#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h4h s LYS 2 N 0.00 3.60 -0.02 0.03 2.47 -1.26 -4.93 119.74 119.64 2h4h s LYS 2 Ca 0.00 0.24 0.17 0.00 -1.56 0.00 0.00 55.97 54.82 2h4h s LYS 2 Cb 0.00 -3.89 -0.19 0.00 -1.46 0.00 0.00 37.83 32.28 2h4h s LYS 2 CO 0.00 -1.13 0.60 -1.33 0.16 0.00 0.00 175.35 173.65 2h4h n MET 3 N 7.00 0.64 -0.22 4.03 2.81 -1.26 -4.12 117.12 126.00 2h4h n MET 3 Ca 0.06 0.13 0.02 0.00 -1.81 0.00 0.00 57.70 56.10 2h4h n MET 3 Cb 0.48 -1.71 0.12 0.00 -0.71 0.00 0.00 33.22 31.41 2h4h n MET 3 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 2h4h h LYS 4 N 0.00 0.14 -0.48 0.03 3.64 -1.95 0.32 116.57 118.27 2h4h h LYS 4 Ca -0.24 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.05 2h4h h LYS 4 Cb 1.69 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.47 2h4h h LYS 4 CO 0.04 0.09 -0.02 0.93 -2.27 0.00 0.00 179.45 178.23 2h4h h GLU 5 N 0.14 0.85 -0.11 1.90 3.07 -1.99 0.47 114.58 118.92 2h4h h GLU 5 Ca 0.35 -0.28 0.01 0.00 -0.50 0.00 0.00 59.36 58.94 2h4h h GLU 5 Cb 0.59 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.41 2h4h h GLU 5 CO -0.54 0.90 0.05 0.35 -1.40 0.00 0.00 179.01 178.37 2h4h h PHE 6 N 0.70 0.09 -0.71 4.33 3.57 -1.49 0.12 116.94 123.55 2h4h h PHE 6 Ca 0.13 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 2h4h h PHE 6 Cb 0.53 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 2h4h h PHE 6 CO 0.04 0.05 0.27 -0.07 -2.23 0.00 0.00 178.31 176.37 2h4h h LEU 7 N 0.11 0.97 0.34 0.59 3.38 0.02 0.66 115.31 121.38 2h4h h LEU 7 Ca 0.04 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 2h4h h LEU 7 Cb 0.01 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.51 2h4h h LEU 7 CO -0.03 0.88 -0.16 0.44 0.09 0.00 0.00 178.44 179.65 2h4h h ASP 8 N 1.03 -0.38 -0.36 -0.43 3.32 0.14 0.78 116.42 120.52 2h4h h ASP 8 Ca 0.24 -0.05 0.08 0.00 0.02 0.00 0.00 57.03 57.32 2h4h h ASP 8 Cb 0.22 0.10 -0.08 0.00 0.22 0.00 0.00 39.33 39.79 2h4h h ASP 8 CO -0.02 -0.20 -0.16 -0.07 -1.72 0.00 0.00 179.24 177.08 2h4h h LEU 9 N -0.55 -0.54 -0.49 1.55 3.38 -0.34 0.66 115.31 118.99 2h4h h LEU 9 Ca -0.05 0.13 0.04 0.00 0.09 0.00 0.00 57.88 58.09 2h4h h LEU 9 Cb 0.41 0.30 -0.04 0.00 0.09 0.00 0.00 40.66 41.42 2h4h h LEU 9 CO 0.08 -0.19 0.26 0.25 0.09 0.00 0.00 178.44 178.92 2h4h h LEU 10 N -0.10 0.39 -0.92 1.67 5.85 0.57 0.36 115.31 123.14 2h4h h LEU 10 Ca 0.18 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.83 2h4h h LEU 10 Cb 0.37 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 2h4h h LEU 10 CO -0.42 0.27 -0.41 0.78 -0.34 0.00 0.00 178.44 178.32 2h4h h ASN 11 N 0.52 0.00 0.11 1.25 2.35 0.16 -3.19 115.58 116.77 2h4h h ASN 11 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 2h4h h ASN 11 Cb 0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 2h4h h ASN 11 CO -0.13 0.41 -0.75 -0.62 -1.65 0.00 0.00 177.43 174.69 2h4h n GLU 12 N -3.59 0.29 -2.35 0.81 1.02 0.22 -4.95 120.64 112.09 2h4h n GLU 12 Ca -0.00 -0.23 -0.41 0.00 -0.02 0.00 0.00 57.16 56.50 2h4h n GLU 12 Cb 0.52 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.41 2h4h n GLU 12 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2h4h s SER 13 N -2.86 7.07 0.13 1.62 0.15 0.08 -4.93 113.70 114.96 2h4h s SER 13 Ca 0.12 2.30 0.01 0.00 0.70 0.00 0.00 55.95 59.08 2h4h s SER 13 Cb 0.17 -2.61 -0.11 0.00 -1.71 0.00 0.00 66.02 61.76 2h4h s SER 13 CO 0.76 -0.37 1.30 0.03 1.20 0.00 0.00 173.24 176.16 2h4h h ARG 14 N 4.84 0.20 -2.84 5.44 3.08 -1.90 -3.45 114.38 119.75 2h4h h ARG 14 Ca -0.45 -0.26 -0.19 0.00 0.07 0.00 0.00 59.98 59.14 2h4h h ARG 14 Cb 1.21 0.08 -0.31 0.00 0.08 0.00 0.00 29.97 31.04 2h4h h ARG 14 CO 0.73 1.03 -0.49 -1.17 -1.07 0.00 0.00 179.97 179.00 2h4h s LEU 15 N -7.29 -0.21 -0.06 3.04 0.20 -1.26 -4.94 118.68 108.17 2h4h s LEU 15 Ca -0.03 0.64 0.05 0.00 0.69 0.00 0.00 54.13 55.49 2h4h s LEU 15 Cb 0.09 0.82 -0.00 0.00 -0.43 0.00 0.00 46.19 46.66 2h4h s LEU 15 CO 0.84 -0.22 -0.22 -0.89 -0.29 0.00 0.00 176.35 175.57 2h4h s THR 16 N 2.19 1.81 0.15 3.68 2.01 -1.26 0.06 115.64 124.28 2h4h s THR 16 Ca -0.02 -0.91 0.08 0.00 0.31 0.00 0.00 61.69 61.15 2h4h s THR 16 Cb -0.12 -1.55 -0.04 0.00 0.01 0.00 0.00 72.50 70.81 2h4h s THR 16 CO -0.09 0.51 -0.18 0.54 -0.69 0.00 0.00 174.62 174.70 2h4h s VAL 17 N 0.05 1.77 0.10 3.82 0.11 0.26 0.10 120.40 126.62 2h4h s VAL 17 Ca -0.07 -1.85 0.10 0.00 -2.93 0.00 0.00 61.98 57.23 2h4h s VAL 17 Cb -0.14 -1.78 -0.04 0.00 -1.53 0.00 0.00 36.38 32.89 2h4h s VAL 17 CO 0.04 -0.28 -0.24 0.42 -3.33 0.00 0.00 175.10 171.71 2h4h s THR 18 N -1.92 2.41 -0.09 5.04 -4.23 -0.24 0.12 115.64 116.73 2h4h s THR 18 Ca 0.14 -1.59 0.03 0.00 -1.18 0.00 0.00 61.69 59.09 2h4h s THR 18 Cb -0.06 -2.05 0.01 0.00 1.34 0.00 0.00 72.50 71.74 2h4h s THR 18 CO 0.06 0.16 -0.17 -0.22 -0.54 0.00 0.00 174.62 173.92 2h4h s LEU 19 N -1.87 1.81 0.25 4.79 2.96 0.76 0.12 118.68 127.50 2h4h s LEU 19 Ca 0.14 -0.43 0.08 0.00 -0.22 0.00 0.00 54.13 53.71 2h4h s LEU 19 Cb -0.10 -1.10 -0.05 0.00 0.50 0.00 0.00 46.19 45.44 2h4h s LEU 19 CO 0.06 0.06 -0.12 0.42 -1.32 0.00 0.00 176.35 175.45 2h4h s THR 20 N 0.69 1.85 0.00 3.68 -4.23 0.12 -0.42 115.64 117.33 2h4h s THR 20 Ca -0.13 -2.22 0.00 0.00 -1.18 0.00 0.00 61.69 58.17 2h4h s THR 20 Cb -0.16 -2.24 0.00 0.00 1.34 0.00 0.00 72.50 71.44 2h4h s THR 20 CO 0.03 -0.45 0.00 0.61 -0.54 0.00 0.00 174.62 174.27 2h4h n GLY 21 N -0.50 3.97 0.33 3.99 0.00 -0.73 -0.95 105.19 111.30 2h4h n GLY 21 Ca -0.07 -1.63 0.18 0.00 0.00 0.00 0.00 46.02 44.50 2h4h n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h4h h ALA 22 N 1.04 1.51 -0.16 4.61 0.00 -1.78 -1.86 119.26 122.63 2h4h h ALA 22 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2h4h h ALA 22 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2h4h h ALA 22 CO 0.00 -0.17 0.02 0.78 0.00 0.00 0.00 179.25 179.88 2h4h h GLY 23 N 0.00 0.23 2.00 0.00 0.00 -1.04 -1.43 103.07 102.83 2h4h h GLY 23 Ca 0.04 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.26 2h4h h GLY 23 CO -0.00 0.10 0.00 1.19 0.00 0.00 0.00 176.54 177.83 2h4h h ILE 24 N 0.22 0.00 0.00 2.60 2.10 -1.43 -3.26 117.51 117.74 2h4h h ILE 24 Ca 0.05 -0.49 0.00 0.00 1.08 0.00 0.00 64.86 65.51 2h4h h ILE 24 Cb 0.12 1.40 0.00 0.00 -1.09 0.00 0.00 36.82 37.25 2h4h h ILE 24 CO -0.00 0.00 -1.08 -1.20 -1.08 0.00 0.00 178.15 174.79 2h4h n SER 25 N -2.71 0.83 -0.35 2.19 7.64 -0.57 -4.41 113.62 116.25 2h4h n SER 25 Ca 0.02 -0.77 0.11 0.00 1.01 0.00 0.00 58.87 59.24 2h4h n SER 25 Cb 0.33 1.17 0.30 0.00 -1.01 0.00 0.00 64.21 64.99 2h4h n SER 25 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2h4h h THR 26 N 0.00 0.79 0.00 0.44 1.35 -1.45 -0.94 112.91 113.10 2h4h h THR 26 Ca 0.00 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 2h4h h THR 26 Cb 0.53 -0.12 0.00 0.00 -1.73 0.00 0.00 68.15 66.83 2h4h h THR 26 CO 0.00 0.15 0.00 -2.65 -0.25 0.00 0.00 175.52 172.77 2h4h n PRO 27 N -4.69 0.13 -0.05 4.72 -0.02 -1.26 -0.40 135.00 133.42 2h4h n PRO 27 Ca 0.21 0.44 0.12 0.00 -2.02 0.00 0.00 63.50 62.25 2h4h n PRO 27 Cb 0.49 -1.78 0.41 0.00 -0.02 0.00 0.00 33.50 32.59 2h4h n PRO 27 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2h4h n SER 28 N -2.03 1.78 0.00 2.55 7.64 -0.37 -4.94 113.62 118.26 2h4h n SER 28 Ca 0.02 -1.66 0.00 0.00 1.01 0.00 0.00 58.87 58.23 2h4h n SER 28 Cb 0.16 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.29 2h4h n SER 28 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2h4h n GLY 29 N 1.18 0.84 3.41 0.23 0.00 0.47 -4.02 105.19 107.29 2h4h n GLY 29 Ca 0.17 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 2h4h n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h4h s ILE 30 N -2.00 4.25 0.34 -0.61 1.01 -1.15 -5.03 121.20 118.01 2h4h s ILE 30 Ca 0.00 -0.36 -0.29 0.00 0.00 0.00 0.00 60.65 60.01 2h4h s ILE 30 Cb 0.00 -3.07 -0.11 0.00 0.01 0.00 0.00 42.46 39.30 2h4h s ILE 30 CO 0.00 0.23 1.39 -2.84 0.00 0.00 0.00 174.94 173.72 2h4h s PRO 31 N 1.58 4.25 0.46 2.79 0.02 -1.26 -3.20 135.00 139.64 2h4h s PRO 31 Ca 0.05 2.36 -0.08 0.00 0.02 0.00 0.00 61.00 63.35 2h4h s PRO 31 Cb -0.16 -3.04 0.11 0.00 0.02 0.00 0.00 34.50 31.43 2h4h s PRO 31 CO 0.04 -0.34 0.63 -0.40 -0.33 0.00 0.00 177.00 176.59 2h4h n ASP 32 N 0.83 0.05 0.16 2.53 3.85 -1.26 -4.96 116.55 117.74 2h4h n ASP 32 Ca 0.01 -1.23 0.07 0.00 -0.71 0.00 0.00 54.79 52.94 2h4h n ASP 32 Cb 0.41 -0.48 0.07 0.00 -1.35 0.00 0.00 41.12 39.77 2h4h n ASP 32 CO 0.00 0.00 0.00 -0.26 -1.01 0.00 0.00 177.20 175.93 2h4h h PHE 33 N -1.36 0.00 -3.52 2.11 0.05 -1.95 -3.43 116.94 108.83 2h4h h PHE 33 Ca -0.20 0.00 -0.72 0.00 3.82 0.00 0.00 57.97 60.87 2h4h h PHE 33 Cb 0.56 0.00 -0.34 0.00 2.00 0.00 0.00 35.95 38.17 2h4h h PHE 33 CO 0.00 0.23 -0.18 0.50 -0.18 0.00 0.00 178.31 178.67 2h4h s ARG 34 N -3.12 3.00 0.00 1.51 6.06 -1.26 -4.98 118.95 120.16 2h4h s ARG 34 Ca 0.04 -2.79 0.00 0.00 -2.50 0.00 0.00 55.73 50.47 2h4h s ARG 34 Cb 0.07 -3.93 0.00 0.00 0.06 0.00 0.00 34.95 31.15 2h4h s ARG 34 CO 0.73 -1.22 0.00 0.41 -2.50 0.00 0.00 175.30 172.72 2h4h n GLY 35 N 3.14 -1.43 0.12 8.12 0.00 -1.26 -5.09 105.19 108.79 2h4h n GLY 35 Ca 0.14 0.62 -0.19 0.00 0.00 0.00 0.00 46.02 46.58 2h4h n GLY 35 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2h4h h PRO 36 N 0.00 0.36 -1.99 1.61 0.14 -1.93 -3.53 132.00 126.65 2h4h h PRO 36 Ca 0.00 -0.61 -0.01 0.00 0.14 0.00 0.00 66.00 65.52 2h4h h PRO 36 Cb 0.00 0.23 -0.21 0.00 0.14 0.00 0.00 31.00 31.16 2h4h h PRO 36 CO 0.00 1.27 0.08 1.21 0.14 0.00 0.00 178.00 180.70 2h4h s ASN 46 N -7.25 -0.84 0.31 1.44 3.84 -1.26 -5.20 114.94 105.98 2h4h s ASN 46 Ca -0.07 1.47 0.24 0.00 0.21 0.00 0.00 52.86 54.71 2h4h s ASN 46 Cb 0.06 1.43 1.13 0.00 -0.55 0.00 0.00 41.25 43.31 2h4h s ASN 46 CO 0.89 -0.24 1.73 -0.37 -2.79 0.00 0.00 177.10 176.32 2h4h h VAL 47 N 4.47 0.00 -0.53 -5.21 -1.51 -1.99 -1.08 116.25 110.40 2h4h h VAL 47 Ca -0.29 -0.14 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 2h4h h VAL 47 Cb 1.19 0.79 0.00 0.00 -2.13 0.00 0.00 31.29 31.15 2h4h h VAL 47 CO 0.10 0.00 0.00 0.49 -1.23 0.00 0.00 177.57 176.93 2h4h n PHE 48 N -2.32 1.35 -3.37 5.19 3.72 -1.26 -4.56 117.46 116.22 2h4h n PHE 48 Ca 0.00 -0.52 -0.38 0.00 -0.05 0.00 0.00 57.45 56.51 2h4h n PHE 48 Cb 0.15 -0.26 -0.06 0.00 -0.94 0.00 0.00 39.48 38.37 2h4h n PHE 48 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2h4h s ASP 49 N -0.78 6.80 0.35 4.37 1.01 -0.41 -0.34 116.67 127.66 2h4h s ASP 49 Ca 0.43 0.95 0.06 0.00 0.71 0.00 0.00 52.55 54.70 2h4h s ASP 49 Cb 0.29 -2.29 0.73 0.00 1.01 0.00 0.00 42.92 42.66 2h4h s ASP 49 CO 0.19 0.16 1.92 -0.29 0.21 0.00 0.00 175.17 177.35 2h4h h ILE 50 N 4.17 0.96 -0.26 0.77 6.09 -1.52 -1.06 117.51 126.67 2h4h h ILE 50 Ca -0.46 -0.27 -0.10 0.00 -1.37 0.00 0.00 64.86 62.66 2h4h h ILE 50 Cb 1.20 0.11 -0.01 0.00 0.47 0.00 0.00 36.82 38.59 2h4h h ILE 50 CO 0.69 0.14 -0.27 0.44 -3.07 0.00 0.00 178.15 176.08 2h4h h ASP 51 N 0.78 0.51 -0.19 2.19 3.32 -1.93 -1.78 116.42 119.32 2h4h h ASP 51 Ca 0.38 -0.18 -0.07 0.00 0.02 0.00 0.00 57.03 57.18 2h4h h ASP 51 Cb 0.42 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 2h4h h ASP 51 CO -0.15 0.77 -0.14 0.15 -1.72 0.00 0.00 179.24 178.15 2h4h h PHE 52 N 0.44 0.50 -0.42 4.55 3.57 -1.52 0.60 116.94 124.67 2h4h h PHE 52 Ca 0.06 -0.14 0.01 0.00 3.53 0.00 0.00 57.97 61.43 2h4h h PHE 52 Cb 0.70 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 2h4h h PHE 52 CO 0.02 0.76 0.27 0.35 -2.23 0.00 0.00 178.31 177.49 2h4h h PHE 53 N 0.10 0.51 -0.21 0.41 3.57 -1.03 0.20 116.94 120.49 2h4h h PHE 53 Ca 0.04 0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.40 2h4h h PHE 53 Cb 0.66 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 2h4h h PHE 53 CO 0.07 0.32 -0.49 1.88 -2.23 0.00 0.00 178.31 177.86 2h4h h TYR 54 N 0.55 0.70 -0.16 0.41 0.05 -1.29 -2.25 116.97 114.99 2h4h h TYR 54 Ca 0.16 -0.23 -0.16 0.00 0.05 0.00 0.00 58.73 58.55 2h4h h TYR 54 Cb -0.05 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 37.54 2h4h h TYR 54 CO -0.05 0.95 -0.56 0.77 -1.05 0.00 0.00 178.16 178.22 2h4h h SER 55 N 0.45 0.53 -1.98 3.88 0.02 -0.62 -3.39 113.55 112.43 2h4h h SER 55 Ca 0.02 -0.28 -0.51 0.00 -0.84 0.00 0.00 61.79 60.18 2h4h h SER 55 Cb 1.02 -0.15 -0.39 0.00 0.14 0.00 0.00 62.40 63.02 2h4h h SER 55 CO 0.09 0.97 -1.16 1.41 -1.14 0.00 0.00 176.83 177.01 2h4h n HIS 56 N -3.94 -0.04 0.24 3.45 8.25 0.68 -4.96 115.22 118.90 2h4h n HIS 56 Ca -0.03 -3.71 0.07 0.00 -0.26 0.00 0.00 57.72 53.79 2h4h n HIS 56 Cb 0.60 -0.38 0.58 0.00 1.12 0.00 0.00 29.99 31.91 2h4h n HIS 56 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2h4h h PRO 57 N 3.36 0.00 -0.11 -0.41 0.13 -1.58 -1.87 132.00 131.51 2h4h h PRO 57 Ca 0.09 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.13 2h4h h PRO 57 Cb 0.94 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.06 2h4h h PRO 57 CO 0.48 0.15 -0.33 1.05 -0.23 0.00 0.00 178.00 179.12 2h4h h GLU 58 N 0.00 0.23 -0.13 0.86 9.09 -1.87 -0.53 114.58 122.22 2h4h h GLU 58 Ca -0.00 -0.09 -0.14 0.00 0.05 0.00 0.00 59.36 59.18 2h4h h GLU 58 Cb 0.28 -0.01 0.01 0.00 -1.65 0.00 0.00 28.75 27.38 2h4h h GLU 58 CO 0.02 0.54 -0.48 0.93 0.05 0.00 0.00 179.01 180.07 2h4h h GLU 59 N 0.20 0.55 -0.66 1.06 4.39 -1.67 0.04 114.58 118.48 2h4h h GLU 59 Ca 0.03 -0.42 0.06 0.00 0.34 0.00 0.00 59.36 59.37 2h4h h GLU 59 Cb 0.69 0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 29.36 2h4h h GLU 59 CO 0.05 1.05 0.36 0.35 -1.16 0.00 0.00 179.01 179.66 2h4h h PHE 60 N 0.17 0.66 -0.11 4.33 3.57 -0.68 0.06 116.94 124.94 2h4h h PHE 60 Ca -0.02 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.33 2h4h h PHE 60 Cb 1.11 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.65 2h4h h PHE 60 CO 0.11 0.30 -0.67 1.88 -2.23 0.00 0.00 178.31 177.70 2h4h h TYR 61 N 0.66 0.58 -0.16 0.41 0.05 -1.06 0.11 116.97 117.56 2h4h h TYR 61 Ca 0.30 -0.24 0.05 0.00 0.05 0.00 0.00 58.73 58.89 2h4h h TYR 61 Cb 0.21 -0.10 -0.05 0.00 1.01 0.00 0.00 36.73 37.81 2h4h h TYR 61 CO -0.09 0.98 -0.16 -0.09 -1.05 0.00 0.00 178.16 177.75 2h4h h ARG 62 N 0.32 -0.18 -0.74 4.88 2.43 -0.64 -1.89 114.38 118.57 2h4h h ARG 62 Ca -0.02 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.23 2h4h h ARG 62 Cb 1.23 0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 30.76 2h4h h ARG 62 CO 0.12 -0.12 0.43 0.35 -1.51 0.00 0.00 179.97 179.24 2h4h h PHE 63 N -0.18 0.78 -0.84 2.20 3.57 -0.62 -2.84 116.94 119.01 2h4h h PHE 63 Ca 0.11 0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.77 2h4h h PHE 63 Cb 0.34 -0.24 -0.06 0.00 2.79 0.00 0.00 35.95 38.77 2h4h h PHE 63 CO -0.29 0.38 0.55 0.00 -2.23 0.00 0.00 178.31 176.72 2h4h h ALA 64 N 1.38 1.91 -0.72 2.41 0.00 0.01 0.27 119.26 124.51 2h4h h ALA 64 Ca 0.33 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.30 2h4h h ALA 64 Cb 0.20 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 2h4h h ALA 64 CO -0.19 -0.13 0.47 0.87 0.00 0.00 0.00 179.25 180.28 2h4h h LYS 65 N 0.62 0.77 0.10 0.00 1.79 -1.20 0.39 116.57 119.04 2h4h h LYS 65 Ca 0.42 -0.05 -0.35 0.00 -2.18 0.00 0.00 60.65 58.49 2h4h h LYS 65 Cb 0.73 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 31.18 2h4h h LYS 65 CO -0.17 0.51 -1.92 0.39 -1.08 0.00 0.00 179.45 177.18 2h4h n GLU 66 N -4.47 0.73 -0.00 3.15 -0.58 -0.52 -4.24 120.64 114.70 2h4h n GLU 66 Ca 0.10 0.30 0.04 0.00 -0.42 0.00 0.00 57.16 57.18 2h4h n GLU 66 Cb 0.19 -1.71 -0.06 0.00 -0.57 0.00 0.00 31.44 29.30 2h4h n GLU 66 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2h4h n GLY 67 N 1.92 -0.10 0.85 0.62 0.00 0.83 -4.44 105.19 104.87 2h4h n GLY 67 Ca -0.33 -0.21 -0.05 0.00 0.00 0.00 0.00 46.02 45.43 2h4h n GLY 67 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2h4h n ILE 68 N -1.52 0.51 -0.03 -0.61 5.41 0.31 -4.66 119.36 118.77 2h4h n ILE 68 Ca -0.00 0.03 -0.11 0.00 1.00 0.00 0.00 62.75 63.67 2h4h n ILE 68 Cb 0.18 -1.61 -0.05 0.00 -0.71 0.00 0.00 39.64 37.46 2h4h n ILE 68 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 2h4h h PHE 69 N -0.18 0.22 0.00 1.39 0.04 -0.60 -0.72 116.94 117.09 2h4h h PHE 69 Ca -0.10 -0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.67 2h4h h PHE 69 Cb 0.90 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.98 2h4h h PHE 69 CO -0.03 0.21 0.08 -2.30 -0.60 0.00 0.00 178.31 175.67 2h4h n PRO 70 N -4.93 0.00 0.17 1.51 -0.02 -1.26 -1.06 135.00 129.42 2h4h n PRO 70 Ca -0.04 0.43 0.10 0.00 -2.02 0.00 0.00 63.50 61.97 2h4h n PRO 70 Cb 0.07 -1.59 0.54 0.00 -0.02 0.00 0.00 33.50 32.50 2h4h n PRO 70 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 2h4h h MET 71 N 0.00 0.00 -0.10 -0.52 2.86 -1.39 -1.04 114.93 114.74 2h4h h MET 71 Ca 0.00 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.47 2h4h h MET 71 Cb 0.16 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 2h4h h MET 71 CO 0.00 0.00 -0.67 -0.07 1.06 0.00 0.00 176.91 177.23 2h4h h LEU 72 N 0.00 0.48 -0.79 1.22 3.38 -1.29 -1.74 115.31 116.57 2h4h h LEU 72 Ca 0.00 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2h4h h LEU 72 Cb 0.20 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2h4h h LEU 72 CO 0.00 1.02 0.00 0.00 0.09 0.00 0.00 178.44 179.55 2h4h n GLN 73 N -3.87 0.15 -2.42 1.13 6.02 -0.39 -4.84 117.38 113.16 2h4h n GLN 73 Ca -0.04 0.47 -0.41 0.00 -0.01 0.00 0.00 57.00 57.01 2h4h n GLN 73 Cb 0.67 -1.84 -0.04 0.00 1.02 0.00 0.00 30.24 30.06 2h4h n GLN 73 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2h4h s ALA 74 N -3.33 3.41 -0.02 -1.58 0.00 -0.66 -5.02 121.76 114.56 2h4h s ALA 74 Ca 0.02 0.91 -0.00 0.00 0.00 0.00 0.00 51.96 52.89 2h4h s ALA 74 Cb 0.08 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 2h4h s ALA 74 CO 0.30 -0.32 0.04 0.15 0.00 0.00 0.00 175.76 175.94 2h4h s LYS 75 N -0.30 2.98 0.70 0.00 1.02 -1.26 -5.02 119.74 117.86 2h4h s LYS 75 Ca 0.52 -0.49 -0.16 0.00 0.02 0.00 0.00 55.97 55.85 2h4h s LYS 75 Cb -0.32 -2.81 0.02 0.00 -0.52 0.00 0.00 37.83 34.21 2h4h s LYS 75 CO 0.36 0.66 1.25 -1.25 -0.92 0.00 0.00 175.35 175.45 2h4h s PRO 76 N -1.48 2.27 0.54 -1.68 0.04 -1.26 -4.48 135.00 128.94 2h4h s PRO 76 Ca 0.20 1.91 0.04 0.00 0.04 0.00 0.00 61.00 63.19 2h4h s PRO 76 Cb -0.12 -1.83 0.04 0.00 0.04 0.00 0.00 34.50 32.63 2h4h s PRO 76 CO 0.10 -1.78 0.34 0.27 0.04 0.00 0.00 177.00 175.98 2h4h n ASN 77 N -2.39 2.83 0.23 6.66 0.23 -1.26 -4.96 115.26 116.59 2h4h n ASN 77 Ca 0.15 -2.91 0.11 0.00 -0.53 0.00 0.00 54.58 51.40 2h4h n ASN 77 Cb 0.49 0.02 0.71 0.00 -2.08 0.00 0.00 39.78 38.92 2h4h n ASN 77 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 2h4h h LEU 78 N 0.00 0.00 -0.08 -4.53 5.85 -1.94 -0.74 115.31 113.86 2h4h h LEU 78 Ca -0.35 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.28 2h4h h LEU 78 Cb 1.25 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.29 2h4h h LEU 78 CO 0.56 0.00 -0.28 0.00 -0.34 0.00 0.00 178.44 178.39 2h4h h ALA 79 N 1.95 0.15 -0.67 1.25 0.00 -1.83 0.93 119.26 121.04 2h4h h ALA 79 Ca 0.04 -0.42 0.07 0.00 0.00 0.00 0.00 54.91 54.60 2h4h h ALA 79 Cb 0.17 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 2h4h h ALA 79 CO -0.00 0.16 0.36 0.45 0.00 0.00 0.00 179.25 180.22 2h4h h HIS 80 N -0.14 0.65 -0.58 0.00 3.86 -1.74 -1.93 115.15 115.28 2h4h h HIS 80 Ca -0.01 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.19 2h4h h HIS 80 Cb 0.90 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 29.15 2h4h h HIS 80 CO 0.12 0.29 0.24 0.28 0.86 0.00 0.00 177.93 179.72 2h4h h VAL 81 N 0.64 1.22 -0.95 2.45 2.07 -0.65 -1.74 116.25 119.30 2h4h h VAL 81 Ca 0.31 -0.69 0.02 0.00 0.82 0.00 0.00 66.70 67.16 2h4h h VAL 81 Cb 0.23 0.60 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 2h4h h VAL 81 CO -0.21 0.27 0.62 0.25 0.02 0.00 0.00 177.57 178.52 2h4h h LEU 82 N 0.79 1.06 -0.69 2.57 5.85 0.14 0.16 115.31 125.20 2h4h h LEU 82 Ca 0.19 -0.02 -0.12 0.00 0.84 0.00 0.00 57.88 58.78 2h4h h LEU 82 Cb 0.19 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 2h4h h LEU 82 CO -0.02 0.75 -0.23 -0.07 -0.34 0.00 0.00 178.44 178.54 2h4h h LEU 83 N 1.25 0.79 -0.38 2.25 3.38 -1.02 0.30 115.31 121.88 2h4h h LEU 83 Ca 0.36 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2h4h h LEU 83 Cb -0.09 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 2h4h h LEU 83 CO -0.09 0.99 0.19 0.00 0.09 0.00 0.00 178.44 179.61 2h4h h ALA 84 N 1.07 0.49 -0.61 1.53 0.00 -0.68 0.01 119.26 121.06 2h4h h ALA 84 Ca 0.09 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2h4h h ALA 84 Cb 0.74 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2h4h h ALA 84 CO 0.06 0.04 0.14 0.87 0.00 0.00 0.00 179.25 180.36 2h4h h LYS 85 N 0.47 0.95 -0.40 0.00 1.57 0.11 -0.40 116.57 118.88 2h4h h LYS 85 Ca 0.13 -0.21 -0.09 0.00 -1.87 0.00 0.00 60.65 58.61 2h4h h LYS 85 Cb 0.11 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 2h4h h LYS 85 CO -0.02 0.85 -0.12 -0.07 -0.57 0.00 0.00 179.45 179.53 2h4h h LEU 86 N 0.91 0.79 -0.37 2.94 3.38 -0.24 0.68 115.31 123.41 2h4h h LEU 86 Ca 0.19 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.81 2h4h h LEU 86 Cb 0.33 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2h4h h LEU 86 CO 0.00 0.98 0.22 -0.08 0.09 0.00 0.00 178.44 179.65 2h4h h GLU 87 N 0.59 0.43 -0.47 1.13 4.81 -0.81 0.21 114.58 120.47 2h4h h GLU 87 Ca 0.10 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 2h4h h GLU 87 Cb 0.65 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 2h4h h GLU 87 CO 0.04 0.28 0.22 1.05 -0.73 0.00 0.00 179.01 179.88 2h4h h GLU 88 N 0.44 0.65 -0.00 1.92 4.11 -0.70 -1.00 114.58 120.00 2h4h h GLU 88 Ca 0.14 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 59.50 2h4h h GLU 88 Cb -0.00 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.12 2h4h h GLU 88 CO -0.06 0.51 -0.01 1.63 0.07 0.00 0.00 179.01 181.15 2h4h n LYS 89 N -4.39 1.06 -1.00 1.06 5.02 0.20 -4.90 118.16 115.21 2h4h n LYS 89 Ca 0.04 -0.22 0.00 0.00 -2.02 0.00 0.00 58.31 56.10 2h4h n LYS 89 Cb 0.12 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.64 2h4h n LYS 89 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2h4h n GLY 90 N 1.09 0.45 0.03 0.72 0.00 -0.38 -4.91 105.19 102.19 2h4h n GLY 90 Ca 0.21 -0.50 0.11 0.00 0.00 0.00 0.00 46.02 45.85 2h4h n GLY 90 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2h4h n LEU 91 N 0.00 0.63 -4.15 0.99 4.77 0.59 -4.83 117.00 115.00 2h4h n LEU 91 Ca 0.00 0.01 -0.18 0.00 -0.03 0.00 0.00 56.01 55.81 2h4h n LEU 91 Cb 0.00 -0.12 -0.12 0.00 -2.33 0.00 0.00 43.42 40.84 2h4h n LEU 91 CO 0.00 0.04 -0.45 0.27 -1.33 0.00 0.00 177.39 175.92 2h4h s ILE 92 N -3.16 1.04 -0.07 -0.08 -4.36 -1.16 -4.63 121.20 108.77 2h4h s ILE 92 Ca 0.05 -1.23 -0.08 0.00 -0.26 0.00 0.00 60.65 59.13 2h4h s ILE 92 Cb 0.15 -1.00 -0.29 0.00 1.25 0.00 0.00 42.46 42.57 2h4h s ILE 92 CO 0.78 -0.21 0.59 -0.08 0.24 0.00 0.00 174.94 176.26 2h4h h GLU 93 N 4.42 0.32 -2.97 0.37 4.57 0.34 -3.39 114.58 118.24 2h4h h GLU 93 Ca -0.40 -0.55 0.00 0.00 -1.18 0.00 0.00 59.36 57.23 2h4h h GLU 93 Cb 1.19 0.21 -0.11 0.00 -0.16 0.00 0.00 28.75 29.88 2h4h h GLU 93 CO 0.41 1.23 0.23 0.00 -1.18 0.00 0.00 179.01 179.70 2h4h s ALA 94 N -2.58 -1.53 -0.26 2.92 0.00 -1.25 -4.79 121.76 114.28 2h4h s ALA 94 Ca -0.17 0.34 -0.06 0.00 0.00 0.00 0.00 51.96 52.08 2h4h s ALA 94 Cb 0.06 0.86 -0.00 0.00 0.00 0.00 0.00 23.12 24.04 2h4h s ALA 94 CO 0.83 -0.82 0.03 0.08 0.00 0.00 0.00 175.76 175.87 2h4h s VAL 95 N -3.76 3.76 -0.16 0.00 1.01 0.18 -1.07 120.40 120.37 2h4h s VAL 95 Ca 0.03 -0.53 -0.16 0.00 0.00 0.00 0.00 61.98 61.32 2h4h s VAL 95 Cb -0.02 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 2h4h s VAL 95 CO -0.09 0.26 0.38 -0.63 0.00 0.00 0.00 175.10 175.02 2h4h s ILE 96 N 1.51 5.24 0.03 2.22 1.01 0.33 0.51 121.20 132.05 2h4h s ILE 96 Ca 0.04 0.72 0.05 0.00 0.00 0.00 0.00 60.65 61.46 2h4h s ILE 96 Cb -0.16 -3.71 -0.02 0.00 0.01 0.00 0.00 42.46 38.58 2h4h s ILE 96 CO 0.00 0.34 -0.14 0.28 0.00 0.00 0.00 174.94 175.42 2h4h s THR 97 N 0.71 1.09 -1.62 2.92 -1.32 0.27 0.12 115.64 117.81 2h4h s THR 97 Ca 0.20 -0.92 0.26 0.00 -1.21 0.00 0.00 61.69 60.02 2h4h s THR 97 Cb -0.14 -0.98 0.19 0.00 -1.51 0.00 0.00 72.50 70.06 2h4h s THR 97 CO 0.07 0.05 1.49 0.00 -2.21 0.00 0.00 174.62 174.02 2h4h n GLN 98 N 2.04 0.69 -2.45 7.08 6.02 -0.12 -0.58 117.38 130.06 2h4h n GLN 98 Ca -0.17 -0.43 -0.35 0.00 -0.01 0.00 0.00 57.00 56.04 2h4h n GLN 98 Cb 0.55 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 30.29 2h4h n GLN 98 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2h4h s ASN 99 N -2.60 6.25 -0.04 1.08 0.01 -1.26 -4.61 114.94 113.76 2h4h s ASN 99 Ca 0.21 2.04 0.09 0.00 -0.71 0.00 0.00 52.86 54.48 2h4h s ASN 99 Cb 0.19 -2.57 0.22 0.00 0.41 0.00 0.00 41.25 39.49 2h4h s ASN 99 CO 0.57 -0.85 1.17 2.30 -1.51 0.00 0.00 177.10 178.77 2h4h n ILE 100 N -0.86 1.29 1.06 0.60 -5.35 -1.26 -4.71 119.36 110.13 2h4h n ILE 100 Ca 0.09 -1.28 0.11 0.00 -0.27 0.00 0.00 62.75 61.40 2h4h n ILE 100 Cb 0.51 0.30 0.09 0.00 -1.74 0.00 0.00 39.64 38.81 2h4h n ILE 100 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2h4h n ASP 101 N -0.26 1.43 -1.06 7.28 5.68 -1.26 -1.33 116.55 127.03 2h4h n ASP 101 Ca 0.09 -1.14 -0.14 0.00 -0.50 0.00 0.00 54.79 53.10 2h4h n ASP 101 Cb 0.45 0.48 -0.06 0.00 -1.14 0.00 0.00 41.12 40.85 2h4h n ASP 101 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2h4h n ARG 102 N -0.61 -1.28 0.17 0.11 5.12 -1.26 -4.87 116.66 114.03 2h4h n ARG 102 Ca 0.09 0.97 0.04 0.00 -1.93 0.00 0.00 57.85 57.02 2h4h n ARG 102 Cb 0.40 -5.20 0.26 0.00 -1.16 0.00 0.00 32.46 26.75 2h4h n ARG 102 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 2h4h h LEU 103 N 0.00 0.00 -0.50 0.55 3.38 -1.95 -0.41 115.31 116.38 2h4h h LEU 103 Ca -0.28 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.61 2h4h h LEU 103 Cb 1.06 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 2h4h h LEU 103 CO 0.42 0.44 0.01 0.45 0.09 0.00 0.00 178.44 179.84 2h4h h HIS 104 N 0.00 0.96 -0.48 1.13 3.86 -1.94 -0.66 115.15 118.02 2h4h h HIS 104 Ca -0.00 -0.16 -0.08 0.00 -1.16 0.00 0.00 60.37 58.96 2h4h h HIS 104 Cb 1.03 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 29.23 2h4h h HIS 104 CO 0.00 0.90 -0.03 1.96 0.86 0.00 0.00 177.93 181.62 2h4h h GLN 105 N 0.75 0.87 0.00 2.45 7.50 -1.70 0.29 115.11 125.27 2h4h h GLN 105 Ca 0.14 -0.29 -0.00 0.00 0.50 0.00 0.00 58.65 59.00 2h4h h GLN 105 Cb 0.51 -0.07 -0.00 0.00 0.05 0.00 0.00 27.48 27.97 2h4h h GLN 105 CO 0.02 0.93 -0.02 0.00 -1.50 0.00 0.00 178.83 178.27 2h4h h ARG 106 N 0.73 0.00 0.00 1.46 3.08 -0.56 -1.73 114.38 117.36 2h4h h ARG 106 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 2h4h h ARG 106 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.60 2h4h h ARG 106 CO 0.03 0.02 -0.14 0.00 -1.07 0.00 0.00 179.97 178.81 2h4h n ALA 107 N -2.39 2.45 0.00 0.04 0.00 -0.30 -4.78 120.51 115.53 2h4h n ALA 107 Ca -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2h4h n ALA 107 Cb 0.10 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.15 2h4h n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h4h n GLY 108 N 1.34 0.88 3.76 0.00 0.00 -0.65 -4.60 105.19 105.92 2h4h n GLY 108 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 2h4h n GLY 108 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2h4h s SER 109 N -1.89 6.93 -0.26 1.61 0.01 0.05 -4.83 113.70 115.32 2h4h s SER 109 Ca 0.00 2.52 -0.14 0.00 1.31 0.00 0.00 55.95 59.64 2h4h s SER 109 Cb 0.00 -2.64 -0.11 0.00 0.21 0.00 0.00 66.02 63.48 2h4h s SER 109 CO 0.00 -0.43 -0.35 0.29 0.41 0.00 0.00 173.24 173.16 2h4h n LYS 110 N 1.25 0.57 -3.11 12.44 4.76 -1.26 -4.25 118.16 128.56 2h4h n LYS 110 Ca 0.01 0.25 -0.45 0.00 -2.87 0.00 0.00 58.31 55.25 2h4h n LYS 110 Cb 0.43 -1.46 -0.02 0.00 -1.84 0.00 0.00 35.03 32.14 2h4h n LYS 110 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2h4h s LYS 111 N -2.55 3.72 -0.16 1.97 3.01 -1.26 -4.95 119.74 119.53 2h4h s LYS 111 Ca -0.37 -2.26 0.00 0.00 -1.01 0.00 0.00 55.97 52.34 2h4h s LYS 111 Cb 0.13 -4.73 0.01 0.00 -1.01 0.00 0.00 37.83 32.23 2h4h s LYS 111 CO 0.47 -1.55 -0.17 0.08 0.51 0.00 0.00 175.35 174.69 2h4h s VAL 112 N 1.27 2.46 -0.38 3.17 1.01 -1.26 0.50 120.40 127.18 2h4h s VAL 112 Ca 0.29 -0.83 -0.11 0.00 0.00 0.00 0.00 61.98 61.32 2h4h s VAL 112 Cb -0.07 -2.04 0.03 0.00 0.00 0.00 0.00 36.38 34.30 2h4h s VAL 112 CO -0.08 0.52 0.22 -0.63 0.00 0.00 0.00 175.10 175.13 2h4h s ILE 113 N 1.00 4.65 -0.74 2.22 1.01 0.18 -4.95 121.20 124.58 2h4h s ILE 113 Ca -0.02 -0.86 -0.21 0.00 0.00 0.00 0.00 60.65 59.56 2h4h s ILE 113 Cb -0.15 -3.61 0.09 0.00 0.01 0.00 0.00 42.46 38.80 2h4h s ILE 113 CO -0.04 -0.26 1.02 -1.61 0.00 0.00 0.00 174.94 174.05 2h4h s GLU 114 N 1.57 3.26 0.44 2.79 2.02 -1.26 0.95 118.70 128.46 2h4h s GLU 114 Ca 0.02 -1.11 0.12 0.00 0.02 0.00 0.00 54.97 54.02 2h4h s GLU 114 Cb -0.19 -4.45 1.01 0.00 0.10 0.00 0.00 34.13 30.59 2h4h s GLU 114 CO 0.07 -1.81 2.05 -0.07 0.02 0.00 0.00 175.26 175.52 2h4h h LEU 115 N 11.11 0.34 -2.96 1.80 3.38 -1.16 -3.07 115.31 124.75 2h4h h LEU 115 Ca -0.15 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 2h4h h LEU 115 Cb 1.06 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 2h4h h LEU 115 CO 1.17 0.23 -0.34 -1.22 0.09 0.00 0.00 178.44 178.37 2h4h n TYR 116 N -4.48 0.00 -4.37 1.13 0.53 -1.26 -4.48 117.16 104.23 2h4h n TYR 116 Ca 0.04 -1.20 0.00 0.00 -1.02 0.00 0.00 57.90 55.73 2h4h n TYR 116 Cb 0.19 -0.20 0.00 0.00 -1.03 0.00 0.00 39.34 38.30 2h4h n TYR 116 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2h4h n GLY 117 N -1.11 -0.15 3.72 2.72 0.00 -1.16 -0.94 105.19 108.27 2h4h n GLY 117 Ca 0.16 -1.01 -0.08 0.00 0.00 0.00 0.00 46.02 45.10 2h4h n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h4h s ASN 118 N -4.00 -0.27 0.00 1.61 2.20 -0.85 -4.23 114.94 109.40 2h4h s ASN 118 Ca 0.00 -0.57 0.20 0.00 -0.94 0.00 0.00 52.86 51.56 2h4h s ASN 118 Cb 0.00 0.67 0.56 0.00 -2.00 0.00 0.00 41.25 40.49 2h4h s ASN 118 CO 0.00 -1.23 1.47 1.33 -2.94 0.00 0.00 177.10 175.73 2h4h n VAL 119 N -0.42 0.82 0.10 3.54 0.24 -0.44 -3.50 118.33 118.68 2h4h n VAL 119 Ca -0.06 -0.85 0.06 0.00 -2.04 0.00 0.00 64.34 61.45 2h4h n VAL 119 Cb 0.61 0.48 0.00 0.00 -1.47 0.00 0.00 33.84 33.46 2h4h n VAL 119 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 2h4h h GLU 120 N 3.81 0.00 -5.91 7.34 5.08 -1.95 -3.42 114.58 119.53 2h4h h GLU 120 Ca 0.00 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.68 2h4h h GLU 120 Cb 0.87 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.97 2h4h h GLU 120 CO 0.00 0.19 -0.62 -1.21 -1.00 0.00 0.00 179.01 176.37 2h4h s GLU 121 N -3.12 3.06 0.09 2.33 2.02 -1.23 -1.36 118.70 120.49 2h4h s GLU 121 Ca 0.01 -0.40 0.01 0.00 0.02 0.00 0.00 54.97 54.60 2h4h s GLU 121 Cb 0.08 -2.82 -0.04 0.00 0.10 0.00 0.00 34.13 31.45 2h4h s GLU 121 CO 0.77 0.67 -0.04 0.71 0.02 0.00 0.00 175.26 177.39 2h4h s TYR 122 N -0.78 0.80 0.09 1.61 2.02 0.12 -0.09 117.35 121.11 2h4h s TYR 122 Ca 0.12 -0.99 -0.20 0.00 -0.37 0.00 0.00 57.07 55.62 2h4h s TYR 122 Cb -0.11 -0.49 0.05 0.00 -0.40 0.00 0.00 41.96 41.01 2h4h s TYR 122 CO 0.02 -0.25 0.49 1.52 -1.57 0.00 0.00 175.55 175.76 2h4h s TYR 123 N -3.75 -0.37 0.08 2.71 -0.85 0.28 0.20 117.35 115.64 2h4h s TYR 123 Ca 0.12 0.26 -0.31 0.00 -0.52 0.00 0.00 57.07 56.62 2h4h s TYR 123 Cb 0.06 0.35 -0.08 0.00 0.38 0.00 0.00 41.96 42.67 2h4h s TYR 123 CO -0.05 -0.69 1.56 0.00 -1.52 0.00 0.00 175.55 174.84 2h4h h VAL 125 N 4.63 1.03 0.01 0.00 3.04 -0.68 0.23 116.25 124.51 2h4h h VAL 125 Ca -0.42 -0.33 -0.00 0.00 -1.01 0.00 0.00 66.70 64.94 2h4h h VAL 125 Cb 1.20 -0.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.46 2h4h h VAL 125 CO 0.91 0.18 -0.00 -0.09 -1.01 0.00 0.00 177.57 177.56 2h4h h ARG 126 N 0.97 -0.01 0.00 4.17 9.65 -1.91 -3.40 114.38 123.85 2h4h h ARG 126 Ca 0.39 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.27 2h4h h ARG 126 Cb 0.27 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.85 2h4h h ARG 126 CO -0.16 -0.01 -0.50 0.00 2.80 0.00 0.00 179.97 182.11 2h4h n GLU 128 N -1.50 -0.63 -1.70 0.00 1.02 0.82 -4.93 120.64 113.71 2h4h n GLU 128 Ca 0.05 0.69 -0.43 0.00 -0.02 0.00 0.00 57.16 57.46 2h4h n GLU 128 Cb 0.34 -4.50 -0.03 0.00 -0.02 0.00 0.00 31.44 27.23 2h4h n GLU 128 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2h4h n LYS 129 N -2.51 2.74 -2.64 3.49 4.81 -1.26 -4.40 118.16 118.39 2h4h n LYS 129 Ca -0.07 0.99 -0.40 0.00 -0.87 0.00 0.00 58.31 57.96 2h4h n LYS 129 Cb 0.26 -2.85 -0.05 0.00 0.02 0.00 0.00 35.03 32.41 2h4h n LYS 129 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2h4h s LYS 130 N 1.84 4.75 0.08 1.64 1.02 -1.26 0.67 119.74 128.48 2h4h s LYS 130 Ca 0.78 1.61 0.04 0.00 0.02 0.00 0.00 55.97 58.43 2h4h s LYS 130 Cb -0.51 -3.26 -0.03 0.00 -0.52 0.00 0.00 37.83 33.51 2h4h s LYS 130 CO 0.35 0.36 -0.12 0.71 -0.92 0.00 0.00 175.35 175.73 2h4h s TYR 131 N -1.02 1.07 0.52 3.18 2.02 0.13 -4.92 117.35 118.33 2h4h s TYR 131 Ca 0.43 -0.53 -0.05 0.00 -0.37 0.00 0.00 57.07 56.55 2h4h s TYR 131 Cb -0.28 -0.60 -0.02 0.00 -0.40 0.00 0.00 41.96 40.67 2h4h s TYR 131 CO 0.35 0.02 0.81 0.95 -1.57 0.00 0.00 175.55 176.11 2h4h s THR 132 N -1.71 4.33 0.26 -0.71 -4.23 -1.26 0.13 115.64 112.45 2h4h s THR 132 Ca -0.01 0.03 -0.02 0.00 -1.18 0.00 0.00 61.69 60.51 2h4h s THR 132 Cb -0.07 -3.66 0.24 0.00 1.34 0.00 0.00 72.50 70.34 2h4h s THR 132 CO 0.01 -0.64 1.79 1.62 -0.54 0.00 0.00 174.62 176.87 2h4h h VAL 133 N 0.10 0.83 0.00 2.29 3.04 -1.48 -1.73 116.25 119.31 2h4h h VAL 133 Ca -0.46 -0.26 -0.13 0.00 -1.01 0.00 0.00 66.70 64.84 2h4h h VAL 133 Cb 1.23 0.02 -0.02 0.00 -2.01 0.00 0.00 31.29 30.51 2h4h h VAL 133 CO 0.61 0.14 -0.62 -0.33 -1.01 0.00 0.00 177.57 176.35 2h4h h GLU 134 N 0.74 0.00 -0.12 4.17 5.08 -1.94 0.50 114.58 123.01 2h4h h GLU 134 Ca 0.44 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.84 2h4h h GLU 134 Cb 0.52 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.72 2h4h h GLU 134 CO -0.30 0.62 -0.17 -0.44 -1.00 0.00 0.00 179.01 177.72 2h4h h ASP 135 N 0.00 -0.54 -0.72 1.42 3.32 -1.80 -0.88 116.42 117.22 2h4h h ASP 135 Ca -0.01 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 2h4h h ASP 135 Cb 1.13 0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.89 2h4h h ASP 135 CO 0.08 -0.22 0.42 0.58 -1.72 0.00 0.00 179.24 178.38 2h4h h VAL 136 N -0.22 1.21 -0.42 -1.35 2.07 -1.05 0.45 116.25 116.93 2h4h h VAL 136 Ca 0.09 -0.49 0.03 0.00 0.82 0.00 0.00 66.70 67.16 2h4h h VAL 136 Cb 0.36 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.32 2h4h h VAL 136 CO -0.25 0.22 0.21 0.40 0.02 0.00 0.00 177.57 178.17 2h4h h ILE 137 N 0.99 0.97 -0.18 4.57 2.04 -0.66 -0.16 117.51 125.08 2h4h h ILE 137 Ca 0.26 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.98 2h4h h ILE 137 Cb -0.01 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 2h4h h ILE 137 CO -0.05 0.08 0.12 0.11 0.00 0.00 0.00 178.15 178.41 2h4h h LYS 138 N 0.42 0.23 -0.83 2.37 1.57 -0.56 -2.64 116.57 117.14 2h4h h LYS 138 Ca 0.18 -0.01 0.10 0.00 -1.87 0.00 0.00 60.65 59.05 2h4h h LYS 138 Cb 0.09 -0.05 -0.08 0.00 0.08 0.00 0.00 32.23 32.27 2h4h h LYS 138 CO -0.13 0.15 0.46 0.87 -0.57 0.00 0.00 179.45 180.24 2h4h h LYS 139 N 0.24 0.73 0.00 3.15 1.57 -0.62 -0.85 116.57 120.80 2h4h h LYS 139 Ca 0.06 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2h4h h LYS 139 Cb -0.03 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.12 2h4h h LYS 139 CO -0.01 0.49 0.00 1.28 -0.57 0.00 0.00 179.45 180.63 2h4h n LEU 140 N -4.77 0.11 0.22 2.94 4.77 -0.10 -1.31 117.00 118.86 2h4h n LEU 140 Ca 0.14 0.53 0.11 0.00 -0.03 0.00 0.00 56.01 56.76 2h4h n LEU 140 Cb 0.31 -0.53 0.32 0.00 -2.33 0.00 0.00 43.42 41.20 2h4h n LEU 140 CO 0.26 -0.38 0.78 -0.33 -1.33 0.00 0.00 177.39 176.38 2h4h h GLU 141 N 0.00 0.00 0.00 3.23 5.08 -0.96 -3.35 114.58 118.59 2h4h h GLU 141 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2h4h h GLU 141 Cb 0.19 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 2h4h h GLU 141 CO 0.00 0.16 -1.24 -1.13 -1.00 0.00 0.00 179.01 175.80 2h4h n SER 142 N -3.20 3.85 -4.17 1.42 3.41 -0.84 -5.07 113.62 109.01 2h4h n SER 142 Ca 0.02 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.49 2h4h n SER 142 Cb 0.50 1.15 -0.11 0.00 -0.26 0.00 0.00 64.21 65.49 2h4h n SER 142 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2h4h s SER 143 N -2.71 1.40 0.33 4.04 0.15 -0.43 -5.04 113.70 111.43 2h4h s SER 143 Ca -0.02 -0.84 0.15 0.00 0.70 0.00 0.00 55.95 55.94 2h4h s SER 143 Cb 0.03 0.02 0.51 0.00 -1.71 0.00 0.00 66.02 64.87 2h4h s SER 143 CO 0.21 -0.29 1.67 -2.24 1.20 0.00 0.00 173.24 173.78 2h4h h ASP 144 N 3.47 0.00 -4.66 5.45 2.03 -1.86 -3.37 116.42 117.49 2h4h h ASP 144 Ca -0.37 0.00 -0.31 0.00 -0.73 0.00 0.00 57.03 55.62 2h4h h ASP 144 Cb 1.19 0.00 -0.21 0.00 -0.83 0.00 0.00 39.33 39.48 2h4h h ASP 144 CO 0.55 0.49 -0.74 0.68 -1.03 0.00 0.00 179.24 179.18 2h4h s VAL 145 N -3.57 0.72 0.10 4.15 -7.23 -1.26 -4.40 120.40 108.90 2h4h s VAL 145 Ca -0.00 -1.20 -0.30 0.00 -1.81 0.00 0.00 61.98 58.67 2h4h s VAL 145 Cb 0.12 -0.81 -0.06 0.00 0.56 0.00 0.00 36.38 36.19 2h4h s VAL 145 CO 0.72 -0.36 0.95 -2.16 -0.31 0.00 0.00 175.10 173.94 2h4h s PRO 146 N -1.76 4.68 -0.03 4.82 0.04 -1.26 -4.81 135.00 136.68 2h4h s PRO 146 Ca -0.06 1.43 0.07 0.00 0.04 0.00 0.00 61.00 62.48 2h4h s PRO 146 Cb -0.09 -3.38 -0.02 0.00 0.04 0.00 0.00 34.50 31.05 2h4h s PRO 146 CO 0.01 0.19 -0.25 -0.51 0.04 0.00 0.00 177.00 176.48 2h4h s LEU 147 N 0.09 2.05 0.41 -3.56 2.01 -1.26 -1.55 118.68 116.86 2h4h s LEU 147 Ca 0.47 -0.46 -0.25 0.00 0.01 0.00 0.00 54.13 53.90 2h4h s LEU 147 Cb -0.23 -1.29 -0.10 0.00 0.01 0.00 0.00 46.19 44.58 2h4h s LEU 147 CO 0.29 0.29 1.14 0.00 1.01 0.00 0.00 176.35 179.09 2h4h n ASP 149 N 0.40 0.59 -0.09 0.00 8.00 -1.26 -2.61 116.55 121.56 2h4h n ASP 149 Ca 0.08 0.54 -0.14 0.00 0.71 0.00 0.00 54.79 55.98 2h4h n ASP 149 Cb 0.39 -0.69 -0.06 0.00 -0.02 0.00 0.00 41.12 40.73 2h4h n ASP 149 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2h4h n ASP 150 N -2.04 1.87 -0.34 -2.24 9.92 -1.26 -4.65 116.55 117.80 2h4h n ASP 150 Ca 0.06 0.47 0.03 0.00 -0.53 0.00 0.00 54.79 54.82 2h4h n ASP 150 Cb 0.41 -0.87 0.08 0.00 -0.64 0.00 0.00 41.12 40.09 2h4h n ASP 150 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2h4h n ASN 152 N 0.14 -4.79 -4.71 0.00 5.15 -1.07 -4.97 115.26 105.01 2h4h n ASN 152 Ca 0.06 0.25 -0.27 0.00 -0.60 0.00 0.00 54.58 54.02 2h4h n ASN 152 Cb 0.31 -3.67 0.10 0.00 -0.53 0.00 0.00 39.78 36.00 2h4h n ASN 152 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2h4h s SER 153 N -2.14 4.30 0.18 1.20 0.01 -1.26 -4.49 113.70 111.50 2h4h s SER 153 Ca 0.00 0.36 -0.30 0.00 1.31 0.00 0.00 55.95 57.32 2h4h s SER 153 Cb 0.00 -0.81 -0.09 0.00 0.21 0.00 0.00 66.02 65.34 2h4h s SER 153 CO 0.00 -1.95 1.33 -0.22 0.41 0.00 0.00 173.24 172.81 2h4h s LEU 154 N -5.44 4.40 -0.06 2.44 2.96 -1.26 0.35 118.68 122.07 2h4h s LEU 154 Ca 0.64 2.39 -0.17 0.00 -0.22 0.00 0.00 54.13 56.77 2h4h s LEU 154 Cb -0.08 -3.60 -0.05 0.00 0.50 0.00 0.00 46.19 42.95 2h4h s LEU 154 CO 0.47 -0.56 0.46 -0.63 -1.32 0.00 0.00 176.35 174.77 2h4h s ILE 155 N 0.36 5.09 0.15 6.68 1.01 -0.59 0.08 121.20 133.96 2h4h s ILE 155 Ca 0.59 0.94 0.08 0.00 0.00 0.00 0.00 60.65 62.25 2h4h s ILE 155 Cb -0.37 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.28 2h4h s ILE 155 CO 0.36 0.44 -0.17 0.00 0.00 0.00 0.00 174.94 175.57 2h4h s ARG 156 N -0.13 1.18 0.52 2.79 1.70 0.15 -4.71 118.95 120.45 2h4h s ARG 156 Ca 0.25 -1.34 -0.20 0.00 -0.47 0.00 0.00 55.73 53.98 2h4h s ARG 156 Cb -0.16 -1.18 -0.07 0.00 -0.57 0.00 0.00 34.95 32.97 2h4h s ARG 156 CO 0.12 0.24 1.07 -1.25 -1.08 0.00 0.00 175.30 174.40 2h4h s PRO 157 N -2.73 3.59 -0.68 3.89 0.04 -1.26 0.98 135.00 138.83 2h4h s PRO 157 Ca 0.13 1.44 -0.06 0.00 0.04 0.00 0.00 61.00 62.55 2h4h s PRO 157 Cb -0.05 -2.06 -0.09 0.00 0.04 0.00 0.00 34.50 32.34 2h4h s PRO 157 CO 0.05 -0.62 3.08 -1.71 0.04 0.00 0.00 177.00 177.85 2h4h n ASN 158 N -1.19 6.77 -4.74 6.66 5.15 0.87 -4.78 115.26 124.01 2h4h n ASN 158 Ca 0.10 -2.78 -0.23 0.00 -0.60 0.00 0.00 54.58 51.08 2h4h n ASN 158 Cb 0.52 -1.40 -0.06 0.00 -0.53 0.00 0.00 39.78 38.31 2h4h n ASN 158 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2h4h s ILE 159 N 0.16 3.36 -0.29 -1.44 -4.36 -1.26 -2.00 121.20 115.37 2h4h s ILE 159 Ca 0.64 -1.66 -0.22 0.00 -0.26 0.00 0.00 60.65 59.15 2h4h s ILE 159 Cb 0.28 -3.03 -0.01 0.00 1.25 0.00 0.00 42.46 40.96 2h4h s ILE 159 CO -0.08 -0.24 0.71 -0.69 0.24 0.00 0.00 174.94 174.87 2h4h s VAL 160 N -2.35 4.89 0.52 8.37 1.01 -0.12 -4.91 120.40 127.81 2h4h s VAL 160 Ca 0.36 1.12 -0.09 0.00 0.00 0.00 0.00 61.98 63.37 2h4h s VAL 160 Cb -0.04 -4.05 -0.05 0.00 0.00 0.00 0.00 36.38 32.24 2h4h s VAL 160 CO 0.23 -0.13 0.89 -0.36 0.00 0.00 0.00 175.10 175.73 2h4h s PHE 161 N 2.73 3.56 0.30 5.22 0.08 -1.26 -4.92 117.98 123.69 2h4h s PHE 161 Ca 0.29 1.08 -0.30 0.00 0.12 0.00 0.00 56.93 58.13 2h4h s PHE 161 Cb -0.15 -2.52 -0.12 0.00 -0.57 0.00 0.00 43.02 39.66 2h4h s PHE 161 CO 0.11 -0.41 1.44 1.19 -0.10 0.00 0.00 175.22 177.45 2h4h n PHE 162 N -2.23 2.49 -0.04 0.36 3.72 0.54 -1.60 117.46 120.69 2h4h n PHE 162 Ca 0.03 0.41 0.00 0.00 -0.05 0.00 0.00 57.45 57.85 2h4h n PHE 162 Cb 0.54 -2.50 0.00 0.00 -0.94 0.00 0.00 39.48 36.59 2h4h n PHE 162 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2h4h n GLY 163 N 1.61 0.51 3.93 1.37 0.00 -1.26 -1.42 105.19 109.93 2h4h n GLY 163 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 2h4h n GLY 163 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2h4h s GLU 164 N -0.84 3.47 0.46 1.61 2.02 -0.63 -4.99 118.70 119.80 2h4h s GLU 164 Ca 0.00 -0.48 -0.20 0.00 0.02 0.00 0.00 54.97 54.31 2h4h s GLU 164 Cb 0.00 -2.93 -0.10 0.00 0.10 0.00 0.00 34.13 31.20 2h4h s GLU 164 CO 0.00 0.49 0.99 -0.80 0.02 0.00 0.00 175.26 175.96 2h4h s ASN 165 N -3.09 6.66 0.70 -0.19 -0.87 -1.26 -4.83 114.94 112.06 2h4h s ASN 165 Ca 0.36 1.78 -0.11 0.00 -1.57 0.00 0.00 52.86 53.32 2h4h s ASN 165 Cb -0.11 -2.55 0.01 0.00 -0.02 0.00 0.00 41.25 38.58 2h4h s ASN 165 CO 0.28 -0.55 1.07 -0.76 -2.57 0.00 0.00 177.10 174.57 2h4h s LEU 166 N -3.38 3.01 0.11 0.60 1.02 -1.26 -4.96 118.68 113.81 2h4h s LEU 166 Ca 0.64 1.46 -0.31 0.00 0.02 0.00 0.00 54.13 55.94 2h4h s LEU 166 Cb -0.12 -4.30 -0.10 0.00 0.02 0.00 0.00 46.19 41.69 2h4h s LEU 166 CO 0.17 -1.44 1.73 -2.16 0.02 0.00 0.00 176.35 174.68 2h4h s PRO 167 N -5.13 4.17 0.26 1.29 0.04 -1.26 -4.89 135.00 129.48 2h4h s PRO 167 Ca 0.58 2.47 -0.03 0.00 0.04 0.00 0.00 61.00 64.07 2h4h s PRO 167 Cb -0.13 -3.51 0.41 0.00 0.04 0.00 0.00 34.50 31.30 2h4h s PRO 167 CO 0.54 -0.77 1.86 -0.56 0.04 0.00 0.00 177.00 178.11 2h4h h GLN 168 N 8.19 1.03 -0.07 4.56 -0.00 -1.98 -2.32 115.11 124.51 2h4h h GLN 168 Ca -0.44 -0.06 -0.15 0.00 -0.00 0.00 0.00 58.65 58.00 2h4h h GLN 168 Cb 1.21 -0.23 0.01 0.00 -0.00 0.00 0.00 27.48 28.46 2h4h h GLN 168 CO 0.94 0.68 -0.53 -0.44 -0.00 0.00 0.00 178.83 179.48 2h4h h ASP 169 N 1.06 0.59 -0.40 0.06 3.32 -1.99 0.95 116.42 120.02 2h4h h ASP 169 Ca 0.43 -0.68 0.01 0.00 0.02 0.00 0.00 57.03 56.81 2h4h h ASP 169 Cb 0.24 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 2h4h h ASP 169 CO -0.20 1.18 0.26 0.00 -1.72 0.00 0.00 179.24 178.76 2h4h h ALA 170 N 0.43 0.51 -0.24 3.45 0.00 -1.91 0.10 119.26 121.59 2h4h h ALA 170 Ca -0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2h4h h ALA 170 Cb 1.20 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2h4h h ALA 170 CO 0.11 -0.05 0.07 1.25 0.00 0.00 0.00 179.25 180.63 2h4h h LEU 171 N 0.53 0.36 -1.06 0.00 5.85 -1.37 -0.53 115.31 119.10 2h4h h LEU 171 Ca 0.15 -0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.71 2h4h h LEU 171 Cb -0.05 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 40.83 2h4h h LEU 171 CO -0.04 0.48 0.63 0.03 -0.34 0.00 0.00 178.44 179.20 2h4h h ARG 172 N 0.22 1.13 -0.49 1.25 -0.00 -0.50 0.44 114.38 116.44 2h4h h ARG 172 Ca 0.08 -0.07 -0.07 0.00 -0.50 0.00 0.00 59.98 59.42 2h4h h ARG 172 Cb 0.26 -0.26 -0.02 0.00 0.00 0.00 0.00 29.97 29.95 2h4h h ARG 172 CO -0.00 0.75 0.03 1.49 0.00 0.00 0.00 179.97 182.24 2h4h h GLU 173 N 1.17 0.84 -0.27 0.04 4.81 -0.76 0.75 114.58 121.15 2h4h h GLU 173 Ca 0.40 -0.25 -0.02 0.00 -0.13 0.00 0.00 59.36 59.36 2h4h h GLU 173 Cb 0.10 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 2h4h h GLU 173 CO -0.14 0.87 0.09 0.00 -0.73 0.00 0.00 179.01 179.10 2h4h h ALA 174 N 0.94 0.36 -0.31 2.92 0.00 -0.72 0.94 119.26 123.39 2h4h h ALA 174 Ca 0.14 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2h4h h ALA 174 Cb 0.47 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2h4h h ALA 174 CO 0.02 -0.02 0.16 0.82 0.00 0.00 0.00 179.25 180.23 2h4h h ILE 175 N 0.28 1.00 -0.53 0.00 2.04 -0.85 -0.41 117.51 119.04 2h4h h ILE 175 Ca 0.09 -0.12 -0.07 0.00 1.00 0.00 0.00 64.86 65.76 2h4h h ILE 175 Cb 0.23 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 2h4h h ILE 175 CO -0.00 0.06 0.04 1.23 0.00 0.00 0.00 178.15 179.48 2h4h h GLY 176 N 0.34 0.94 1.33 5.37 0.00 -0.56 0.17 103.07 110.65 2h4h h GLY 176 Ca 0.13 -0.62 -0.22 0.00 0.00 0.00 0.00 47.33 46.62 2h4h h GLY 176 CO -0.08 0.57 -0.80 1.41 0.00 0.00 0.00 176.54 177.64 2h4h h LEU 177 N 0.82 0.78 -0.40 3.11 3.38 -0.70 -2.08 115.31 120.22 2h4h h LEU 177 Ca 0.16 -0.53 -0.05 0.00 0.09 0.00 0.00 57.88 57.55 2h4h h LEU 177 Cb 0.43 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2h4h h LEU 177 CO 0.02 1.31 0.04 0.28 0.09 0.00 0.00 178.44 180.18 2h4h h SER 178 N 0.43 0.65 -0.05 -0.43 0.02 -0.79 0.14 113.55 113.53 2h4h h SER 178 Ca -0.06 -0.28 -0.08 0.00 -0.84 0.00 0.00 61.79 60.54 2h4h h SER 178 Cb 1.42 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 63.77 2h4h h SER 178 CO 0.15 0.77 -0.18 0.77 -1.14 0.00 0.00 176.83 177.20 2h4h h SER 179 N 0.52 0.41 1.28 3.07 4.64 -0.59 -3.05 113.55 119.82 2h4h h SER 179 Ca 0.12 -0.11 -0.02 0.00 -0.47 0.00 0.00 61.79 61.31 2h4h h SER 179 Cb 0.40 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 2h4h h SER 179 CO 0.01 0.61 -0.73 0.03 -0.87 0.00 0.00 176.83 175.88 2h4h h ARG 180 N 0.38 0.00 -6.77 4.77 3.08 -1.19 -3.44 114.38 111.21 2h4h h ARG 180 Ca 0.07 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.59 2h4h h ARG 180 Cb 0.54 0.00 0.08 0.00 0.08 0.00 0.00 29.97 30.67 2h4h h ARG 180 CO 0.04 0.05 0.91 0.00 -1.07 0.00 0.00 179.97 179.89 2h4h s ALA 181 N -3.26 3.78 -0.84 0.04 0.00 0.02 -4.80 121.76 116.70 2h4h s ALA 181 Ca 0.02 1.56 0.27 0.00 0.00 0.00 0.00 51.96 53.81 2h4h s ALA 181 Cb 0.08 -3.65 0.86 0.00 0.00 0.00 0.00 23.12 20.41 2h4h s ALA 181 CO 0.76 -0.96 1.73 -1.13 0.00 0.00 0.00 175.76 176.16 2h4h n SER 182 N 2.57 0.48 -3.72 0.00 3.41 0.11 -3.84 113.62 112.64 2h4h n SER 182 Ca 0.10 0.40 -0.13 0.00 -0.26 0.00 0.00 58.87 58.99 2h4h n SER 182 Cb 0.37 -0.46 -0.13 0.00 -0.26 0.00 0.00 64.21 63.73 2h4h n SER 182 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2h4h s LEU 183 N -3.80 0.29 -0.11 1.04 2.96 -0.08 0.75 118.68 119.73 2h4h s LEU 183 Ca 0.11 0.53 0.01 0.00 -0.22 0.00 0.00 54.13 54.57 2h4h s LEU 183 Cb 0.15 0.73 -0.02 0.00 0.50 0.00 0.00 46.19 47.55 2h4h s LEU 183 CO 0.60 -0.18 -0.15 -0.32 -1.32 0.00 0.00 176.35 174.99 2h4h s MET 184 N 1.46 3.14 -0.23 1.98 -2.45 0.12 -0.57 119.30 122.76 2h4h s MET 184 Ca -0.07 -0.71 -0.00 0.00 -1.25 0.00 0.00 55.69 53.65 2h4h s MET 184 Cb -0.11 -2.54 0.03 0.00 1.25 0.00 0.00 34.83 33.46 2h4h s MET 184 CO -0.09 0.31 -0.11 0.42 1.05 0.00 0.00 175.02 176.60 2h4h s ILE 185 N 0.10 2.54 -0.10 10.11 1.01 0.33 0.11 121.20 135.30 2h4h s ILE 185 Ca -0.06 -1.05 -0.14 0.00 0.00 0.00 0.00 60.65 59.39 2h4h s ILE 185 Cb -0.15 -2.24 -0.05 0.00 0.01 0.00 0.00 42.46 40.03 2h4h s ILE 185 CO 0.05 0.29 0.34 -0.69 0.00 0.00 0.00 174.94 174.93 2h4h s VAL 186 N 1.29 5.22 -0.10 2.92 1.01 0.16 -0.17 120.40 130.73 2h4h s VAL 186 Ca 0.01 0.67 0.01 0.00 0.00 0.00 0.00 61.98 62.67 2h4h s VAL 186 Cb -0.16 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.58 2h4h s VAL 186 CO -0.07 0.46 -0.13 -0.76 0.00 0.00 0.00 175.10 174.60 2h4h s LEU 187 N -0.16 1.59 -0.85 3.92 1.02 0.44 0.14 118.68 124.78 2h4h s LEU 187 Ca 0.20 -0.37 -0.06 0.00 0.02 0.00 0.00 54.13 53.93 2h4h s LEU 187 Cb -0.14 -0.97 0.01 0.00 0.02 0.00 0.00 46.19 45.10 2h4h s LEU 187 CO 0.08 -0.01 0.74 0.61 0.02 0.00 0.00 176.35 177.79 2h4h n GLY 188 N 4.26 0.01 3.01 -3.19 0.00 0.54 -2.53 105.19 107.30 2h4h n GLY 188 Ca -0.19 -0.09 -0.17 0.00 0.00 0.00 0.00 46.02 45.57 2h4h n GLY 188 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2h4h s SER 189 N -3.21 0.87 0.27 1.61 0.15 -1.26 -0.42 113.70 111.71 2h4h s SER 189 Ca 0.37 -0.20 0.25 0.00 0.70 0.00 0.00 55.95 57.06 2h4h s SER 189 Cb -0.16 -0.07 0.61 0.00 -1.71 0.00 0.00 66.02 64.68 2h4h s SER 189 CO 0.46 0.04 1.67 0.77 1.20 0.00 0.00 173.24 177.38 2h4h h SER 190 N 5.71 0.00 -5.26 5.45 4.64 -1.95 -3.46 113.55 118.68 2h4h h SER 190 Ca -0.31 -0.02 -0.31 0.00 -0.47 0.00 0.00 61.79 60.69 2h4h h SER 190 Cb 1.19 0.00 0.14 0.00 -0.31 0.00 0.00 62.40 63.42 2h4h h SER 190 CO 0.48 0.01 -0.66 0.18 -0.87 0.00 0.00 176.83 175.97 2h4h n LEU 191 N -2.51 -3.66 0.00 5.97 4.77 -1.26 -4.15 117.00 116.15 2h4h n LEU 191 Ca 0.05 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.50 2h4h n LEU 191 Cb 0.46 -2.82 0.00 0.00 -2.33 0.00 0.00 43.42 38.74 2h4h n LEU 191 CO 0.32 0.40 0.09 1.33 -1.33 0.00 0.00 177.39 178.21 2h4h n VAL 192 N -4.04 0.00 -3.42 4.08 0.24 -1.26 -4.57 118.33 109.36 2h4h n VAL 192 Ca -0.19 -0.49 -0.40 0.00 -2.04 0.00 0.00 64.34 61.23 2h4h n VAL 192 Cb 0.63 1.01 -0.09 0.00 -1.47 0.00 0.00 33.84 33.91 2h4h n VAL 192 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2h4h s VAL 193 N -0.60 5.19 0.34 3.34 1.01 -1.26 -4.92 120.40 123.49 2h4h s VAL 193 Ca 0.00 0.22 -0.19 0.00 0.00 0.00 0.00 61.98 62.01 2h4h s VAL 193 Cb 0.00 -3.74 -0.10 0.00 0.00 0.00 0.00 36.38 32.54 2h4h s VAL 193 CO 0.00 0.03 0.82 -0.31 0.00 0.00 0.00 175.10 175.64 2h4h s TYR 194 N 2.00 3.43 -2.30 5.22 1.51 -1.26 -0.35 117.35 125.59 2h4h s TYR 194 Ca 0.12 1.41 0.28 0.00 -1.01 0.00 0.00 57.07 57.87 2h4h s TYR 194 Cb -0.16 -2.68 1.01 0.00 -0.11 0.00 0.00 41.96 40.02 2h4h s TYR 194 CO 0.11 0.08 1.72 -0.35 -1.11 0.00 0.00 175.55 176.01 2h4h n PRO 195 N -0.18 1.44 -0.14 -1.71 -0.04 -1.26 -4.86 135.00 128.26 2h4h n PRO 195 Ca 0.03 -0.82 0.01 0.00 -0.04 0.00 0.00 63.50 62.68 2h4h n PRO 195 Cb 0.53 -1.48 0.28 0.00 -0.04 0.00 0.00 33.50 32.79 2h4h n PRO 195 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2h4h h ALA 196 N 4.18 1.48 -0.22 0.55 0.00 -1.83 0.21 119.26 123.63 2h4h h ALA 196 Ca 0.00 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.89 2h4h h ALA 196 Cb 0.48 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2h4h h ALA 196 CO 0.00 0.45 0.21 0.00 0.00 0.00 0.00 179.25 179.91 2h4h h ALA 197 N 1.55 1.94 -0.00 0.00 0.00 -0.97 -1.91 119.26 119.87 2h4h h ALA 197 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2h4h h ALA 197 Cb -0.01 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2h4h h ALA 197 CO -0.04 -0.33 -0.19 0.39 0.00 0.00 0.00 179.25 179.09 2h4h n GLU 198 N -3.96 0.42 -0.09 0.00 1.02 0.06 -4.11 120.64 113.97 2h4h n GLU 198 Ca 0.02 -0.16 -0.10 0.00 -0.02 0.00 0.00 57.16 56.91 2h4h n GLU 198 Cb 0.35 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.25 2h4h n GLU 198 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2h4h h LEU 199 N 0.39 0.38 -1.65 -4.62 3.38 -1.42 -1.05 115.31 110.72 2h4h h LEU 199 Ca 0.00 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 57.87 2h4h h LEU 199 Cb 0.43 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2h4h h LEU 199 CO 0.00 0.39 0.25 -0.65 0.09 0.00 0.00 178.44 178.52 2h4h h PRO 200 N 0.35 0.45 -0.30 1.13 0.11 -1.77 -1.85 132.00 130.12 2h4h h PRO 200 Ca 0.10 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.05 2h4h h PRO 200 Cb 0.11 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 2h4h h PRO 200 CO -0.01 0.30 -0.36 1.25 -0.21 0.00 0.00 178.00 178.97 2h4h h LEU 201 N 0.47 0.71 -0.51 2.35 5.85 -1.61 -1.55 115.31 121.02 2h4h h LEU 201 Ca 0.15 -0.30 0.05 0.00 0.84 0.00 0.00 57.88 58.61 2h4h h LEU 201 Cb 0.02 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 2h4h h LEU 201 CO -0.03 1.00 0.26 0.40 -0.34 0.00 0.00 178.44 179.73 2h4h h ILE 202 N 0.57 0.95 -0.24 4.05 2.04 -0.50 0.14 117.51 124.52 2h4h h ILE 202 Ca 0.06 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 2h4h h ILE 202 Cb 0.88 0.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 2h4h h ILE 202 CO 0.08 0.09 0.13 0.74 0.00 0.00 0.00 178.15 179.18 2h4h h THR 203 N 0.50 1.12 -0.23 -0.27 2.02 -0.57 -0.38 112.91 115.10 2h4h h THR 203 Ca 0.23 -0.34 -0.04 0.00 0.77 0.00 0.00 66.41 67.03 2h4h h THR 203 Cb 0.14 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 2h4h h THR 203 CO -0.16 0.12 -0.03 0.58 0.37 0.00 0.00 175.52 176.40 2h4h h VAL 204 N 0.27 1.27 -0.26 3.16 2.07 -1.03 0.27 116.25 121.99 2h4h h VAL 204 Ca 0.08 -0.97 0.04 0.00 0.82 0.00 0.00 66.70 66.67 2h4h h VAL 204 Cb 0.08 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 2h4h h VAL 204 CO -0.01 0.30 0.18 0.03 0.02 0.00 0.00 177.57 178.09 2h4h h ARG 205 N 0.19 0.20 0.00 1.57 2.47 -0.48 -0.87 114.38 117.45 2h4h h ARG 205 Ca 0.06 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 2h4h h ARG 205 Cb 0.46 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.74 2h4h h ARG 205 CO 0.02 0.13 -0.11 0.43 0.56 0.00 0.00 179.97 181.00 2h4h n SER 206 N -4.49 0.32 0.00 7.04 7.64 -0.17 -4.91 113.62 119.04 2h4h n SER 206 Ca 0.02 0.40 0.00 0.00 1.01 0.00 0.00 58.87 60.30 2h4h n SER 206 Cb 0.19 -0.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 2h4h n SER 206 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2h4h n GLY 207 N 1.44 1.04 3.94 0.23 0.00 -0.33 -5.01 105.19 106.49 2h4h n GLY 207 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 2h4h n GLY 207 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2h4h s GLY 208 N -0.85 1.65 0.18 -0.02 0.00 0.91 -4.94 107.32 104.26 2h4h s GLY 208 Ca 0.00 -0.93 0.04 0.00 0.00 0.00 0.00 44.72 43.83 2h4h s GLY 208 CO 0.00 -0.65 0.27 0.54 0.00 0.00 0.00 173.10 173.26 2h4h s LYS 209 N -4.90 3.31 -0.06 2.90 1.02 0.23 -4.12 119.74 118.11 2h4h s LYS 209 Ca 0.54 -0.71 0.05 0.00 0.02 0.00 0.00 55.97 55.87 2h4h s LYS 209 Cb -0.10 -2.87 -0.01 0.00 -0.52 0.00 0.00 37.83 34.33 2h4h s LYS 209 CO 0.42 0.49 -0.22 -1.17 -0.92 0.00 0.00 175.35 173.95 2h4h s LEU 210 N -3.41 2.01 -0.08 3.17 2.96 -1.26 0.12 118.68 122.19 2h4h s LEU 210 Ca 0.34 -0.47 0.04 0.00 -0.22 0.00 0.00 54.13 53.82 2h4h s LEU 210 Cb -0.10 -1.25 -0.01 0.00 0.50 0.00 0.00 46.19 45.32 2h4h s LEU 210 CO 0.27 0.19 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.60 2h4h s VAL 211 N 0.04 2.44 -0.08 1.68 1.01 0.30 0.10 120.40 125.89 2h4h s VAL 211 Ca -0.08 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 61.01 2h4h s VAL 211 Cb -0.14 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 2h4h s VAL 211 CO 0.04 0.56 -0.17 -0.63 0.00 0.00 0.00 175.10 174.91 2h4h s ILE 212 N -0.10 2.74 -0.26 2.22 1.01 0.41 0.39 121.20 127.62 2h4h s ILE 212 Ca -0.04 -0.81 0.03 0.00 0.00 0.00 0.00 60.65 59.83 2h4h s ILE 212 Cb -0.14 -2.09 0.06 0.00 0.01 0.00 0.00 42.46 40.30 2h4h s ILE 212 CO 0.04 0.56 -0.11 -0.69 0.00 0.00 0.00 174.94 174.75 2h4h s VAL 213 N -0.12 2.20 -0.19 2.92 1.01 0.37 0.50 120.40 127.10 2h4h s VAL 213 Ca -0.02 -1.63 -0.28 0.00 0.00 0.00 0.00 61.98 60.04 2h4h s VAL 213 Cb -0.14 -2.30 0.10 0.00 0.00 0.00 0.00 36.38 34.04 2h4h s VAL 213 CO 0.04 -0.04 0.85 0.21 0.00 0.00 0.00 175.10 176.16 2h4h s ASN 214 N 1.10 -0.56 0.02 3.32 3.84 -0.31 -0.34 114.94 122.02 2h4h s ASN 214 Ca -0.09 0.87 -0.18 0.00 0.21 0.00 0.00 52.86 53.67 2h4h s ASN 214 Cb -0.20 0.80 -0.26 0.00 -0.55 0.00 0.00 41.25 41.04 2h4h s ASN 214 CO -0.05 -0.34 1.08 -0.07 -2.79 0.00 0.00 177.10 174.93 2h4h h LEU 215 N 3.70 0.66-10.76 3.21 3.38 -1.84 -3.25 115.31 110.41 2h4h h LEU 215 Ca -0.26 -0.80 -0.46 0.00 0.09 0.00 0.00 57.88 56.45 2h4h h LEU 215 Cb 1.16 -0.20 0.11 0.00 0.09 0.00 0.00 40.66 41.82 2h4h h LEU 215 CO 0.22 1.38 0.21 -0.83 0.09 0.00 0.00 178.44 179.51 2h4h s GLY 216 N -4.24 1.77 0.54 0.83 0.00 -1.26 -4.81 107.32 100.15 2h4h s GLY 216 Ca -0.12 -1.61 -0.20 0.00 0.00 0.00 0.00 44.72 42.80 2h4h s GLY 216 CO 0.86 -0.95 1.16 -0.54 0.00 0.00 0.00 173.10 173.63 2h4h s GLU 217 N -5.41 3.31 0.16 2.90 2.02 -1.26 -5.01 118.70 115.42 2h4h s GLU 217 Ca 0.69 1.70 0.07 0.00 0.02 0.00 0.00 54.97 57.45 2h4h s GLU 217 Cb -0.04 -2.05 -0.04 0.00 0.10 0.00 0.00 34.13 32.09 2h4h s GLU 217 CO 0.47 -0.90 -0.14 0.95 0.02 0.00 0.00 175.26 175.66 2h4h s THR 218 N -1.68 1.50 -1.26 3.63 -4.23 -1.26 -4.81 115.64 107.53 2h4h s THR 218 Ca 0.73 -1.97 0.04 0.00 -1.18 0.00 0.00 61.69 59.30 2h4h s THR 218 Cb -0.27 -1.80 0.05 0.00 1.34 0.00 0.00 72.50 71.83 2h4h s THR 218 CO 0.30 -0.52 1.01 -2.65 -0.54 0.00 0.00 174.62 172.21 2h4h n PRO 219 N 0.07 0.03 -0.16 3.99 -0.02 -1.26 -2.41 135.00 135.23 2h4h n PRO 219 Ca -0.12 0.33 0.05 0.00 -2.02 0.00 0.00 63.50 61.74 2h4h n PRO 219 Cb 0.59 -1.50 0.13 0.00 -0.02 0.00 0.00 33.50 32.70 2h4h n PRO 219 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2h4h n PHE 220 N -1.37 0.39 -0.26 6.00 3.72 -1.26 -4.66 117.46 120.02 2h4h n PHE 220 Ca 0.01 -0.58 0.14 0.00 -0.05 0.00 0.00 57.45 56.98 2h4h n PHE 220 Cb 0.03 -0.08 0.42 0.00 -0.94 0.00 0.00 39.48 38.92 2h4h n PHE 220 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2h4h h ASP 221 N 1.41 0.57 0.29 4.37 3.32 -1.89 -1.50 116.42 122.99 2h4h h ASP 221 Ca 0.00 0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 2h4h h ASP 221 Cb 0.79 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 2h4h h ASP 221 CO 0.03 0.26 -0.27 -2.24 -1.72 0.00 0.00 179.24 175.31 2h4h h ASP 222 N 0.59 0.00 -0.13 6.45 2.03 -1.85 -2.77 116.42 120.74 2h4h h ASP 222 Ca 0.46 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.76 2h4h h ASP 222 Cb 0.88 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.38 2h4h h ASP 222 CO -0.21 0.27 0.00 2.30 -1.03 0.00 0.00 179.24 180.57 2h4h n ILE 223 N -4.17 0.14 -2.56 4.15 -5.35 -0.59 -4.91 119.36 106.07 2h4h n ILE 223 Ca -0.02 -0.55 -0.41 0.00 -0.27 0.00 0.00 62.75 61.51 2h4h n ILE 223 Cb 0.32 1.26 -0.04 0.00 -1.74 0.00 0.00 39.64 39.44 2h4h n ILE 223 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2h4h s ALA 224 N -1.86 3.37 0.19 -1.28 0.00 -1.05 -4.45 121.76 116.68 2h4h s ALA 224 Ca 0.32 0.78 -0.05 0.00 0.00 0.00 0.00 51.96 53.01 2h4h s ALA 224 Cb 0.21 -3.31 0.10 0.00 0.00 0.00 0.00 23.12 20.12 2h4h s ALA 224 CO 0.31 -0.10 1.54 1.15 0.00 0.00 0.00 175.76 178.66 2h4h h THR 225 N 3.46 1.29 -3.77 0.00 2.02 0.33 -3.45 112.91 112.79 2h4h h THR 225 Ca -0.45 -1.57 -0.30 0.00 0.77 0.00 0.00 66.41 64.86 2h4h h THR 225 Cb 1.21 1.48 -0.29 0.00 -1.74 0.00 0.00 68.15 68.80 2h4h h THR 225 CO 0.70 0.51 -0.74 -0.76 0.37 0.00 0.00 175.52 175.60 2h4h s LEU 226 N -8.68 1.85 -0.09 2.58 1.43 -0.99 -5.03 118.68 109.75 2h4h s LEU 226 Ca -0.09 -0.05 0.03 0.00 -1.03 0.00 0.00 54.13 52.99 2h4h s LEU 226 Cb 0.12 -0.17 0.01 0.00 0.03 0.00 0.00 46.19 46.18 2h4h s LEU 226 CO 0.85 0.01 -0.17 -0.75 0.23 0.00 0.00 176.35 176.52 2h4h s LYS 227 N 0.14 2.30 -0.37 1.70 2.47 -1.26 -0.45 119.74 124.26 2h4h s LYS 227 Ca -0.01 -0.61 -0.07 0.00 -1.56 0.00 0.00 55.97 53.71 2h4h s LYS 227 Cb -0.04 -1.83 0.06 0.00 -1.46 0.00 0.00 37.83 34.56 2h4h s LYS 227 CO -0.00 0.06 0.17 0.71 0.16 0.00 0.00 175.35 176.45 2h4h s TYR 228 N 0.62 3.31 -1.25 4.03 2.02 0.18 -4.94 117.35 121.31 2h4h s TYR 228 Ca -0.14 -1.50 -0.15 0.00 -0.37 0.00 0.00 57.07 54.91 2h4h s TYR 228 Cb -0.16 -2.58 0.14 0.00 -0.40 0.00 0.00 41.96 38.95 2h4h s TYR 228 CO 0.04 -0.78 1.58 0.09 -1.57 0.00 0.00 175.55 174.92 2h4h n ASN 229 N 4.84 5.09 -3.52 2.29 3.02 -1.26 -1.16 115.26 124.57 2h4h n ASN 229 Ca -0.11 -2.96 -0.11 0.00 -0.03 0.00 0.00 54.58 51.37 2h4h n ASN 229 Cb 0.44 -1.63 -0.02 0.00 -0.61 0.00 0.00 39.78 37.96 2h4h n ASN 229 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2h4h s MET 230 N 2.39 1.34 0.31 3.52 0.23 -1.22 -4.88 119.30 120.98 2h4h s MET 230 Ca 0.46 -0.59 -0.30 0.00 -1.03 0.00 0.00 55.69 54.24 2h4h s MET 230 Cb 0.01 0.58 -0.11 0.00 -1.53 0.00 0.00 34.83 33.77 2h4h s MET 230 CO 0.02 -0.59 1.59 -3.47 -2.03 0.00 0.00 175.02 170.55 2h4h n ASP 231 N -0.38 3.90 -0.21 -1.18 2.03 -1.26 -4.00 116.55 115.45 2h4h n ASP 231 Ca -0.15 1.16 0.04 0.00 0.52 0.00 0.00 54.79 56.36 2h4h n ASP 231 Cb 0.64 -1.60 0.29 0.00 -0.72 0.00 0.00 41.12 39.73 2h4h n ASP 231 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2h4h h VAL 232 N 3.31 1.09 -0.31 5.18 -1.51 -1.91 0.57 116.25 122.67 2h4h h VAL 232 Ca -0.48 -0.31 -0.10 0.00 -1.23 0.00 0.00 66.70 64.58 2h4h h VAL 232 Cb 1.22 0.12 -0.01 0.00 -2.13 0.00 0.00 31.29 30.49 2h4h h VAL 232 CO 0.77 0.16 -0.21 0.58 -1.23 0.00 0.00 177.57 177.65 2h4h h VAL 233 N 0.90 1.30 -0.46 7.19 2.07 -1.93 -0.36 116.25 124.96 2h4h h VAL 233 Ca 0.31 -1.34 -0.10 0.00 0.82 0.00 0.00 66.70 66.39 2h4h h VAL 233 Cb 0.11 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 2h4h h VAL 233 CO -0.10 0.43 -0.13 -0.08 0.02 0.00 0.00 177.57 177.72 2h4h h GLU 234 N 0.45 0.84 -0.18 1.57 4.57 -1.83 0.11 114.58 120.11 2h4h h GLU 234 Ca 0.06 -0.30 0.00 0.00 -1.18 0.00 0.00 59.36 57.95 2h4h h GLU 234 Cb 0.75 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 2h4h h GLU 234 CO 0.06 0.92 0.12 0.35 -1.18 0.00 0.00 179.01 179.28 2h4h h PHE 235 N 0.76 0.23 -0.36 0.92 3.57 -0.74 0.21 116.94 121.52 2h4h h PHE 235 Ca 0.12 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.67 2h4h h PHE 235 Cb 0.63 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.26 2h4h h PHE 235 CO 0.04 0.16 0.13 0.00 -2.23 0.00 0.00 178.31 176.41 2h4h h ALA 236 N 1.06 0.42 -0.40 2.41 0.00 -0.76 0.23 119.26 122.22 2h4h h ALA 236 Ca 0.07 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.04 2h4h h ALA 236 Cb -0.01 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2h4h h ALA 236 CO -0.01 -0.26 0.21 -0.09 0.00 0.00 0.00 179.25 179.10 2h4h h ARG 237 N 0.29 0.42 -0.26 0.00 2.43 -0.16 -1.23 114.38 115.86 2h4h h ARG 237 Ca 0.16 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 2h4h h ARG 237 Cb 0.13 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 2h4h h ARG 237 CO -0.16 0.28 0.16 0.00 -1.51 0.00 0.00 179.97 178.74 2h4h h ARG 238 N 0.43 0.33 -0.88 0.20 2.47 -0.28 0.10 114.38 116.75 2h4h h ARG 238 Ca 0.16 -0.02 0.05 0.00 -1.26 0.00 0.00 59.98 58.91 2h4h h ARG 238 Cb 0.05 -0.07 -0.06 0.00 -1.65 0.00 0.00 29.97 28.24 2h4h h ARG 238 CO -0.10 0.22 0.56 0.28 0.56 0.00 0.00 179.97 181.49 2h4h h VAL 239 N 0.34 1.10 -0.27 2.04 2.07 -0.28 -0.27 116.25 120.98 2h4h h VAL 239 Ca 0.10 -0.36 -0.07 0.00 0.82 0.00 0.00 66.70 67.18 2h4h h VAL 239 Cb -0.03 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.68 2h4h h VAL 239 CO -0.03 0.19 -0.12 0.24 0.02 0.00 0.00 177.57 177.88 2h4h h MET 240 N 1.06 0.56 0.15 1.57 2.86 -0.68 0.23 114.93 120.68 2h4h h MET 240 Ca 0.37 -0.24 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 2h4h h MET 240 Cb 0.08 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.73 2h4h h MET 240 CO -0.14 0.80 -0.07 0.93 1.06 0.00 0.00 176.91 179.48 2h4h h GLU 241 N 0.30 -0.20 0.00 1.72 4.39 -0.45 0.84 114.58 121.18 2h4h h GLU 241 Ca 0.06 0.01 -0.11 0.00 0.34 0.00 0.00 59.36 59.66 2h4h h GLU 241 Cb 0.63 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.30 2h4h h GLU 241 CO 0.04 0.02 -0.54 0.93 -1.16 0.00 0.00 179.01 178.29 2h4h h GLU 242 N -0.39 0.00 -0.01 2.33 4.39 -1.05 -2.79 114.58 117.06 2h4h h GLU 242 Ca -0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2h4h h GLU 242 Cb 0.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2h4h h GLU 242 CO 0.03 0.54 -0.27 0.41 -1.16 0.00 0.00 179.01 178.57 2h4h n GLY 243 N 0.39 -0.61 2.23 -3.84 0.00 0.82 -4.92 105.19 99.26 2h4h n GLY 243 Ca -0.00 -0.41 -0.09 0.00 0.00 0.00 0.00 46.02 45.51 2h4h n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h4h n GLY 244 N 1.35 0.59 0.14 -0.02 0.00 -0.79 -4.88 105.19 101.58 2h4h n GLY 244 Ca 0.12 -0.56 0.08 0.00 0.00 0.00 0.00 46.02 45.66 2h4h n GLY 244 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2h4h h ILE 245 N 0.00 0.21 -0.01 -0.61 2.04 -0.73 -3.50 117.51 114.92 2h4h h ILE 245 Ca -0.20 -1.36 0.00 0.00 1.00 0.00 0.00 64.86 64.30 2h4h h ILE 245 Cb 0.86 1.85 0.00 0.00 -0.74 0.00 0.00 36.82 38.79 2h4h h ILE 245 CO 0.27 0.12 0.00 -1.20 0.00 0.00 0.00 178.15 177.34