 -0.41 0.13 0.00 -0.52 0.00 0.00 52.55 52.21 2q3u s ASP 135 Cb 0.35 0.81 0.49 0.00 -1.46 0.00 0.00 42.92 43.11 2q3u s ASP 135 CO 0.13 -0.36 1.40 -2.67 0.52 0.00 0.00 175.17 174.20 2q3u n TRP 136 N 5.34 0.86 -0.15 -5.34 2.14 -1.26 -4.83 117.44 114.20 2q3u n TRP 136 Ca -0.02 -1.29 -0.13 0.00 2.07 0.00 0.00 57.50 58.13 2q3u n TRP 136 Cb 0.48 -0.38 -0.10 0.00 -0.81 0.00 0.00 31.31 30.50 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 1.15 -1.84 0.14 -0.67 0.02 -1.99 -1.24 113.55 109.11 2q3u h SER 137 Ca 0.11 0.24 -0.14 0.00 -0.84 0.00 0.00 61.79 61.16 2q3u h SER 137 Cb 1.48 0.76 -0.01 0.00 0.14 0.00 0.00 62.40 64.77 2q3u h SER 137 CO 0.27 -0.39 -0.52 0.45 -1.14 0.00 0.00 176.83 175.50 2q3u h HIS 138 N -0.37 0.52 -0.19 3.45 3.86 -1.91 -3.01 115.15 117.49 2q3u h HIS 138 Ca 0.07 -0.18 -0.01 0.00 -1.16 0.00 0.00 60.37 59.09 2q3u h HIS 138 Cb 0.57 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.93 2q3u h HIS 138 CO -0.74 0.86 0.06 -0.44 0.86 0.00 0.00 177.93 178.53 2q3u h ASP 139 N 0.33 0.24 -0.04 2.45 3.45 -1.69 -0.82 116.42 120.34 2q3u h ASP 139 Ca 0.01 -0.02 0.01 0.00 0.43 0.00 0.00 57.03 57.47 2q3u h ASP 139 Cb 1.03 -0.06 -0.00 0.00 -0.56 0.00 0.00 39.33 39.73 2q3u h ASP 139 CO 0.09 0.23 0.03 -0.07 -1.57 0.00 0.00 179.24 177.96 2q3u h LEU 140 N 0.27 0.00 -0.91 1.55 3.38 -1.11 -2.69 115.31 115.80 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 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2q3u h LEU 140 CO -0.01 0.00 -0.32 0.18 0.09 0.00 0.00 178.44 178.38 2q3u n LEU 141 N -4.18 1.73 -0.04 1.67 4.77 -0.32 -4.59 117.00 116.03 2q3u n LEU 141 Ca -0.02 -0.59 -0.11 0.00 -0.03 0.00 0.00 56.01 55.26 2q3u n LEU 141 Cb 0.13 -0.04 -0.05 0.00 -2.33 0.00 0.00 43.42 41.13 2q3u n LEU 141 CO 0.31 0.31 0.85 0.58 -1.33 0.00 0.00 177.39 178.11 2q3u h VAL 142 N 2.21 1.15 0.02 4.08 2.07 -1.41 0.62 116.25 125.00 2q3u h VAL 142 Ca 0.00 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.06 2q3u h VAL 142 Cb 0.67 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.58 2q3u h VAL 142 CO 0.00 0.15 -0.03 0.28 0.02 0.00 0.00 177.57 177.99 2q3u h SER 143 N 0.12 -0.07 -0.40 0.57 0.02 -1.79 0.31 113.55 112.32 2q3u h SER 143 Ca 0.06 0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 2q3u h SER 143 Cb 0.17 0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 2q3u h SER 143 CO -0.00 -0.04 0.09 -0.09 -1.14 0.00 0.00 176.83 175.64 2q3u h ARG 144 N -0.06 0.72 -0.30 3.45 2.43 -1.81 -2.07 114.38 116.74 2q3u h ARG 144 Ca 0.00 -0.15 -0.03 0.00 -0.81 0.00 0.00 59.98 59.00 2q3u h ARG 144 Cb 0.06 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 2q3u h ARG 144 CO -0.01 0.68 0.09 0.87 -1.51 0.00 0.00 179.97 180.08 2q3u h LYS 145 N 0.70 0.47 0.33 0.20 1.57 0.79 -2.08 116.57 118.55 2q3u h LYS 145 Ca 0.15 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2q3u h LYS 145 Cb 0.30 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 2q3u h LYS 145 CO 0.00 0.53 -0.35 0.82 -0.57 0.00 0.00 179.45 179.89 2q3u h ILE 146 N 0.32 0.28 -0.62 1.86 2.04 -0.08 -2.77 117.51 118.54 2q3u h ILE 146 Ca 0.10 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.99 2q3u h ILE 146 Cb 0.26 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 36.59 2q3u h ILE 146 CO -0.00 0.00 0.41 -0.07 0.00 0.00 0.00 178.15 178.49 2q3u h LEU 147 N -0.71 0.63 -0.28 1.44 3.38 -1.42 -1.16 115.31 117.18 2q3u h LEU 147 Ca -0.02 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 57.99 2q3u h LEU 147 Cb 0.65 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.21 2q3u h LEU 147 CO -0.07 0.43 0.00 0.00 0.09 0.00 0.00 178.44 178.88 2q3u h ALA 148 N 1.64 0.25 -0.64 1.53 0.00 -1.31 0.82 119.26 121.54 2q3u h ALA 148 Ca 0.25 0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.35 2q3u h ALA 148 Cb 0.10 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 17.94 2q3u h ALA 148 CO -0.07 -0.41 0.23 -0.07 0.00 0.00 0.00 179.25 178.93 2q3u h LEU 149 N 0.08 0.20 -0.57 0.00 3.38 -0.95 -0.71 115.31 116.74 2q3u h LEU 149 Ca 0.13 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2q3u h LEU 149 Cb 0.18 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2q3u h LEU 149 CO -0.23 0.11 -0.10 -0.62 0.09 0.00 0.00 178.44 177.69 2q3u n GLU 150 N -5.02 1.14 -3.88 1.13 -0.58 -0.71 -4.93 120.64 107.80 2q3u n GLU 150 Ca 0.10 -0.57 -0.28 0.00 -0.42 0.00 0.00 57.16 55.99 2q3u n GLU 150 Cb 0.31 -1.49 0.03 0.00 -0.57 0.00 0.00 31.44 29.72 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 -0.44 -5.30 -3.67 3.49 1.74 0.27 -4.97 116.66 107.78 2q3u n ARG 151 Ca 0.16 0.59 -0.36 0.00 -0.77 0.00 0.00 57.85 57.48 2q3u n ARG 151 Cb 0.31 -5.39 -0.07 0.00 -1.02 0.00 0.00 32.46 26.29 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 -3.40 5.37 0.62 0.55 1.01 -0.17 -5.02 121.20 120.16 2q3u s ILE 152 Ca 0.50 0.36 -0.19 0.00 0.00 0.00 0.00 60.65 61.32 2q3u s ILE 152 Cb -0.25 -3.53 -0.02 0.00 0.01 0.00 0.00 42.46 38.67 2q3u s ILE 152 CO 0.83 0.46 1.30 -2.84 0.00 0.00 0.00 174.94 174.69 2q3u s PRO 153 N 0.10 2.70 -0.08 2.79 0.02 -1.26 -4.61 135.00 134.66 2q3u s PRO 153 Ca 0.13 2.09 0.03 0.00 0.02 0.00 0.00 61.00 63.27 2q3u s PRO 153 Cb -0.12 -1.94 -0.02 0.00 0.02 0.00 0.00 34.50 32.45 2q3u s PRO 153 CO 0.02 -1.49 -0.17 0.50 -0.33 0.00 0.00 177.00 175.52 2q3u s ARG 154 N -3.28 2.87 -0.30 5.54 3.52 -1.26 0.78 118.95 126.82 2q3u s ARG 154 Ca 0.80 -0.76 -0.04 0.00 -0.13 0.00 0.00 55.73 55.60 2q3u s ARG 154 Cb -0.38 -2.41 0.04 0.00 -1.56 0.00 0.00 34.95 30.64 2q3u s ARG 154 CO 0.41 0.38 0.03 -0.06 -0.81 0.00 0.00 175.30 175.25 2q3u s PHE 155 N -0.12 3.21 0.25 5.12 2.99 0.97 -4.93 117.98 125.48 2q3u s PHE 155 Ca -0.03 -1.58 -0.22 0.00 0.00 0.00 0.00 56.93 55.11 2q3u s PHE 155 Cb -0.14 -2.17 -0.09 0.00 0.00 0.00 0.00 43.02 40.63 2q3u s PHE 155 CO 0.04 -0.74 0.79 -1.14 -0.00 0.00 0.00 175.22 174.16 2q3u s GLN 156 N 1.34 4.35 0.04 0.44 0.74 -1.26 -1.30 119.66 124.00 2q3u s GLN 156 Ca -0.02 1.00 0.06 0.00 0.05 0.00 0.00 55.36 56.45 2q3u s GLN 156 Cb -0.19 -2.87 -0.02 0.00 1.10 0.00 0.00 33.01 31.03 2q3u s GLN 156 CO -0.00 0.37 -0.17 -1.58 -0.55 0.00 0.00 175.29 173.36 2q3u s HIS 157 N -1.53 1.46 -0.90 1.67 2.46 0.06 -4.84 115.29 113.67 2q3u s HIS 157 Ca 0.45 -0.35 -0.18 0.00 0.47 0.00 0.00 55.06 55.44 2q3u s HIS 157 Cb -0.17 -0.87 0.14 0.00 -0.13 0.00 0.00 32.58 31.54 2q3u s HIS 157 CO 0.22 0.05 1.07 -1.54 -2.47 0.00 0.00 174.74 172.07 2q3u s SER 158 N -1.09 6.60 -0.06 9.88 1.04 -1.26 -2.97 113.70 125.85 2q3u s SER 158 Ca 0.04 -2.03 0.04 0.00 0.48 0.00 0.00 55.95 54.48 2q3u s SER 158 Cb -0.08 -2.38 0.00 0.00 0.10 0.00 0.00 66.02 63.66 2q3u s SER 158 CO 0.01 -1.04 -0.17 -0.63 0.98 0.00 0.00 173.24 172.39 2q3u s ILE 160 N 2.52 1.46 0.01 -1.02 1.01 -1.26 -4.54 121.20 119.37 2q3u s ILE 160 Ca 0.30 -0.70 -0.28 0.00 0.00 0.00 0.00 60.65 59.97 2q3u s ILE 160 Cb -0.06 -1.27 0.10 0.00 0.01 0.00 0.00 42.46 41.23 2q3u s ILE 160 CO -0.08 0.42 0.82 -0.22 0.00 0.00 0.00 174.94 175.88 2q3u s LEU 161 N 0.25 -0.44 0.04 2.97 2.96 0.16 -4.74 118.68 119.88 2q3u s LEU 161 Ca -0.09 0.13 0.08 0.00 -0.22 0.00 0.00 54.13 54.03 2q3u s LEU 161 Cb -0.14 2.18 -0.03 0.00 0.50 0.00 0.00 46.19 48.71 2q3u s LEU 161 CO 0.04 -0.66 -0.23 -1.61 -1.32 0.00 0.00 176.35 172.57 2q3u s GLU 162 N -2.79 1.57 0.63 1.98 8.01 -1.26 -4.41 118.70 122.43 2q3u s GLU 162 Ca 0.02 -0.98 0.35 0.00 0.01 0.00 0.00 54.97 54.37 2q3u s GLU 162 Cb -0.01 -1.69 1.98 0.00 -4.31 0.00 0.00 34.13 30.10 2q3u s GLU 162 CO -0.07 0.44 2.20 0.78 0.01 0.00 0.00 175.26 178.62 2q3u h GLY 163 N 4.92 0.00 1.69 -1.39 0.00 -1.26 -0.04 103.07 106.99 2q3u h GLY 163 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2q3u h GLY 163 CO 0.44 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.59 2q3u n GLY 164 N -1.24 -1.10 0.10 4.60 0.00 -0.37 -3.13 105.19 104.04 2q3u n GLY 164 Ca -0.01 -0.10 0.13 0.00 0.00 0.00 0.00 46.02 46.04 2q3u n GLY 164 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2q3u n SER 165 N -1.34 0.75 -4.22 1.61 3.41 -0.03 -3.84 113.62 109.96 2q3u n SER 165 Ca 0.09 0.56 -0.23 0.00 -0.26 0.00 0.00 58.87 59.03 2q3u n SER 165 Cb 0.20 -0.74 -0.14 0.00 -0.26 0.00 0.00 64.21 63.27 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 -3.09 1.47 -0.10 -1.33 -4.36 -1.18 -4.40 121.20 108.20 2q3u s ILE 166 Ca 0.11 -1.18 0.00 0.00 -0.26 0.00 0.00 60.65 59.32 2q3u s ILE 166 Cb 0.13 -1.30 0.02 0.00 1.25 0.00 0.00 42.46 42.56 2q3u s ILE 166 CO 0.60 0.09 -0.08 -1.00 0.24 0.00 0.00 174.94 174.79 2q3u s HIS 167 N -0.87 1.40 0.07 1.37 3.76 -0.66 -4.97 115.29 115.38 2q3u s HIS 167 Ca 0.05 -0.65 0.04 0.00 -0.15 0.00 0.00 55.06 54.35 2q3u s HIS 167 Cb -0.09 -1.15 -0.04 0.00 1.11 0.00 0.00 32.58 32.41 2q3u s HIS 167 CO 0.02 -0.45 0.00 0.14 -0.85 0.00 0.00 174.74 173.61 2q3u s VAL 168 N 1.49 4.07 -0.90 -0.90 -7.23 -1.26 -0.39 120.40 115.28 2q3u s VAL 168 Ca 0.01 -0.88 0.17 0.00 -1.81 0.00 0.00 61.98 59.47 2q3u s VAL 168 Cb -0.13 -2.91 0.74 0.00 0.56 0.00 0.00 36.38 34.63 2q3u s VAL 168 CO -0.05 0.18 1.65 -0.90 -0.31 0.00 0.00 175.10 175.67 2q3u n ASP 169 N 0.76 4.94 0.00 4.85 5.75 -1.07 -4.56 116.55 127.23 2q3u n ASP 169 Ca -0.11 -2.57 0.00 0.00 -0.01 0.00 0.00 54.79 52.10 2q3u n ASP 169 Cb 0.52 -0.60 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 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 0.96 1.54 1.90 6.12 0.00 -1.26 -4.57 105.19 109.88 2q3u n GLY 170 Ca 0.26 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.06 2q3u n GLY 170 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2q3u n GLU 171 N -1.88 2.86 0.00 1.61 1.02 -1.26 -4.81 120.64 118.18 2q3u n GLU 171 Ca 0.00 -3.64 0.00 0.00 -0.02 0.00 0.00 57.16 53.50 2q3u n GLU 171 Cb 0.00 -2.16 0.00 0.00 -0.02 0.00 0.00 31.44 29.26 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 -0.89 1.93 3.80 0.62 0.00 -1.26 -4.32 105.19 105.07 2q3u n GLY 172 Ca 0.47 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.27 2q3u n GLY 172 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q3u s THR 173 N -2.33 3.83 0.03 2.61 2.01 -1.26 0.45 115.64 120.98 2q3u s THR 173 Ca 0.00 -1.49 0.04 0.00 0.31 0.00 0.00 61.69 60.55 2q3u s THR 173 Cb 0.00 -3.21 -0.02 0.00 0.01 0.00 0.00 72.50 69.29 2q3u s THR 173 CO 0.00 -0.27 -0.11 0.00 -0.69 0.00 0.00 174.62 173.55 2q3u s LEU 175 N -1.07 1.47 0.43 0.00 2.96 0.48 -0.21 118.68 122.75 2q3u s LEU 175 Ca -0.01 -1.06 0.03 0.00 -0.22 0.00 0.00 54.13 52.88 2q3u s LEU 175 Cb -0.07 -0.68 -0.03 0.00 0.50 0.00 0.00 46.19 45.91 2q3u s LEU 175 CO 0.01 -0.33 0.08 0.68 -1.32 0.00 0.00 176.35 175.46 2q3u s VAL 176 N 1.79 0.88 0.09 1.68 -7.23 -0.72 -1.66 120.40 115.23 2q3u s VAL 176 Ca 0.02 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.27 2q3u s VAL 176 Cb -0.17 -2.37 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 2q3u s VAL 176 CO -0.13 0.00 -0.20 0.42 -0.31 0.00 0.00 175.10 174.87 2q3u s THR 177 N -3.10 2.67 0.17 5.32 -4.23 -1.26 -1.25 115.64 113.96 2q3u s THR 177 Ca 0.20 -1.45 -0.01 0.00 -1.18 0.00 0.00 61.69 59.25 2q3u s THR 177 Cb 0.03 -2.18 -0.13 0.00 1.34 0.00 0.00 72.50 71.57 2q3u s THR 177 CO 0.11 0.18 1.40 -0.33 -0.54 0.00 0.00 174.62 175.45 2q3u h GLU 178 N 4.06 0.35 -0.64 3.99 5.08 0.39 -2.77 114.58 125.04 2q3u h GLU 178 Ca -0.49 -0.32 0.14 0.00 -1.00 0.00 0.00 59.36 57.69 2q3u h GLU 178 Cb 1.16 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 30.45 2q3u h GLU 178 CO 0.45 0.98 0.44 1.49 -1.00 0.00 0.00 179.01 181.37 2q3u h GLU 179 N 0.22 0.26 0.00 2.33 4.81 0.12 -1.70 114.58 120.62 2q3u h GLU 179 Ca -0.04 -0.02 -0.29 0.00 -0.13 0.00 0.00 59.36 58.89 2q3u h GLU 179 Cb 1.39 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.67 2q3u h GLU 179 CO 0.13 0.17 -1.88 0.00 -0.73 0.00 0.00 179.01 176.71 2q3u h LEU 181 N -1.00 0.00 -2.71 0.00 -0.00 -1.48 -1.98 115.31 108.15 2q3u h LEU 181 Ca -0.43 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.39 2q3u h LEU 181 Cb 1.35 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.98 2q3u h LEU 181 CO -0.26 0.67 0.07 0.18 -0.00 0.00 0.00 178.44 179.11 2q3u n LEU 182 N -3.59 4.20 -4.78 1.67 4.77 -0.64 -4.66 117.00 113.97 2q3u n LEU 182 Ca -0.00 -2.15 -0.38 0.00 -0.03 0.00 0.00 56.01 53.44 2q3u n LEU 182 Cb 0.70 -0.63 -0.06 0.00 -2.33 0.00 0.00 43.42 41.09 2q3u n LEU 182 CO 0.42 0.55 0.56 0.21 -1.33 0.00 0.00 177.39 177.81 2q3u s ASN 183 N -0.47 7.39 0.10 -1.43 3.84 -0.75 -4.95 114.94 118.67 2q3u s ASN 183 Ca 0.34 1.74 0.12 0.00 0.21 0.00 0.00 52.86 55.27 2q3u s ASN 183 Cb 0.27 -2.54 0.54 0.00 -0.55 0.00 0.00 41.25 38.97 2q3u s ASN 183 CO 0.09 0.09 1.36 2.29 -2.79 0.00 0.00 177.10 178.14 2q3u n LYS 184 N 1.13 0.05 -0.08 0.43 2.85 -1.26 -1.74 118.16 119.54 2q3u n LYS 184 Ca -0.02 0.44 0.09 0.00 -1.05 0.00 0.00 58.31 57.78 2q3u n LYS 184 Cb 0.49 -1.64 0.35 0.00 -0.65 0.00 0.00 35.03 33.58 2q3u n LYS 184 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 2q3u n ASN 185 N -1.75 1.47 0.00 -5.58 0.23 -1.26 -4.22 115.26 104.15 2q3u n ASN 185 Ca 0.01 -1.72 0.00 0.00 -0.53 0.00 0.00 54.58 52.34 2q3u n ASN 185 Cb 0.09 -0.11 0.00 0.00 -2.08 0.00 0.00 39.78 37.68 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 0.21 0.00 -3.48 -3.83 5.12 -0.71 -4.33 116.66 109.64 2q3u n ARG 186 Ca 0.15 0.00 -0.27 0.00 -1.93 0.00 0.00 57.85 55.80 2q3u n ARG 186 Cb 0.29 0.00 -0.09 0.00 -1.16 0.00 0.00 32.46 31.50 2q3u n ARG 186 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2q3u n ASN 187 N -0.06 2.87 0.33 0.55 4.13 -1.26 -4.70 115.26 117.12 2q3u n ASN 187 Ca 0.00 -3.23 0.20 0.00 1.68 0.00 0.00 54.58 53.22 2q3u n ASN 187 Cb 0.00 -0.68 1.06 0.00 -1.54 0.00 0.00 39.78 38.62 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 4.46 0.00 -2.95 3.52 0.13 -1.80 -3.45 132.00 131.91 2q3u h PRO 188 Ca 0.17 0.00 -0.80 0.00 -0.87 0.00 0.00 66.00 64.50 2q3u h PRO 188 Cb 0.72 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 31.60 2q3u h PRO 188 CO 0.73 0.00 1.01 0.72 -0.23 0.00 0.00 178.00 180.24 2q3u n HIS 189 N -2.97 2.36 -4.30 1.56 8.25 -1.26 -5.08 115.22 113.78 2q3u n HIS 189 Ca -0.03 -2.60 -0.20 0.00 -0.26 0.00 0.00 57.72 54.64 2q3u n HIS 189 Cb 0.18 -1.36 -0.11 0.00 1.12 0.00 0.00 29.99 29.82 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 -1.36 2.40 0.18 0.41 1.04 -1.26 -5.16 113.70 109.95 2q3u s SER 191 Ca 0.33 -0.86 -0.18 0.00 0.48 0.00 0.00 55.95 55.72 2q3u s SER 191 Cb 0.07 -0.12 0.12 0.00 0.10 0.00 0.00 66.02 66.19 2q3u s SER 191 CO 0.08 -0.10 1.63 0.50 0.98 0.00 0.00 173.24 176.33 2q3u h LYS 192 N 3.27 -0.09 -0.88 4.02 3.64 -1.98 0.20 116.57 124.76 2q3u h LYS 192 Ca -0.41 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.03 2q3u h LYS 192 Cb 1.20 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.99 2q3u h LYS 192 CO 0.52 -0.06 0.57 0.93 -2.27 0.00 0.00 179.45 179.14 2q3u h GLU 193 N -0.09 0.99 -0.29 1.90 3.07 -2.05 -2.16 114.58 115.94 2q3u h GLU 193 Ca 0.21 -0.06 -0.08 0.00 -0.50 0.00 0.00 59.36 58.94 2q3u h GLU 193 Cb 0.42 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 28.10 2q3u h GLU 193 CO -0.51 0.65 -0.12 1.96 -1.40 0.00 0.00 179.01 179.59 2q3u h GLN 194 N 1.02 0.60 -0.53 2.33 4.20 -1.59 -2.51 115.11 118.63 2q3u h GLN 194 Ca 0.37 -0.26 0.10 0.00 0.06 0.00 0.00 58.65 58.92 2q3u h GLN 194 Cb 0.15 -0.02 -0.08 0.00 0.30 0.00 0.00 27.48 27.83 2q3u h GLN 194 CO -0.13 0.83 0.07 0.82 -0.67 0.00 0.00 178.83 179.75 2q3u h ILE 195 N 0.35 0.65 -0.47 2.54 2.04 -0.07 -0.22 117.51 122.34 2q3u h ILE 195 Ca 0.07 -0.07 0.04 0.00 1.00 0.00 0.00 64.86 65.91 2q3u h ILE 195 Cb 0.64 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 2q3u h ILE 195 CO 0.04 0.04 0.22 -0.33 0.00 0.00 0.00 178.15 178.12 2q3u h GLU 196 N 0.19 0.43 -0.35 2.37 5.08 -1.32 0.30 114.58 121.28 2q3u h GLU 196 Ca 0.27 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.59 2q3u h GLU 196 Cb 0.40 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2q3u h GLU 196 CO -0.39 0.28 0.16 1.49 -1.00 0.00 0.00 179.01 179.55 2q3u h GLU 197 N 0.44 0.49 -0.22 2.33 4.57 -0.93 0.77 114.58 122.03 2q3u h GLU 197 Ca 0.21 -0.05 -0.19 0.00 -1.18 0.00 0.00 59.36 58.14 2q3u h GLU 197 Cb 0.14 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.63 2q3u h GLU 197 CO -0.16 0.40 -0.63 0.93 -1.18 0.00 0.00 179.01 178.37 2q3u h GLU 198 N 0.50 0.77 -0.09 1.92 4.39 -0.15 -2.07 114.58 119.84 2q3u h GLU 198 Ca 0.13 -0.53 -0.18 0.00 0.34 0.00 0.00 59.36 59.12 2q3u h GLU 198 Cb 0.08 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 2q3u h GLU 198 CO -0.02 1.16 -0.69 -0.07 -1.16 0.00 0.00 179.01 178.23 2q3u h LEU 199 N 0.57 0.48 -0.37 1.33 3.38 -0.47 -1.80 115.31 118.42 2q3u h LEU 199 Ca -0.01 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.66 2q3u h LEU 199 Cb 1.23 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 2q3u h LEU 199 CO 0.13 1.02 0.22 0.11 0.09 0.00 0.00 178.44 180.02 2q3u h LYS 200 N 0.29 0.50 -0.82 1.13 1.57 0.54 -0.02 116.57 119.76 2q3u h LYS 200 Ca -0.02 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2q3u h LYS 200 Cb 1.25 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.42 2q3u h LYS 200 CO 0.12 0.38 0.39 0.87 -0.57 0.00 0.00 179.45 180.64 2q3u h LYS 201 N 0.48 1.18 0.00 3.15 1.57 -1.25 -2.03 116.57 119.68 2q3u h LYS 201 Ca 0.13 -0.17 -0.16 0.00 -1.87 0.00 0.00 60.65 58.58 2q3u h LYS 201 Cb 0.00 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.07 2q3u h LYS 201 CO -0.02 0.91 -1.79 0.66 -0.57 0.00 0.00 179.45 178.64 2q3u n TYR 202 N -4.31 0.47 0.61 -1.35 4.01 -0.69 -0.52 117.16 115.38 2q3u n TYR 202 Ca 0.08 0.15 0.07 0.00 -0.16 0.00 0.00 57.90 58.05 2q3u n TYR 202 Cb 0.14 -0.90 0.04 0.00 -0.31 0.00 0.00 39.34 38.31 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 -2.67 1.95 -1.20 7.72 4.77 -0.03 -4.81 117.00 122.73 2q3u n LEU 203 Ca -0.13 -0.92 -0.11 0.00 -0.03 0.00 0.00 56.01 54.82 2q3u n LEU 203 Cb 0.83 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.91 2q3u n LEU 203 CO 0.44 0.36 -0.14 0.61 -1.33 0.00 0.00 177.39 177.33 2q3u n GLY 204 N 0.90 0.11 3.90 -0.72 0.00 -0.76 -4.48 105.19 104.13 2q3u n GLY 204 Ca 0.07 -0.44 -0.20 0.00 0.00 0.00 0.00 46.02 45.45 2q3u n GLY 204 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2q3u s VAL 205 N -2.53 3.63 -0.09 1.61 -7.23 -1.22 -4.65 120.40 109.93 2q3u s VAL 205 Ca 0.00 -1.23 -0.03 0.00 -1.81 0.00 0.00 61.98 58.91 2q3u s VAL 205 Cb 0.00 -3.24 -0.04 0.00 0.56 0.00 0.00 36.38 33.66 2q3u s VAL 205 CO 0.00 -0.15 -0.10 0.00 -0.31 0.00 0.00 175.10 174.54 2q3u n GLN 206 N -1.49 0.19 -4.45 4.82 3.00 0.17 -4.40 117.38 115.23 2q3u n GLN 206 Ca -0.01 0.07 -0.22 0.00 -0.01 0.00 0.00 57.00 56.84 2q3u n GLN 206 Cb 0.59 -0.94 -0.10 0.00 0.00 0.00 0.00 30.24 29.79 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 -5.42 2.72 -0.08 1.08 1.04 -1.23 -5.05 113.70 106.76 2q3u s SER 207 Ca -0.12 -1.26 0.01 0.00 0.48 0.00 0.00 55.95 55.06 2q3u s SER 207 Cb 0.04 -0.16 0.02 0.00 0.10 0.00 0.00 66.02 66.02 2q3u s SER 207 CO 0.17 -0.43 -0.10 -0.36 0.98 0.00 0.00 173.24 173.49 2q3u s PHE 208 N -3.08 1.41 -0.26 5.02 0.40 -1.26 -1.88 117.98 118.33 2q3u s PHE 208 Ca 0.32 -0.58 -0.12 0.00 -0.60 0.00 0.00 56.93 55.95 2q3u s PHE 208 Cb 0.06 -1.09 -0.05 0.00 0.51 0.00 0.00 43.02 42.45 2q3u s PHE 208 CO 0.13 -0.35 0.22 0.42 0.70 0.00 0.00 175.22 176.35 2q3u s ILE 209 N 1.03 5.30 -0.37 0.64 1.01 0.71 -4.99 121.20 124.54 2q3u s ILE 209 Ca -0.08 0.28 -0.08 0.00 0.00 0.00 0.00 60.65 60.77 2q3u s ILE 209 Cb -0.15 -3.56 0.05 0.00 0.01 0.00 0.00 42.46 38.81 2q3u s ILE 209 CO -0.01 0.27 0.16 0.26 0.00 0.00 0.00 174.94 175.63 2q3u s TRP 210 N 1.52 3.28 0.23 3.97 0.52 -1.26 -1.76 118.94 125.44 2q3u s TRP 210 Ca 0.09 -1.40 -0.16 0.00 0.02 0.00 0.00 56.10 54.65 2q3u s TRP 210 Cb -0.15 -2.50 -0.08 0.00 -1.15 0.00 0.00 33.47 29.59 2q3u s TRP 210 CO 0.08 -0.75 0.67 -0.51 0.02 0.00 0.00 176.95 176.46 2q3u s LEU 211 N 1.43 4.25 0.15 2.99 1.43 -0.38 -4.88 118.68 123.67 2q3u s LEU 211 Ca 0.00 1.26 -0.11 0.00 -1.03 0.00 0.00 54.13 54.25 2q3u s LEU 211 Cb -0.20 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 42.37 2q3u s LEU 211 CO 0.03 -0.02 1.56 -0.65 0.23 0.00 0.00 176.35 177.50 2q3u h PRO 212 N 3.07 0.92 -5.50 1.29 0.11 -1.93 0.48 132.00 130.44 2q3u h PRO 212 Ca -0.48 -0.36 -0.45 0.00 0.11 0.00 0.00 66.00 64.82 2q3u h PRO 212 Cb 1.19 -0.05 -0.23 0.00 0.11 0.00 0.00 31.00 32.02 2q3u h PRO 212 CO 0.66 1.01 -0.79 1.03 -0.21 0.00 0.00 178.00 179.70 2q3u s ARG 213 N -4.78 0.93 0.00 1.05 0.52 -1.26 0.15 118.95 115.56 2q3u s ARG 213 Ca -0.12 -0.92 0.00 0.00 -0.52 0.00 0.00 55.73 54.17 2q3u s ARG 213 Cb 0.12 -0.99 0.00 0.00 0.52 0.00 0.00 34.95 34.60 2q3u s ARG 213 CO 0.85 0.23 0.00 0.41 0.02 0.00 0.00 175.30 176.81 2q3u n GLY 214 N 1.47 -0.39 3.76 -3.53 0.00 -0.96 -4.90 105.19 100.64 2q3u n GLY 214 Ca -0.20 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 43.79 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 4.49 0.25 0.99 2.96 -1.26 -4.95 118.68 121.16 2q3u s LEU 215 Ca 0.00 2.44 -0.31 0.00 -0.22 0.00 0.00 54.13 56.05 2q3u s LEU 215 Cb 0.00 -3.63 -0.11 0.00 0.50 0.00 0.00 46.19 42.95 2q3u s LEU 215 CO 0.00 -0.33 1.58 -0.47 -1.32 0.00 0.00 176.35 175.81 2q3u s TYR 216 N -1.02 2.88 0.00 5.38 6.14 -1.26 -1.70 117.35 127.77 2q3u s TYR 216 Ca 0.47 0.74 0.00 0.00 0.64 0.00 0.00 57.07 58.92 2q3u s TYR 216 Cb -0.35 -4.01 0.00 0.00 0.42 0.00 0.00 41.96 38.02 2q3u s TYR 216 CO 0.45 -3.49 0.00 0.41 0.64 0.00 0.00 175.55 173.56 2q3u n GLY 217 N 2.72 1.90 2.18 8.97 0.00 -1.26 -4.71 105.19 114.99 2q3u n GLY 217 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 2q3u n GLY 217 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2q3u n ASP 218 N 0.00 5.72 0.15 1.61 10.43 -0.69 -4.48 116.55 129.29 2q3u n ASP 218 Ca 0.00 -3.55 0.01 0.00 2.57 0.00 0.00 54.79 53.82 2q3u n ASP 218 Cb 0.00 -0.91 0.31 0.00 1.84 0.00 0.00 41.12 42.36 2q3u n ASP 218 CO 0.00 0.00 0.00 -0.08 -1.07 0.00 0.00 177.20 176.05 2q3u h GLU 219 N 1.43 0.07 -0.53 -1.24 4.57 -1.94 0.12 114.58 117.07 2q3u h GLU 219 Ca 0.56 -0.03 -0.06 0.00 -1.18 0.00 0.00 59.36 58.65 2q3u h GLU 219 Cb 1.68 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 30.25 2q3u h GLU 219 CO 1.23 0.46 0.10 -0.44 -1.18 0.00 0.00 179.01 179.18 2q3u h ASP 220 N 0.06 0.78 -0.07 1.04 3.32 -1.96 -2.56 116.42 117.04 2q3u h ASP 220 Ca 0.00 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.90 2q3u h ASP 220 Cb 0.73 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.07 2q3u h ASP 220 CO 0.05 0.79 0.00 0.35 -1.72 0.00 0.00 179.24 178.71 2q3u n THR 221 N -4.26 0.05 -3.07 0.35 -2.24 -1.18 -4.74 114.28 99.19 2q3u n THR 221 Ca 0.04 -0.52 -0.14 0.00 -2.27 0.00 0.00 64.05 61.17 2q3u n THR 221 Cb 0.25 1.40 0.04 0.00 -2.10 0.00 0.00 70.33 69.92 2q3u n THR 221 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2q3u n ASN 222 N 1.31 -4.47 -2.45 3.42 4.13 -0.21 -4.52 115.26 112.48 2q3u n ASN 222 Ca 0.15 -0.29 -0.11 0.00 1.68 0.00 0.00 54.58 56.00 2q3u n ASN 222 Cb 0.59 -3.08 0.05 0.00 -1.54 0.00 0.00 39.78 35.80 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 -1.34 -0.02 3.50 7.41 0.00 -0.14 -2.15 105.19 112.44 2q3u n GLY 223 Ca -0.00 -0.12 -0.51 0.00 0.00 0.00 0.00 46.02 45.38 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 -3.19 0.49 -0.06 1.61 8.25 -1.26 -2.28 115.22 118.79 2q3u n HIS 224 Ca -0.13 0.89 0.25 0.00 -0.26 0.00 0.00 57.72 58.47 2q3u n HIS 224 Cb 0.59 -2.11 0.70 0.00 1.12 0.00 0.00 29.99 30.28 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 2.12 0.36 0.00 1.59 6.09 -1.80 -1.97 117.51 123.90 2q3u h ILE 225 Ca -0.40 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.09 2q3u h ILE 225 Cb 1.40 0.51 0.00 0.00 0.47 0.00 0.00 36.82 39.20 2q3u h ILE 225 CO 0.63 0.00 0.00 -2.24 -3.07 0.00 0.00 178.15 173.47 2q3u h ASP 226 N 0.00 0.00 -0.98 2.19 -0.00 -1.88 0.48 116.42 116.22 2q3u h ASP 226 Ca 0.33 0.00 -0.53 0.00 -0.00 0.00 0.00 57.03 56.83 2q3u h ASP 226 Cb 1.61 0.00 -0.30 0.00 -0.00 0.00 0.00 39.33 40.64 2q3u h ASP 226 CO -0.00 0.00 0.66 -3.20 -0.00 0.00 0.00 179.24 176.69 2q3u n ASN 227 N -3.00 4.13 -4.84 4.15 5.15 -0.74 -3.54 115.26 116.57 2q3u n ASN 227 Ca 0.02 -3.64 -0.33 0.00 -0.60 0.00 0.00 54.58 50.03 2q3u n ASN 227 Cb 0.37 -0.85 -0.06 0.00 -0.53 0.00 0.00 39.78 38.71 2q3u n ASN 227 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2q3u s PHE 231 N -3.04 3.77 -0.03 0.00 0.08 -1.26 -0.69 117.98 116.81 2q3u s PHE 231 Ca 0.23 1.26 0.12 0.00 0.12 0.00 0.00 56.93 58.66 2q3u s PHE 231 Cb -0.02 -2.49 -0.22 0.00 -0.57 0.00 0.00 43.02 39.72 2q3u s PHE 231 CO 0.17 0.55 0.73 0.00 -0.10 0.00 0.00 175.22 176.57 2q3u h ALA 232 N 4.33 0.73 -2.03 5.36 0.00 -0.56 -3.45 119.26 123.64 2q3u h ALA 232 Ca -0.49 -1.38 0.35 0.00 0.00 0.00 0.00 54.91 53.38 2q3u h ALA 232 Cb 1.21 0.42 -0.07 0.00 0.00 0.00 0.00 17.79 19.35 2q3u h ALA 232 CO 0.64 1.52 0.90 -0.98 0.00 0.00 0.00 179.25 181.33 2q3u s ARG 233 N -2.63 0.36 0.23 0.00 1.70 -1.15 -4.95 118.95 112.53 2q3u s ARG 233 Ca -0.04 -0.23 -0.30 0.00 -0.47 0.00 0.00 55.73 54.69 2q3u s ARG 233 Cb 0.08 0.10 -0.10 0.00 -0.57 0.00 0.00 34.95 34.47 2q3u s ARG 233 CO 0.82 -0.17 1.38 -2.14 -1.08 0.00 0.00 175.30 174.11 2q3u s PRO 234 N -2.06 4.32 0.00 3.89 0.02 -1.26 -1.32 135.00 138.59 2q3u s PRO 234 Ca 0.28 2.19 0.00 0.00 0.02 0.00 0.00 61.00 63.49 2q3u s PRO 234 Cb 0.00 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.38 2q3u s PRO 234 CO -0.01 -0.33 0.00 0.41 -0.33 0.00 0.00 177.00 176.73 2q3u n GLY 235 N 2.19 0.90 2.82 0.52 0.00 -1.26 -5.02 105.19 105.34 2q3u n GLY 235 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 2q3u n GLY 235 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q3u s VAL 236 N -3.61 0.22 0.24 1.61 1.01 -0.43 -1.12 120.40 118.31 2q3u s VAL 236 Ca 0.00 0.08 0.11 0.00 0.00 0.00 0.00 61.98 62.17 2q3u s VAL 236 Cb 0.00 -0.32 -0.05 0.00 0.00 0.00 0.00 36.38 36.01 2q3u s VAL 236 CO 0.00 0.17 -0.16 0.68 0.00 0.00 0.00 175.10 175.78 2q3u s VAL 237 N 1.14 2.71 -0.15 2.92 -7.23 -0.41 0.18 120.40 119.57 2q3u s VAL 237 Ca -0.08 -2.10 -0.02 0.00 -1.81 0.00 0.00 61.98 57.97 2q3u s VAL 237 Cb -0.13 -2.38 -0.02 0.00 0.56 0.00 0.00 36.38 34.40 2q3u s VAL 237 CO -0.02 -0.26 -0.07 -0.76 -0.31 0.00 0.00 175.10 173.68 2q3u s LEU 238 N -3.17 3.06 -0.08 1.32 1.43 0.13 0.54 118.68 121.91 2q3u s LEU 238 Ca 0.27 -0.20 0.04 0.00 -1.03 0.00 0.00 54.13 53.21 2q3u s LEU 238 Cb -0.07 -1.72 -0.00 0.00 0.03 0.00 0.00 46.19 44.43 2q3u s LEU 238 CO 0.14 0.17 -0.22 -0.22 0.23 0.00 0.00 176.35 176.45 2q3u s LEU 239 N 0.37 2.01 0.14 1.79 2.96 0.14 -1.98 118.68 124.10 2q3u s LEU 239 Ca -0.06 -0.50 -0.33 0.00 -0.22 0.00 0.00 54.13 53.02 2q3u s LEU 239 Cb -0.15 -1.29 -0.12 0.00 0.50 0.00 0.00 46.19 45.13 2q3u s LEU 239 CO 0.04 0.16 1.72 -1.20 -1.32 0.00 0.00 176.35 175.75 2q3u n SER 240 N 3.39 3.65 -4.07 3.68 7.64 -1.26 -1.30 113.62 125.35 2q3u n SER 240 Ca -0.19 1.04 -0.08 0.00 1.01 0.00 0.00 58.87 60.64 2q3u n SER 240 Cb 0.53 -1.50 -0.09 0.00 -1.01 0.00 0.00 64.21 62.14 2q3u n SER 240 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 2q3u s TRP 241 N 1.80 0.59 -0.16 1.43 -0.11 -0.05 -4.70 118.94 117.74 2q3u s TRP 241 Ca 0.80 -1.05 -0.20 0.00 1.22 0.00 0.00 56.10 56.87 2q3u s TRP 241 Cb -0.58 -0.35 0.05 0.00 -1.50 0.00 0.00 33.47 31.09 2q3u s TRP 241 CO 0.37 -0.48 0.54 -0.08 -4.62 0.00 0.00 176.95 172.68 2q3u s THR 242 N -3.97 0.01 -1.30 5.86 -1.32 -1.26 -1.29 115.64 112.36 2q3u s THR 242 Ca 0.14 -0.06 0.24 0.00 -1.21 0.00 0.00 61.69 60.81 2q3u s THR 242 Cb 0.07 -0.78 0.02 0.00 -1.51 0.00 0.00 72.50 70.30 2q3u s THR 242 CO -0.05 -0.03 1.31 0.47 -2.21 0.00 0.00 174.62 174.11 2q3u n ASP 243 N 2.33 0.90 -4.56 8.08 8.00 -1.26 -4.82 116.55 125.22 2q3u n ASP 243 Ca -0.15 -0.70 -0.42 0.00 0.71 0.00 0.00 54.79 54.22 2q3u n ASP 243 Cb 0.56 0.40 -0.03 0.00 -0.02 0.00 0.00 41.12 42.03 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 -2.82 6.39 0.00 -2.24 -1.08 -1.26 -4.89 116.67 110.78 2q3u s ASP 244 Ca 0.15 -0.08 0.17 0.00 -0.52 0.00 0.00 52.55 52.27 2q3u s ASP 244 Cb 0.18 -2.52 1.01 0.00 -1.46 0.00 0.00 42.92 40.13 2q3u s ASP 244 CO 0.68 -1.44 1.42 -0.62 0.52 0.00 0.00 175.17 175.72 2q3u n GLU 245 N 8.24 0.55 0.00 4.34 1.02 -1.26 -1.64 120.64 131.89 2q3u n GLU 245 Ca 0.06 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.33 2q3u n GLU 245 Cb 0.49 -1.48 0.37 0.00 -0.02 0.00 0.00 31.44 30.79 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 -0.98 0.00 -3.42 2.62 -2.24 -1.26 -4.83 114.28 104.16 2q3u n THR 246 Ca 0.13 -0.24 -0.37 0.00 -2.27 0.00 0.00 64.05 61.29 2q3u n THR 246 Cb 0.06 0.68 -0.06 0.00 -2.10 0.00 0.00 70.33 68.90 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 6.62 0.67 3.42 -1.08 -0.65 -4.92 116.67 118.51 2q3u s ASP 247 Ca 0.30 0.73 0.41 0.00 -0.52 0.00 0.00 52.55 53.47 2q3u s ASP 247 Cb 0.20 -2.24 2.23 0.00 -1.46 0.00 0.00 42.92 41.64 2q3u s ASP 247 CO 0.41 0.09 2.25 -0.65 0.52 0.00 0.00 175.17 177.80 2q3u h PRO 248 N 6.37 0.00 -0.12 4.34 0.11 -1.88 -0.28 132.00 140.54 2q3u h PRO 248 Ca -0.43 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.61 2q3u h PRO 248 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2q3u h PRO 248 CO 0.73 0.00 -0.26 0.37 -0.21 0.00 0.00 178.00 178.64 2q3u h GLN 249 N 0.00 0.21 -0.58 1.05 5.75 -1.91 -3.34 115.11 116.30 2q3u h GLN 249 Ca 0.00 -0.07 0.10 0.00 -0.15 0.00 0.00 58.65 58.53 2q3u h GLN 249 Cb 0.17 -0.02 -0.08 0.00 1.07 0.00 0.00 27.48 28.63 2q3u h GLN 249 CO 0.00 0.46 0.17 -0.92 -2.65 0.00 0.00 178.83 175.89 2q3u h TYR 250 N 0.19 0.28 0.00 3.99 5.03 -1.27 0.10 116.97 125.29 2q3u h TYR 250 Ca 0.03 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.36 2q3u h TYR 250 Cb 0.56 -0.04 -0.00 0.00 1.55 0.00 0.00 36.73 38.80 2q3u h TYR 250 CO 0.01 0.03 -0.07 1.05 -1.32 0.00 0.00 178.16 177.86 2q3u h GLU 251 N 0.32 0.00 0.06 1.82 4.11 -1.77 -0.63 114.58 118.49 2q3u h GLU 251 Ca 0.29 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.49 2q3u h GLU 251 Cb 0.40 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.67 2q3u h GLU 251 CO -0.34 0.07 -0.96 0.00 0.07 0.00 0.00 179.01 177.85 2q3u h ARG 252 N 0.00 0.55 -0.25 1.06 3.08 -0.98 -2.75 114.38 115.09 2q3u h ARG 252 Ca -0.00 -0.67 -0.03 0.00 0.07 0.00 0.00 59.98 59.35 2q3u h ARG 252 Cb 0.40 0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 2q3u h ARG 252 CO 0.01 1.27 0.04 0.77 -1.07 0.00 0.00 179.97 180.99 2q3u h SER 253 N 0.13 0.39 -0.68 7.04 0.02 -0.92 -2.07 113.55 117.46 2q3u h SER 253 Ca -0.14 -0.26 0.05 0.00 -0.84 0.00 0.00 61.79 60.61 2q3u h SER 253 Cb 1.65 -0.10 -0.05 0.00 0.14 0.00 0.00 62.40 64.04 2q3u h SER 253 CO 0.19 0.55 0.40 0.58 -1.14 0.00 0.00 176.83 177.40 2q3u h VAL 254 N 0.22 1.02 -0.41 2.27 2.07 -1.15 -1.70 116.25 118.57 2q3u h VAL 254 Ca 0.08 -0.26 -0.08 0.00 0.82 0.00 0.00 66.70 67.26 2q3u h VAL 254 Cb 0.32 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.27 2q3u h VAL 254 CO 0.00 0.14 -0.06 -0.08 0.02 0.00 0.00 177.57 177.59 2q3u h GLU 255 N 0.75 0.69 -0.42 1.57 4.81 -1.43 -2.14 114.58 118.41 2q3u h GLU 255 Ca 0.29 -0.20 -0.07 0.00 -0.13 0.00 0.00 59.36 59.25 2q3u h GLU 255 Cb 0.12 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 2q3u h GLU 255 CO -0.15 0.75 0.00 0.00 -0.73 0.00 0.00 179.01 178.88 2q3u h ALA 256 N 1.29 0.57 -0.65 2.92 0.00 -0.87 -2.13 119.26 120.39 2q3u h ALA 256 Ca 0.12 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2q3u h ALA 256 Cb 0.49 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2q3u h ALA 256 CO 0.03 0.35 0.39 1.25 0.00 0.00 0.00 179.25 181.27 2q3u h LEU 257 N 0.58 0.77 -0.19 0.00 5.85 -1.17 -0.55 115.31 120.61 2q3u h LEU 257 Ca 0.12 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.74 2q3u h LEU 257 Cb 0.48 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 2q3u h LEU 257 CO 0.02 0.59 -0.12 -1.28 -0.34 0.00 0.00 178.44 177.32 2q3u h SER 258 N 0.90 0.44 0.27 1.25 0.87 -1.18 0.42 113.55 116.51 2q3u h SER 258 Ca 0.24 -0.43 -0.00 0.00 -1.23 0.00 0.00 61.79 60.36 2q3u h SER 258 Cb -0.04 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.79 2q3u h SER 258 CO -0.04 0.77 -0.20 0.58 -0.53 0.00 0.00 176.83 177.41 2q3u h VAL 259 N 0.10 0.57 -0.75 2.23 2.07 -1.11 -2.89 116.25 116.47 2q3u h VAL 259 Ca 0.04 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.66 2q3u h VAL 259 Cb 0.62 0.57 -0.08 0.00 -1.52 0.00 0.00 31.29 30.88 2q3u h VAL 259 CO 0.03 0.00 0.38 -0.07 0.02 0.00 0.00 177.57 177.93 2q3u h LEU 260 N -0.48 0.49 -2.79 2.57 3.38 -1.11 -2.16 115.31 115.20 2q3u h LEU 260 Ca -0.02 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2q3u h LEU 260 Cb 0.42 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2q3u h LEU 260 CO -0.00 0.26 0.00 0.28 0.09 0.00 0.00 178.44 179.07 2q3u h SER 261 N 0.62 0.00 -0.40 -0.43 0.02 -0.72 0.33 113.55 112.97 2q3u h SER 261 Ca 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.33 2q3u h SER 261 Cb 0.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.97 2q3u h SER 261 CO -0.29 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 175.99 2q3u n ASN 262 N -3.08 3.64 -4.79 3.07 3.02 -0.85 -4.92 115.26 111.36 2q3u n ASN 262 Ca -0.03 -2.40 -0.36 0.00 -0.03 0.00 0.00 54.58 51.77 2q3u n ASN 262 Cb 0.10 -0.41 -0.07 0.00 -0.61 0.00 0.00 39.78 38.79 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 -1.26 5.86 -0.13 6.41 0.01 0.11 -5.06 113.70 119.64 2q3u s SER 263 Ca 0.36 0.31 0.02 0.00 1.31 0.00 0.00 55.95 57.95 2q3u s SER 263 Cb 0.24 -1.79 0.01 0.00 0.21 0.00 0.00 66.02 64.69 2q3u s SER 263 CO 0.16 0.39 -0.18 -0.63 0.41 0.00 0.00 173.24 173.39 2q3u s ILE 264 N -0.98 1.75 0.99 1.44 1.01 -1.26 -0.92 121.20 123.24 2q3u s ILE 264 Ca 0.15 -0.78 -0.15 0.00 0.00 0.00 0.00 60.65 59.87 2q3u s ILE 264 Cb -0.12 -1.58 0.19 0.00 0.01 0.00 0.00 42.46 40.96 2q3u s ILE 264 CO 0.04 0.49 1.17 1.51 0.00 0.00 0.00 174.94 178.15 2q3u s ASP 265 N 1.03 2.78 0.51 3.58 1.47 0.40 -4.87 116.67 121.57 2q3u s ASP 265 Ca -0.04 0.73 0.22 0.00 1.18 0.00 0.00 52.55 54.64 2q3u s ASP 265 Cb -0.15 -1.11 1.36 0.00 -0.34 0.00 0.00 42.92 42.69 2q3u s ASP 265 CO -0.04 -2.98 2.09 0.00 0.68 0.00 0.00 175.17 174.92 2q3u h ALA 266 N -1.80 1.54 -0.00 2.11 0.00 -1.87 0.17 119.26 119.40 2q3u h ALA 266 Ca -0.48 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2q3u h ALA 266 Cb 1.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2q3u h ALA 266 CO 0.50 0.13 -0.02 0.54 0.00 0.00 0.00 179.25 180.40 2q3u n ARG 267 N -3.99 0.91 0.00 0.00 1.74 -1.26 -4.89 116.66 109.17 2q3u n ARG 267 Ca -0.02 -0.17 0.00 0.00 -0.77 0.00 0.00 57.85 56.89 2q3u n ARG 267 Cb 0.19 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.14 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 1.13 0.85 3.82 -0.13 0.00 0.61 -5.08 105.19 106.39 2q3u n GLY 268 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.98 4.13 0.10 1.61 0.52 -1.24 -4.76 118.95 118.33 2q3u s ARG 269 Ca 0.00 0.67 -0.30 0.00 -0.52 0.00 0.00 55.73 55.58 2q3u s ARG 269 Cb 0.00 -3.07 -0.06 0.00 0.52 0.00 0.00 34.95 32.34 2q3u s ARG 269 CO 0.00 0.55 1.13 0.15 0.02 0.00 0.00 175.30 177.15 2q3u s LYS 270 N -1.55 4.51 0.35 3.54 1.02 -1.26 0.15 119.74 126.50 2q3u s LYS 270 Ca 0.34 1.71 -0.28 0.00 0.02 0.00 0.00 55.97 57.76 2q3u s LYS 270 Cb -0.17 -3.33 -0.10 0.00 -0.52 0.00 0.00 37.83 33.70 2q3u s LYS 270 CO 0.19 -0.11 1.37 0.42 -0.92 0.00 0.00 175.35 176.31 2q3u s ILE 271 N 0.55 2.47 0.03 2.17 -1.09 -0.10 -4.90 121.20 120.34 2q3u s ILE 271 Ca 0.54 0.47 -0.00 0.00 -2.23 0.00 0.00 60.65 59.44 2q3u s ILE 271 Cb -0.28 -3.30 -0.04 0.00 -1.58 0.00 0.00 42.46 37.26 2q3u s ILE 271 CO 0.31 0.11 0.14 -1.58 -1.23 0.00 0.00 174.94 172.69 2q3u s GLN 272 N -1.92 3.20 -0.07 2.79 0.74 -0.27 -4.82 119.66 119.32 2q3u s GLN 272 Ca 0.50 -0.48 0.04 0.00 0.05 0.00 0.00 55.36 55.48 2q3u s GLN 272 Cb -0.42 -2.93 -0.00 0.00 1.10 0.00 0.00 33.01 30.76 2q3u s GLN 272 CO 0.57 0.63 -0.21 0.08 -0.55 0.00 0.00 175.29 175.80 2q3u s VAL 273 N -1.34 1.78 -0.13 1.34 1.01 -1.26 -1.29 120.40 120.51 2q3u s VAL 273 Ca 0.28 -0.89 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 2q3u s VAL 273 Cb -0.12 -1.53 -0.02 0.00 0.00 0.00 0.00 36.38 34.70 2q3u s VAL 273 CO 0.20 0.50 -0.10 -0.63 0.00 0.00 0.00 175.10 175.07 2q3u s ILE 274 N 0.17 3.36 -0.17 2.22 1.01 0.19 -4.98 121.20 123.01 2q3u s ILE 274 Ca -0.10 -0.56 -0.22 0.00 0.00 0.00 0.00 60.65 59.77 2q3u s ILE 274 Cb -0.15 -2.42 -0.02 0.00 0.01 0.00 0.00 42.46 39.87 2q3u s ILE 274 CO 0.05 0.52 0.68 -0.54 0.00 0.00 0.00 174.94 175.65 2q3u s LYS 275 N 0.20 4.27 -0.31 2.79 1.02 -1.26 0.25 119.74 126.69 2q3u s LYS 275 Ca -0.06 0.74 -0.05 0.00 0.02 0.00 0.00 55.97 56.62 2q3u s LYS 275 Cb -0.15 -3.55 0.03 0.00 -0.52 0.00 0.00 37.83 33.64 2q3u s LYS 275 CO 0.04 -0.20 0.06 -1.17 -0.92 0.00 0.00 175.35 173.16 2q3u s LEU 276 N 1.75 3.97 -0.07 3.17 2.96 -0.42 -4.89 118.68 125.15 2q3u s LEU 276 Ca 0.32 -1.01 -0.28 0.00 -0.22 0.00 0.00 54.13 52.94 2q3u s LEU 276 Cb -0.16 -1.82 -0.02 0.00 0.50 0.00 0.00 46.19 44.69 2q3u s LEU 276 CO 0.12 -0.25 0.92 -0.31 -1.32 0.00 0.00 176.35 175.50 2q3u s TYR 277 N 1.39 3.56 1.15 5.38 2.02 -1.26 -0.87 117.35 128.72 2q3u s TYR 277 Ca -0.01 1.52 -0.13 0.00 -0.37 0.00 0.00 57.07 58.08 2q3u s TYR 277 Cb -0.19 -3.07 0.27 0.00 -0.40 0.00 0.00 41.96 38.58 2q3u s TYR 277 CO 0.01 -0.10 1.04 0.96 -1.57 0.00 0.00 175.55 175.89 2q3u s ILE 278 N 1.47 2.01 0.64 2.71 -4.36 -0.41 -4.77 121.20 118.48 2q3u s ILE 278 Ca 0.46 0.00 -0.11 0.00 -0.26 0.00 0.00 60.65 60.74 2q3u s ILE 278 Cb -0.19 -2.15 -0.03 0.00 1.25 0.00 0.00 42.46 41.34 2q3u s ILE 278 CO 0.21 -0.00 1.04 -2.16 0.24 0.00 0.00 174.94 174.26 2q3u s PRO 279 N -4.56 3.46 0.45 0.37 0.04 -1.26 -4.89 135.00 128.61 2q3u s PRO 279 Ca 0.68 0.79 -0.24 0.00 0.04 0.00 0.00 61.00 62.28 2q3u s PRO 279 Cb -0.24 -2.06 -0.10 0.00 0.04 0.00 0.00 34.50 32.15 2q3u s PRO 279 CO 0.63 -0.68 1.05 -0.85 0.04 0.00 0.00 177.00 177.19 2q3u n GLU 280 N -2.82 1.39 -1.61 4.56 0.28 -1.26 -4.77 120.64 116.40 2q3u n GLU 280 Ca 0.06 0.50 -0.58 0.00 -0.16 0.00 0.00 57.16 56.98 2q3u n GLU 280 Cb 0.54 -2.12 -0.08 0.00 1.43 0.00 0.00 31.44 31.22 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 -0.03 0.59 -4.69 3.44 -0.02 -1.26 -4.97 135.00 128.05 2q3u n PRO 281 Ca 0.09 0.22 -0.32 0.00 -2.02 0.00 0.00 63.50 61.47 2q3u n PRO 281 Cb 0.40 -1.80 -0.12 0.00 -0.02 0.00 0.00 33.50 31.96 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 1.32 2.78 0.00 2.45 1.43 -1.26 -5.08 118.68 120.32 2q3u s LEU 282 Ca 0.93 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 53.74 2q3u s LEU 282 Cb -1.17 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 43.45 2q3u s LEU 282 CO 0.59 0.29 0.00 -1.22 0.23 0.00 0.00 176.35 176.25 2q3u n TYR 283 N 1.81 0.00 -4.20 0.29 4.02 -1.26 -1.35 117.16 116.47 2q3u n TYR 283 Ca -0.16 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.56 2q3u n TYR 283 Cb 0.52 0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.72 2q3u n TYR 283 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2q3u s THR 285 N 3.56 0.88 0.49 -0.72 -4.23 -1.26 -4.82 115.64 109.54 2q3u s THR 285 Ca 0.00 -1.05 0.21 0.00 -1.18 0.00 0.00 61.69 59.68 2q3u s THR 285 Cb 0.00 -0.85 0.38 0.00 1.34 0.00 0.00 72.50 73.36 2q3u s THR 285 CO 0.00 -0.17 1.98 -0.08 -0.54 0.00 0.00 174.62 175.81 2q3u h GLU 286 N 4.71 0.15 -0.18 3.99 4.57 -1.94 0.34 114.58 126.21 2q3u h GLU 286 Ca -0.37 -0.01 -0.06 0.00 -1.18 0.00 0.00 59.36 57.73 2q3u h GLU 286 Cb 1.19 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.73 2q3u h GLU 286 CO 0.42 0.10 -0.17 1.49 -1.18 0.00 0.00 179.01 179.67 2q3u h GLU 287 N 0.16 0.31 -0.43 1.92 4.81 -2.01 -3.17 114.58 116.15 2q3u h GLU 287 Ca 0.28 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.40 2q3u h GLU 287 Cb 0.90 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.22 2q3u h GLU 287 CO -0.04 0.48 0.16 0.93 -0.73 0.00 0.00 179.01 179.81 2q3u h GLU 288 N 0.28 0.65 -0.19 1.92 5.08 -1.38 -3.23 114.58 117.71 2q3u h GLU 288 Ca 0.05 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 2q3u h GLU 288 Cb 0.47 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2q3u h GLU 288 CO 0.03 0.61 -0.14 1.03 -1.00 0.00 0.00 179.01 179.54 2q3u h SER 289 N 0.56 0.30 0.58 1.42 0.87 -1.50 -2.80 113.55 112.96 2q3u h SER 289 Ca 0.14 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2q3u h SER 289 Cb 0.21 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 62.09 2q3u h SER 289 CO -0.01 0.46 -0.02 0.77 -0.53 0.00 0.00 176.83 177.50 2q3u h SER 290 N 0.29 0.00 -0.15 6.23 4.64 -1.56 -2.04 113.55 120.96 2q3u h SER 290 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2q3u h SER 290 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 2q3u h SER 290 CO 0.02 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 2q3u n GLY 291 N -0.45 0.21 3.28 -0.77 0.00 -1.06 -4.77 105.19 101.64 2q3u n GLY 291 Ca -0.01 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.81 3.39 0.32 -0.61 1.01 -0.77 -2.95 121.20 119.79 2q3u s ILE 292 Ca 0.33 -0.75 -0.28 0.00 0.00 0.00 0.00 60.65 59.95 2q3u s ILE 292 Cb 0.17 -2.68 -0.13 0.00 0.01 0.00 0.00 42.46 39.84 2q3u s ILE 292 CO 0.27 0.23 1.20 0.41 0.00 0.00 0.00 174.94 177.05 2q3u n THR 293 N 4.77 1.98 -3.73 2.92 -1.04 -0.44 -4.96 114.28 113.79 2q3u n THR 293 Ca -0.16 -0.50 -0.37 0.00 -2.04 0.00 0.00 64.05 60.98 2q3u n THR 293 Cb 0.48 -1.39 -0.11 0.00 -1.82 0.00 0.00 70.33 67.49 2q3u n THR 293 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2q3u s GLN 294 N -1.76 2.26 -0.01 -2.82 -0.21 -1.26 -4.33 119.66 111.54 2q3u s GLN 294 Ca 0.57 -1.65 0.07 0.00 0.02 0.00 0.00 55.36 54.36 2q3u s GLN 294 Cb -0.61 -3.61 -0.09 0.00 1.00 0.00 0.00 33.01 29.69 2q3u s GLN 294 CO 0.61 -0.99 0.20 -0.40 -2.12 0.00 0.00 175.29 172.59 2q3u n ASP 295 N 4.71 2.27 0.00 5.90 5.68 -1.26 -5.02 116.55 128.83 2q3u n ASP 295 Ca -0.06 -0.25 0.00 0.00 -0.50 0.00 0.00 54.79 53.98 2q3u n ASP 295 Cb 0.42 1.20 0.00 0.00 -1.14 0.00 0.00 41.12 41.59 2q3u n ASP 295 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2q3u n GLY 296 N 1.76 2.91 0.00 6.12 0.00 -1.26 -4.79 105.19 109.92 2q3u n GLY 296 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.10 0.04 -4.23 1.61 -0.58 -1.26 -4.62 120.64 110.50 2q3u n GLU 297 Ca 0.00 0.32 -0.13 0.00 -0.42 0.00 0.00 57.16 56.93 2q3u n GLU 297 Cb 0.00 -1.50 -0.10 0.00 -0.57 0.00 0.00 31.44 29.27 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 -2.83 1.30 0.69 0.62 0.00 -1.26 -2.88 121.76 117.39 2q3u s ALA 298 Ca 0.05 -1.60 -0.11 0.00 0.00 0.00 0.00 51.96 50.30 2q3u s ALA 298 Cb 0.05 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.83 2q3u s ALA 298 CO 0.12 -0.36 1.08 0.96 0.00 0.00 0.00 175.76 177.55 2q3u s ILE 299 N -3.74 3.84 0.48 0.00 -4.36 -1.09 -4.84 121.20 111.49 2q3u s ILE 299 Ca 0.25 0.60 -0.23 0.00 -0.26 0.00 0.00 60.65 61.01 2q3u s ILE 299 Cb 0.06 -3.55 -0.07 0.00 1.25 0.00 0.00 42.46 40.15 2q3u s ILE 299 CO 0.05 -0.78 1.33 -2.84 0.24 0.00 0.00 174.94 172.93 2q3u s PRO 300 N -5.27 3.52 -0.39 0.37 0.02 -1.26 -4.96 135.00 127.02 2q3u s PRO 300 Ca 0.57 2.18 0.02 0.00 0.02 0.00 0.00 61.00 63.80 2q3u s PRO 300 Cb -0.11 -2.46 0.12 0.00 0.02 0.00 0.00 34.50 32.06 2q3u s PRO 300 CO 0.53 -0.87 0.15 1.03 -0.33 0.00 0.00 177.00 177.51 2q3u s ARG 301 N -2.65 1.33 0.12 5.54 1.81 -1.26 -5.11 118.95 118.73 2q3u s ARG 301 Ca 0.65 -1.85 0.06 0.00 -1.72 0.00 0.00 55.73 52.86 2q3u s ARG 301 Cb -0.39 -2.69 -0.04 0.00 -0.45 0.00 0.00 34.95 31.38 2q3u s ARG 301 CO 0.47 -1.04 0.00 -0.51 -0.68 0.00 0.00 175.30 173.54 2q3u s LEU 302 N 0.70 3.43 0.26 2.53 1.43 -1.26 -4.66 118.68 121.11 2q3u s LEU 302 Ca 0.14 -0.24 -0.31 0.00 -1.03 0.00 0.00 54.13 52.69 2q3u s LEU 302 Cb -0.21 -2.14 -0.12 0.00 0.03 0.00 0.00 46.19 43.75 2q3u s LEU 302 CO -0.09 0.15 1.59 0.00 0.23 0.00 0.00 176.35 178.23 2q3u n ALA 303 N 0.36 2.28 -0.14 4.21 0.00 -1.26 -2.79 120.51 123.16 2q3u n ALA 303 Ca -0.11 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.72 2q3u n ALA 303 Cb 0.53 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.54 2q3u n ALA 303 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2q3u n GLY 304 N 2.61 0.60 3.74 0.00 0.00 -1.26 -4.93 105.19 105.94 2q3u n GLY 304 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.34 2.95 0.02 2.61 2.01 -1.12 -4.89 115.64 114.89 2q3u s THR 305 Ca 0.00 0.78 -0.30 0.00 0.31 0.00 0.00 61.69 62.48 2q3u s THR 305 Cb 0.00 -3.50 -0.06 0.00 0.01 0.00 0.00 72.50 68.95 2q3u s THR 305 CO 0.00 0.11 1.48 -0.60 -0.69 0.00 0.00 174.62 174.93 2q3u s ARG 306 N -0.09 4.25 0.39 4.92 6.06 -1.26 -4.17 118.95 129.05 2q3u s ARG 306 Ca 0.59 2.08 -0.23 0.00 -2.50 0.00 0.00 55.73 55.67 2q3u s ARG 306 Cb -0.39 -3.59 -0.11 0.00 0.06 0.00 0.00 34.95 30.93 2q3u s ARG 306 CO 0.39 -0.63 0.95 -0.51 -2.50 0.00 0.00 175.30 173.00 2q3u s LEU 307 N 2.50 4.10 -1.19 -0.88 1.43 -0.46 -4.84 118.68 119.35 2q3u s LEU 307 Ca 0.67 1.75 -0.12 0.00 -1.03 0.00 0.00 54.13 55.40 2q3u s LEU 307 Cb -0.34 -4.32 0.20 0.00 0.03 0.00 0.00 46.19 41.76 2q3u s LEU 307 CO 0.28 -0.24 1.42 0.00 0.23 0.00 0.00 176.35 178.05 2q3u n ALA 308 N -0.15 4.20 -2.83 4.21 0.00 -1.26 -4.79 120.51 119.89 2q3u n ALA 308 Ca 0.05 -4.38 -0.36 0.00 0.00 0.00 0.00 53.44 48.75 2q3u n ALA 308 Cb 0.52 -2.88 -0.11 0.00 0.00 0.00 0.00 19.45 16.98 2q3u n ALA 308 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2q3u s ALA 309 N 0.57 3.37 -0.09 0.00 0.00 -1.26 -4.85 121.76 119.50 2q3u s ALA 309 Ca 0.39 -0.97 -0.07 0.00 0.00 0.00 0.00 51.96 51.32 2q3u s ALA 309 Cb -0.03 -2.14 0.03 0.00 0.00 0.00 0.00 23.12 20.99 2q3u s ALA 309 CO -0.01 -0.25 0.23 0.45 0.00 0.00 0.00 175.76 176.18 2q3u s SER 310 N 1.18 -0.25 0.00 0.00 0.15 -1.26 -4.40 113.70 109.13 2q3u s SER 310 Ca 0.05 0.48 0.12 0.00 0.70 0.00 0.00 55.95 57.31 2q3u s SER 310 Cb -0.14 0.43 0.61 0.00 -1.71 0.00 0.00 66.02 65.21 2q3u s SER 310 CO 0.04 -0.12 1.30 -1.22 1.20 0.00 0.00 173.24 174.44 2q3u n TYR 311 N 3.55 0.00 0.25 3.44 4.01 -1.26 -1.58 117.16 125.56 2q3u n TYR 311 Ca -0.19 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.65 2q3u n TYR 311 Cb 0.56 -0.29 0.65 0.00 -0.31 0.00 0.00 39.34 39.95 2q3u n TYR 311 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2q3u h VAL 312 N 0.00 0.79 -0.02 -0.72 2.07 -1.86 -3.30 116.25 113.21 2q3u h VAL 312 Ca 0.00 -0.55 -0.65 0.00 0.82 0.00 0.00 66.70 66.32 2q3u h VAL 312 Cb 0.11 1.33 0.02 0.00 -1.52 0.00 0.00 31.29 31.24 2q3u h VAL 312 CO 0.00 0.14 3.67 -3.20 0.02 0.00 0.00 177.57 178.20 2q3u n ASN 313 N -3.91 8.63 -4.90 0.57 5.15 -0.62 -4.85 115.26 115.33 2q3u n ASN 313 Ca -0.02 -2.57 -0.24 0.00 -0.60 0.00 0.00 54.58 51.14 2q3u n ASN 313 Cb 0.23 -1.55 -0.01 0.00 -0.53 0.00 0.00 39.78 37.92 2q3u n ASN 313 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 2q3u s PHE 314 N 2.07 1.91 0.18 1.20 -0.12 -1.24 -1.63 117.98 120.34 2q3u s PHE 314 Ca 0.70 -0.74 0.09 0.00 -0.05 0.00 0.00 56.93 56.93 2q3u s PHE 314 Cb 0.19 -2.00 -0.04 0.00 -0.63 0.00 0.00 43.02 40.54 2q3u s PHE 314 CO -0.06 -0.41 -0.09 -0.47 -0.05 0.00 0.00 175.22 174.14 2q3u s TYR 315 N -2.69 2.64 -0.25 3.49 5.04 -0.13 -3.96 117.35 121.49 2q3u s TYR 315 Ca 0.40 -0.22 -0.04 0.00 -2.44 0.00 0.00 57.07 54.77 2q3u s TYR 315 Cb -0.02 -1.29 0.01 0.00 0.35 0.00 0.00 41.96 41.01 2q3u s TYR 315 CO 0.24 0.51 -0.02 0.42 -1.34 0.00 0.00 175.55 175.37 2q3u s ILE 316 N -1.72 3.37 0.35 3.14 1.01 -1.26 0.05 121.20 126.14 2q3u s ILE 316 Ca 0.25 -0.71 0.09 0.00 0.00 0.00 0.00 60.65 60.28 2q3u s ILE 316 Cb -0.09 -2.64 -0.07 0.00 0.01 0.00 0.00 42.46 39.67 2q3u s ILE 316 CO 0.15 0.26 -0.08 0.00 0.00 0.00 0.00 174.94 175.27 2q3u s ALA 317 N 1.44 2.96 -0.78 9.38 0.00 -0.50 -4.79 121.76 129.47 2q3u s ALA 317 Ca 0.03 -2.11 -0.23 0.00 0.00 0.00 0.00 51.96 49.65 2q3u s ALA 317 Cb -0.16 -0.01 -0.16 0.00 0.00 0.00 0.00 23.12 22.79 2q3u s ALA 317 CO -0.02 0.05 2.39 0.09 0.00 0.00 0.00 175.76 178.27 2q3u n ASN 318 N -0.81 1.26 0.00 0.00 3.02 -1.26 -1.83 115.26 115.64 2q3u n ASN 318 Ca -0.05 -1.01 0.00 0.00 -0.03 0.00 0.00 54.58 53.49 2q3u n ASN 318 Cb 0.64 -1.41 0.00 0.00 -0.61 0.00 0.00 39.78 38.40 2q3u n ASN 318 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2q3u n GLY 319 N 6.40 0.47 3.17 7.41 0.00 -1.26 -4.73 105.19 116.65 2q3u n GLY 319 Ca 0.50 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.43 2q3u n GLY 319 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2q3u s GLY 320 N -1.13 0.39 -0.14 -0.02 0.00 -0.76 -1.20 107.32 104.47 2q3u s GLY 320 Ca 0.00 -0.99 0.01 0.00 0.00 0.00 0.00 44.72 43.75 2q3u s GLY 320 CO 0.00 -1.08 -0.17 -0.42 0.00 0.00 0.00 173.10 171.42 2q3u s ILE 321 N -3.92 1.74 -0.45 0.90 -1.09 -0.41 -1.41 121.20 116.55 2q3u s ILE 321 Ca 0.09 -0.77 -0.10 0.00 -2.23 0.00 0.00 60.65 57.65 2q3u s ILE 321 Cb 0.06 -1.58 0.10 0.00 -1.58 0.00 0.00 42.46 39.46 2q3u s ILE 321 CO -0.08 0.49 0.32 -0.63 -1.23 0.00 0.00 174.94 173.80 2q3u s ILE 322 N 1.10 4.31 0.03 2.92 -1.09 0.11 -1.04 121.20 127.54 2q3u s ILE 322 Ca -0.02 -1.56 0.08 0.00 -2.23 0.00 0.00 60.65 56.92 2q3u s ILE 322 Cb -0.14 -3.73 -0.03 0.00 -1.58 0.00 0.00 42.46 36.98 2q3u s ILE 322 CO -0.05 -0.65 -0.23 0.00 -1.23 0.00 0.00 174.94 172.78 2q3u s ALA 323 N 1.42 2.38 0.56 9.38 0.00 -0.48 -0.95 121.76 134.06 2q3u s ALA 323 Ca 0.04 -1.22 -0.20 0.00 0.00 0.00 0.00 51.96 50.58 2q3u s ALA 323 Cb -0.25 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.23 2q3u s ALA 323 CO 0.01 0.55 1.25 -1.25 0.00 0.00 0.00 175.76 176.32 2q3u s PRO 324 N -1.21 3.14 -0.13 0.00 0.04 -1.26 -0.66 135.00 134.91 2q3u s PRO 324 Ca 0.12 1.97 0.01 0.00 0.04 0.00 0.00 61.00 63.14 2q3u s PRO 324 Cb -0.10 -2.12 0.02 0.00 0.04 0.00 0.00 34.50 32.34 2q3u s PRO 324 CO 0.03 -1.11 -0.16 -0.65 0.04 0.00 0.00 177.00 175.15 2q3u s GLN 325 N -3.08 2.38 0.00 4.56 -1.52 -0.86 -4.67 119.66 116.47 2q3u s GLN 325 Ca 0.73 -0.60 0.24 0.00 -1.95 0.00 0.00 55.36 53.78 2q3u s GLN 325 Cb -0.34 -2.07 0.14 0.00 -0.22 0.00 0.00 33.01 30.52 2q3u s GLN 325 CO 0.39 -0.14 1.21 1.19 -0.25 0.00 0.00 175.29 177.69 2q3u n PHE 326 N 4.45 0.00 -0.04 0.91 3.01 -1.26 -0.68 117.46 123.85 2q3u n PHE 326 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.28 2q3u n PHE 326 Cb 0.51 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.97 2q3u n PHE 326 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2q3u n GLY 327 N 1.37 0.61 3.38 1.37 0.00 -1.26 -4.64 105.19 106.02 2q3u n GLY 327 Ca 0.12 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.70 2q3u n GLY 327 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2q3u s ASP 328 N -2.81 6.17 0.44 1.61 3.68 -1.26 -4.95 116.67 119.54 2q3u s ASP 328 Ca 0.00 -1.38 0.10 0.00 2.13 0.00 0.00 52.55 53.41 2q3u s ASP 328 Cb 0.00 -2.21 0.98 0.00 -1.45 0.00 0.00 42.92 40.24 2q3u s ASP 328 CO 0.00 -0.74 2.06 1.55 0.13 0.00 0.00 175.17 178.17 2q3u h PRO 329 N 8.83 0.40 -0.00 4.34 0.13 -1.97 0.59 132.00 144.32 2q3u h PRO 329 Ca -0.29 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 64.78 2q3u h PRO 329 Cb 1.11 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2q3u h PRO 329 CO 0.93 0.27 -0.15 0.82 -0.23 0.00 0.00 178.00 179.64 2q3u h ILE 330 N 0.41 1.57 0.00 -3.56 2.04 -1.99 -2.29 117.51 113.70 2q3u h ILE 330 Ca 0.15 -1.89 -0.08 0.00 1.00 0.00 0.00 64.86 64.04 2q3u h ILE 330 Cb 0.09 2.80 -0.01 0.00 -0.74 0.00 0.00 36.82 38.96 2q3u h ILE 330 CO -0.04 0.51 -0.39 0.03 0.00 0.00 0.00 178.15 178.26 2q3u h ARG 331 N -0.60 0.00 -0.44 2.37 2.47 -1.87 -2.41 114.38 113.90 2q3u h ARG 331 Ca -0.02 0.00 -0.12 0.00 -1.26 0.00 0.00 59.98 58.58 2q3u h ARG 331 Cb 0.91 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.22 2q3u h ARG 331 CO 0.03 0.39 -0.22 -0.44 0.56 0.00 0.00 179.97 180.29 2q3u h ASP 332 N 0.00 0.90 -0.02 7.04 3.32 0.14 -1.75 116.42 126.05 2q3u h ASP 332 Ca -0.00 -0.33 -0.00 0.00 0.02 0.00 0.00 57.03 56.71 2q3u h ASP 332 Cb 1.09 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 40.40 2q3u h ASP 332 CO 0.05 1.08 -0.01 0.50 -1.72 0.00 0.00 179.24 179.14 2q3u h LYS 333 N 0.76 0.04 -0.94 3.56 3.64 -1.06 -3.02 116.57 119.56 2q3u h LYS 333 Ca 0.10 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.54 2q3u h LYS 333 Cb 0.76 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.51 2q3u h LYS 333 CO 0.06 0.41 0.61 1.49 -2.27 0.00 0.00 179.45 179.75 2q3u h GLU 334 N -0.33 1.01 -0.51 1.90 4.57 -1.43 -1.91 114.58 117.88 2q3u h GLU 334 Ca 0.00 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.14 2q3u h GLU 334 Cb 0.40 -0.23 -0.03 0.00 -0.16 0.00 0.00 28.75 28.73 2q3u h GLU 334 CO 0.00 0.67 0.32 0.00 -1.18 0.00 0.00 179.01 178.83 2q3u h ALA 335 N 1.50 0.65 -0.64 2.92 0.00 -1.27 0.35 119.26 122.77 2q3u h ALA 335 Ca 0.42 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.24 2q3u h ALA 335 Cb 0.25 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2q3u h ALA 335 CO -0.17 0.05 0.16 0.82 0.00 0.00 0.00 179.25 180.11 2q3u h ILE 336 N 0.65 1.25 -0.33 0.00 1.08 -1.26 -1.44 117.51 117.47 2q3u h ILE 336 Ca 0.20 -0.91 0.00 0.00 -0.39 0.00 0.00 64.86 63.75 2q3u h ILE 336 Cb -0.03 0.59 -0.02 0.00 -3.07 0.00 0.00 36.82 34.29 2q3u h ILE 336 CO -0.06 0.35 0.21 -0.09 -0.69 0.00 0.00 178.15 177.87 2q3u h ARG 337 N 0.97 0.43 -0.31 2.37 2.43 -0.24 0.16 114.38 120.19 2q3u h ARG 337 Ca 0.21 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.28 2q3u h ARG 337 Cb 0.34 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 2q3u h ARG 337 CO 0.00 0.29 -0.08 0.28 -1.51 0.00 0.00 179.97 178.95 2q3u h VAL 338 N 0.44 1.28 -0.35 0.20 2.07 -0.30 -1.25 116.25 118.34 2q3u h VAL 338 Ca 0.12 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.51 2q3u h VAL 338 Cb -0.04 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 2q3u h VAL 338 CO -0.03 0.37 0.23 -0.07 0.02 0.00 0.00 177.57 178.09 2q3u h LEU 339 N 0.38 0.40 -1.25 2.57 3.38 -1.18 0.25 115.31 119.87 2q3u h LEU 339 Ca 0.08 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 2q3u h LEU 339 Cb 0.58 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2q3u h LEU 339 CO 0.03 0.30 -0.10 0.28 0.09 0.00 0.00 178.44 179.04 2q3u h SER 340 N 0.47 0.38 0.29 -0.43 0.02 -0.57 0.55 113.55 114.26 2q3u h SER 340 Ca 0.13 -0.08 -0.15 0.00 -0.84 0.00 0.00 61.79 60.84 2q3u h SER 340 Cb -0.05 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 2q3u h SER 340 CO -0.03 0.52 -0.61 -0.78 -1.14 0.00 0.00 176.83 174.79 2q3u h ASP 341 N 0.37 0.36 1.21 3.07 1.82 -0.71 -3.07 116.42 119.47 2q3u h ASP 341 Ca 0.08 -0.21 -0.13 0.00 -0.39 0.00 0.00 57.03 56.38 2q3u h ASP 341 Cb 0.41 -0.10 -0.02 0.00 0.68 0.00 0.00 39.33 40.29 2q3u h ASP 341 CO 0.02 0.88 -0.60 0.74 -1.61 0.00 0.00 179.24 178.67 2q3u h THR 342 N 0.23 1.10 -2.19 2.25 2.02 -0.05 -3.34 112.91 112.93 2q3u h THR 342 Ca -0.01 -2.37 -0.59 0.00 0.77 0.00 0.00 66.41 64.21 2q3u h THR 342 Cb 1.12 2.42 -0.42 0.00 -1.74 0.00 0.00 68.15 69.54 2q3u h THR 342 CO 0.10 0.59 -0.69 0.49 0.37 0.00 0.00 175.52 176.38 2q3u n PHE 343 N -3.34 3.19 0.34 3.16 3.01 0.14 -4.95 117.46 119.01 2q3u n PHE 343 Ca 0.01 -4.03 0.04 0.00 1.01 0.00 0.00 57.45 54.48 2q3u n PHE 343 Cb 0.74 -0.51 0.20 0.00 -0.01 0.00 0.00 39.48 39.89 2q3u n PHE 343 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2q3u n PRO 344 N 0.51 0.05 -0.31 -1.08 -0.04 -1.16 -1.57 135.00 131.39 2q3u n PRO 344 Ca 0.29 0.29 0.08 0.00 -0.04 0.00 0.00 63.50 64.12 2q3u n PRO 344 Cb 0.43 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.63 2q3u n PRO 344 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2q3u n HIS 345 N -1.41 0.77 -4.39 0.54 8.25 -1.26 -4.99 115.22 112.73 2q3u n HIS 345 Ca 0.03 -0.54 -0.27 0.00 -0.26 0.00 0.00 57.72 56.67 2q3u n HIS 345 Cb 0.09 -0.07 -0.12 0.00 1.12 0.00 0.00 29.99 31.01 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 -1.23 2.35 -0.27 4.41 3.76 -0.61 -4.88 115.29 118.82 2q3u s HIS 346 Ca 0.36 -0.34 -0.21 0.00 -0.15 0.00 0.00 55.06 54.71 2q3u s HIS 346 Cb 0.20 -1.19 -0.01 0.00 1.11 0.00 0.00 32.58 32.69 2q3u s HIS 346 CO 0.22 0.46 0.67 0.45 -0.85 0.00 0.00 174.74 175.68 2q3u s SER 347 N -2.52 6.59 -0.36 1.40 0.15 -0.34 -4.86 113.70 113.76 2q3u s SER 347 Ca 0.20 0.67 -0.20 0.00 0.70 0.00 0.00 55.95 57.32 2q3u s SER 347 Cb -0.09 -2.35 0.00 0.00 -1.71 0.00 0.00 66.02 61.87 2q3u s SER 347 CO 0.10 -0.44 0.60 -0.69 1.20 0.00 0.00 173.24 174.01 2q3u s VAL 348 N 2.62 4.92 -0.17 4.45 1.01 -1.26 -1.29 120.40 130.67 2q3u s VAL 348 Ca 0.28 0.49 -0.05 0.00 0.00 0.00 0.00 61.98 62.69 2q3u s VAL 348 Cb -0.15 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.14 2q3u s VAL 348 CO 0.10 -0.31 0.01 -0.69 0.00 0.00 0.00 175.10 174.21 2q3u s VAL 349 N 2.63 4.32 -0.13 2.92 1.01 -0.21 -4.97 120.40 125.98 2q3u s VAL 349 Ca 0.23 -0.20 -0.06 0.00 0.00 0.00 0.00 61.98 61.94 2q3u s VAL 349 Cb -0.15 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 2q3u s VAL 349 CO 0.15 0.48 0.11 -0.83 0.00 0.00 0.00 175.10 175.00 2q3u s GLY 350 N 0.38 2.07 -0.51 4.51 0.00 -1.26 -1.38 107.32 111.13 2q3u s GLY 350 Ca -0.01 -0.68 -0.17 0.00 0.00 0.00 0.00 44.72 43.86 2q3u s GLY 350 CO 0.02 -0.34 0.53 -0.42 0.00 0.00 0.00 173.10 172.89 2q3u s ILE 351 N -0.78 5.05 0.69 0.90 -1.09 0.16 -4.90 121.20 121.24 2q3u s ILE 351 Ca 0.13 -0.93 -0.17 0.00 -2.23 0.00 0.00 60.65 57.46 2q3u s ILE 351 Cb -0.12 -4.27 -0.01 0.00 -1.58 0.00 0.00 42.46 36.49 2q3u s ILE 351 CO 0.03 -0.78 0.97 -0.62 -1.23 0.00 0.00 174.94 173.32 2q3u n GLU 352 N 5.69 0.63 -2.37 2.79 -0.58 -1.26 -2.02 120.64 123.53 2q3u n GLU 352 Ca -0.10 0.27 -0.20 0.00 -0.42 0.00 0.00 57.16 56.71 2q3u n GLU 352 Cb 0.43 -2.22 -0.01 0.00 -0.57 0.00 0.00 31.44 29.07 2q3u n GLU 352 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2q3u n ASN 353 N -1.44 -5.63 0.00 1.62 4.13 -1.17 -4.81 115.26 107.95 2q3u n ASN 353 Ca 0.13 0.04 0.04 0.00 1.68 0.00 0.00 54.58 56.47 2q3u n ASN 353 Cb 0.49 -4.71 0.22 0.00 -1.54 0.00 0.00 39.78 34.23 2q3u n ASN 353 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2q3u n ALA 354 N -1.89 1.54 0.02 5.41 0.00 0.15 -1.48 120.51 124.26 2q3u n ALA 354 Ca -0.23 -0.04 0.17 0.00 0.00 0.00 0.00 53.44 53.33 2q3u n ALA 354 Cb 0.68 -1.15 0.64 0.00 0.00 0.00 0.00 19.45 19.62 2q3u n ALA 354 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2q3u h ARG 355 N 0.00 0.09 0.00 0.00 2.43 -1.83 -2.61 114.38 112.47 2q3u h ARG 355 Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2q3u h ARG 355 Cb 0.10 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2q3u h ARG 355 CO 0.00 0.06 0.00 0.93 -1.51 0.00 0.00 179.97 179.45 2q3u h GLU 356 N 0.10 0.00 0.18 0.20 4.39 -1.64 -2.19 114.58 115.62 2q3u h GLU 356 Ca 0.22 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.61 2q3u h GLU 356 Cb 0.76 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.42 2q3u h GLU 356 CO -0.02 0.00 -1.52 0.82 -1.16 0.00 0.00 179.01 177.13 2q3u h ILE 357 N 0.00 1.10 0.00 3.13 2.04 -1.69 -3.35 117.51 118.73 2q3u h ILE 357 Ca 0.00 -2.53 0.00 0.00 1.00 0.00 0.00 64.86 63.33 2q3u h ILE 357 Cb 0.28 2.87 0.00 0.00 -0.74 0.00 0.00 36.82 39.23 2q3u h ILE 357 CO 0.00 0.80 0.00 1.62 0.00 0.00 0.00 178.15 180.57 2q3u h VAL 358 N -0.02 0.00 0.00 1.67 3.04 -1.08 -1.87 116.25 117.99 2q3u h VAL 358 Ca -0.30 -0.33 0.00 0.00 -1.01 0.00 0.00 66.70 65.07 2q3u h VAL 358 Cb 2.00 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 32.42 2q3u h VAL 358 CO 0.17 0.00 0.00 0.18 -1.01 0.00 0.00 177.57 176.91 2q3u n LEU 359 N -2.38 0.59 0.00 3.16 4.77 -0.86 -2.99 117.00 119.29 2q3u n LEU 359 Ca 0.03 0.69 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 2q3u n LEU 359 Cb 0.28 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 2q3u n LEU 359 CO 0.23 -0.68 0.40 0.00 -1.33 0.00 0.00 177.39 176.01 2q3u n ALA 360 N -1.76 2.12 0.00 -1.18 0.00 -0.73 -5.02 120.51 113.94 2q3u n ALA 360 Ca 0.01 -0.79 0.00 0.00 0.00 0.00 0.00 53.44 52.66 2q3u n ALA 360 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.60 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 -0.30 -0.82 0.00 0.00 0.00 -1.06 -5.06 105.19 97.95 2q3u n GLY 361 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.31 2q3u n GLY 361 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q3u n GLY 362 N 0.00 2.36 0.00 -0.02 0.00 -1.26 -4.52 105.19 101.75 2q3u n GLY 362 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.28 2q3u n GLY 362 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2q3u n ASN 363 N 0.00 0.01 -0.24 1.61 4.05 -1.26 -2.29 115.26 117.13 2q3u n ASN 363 Ca 0.00 0.00 0.03 0.00 0.45 0.00 0.00 54.58 55.06 2q3u n ASN 363 Cb 0.00 0.00 0.12 0.00 1.23 0.00 0.00 39.78 41.13 2q3u n ASN 363 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 177.26 174.61 2q3u h ILE 364 N 0.00 0.33 0.00 -1.44 2.04 -1.77 -0.47 117.51 116.21 2q3u h ILE 364 Ca 0.00 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 2q3u h ILE 364 Cb 0.00 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 36.35 2q3u h ILE 364 CO 0.00 0.01 -0.16 -0.74 0.00 0.00 0.00 178.15 177.26 2q3u h HIS 365 N 0.05 0.00 0.00 1.37 2.76 -1.43 -2.76 115.15 115.14 2q3u h HIS 365 Ca 0.37 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.54 2q3u h HIS 365 Cb 0.61 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.57 2q3u h HIS 365 CO -0.48 0.16 0.00 0.00 -1.30 0.00 0.00 177.93 176.31 2q3u n ILE 367 N -2.93 0.47 -4.36 0.00 -5.35 -1.05 -1.19 119.36 104.96 2q3u n ILE 367 Ca 0.04 -0.69 -0.29 0.00 -0.27 0.00 0.00 62.75 61.53 2q3u n ILE 367 Cb 0.48 0.87 -0.12 0.00 -1.74 0.00 0.00 39.64 39.13 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 -1.53 2.61 -0.23 7.28 -4.23 -1.17 -4.25 115.64 114.13 2q3u s THR 368 Ca 0.38 -1.59 -0.03 0.00 -1.18 0.00 0.00 61.69 59.27 2q3u s THR 368 Cb 0.22 -2.18 0.11 0.00 1.34 0.00 0.00 72.50 71.99 2q3u s THR 368 CO 0.31 0.11 0.29 -1.58 -0.54 0.00 0.00 174.62 173.20 2q3u s GLN 369 N -2.07 0.26 0.52 3.99 2.00 -0.08 -3.31 119.66 120.97 2q3u s GLN 369 Ca 0.16 0.30 -0.19 0.00 -2.00 0.00 0.00 55.36 53.63 2q3u s GLN 369 Cb -0.10 -0.90 -0.07 0.00 0.80 0.00 0.00 33.01 32.74 2q3u s GLN 369 CO 0.08 -0.68 1.08 1.14 -0.50 0.00 0.00 175.29 176.41 2q3u s GLN 370 N 2.41 3.55 -0.33 1.67 0.00 -1.26 -0.44 119.66 125.27 2q3u s GLN 370 Ca 0.09 1.44 -0.03 0.00 -0.00 0.00 0.00 55.36 56.87 2q3u s GLN 370 Cb -0.15 -2.05 0.06 0.00 0.00 0.00 0.00 33.01 30.87 2q3u s GLN 370 CO -0.15 -0.66 0.05 -1.14 0.00 0.00 0.00 175.29 173.40 2q3u s GLN 371 N -3.37 2.36 0.57 9.60 0.74 0.11 -4.52 119.66 125.15 2q3u s GLN 371 Ca 0.69 -1.37 -0.21 0.00 0.05 0.00 0.00 55.36 54.53 2q3u s GLN 371 Cb -0.19 -3.30 -0.04 0.00 1.10 0.00 0.00 33.01 30.58 2q3u s GLN 371 CO 0.25 -0.72 1.30 -2.14 -0.55 0.00 0.00 175.29 173.44 2q3u s PRO 372 N 1.25 3.05 0.25 1.67 0.02 -1.26 0.37 135.00 140.35 2q3u s PRO 372 Ca -0.02 2.09 -0.30 0.00 0.02 0.00 0.00 61.00 62.80 2q3u s PRO 372 Cb -0.20 -2.14 -0.10 0.00 0.02 0.00 0.00 34.50 32.08 2q3u s PRO 372 CO -0.01 -1.22 1.39 0.00 -0.33 0.00 0.00 177.00 176.84 2q3u s ALA 373 N -1.39 3.59 -0.30 -1.55 0.00 0.12 -4.06 121.76 118.17 2q3u s ALA 373 Ca 0.74 1.27 -0.29 0.00 0.00 0.00 0.00 51.96 53.69 2q3u s ALA 373 Cb -0.37 -3.53 -0.01 0.00 0.00 0.00 0.00 23.12 19.21 2q3u s ALA 373 CO 0.43 -0.69 1.44 -2.00 0.00 0.00 0.00 175.76 174.94 2q3u s GLU 374 N -0.53 3.78 0.34 0.00 2.12 -1.26 -4.88 118.70 118.27 2q3u s GLU 374 Ca 0.57 1.30 -0.29 0.00 0.36 0.00 0.00 54.97 56.92 2q3u s GLU 374 Cb -0.40 -3.97 -0.11 0.00 0.26 0.00 0.00 34.13 29.91 2q3u s GLU 374 CO 0.44 -1.31 1.47 -2.14 -0.54 0.00 0.00 175.26 173.18 2q3u s PRO 375 N 4.56 4.17 0.00 4.30 0.02 -1.26 -5.01 135.00 141.77 2q3u s PRO 375 Ca 0.63 2.49 0.00 0.00 0.02 0.00 0.00 61.00 64.13 2q3u s PRO 375 Cb -0.19 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.32 2q3u s PRO 375 CO 0.27 -0.48 0.00 -2.37 -0.33 0.00 0.00 177.00 174.09