#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x2g n THR 2 N 0.00 0.00 -4.55 0.44 -2.24 -1.26 -4.98 114.28 101.69 1x2g n THR 2 Ca 0.00 -0.41 -0.30 0.00 -2.27 0.00 0.00 64.05 61.07 1x2g n THR 2 Cb 0.00 1.32 -0.12 0.00 -2.10 0.00 0.00 70.33 69.43 1x2g n THR 2 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1x2g s LEU 3 N -1.89 2.60 -0.14 3.22 1.43 -1.26 -1.29 118.68 121.34 1x2g s LEU 3 Ca 0.19 -0.49 0.02 0.00 -1.03 0.00 0.00 54.13 52.82 1x2g s LEU 3 Cb 0.16 -1.50 0.02 0.00 0.03 0.00 0.00 46.19 44.89 1x2g s LEU 3 CO 0.35 0.23 -0.18 -0.13 0.23 0.00 0.00 176.35 176.85 1x2g s ARG 4 N -1.66 2.63 -0.27 1.70 1.81 0.61 -4.91 118.95 118.86 1x2g s ARG 4 Ca 0.15 -0.70 -0.03 0.00 -1.72 0.00 0.00 55.73 53.43 1x2g s ARG 4 Cb -0.10 -2.24 0.02 0.00 -0.45 0.00 0.00 34.95 32.18 1x2g s ARG 4 CO 0.07 -0.11 -0.01 -1.17 -0.68 0.00 0.00 175.30 173.39 1x2g s LEU 5 N 1.10 3.47 -0.18 2.53 2.96 -1.26 -1.76 118.68 125.53 1x2g s LEU 5 Ca -0.02 -0.88 -0.03 0.00 -0.22 0.00 0.00 54.13 52.99 1x2g s LEU 5 Cb -0.14 -1.73 -0.01 0.00 0.50 0.00 0.00 46.19 44.80 1x2g s LEU 5 CO -0.06 -0.16 -0.07 -0.76 -1.32 0.00 0.00 176.35 173.98 1x2g s LEU 6 N 1.36 2.92 -0.20 -0.68 1.43 0.12 -0.09 118.68 123.55 1x2g s LEU 6 Ca 0.00 -0.32 0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1x2g s LEU 6 Cb -0.17 -1.71 0.02 0.00 0.03 0.00 0.00 46.19 44.36 1x2g s LEU 6 CO -0.02 0.07 -0.16 -0.63 0.23 0.00 0.00 176.35 175.85 1x2g s ILE 7 N 0.91 2.33 -0.05 -0.59 -1.09 0.37 -1.62 121.20 121.46 1x2g s ILE 7 Ca -0.01 -0.96 -0.29 0.00 -2.23 0.00 0.00 60.65 57.16 1x2g s ILE 7 Cb -0.15 -2.05 -0.03 0.00 -1.58 0.00 0.00 42.46 38.66 1x2g s ILE 7 CO 0.01 0.43 0.93 -0.55 -1.23 0.00 0.00 174.94 174.53 1x2g s SER 8 N 1.30 7.25 -0.31 3.58 0.15 -0.30 0.57 113.70 125.94 1x2g s SER 8 Ca 0.03 1.52 0.10 0.00 0.70 0.00 0.00 55.95 58.30 1x2g s SER 8 Cb -0.14 -2.53 0.69 0.00 -1.71 0.00 0.00 66.02 62.32 1x2g s SER 8 CO -0.10 -0.30 1.73 -0.67 1.20 0.00 0.00 173.24 175.10 1x2g n ASP 9 N 4.26 4.34 -4.13 5.45 2.03 0.13 -4.74 116.55 123.89 1x2g n ASP 9 Ca 0.05 -3.30 -0.22 0.00 0.52 0.00 0.00 54.79 51.84 1x2g n ASP 9 Cb 0.50 -0.72 -0.15 0.00 -0.72 0.00 0.00 41.12 40.04 1x2g n ASP 9 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1x2g s SER 10 N -1.37 1.76 0.00 1.67 0.15 -1.26 -4.93 113.70 109.72 1x2g s SER 10 Ca 0.52 -0.34 0.23 0.00 0.70 0.00 0.00 55.95 57.07 1x2g s SER 10 Cb 0.43 -0.17 0.44 0.00 -1.71 0.00 0.00 66.02 65.01 1x2g s SER 10 CO 0.11 0.14 1.41 -1.22 1.20 0.00 0.00 173.24 174.87 1x2g n TYR 11 N 2.43 0.54 -1.85 3.44 4.01 -1.26 -4.55 117.16 119.92 1x2g n TYR 11 Ca -0.15 -0.28 -0.43 0.00 -0.16 0.00 0.00 57.90 56.88 1x2g n TYR 11 Cb 0.55 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.55 1x2g n TYR 11 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1x2g s ASP 12 N -1.42 5.78 0.46 7.72 -1.08 -1.26 -1.87 116.67 125.01 1x2g s ASP 12 Ca 0.39 1.59 0.21 0.00 -0.52 0.00 0.00 52.55 54.22 1x2g s ASP 12 Cb 0.23 -2.52 1.14 0.00 -1.46 0.00 0.00 42.92 40.31 1x2g s ASP 12 CO 0.31 -1.75 1.98 1.55 0.52 0.00 0.00 175.17 177.79 1x2g h PRO 13 N 13.45 0.00 -0.06 4.34 0.13 -1.90 -2.03 132.00 145.93 1x2g h PRO 13 Ca -0.37 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.64 1x2g h PRO 13 Cb 1.20 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.33 1x2g h PRO 13 CO 1.00 0.20 -0.44 -1.49 -0.23 0.00 0.00 178.00 177.04 1x2g h TRP 14 N 0.00 0.55 -0.11 1.56 6.55 -1.91 -0.47 115.95 122.12 1x2g h TRP 14 Ca -0.00 -0.26 0.05 0.00 0.95 0.00 0.00 58.89 59.62 1x2g h TRP 14 Cb 0.44 -0.08 -0.06 0.00 -0.86 0.00 0.00 29.16 28.60 1x2g h TRP 14 CO 0.00 1.03 -0.27 0.35 -1.05 0.00 0.00 178.44 178.50 1x2g h PHE 15 N -0.09 -0.74 -0.42 0.49 3.57 -1.88 0.37 116.94 118.24 1x2g h PHE 15 Ca -0.04 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.39 1x2g h PHE 15 Cb 1.11 0.35 -0.02 0.00 2.79 0.00 0.00 35.95 40.18 1x2g h PHE 15 CO 0.13 -0.36 -0.15 -0.91 -2.23 0.00 0.00 178.31 174.79 1x2g h ASN 16 N -0.35 0.77 0.11 0.41 2.35 -1.34 -0.66 115.58 116.87 1x2g h ASN 16 Ca 0.10 -0.25 -0.10 0.00 -0.55 0.00 0.00 56.30 55.49 1x2g h ASN 16 Cb 0.50 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 1x2g h ASN 16 CO -0.32 0.93 -0.36 -0.07 -1.65 0.00 0.00 177.43 175.97 1x2g h LEU 17 N 0.69 0.36 -0.83 1.61 3.38 -1.00 -2.56 115.31 116.96 1x2g h LEU 17 Ca 0.11 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1x2g h LEU 17 Cb 0.65 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1x2g h LEU 17 CO 0.05 0.69 0.08 0.00 0.09 0.00 0.00 178.44 179.35 1x2g h ALA 18 N 1.33 1.03 -0.18 1.53 0.00 0.04 -0.80 119.26 122.22 1x2g h ALA 18 Ca 0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 1x2g h ALA 18 Cb 0.77 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1x2g h ALA 18 CO 0.06 0.62 0.08 0.28 0.00 0.00 0.00 179.25 180.29 1x2g h VAL 19 N 0.90 1.14 -0.77 0.00 2.07 -0.99 -1.24 116.25 117.36 1x2g h VAL 19 Ca 0.18 -0.40 0.07 0.00 0.82 0.00 0.00 66.70 67.37 1x2g h VAL 19 Cb 0.41 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.22 1x2g h VAL 19 CO 0.01 0.13 0.50 -0.33 0.02 0.00 0.00 177.57 177.90 1x2g h GLU 20 N 0.15 0.78 -0.24 1.57 5.08 -1.34 -1.28 114.58 119.30 1x2g h GLU 20 Ca 0.06 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.24 1x2g h GLU 20 Cb 0.14 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 1x2g h GLU 20 CO -0.01 0.52 -0.37 1.49 -1.00 0.00 0.00 179.01 179.64 1x2g h GLU 21 N 0.81 0.68 -0.53 2.33 4.57 -0.61 0.11 114.58 121.93 1x2g h GLU 21 Ca 0.33 -0.41 0.04 0.00 -1.18 0.00 0.00 59.36 58.15 1x2g h GLU 21 Cb 0.26 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.85 1x2g h GLU 21 CO -0.12 1.03 0.28 0.00 -1.18 0.00 0.00 179.01 179.02 1x2g h ILE 23 N 0.54 1.12 -0.36 0.00 2.04 -1.02 0.29 117.51 120.12 1x2g h ILE 23 Ca 0.23 -0.23 -0.15 0.00 1.00 0.00 0.00 64.86 65.72 1x2g h ILE 23 Cb 0.13 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 1x2g h ILE 23 CO -0.15 0.12 -0.36 0.15 0.00 0.00 0.00 178.15 177.91 1x2g h PHE 24 N 0.66 1.06 0.00 1.37 3.57 -0.31 -3.41 116.94 119.88 1x2g h PHE 24 Ca 0.18 -0.32 0.00 0.00 3.53 0.00 0.00 57.97 61.36 1x2g h PHE 24 Cb -0.07 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.44 1x2g h PHE 24 CO -0.04 1.13 0.00 2.89 -2.23 0.00 0.00 178.31 180.06 1x2g n ARG 25 N -4.11 -0.06 -1.33 1.11 1.85 0.29 -5.07 116.66 109.33 1x2g n ARG 25 Ca -0.03 -0.17 -0.29 0.00 -1.00 0.00 0.00 57.85 56.36 1x2g n ARG 25 Cb 0.53 -0.58 0.11 0.00 -1.05 0.00 0.00 32.46 31.47 1x2g n ARG 25 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1x2g n GLN 26 N -0.01 2.60 -4.18 2.89 1.13 0.10 -5.00 117.38 114.90 1x2g n GLN 26 Ca 0.00 -3.30 -0.32 0.00 -1.94 0.00 0.00 57.00 51.44 1x2g n GLN 26 Cb 0.25 -2.22 -0.08 0.00 0.11 0.00 0.00 30.24 28.30 1x2g n GLN 26 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1x2g s PRO 28 N -3.63 2.79 -0.17 -1.09 0.04 -1.26 -4.76 135.00 126.92 1x2g s PRO 28 Ca 0.60 -0.66 -0.01 0.00 0.04 0.00 0.00 61.00 60.98 1x2g s PRO 28 Cb 0.48 -2.68 0.10 0.00 0.04 0.00 0.00 34.50 32.44 1x2g s PRO 28 CO 0.03 0.60 2.11 0.00 0.04 0.00 0.00 177.00 179.78 1x2g n ALA 29 N 1.02 4.75 0.74 8.56 0.00 -1.26 -4.33 120.51 129.98 1x2g n ALA 29 Ca -0.12 -1.02 0.08 0.00 0.00 0.00 0.00 53.44 52.38 1x2g n ALA 29 Cb 0.52 -1.29 -0.10 0.00 0.00 0.00 0.00 19.45 18.59 1x2g n ALA 29 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1x2g n THR 30 N 0.95 0.00 -4.56 0.00 -2.24 -1.26 -2.86 114.28 104.31 1x2g n THR 30 Ca 0.19 -0.12 -0.27 0.00 -2.27 0.00 0.00 64.05 61.57 1x2g n THR 30 Cb 0.56 0.94 -0.11 0.00 -2.10 0.00 0.00 70.33 69.63 1x2g n THR 30 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1x2g s GLN 31 N -2.61 1.88 -0.19 -0.78 -0.21 -1.26 -4.96 119.66 111.53 1x2g s GLN 31 Ca 0.06 -1.99 -0.14 0.00 0.02 0.00 0.00 55.36 53.31 1x2g s GLN 31 Cb 0.12 -1.69 -0.05 0.00 1.00 0.00 0.00 33.01 32.40 1x2g s GLN 31 CO 0.69 0.07 0.29 1.03 -2.12 0.00 0.00 175.29 175.24 1x2g s ARG 32 N -3.65 4.21 -0.11 2.91 3.00 -0.41 -4.39 118.95 120.50 1x2g s ARG 32 Ca 0.34 0.05 0.02 0.00 0.00 0.00 0.00 55.73 56.13 1x2g s ARG 32 Cb 0.05 -3.47 -0.01 0.00 0.00 0.00 0.00 34.95 31.52 1x2g s ARG 32 CO 0.17 0.15 -0.18 0.08 0.00 0.00 0.00 175.30 175.52 1x2g s VAL 33 N 0.75 2.60 -0.11 3.52 1.01 -1.26 -0.28 120.40 126.63 1x2g s VAL 33 Ca 0.15 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.32 1x2g s VAL 33 Cb -0.13 -2.05 0.01 0.00 0.00 0.00 0.00 36.38 34.21 1x2g s VAL 33 CO 0.04 0.54 -0.17 -0.22 0.00 0.00 0.00 175.10 175.30 1x2g s LEU 34 N 0.28 1.82 -0.12 3.92 2.96 -0.73 -4.14 118.68 122.68 1x2g s LEU 34 Ca -0.13 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.33 1x2g s LEU 34 Cb -0.16 -1.17 0.01 0.00 0.50 0.00 0.00 46.19 45.37 1x2g s LEU 34 CO 0.07 0.04 -0.16 0.12 -1.32 0.00 0.00 176.35 175.10 1x2g s PHE 35 N 0.89 2.05 -0.12 5.38 5.36 0.07 -0.70 117.98 130.91 1x2g s PHE 35 Ca -0.08 -0.99 0.03 0.00 -0.96 0.00 0.00 56.93 54.93 1x2g s PHE 35 Cb -0.15 -1.47 0.00 0.00 -0.34 0.00 0.00 43.02 41.06 1x2g s PHE 35 CO -0.01 -0.51 -0.23 -0.51 -1.46 0.00 0.00 175.22 172.51 1x2g s LEU 36 N 1.02 2.13 0.23 6.12 1.43 -0.64 -0.26 118.68 128.72 1x2g s LEU 36 Ca -0.05 -0.57 -0.22 0.00 -1.03 0.00 0.00 54.13 52.26 1x2g s LEU 36 Cb -0.15 -1.44 0.04 0.00 0.03 0.00 0.00 46.19 44.68 1x2g s LEU 36 CO -0.03 0.12 0.68 -1.66 0.23 0.00 0.00 176.35 175.70 1x2g s TRP 37 N 0.55 -0.32 0.08 0.29 1.48 -0.48 -1.15 118.94 119.40 1x2g s TRP 37 Ca -0.13 -0.05 -0.12 0.00 -1.06 0.00 0.00 56.10 54.74 1x2g s TRP 37 Cb -0.17 0.65 0.01 0.00 -1.16 0.00 0.00 33.47 32.81 1x2g s TRP 37 CO 0.04 -1.08 0.27 -0.98 -4.06 0.00 0.00 176.95 171.14 1x2g s ARG 38 N -3.84 0.89 -0.04 3.25 1.70 -1.26 -0.54 118.95 119.11 1x2g s ARG 38 Ca 0.07 -0.77 0.01 0.00 -0.47 0.00 0.00 55.73 54.58 1x2g s ARG 38 Cb -0.04 0.37 -0.03 0.00 -0.57 0.00 0.00 34.95 34.68 1x2g s ARG 38 CO -0.00 -0.30 -0.05 -0.80 -1.08 0.00 0.00 175.30 173.07 1x2g s ASN 39 N -2.61 4.80 1.27 -2.89 0.01 -1.26 -4.11 114.94 110.15 1x2g s ASN 39 Ca 0.01 -0.03 -0.20 0.00 -0.71 0.00 0.00 52.86 51.93 1x2g s ASN 39 Cb 0.02 -1.21 0.30 0.00 0.41 0.00 0.00 41.25 40.77 1x2g s ASN 39 CO -0.09 0.33 0.98 0.00 -1.51 0.00 0.00 177.10 176.81 1x2g n ALA 40 N 1.87 -3.48 -1.64 0.60 0.00 -0.78 -2.97 120.51 114.12 1x2g n ALA 40 Ca -0.17 -1.50 -0.53 0.00 0.00 0.00 0.00 53.44 51.24 1x2g n ALA 40 Cb 0.53 -0.11 -0.07 0.00 0.00 0.00 0.00 19.45 19.80 1x2g n ALA 40 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1x2g n ASP 41 N -4.89 2.62 -3.73 0.00 8.00 -1.25 -4.42 116.55 112.88 1x2g n ASP 41 Ca 0.14 0.88 -0.13 0.00 0.71 0.00 0.00 54.79 56.39 1x2g n ASP 41 Cb 0.55 -1.23 -0.10 0.00 -0.02 0.00 0.00 41.12 40.32 1x2g n ASP 41 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1x2g s THR 42 N 4.66 -0.00 -0.26 -3.53 2.01 -0.56 -1.08 115.64 116.88 1x2g s THR 42 Ca 1.00 0.01 -0.12 0.00 0.31 0.00 0.00 61.69 62.89 1x2g s THR 42 Cb -0.92 -0.57 -0.05 0.00 0.01 0.00 0.00 72.50 70.98 1x2g s THR 42 CO 0.58 0.01 0.22 -0.69 -0.69 0.00 0.00 174.62 174.04 1x2g s VAL 43 N 0.36 5.30 -0.26 3.82 1.01 -0.16 -0.23 120.40 130.25 1x2g s VAL 43 Ca -0.01 0.25 -0.10 0.00 0.00 0.00 0.00 61.98 62.12 1x2g s VAL 43 Cb -0.04 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 1x2g s VAL 43 CO -0.01 0.26 0.14 -0.69 0.00 0.00 0.00 175.10 174.80 1x2g s VAL 44 N 1.60 5.03 0.21 2.92 1.01 0.15 -1.84 120.40 129.48 1x2g s VAL 44 Ca 0.09 0.07 0.07 0.00 0.00 0.00 0.00 61.98 62.21 1x2g s VAL 44 Cb -0.15 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 1x2g s VAL 44 CO 0.09 0.31 0.12 0.27 0.00 0.00 0.00 175.10 175.89 1x2g s ILE 45 N 1.45 4.23 0.78 2.22 -4.36 -0.37 -1.17 121.20 123.98 1x2g s ILE 45 Ca 0.07 -1.36 -0.11 0.00 -0.26 0.00 0.00 60.65 58.99 1x2g s ILE 45 Cb -0.15 -3.21 0.06 0.00 1.25 0.00 0.00 42.46 40.41 1x2g s ILE 45 CO 0.07 -0.23 1.09 -0.83 0.24 0.00 0.00 174.94 175.28 1x2g s GLY 46 N -3.42 1.67 0.66 6.27 0.00 -1.22 -1.49 107.32 109.79 1x2g s GLY 46 Ca 0.31 0.24 0.43 0.00 0.00 0.00 0.00 44.72 45.69 1x2g s GLY 46 CO 0.23 0.59 2.35 0.07 0.00 0.00 0.00 173.10 176.34 1x2g h ARG 47 N -1.14 0.00 -0.37 2.90 0.11 -1.05 -2.47 114.38 112.36 1x2g h ARG 47 Ca -0.44 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.64 1x2g h ARG 47 Cb 1.23 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.31 1x2g h ARG 47 CO 0.52 0.00 0.00 0.00 0.10 0.00 0.00 179.97 180.59 1x2g n ALA 48 N -2.10 2.26 -2.25 0.08 0.00 -1.26 -5.00 120.51 112.24 1x2g n ALA 48 Ca -0.03 -1.24 -0.29 0.00 0.00 0.00 0.00 53.44 51.88 1x2g n ALA 48 Cb 0.08 -0.50 -0.02 0.00 0.00 0.00 0.00 19.45 19.01 1x2g n ALA 48 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1x2g s GLN 49 N -1.14 3.69 -0.47 0.00 -0.21 -0.93 -0.27 119.66 120.34 1x2g s GLN 49 Ca 0.27 0.33 -0.11 0.00 0.02 0.00 0.00 55.36 55.87 1x2g s GLN 49 Cb 0.15 -2.42 0.10 0.00 1.00 0.00 0.00 33.01 31.84 1x2g s GLN 49 CO 0.17 -0.05 0.36 1.21 -2.12 0.00 0.00 175.29 174.85 1x2g s ASN 50 N -3.42 5.84 0.48 5.90 2.47 -1.26 -4.94 114.94 120.00 1x2g s ASN 50 Ca 0.49 -1.70 0.19 0.00 0.42 0.00 0.00 52.86 52.27 1x2g s ASN 50 Cb -0.10 -2.07 1.19 0.00 -1.45 0.00 0.00 41.25 38.82 1x2g s ASN 50 CO 0.35 -0.68 2.03 1.55 -3.72 0.00 0.00 177.10 176.63 1x2g h PRO 51 N 8.56 0.00 -0.01 0.43 0.13 -1.91 -0.25 132.00 138.95 1x2g h PRO 51 Ca -0.24 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.80 1x2g h PRO 51 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1x2g h PRO 51 CO 0.87 0.15 -0.42 -1.49 -0.23 0.00 0.00 178.00 176.88 1x2g h TRP 52 N 0.00 0.02 0.11 1.56 4.06 -1.93 0.16 115.95 119.93 1x2g h TRP 52 Ca -0.00 -0.01 -0.34 0.00 2.06 0.00 0.00 58.89 60.60 1x2g h TRP 52 Cb 0.31 -0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.45 1x2g h TRP 52 CO 0.00 0.44 -1.84 -0.22 -3.56 0.00 0.00 178.44 173.26 1x2g h LYS 53 N 0.02 0.23 -0.19 0.49 3.11 -1.86 -3.41 116.57 114.96 1x2g h LYS 53 Ca -0.00 -0.40 -0.19 0.00 -2.81 0.00 0.00 60.65 57.25 1x2g h LYS 53 Cb 0.76 0.15 -0.00 0.00 -1.00 0.00 0.00 32.23 32.14 1x2g h LYS 53 CO 0.06 1.19 -0.63 0.93 -2.81 0.00 0.00 179.45 178.19 1x2g h GLU 54 N -0.11 0.69 -6.12 1.90 4.39 -0.96 -3.42 114.58 110.94 1x2g h GLU 54 Ca -0.40 -0.48 -0.65 0.00 0.34 0.00 0.00 59.36 58.17 1x2g h GLU 54 Cb 1.91 0.07 -0.10 0.00 -0.10 0.00 0.00 28.75 30.53 1x2g h GLU 54 CO 0.05 1.10 -0.60 0.00 -1.16 0.00 0.00 179.01 178.39 1x2g s ASN 56 N -1.97 6.41 0.22 0.00 3.84 0.41 -4.61 114.94 119.24 1x2g s ASN 56 Ca 0.25 -1.48 0.02 0.00 0.21 0.00 0.00 52.86 51.85 1x2g s ASN 56 Cb -0.12 -2.57 0.19 0.00 -0.55 0.00 0.00 41.25 38.20 1x2g s ASN 56 CO 0.16 -1.59 1.53 0.71 -2.79 0.00 0.00 177.10 175.12 1x2g h THR 57 N 6.72 1.37 -0.36 -5.21 1.35 -1.88 -3.01 112.91 111.89 1x2g h THR 57 Ca 0.21 -1.94 -0.04 0.00 -0.55 0.00 0.00 66.41 64.09 1x2g h THR 57 Cb 1.00 1.95 -0.01 0.00 -1.73 0.00 0.00 68.15 69.35 1x2g h THR 57 CO 1.41 0.58 0.05 -0.09 -0.25 0.00 0.00 175.52 177.23 1x2g h ARG 58 N 0.25 0.59 -1.66 4.72 9.65 -1.97 0.99 114.38 126.96 1x2g h ARG 58 Ca -0.01 -0.16 0.00 0.00 -1.10 0.00 0.00 59.98 58.71 1x2g h ARG 58 Cb 1.12 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.64 1x2g h ARG 58 CO 0.10 0.67 0.00 -2.13 2.80 0.00 0.00 179.97 181.41 1x2g n ARG 59 N -4.56 0.17 0.00 0.20 0.63 -1.14 -1.36 116.66 110.59 1x2g n ARG 59 Ca -0.01 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 1x2g n ARG 59 Cb 0.23 -1.38 0.00 0.00 0.45 0.00 0.00 32.46 31.76 1x2g n ARG 59 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1x2g n GLU 61 N 0.86 0.00 -0.27 -0.14 1.02 0.34 -1.31 120.64 121.15 1x2g n GLU 61 Ca 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 57.16 57.09 1x2g n GLU 61 Cb 0.08 0.00 0.08 0.00 -0.02 0.00 0.00 31.44 31.58 1x2g n GLU 61 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1x2g h GLU 62 N 0.00 1.15 -0.00 3.49 5.08 -1.48 -2.66 114.58 120.16 1x2g h GLU 62 Ca 0.00 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1x2g h GLU 62 Cb 0.00 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.06 1x2g h GLU 62 CO 0.00 0.94 -0.34 -0.25 -1.00 0.00 0.00 179.01 178.36 1x2g n ASP 63 N -4.27 0.34 -3.21 1.42 8.00 -0.42 -4.95 116.55 113.46 1x2g n ASP 63 Ca 0.07 -0.01 -0.21 0.00 0.71 0.00 0.00 54.79 55.35 1x2g n ASP 63 Cb 0.19 0.01 0.07 0.00 -0.02 0.00 0.00 41.12 41.37 1x2g n ASP 63 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1x2g n ASN 64 N -1.50 -5.74 -4.66 -2.24 5.03 -1.01 -4.98 115.26 100.16 1x2g n ASN 64 Ca 0.06 -0.47 -0.43 0.00 0.87 0.00 0.00 54.58 54.61 1x2g n ASN 64 Cb 0.34 -4.47 -0.02 0.00 -1.02 0.00 0.00 39.78 34.61 1x2g n ASN 64 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1x2g s VAL 65 N -3.28 4.70 0.61 2.41 1.01 -1.26 -4.88 120.40 119.70 1x2g s VAL 65 Ca 0.50 2.03 -0.15 0.00 0.00 0.00 0.00 61.98 64.36 1x2g s VAL 65 Cb -0.22 -4.31 -0.03 0.00 0.00 0.00 0.00 36.38 31.82 1x2g s VAL 65 CO 0.64 -0.15 1.05 -0.13 0.00 0.00 0.00 175.10 176.51 1x2g s ARG 66 N 3.02 3.29 -0.09 2.72 0.52 -0.24 -4.64 118.95 123.54 1x2g s ARG 66 Ca 0.45 1.14 0.02 0.00 -0.52 0.00 0.00 55.73 56.82 1x2g s ARG 66 Cb -0.15 -2.03 -0.02 0.00 0.52 0.00 0.00 34.95 33.26 1x2g s ARG 66 CO 0.08 -0.83 -0.13 -1.17 0.02 0.00 0.00 175.30 173.27 1x2g s LEU 67 N -4.66 2.76 -0.03 2.53 2.96 -1.26 -0.99 118.68 120.00 1x2g s LEU 67 Ca 0.62 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 54.30 1x2g s LEU 67 Cb -0.15 -1.59 0.02 0.00 0.50 0.00 0.00 46.19 44.97 1x2g s LEU 67 CO 0.40 0.27 -0.02 0.00 -1.32 0.00 0.00 176.35 175.67 1x2g s ALA 68 N -0.27 0.41 -0.13 5.97 0.00 -0.77 -4.90 121.76 122.07 1x2g s ALA 68 Ca 0.02 0.02 -0.13 0.00 0.00 0.00 0.00 51.96 51.87 1x2g s ALA 68 Cb -0.13 -0.28 -0.05 0.00 0.00 0.00 0.00 23.12 22.67 1x2g s ALA 68 CO 0.03 -0.01 0.28 0.50 0.00 0.00 0.00 175.76 176.56 1x2g s ARG 69 N 0.68 4.07 0.44 0.00 3.52 -1.26 -1.23 118.95 125.16 1x2g s ARG 69 Ca -0.07 0.10 0.08 0.00 -0.13 0.00 0.00 55.73 55.71 1x2g s ARG 69 Cb -0.11 -3.35 0.01 0.00 -1.56 0.00 0.00 34.95 29.94 1x2g s ARG 69 CO -0.01 0.40 0.55 -0.98 -0.81 0.00 0.00 175.30 174.46 1x2g s ARG 70 N -0.04 2.69 0.08 5.12 1.70 -0.55 -4.93 118.95 123.02 1x2g s ARG 70 Ca 0.17 -1.37 0.11 0.00 -0.47 0.00 0.00 55.73 54.17 1x2g s ARG 70 Cb -0.13 -2.65 -0.17 0.00 -0.57 0.00 0.00 34.95 31.43 1x2g s ARG 70 CO 0.05 -0.33 1.04 0.77 -1.08 0.00 0.00 175.30 175.75 1x2g h SER 71 N 0.67 0.00 -4.54 -2.89 0.02 -1.95 -2.85 113.55 102.01 1x2g h SER 71 Ca -0.39 0.00 -0.48 0.00 -0.84 0.00 0.00 61.79 60.08 1x2g h SER 71 Cb 1.28 0.00 0.09 0.00 0.14 0.00 0.00 62.40 63.91 1x2g h SER 71 CO 0.48 0.87 0.41 -0.94 -1.14 0.00 0.00 176.83 176.51 1x2g s SER 72 N -6.35 4.94 0.00 3.07 1.04 -1.26 -4.60 113.70 110.54 1x2g s SER 72 Ca -0.01 0.94 0.00 0.00 0.48 0.00 0.00 55.95 57.36 1x2g s SER 72 Cb 0.09 -1.57 0.00 0.00 0.10 0.00 0.00 66.02 64.64 1x2g s SER 72 CO 0.81 -1.64 0.00 0.61 0.98 0.00 0.00 173.24 174.00 1x2g n GLY 73 N -3.17 0.59 0.25 7.32 0.00 -1.24 -1.60 105.19 107.34 1x2g n GLY 73 Ca 0.07 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.49 1x2g n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x2g n GLY 74 N 5.00 -2.42 0.76 -0.02 0.00 -0.33 -4.53 105.19 103.64 1x2g n GLY 74 Ca 0.00 -2.05 -0.05 0.00 0.00 0.00 0.00 46.02 43.93 1x2g n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x2g n GLY 75 N -0.01 2.71 3.80 -0.02 0.00 -1.25 -3.41 105.19 107.01 1x2g n GLY 75 Ca 0.00 -2.18 -0.36 0.00 0.00 0.00 0.00 46.02 43.48 1x2g n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x2g s ALA 76 N -2.15 3.23 -0.07 4.61 0.00 -1.26 -3.95 121.76 122.16 1x2g s ALA 76 Ca 0.08 0.38 -0.04 0.00 0.00 0.00 0.00 51.96 52.38 1x2g s ALA 76 Cb -0.01 -3.06 0.03 0.00 0.00 0.00 0.00 23.12 20.09 1x2g s ALA 76 CO 0.05 0.21 0.17 0.08 0.00 0.00 0.00 175.76 176.27 1x2g s VAL 77 N -1.75 -0.04 -0.13 0.00 1.01 -0.31 -4.96 120.40 114.21 1x2g s VAL 77 Ca 0.52 0.13 -0.07 0.00 0.00 0.00 0.00 61.98 62.56 1x2g s VAL 77 Cb -0.15 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1x2g s VAL 77 CO 0.20 0.05 0.12 0.12 0.00 0.00 0.00 175.10 175.59 1x2g s PHE 78 N 0.93 3.49 -0.02 5.22 5.36 -1.26 0.31 117.98 132.01 1x2g s PHE 78 Ca -0.07 0.43 0.06 0.00 -0.96 0.00 0.00 56.93 56.39 1x2g s PHE 78 Cb -0.09 -1.96 -0.01 0.00 -0.34 0.00 0.00 43.02 40.62 1x2g s PHE 78 CO -0.05 0.60 -0.20 -1.01 -1.46 0.00 0.00 175.22 173.10 1x2g s HIS 79 N -0.71 1.79 0.27 10.12 3.76 0.68 -4.98 115.29 126.23 1x2g s HIS 79 Ca 0.13 -0.38 0.06 0.00 -0.15 0.00 0.00 55.06 54.72 1x2g s HIS 79 Cb -0.12 -1.16 -0.02 0.00 1.11 0.00 0.00 32.58 32.39 1x2g s HIS 79 CO 0.03 -0.06 0.24 -0.40 -0.85 0.00 0.00 174.74 173.69 1x2g n ASP 80 N 2.70 -0.61 0.06 1.40 5.68 -1.25 -1.50 116.55 123.04 1x2g n ASP 80 Ca -0.16 -2.81 0.07 0.00 -0.50 0.00 0.00 54.79 51.40 1x2g n ASP 80 Cb 0.53 1.41 0.33 0.00 -1.14 0.00 0.00 41.12 42.25 1x2g n ASP 80 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1x2g n LEU 81 N 0.00 0.26 -0.18 -2.12 4.77 -1.16 -1.96 117.00 116.61 1x2g n LEU 81 Ca 0.06 0.58 0.14 0.00 -0.03 0.00 0.00 56.01 56.77 1x2g n LEU 81 Cb 0.50 -0.57 0.74 0.00 -2.33 0.00 0.00 43.42 41.77 1x2g n LEU 81 CO 0.26 -0.49 0.99 0.61 -1.33 0.00 0.00 177.39 177.43 1x2g n GLY 82 N -0.50 -0.61 3.66 -0.72 0.00 -1.26 -4.70 105.19 101.05 1x2g n GLY 82 Ca 0.02 -0.28 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 1x2g n GLY 82 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x2g s ASN 83 N -1.93 5.88 -0.25 1.61 -0.87 -0.83 -0.28 114.94 118.27 1x2g s ASN 83 Ca 0.42 0.12 -0.06 0.00 -1.57 0.00 0.00 52.86 51.77 1x2g s ASN 83 Cb 0.20 -2.03 -0.01 0.00 -0.02 0.00 0.00 41.25 39.40 1x2g s ASN 83 CO 0.34 0.15 0.03 -0.89 -2.57 0.00 0.00 177.10 174.15 1x2g s THR 84 N 0.55 3.79 0.14 1.60 2.01 -0.65 -4.66 115.64 118.43 1x2g s THR 84 Ca 0.06 -0.50 0.07 0.00 0.31 0.00 0.00 61.69 61.62 1x2g s THR 84 Cb -0.12 -2.82 -0.04 0.00 0.01 0.00 0.00 72.50 69.52 1x2g s THR 84 CO 0.00 0.28 -0.01 0.00 -0.69 0.00 0.00 174.62 174.20 1x2g s PHE 86 N -1.55 0.34 -0.03 0.00 -0.12 -0.57 -1.39 117.98 114.65 1x2g s PHE 86 Ca 0.26 -0.51 0.01 0.00 -0.05 0.00 0.00 56.93 56.64 1x2g s PHE 86 Cb -0.10 -0.23 0.03 0.00 -0.63 0.00 0.00 43.02 42.08 1x2g s PHE 86 CO 0.18 -0.16 -0.01 0.99 -0.05 0.00 0.00 175.22 176.17 1x2g s THR 87 N -1.39 0.25 0.48 -4.49 2.01 0.65 -1.03 115.64 112.13 1x2g s THR 87 Ca -0.14 0.04 0.03 0.00 0.31 0.00 0.00 61.69 61.92 1x2g s THR 87 Cb -0.10 -0.33 -0.03 0.00 0.01 0.00 0.00 72.50 72.05 1x2g s THR 87 CO -0.01 0.16 0.01 -0.36 -0.69 0.00 0.00 174.62 173.73 1x2g s PHE 88 N 0.99 2.01 0.00 4.92 0.08 0.24 -0.75 117.98 125.47 1x2g s PHE 88 Ca -0.10 -0.90 0.00 0.00 0.12 0.00 0.00 56.93 56.05 1x2g s PHE 88 Cb -0.14 -1.64 0.00 0.00 -0.57 0.00 0.00 43.02 40.68 1x2g s PHE 88 CO -0.01 0.27 0.00 0.00 -0.10 0.00 0.00 175.22 175.37 1x2g n ALA 90 N -1.18 0.00 -1.74 5.36 0.00 -1.16 -0.41 120.51 121.37 1x2g n ALA 90 Ca -0.16 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.92 1x2g n ALA 90 Cb 0.67 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.17 1x2g n ALA 90 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1x2g s GLY 91 N 0.00 2.81 0.49 0.00 0.00 -1.14 -1.57 107.32 107.91 1x2g s GLY 91 Ca 0.00 1.13 -0.12 0.00 0.00 0.00 0.00 44.72 45.73 1x2g s GLY 91 CO 0.00 1.54 0.89 0.54 0.00 0.00 0.00 173.10 176.07 1x2g s LYS 92 N -3.35 3.77 0.00 2.90 1.02 0.21 -2.46 119.74 121.83 1x2g s LYS 92 Ca 0.80 0.65 0.27 0.00 0.02 0.00 0.00 55.97 57.71 1x2g s LYS 92 Cb -0.34 -2.24 0.94 0.00 -0.52 0.00 0.00 37.83 35.66 1x2g s LYS 92 CO 0.37 -0.24 1.69 -0.35 -0.92 0.00 0.00 175.35 175.90 1x2g n PRO 93 N -1.79 0.50 0.00 -1.68 -0.04 -1.26 -4.89 135.00 125.83 1x2g n PRO 93 Ca 0.04 -0.23 0.03 0.00 -0.04 0.00 0.00 63.50 63.30 1x2g n PRO 93 Cb 0.54 -1.50 0.39 0.00 -0.04 0.00 0.00 33.50 32.90 1x2g n PRO 93 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1x2g h GLU 94 N 0.56 0.53 -6.13 0.54 4.81 -1.95 -3.43 114.58 109.50 1x2g h GLU 94 Ca 0.00 -0.05 -0.68 0.00 -0.13 0.00 0.00 59.36 58.49 1x2g h GLU 94 Cb 0.45 -0.11 -0.25 0.00 0.63 0.00 0.00 28.75 29.47 1x2g h GLU 94 CO 0.00 0.41 -0.78 -0.47 -0.73 0.00 0.00 179.01 177.43 1x2g s TYR 95 N -5.35 2.68 0.28 0.92 6.14 -1.03 -5.07 117.35 115.93 1x2g s TYR 95 Ca -0.08 -0.30 0.03 0.00 0.64 0.00 0.00 57.07 57.35 1x2g s TYR 95 Cb 0.17 -1.66 -0.04 0.00 0.42 0.00 0.00 41.96 40.85 1x2g s TYR 95 CO 0.74 0.07 0.16 0.16 0.64 0.00 0.00 175.55 177.32 1x2g s ASP 96 N -0.48 1.28 0.63 4.32 1.47 -1.26 -4.60 116.67 118.03 1x2g s ASP 96 Ca 0.06 -1.53 0.34 0.00 1.18 0.00 0.00 52.55 52.60 1x2g s ASP 96 Cb -0.12 0.38 1.93 0.00 -0.34 0.00 0.00 42.92 44.77 1x2g s ASP 96 CO 0.02 -0.88 2.17 0.50 0.68 0.00 0.00 175.17 177.65 1x2g h LYS 97 N 2.29 0.00 0.00 2.11 3.64 -1.99 -2.36 116.57 120.25 1x2g h LYS 97 Ca -0.33 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 58.98 1x2g h LYS 97 Cb 1.25 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.06 1x2g h LYS 97 CO 0.51 0.00 -0.30 1.79 -2.27 0.00 0.00 179.45 179.18 1x2g h THR 98 N 0.00 0.64 0.22 1.00 1.35 -2.00 -2.85 112.91 111.28 1x2g h THR 98 Ca 0.03 -1.45 -0.01 0.00 -0.55 0.00 0.00 66.41 64.43 1x2g h THR 98 Cb 0.32 1.97 0.00 0.00 -1.73 0.00 0.00 68.15 68.71 1x2g h THR 98 CO -0.00 0.30 -0.10 0.40 -0.25 0.00 0.00 175.52 175.86 1x2g h ILE 99 N 0.00 0.86 -0.17 6.82 5.03 -1.84 -2.68 117.51 125.52 1x2g h ILE 99 Ca -0.00 -0.69 -0.01 0.00 -0.12 0.00 0.00 64.86 64.04 1x2g h ILE 99 Cb 0.95 1.25 -0.01 0.00 -3.03 0.00 0.00 36.82 35.98 1x2g h ILE 99 CO 0.04 0.15 0.06 0.77 -0.68 0.00 0.00 178.15 178.49 1x2g h SER 100 N -0.65 0.24 -0.72 1.72 4.64 -1.73 -2.53 113.55 114.52 1x2g h SER 100 Ca -0.03 -0.17 0.16 0.00 -0.47 0.00 0.00 61.79 61.28 1x2g h SER 100 Cb 0.46 -0.06 -0.12 0.00 -0.31 0.00 0.00 62.40 62.37 1x2g h SER 100 CO 0.05 0.35 0.00 0.74 -0.87 0.00 0.00 176.83 177.10 1x2g h THR 101 N 0.12 0.39 -0.46 2.95 2.02 -1.60 -1.44 112.91 114.89 1x2g h THR 101 Ca 0.06 -0.04 -0.04 0.00 0.77 0.00 0.00 66.41 67.16 1x2g h THR 101 Cb 0.19 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 1x2g h THR 101 CO -0.00 0.02 0.14 -1.28 0.37 0.00 0.00 175.52 174.76 1x2g h SER 102 N 0.11 0.68 -0.95 4.18 0.87 -1.39 0.48 113.55 117.53 1x2g h SER 102 Ca 0.39 -0.21 0.04 0.00 -1.23 0.00 0.00 61.79 60.77 1x2g h SER 102 Cb 0.66 -0.18 -0.06 0.00 -0.44 0.00 0.00 62.40 62.39 1x2g h SER 102 CO -0.62 0.72 0.61 0.40 -0.53 0.00 0.00 176.83 177.41 1x2g h ILE 103 N 0.62 1.15 0.03 2.23 2.04 -0.97 0.89 117.51 123.49 1x2g h ILE 103 Ca 0.15 -0.40 -0.16 0.00 1.00 0.00 0.00 64.86 65.45 1x2g h ILE 103 Cb 0.28 -0.14 0.01 0.00 -0.74 0.00 0.00 36.82 36.24 1x2g h ILE 103 CO -0.00 0.22 -0.63 0.58 0.00 0.00 0.00 178.15 178.31 1x2g h VAL 104 N 1.18 1.45 -0.41 1.67 2.07 -1.00 -1.75 116.25 119.46 1x2g h VAL 104 Ca 0.38 -2.18 0.09 0.00 0.82 0.00 0.00 66.70 65.80 1x2g h VAL 104 Cb 0.02 2.75 -0.09 0.00 -1.52 0.00 0.00 31.29 32.45 1x2g h VAL 104 CO -0.13 0.63 -0.24 -0.07 0.02 0.00 0.00 177.57 177.78 1x2g h LEU 105 N -0.19 -0.81 -1.57 2.57 3.38 0.13 -0.41 115.31 118.41 1x2g h LEU 105 Ca -0.09 0.17 0.05 0.00 0.09 0.00 0.00 57.88 58.10 1x2g h LEU 105 Cb 1.38 0.41 -0.03 0.00 0.09 0.00 0.00 40.66 42.51 1x2g h LEU 105 CO 0.12 -0.26 0.36 0.78 0.09 0.00 0.00 178.44 179.53 1x2g h ASN 106 N -0.16 0.47 -0.06 -0.43 2.35 0.81 -2.25 115.58 116.30 1x2g h ASN 106 Ca 0.20 -0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.73 1x2g h ASN 106 Cb 0.47 -0.10 0.01 0.00 0.05 0.00 0.00 38.32 38.75 1x2g h ASN 106 CO -0.51 0.31 -0.77 0.00 -1.65 0.00 0.00 177.43 174.81 1x2g h ALA 107 N 1.70 0.37 0.84 -0.83 0.00 -0.49 -1.13 119.26 119.73 1x2g h ALA 107 Ca 0.23 -0.60 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 1x2g h ALA 107 Cb 0.22 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.00 1x2g h ALA 107 CO -0.06 0.70 -0.40 -0.07 0.00 0.00 0.00 179.25 179.41 1x2g h LEU 108 N 0.49 -0.96 -0.70 0.00 3.38 -0.55 -2.50 115.31 114.47 1x2g h LEU 108 Ca -0.05 0.03 0.14 0.00 0.09 0.00 0.00 57.88 58.09 1x2g h LEU 108 Cb 1.39 0.25 -0.13 0.00 0.09 0.00 0.00 40.66 42.25 1x2g h LEU 108 CO 0.15 -0.67 -0.22 0.78 0.09 0.00 0.00 178.44 178.57 1x2g h ASN 109 N -1.16 -0.81 -0.16 -0.43 4.21 -1.01 0.57 115.58 116.79 1x2g h ASN 109 Ca -0.12 0.22 0.05 0.00 1.21 0.00 0.00 56.30 57.66 1x2g h ASN 109 Cb 0.87 0.49 -0.01 0.00 -1.12 0.00 0.00 38.32 38.56 1x2g h ASN 109 CO 0.19 -0.26 0.37 0.00 -1.29 0.00 0.00 177.43 176.45 1x2g h ALA 110 N 1.55 1.64 0.00 -0.83 0.00 -0.96 -1.39 119.26 119.27 1x2g h ALA 110 Ca 0.32 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.97 1x2g h ALA 110 Cb 0.54 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1x2g h ALA 110 CO -0.74 -0.46 -1.92 1.28 0.00 0.00 0.00 179.25 177.42 1x2g n LEU 111 N -3.22 0.44 0.00 0.00 4.77 0.19 -4.96 117.00 114.23 1x2g n LEU 111 Ca 0.02 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1x2g n LEU 111 Cb 0.47 0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.81 1x2g n LEU 111 CO 0.19 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1x2g n GLY 112 N 1.55 -0.92 2.79 -0.72 0.00 -0.52 -5.11 105.19 102.27 1x2g n GLY 112 Ca -0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 1x2g n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x2g s VAL 113 N 0.00 0.99 -0.32 1.61 1.01 -0.89 -4.95 120.40 117.84 1x2g s VAL 113 Ca 0.00 -1.15 -0.29 0.00 0.00 0.00 0.00 61.98 60.54 1x2g s VAL 113 Cb 0.00 -1.55 0.00 0.00 0.00 0.00 0.00 36.38 34.83 1x2g s VAL 113 CO 0.00 -0.40 1.32 -0.94 0.00 0.00 0.00 175.10 175.08 1x2g s SER 114 N 1.61 6.61 0.06 3.32 1.04 -1.26 -2.29 113.70 122.78 1x2g s SER 114 Ca 0.03 1.12 -0.00 0.00 0.48 0.00 0.00 55.95 57.58 1x2g s SER 114 Cb -0.18 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.36 1x2g s SER 114 CO -0.15 -1.14 -0.04 0.00 0.98 0.00 0.00 173.24 172.89 1x2g s ALA 115 N 4.56 0.57 0.04 5.32 0.00 -1.26 -4.61 121.76 126.38 1x2g s ALA 115 Ca 0.57 -1.20 -0.08 0.00 0.00 0.00 0.00 51.96 51.25 1x2g s ALA 115 Cb -0.16 0.24 -0.00 0.00 0.00 0.00 0.00 23.12 23.20 1x2g s ALA 115 CO 0.25 -0.33 0.16 -1.21 0.00 0.00 0.00 175.76 174.63 1x2g s GLU 116 N -3.75 0.68 1.22 0.00 2.02 0.48 -4.93 118.70 114.42 1x2g s GLU 116 Ca 0.06 -0.70 -0.16 0.00 0.02 0.00 0.00 54.97 54.19 1x2g s GLU 116 Cb 0.06 0.28 0.30 0.00 0.10 0.00 0.00 34.13 34.87 1x2g s GLU 116 CO -0.09 -0.19 1.01 0.00 0.02 0.00 0.00 175.26 176.02 1x2g s ALA 117 N -2.72 -0.37 -0.30 5.21 0.00 -1.26 0.27 121.76 122.58 1x2g s ALA 117 Ca -0.04 -0.41 -0.19 0.00 0.00 0.00 0.00 51.96 51.32 1x2g s ALA 117 Cb -0.00 -3.12 0.20 0.00 0.00 0.00 0.00 23.12 20.20 1x2g s ALA 117 CO -0.05 -3.94 1.31 -1.54 0.00 0.00 0.00 175.76 171.54 1x2g s SER 118 N -2.88 -0.02 0.55 0.00 1.04 -1.10 -4.59 113.70 106.69 1x2g s SER 118 Ca 0.68 0.03 0.00 0.00 0.48 0.00 0.00 55.95 57.14 1x2g s SER 118 Cb -0.20 1.02 0.00 0.00 0.10 0.00 0.00 66.02 66.94 1x2g s SER 118 CO 0.62 -0.00 0.00 0.61 0.98 0.00 0.00 173.24 175.44 1x2g n GLY 119 N 4.04 -0.06 0.19 7.32 0.00 -1.26 -3.10 105.19 112.32 1x2g n GLY 119 Ca -0.10 -1.01 -0.12 0.00 0.00 0.00 0.00 46.02 44.80 1x2g n GLY 119 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1x2g h ARG 120 N 0.00 0.59 0.00 1.61 3.08 -2.01 -3.42 114.38 114.23 1x2g h ARG 120 Ca 0.00 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.81 1x2g h ARG 120 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.02 1x2g h ARG 120 CO 0.00 0.80 -0.11 0.09 -1.07 0.00 0.00 179.97 179.68 1x2g n ASN 121 N -4.46 0.55 -4.84 7.04 3.02 -1.26 -5.01 115.26 110.31 1x2g n ASN 121 Ca -0.03 -0.41 -0.22 0.00 -0.03 0.00 0.00 54.58 53.90 1x2g n ASN 121 Cb 0.34 0.92 -0.04 0.00 -0.61 0.00 0.00 39.78 40.39 1x2g n ASN 121 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1x2g s ASP 122 N -1.03 5.59 -0.12 6.41 1.11 -1.18 -0.83 116.67 126.62 1x2g s ASP 122 Ca 0.00 -0.23 -0.01 0.00 0.18 0.00 0.00 52.55 52.49 1x2g s ASP 122 Cb 0.00 -1.44 0.03 0.00 1.07 0.00 0.00 42.92 42.59 1x2g s ASP 122 CO 0.00 -0.05 -0.02 -0.76 1.18 0.00 0.00 175.17 175.52 1x2g s LEU 123 N -3.86 1.02 0.23 1.23 1.43 -0.22 -2.69 118.68 115.81 1x2g s LEU 123 Ca 0.33 -0.36 0.11 0.00 -1.03 0.00 0.00 54.13 53.17 1x2g s LEU 123 Cb -0.08 -0.65 -0.04 0.00 0.03 0.00 0.00 46.19 45.44 1x2g s LEU 123 CO 0.25 -0.19 -0.15 0.68 0.23 0.00 0.00 176.35 177.17 1x2g s VAL 124 N 1.83 2.80 -0.35 -1.59 -7.23 0.14 -0.53 120.40 115.47 1x2g s VAL 124 Ca 0.03 -2.01 -0.04 0.00 -1.81 0.00 0.00 61.98 58.15 1x2g s VAL 124 Cb -0.14 -2.42 0.06 0.00 0.56 0.00 0.00 36.38 34.45 1x2g s VAL 124 CO -0.07 -0.24 0.10 -0.69 -0.31 0.00 0.00 175.10 173.90 1x2g s VAL 125 N -2.02 3.42 -0.04 1.32 1.01 0.48 -0.39 120.40 124.18 1x2g s VAL 125 Ca 0.26 -1.45 -0.29 0.00 0.00 0.00 0.00 61.98 60.49 1x2g s VAL 125 Cb -0.07 -3.05 -0.07 0.00 0.00 0.00 0.00 36.38 33.19 1x2g s VAL 125 CO 0.14 -0.29 1.96 -0.54 0.00 0.00 0.00 175.10 176.37 1x2g s LYS 126 N 1.29 3.91 0.00 2.72 -0.14 -1.26 -2.42 119.74 123.84 1x2g s LYS 126 Ca -0.00 2.38 0.00 0.00 -1.36 0.00 0.00 55.97 56.98 1x2g s LYS 126 Cb -0.21 -4.18 0.00 0.00 -1.68 0.00 0.00 37.83 31.77 1x2g s LYS 126 CO -0.00 -1.20 0.00 0.25 -0.76 0.00 0.00 175.35 173.63 1x2g n THR 127 N 6.06 0.00 0.01 2.17 -2.24 0.15 -5.00 114.28 115.42 1x2g n THR 127 Ca 0.22 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 62.00 1x2g n THR 127 Cb 0.42 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.64 1x2g n THR 127 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 1x2g n VAL 128 N 0.00 0.00 0.74 2.28 3.14 -1.26 -4.50 118.33 118.73 1x2g n VAL 128 Ca 0.00 -0.10 0.08 0.00 -2.96 0.00 0.00 64.34 61.36 1x2g n VAL 128 Cb 0.00 0.53 0.41 0.00 -1.06 0.00 0.00 33.84 33.73 1x2g n VAL 128 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1x2g n GLU 129 N -1.49 0.17 0.00 1.45 4.71 -1.26 -5.02 120.64 119.19 1x2g n GLU 129 Ca -0.00 0.15 0.00 0.00 -0.01 0.00 0.00 57.16 57.30 1x2g n GLU 129 Cb 0.05 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 28.98 1x2g n GLU 129 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1x2g n GLY 130 N 0.20 0.26 3.85 0.62 0.00 -1.26 -5.05 105.19 103.81 1x2g n GLY 130 Ca 0.07 -1.69 -0.36 0.00 0.00 0.00 0.00 46.02 44.04 1x2g n GLY 130 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x2g s ASP 131 N -4.00 6.77 -0.30 1.61 1.01 -1.26 0.32 116.67 120.81 1x2g s ASP 131 Ca 0.00 0.96 -0.01 0.00 0.71 0.00 0.00 52.55 54.21 1x2g s ASP 131 Cb 0.00 -2.24 0.10 0.00 1.01 0.00 0.00 42.92 41.78 1x2g s ASP 131 CO 0.00 0.17 0.09 -0.13 0.21 0.00 0.00 175.17 175.51 1x2g s ARG 132 N -1.77 0.70 0.01 8.23 0.52 -1.02 -4.36 118.95 121.27 1x2g s ARG 132 Ca 0.33 -1.01 -0.30 0.00 -0.52 0.00 0.00 55.73 54.23 1x2g s ARG 132 Cb -0.15 -1.96 -0.07 0.00 0.52 0.00 0.00 34.95 33.28 1x2g s ARG 132 CO 0.18 -0.97 1.74 0.21 0.02 0.00 0.00 175.30 176.48 1x2g s LYS 133 N 1.65 4.18 0.00 3.54 2.20 0.49 -0.39 119.74 131.41 1x2g s LYS 133 Ca 0.09 2.35 0.11 0.00 -0.36 0.00 0.00 55.97 58.16 1x2g s LYS 133 Cb -0.17 -3.89 0.02 0.00 -1.51 0.00 0.00 37.83 32.28 1x2g s LYS 133 CO -0.25 -0.84 0.71 1.33 -0.36 0.00 0.00 175.35 175.95 1x2g n VAL 134 N 5.22 0.00 -3.62 4.02 0.24 0.31 -0.39 118.33 124.11 1x2g n VAL 134 Ca 0.17 -0.41 -0.09 0.00 -2.04 0.00 0.00 64.34 61.97 1x2g n VAL 134 Cb 0.41 1.15 -0.06 0.00 -1.47 0.00 0.00 33.84 33.87 1x2g n VAL 134 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1x2g s SER 135 N -1.35 -0.41 0.10 -1.34 0.15 -1.18 -1.27 113.70 108.40 1x2g s SER 135 Ca 0.10 0.71 0.03 0.00 0.70 0.00 0.00 55.95 57.50 1x2g s SER 135 Cb 0.09 0.69 -0.04 0.00 -1.71 0.00 0.00 66.02 65.06 1x2g s SER 135 CO 0.25 -0.20 -0.09 -0.83 1.20 0.00 0.00 173.24 173.57 1x2g s GLY 136 N -0.14 0.83 0.18 9.45 0.00 -1.12 -1.05 107.32 115.47 1x2g s GLY 136 Ca 0.02 -1.23 -0.13 0.00 0.00 0.00 0.00 44.72 43.39 1x2g s GLY 136 CO -0.04 -1.31 0.39 -1.35 0.00 0.00 0.00 173.10 170.79 1x2g s SER 137 N -2.58 -0.08 0.12 1.64 1.04 -0.01 -1.64 113.70 112.17 1x2g s SER 137 Ca 0.07 -0.71 0.08 0.00 0.48 0.00 0.00 55.95 55.87 1x2g s SER 137 Cb -0.01 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.57 1x2g s SER 137 CO -0.01 -0.97 -0.19 0.00 0.98 0.00 0.00 173.24 173.05 1x2g s ALA 138 N -3.93 1.81 -0.04 5.32 0.00 -0.09 -4.65 121.76 120.18 1x2g s ALA 138 Ca 0.14 -1.30 0.07 0.00 0.00 0.00 0.00 51.96 50.86 1x2g s ALA 138 Cb 0.01 -0.21 -0.02 0.00 0.00 0.00 0.00 23.12 22.91 1x2g s ALA 138 CO -0.01 0.30 -0.25 -0.47 0.00 0.00 0.00 175.76 175.34 1x2g s TYR 139 N -1.47 2.29 0.03 0.00 5.04 -1.26 -1.59 117.35 120.39 1x2g s TYR 139 Ca 0.09 -0.54 0.05 0.00 -2.44 0.00 0.00 57.07 54.23 1x2g s TYR 139 Cb -0.08 -1.49 -0.02 0.00 0.35 0.00 0.00 41.96 40.72 1x2g s TYR 139 CO 0.05 -0.11 -0.15 1.03 -1.34 0.00 0.00 175.55 175.02 1x2g s ARG 140 N -0.39 1.06 0.17 4.97 1.81 0.26 -4.98 118.95 121.85 1x2g s ARG 140 Ca 0.04 -0.76 0.11 0.00 -1.72 0.00 0.00 55.73 53.40 1x2g s ARG 140 Cb -0.11 -1.08 -0.04 0.00 -0.45 0.00 0.00 34.95 33.27 1x2g s ARG 140 CO 0.01 0.27 -0.24 -1.21 -0.68 0.00 0.00 175.30 173.45 1x2g s GLU 141 N -1.03 1.45 0.00 3.54 2.02 -1.26 0.09 118.70 123.51 1x2g s GLU 141 Ca 0.03 -1.45 0.00 0.00 0.02 0.00 0.00 54.97 53.57 1x2g s GLU 141 Cb -0.08 -1.80 0.00 0.00 0.10 0.00 0.00 34.13 32.36 1x2g s GLU 141 CO 0.01 0.40 0.00 0.25 0.02 0.00 0.00 175.26 175.94 1x2g n THR 142 N 0.49 0.00 -0.04 3.63 -2.24 -0.42 -5.02 114.28 110.67 1x2g n THR 142 Ca -0.14 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.48 1x2g n THR 142 Cb 0.55 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.71 1x2g n THR 142 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1x2g h LYS 143 N 0.00 0.56 0.00 -0.78 1.57 -2.03 -3.36 116.57 112.53 1x2g h LYS 143 Ca 0.00 -0.41 -0.02 0.00 -1.87 0.00 0.00 60.65 58.35 1x2g h LYS 143 Cb 0.00 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 1x2g h LYS 143 CO 0.00 1.03 -0.26 0.38 -0.57 0.00 0.00 179.45 180.02 1x2g h ASP 144 N 0.20 0.00 -5.04 0.86 2.03 -1.97 -3.42 116.42 109.08 1x2g h ASP 144 Ca -0.01 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.18 1x2g h ASP 144 Cb 1.06 0.00 -0.18 0.00 -0.83 0.00 0.00 39.33 39.38 1x2g h ASP 144 CO 0.09 0.09 -0.35 0.00 -1.03 0.00 0.00 179.24 178.04 1x2g s ARG 145 N -3.19 0.69 0.23 4.15 1.70 -1.26 0.63 118.95 121.90 1x2g s ARG 145 Ca 0.05 -0.51 0.05 0.00 -0.47 0.00 0.00 55.73 54.86 1x2g s ARG 145 Cb 0.06 0.29 -0.03 0.00 -0.57 0.00 0.00 34.95 34.70 1x2g s ARG 145 CO 0.70 -0.20 0.29 0.20 -1.08 0.00 0.00 175.30 175.21 1x2g s GLY 146 N -1.88 1.36 -0.16 3.88 0.00 -0.61 -1.30 107.32 108.60 1x2g s GLY 146 Ca -0.08 -1.26 -0.04 0.00 0.00 0.00 0.00 44.72 43.35 1x2g s GLY 146 CO -0.02 -1.28 0.23 -0.12 0.00 0.00 0.00 173.10 171.92 1x2g s PHE 147 N -1.98 -0.34 -0.12 1.90 2.19 0.11 -3.00 117.98 116.75 1x2g s PHE 147 Ca 0.34 0.56 0.02 0.00 0.33 0.00 0.00 56.93 58.18 1x2g s PHE 147 Cb -0.09 -0.22 0.01 0.00 -1.31 0.00 0.00 43.02 41.41 1x2g s PHE 147 CO 0.27 -0.48 -0.19 -1.58 1.83 0.00 0.00 175.22 175.08 1x2g s HIS 148 N 2.36 2.29 0.08 10.12 2.46 0.45 -0.57 115.29 132.48 1x2g s HIS 148 Ca 0.05 -1.08 0.02 0.00 0.47 0.00 0.00 55.06 54.52 1x2g s HIS 148 Cb -0.14 -1.59 -0.04 0.00 -0.13 0.00 0.00 32.58 30.69 1x2g s HIS 148 CO -0.10 -0.51 -0.07 -3.38 -2.47 0.00 0.00 174.74 168.21 1x2g s HIS 149 N 0.81 0.80 0.01 3.88 -3.43 -0.62 0.79 115.29 117.54 1x2g s HIS 149 Ca -0.09 -0.78 -0.01 0.00 -0.80 0.00 0.00 55.06 53.38 1x2g s HIS 149 Cb -0.16 -0.47 0.00 0.00 -1.43 0.00 0.00 32.58 30.52 1x2g s HIS 149 CO 0.00 -0.13 0.05 0.41 -2.00 0.00 0.00 174.74 173.07 1x2g n GLY 150 N 0.48 1.51 3.06 -1.38 0.00 -0.19 -0.91 105.19 107.76 1x2g n GLY 150 Ca -0.16 -0.97 -0.18 0.00 0.00 0.00 0.00 46.02 44.72 1x2g n GLY 150 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x2g s THR 151 N -2.69 0.79 -0.19 2.61 2.01 -0.65 -1.52 115.64 116.00 1x2g s THR 151 Ca 0.01 -0.69 -0.03 0.00 0.31 0.00 0.00 61.69 61.29 1x2g s THR 151 Cb -0.00 -0.71 -0.02 0.00 0.01 0.00 0.00 72.50 71.78 1x2g s THR 151 CO 0.00 0.03 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.15 1x2g s LEU 152 N -0.74 2.97 -0.62 4.42 1.43 0.68 -2.77 118.68 124.05 1x2g s LEU 152 Ca 0.00 -0.31 -0.28 0.00 -1.03 0.00 0.00 54.13 52.52 1x2g s LEU 152 Cb -0.06 -1.73 0.02 0.00 0.03 0.00 0.00 46.19 44.45 1x2g s LEU 152 CO 0.00 0.06 1.30 -0.76 0.23 0.00 0.00 176.35 177.18 1x2g s LEU 153 N 0.98 3.35 -0.23 1.79 1.43 -0.39 -1.63 118.68 123.98 1x2g s LEU 153 Ca -0.00 0.01 -0.16 0.00 -1.03 0.00 0.00 54.13 52.95 1x2g s LEU 153 Cb -0.15 -2.95 -0.11 0.00 0.03 0.00 0.00 46.19 43.01 1x2g s LEU 153 CO 0.00 -1.67 -0.23 0.18 0.23 0.00 0.00 176.35 174.86 1x2g n LEU 154 N 9.13 1.92 -2.71 1.79 4.77 0.62 -1.19 117.00 131.33 1x2g n LEU 154 Ca 0.08 0.39 -0.09 0.00 -0.03 0.00 0.00 56.01 56.36 1x2g n LEU 154 Cb 0.49 -0.83 0.06 0.00 -2.33 0.00 0.00 43.42 40.81 1x2g n LEU 154 CO 0.71 0.19 0.11 -3.20 -1.33 0.00 0.00 177.39 173.87 1x2g n ASN 155 N -4.38 0.08 -4.76 -1.43 5.15 -0.22 -2.08 115.26 107.61 1x2g n ASN 155 Ca -0.35 -2.69 -0.39 0.00 -0.60 0.00 0.00 54.58 50.55 1x2g n ASN 155 Cb 0.69 0.11 -0.06 0.00 -0.53 0.00 0.00 39.78 39.99 1x2g n ASN 155 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1x2g s ALA 156 N -1.78 3.49 -0.35 5.20 0.00 -1.22 -4.21 121.76 122.89 1x2g s ALA 156 Ca 0.26 0.03 -0.21 0.00 0.00 0.00 0.00 51.96 52.04 1x2g s ALA 156 Cb 0.42 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.81 1x2g s ALA 156 CO -0.02 0.17 0.68 0.34 0.00 0.00 0.00 175.76 176.93 1x2g s ASP 157 N -0.20 6.48 0.25 0.00 -1.08 -1.26 -4.94 116.67 115.92 1x2g s ASP 157 Ca 0.31 0.28 0.22 0.00 -0.52 0.00 0.00 52.55 52.84 1x2g s ASP 157 Cb -0.18 -2.35 0.06 0.00 -1.46 0.00 0.00 42.92 38.99 1x2g s ASP 157 CO 0.17 -0.61 1.16 -0.07 0.52 0.00 0.00 175.17 176.34 1x2g h LEU 158 N 9.43 0.00 -0.38 -1.34 4.07 -2.00 -3.25 115.31 121.85 1x2g h LEU 158 Ca -0.26 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.70 1x2g h LEU 158 Cb 1.11 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.85 1x2g h LEU 158 CO 0.85 0.05 -0.10 -1.54 -1.08 0.00 0.00 178.44 176.62 1x2g n SER 159 N -2.79 0.69 0.03 -0.43 3.41 -1.26 -4.38 113.62 108.89 1x2g n SER 159 Ca 0.00 -0.85 -0.20 0.00 -0.26 0.00 0.00 58.87 57.56 1x2g n SER 159 Cb 0.57 -0.02 -0.11 0.00 -0.26 0.00 0.00 64.21 64.39 1x2g n SER 159 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1x2g h ARG 160 N 0.93 0.63 -0.66 4.33 2.47 -1.99 -3.27 114.38 116.81 1x2g h ARG 160 Ca 0.00 -0.68 0.13 0.00 -1.26 0.00 0.00 59.98 58.18 1x2g h ARG 160 Cb 0.36 0.19 -0.12 0.00 -1.65 0.00 0.00 29.97 28.75 1x2g h ARG 160 CO 0.00 1.27 -0.13 1.25 0.56 0.00 0.00 179.97 182.92 1x2g h LEU 161 N 0.26 -0.55 -1.98 3.04 5.85 -1.83 -0.25 115.31 119.85 1x2g h LEU 161 Ca -0.12 0.19 0.15 0.00 0.84 0.00 0.00 57.88 58.95 1x2g h LEU 161 Cb 1.60 0.39 -0.02 0.00 0.37 0.00 0.00 40.66 42.99 1x2g h LEU 161 CO 0.18 -0.20 0.39 0.00 -0.34 0.00 0.00 178.44 178.47 1x2g h ALA 162 N 1.65 2.49 0.00 1.25 0.00 -1.86 0.23 119.26 123.01 1x2g h ALA 162 Ca 0.32 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 1x2g h ALA 162 Cb 0.51 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1x2g h ALA 162 CO -0.66 -0.64 -0.00 -0.91 0.00 0.00 0.00 179.25 177.04 1x2g h ASN 163 N 0.02 0.00 -0.00 0.00 2.35 -1.16 -3.25 115.58 113.53 1x2g h ASN 163 Ca 0.26 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.01 1x2g h ASN 163 Cb 1.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.38 1x2g h ASN 163 CO -0.01 0.00 -0.15 -1.22 -1.65 0.00 0.00 177.43 174.40 1x2g n TYR 164 N -3.09 0.00 -3.79 1.19 4.01 0.05 -4.88 117.16 110.66 1x2g n TYR 164 Ca -0.01 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.38 1x2g n TYR 164 Cb 0.17 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.15 1x2g n TYR 164 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1x2g s LEU 165 N -1.51 4.38 0.31 7.72 1.43 -1.10 0.16 118.68 130.06 1x2g s LEU 165 Ca 0.05 0.53 -0.23 0.00 -1.03 0.00 0.00 54.13 53.45 1x2g s LEU 165 Cb 0.05 -2.60 -0.10 0.00 0.03 0.00 0.00 46.19 43.58 1x2g s LEU 165 CO 0.17 0.27 0.87 0.20 0.23 0.00 0.00 176.35 178.09 1x2g s ASN 166 N -1.64 7.16 0.32 2.29 0.02 -0.24 -4.58 114.94 118.27 1x2g s ASN 166 Ca 0.26 1.66 -0.29 0.00 -1.02 0.00 0.00 52.86 53.47 1x2g s ASN 166 Cb -0.13 -2.51 -0.11 0.00 0.02 0.00 0.00 41.25 38.52 1x2g s ASN 166 CO 0.15 -0.09 1.46 -2.16 0.02 0.00 0.00 177.10 176.48 1x2g s PRO 167 N -2.27 4.20 -0.39 -0.60 0.04 -1.26 -4.91 135.00 129.80 1x2g s PRO 167 Ca 0.50 2.44 -0.05 0.00 0.04 0.00 0.00 61.00 63.93 1x2g s PRO 167 Cb -0.16 -3.03 0.09 0.00 0.04 0.00 0.00 34.50 31.43 1x2g s PRO 167 CO 0.21 -0.46 0.19 0.34 0.04 0.00 0.00 177.00 177.32 1x2g s ASP 168 N 0.02 5.34 0.10 6.66 -1.08 -1.26 -5.01 116.67 121.45 1x2g s ASP 168 Ca 0.56 -1.67 -0.29 0.00 -0.52 0.00 0.00 52.55 50.62 1x2g s ASP 168 Cb -0.44 -1.87 -0.12 0.00 -1.46 0.00 0.00 42.92 39.03 1x2g s ASP 168 CO 0.53 -0.49 1.63 0.11 0.52 0.00 0.00 175.17 177.48 1x2g h LYS 169 N 8.19 -0.59 -0.35 4.34 6.56 -1.98 -0.36 116.57 132.37 1x2g h LYS 169 Ca -0.19 0.04 -0.01 0.00 -1.06 0.00 0.00 60.65 59.44 1x2g h LYS 169 Cb 1.06 0.13 -0.02 0.00 -0.57 0.00 0.00 32.23 32.84 1x2g h LYS 169 CO 0.69 -0.39 0.18 0.87 -2.06 0.00 0.00 179.45 178.74 1x2g h LYS 170 N -0.61 0.48 -0.08 3.15 1.57 -1.97 0.13 116.57 119.23 1x2g h LYS 170 Ca -0.01 -0.04 -0.19 0.00 -1.87 0.00 0.00 60.65 58.54 1x2g h LYS 170 Cb 0.57 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 1x2g h LYS 170 CO -0.08 0.37 -0.74 -0.22 -0.57 0.00 0.00 179.45 178.20 1x2g h LYS 171 N 0.49 0.42 -0.02 3.15 3.64 -1.92 -1.40 116.57 120.93 1x2g h LYS 171 Ca 0.13 -0.35 -0.17 0.00 -1.27 0.00 0.00 60.65 58.98 1x2g h LYS 171 Cb 0.03 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1x2g h LYS 171 CO -0.02 0.99 -0.77 -0.07 -2.27 0.00 0.00 179.45 177.32 1x2g h LEU 172 N 0.29 0.23 -0.53 5.20 3.38 -0.46 -3.10 115.31 120.33 1x2g h LEU 172 Ca -0.03 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1x2g h LEU 172 Cb 1.32 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1x2g h LEU 172 CO 0.13 0.91 0.00 0.00 0.09 0.00 0.00 178.44 179.57 1x2g h ALA 173 N 1.08 1.00 0.00 1.53 0.00 -0.71 -3.39 119.26 118.77 1x2g h ALA 173 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1x2g h ALA 173 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1x2g h ALA 173 CO 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 179.25 179.16 1x2g h ALA 174 N 2.11 0.00 -3.00 0.00 0.00 -1.18 -3.50 119.26 113.69 1x2g h ALA 174 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1x2g h ALA 174 Cb 0.74 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1x2g h ALA 174 CO 0.00 0.20 0.00 1.63 0.00 0.00 0.00 179.25 181.08 1x2g n LYS 175 N -4.16 3.45 0.00 0.00 4.76 -1.21 -5.11 118.16 115.90 1x2g n LYS 175 Ca -0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 1x2g n LYS 175 Cb 0.11 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.30 1x2g n LYS 175 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1x2g n ARG 183 N 0.00 0.00 -2.97 1.97 1.74 -1.26 -5.03 116.66 111.10 1x2g n ARG 183 Ca 0.00 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.66 1x2g n ARG 183 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.39 1x2g n ARG 183 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1x2g s VAL 184 N 0.00 4.75 0.08 1.55 1.01 -1.26 -0.38 120.40 126.15 1x2g s VAL 184 Ca 0.00 0.83 0.07 0.00 0.00 0.00 0.00 61.98 62.88 1x2g s VAL 184 Cb 0.00 -4.20 -0.03 0.00 0.00 0.00 0.00 36.38 32.15 1x2g s VAL 184 CO 0.00 -0.44 -0.20 -0.89 0.00 0.00 0.00 175.10 173.58 1x2g s THR 185 N 3.07 1.60 -0.04 3.92 2.01 0.47 -4.93 115.64 121.74 1x2g s THR 185 Ca 0.30 -1.42 -0.17 0.00 0.31 0.00 0.00 61.69 60.71 1x2g s THR 185 Cb -0.13 -1.45 -0.05 0.00 0.01 0.00 0.00 72.50 70.88 1x2g s THR 185 CO 0.17 -0.03 0.46 0.20 -0.69 0.00 0.00 174.62 174.73 1x2g s ASN 186 N -1.72 6.79 0.55 3.53 0.01 -1.26 -4.24 114.94 118.60 1x2g s ASN 186 Ca 0.05 0.93 0.37 0.00 -0.71 0.00 0.00 52.86 53.51 1x2g s ASN 186 Cb -0.10 -2.28 2.00 0.00 0.41 0.00 0.00 41.25 41.29 1x2g s ASN 186 CO 0.03 0.18 2.13 -0.07 -1.51 0.00 0.00 177.10 177.86 1x2g h LEU 187 N 5.58 0.00 -0.77 0.60 3.38 -1.18 -1.48 115.31 121.45 1x2g h LEU 187 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1x2g h LEU 187 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1x2g h LEU 187 CO 0.68 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.56 1x2g n THR 188 N -2.80 0.85 0.00 0.22 -2.24 -0.89 -0.13 114.28 109.28 1x2g n THR 188 Ca -0.02 0.27 0.00 0.00 -2.27 0.00 0.00 64.05 62.03 1x2g n THR 188 Cb 0.06 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 67.08 1x2g n THR 188 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1x2g n GLU 189 N -2.25 0.00 0.03 -0.78 1.02 -0.56 -2.66 120.64 115.45 1x2g n GLU 189 Ca 0.02 0.50 0.21 0.00 -0.02 0.00 0.00 57.16 57.86 1x2g n GLU 189 Cb 0.21 -1.17 0.73 0.00 -0.02 0.00 0.00 31.44 31.19 1x2g n GLU 189 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1x2g h LEU 190 N 0.00 0.00 -6.08 -4.62 3.38 -1.64 -3.27 115.31 103.07 1x2g h LEU 190 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 1x2g h LEU 190 Cb 0.00 0.00 -0.38 0.00 0.09 0.00 0.00 40.66 40.37 1x2g h LEU 190 CO 0.00 0.00 -1.06 0.18 0.09 0.00 0.00 178.44 177.65 1x2g n LEU 191 N -4.06 -0.09 0.00 1.67 4.77 0.81 -5.05 117.00 115.05 1x2g n LEU 191 Ca 0.09 -4.57 0.00 0.00 -0.03 0.00 0.00 56.01 51.51 1x2g n LEU 191 Cb 0.63 0.62 0.00 0.00 -2.33 0.00 0.00 43.42 42.34 1x2g n LEU 191 CO 0.33 2.01 0.00 -2.65 -1.33 0.00 0.00 177.39 175.75 1x2g n PRO 192 N 1.83 0.00 -0.45 3.23 -0.02 -1.09 -1.34 135.00 137.16 1x2g n PRO 192 Ca 0.23 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.82 1x2g n PRO 192 Cb 0.52 0.00 0.32 0.00 -0.02 0.00 0.00 33.50 34.32 1x2g n PRO 192 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1x2g n GLY 193 N -0.90 2.65 3.68 -1.23 0.00 -1.26 -4.83 105.19 103.30 1x2g n GLY 193 Ca 0.00 -0.79 -0.45 0.00 0.00 0.00 0.00 46.02 44.77 1x2g n GLY 193 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1x2g n ILE 194 N 1.34 0.33 -3.44 -0.61 -5.35 -0.45 -4.99 119.36 106.19 1x2g n ILE 194 Ca 0.24 -0.08 -0.28 0.00 -0.27 0.00 0.00 62.75 62.36 1x2g n ILE 194 Cb 0.72 -1.56 -0.03 0.00 -1.74 0.00 0.00 39.64 37.03 1x2g n ILE 194 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1x2g s THR 195 N 0.59 5.08 0.09 7.28 2.01 -1.26 -4.97 115.64 124.47 1x2g s THR 195 Ca 0.75 -0.13 -0.23 0.00 0.31 0.00 0.00 61.69 62.39 1x2g s THR 195 Cb -0.65 -3.75 -0.14 0.00 0.01 0.00 0.00 72.50 67.97 1x2g s THR 195 CO 0.42 -0.31 1.73 -0.74 -0.69 0.00 0.00 174.62 175.03 1x2g h HIS 196 N 1.65 -0.03 -0.98 4.92 2.76 -1.94 -2.87 115.15 118.67 1x2g h HIS 196 Ca -0.48 0.00 0.23 0.00 -2.20 0.00 0.00 60.37 57.92 1x2g h HIS 196 Cb 1.19 0.01 -0.12 0.00 1.55 0.00 0.00 27.41 30.05 1x2g h HIS 196 CO 0.56 -0.02 0.55 0.93 -1.30 0.00 0.00 177.93 178.66 1x2g h GLU 197 N -0.02 0.56 -0.31 5.26 3.07 -1.99 -1.03 114.58 120.13 1x2g h GLU 197 Ca 0.01 -0.03 -0.15 0.00 -0.50 0.00 0.00 59.36 58.69 1x2g h GLU 197 Cb 0.03 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 27.80 1x2g h GLU 197 CO -0.02 0.37 -0.40 1.96 -1.40 0.00 0.00 179.01 179.52 1x2g h GLN 198 N 0.58 0.75 -0.43 2.33 4.20 -1.96 -0.60 115.11 119.98 1x2g h GLN 198 Ca 0.61 -0.39 -0.14 0.00 0.06 0.00 0.00 58.65 58.79 1x2g h GLN 198 Cb 1.12 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.90 1x2g h GLN 198 CO -0.47 1.01 -0.29 0.28 -0.67 0.00 0.00 178.83 178.69 1x2g h VAL 199 N 0.61 1.27 -0.49 -0.54 2.07 -1.11 -1.92 116.25 116.14 1x2g h VAL 199 Ca 0.05 -1.46 -0.01 0.00 0.82 0.00 0.00 66.70 66.10 1x2g h VAL 199 Cb 0.95 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 1x2g h VAL 199 CO 0.09 0.50 0.28 0.00 0.02 0.00 0.00 177.57 178.45 1x2g h GLU 201 N 0.65 0.69 -0.22 0.00 4.22 -1.11 -0.72 114.58 118.08 1x2g h GLU 201 Ca 0.17 -0.04 -0.20 0.00 0.08 0.00 0.00 59.36 59.38 1x2g h GLU 201 Cb 0.03 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.13 1x2g h GLU 201 CO -0.03 0.45 -0.63 0.00 -2.18 0.00 0.00 179.01 176.63 1x2g h ALA 202 N 1.42 0.37 -0.35 2.92 0.00 -0.78 -2.12 119.26 120.72 1x2g h ALA 202 Ca 0.36 -0.54 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1x2g h ALA 202 Cb 0.32 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1x2g h ALA 202 CO -0.24 0.64 -0.16 0.82 0.00 0.00 0.00 179.25 180.31 1x2g h ILE 203 N 0.56 1.26 0.43 0.00 2.04 -0.87 -2.44 117.51 118.48 1x2g h ILE 203 Ca -0.02 -1.18 -0.02 0.00 1.00 0.00 0.00 64.86 64.65 1x2g h ILE 203 Cb 1.25 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 38.49 1x2g h ILE 203 CO 0.13 0.39 -0.25 0.74 0.00 0.00 0.00 178.15 179.17 1x2g h THR 204 N 0.58 0.00 -0.98 -0.27 2.02 -1.01 -2.14 112.91 111.10 1x2g h THR 204 Ca 0.10 0.00 0.20 0.00 0.77 0.00 0.00 66.41 67.47 1x2g h THR 204 Cb 0.60 0.00 -0.19 0.00 -1.74 0.00 0.00 68.15 66.82 1x2g h THR 204 CO 0.04 0.00 -0.24 -0.33 0.37 0.00 0.00 175.52 175.36 1x2g h GLU 205 N -0.63 0.00 0.00 6.66 4.39 -1.42 0.25 114.58 123.83 1x2g h GLU 205 Ca -0.06 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.64 1x2g h GLU 205 Cb 0.50 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1x2g h GLU 205 CO 0.07 0.00 -0.00 0.00 -1.16 0.00 0.00 179.01 177.92 1x2g h ALA 206 N 1.98 1.00 0.12 3.43 0.00 -1.32 0.43 119.26 124.90 1x2g h ALA 206 Ca 0.47 -0.00 -0.36 0.00 0.00 0.00 0.00 54.91 55.02 1x2g h ALA 206 Cb 0.73 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1x2g h ALA 206 CO -1.01 0.00 -1.96 0.34 0.00 0.00 0.00 179.25 176.62 1x2g n PHE 207 N -3.09 1.25 0.03 0.00 7.35 0.66 -2.36 117.46 121.31 1x2g n PHE 207 Ca 0.00 0.28 -0.11 0.00 -0.76 0.00 0.00 57.45 56.86 1x2g n PHE 207 Cb 0.28 -1.16 -0.05 0.00 0.35 0.00 0.00 39.48 38.91 1x2g n PHE 207 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 1x2g h PHE 208 N 0.01 -0.87 -0.59 -5.13 0.04 -0.68 -2.46 116.94 107.27 1x2g h PHE 208 Ca -0.42 0.03 0.09 0.00 2.80 0.00 0.00 57.97 60.47 1x2g h PHE 208 Cb 1.99 0.39 -0.07 0.00 2.20 0.00 0.00 35.95 40.47 1x2g h PHE 208 CO 0.08 -0.40 0.20 0.00 -0.60 0.00 0.00 178.31 177.58 1x2g h ALA 209 N 0.34 0.74 -0.40 2.45 0.00 -0.27 0.62 119.26 122.74 1x2g h ALA 209 Ca 0.08 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1x2g h ALA 209 Cb 0.55 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1x2g h ALA 209 CO -0.30 -0.22 0.10 1.25 0.00 0.00 0.00 179.25 180.07 1x2g h HIS 210 N 0.36 0.59 -0.02 0.00 -0.00 -1.25 -2.37 115.15 112.47 1x2g h HIS 210 Ca 0.30 -0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.63 1x2g h HIS 210 Cb 0.38 -0.18 0.00 0.00 -0.00 0.00 0.00 27.41 27.61 1x2g h HIS 210 CO -0.18 0.51 -0.21 0.66 -0.00 0.00 0.00 177.93 178.71 1x2g n TYR 211 N -4.33 0.00 -3.08 5.26 4.01 -0.78 -4.97 117.16 113.27 1x2g n TYR 211 Ca 0.02 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.54 1x2g n TYR 211 Cb 0.19 -0.01 0.03 0.00 -0.31 0.00 0.00 39.34 39.23 1x2g n TYR 211 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1x2g n GLY 212 N 1.35 -0.52 3.28 2.72 0.00 0.21 -4.95 105.19 107.29 1x2g n GLY 212 Ca 0.13 0.12 -0.11 0.00 0.00 0.00 0.00 46.02 46.15 1x2g n GLY 212 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x2g s GLU 213 N -5.76 0.90 0.06 1.61 2.12 -0.82 -5.03 118.70 111.78 1x2g s GLU 213 Ca 0.32 -0.53 0.06 0.00 0.36 0.00 0.00 54.97 55.18 1x2g s GLU 213 Cb -0.15 0.39 -0.03 0.00 0.26 0.00 0.00 34.13 34.61 1x2g s GLU 213 CO 0.39 -0.31 -0.16 0.50 -0.54 0.00 0.00 175.26 175.14 1x2g s ARG 214 N -2.87 1.01 0.01 4.30 3.52 -1.26 -4.32 118.95 119.34 1x2g s ARG 214 Ca -0.03 -0.92 -0.06 0.00 -0.13 0.00 0.00 55.73 54.59 1x2g s ARG 214 Cb 0.00 -1.09 -0.00 0.00 -1.56 0.00 0.00 34.95 32.30 1x2g s ARG 214 CO -0.05 0.26 0.12 0.14 -0.81 0.00 0.00 175.30 174.96 1x2g s VAL 215 N -1.01 0.09 0.47 7.11 -7.23 -1.26 -5.02 120.40 113.54 1x2g s VAL 215 Ca 0.03 -0.75 -0.24 0.00 -1.81 0.00 0.00 61.98 59.21 1x2g s VAL 215 Cb -0.09 -0.45 -0.07 0.00 0.56 0.00 0.00 36.38 36.33 1x2g s VAL 215 CO 0.02 -0.41 1.33 -1.61 -0.31 0.00 0.00 175.10 174.12 1x2g s GLU 216 N -1.50 3.59 0.20 4.82 0.41 -1.26 -4.97 118.70 119.99 1x2g s GLU 216 Ca -0.14 2.18 -0.30 0.00 -0.41 0.00 0.00 54.97 56.30 1x2g s GLU 216 Cb -0.07 -2.51 -0.08 0.00 -1.78 0.00 0.00 34.13 29.69 1x2g s GLU 216 CO 0.01 -0.81 1.17 0.00 -0.49 0.00 0.00 175.26 175.14 1x2g s ALA 217 N -1.31 3.42 -0.45 5.21 0.00 -1.26 -4.60 121.76 122.77 1x2g s ALA 217 Ca 0.64 0.93 -0.22 0.00 0.00 0.00 0.00 51.96 53.31 1x2g s ALA 217 Cb -0.38 -3.39 0.03 0.00 0.00 0.00 0.00 23.12 19.37 1x2g s ALA 217 CO 0.48 -0.32 0.70 -1.21 0.00 0.00 0.00 175.76 175.40 1x2g s GLU 218 N -0.47 3.31 -0.40 0.00 2.02 0.88 -4.97 118.70 119.06 1x2g s GLU 218 Ca 0.51 -0.30 -0.25 0.00 0.02 0.00 0.00 54.97 54.95 1x2g s GLU 218 Cb -0.32 -3.96 0.02 0.00 0.10 0.00 0.00 34.13 29.97 1x2g s GLU 218 CO 0.37 -1.07 0.87 0.42 0.02 0.00 0.00 175.26 175.88 1x2g s ILE 219 N 3.00 4.59 0.11 -1.63 -1.09 -1.26 -0.48 121.20 124.45 1x2g s ILE 219 Ca 0.25 0.89 0.08 0.00 -2.23 0.00 0.00 60.65 59.65 1x2g s ILE 219 Cb -0.14 -4.33 -0.04 0.00 -1.58 0.00 0.00 42.46 36.37 1x2g s ILE 219 CO 0.20 -0.62 -0.15 0.27 -1.23 0.00 0.00 174.94 173.40 1x2g s ILE 220 N 3.45 3.02 0.13 2.92 -4.36 0.19 -4.93 121.20 121.62 1x2g s ILE 220 Ca 0.35 -1.41 -0.23 0.00 -0.26 0.00 0.00 60.65 59.11 1x2g s ILE 220 Cb -0.12 -2.39 0.06 0.00 1.25 0.00 0.00 42.46 41.27 1x2g s ILE 220 CO 0.21 0.12 0.57 -0.94 0.24 0.00 0.00 174.94 175.14 1x2g s SER 221 N -2.12 -0.51 0.28 4.36 1.04 -1.26 -0.70 113.70 114.78 1x2g s SER 221 Ca 0.19 0.02 0.19 0.00 0.48 0.00 0.00 55.95 56.83 1x2g s SER 221 Cb -0.11 0.57 1.01 0.00 0.10 0.00 0.00 66.02 67.59 1x2g s SER 221 CO 0.11 -0.90 1.58 -0.81 0.98 0.00 0.00 173.24 174.20 1x2g n PRO 222 N -0.19 0.12 0.15 4.02 -0.04 -1.26 -2.92 135.00 134.88 1x2g n PRO 222 Ca -0.17 0.61 0.13 0.00 -0.04 0.00 0.00 63.50 64.02 1x2g n PRO 222 Cb 0.64 -1.89 0.46 0.00 -0.04 0.00 0.00 33.50 32.67 1x2g n PRO 222 CO 0.00 0.00 0.00 -2.95 -0.04 0.00 0.00 175.50 172.51 1x2g h ASN 223 N 0.00 0.00 -3.55 3.54 -0.00 -2.01 -3.42 115.58 110.13 1x2g h ASN 223 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 56.30 55.97 1x2g h ASN 223 Cb 0.02 0.00 -0.33 0.00 -0.00 0.00 0.00 38.32 38.01 1x2g h ASN 223 CO 0.00 0.00 -0.74 -0.75 -0.00 0.00 0.00 177.43 175.94 1x2g s LYS 224 N -3.28 0.23 -0.07 4.14 2.20 -1.15 -5.13 119.74 116.69 1x2g s LYS 224 Ca 0.06 0.06 -0.33 0.00 -0.36 0.00 0.00 55.97 55.41 1x2g s LYS 224 Cb 0.10 -0.40 -0.11 0.00 -1.51 0.00 0.00 37.83 35.92 1x2g s LYS 224 CO 0.50 -0.11 1.94 2.41 -0.36 0.00 0.00 175.35 179.73 1x2g n THR 225 N 3.96 0.62 -1.41 3.43 -1.04 -1.26 -4.50 114.28 114.08 1x2g n THR 225 Ca -0.25 -0.14 -0.30 0.00 -2.04 0.00 0.00 64.05 61.32 1x2g n THR 225 Cb 0.52 -2.04 0.10 0.00 -1.82 0.00 0.00 70.33 67.08 1x2g n THR 225 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1x2g s PRO 226 N 4.39 2.06 -1.31 -2.82 0.05 -1.26 -4.91 135.00 131.19 1x2g s PRO 226 Ca 0.93 0.85 -0.14 0.00 0.05 0.00 0.00 61.00 62.68 1x2g s PRO 226 Cb -0.60 -1.90 0.11 0.00 0.05 0.00 0.00 34.50 32.16 1x2g s PRO 226 CO 0.48 -1.69 1.80 -3.47 0.05 0.00 0.00 177.00 174.16 1x2g n ASP 227 N -3.51 4.80 -3.78 6.66 2.03 -1.26 -4.84 116.55 116.65 1x2g n ASP 227 Ca 0.07 -2.95 -0.13 0.00 0.52 0.00 0.00 54.79 52.30 1x2g n ASP 227 Cb 0.55 -1.64 -0.13 0.00 -0.72 0.00 0.00 41.12 39.18 1x2g n ASP 227 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1x2g s LEU 228 N 2.31 0.99 0.50 -2.67 1.43 -1.26 -5.14 118.68 114.83 1x2g s LEU 228 Ca 0.47 0.33 -0.21 0.00 -1.03 0.00 0.00 54.13 53.69 1x2g s LEU 228 Cb 0.05 0.47 -0.07 0.00 0.03 0.00 0.00 46.19 46.67 1x2g s LEU 228 CO 0.01 -0.11 1.12 -2.16 0.23 0.00 0.00 176.35 175.44 1x2g s PRO 229 N 0.72 3.60 -1.37 1.29 0.05 -1.26 -3.35 135.00 134.67 1x2g s PRO 229 Ca -0.05 1.61 0.00 0.00 0.05 0.00 0.00 61.00 62.60 1x2g s PRO 229 Cb -0.07 -2.17 0.00 0.00 0.05 0.00 0.00 34.50 32.31 1x2g s PRO 229 CO -0.04 -0.65 0.00 0.09 0.05 0.00 0.00 177.00 176.46 1x2g n ASN 230 N -0.93 -4.65 0.05 6.66 4.13 -1.26 -4.86 115.26 114.41 1x2g n ASN 230 Ca 0.10 0.14 -0.13 0.00 1.68 0.00 0.00 54.58 56.37 1x2g n ASN 230 Cb 0.50 -3.94 -0.08 0.00 -1.54 0.00 0.00 39.78 34.72 1x2g n ASN 230 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 1x2g h PHE 231 N 0.00 -0.10 -0.86 3.10 3.57 -1.91 -2.60 116.94 118.14 1x2g h PHE 231 Ca -0.37 -0.00 0.22 0.00 3.53 0.00 0.00 57.97 61.35 1x2g h PHE 231 Cb 1.25 0.03 -0.14 0.00 2.79 0.00 0.00 35.95 39.89 1x2g h PHE 231 CO 0.63 0.15 0.20 0.00 -2.23 0.00 0.00 178.31 177.05 1x2g h ALA 232 N 0.56 1.19 0.17 2.41 0.00 -1.90 0.19 119.26 121.88 1x2g h ALA 232 Ca -0.01 0.22 -0.30 0.00 0.00 0.00 0.00 54.91 54.83 1x2g h ALA 232 Cb 0.29 0.33 0.02 0.00 0.00 0.00 0.00 17.79 18.42 1x2g h ALA 232 CO 0.02 -0.45 -1.33 1.49 0.00 0.00 0.00 179.25 178.98 1x2g h GLU 233 N 0.20 0.36 -0.13 0.00 4.57 -1.97 -1.00 114.58 116.61 1x2g h GLU 233 Ca 0.53 -0.62 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1x2g h GLU 233 Cb 1.04 0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 29.85 1x2g h GLU 233 CO -0.65 1.29 0.08 1.15 -1.18 0.00 0.00 179.01 179.70 1x2g h THR 234 N 0.10 1.07 -0.32 0.32 2.02 -0.94 -1.07 112.91 114.10 1x2g h THR 234 Ca -0.18 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 66.79 1x2g h THR 234 Cb 2.04 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 69.39 1x2g h THR 234 CO 0.23 0.07 0.09 0.15 0.37 0.00 0.00 175.52 176.42 1x2g h PHE 235 N 0.14 0.52 -0.68 3.16 3.57 -0.71 0.17 116.94 123.10 1x2g h PHE 235 Ca 0.05 -0.06 0.10 0.00 3.53 0.00 0.00 57.97 61.59 1x2g h PHE 235 Cb 0.04 -0.15 -0.07 0.00 2.79 0.00 0.00 35.95 38.56 1x2g h PHE 235 CO -0.05 0.53 0.31 0.00 -2.23 0.00 0.00 178.31 176.87 1x2g h ALA 236 N 0.93 0.93 -0.12 2.41 0.00 -1.06 -1.53 119.26 120.81 1x2g h ALA 236 Ca 0.10 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1x2g h ALA 236 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1x2g h ALA 236 CO -0.00 -0.10 -0.26 0.00 0.00 0.00 0.00 179.25 178.88 1x2g h ARG 237 N 0.53 0.39 -0.60 0.00 3.08 -1.10 -2.93 114.38 113.75 1x2g h ARG 237 Ca 0.34 -0.26 0.01 0.00 0.07 0.00 0.00 59.98 60.15 1x2g h ARG 237 Cb 0.39 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.45 1x2g h ARG 237 CO -0.29 0.86 0.40 0.37 -1.07 0.00 0.00 179.97 180.24 1x2g h GLN 238 N -0.03 0.75 -0.29 0.04 5.75 -0.51 -2.58 115.11 118.24 1x2g h GLN 238 Ca 0.00 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.46 1x2g h GLN 238 Cb 0.86 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 29.24 1x2g h GLN 238 CO 0.06 0.50 0.00 -1.13 -2.65 0.00 0.00 178.83 175.61 1x2g n SER 239 N -4.45 2.28 -4.73 -0.69 3.41 -0.59 -4.70 113.62 104.15 1x2g n SER 239 Ca 0.06 -1.85 -0.42 0.00 -0.26 0.00 0.00 58.87 56.41 1x2g n SER 239 Cb 0.07 -0.19 -0.03 0.00 -0.26 0.00 0.00 64.21 63.81 1x2g n SER 239 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1x2g s SER 240 N -1.42 6.81 0.39 4.04 0.01 -0.98 -4.92 113.70 117.64 1x2g s SER 240 Ca 0.33 2.44 0.12 0.00 1.31 0.00 0.00 55.95 60.16 1x2g s SER 240 Cb 0.18 -2.60 0.93 0.00 0.21 0.00 0.00 66.02 64.74 1x2g s SER 240 CO 0.26 -0.62 1.89 -0.25 0.41 0.00 0.00 173.24 174.94 1x2g h TRP 241 N 5.83 0.66 0.00 2.43 7.01 -1.91 -0.51 115.95 129.46 1x2g h TRP 241 Ca -0.44 0.02 -0.07 0.00 2.11 0.00 0.00 58.89 60.50 1x2g h TRP 241 Cb 1.21 -0.21 -0.01 0.00 -2.10 0.00 0.00 29.16 28.06 1x2g h TRP 241 CO 0.63 0.24 -0.36 0.93 -2.79 0.00 0.00 178.44 177.10 1x2g h GLU 242 N 0.56 0.00 0.09 2.65 4.39 -1.94 0.19 114.58 120.53 1x2g h GLU 242 Ca 0.41 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.85 1x2g h GLU 242 Cb 0.79 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.43 1x2g h GLU 242 CO -0.16 0.36 -1.34 2.35 -1.16 0.00 0.00 179.01 179.05 1x2g h TRP 243 N 0.00 0.36 0.05 4.33 2.91 -1.60 -3.06 115.95 118.95 1x2g h TRP 243 Ca -0.00 -0.27 -0.00 0.00 1.13 0.00 0.00 58.89 59.75 1x2g h TRP 243 Cb 0.82 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 29.46 1x2g h TRP 243 CO 0.00 1.53 -0.02 -0.91 -1.03 0.00 0.00 178.44 178.00 1x2g h ASN 244 N -0.41 -0.06 0.00 2.65 4.21 -0.97 -3.41 115.58 117.58 1x2g h ASN 244 Ca -0.30 -0.48 0.00 0.00 1.21 0.00 0.00 56.30 56.74 1x2g h ASN 244 Cb 1.67 0.02 0.00 0.00 -1.12 0.00 0.00 38.32 38.89 1x2g h ASN 244 CO 0.02 0.46 -0.13 0.49 -1.29 0.00 0.00 177.43 176.99 1x2g n PHE 245 N -4.87 0.24 -0.47 1.19 3.72 0.61 -4.49 117.46 113.39 1x2g n PHE 245 Ca -0.09 0.11 0.06 0.00 -0.05 0.00 0.00 57.45 57.48 1x2g n PHE 245 Cb 0.27 -0.38 -0.03 0.00 -0.94 0.00 0.00 39.48 38.40 1x2g n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1x2g n GLY 246 N 1.71 -2.77 3.77 1.37 0.00 -0.74 -4.78 105.19 103.75 1x2g n GLY 246 Ca -0.02 -1.33 -0.39 0.00 0.00 0.00 0.00 46.02 44.29 1x2g n GLY 246 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x2g s GLN 247 N -3.27 4.14 0.28 1.61 -0.21 -1.26 -5.00 119.66 115.95 1x2g s GLN 247 Ca 0.00 1.91 -0.28 0.00 0.02 0.00 0.00 55.36 57.01 1x2g s GLN 247 Cb 0.00 -2.78 -0.14 0.00 1.00 0.00 0.00 33.01 31.09 1x2g s GLN 247 CO 0.00 -0.27 1.01 0.00 -2.12 0.00 0.00 175.29 173.91 1x2g n ALA 248 N 0.27 -0.32 -1.79 6.09 0.00 -1.26 -4.95 120.51 118.56 1x2g n ALA 248 Ca 0.03 0.40 -0.42 0.00 0.00 0.00 0.00 53.44 53.45 1x2g n ALA 248 Cb 0.45 -2.01 -0.03 0.00 0.00 0.00 0.00 19.45 17.87 1x2g n ALA 248 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x2g s PRO 249 N -1.45 4.15 -0.38 0.00 0.04 -1.26 -4.99 135.00 131.11 1x2g s PRO 249 Ca 0.60 2.54 0.02 0.00 0.04 0.00 0.00 61.00 64.19 1x2g s PRO 249 Cb -0.72 -3.08 0.11 0.00 0.04 0.00 0.00 34.50 30.85 1x2g s PRO 249 CO 0.59 -0.69 0.14 0.00 0.04 0.00 0.00 177.00 177.09 1x2g s ALA 250 N 0.90 2.23 0.17 8.56 0.00 -1.26 -5.08 121.76 127.28 1x2g s ALA 250 Ca 0.71 -2.32 0.01 0.00 0.00 0.00 0.00 51.96 50.37 1x2g s ALA 250 Cb -0.48 -1.84 -0.05 0.00 0.00 0.00 0.00 23.12 20.76 1x2g s ALA 250 CO 0.35 -1.82 0.01 -0.06 0.00 0.00 0.00 175.76 174.24 1x2g s PHE 251 N 0.88 1.18 -0.95 0.00 0.40 -1.26 -5.03 117.98 113.20 1x2g s PHE 251 Ca 0.13 -1.05 0.23 0.00 -0.60 0.00 0.00 56.93 55.64 1x2g s PHE 251 Cb -0.21 -0.67 0.06 0.00 0.51 0.00 0.00 43.02 42.71 1x2g s PHE 251 CO -0.11 -0.25 1.09 -1.13 0.70 0.00 0.00 175.22 175.52 1x2g n SER 252 N -0.23 0.77 -4.30 1.36 3.41 -1.20 -4.87 113.62 108.56 1x2g n SER 252 Ca -0.06 -0.64 -0.25 0.00 -0.26 0.00 0.00 58.87 57.65 1x2g n SER 252 Cb 0.63 0.73 -0.13 0.00 -0.26 0.00 0.00 64.21 65.18 1x2g n SER 252 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1x2g s HIS 253 N -3.03 1.88 -0.08 7.33 3.76 0.16 -5.00 115.29 120.31 1x2g s HIS 253 Ca 0.08 -0.40 -0.03 0.00 -0.15 0.00 0.00 55.06 54.56 1x2g s HIS 253 Cb 0.16 -1.05 0.05 0.00 1.11 0.00 0.00 32.58 32.85 1x2g s HIS 253 CO 0.80 0.20 0.15 -1.17 -0.85 0.00 0.00 174.74 173.88 1x2g s LEU 254 N -1.78 -0.05 -0.08 0.89 2.96 -1.26 -1.42 118.68 117.94 1x2g s LEU 254 Ca 0.08 0.28 0.03 0.00 -0.22 0.00 0.00 54.13 54.30 1x2g s LEU 254 Cb -0.10 0.23 -0.02 0.00 0.50 0.00 0.00 46.19 46.81 1x2g s LEU 254 CO 0.04 -0.25 -0.18 -0.76 -1.32 0.00 0.00 176.35 173.89 1x2g s LEU 255 N 2.28 2.50 0.05 -0.68 1.43 0.27 -4.98 118.68 119.55 1x2g s LEU 255 Ca 0.03 -0.36 -0.06 0.00 -1.03 0.00 0.00 54.13 52.72 1x2g s LEU 255 Cb -0.12 -1.51 -0.01 0.00 0.03 0.00 0.00 46.19 44.57 1x2g s LEU 255 CO -0.06 0.24 0.11 1.51 0.23 0.00 0.00 176.35 178.38 1x2g s ASP 256 N -0.11 0.18 0.03 2.29 1.47 -1.26 -0.35 116.67 118.92 1x2g s ASP 256 Ca -0.03 -0.58 -0.27 0.00 1.18 0.00 0.00 52.55 52.85 1x2g s ASP 256 Cb -0.14 0.25 0.07 0.00 -0.34 0.00 0.00 42.92 42.76 1x2g s ASP 256 CO 0.04 -0.56 0.62 -0.70 0.68 0.00 0.00 175.17 175.25 1x2g s GLU 257 N -2.93 1.11 -0.17 2.11 2.56 -0.67 -5.01 118.70 115.68 1x2g s GLU 257 Ca -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 54.97 54.88 1x2g s GLU 257 Cb 0.01 0.51 -0.01 0.00 2.00 0.00 0.00 34.13 36.64 1x2g s GLU 257 CO -0.06 -0.40 -0.10 0.50 -0.56 0.00 0.00 175.26 174.64 1x2g s ARG 258 N -2.15 3.35 0.44 4.30 6.06 -1.26 -0.64 118.95 129.05 1x2g s ARG 258 Ca -0.07 -0.67 0.06 0.00 -2.50 0.00 0.00 55.73 52.56 1x2g s ARG 258 Cb -0.01 -2.79 -0.03 0.00 0.06 0.00 0.00 34.95 32.18 1x2g s ARG 258 CO 0.01 -0.00 0.20 -0.06 -2.50 0.00 0.00 175.30 172.95 1x2g s PHE 259 N 0.93 2.40 0.55 5.12 0.40 -0.24 -4.98 117.98 122.16 1x2g s PHE 259 Ca -0.02 -0.65 0.34 0.00 -0.60 0.00 0.00 56.93 56.00 1x2g s PHE 259 Cb -0.15 -1.93 1.91 0.00 0.51 0.00 0.00 43.02 43.36 1x2g s PHE 259 CO -0.00 0.08 2.24 1.79 0.70 0.00 0.00 175.22 180.03 1x2g h THR 260 N 1.31 0.35 -0.11 0.64 1.35 -2.01 -2.64 112.91 111.80 1x2g h THR 260 Ca -0.42 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 1x2g h THR 260 Cb 1.27 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 1x2g h THR 260 CO 0.68 0.03 0.00 -2.67 -0.25 0.00 0.00 175.52 173.31 1x2g n TRP 261 N -3.53 0.12 0.00 4.73 4.27 -1.26 -5.05 117.44 116.71 1x2g n TRP 261 Ca -0.03 -0.08 0.00 0.00 -3.89 0.00 0.00 57.50 53.50 1x2g n TRP 261 Cb 0.12 -0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.07 1x2g n TRP 261 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1x2g n GLY 262 N 1.02 3.57 3.82 -1.67 0.00 -1.00 -4.37 105.19 106.57 1x2g n GLY 262 Ca 0.12 -1.00 -0.33 0.00 0.00 0.00 0.00 46.02 44.80 1x2g n GLY 262 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x2g s GLY 263 N 0.00 2.27 -0.03 -0.02 0.00 -1.26 -1.08 107.32 107.20 1x2g s GLY 263 Ca 0.00 0.40 0.01 0.00 0.00 0.00 0.00 44.72 45.12 1x2g s GLY 263 CO 0.00 0.70 -0.02 0.14 0.00 0.00 0.00 173.10 173.92 1x2g s VAL 264 N -2.31 0.27 -0.11 1.40 1.01 0.19 -3.43 120.40 117.41 1x2g s VAL 264 Ca 0.63 -0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.64 1x2g s VAL 264 Cb -0.13 -0.33 0.01 0.00 0.00 0.00 0.00 36.38 35.93 1x2g s VAL 264 CO 0.25 0.15 -0.22 -1.61 0.00 0.00 0.00 175.10 173.68 1x2g s GLU 265 N 0.79 2.88 -0.25 2.72 2.02 -0.47 -1.68 118.70 124.72 1x2g s GLU 265 Ca -0.08 -0.81 0.01 0.00 0.02 0.00 0.00 54.97 54.10 1x2g s GLU 265 Cb -0.12 -2.26 0.04 0.00 0.10 0.00 0.00 34.13 31.90 1x2g s GLU 265 CO -0.01 0.08 -0.10 -1.17 0.02 0.00 0.00 175.26 174.08 1x2g s LEU 266 N 0.59 3.18 -0.12 1.80 2.96 0.53 -0.82 118.68 126.80 1x2g s LEU 266 Ca -0.13 -1.09 -0.04 0.00 -0.22 0.00 0.00 54.13 52.65 1x2g s LEU 266 Cb -0.17 -1.59 -0.03 0.00 0.50 0.00 0.00 46.19 44.90 1x2g s LEU 266 CO 0.04 -0.14 0.03 -1.00 -1.32 0.00 0.00 176.35 173.95 1x2g s HIS 267 N 1.22 3.22 0.01 5.38 3.76 0.54 -0.56 115.29 128.85 1x2g s HIS 267 Ca -0.03 0.15 -0.28 0.00 -0.15 0.00 0.00 55.06 54.75 1x2g s HIS 267 Cb -0.18 -1.89 0.09 0.00 1.11 0.00 0.00 32.58 31.72 1x2g s HIS 267 CO -0.06 0.38 0.81 -0.59 -0.85 0.00 0.00 174.74 174.43 1x2g s PHE 268 N -0.50 -0.42 -0.09 1.40 -0.71 -0.51 -0.30 117.98 116.86 1x2g s PHE 268 Ca 0.09 0.38 -0.02 0.00 -1.04 0.00 0.00 56.93 56.34 1x2g s PHE 268 Cb -0.12 0.52 -0.03 0.00 -1.21 0.00 0.00 43.02 42.18 1x2g s PHE 268 CO 0.02 -0.60 0.01 -0.51 -1.34 0.00 0.00 175.22 172.80 1x2g s ASP 269 N -2.25 5.27 -0.16 1.98 1.01 -0.67 -0.66 116.67 121.19 1x2g s ASP 269 Ca 0.02 0.15 -0.03 0.00 0.71 0.00 0.00 52.55 53.40 1x2g s ASP 269 Cb -0.01 -1.49 -0.02 0.00 1.01 0.00 0.00 42.92 42.41 1x2g s ASP 269 CO -0.07 0.38 -0.07 -0.69 0.21 0.00 0.00 175.17 174.93 1x2g s VAL 270 N -0.88 3.49 -0.02 -1.27 1.01 -1.26 -1.29 120.40 120.17 1x2g s VAL 270 Ca 0.13 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 61.63 1x2g s VAL 270 Cb -0.11 -2.52 0.01 0.00 0.00 0.00 0.00 36.38 33.75 1x2g s VAL 270 CO 0.02 0.49 -0.03 -1.61 0.00 0.00 0.00 175.10 173.97 1x2g s GLU 271 N 0.63 0.42 -1.47 2.72 2.02 -0.13 -4.84 118.70 118.05 1x2g s GLU 271 Ca -0.04 -0.08 -0.08 0.00 0.02 0.00 0.00 54.97 54.79 1x2g s GLU 271 Cb -0.15 -0.46 0.03 0.00 0.10 0.00 0.00 34.13 33.65 1x2g s GLU 271 CO 0.03 0.00 0.76 1.63 0.02 0.00 0.00 175.26 177.70 1x2g n LYS 272 N 3.46 -5.35 -0.98 1.61 5.02 -1.26 -2.01 118.16 118.65 1x2g n LYS 272 Ca -0.19 0.77 0.00 0.00 -2.02 0.00 0.00 58.31 56.87 1x2g n LYS 272 Cb 0.55 -5.65 0.00 0.00 -0.02 0.00 0.00 35.03 29.91 1x2g n LYS 272 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x2g n GLY 273 N -1.58 0.67 3.22 0.72 0.00 -1.26 -5.00 105.19 101.96 1x2g n GLY 273 Ca -0.05 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.78 1x2g n GLY 273 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1x2g s HIS 274 N -2.77 1.39 -0.06 1.61 3.76 -0.85 -0.62 115.29 117.74 1x2g s HIS 274 Ca 0.00 -0.50 -0.30 0.00 -0.15 0.00 0.00 55.06 54.12 1x2g s HIS 274 Cb 0.00 -0.75 -0.03 0.00 1.11 0.00 0.00 32.58 32.91 1x2g s HIS 274 CO 0.00 0.12 1.14 0.42 -0.85 0.00 0.00 174.74 175.57 1x2g s ILE 275 N -1.65 4.42 -0.13 0.60 1.01 0.14 -0.95 121.20 124.63 1x2g s ILE 275 Ca 0.04 1.72 0.20 0.00 0.00 0.00 0.00 60.65 62.61 1x2g s ILE 275 Cb -0.08 -4.11 -0.20 0.00 0.01 0.00 0.00 42.46 38.08 1x2g s ILE 275 CO 0.03 0.01 0.60 0.35 0.00 0.00 0.00 174.94 175.93 1x2g n THR 276 N 4.55 0.77 -3.62 2.92 -2.24 -0.41 -0.62 114.28 115.63 1x2g n THR 276 Ca 0.10 -0.64 -0.12 0.00 -2.27 0.00 0.00 64.05 61.12 1x2g n THR 276 Cb 0.47 -0.39 -0.07 0.00 -2.10 0.00 0.00 70.33 68.24 1x2g n THR 276 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x2g s ARG 277 N -3.09 0.70 -0.03 -0.78 1.70 -1.25 -4.75 118.95 111.45 1x2g s ARG 277 Ca -0.06 0.72 -0.14 0.00 -0.47 0.00 0.00 55.73 55.78 1x2g s ARG 277 Cb 0.10 0.34 0.02 0.00 -0.57 0.00 0.00 34.95 34.84 1x2g s ARG 277 CO 0.84 -0.11 0.30 0.00 -1.08 0.00 0.00 175.30 175.25 1x2g s ALA 278 N 0.09 -0.74 -0.08 7.88 0.00 -1.26 -1.66 121.76 125.99 1x2g s ALA 278 Ca 0.00 0.36 -0.05 0.00 0.00 0.00 0.00 51.96 52.28 1x2g s ALA 278 Cb -0.04 0.00 0.03 0.00 0.00 0.00 0.00 23.12 23.11 1x2g s ALA 278 CO -0.01 -0.24 0.19 -1.14 0.00 0.00 0.00 175.76 174.55 1x2g s GLN 279 N -1.14 0.17 -0.06 0.00 0.74 0.59 -4.96 119.66 114.99 1x2g s GLN 279 Ca -0.12 0.38 0.04 0.00 0.05 0.00 0.00 55.36 55.70 1x2g s GLN 279 Cb -0.05 -0.07 -0.02 0.00 1.10 0.00 0.00 33.01 33.97 1x2g s GLN 279 CO 0.04 -0.12 -0.17 0.08 -0.55 0.00 0.00 175.29 174.57 1x2g s VAL 280 N 0.83 2.80 0.11 1.34 1.01 -1.26 -0.34 120.40 124.88 1x2g s VAL 280 Ca -0.06 -0.80 0.10 0.00 0.00 0.00 0.00 61.98 61.21 1x2g s VAL 280 Cb -0.08 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 1x2g s VAL 280 CO -0.05 0.57 -0.24 -0.36 0.00 0.00 0.00 175.10 175.02 1x2g s PHE 281 N -0.40 2.10 0.09 5.22 0.08 -0.00 -4.92 117.98 120.15 1x2g s PHE 281 Ca 0.04 -0.40 -0.22 0.00 0.12 0.00 0.00 56.93 56.48 1x2g s PHE 281 Cb -0.12 -1.16 0.05 0.00 -0.57 0.00 0.00 43.02 41.22 1x2g s PHE 281 CO 0.02 0.26 0.53 -0.08 -0.10 0.00 0.00 175.22 175.85 1x2g s THR 282 N -1.06 0.03 -1.15 0.64 -1.32 0.63 -1.37 115.64 112.03 1x2g s THR 282 Ca 0.11 -0.23 0.13 0.00 -1.21 0.00 0.00 61.69 60.48 1x2g s THR 282 Cb -0.10 -1.02 0.34 0.00 -1.51 0.00 0.00 72.50 70.21 1x2g s THR 282 CO 0.05 -0.13 1.26 -0.90 -2.21 0.00 0.00 174.62 172.69 1x2g n ASP 283 N 0.10 3.00 -4.60 8.08 5.75 -1.22 -3.16 116.55 124.50 1x2g n ASP 283 Ca -0.18 -1.96 -0.42 0.00 -0.01 0.00 0.00 54.79 52.23 1x2g n ASP 283 Cb 0.62 -0.25 0.00 0.00 -1.03 0.00 0.00 41.12 40.47 1x2g n ASP 283 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1x2g n SER 284 N 0.71 1.16 0.14 -1.12 2.88 -1.26 -3.17 113.62 112.95 1x2g n SER 284 Ca 0.13 1.07 -0.00 0.00 -1.33 0.00 0.00 58.87 58.74 1x2g n SER 284 Cb 0.45 -1.32 0.27 0.00 -0.75 0.00 0.00 64.21 62.85 1x2g n SER 284 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1x2g h LEU 285 N 1.63 0.11 -7.50 2.46 3.38 -1.89 -0.87 115.31 112.62 1x2g h LEU 285 Ca -0.43 -0.04 -0.65 0.00 0.09 0.00 0.00 57.88 56.84 1x2g h LEU 285 Cb 1.34 -0.03 -0.40 0.00 0.09 0.00 0.00 40.66 41.66 1x2g h LEU 285 CO 0.58 0.53 -0.61 0.21 0.09 0.00 0.00 178.44 179.23 1x2g s ASN 286 N -6.90 4.58 0.16 -0.43 2.47 -1.26 -3.73 114.94 109.84 1x2g s ASN 286 Ca -0.03 -2.75 0.19 0.00 0.42 0.00 0.00 52.86 50.68 1x2g s ASN 286 Cb 0.14 -1.67 0.81 0.00 -1.45 0.00 0.00 41.25 39.07 1x2g s ASN 286 CO 0.75 -0.30 1.57 -2.65 -3.72 0.00 0.00 177.10 172.76 1x2g n PRO 287 N 3.49 0.11 -0.21 0.43 -0.02 -1.25 -4.36 135.00 133.19 1x2g n PRO 287 Ca 0.05 0.40 0.02 0.00 -2.02 0.00 0.00 63.50 61.95 1x2g n PRO 287 Cb 0.36 -1.73 0.13 0.00 -0.02 0.00 0.00 33.50 32.23 1x2g n PRO 287 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1x2g h ALA 288 N 2.29 0.76 -0.69 3.55 0.00 -1.94 -0.86 119.26 122.37 1x2g h ALA 288 Ca 0.00 0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.10 1x2g h ALA 288 Cb 0.26 0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1x2g h ALA 288 CO 0.00 -0.34 0.46 -1.35 0.00 0.00 0.00 179.25 178.02 1x2g h PRO 289 N 0.23 0.82 -0.11 0.00 0.11 -2.00 -1.20 132.00 129.85 1x2g h PRO 289 Ca 0.35 -0.05 -0.19 0.00 0.11 0.00 0.00 66.00 66.22 1x2g h PRO 289 Cb 0.55 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.47 1x2g h PRO 289 CO -0.46 0.54 -0.71 -0.07 -0.21 0.00 0.00 178.00 177.09 1x2g h LEU 290 N 0.84 0.58 -0.72 2.35 4.07 -1.48 0.16 115.31 121.12 1x2g h LEU 290 Ca 0.27 -0.37 -0.06 0.00 0.08 0.00 0.00 57.88 57.80 1x2g h LEU 290 Cb 0.04 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.58 1x2g h LEU 290 CO -0.07 1.12 0.22 -0.33 -1.08 0.00 0.00 178.44 178.29 1x2g h GLU 291 N 0.35 1.12 -0.24 1.13 5.08 -1.16 -0.55 114.58 120.30 1x2g h GLU 291 Ca -0.03 -0.24 -0.09 0.00 -1.00 0.00 0.00 59.36 57.99 1x2g h GLU 291 Cb 1.29 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.37 1x2g h GLU 291 CO 0.13 0.96 -0.22 0.00 -1.00 0.00 0.00 179.01 178.88 1x2g h ALA 292 N 1.11 0.35 -0.51 3.43 0.00 -1.14 -1.94 119.26 120.56 1x2g h ALA 292 Ca 0.23 -0.36 0.08 0.00 0.00 0.00 0.00 54.91 54.85 1x2g h ALA 292 Cb 0.31 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 1x2g h ALA 292 CO -0.01 0.30 0.14 1.25 0.00 0.00 0.00 179.25 180.94 1x2g h LEU 293 N 0.28 0.10 -0.69 0.00 5.85 -0.52 -1.08 115.31 119.26 1x2g h LEU 293 Ca 0.04 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.86 1x2g h LEU 293 Cb 0.77 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.84 1x2g h LEU 293 CO 0.06 0.08 0.43 0.00 -0.34 0.00 0.00 178.44 178.67 1x2g h ALA 294 N 1.37 0.89 -0.82 1.25 0.00 -0.91 -1.10 119.26 119.94 1x2g h ALA 294 Ca 0.25 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.20 1x2g h ALA 294 Cb 0.31 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 1x2g h ALA 294 CO -0.29 0.21 0.53 0.78 0.00 0.00 0.00 179.25 180.49 1x2g h GLY 295 N 0.85 1.14 1.85 0.00 0.00 -0.71 -2.50 103.07 103.70 1x2g h GLY 295 Ca 0.27 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.24 1x2g h GLY 295 CO -0.10 0.26 -0.13 3.21 0.00 0.00 0.00 176.54 179.78 1x2g h ARG 296 N 0.89 0.00 0.00 4.80 3.08 -0.61 -3.21 114.38 119.32 1x2g h ARG 296 Ca 0.35 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.37 1x2g h ARG 296 Cb 0.24 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1x2g h ARG 296 CO -0.13 0.00 -0.18 -0.07 -1.07 0.00 0.00 179.97 178.53 1x2g h LEU 297 N 0.00 0.00 -9.46 3.04 3.38 -0.75 -3.43 115.31 108.09 1x2g h LEU 297 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 1x2g h LEU 297 Cb 0.87 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.66 1x2g h LEU 297 CO 0.00 0.18 1.04 0.00 0.09 0.00 0.00 178.44 179.74 1x2g n GLN 298 N -3.25 2.52 -0.46 1.13 1.13 -1.21 -1.76 117.38 115.49 1x2g n GLN 298 Ca 0.01 0.92 0.00 0.00 -1.94 0.00 0.00 57.00 55.99 1x2g n GLN 298 Cb 0.47 -2.77 0.00 0.00 0.11 0.00 0.00 30.24 28.04 1x2g n GLN 298 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1x2g n GLY 299 N 4.09 1.47 3.77 1.08 0.00 0.21 -5.00 105.19 110.80 1x2g n GLY 299 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 1x2g n GLY 299 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x2g n LEU 301 N 0.29 4.22 -4.55 0.00 7.94 -1.26 0.26 117.00 123.91 1x2g n LEU 301 Ca 0.03 1.10 -0.43 0.00 -1.11 0.00 0.00 56.01 55.60 1x2g n LEU 301 Cb 0.43 -1.59 0.00 0.00 0.53 0.00 0.00 43.42 42.79 1x2g n LEU 301 CO 0.56 0.19 1.83 0.00 -1.11 0.00 0.00 177.39 178.87 1x2g n TYR 302 N 3.06 4.75 -3.66 1.96 9.36 0.20 -4.39 117.16 128.44 1x2g n TYR 302 Ca 0.12 -2.97 -0.11 0.00 3.32 0.00 0.00 57.90 58.25 1x2g n TYR 302 Cb 0.36 -2.52 -0.08 0.00 -0.63 0.00 0.00 39.34 36.47 1x2g n TYR 302 CO 0.00 0.00 0.00 0.50 0.22 0.00 0.00 176.86 177.58 1x2g s ARG 303 N 3.54 0.68 0.24 2.98 3.52 -1.26 -4.97 118.95 123.68 1x2g s ARG 303 Ca 0.51 0.96 -0.13 0.00 -0.13 0.00 0.00 55.73 56.94 1x2g s ARG 303 Cb 0.02 0.24 0.32 0.00 -1.56 0.00 0.00 34.95 33.97 1x2g s ARG 303 CO 0.06 -0.11 1.58 0.00 -0.81 0.00 0.00 175.30 176.01 1x2g h ALA 304 N 5.94 0.41 0.00 6.12 0.00 -1.89 -2.54 119.26 127.30 1x2g h ALA 304 Ca -0.30 0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1x2g h ALA 304 Cb 1.19 0.74 0.00 0.00 0.00 0.00 0.00 17.79 19.71 1x2g h ALA 304 CO 0.15 -0.48 0.00 -0.40 0.00 0.00 0.00 179.25 178.52 1x2g n ASP 305 N -5.52 0.00 0.00 0.00 5.75 -1.26 -1.69 116.55 113.82 1x2g n ASP 305 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.89 1x2g n ASP 305 Cb 0.42 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.51 1x2g n ASP 305 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1x2g n LEU 307 N 0.02 0.00 -0.09 -2.12 4.77 -0.96 -0.92 117.00 117.70 1x2g n LEU 307 Ca 0.00 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.92 1x2g n LEU 307 Cb 0.00 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.22 1x2g n LEU 307 CO 0.00 0.00 0.79 1.56 -1.33 0.00 0.00 177.39 178.41 1x2g h GLN 308 N 0.00 0.76 -0.51 3.23 4.20 -1.61 -1.77 115.11 119.42 1x2g h GLN 308 Ca 0.00 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.46 1x2g h GLN 308 Cb 0.00 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 1x2g h GLN 308 CO 0.00 0.85 0.31 0.37 -0.67 0.00 0.00 178.83 179.68 1x2g h GLN 309 N 0.69 0.69 -0.48 1.46 5.75 -1.27 -0.12 115.11 121.82 1x2g h GLN 309 Ca 0.12 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.52 1x2g h GLN 309 Cb 0.59 -0.14 -0.02 0.00 1.07 0.00 0.00 27.48 28.97 1x2g h GLN 309 CO 0.04 0.50 0.15 0.93 -2.65 0.00 0.00 178.83 177.80 1x2g h GLU 310 N 0.68 0.74 0.09 1.69 4.39 -1.79 -2.19 114.58 118.19 1x2g h GLU 310 Ca 0.18 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 1x2g h GLU 310 Cb -0.02 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.53 1x2g h GLU 310 CO -0.03 0.70 -0.04 0.00 -1.16 0.00 0.00 179.01 178.47 1x2g h GLU 312 N -0.22 0.00 0.00 0.00 5.08 -0.92 -1.92 114.58 116.60 1x2g h GLU 312 Ca -0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1x2g h GLU 312 Cb 0.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1x2g h GLU 312 CO 0.02 0.00 -0.09 0.00 -1.00 0.00 0.00 179.01 177.94 1x2g h ALA 313 N 2.20 1.06 0.00 3.43 0.00 -1.37 -2.43 119.26 122.15 1x2g h ALA 313 Ca 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1x2g h ALA 313 Cb 0.44 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1x2g h ALA 313 CO 0.00 0.11 -0.13 -0.07 0.00 0.00 0.00 179.25 179.16 1x2g h LEU 314 N 0.00 0.00 -0.88 0.00 3.38 -1.43 -3.37 115.31 113.01 1x2g h LEU 314 Ca -0.00 0.00 0.19 0.00 0.09 0.00 0.00 57.88 58.16 1x2g h LEU 314 Cb 0.49 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.13 1x2g h LEU 314 CO 0.01 0.13 0.41 -0.07 0.09 0.00 0.00 178.44 179.01 1x2g h LEU 315 N 0.00 0.41 -2.43 1.67 3.38 -1.58 -1.87 115.31 114.89 1x2g h LEU 315 Ca -0.00 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1x2g h LEU 315 Cb 1.05 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 1x2g h LEU 315 CO 0.02 0.09 -0.03 1.62 0.09 0.00 0.00 178.44 180.23 1x2g h VAL 316 N 0.49 0.42 -0.01 1.22 3.04 -1.80 -1.95 116.25 117.66 1x2g h VAL 316 Ca 0.52 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 66.09 1x2g h VAL 316 Cb 0.90 1.09 0.00 0.00 -2.01 0.00 0.00 31.29 31.27 1x2g h VAL 316 CO -0.46 0.03 -0.24 0.47 -1.01 0.00 0.00 177.57 176.35 1x2g n ASP 317 N -3.64 1.64 -3.17 3.17 8.00 -0.73 -4.55 116.55 117.27 1x2g n ASP 317 Ca -0.03 -1.32 -0.25 0.00 0.71 0.00 0.00 54.79 53.90 1x2g n ASP 317 Cb 0.12 0.39 -0.06 0.00 -0.02 0.00 0.00 41.12 41.55 1x2g n ASP 317 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1x2g n PHE 318 N 0.02 2.56 0.05 1.24 3.72 -0.74 -4.94 117.46 119.37 1x2g n PHE 318 Ca 0.06 -3.95 0.04 0.00 -0.05 0.00 0.00 57.45 53.55 1x2g n PHE 318 Cb 0.32 -0.48 0.44 0.00 -0.94 0.00 0.00 39.48 38.81 1x2g n PHE 318 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1x2g h PRO 319 N 3.51 0.43 0.00 -1.08 0.13 -1.79 -1.81 132.00 131.39 1x2g h PRO 319 Ca 0.14 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1x2g h PRO 319 Cb 0.69 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.73 1x2g h PRO 319 CO 0.71 0.33 0.00 0.39 -0.23 0.00 0.00 178.00 179.21 1x2g n GLU 320 N -4.44 0.08 -0.16 0.86 4.71 -1.26 -3.10 120.64 117.32 1x2g n GLU 320 Ca 0.02 0.16 0.09 0.00 -0.01 0.00 0.00 57.16 57.41 1x2g n GLU 320 Cb 0.10 -1.61 0.16 0.00 -1.01 0.00 0.00 31.44 29.08 1x2g n GLU 320 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1x2g n GLN 321 N -1.75 1.89 -0.29 3.49 3.00 -0.71 -4.78 117.38 118.24 1x2g n GLN 321 Ca 0.05 -2.54 0.01 0.00 -0.01 0.00 0.00 57.00 54.51 1x2g n GLN 321 Cb 0.30 -1.54 0.08 0.00 0.00 0.00 0.00 30.24 29.08 1x2g n GLN 321 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.06 178.55 1x2g h GLU 322 N 0.52 -0.03 -0.35 -1.09 4.22 -1.42 -2.24 114.58 114.18 1x2g h GLU 322 Ca 0.00 0.00 -0.07 0.00 0.08 0.00 0.00 59.36 59.37 1x2g h GLU 322 Cb 1.06 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 1x2g h GLU 322 CO 0.06 -0.02 -0.07 -0.22 -2.18 0.00 0.00 179.01 176.57 1x2g h LYS 323 N -0.03 0.66 -0.50 1.92 3.64 -1.88 -1.72 116.57 118.66 1x2g h LYS 323 Ca 0.36 -0.25 0.05 0.00 -1.27 0.00 0.00 60.65 59.54 1x2g h LYS 323 Cb 0.60 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.33 1x2g h LYS 323 CO -0.85 0.82 0.24 0.93 -2.27 0.00 0.00 179.45 178.33 1x2g h GLU 324 N 0.45 0.45 -0.40 1.90 3.07 -1.86 -1.63 114.58 116.57 1x2g h GLU 324 Ca 0.09 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 58.88 1x2g h GLU 324 Cb 0.57 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.36 1x2g h GLU 324 CO 0.03 0.30 0.07 -0.07 -1.40 0.00 0.00 179.01 177.94 1x2g h LEU 325 N 0.47 0.62 -0.97 1.33 3.38 -1.28 -0.16 115.31 118.70 1x2g h LEU 325 Ca 0.23 -0.25 0.11 0.00 0.09 0.00 0.00 57.88 58.05 1x2g h LEU 325 Cb 0.16 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 40.66 1x2g h LEU 325 CO -0.17 0.72 0.60 0.03 0.09 0.00 0.00 178.44 179.70 1x2g h ARG 326 N 0.50 0.94 0.01 1.13 3.08 -1.23 0.49 114.38 119.30 1x2g h ARG 326 Ca 0.12 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 1x2g h ARG 326 Cb 0.36 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.19 1x2g h ARG 326 CO 0.01 0.62 -0.00 0.93 -1.07 0.00 0.00 179.97 180.45 1x2g h GLU 327 N 0.97 -0.01 -0.73 0.04 5.08 -1.03 -0.68 114.58 118.21 1x2g h GLU 327 Ca 0.47 0.00 0.16 0.00 -1.00 0.00 0.00 59.36 59.00 1x2g h GLU 327 Cb 0.44 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 29.56 1x2g h GLU 327 CO -0.26 0.56 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.21 1x2g h LEU 328 N -0.59 -0.42 -0.01 1.33 3.38 -0.93 0.12 115.31 118.19 1x2g h LEU 328 Ca -0.00 0.20 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 1x2g h LEU 328 Cb 0.58 0.37 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 1x2g h LEU 328 CO 0.00 -0.19 0.00 -1.28 0.09 0.00 0.00 178.44 177.06 1x2g h SER 329 N 0.07 0.02 -0.87 -0.43 0.87 -0.81 -2.96 113.55 109.43 1x2g h SER 329 Ca 0.39 -0.23 0.06 0.00 -1.23 0.00 0.00 61.79 60.78 1x2g h SER 329 Cb 0.66 -0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.56 1x2g h SER 329 CO -0.67 0.24 0.55 0.00 -0.53 0.00 0.00 176.83 176.41 1x2g h ALA 330 N 0.78 1.20 0.00 6.23 0.00 -0.81 -1.96 119.26 124.69 1x2g h ALA 330 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1x2g h ALA 330 Cb 0.23 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1x2g h ALA 330 CO 0.00 0.31 0.00 1.87 0.00 0.00 0.00 179.25 181.43 1x2g n TRP 331 N -4.60 0.00 0.00 0.00 -0.00 0.40 -3.38 117.44 109.86 1x2g n TRP 331 Ca 0.12 -0.09 0.00 0.00 -0.00 0.00 0.00 57.50 57.54 1x2g n TRP 331 Cb 0.16 -0.10 0.00 0.00 -0.00 0.00 0.00 31.31 31.37 1x2g n TRP 331 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1x2g n ALA 333 N 0.70 0.00 0.03 5.87 0.00 -0.74 -1.49 120.51 124.89 1x2g n ALA 333 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1x2g n ALA 333 Cb 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.43 1x2g n ALA 333 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1x2g h GLY 334 N 0.00 0.12 1.91 0.00 0.00 -1.85 -3.39 103.07 99.86 1x2g h GLY 334 Ca 0.00 -0.31 -0.15 0.00 0.00 0.00 0.00 47.33 46.87 1x2g h GLY 334 CO 0.00 0.27 -0.77 0.00 0.00 0.00 0.00 176.54 176.04 1x2g h ALA 335 N 0.77 0.56 0.00 3.60 0.00 -1.57 -3.25 119.26 119.37 1x2g h ALA 335 Ca -0.20 -0.67 -0.01 0.00 0.00 0.00 0.00 54.91 54.03 1x2g h ALA 335 Cb 1.95 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.67 1x2g h ALA 335 CO 0.12 0.90 -0.05 0.28 0.00 0.00 0.00 179.25 180.51 1x2g h VAL 336 N 0.00 0.68 -0.01 0.00 2.07 -1.82 -3.51 116.25 113.66 1x2g h VAL 336 Ca -0.02 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1x2g h VAL 336 Cb 1.56 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 1x2g h VAL 336 CO 0.09 0.04 0.00 -2.11 0.02 0.00 0.00 177.57 175.61