#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ihm s ILE 5 N 0.00 2.28 -0.18 5.15 -1.09 -0.28 -0.95 121.20 126.12 3ihm s ILE 5 Ca 0.00 -0.90 -0.08 0.00 -2.23 0.00 0.00 60.65 57.44 3ihm s ILE 5 Cb 0.00 -1.93 -0.04 0.00 -1.58 0.00 0.00 42.46 38.90 3ihm s ILE 5 CO 0.00 0.54 0.09 -0.83 -1.23 0.00 0.00 174.94 173.51 3ihm s GLY 6 N 0.88 1.97 -0.22 6.18 0.00 -0.64 -1.77 107.32 113.72 3ihm s GLY 6 Ca -0.05 -0.72 0.01 0.00 0.00 0.00 0.00 44.72 43.97 3ihm s GLY 6 CO -0.03 0.06 -0.14 -0.42 0.00 0.00 0.00 173.10 172.57 3ihm s ILE 7 N 0.28 2.24 -0.49 0.90 1.01 0.63 -0.14 121.20 125.62 3ihm s ILE 7 Ca 0.06 -1.24 -0.21 0.00 0.00 0.00 0.00 60.65 59.26 3ihm s ILE 7 Cb -0.12 -2.13 0.04 0.00 0.01 0.00 0.00 42.46 40.27 3ihm s ILE 7 CO -0.01 0.25 0.71 -0.69 0.00 0.00 0.00 174.94 175.20 3ihm s VAL 8 N 1.22 4.75 0.00 2.92 1.01 0.27 0.03 120.40 130.59 3ihm s VAL 8 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 61.98 61.87 3ihm s VAL 8 Cb -0.16 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 31.89 3ihm s VAL 8 CO -0.08 -0.80 0.00 0.61 0.00 0.00 0.00 175.10 174.82 3ihm n GLY 9 N 5.11 2.63 0.00 4.51 0.00 0.18 -1.11 105.19 116.51 3ihm n GLY 9 Ca -0.03 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.49 3ihm n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ihm n ALA 10 N 1.42 0.00 -0.81 4.61 0.00 -1.26 -4.45 120.51 120.02 3ihm n ALA 10 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 3ihm n ALA 10 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 3ihm n ALA 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ihm n GLY 11 N 5.00 -1.89 0.38 0.00 0.00 -1.26 -2.58 105.19 104.84 3ihm n GLY 11 Ca 0.00 -1.31 -0.02 0.00 0.00 0.00 0.00 46.02 44.70 3ihm n GLY 11 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3ihm h THR 12 N -0.76 1.24 0.40 2.61 2.02 -1.96 -1.56 112.91 114.90 3ihm h THR 12 Ca -0.01 -0.46 -0.02 0.00 0.77 0.00 0.00 66.41 66.69 3ihm h THR 12 Cb 0.75 -0.23 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 3ihm h THR 12 CO 0.01 0.25 -0.19 0.00 0.37 0.00 0.00 175.52 175.96 3ihm h ALA 13 N 1.38 -0.54 -0.60 6.16 0.00 -1.77 -1.81 119.26 122.08 3ihm h ALA 13 Ca 0.38 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 3ihm h ALA 13 Cb -0.13 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3ihm h ALA 13 CO -0.09 -0.69 -0.02 0.78 0.00 0.00 0.00 179.25 179.23 3ihm h GLY 14 N -0.76 1.16 1.26 0.00 0.00 -1.43 -1.94 103.07 101.36 3ihm h GLY 14 Ca -0.06 -0.86 -0.25 0.00 0.00 0.00 0.00 47.33 46.16 3ihm h GLY 14 CO 0.09 0.79 -0.96 1.41 0.00 0.00 0.00 176.54 177.88 3ihm h LEU 15 N 0.97 0.87 -0.78 3.11 3.38 -1.36 -0.22 115.31 121.26 3ihm h LEU 15 Ca 0.17 -0.66 -0.06 0.00 0.09 0.00 0.00 57.88 57.42 3ihm h LEU 15 Cb 0.58 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 3ihm h LEU 15 CO 0.03 1.46 0.18 0.45 0.09 0.00 0.00 178.44 180.65 3ihm h HIS 16 N 0.41 1.15 -0.27 1.13 3.86 -1.35 0.54 115.15 120.62 3ihm h HIS 16 Ca -0.10 -0.13 -0.02 0.00 -1.16 0.00 0.00 60.37 58.96 3ihm h HIS 16 Cb 1.60 -0.33 -0.01 0.00 1.06 0.00 0.00 27.41 29.73 3ihm h HIS 16 CO 0.09 0.92 0.10 1.25 0.86 0.00 0.00 177.93 181.16 3ihm h LEU 17 N 1.05 0.38 -0.65 2.43 5.85 -1.32 -1.86 115.31 121.19 3ihm h LEU 17 Ca 0.22 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 3ihm h LEU 17 Cb 0.34 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 3ihm h LEU 17 CO -0.00 0.46 0.33 1.23 -0.34 0.00 0.00 178.44 180.11 3ihm h GLY 18 N 0.28 0.99 1.53 3.75 0.00 -0.80 -1.27 103.07 107.56 3ihm h GLY 18 Ca 0.09 -0.47 -0.09 0.00 0.00 0.00 0.00 47.33 46.85 3ihm h GLY 18 CO -0.01 0.45 -0.22 1.41 0.00 0.00 0.00 176.54 178.18 3ihm h LEU 19 N 0.89 0.54 0.11 3.11 3.38 -0.89 -1.65 115.31 120.82 3ihm h LEU 19 Ca 0.22 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3ihm h LEU 19 Cb 0.09 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3ihm h LEU 19 CO -0.03 0.76 -0.05 0.15 0.09 0.00 0.00 178.44 179.36 3ihm h PHE 20 N 0.49 -0.14 -0.04 1.13 3.57 -1.03 -2.96 116.94 117.95 3ihm h PHE 20 Ca 0.07 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 3ihm h PHE 20 Cb 0.64 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.42 3ihm h PHE 20 CO 0.02 0.18 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.06 3ihm h LEU 21 N -0.46 0.06 -0.95 0.59 3.38 -1.19 -2.27 115.31 114.47 3ihm h LEU 21 Ca -0.02 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 3ihm h LEU 21 Cb 0.38 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 3ihm h LEU 21 CO 0.03 0.22 -0.36 -0.09 0.09 0.00 0.00 178.44 178.32 3ihm h ARG 22 N 0.06 0.00 0.00 1.13 9.65 -1.29 -1.13 114.38 122.81 3ihm h ARG 22 Ca 0.01 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 58.85 3ihm h ARG 22 Cb 0.30 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.88 3ihm h ARG 22 CO 0.02 0.36 -0.22 1.96 2.80 0.00 0.00 179.97 184.89 3ihm h GLN 23 N 0.00 0.00 -0.55 0.20 4.20 -1.23 -2.92 115.11 114.80 3ihm h GLN 23 Ca -0.00 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 3ihm h GLN 23 Cb 0.88 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.59 3ihm h GLN 23 CO 0.05 0.22 0.12 0.72 -0.67 0.00 0.00 178.83 179.27 3ihm n HIS 24 N -3.44 1.89 -3.02 2.96 8.25 -1.01 -4.95 115.22 115.89 3ihm n HIS 24 Ca -0.00 -1.06 -0.22 0.00 -0.26 0.00 0.00 57.72 56.18 3ihm n HIS 24 Cb 0.40 -0.54 0.02 0.00 1.12 0.00 0.00 29.99 30.99 3ihm n HIS 24 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 3ihm n ASP 25 N -0.17 -5.38 -4.80 0.41 4.64 -1.10 -4.99 116.55 105.16 3ihm n ASP 25 Ca 0.33 -0.26 -0.38 0.00 -1.38 0.00 0.00 54.79 53.09 3ihm n ASP 25 Cb 1.20 -4.39 -0.06 0.00 -1.04 0.00 0.00 41.12 36.83 3ihm n ASP 25 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 3ihm s VAL 26 N -3.07 4.92 -0.20 5.18 1.01 -0.46 -5.02 120.40 122.76 3ihm s VAL 26 Ca 0.29 1.06 -0.29 0.00 0.00 0.00 0.00 61.98 63.04 3ihm s VAL 26 Cb -0.14 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 3ihm s VAL 26 CO 0.35 0.51 1.33 -0.62 0.00 0.00 0.00 175.10 176.67 3ihm s ASP 27 N -0.72 6.81 -0.03 3.32 -1.08 -1.26 -4.29 116.67 119.42 3ihm s ASP 27 Ca 0.27 1.59 0.06 0.00 -0.52 0.00 0.00 52.55 53.96 3ihm s ASP 27 Cb -0.18 -2.54 -0.01 0.00 -1.46 0.00 0.00 42.92 38.73 3ihm s ASP 27 CO 0.16 -0.90 -0.22 0.68 0.52 0.00 0.00 175.17 175.42 3ihm s VAL 28 N 3.90 1.74 -0.08 1.11 -7.23 -1.26 -1.13 120.40 117.44 3ihm s VAL 28 Ca 0.58 -0.91 0.02 0.00 -1.81 0.00 0.00 61.98 59.85 3ihm s VAL 28 Cb -0.21 -1.46 0.01 0.00 0.56 0.00 0.00 36.38 35.28 3ihm s VAL 28 CO 0.19 0.49 -0.13 -0.89 -0.31 0.00 0.00 175.10 174.45 3ihm s THR 29 N -0.29 1.25 -0.19 5.32 2.01 -0.73 -1.37 115.64 121.65 3ihm s THR 29 Ca 0.02 -0.52 -0.04 0.00 0.31 0.00 0.00 61.69 61.47 3ihm s THR 29 Cb -0.11 -1.15 -0.02 0.00 0.01 0.00 0.00 72.50 71.23 3ihm s THR 29 CO 0.01 0.39 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.61 3ihm s VAL 30 N 0.88 3.69 -0.39 3.82 1.01 0.67 -0.27 120.40 129.81 3ihm s VAL 30 Ca -0.10 -0.41 -0.14 0.00 0.00 0.00 0.00 61.98 61.33 3ihm s VAL 30 Cb -0.15 -2.65 0.01 0.00 0.00 0.00 0.00 36.38 33.59 3ihm s VAL 30 CO 0.01 0.45 0.27 -0.31 0.00 0.00 0.00 175.10 175.52 3ihm s TYR 31 N 0.94 3.24 0.04 5.22 2.02 0.10 -0.96 117.35 127.96 3ihm s TYR 31 Ca 0.00 -0.56 -0.05 0.00 -0.37 0.00 0.00 57.07 56.09 3ihm s TYR 31 Cb -0.15 -2.54 -0.01 0.00 -0.40 0.00 0.00 41.96 38.86 3ihm s TYR 31 CO 0.01 -0.54 0.09 -0.08 -1.57 0.00 0.00 175.55 173.46 3ihm s THR 32 N 1.67 0.14 -0.13 -0.71 -1.32 -1.08 0.51 115.64 114.72 3ihm s THR 32 Ca 0.05 -1.16 0.17 0.00 -1.21 0.00 0.00 61.69 59.53 3ihm s THR 32 Cb -0.19 -0.99 -0.09 0.00 -1.51 0.00 0.00 72.50 69.72 3ihm s THR 32 CO 0.10 -0.64 0.96 -2.24 -2.21 0.00 0.00 174.62 170.58 3ihm h ASP 33 N 3.53 0.00 -3.24 8.08 2.03 -1.87 -2.00 116.42 122.95 3ihm h ASP 33 Ca -0.33 0.00 -0.63 0.00 -0.73 0.00 0.00 57.03 55.34 3ihm h ASP 33 Cb 1.18 0.00 -0.16 0.00 -0.83 0.00 0.00 39.33 39.53 3ihm h ASP 33 CO 0.52 0.54 -0.57 -0.60 -1.03 0.00 0.00 179.24 178.10 3ihm s ARG 34 N -2.95 3.79 0.58 4.15 6.06 -1.26 -4.73 118.95 124.59 3ihm s ARG 34 Ca -0.01 -0.35 -0.15 0.00 -2.50 0.00 0.00 55.73 52.72 3ihm s ARG 34 Cb 0.09 -3.14 -0.05 0.00 0.06 0.00 0.00 34.95 31.91 3ihm s ARG 34 CO 0.80 0.36 1.03 0.15 -2.50 0.00 0.00 175.30 175.15 3ihm s LYS 35 N 0.10 3.49 0.36 5.12 1.02 -1.26 -4.98 119.74 123.59 3ihm s LYS 35 Ca 0.05 1.08 0.07 0.00 0.02 0.00 0.00 55.97 57.18 3ihm s LYS 35 Cb -0.12 -2.06 0.76 0.00 -0.52 0.00 0.00 37.83 35.88 3ihm s LYS 35 CO 0.01 -0.66 1.93 -1.35 -0.92 0.00 0.00 175.35 174.36 3ihm h PRO 36 N 0.44 0.73 -0.27 -1.68 0.11 -1.98 -2.06 132.00 127.29 3ihm h PRO 36 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3ihm h PRO 36 Cb 1.21 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3ihm h PRO 36 CO 0.59 0.48 0.00 -0.40 -0.21 0.00 0.00 178.00 178.46 3ihm n ASP 37 N -4.50 1.25 -0.49 -2.05 5.68 -1.26 -3.76 116.55 111.42 3ihm n ASP 37 Ca 0.13 -2.02 0.06 0.00 -0.50 0.00 0.00 54.79 52.45 3ihm n ASP 37 Cb 0.31 -0.18 0.14 0.00 -1.14 0.00 0.00 41.12 40.26 3ihm n ASP 37 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3ihm n GLU 38 N 0.13 2.70 0.01 0.11 1.02 -0.78 -4.69 120.64 119.15 3ihm n GLU 38 Ca 0.07 -2.20 -0.09 0.00 -0.02 0.00 0.00 57.16 54.92 3ihm n GLU 38 Cb 0.21 -1.39 -0.13 0.00 -0.02 0.00 0.00 31.44 30.11 3ihm n GLU 38 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 3ihm h TYR 39 N 1.25 0.03 -0.02 -0.32 0.05 -1.71 -3.38 116.97 112.88 3ihm h TYR 39 Ca 0.00 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.76 3ihm h TYR 39 Cb 0.90 -0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.64 3ihm h TYR 39 CO 0.22 1.03 0.01 0.66 -1.05 0.00 0.00 178.16 179.03 3ihm h SER 40 N 0.00 0.00 -0.11 3.88 4.64 -1.84 -1.91 113.55 118.22 3ihm h SER 40 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3ihm h SER 40 Cb 1.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.01 3ihm h SER 40 CO 0.10 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.67 3ihm n GLY 41 N -1.48 0.70 3.77 -0.77 0.00 -1.26 -4.95 105.19 101.20 3ihm n GLY 41 Ca -0.03 -0.58 -0.36 0.00 0.00 0.00 0.00 46.02 45.06 3ihm n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ihm s LEU 42 N -1.85 3.89 0.48 0.99 1.43 -0.72 -5.01 118.68 117.88 3ihm s LEU 42 Ca 0.34 2.21 -0.23 0.00 -1.03 0.00 0.00 54.13 55.41 3ihm s LEU 42 Cb 0.20 -4.42 -0.07 0.00 0.03 0.00 0.00 46.19 41.94 3ihm s LEU 42 CO 0.31 -1.02 1.28 -0.60 0.23 0.00 0.00 176.35 176.55 3ihm s ARG 43 N -2.99 3.58 -0.38 1.70 3.52 -1.26 -4.85 118.95 118.26 3ihm s ARG 43 Ca 0.68 2.07 -0.45 0.00 -0.13 0.00 0.00 55.73 57.89 3ihm s ARG 43 Cb -0.25 -2.45 -0.20 0.00 -1.56 0.00 0.00 34.95 30.49 3ihm s ARG 43 CO 0.30 -0.78 1.47 -0.11 -0.81 0.00 0.00 175.30 175.37 3ihm n LEU 44 N -0.52 0.92 0.00 -0.88 7.94 0.55 -4.95 117.00 120.06 3ihm n LEU 44 Ca 0.07 1.18 0.00 0.00 -1.11 0.00 0.00 56.01 56.16 3ihm n LEU 44 Cb 0.45 -0.89 0.00 0.00 0.53 0.00 0.00 43.42 43.52 3ihm n LEU 44 CO 0.52 -1.09 0.00 0.18 -1.11 0.00 0.00 177.39 175.89 3ihm n LEU 45 N 3.41 0.00 -4.59 -1.96 4.77 -1.26 -4.81 117.00 112.55 3ihm n LEU 45 Ca 0.28 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.84 3ihm n LEU 45 Cb -0.03 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.04 3ihm n LEU 45 CO 0.83 0.00 1.27 0.21 -1.33 0.00 0.00 177.39 178.37 3ihm s ASN 46 N -1.00 6.24 0.00 -1.43 3.84 -1.26 -4.87 114.94 116.45 3ihm s ASN 46 Ca 0.00 0.71 0.16 0.00 0.21 0.00 0.00 52.86 53.95 3ihm s ASN 46 Cb 0.00 -2.54 0.98 0.00 -0.55 0.00 0.00 41.25 39.14 3ihm s ASN 46 CO 0.00 -1.54 1.49 1.07 -2.79 0.00 0.00 177.10 175.33 3ihm n THR 47 N 7.06 0.00 -2.04 -5.21 5.66 -1.26 -4.73 114.28 113.76 3ihm n THR 47 Ca 0.16 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.78 3ihm n THR 47 Cb 0.48 -0.43 0.01 0.00 -1.55 0.00 0.00 70.33 68.84 3ihm n THR 47 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 3ihm s VAL 48 N -2.00 2.61 0.43 1.08 0.11 -1.26 -4.99 120.40 116.37 3ihm s VAL 48 Ca 0.25 0.50 -0.07 0.00 -2.93 0.00 0.00 61.98 59.72 3ihm s VAL 48 Cb 0.11 -3.27 -0.05 0.00 -1.53 0.00 0.00 36.38 31.64 3ihm s VAL 48 CO 0.19 0.03 0.75 0.00 -3.33 0.00 0.00 175.10 172.74 3ihm s ALA 49 N -1.35 3.42 -0.23 1.54 0.00 -1.26 -4.81 121.76 119.06 3ihm s ALA 49 Ca 0.63 -0.42 -0.10 0.00 0.00 0.00 0.00 51.96 52.07 3ihm s ALA 49 Cb -0.36 -2.58 -0.05 0.00 0.00 0.00 0.00 23.12 20.13 3ihm s ALA 49 CO 0.45 -0.15 0.16 -1.01 0.00 0.00 0.00 175.76 175.20 3ihm s HIS 50 N -2.52 3.34 0.80 0.00 3.76 0.58 -4.62 115.29 116.63 3ihm s HIS 50 Ca 0.48 0.26 -0.11 0.00 -0.15 0.00 0.00 55.06 55.54 3ihm s HIS 50 Cb -0.10 -2.25 0.10 0.00 1.11 0.00 0.00 32.58 31.44 3ihm s HIS 50 CO 0.38 0.12 1.15 0.54 -0.85 0.00 0.00 174.74 176.08 3ihm s ASN 51 N 0.88 4.36 0.32 1.40 2.20 -1.26 -0.35 114.94 122.50 3ihm s ASN 51 Ca 0.08 0.57 0.08 0.00 -0.94 0.00 0.00 52.86 52.65 3ihm s ASN 51 Cb -0.13 -1.03 0.79 0.00 -2.00 0.00 0.00 41.25 38.88 3ihm s ASN 51 CO 0.03 -1.95 1.80 0.00 -2.94 0.00 0.00 177.10 174.04 3ihm h ALA 52 N -1.01 1.77 -0.43 3.54 0.00 -1.80 0.10 119.26 121.43 3ihm h ALA 52 Ca -0.45 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.43 3ihm h ALA 52 Cb 1.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3ihm h ALA 52 CO 0.59 -0.10 -0.08 0.28 0.00 0.00 0.00 179.25 179.94 3ihm h VAL 53 N 0.72 1.27 -0.71 0.00 2.07 -1.93 -0.07 116.25 117.61 3ihm h VAL 53 Ca 0.55 -1.17 -0.05 0.00 0.82 0.00 0.00 66.70 66.85 3ihm h VAL 53 Cb 0.90 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 3ihm h VAL 53 CO -0.32 0.40 0.25 0.74 0.02 0.00 0.00 177.57 178.65 3ihm h THR 54 N 0.63 1.25 -0.94 2.57 2.02 -1.67 -2.62 112.91 114.16 3ihm h THR 54 Ca 0.11 -0.84 -0.00 0.00 0.77 0.00 0.00 66.41 66.45 3ihm h THR 54 Cb 0.60 0.47 -0.05 0.00 -1.74 0.00 0.00 68.15 67.44 3ihm h THR 54 CO 0.04 0.33 0.57 0.58 0.37 0.00 0.00 175.52 177.41 3ihm h VAL 55 N 1.03 1.26 -1.01 3.16 2.07 -0.73 -1.70 116.25 120.33 3ihm h VAL 55 Ca 0.23 -0.55 0.03 0.00 0.82 0.00 0.00 66.70 67.23 3ihm h VAL 55 Cb 0.26 -0.08 -0.06 0.00 -1.52 0.00 0.00 31.29 29.90 3ihm h VAL 55 CO -0.01 0.27 0.66 1.56 0.02 0.00 0.00 177.57 180.07 3ihm h GLN 56 N 1.30 1.26 -0.57 1.57 4.20 -0.77 -1.02 115.11 121.08 3ihm h GLN 56 Ca 0.34 -0.08 -0.07 0.00 0.06 0.00 0.00 58.65 58.90 3ihm h GLN 56 Cb -0.07 -0.28 -0.02 0.00 0.30 0.00 0.00 27.48 27.41 3ihm h GLN 56 CO -0.06 0.84 0.07 0.00 -0.67 0.00 0.00 178.83 179.00 3ihm h ARG 57 N 1.30 0.92 -0.60 1.46 3.08 -1.05 -1.66 114.38 117.83 3ihm h ARG 57 Ca 0.39 -0.23 -0.08 0.00 0.07 0.00 0.00 59.98 60.13 3ihm h ARG 57 Cb -0.05 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 3ihm h ARG 57 CO -0.11 0.87 0.04 0.93 -1.07 0.00 0.00 179.97 180.62 3ihm h GLU 58 N 0.87 1.01 -0.32 0.04 5.08 -0.60 0.15 114.58 120.81 3ihm h GLU 58 Ca 0.18 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 3ihm h GLU 58 Cb 0.41 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 3ihm h GLU 58 CO 0.01 0.97 0.13 0.28 -1.00 0.00 0.00 179.01 179.40 3ihm h VAL 59 N 0.94 1.18 -0.24 3.13 2.07 -1.04 0.13 116.25 122.41 3ihm h VAL 59 Ca 0.18 -0.55 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 3ihm h VAL 59 Cb 0.49 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3ihm h VAL 59 CO 0.02 0.19 -0.05 0.00 0.02 0.00 0.00 177.57 177.76 3ihm h ALA 60 N 0.98 1.48 -0.09 1.67 0.00 -1.04 -1.84 119.26 120.42 3ihm h ALA 60 Ca 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3ihm h ALA 60 Cb 0.18 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3ihm h ALA 60 CO -0.01 0.37 0.00 1.28 0.00 0.00 0.00 179.25 180.89 3ihm n LEU 61 N -4.30 1.13 -3.72 0.00 4.77 0.52 -4.94 117.00 110.45 3ihm n LEU 61 Ca 0.00 -0.45 -0.27 0.00 -0.03 0.00 0.00 56.01 55.27 3ihm n LEU 61 Cb 0.24 -0.06 0.06 0.00 -2.33 0.00 0.00 43.42 41.33 3ihm n LEU 61 CO 0.38 0.22 0.18 -0.67 -1.33 0.00 0.00 177.39 176.18 3ihm n ASP 62 N -0.06 -5.72 -0.59 -1.43 2.03 -0.41 -4.91 116.55 105.46 3ihm n ASP 62 Ca 0.17 -0.64 0.06 0.00 0.52 0.00 0.00 54.79 54.90 3ihm n ASP 62 Cb 0.26 -4.53 0.15 0.00 -0.72 0.00 0.00 41.12 36.28 3ihm n ASP 62 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 3ihm n VAL 63 N -4.86 1.63 -1.35 5.18 0.24 0.33 -4.92 118.33 114.58 3ihm n VAL 63 Ca 0.02 -2.42 -0.38 0.00 -2.04 0.00 0.00 64.34 59.53 3ihm n VAL 63 Cb 0.55 0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.90 3ihm n VAL 63 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3ihm n ASN 64 N -0.87 6.61 -0.15 -1.34 5.15 -1.22 -4.66 115.26 118.78 3ihm n ASN 64 Ca 0.15 -2.62 -0.09 0.00 -0.60 0.00 0.00 54.58 51.41 3ihm n ASN 64 Cb 0.75 -1.51 -0.00 0.00 -0.53 0.00 0.00 39.78 38.49 3ihm n ASN 64 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 3ihm h GLU 65 N 5.60 0.67 -4.35 1.20 4.57 -1.93 -3.38 114.58 116.95 3ihm h GLU 65 Ca 0.72 -0.15 -0.67 0.00 -1.18 0.00 0.00 59.36 58.08 3ihm h GLU 65 Cb 0.39 -0.09 -0.38 0.00 -0.16 0.00 0.00 28.75 28.50 3ihm h GLU 65 CO 1.79 0.66 -0.63 -1.58 -1.18 0.00 0.00 179.01 178.06 3ihm s TRP 66 N -5.37 3.60 0.36 0.92 0.51 -1.26 -5.10 118.94 112.61 3ihm s TRP 66 Ca -0.13 -2.86 -0.28 0.00 -2.12 0.00 0.00 56.10 50.71 3ihm s TRP 66 Cb 0.10 -3.01 -0.11 0.00 -0.81 0.00 0.00 33.47 29.64 3ihm s TRP 66 CO 0.77 -0.92 1.51 -2.30 -0.51 0.00 0.00 176.95 175.51 3ihm n PRO 67 N 4.11 2.69 0.24 4.98 -0.02 -1.26 -4.82 135.00 140.91 3ihm n PRO 67 Ca 0.03 0.95 0.09 0.00 -2.02 0.00 0.00 63.50 62.54 3ihm n PRO 67 Cb 0.40 -2.69 0.59 0.00 -0.02 0.00 0.00 33.50 31.78 3ihm n PRO 67 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3ihm h SER 68 N 3.29 0.00 0.82 2.55 4.64 -1.93 -0.37 113.55 122.55 3ihm h SER 68 Ca -0.50 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.71 3ihm h SER 68 Cb 1.24 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 3ihm h SER 68 CO 0.67 0.19 -0.50 -0.08 -0.87 0.00 0.00 176.83 176.23 3ihm h GLU 69 N 0.00 0.00 0.04 4.77 4.57 -1.91 0.22 114.58 122.27 3ihm h GLU 69 Ca -0.00 0.00 -0.36 0.00 -1.18 0.00 0.00 59.36 57.82 3ihm h GLU 69 Cb 0.40 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.94 3ihm h GLU 69 CO 0.02 0.50 -2.14 -1.91 -1.18 0.00 0.00 179.01 174.31 3ihm n GLU 70 N -3.59 0.69 0.00 1.92 4.07 -0.88 -4.62 120.64 118.23 3ihm n GLU 70 Ca -0.00 0.19 0.03 0.00 -0.06 0.00 0.00 57.16 57.32 3ihm n GLU 70 Cb 0.58 -1.64 -0.03 0.00 -0.06 0.00 0.00 31.44 30.29 3ihm n GLU 70 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 3ihm n PHE 71 N -3.20 0.00 -2.58 4.31 3.72 -0.20 -5.05 117.46 114.47 3ihm n PHE 71 Ca -0.33 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.02 3ihm n PHE 71 Cb 1.05 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 39.62 3ihm n PHE 71 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ihm n GLY 72 N 1.09 1.16 3.40 1.37 0.00 0.07 -4.67 105.19 107.60 3ihm n GLY 72 Ca 0.02 -2.04 -0.21 0.00 0.00 0.00 0.00 46.02 43.79 3ihm n GLY 72 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ihm s TYR 73 N -0.36 1.95 -0.53 1.61 -0.85 0.92 -4.90 117.35 115.19 3ihm s TYR 73 Ca 0.16 -0.47 0.05 0.00 -0.52 0.00 0.00 57.07 56.29 3ihm s TYR 73 Cb -0.01 -0.88 0.02 0.00 0.38 0.00 0.00 41.96 41.47 3ihm s TYR 73 CO 0.11 0.51 0.55 1.19 -1.52 0.00 0.00 175.55 176.38 3ihm n PHE 74 N -0.45 0.00 -3.93 -3.49 3.72 -0.05 -1.62 117.46 111.64 3ihm n PHE 74 Ca -0.07 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.34 3ihm n PHE 74 Cb 0.60 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.15 3ihm n PHE 74 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ihm n GLY 75 N 0.46 0.42 3.16 1.37 0.00 -1.26 -1.47 105.19 107.88 3ihm n GLY 75 Ca 0.02 -0.94 -0.33 0.00 0.00 0.00 0.00 46.02 44.78 3ihm n GLY 75 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3ihm s HIS 76 N -2.55 2.71 0.26 1.61 3.76 0.42 -1.76 115.29 119.74 3ihm s HIS 76 Ca 0.15 -1.42 -0.26 0.00 -0.15 0.00 0.00 55.06 53.37 3ihm s HIS 76 Cb -0.00 -1.85 -0.09 0.00 1.11 0.00 0.00 32.58 31.74 3ihm s HIS 76 CO -0.00 -0.67 0.89 0.71 -0.85 0.00 0.00 174.74 174.82 3ihm s TYR 77 N 0.96 3.81 -0.12 1.40 2.02 0.13 -0.96 117.35 124.60 3ihm s TYR 77 Ca -0.03 1.76 0.03 0.00 -0.37 0.00 0.00 57.07 58.46 3ihm s TYR 77 Cb -0.15 -2.88 0.01 0.00 -0.40 0.00 0.00 41.96 38.53 3ihm s TYR 77 CO -0.05 0.35 -0.22 0.71 -1.57 0.00 0.00 175.55 174.76 3ihm s TYR 78 N -1.40 2.54 -0.08 2.71 2.02 0.73 -0.72 117.35 123.15 3ihm s TYR 78 Ca 0.44 -1.15 0.04 0.00 -0.37 0.00 0.00 57.07 56.04 3ihm s TYR 78 Cb -0.21 -1.71 -0.00 0.00 -0.40 0.00 0.00 41.96 39.63 3ihm s TYR 78 CO 0.26 -0.50 -0.21 -0.47 -1.57 0.00 0.00 175.55 173.07 3ihm s TYR 79 N 0.57 2.21 -0.11 2.71 5.04 0.28 -2.26 117.35 125.80 3ihm s TYR 79 Ca -0.13 -0.81 -0.01 0.00 -2.44 0.00 0.00 57.07 53.67 3ihm s TYR 79 Cb -0.17 -1.49 0.03 0.00 0.35 0.00 0.00 41.96 40.69 3ihm s TYR 79 CO 0.04 -0.32 -0.01 0.54 -1.34 0.00 0.00 175.55 174.47 3ihm s VAL 80 N 0.25 0.55 0.00 3.14 0.11 -0.96 -0.16 120.40 123.33 3ihm s VAL 80 Ca -0.13 -0.11 0.00 0.00 -2.93 0.00 0.00 61.98 58.81 3ihm s VAL 80 Cb -0.16 -0.75 0.00 0.00 -1.53 0.00 0.00 36.38 33.94 3ihm s VAL 80 CO 0.06 0.18 0.00 0.61 -3.33 0.00 0.00 175.10 172.62 3ihm n GLY 81 N 5.08 -0.50 0.00 6.54 0.00 0.24 -1.41 105.19 115.15 3ihm n GLY 81 Ca -0.09 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.44 3ihm n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ihm n GLY 82 N 4.24 0.57 0.37 -0.02 0.00 -1.26 -4.48 105.19 104.60 3ihm n GLY 82 Ca 0.00 -2.15 0.06 0.00 0.00 0.00 0.00 46.02 43.92 3ihm n GLY 82 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3ihm h PRO 83 N 0.00 1.02 -3.78 1.61 0.11 -2.03 -3.29 132.00 125.64 3ihm h PRO 83 Ca 0.00 -0.06 -0.68 0.00 0.11 0.00 0.00 66.00 65.37 3ihm h PRO 83 Cb 0.00 -0.23 -0.37 0.00 0.11 0.00 0.00 31.00 30.51 3ihm h PRO 83 CO 0.00 0.68 -0.49 -1.14 -0.21 0.00 0.00 178.00 176.84 3ihm s GLN 84 N -5.97 2.24 0.54 1.05 2.00 -1.26 -5.10 119.66 113.16 3ihm s GLN 84 Ca -0.12 -2.38 -0.19 0.00 -2.00 0.00 0.00 55.36 50.67 3ihm s GLN 84 Cb 0.21 -3.57 -0.06 0.00 0.80 0.00 0.00 33.01 30.39 3ihm s GLN 84 CO 0.81 -1.12 1.10 -1.25 -0.50 0.00 0.00 175.29 174.33 3ihm s PRO 85 N 0.17 3.44 -0.13 1.67 0.04 -1.24 -4.93 135.00 134.01 3ihm s PRO 85 Ca 0.15 1.52 -0.02 0.00 0.04 0.00 0.00 61.00 62.69 3ihm s PRO 85 Cb -0.22 -2.03 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 3ihm s PRO 85 CO -0.03 -0.76 -0.07 -1.64 0.04 0.00 0.00 177.00 174.53 3ihm s MET 86 N -3.35 3.42 -0.17 4.56 -1.94 -0.50 -4.99 119.30 116.34 3ihm s MET 86 Ca 0.71 -0.58 0.00 0.00 -1.71 0.00 0.00 55.69 54.11 3ihm s MET 86 Cb -0.21 -2.76 0.03 0.00 2.01 0.00 0.00 34.83 33.90 3ihm s MET 86 CO 0.26 0.31 -0.10 1.03 -0.01 0.00 0.00 175.02 176.52 3ihm s ARG 87 N 0.15 1.89 0.31 2.03 0.52 -1.26 -2.25 118.95 120.33 3ihm s ARG 87 Ca -0.03 -0.61 -0.09 0.00 -0.52 0.00 0.00 55.73 54.47 3ihm s ARG 87 Cb -0.14 -2.13 0.01 0.00 0.52 0.00 0.00 34.95 33.21 3ihm s ARG 87 CO 0.04 -0.36 0.53 -0.59 0.02 0.00 0.00 175.30 174.94 3ihm s PHE 88 N 1.52 0.58 0.02 -0.53 -0.12 -0.96 -5.02 117.98 113.47 3ihm s PHE 88 Ca 0.02 -0.95 0.00 0.00 -0.05 0.00 0.00 56.93 55.95 3ihm s PHE 88 Cb -0.15 0.20 -0.01 0.00 -0.63 0.00 0.00 43.02 42.43 3ihm s PHE 88 CO -0.09 -1.15 -0.03 -0.47 -0.05 0.00 0.00 175.22 173.43 3ihm s TYR 89 N -3.35 0.24 -0.01 3.49 5.04 -1.26 -0.19 117.35 121.31 3ihm s TYR 89 Ca 0.24 -0.35 0.02 0.00 -2.44 0.00 0.00 57.07 54.55 3ihm s TYR 89 Cb -0.01 -0.16 -0.00 0.00 0.35 0.00 0.00 41.96 42.13 3ihm s TYR 89 CO 0.14 -0.11 -0.08 0.20 -1.34 0.00 0.00 175.55 174.36 3ihm s GLY 90 N -0.98 0.41 0.24 8.97 0.00 -0.13 -4.56 107.32 111.26 3ihm s GLY 90 Ca -0.10 -0.32 -0.20 0.00 0.00 0.00 0.00 44.72 44.11 3ihm s GLY 90 CO -0.01 -0.20 0.74 0.99 0.00 0.00 0.00 173.10 174.63 3ihm s ASP 91 N -0.05 7.06 0.09 1.64 1.01 -1.26 -0.44 116.67 124.72 3ihm s ASP 91 Ca 0.01 1.44 -0.18 0.00 0.71 0.00 0.00 52.55 54.53 3ihm s ASP 91 Cb -0.05 -2.43 -0.07 0.00 1.01 0.00 0.00 42.92 41.39 3ihm s ASP 91 CO -0.00 0.01 0.56 -0.76 0.21 0.00 0.00 175.17 175.19 3ihm s LEU 92 N -2.06 4.48 0.22 1.23 1.43 -0.54 -3.77 118.68 119.67 3ihm s LEU 92 Ca 0.44 1.22 -0.04 0.00 -1.03 0.00 0.00 54.13 54.71 3ihm s LEU 92 Cb -0.16 -3.00 0.20 0.00 0.03 0.00 0.00 46.19 43.26 3ihm s LEU 92 CO 0.21 0.23 1.66 0.11 0.23 0.00 0.00 176.35 178.78 3ihm h LYS 93 N 4.27 0.81 -4.42 1.70 1.57 -1.91 -3.44 116.57 115.15 3ihm h LYS 93 Ca -0.49 -0.30 -0.29 0.00 -1.87 0.00 0.00 60.65 57.70 3ihm h LYS 93 Cb 1.21 -0.05 -0.24 0.00 0.08 0.00 0.00 32.23 33.22 3ihm h LYS 93 CO 0.64 0.91 -0.74 0.00 -0.57 0.00 0.00 179.45 179.69 3ihm s ALA 94 N -4.73 0.49 0.47 3.86 0.00 -1.26 -5.14 121.76 115.45 3ihm s ALA 94 Ca -0.10 -0.51 -0.25 0.00 0.00 0.00 0.00 51.96 51.11 3ihm s ALA 94 Cb 0.13 -0.02 -0.08 0.00 0.00 0.00 0.00 23.12 23.16 3ihm s ALA 94 CO 0.83 0.03 1.42 -1.25 0.00 0.00 0.00 175.76 176.80 3ihm s PRO 95 N -0.91 3.56 0.38 0.00 0.04 -1.26 -4.54 135.00 132.27 3ihm s PRO 95 Ca -0.05 2.40 0.05 0.00 0.04 0.00 0.00 61.00 63.44 3ihm s PRO 95 Cb -0.06 -2.57 -0.00 0.00 0.04 0.00 0.00 34.50 31.90 3ihm s PRO 95 CO 0.00 -0.91 0.54 -1.12 0.04 0.00 0.00 177.00 175.55 3ihm s SER 96 N -0.58 5.85 -0.17 6.66 0.01 -0.64 -3.66 113.70 121.16 3ihm s SER 96 Ca 0.63 -0.14 -0.11 0.00 1.31 0.00 0.00 55.95 57.65 3ihm s SER 96 Cb -0.43 -1.16 0.06 0.00 0.21 0.00 0.00 66.02 64.69 3ihm s SER 96 CO 0.55 -0.58 0.42 -0.60 0.41 0.00 0.00 173.24 173.44 3ihm s ARG 97 N -4.31 0.43 -0.17 12.44 3.00 0.53 -0.06 118.95 130.81 3ihm s ARG 97 Ca 0.48 0.75 -0.01 0.00 -1.00 0.00 0.00 55.73 55.96 3ihm s ARG 97 Cb -0.10 0.05 -0.00 0.00 0.00 0.00 0.00 34.95 34.90 3ihm s ARG 97 CO 0.33 -0.13 -0.13 0.00 0.00 0.00 0.00 175.30 175.37 3ihm s ALA 98 N 1.12 2.57 -0.08 6.12 0.00 -1.26 -0.31 121.76 129.93 3ihm s ALA 98 Ca -0.07 -1.08 0.03 0.00 0.00 0.00 0.00 51.96 50.83 3ihm s ALA 98 Cb -0.07 -1.35 0.01 0.00 0.00 0.00 0.00 23.12 21.71 3ihm s ALA 98 CO -0.10 -0.15 -0.15 0.08 0.00 0.00 0.00 175.76 175.44 3ihm s VAL 99 N 1.00 1.39 -0.41 0.00 1.01 -1.26 -1.69 120.40 120.45 3ihm s VAL 99 Ca -0.01 -0.63 -0.45 0.00 0.00 0.00 0.00 61.98 60.89 3ihm s VAL 99 Cb -0.15 -1.25 -0.20 0.00 0.00 0.00 0.00 36.38 34.79 3ihm s VAL 99 CO -0.02 0.41 1.53 -0.67 0.00 0.00 0.00 175.10 176.35 3ihm n ASP 100 N 3.78 1.12 0.32 3.32 -0.08 0.80 -4.68 116.55 121.13 3ihm n ASP 100 Ca -0.22 1.18 0.20 0.00 -1.51 0.00 0.00 54.79 54.44 3ihm n ASP 100 Cb 0.52 -0.91 1.10 0.00 2.34 0.00 0.00 41.12 44.17 3ihm n ASP 100 CO 0.00 0.00 0.00 1.88 0.12 0.00 0.00 177.20 179.20 3ihm h TYR 101 N 4.85 0.00 0.00 -0.67 -1.99 -1.90 0.44 116.97 117.70 3ihm h TYR 101 Ca -0.45 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.28 3ihm h TYR 101 Cb 1.37 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.10 3ihm h TYR 101 CO 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 178.16 178.81 3ihm h ARG 102 N 0.00 0.00 0.00 4.88 3.08 -1.87 -0.25 114.38 120.22 3ihm h ARG 102 Ca -0.00 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.70 3ihm h ARG 102 Cb 0.03 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.02 3ihm h ARG 102 CO 0.00 0.00 -2.34 1.28 -1.07 0.00 0.00 179.97 177.84 3ihm n LEU 103 N -2.55 2.97 -0.05 3.04 4.77 -0.02 -4.35 117.00 120.81 3ihm n LEU 103 Ca 0.02 -0.12 -0.14 0.00 -0.03 0.00 0.00 56.01 55.74 3ihm n LEU 103 Cb 0.27 -0.82 -0.07 0.00 -2.33 0.00 0.00 43.42 40.46 3ihm n LEU 103 CO 0.23 0.89 0.53 0.22 -1.33 0.00 0.00 177.39 177.94 3ihm h TYR 104 N -0.01 0.51 -0.30 -1.77 3.20 -0.97 -3.08 116.97 114.55 3ihm h TYR 104 Ca -0.53 -0.18 -0.03 0.00 3.14 0.00 0.00 58.73 61.14 3ihm h TYR 104 Cb 1.81 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.97 3ihm h TYR 104 CO 0.03 0.86 0.09 1.96 -1.64 0.00 0.00 178.16 179.45 3ihm h GLN 105 N 0.01 0.48 -0.49 1.82 1.08 -1.30 -2.41 115.11 114.30 3ihm h GLN 105 Ca 0.01 -0.11 0.02 0.00 -1.45 0.00 0.00 58.65 57.12 3ihm h GLN 105 Cb 0.82 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 28.16 3ihm h GLN 105 CO 0.05 0.53 0.33 -1.35 -0.95 0.00 0.00 178.83 177.44 3ihm h PRO 106 N 0.33 0.57 -0.41 1.46 0.11 -1.75 -0.78 132.00 131.53 3ihm h PRO 106 Ca 0.10 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.18 3ihm h PRO 106 Cb 0.26 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.22 3ihm h PRO 106 CO -0.00 0.38 0.25 1.98 -0.21 0.00 0.00 178.00 180.40 3ihm h MET 107 N 0.59 0.50 -0.59 1.05 -1.53 -1.39 -0.88 114.93 112.68 3ihm h MET 107 Ca 0.19 -0.03 -0.10 0.00 -3.44 0.00 0.00 59.70 56.32 3ihm h MET 107 Cb 0.04 -0.11 -0.02 0.00 -0.55 0.00 0.00 31.60 30.96 3ihm h MET 107 CO -0.05 0.33 -0.02 -0.07 0.14 0.00 0.00 176.91 177.24 3ihm h LEU 108 N 0.51 1.02 -0.51 3.39 3.38 -0.90 -2.20 115.31 120.01 3ihm h LEU 108 Ca 0.16 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 3ihm h LEU 108 Cb -0.02 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 3ihm h LEU 108 CO -0.06 1.08 0.13 0.24 0.09 0.00 0.00 178.44 179.93 3ihm h MET 109 N 0.95 0.81 -0.14 1.13 2.86 -0.96 -0.89 114.93 118.69 3ihm h MET 109 Ca 0.16 -0.19 -0.12 0.00 -2.06 0.00 0.00 59.70 57.49 3ihm h MET 109 Cb 0.58 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 3ihm h MET 109 CO 0.03 0.78 -0.44 0.00 1.06 0.00 0.00 176.91 178.34 3ihm h ARG 110 N 0.70 0.32 -0.40 1.72 3.08 -1.12 -1.32 114.38 117.36 3ihm h ARG 110 Ca 0.16 -0.16 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 3ihm h ARG 110 Cb 0.32 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 3ihm h ARG 110 CO 0.00 0.70 -0.34 0.00 -1.07 0.00 0.00 179.97 179.26 3ihm h ALA 111 N 1.28 0.63 -0.27 0.04 0.00 -1.23 -2.29 119.26 117.42 3ihm h ALA 111 Ca 0.02 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.41 3ihm h ALA 111 Cb 0.88 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3ihm h ALA 111 CO 0.07 0.67 -0.14 1.25 0.00 0.00 0.00 179.25 181.10 3ihm h LEU 112 N 0.76 0.59 -0.82 0.00 5.85 -0.99 -2.76 115.31 117.94 3ihm h LEU 112 Ca 0.07 -0.42 -0.02 0.00 0.84 0.00 0.00 57.88 58.35 3ihm h LEU 112 Cb 0.93 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.75 3ihm h LEU 112 CO 0.09 0.88 0.42 -0.08 -0.34 0.00 0.00 178.44 179.41 3ihm h GLU 113 N 0.30 1.17 0.00 1.25 4.81 -1.28 -0.01 114.58 120.81 3ihm h GLU 113 Ca 0.06 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 3ihm h GLU 113 Cb 0.66 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.82 3ihm h GLU 113 CO 0.04 0.88 -0.09 0.00 -0.73 0.00 0.00 179.01 179.11 3ihm h ALA 114 N 1.22 1.07 -0.45 2.92 0.00 -1.37 -2.84 119.26 119.81 3ihm h ALA 114 Ca 0.29 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3ihm h ALA 114 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3ihm h ALA 114 CO -0.04 0.12 0.00 0.54 0.00 0.00 0.00 179.25 179.87 3ihm n ARG 115 N -3.30 2.51 0.00 0.00 1.74 -1.01 -4.94 116.66 111.67 3ihm n ARG 115 Ca -0.00 -2.30 0.00 0.00 -0.77 0.00 0.00 57.85 54.78 3ihm n ARG 115 Cb 0.31 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 3ihm n ARG 115 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ihm n GLY 116 N 1.52 0.73 3.72 -0.13 0.00 -1.07 -4.98 105.19 104.98 3ihm n GLY 116 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3ihm n GLY 116 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ihm s GLY 117 N -0.74 2.19 0.05 -0.02 0.00 -0.05 -4.78 107.32 103.97 3ihm s GLY 117 Ca 0.00 1.01 -0.14 0.00 0.00 0.00 0.00 44.72 45.58 3ihm s GLY 117 CO 0.00 2.19 0.45 0.54 0.00 0.00 0.00 173.10 176.29 3ihm s LYS 118 N 0.97 3.94 -0.13 2.90 -0.14 -0.47 -4.03 119.74 122.78 3ihm s LYS 118 Ca 0.61 0.43 0.02 0.00 -1.36 0.00 0.00 55.97 55.68 3ihm s LYS 118 Cb -0.34 -3.13 -0.00 0.00 -1.68 0.00 0.00 37.83 32.68 3ihm s LYS 118 CO 0.30 0.63 -0.20 -0.06 -0.76 0.00 0.00 175.35 175.26 3ihm s PHE 119 N -1.21 2.68 -0.37 3.18 0.08 -1.26 -0.24 117.98 120.84 3ihm s PHE 119 Ca 0.29 -1.04 -0.04 0.00 0.12 0.00 0.00 56.93 56.25 3ihm s PHE 119 Cb -0.16 -1.80 0.08 0.00 -0.57 0.00 0.00 43.02 40.57 3ihm s PHE 119 CO 0.16 -0.44 0.15 0.00 -0.10 0.00 0.00 175.22 174.99 3ihm s TYR 121 N 1.27 2.86 -0.11 0.00 2.02 -1.26 -2.62 117.35 119.52 3ihm s TYR 121 Ca 0.02 -1.41 -0.18 0.00 -0.37 0.00 0.00 57.07 55.13 3ihm s TYR 121 Cb -0.21 -4.61 0.04 0.00 -0.40 0.00 0.00 41.96 36.78 3ihm s TYR 121 CO -0.01 -1.74 0.45 0.34 -1.57 0.00 0.00 175.55 173.02 3ihm s ASP 122 N 4.18 -0.42 0.01 2.29 -1.08 -0.75 -4.92 116.67 115.97 3ihm s ASP 122 Ca 0.47 0.66 -0.30 0.00 -0.52 0.00 0.00 52.55 52.86 3ihm s ASP 122 Cb 0.00 0.71 -0.04 0.00 -1.46 0.00 0.00 42.92 42.14 3ihm s ASP 122 CO -0.02 -0.30 1.14 0.00 0.52 0.00 0.00 175.17 176.51 3ihm s ALA 123 N -0.40 3.36 -0.17 3.66 0.00 -1.26 -4.01 121.76 122.94 3ihm s ALA 123 Ca -0.05 0.69 -0.03 0.00 0.00 0.00 0.00 51.96 52.57 3ihm s ALA 123 Cb -0.03 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.63 3ihm s ALA 123 CO 0.03 -0.48 -0.07 0.08 0.00 0.00 0.00 175.76 175.32 3ihm s VAL 124 N 1.40 3.42 0.54 0.00 1.01 -1.26 -5.09 120.40 120.42 3ihm s VAL 124 Ca 0.56 -0.51 0.03 0.00 0.00 0.00 0.00 61.98 62.06 3ihm s VAL 124 Cb -0.26 -2.50 0.02 0.00 0.00 0.00 0.00 36.38 33.65 3ihm s VAL 124 CO 0.26 0.48 0.25 -0.94 0.00 0.00 0.00 175.10 175.16 3ihm s SER 125 N 0.77 4.44 0.37 3.32 1.04 -1.26 -4.79 113.70 117.59 3ihm s SER 125 Ca -0.03 -1.43 0.07 0.00 0.48 0.00 0.00 55.95 55.04 3ihm s SER 125 Cb -0.15 0.53 0.79 0.00 0.10 0.00 0.00 66.02 67.29 3ihm s SER 125 CO 0.02 -1.05 1.96 0.00 0.98 0.00 0.00 173.24 175.15 3ihm h ALA 126 N 0.95 1.75 0.00 5.32 0.00 -1.89 -2.08 119.26 123.31 3ihm h ALA 126 Ca -0.39 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 3ihm h ALA 126 Cb 1.31 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 3ihm h ALA 126 CO 0.63 0.12 -0.10 1.05 0.00 0.00 0.00 179.25 180.95 3ihm h GLU 127 N 0.70 0.00 0.00 0.00 4.11 -1.97 -2.98 114.58 114.44 3ihm h GLU 127 Ca 0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.74 3ihm h GLU 127 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3ihm h GLU 127 CO -0.10 0.10 -0.33 -0.44 0.07 0.00 0.00 179.01 178.31 3ihm h ASP 128 N 0.00 0.00 -0.66 3.06 3.32 -1.78 -3.39 116.42 116.97 3ihm h ASP 128 Ca -0.00 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 3ihm h ASP 128 Cb 0.41 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 3ihm h ASP 128 CO 0.01 0.02 0.32 -0.07 -1.72 0.00 0.00 179.24 177.81 3ihm h LEU 129 N 0.00 0.88 -0.48 1.55 3.38 -1.60 -2.24 115.31 116.80 3ihm h LEU 129 Ca 0.00 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 3ihm h LEU 129 Cb 0.88 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 3ihm h LEU 129 CO 0.00 0.76 0.03 -0.08 0.09 0.00 0.00 178.44 179.24 3ihm h GLU 130 N 0.97 0.83 -0.65 1.13 4.81 -1.80 -1.37 114.58 118.50 3ihm h GLU 130 Ca 0.24 -0.25 -0.08 0.00 -0.13 0.00 0.00 59.36 59.14 3ihm h GLU 130 Cb 0.11 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.38 3ihm h GLU 130 CO -0.03 0.86 0.11 0.78 -0.73 0.00 0.00 179.01 180.00 3ihm h GLY 131 N 0.69 1.15 2.00 1.92 0.00 -1.76 -3.01 103.07 104.07 3ihm h GLY 131 Ca 0.14 -0.77 -0.10 0.00 0.00 0.00 0.00 47.33 46.60 3ihm h GLY 131 CO 0.02 0.71 -0.50 1.41 0.00 0.00 0.00 176.54 178.18 3ihm h LEU 132 N 0.99 0.00 -1.41 3.11 3.38 -1.31 -3.09 115.31 116.98 3ihm h LEU 132 Ca 0.20 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 3ihm h LEU 132 Cb 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 3ihm h LEU 132 CO 0.01 0.50 -0.26 0.77 0.09 0.00 0.00 178.44 179.55 3ihm h SER 133 N 0.00 0.00 0.53 -0.43 4.64 -1.11 -2.38 113.55 114.80 3ihm h SER 133 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ihm h SER 133 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 3ihm h SER 133 CO 0.06 0.26 -0.39 -0.62 -0.87 0.00 0.00 176.83 175.28 3ihm n GLU 134 N -3.74 0.13 0.09 4.77 1.02 -1.17 -3.85 120.64 117.88 3ihm n GLU 134 Ca -0.01 -0.07 0.10 0.00 -0.02 0.00 0.00 57.16 57.16 3ihm n GLU 134 Cb 0.37 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.27 3ihm n GLU 134 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3ihm n GLN 135 N -1.38 0.61 -4.35 3.49 6.02 -0.91 -4.96 117.38 115.90 3ihm n GLN 135 Ca 0.07 0.12 -0.18 0.00 -0.01 0.00 0.00 57.00 57.00 3ihm n GLN 135 Cb 0.33 -1.81 -0.10 0.00 1.02 0.00 0.00 30.24 29.68 3ihm n GLN 135 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 3ihm s TYR 136 N -3.31 1.68 0.23 1.08 2.02 -1.16 -4.79 117.35 113.10 3ihm s TYR 136 Ca -0.01 -0.71 0.02 0.00 -0.37 0.00 0.00 57.07 55.99 3ihm s TYR 136 Cb 0.10 -0.89 0.23 0.00 -0.40 0.00 0.00 41.96 41.00 3ihm s TYR 136 CO 0.80 0.21 1.57 -0.44 -1.57 0.00 0.00 175.55 176.11 3ihm h ASP 137 N 2.49 0.41 -3.43 2.29 3.32 -1.33 -3.44 116.42 116.73 3ihm h ASP 137 Ca -0.38 -0.21 -0.19 0.00 0.02 0.00 0.00 57.03 56.26 3ihm h ASP 137 Cb 1.22 -0.12 -0.29 0.00 0.22 0.00 0.00 39.33 40.36 3ihm h ASP 137 CO 0.64 0.87 -0.48 -0.22 -1.72 0.00 0.00 179.24 178.33 3ihm s LEU 138 N -8.16 0.54 -0.22 1.55 2.96 -1.19 -4.84 118.68 109.33 3ihm s LEU 138 Ca -0.05 0.51 -0.08 0.00 -0.22 0.00 0.00 54.13 54.28 3ihm s LEU 138 Cb 0.12 0.74 -0.04 0.00 0.50 0.00 0.00 46.19 47.50 3ihm s LEU 138 CO 0.81 -0.15 0.10 -0.22 -1.32 0.00 0.00 176.35 175.57 3ihm s LEU 139 N 1.06 3.83 -0.13 -0.68 2.96 -1.26 -1.62 118.68 122.84 3ihm s LEU 139 Ca -0.08 0.03 0.01 0.00 -0.22 0.00 0.00 54.13 53.87 3ihm s LEU 139 Cb -0.09 -2.00 -0.00 0.00 0.50 0.00 0.00 46.19 44.60 3ihm s LEU 139 CO -0.07 0.09 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.18 3ihm s VAL 140 N 0.88 2.53 -0.13 1.68 1.01 0.80 -1.95 120.40 125.23 3ihm s VAL 140 Ca 0.05 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.21 3ihm s VAL 140 Cb -0.13 -2.04 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 3ihm s VAL 140 CO 0.03 0.53 -0.16 0.54 0.00 0.00 0.00 175.10 176.04 3ihm s VAL 141 N 0.57 2.73 0.00 2.92 0.11 -0.63 0.95 120.40 127.05 3ihm s VAL 141 Ca -0.11 -0.77 0.00 0.00 -2.93 0.00 0.00 61.98 58.17 3ihm s VAL 141 Cb -0.16 -2.12 0.00 0.00 -1.53 0.00 0.00 36.38 32.56 3ihm s VAL 141 CO 0.04 0.53 0.34 0.00 -3.33 0.00 0.00 175.10 172.68 3ihm s THR 143 N -0.08 3.90 -0.86 0.00 -1.32 -1.20 -4.02 115.64 112.06 3ihm s THR 143 Ca 0.00 -0.38 0.25 0.00 -1.21 0.00 0.00 61.69 60.35 3ihm s THR 143 Cb 0.00 -2.65 0.08 0.00 -1.51 0.00 0.00 72.50 68.42 3ihm s THR 143 CO 0.00 0.56 1.50 0.61 -2.21 0.00 0.00 174.62 175.07 3ihm n GLY 144 N 2.76 -1.38 3.81 6.08 0.00 -1.26 -4.61 105.19 110.59 3ihm n GLY 144 Ca -0.18 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.27 3ihm n GLY 144 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ihm s LYS 145 N -3.06 3.11 -1.41 1.61 -2.85 -1.26 -3.23 119.74 112.65 3ihm s LYS 145 Ca 0.10 1.07 -0.00 0.00 -1.00 0.00 0.00 55.97 56.14 3ihm s LYS 145 Cb 0.16 -2.01 0.00 0.00 -2.06 0.00 0.00 37.83 33.92 3ihm s LYS 145 CO 0.67 -0.96 0.03 0.66 0.10 0.00 0.00 175.35 175.85 3ihm n TYR 146 N -2.61 -0.84 -2.47 1.78 4.01 -1.26 -3.75 117.16 112.02 3ihm n TYR 146 Ca 0.08 0.03 -0.19 0.00 -0.16 0.00 0.00 57.90 57.66 3ihm n TYR 146 Cb 0.53 -3.39 -0.01 0.00 -0.31 0.00 0.00 39.34 36.16 3ihm n TYR 146 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3ihm n ALA 147 N -1.89 -0.69 0.41 -0.72 0.00 -1.20 -4.45 120.51 111.96 3ihm n ALA 147 Ca -0.19 0.16 0.13 0.00 0.00 0.00 0.00 53.44 53.54 3ihm n ALA 147 Cb 0.65 -2.16 0.49 0.00 0.00 0.00 0.00 19.45 18.42 3ihm n ALA 147 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3ihm h LEU 148 N -0.12 0.00 -1.85 0.00 3.38 -1.64 -3.12 115.31 111.97 3ihm h LEU 148 Ca -0.45 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.49 3ihm h LEU 148 Cb 1.33 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.08 3ihm h LEU 148 CO 0.53 0.00 -0.13 1.23 0.09 0.00 0.00 178.44 180.15 3ihm h GLY 149 N 2.88 0.00 2.00 0.83 0.00 -1.82 -2.78 103.07 104.18 3ihm h GLY 149 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3ihm h GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.54 177.04 3ihm h LYS 150 N 0.00 0.00 0.00 4.80 1.57 -1.91 -2.76 116.57 118.27 3ihm h LYS 150 Ca -0.00 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 3ihm h LYS 150 Cb 0.28 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 3ihm h LYS 150 CO 0.02 0.00 -0.56 0.28 -0.57 0.00 0.00 179.45 178.61 3ihm h VAL 151 N 0.00 1.34 -3.69 0.50 2.07 -1.72 -3.42 116.25 111.34 3ihm h VAL 151 Ca 0.00 -1.97 -0.67 0.00 0.82 0.00 0.00 66.70 64.88 3ihm h VAL 151 Cb 0.40 2.08 -0.21 0.00 -1.52 0.00 0.00 31.29 32.04 3ihm h VAL 151 CO 0.00 0.55 -0.52 -0.36 0.02 0.00 0.00 177.57 177.26 3ihm s PHE 152 N -3.65 3.20 0.25 1.57 0.08 -1.04 -4.87 117.98 113.52 3ihm s PHE 152 Ca -0.01 -0.38 -0.31 0.00 0.12 0.00 0.00 56.93 56.35 3ihm s PHE 152 Cb 0.13 -2.41 -0.13 0.00 -0.57 0.00 0.00 43.02 40.03 3ihm s PHE 152 CO 0.75 -0.40 1.41 -1.91 -0.10 0.00 0.00 175.22 174.96 3ihm n GLU 153 N 5.04 2.07 -2.35 0.44 4.07 -1.26 -4.59 120.64 124.06 3ihm n GLU 153 Ca -0.13 0.74 -0.42 0.00 -0.06 0.00 0.00 57.16 57.29 3ihm n GLU 153 Cb 0.49 -2.39 -0.03 0.00 -0.06 0.00 0.00 31.44 29.45 3ihm n GLU 153 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 3ihm s LYS 154 N -0.53 4.42 -0.56 5.31 2.20 -1.26 -0.81 119.74 128.52 3ihm s LYS 154 Ca 0.67 1.87 -0.19 0.00 -0.36 0.00 0.00 55.97 57.96 3ihm s LYS 154 Cb -0.64 -3.29 0.08 0.00 -1.51 0.00 0.00 37.83 32.48 3ihm s LYS 154 CO 0.51 -0.24 0.68 -0.65 -0.36 0.00 0.00 175.35 175.28 3ihm s GLN 155 N 0.65 3.08 0.32 4.03 -0.21 0.09 -4.90 119.66 122.71 3ihm s GLN 155 Ca 0.58 -1.13 0.01 0.00 0.02 0.00 0.00 55.36 54.84 3ihm s GLN 155 Cb -0.32 -4.20 0.53 0.00 1.00 0.00 0.00 33.01 30.02 3ihm s GLN 155 CO 0.32 -1.42 1.91 0.66 -2.12 0.00 0.00 175.29 174.63 3ihm h SER 156 N 9.12 0.71 0.36 5.90 4.64 -1.86 -1.29 113.55 131.14 3ihm h SER 156 Ca -0.29 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3ihm h SER 156 Cb 1.09 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3ihm h SER 156 CO 1.05 0.64 0.00 1.05 -0.87 0.00 0.00 176.83 178.69 3ihm h GLU 157 N 0.78 0.00 -0.12 4.77 9.09 -1.95 -2.07 114.58 125.07 3ihm h GLU 157 Ca 0.19 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.60 3ihm h GLU 157 Cb 0.14 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.24 3ihm h GLU 157 CO -0.02 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.13 3ihm n ASN 158 N -2.97 2.13 -3.61 3.06 3.02 -0.66 -4.84 115.26 111.38 3ihm n ASN 158 Ca -0.01 -1.74 -0.28 0.00 -0.03 0.00 0.00 54.58 52.52 3ihm n ASN 158 Cb 0.15 -0.08 -0.11 0.00 -0.61 0.00 0.00 39.78 39.13 3ihm n ASN 158 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3ihm s SER 159 N -0.82 2.93 0.44 6.41 0.01 -0.58 -4.29 113.70 117.79 3ihm s SER 159 Ca 0.10 -3.33 0.24 0.00 1.31 0.00 0.00 55.95 54.27 3ihm s SER 159 Cb 0.06 -0.94 0.71 0.00 0.21 0.00 0.00 66.02 66.05 3ihm s SER 159 CO 0.08 -0.15 1.74 1.55 0.41 0.00 0.00 173.24 176.87 3ihm h PRO 160 N 5.64 0.00 -5.90 12.44 0.13 -1.89 -3.45 132.00 138.98 3ihm h PRO 160 Ca 0.20 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.68 3ihm h PRO 160 Cb 0.85 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.90 3ihm h PRO 160 CO 0.51 0.16 -0.54 -0.06 -0.23 0.00 0.00 178.00 177.84 3ihm s PHE 161 N -3.41 3.40 -0.16 1.56 0.08 -1.26 -5.00 117.98 113.18 3ihm s PHE 161 Ca 0.03 0.29 0.03 0.00 0.12 0.00 0.00 56.93 57.39 3ihm s PHE 161 Cb 0.08 -1.79 -0.02 0.00 -0.57 0.00 0.00 43.02 40.72 3ihm s PHE 161 CO 0.64 0.60 0.19 0.39 -0.10 0.00 0.00 175.22 176.94 3ihm n GLU 162 N 1.23 4.96 -4.06 0.44 -0.58 -1.26 -4.74 120.64 116.64 3ihm n GLU 162 Ca -0.13 -0.12 -0.08 0.00 -0.42 0.00 0.00 57.16 56.41 3ihm n GLU 162 Cb 0.53 -0.70 -0.09 0.00 -0.57 0.00 0.00 31.44 30.61 3ihm n GLU 162 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 3ihm s LYS 163 N -1.06 0.71 0.26 3.49 0.00 -1.26 -4.99 119.74 116.89 3ihm s LYS 163 Ca 0.01 -1.21 -0.30 0.00 0.00 0.00 0.00 55.97 54.47 3ihm s LYS 163 Cb 0.02 0.24 -0.14 0.00 0.00 0.00 0.00 37.83 37.96 3ihm s LYS 163 CO 0.09 -0.17 1.30 -2.30 0.00 0.00 0.00 175.35 174.28 3ihm n PRO 164 N 0.04 1.86 0.11 1.78 -0.02 -1.26 -4.74 135.00 132.77 3ihm n PRO 164 Ca -0.13 0.66 0.12 0.00 -2.02 0.00 0.00 63.50 62.13 3ihm n PRO 164 Cb 0.62 -2.24 0.07 0.00 -0.02 0.00 0.00 33.50 31.92 3ihm n PRO 164 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 3ihm h GLN 165 N 3.48 0.00 -4.48 -0.52 1.08 -1.98 -3.47 115.11 109.21 3ihm h GLN 165 Ca -0.44 0.00 -0.27 0.00 -1.45 0.00 0.00 58.65 56.48 3ihm h GLN 165 Cb 1.29 0.00 -0.22 0.00 -0.05 0.00 0.00 27.48 28.50 3ihm h GLN 165 CO 0.70 0.00 -0.73 1.03 -0.95 0.00 0.00 178.83 178.88 3ihm s ARG 166 N -3.29 0.49 -0.30 1.46 3.00 -1.26 -4.53 118.95 114.52 3ihm s ARG 166 Ca 0.02 -0.66 -0.21 0.00 0.00 0.00 0.00 55.73 54.89 3ihm s ARG 166 Cb 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 34.95 34.76 3ihm s ARG 166 CO 0.76 0.05 0.65 0.00 0.00 0.00 0.00 175.30 176.76 3ihm s ALA 167 N -1.19 3.54 -0.08 2.13 0.00 0.10 -4.58 121.76 121.69 3ihm s ALA 167 Ca -0.09 -0.59 -0.15 0.00 0.00 0.00 0.00 51.96 51.14 3ihm s ALA 167 Cb -0.09 -3.12 -0.05 0.00 0.00 0.00 0.00 23.12 19.87 3ihm s ALA 167 CO 0.00 -1.05 0.37 -0.51 0.00 0.00 0.00 175.76 174.57 3ihm s LEU 168 N 2.64 4.37 -0.28 0.00 1.43 0.70 -1.59 118.68 125.95 3ihm s LEU 168 Ca 0.26 0.78 -0.02 0.00 -1.03 0.00 0.00 54.13 54.12 3ihm s LEU 168 Cb -0.15 -2.51 0.09 0.00 0.03 0.00 0.00 46.19 43.65 3ihm s LEU 168 CO 0.11 0.21 0.08 0.00 0.23 0.00 0.00 176.35 176.98 3ihm s VAL 170 N 1.72 2.56 0.07 0.00 1.01 0.42 -1.40 120.40 124.79 3ihm s VAL 170 Ca 0.07 -0.81 -0.11 0.00 0.00 0.00 0.00 61.98 61.12 3ihm s VAL 170 Cb -0.17 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.15 3ihm s VAL 170 CO -0.22 0.52 0.26 -0.83 0.00 0.00 0.00 175.10 174.83 3ihm s GLY 171 N 0.80 -0.04 -0.22 4.51 0.00 -0.79 0.23 107.32 111.82 3ihm s GLY 171 Ca -0.06 -0.26 -0.11 0.00 0.00 0.00 0.00 44.72 44.30 3ihm s GLY 171 CO -0.00 -0.46 0.16 1.08 0.00 0.00 0.00 173.10 173.87 3ihm s LEU 172 N -2.41 4.16 0.11 0.66 1.43 -0.60 -0.04 118.68 122.00 3ihm s LEU 172 Ca -0.01 0.19 0.09 0.00 -1.03 0.00 0.00 54.13 53.37 3ihm s LEU 172 Cb 0.01 -2.12 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 3ihm s LEU 172 CO -0.07 0.11 -0.22 -0.36 0.23 0.00 0.00 176.35 176.04 3ihm s PHE 173 N 0.73 1.93 0.33 0.29 0.08 0.21 -0.87 117.98 120.69 3ihm s PHE 173 Ca 0.08 -0.41 0.07 0.00 0.12 0.00 0.00 56.93 56.80 3ihm s PHE 173 Cb -0.12 -1.05 -0.03 0.00 -0.57 0.00 0.00 43.02 41.25 3ihm s PHE 173 CO 0.02 0.25 0.27 -1.59 -0.10 0.00 0.00 175.22 174.07 3ihm s LYS 174 N -2.00 2.72 0.00 0.44 -2.85 0.00 -1.96 119.74 116.10 3ihm s LYS 174 Ca 0.09 -1.28 0.00 0.00 -1.00 0.00 0.00 55.97 53.78 3ihm s LYS 174 Cb -0.10 -2.47 0.00 0.00 -2.06 0.00 0.00 37.83 33.20 3ihm s LYS 174 CO 0.05 0.13 0.00 0.41 0.10 0.00 0.00 175.35 176.04 3ihm n GLY 175 N -1.34 0.50 3.42 0.59 0.00 -1.26 -3.33 105.19 103.77 3ihm n GLY 175 Ca -0.03 -0.25 -0.39 0.00 0.00 0.00 0.00 46.02 45.36 3ihm n GLY 175 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ihm s ILE 176 N -2.00 4.55 0.55 -0.61 1.01 -1.26 -1.15 121.20 122.29 3ihm s ILE 176 Ca 0.00 -0.54 -0.21 0.00 0.00 0.00 0.00 60.65 59.90 3ihm s ILE 176 Cb 0.00 -3.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.04 3ihm s ILE 176 CO 0.00 -0.01 1.25 -0.54 0.00 0.00 0.00 174.94 175.65 3ihm s LYS 177 N 1.59 3.19 0.34 2.79 1.02 0.61 -4.88 119.74 124.40 3ihm s LYS 177 Ca 0.04 1.96 -0.26 0.00 0.02 0.00 0.00 55.97 57.73 3ihm s LYS 177 Cb -0.18 -2.15 -0.10 0.00 -0.52 0.00 0.00 37.83 34.89 3ihm s LYS 177 CO 0.06 -1.07 1.00 -2.00 -0.92 0.00 0.00 175.35 172.42 3ihm s GLU 178 N -3.04 4.44 0.85 1.68 2.12 -1.26 -4.89 118.70 118.59 3ihm s GLU 178 Ca 0.73 1.44 -0.11 0.00 0.36 0.00 0.00 54.97 57.39 3ihm s GLU 178 Cb -0.34 -2.75 0.10 0.00 0.26 0.00 0.00 34.13 31.40 3ihm s GLU 178 CO 0.39 0.12 1.10 0.00 -0.54 0.00 0.00 175.26 176.33 3ihm s ALA 179 N -1.58 1.80 0.37 6.30 0.00 -1.26 -4.90 121.76 122.49 3ihm s ALA 179 Ca 0.52 0.27 0.20 0.00 0.00 0.00 0.00 51.96 52.95 3ihm s ALA 179 Cb -0.21 -3.30 1.24 0.00 0.00 0.00 0.00 23.12 20.85 3ihm s ALA 179 CO 0.27 -2.22 1.63 -1.35 0.00 0.00 0.00 175.76 174.09 3ihm h PRO 180 N -1.46 0.16 -6.37 0.00 0.11 -2.01 -3.34 132.00 119.09 3ihm h PRO 180 Ca -0.45 -0.01 -0.69 0.00 0.11 0.00 0.00 66.00 64.95 3ihm h PRO 180 Cb 1.25 -0.04 -0.27 0.00 0.11 0.00 0.00 31.00 32.06 3ihm h PRO 180 CO 0.49 0.11 -0.83 -1.50 -0.21 0.00 0.00 178.00 176.06 3ihm s ILE 181 N -5.54 2.55 -0.24 4.15 2.07 -1.26 -5.08 121.20 117.86 3ihm s ILE 181 Ca -0.09 -0.91 -0.31 0.00 -1.41 0.00 0.00 60.65 57.93 3ihm s ILE 181 Cb 0.31 -1.96 -0.07 0.00 0.13 0.00 0.00 42.46 40.87 3ihm s ILE 181 CO 0.79 0.58 2.18 0.54 -1.91 0.00 0.00 174.94 177.13 3ihm n ARG 182 N 2.48 1.76 -3.57 3.50 1.74 -1.26 -4.90 116.66 116.40 3ihm n ARG 182 Ca -0.17 0.50 -0.12 0.00 -0.77 0.00 0.00 57.85 57.30 3ihm n ARG 182 Cb 0.52 -2.97 -0.04 0.00 -1.02 0.00 0.00 32.46 28.94 3ihm n ARG 182 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3ihm s ALA 183 N 7.60 -1.20 0.38 7.54 0.00 -1.26 -0.87 121.76 133.95 3ihm s ALA 183 Ca 1.02 0.31 -0.25 0.00 0.00 0.00 0.00 51.96 53.05 3ihm s ALA 183 Cb -0.51 0.59 -0.09 0.00 0.00 0.00 0.00 23.12 23.11 3ihm s ALA 183 CO 0.41 -0.60 1.04 0.08 0.00 0.00 0.00 175.76 176.68 3ihm s VAL 184 N -3.20 3.76 -0.16 0.00 1.01 -0.72 -4.56 120.40 116.53 3ihm s VAL 184 Ca -0.01 1.40 -0.01 0.00 0.00 0.00 0.00 61.98 63.36 3ihm s VAL 184 Cb 0.00 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 3ihm s VAL 184 CO -0.08 0.06 -0.11 -0.89 0.00 0.00 0.00 175.10 174.09 3ihm s THR 185 N -1.60 3.13 -0.33 3.92 2.01 -0.72 0.21 115.64 122.26 3ihm s THR 185 Ca 0.55 -0.61 -0.08 0.00 0.31 0.00 0.00 61.69 61.86 3ihm s THR 185 Cb -0.23 -2.35 0.02 0.00 0.01 0.00 0.00 72.50 69.96 3ihm s THR 185 CO 0.29 0.50 0.13 -0.04 -0.69 0.00 0.00 174.62 174.81 3ihm s MET 186 N 0.68 2.90 -0.13 4.92 -1.94 0.10 -0.59 119.30 125.25 3ihm s MET 186 Ca -0.05 -1.01 0.00 0.00 -1.71 0.00 0.00 55.69 52.92 3ihm s MET 186 Cb -0.15 -3.53 -0.01 0.00 2.01 0.00 0.00 34.83 33.15 3ihm s MET 186 CO 0.02 -0.58 -0.14 0.45 -0.01 0.00 0.00 175.02 174.75 3ihm s SER 187 N 1.50 3.89 -0.19 3.03 0.15 0.77 -0.56 113.70 122.29 3ihm s SER 187 Ca 0.01 -0.36 0.01 0.00 0.70 0.00 0.00 55.95 56.32 3ihm s SER 187 Cb -0.18 -1.58 0.03 0.00 -1.71 0.00 0.00 66.02 62.57 3ihm s SER 187 CO 0.04 0.16 -0.17 0.12 1.20 0.00 0.00 173.24 174.59 3ihm s PHE 188 N 0.35 2.77 -0.42 3.44 5.36 0.77 0.50 117.98 130.75 3ihm s PHE 188 Ca -0.12 -1.71 -0.17 0.00 -0.96 0.00 0.00 56.93 53.97 3ihm s PHE 188 Cb -0.16 -1.87 0.02 0.00 -0.34 0.00 0.00 43.02 40.67 3ihm s PHE 188 CO 0.06 -0.80 0.41 0.45 -1.46 0.00 0.00 175.22 173.88 3ihm s SER 189 N 1.29 6.18 -0.06 6.13 0.15 0.72 0.81 113.70 128.92 3ihm s SER 189 Ca 0.02 -0.73 -0.35 0.00 0.70 0.00 0.00 55.95 55.60 3ihm s SER 189 Cb -0.14 -2.21 -0.13 0.00 -1.71 0.00 0.00 66.02 61.83 3ihm s SER 189 CO -0.11 -0.56 1.79 -2.65 1.20 0.00 0.00 173.24 172.91 3ihm n PRO 190 N 5.53 2.01 -0.91 5.44 -0.02 -1.26 -0.98 135.00 144.80 3ihm n PRO 190 Ca -0.08 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 3ihm n PRO 190 Cb 0.47 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 3ihm n PRO 190 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ihm n GLY 191 N 4.14 0.52 0.83 -1.23 0.00 -1.26 -4.80 105.19 103.39 3ihm n GLY 191 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3ihm n GLY 191 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ihm n HIS 192 N -2.32 0.00 0.00 1.61 8.25 -0.15 -4.80 115.22 117.81 3ihm n HIS 192 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3ihm n HIS 192 Cb 0.08 0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.25 3ihm n HIS 192 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ihm n GLY 193 N 2.85 1.49 3.68 -1.41 0.00 -0.29 -0.63 105.19 110.89 3ihm n GLY 193 Ca 0.00 -0.91 -0.32 0.00 0.00 0.00 0.00 46.02 44.79 3ihm n GLY 193 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ihm s GLU 194 N -2.00 2.76 -0.08 1.61 8.01 -0.28 -0.20 118.70 128.52 3ihm s GLU 194 Ca 0.00 -0.63 0.03 0.00 0.01 0.00 0.00 54.97 54.38 3ihm s GLU 194 Cb 0.00 -2.65 0.01 0.00 -4.31 0.00 0.00 34.13 27.17 3ihm s GLU 194 CO 0.00 0.62 -0.17 -1.17 0.01 0.00 0.00 175.26 174.55 3ihm s LEU 195 N -1.59 1.83 -0.28 1.80 2.96 0.18 -0.12 118.68 123.46 3ihm s LEU 195 Ca 0.20 -0.41 -0.03 0.00 -0.22 0.00 0.00 54.13 53.67 3ihm s LEU 195 Cb -0.11 -1.06 0.03 0.00 0.50 0.00 0.00 46.19 45.54 3ihm s LEU 195 CO 0.11 0.09 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.58 3ihm s ILE 196 N 0.52 3.19 -0.29 6.68 1.09 -0.34 -0.17 121.20 131.89 3ihm s ILE 196 Ca -0.16 -1.04 -0.15 0.00 -1.10 0.00 0.00 60.65 58.20 3ihm s ILE 196 Cb -0.17 -2.68 -0.03 0.00 -1.06 0.00 0.00 42.46 38.52 3ihm s ILE 196 CO 0.06 0.08 0.36 -0.70 -0.10 0.00 0.00 174.94 174.64 3ihm s GLU 197 N 1.35 3.90 -0.15 2.79 2.12 0.24 -0.84 118.70 128.10 3ihm s GLU 197 Ca -0.01 -0.10 0.00 0.00 0.36 0.00 0.00 54.97 55.23 3ihm s GLU 197 Cb -0.18 -3.69 0.02 0.00 0.26 0.00 0.00 34.13 30.54 3ihm s GLU 197 CO -0.02 -0.33 -0.15 0.42 -0.54 0.00 0.00 175.26 174.64 3ihm s ILE 198 N 2.04 1.64 -0.04 -3.70 1.01 -0.06 -1.76 121.20 120.34 3ihm s ILE 198 Ca 0.14 -0.69 -0.30 0.00 0.00 0.00 0.00 60.65 59.80 3ihm s ILE 198 Cb -0.16 -1.54 -0.07 0.00 0.01 0.00 0.00 42.46 40.70 3ihm s ILE 198 CO 0.11 0.46 1.87 -2.84 0.00 0.00 0.00 174.94 174.53 3ihm s PRO 199 N 1.46 4.02 -0.06 2.79 0.02 -1.26 0.30 135.00 142.26 3ihm s PRO 199 Ca 0.05 2.34 0.02 0.00 0.02 0.00 0.00 61.00 63.42 3ihm s PRO 199 Cb -0.13 -4.12 0.02 0.00 0.02 0.00 0.00 34.50 30.29 3ihm s PRO 199 CO -0.11 -1.07 -0.10 0.99 -0.33 0.00 0.00 177.00 176.37 3ihm s THR 200 N 4.80 1.01 -0.16 0.99 2.01 0.49 -4.20 115.64 120.58 3ihm s THR 200 Ca 0.84 -0.40 -0.29 0.00 0.31 0.00 0.00 61.69 62.15 3ihm s THR 200 Cb -0.37 -0.94 -0.01 0.00 0.01 0.00 0.00 72.50 71.19 3ihm s THR 200 CO 0.36 0.33 1.13 -0.22 -0.69 0.00 0.00 174.62 175.53 3ihm s LEU 201 N 0.76 4.18 0.00 4.42 2.96 -0.68 -0.46 118.68 129.86 3ihm s LEU 201 Ca -0.13 1.58 0.00 0.00 -0.22 0.00 0.00 54.13 55.36 3ihm s LEU 201 Cb -0.15 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 42.99 3ihm s LEU 201 CO 0.02 -0.65 0.00 -0.24 -1.32 0.00 0.00 176.35 174.17 3ihm n SER 202 N 5.99 0.93 -0.17 3.68 2.88 -0.21 -0.14 113.62 126.58 3ihm n SER 202 Ca 0.12 -0.90 -0.02 0.00 -1.33 0.00 0.00 58.87 56.74 3ihm n SER 202 Cb 0.46 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 63.98 3ihm n SER 202 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 3ihm h PHE 203 N 0.90 -0.18 -0.36 0.66 0.04 -1.96 -1.24 116.94 114.80 3ihm h PHE 203 Ca 0.00 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.81 3ihm h PHE 203 Cb 0.00 0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.31 3ihm h PHE 203 CO 0.00 -0.19 0.00 0.09 -0.60 0.00 0.00 178.31 177.61 3ihm n ASN 204 N -5.32 2.74 0.00 2.17 3.02 -1.26 -5.03 115.26 111.57 3ihm n ASN 204 Ca 0.06 -2.22 0.00 0.00 -0.03 0.00 0.00 54.58 52.39 3ihm n ASN 204 Cb 0.29 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 39.05 3ihm n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ihm n GLY 205 N 0.79 -0.25 3.61 7.41 0.00 -0.47 -4.95 105.19 111.33 3ihm n GLY 205 Ca 0.14 -1.99 -0.43 0.00 0.00 0.00 0.00 46.02 43.74 3ihm n GLY 205 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3ihm s MET 206 N 0.00 3.60 0.51 1.61 -1.94 -1.26 -1.04 119.30 120.77 3ihm s MET 206 Ca 0.00 1.49 0.01 0.00 -1.71 0.00 0.00 55.69 55.48 3ihm s MET 206 Cb 0.00 -4.09 0.01 0.00 2.01 0.00 0.00 34.83 32.75 3ihm s MET 206 CO 0.00 -1.53 0.06 -1.13 -0.01 0.00 0.00 175.02 172.41 3ihm n SER 207 N 9.17 3.30 -4.12 3.03 3.41 0.39 -4.97 113.62 123.83 3ihm n SER 207 Ca 0.20 -3.15 -0.31 0.00 -0.26 0.00 0.00 58.87 55.35 3ihm n SER 207 Cb 0.46 0.29 -0.17 0.00 -0.26 0.00 0.00 64.21 64.54 3ihm n SER 207 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3ihm s THR 208 N -2.79 1.82 0.11 6.66 -4.23 -0.83 -0.38 115.64 115.99 3ihm s THR 208 Ca 0.05 -0.84 -0.30 0.00 -1.18 0.00 0.00 61.69 59.42 3ihm s THR 208 Cb -0.00 -1.63 -0.06 0.00 1.34 0.00 0.00 72.50 72.15 3ihm s THR 208 CO 0.03 0.50 0.99 0.00 -0.54 0.00 0.00 174.62 175.61 3ihm s ALA 209 N 0.87 3.26 -0.31 3.99 0.00 0.15 -0.62 121.76 129.10 3ihm s ALA 209 Ca -0.07 0.62 -0.03 0.00 0.00 0.00 0.00 51.96 52.48 3ihm s ALA 209 Cb -0.15 -3.30 0.05 0.00 0.00 0.00 0.00 23.12 19.71 3ihm s ALA 209 CO -0.01 -0.10 0.02 -0.51 0.00 0.00 0.00 175.76 175.16 3ihm s LEU 210 N 0.11 4.00 -0.53 0.00 1.43 0.95 -0.88 118.68 123.76 3ihm s LEU 210 Ca 0.48 -1.27 -0.14 0.00 -1.03 0.00 0.00 54.13 52.17 3ihm s LEU 210 Cb -0.24 -1.74 0.13 0.00 0.03 0.00 0.00 46.19 44.37 3ihm s LEU 210 CO 0.30 -0.28 0.47 -0.69 0.23 0.00 0.00 176.35 176.39 3ihm s VAL 211 N 1.27 5.00 -0.47 -1.59 1.01 -0.02 -1.88 120.40 123.72 3ihm s VAL 211 Ca -0.04 -1.60 -0.17 0.00 0.00 0.00 0.00 61.98 60.17 3ihm s VAL 211 Cb -0.20 -4.22 0.05 0.00 0.00 0.00 0.00 36.38 32.02 3ihm s VAL 211 CO -0.01 -0.85 0.48 -0.76 0.00 0.00 0.00 175.10 173.96 3ihm s LEU 212 N 1.50 5.19 -0.99 3.92 1.43 -0.49 -1.20 118.68 128.05 3ihm s LEU 212 Ca 0.04 -1.01 -0.14 0.00 -1.03 0.00 0.00 54.13 52.00 3ihm s LEU 212 Cb -0.29 -2.32 0.21 0.00 0.03 0.00 0.00 46.19 43.82 3ihm s LEU 212 CO 0.02 -0.70 1.04 -1.61 0.23 0.00 0.00 176.35 175.33 3ihm s GLU 213 N 2.09 3.85 -0.01 1.70 0.41 0.82 -1.78 118.70 125.79 3ihm s GLU 213 Ca 0.10 -2.54 -0.21 0.00 -0.41 0.00 0.00 54.97 51.90 3ihm s GLU 213 Cb -0.21 -4.67 -0.05 0.00 -1.78 0.00 0.00 34.13 27.42 3ihm s GLU 213 CO 0.10 -1.46 0.62 -0.80 -0.49 0.00 0.00 175.26 173.24 3ihm s ASN 214 N 2.35 7.00 0.43 -0.19 0.01 -0.62 -1.13 114.94 122.78 3ihm s ASN 214 Ca 0.29 1.19 -0.25 0.00 -0.71 0.00 0.00 52.86 53.38 3ihm s ASN 214 Cb -0.08 -2.38 -0.08 0.00 0.41 0.00 0.00 41.25 39.12 3ihm s ASN 214 CO -0.07 0.07 1.22 -1.00 -1.51 0.00 0.00 177.10 175.81 3ihm s HIS 215 N -0.08 2.89 0.05 2.20 3.76 0.20 0.01 115.29 124.32 3ihm s HIS 215 Ca 0.32 1.49 -0.31 0.00 -0.15 0.00 0.00 55.06 56.42 3ihm s HIS 215 Cb -0.18 -3.51 -0.07 0.00 1.11 0.00 0.00 32.58 29.93 3ihm s HIS 215 CO 0.18 -1.71 1.44 0.42 -0.85 0.00 0.00 174.74 174.22 3ihm s ILE 216 N -1.39 3.46 0.00 0.60 -1.09 -1.26 -2.81 121.20 118.71 3ihm s ILE 216 Ca 0.60 0.93 0.00 0.00 -2.23 0.00 0.00 60.65 59.95 3ihm s ILE 216 Cb -0.33 -3.60 0.00 0.00 -1.58 0.00 0.00 42.46 36.95 3ihm s ILE 216 CO 0.42 0.02 0.00 0.61 -1.23 0.00 0.00 174.94 174.76 3ihm n GLY 217 N 3.66 0.73 3.59 6.18 0.00 -1.26 -5.05 105.19 113.04 3ihm n GLY 217 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 3ihm n GLY 217 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ihm n SER 218 N 0.00 0.99 0.00 1.61 3.41 -1.12 -4.97 113.62 113.54 3ihm n SER 218 Ca 0.00 -1.92 0.12 0.00 -0.26 0.00 0.00 58.87 56.81 3ihm n SER 218 Cb 0.00 -0.68 0.66 0.00 -0.26 0.00 0.00 64.21 63.94 3ihm n SER 218 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3ihm n ASP 219 N -3.11 0.00 -0.00 4.04 2.03 -1.26 -3.41 116.55 114.83 3ihm n ASP 219 Ca 0.15 -0.39 0.04 0.00 0.52 0.00 0.00 54.79 55.11 3ihm n ASP 219 Cb 0.54 -0.15 -0.05 0.00 -0.72 0.00 0.00 41.12 40.74 3ihm n ASP 219 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 3ihm n LEU 220 N -1.15 0.35 0.13 -2.67 7.94 -1.26 -4.63 117.00 115.70 3ihm n LEU 220 Ca 0.15 -0.45 0.04 0.00 -1.11 0.00 0.00 56.01 54.64 3ihm n LEU 220 Cb 0.14 0.00 0.45 0.00 0.53 0.00 0.00 43.42 44.54 3ihm n LEU 220 CO 0.16 0.09 0.97 -0.08 -1.11 0.00 0.00 177.39 177.42 3ihm h GLU 221 N 0.00 0.23 -0.71 1.96 4.81 -1.72 -2.91 114.58 116.24 3ihm h GLU 221 Ca 0.00 -0.04 0.20 0.00 -0.13 0.00 0.00 59.36 59.39 3ihm h GLU 221 Cb 0.22 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 3ihm h GLU 221 CO 0.00 0.29 0.50 -0.24 -0.73 0.00 0.00 179.01 178.83 3ihm h VAL 222 N 0.23 0.67 0.00 0.32 3.04 -1.82 -1.68 116.25 117.00 3ihm h VAL 222 Ca 0.05 -0.02 -0.01 0.00 -1.01 0.00 0.00 66.70 65.71 3ihm h VAL 222 Cb 0.23 0.60 -0.00 0.00 -2.01 0.00 0.00 31.29 30.10 3ihm h VAL 222 CO 0.01 0.01 -0.06 -0.07 -1.01 0.00 0.00 177.57 176.45 3ihm h LEU 223 N 0.06 0.00 0.00 3.16 3.38 -1.87 -1.10 115.31 118.95 3ihm h LEU 223 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 3ihm h LEU 223 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 3ihm h LEU 223 CO -0.03 0.06 -0.29 0.00 0.09 0.00 0.00 178.44 178.27 3ihm n ALA 224 N -2.21 3.01 -0.01 1.53 0.00 -0.63 -4.22 120.51 117.98 3ihm n ALA 224 Ca -0.02 -0.24 0.01 0.00 0.00 0.00 0.00 53.44 53.19 3ihm n ALA 224 Cb 0.20 -1.27 -0.05 0.00 0.00 0.00 0.00 19.45 18.33 3ihm n ALA 224 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3ihm n HIS 225 N -1.53 0.00 -2.73 0.00 8.25 -0.56 -4.46 115.22 114.19 3ihm n HIS 225 Ca 0.06 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.10 3ihm n HIS 225 Cb 0.34 -0.20 -0.03 0.00 1.12 0.00 0.00 29.99 31.23 3ihm n HIS 225 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3ihm s THR 226 N -2.34 4.79 -0.14 1.59 -1.32 -0.53 -5.02 115.64 112.68 3ihm s THR 226 Ca -0.03 1.95 -0.18 0.00 -1.21 0.00 0.00 61.69 62.23 3ihm s THR 226 Cb 0.03 -4.27 -0.04 0.00 -1.51 0.00 0.00 72.50 66.71 3ihm s THR 226 CO 0.26 -0.01 0.46 -0.54 -2.21 0.00 0.00 174.62 172.58 3ihm s LYS 227 N 2.18 4.31 0.21 7.08 -0.14 -1.26 -4.96 119.74 127.16 3ihm s LYS 227 Ca 0.46 0.41 -0.10 0.00 -1.36 0.00 0.00 55.97 55.38 3ihm s LYS 227 Cb -0.17 -3.46 0.20 0.00 -1.68 0.00 0.00 37.83 32.72 3ihm s LYS 227 CO 0.15 0.12 1.85 -0.92 -0.76 0.00 0.00 175.35 175.78 3ihm h TYR 228 N 6.84 0.83 0.00 3.18 3.20 -1.96 -2.66 116.97 126.40 3ihm h TYR 228 Ca -0.40 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.49 3ihm h TYR 228 Cb 1.17 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 39.17 3ihm h TYR 228 CO 0.63 0.47 0.00 -0.25 -1.64 0.00 0.00 178.16 177.37 3ihm n ASP 229 N -4.66 0.10 0.07 -2.11 8.00 -1.26 -1.75 116.55 114.93 3ihm n ASP 229 Ca 0.08 0.52 -0.16 0.00 0.71 0.00 0.00 54.79 55.94 3ihm n ASP 229 Cb 0.09 -0.54 -0.08 0.00 -0.02 0.00 0.00 41.12 40.58 3ihm n ASP 229 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3ihm h ASP 230 N 0.00 0.63 -0.44 -2.24 3.32 -1.89 -3.45 116.42 112.35 3ihm h ASP 230 Ca 0.00 -0.53 0.17 0.00 0.02 0.00 0.00 57.03 56.69 3ihm h ASP 230 Cb 0.37 -0.19 -0.19 0.00 0.22 0.00 0.00 39.33 39.53 3ihm h ASP 230 CO 0.00 1.34 -0.11 -0.62 -1.72 0.00 0.00 179.24 178.13 3ihm s ASP 231 N -7.17 -0.73 0.19 6.45 -1.08 -1.03 -5.07 116.67 108.23 3ihm s ASP 231 Ca -0.07 0.09 -0.11 0.00 -0.52 0.00 0.00 52.55 51.94 3ihm s ASP 231 Cb 0.08 1.46 0.11 0.00 -1.46 0.00 0.00 42.92 43.11 3ihm s ASP 231 CO 0.89 -0.13 1.80 -0.65 0.52 0.00 0.00 175.17 177.59 3ihm h PRO 232 N 7.45 0.93 -0.63 4.34 0.11 -1.64 -1.79 132.00 140.77 3ihm h PRO 232 Ca -0.07 -0.11 -0.01 0.00 0.11 0.00 0.00 66.00 65.91 3ihm h PRO 232 Cb 1.18 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.08 3ihm h PRO 232 CO -0.03 0.70 0.34 -0.09 -0.21 0.00 0.00 178.00 178.71 3ihm h ARG 233 N 0.91 0.88 -0.61 1.05 9.65 -1.98 -0.64 114.38 123.64 3ihm h ARG 233 Ca 0.23 -0.10 -0.10 0.00 -1.10 0.00 0.00 59.98 58.91 3ihm h ARG 233 Cb 0.05 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.44 3ihm h ARG 233 CO -0.04 0.67 -0.01 0.00 2.80 0.00 0.00 179.97 183.39 3ihm h ALA 234 N 1.16 0.82 -0.16 2.80 0.00 -1.89 -0.15 119.26 121.85 3ihm h ALA 234 Ca 0.22 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3ihm h ALA 234 Cb 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3ihm h ALA 234 CO -0.04 0.67 0.06 0.35 0.00 0.00 0.00 179.25 180.29 3ihm h PHE 235 N 0.98 0.24 -0.51 0.00 3.57 -1.15 -1.76 116.94 118.31 3ihm h PHE 235 Ca 0.17 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.61 3ihm h PHE 235 Cb 0.58 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.22 3ihm h PHE 235 CO 0.04 0.33 0.16 -0.07 -2.23 0.00 0.00 178.31 176.54 3ihm h LEU 236 N 0.09 0.74 -0.52 0.59 4.07 -1.00 0.04 115.31 119.32 3ihm h LEU 236 Ca 0.05 -0.20 -0.01 0.00 0.08 0.00 0.00 57.88 57.80 3ihm h LEU 236 Cb 0.19 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 41.72 3ihm h LEU 236 CO -0.00 0.75 0.29 0.44 -1.08 0.00 0.00 178.44 178.83 3ihm h ASP 237 N 0.69 0.64 -0.54 -0.43 3.32 -1.04 -0.64 116.42 118.42 3ihm h ASP 237 Ca 0.17 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 3ihm h ASP 237 Cb 0.27 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 3ihm h ASP 237 CO -0.01 0.54 0.24 0.25 -1.72 0.00 0.00 179.24 178.55 3ihm h LEU 238 N 0.69 0.72 -0.48 1.55 5.85 -1.12 -2.33 115.31 120.19 3ihm h LEU 238 Ca 0.18 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.76 3ihm h LEU 238 Cb 0.04 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 3ihm h LEU 238 CO -0.03 0.67 0.31 -0.03 -0.34 0.00 0.00 178.44 179.02 3ihm h MET 239 N 0.73 0.62 -0.32 1.25 4.05 -0.80 -1.71 114.93 118.76 3ihm h MET 239 Ca 0.18 -0.04 0.01 0.00 -0.28 0.00 0.00 59.70 59.58 3ihm h MET 239 Cb 0.15 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 30.79 3ihm h MET 239 CO -0.02 0.41 0.18 -0.07 0.23 0.00 0.00 176.91 177.64 3ihm h LEU 240 N 0.64 0.29 -0.35 3.39 3.38 -0.89 -1.00 115.31 120.77 3ihm h LEU 240 Ca 0.18 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.97 3ihm h LEU 240 Cb -0.05 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 3ihm h LEU 240 CO -0.05 0.21 -0.59 1.05 0.09 0.00 0.00 178.44 179.16 3ihm h GLU 241 N 0.37 0.75 -0.46 1.13 4.11 -1.35 -0.10 114.58 119.03 3ihm h GLU 241 Ca 0.13 -0.50 -0.06 0.00 0.07 0.00 0.00 59.36 59.00 3ihm h GLU 241 Cb 0.01 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 3ihm h GLU 241 CO -0.06 1.12 0.06 0.87 0.07 0.00 0.00 179.01 181.07 3ihm h LYS 242 N 0.56 0.77 -0.26 1.06 1.79 -1.22 -2.27 116.57 117.00 3ihm h LYS 242 Ca 0.00 -0.22 -0.11 0.00 -2.18 0.00 0.00 60.65 58.15 3ihm h LYS 242 Cb 1.18 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.73 3ihm h LYS 242 CO 0.12 0.80 -0.28 -0.07 -1.08 0.00 0.00 179.45 178.94 3ihm h LEU 243 N 0.63 0.53 -0.89 2.94 3.38 -1.20 -1.22 115.31 119.48 3ihm h LEU 243 Ca 0.14 -0.19 0.07 0.00 0.09 0.00 0.00 57.88 57.98 3ihm h LEU 243 Cb 0.41 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 40.95 3ihm h LEU 243 CO 0.01 0.80 0.56 1.23 0.09 0.00 0.00 178.44 181.12 3ihm h GLY 244 N 1.03 1.36 0.00 0.83 0.00 -0.61 -0.37 103.07 105.31 3ihm h GLY 244 Ca 0.06 -0.40 -0.10 0.00 0.00 0.00 0.00 47.33 46.90 3ihm h GLY 244 CO 0.06 0.26 -2.08 0.58 0.00 0.00 0.00 176.54 175.35 3ihm n LYS 245 N -4.61 0.67 -0.11 4.80 2.85 -0.89 -4.30 118.16 116.57 3ihm n LYS 245 Ca 0.14 -0.15 -0.14 0.00 -1.05 0.00 0.00 58.31 57.11 3ihm n LYS 245 Cb 0.20 -1.51 -0.12 0.00 -0.65 0.00 0.00 35.03 32.95 3ihm n LYS 245 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 3ihm n HIS 246 N -2.38 0.00 -3.23 5.58 8.25 -0.46 -4.75 115.22 118.23 3ihm n HIS 246 Ca -0.11 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.10 3ihm n HIS 246 Cb 0.72 -0.91 -0.06 0.00 1.12 0.00 0.00 29.99 30.86 3ihm n HIS 246 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3ihm n HIS 247 N -3.04 1.80 0.20 4.41 8.25 -0.17 -4.39 115.22 122.29 3ihm n HIS 247 Ca -0.38 -3.88 0.06 0.00 -0.26 0.00 0.00 57.72 53.26 3ihm n HIS 247 Cb 0.99 -0.46 0.40 0.00 1.12 0.00 0.00 29.99 32.05 3ihm n HIS 247 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3ihm h PRO 248 N 3.73 0.00 0.00 -0.41 0.13 -1.71 -1.22 132.00 132.52 3ihm h PRO 248 Ca 0.13 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.21 3ihm h PRO 248 Cb 0.76 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.88 3ihm h PRO 248 CO 0.65 0.34 -0.24 0.66 -0.23 0.00 0.00 178.00 179.19 3ihm h SER 249 N 0.00 0.00 0.14 1.44 4.64 -1.93 0.01 113.55 117.85 3ihm h SER 249 Ca -0.00 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.00 3ihm h SER 249 Cb 0.75 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.84 3ihm h SER 249 CO 0.04 0.24 -1.62 0.58 -0.87 0.00 0.00 176.83 175.20 3ihm h VAL 250 N 0.00 0.94 -0.71 0.95 2.07 -1.83 -3.39 116.25 114.28 3ihm h VAL 250 Ca -0.00 -2.43 0.02 0.00 0.82 0.00 0.00 66.70 65.10 3ihm h VAL 250 Cb 0.53 2.70 -0.04 0.00 -1.52 0.00 0.00 31.29 32.97 3ihm h VAL 250 CO 0.03 0.79 0.47 0.00 0.02 0.00 0.00 177.57 178.87 3ihm h ALA 251 N 0.02 1.54 0.00 1.67 0.00 -0.81 -2.53 119.26 119.16 3ihm h ALA 251 Ca -0.34 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3ihm h ALA 251 Cb 1.93 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.45 3ihm h ALA 251 CO 0.11 0.40 0.00 -0.85 0.00 0.00 0.00 179.25 178.91 3ihm n GLU 252 N -4.44 0.17 -0.24 0.00 0.28 -0.05 -1.76 120.64 114.59 3ihm n GLU 252 Ca 0.08 0.40 0.12 0.00 -0.16 0.00 0.00 57.16 57.60 3ihm n GLU 252 Cb 0.08 -1.82 0.25 0.00 1.43 0.00 0.00 31.44 31.37 3ihm n GLU 252 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 3ihm n ARG 253 N -2.14 2.59 -3.26 3.44 1.74 -0.95 -4.94 116.66 113.14 3ihm n ARG 253 Ca 0.02 -2.42 -0.38 0.00 -0.77 0.00 0.00 57.85 54.30 3ihm n ARG 253 Cb 0.22 -1.54 -0.06 0.00 -1.02 0.00 0.00 32.46 30.07 3ihm n ARG 253 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3ihm s ILE 254 N -1.35 5.16 -0.44 0.55 1.01 -0.72 -0.28 121.20 125.12 3ihm s ILE 254 Ca 0.42 1.04 -0.20 0.00 0.00 0.00 0.00 60.65 61.92 3ihm s ILE 254 Cb 0.24 -3.86 0.03 0.00 0.01 0.00 0.00 42.46 38.88 3ihm s ILE 254 CO 0.33 0.31 0.58 -0.62 0.00 0.00 0.00 174.94 175.53 3ihm s ASP 255 N 0.68 6.27 0.46 3.58 2.15 -0.30 -4.97 116.67 124.55 3ihm s ASP 255 Ca 0.28 -0.51 0.14 0.00 0.43 0.00 0.00 52.55 52.88 3ihm s ASP 255 Cb -0.16 -2.29 1.06 0.00 -0.30 0.00 0.00 42.92 41.24 3ihm s ASP 255 CO 0.12 -0.74 2.05 -0.65 -0.17 0.00 0.00 175.17 175.78 3ihm h PRO 256 N 8.85 0.08 0.00 4.34 0.11 -1.95 0.56 132.00 144.00 3ihm h PRO 256 Ca -0.26 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.75 3ihm h PRO 256 Cb 1.10 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3ihm h PRO 256 CO 0.87 0.15 -0.43 0.00 -0.21 0.00 0.00 178.00 178.39 3ihm h ALA 257 N 1.86 1.12 0.00 -0.75 0.00 -1.96 -3.20 119.26 116.33 3ihm h ALA 257 Ca 0.02 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3ihm h ALA 257 Cb 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3ihm h ALA 257 CO 0.01 0.53 -1.61 0.39 0.00 0.00 0.00 179.25 178.57 3ihm n GLU 258 N -3.78 0.56 -1.73 0.00 -0.58 -0.78 -4.98 120.64 109.34 3ihm n GLU 258 Ca -0.01 -0.13 -0.42 0.00 -0.42 0.00 0.00 57.16 56.18 3ihm n GLU 258 Cb 0.49 -1.47 -0.03 0.00 -0.57 0.00 0.00 31.44 29.86 3ihm n GLU 258 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 3ihm s PHE 259 N -3.25 1.40 0.15 -0.32 5.36 0.12 -4.22 117.98 117.23 3ihm s PHE 259 Ca -0.03 -0.17 -0.24 0.00 -0.96 0.00 0.00 56.93 55.53 3ihm s PHE 259 Cb 0.14 -4.14 0.08 0.00 -0.34 0.00 0.00 43.02 38.76 3ihm s PHE 259 CO 0.84 -4.98 1.06 0.34 -1.46 0.00 0.00 175.22 171.02 3ihm s ASP 260 N 4.83 -0.03 0.51 6.13 2.15 -1.21 -5.00 116.67 124.04 3ihm s ASP 260 Ca 0.87 -0.56 -0.21 0.00 0.43 0.00 0.00 52.55 53.08 3ihm s ASP 260 Cb -0.39 0.45 -0.06 0.00 -0.30 0.00 0.00 42.92 42.62 3ihm s ASP 260 CO 0.38 -0.88 1.16 -0.76 -0.17 0.00 0.00 175.17 174.91 3ihm s LEU 261 N -3.33 3.88 0.21 -1.34 1.43 -1.26 -0.82 118.68 117.45 3ihm s LEU 261 Ca 0.20 2.29 -0.10 0.00 -1.03 0.00 0.00 54.13 55.49 3ihm s LEU 261 Cb -0.02 -4.40 0.16 0.00 0.03 0.00 0.00 46.19 41.97 3ihm s LEU 261 CO 0.04 -1.11 1.87 0.00 0.23 0.00 0.00 176.35 177.37 3ihm h ALA 262 N 1.61 0.98 0.00 4.21 0.00 -1.25 -3.40 119.26 121.42 3ihm h ALA 262 Ca -0.50 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.35 3ihm h ALA 262 Cb 1.26 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3ihm h ALA 262 CO 0.58 0.42 -0.24 -1.71 0.00 0.00 0.00 179.25 178.30 3ihm n ASN 263 N -4.52 0.36 -2.99 0.00 5.15 -1.26 -4.82 115.26 107.18 3ihm n ASN 263 Ca 0.07 0.17 -0.10 0.00 -0.60 0.00 0.00 54.58 54.12 3ihm n ASN 263 Cb 0.03 -0.02 0.01 0.00 -0.53 0.00 0.00 39.78 39.27 3ihm n ASN 263 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3ihm s SER 264 N -5.37 0.24 0.00 1.20 1.04 -1.26 -5.02 113.70 104.53 3ihm s SER 264 Ca 0.00 -1.24 0.10 0.00 0.48 0.00 0.00 55.95 55.29 3ihm s SER 264 Cb 0.00 0.81 0.48 0.00 0.10 0.00 0.00 66.02 67.41 3ihm s SER 264 CO 0.00 -1.60 1.22 -1.54 0.98 0.00 0.00 173.24 172.29 3ihm n SER 265 N -1.43 0.00 0.16 7.02 3.41 -1.26 -1.23 113.62 120.29 3ihm n SER 265 Ca -0.06 0.21 0.13 0.00 -0.26 0.00 0.00 58.87 58.89 3ihm n SER 265 Cb 0.60 -0.32 0.47 0.00 -0.26 0.00 0.00 64.21 64.70 3ihm n SER 265 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3ihm h LEU 266 N 0.00 0.00 -1.15 1.04 3.38 -1.95 -3.23 115.31 113.40 3ihm h LEU 266 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ihm h LEU 266 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 3ihm h LEU 266 CO 0.00 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.00 3ihm n ASP 267 N -2.48 1.45 -4.08 -0.43 8.00 -0.37 -0.33 116.55 118.30 3ihm n ASP 267 Ca 0.03 -2.11 -0.25 0.00 0.71 0.00 0.00 54.79 53.17 3ihm n ASP 267 Cb 0.33 -0.42 -0.16 0.00 -0.02 0.00 0.00 41.12 40.85 3ihm n ASP 267 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3ihm s ILE 268 N -1.42 1.26 -0.07 0.53 1.10 -1.22 -1.56 121.20 119.81 3ihm s ILE 268 Ca 0.08 -0.60 0.01 0.00 -0.51 0.00 0.00 60.65 59.63 3ihm s ILE 268 Cb 0.06 -1.11 0.02 0.00 0.15 0.00 0.00 42.46 41.58 3ihm s ILE 268 CO 0.03 0.37 -0.08 -0.22 -2.11 0.00 0.00 174.94 172.94 3ihm s LEU 269 N 0.27 1.33 0.02 8.50 2.96 0.14 -4.62 118.68 127.27 3ihm s LEU 269 Ca -0.08 -0.23 0.05 0.00 -0.22 0.00 0.00 54.13 53.65 3ihm s LEU 269 Cb -0.13 -0.68 -0.02 0.00 0.50 0.00 0.00 46.19 45.87 3ihm s LEU 269 CO 0.03 -0.05 -0.15 -1.10 -1.32 0.00 0.00 176.35 173.75 3ihm s GLN 270 N 1.14 1.10 0.00 1.98 -0.21 -1.26 -0.43 119.66 121.97 3ihm s GLN 270 Ca -0.07 -0.66 0.00 0.00 0.02 0.00 0.00 55.36 54.65 3ihm s GLN 270 Cb -0.14 -1.10 0.00 0.00 1.00 0.00 0.00 33.01 32.77 3ihm s GLN 270 CO -0.01 0.29 0.00 0.41 -2.12 0.00 0.00 175.29 173.85 3ihm n GLY 271 N 2.29 -0.16 3.42 3.09 0.00 -0.92 -5.00 105.19 107.91 3ihm n GLY 271 Ca -0.16 -0.66 -0.16 0.00 0.00 0.00 0.00 46.02 45.04 3ihm n GLY 271 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3ihm s GLY 272 N 0.00 -0.45 -0.14 -0.02 0.00 -1.26 -0.21 107.32 105.23 3ihm s GLY 272 Ca 0.00 0.89 0.01 0.00 0.00 0.00 0.00 44.72 45.62 3ihm s GLY 272 CO 0.00 0.58 -0.17 0.14 0.00 0.00 0.00 173.10 173.65 3ihm s VAL 273 N -1.65 2.54 -0.44 1.40 1.01 -1.26 -4.95 120.40 117.05 3ihm s VAL 273 Ca -0.10 -0.82 -0.23 0.00 0.00 0.00 0.00 61.98 60.83 3ihm s VAL 273 Cb -0.01 -2.06 0.02 0.00 0.00 0.00 0.00 36.38 34.34 3ihm s VAL 273 CO 0.05 0.53 0.80 -0.69 0.00 0.00 0.00 175.10 175.78 3ihm s VAL 274 N 0.71 4.64 0.25 2.92 1.01 -1.26 -4.10 120.40 124.57 3ihm s VAL 274 Ca -0.08 0.52 -0.30 0.00 0.00 0.00 0.00 61.98 62.13 3ihm s VAL 274 Cb -0.16 -4.32 -0.09 0.00 0.00 0.00 0.00 36.38 31.81 3ihm s VAL 274 CO 0.01 -0.69 1.33 -2.16 0.00 0.00 0.00 175.10 173.60 3ihm s PRO 275 N 3.31 4.36 -0.16 2.72 0.04 -1.26 -4.85 135.00 139.17 3ihm s PRO 275 Ca 0.31 2.15 -0.13 0.00 0.04 0.00 0.00 61.00 63.36 3ihm s PRO 275 Cb -0.12 -3.14 0.04 0.00 0.04 0.00 0.00 34.50 31.32 3ihm s PRO 275 CO 0.22 -0.26 0.41 0.00 0.04 0.00 0.00 177.00 177.41 3ihm s ALA 276 N -0.28 -1.02 -0.14 8.56 0.00 -0.38 -4.64 121.76 123.86 3ihm s ALA 276 Ca 0.55 1.22 0.02 0.00 0.00 0.00 0.00 51.96 53.75 3ihm s ALA 276 Cb -0.38 -0.72 0.01 0.00 0.00 0.00 0.00 23.12 22.02 3ihm s ALA 276 CO 0.43 -0.21 -0.20 0.12 0.00 0.00 0.00 175.76 175.90 3ihm s PHE 277 N 0.43 2.70 0.40 0.00 5.36 -1.26 -0.07 117.98 125.54 3ihm s PHE 277 Ca -0.02 -1.26 0.07 0.00 -0.96 0.00 0.00 56.93 54.76 3ihm s PHE 277 Cb -0.04 -1.83 -0.08 0.00 -0.34 0.00 0.00 43.02 40.73 3ihm s PHE 277 CO -0.02 -0.57 0.00 1.03 -1.46 0.00 0.00 175.22 174.20 3ihm s ARG 278 N 0.80 1.95 0.36 10.12 0.52 0.77 -0.73 118.95 132.74 3ihm s ARG 278 Ca -0.07 -2.08 -0.28 0.00 -0.52 0.00 0.00 55.73 52.78 3ihm s ARG 278 Cb -0.16 -1.66 -0.12 0.00 0.52 0.00 0.00 34.95 33.54 3ihm s ARG 278 CO -0.01 -0.02 1.38 -0.25 0.02 0.00 0.00 175.30 176.41 3ihm n ASP 279 N -0.95 3.23 -0.15 0.23 8.00 0.01 -4.82 116.55 122.10 3ihm n ASP 279 Ca -0.05 1.21 0.15 0.00 0.71 0.00 0.00 54.79 56.81 3ihm n ASP 279 Cb 0.66 -1.55 0.79 0.00 -0.02 0.00 0.00 41.12 41.01 3ihm n ASP 279 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ihm n GLY 280 N 0.62 -0.69 3.24 0.44 0.00 -1.26 -4.76 105.19 102.78 3ihm n GLY 280 Ca 0.03 -0.27 -0.09 0.00 0.00 0.00 0.00 46.02 45.69 3ihm n GLY 280 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3ihm s HIS 281 N -1.99 0.10 -0.02 1.61 -3.43 -1.26 -1.24 115.29 109.05 3ihm s HIS 281 Ca 0.44 -0.50 -0.02 0.00 -0.80 0.00 0.00 55.06 54.18 3ihm s HIS 281 Cb 0.21 0.01 0.01 0.00 -1.43 0.00 0.00 32.58 31.38 3ihm s HIS 281 CO 0.35 -0.59 0.05 0.00 -2.00 0.00 0.00 174.74 172.55 3ihm s ALA 282 N -3.86 -0.12 -0.27 -1.38 0.00 -0.39 -4.79 121.76 110.94 3ihm s ALA 282 Ca 0.06 0.16 -0.10 0.00 0.00 0.00 0.00 51.96 52.08 3ihm s ALA 282 Cb 0.04 -0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 3ihm s ALA 282 CO -0.10 -0.03 0.16 0.99 0.00 0.00 0.00 175.76 176.78 3ihm s THR 283 N 0.09 5.06 0.84 0.00 2.01 -1.26 -0.93 115.64 121.44 3ihm s THR 283 Ca -0.01 0.07 -0.10 0.00 0.31 0.00 0.00 61.69 61.97 3ihm s THR 283 Cb -0.01 -3.41 0.15 0.00 0.01 0.00 0.00 72.50 69.24 3ihm s THR 283 CO -0.00 0.26 1.16 -0.76 -0.69 0.00 0.00 174.62 174.60 3ihm s LEU 284 N 1.72 2.80 0.41 4.42 1.43 -0.69 -4.96 118.68 123.80 3ihm s LEU 284 Ca 0.07 0.15 0.14 0.00 -1.03 0.00 0.00 54.13 53.46 3ihm s LEU 284 Cb -0.16 -2.42 0.86 0.00 0.03 0.00 0.00 46.19 44.50 3ihm s LEU 284 CO 0.09 -2.23 1.90 0.78 0.23 0.00 0.00 176.35 177.12 3ihm h ASN 285 N -1.10 0.00 0.15 2.29 4.21 -1.99 -2.37 115.58 116.78 3ihm h ASN 285 Ca -0.42 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.09 3ihm h ASN 285 Cb 1.26 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.46 3ihm h ASN 285 CO 0.44 0.29 0.00 -0.46 -1.29 0.00 0.00 177.43 176.41 3ihm n ASN 286 N -4.16 0.00 0.00 5.81 6.94 -1.26 -4.89 115.26 117.70 3ihm n ASN 286 Ca -0.02 -0.65 0.00 0.00 -0.02 0.00 0.00 54.58 53.89 3ihm n ASN 286 Cb 0.34 -0.09 0.00 0.00 -2.36 0.00 0.00 39.78 37.67 3ihm n ASN 286 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3ihm n GLY 287 N 0.84 0.95 3.83 4.83 0.00 -0.89 -5.05 105.19 109.69 3ihm n GLY 287 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 3ihm n GLY 287 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ihm s LYS 288 N -0.55 4.17 -0.13 1.61 1.02 -1.26 -4.81 119.74 119.79 3ihm s LYS 288 Ca 0.00 0.80 -0.14 0.00 0.02 0.00 0.00 55.97 56.65 3ihm s LYS 288 Cb 0.00 -2.75 -0.05 0.00 -0.52 0.00 0.00 37.83 34.51 3ihm s LYS 288 CO 0.00 0.33 0.32 0.99 -0.92 0.00 0.00 175.35 176.07 3ihm s THR 289 N -1.65 5.26 0.13 2.17 2.01 -1.26 -1.71 115.64 120.59 3ihm s THR 289 Ca 0.46 0.62 0.07 0.00 0.31 0.00 0.00 61.69 63.15 3ihm s THR 289 Cb -0.15 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.67 3ihm s THR 289 CO 0.20 0.43 -0.08 0.27 -0.69 0.00 0.00 174.62 174.75 3ihm s ILE 290 N 0.14 3.41 -0.15 1.82 -4.36 -0.11 -4.62 121.20 117.34 3ihm s ILE 290 Ca 0.19 -1.36 -0.05 0.00 -0.26 0.00 0.00 60.65 59.17 3ihm s ILE 290 Cb -0.14 -2.64 -0.03 0.00 1.25 0.00 0.00 42.46 40.90 3ihm s ILE 290 CO 0.06 0.03 0.01 -0.63 0.24 0.00 0.00 174.94 174.65 3ihm s ILE 291 N -1.39 4.34 0.02 8.37 -1.09 -0.82 -1.26 121.20 129.35 3ihm s ILE 291 Ca 0.23 -0.21 -0.18 0.00 -2.23 0.00 0.00 60.65 58.27 3ihm s ILE 291 Cb -0.10 -2.91 -0.06 0.00 -1.58 0.00 0.00 42.46 37.81 3ihm s ILE 291 CO 0.15 0.51 0.50 -0.83 -1.23 0.00 0.00 174.94 174.04 3ihm s GLY 292 N 0.08 2.57 0.01 6.18 0.00 -0.37 -1.60 107.32 114.18 3ihm s GLY 292 Ca 0.02 -0.08 0.01 0.00 0.00 0.00 0.00 44.72 44.68 3ihm s GLY 292 CO 0.02 0.42 -0.05 -2.27 0.00 0.00 0.00 173.10 171.22 3ihm s LEU 293 N -0.79 2.09 0.00 0.66 0.20 -0.72 -4.76 118.68 115.35 3ihm s LEU 293 Ca 0.27 -0.23 0.00 0.00 0.69 0.00 0.00 54.13 54.86 3ihm s LEU 293 Cb -0.18 -0.17 0.00 0.00 -0.43 0.00 0.00 46.19 45.41 3ihm s LEU 293 CO 0.16 -0.04 0.00 0.61 -0.29 0.00 0.00 176.35 176.78 3ihm n GLY 294 N 2.49 2.83 0.27 7.98 0.00 -1.26 -3.15 105.19 114.34 3ihm n GLY 294 Ca -0.16 -0.23 0.09 0.00 0.00 0.00 0.00 46.02 45.72 3ihm n GLY 294 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ihm h ASP 295 N 0.00 0.00 0.08 1.61 3.45 -1.71 -1.70 116.42 118.15 3ihm h ASP 295 Ca 0.00 0.00 -0.16 0.00 0.43 0.00 0.00 57.03 57.30 3ihm h ASP 295 Cb 0.00 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.76 3ihm h ASP 295 CO 0.00 0.01 -0.56 -0.29 -1.57 0.00 0.00 179.24 176.83 3ihm h ILE 296 N 0.00 1.33 0.07 0.35 6.09 -1.71 -3.21 117.51 120.44 3ihm h ILE 296 Ca -0.00 -1.82 -0.26 0.00 -1.37 0.00 0.00 64.86 61.41 3ihm h ILE 296 Cb 0.01 1.80 -0.01 0.00 0.47 0.00 0.00 36.82 39.10 3ihm h ILE 296 CO 0.00 0.56 -1.24 -0.61 -3.07 0.00 0.00 178.15 173.79 3ihm h GLN 297 N 0.39 0.16 -2.57 2.19 4.15 -1.57 -3.42 115.11 114.43 3ihm h GLN 297 Ca 0.01 -0.27 -0.18 0.00 0.77 0.00 0.00 58.65 58.98 3ihm h GLN 297 Cb 1.09 0.10 -0.31 0.00 0.21 0.00 0.00 27.48 28.57 3ihm h GLN 297 CO 0.10 1.08 -0.48 0.00 -1.93 0.00 0.00 178.83 177.60 3ihm s ALA 298 N -2.66 -0.79 -0.38 3.38 0.00 -0.69 -0.16 121.76 120.44 3ihm s ALA 298 Ca -0.03 1.03 -0.16 0.00 0.00 0.00 0.00 51.96 52.81 3ihm s ALA 298 Cb 0.08 -1.24 0.01 0.00 0.00 0.00 0.00 23.12 21.96 3ihm s ALA 298 CO 0.85 -0.83 0.36 0.99 0.00 0.00 0.00 175.76 177.13 3ihm s THR 299 N 2.49 5.18 -0.02 0.00 2.01 0.90 -4.08 115.64 122.11 3ihm s THR 299 Ca 0.03 -0.28 0.01 0.00 0.31 0.00 0.00 61.69 61.76 3ihm s THR 299 Cb -0.13 -3.91 -0.03 0.00 0.01 0.00 0.00 72.50 68.44 3ihm s THR 299 CO -0.11 -0.24 -0.02 0.54 -0.69 0.00 0.00 174.62 174.09 3ihm s VAL 300 N 1.94 4.01 0.16 3.82 0.11 -1.26 -1.24 120.40 127.94 3ihm s VAL 300 Ca 0.10 -0.59 -0.30 0.00 -2.93 0.00 0.00 61.98 58.25 3ihm s VAL 300 Cb -0.17 -2.75 -0.08 0.00 -1.53 0.00 0.00 36.38 31.84 3ihm s VAL 300 CO 0.12 0.43 1.32 -0.62 -3.33 0.00 0.00 175.10 173.02 3ihm s ASP 301 N -1.38 6.90 0.00 3.54 -1.08 -1.26 -4.92 116.67 118.47 3ihm s ASP 301 Ca 0.18 2.34 0.15 0.00 -0.52 0.00 0.00 52.55 54.70 3ihm s ASP 301 Cb -0.11 -2.60 0.90 0.00 -1.46 0.00 0.00 42.92 39.65 3ihm s ASP 301 CO 0.08 -0.55 1.35 -0.81 0.52 0.00 0.00 175.17 175.76 3ihm n PRO 302 N 3.11 0.65 -0.23 4.34 -0.04 -1.26 -4.09 135.00 137.48 3ihm n PRO 302 Ca 0.08 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.66 3ihm n PRO 302 Cb 0.43 -1.36 0.41 0.00 -0.04 0.00 0.00 33.50 32.93 3ihm n PRO 302 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 3ihm h VAL 303 N 0.00 0.85 -0.19 0.52 3.04 -1.97 -1.29 116.25 117.21 3ihm h VAL 303 Ca 0.00 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.48 3ihm h VAL 303 Cb 0.00 0.17 0.00 0.00 -2.01 0.00 0.00 31.29 29.45 3ihm h VAL 303 CO 0.00 0.11 0.00 0.18 -1.01 0.00 0.00 177.57 176.85 3ihm n LEU 304 N -4.52 3.00 -3.64 3.16 4.32 -1.26 -4.97 117.00 113.09 3ihm n LEU 304 Ca 0.15 -1.26 -0.20 0.00 -0.02 0.00 0.00 56.01 54.68 3ihm n LEU 304 Cb 0.45 -0.11 0.05 0.00 -1.62 0.00 0.00 43.42 42.18 3ihm n LEU 304 CO 0.31 0.59 -0.02 0.61 -1.22 0.00 0.00 177.39 177.66 3ihm n GLY 305 N 1.24 -0.31 0.08 -0.72 0.00 -0.49 -4.93 105.19 100.05 3ihm n GLY 305 Ca 0.15 0.12 -0.06 0.00 0.00 0.00 0.00 46.02 46.23 3ihm n GLY 305 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3ihm n GLN 306 N -4.25 0.68 -0.19 1.61 1.13 -1.26 -4.70 117.38 110.40 3ihm n GLN 306 Ca -0.29 -0.02 -0.13 0.00 -1.94 0.00 0.00 57.00 54.63 3ihm n GLN 306 Cb 0.67 -1.55 -0.09 0.00 0.11 0.00 0.00 30.24 29.38 3ihm n GLN 306 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 3ihm h GLY 307 N 3.96 -0.93 1.00 1.08 0.00 -1.91 -1.17 103.07 105.11 3ihm h GLY 307 Ca -0.42 0.72 -0.01 0.00 0.00 0.00 0.00 47.33 47.62 3ihm h GLY 307 CO 0.03 -0.10 0.41 0.00 0.00 0.00 0.00 176.54 176.88 3ihm h ALA 308 N 0.10 0.91 -0.26 3.60 0.00 -1.87 -1.79 119.26 119.96 3ihm h ALA 308 Ca 0.10 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 3ihm h ALA 308 Cb 0.57 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3ihm h ALA 308 CO -0.65 0.40 -0.23 -0.91 0.00 0.00 0.00 179.25 177.86 3ihm h ASN 309 N 0.97 0.48 -0.03 0.00 2.35 -1.70 -1.51 115.58 116.13 3ihm h ASN 309 Ca 0.25 -0.15 -0.16 0.00 -0.55 0.00 0.00 56.30 55.69 3ihm h ASN 309 Cb -0.00 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 3ihm h ASN 309 CO -0.04 0.71 -0.51 0.24 -1.65 0.00 0.00 177.43 176.17 3ihm h MET 310 N 0.43 0.60 -0.15 0.81 2.86 -0.99 -1.52 114.93 116.98 3ihm h MET 310 Ca 0.07 -0.36 -0.00 0.00 -2.06 0.00 0.00 59.70 57.34 3ihm h MET 310 Cb 0.63 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 3ihm h MET 310 CO 0.04 0.97 0.08 0.00 1.06 0.00 0.00 176.91 179.06 3ihm h ALA 311 N 0.97 0.19 -0.37 6.32 0.00 -0.99 -1.79 119.26 123.59 3ihm h ALA 311 Ca 0.02 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3ihm h ALA 311 Cb 1.05 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3ihm h ALA 311 CO 0.10 -0.26 0.08 1.03 0.00 0.00 0.00 179.25 180.20 3ihm h SER 312 N 0.13 0.57 0.23 0.00 0.87 -1.29 -2.02 113.55 112.04 3ihm h SER 312 Ca 0.05 -0.24 -0.00 0.00 -1.23 0.00 0.00 61.79 60.37 3ihm h SER 312 Cb 0.10 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 3ihm h SER 312 CO -0.01 0.67 -0.18 0.22 -0.53 0.00 0.00 176.83 177.00 3ihm h TYR 313 N 0.45 -0.48 -0.26 2.24 3.20 -1.24 -2.09 116.97 118.78 3ihm h TYR 313 Ca 0.11 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.91 3ihm h TYR 313 Cb 0.33 0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 3ihm h TYR 313 CO 0.02 -0.28 -0.16 0.00 -1.64 0.00 0.00 178.16 176.09 3ihm h ALA 314 N 0.31 1.23 -0.84 1.82 0.00 -1.36 -2.49 119.26 117.93 3ihm h ALA 314 Ca -0.01 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 3ihm h ALA 314 Cb 0.38 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3ihm h ALA 314 CO -0.02 0.50 0.41 0.00 0.00 0.00 0.00 179.25 180.14 3ihm h ALA 315 N 1.41 1.13 -0.29 0.00 0.00 -1.21 -0.07 119.26 120.24 3ihm h ALA 315 Ca 0.07 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 3ihm h ALA 315 Cb 0.54 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3ihm h ALA 315 CO 0.03 0.66 -0.04 2.35 0.00 0.00 0.00 179.25 182.25 3ihm h TRP 316 N 1.20 0.59 -0.29 0.00 2.91 -1.01 -1.25 115.95 118.10 3ihm h TRP 316 Ca 0.29 -0.12 -0.03 0.00 1.13 0.00 0.00 58.89 60.16 3ihm h TRP 316 Cb 0.11 -0.15 -0.01 0.00 -0.51 0.00 0.00 29.16 28.60 3ihm h TRP 316 CO 0.01 0.71 0.05 0.82 -1.03 0.00 0.00 178.44 179.01 3ihm h ILE 317 N 0.30 1.23 -0.70 2.65 5.03 -1.30 -2.02 117.51 122.71 3ihm h ILE 317 Ca 0.08 -0.78 -0.02 0.00 -0.12 0.00 0.00 64.86 64.02 3ihm h ILE 317 Cb 0.50 1.18 -0.03 0.00 -3.03 0.00 0.00 36.82 35.44 3ihm h ILE 317 CO 0.02 0.25 0.36 0.25 -0.68 0.00 0.00 178.15 178.36 3ihm h LEU 318 N 0.30 0.87 -0.44 1.44 5.85 -1.03 -0.76 115.31 121.55 3ihm h LEU 318 Ca 0.09 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.74 3ihm h LEU 318 Cb 0.33 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 3ihm h LEU 318 CO 0.00 0.72 0.28 1.23 -0.34 0.00 0.00 178.44 180.34 3ihm h GLY 319 N 1.03 0.61 1.11 3.75 0.00 -1.04 -0.65 103.07 107.88 3ihm h GLY 319 Ca 0.25 -0.22 -0.06 0.00 0.00 0.00 0.00 47.33 47.29 3ihm h GLY 319 CO -0.04 0.21 0.18 0.83 0.00 0.00 0.00 176.54 177.72 3ihm h GLU 320 N 0.57 1.11 0.00 4.80 5.08 -0.93 -3.04 114.58 122.18 3ihm h GLU 320 Ca 0.16 -0.25 -0.11 0.00 -1.00 0.00 0.00 59.36 58.16 3ihm h GLU 320 Cb -0.05 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 3ihm h GLU 320 CO -0.05 0.97 -0.54 0.93 -1.00 0.00 0.00 179.01 179.32 3ihm h GLU 321 N 1.05 0.00 -0.53 2.33 4.39 -0.86 -2.33 114.58 118.63 3ihm h GLU 321 Ca 0.22 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.82 3ihm h GLU 321 Cb 0.35 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 3ihm h GLU 321 CO -0.00 0.54 -0.07 0.82 -1.16 0.00 0.00 179.01 179.14 3ihm h ILE 322 N 0.00 1.26 -0.45 3.13 2.04 -1.04 -2.16 117.51 120.29 3ihm h ILE 322 Ca -0.01 -1.20 -0.14 0.00 1.00 0.00 0.00 64.86 64.52 3ihm h ILE 322 Cb 1.04 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 3ihm h ILE 322 CO 0.07 0.42 -0.28 -0.07 0.00 0.00 0.00 178.15 178.29 3ihm h LEU 323 N 0.86 1.02 -0.21 1.44 3.38 -1.40 -3.28 115.31 117.11 3ihm h LEU 323 Ca 0.14 -0.42 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 3ihm h LEU 323 Cb 0.61 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3ihm h LEU 323 CO 0.04 1.22 -0.18 0.00 0.09 0.00 0.00 178.44 179.61 3ihm h ALA 324 N 0.84 0.90 -2.60 1.53 0.00 -1.34 -3.46 119.26 115.13 3ihm h ALA 324 Ca 0.09 -0.16 -0.59 0.00 0.00 0.00 0.00 54.91 54.25 3ihm h ALA 324 Cb 0.87 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.51 3ihm h ALA 324 CO 0.08 0.22 -0.69 -1.01 0.00 0.00 0.00 179.25 177.85 3ihm s HIS 325 N -3.21 2.65 0.00 0.00 3.76 -0.82 -5.04 115.29 112.63 3ihm s HIS 325 Ca 0.05 -0.22 0.00 0.00 -0.15 0.00 0.00 55.06 54.74 3ihm s HIS 325 Cb 0.07 -1.23 0.00 0.00 1.11 0.00 0.00 32.58 32.52 3ihm s HIS 325 CO 0.68 0.57 0.00 0.43 -0.85 0.00 0.00 174.74 175.57 3ihm n SER 326 N -0.41 4.69 -4.27 1.40 7.64 -1.26 -4.83 113.62 116.58 3ihm n SER 326 Ca -0.08 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.44 3ihm n SER 326 Cb 0.57 0.93 -0.14 0.00 -1.01 0.00 0.00 64.21 64.57 3ihm n SER 326 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3ihm s VAL 327 N -1.88 3.36 -1.09 0.44 1.01 -1.26 -5.05 120.40 115.93 3ihm s VAL 327 Ca 0.00 -0.83 -0.08 0.00 0.00 0.00 0.00 61.98 61.08 3ihm s VAL 327 Cb 0.00 -2.69 0.28 0.00 0.00 0.00 0.00 36.38 33.96 3ihm s VAL 327 CO 0.00 0.18 1.11 -1.22 0.00 0.00 0.00 175.10 175.17 3ihm n TYR 328 N 4.76 4.92 -2.54 5.22 4.01 -1.26 -4.51 117.16 127.76 3ihm n TYR 328 Ca -0.16 -3.84 0.00 0.00 -0.16 0.00 0.00 57.90 53.74 3ihm n TYR 328 Cb 0.48 -1.60 0.00 0.00 -0.31 0.00 0.00 39.34 37.91 3ihm n TYR 328 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3ihm n ASP 329 N 2.51 0.96 -0.02 7.72 5.68 -1.26 -4.46 116.55 127.68 3ihm n ASP 329 Ca 0.24 0.00 -0.02 0.00 -0.50 0.00 0.00 54.79 54.51 3ihm n ASP 329 Cb 0.38 0.00 0.24 0.00 -1.14 0.00 0.00 41.12 40.61 3ihm n ASP 329 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 3ihm h LEU 330 N 0.00 0.55 -0.43 -2.12 3.38 -1.98 -1.26 115.31 113.44 3ihm h LEU 330 Ca 0.00 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 3ihm h LEU 330 Cb 0.00 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 3ihm h LEU 330 CO 0.00 0.66 0.01 -0.09 0.09 0.00 0.00 178.44 179.11 3ihm h ARG 331 N 0.55 0.76 -0.63 1.13 9.65 -1.96 0.11 114.38 123.98 3ihm h ARG 331 Ca 0.11 -0.24 0.03 0.00 -1.10 0.00 0.00 59.98 58.78 3ihm h ARG 331 Cb 0.42 -0.07 -0.04 0.00 -1.39 0.00 0.00 29.97 28.89 3ihm h ARG 331 CO 0.02 0.82 0.39 0.35 2.80 0.00 0.00 179.97 184.35 3ihm h PHE 332 N 0.60 0.73 -0.95 2.20 3.57 -1.74 -1.85 116.94 119.50 3ihm h PHE 332 Ca 0.12 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.67 3ihm h PHE 332 Cb 0.48 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.93 3ihm h PHE 332 CO 0.04 0.42 0.63 1.03 -2.23 0.00 0.00 178.31 178.19 3ihm h SER 333 N 0.77 1.06 -0.16 0.41 0.87 -0.88 -1.48 113.55 114.14 3ihm h SER 333 Ca 0.26 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.79 3ihm h SER 333 Cb 0.02 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.72 3ihm h SER 333 CO -0.10 0.75 0.07 -0.33 -0.53 0.00 0.00 176.83 176.68 3ihm h GLU 334 N 1.24 0.24 -0.82 2.24 5.08 -0.54 -1.88 114.58 120.14 3ihm h GLU 334 Ca 0.37 -0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.78 3ihm h GLU 334 Cb -0.06 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.07 3ihm h GLU 334 CO -0.10 0.30 0.46 0.45 -1.00 0.00 0.00 179.01 179.12 3ihm h HIS 335 N 0.12 0.84 -0.00 4.33 3.86 -0.99 -1.40 115.15 121.91 3ihm h HIS 335 Ca 0.05 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.29 3ihm h HIS 335 Cb 0.14 -0.26 -0.00 0.00 1.06 0.00 0.00 27.41 28.36 3ihm h HIS 335 CO -0.02 0.34 0.00 1.25 0.86 0.00 0.00 177.93 180.36 3ihm h LEU 336 N 0.78 0.01 -0.81 2.43 5.85 -1.11 -3.04 115.31 119.41 3ihm h LEU 336 Ca 0.39 -0.24 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 3ihm h LEU 336 Cb 0.36 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 3ihm h LEU 336 CO -0.25 0.25 0.03 -0.33 -0.34 0.00 0.00 178.44 177.80 3ihm h GLU 337 N -0.24 0.92 -0.89 1.25 4.39 -1.16 -1.15 114.58 117.70 3ihm h GLU 337 Ca 0.00 -0.25 0.17 0.00 0.34 0.00 0.00 59.36 59.62 3ihm h GLU 337 Cb 0.25 -0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 28.72 3ihm h GLU 337 CO 0.00 0.89 0.58 -0.09 -1.16 0.00 0.00 179.01 179.23 3ihm h ARG 338 N 0.86 0.55 0.16 2.33 9.65 -1.24 0.36 114.38 127.04 3ihm h ARG 338 Ca 0.17 -0.03 -0.31 0.00 -1.10 0.00 0.00 59.98 58.70 3ihm h ARG 338 Cb 0.46 -0.13 0.01 0.00 -1.39 0.00 0.00 29.97 28.93 3ihm h ARG 338 CO 0.02 0.37 -1.57 0.00 2.80 0.00 0.00 179.97 181.59 3ihm h ARG 339 N 0.57 0.33 0.00 0.20 3.08 -1.28 -3.42 114.38 113.86 3ihm h ARG 339 Ca 0.46 -0.57 -0.32 0.00 0.07 0.00 0.00 59.98 59.63 3ihm h ARG 339 Cb 0.91 0.21 -0.06 0.00 0.08 0.00 0.00 29.97 31.11 3ihm h ARG 339 CO -0.20 1.27 -2.25 2.89 -1.07 0.00 0.00 179.97 180.61 3ihm n ARG 340 N -3.76 0.68 -0.06 0.04 1.85 -0.50 -4.72 116.66 110.20 3ihm n ARG 340 Ca -0.24 0.01 -0.09 0.00 -1.00 0.00 0.00 57.85 56.53 3ihm n ARG 340 Cb 0.99 -1.56 -0.02 0.00 -1.05 0.00 0.00 32.46 30.82 3ihm n ARG 340 CO 0.00 0.00 0.00 1.96 -0.01 0.00 0.00 177.63 179.58 3ihm h GLN 341 N 0.00 0.25 0.02 2.89 4.20 -1.15 -3.03 115.11 118.29 3ihm h GLN 341 Ca -0.45 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.27 3ihm h GLN 341 Cb 2.07 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 29.75 3ihm h GLN 341 CO 0.03 0.16 -0.31 0.22 -0.67 0.00 0.00 178.83 178.27 3ihm h ASP 342 N 0.26 -0.92 -0.33 1.46 3.58 -1.85 0.59 116.42 119.21 3ihm h ASP 342 Ca 0.10 0.12 0.00 0.00 0.42 0.00 0.00 57.03 57.67 3ihm h ASP 342 Cb 0.02 0.37 -0.02 0.00 1.72 0.00 0.00 39.33 41.42 3ihm h ASP 342 CO -0.06 -0.38 0.22 -0.09 -2.88 0.00 0.00 179.24 176.05 3ihm h ARG 343 N -0.47 0.43 -0.24 0.28 2.43 -1.89 0.17 114.38 115.10 3ihm h ARG 343 Ca 0.06 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 3ihm h ARG 343 Cb 0.55 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 3ihm h ARG 343 CO -0.25 0.29 0.04 0.28 -1.51 0.00 0.00 179.97 178.82 3ihm h VAL 344 N 0.45 1.22 -0.69 0.20 2.07 -1.33 -1.45 116.25 116.71 3ihm h VAL 344 Ca 0.12 -0.74 -0.07 0.00 0.82 0.00 0.00 66.70 66.84 3ihm h VAL 344 Cb -0.05 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 3ihm h VAL 344 CO -0.03 0.23 0.17 0.25 0.02 0.00 0.00 177.57 178.21 3ihm h LEU 345 N 0.20 1.03 -1.07 2.57 5.85 0.28 -2.78 115.31 121.39 3ihm h LEU 345 Ca 0.07 -0.21 -0.09 0.00 0.84 0.00 0.00 57.88 58.49 3ihm h LEU 345 Cb 0.31 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 3ihm h LEU 345 CO 0.00 0.99 -0.31 0.00 -0.34 0.00 0.00 178.44 178.78 3ihm h ALA 347 N 1.44 1.10 -0.15 0.00 0.00 -1.04 0.28 119.26 120.90 3ihm h ALA 347 Ca 0.03 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 3ihm h ALA 347 Cb 0.67 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3ihm h ALA 347 CO 0.05 0.61 -0.01 1.15 0.00 0.00 0.00 179.25 181.05 3ihm h THR 348 N 1.20 1.26 -0.58 0.00 2.02 -1.17 -2.21 112.91 113.43 3ihm h THR 348 Ca 0.30 -0.88 -0.09 0.00 0.77 0.00 0.00 66.41 66.51 3ihm h THR 348 Cb 0.03 1.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 3ihm h THR 348 CO -0.05 0.26 0.00 0.03 0.37 0.00 0.00 175.52 176.13 3ihm h ARG 349 N 0.00 1.03 -0.50 6.66 3.08 -0.71 -0.56 114.38 123.38 3ihm h ARG 349 Ca 0.04 -0.33 -0.12 0.00 0.07 0.00 0.00 59.98 59.65 3ihm h ARG 349 Cb 0.40 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 3ihm h ARG 349 CO 0.01 1.02 -0.14 2.35 -1.07 0.00 0.00 179.97 182.14 3ihm h TRP 350 N 0.92 1.09 -0.14 3.04 7.01 -0.52 -0.71 115.95 126.65 3ihm h TRP 350 Ca 0.17 -0.23 -0.03 0.00 2.11 0.00 0.00 58.89 60.91 3ihm h TRP 350 Cb 0.55 -0.27 -0.00 0.00 -2.10 0.00 0.00 29.16 27.34 3ihm h TRP 350 CO 0.04 1.03 -0.02 1.15 -2.79 0.00 0.00 178.44 177.85 3ihm h THR 351 N 0.86 1.27 -0.69 2.65 2.02 -1.23 -1.88 112.91 115.91 3ihm h THR 351 Ca 0.13 -0.92 -0.07 0.00 0.77 0.00 0.00 66.41 66.32 3ihm h THR 351 Cb 0.70 1.61 -0.03 0.00 -1.74 0.00 0.00 68.15 68.69 3ihm h THR 351 CO 0.05 0.27 0.15 0.78 0.37 0.00 0.00 175.52 177.14 3ihm h ASN 352 N -0.04 1.06 -0.24 4.18 -0.26 -1.09 -1.44 115.58 117.75 3ihm h ASN 352 Ca 0.04 -0.24 0.02 0.00 -0.56 0.00 0.00 56.30 55.55 3ihm h ASN 352 Cb 0.42 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 37.38 3ihm h ASN 352 CO 0.01 1.03 0.11 0.15 -1.06 0.00 0.00 177.43 177.67 3ihm h PHE 353 N 1.04 0.20 -0.52 1.19 3.57 -1.14 -2.57 116.94 118.72 3ihm h PHE 353 Ca 0.21 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.66 3ihm h PHE 353 Cb 0.39 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 3ihm h PHE 353 CO 0.03 0.11 0.07 1.15 -2.23 0.00 0.00 178.31 177.44 3ihm h THR 354 N 0.24 1.25 -0.55 4.41 2.02 -1.06 0.21 112.91 119.43 3ihm h THR 354 Ca 0.10 -0.97 0.04 0.00 0.77 0.00 0.00 66.41 66.34 3ihm h THR 354 Cb 0.04 0.87 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 3ihm h THR 354 CO -0.08 0.35 0.31 -0.07 0.37 0.00 0.00 175.52 176.40 3ihm h LEU 355 N 0.75 0.47 -0.33 2.58 3.38 -1.25 -0.14 115.31 120.77 3ihm h LEU 355 Ca 0.16 0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.95 3ihm h LEU 355 Cb 0.43 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 3ihm h LEU 355 CO 0.01 0.33 -0.76 0.28 0.09 0.00 0.00 178.44 178.39 3ihm h SER 356 N 0.60 0.57 -0.05 -0.43 0.02 -1.17 -3.06 113.55 110.03 3ihm h SER 356 Ca 0.23 -0.38 -0.12 0.00 -0.84 0.00 0.00 61.79 60.67 3ihm h SER 356 Cb 0.09 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 3ihm h SER 356 CO -0.13 1.14 -0.36 0.00 -1.14 0.00 0.00 176.83 176.33 3ihm h ALA 357 N 0.85 0.90 -0.20 3.77 0.00 -0.39 -1.84 119.26 122.35 3ihm h ALA 357 Ca -0.04 -0.42 -0.10 0.00 0.00 0.00 0.00 54.91 54.35 3ihm h ALA 357 Cb 1.35 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3ihm h ALA 357 CO 0.14 0.63 -0.32 -0.07 0.00 0.00 0.00 179.25 179.62 3ihm h LEU 358 N 0.46 0.43 0.21 0.00 4.07 -1.04 0.17 115.31 119.61 3ihm h LEU 358 Ca 0.05 -0.16 -0.35 0.00 0.08 0.00 0.00 57.88 57.50 3ihm h LEU 358 Cb 0.85 -0.12 0.02 0.00 1.08 0.00 0.00 40.66 42.49 3ihm h LEU 358 CO 0.07 0.73 -1.67 0.77 -1.08 0.00 0.00 178.44 177.26 3ihm h SER 359 N 0.36 0.69 0.69 -0.43 4.64 -1.48 -3.38 113.55 114.64 3ihm h SER 359 Ca 0.04 -0.92 -0.26 0.00 -0.47 0.00 0.00 61.79 60.19 3ihm h SER 359 Cb 0.75 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 62.57 3ihm h SER 359 CO 0.06 1.76 -1.43 0.00 -0.87 0.00 0.00 176.83 176.34 3ihm h ALA 360 N 0.14 0.61 -6.02 5.18 0.00 -1.39 -3.46 119.26 114.32 3ihm h ALA 360 Ca -0.32 -1.25 -0.23 0.00 0.00 0.00 0.00 54.91 53.11 3ihm h ALA 360 Cb 2.12 0.24 0.00 0.00 0.00 0.00 0.00 17.79 20.15 3ihm h ALA 360 CO 0.21 1.46 -0.54 1.28 0.00 0.00 0.00 179.25 181.66 3ihm n LEU 361 N -3.16 -4.53 -4.79 0.00 4.77 0.60 -4.98 117.00 104.91 3ihm n LEU 361 Ca -0.10 -0.46 -0.33 0.00 -0.03 0.00 0.00 56.01 55.09 3ihm n LEU 361 Cb 1.01 -2.52 0.03 0.00 -2.33 0.00 0.00 43.42 39.61 3ihm n LEU 361 CO 0.46 -0.46 0.73 -2.84 -1.33 0.00 0.00 177.39 173.94 3ihm s PRO 362 N -3.84 3.00 0.20 3.23 0.02 -1.26 -4.84 135.00 131.51 3ihm s PRO 362 Ca 0.02 1.27 -0.13 0.00 0.02 0.00 0.00 61.00 62.18 3ihm s PRO 362 Cb -0.00 -1.99 0.22 0.00 0.02 0.00 0.00 34.50 32.75 3ihm s PRO 362 CO 0.82 -1.07 1.67 -1.35 -0.33 0.00 0.00 177.00 176.73 3ihm h PRO 363 N 0.09 0.08 0.00 5.54 0.11 -1.99 -1.52 132.00 134.31 3ihm h PRO 363 Ca -0.46 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 3ihm h PRO 363 Cb 1.23 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3ihm h PRO 363 CO 0.56 0.06 -0.25 1.05 -0.21 0.00 0.00 178.00 179.20 3ihm h GLU 364 N 0.09 0.00 0.21 1.05 9.09 -1.97 -1.95 114.58 121.09 3ihm h GLU 364 Ca 0.28 0.00 -0.31 0.00 0.05 0.00 0.00 59.36 59.37 3ihm h GLU 364 Cb 0.43 0.00 0.03 0.00 -1.65 0.00 0.00 28.75 27.56 3ihm h GLU 364 CO -0.48 0.25 -1.39 0.35 0.05 0.00 0.00 179.01 177.79 3ihm h PHE 365 N 0.00 0.82 -0.63 2.06 3.57 -1.74 -2.68 116.94 118.33 3ihm h PHE 365 Ca -0.00 -0.59 -0.07 0.00 3.53 0.00 0.00 57.97 60.83 3ihm h PHE 365 Cb 0.56 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.24 3ihm h PHE 365 CO 0.00 1.46 0.10 -0.07 -2.23 0.00 0.00 178.31 177.58 3ihm h LEU 366 N 0.13 0.97 -1.21 0.59 3.38 -1.13 -1.74 115.31 116.30 3ihm h LEU 366 Ca -0.21 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.49 3ihm h LEU 366 Cb 2.09 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 42.57 3ihm h LEU 366 CO 0.25 0.97 0.00 0.00 0.09 0.00 0.00 178.44 179.75 3ihm h ALA 367 N 1.15 1.35 -0.30 1.53 0.00 -1.42 -2.53 119.26 119.05 3ihm h ALA 367 Ca 0.19 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3ihm h ALA 367 Cb 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3ihm h ALA 367 CO 0.01 0.45 0.04 0.35 0.00 0.00 0.00 179.25 180.10 3ihm h PHE 368 N 0.52 0.54 -0.24 0.00 3.57 -1.10 -2.70 116.94 117.54 3ihm h PHE 368 Ca 0.11 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 3ihm h PHE 368 Cb 0.33 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 3ihm h PHE 368 CO 0.01 0.60 0.07 -0.07 -2.23 0.00 0.00 178.31 176.70 3ihm h LEU 369 N 0.32 0.29 0.05 0.59 3.38 -1.12 -0.84 115.31 117.98 3ihm h LEU 369 Ca 0.09 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3ihm h LEU 369 Cb 0.36 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3ihm h LEU 369 CO 0.01 0.29 -0.03 1.56 0.09 0.00 0.00 178.44 180.36 3ihm h GLN 370 N 0.33 -0.07 -0.56 1.13 4.20 -1.37 -2.40 115.11 116.37 3ihm h GLN 370 Ca 0.08 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.73 3ihm h GLN 370 Cb 0.10 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 3ihm h GLN 370 CO -0.01 0.42 0.09 0.97 -0.67 0.00 0.00 178.83 179.63 3ihm h ILE 371 N -0.60 1.24 -0.86 2.54 6.09 -1.39 -2.77 117.51 121.77 3ihm h ILE 371 Ca -0.01 -0.94 0.01 0.00 -1.37 0.00 0.00 64.86 62.55 3ihm h ILE 371 Cb 0.52 0.72 -0.04 0.00 0.47 0.00 0.00 36.82 38.49 3ihm h ILE 371 CO 0.01 0.34 0.57 0.25 -3.07 0.00 0.00 178.15 176.25 3ihm h LEU 372 N 0.85 0.98 -1.20 2.19 5.85 -1.19 -1.60 115.31 121.19 3ihm h LEU 372 Ca 0.18 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 3ihm h LEU 372 Cb 0.38 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 3ihm h LEU 372 CO 0.01 0.72 -0.21 0.77 -0.34 0.00 0.00 178.44 179.38 3ihm h SER 373 N 1.16 0.00 -0.27 1.25 4.64 -1.24 -3.15 113.55 115.94 3ihm h SER 373 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 3ihm h SER 373 Cb -0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.96 3ihm h SER 373 CO -0.07 0.21 0.00 0.00 -0.87 0.00 0.00 176.83 176.10 3ihm n GLN 374 N -3.40 2.09 -3.76 4.77 6.02 -0.92 -4.85 117.38 117.32 3ihm n GLN 374 Ca -0.00 -1.94 -0.27 0.00 -0.01 0.00 0.00 57.00 54.78 3ihm n GLN 374 Cb 0.41 -1.38 -0.17 0.00 1.02 0.00 0.00 30.24 30.13 3ihm n GLN 374 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3ihm s SER 375 N -1.24 2.81 0.15 1.08 0.15 -0.65 -5.02 113.70 110.99 3ihm s SER 375 Ca 0.28 -0.75 -0.12 0.00 0.70 0.00 0.00 55.95 56.06 3ihm s SER 375 Cb 0.17 -0.64 0.03 0.00 -1.71 0.00 0.00 66.02 63.87 3ihm s SER 375 CO 0.23 -0.28 1.62 -0.09 1.20 0.00 0.00 173.24 175.93 3ihm h ARG 376 N 8.23 0.89 -0.59 5.44 9.65 -1.89 -1.97 114.38 134.14 3ihm h ARG 376 Ca -0.17 -0.26 -0.02 0.00 -1.10 0.00 0.00 59.98 58.42 3ihm h ARG 376 Cb 1.12 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 29.58 3ihm h ARG 376 CO 0.34 0.89 0.28 1.05 2.80 0.00 0.00 179.97 185.33 3ihm h GLU 377 N 0.76 0.82 -0.27 0.20 9.09 -1.94 0.14 114.58 123.38 3ihm h GLU 377 Ca 0.15 -0.10 -0.16 0.00 0.05 0.00 0.00 59.36 59.30 3ihm h GLU 377 Cb 0.47 -0.16 -0.00 0.00 -1.65 0.00 0.00 28.75 27.41 3ihm h GLU 377 CO 0.02 0.64 -0.47 1.98 0.05 0.00 0.00 179.01 181.23 3ihm h MET 378 N 0.82 0.79 -0.80 1.06 4.05 -1.87 -2.48 114.93 116.50 3ihm h MET 378 Ca 0.20 -0.49 -0.03 0.00 -0.28 0.00 0.00 59.70 59.10 3ihm h MET 378 Cb 0.09 0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 30.91 3ihm h MET 378 CO -0.03 1.12 0.38 0.00 0.23 0.00 0.00 176.91 178.62 3ihm h ALA 379 N 0.66 1.03 -0.23 0.39 0.00 -0.93 0.32 119.26 120.51 3ihm h ALA 379 Ca 0.02 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3ihm h ALA 379 Cb 1.07 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3ihm h ALA 379 CO 0.11 0.59 0.15 -0.44 0.00 0.00 0.00 179.25 179.66 3ihm h ASP 380 N 1.13 0.27 -0.16 0.00 3.32 -0.99 -0.89 116.42 119.10 3ihm h ASP 380 Ca 0.27 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 3ihm h ASP 380 Cb 0.12 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3ihm h ASP 380 CO -0.03 0.20 0.04 -0.08 -1.72 0.00 0.00 179.24 177.64 3ihm h GLU 381 N 0.31 0.25 -0.84 3.56 4.81 -1.13 -1.06 114.58 120.47 3ihm h GLU 381 Ca 0.08 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 3ihm h GLU 381 Cb -0.03 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.27 3ihm h GLU 381 CO -0.02 0.40 0.55 0.35 -0.73 0.00 0.00 179.01 179.57 3ihm h PHE 382 N 0.05 1.03 0.38 0.92 3.57 -0.93 -0.86 116.94 121.11 3ihm h PHE 382 Ca 0.05 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 3ihm h PHE 382 Cb 0.27 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.67 3ihm h PHE 382 CO 0.01 0.62 -0.18 1.15 -2.23 0.00 0.00 178.31 177.67 3ihm h THR 383 N 1.09 0.62 0.00 4.41 2.02 -1.00 -3.11 112.91 116.93 3ihm h THR 383 Ca 0.33 -0.35 -0.04 0.00 0.77 0.00 0.00 66.41 67.12 3ihm h THR 383 Cb -0.05 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 3ihm h THR 383 CO -0.10 0.07 -0.17 -0.78 0.37 0.00 0.00 175.52 174.91 3ihm h ASP 384 N -0.71 0.00 0.15 4.18 3.58 -1.11 -2.12 116.42 120.38 3ihm h ASP 384 Ca -0.05 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.40 3ihm h ASP 384 Cb 0.50 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.55 3ihm h ASP 384 CO 0.09 0.17 0.00 0.59 -2.88 0.00 0.00 179.24 177.21 3ihm n ASN 385 N -4.32 0.00 0.26 2.28 3.02 -0.34 -1.70 115.26 114.47 3ihm n ASN 385 Ca -0.02 -0.26 0.09 0.00 -0.03 0.00 0.00 54.58 54.36 3ihm n ASN 385 Cb 0.24 -0.13 0.69 0.00 -0.61 0.00 0.00 39.78 39.97 3ihm n ASN 385 CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 3ihm h PHE 386 N 0.00 0.00 0.00 3.10 0.04 -1.39 -1.08 116.94 117.60 3ihm h PHE 386 Ca 0.00 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 3ihm h PHE 386 Cb 0.07 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.22 3ihm h PHE 386 CO 0.00 0.02 -0.02 -0.91 -0.60 0.00 0.00 178.31 176.80 3ihm h ASN 387 N 0.00 0.00 -2.88 2.17 4.21 -1.55 -3.39 115.58 114.15 3ihm h ASN 387 Ca -0.00 0.00 -0.60 0.00 1.21 0.00 0.00 56.30 56.91 3ihm h ASN 387 Cb 0.05 0.00 -0.40 0.00 -1.12 0.00 0.00 38.32 36.85 3ihm h ASN 387 CO 0.00 0.02 -0.79 -0.31 -1.29 0.00 0.00 177.43 175.07 3ihm s TYR 388 N -3.63 2.05 0.45 1.19 2.02 -0.41 -4.98 117.35 114.04 3ihm s TYR 388 Ca 0.02 -2.63 0.28 0.00 -0.37 0.00 0.00 57.07 54.37 3ihm s TYR 388 Cb 0.09 -1.70 1.52 0.00 -0.40 0.00 0.00 41.96 41.46 3ihm s TYR 388 CO 0.56 -0.73 2.11 -1.00 -1.57 0.00 0.00 175.55 174.92 3ihm h PRO 389 N 5.90 0.00 -0.50 -1.71 0.13 -1.76 -2.57 132.00 131.50 3ihm h PRO 389 Ca 0.15 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.22 3ihm h PRO 389 Cb 0.87 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.98 3ihm h PRO 389 CO 0.50 0.10 0.04 1.05 -0.23 0.00 0.00 178.00 179.46 3ihm h GLU 390 N 0.00 0.80 0.00 0.86 9.09 -1.86 -1.04 114.58 122.44 3ihm h GLU 390 Ca -0.00 -0.20 0.00 0.00 0.05 0.00 0.00 59.36 59.21 3ihm h GLU 390 Cb 0.27 -0.10 0.00 0.00 -1.65 0.00 0.00 28.75 27.27 3ihm h GLU 390 CO 0.01 0.78 -0.37 0.07 0.05 0.00 0.00 179.01 179.55 3ihm h ARG 391 N 0.76 0.00 -0.35 1.06 0.11 -1.81 -2.47 114.38 111.68 3ihm h ARG 391 Ca 0.15 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 60.12 3ihm h ARG 391 Cb 0.40 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.47 3ihm h ARG 391 CO 0.01 0.00 -0.25 1.96 0.10 0.00 0.00 179.97 181.79 3ihm h GLN 392 N 0.00 0.78 0.00 0.08 1.08 -1.23 -3.07 115.11 112.75 3ihm h GLN 392 Ca 0.00 -0.38 -0.06 0.00 -1.45 0.00 0.00 58.65 56.76 3ihm h GLN 392 Cb 0.86 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.28 3ihm h GLN 392 CO 0.00 1.00 -0.28 2.35 -0.95 0.00 0.00 178.83 180.95 3ihm h TRP 393 N 0.57 0.00 0.00 2.96 -0.00 -1.13 -1.10 115.95 117.25 3ihm h TRP 393 Ca 0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.95 3ihm h TRP 393 Cb 0.81 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.97 3ihm h TRP 393 CO 0.06 0.28 -0.06 -0.44 -0.00 0.00 0.00 178.44 178.29 3ihm h ASP 394 N 0.00 0.00 0.15 2.65 3.32 -1.35 -1.23 116.42 119.95 3ihm h ASP 394 Ca -0.00 0.00 -0.36 0.00 0.02 0.00 0.00 57.03 56.69 3ihm h ASP 394 Cb 0.60 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 3ihm h ASP 394 CO 0.04 0.06 -2.00 0.54 -1.72 0.00 0.00 179.24 176.16 3ihm n ARG 395 N -3.84 0.75 -0.00 3.56 5.12 -0.53 -4.64 116.66 117.07 3ihm n ARG 395 Ca -0.03 0.26 0.10 0.00 -1.93 0.00 0.00 57.85 56.25 3ihm n ARG 395 Cb 0.15 -1.71 -0.12 0.00 -1.16 0.00 0.00 32.46 29.62 3ihm n ARG 395 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 3ihm n PHE 396 N -3.44 0.00 0.24 -1.55 3.72 -0.54 -1.59 117.46 114.29 3ihm n PHE 396 Ca -0.31 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.21 3ihm n PHE 396 Cb 1.05 -0.07 0.74 0.00 -0.94 0.00 0.00 39.48 40.26 3ihm n PHE 396 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3ihm h SER 397 N 0.00 0.00 -5.09 4.37 4.64 -1.48 -3.43 113.55 112.56 3ihm h SER 397 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 3ihm h SER 397 Cb 0.55 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 62.46 3ihm h SER 397 CO 0.00 0.00 -0.57 -0.94 -0.87 0.00 0.00 176.83 174.45 3ihm s SER 398 N -6.58 0.23 0.47 4.97 1.04 -1.26 -5.04 113.70 107.53 3ihm s SER 398 Ca -0.05 -0.58 0.16 0.00 0.48 0.00 0.00 55.95 55.96 3ihm s SER 398 Cb 0.17 0.20 1.14 0.00 0.10 0.00 0.00 66.02 67.63 3ihm s SER 398 CO 0.63 -0.48 2.04 -0.65 0.98 0.00 0.00 173.24 175.76 3ihm h PRO 399 N 3.78 0.23 -0.26 4.02 0.11 -1.92 -1.79 132.00 136.18 3ihm h PRO 399 Ca -0.33 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.64 3ihm h PRO 399 Cb 1.18 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3ihm h PRO 399 CO 0.51 0.15 -0.38 0.93 -0.21 0.00 0.00 178.00 179.00 3ihm h GLU 400 N 0.24 0.58 -0.05 1.05 3.07 -1.96 -1.65 114.58 115.86 3ihm h GLU 400 Ca 0.18 -0.29 -0.21 0.00 -0.50 0.00 0.00 59.36 58.55 3ihm h GLU 400 Cb 0.40 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.31 3ihm h GLU 400 CO -0.03 0.87 -0.83 0.00 -1.40 0.00 0.00 179.01 177.62 3ihm h ARG 401 N 0.49 0.43 -0.14 2.33 3.08 -1.66 -1.11 114.38 117.79 3ihm h ARG 401 Ca 0.05 -0.40 -0.00 0.00 0.07 0.00 0.00 59.98 59.70 3ihm h ARG 401 Cb 0.88 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 3ihm h ARG 401 CO 0.08 1.05 0.09 0.82 -1.07 0.00 0.00 179.97 180.93 3ihm h ILE 402 N 0.27 1.06 -0.78 2.04 2.04 -0.46 -2.14 117.51 119.55 3ihm h ILE 402 Ca -0.05 -0.15 -0.05 0.00 1.00 0.00 0.00 64.86 65.61 3ihm h ILE 402 Cb 1.43 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 38.38 3ihm h ILE 402 CO 0.14 0.06 0.27 1.23 0.00 0.00 0.00 178.15 179.85 3ihm h GLY 403 N 0.17 1.27 1.05 5.37 0.00 -1.26 -1.88 103.07 107.79 3ihm h GLY 403 Ca 0.05 -0.73 -0.06 0.00 0.00 0.00 0.00 47.33 46.59 3ihm h GLY 403 CO -0.01 0.68 0.19 -1.61 0.00 0.00 0.00 176.54 175.80 3ihm h GLN 404 N 1.14 1.10 -0.29 4.80 -0.00 -1.15 -2.43 115.11 118.29 3ihm h GLN 404 Ca 0.25 -0.25 -0.15 0.00 -0.00 0.00 0.00 58.65 58.51 3ihm h GLN 404 Cb 0.27 -0.15 -0.01 0.00 0.00 0.00 0.00 27.48 27.59 3ihm h GLN 404 CO -0.01 0.96 -0.41 2.35 0.00 0.00 0.00 178.83 181.72 3ihm h TRP 405 N 1.04 0.85 -0.42 3.99 7.01 -1.20 -3.12 115.95 124.10 3ihm h TRP 405 Ca 0.22 -0.25 -0.07 0.00 2.11 0.00 0.00 58.89 60.89 3ihm h TRP 405 Cb 0.34 -0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 27.20 3ihm h TRP 405 CO 0.03 1.00 -0.04 0.00 -2.79 0.00 0.00 178.44 176.64 3ihm n SER 407 N -4.21 0.18 0.19 0.00 3.41 -0.93 -2.66 113.62 109.61 3ihm n SER 407 Ca 0.02 0.54 0.14 0.00 -0.26 0.00 0.00 58.87 59.31 3ihm n SER 407 Cb 0.31 -0.58 0.46 0.00 -0.26 0.00 0.00 64.21 64.14 3ihm n SER 407 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 3ihm h GLN 408 N 0.00 0.00 0.00 4.33 4.20 -1.52 -3.38 115.11 118.74 3ihm h GLN 408 Ca 0.00 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.57 3ihm h GLN 408 Cb 0.33 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 3ihm h GLN 408 CO 0.00 0.00 -1.32 1.19 -0.67 0.00 0.00 178.83 178.03 3ihm n PHE 409 N -2.72 0.00 -1.83 2.96 3.72 -1.09 -5.15 117.46 113.36 3ihm n PHE 409 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 3ihm n PHE 409 Cb 0.36 -0.33 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 3ihm n PHE 409 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71