#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p7i s ASN 22 N 0.00 3.08 0.21 7.72 3.04 -1.26 -4.78 114.94 122.94 2p7i s ASN 22 Ca 0.00 -0.62 -0.10 0.00 0.04 0.00 0.00 52.86 52.19 2p7i s ASN 22 Cb 0.00 -1.44 0.25 0.00 -1.54 0.00 0.00 41.25 38.52 2p7i s ASN 22 CO 0.00 0.03 1.78 0.15 -3.04 0.00 0.00 177.10 176.03 2p7i h PHE 23 N 7.67 0.57 -0.51 0.43 3.57 -1.93 0.28 116.94 127.02 2p7i h PHE 23 Ca -0.39 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.10 2p7i h PHE 23 Cb 1.16 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.72 2p7i h PHE 23 CO 0.47 0.24 0.21 -0.44 -2.23 0.00 0.00 178.31 176.55 2p7i h ASP 24 N 0.57 0.71 0.16 0.41 3.32 -1.96 -0.06 116.42 119.57 2p7i h ASP 24 Ca 0.30 -0.17 -0.21 0.00 0.02 0.00 0.00 57.03 56.97 2p7i h ASP 24 Cb 0.25 -0.18 0.02 0.00 0.22 0.00 0.00 39.33 39.64 2p7i h ASP 24 CO -0.22 0.69 -0.92 0.15 -1.72 0.00 0.00 179.24 177.22 2p7i h PHE 25 N 0.69 0.61 0.00 4.55 3.57 -1.93 -1.33 116.94 123.10 2p7i h PHE 25 Ca 0.17 -0.44 -0.20 0.00 3.53 0.00 0.00 57.97 61.03 2p7i h PHE 25 Cb 0.20 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 38.88 2p7i h PHE 25 CO 0.01 1.35 -1.52 -0.25 -2.23 0.00 0.00 178.31 175.66 2p7i n ASP 26 N -4.07 0.82 -0.68 0.41 8.00 0.97 -4.12 116.55 117.90 2p7i n ASP 26 Ca -0.14 0.37 0.06 0.00 0.71 0.00 0.00 54.79 55.79 2p7i n ASP 26 Cb 0.86 0.16 0.17 0.00 -0.02 0.00 0.00 41.12 42.29 2p7i n ASP 26 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2p7i n VAL 27 N -2.91 1.12 0.00 2.53 0.31 -0.04 -4.66 118.33 114.67 2p7i n VAL 27 Ca -0.12 -1.08 0.00 0.00 -0.01 0.00 0.00 64.34 63.13 2p7i n VAL 27 Cb 0.90 0.43 0.00 0.00 -0.91 0.00 0.00 33.84 34.26 2p7i n VAL 27 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 2p7i n HIS 29 N 0.45 0.00 -0.29 3.52 -0.00 -0.50 -2.92 115.22 115.48 2p7i n HIS 29 Ca 0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 57.72 57.83 2p7i n HIS 29 Cb 0.47 0.00 0.17 0.00 -0.00 0.00 0.00 29.99 30.63 2p7i n HIS 29 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2p7i h PRO 30 N 0.00 1.15 -1.81 -0.41 0.13 -1.83 -2.34 132.00 126.90 2p7i h PRO 30 Ca 0.00 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 65.04 2p7i h PRO 30 Cb 0.00 -0.25 0.00 0.00 0.13 0.00 0.00 31.00 30.88 2p7i h PRO 30 CO 0.00 0.78 0.00 1.19 -0.23 0.00 0.00 178.00 179.74 2p7i n PHE 31 N -4.38 0.00 0.00 1.56 3.72 -1.15 -1.34 117.46 115.87 2p7i n PHE 31 Ca 0.10 -0.32 0.00 0.00 -0.05 0.00 0.00 57.45 57.18 2p7i n PHE 31 Cb 0.04 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 38.32 2p7i n PHE 31 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2p7i n VAL 33 N 1.33 0.00 -0.14 -4.37 0.31 -0.88 -0.64 118.33 113.93 2p7i n VAL 33 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.29 2p7i n VAL 33 Cb 0.21 0.00 0.05 0.00 -0.91 0.00 0.00 33.84 33.19 2p7i n VAL 33 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 2p7i h ARG 34 N 0.00 0.27 -0.79 5.55 2.43 -1.49 -1.73 114.38 118.63 2p7i h ARG 34 Ca 0.00 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 2p7i h ARG 34 Cb 0.00 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.45 2p7i h ARG 34 CO 0.00 0.18 0.52 0.00 -1.51 0.00 0.00 179.97 179.16 2p7i h ALA 35 N 1.33 1.46 0.02 2.80 0.00 -1.15 -2.91 119.26 120.81 2p7i h ALA 35 Ca 0.22 -0.05 -0.20 0.00 0.00 0.00 0.00 54.91 54.88 2p7i h ALA 35 Cb 0.26 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2p7i h ALA 35 CO -0.26 0.49 -0.92 0.74 0.00 0.00 0.00 179.25 179.29 2p7i h PHE 36 N 1.04 0.16 -0.62 0.00 0.04 -1.73 -3.40 116.94 112.42 2p7i h PHE 36 Ca 0.30 -0.10 0.11 0.00 2.80 0.00 0.00 57.97 61.08 2p7i h PHE 36 Cb -0.08 -0.01 -0.08 0.00 2.20 0.00 0.00 35.95 37.97 2p7i h PHE 36 CO -0.00 0.96 0.16 1.15 -0.60 0.00 0.00 178.31 179.99 2p7i h THR 37 N 0.05 0.66 0.00 -1.55 2.02 -1.11 -0.30 112.91 112.68 2p7i h THR 37 Ca -0.03 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.04 2p7i h THR 37 Cb 1.60 0.33 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 2p7i h THR 37 CO 0.13 0.06 0.00 -0.65 0.37 0.00 0.00 175.52 175.43 2p7i h PRO 38 N 0.30 0.00 0.00 6.66 0.11 -1.77 -2.95 132.00 134.35 2p7i h PRO 38 Ca 0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.44 2p7i h PRO 38 Cb 0.48 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.59 2p7i h PRO 38 CO -0.39 0.00 -1.24 1.19 -0.21 0.00 0.00 178.00 177.35 2p7i n PHE 39 N -2.87 0.00 -1.66 0.65 3.72 -0.15 -5.00 117.46 112.16 2p7i n PHE 39 Ca -0.01 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 56.94 2p7i n PHE 39 Cb 0.15 -0.13 -0.02 0.00 -0.94 0.00 0.00 39.48 38.53 2p7i n PHE 39 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 2p7i n PHE 40 N -1.69 1.98 -3.61 1.38 3.72 -1.08 -4.99 117.46 113.17 2p7i n PHE 40 Ca 0.02 0.54 -0.32 0.00 -0.05 0.00 0.00 57.45 57.64 2p7i n PHE 40 Cb 0.38 -2.40 -0.05 0.00 -0.94 0.00 0.00 39.48 36.48 2p7i n PHE 40 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2p7i s ARG 41 N -1.06 3.67 0.52 -1.08 1.81 -1.26 -5.08 118.95 116.46 2p7i s ARG 41 Ca 0.63 0.01 -0.21 0.00 -1.72 0.00 0.00 55.73 54.44 2p7i s ARG 41 Cb -0.65 -2.81 -0.06 0.00 -0.45 0.00 0.00 34.95 30.98 2p7i s ARG 41 CO 0.56 0.44 1.19 -1.25 -0.68 0.00 0.00 175.30 175.55 2p7i s PRO 42 N -2.64 3.40 0.00 3.54 0.04 -1.26 -4.76 135.00 133.32 2p7i s PRO 42 Ca 0.42 1.79 0.00 0.00 0.04 0.00 0.00 61.00 63.25 2p7i s PRO 42 Cb -0.12 -2.17 0.00 0.00 0.04 0.00 0.00 34.50 32.25 2p7i s PRO 42 CO 0.23 -0.85 0.00 0.41 0.04 0.00 0.00 177.00 176.83 2p7i n GLY 43 N 0.41 0.19 3.92 0.56 0.00 -1.26 -4.88 105.19 104.14 2p7i n GLY 43 Ca 0.10 -1.62 -0.21 0.00 0.00 0.00 0.00 46.02 44.29 2p7i n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2p7i s ASN 44 N -4.00 5.02 0.02 1.61 2.20 -1.26 -4.81 114.94 113.72 2p7i s ASN 44 Ca 0.00 -0.85 0.02 0.00 -0.94 0.00 0.00 52.86 51.10 2p7i s ASN 44 Cb 0.00 -0.20 -0.01 0.00 -2.00 0.00 0.00 41.25 39.03 2p7i s ASN 44 CO 0.00 -0.89 -0.08 -0.22 -2.94 0.00 0.00 177.10 172.98 2p7i s LEU 45 N -4.28 2.12 -0.16 3.54 0.20 -0.68 -2.35 118.68 117.07 2p7i s LEU 45 Ca 0.48 -0.31 -0.00 0.00 0.69 0.00 0.00 54.13 54.99 2p7i s LEU 45 Cb -0.04 -0.31 -0.00 0.00 -0.43 0.00 0.00 46.19 45.41 2p7i s LEU 45 CO 0.29 -0.02 -0.14 -0.22 -0.29 0.00 0.00 176.35 175.96 2p7i s LEU 46 N -0.76 2.53 -0.36 -0.68 2.96 0.52 -1.06 118.68 121.82 2p7i s LEU 46 Ca -0.02 -0.45 -0.06 0.00 -0.22 0.00 0.00 54.13 53.38 2p7i s LEU 46 Cb -0.06 -1.58 0.05 0.00 0.50 0.00 0.00 46.19 45.11 2p7i s LEU 46 CO 0.00 0.09 0.14 -0.70 -1.32 0.00 0.00 176.35 174.56 2p7i s GLU 47 N 0.80 2.56 -0.24 1.98 2.12 0.87 -0.12 118.70 126.67 2p7i s GLU 47 Ca -0.05 -1.29 -0.21 0.00 0.36 0.00 0.00 54.97 53.78 2p7i s GLU 47 Cb -0.15 -3.52 -0.02 0.00 0.26 0.00 0.00 34.13 30.70 2p7i s GLU 47 CO 0.00 -0.75 0.65 -0.51 -0.54 0.00 0.00 175.26 174.11 2p7i s LEU 48 N 1.38 4.08 0.00 2.70 1.43 -0.52 -1.65 118.68 126.10 2p7i s LEU 48 Ca -0.00 0.77 0.00 0.00 -1.03 0.00 0.00 54.13 53.87 2p7i s LEU 48 Cb -0.20 -2.90 0.00 0.00 0.03 0.00 0.00 46.19 43.12 2p7i s LEU 48 CO 0.02 -0.36 0.00 0.61 0.23 0.00 0.00 176.35 176.85 2p7i n GLY 49 N 4.04 0.69 0.09 -3.19 0.00 0.71 -4.58 105.19 102.94 2p7i n GLY 49 Ca -0.00 -0.38 0.13 0.00 0.00 0.00 0.00 46.02 45.77 2p7i n GLY 49 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2p7i n SER 50 N -1.25 0.62 0.00 1.61 3.41 -0.99 -4.95 113.62 112.07 2p7i n SER 50 Ca 0.00 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 2p7i n SER 50 Cb 0.49 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 2p7i n SER 50 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2p7i n PHE 51 N -2.10 0.00 1.61 7.33 7.35 -1.26 -1.21 117.46 129.18 2p7i n PHE 51 Ca 0.05 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 56.88 2p7i n PHE 51 Cb 0.37 0.00 0.62 0.00 0.35 0.00 0.00 39.48 40.82 2p7i n PHE 51 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 2p7i n LYS 52 N 14.00 1.50 -0.38 -4.13 5.02 -1.26 -3.85 118.16 129.06 2p7i n LYS 52 Ca 0.00 -0.72 0.00 0.00 -2.02 0.00 0.00 58.31 55.57 2p7i n LYS 52 Cb 0.00 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 2p7i n LYS 52 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2p7i n GLY 53 N 1.12 0.80 0.36 0.72 0.00 -0.35 -3.25 105.19 104.58 2p7i n GLY 53 Ca 0.20 -0.09 -0.03 0.00 0.00 0.00 0.00 46.02 46.10 2p7i n GLY 53 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2p7i h ASP 54 N 0.00 1.08 0.68 1.61 3.32 -1.91 -2.55 116.42 118.66 2p7i h ASP 54 Ca 0.00 -0.10 -0.27 0.00 0.02 0.00 0.00 57.03 56.69 2p7i h ASP 54 Cb 0.00 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 2p7i h ASP 54 CO 0.00 0.88 -1.30 0.15 -1.72 0.00 0.00 179.24 177.24 2p7i h PHE 55 N 1.21 0.27 -0.97 4.55 3.57 -1.93 -3.31 116.94 120.33 2p7i h PHE 55 Ca 0.30 -0.20 0.09 0.00 3.53 0.00 0.00 57.97 61.70 2p7i h PHE 55 Cb 0.04 -0.01 -0.08 0.00 2.79 0.00 0.00 35.95 38.69 2p7i h PHE 55 CO 0.01 1.19 0.61 1.15 -2.23 0.00 0.00 178.31 179.04 2p7i h THR 56 N 0.04 0.98 -0.34 4.41 2.02 -1.81 -1.49 112.91 116.73 2p7i h THR 56 Ca -0.14 -0.35 -0.00 0.00 0.77 0.00 0.00 66.41 66.68 2p7i h THR 56 Cb 1.93 -0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 2p7i h THR 56 CO 0.15 0.19 0.21 0.77 0.37 0.00 0.00 175.52 177.21 2p7i h SER 57 N 1.03 0.40 0.07 4.18 4.64 -1.55 0.24 113.55 122.56 2p7i h SER 57 Ca 0.45 -0.01 -0.23 0.00 -0.47 0.00 0.00 61.79 61.53 2p7i h SER 57 Cb 0.34 -0.10 0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2p7i h SER 57 CO -0.23 0.30 -0.87 0.03 -0.87 0.00 0.00 176.83 175.19 2p7i h ARG 58 N 0.47 0.61 -0.15 4.77 3.08 -1.45 -3.16 114.38 118.55 2p7i h ARG 58 Ca 0.12 -0.57 -0.05 0.00 0.07 0.00 0.00 59.98 59.55 2p7i h ARG 58 Cb -0.03 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2p7i h ARG 58 CO -0.02 1.19 -0.14 -0.07 -1.07 0.00 0.00 179.97 179.85 2p7i h LEU 59 N 0.39 0.23 -2.54 3.04 3.38 -0.60 -2.64 115.31 116.58 2p7i h LEU 59 Ca -0.07 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 2p7i h LEU 59 Cb 1.50 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.19 2p7i h LEU 59 CO 0.17 0.40 -0.01 1.56 0.09 0.00 0.00 178.44 180.65 2p7i h GLN 60 N 0.23 0.00 0.00 1.13 4.20 -0.56 0.23 115.11 120.34 2p7i h GLN 60 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2p7i h GLN 60 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 2p7i h GLN 60 CO 0.02 0.01 0.00 0.93 -0.67 0.00 0.00 178.83 179.13 2p7i h GLU 61 N 0.00 0.00 0.00 1.46 4.39 -1.54 -3.30 114.58 115.59 2p7i h GLU 61 Ca -0.00 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 2p7i h GLU 61 Cb 0.05 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.69 2p7i h GLU 61 CO 0.00 0.00 -1.38 0.72 -1.16 0.00 0.00 179.01 177.19 2p7i n HIS 62 N -2.33 0.00 -3.86 4.33 8.25 0.71 -5.02 115.22 117.30 2p7i n HIS 62 Ca 0.01 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.33 2p7i n HIS 62 Cb 0.19 -0.22 -0.15 0.00 1.12 0.00 0.00 29.99 30.93 2p7i n HIS 62 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2p7i s PHE 63 N -2.41 0.08 -0.52 4.41 0.08 -0.69 -5.03 117.98 113.90 2p7i s PHE 63 Ca -0.03 0.05 0.24 0.00 0.12 0.00 0.00 56.93 57.30 2p7i s PHE 63 Cb 0.04 -0.16 0.26 0.00 -0.57 0.00 0.00 43.02 42.59 2p7i s PHE 63 CO 0.30 -0.05 1.28 -2.95 -0.10 0.00 0.00 175.22 173.70 2p7i h ASN 64 N 6.72 0.00 -3.97 1.36 7.08 -1.89 -3.39 115.58 121.49 2p7i h ASN 64 Ca -0.35 -0.13 -0.65 0.00 -3.08 0.00 0.00 56.30 52.08 2p7i h ASN 64 Cb 1.16 0.00 -0.40 0.00 -2.08 0.00 0.00 38.32 37.00 2p7i h ASN 64 CO 0.49 0.07 -0.67 -0.62 -2.08 0.00 0.00 177.43 174.62 2p7i s ASP 65 N -4.69 4.61 -0.05 6.14 -1.08 -1.26 -4.56 116.67 115.77 2p7i s ASP 65 Ca 0.05 -2.52 0.05 0.00 -0.52 0.00 0.00 52.55 49.61 2p7i s ASP 65 Cb 0.12 -1.65 -0.01 0.00 -1.46 0.00 0.00 42.92 39.93 2p7i s ASP 65 CO 0.73 -0.32 -0.21 -0.63 0.52 0.00 0.00 175.17 175.26 2p7i s ILE 66 N 0.41 1.75 -0.10 4.11 1.01 -0.95 -1.69 121.20 125.75 2p7i s ILE 66 Ca 0.13 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 59.91 2p7i s ILE 66 Cb -0.22 -1.50 -0.01 0.00 0.01 0.00 0.00 42.46 40.74 2p7i s ILE 66 CO -0.05 0.49 -0.17 -0.89 0.00 0.00 0.00 174.94 174.33 2p7i s THR 67 N -0.02 2.76 -0.14 2.92 2.01 -0.22 -0.46 115.64 122.48 2p7i s THR 67 Ca -0.05 -0.78 0.01 0.00 0.31 0.00 0.00 61.69 61.18 2p7i s THR 67 Cb -0.13 -2.11 0.02 0.00 0.01 0.00 0.00 72.50 70.28 2p7i s THR 67 CO 0.03 0.55 -0.17 0.00 -0.69 0.00 0.00 174.62 174.34 2p7i s VAL 69 N 1.22 3.88 -0.13 0.00 1.01 -0.66 -0.16 120.40 125.56 2p7i s VAL 69 Ca 0.00 -0.35 -0.10 0.00 0.00 0.00 0.00 61.98 61.54 2p7i s VAL 69 Cb -0.14 -2.73 0.04 0.00 0.00 0.00 0.00 36.38 33.55 2p7i s VAL 69 CO -0.08 0.45 0.34 -0.70 0.00 0.00 0.00 175.10 175.12 2p7i s GLU 70 N 0.80 0.36 0.18 2.72 2.56 -0.79 -0.21 118.70 124.31 2p7i s GLU 70 Ca -0.00 0.57 0.11 0.00 0.00 0.00 0.00 54.97 55.64 2p7i s GLU 70 Cb -0.14 0.07 -0.10 0.00 2.00 0.00 0.00 34.13 35.96 2p7i s GLU 70 CO 0.02 -0.10 1.32 0.00 -0.56 0.00 0.00 175.26 175.94 2p7i h ALA 71 N 6.33 0.50 -2.33 6.30 0.00 -1.83 -2.20 119.26 126.04 2p7i h ALA 71 Ca -0.32 -0.74 -0.60 0.00 0.00 0.00 0.00 54.91 53.25 2p7i h ALA 71 Cb 1.18 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.77 2p7i h ALA 71 CO 0.31 1.00 0.33 0.45 0.00 0.00 0.00 179.25 181.34 2p7i s SER 72 N -6.57 6.66 0.23 0.00 0.15 -1.26 -4.67 113.70 108.24 2p7i s SER 72 Ca 0.02 0.73 -0.08 0.00 0.70 0.00 0.00 55.95 57.32 2p7i s SER 72 Cb 0.09 -2.39 0.21 0.00 -1.71 0.00 0.00 66.02 62.22 2p7i s SER 72 CO 0.79 -0.52 1.90 -0.08 1.20 0.00 0.00 173.24 176.53 2p7i h GLU 73 N 7.97 1.14 0.29 5.44 4.81 -1.99 -1.00 114.58 131.25 2p7i h GLU 73 Ca -0.25 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 58.90 2p7i h GLU 73 Cb 1.10 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.23 2p7i h GLU 73 CO 0.85 0.75 -0.14 0.93 -0.73 0.00 0.00 179.01 180.67 2p7i h GLU 74 N 1.17 -0.37 -0.38 1.92 5.08 -1.99 -0.85 114.58 119.15 2p7i h GLU 74 Ca 0.32 0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.74 2p7i h GLU 74 Cb -0.12 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 2p7i h GLU 74 CO -0.08 -0.20 0.18 0.00 -1.00 0.00 0.00 179.01 177.92 2p7i h ALA 75 N 0.23 0.47 -0.03 3.43 0.00 -1.84 -1.86 119.26 119.67 2p7i h ALA 75 Ca -0.04 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2p7i h ALA 75 Cb 0.35 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2p7i h ALA 75 CO 0.06 -0.19 -0.32 0.97 0.00 0.00 0.00 179.25 179.78 2p7i h ILE 76 N 0.37 1.24 -0.17 0.00 2.10 -1.04 -1.18 117.51 118.82 2p7i h ILE 76 Ca 0.17 -1.13 -0.11 0.00 1.08 0.00 0.00 64.86 64.86 2p7i h ILE 76 Cb 0.09 1.58 0.00 0.00 -1.09 0.00 0.00 36.82 37.40 2p7i h ILE 76 CO -0.13 0.33 -0.33 -1.28 -1.08 0.00 0.00 178.15 175.66 2p7i h SER 77 N 0.04 0.59 -0.21 2.19 0.87 -0.74 -2.25 113.55 114.05 2p7i h SER 77 Ca 0.00 -0.55 0.03 0.00 -1.23 0.00 0.00 61.79 60.05 2p7i h SER 77 Cb 0.58 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.34 2p7i h SER 77 CO 0.04 1.03 -0.00 -0.74 -0.53 0.00 0.00 176.83 176.63 2p7i h HIS 78 N 0.17 -0.01 -0.32 2.24 -0.00 -0.88 -1.32 115.15 115.03 2p7i h HIS 78 Ca 0.01 0.02 0.07 0.00 -0.00 0.00 0.00 60.37 60.46 2p7i h HIS 78 Cb 0.92 0.04 -0.08 0.00 -0.00 0.00 0.00 27.41 28.29 2p7i h HIS 78 CO 0.09 -0.03 -0.21 0.00 -0.00 0.00 0.00 177.93 177.78 2p7i h ALA 79 N 1.18 -0.01 -0.72 5.26 0.00 -1.21 -1.45 119.26 122.31 2p7i h ALA 79 Ca 0.10 0.11 0.11 0.00 0.00 0.00 0.00 54.91 55.22 2p7i h ALA 79 Cb 0.12 0.48 -0.08 0.00 0.00 0.00 0.00 17.79 18.31 2p7i h ALA 79 CO -0.17 -0.61 0.33 0.37 0.00 0.00 0.00 179.25 179.18 2p7i h GLN 80 N -0.18 0.53 -0.20 0.00 4.15 -0.91 0.17 115.11 118.66 2p7i h GLN 80 Ca 0.16 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.54 2p7i h GLN 80 Cb 0.43 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.99 2p7i h GLN 80 CO -0.42 0.35 0.07 0.78 -1.93 0.00 0.00 178.83 177.68 2p7i h GLY 81 N 0.54 0.34 1.46 2.39 0.00 -0.80 -3.35 103.07 103.65 2p7i h GLY 81 Ca 0.37 -0.19 -0.30 0.00 0.00 0.00 0.00 47.33 47.20 2p7i h GLY 81 CO -0.31 0.18 -1.35 -0.09 0.00 0.00 0.00 176.54 174.97 2p7i h ARG 82 N 0.17 0.40 -7.25 4.80 2.43 -0.20 -3.47 114.38 111.26 2p7i h ARG 82 Ca 0.07 -0.68 -0.51 0.00 -0.81 0.00 0.00 59.98 58.05 2p7i h ARG 82 Cb 0.21 0.25 0.05 0.00 -0.42 0.00 0.00 29.97 30.06 2p7i h ARG 82 CO -0.00 1.33 0.34 -0.51 -1.51 0.00 0.00 179.97 179.61 2p7i s LEU 83 N -7.37 3.33 0.94 3.80 1.43 0.49 -5.07 118.68 116.24 2p7i s LEU 83 Ca -0.06 1.29 -0.15 0.00 -1.03 0.00 0.00 54.13 54.18 2p7i s LEU 83 Cb 0.06 -4.31 0.17 0.00 0.03 0.00 0.00 46.19 42.13 2p7i s LEU 83 CO 0.91 -0.79 1.23 -0.54 0.23 0.00 0.00 176.35 177.39 2p7i s LYS 84 N -5.06 0.85 0.96 1.70 3.01 -1.26 -4.93 119.74 115.00 2p7i s LYS 84 Ca 0.53 -0.11 -0.12 0.00 -1.01 0.00 0.00 55.97 55.26 2p7i s LYS 84 Cb -0.11 -1.84 0.16 0.00 -1.01 0.00 0.00 37.83 35.03 2p7i s LYS 84 CO 0.52 -2.32 1.09 0.16 0.51 0.00 0.00 175.35 175.30 2p7i s ASP 85 N -4.55 2.88 0.00 2.83 3.84 -1.26 -4.37 116.67 116.04 2p7i s ASP 85 Ca 0.69 1.54 0.00 0.00 -0.00 0.00 0.00 52.55 54.77 2p7i s ASP 85 Cb -0.08 -2.20 0.00 0.00 -1.38 0.00 0.00 42.92 39.26 2p7i s ASP 85 CO 0.52 -3.02 0.00 0.61 -0.00 0.00 0.00 175.17 173.29 2p7i n GLY 86 N -0.65 0.79 3.43 2.12 0.00 -1.26 -5.03 105.19 104.59 2p7i n GLY 86 Ca 0.07 -0.38 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 2p7i n GLY 86 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2p7i s ILE 87 N -2.00 3.48 -0.26 -0.61 -1.09 -1.26 -2.23 121.20 117.23 2p7i s ILE 87 Ca 0.00 -0.50 -0.14 0.00 -2.23 0.00 0.00 60.65 57.77 2p7i s ILE 87 Cb 0.00 -2.50 -0.04 0.00 -1.58 0.00 0.00 42.46 38.34 2p7i s ILE 87 CO 0.00 0.50 0.35 -0.89 -1.23 0.00 0.00 174.94 173.67 2p7i s THR 88 N 0.44 5.20 -0.13 2.92 2.01 0.39 -5.00 115.64 121.47 2p7i s THR 88 Ca -0.06 0.54 -0.11 0.00 0.31 0.00 0.00 61.69 62.36 2p7i s THR 88 Cb -0.15 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.64 2p7i s THR 88 CO 0.04 0.19 0.24 -0.31 -0.69 0.00 0.00 174.62 174.08 2p7i s TYR 89 N 1.87 3.54 -0.21 4.92 2.02 -1.26 -0.00 117.35 128.23 2p7i s TYR 89 Ca 0.15 0.60 -0.00 0.00 -0.37 0.00 0.00 57.07 57.44 2p7i s TYR 89 Cb -0.15 -2.18 0.06 0.00 -0.40 0.00 0.00 41.96 39.29 2p7i s TYR 89 CO 0.09 0.47 -0.03 0.42 -1.57 0.00 0.00 175.55 174.93 2p7i s ILE 90 N -0.28 1.19 -0.60 2.71 1.01 0.77 -4.93 121.20 121.07 2p7i s ILE 90 Ca 0.16 -0.91 -0.21 0.00 0.00 0.00 0.00 60.65 59.68 2p7i s ILE 90 Cb -0.13 -1.49 0.08 0.00 0.01 0.00 0.00 42.46 40.93 2p7i s ILE 90 CO 0.04 -0.07 0.82 -2.28 0.00 0.00 0.00 174.94 173.46 2p7i s HIS 91 N 1.57 2.85 0.06 3.97 5.65 -1.26 -1.89 115.29 126.23 2p7i s HIS 91 Ca -0.03 -0.64 -0.26 0.00 0.25 0.00 0.00 55.06 54.38 2p7i s HIS 91 Cb -0.18 -4.07 0.08 0.00 -1.18 0.00 0.00 32.58 27.24 2p7i s HIS 91 CO -0.07 -1.41 0.72 0.45 -0.65 0.00 0.00 174.74 173.78 2p7i s SER 92 N 3.44 -0.51 0.48 9.88 0.15 -0.83 -4.97 113.70 121.33 2p7i s SER 92 Ca 0.18 0.14 -0.19 0.00 0.70 0.00 0.00 55.95 56.79 2p7i s SER 92 Cb -0.19 0.51 -0.09 0.00 -1.71 0.00 0.00 66.02 64.53 2p7i s SER 92 CO 0.10 -0.77 0.98 -0.13 1.20 0.00 0.00 173.24 174.62 2p7i s ARG 93 N -2.97 4.03 0.30 5.44 0.52 -1.26 -2.99 118.95 122.02 2p7i s ARG 93 Ca 0.00 1.06 -0.01 0.00 -0.52 0.00 0.00 55.73 56.26 2p7i s ARG 93 Cb -0.01 -2.15 0.47 0.00 0.52 0.00 0.00 34.95 33.78 2p7i s ARG 93 CO -0.07 -0.20 1.94 0.74 0.02 0.00 0.00 175.30 177.72 2p7i h PHE 94 N 1.37 0.94 0.00 -0.53 0.04 -1.97 -2.15 116.94 114.65 2p7i h PHE 94 Ca -0.48 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.25 2p7i h PHE 94 Cb 1.19 -0.31 -0.00 0.00 2.20 0.00 0.00 35.95 39.02 2p7i h PHE 94 CO 0.62 0.65 -0.16 1.05 -0.60 0.00 0.00 178.31 179.87 2p7i h GLU 95 N 0.98 0.00 -0.00 1.51 9.09 -1.99 -2.79 114.58 121.38 2p7i h GLU 95 Ca 0.25 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.66 2p7i h GLU 95 Cb -0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2p7i h GLU 95 CO -0.04 0.16 -0.82 -0.25 0.05 0.00 0.00 179.01 178.11 2p7i n ASP 96 N -3.47 1.15 -4.71 3.06 8.00 -0.85 -5.00 116.55 114.73 2p7i n ASP 96 Ca -0.01 -1.02 -0.42 0.00 0.71 0.00 0.00 54.79 54.05 2p7i n ASP 96 Cb 0.33 0.79 -0.03 0.00 -0.02 0.00 0.00 41.12 42.19 2p7i n ASP 96 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2p7i s ALA 97 N -2.88 3.62 -0.33 2.24 0.00 -0.95 -4.97 121.76 118.49 2p7i s ALA 97 Ca 0.11 1.13 -0.02 0.00 0.00 0.00 0.00 51.96 53.18 2p7i s ALA 97 Cb 0.17 -3.57 0.06 0.00 0.00 0.00 0.00 23.12 19.78 2p7i s ALA 97 CO 0.78 -0.70 0.05 -0.65 0.00 0.00 0.00 175.76 175.24 2p7i s GLN 98 N 1.35 2.32 0.02 0.00 -1.52 -1.26 -5.06 119.66 115.51 2p7i s GLN 98 Ca 0.66 -1.39 -0.05 0.00 -1.95 0.00 0.00 55.36 52.63 2p7i s GLN 98 Cb -0.37 -3.28 -0.05 0.00 -0.22 0.00 0.00 33.01 29.09 2p7i s GLN 98 CO 0.30 -0.73 0.25 -0.51 -0.25 0.00 0.00 175.29 174.35 2p7i s LEU 99 N 1.23 4.36 0.00 2.90 1.43 -1.26 -4.99 118.68 122.35 2p7i s LEU 99 Ca -0.02 0.47 0.23 0.00 -1.03 0.00 0.00 54.13 53.78 2p7i s LEU 99 Cb -0.20 -2.74 1.02 0.00 0.03 0.00 0.00 46.19 44.29 2p7i s LEU 99 CO -0.02 0.23 1.73 -0.81 0.23 0.00 0.00 176.35 177.71 2p7i n PRO 100 N 0.88 0.08 -3.91 1.29 -0.04 -1.26 -4.90 135.00 127.14 2p7i n PRO 100 Ca -0.10 0.10 -0.08 0.00 -0.04 0.00 0.00 63.50 63.39 2p7i n PRO 100 Cb 0.52 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.45 2p7i n PRO 100 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2p7i s ARG 101 N -2.89 1.72 0.31 0.54 3.52 -1.26 -5.17 118.95 115.71 2p7i s ARG 101 Ca 0.14 -1.11 0.07 0.00 -0.13 0.00 0.00 55.73 54.69 2p7i s ARG 101 Cb 0.15 0.56 -0.03 0.00 -1.56 0.00 0.00 34.95 34.07 2p7i s ARG 101 CO 0.40 -0.76 0.29 1.03 -0.81 0.00 0.00 175.30 175.45 2p7i s ARG 102 N -3.88 2.88 -0.01 5.12 0.52 -1.26 -4.88 118.95 117.44 2p7i s ARG 102 Ca 0.16 -1.15 0.05 0.00 -0.52 0.00 0.00 55.73 54.26 2p7i s ARG 102 Cb -0.04 -2.58 -0.01 0.00 0.52 0.00 0.00 34.95 32.84 2p7i s ARG 102 CO 0.08 0.20 -0.15 0.71 0.02 0.00 0.00 175.30 176.16 2p7i s TYR 103 N -2.22 1.30 0.12 -0.53 1.51 0.03 -4.74 117.35 112.83 2p7i s TYR 103 Ca 0.39 -0.25 0.10 0.00 -1.01 0.00 0.00 57.07 56.30 2p7i s TYR 103 Cb -0.07 -0.83 0.06 0.00 -0.11 0.00 0.00 41.96 41.01 2p7i s TYR 103 CO 0.27 -0.02 1.43 -0.44 -1.11 0.00 0.00 175.55 175.68 2p7i h ASP 104 N 5.72 0.00 -3.48 2.29 3.32 -1.87 0.92 116.42 123.31 2p7i h ASP 104 Ca -0.35 0.00 -0.37 0.00 0.02 0.00 0.00 57.03 56.33 2p7i h ASP 104 Cb 1.16 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 40.37 2p7i h ASP 104 CO 0.48 0.77 -0.76 0.20 -1.72 0.00 0.00 179.24 178.22 2p7i s ASN 105 N -6.68 0.65 -0.09 6.45 0.01 -0.99 -0.95 114.94 113.33 2p7i s ASN 105 Ca 0.01 -0.07 0.03 0.00 -0.71 0.00 0.00 52.86 52.11 2p7i s ASN 105 Cb 0.10 -0.32 0.01 0.00 0.41 0.00 0.00 41.25 41.46 2p7i s ASN 105 CO 0.78 -0.08 -0.17 -0.63 -1.51 0.00 0.00 177.10 175.49 2p7i s ILE 106 N 0.98 1.60 -0.21 0.60 1.01 0.65 -0.36 121.20 125.47 2p7i s ILE 106 Ca -0.10 -0.73 -0.05 0.00 0.00 0.00 0.00 60.65 59.77 2p7i s ILE 106 Cb -0.14 -1.42 -0.02 0.00 0.01 0.00 0.00 42.46 40.89 2p7i s ILE 106 CO -0.01 0.46 -0.01 -0.69 0.00 0.00 0.00 174.94 174.69 2p7i s VAL 107 N 0.67 3.79 -0.48 2.92 1.01 0.83 0.04 120.40 129.18 2p7i s VAL 107 Ca -0.13 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 61.52 2p7i s VAL 107 Cb -0.16 -2.72 0.15 0.00 0.00 0.00 0.00 36.38 33.65 2p7i s VAL 107 CO 0.03 0.42 0.32 -0.22 0.00 0.00 0.00 175.10 175.65 2p7i s LEU 108 N 1.21 2.65 -0.21 3.92 2.96 -0.05 -1.44 118.68 127.72 2p7i s LEU 108 Ca 0.03 -2.97 -0.04 0.00 -0.22 0.00 0.00 54.13 50.93 2p7i s LEU 108 Cb -0.15 -0.94 -0.01 0.00 0.50 0.00 0.00 46.19 45.59 2p7i s LEU 108 CO 0.01 -0.20 -0.03 -0.89 -1.32 0.00 0.00 176.35 173.91 2p7i s THR 109 N -0.05 3.53 -1.46 3.68 2.01 -1.26 -1.29 115.64 120.80 2p7i s THR 109 Ca 0.23 -0.44 -0.07 0.00 0.31 0.00 0.00 61.69 61.72 2p7i s THR 109 Cb -0.12 -2.60 0.05 0.00 0.01 0.00 0.00 72.50 69.83 2p7i s THR 109 CO -0.09 0.42 0.73 1.41 -0.69 0.00 0.00 174.62 176.40 2p7i n HIS 110 N 4.64 -1.95 0.00 4.92 8.25 0.70 -4.87 115.22 126.91 2p7i n HIS 110 Ca -0.18 0.83 0.00 0.00 -0.26 0.00 0.00 57.72 58.11 2p7i n HIS 110 Cb 0.51 -3.91 0.00 0.00 1.12 0.00 0.00 29.99 27.71 2p7i n HIS 110 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2p7i n VAL 111 N -4.45 0.00 0.15 1.59 0.31 -1.26 -4.85 118.33 109.82 2p7i n VAL 111 Ca -0.14 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.32 2p7i n VAL 111 Cb 0.61 -0.40 0.68 0.00 -0.91 0.00 0.00 33.84 33.82 2p7i n VAL 111 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2p7i h LEU 112 N 0.00 0.00 -0.57 7.52 5.85 -1.86 -0.63 115.31 125.62 2p7i h LEU 112 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2p7i h LEU 112 Cb 0.76 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.79 2p7i h LEU 112 CO 0.00 0.00 0.00 -1.84 -0.34 0.00 0.00 178.44 176.26 2p7i n GLU 113 N -4.42 0.21 0.00 1.25 0.00 -1.26 -1.89 120.64 114.54 2p7i n GLU 113 Ca 0.03 0.38 0.13 0.00 0.00 0.00 0.00 57.16 57.70 2p7i n GLU 113 Cb 0.32 -1.87 0.34 0.00 0.00 0.00 0.00 31.44 30.23 2p7i n GLU 113 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2p7i n HIS 114 N -2.26 0.00 -3.56 -1.84 8.25 -0.24 0.10 115.22 115.66 2p7i n HIS 114 Ca 0.03 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.13 2p7i n HIS 114 Cb 0.27 -0.09 -0.07 0.00 1.12 0.00 0.00 29.99 31.22 2p7i n HIS 114 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2p7i s ILE 115 N -2.44 5.32 0.23 1.59 -1.09 -0.79 -4.76 121.20 119.26 2p7i s ILE 115 Ca 0.25 0.48 -0.07 0.00 -2.23 0.00 0.00 60.65 59.07 2p7i s ILE 115 Cb 0.19 -3.60 0.20 0.00 -1.58 0.00 0.00 42.46 37.67 2p7i s ILE 115 CO 0.51 0.38 1.85 0.44 -1.23 0.00 0.00 174.94 176.89 2p7i h ASP 116 N 6.80 1.10 -3.07 3.58 3.32 -1.92 -3.33 116.42 122.89 2p7i h ASP 116 Ca -0.40 -0.10 -0.62 0.00 0.02 0.00 0.00 57.03 55.93 2p7i h ASP 116 Cb 1.16 -0.28 -0.42 0.00 0.22 0.00 0.00 39.33 40.01 2p7i h ASP 116 CO 0.75 0.88 -0.59 -0.62 -1.72 0.00 0.00 179.24 177.94 2p7i s ASP 117 N -6.20 4.67 0.26 6.45 -1.08 -1.26 -4.97 116.67 114.54 2p7i s ASP 117 Ca -0.13 -3.82 -0.02 0.00 -0.52 0.00 0.00 52.55 48.06 2p7i s ASP 117 Cb 0.17 -1.58 0.32 0.00 -1.46 0.00 0.00 42.92 40.37 2p7i s ASP 117 CO 0.82 -0.09 1.74 1.55 0.52 0.00 0.00 175.17 179.71 2p7i h PRO 118 N 5.40 0.75 -0.70 4.34 0.13 -1.87 -2.49 132.00 137.57 2p7i h PRO 118 Ca 0.15 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2p7i h PRO 118 Cb 0.76 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 31.78 2p7i h PRO 118 CO 0.70 0.80 0.45 0.28 -0.23 0.00 0.00 178.00 180.00 2p7i h VAL 119 N 0.69 1.19 -0.16 1.56 2.07 -1.93 -1.72 116.25 117.94 2p7i h VAL 119 Ca 0.13 -0.37 -0.10 0.00 0.82 0.00 0.00 66.70 67.17 2p7i h VAL 119 Cb 0.52 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 2p7i h VAL 119 CO 0.03 0.19 -0.35 0.00 0.02 0.00 0.00 177.57 177.46 2p7i h ALA 120 N 1.54 1.11 -0.17 1.67 0.00 -1.84 -0.24 119.26 121.31 2p7i h ALA 120 Ca 0.25 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 2p7i h ALA 120 Cb -0.08 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2p7i h ALA 120 CO -0.05 0.57 -0.26 1.25 0.00 0.00 0.00 179.25 180.76 2p7i h LEU 121 N 0.29 0.53 -1.37 0.00 5.85 -1.35 -2.40 115.31 116.87 2p7i h LEU 121 Ca 0.03 -0.52 -0.06 0.00 0.84 0.00 0.00 57.88 58.17 2p7i h LEU 121 Cb 0.75 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 2p7i h LEU 121 CO 0.06 0.95 -0.23 -0.07 -0.34 0.00 0.00 178.44 178.81 2p7i h LEU 122 N 0.13 0.12 -0.37 2.25 3.38 -1.09 -1.67 115.31 118.07 2p7i h LEU 122 Ca 0.02 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 2p7i h LEU 122 Cb 0.83 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 2p7i h LEU 122 CO 0.06 0.36 -0.35 0.50 0.09 0.00 0.00 178.44 179.11 2p7i h LYS 123 N 0.12 0.88 -0.84 1.13 3.64 -1.00 -0.58 116.57 119.92 2p7i h LYS 123 Ca 0.02 -0.46 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 2p7i h LYS 123 Cb 0.48 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.27 2p7i h LYS 123 CO 0.03 1.10 0.54 0.00 -2.27 0.00 0.00 179.45 178.86 2p7i h ARG 124 N 0.68 1.11 -0.49 1.90 3.08 -0.95 0.17 114.38 119.89 2p7i h ARG 124 Ca 0.06 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 2p7i h ARG 124 Cb 0.94 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.72 2p7i h ARG 124 CO 0.09 0.75 0.28 0.82 -1.07 0.00 0.00 179.97 180.84 2p7i h ILE 125 N 1.14 1.16 -0.06 2.04 2.04 -1.04 0.23 117.51 123.02 2p7i h ILE 125 Ca 0.31 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 2p7i h ILE 125 Cb -0.11 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 36.50 2p7i h ILE 125 CO -0.06 0.16 -0.01 -1.13 0.00 0.00 0.00 178.15 177.11 2p7i h ASN 126 N 0.65 0.12 0.50 1.72 -1.24 -0.64 -0.28 115.58 116.40 2p7i h ASN 126 Ca 0.17 -0.35 -0.29 0.00 0.71 0.00 0.00 56.30 56.54 2p7i h ASN 126 Cb 0.02 -0.03 -0.03 0.00 0.73 0.00 0.00 38.32 39.01 2p7i h ASN 126 CO -0.03 0.44 -1.59 0.44 -1.29 0.00 0.00 177.43 175.40 2p7i h ASP 127 N -0.20 0.19 0.00 1.15 5.19 -0.51 -3.39 116.42 118.85 2p7i h ASP 127 Ca 0.02 -0.31 -0.24 0.00 -0.62 0.00 0.00 57.03 55.88 2p7i h ASP 127 Cb 0.39 -0.06 -0.04 0.00 0.18 0.00 0.00 39.33 39.79 2p7i h ASP 127 CO 0.01 1.27 -1.91 0.47 -3.12 0.00 0.00 179.24 175.96 2p7i n ASP 128 N -3.28 2.16 -0.04 6.45 8.00 0.78 -4.89 116.55 125.72 2p7i n ASP 128 Ca -0.16 -0.03 -0.05 0.00 0.71 0.00 0.00 54.79 55.26 2p7i n ASP 128 Cb 1.03 0.41 -0.06 0.00 -0.02 0.00 0.00 41.12 42.49 2p7i n ASP 128 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 2p7i n TRP 129 N -2.67 0.00 -2.18 1.24 8.01 -0.97 -4.78 117.44 116.10 2p7i n TRP 129 Ca -0.24 0.00 -0.42 0.00 -1.31 0.00 0.00 57.50 55.53 2p7i n TRP 129 Cb 0.88 -0.39 -0.03 0.00 -2.01 0.00 0.00 31.31 29.76 2p7i n TRP 129 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 2p7i s LEU 130 N -4.80 4.36 0.92 -0.99 1.43 -0.13 -0.79 118.68 118.68 2p7i s LEU 130 Ca -0.06 2.28 -0.11 0.00 -1.03 0.00 0.00 54.13 55.21 2p7i s LEU 130 Cb 0.03 -3.58 0.15 0.00 0.03 0.00 0.00 46.19 42.81 2p7i s LEU 130 CO 0.30 -0.67 1.09 0.00 0.23 0.00 0.00 176.35 177.30 2p7i s ALA 131 N 1.45 1.32 0.20 4.21 0.00 0.32 -4.68 121.76 124.58 2p7i s ALA 131 Ca 0.65 0.04 -0.31 0.00 0.00 0.00 0.00 51.96 52.34 2p7i s ALA 131 Cb -0.36 -3.24 -0.11 0.00 0.00 0.00 0.00 23.12 19.41 2p7i s ALA 131 CO 0.29 -2.56 1.63 -1.21 0.00 0.00 0.00 175.76 173.91 2p7i s GLU 132 N -4.83 4.17 0.00 0.00 0.41 -1.26 -1.00 118.70 116.19 2p7i s GLU 132 Ca 0.64 2.48 0.00 0.00 -0.41 0.00 0.00 54.97 57.68 2p7i s GLU 132 Cb -0.19 -3.11 0.00 0.00 -1.78 0.00 0.00 34.13 29.05 2p7i s GLU 132 CO 0.58 -0.66 0.00 0.41 -0.49 0.00 0.00 175.26 175.10 2p7i n GLY 133 N 3.60 1.63 3.78 -1.39 0.00 -1.26 -5.01 105.19 106.54 2p7i n GLY 133 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2p7i n GLY 133 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2p7i s GLY 134 N -2.00 1.98 -0.03 -0.02 0.00 -0.17 -5.01 107.32 102.07 2p7i s GLY 134 Ca 0.00 0.39 0.05 0.00 0.00 0.00 0.00 44.72 45.16 2p7i s GLY 134 CO 0.00 0.73 -0.18 0.50 0.00 0.00 0.00 173.10 174.15 2p7i s ARG 135 N -4.39 1.65 -0.20 2.90 0.52 -0.12 -4.19 118.95 115.12 2p7i s ARG 135 Ca 0.64 -0.64 -0.10 0.00 -0.52 0.00 0.00 55.73 55.10 2p7i s ARG 135 Cb -0.18 -1.51 -0.05 0.00 0.52 0.00 0.00 34.95 33.73 2p7i s ARG 135 CO 0.45 0.33 0.15 -1.17 0.02 0.00 0.00 175.30 175.08 2p7i s LEU 136 N -0.21 4.21 -0.59 2.53 2.96 -0.04 -0.25 118.68 127.30 2p7i s LEU 136 Ca 0.02 0.26 -0.11 0.00 -0.22 0.00 0.00 54.13 54.08 2p7i s LEU 136 Cb -0.09 -2.12 0.15 0.00 0.50 0.00 0.00 46.19 44.63 2p7i s LEU 136 CO 0.01 0.17 0.49 -0.36 -1.32 0.00 0.00 176.35 175.34 2p7i s PHE 137 N 0.37 3.46 -0.35 5.38 0.40 0.11 -1.14 117.98 126.20 2p7i s PHE 137 Ca 0.09 -1.88 -0.10 0.00 -0.60 0.00 0.00 56.93 54.44 2p7i s PHE 137 Cb -0.11 -3.60 0.02 0.00 0.51 0.00 0.00 43.02 39.83 2p7i s PHE 137 CO -0.01 -0.98 0.18 -1.17 0.70 0.00 0.00 175.22 173.94 2p7i s LEU 138 N 0.97 4.48 -0.05 -0.37 2.96 -0.74 -0.87 118.68 125.06 2p7i s LEU 138 Ca 0.09 -0.83 0.02 0.00 -0.22 0.00 0.00 54.13 53.19 2p7i s LEU 138 Cb -0.23 -2.01 0.01 0.00 0.50 0.00 0.00 46.19 44.47 2p7i s LEU 138 CO -0.02 -0.31 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.92 2p7i s VAL 139 N 1.57 0.82 0.08 1.68 1.01 -0.42 -1.13 120.40 124.02 2p7i s VAL 139 Ca 0.03 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.70 2p7i s VAL 139 Cb -0.18 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 2p7i s VAL 139 CO 0.06 0.28 -0.06 0.00 0.00 0.00 0.00 175.10 175.38 2p7i s PRO 141 N -3.21 4.13 -0.19 0.00 0.02 -1.26 -0.90 135.00 133.58 2p7i s PRO 141 Ca 0.05 2.55 -0.16 0.00 0.02 0.00 0.00 61.00 63.47 2p7i s PRO 141 Cb 0.01 -3.00 -0.04 0.00 0.02 0.00 0.00 34.50 31.49 2p7i s PRO 141 CO -0.04 -0.56 0.38 1.21 -0.33 0.00 0.00 177.00 177.66 2p7i s ASN 142 N 0.14 6.44 0.35 2.53 2.47 -0.42 -4.10 114.94 122.34 2p7i s ASN 142 Ca 0.57 0.52 0.05 0.00 0.42 0.00 0.00 52.86 54.42 2p7i s ASN 142 Cb -0.47 -2.22 0.71 0.00 -1.45 0.00 0.00 41.25 37.82 2p7i s ASN 142 CO 0.56 -0.04 1.94 0.00 -3.72 0.00 0.00 177.10 175.83 2p7i h ALA 143 N 7.24 1.68 -0.56 1.71 0.00 -1.00 -2.69 119.26 125.63 2p7i h ALA 143 Ca -0.37 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2p7i h ALA 143 Cb 1.16 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.75 2p7i h ALA 143 CO 0.72 0.19 0.00 0.09 0.00 0.00 0.00 179.25 180.25 2p7i n ASN 144 N -4.49 3.40 -4.64 0.00 3.02 -1.26 -4.53 115.26 106.76 2p7i n ASN 144 Ca 0.12 -2.13 -0.41 0.00 -0.03 0.00 0.00 54.58 52.13 2p7i n ASN 144 Cb 0.25 -0.44 0.02 0.00 -0.61 0.00 0.00 39.78 39.00 2p7i n ASN 144 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2p7i n ALA 145 N 1.08 0.48 -0.03 5.41 0.00 -1.02 -4.31 120.51 122.12 2p7i n ALA 145 Ca 0.20 0.21 -0.08 0.00 0.00 0.00 0.00 53.44 53.76 2p7i n ALA 145 Cb 0.58 -2.14 -0.02 0.00 0.00 0.00 0.00 19.45 17.87 2p7i n ALA 145 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2p7i h VAL 146 N 1.53 0.64 -0.76 0.00 2.07 -1.44 0.18 116.25 118.47 2p7i h VAL 146 Ca -0.46 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.17 2p7i h VAL 146 Cb 1.33 0.64 -0.08 0.00 -1.52 0.00 0.00 31.29 31.66 2p7i h VAL 146 CO 0.57 0.00 0.37 0.77 0.02 0.00 0.00 177.57 179.30 2p7i h SER 147 N -0.11 0.46 -0.48 0.57 4.64 -1.23 -0.57 113.55 116.83 2p7i h SER 147 Ca 0.11 0.07 -0.13 0.00 -0.47 0.00 0.00 61.79 61.38 2p7i h SER 147 Cb 0.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 2p7i h SER 147 CO -0.26 0.24 -0.20 -0.09 -0.87 0.00 0.00 176.83 175.64 2p7i h ARG 148 N 0.60 0.98 -0.90 4.77 2.43 -1.60 -2.01 114.38 118.66 2p7i h ARG 148 Ca 0.39 -0.42 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 2p7i h ARG 148 Cb 0.47 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.95 2p7i h ARG 148 CO -0.31 1.09 0.49 1.96 -1.51 0.00 0.00 179.97 181.69 2p7i h GLN 149 N 0.84 1.25 -0.78 0.20 4.20 -0.26 -0.64 115.11 119.92 2p7i h GLN 149 Ca 0.11 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2p7i h GLN 149 Cb 0.78 -0.25 -0.04 0.00 0.30 0.00 0.00 27.48 28.28 2p7i h GLN 149 CO 0.06 0.92 0.50 0.82 -0.67 0.00 0.00 178.83 180.46 2p7i h ILE 150 N 1.26 1.21 -0.17 2.54 2.04 -0.93 -0.79 117.51 122.67 2p7i h ILE 150 Ca 0.32 -0.42 -0.09 0.00 1.00 0.00 0.00 64.86 65.67 2p7i h ILE 150 Cb 0.03 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.18 2p7i h ILE 150 CO -0.05 0.21 -0.28 0.00 0.00 0.00 0.00 178.15 178.03 2p7i h ALA 151 N 1.27 1.22 -0.26 1.87 0.00 -0.58 -2.16 119.26 120.61 2p7i h ALA 151 Ca 0.28 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2p7i h ALA 151 Cb -0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2p7i h ALA 151 CO -0.06 0.51 0.07 0.28 0.00 0.00 0.00 179.25 180.06 2p7i h VAL 152 N 0.28 1.21 0.00 0.00 2.07 -0.80 -0.59 116.25 118.42 2p7i h VAL 152 Ca 0.04 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.89 2p7i h VAL 152 Cb 0.64 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 2p7i h VAL 152 CO 0.05 0.22 0.00 0.29 0.02 0.00 0.00 177.57 178.15 2p7i n LYS 153 N -4.72 0.14 -0.05 1.57 4.76 -0.33 -4.42 118.16 115.11 2p7i n LYS 153 Ca -0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 2p7i n LYS 153 Cb 0.17 -1.43 0.00 0.00 -1.84 0.00 0.00 35.03 31.93 2p7i n LYS 153 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2p7i n GLY 155 N 1.61 -0.41 0.10 0.72 0.00 -0.96 -5.10 105.19 101.15 2p7i n GLY 155 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 2p7i n GLY 155 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2p7i h ILE 156 N 3.27 1.39 -4.18 -0.61 2.04 -1.33 -3.44 117.51 114.66 2p7i h ILE 156 Ca 0.00 -2.83 -0.55 0.00 1.00 0.00 0.00 64.86 62.48 2p7i h ILE 156 Cb 1.02 2.60 -0.30 0.00 -0.74 0.00 0.00 36.82 39.39 2p7i h ILE 156 CO 0.00 0.76 -0.84 -0.63 0.00 0.00 0.00 178.15 177.45 2p7i s ILE 157 N -2.93 1.41 0.09 -0.67 1.01 -1.14 -4.98 121.20 113.99 2p7i s ILE 157 Ca 0.02 -0.74 -0.16 0.00 0.00 0.00 0.00 60.65 59.77 2p7i s ILE 157 Cb 0.10 -1.18 -0.09 0.00 0.01 0.00 0.00 42.46 41.29 2p7i s ILE 157 CO 0.78 0.40 1.41 0.77 0.00 0.00 0.00 174.94 178.31 2p7i h SER 158 N 5.89 0.68 -5.02 3.58 4.64 -1.89 -3.37 113.55 118.07 2p7i h SER 158 Ca -0.35 -0.47 0.03 0.00 -0.47 0.00 0.00 61.79 60.53 2p7i h SER 158 Cb 1.16 -0.19 -0.07 0.00 -0.31 0.00 0.00 62.40 62.98 2p7i h SER 158 CO 0.48 1.01 0.19 -1.38 -0.87 0.00 0.00 176.83 176.26 2p7i s HIS 159 N -4.37 -0.24 0.15 4.77 0.00 -1.26 -4.99 115.29 109.35 2p7i s HIS 159 Ca -0.13 -0.14 -0.17 0.00 -3.00 0.00 0.00 55.06 51.62 2p7i s HIS 159 Cb 0.08 0.62 0.01 0.00 -4.00 0.00 0.00 32.58 29.29 2p7i s HIS 159 CO 0.81 -1.10 1.80 -0.91 -1.00 0.00 0.00 174.74 174.34 2p7i h ASN 160 N 2.03 0.38 -0.22 7.38 2.35 -1.91 -1.81 115.58 123.78 2p7i h ASN 160 Ca -0.24 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 2p7i h ASN 160 Cb 1.27 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.55 2p7i h ASN 160 CO 0.29 0.27 0.00 -1.54 -1.65 0.00 0.00 177.43 174.80 2p7i n SER 161 N -4.86 1.42 -4.70 5.81 3.41 -1.26 -4.65 113.62 108.78 2p7i n SER 161 Ca 0.00 -1.87 -0.34 0.00 -0.26 0.00 0.00 58.87 56.40 2p7i n SER 161 Cb 0.04 -0.15 0.12 0.00 -0.26 0.00 0.00 64.21 63.96 2p7i n SER 161 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2p7i n ALA 162 N 0.23 0.18 -3.34 7.33 0.00 -0.68 -4.10 120.51 120.12 2p7i n ALA 162 Ca 0.12 -0.27 -0.36 0.00 0.00 0.00 0.00 53.44 52.93 2p7i n ALA 162 Cb 0.25 -2.26 -0.13 0.00 0.00 0.00 0.00 19.45 17.31 2p7i n ALA 162 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2p7i s VAL 163 N -1.98 3.70 0.87 0.00 1.01 -1.26 -4.62 120.40 118.12 2p7i s VAL 163 Ca 0.75 -0.46 -0.13 0.00 0.00 0.00 0.00 61.98 62.15 2p7i s VAL 163 Cb -0.31 -2.74 0.12 0.00 0.00 0.00 0.00 36.38 33.45 2p7i s VAL 163 CO 0.49 0.34 1.18 0.42 0.00 0.00 0.00 175.10 177.53 2p7i s THR 164 N 1.51 1.99 0.09 3.92 -4.23 -1.26 -4.80 115.64 112.86 2p7i s THR 164 Ca 0.05 0.00 -0.21 0.00 -1.18 0.00 0.00 61.69 60.35 2p7i s THR 164 Cb -0.15 -2.90 -0.11 0.00 1.34 0.00 0.00 72.50 70.69 2p7i s THR 164 CO -0.01 0.00 1.67 -0.33 -0.54 0.00 0.00 174.62 175.41 2p7i h GLU 165 N -1.32 0.20 -0.62 3.99 4.39 -1.99 0.89 114.58 120.13 2p7i h GLU 165 Ca -0.47 -0.03 0.06 0.00 0.34 0.00 0.00 59.36 59.25 2p7i h GLU 165 Cb 1.32 -0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 29.88 2p7i h GLU 165 CO 0.61 0.24 0.33 0.00 -1.16 0.00 0.00 179.01 179.02 2p7i h ALA 166 N 0.95 0.81 -0.30 3.43 0.00 -1.99 -1.42 119.26 120.74 2p7i h ALA 166 Ca 0.05 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2p7i h ALA 166 Cb 0.10 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2p7i h ALA 166 CO -0.01 -0.01 0.17 0.93 0.00 0.00 0.00 179.25 180.33 2p7i h GLU 167 N 0.62 0.41 -0.77 0.00 5.08 -1.88 -0.71 114.58 117.32 2p7i h GLU 167 Ca 0.28 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.58 2p7i h GLU 167 Cb 0.18 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.31 2p7i h GLU 167 CO -0.18 0.35 0.43 0.35 -1.00 0.00 0.00 179.01 178.96 2p7i h PHE 168 N 0.37 1.03 -0.54 4.33 3.04 -0.61 -1.44 116.94 123.12 2p7i h PHE 168 Ca 0.10 -0.01 -0.03 0.00 3.98 0.00 0.00 57.97 62.01 2p7i h PHE 168 Cb 0.05 -0.33 -0.03 0.00 2.56 0.00 0.00 35.95 38.20 2p7i h PHE 168 CO -0.03 0.71 0.19 0.00 -2.02 0.00 0.00 178.31 177.16 2p7i h ALA 169 N 1.41 1.33 0.00 2.41 0.00 -0.56 -1.06 119.26 122.80 2p7i h ALA 169 Ca 0.27 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2p7i h ALA 169 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.58 2p7i h ALA 169 CO -0.05 0.49 0.00 1.58 0.00 0.00 0.00 179.25 181.28 2p7i n HIS 170 N -4.32 0.00 0.00 0.00 -0.00 -0.34 -4.89 115.22 105.67 2p7i n HIS 170 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.76 2p7i n HIS 170 Cb 0.18 -0.41 0.00 0.00 -0.00 0.00 0.00 29.99 29.75 2p7i n HIS 170 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2p7i n GLY 171 N 1.12 0.88 3.75 1.57 0.00 -0.40 -5.08 105.19 107.02 2p7i n GLY 171 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2p7i n GLY 171 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2p7i s HIS 172 N -2.00 2.99 -0.43 1.61 3.76 -0.65 -4.26 115.29 116.31 2p7i s HIS 172 Ca 0.00 1.09 0.04 0.00 -0.15 0.00 0.00 55.06 56.04 2p7i s HIS 172 Cb 0.00 -3.82 0.01 0.00 1.11 0.00 0.00 32.58 29.88 2p7i s HIS 172 CO 0.00 -2.58 0.49 0.54 -0.85 0.00 0.00 174.74 172.34 2p7i n ARG 173 N 1.97 1.53 -3.71 1.40 5.12 0.28 -4.32 116.66 118.94 2p7i n ARG 173 Ca 0.05 -0.52 -0.04 0.00 -1.93 0.00 0.00 57.85 55.41 2p7i n ARG 173 Cb 0.40 -0.96 -0.01 0.00 -1.16 0.00 0.00 32.46 30.73 2p7i n ARG 173 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2p7i s THR 175 N -3.24 1.17 0.57 0.00 2.01 -1.26 -4.83 115.64 110.06 2p7i s THR 175 Ca 0.11 -1.57 -0.19 0.00 0.31 0.00 0.00 61.69 60.35 2p7i s THR 175 Cb -0.01 -1.87 -0.05 0.00 0.01 0.00 0.00 72.50 70.59 2p7i s THR 175 CO 0.00 -0.64 1.13 -0.31 -0.69 0.00 0.00 174.62 174.11 2p7i s TYR 176 N 1.47 2.64 0.45 4.92 2.02 -1.26 -4.63 117.35 122.97 2p7i s TYR 176 Ca 0.09 1.54 0.03 0.00 -0.37 0.00 0.00 57.07 58.37 2p7i s TYR 176 Cb -0.18 -3.28 -0.02 0.00 -0.40 0.00 0.00 41.96 38.08 2p7i s TYR 176 CO -0.21 -1.64 0.07 0.00 -1.57 0.00 0.00 175.55 172.20 2p7i s ALA 177 N -1.87 3.41 0.44 3.71 0.00 -1.26 -0.42 121.76 125.78 2p7i s ALA 177 Ca 0.72 -0.95 0.12 0.00 0.00 0.00 0.00 51.96 51.85 2p7i s ALA 177 Cb -0.24 0.42 1.02 0.00 0.00 0.00 0.00 23.12 24.32 2p7i s ALA 177 CO 0.30 -0.20 2.04 -0.07 0.00 0.00 0.00 175.76 177.84 2p7i h LEU 178 N 1.62 0.33 -0.09 0.00 3.38 -1.96 -0.42 115.31 118.17 2p7i h LEU 178 Ca -0.39 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.55 2p7i h LEU 178 Cb 1.29 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 2p7i h LEU 178 CO 0.65 0.22 -0.02 -2.24 0.09 0.00 0.00 178.44 177.15 2p7i h ASP 179 N 0.38 0.18 0.73 -0.43 2.03 -1.99 -2.24 116.42 115.07 2p7i h ASP 179 Ca 0.18 -0.36 -0.24 0.00 -0.73 0.00 0.00 57.03 55.87 2p7i h ASP 179 Cb 0.22 -0.05 -0.01 0.00 -0.83 0.00 0.00 39.33 38.66 2p7i h ASP 179 CO -0.04 0.50 -1.11 0.71 -1.03 0.00 0.00 179.24 178.27 2p7i h THR 180 N -0.14 1.56 -0.09 1.15 1.35 -1.89 -1.96 112.91 112.89 2p7i h THR 180 Ca 0.02 -3.09 -0.00 0.00 -0.55 0.00 0.00 66.41 62.79 2p7i h THR 180 Cb 0.42 2.83 -0.00 0.00 -1.73 0.00 0.00 68.15 69.66 2p7i h THR 180 CO 0.01 0.90 0.05 0.25 -0.25 0.00 0.00 175.52 176.47 2p7i h LEU 181 N 0.06 0.11 -1.06 3.87 5.85 -1.14 -1.99 115.31 121.01 2p7i h LEU 181 Ca -0.08 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.50 2p7i h LEU 181 Cb 1.83 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.80 2p7i h LEU 181 CO 0.17 0.18 0.22 -0.08 -0.34 0.00 0.00 178.44 178.59 2p7i h GLU 182 N 0.04 0.89 -0.16 1.25 4.81 -1.45 -1.90 114.58 118.06 2p7i h GLU 182 Ca 0.03 -0.15 0.05 0.00 -0.13 0.00 0.00 59.36 59.16 2p7i h GLU 182 Cb 0.09 -0.15 -0.06 0.00 0.63 0.00 0.00 28.75 29.27 2p7i h GLU 182 CO -0.00 0.75 -0.20 -0.09 -0.73 0.00 0.00 179.01 178.73 2p7i h ARG 183 N 0.88 -0.24 -0.49 1.92 2.43 -1.21 0.59 114.38 118.26 2p7i h ARG 183 Ca 0.20 0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.27 2p7i h ARG 183 Cb 0.20 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 2p7i h ARG 183 CO -0.02 -0.16 -0.18 -0.44 -1.51 0.00 0.00 179.97 177.67 2p7i h ASP 184 N -0.25 1.00 -0.74 -3.80 3.32 -1.09 0.18 116.42 115.04 2p7i h ASP 184 Ca 0.11 -0.36 -0.00 0.00 0.02 0.00 0.00 57.03 56.80 2p7i h ASP 184 Cb 0.41 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 2p7i h ASP 184 CO -0.30 1.15 0.45 0.00 -1.72 0.00 0.00 179.24 178.82 2p7i h ALA 185 N 0.93 0.94 -0.27 3.45 0.00 -1.13 -1.54 119.26 121.64 2p7i h ALA 185 Ca 0.12 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2p7i h ALA 185 Cb 0.75 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2p7i h ALA 185 CO 0.06 0.40 0.02 1.03 0.00 0.00 0.00 179.25 180.76 2p7i h SER 186 N 1.00 0.44 -0.33 0.00 0.87 -0.61 -2.35 113.55 112.58 2p7i h SER 186 Ca 0.26 -0.29 0.09 0.00 -1.23 0.00 0.00 61.79 60.62 2p7i h SER 186 Cb -0.05 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.78 2p7i h SER 186 CO -0.05 0.63 0.24 0.03 -0.53 0.00 0.00 176.83 177.14 2p7i h ARG 187 N 0.25 0.05 -0.00 2.24 3.08 -0.42 -2.01 114.38 117.56 2p7i h ARG 187 Ca 0.08 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2p7i h ARG 187 Cb 0.39 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.43 2p7i h ARG 187 CO 0.01 0.03 -0.01 0.00 -1.07 0.00 0.00 179.97 178.93 2p7i n ALA 188 N -2.59 2.63 -0.62 0.04 0.00 -0.60 -4.92 120.51 114.45 2p7i n ALA 188 Ca 0.05 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.28 2p7i n ALA 188 Cb 0.38 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.36 2p7i n ALA 188 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2p7i n GLY 189 N 1.13 0.79 3.79 0.00 0.00 -0.75 -4.22 105.19 105.93 2p7i n GLY 189 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 2p7i n GLY 189 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2p7i s LEU 190 N 0.00 3.55 -0.25 0.99 1.43 -0.92 -3.11 118.68 120.38 2p7i s LEU 190 Ca 0.00 1.89 -0.11 0.00 -1.03 0.00 0.00 54.13 54.88 2p7i s LEU 190 Cb 0.00 -4.54 -0.05 0.00 0.03 0.00 0.00 46.19 41.63 2p7i s LEU 190 CO 0.00 -1.19 0.17 -1.10 0.23 0.00 0.00 176.35 174.46 2p7i s GLN 191 N -3.90 4.04 -0.28 1.70 -1.52 0.40 -4.44 119.66 115.66 2p7i s GLN 191 Ca 0.65 -0.28 -0.20 0.00 -1.95 0.00 0.00 55.36 53.58 2p7i s GLN 191 Cb -0.17 -3.56 -0.01 0.00 -0.22 0.00 0.00 33.01 29.04 2p7i s GLN 191 CO 0.34 0.00 0.63 0.08 -0.25 0.00 0.00 175.29 176.10 2p7i s VAL 192 N 1.22 4.96 -0.11 1.09 1.01 -1.26 -0.32 120.40 126.99 2p7i s VAL 192 Ca 0.07 1.02 0.14 0.00 0.00 0.00 0.00 61.98 63.21 2p7i s VAL 192 Cb -0.14 -3.96 -0.20 0.00 0.00 0.00 0.00 36.38 32.07 2p7i s VAL 192 CO 0.06 -0.04 0.14 0.35 0.00 0.00 0.00 175.10 175.60 2p7i n THR 193 N 5.28 0.73 -3.81 3.92 -2.24 0.81 -4.98 114.28 114.00 2p7i n THR 193 Ca -0.01 -0.56 -0.12 0.00 -2.27 0.00 0.00 64.05 61.09 2p7i n THR 193 Cb 0.49 -0.39 -0.12 0.00 -2.10 0.00 0.00 70.33 68.21 2p7i n THR 193 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2p7i s TYR 194 N -2.58 -0.19 -0.07 4.78 2.02 -0.90 -4.99 117.35 115.43 2p7i s TYR 194 Ca -0.07 0.45 0.05 0.00 -0.37 0.00 0.00 57.07 57.13 2p7i s TYR 194 Cb 0.06 0.06 -0.00 0.00 -0.40 0.00 0.00 41.96 41.68 2p7i s TYR 194 CO 0.63 -0.14 -0.22 1.03 -1.57 0.00 0.00 175.55 175.28 2p7i s ARG 195 N -0.12 2.44 0.32 -0.62 0.52 -1.26 -0.74 118.95 119.48 2p7i s ARG 195 Ca -0.02 -0.80 -0.09 0.00 -0.52 0.00 0.00 55.73 54.30 2p7i s ARG 195 Cb -0.02 -2.00 0.04 0.00 0.52 0.00 0.00 34.95 33.48 2p7i s ARG 195 CO 0.01 0.27 0.58 0.45 0.02 0.00 0.00 175.30 176.63 2p7i n SER 196 N 3.20 -1.67 -4.10 0.23 2.88 0.04 -5.03 113.62 109.17 2p7i n SER 196 Ca -0.18 -2.41 -0.13 0.00 -1.33 0.00 0.00 58.87 54.82 2p7i n SER 196 Cb 0.52 2.85 -0.11 0.00 -0.75 0.00 0.00 64.21 66.73 2p7i n SER 196 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2p7i s GLY 197 N -2.75 0.61 -0.27 0.46 0.00 -1.26 -1.42 107.32 102.69 2p7i s GLY 197 Ca 0.17 -0.94 0.03 0.00 0.00 0.00 0.00 44.72 43.97 2p7i s GLY 197 CO 0.12 -1.01 -0.09 -0.42 0.00 0.00 0.00 173.10 171.71 2p7i s ILE 198 N -1.97 2.21 0.00 0.90 1.01 0.01 -4.22 121.20 119.14 2p7i s ILE 198 Ca -0.04 -1.70 0.00 0.00 0.00 0.00 0.00 60.65 58.92 2p7i s ILE 198 Cb -0.06 -2.33 0.00 0.00 0.01 0.00 0.00 42.46 40.08 2p7i s ILE 198 CO -0.01 -0.09 0.00 0.33 0.00 0.00 0.00 174.94 175.18 2p7i n PHE 199 N 4.42 0.00 -1.97 3.97 7.35 -1.26 -2.76 117.46 127.21 2p7i n PHE 199 Ca -0.12 0.00 -0.43 0.00 -0.76 0.00 0.00 57.45 56.14 2p7i n PHE 199 Cb 0.42 -1.75 -0.03 0.00 0.35 0.00 0.00 39.48 38.48 2p7i n PHE 199 CO 0.00 0.00 0.00 0.12 -0.76 0.00 0.00 176.76 176.12 2p7i s PHE 200 N 0.00 1.77 -0.32 -5.13 2.19 -0.29 -0.20 117.98 116.01 2p7i s PHE 200 Ca 0.00 0.59 0.01 0.00 0.33 0.00 0.00 56.93 57.86 2p7i s PHE 200 Cb 0.00 -4.10 0.08 0.00 -1.31 0.00 0.00 43.02 37.69 2p7i s PHE 200 CO 0.00 -3.10 0.01 0.21 1.83 0.00 0.00 175.22 174.17 2p7i s LYS 201 N 5.59 2.01 0.00 10.12 2.20 -1.25 -4.86 119.74 133.55 2p7i s LYS 201 Ca 0.81 -1.56 0.16 0.00 -0.36 0.00 0.00 55.97 55.02 2p7i s LYS 201 Cb -0.24 -3.16 -0.11 0.00 -1.51 0.00 0.00 37.83 32.82 2p7i s LYS 201 CO 0.34 -0.77 0.74 0.00 -0.36 0.00 0.00 175.35 175.30 2p7i n ALA 202 N 4.44 3.71 -2.43 3.13 0.00 -1.26 -0.96 120.51 127.14 2p7i n ALA 202 Ca -0.07 -0.48 -0.26 0.00 0.00 0.00 0.00 53.44 52.63 2p7i n ALA 202 Cb 0.42 -0.57 -0.12 0.00 0.00 0.00 0.00 19.45 19.18 2p7i n ALA 202 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2p7i s LEU 203 N -2.47 2.41 0.51 0.00 1.43 -1.26 -4.26 118.68 115.04 2p7i s LEU 203 Ca 0.09 -0.84 -0.12 0.00 -1.03 0.00 0.00 54.13 52.23 2p7i s LEU 203 Cb 0.12 -1.12 -0.06 0.00 0.03 0.00 0.00 46.19 45.17 2p7i s LEU 203 CO 0.55 0.11 0.91 0.00 0.23 0.00 0.00 176.35 178.15 2p7i s ALA 204 N -1.59 3.20 0.23 4.21 0.00 -1.26 -4.75 121.76 121.80 2p7i s ALA 204 Ca 0.18 -0.11 -0.08 0.00 0.00 0.00 0.00 51.96 51.96 2p7i s ALA 204 Cb -0.08 -2.92 0.39 0.00 0.00 0.00 0.00 23.12 20.51 2p7i s ALA 204 CO 0.09 -0.33 1.67 -0.91 0.00 0.00 0.00 175.76 176.28 2p7i h ASN 205 N 0.54 -0.15 -0.56 0.00 4.21 -2.00 0.16 115.58 117.77 2p7i h ASN 205 Ca -0.46 0.16 0.08 0.00 1.21 0.00 0.00 56.30 57.28 2p7i h ASN 205 Cb 1.19 0.25 -0.03 0.00 -1.12 0.00 0.00 38.32 38.60 2p7i h ASN 205 CO 0.62 -0.09 0.38 2.19 -1.29 0.00 0.00 177.43 179.24 2p7i h PHE 206 N 0.18 0.47 -0.06 1.19 -0.00 -2.00 0.29 116.94 117.01 2p7i h PHE 206 Ca 0.38 0.01 -0.22 0.00 -0.00 0.00 0.00 57.97 58.14 2p7i h PHE 206 Cb 0.64 -0.15 0.01 0.00 -0.00 0.00 0.00 35.95 36.45 2p7i h PHE 206 CO -0.32 0.24 -0.81 1.96 -0.00 0.00 0.00 178.31 179.37 2p7i h GLN 207 N 0.45 0.66 -0.47 6.09 4.20 -1.14 -3.11 115.11 121.79 2p7i h GLN 207 Ca 0.25 -0.63 0.04 0.00 0.06 0.00 0.00 58.65 58.37 2p7i h GLN 207 Cb 0.40 0.16 -0.04 0.00 0.30 0.00 0.00 27.48 28.30 2p7i h GLN 207 CO -0.07 1.23 0.24 -1.49 -0.67 0.00 0.00 178.83 178.07 2p7i h TRP 208 N 0.32 0.43 -0.19 2.96 4.06 0.21 -0.08 115.95 123.67 2p7i h TRP 208 Ca -0.08 0.02 -0.06 0.00 2.06 0.00 0.00 58.89 60.83 2p7i h TRP 208 Cb 1.47 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 29.49 2p7i h TRP 208 CO 0.11 0.22 -0.14 -0.44 -3.56 0.00 0.00 178.44 174.62 2p7i h ASP 209 N 0.47 0.29 -0.02 -3.49 3.32 -1.03 0.19 116.42 116.15 2p7i h ASP 209 Ca 0.21 -0.07 -0.05 0.00 0.02 0.00 0.00 57.03 57.14 2p7i h ASP 209 Cb 0.11 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.59 2p7i h ASP 209 CO -0.15 0.47 -0.16 1.56 -1.72 0.00 0.00 179.24 179.24 2p7i h GLN 210 N 0.29 0.15 0.00 3.56 4.20 -1.42 -3.32 115.11 118.57 2p7i h GLN 210 Ca 0.06 -0.13 -0.07 0.00 0.06 0.00 0.00 58.65 58.56 2p7i h GLN 210 Cb 0.43 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 2p7i h GLN 210 CO 0.03 0.82 -0.33 0.82 -0.67 0.00 0.00 178.83 179.49 2p7i h ILE 211 N -0.47 1.18 0.00 2.54 2.04 -0.40 -2.36 117.51 120.03 2p7i h ILE 211 Ca -0.01 -1.16 0.00 0.00 1.00 0.00 0.00 64.86 64.68 2p7i h ILE 211 Cb 0.86 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.57 2p7i h ILE 211 CO 0.03 0.33 0.00 -0.07 0.00 0.00 0.00 178.15 178.44 2p7i h LEU 212 N 0.00 0.00 0.00 1.44 3.38 -0.76 -1.23 115.31 118.14 2p7i h LEU 212 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2p7i h LEU 212 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2p7i h LEU 212 CO 0.04 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.57 2p7i n GLN 213 N -3.04 0.20 -3.58 1.13 6.02 -0.89 -4.83 117.38 112.40 2p7i n GLN 213 Ca 0.01 0.07 -0.24 0.00 -0.01 0.00 0.00 57.00 56.84 2p7i n GLN 213 Cb 0.33 -1.50 0.02 0.00 1.02 0.00 0.00 30.24 30.10 2p7i n GLN 213 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2p7i s THR 214 N -2.75 1.88 -0.54 5.09 -4.23 -0.46 -5.03 115.64 109.60 2p7i s THR 214 Ca 0.18 -1.32 0.16 0.00 -1.18 0.00 0.00 61.69 59.53 2p7i s THR 214 Cb 0.16 -2.20 0.78 0.00 1.34 0.00 0.00 72.50 72.58 2p7i s THR 214 CO 0.39 0.00 1.70 -0.90 -0.54 0.00 0.00 174.62 175.28 2p7i n ASP 215 N -1.91 5.36 -0.17 3.99 5.75 -1.26 -4.60 116.55 123.70 2p7i n ASP 215 Ca 0.05 -2.78 -0.10 0.00 -0.01 0.00 0.00 54.79 51.95 2p7i n ASP 215 Cb 0.63 -0.65 0.03 0.00 -1.03 0.00 0.00 41.12 40.11 2p7i n ASP 215 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 2p7i h ILE 216 N 3.94 1.27 -3.67 2.12 2.04 -1.96 -3.42 117.51 117.83 2p7i h ILE 216 Ca 0.00 -1.26 -0.67 0.00 1.00 0.00 0.00 64.86 63.93 2p7i h ILE 216 Cb 1.79 0.96 -0.25 0.00 -0.74 0.00 0.00 36.82 38.58 2p7i h ILE 216 CO 0.40 0.44 -0.77 -0.76 0.00 0.00 0.00 178.15 177.46 2p7i s LEU 217 N -9.18 2.74 0.50 1.44 1.43 -1.26 -5.13 118.68 109.22 2p7i s LEU 217 Ca -0.11 -0.25 0.06 0.00 -1.03 0.00 0.00 54.13 52.79 2p7i s LEU 217 Cb 0.13 -1.59 0.04 0.00 0.03 0.00 0.00 46.19 44.80 2p7i s LEU 217 CO 0.86 0.26 0.69 -0.94 0.23 0.00 0.00 176.35 177.45 2p7i s SER 218 N -0.20 5.36 0.33 2.29 1.04 -1.26 -4.99 113.70 116.26 2p7i s SER 218 Ca 0.00 -0.38 0.08 0.00 0.48 0.00 0.00 55.95 56.14 2p7i s SER 218 Cb -0.13 -0.50 0.57 0.00 0.10 0.00 0.00 66.02 66.06 2p7i s SER 218 CO 0.03 -1.05 1.77 0.07 0.98 0.00 0.00 173.24 175.04 2p7i h LYS 219 N 0.32 0.18 -0.09 4.02 2.10 -2.00 -2.19 116.57 118.92 2p7i h LYS 219 Ca -0.39 -0.07 -0.08 0.00 -2.00 0.00 0.00 60.65 58.11 2p7i h LYS 219 Cb 1.28 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 32.59 2p7i h LYS 219 CO 0.46 0.52 -0.32 0.93 -2.00 0.00 0.00 179.45 179.04 2p7i h GLU 220 N 0.16 0.16 -0.25 0.07 3.07 -1.99 -1.45 114.58 114.36 2p7i h GLU 220 Ca 0.02 -0.06 -0.09 0.00 -0.50 0.00 0.00 59.36 58.73 2p7i h GLU 220 Cb 0.70 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.60 2p7i h GLU 220 CO 0.05 0.47 -0.21 -0.92 -1.40 0.00 0.00 179.01 177.00 2p7i h TYR 221 N 0.14 0.69 -0.58 4.33 3.20 -1.80 -0.68 116.97 122.27 2p7i h TYR 221 Ca 0.02 -0.20 -0.01 0.00 3.14 0.00 0.00 58.73 61.68 2p7i h TYR 221 Cb 0.64 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.73 2p7i h TYR 221 CO 0.01 0.89 0.33 -0.07 -1.64 0.00 0.00 178.16 177.67 2p7i h LEU 222 N 0.29 0.72 -0.99 2.82 3.38 -1.02 -1.86 115.31 118.65 2p7i h LEU 222 Ca 0.04 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 57.97 2p7i h LEU 222 Cb 0.75 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.26 2p7i h LEU 222 CO 0.05 0.59 0.65 0.44 0.09 0.00 0.00 178.44 180.27 2p7i h ASP 223 N 0.79 1.08 -0.71 -0.43 3.32 -1.17 -0.99 116.42 118.29 2p7i h ASP 223 Ca 0.21 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.25 2p7i h ASP 223 Cb 0.03 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.30 2p7i h ASP 223 CO -0.03 0.73 0.47 1.23 -1.72 0.00 0.00 179.24 179.92 2p7i h GLY 224 N 1.24 1.01 1.07 2.75 0.00 -0.54 0.16 103.07 108.76 2p7i h GLY 224 Ca 0.40 -0.38 -0.11 0.00 0.00 0.00 0.00 47.33 47.24 2p7i h GLY 224 CO -0.13 0.37 -0.14 0.00 0.00 0.00 0.00 176.54 176.64 2p7i h TYR 226 N 0.81 0.16 -0.05 0.00 3.20 -0.61 -0.45 116.97 120.03 2p7i h TYR 226 Ca 0.12 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.00 2p7i h TYR 226 Cb 0.70 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.92 2p7i h TYR 226 CO 0.05 0.09 0.02 1.96 -1.64 0.00 0.00 178.16 178.65 2p7i h GLN 227 N 0.18 0.06 -0.32 1.82 4.20 -0.79 -2.97 115.11 117.29 2p7i h GLN 227 Ca 0.06 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 2p7i h GLN 227 Cb 0.00 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 2p7i h GLN 227 CO -0.03 0.15 -0.15 1.25 -0.67 0.00 0.00 178.83 179.38 2p7i h LEU 228 N -0.04 0.55 -1.04 1.46 5.85 -0.75 -3.06 115.31 118.27 2p7i h LEU 228 Ca 0.02 -0.16 0.15 0.00 0.84 0.00 0.00 57.88 58.73 2p7i h LEU 228 Cb 0.11 -0.15 -0.09 0.00 0.37 0.00 0.00 40.66 40.90 2p7i h LEU 228 CO -0.00 0.72 0.62 1.23 -0.34 0.00 0.00 178.44 180.67 2p7i h GLY 229 N 0.96 1.65 1.47 3.75 0.00 -1.11 -0.09 103.07 109.71 2p7i h GLY 229 Ca 0.09 -0.38 0.07 0.00 0.00 0.00 0.00 47.33 47.10 2p7i h GLY 229 CO 0.04 0.06 0.20 1.46 0.00 0.00 0.00 176.54 178.29 2p7i h GLN 230 N 0.86 0.00 0.00 4.80 4.20 -1.41 -1.13 115.11 122.43 2p7i h GLN 230 Ca 0.53 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.24 2p7i h GLN 230 Cb 0.70 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.48 2p7i h GLN 230 CO -0.31 0.00 -0.24 1.04 -0.67 0.00 0.00 178.83 178.66 2p7i n GLN 231 N -4.21 0.17 -3.19 1.46 6.02 -0.05 -4.22 117.38 113.36 2p7i n GLN 231 Ca 0.03 0.10 -0.22 0.00 -0.01 0.00 0.00 57.00 56.90 2p7i n GLN 231 Cb 0.34 -1.66 -0.05 0.00 1.02 0.00 0.00 30.24 29.90 2p7i n GLN 231 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2p7i n TYR 232 N -1.93 0.42 -0.33 1.08 4.01 -0.45 -4.98 117.16 114.97 2p7i n TYR 232 Ca 0.05 -3.74 0.21 0.00 -0.16 0.00 0.00 57.90 54.26 2p7i n TYR 232 Cb 0.40 -0.40 0.46 0.00 -0.31 0.00 0.00 39.34 39.49 2p7i n TYR 232 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 2p7i h PRO 233 N 3.48 0.45 0.00 -0.72 0.11 -1.67 -1.41 132.00 132.24 2p7i h PRO 233 Ca 0.10 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.18 2p7i h PRO 233 Cb 0.88 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.89 2p7i h PRO 233 CO 0.53 0.30 0.00 0.22 -0.21 0.00 0.00 178.00 178.83 2p7i h ASP 234 N 0.46 0.00 -0.34 -2.05 3.58 -1.92 -2.90 116.42 113.25 2p7i h ASP 234 Ca 0.61 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.06 2p7i h ASP 234 Cb 1.41 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.46 2p7i h ASP 234 CO -0.36 0.00 0.00 0.18 -2.88 0.00 0.00 179.24 176.18 2p7i n LEU 235 N -3.03 3.31 -4.90 2.28 4.77 -0.53 -4.05 117.00 114.86 2p7i n LEU 235 Ca 0.00 -1.48 -0.29 0.00 -0.03 0.00 0.00 56.01 54.21 2p7i n LEU 235 Cb 0.26 -0.22 0.05 0.00 -2.33 0.00 0.00 43.42 41.18 2p7i n LEU 235 CO 0.25 0.71 0.69 0.00 -1.33 0.00 0.00 177.39 177.72 2p7i h ALA 237 N -0.56 0.60 -3.34 0.00 0.00 -0.47 -3.33 119.26 112.16 2p7i h ALA 237 Ca -0.45 0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.15 2p7i h ALA 237 Cb 1.26 -0.09 -0.22 0.00 0.00 0.00 0.00 17.79 18.74 2p7i h ALA 237 CO 0.63 -0.08 -0.75 -1.12 0.00 0.00 0.00 179.25 177.93 2p7i s SER 238 N -5.51 1.03 0.21 0.00 0.01 -1.11 -1.31 113.70 107.01 2p7i s SER 238 Ca -0.13 -0.50 0.08 0.00 1.31 0.00 0.00 55.95 56.71 2p7i s SER 238 Cb 0.13 -0.00 -0.04 0.00 0.21 0.00 0.00 66.02 66.32 2p7i s SER 238 CO 0.73 -0.13 -0.02 0.27 0.41 0.00 0.00 173.24 174.50 2p7i s ILE 239 N -1.18 3.52 -0.12 1.44 -4.36 -0.08 -0.81 121.20 119.61 2p7i s ILE 239 Ca -0.06 -1.64 -0.04 0.00 -0.26 0.00 0.00 60.65 58.65 2p7i s ILE 239 Cb -0.09 -2.80 0.05 0.00 1.25 0.00 0.00 42.46 40.87 2p7i s ILE 239 CO 0.01 -0.20 0.11 0.12 0.24 0.00 0.00 174.94 175.21 2p7i s PHE 240 N -1.92 0.04 -0.20 1.37 5.36 -0.51 -1.71 117.98 120.41 2p7i s PHE 240 Ca 0.28 0.08 -0.07 0.00 -0.96 0.00 0.00 56.93 56.26 2p7i s PHE 240 Cb -0.08 -0.52 -0.03 0.00 -0.34 0.00 0.00 43.02 42.04 2p7i s PHE 240 CO 0.18 -0.38 0.04 -0.51 -1.46 0.00 0.00 175.22 173.10 2p7i s LEU 241 N 2.19 3.58 -0.24 6.12 1.43 -0.28 -0.78 118.68 130.70 2p7i s LEU 241 Ca 0.04 -0.05 -0.16 0.00 -1.03 0.00 0.00 54.13 52.92 2p7i s LEU 241 Cb -0.14 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 2p7i s LEU 241 CO -0.07 0.11 0.44 -0.22 0.23 0.00 0.00 176.35 176.84 2p7i s LEU 242 N 0.73 4.09 0.13 1.79 2.96 0.08 -1.79 118.68 126.66 2p7i s LEU 242 Ca 0.02 0.47 0.08 0.00 -0.22 0.00 0.00 54.13 54.48 2p7i s LEU 242 Cb -0.14 -2.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.96 2p7i s LEU 242 CO 0.02 -0.18 -0.19 0.00 -1.32 0.00 0.00 176.35 174.67 2p7i s GLU 244 N -2.29 1.65 0.17 0.00 2.02 0.56 -0.86 118.70 119.95 2p7i s GLU 244 Ca 0.10 -1.89 -0.30 0.00 0.02 0.00 0.00 54.97 52.90 2p7i s GLU 244 Cb -0.08 -1.08 -0.08 0.00 0.10 0.00 0.00 34.13 32.99 2p7i s GLU 244 CO 0.05 -0.08 1.18 0.21 0.02 0.00 0.00 175.26 176.64 2p7i s LYS 245 N -3.80 4.50 0.12 1.61 2.20 -1.26 -0.46 119.74 122.65 2p7i s LYS 245 Ca 0.33 1.83 0.03 0.00 -0.36 0.00 0.00 55.97 57.81 2p7i s LYS 245 Cb 0.07 -3.26 -0.04 0.00 -1.51 0.00 0.00 37.83 33.09 2p7i s LYS 245 CO 0.14 -0.08 0.14 0.20 -0.36 0.00 0.00 175.35 175.39 2p7i s GLY 246 N 0.20 1.89 -0.06 5.54 0.00 -1.18 -4.63 107.32 109.08 2p7i s GLY 246 Ca 0.53 -1.07 -0.30 0.00 0.00 0.00 0.00 44.72 43.88 2p7i s GLY 246 CO 0.35 -1.07 1.04 -0.42 0.00 0.00 0.00 173.10 173.01 2p7i s ILE 247 N -1.58 4.68 -0.05 0.90 1.01 -1.26 -4.89 121.20 120.00 2p7i s ILE 247 Ca 0.31 1.94 0.01 0.00 0.00 0.00 0.00 60.65 62.91 2p7i s ILE 247 Cb -0.11 -4.25 0.02 0.00 0.01 0.00 0.00 42.46 38.13 2p7i s ILE 247 CO 0.24 0.06 -0.06 0.21 0.00 0.00 0.00 174.94 175.39 2p7i s ASN 248 N 1.13 1.19 0.00 3.58 2.47 -1.26 -5.09 114.94 116.95 2p7i s ASN 248 Ca 0.51 -0.16 0.00 0.00 0.42 0.00 0.00 52.86 53.63 2p7i s ASN 248 Cb -0.21 -0.53 0.00 0.00 -1.45 0.00 0.00 41.25 39.06 2p7i s ASN 248 CO 0.22 -0.05 0.50 0.00 -3.72 0.00 0.00 177.10 174.05