#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ihm s ARG 4 N 0.00 1.26 -0.08 1.64 3.52 -1.26 0.56 118.95 124.60 3ihm s ARG 4 Ca 0.00 -0.80 0.03 0.00 -0.13 0.00 0.00 55.73 54.83 3ihm s ARG 4 Cb 0.00 -2.42 -0.02 0.00 -1.56 0.00 0.00 34.95 30.96 3ihm s ARG 4 CO 0.00 -0.63 -0.18 0.42 -0.81 0.00 0.00 175.30 174.11 3ihm s ILE 5 N 1.56 2.71 -0.17 4.11 -1.09 0.41 -1.26 121.20 127.46 3ihm s ILE 5 Ca -0.04 -0.82 -0.05 0.00 -2.23 0.00 0.00 60.65 57.52 3ihm s ILE 5 Cb -0.18 -2.07 -0.03 0.00 -1.58 0.00 0.00 42.46 38.60 3ihm s ILE 5 CO -0.07 0.56 -0.01 -0.83 -1.23 0.00 0.00 174.94 173.36 3ihm s GLY 6 N -0.15 1.75 -0.22 6.18 0.00 -0.56 -1.89 107.32 112.43 3ihm s GLY 6 Ca -0.02 -0.86 -0.00 0.00 0.00 0.00 0.00 44.72 43.83 3ihm s GLY 6 CO 0.04 0.05 -0.12 -0.42 0.00 0.00 0.00 173.10 172.65 3ihm s ILE 7 N 0.58 2.53 -0.41 0.90 1.01 0.57 -0.72 121.20 125.65 3ihm s ILE 7 Ca -0.01 -1.04 -0.20 0.00 0.00 0.00 0.00 60.65 59.40 3ihm s ILE 7 Cb -0.14 -2.23 0.02 0.00 0.01 0.00 0.00 42.46 40.12 3ihm s ILE 7 CO 0.02 0.30 0.63 -0.69 0.00 0.00 0.00 174.94 175.21 3ihm s VAL 8 N 1.29 4.86 0.00 2.92 1.01 0.18 -0.33 120.40 130.32 3ihm s VAL 8 Ca 0.01 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.22 3ihm s VAL 8 Cb -0.16 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.07 3ihm s VAL 8 CO -0.07 -0.50 0.00 0.61 0.00 0.00 0.00 175.10 175.13 3ihm n GLY 9 N 4.94 1.81 0.00 4.51 0.00 0.57 -1.08 105.19 115.94 3ihm n GLY 9 Ca -0.02 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.43 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 1.81 0.00 -0.58 4.61 0.00 -1.26 -4.45 120.51 120.64 3ihm n ALA 10 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 3ihm n ALA 10 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 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 -1.94 0.30 0.00 0.00 -1.26 -1.76 105.19 105.52 3ihm n GLY 11 Ca 0.00 -1.33 -0.05 0.00 0.00 0.00 0.00 46.02 44.64 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 -0.40 1.21 0.51 2.61 2.02 -1.96 -1.80 112.91 115.10 3ihm h THR 12 Ca 0.01 -0.45 -0.02 0.00 0.77 0.00 0.00 66.41 66.71 3ihm h THR 12 Cb 0.40 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 3ihm h THR 12 CO 0.00 0.22 -0.24 0.00 0.37 0.00 0.00 175.52 175.86 3ihm h ALA 13 N 1.24 -0.68 -0.44 6.16 0.00 -1.76 -1.68 119.26 122.09 3ihm h ALA 13 Ca 0.27 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3ihm h ALA 13 Cb -0.04 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3ihm h ALA 13 CO -0.05 -0.88 -0.03 0.78 0.00 0.00 0.00 179.25 179.06 3ihm h GLY 14 N -0.68 0.87 1.60 0.00 0.00 -1.30 -2.49 103.07 101.07 3ihm h GLY 14 Ca -0.07 -0.67 -0.23 0.00 0.00 0.00 0.00 47.33 46.36 3ihm h GLY 14 CO 0.11 0.61 -0.99 1.41 0.00 0.00 0.00 176.54 177.68 3ihm h LEU 15 N 0.65 0.47 -0.31 3.11 3.38 -1.38 -0.73 115.31 120.49 3ihm h LEU 15 Ca 0.12 -0.40 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 3ihm h LEU 15 Cb 0.54 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3ihm h LEU 15 CO 0.03 1.22 0.09 0.45 0.09 0.00 0.00 178.44 180.32 3ihm h HIS 16 N 0.18 0.50 -0.10 1.13 3.86 -1.35 -0.08 115.15 119.29 3ihm h HIS 16 Ca -0.09 -0.05 0.01 0.00 -1.16 0.00 0.00 60.37 59.09 3ihm h HIS 16 Cb 1.65 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.96 3ihm h HIS 16 CO 0.06 0.52 0.01 1.25 0.86 0.00 0.00 177.93 180.62 3ihm h LEU 17 N 0.34 -0.02 -0.40 2.43 5.85 -1.43 -0.54 115.31 121.55 3ihm h LEU 17 Ca 0.10 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.89 3ihm h LEU 17 Cb 0.25 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 3ihm h LEU 17 CO -0.00 0.01 0.14 1.23 -0.34 0.00 0.00 178.44 179.48 3ihm h GLY 18 N 0.05 0.51 1.02 3.75 0.00 -1.04 -1.12 103.07 106.24 3ihm h GLY 18 Ca 0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 3ihm h GLY 18 CO -0.07 0.03 0.40 1.41 0.00 0.00 0.00 176.54 178.31 3ihm h LEU 19 N 0.30 0.98 -0.17 3.11 3.38 -0.83 -1.67 115.31 120.42 3ihm h LEU 19 Ca 0.18 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3ihm h LEU 19 Cb 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3ihm h LEU 19 CO -0.18 0.82 0.10 0.15 0.09 0.00 0.00 178.44 179.41 3ihm h PHE 20 N 1.08 0.22 -0.33 1.13 3.57 -0.67 -2.94 116.94 119.00 3ihm h PHE 20 Ca 0.27 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.68 3ihm h PHE 20 Cb 0.07 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 3ihm h PHE 20 CO 0.00 0.18 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.05 3ihm h LEU 21 N 0.20 0.58 -1.40 0.59 3.38 -1.02 -2.77 115.31 114.87 3ihm h LEU 21 Ca 0.06 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 3ihm h LEU 21 Cb 0.03 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3ihm h LEU 21 CO -0.01 0.75 -0.27 0.03 0.09 0.00 0.00 178.44 179.03 3ihm h ARG 22 N 0.54 0.00 0.00 1.13 2.47 -1.23 -2.19 114.38 115.09 3ihm h ARG 22 Ca 0.09 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.76 3ihm h ARG 22 Cb 0.57 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.88 3ihm h ARG 22 CO 0.04 0.27 -0.26 1.96 0.56 0.00 0.00 179.97 182.53 3ihm h GLN 23 N 0.00 0.00 -0.55 0.04 4.20 -1.31 -2.24 115.11 115.25 3ihm h GLN 23 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3ihm h GLN 23 Cb 0.61 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.39 3ihm h GLN 23 CO 0.03 0.26 0.00 0.72 -0.67 0.00 0.00 178.83 179.18 3ihm n HIS 24 N -4.15 1.86 -3.70 2.96 8.25 -0.90 -4.96 115.22 114.58 3ihm n HIS 24 Ca -0.02 -0.73 -0.28 0.00 -0.26 0.00 0.00 57.72 56.43 3ihm n HIS 24 Cb 0.32 -0.45 0.03 0.00 1.12 0.00 0.00 29.99 31.01 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 0.56 -4.98 -4.89 0.41 2.03 -0.84 -5.00 116.55 103.84 3ihm n ASP 25 Ca 0.27 -0.64 -0.32 0.00 0.52 0.00 0.00 54.79 54.61 3ihm n ASP 25 Cb 1.12 -3.99 -0.05 0.00 -0.72 0.00 0.00 41.12 37.48 3ihm n ASP 25 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3ihm s VAL 26 N -3.23 5.20 -0.02 5.18 -7.23 -0.88 -5.02 120.40 114.41 3ihm s VAL 26 Ca 0.58 0.05 -0.30 0.00 -1.81 0.00 0.00 61.98 60.50 3ihm s VAL 26 Cb -0.29 -3.62 -0.05 0.00 0.56 0.00 0.00 36.38 32.99 3ihm s VAL 26 CO 0.72 0.13 1.37 -0.62 -0.31 0.00 0.00 175.10 176.39 3ihm s ASP 27 N -2.25 6.88 -0.08 4.85 3.68 0.19 -4.37 116.67 125.57 3ihm s ASP 27 Ca 0.37 2.05 0.02 0.00 2.13 0.00 0.00 52.55 57.12 3ihm s ASP 27 Cb -0.13 -2.56 0.01 0.00 -1.45 0.00 0.00 42.92 38.80 3ihm s ASP 27 CO 0.23 -0.71 -0.15 -0.69 0.13 0.00 0.00 175.17 173.98 3ihm s VAL 28 N 2.48 1.39 -0.09 1.11 1.01 -1.26 -0.44 120.40 124.60 3ihm s VAL 28 Ca 0.62 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 62.00 3ihm s VAL 28 Cb -0.30 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 34.85 3ihm s VAL 28 CO 0.25 0.41 -0.12 -0.89 0.00 0.00 0.00 175.10 174.76 3ihm s THR 29 N 0.67 1.20 -0.15 3.92 2.01 -0.79 -1.16 115.64 121.34 3ihm s THR 29 Ca -0.14 -0.47 -0.03 0.00 0.31 0.00 0.00 61.69 61.36 3ihm s THR 29 Cb -0.16 -1.12 -0.03 0.00 0.01 0.00 0.00 72.50 71.20 3ihm s THR 29 CO 0.04 0.38 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.60 3ihm s VAL 30 N 1.01 3.74 -0.36 3.82 1.01 0.79 -0.32 120.40 130.09 3ihm s VAL 30 Ca -0.08 -0.42 -0.13 0.00 0.00 0.00 0.00 61.98 61.36 3ihm s VAL 30 Cb -0.15 -2.62 0.00 0.00 0.00 0.00 0.00 36.38 33.61 3ihm s VAL 30 CO -0.01 0.50 0.24 -0.31 0.00 0.00 0.00 175.10 175.53 3ihm s TYR 31 N 0.32 3.23 0.06 5.22 2.02 0.55 -0.91 117.35 127.83 3ihm s TYR 31 Ca -0.05 -0.50 0.00 0.00 -0.37 0.00 0.00 57.07 56.16 3ihm s TYR 31 Cb -0.14 -2.49 -0.04 0.00 -0.40 0.00 0.00 41.96 38.89 3ihm s TYR 31 CO 0.03 -0.49 -0.04 0.95 -1.57 0.00 0.00 175.55 174.43 3ihm s THR 32 N 1.67 0.37 -0.66 -0.71 -4.23 -0.96 -0.31 115.64 110.80 3ihm s THR 32 Ca 0.05 -1.64 0.16 0.00 -1.18 0.00 0.00 61.69 59.08 3ihm s THR 32 Cb -0.18 -1.28 0.58 0.00 1.34 0.00 0.00 72.50 72.96 3ihm s THR 32 CO 0.09 -0.83 1.50 -0.67 -0.54 0.00 0.00 174.62 174.17 3ihm n ASP 33 N 0.43 4.20 -3.83 3.99 2.03 -1.25 0.29 116.55 122.40 3ihm n ASP 33 Ca -0.16 -2.60 -0.23 0.00 0.52 0.00 0.00 54.79 52.32 3ihm n ASP 33 Cb 0.59 -0.51 -0.17 0.00 -0.72 0.00 0.00 41.12 40.32 3ihm n ASP 33 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3ihm s ARG 34 N -2.11 0.85 0.46 -0.67 1.81 -1.26 -4.95 118.95 113.09 3ihm s ARG 34 Ca 0.43 -0.02 -0.14 0.00 -1.72 0.00 0.00 55.73 54.27 3ihm s ARG 34 Cb 0.30 -1.05 -0.07 0.00 -0.45 0.00 0.00 34.95 33.68 3ihm s ARG 34 CO 0.16 -0.23 0.89 0.15 -0.68 0.00 0.00 175.30 175.59 3ihm s LYS 35 N 1.61 3.87 0.24 3.54 1.02 -1.26 -5.00 119.74 123.77 3ihm s LYS 35 Ca 0.00 0.74 -0.04 0.00 0.02 0.00 0.00 55.97 56.69 3ihm s LYS 35 Cb -0.13 -2.25 0.42 0.00 -0.52 0.00 0.00 37.83 35.35 3ihm s LYS 35 CO -0.04 -0.16 1.78 -1.35 -0.92 0.00 0.00 175.35 174.66 3ihm h PRO 36 N 1.09 0.63 0.00 -1.68 0.11 -1.97 -1.56 132.00 128.61 3ihm h PRO 36 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3ihm h PRO 36 Cb 1.19 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3ihm h PRO 36 CO 0.63 0.42 0.00 -0.40 -0.21 0.00 0.00 178.00 178.43 3ihm n ASP 37 N -4.84 0.00 -0.36 -2.05 5.75 -1.26 -2.97 116.55 110.82 3ihm n ASP 37 Ca 0.14 -0.38 0.12 0.00 -0.01 0.00 0.00 54.79 54.66 3ihm n ASP 37 Cb 0.34 -0.17 0.18 0.00 -1.03 0.00 0.00 41.12 40.44 3ihm n ASP 37 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3ihm n GLU 38 N -1.17 0.99 0.02 0.11 1.02 -0.59 -4.44 120.64 116.59 3ihm n GLU 38 Ca 0.15 -0.72 -0.15 0.00 -0.02 0.00 0.00 57.16 56.42 3ihm n GLU 38 Cb 0.15 -1.49 -0.04 0.00 -0.02 0.00 0.00 31.44 30.05 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 1.76 0.84 0.00 -0.32 0.05 -1.62 -3.29 116.97 114.40 3ihm h TYR 39 Ca 0.00 -0.39 -0.01 0.00 0.05 0.00 0.00 58.73 58.38 3ihm h TYR 39 Cb 0.63 -0.12 -0.00 0.00 1.01 0.00 0.00 36.73 38.24 3ihm h TYR 39 CO 0.00 1.20 -0.03 0.66 -1.05 0.00 0.00 178.16 178.94 3ihm h SER 40 N 0.40 0.00 -0.68 3.88 4.64 -1.78 -1.92 113.55 118.09 3ihm h SER 40 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 3ihm h SER 40 Cb 1.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.52 3ihm h SER 40 CO 0.15 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.75 3ihm n GLY 41 N -1.14 2.43 3.90 -0.77 0.00 -1.24 -4.99 105.19 103.39 3ihm n GLY 41 Ca -0.03 -0.79 -0.28 0.00 0.00 0.00 0.00 46.02 44.92 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 -1.29 3.64 0.63 0.99 1.43 -0.72 -5.07 118.68 118.29 3ihm s LEU 42 Ca 0.48 0.99 -0.16 0.00 -1.03 0.00 0.00 54.13 54.41 3ihm s LEU 42 Cb 0.27 -3.94 -0.01 0.00 0.03 0.00 0.00 46.19 42.54 3ihm s LEU 42 CO 0.29 -0.56 1.14 -0.60 0.23 0.00 0.00 176.35 176.85 3ihm s ARG 43 N -4.61 2.85 0.11 1.70 3.52 -1.26 -4.88 118.95 116.38 3ihm s ARG 43 Ca 0.48 1.55 -0.35 0.00 -0.13 0.00 0.00 55.73 57.28 3ihm s ARG 43 Cb -0.10 -1.94 -0.17 0.00 -1.56 0.00 0.00 34.95 31.17 3ihm s ARG 43 CO 0.43 -1.24 1.14 -0.11 -0.81 0.00 0.00 175.30 174.72 3ihm n LEU 44 N -2.10 0.97 0.00 -0.88 7.94 0.22 -5.00 117.00 118.15 3ihm n LEU 44 Ca 0.11 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.15 3ihm n LEU 44 Cb 0.51 -1.12 0.00 0.00 0.53 0.00 0.00 43.42 43.35 3ihm n LEU 44 CO 0.46 -1.50 0.00 0.18 -1.11 0.00 0.00 177.39 175.42 3ihm n LEU 45 N 2.05 0.00 -4.64 -1.96 4.77 -1.26 -4.85 117.00 111.10 3ihm n LEU 45 Ca 0.17 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.73 3ihm n LEU 45 Cb 0.19 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.25 3ihm n LEU 45 CO 0.61 -0.22 1.68 -3.20 -1.33 0.00 0.00 177.39 174.93 3ihm n ASN 46 N -1.33 3.85 -1.45 -1.43 2.85 -1.26 -4.87 115.26 111.63 3ihm n ASN 46 Ca 0.00 0.70 -0.04 0.00 -0.11 0.00 0.00 54.58 55.13 3ihm n ASN 46 Cb 0.00 -1.52 0.17 0.00 1.24 0.00 0.00 39.78 39.66 3ihm n ASN 46 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 3ihm n THR 47 N 6.18 1.82 -2.44 -0.44 -2.24 -1.26 -4.61 114.28 111.29 3ihm n THR 47 Ca 0.23 -0.89 -0.36 0.00 -2.27 0.00 0.00 64.05 60.77 3ihm n THR 47 Cb 0.41 -0.53 -0.03 0.00 -2.10 0.00 0.00 70.33 68.09 3ihm n THR 47 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3ihm s VAL 48 N -1.89 3.53 0.34 2.28 0.11 -1.26 -5.04 120.40 118.47 3ihm s VAL 48 Ca 0.30 1.07 -0.03 0.00 -2.93 0.00 0.00 61.98 60.40 3ihm s VAL 48 Cb 0.24 -3.51 -0.04 0.00 -1.53 0.00 0.00 36.38 31.55 3ihm s VAL 48 CO 0.07 -0.09 0.58 0.00 -3.33 0.00 0.00 175.10 172.34 3ihm s ALA 49 N -1.73 3.63 -0.27 1.54 0.00 -1.26 -4.76 121.76 118.90 3ihm s ALA 49 Ca 0.64 -0.71 -0.09 0.00 0.00 0.00 0.00 51.96 51.80 3ihm s ALA 49 Cb -0.22 -2.25 -0.04 0.00 0.00 0.00 0.00 23.12 20.61 3ihm s ALA 49 CO 0.27 0.05 0.13 -1.01 0.00 0.00 0.00 175.76 175.21 3ihm s HIS 50 N -2.27 3.16 1.05 0.00 3.76 0.13 -4.64 115.29 116.47 3ihm s HIS 50 Ca 0.43 -0.17 -0.17 0.00 -0.15 0.00 0.00 55.06 54.99 3ihm s HIS 50 Cb -0.10 -2.32 0.24 0.00 1.11 0.00 0.00 32.58 31.51 3ihm s HIS 50 CO 0.35 -0.27 1.28 0.54 -0.85 0.00 0.00 174.74 175.79 3ihm s ASN 51 N 1.69 2.36 0.31 1.40 6.03 -1.26 -0.11 114.94 125.36 3ihm s ASN 51 Ca 0.07 0.30 0.02 0.00 -1.03 0.00 0.00 52.86 52.21 3ihm s ASN 51 Cb -0.16 -0.34 0.57 0.00 -3.03 0.00 0.00 41.25 38.30 3ihm s ASN 51 CO 0.07 -3.21 1.92 0.00 -2.03 0.00 0.00 177.10 173.86 3ihm h ALA 52 N -1.97 1.55 -0.09 3.54 0.00 -1.80 -1.64 119.26 118.86 3ihm h ALA 52 Ca -0.44 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.33 3ihm h ALA 52 Cb 1.24 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3ihm h ALA 52 CO 0.34 0.31 -0.46 -0.39 0.00 0.00 0.00 179.25 179.05 3ihm h VAL 53 N 0.98 1.33 -0.14 0.00 -1.51 -1.92 -1.44 116.25 113.55 3ihm h VAL 53 Ca 0.38 -1.63 -0.08 0.00 -1.23 0.00 0.00 66.70 64.14 3ihm h VAL 53 Cb 0.22 1.77 -0.00 0.00 -2.13 0.00 0.00 31.29 31.16 3ihm h VAL 53 CO -0.14 0.48 -0.21 0.74 -1.23 0.00 0.00 177.57 177.21 3ihm h THR 54 N 0.18 1.37 -0.09 7.19 2.02 -1.73 -2.58 112.91 119.26 3ihm h THR 54 Ca 0.01 -1.45 -0.05 0.00 0.77 0.00 0.00 66.41 65.69 3ihm h THR 54 Cb 0.88 1.99 -0.01 0.00 -1.74 0.00 0.00 68.15 69.27 3ihm h THR 54 CO 0.07 0.43 -0.19 -0.37 0.37 0.00 0.00 175.52 175.82 3ihm h VAL 55 N -0.02 1.18 -0.48 3.16 -1.51 -1.26 0.09 116.25 117.42 3ihm h VAL 55 Ca 0.01 -0.85 0.00 0.00 -1.23 0.00 0.00 66.70 64.64 3ihm h VAL 55 Cb 0.78 1.34 -0.02 0.00 -2.13 0.00 0.00 31.29 31.26 3ihm h VAL 55 CO 0.05 0.25 0.32 -0.61 -1.23 0.00 0.00 177.57 176.35 3ihm h GLN 56 N 0.13 0.63 -0.61 5.19 4.15 -1.22 0.17 115.11 123.56 3ihm h GLN 56 Ca 0.02 -0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.34 3ihm h GLN 56 Cb 0.42 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.95 3ihm h GLN 56 CO 0.03 0.42 0.10 0.00 -1.93 0.00 0.00 178.83 177.45 3ihm h ARG 57 N 0.65 0.98 -0.83 1.69 3.08 -0.96 -2.04 114.38 116.95 3ihm h ARG 57 Ca 0.18 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3ihm h ARG 57 Cb -0.07 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 29.81 3ihm h ARG 57 CO -0.04 0.90 0.46 0.93 -1.07 0.00 0.00 179.97 181.15 3ihm h GLU 58 N 0.92 1.15 -0.48 0.04 5.08 -0.45 -1.16 114.58 119.68 3ihm h GLU 58 Ca 0.19 -0.13 -0.05 0.00 -1.00 0.00 0.00 59.36 58.37 3ihm h GLU 58 Cb 0.39 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 3ihm h GLU 58 CO 0.01 0.84 0.12 0.28 -1.00 0.00 0.00 179.01 179.25 3ihm h VAL 59 N 1.15 1.24 0.00 3.13 2.07 -0.46 -0.34 116.25 123.03 3ihm h VAL 59 Ca 0.29 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.95 3ihm h VAL 59 Cb 0.02 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 3ihm h VAL 59 CO -0.05 0.30 -0.17 0.00 0.02 0.00 0.00 177.57 177.67 3ihm h ALA 60 N 0.98 1.47 -0.45 1.67 0.00 -1.13 -1.69 119.26 120.12 3ihm h ALA 60 Ca 0.15 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3ihm h ALA 60 Cb 0.33 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3ihm h ALA 60 CO 0.00 0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.74 3ihm n LEU 61 N -3.98 2.45 -3.91 0.00 4.77 -0.46 -4.95 117.00 110.92 3ihm n LEU 61 Ca -0.02 -1.21 -0.25 0.00 -0.03 0.00 0.00 56.01 54.50 3ihm n LEU 61 Cb 0.25 -0.30 -0.01 0.00 -2.33 0.00 0.00 43.42 41.04 3ihm n LEU 61 CO 0.33 0.61 -0.19 -0.67 -1.33 0.00 0.00 177.39 176.14 3ihm n ASP 62 N 0.84 -0.67 -0.66 -1.43 4.64 -0.64 -4.89 116.55 113.74 3ihm n ASP 62 Ca 0.16 -0.96 0.04 0.00 -1.38 0.00 0.00 54.79 52.64 3ihm n ASP 62 Cb 0.39 -3.28 0.06 0.00 -1.04 0.00 0.00 41.12 37.25 3ihm n ASP 62 CO 0.00 0.00 0.00 0.55 -0.82 0.00 0.00 177.20 176.93 3ihm n VAL 63 N -4.38 0.68 -1.69 5.18 3.14 -0.18 -4.94 118.33 116.15 3ihm n VAL 63 Ca -0.29 -1.13 -0.41 0.00 -2.96 0.00 0.00 64.34 59.55 3ihm n VAL 63 Cb 0.68 0.37 -0.01 0.00 -1.06 0.00 0.00 33.84 33.81 3ihm n VAL 63 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 3ihm n ASN 64 N -0.33 6.01 -0.19 6.55 5.15 -1.24 -4.71 115.26 126.50 3ihm n ASN 64 Ca 0.07 -2.81 -0.09 0.00 -0.60 0.00 0.00 54.58 51.15 3ihm n ASN 64 Cb 0.79 -1.58 0.04 0.00 -0.53 0.00 0.00 39.78 38.50 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 5.51 1.03 -4.52 1.20 4.57 -1.94 -3.39 114.58 117.05 3ihm h GLU 65 Ca 0.66 -0.34 -0.67 0.00 -1.18 0.00 0.00 59.36 57.83 3ihm h GLU 65 Cb 0.49 -0.09 -0.38 0.00 -0.16 0.00 0.00 28.75 28.61 3ihm h GLU 65 CO 1.79 1.03 -0.66 -1.58 -1.18 0.00 0.00 179.01 178.41 3ihm s TRP 66 N -4.95 3.67 0.43 0.92 0.51 -1.26 -5.10 118.94 113.16 3ihm s TRP 66 Ca -0.11 -2.85 -0.25 0.00 -2.12 0.00 0.00 56.10 50.77 3ihm s TRP 66 Cb 0.14 -3.01 -0.10 0.00 -0.81 0.00 0.00 33.47 29.68 3ihm s TRP 66 CO 0.86 -0.94 1.15 -2.30 -0.51 0.00 0.00 176.95 175.20 3ihm n PRO 67 N 4.26 1.63 0.29 4.98 -0.02 -1.26 -4.86 135.00 140.01 3ihm n PRO 67 Ca 0.02 0.58 0.14 0.00 -2.02 0.00 0.00 63.50 62.23 3ihm n PRO 67 Cb 0.41 -2.23 0.87 0.00 -0.02 0.00 0.00 33.50 32.53 3ihm n PRO 67 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3ihm h SER 68 N 1.79 0.00 -0.09 2.55 0.02 -1.95 -2.71 113.55 113.16 3ihm h SER 68 Ca -0.46 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.29 3ihm h SER 68 Cb 1.32 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.87 3ihm h SER 68 CO 0.58 0.03 -0.71 -0.33 -1.14 0.00 0.00 176.83 175.27 3ihm h GLU 69 N 0.00 0.63 0.00 3.45 3.07 -1.90 -0.94 114.58 118.90 3ihm h GLU 69 Ca -0.00 -0.57 -0.28 0.00 -0.50 0.00 0.00 59.36 58.02 3ihm h GLU 69 Cb 0.09 0.13 -0.05 0.00 -0.84 0.00 0.00 28.75 28.09 3ihm h GLU 69 CO 0.00 1.18 -1.66 1.49 -1.40 0.00 0.00 179.01 178.63 3ihm h GLU 70 N 0.28 0.00 0.00 2.33 4.81 -1.93 -3.41 114.58 116.67 3ihm h GLU 70 Ca -0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3ihm h GLU 70 Cb 1.36 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.74 3ihm h GLU 70 CO 0.14 0.49 -0.22 1.19 -0.73 0.00 0.00 179.01 179.88 3ihm n PHE 71 N -3.04 0.00 -2.69 0.92 3.72 -1.03 -5.07 117.46 110.27 3ihm n PHE 71 Ca -0.16 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.07 3ihm n PHE 71 Cb 1.03 -0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.65 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 1.25 1.06 3.42 1.37 0.00 -0.36 -4.53 105.19 107.41 3ihm n GLY 72 Ca 0.00 -2.07 -0.21 0.00 0.00 0.00 0.00 46.02 43.74 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 -2.25 1.95 0.00 1.61 1.13 0.59 -4.88 117.35 115.50 3ihm s TYR 73 Ca 0.51 -0.63 0.00 0.00 -1.41 0.00 0.00 57.07 55.54 3ihm s TYR 73 Cb -0.03 -1.05 0.00 0.00 -1.10 0.00 0.00 41.96 39.78 3ihm s TYR 73 CO 0.34 0.34 0.25 1.19 -2.51 0.00 0.00 175.55 175.16 3ihm n PHE 74 N -0.55 0.00 -3.64 -3.49 3.72 -0.27 -1.70 117.46 111.53 3ihm n PHE 74 Ca -0.06 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.33 3ihm n PHE 74 Cb 0.62 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.17 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 0.44 0.97 3.12 1.37 0.00 -1.26 -1.63 105.19 108.19 3ihm n GLY 75 Ca 0.00 -0.98 -0.29 0.00 0.00 0.00 0.00 46.02 44.75 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 -4.36 2.13 0.13 1.61 3.76 0.25 -1.96 115.29 116.86 3ihm s HIS 76 Ca 0.08 -0.92 -0.20 0.00 -0.15 0.00 0.00 55.06 53.87 3ihm s HIS 76 Cb -0.01 -1.48 -0.07 0.00 1.11 0.00 0.00 32.58 32.13 3ihm s HIS 76 CO 0.01 -0.42 0.65 0.71 -0.85 0.00 0.00 174.74 174.84 3ihm s TYR 77 N 0.66 3.78 -0.12 1.40 2.02 0.14 -1.12 117.35 124.11 3ihm s TYR 77 Ca -0.13 1.37 0.03 0.00 -0.37 0.00 0.00 57.07 57.96 3ihm s TYR 77 Cb -0.16 -2.58 0.01 0.00 -0.40 0.00 0.00 41.96 38.83 3ihm s TYR 77 CO 0.03 0.51 -0.21 0.71 -1.57 0.00 0.00 175.55 175.02 3ihm s TYR 78 N -1.24 2.48 -0.10 2.71 2.02 0.97 -0.37 117.35 123.82 3ihm s TYR 78 Ca 0.34 -1.14 0.03 0.00 -0.37 0.00 0.00 57.07 55.94 3ihm s TYR 78 Cb -0.19 -1.69 0.00 0.00 -0.40 0.00 0.00 41.96 39.68 3ihm s TYR 78 CO 0.21 -0.50 -0.21 -0.47 -1.57 0.00 0.00 175.55 173.01 3ihm s TYR 79 N 0.64 2.37 -0.18 2.71 5.04 0.20 -1.96 117.35 126.16 3ihm s TYR 79 Ca -0.12 -1.01 0.01 0.00 -2.44 0.00 0.00 57.07 53.51 3ihm s TYR 79 Cb -0.16 -1.61 0.03 0.00 0.35 0.00 0.00 41.96 40.57 3ihm s TYR 79 CO 0.03 -0.43 -0.14 0.08 -1.34 0.00 0.00 175.55 173.75 3ihm s VAL 80 N 0.50 1.75 1.11 3.14 1.01 -0.53 -0.08 120.40 127.30 3ihm s VAL 80 Ca -0.16 -0.93 -0.16 0.00 0.00 0.00 0.00 61.98 60.74 3ihm s VAL 80 Cb -0.17 -1.72 0.24 0.00 0.00 0.00 0.00 36.38 34.73 3ihm s VAL 80 CO 0.06 0.33 1.09 -0.83 0.00 0.00 0.00 175.10 175.75 3ihm s GLY 81 N 1.38 1.57 0.00 4.51 0.00 0.14 -1.31 107.32 113.60 3ihm s GLY 81 Ca 0.01 -0.63 0.00 0.00 0.00 0.00 0.00 44.72 44.10 3ihm s GLY 81 CO -0.10 0.12 0.00 0.61 0.00 0.00 0.00 173.10 173.73 3ihm n GLY 82 N -0.90 2.51 0.36 0.20 0.00 -1.26 -4.67 105.19 101.44 3ihm n GLY 82 Ca 0.09 -1.96 0.07 0.00 0.00 0.00 0.00 46.02 44.22 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 0.97 -4.66 1.61 0.11 -2.05 -3.19 132.00 124.79 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 -0.22 -0.36 0.00 0.11 0.00 0.00 31.00 30.53 3ihm h PRO 83 CO 0.00 0.64 -0.67 -1.14 -0.21 0.00 0.00 178.00 176.63 3ihm s GLN 84 N -5.96 1.96 0.60 1.05 2.00 -1.26 -5.12 119.66 112.93 3ihm s GLN 84 Ca -0.12 -1.66 -0.15 0.00 -2.00 0.00 0.00 55.36 51.43 3ihm s GLN 84 Cb 0.22 -3.30 -0.04 0.00 0.80 0.00 0.00 33.01 30.70 3ihm s GLN 84 CO 0.81 -0.87 1.04 -2.14 -0.50 0.00 0.00 175.29 173.63 3ihm s PRO 85 N 1.08 3.39 -0.22 1.67 0.02 -1.21 -4.96 135.00 134.78 3ihm s PRO 85 Ca 0.04 1.10 -0.10 0.00 0.02 0.00 0.00 61.00 62.07 3ihm s PRO 85 Cb -0.21 -2.05 -0.05 0.00 0.02 0.00 0.00 34.50 32.22 3ihm s PRO 85 CO -0.05 -0.75 0.12 -1.64 -0.33 0.00 0.00 177.00 174.36 3ihm s MET 86 N -4.26 4.07 -0.17 5.54 -1.94 -0.42 -4.96 119.30 117.14 3ihm s MET 86 Ca 0.62 -0.28 0.01 0.00 -1.71 0.00 0.00 55.69 54.32 3ihm s MET 86 Cb -0.14 -3.42 0.03 0.00 2.01 0.00 0.00 34.83 33.31 3ihm s MET 86 CO 0.39 0.17 -0.12 1.03 -0.01 0.00 0.00 175.02 176.48 3ihm s ARG 87 N 0.72 2.09 0.25 2.03 0.52 -1.26 -1.45 118.95 121.86 3ihm s ARG 87 Ca 0.07 -0.69 -0.10 0.00 -0.52 0.00 0.00 55.73 54.49 3ihm s ARG 87 Cb -0.13 -2.24 -0.01 0.00 0.52 0.00 0.00 34.95 33.10 3ihm s ARG 87 CO 0.02 -0.34 0.44 -0.59 0.02 0.00 0.00 175.30 174.84 3ihm s PHE 88 N 1.46 0.54 0.01 -0.53 -0.12 -0.83 -5.01 117.98 113.50 3ihm s PHE 88 Ca 0.02 -0.88 0.00 0.00 -0.05 0.00 0.00 56.93 56.02 3ihm s PHE 88 Cb -0.15 0.07 -0.01 0.00 -0.63 0.00 0.00 43.02 42.30 3ihm s PHE 88 CO -0.09 -0.97 -0.02 -0.47 -0.05 0.00 0.00 175.22 173.62 3ihm s TYR 89 N -3.90 0.18 -0.02 3.49 5.04 -1.26 -0.02 117.35 120.86 3ihm s TYR 89 Ca 0.25 -0.25 0.02 0.00 -2.44 0.00 0.00 57.07 54.66 3ihm s TYR 89 Cb 0.00 -0.12 0.00 0.00 0.35 0.00 0.00 41.96 42.19 3ihm s TYR 89 CO 0.11 -0.08 -0.08 0.20 -1.34 0.00 0.00 175.55 174.35 3ihm s GLY 90 N -0.70 0.47 0.40 8.97 0.00 -0.27 -4.63 107.32 111.56 3ihm s GLY 90 Ca -0.07 -0.29 -0.22 0.00 0.00 0.00 0.00 44.72 44.13 3ihm s GLY 90 CO -0.00 -0.08 0.96 0.99 0.00 0.00 0.00 173.10 174.97 3ihm s ASP 91 N 0.17 7.02 -0.06 1.64 1.01 -1.26 -0.58 116.67 124.60 3ihm s ASP 91 Ca -0.02 1.75 -0.13 0.00 0.71 0.00 0.00 52.55 54.86 3ihm s ASP 91 Cb -0.08 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.25 3ihm s ASP 91 CO 0.00 -0.30 0.33 -0.76 0.21 0.00 0.00 175.17 174.65 3ihm s LEU 92 N -2.87 4.40 0.17 1.23 1.43 -0.65 -3.81 118.68 118.59 3ihm s LEU 92 Ca 0.59 0.76 -0.12 0.00 -1.03 0.00 0.00 54.13 54.32 3ihm s LEU 92 Cb -0.12 -2.44 0.08 0.00 0.03 0.00 0.00 46.19 43.74 3ihm s LEU 92 CO 0.17 0.28 1.77 0.11 0.23 0.00 0.00 176.35 178.91 3ihm h LYS 93 N 5.26 0.85 -5.63 1.70 1.57 -1.91 -3.43 116.57 114.98 3ihm h LYS 93 Ca -0.50 -0.12 -0.48 0.00 -1.87 0.00 0.00 60.65 57.68 3ihm h LYS 93 Cb 1.21 -0.16 -0.23 0.00 0.08 0.00 0.00 32.23 33.13 3ihm h LYS 93 CO 0.64 0.67 -0.80 0.00 -0.57 0.00 0.00 179.45 179.39 3ihm s ALA 94 N -5.75 1.40 0.57 3.86 0.00 -1.26 -5.13 121.76 115.46 3ihm s ALA 94 Ca -0.13 -1.00 -0.20 0.00 0.00 0.00 0.00 51.96 50.63 3ihm s ALA 94 Cb 0.13 -0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 3ihm s ALA 94 CO 0.78 0.26 1.23 -2.14 0.00 0.00 0.00 175.76 175.90 3ihm s PRO 95 N -1.47 3.07 0.40 0.00 0.02 -1.26 -4.54 135.00 131.21 3ihm s PRO 95 Ca 0.03 1.91 0.08 0.00 0.02 0.00 0.00 61.00 63.03 3ihm s PRO 95 Cb -0.09 -2.04 0.01 0.00 0.02 0.00 0.00 34.50 32.40 3ihm s PRO 95 CO 0.02 -1.15 0.54 -1.12 -0.33 0.00 0.00 177.00 174.97 3ihm s SER 96 N -1.44 5.71 -0.14 2.53 0.01 -0.69 -3.64 113.70 116.05 3ihm s SER 96 Ca 0.75 -0.38 -0.09 0.00 1.31 0.00 0.00 55.95 57.55 3ihm s SER 96 Cb -0.32 -0.78 0.05 0.00 0.21 0.00 0.00 66.02 65.17 3ihm s SER 96 CO 0.36 -0.69 0.34 -0.60 0.41 0.00 0.00 173.24 173.06 3ihm s ARG 97 N -4.31 0.33 -0.19 12.44 3.52 0.84 -0.30 118.95 131.29 3ihm s ARG 97 Ca 0.53 0.61 0.01 0.00 -0.13 0.00 0.00 55.73 56.75 3ihm s ARG 97 Cb -0.10 0.00 0.02 0.00 -1.56 0.00 0.00 34.95 33.32 3ihm s ARG 97 CO 0.32 -0.13 -0.17 0.00 -0.81 0.00 0.00 175.30 174.51 3ihm s ALA 98 N 1.01 2.40 -0.09 6.12 0.00 -1.26 0.21 121.76 130.16 3ihm s ALA 98 Ca -0.07 -1.25 0.03 0.00 0.00 0.00 0.00 51.96 50.67 3ihm s ALA 98 Cb -0.07 -1.27 0.01 0.00 0.00 0.00 0.00 23.12 21.78 3ihm s ALA 98 CO -0.08 -0.42 -0.19 0.08 0.00 0.00 0.00 175.76 175.16 3ihm s VAL 99 N 1.30 1.68 -0.35 0.00 1.01 -1.26 -1.56 120.40 121.22 3ihm s VAL 99 Ca 0.04 -0.79 -0.44 0.00 0.00 0.00 0.00 61.98 60.80 3ihm s VAL 99 Cb -0.14 -1.48 -0.19 0.00 0.00 0.00 0.00 36.38 34.57 3ihm s VAL 99 CO -0.11 0.48 1.40 -0.67 0.00 0.00 0.00 175.10 176.20 3ihm n ASP 100 N 3.74 0.84 0.32 3.32 -0.08 0.72 -4.64 116.55 120.77 3ihm n ASP 100 Ca -0.20 1.14 0.20 0.00 -1.51 0.00 0.00 54.79 54.42 3ihm n ASP 100 Cb 0.52 -0.86 1.07 0.00 2.34 0.00 0.00 41.12 44.19 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 4.30 0.00 0.00 -0.67 -1.99 -1.90 0.61 116.97 117.32 3ihm h TYR 101 Ca -0.44 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.29 3ihm h TYR 101 Cb 1.34 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.07 3ihm h TYR 101 CO 0.61 0.01 0.00 0.54 -0.00 0.00 0.00 178.16 179.32 3ihm n ARG 102 N -3.20 0.06 -0.06 4.88 1.74 -1.26 -1.11 116.66 117.70 3ihm n ARG 102 Ca -0.02 0.11 -0.08 0.00 -0.77 0.00 0.00 57.85 57.08 3ihm n ARG 102 Cb 0.12 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 29.99 3ihm n ARG 102 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3ihm n LEU 103 N -1.46 2.04 -0.03 0.55 4.77 -0.18 -3.92 117.00 118.78 3ihm n LEU 103 Ca 0.06 -0.05 -0.15 0.00 -0.03 0.00 0.00 56.01 55.84 3ihm n LEU 103 Cb 0.25 -0.25 -0.10 0.00 -2.33 0.00 0.00 43.42 40.99 3ihm n LEU 103 CO 0.20 0.59 0.41 0.22 -1.33 0.00 0.00 177.39 177.48 3ihm h TYR 104 N 0.00 0.45 -0.16 -1.77 3.20 -0.86 -3.17 116.97 114.66 3ihm h TYR 104 Ca -0.31 -0.21 -0.01 0.00 3.14 0.00 0.00 58.73 61.35 3ihm h TYR 104 Cb 1.54 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.74 3ihm h TYR 104 CO 0.01 0.96 0.06 1.96 -1.64 0.00 0.00 178.16 179.51 3ihm h GLN 105 N -0.18 0.23 -0.40 1.82 1.08 -1.38 -2.46 115.11 113.83 3ihm h GLN 105 Ca -0.03 -0.04 0.02 0.00 -1.45 0.00 0.00 58.65 57.15 3ihm h GLN 105 Cb 1.01 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 28.38 3ihm h GLN 105 CO 0.07 0.32 0.26 -1.00 -0.95 0.00 0.00 178.83 177.53 3ihm h PRO 106 N 0.10 0.47 -0.57 1.46 0.13 -1.76 -0.91 132.00 130.92 3ihm h PRO 106 Ca 0.05 -0.03 0.01 0.00 -0.87 0.00 0.00 66.00 65.16 3ihm h PRO 106 Cb 0.17 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 31.16 3ihm h PRO 106 CO -0.00 0.31 0.38 1.98 -0.23 0.00 0.00 178.00 180.43 3ihm h MET 107 N 0.48 0.75 -0.64 0.86 1.85 -1.46 0.41 114.93 117.17 3ihm h MET 107 Ca 0.15 -0.04 -0.03 0.00 -0.61 0.00 0.00 59.70 59.17 3ihm h MET 107 Cb 0.02 -0.17 -0.03 0.00 0.43 0.00 0.00 31.60 31.86 3ihm h MET 107 CO -0.04 0.49 0.28 -0.07 -0.40 0.00 0.00 176.91 177.18 3ihm h LEU 108 N 0.77 0.86 -0.43 3.39 3.38 -0.93 -2.30 115.31 120.05 3ihm h LEU 108 Ca 0.21 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 3ihm h LEU 108 Cb -0.08 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 3ihm h LEU 108 CO -0.05 0.77 0.15 0.24 0.09 0.00 0.00 178.44 179.64 3ihm h MET 109 N 0.89 0.65 -0.50 1.13 2.86 -0.72 -0.71 114.93 118.52 3ihm h MET 109 Ca 0.22 -0.13 -0.07 0.00 -2.06 0.00 0.00 59.70 57.66 3ihm h MET 109 Cb 0.16 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 3ihm h MET 109 CO -0.02 0.62 0.04 0.00 1.06 0.00 0.00 176.91 178.62 3ihm h ARG 110 N 0.55 0.80 -0.26 1.72 2.47 -0.91 0.17 114.38 118.92 3ihm h ARG 110 Ca 0.14 -0.20 -0.05 0.00 -1.26 0.00 0.00 59.98 58.61 3ihm h ARG 110 Cb 0.23 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.44 3ihm h ARG 110 CO -0.01 0.78 -0.03 0.00 0.56 0.00 0.00 179.97 181.27 3ihm h ALA 111 N 1.29 0.35 -0.62 0.04 0.00 -1.18 -1.47 119.26 117.67 3ihm h ALA 111 Ca 0.16 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 3ihm h ALA 111 Cb 0.40 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3ihm h ALA 111 CO 0.01 0.12 0.04 1.25 0.00 0.00 0.00 179.25 180.67 3ihm h LEU 112 N 0.24 1.04 -0.14 0.00 5.85 -0.96 -2.32 115.31 119.03 3ihm h LEU 112 Ca 0.07 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.50 3ihm h LEU 112 Cb 0.47 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 3ihm h LEU 112 CO 0.02 1.08 0.09 -0.08 -0.34 0.00 0.00 178.44 179.21 3ihm h GLU 113 N 0.98 0.18 0.00 1.25 4.81 -0.94 0.17 114.58 121.02 3ihm h GLU 113 Ca 0.18 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 3ihm h GLU 113 Cb 0.52 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.86 3ihm h GLU 113 CO 0.02 0.13 0.00 0.00 -0.73 0.00 0.00 179.01 178.43 3ihm h ALA 114 N 1.04 1.00 -0.47 2.92 0.00 -1.14 -2.55 119.26 120.06 3ihm h ALA 114 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3ihm h ALA 114 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3ihm h ALA 114 CO -0.01 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.78 3ihm n ARG 115 N -2.35 3.79 -0.18 0.00 1.74 -0.88 -4.94 116.66 113.83 3ihm n ARG 115 Ca 0.01 -2.89 0.00 0.00 -0.77 0.00 0.00 57.85 54.19 3ihm n ARG 115 Cb 0.17 -1.94 0.00 0.00 -1.02 0.00 0.00 32.46 29.67 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 0.38 0.78 3.73 -0.13 0.00 -0.96 -4.95 105.19 104.05 3ihm n GLY 116 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.61 2.05 -0.06 -0.02 0.00 0.00 -4.76 107.32 102.93 3ihm s GLY 117 Ca 0.00 1.30 -0.04 0.00 0.00 0.00 0.00 44.72 45.97 3ihm s GLY 117 CO 0.00 2.38 0.14 0.54 0.00 0.00 0.00 173.10 176.16 3ihm s LYS 118 N 0.30 3.37 -0.13 2.90 1.02 -0.31 -4.14 119.74 122.75 3ihm s LYS 118 Ca 0.63 -0.26 0.02 0.00 0.02 0.00 0.00 55.97 56.38 3ihm s LYS 118 Cb -0.41 -3.09 -0.00 0.00 -0.52 0.00 0.00 37.83 33.80 3ihm s LYS 118 CO 0.37 0.72 -0.19 -0.06 -0.92 0.00 0.00 175.35 175.28 3ihm s PHE 119 N -1.16 2.70 -0.38 3.18 0.08 -1.26 -0.15 117.98 120.99 3ihm s PHE 119 Ca 0.21 -1.06 -0.08 0.00 0.12 0.00 0.00 56.93 56.12 3ihm s PHE 119 Cb -0.12 -1.82 0.05 0.00 -0.57 0.00 0.00 43.02 40.56 3ihm s PHE 119 CO 0.11 -0.45 0.19 0.00 -0.10 0.00 0.00 175.22 174.96 3ihm s TYR 121 N 1.44 2.65 -0.02 0.00 2.02 -1.25 -2.27 117.35 119.92 3ihm s TYR 121 Ca 0.01 -0.96 -0.23 0.00 -0.37 0.00 0.00 57.07 55.52 3ihm s TYR 121 Cb -0.21 -4.61 0.05 0.00 -0.40 0.00 0.00 41.96 36.79 3ihm s TYR 121 CO 0.03 -1.85 0.51 0.34 -1.57 0.00 0.00 175.55 173.01 3ihm s ASP 122 N 4.69 -0.44 -0.06 2.29 -1.08 0.14 -4.89 116.67 117.33 3ihm s ASP 122 Ca 0.43 0.36 -0.20 0.00 -0.52 0.00 0.00 52.55 52.62 3ihm s ASP 122 Cb -0.01 0.44 -0.04 0.00 -1.46 0.00 0.00 42.92 41.85 3ihm s ASP 122 CO -0.10 -0.57 0.58 0.00 0.52 0.00 0.00 175.17 175.59 3ihm s ALA 123 N -1.53 3.44 -0.24 3.66 0.00 -1.26 -3.75 121.76 122.09 3ihm s ALA 123 Ca -0.11 -0.03 -0.07 0.00 0.00 0.00 0.00 51.96 51.76 3ihm s ALA 123 Cb -0.02 -2.76 -0.03 0.00 0.00 0.00 0.00 23.12 20.31 3ihm s ALA 123 CO 0.05 0.04 0.07 0.08 0.00 0.00 0.00 175.76 176.00 3ihm s VAL 124 N 0.37 4.40 0.42 0.00 1.01 -1.26 -5.10 120.40 120.25 3ihm s VAL 124 Ca 0.31 -0.15 -0.02 0.00 0.00 0.00 0.00 61.98 62.13 3ihm s VAL 124 Cb -0.17 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 3ihm s VAL 124 CO 0.15 0.36 0.66 -0.44 0.00 0.00 0.00 175.10 175.83 3ihm s SER 125 N 1.38 6.14 0.40 3.32 0.01 -1.26 -4.83 113.70 118.86 3ihm s SER 125 Ca 0.05 0.57 0.11 0.00 1.31 0.00 0.00 55.95 57.99 3ihm s SER 125 Cb -0.15 -1.96 0.92 0.00 0.21 0.00 0.00 66.02 65.04 3ihm s SER 125 CO 0.04 -0.51 1.94 0.00 0.41 0.00 0.00 173.24 175.12 3ihm h ALA 126 N 0.47 1.92 0.00 1.44 0.00 -1.94 -1.29 119.26 119.86 3ihm h ALA 126 Ca -0.48 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 3ihm h ALA 126 Cb 1.22 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3ihm h ALA 126 CO 0.60 -0.08 -0.18 0.93 0.00 0.00 0.00 179.25 180.53 3ihm h GLU 127 N 0.55 0.00 0.00 0.00 3.07 -1.97 -2.89 114.58 113.33 3ihm h GLU 127 Ca 0.33 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.19 3ihm h GLU 127 Cb 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 3ihm h GLU 127 CO -0.11 0.18 0.00 -0.44 -1.40 0.00 0.00 179.01 177.24 3ihm h ASP 128 N 0.00 0.00 -0.91 1.42 3.32 -1.62 -3.37 116.42 115.26 3ihm h ASP 128 Ca -0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.07 3ihm h ASP 128 Cb 0.37 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.87 3ihm h ASP 128 CO 0.02 0.00 0.60 -0.07 -1.72 0.00 0.00 179.24 178.07 3ihm h LEU 129 N 0.00 1.01 -0.53 1.55 3.38 -1.57 -1.46 115.31 117.69 3ihm h LEU 129 Ca 0.00 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3ihm h LEU 129 Cb 0.82 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 3ihm h LEU 129 CO 0.00 0.71 0.23 -0.08 0.09 0.00 0.00 178.44 179.39 3ihm h GLU 130 N 1.19 0.78 -0.61 1.13 4.81 -1.79 -0.64 114.58 119.45 3ihm h GLU 130 Ca 0.35 -0.13 -0.06 0.00 -0.13 0.00 0.00 59.36 59.39 3ihm h GLU 130 Cb -0.06 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.16 3ihm h GLU 130 CO -0.10 0.67 0.13 0.78 -0.73 0.00 0.00 179.01 179.76 3ihm h GLY 131 N 0.71 1.07 1.52 1.92 0.00 -1.69 -3.07 103.07 103.52 3ihm h GLY 131 Ca 0.18 -0.69 -0.11 0.00 0.00 0.00 0.00 47.33 46.71 3ihm h GLY 131 CO -0.02 0.64 -0.28 1.41 0.00 0.00 0.00 176.54 178.28 3ihm h LEU 132 N 0.90 0.57 -1.76 3.11 3.38 -1.07 -2.94 115.31 117.49 3ihm h LEU 132 Ca 0.19 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3ihm h LEU 132 Cb 0.38 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 3ihm h LEU 132 CO 0.01 0.83 -0.16 0.77 0.09 0.00 0.00 178.44 179.97 3ihm h SER 133 N 0.48 0.00 0.52 -0.43 4.64 -1.03 -1.59 113.55 116.14 3ihm h SER 133 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3ihm h SER 133 Cb 0.74 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.83 3ihm h SER 133 CO 0.06 0.16 -0.23 -0.62 -0.87 0.00 0.00 176.83 175.32 3ihm n GLU 134 N -3.78 0.34 0.03 4.77 1.02 -1.12 -3.73 120.64 118.16 3ihm n GLU 134 Ca -0.02 -0.14 0.11 0.00 -0.02 0.00 0.00 57.16 57.09 3ihm n GLU 134 Cb 0.26 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.13 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 -1.21 0.46 -4.27 3.49 6.02 -0.61 -4.98 117.38 116.29 3ihm n GLN 135 Ca 0.10 -0.04 -0.15 0.00 -0.01 0.00 0.00 57.00 56.90 3ihm n GLN 135 Cb 0.32 -1.62 -0.10 0.00 1.02 0.00 0.00 30.24 29.86 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 -3.33 1.36 0.24 1.08 2.02 -1.14 -5.04 117.35 112.54 3ihm s TYR 136 Ca -0.01 -0.74 -0.04 0.00 -0.37 0.00 0.00 57.07 55.91 3ihm s TYR 136 Cb 0.13 -0.69 0.26 0.00 -0.40 0.00 0.00 41.96 41.26 3ihm s TYR 136 CO 0.84 0.12 1.72 -0.44 -1.57 0.00 0.00 175.55 176.21 3ihm h ASP 137 N 2.72 0.83 -3.64 2.29 3.32 -1.46 -3.44 116.42 117.03 3ihm h ASP 137 Ca -0.37 -0.22 -0.20 0.00 0.02 0.00 0.00 57.03 56.26 3ihm h ASP 137 Cb 1.20 -0.22 -0.28 0.00 0.22 0.00 0.00 39.33 40.25 3ihm h ASP 137 CO 0.63 0.91 -0.53 -0.22 -1.72 0.00 0.00 179.24 178.31 3ihm s LEU 138 N -9.16 1.07 -0.18 1.55 2.96 -1.22 -4.82 118.68 108.87 3ihm s LEU 138 Ca -0.10 0.36 -0.04 0.00 -0.22 0.00 0.00 54.13 54.13 3ihm s LEU 138 Cb 0.14 0.55 -0.02 0.00 0.50 0.00 0.00 46.19 47.36 3ihm s LEU 138 CO 0.82 -0.10 -0.02 -0.22 -1.32 0.00 0.00 176.35 175.51 3ihm s LEU 139 N 0.52 3.21 -0.09 -0.68 2.96 -1.26 -1.49 118.68 121.85 3ihm s LEU 139 Ca -0.04 -0.18 0.04 0.00 -0.22 0.00 0.00 54.13 53.73 3ihm s LEU 139 Cb -0.05 -1.79 -0.00 0.00 0.50 0.00 0.00 46.19 44.84 3ihm s LEU 139 CO -0.03 0.11 -0.24 0.54 -1.32 0.00 0.00 176.35 175.42 3ihm s VAL 140 N 0.71 2.12 -0.11 1.68 0.11 0.10 -1.92 120.40 123.08 3ihm s VAL 140 Ca -0.01 -1.01 -0.02 0.00 -2.93 0.00 0.00 61.98 58.01 3ihm s VAL 140 Cb -0.14 -1.80 -0.03 0.00 -1.53 0.00 0.00 36.38 32.88 3ihm s VAL 140 CO 0.02 0.56 -0.05 -0.69 -3.33 0.00 0.00 175.10 171.62 3ihm s VAL 141 N 0.21 3.85 0.00 2.04 1.01 -0.04 0.47 120.40 127.94 3ihm s VAL 141 Ca -0.15 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 61.43 3ihm s VAL 141 Cb -0.17 -2.63 0.00 0.00 0.00 0.00 0.00 36.38 33.58 3ihm s VAL 141 CO 0.07 0.55 0.03 0.00 0.00 0.00 0.00 175.10 175.76 3ihm s THR 143 N -0.05 4.92 -2.08 0.00 -1.32 -1.19 -3.95 115.64 111.97 3ihm s THR 143 Ca 0.00 1.05 0.13 0.00 -1.21 0.00 0.00 61.69 61.66 3ihm s THR 143 Cb 0.00 -3.82 0.34 0.00 -1.51 0.00 0.00 72.50 67.50 3ihm s THR 143 CO 0.00 0.52 1.34 0.61 -2.21 0.00 0.00 174.62 174.88 3ihm n GLY 144 N 2.02 0.34 3.94 6.08 0.00 -1.26 -4.70 105.19 111.61 3ihm n GLY 144 Ca -0.11 -0.35 -0.24 0.00 0.00 0.00 0.00 46.02 45.32 3ihm n GLY 144 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ihm s LYS 145 N -1.66 2.69 -1.60 1.61 1.02 -1.26 -4.45 119.74 116.09 3ihm s LYS 145 Ca 0.24 -0.35 0.00 0.00 0.02 0.00 0.00 55.97 55.89 3ihm s LYS 145 Cb 0.13 -2.36 0.00 0.00 -0.52 0.00 0.00 37.83 35.08 3ihm s LYS 145 CO 0.18 -0.74 0.00 0.66 -0.92 0.00 0.00 175.35 174.52 3ihm n TYR 146 N -2.50 -0.31 -2.00 3.18 4.01 -1.26 -2.77 117.16 115.50 3ihm n TYR 146 Ca 0.06 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.63 3ihm n TYR 146 Cb 0.59 -3.03 -0.04 0.00 -0.31 0.00 0.00 39.34 36.55 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 0.06 -0.50 0.34 -0.72 0.00 -1.26 -4.48 120.51 113.94 3ihm n ALA 147 Ca -0.18 0.19 0.14 0.00 0.00 0.00 0.00 53.44 53.60 3ihm n ALA 147 Cb 0.58 -1.77 0.61 0.00 0.00 0.00 0.00 19.45 18.87 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 0.00 0.00 -1.71 0.00 3.38 -1.79 -2.54 115.31 112.66 3ihm h LEU 148 Ca -0.37 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 3ihm h LEU 148 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 3ihm h LEU 148 CO 0.48 0.00 -0.18 1.23 0.09 0.00 0.00 178.44 180.06 3ihm h GLY 149 N 1.93 0.00 2.00 0.83 0.00 -1.84 -2.86 103.07 103.13 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 -0.02 0.50 0.00 0.00 0.00 176.54 177.02 3ihm h LYS 150 N 0.00 0.00 -0.03 4.80 1.57 -1.85 -1.60 116.57 119.45 3ihm h LYS 150 Ca -0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 3ihm h LYS 150 Cb 0.36 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 3ihm h LYS 150 CO 0.02 0.02 -0.63 0.28 -0.57 0.00 0.00 179.45 178.58 3ihm h VAL 151 N 0.00 1.42 -3.57 0.50 2.07 -1.70 -3.42 116.25 111.55 3ihm h VAL 151 Ca -0.00 -2.09 -0.68 0.00 0.82 0.00 0.00 66.70 64.75 3ihm h VAL 151 Cb 0.27 2.10 -0.18 0.00 -1.52 0.00 0.00 31.29 31.96 3ihm h VAL 151 CO 0.00 0.61 -0.22 -0.36 0.02 0.00 0.00 177.57 177.62 3ihm s PHE 152 N -3.66 3.18 0.12 1.57 0.08 -0.60 -4.85 117.98 113.82 3ihm s PHE 152 Ca -0.03 -0.25 -0.34 0.00 0.12 0.00 0.00 56.93 56.43 3ihm s PHE 152 Cb 0.12 -2.83 -0.13 0.00 -0.57 0.00 0.00 43.02 39.61 3ihm s PHE 152 CO 0.78 -0.62 1.65 -1.91 -0.10 0.00 0.00 175.22 175.03 3ihm n GLU 153 N 5.55 2.23 -2.14 0.44 2.13 -1.26 -4.59 120.64 122.99 3ihm n GLU 153 Ca -0.08 0.81 -0.42 0.00 0.66 0.00 0.00 57.16 58.13 3ihm n GLU 153 Cb 0.48 -2.60 -0.03 0.00 0.27 0.00 0.00 31.44 29.56 3ihm n GLU 153 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 3ihm s LYS 154 N 1.60 4.33 -0.53 5.31 2.20 -1.26 -0.91 119.74 130.47 3ihm s LYS 154 Ca 0.81 2.13 -0.20 0.00 -0.36 0.00 0.00 55.97 58.36 3ihm s LYS 154 Cb -0.66 -3.19 0.06 0.00 -1.51 0.00 0.00 37.83 32.53 3ihm s LYS 154 CO 0.40 -0.38 0.68 -0.65 -0.36 0.00 0.00 175.35 175.04 3ihm s GLN 155 N 0.37 3.13 0.32 4.03 -0.21 0.12 -4.89 119.66 122.54 3ihm s GLN 155 Ca 0.61 -0.88 0.03 0.00 0.02 0.00 0.00 55.36 55.15 3ihm s GLN 155 Cb -0.38 -4.12 0.56 0.00 1.00 0.00 0.00 33.01 30.07 3ihm s GLN 155 CO 0.36 -1.31 1.86 0.66 -2.12 0.00 0.00 175.29 174.74 3ihm h SER 156 N 9.07 0.54 0.72 5.90 4.64 -1.87 -1.83 113.55 130.72 3ihm h SER 156 Ca -0.28 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3ihm h SER 156 Cb 1.09 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 3ihm h SER 156 CO 1.00 0.60 0.00 1.05 -0.87 0.00 0.00 176.83 178.62 3ihm h GLU 157 N 0.55 0.00 -0.10 4.77 9.09 -1.95 -2.47 114.58 124.48 3ihm h GLU 157 Ca 0.12 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.53 3ihm h GLU 157 Cb 0.33 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.43 3ihm h GLU 157 CO 0.01 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.16 3ihm n ASN 158 N -2.61 2.00 -3.78 3.06 5.03 -0.91 -4.83 115.26 113.22 3ihm n ASN 158 Ca 0.01 -1.58 -0.28 0.00 0.87 0.00 0.00 54.58 53.59 3ihm n ASN 158 Cb 0.23 -0.06 -0.12 0.00 -1.02 0.00 0.00 39.78 38.81 3ihm n ASN 158 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 3ihm s SER 159 N -0.76 3.97 0.47 6.41 0.01 -0.74 -4.39 113.70 118.67 3ihm s SER 159 Ca 0.11 -3.56 0.27 0.00 1.31 0.00 0.00 55.95 54.08 3ihm s SER 159 Cb 0.07 -1.33 0.88 0.00 0.21 0.00 0.00 66.02 65.85 3ihm s SER 159 CO 0.09 -0.12 1.80 1.55 0.41 0.00 0.00 173.24 176.98 3ihm h PRO 160 N 5.59 0.00 -6.11 12.44 0.13 -1.88 -3.45 132.00 138.72 3ihm h PRO 160 Ca 0.15 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.61 3ihm h PRO 160 Cb 0.81 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.80 3ihm h PRO 160 CO 0.62 0.10 -0.63 -0.06 -0.23 0.00 0.00 178.00 177.80 3ihm s PHE 161 N -3.49 3.12 0.00 1.56 0.08 -1.26 -5.01 117.98 112.98 3ihm s PHE 161 Ca 0.03 0.11 0.00 0.00 0.12 0.00 0.00 56.93 57.19 3ihm s PHE 161 Cb 0.08 -1.69 0.00 0.00 -0.57 0.00 0.00 43.02 40.84 3ihm s PHE 161 CO 0.62 0.48 0.35 -0.85 -0.10 0.00 0.00 175.22 175.72 3ihm n GLU 162 N 1.46 0.76 -4.22 0.44 0.28 -1.26 -4.71 120.64 113.39 3ihm n GLU 162 Ca -0.15 -0.35 -0.13 0.00 -0.16 0.00 0.00 57.16 56.37 3ihm n GLU 162 Cb 0.53 -0.84 -0.10 0.00 1.43 0.00 0.00 31.44 32.45 3ihm n GLU 162 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 3ihm s LYS 163 N -0.21 1.03 0.24 3.44 0.00 -1.26 -5.02 119.74 117.96 3ihm s LYS 163 Ca 0.00 -1.48 -0.31 0.00 0.00 0.00 0.00 55.97 54.18 3ihm s LYS 163 Cb 0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 37.83 37.45 3ihm s LYS 163 CO 0.00 -0.09 1.65 -2.30 0.00 0.00 0.00 175.35 174.61 3ihm n PRO 164 N -0.19 2.70 0.02 1.78 -0.02 -1.26 -4.71 135.00 133.33 3ihm n PRO 164 Ca -0.08 0.97 0.13 0.00 -2.02 0.00 0.00 63.50 62.50 3ihm n PRO 164 Cb 0.62 -2.78 0.43 0.00 -0.02 0.00 0.00 33.50 31.76 3ihm n PRO 164 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3ihm n GLN 165 N 3.11 0.07 -3.80 -0.52 1.13 -1.26 -4.85 117.38 111.26 3ihm n GLN 165 Ca 0.13 0.04 -0.13 0.00 -1.94 0.00 0.00 57.00 55.10 3ihm n GLN 165 Cb 0.35 -1.56 -0.12 0.00 0.11 0.00 0.00 30.24 29.02 3ihm n GLN 165 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 3ihm s ARG 166 N -3.03 0.29 -0.36 -1.09 6.06 -1.26 -4.63 118.95 114.93 3ihm s ARG 166 Ca 0.12 0.28 -0.24 0.00 -2.50 0.00 0.00 55.73 53.39 3ihm s ARG 166 Cb 0.17 0.14 0.01 0.00 0.06 0.00 0.00 34.95 35.33 3ihm s ARG 166 CO 0.61 -0.04 0.83 0.00 -2.50 0.00 0.00 175.30 174.20 3ihm s ALA 167 N 0.02 3.43 -0.05 6.12 0.00 0.18 -4.50 121.76 126.97 3ihm s ALA 167 Ca -0.01 -0.57 -0.14 0.00 0.00 0.00 0.00 51.96 51.23 3ihm s ALA 167 Cb -0.02 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 3ihm s ALA 167 CO 0.00 -1.49 0.38 -0.51 0.00 0.00 0.00 175.76 174.14 3ihm s LEU 168 N 3.19 4.41 -0.20 0.00 1.43 0.80 -1.58 118.68 126.73 3ihm s LEU 168 Ca 0.33 0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 54.25 3ihm s LEU 168 Cb -0.13 -2.53 0.06 0.00 0.03 0.00 0.00 46.19 43.62 3ihm s LEU 168 CO 0.17 0.26 0.03 0.00 0.23 0.00 0.00 176.35 177.04 3ihm s VAL 170 N 1.81 1.40 0.11 0.00 0.11 -0.01 -0.81 120.40 123.02 3ihm s VAL 170 Ca -0.01 -0.67 -0.18 0.00 -2.93 0.00 0.00 61.98 58.19 3ihm s VAL 170 Cb -0.17 -1.23 0.04 0.00 -1.53 0.00 0.00 36.38 33.49 3ihm s VAL 170 CO -0.09 0.41 0.44 -0.83 -3.33 0.00 0.00 175.10 171.71 3ihm s GLY 171 N 0.28 -0.34 -0.20 6.54 0.00 -1.03 -0.07 107.32 112.50 3ihm s GLY 171 Ca -0.09 0.14 -0.12 0.00 0.00 0.00 0.00 44.72 44.64 3ihm s GLY 171 CO 0.04 -0.14 0.23 1.08 0.00 0.00 0.00 173.10 174.30 3ihm s LEU 172 N -2.63 4.19 0.04 0.66 1.43 -0.70 -1.00 118.68 120.66 3ihm s LEU 172 Ca 0.01 0.32 0.07 0.00 -1.03 0.00 0.00 54.13 53.50 3ihm s LEU 172 Cb 0.01 -2.24 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 3ihm s LEU 172 CO -0.10 0.09 -0.19 -0.36 0.23 0.00 0.00 176.35 176.01 3ihm s PHE 173 N 0.72 1.69 0.32 0.29 0.08 0.15 -0.48 117.98 120.75 3ihm s PHE 173 Ca 0.12 -0.37 0.07 0.00 0.12 0.00 0.00 56.93 56.87 3ihm s PHE 173 Cb -0.13 -1.01 -0.02 0.00 -0.57 0.00 0.00 43.02 41.30 3ihm s PHE 173 CO 0.03 0.08 0.40 -1.59 -0.10 0.00 0.00 175.22 174.03 3ihm s LYS 174 N -1.16 3.05 0.00 0.44 -2.85 -0.49 -1.72 119.74 117.01 3ihm s LYS 174 Ca 0.06 -1.06 0.00 0.00 -1.00 0.00 0.00 55.97 53.98 3ihm s LYS 174 Cb -0.09 -2.73 0.00 0.00 -2.06 0.00 0.00 37.83 32.96 3ihm s LYS 174 CO 0.02 0.13 0.00 0.41 0.10 0.00 0.00 175.35 176.01 3ihm n GLY 175 N -1.52 0.69 3.39 0.59 0.00 -1.26 -3.22 105.19 103.85 3ihm n GLY 175 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.03 4.39 0.44 -0.61 1.01 -1.26 -0.44 121.20 122.70 3ihm s ILE 176 Ca 0.00 -0.64 -0.24 0.00 0.00 0.00 0.00 60.65 59.76 3ihm s ILE 176 Cb 0.00 -3.32 -0.08 0.00 0.01 0.00 0.00 42.46 39.08 3ihm s ILE 176 CO 0.00 -0.02 1.25 -0.75 0.00 0.00 0.00 174.94 175.42 3ihm s LYS 177 N 1.56 3.81 0.46 2.79 2.20 0.84 -4.90 119.74 126.51 3ihm s LYS 177 Ca 0.03 2.02 -0.22 0.00 -0.36 0.00 0.00 55.97 57.44 3ihm s LYS 177 Cb -0.18 -2.58 -0.08 0.00 -1.51 0.00 0.00 37.83 33.48 3ihm s LYS 177 CO 0.05 -0.58 1.10 -1.21 -0.36 0.00 0.00 175.35 174.35 3ihm s GLU 178 N -2.46 3.81 1.01 4.03 2.02 -1.26 -4.86 118.70 120.98 3ihm s GLU 178 Ca 0.61 1.59 -0.12 0.00 0.02 0.00 0.00 54.97 57.06 3ihm s GLU 178 Cb -0.35 -2.31 0.19 0.00 0.10 0.00 0.00 34.13 31.77 3ihm s GLU 178 CO 0.43 -0.47 1.08 0.00 0.02 0.00 0.00 175.26 176.33 3ihm s ALA 179 N -1.71 0.78 0.31 5.21 0.00 -1.26 -4.92 121.76 120.17 3ihm s ALA 179 Ca 0.64 -0.16 0.08 0.00 0.00 0.00 0.00 51.96 52.52 3ihm s ALA 179 Cb -0.23 -3.19 0.86 0.00 0.00 0.00 0.00 23.12 20.56 3ihm s ALA 179 CO 0.28 -2.96 1.69 -1.35 0.00 0.00 0.00 175.76 173.42 3ihm h PRO 180 N -1.99 0.38 -5.53 0.00 0.11 -2.01 -3.36 132.00 119.61 3ihm h PRO 180 Ca -0.54 -0.02 -0.65 0.00 0.11 0.00 0.00 66.00 64.89 3ihm h PRO 180 Cb 1.31 -0.09 -0.21 0.00 0.11 0.00 0.00 31.00 32.13 3ihm h PRO 180 CO 0.54 0.25 -0.67 0.42 -0.21 0.00 0.00 178.00 178.33 3ihm s ILE 181 N -5.81 3.88 -0.27 4.15 1.01 -1.26 -5.06 121.20 117.84 3ihm s ILE 181 Ca -0.11 -0.38 -0.29 0.00 0.00 0.00 0.00 60.65 59.88 3ihm s ILE 181 Cb 0.27 -2.67 -0.06 0.00 0.01 0.00 0.00 42.46 40.01 3ihm s ILE 181 CO 0.78 0.53 2.25 -1.14 0.00 0.00 0.00 174.94 177.36 3ihm n ARG 182 N 3.14 1.74 -3.49 2.79 3.00 -1.26 -4.89 116.66 117.69 3ihm n ARG 182 Ca -0.18 0.44 -0.13 0.00 -0.00 0.00 0.00 57.85 57.98 3ihm n ARG 182 Cb 0.53 -3.16 -0.04 0.00 0.00 0.00 0.00 32.46 29.79 3ihm n ARG 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3ihm s ALA 183 N 8.67 -1.51 0.33 5.13 0.00 -1.26 -1.11 121.76 132.00 3ihm s ALA 183 Ca 1.02 0.62 -0.27 0.00 0.00 0.00 0.00 51.96 53.32 3ihm s ALA 183 Cb -0.38 0.60 -0.09 0.00 0.00 0.00 0.00 23.12 23.24 3ihm s ALA 183 CO 0.36 -0.63 1.08 0.08 0.00 0.00 0.00 175.76 176.65 3ihm s VAL 184 N -3.01 3.56 -0.16 0.00 1.01 -0.83 -4.49 120.40 116.49 3ihm s VAL 184 Ca -0.02 1.42 -0.02 0.00 0.00 0.00 0.00 61.98 63.36 3ihm s VAL 184 Cb -0.00 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 3ihm s VAL 184 CO -0.06 0.23 -0.10 -0.89 0.00 0.00 0.00 175.10 174.28 3ihm s THR 185 N -1.34 3.22 -0.36 3.92 2.01 -0.38 0.24 115.64 122.94 3ihm s THR 185 Ca 0.50 -0.58 -0.08 0.00 0.31 0.00 0.00 61.69 61.83 3ihm s THR 185 Cb -0.28 -2.39 0.04 0.00 0.01 0.00 0.00 72.50 69.88 3ihm s THR 185 CO 0.36 0.49 0.15 -0.04 -0.69 0.00 0.00 174.62 174.90 3ihm s MET 186 N 0.69 2.65 -0.13 4.92 -1.94 0.50 -0.37 119.30 125.62 3ihm s MET 186 Ca -0.05 -1.20 -0.02 0.00 -1.71 0.00 0.00 55.69 52.71 3ihm s MET 186 Cb -0.15 -3.57 -0.02 0.00 2.01 0.00 0.00 34.83 33.10 3ihm s MET 186 CO 0.02 -0.72 -0.07 0.45 -0.01 0.00 0.00 175.02 174.69 3ihm s SER 187 N 1.54 4.53 -0.15 3.03 0.15 0.99 -0.63 113.70 123.15 3ihm s SER 187 Ca -0.00 -0.17 0.01 0.00 0.70 0.00 0.00 55.95 56.49 3ihm s SER 187 Cb -0.20 -1.60 0.02 0.00 -1.71 0.00 0.00 66.02 62.53 3ihm s SER 187 CO 0.04 0.21 -0.16 0.12 1.20 0.00 0.00 173.24 174.65 3ihm s PHE 188 N 0.12 2.29 -0.42 3.44 5.99 0.89 0.61 117.98 130.90 3ihm s PHE 188 Ca -0.03 -1.28 -0.14 0.00 0.00 0.00 0.00 56.93 55.48 3ihm s PHE 188 Cb -0.14 -1.65 0.04 0.00 0.00 0.00 0.00 43.02 41.27 3ihm s PHE 188 CO 0.03 -0.68 0.31 0.45 -0.00 0.00 0.00 175.22 175.33 3ihm s SER 189 N 1.38 6.01 -0.22 6.13 0.15 0.64 0.23 113.70 128.02 3ihm s SER 189 Ca 0.03 -1.09 -0.36 0.00 0.70 0.00 0.00 55.95 55.24 3ihm s SER 189 Cb -0.13 -2.13 -0.12 0.00 -1.71 0.00 0.00 66.02 61.93 3ihm s SER 189 CO -0.10 -0.50 1.97 -2.65 1.20 0.00 0.00 173.24 173.16 3ihm n PRO 190 N 5.12 1.58 -1.00 5.44 -0.02 -1.26 -1.00 135.00 143.85 3ihm n PRO 190 Ca -0.11 0.54 -0.00 0.00 -2.02 0.00 0.00 63.50 61.90 3ihm n PRO 190 Cb 0.45 -2.49 -0.00 0.00 -0.02 0.00 0.00 33.50 31.44 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 5.11 0.44 0.37 -1.23 0.00 -1.26 -4.84 105.19 103.78 3ihm n GLY 191 Ca 0.30 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.28 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 -2.88 0.00 0.00 1.61 8.25 -0.17 -4.81 115.22 117.22 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 0.06 0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.23 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 2.45 1.81 3.60 -1.41 0.00 -0.71 -0.72 105.19 110.22 3ihm n GLY 193 Ca 0.00 -0.88 -0.31 0.00 0.00 0.00 0.00 46.02 44.82 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 2.47 -0.09 1.61 8.01 0.37 -0.26 118.70 128.80 3ihm s GLU 194 Ca 0.00 -0.79 0.03 0.00 0.01 0.00 0.00 54.97 54.21 3ihm s GLU 194 Cb 0.00 -2.47 0.01 0.00 -4.31 0.00 0.00 34.13 27.36 3ihm s GLU 194 CO 0.00 0.58 -0.17 -1.17 0.01 0.00 0.00 175.26 174.50 3ihm s LEU 195 N -1.67 1.83 -0.31 1.80 0.20 0.20 0.01 118.68 120.74 3ihm s LEU 195 Ca 0.19 -0.43 -0.02 0.00 0.69 0.00 0.00 54.13 54.55 3ihm s LEU 195 Cb -0.11 -1.11 0.05 0.00 -0.43 0.00 0.00 46.19 44.59 3ihm s LEU 195 CO 0.10 0.07 0.02 -0.63 -0.29 0.00 0.00 176.35 175.62 3ihm s ILE 196 N 0.67 3.08 -0.27 6.68 1.09 -0.46 -0.01 121.20 131.98 3ihm s ILE 196 Ca -0.13 -1.41 -0.16 0.00 -1.10 0.00 0.00 60.65 57.85 3ihm s ILE 196 Cb -0.16 -2.80 -0.03 0.00 -1.06 0.00 0.00 42.46 38.41 3ihm s ILE 196 CO 0.04 -0.15 0.43 -0.70 -0.10 0.00 0.00 174.94 174.45 3ihm s GLU 197 N 1.26 4.01 -0.14 2.79 2.12 0.50 -1.06 118.70 128.19 3ihm s GLU 197 Ca -0.04 0.13 0.02 0.00 0.36 0.00 0.00 54.97 55.44 3ihm s GLU 197 Cb -0.20 -3.66 0.01 0.00 0.26 0.00 0.00 34.13 30.53 3ihm s GLU 197 CO -0.01 -0.32 -0.21 0.42 -0.54 0.00 0.00 175.26 174.60 3ihm s ILE 198 N 2.17 2.20 -0.08 -3.70 -1.09 -0.22 -1.25 121.20 119.24 3ihm s ILE 198 Ca 0.17 -0.94 -0.30 0.00 -2.23 0.00 0.00 60.65 57.36 3ihm s ILE 198 Cb -0.16 -1.88 -0.05 0.00 -1.58 0.00 0.00 42.46 38.79 3ihm s ILE 198 CO 0.10 0.54 1.56 -2.84 -1.23 0.00 0.00 174.94 173.07 3ihm s PRO 199 N 0.72 4.20 -0.03 2.79 0.02 -1.26 -0.17 135.00 141.26 3ihm s PRO 199 Ca -0.09 2.06 0.01 0.00 0.02 0.00 0.00 61.00 63.01 3ihm s PRO 199 Cb -0.16 -3.92 0.01 0.00 0.02 0.00 0.00 34.50 30.46 3ihm s PRO 199 CO 0.01 -0.80 -0.05 0.95 -0.33 0.00 0.00 177.00 176.78 3ihm s THR 200 N 3.84 0.49 -0.10 0.99 -4.23 0.50 -4.21 115.64 112.92 3ihm s THR 200 Ca 0.69 -0.15 -0.30 0.00 -1.18 0.00 0.00 61.69 60.75 3ihm s THR 200 Cb -0.31 -0.49 -0.02 0.00 1.34 0.00 0.00 72.50 73.03 3ihm s THR 200 CO 0.26 0.19 1.11 -0.22 -0.54 0.00 0.00 174.62 175.42 3ihm s LEU 201 N 0.59 4.24 0.00 4.79 2.96 -0.60 0.60 118.68 131.25 3ihm s LEU 201 Ca -0.07 1.64 0.00 0.00 -0.22 0.00 0.00 54.13 55.48 3ihm s LEU 201 Cb -0.11 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.03 3ihm s LEU 201 CO -0.00 -0.55 0.00 -0.24 -1.32 0.00 0.00 176.35 174.24 3ihm n SER 202 N 5.36 0.94 -0.27 3.68 2.88 0.26 -0.20 113.62 126.29 3ihm n SER 202 Ca 0.10 -0.98 0.06 0.00 -1.33 0.00 0.00 58.87 56.72 3ihm n SER 202 Cb 0.47 0.00 0.20 0.00 -0.75 0.00 0.00 64.21 64.13 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 0.98 0.60 -0.40 0.66 0.04 -1.97 -0.96 116.94 115.89 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 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.00 3ihm h PHE 203 CO 0.00 0.11 0.00 0.09 -0.60 0.00 0.00 178.31 177.91 3ihm n ASN 204 N -4.95 3.54 0.00 2.17 3.02 -1.26 -5.04 115.26 112.74 3ihm n ASN 204 Ca 0.15 -2.40 0.00 0.00 -0.03 0.00 0.00 54.58 52.30 3ihm n ASN 204 Cb 0.42 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 39.06 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 0.67 -0.47 3.69 7.41 0.00 -0.36 -4.97 105.19 111.16 3ihm n GLY 205 Ca 0.17 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.87 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 4.24 0.32 1.61 -1.94 -1.26 -0.57 119.30 121.70 3ihm s MET 206 Ca 0.00 2.14 0.03 0.00 -1.71 0.00 0.00 55.69 56.14 3ihm s MET 206 Cb 0.00 -3.61 -0.01 0.00 2.01 0.00 0.00 34.83 33.22 3ihm s MET 206 CO 0.00 -0.66 0.10 -1.13 -0.01 0.00 0.00 175.02 173.32 3ihm n SER 207 N 5.59 1.39 -3.99 3.03 3.41 0.20 -4.91 113.62 118.34 3ihm n SER 207 Ca 0.15 -2.68 -0.28 0.00 -0.26 0.00 0.00 58.87 55.79 3ihm n SER 207 Cb 0.42 0.74 -0.17 0.00 -0.26 0.00 0.00 64.21 64.94 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 -2.69 1.32 0.11 6.66 -4.23 -0.70 -0.37 115.64 115.73 3ihm s THR 208 Ca 0.14 -0.50 -0.28 0.00 -1.18 0.00 0.00 61.69 59.87 3ihm s THR 208 Cb 0.01 -1.26 -0.06 0.00 1.34 0.00 0.00 72.50 72.53 3ihm s THR 208 CO 0.10 0.41 0.88 0.00 -0.54 0.00 0.00 174.62 175.47 3ihm s ALA 209 N 1.38 3.32 -0.32 3.99 0.00 0.76 -0.68 121.76 130.21 3ihm s ALA 209 Ca 0.01 0.47 -0.01 0.00 0.00 0.00 0.00 51.96 52.43 3ihm s ALA 209 Cb -0.13 -3.15 0.07 0.00 0.00 0.00 0.00 23.12 19.90 3ihm s ALA 209 CO -0.06 0.06 0.03 -0.51 0.00 0.00 0.00 175.76 175.28 3ihm s LEU 210 N -0.28 4.22 -0.70 0.00 1.43 -0.17 -1.06 118.68 122.11 3ihm s LEU 210 Ca 0.42 -1.54 -0.17 0.00 -1.03 0.00 0.00 54.13 51.81 3ihm s LEU 210 Cb -0.23 -1.71 0.14 0.00 0.03 0.00 0.00 46.19 44.43 3ihm s LEU 210 CO 0.28 -0.32 0.76 -0.69 0.23 0.00 0.00 176.35 176.60 3ihm s VAL 211 N 1.17 5.07 -0.48 -1.59 1.01 -0.22 -2.45 120.40 122.90 3ihm s VAL 211 Ca -0.01 -1.55 -0.21 0.00 0.00 0.00 0.00 61.98 60.21 3ihm s VAL 211 Cb -0.20 -4.51 0.04 0.00 0.00 0.00 0.00 36.38 31.70 3ihm s VAL 211 CO -0.03 -1.13 0.70 -0.76 0.00 0.00 0.00 175.10 173.89 3ihm s LEU 212 N 1.87 4.57 -0.77 3.92 1.43 0.01 -1.35 118.68 128.35 3ihm s LEU 212 Ca 0.15 -0.52 -0.13 0.00 -1.03 0.00 0.00 54.13 52.61 3ihm s LEU 212 Cb -0.18 -2.67 0.20 0.00 0.03 0.00 0.00 46.19 43.57 3ihm s LEU 212 CO -0.01 -0.91 0.70 -1.61 0.23 0.00 0.00 176.35 174.75 3ihm s GLU 213 N 3.00 3.40 -0.09 1.70 2.02 0.10 -1.38 118.70 127.46 3ihm s GLU 213 Ca 0.22 -2.39 -0.16 0.00 0.02 0.00 0.00 54.97 52.66 3ihm s GLU 213 Cb -0.15 -4.32 -0.05 0.00 0.10 0.00 0.00 34.13 29.71 3ihm s GLU 213 CO 0.17 -1.28 0.42 -0.80 0.02 0.00 0.00 175.26 173.79 3ihm s ASN 214 N 2.12 6.68 0.36 -0.19 0.01 -0.61 -0.48 114.94 122.82 3ihm s ASN 214 Ca 0.16 0.81 -0.28 0.00 -0.71 0.00 0.00 52.86 52.84 3ihm s ASN 214 Cb -0.13 -2.26 -0.10 0.00 0.41 0.00 0.00 41.25 39.17 3ihm s ASN 214 CO -0.07 0.12 1.30 -1.00 -1.51 0.00 0.00 177.10 175.94 3ihm s HIS 215 N 0.06 2.98 -0.06 2.20 3.76 0.11 -0.64 115.29 123.70 3ihm s HIS 215 Ca 0.24 1.42 -0.30 0.00 -0.15 0.00 0.00 55.06 56.27 3ihm s HIS 215 Cb -0.15 -3.66 -0.04 0.00 1.11 0.00 0.00 32.58 29.83 3ihm s HIS 215 CO 0.10 -1.90 1.35 0.42 -0.85 0.00 0.00 174.74 173.87 3ihm s ILE 216 N -1.19 3.96 0.00 0.60 1.01 -1.26 -2.75 121.20 121.57 3ihm s ILE 216 Ca 0.51 1.27 0.00 0.00 0.00 0.00 0.00 60.65 62.43 3ihm s ILE 216 Cb -0.39 -3.82 0.00 0.00 0.01 0.00 0.00 42.46 38.27 3ihm s ILE 216 CO 0.51 -0.04 0.00 0.61 0.00 0.00 0.00 174.94 176.02 3ihm n GLY 217 N 3.63 0.74 1.80 6.18 0.00 -1.26 -5.08 105.19 111.21 3ihm n GLY 217 Ca 0.13 -0.21 -0.09 0.00 0.00 0.00 0.00 46.02 45.85 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 0.39 1.08 0.00 1.61 3.41 -1.11 -5.00 113.62 114.00 3ihm n SER 218 Ca 0.00 -1.73 0.16 0.00 -0.26 0.00 0.00 58.87 57.03 3ihm n SER 218 Cb 0.00 -0.18 0.91 0.00 -0.26 0.00 0.00 64.21 64.68 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 -2.60 0.00 -0.00 4.04 2.03 -1.26 -3.72 116.55 115.05 3ihm n ASP 219 Ca 0.07 -0.89 0.02 0.00 0.52 0.00 0.00 54.79 54.51 3ihm n ASP 219 Cb 0.28 -0.03 -0.03 0.00 -0.72 0.00 0.00 41.12 40.62 3ihm n ASP 219 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3ihm n LEU 220 N -1.03 0.14 0.15 -2.67 4.77 -1.26 -4.68 117.00 112.43 3ihm n LEU 220 Ca 0.22 -0.37 0.10 0.00 -0.03 0.00 0.00 56.01 55.93 3ihm n LEU 220 Cb 0.12 0.00 0.61 0.00 -2.33 0.00 0.00 43.42 41.82 3ihm n LEU 220 CO 0.18 0.04 1.11 -0.08 -1.33 0.00 0.00 177.39 177.31 3ihm h GLU 221 N 0.00 0.10 0.00 3.23 4.81 -1.72 -2.32 114.58 118.68 3ihm h GLU 221 Ca 0.00 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3ihm h GLU 221 Cb 0.12 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.48 3ihm h GLU 221 CO 0.00 0.07 -0.00 -0.24 -0.73 0.00 0.00 179.01 178.11 3ihm h VAL 222 N 0.11 0.71 0.00 0.32 3.04 -1.83 -1.82 116.25 116.78 3ihm h VAL 222 Ca 0.09 -0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.76 3ihm h VAL 222 Cb 0.22 1.00 -0.00 0.00 -2.01 0.00 0.00 31.29 30.49 3ihm h VAL 222 CO -0.01 0.00 -0.08 -0.07 -1.01 0.00 0.00 177.57 176.40 3ihm h LEU 223 N 0.00 0.00 -0.24 3.16 3.38 -1.76 -1.36 115.31 118.49 3ihm h LEU 223 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ihm h LEU 223 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3ihm h LEU 223 CO 0.00 0.08 -0.25 0.00 0.09 0.00 0.00 178.44 178.36 3ihm n ALA 224 N -2.18 3.03 -0.00 1.53 0.00 -0.68 -4.35 120.51 117.85 3ihm n ALA 224 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.11 3ihm n ALA 224 Cb 0.25 -1.23 -0.01 0.00 0.00 0.00 0.00 19.45 18.47 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 -1.05 0.00 -2.71 0.00 8.25 -0.74 -4.50 115.22 114.48 3ihm n HIS 225 Ca 0.11 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.14 3ihm n HIS 225 Cb 0.32 -0.03 -0.03 0.00 1.12 0.00 0.00 29.99 31.37 3ihm n HIS 225 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3ihm s THR 226 N -2.05 4.79 -0.08 1.59 -4.23 -0.59 -5.02 115.64 110.05 3ihm s THR 226 Ca -0.00 2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 62.29 3ihm s THR 226 Cb 0.00 -4.30 -0.04 0.00 1.34 0.00 0.00 72.50 69.51 3ihm s THR 226 CO 0.04 -0.00 0.62 -0.54 -0.54 0.00 0.00 174.62 174.19 3ihm s LYS 227 N 2.09 4.40 0.28 3.99 3.01 -1.26 -4.96 119.74 127.29 3ihm s LYS 227 Ca 0.47 0.72 -0.03 0.00 -1.01 0.00 0.00 55.97 56.13 3ihm s LYS 227 Cb -0.18 -3.44 0.40 0.00 -1.01 0.00 0.00 37.83 33.61 3ihm s LYS 227 CO 0.17 0.11 1.92 -0.92 0.51 0.00 0.00 175.35 177.14 3ihm h TYR 228 N 6.69 1.15 0.00 3.18 3.20 -1.95 -2.93 116.97 126.31 3ihm h TYR 228 Ca -0.41 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.46 3ihm h TYR 228 Cb 1.19 -0.38 -0.00 0.00 1.54 0.00 0.00 36.73 39.07 3ihm h TYR 228 CO 0.64 0.66 -0.15 -0.44 -1.64 0.00 0.00 178.16 177.23 3ihm h ASP 229 N 1.19 0.00 -0.06 -2.11 3.32 -1.94 -1.88 116.42 114.93 3ihm h ASP 229 Ca 0.38 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.29 3ihm h ASP 229 Cb 0.02 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 3ihm h ASP 229 CO -0.12 0.15 -0.42 0.44 -1.72 0.00 0.00 179.24 177.57 3ihm h ASP 230 N 0.00 0.63 -0.47 6.45 3.32 -1.94 -3.43 116.42 120.98 3ihm h ASP 230 Ca -0.00 -0.28 0.15 0.00 0.02 0.00 0.00 57.03 56.92 3ihm h ASP 230 Cb 0.65 -0.18 -0.19 0.00 0.22 0.00 0.00 39.33 39.84 3ihm h ASP 230 CO 0.02 0.97 -0.13 -0.62 -1.72 0.00 0.00 179.24 177.75 3ihm s ASP 231 N -6.86 -0.76 0.19 6.45 -1.08 -1.11 -5.07 116.67 108.44 3ihm s ASP 231 Ca -0.08 0.03 -0.12 0.00 -0.52 0.00 0.00 52.55 51.86 3ihm s ASP 231 Cb 0.12 1.41 0.12 0.00 -1.46 0.00 0.00 42.92 43.11 3ihm s ASP 231 CO 0.83 -0.13 1.85 -0.65 0.52 0.00 0.00 175.17 177.58 3ihm h PRO 232 N 7.28 0.78 -0.52 4.34 0.11 -1.63 -1.98 132.00 140.38 3ihm h PRO 232 Ca -0.06 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.00 3ihm h PRO 232 Cb 1.18 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 3ihm h PRO 232 CO -0.03 0.52 0.31 -0.09 -0.21 0.00 0.00 178.00 178.50 3ihm h ARG 233 N 0.80 0.71 -0.65 1.05 9.65 -1.98 -0.97 114.38 123.01 3ihm h ARG 233 Ca 0.23 -0.07 -0.08 0.00 -1.10 0.00 0.00 59.98 58.97 3ihm h ARG 233 Cb -0.05 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 28.35 3ihm h ARG 233 CO -0.07 0.53 0.10 0.00 2.80 0.00 0.00 179.97 183.33 3ihm h ALA 234 N 1.15 0.96 -0.26 2.80 0.00 -1.92 -0.68 119.26 121.32 3ihm h ALA 234 Ca 0.19 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3ihm h ALA 234 Cb 0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3ihm h ALA 234 CO -0.03 0.65 0.07 0.35 0.00 0.00 0.00 179.25 180.28 3ihm h PHE 235 N 0.99 0.43 -0.34 0.00 3.57 -1.10 -1.78 116.94 118.71 3ihm h PHE 235 Ca 0.20 -0.05 -0.14 0.00 3.53 0.00 0.00 57.97 61.51 3ihm h PHE 235 Cb 0.43 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 3ihm h PHE 235 CO 0.03 0.49 -0.35 -0.07 -2.23 0.00 0.00 178.31 176.18 3ihm h LEU 236 N 0.24 0.80 -0.55 0.59 3.38 -1.05 0.07 115.31 118.80 3ihm h LEU 236 Ca 0.08 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.66 3ihm h LEU 236 Cb 0.27 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 3ihm h LEU 236 CO 0.00 1.08 0.17 0.44 0.09 0.00 0.00 178.44 180.21 3ihm h ASP 237 N 0.64 0.81 -0.45 -0.43 5.19 -1.14 0.20 116.42 121.24 3ihm h ASP 237 Ca 0.06 -0.21 -0.01 0.00 -0.62 0.00 0.00 57.03 56.25 3ihm h ASP 237 Cb 0.89 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 40.17 3ihm h ASP 237 CO 0.08 0.80 0.23 0.25 -3.12 0.00 0.00 179.24 177.48 3ihm h LEU 238 N 0.77 0.57 -0.32 1.55 5.85 -1.15 -0.79 115.31 121.78 3ihm h LEU 238 Ca 0.18 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.81 3ihm h LEU 238 Cb 0.29 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 3ihm h LEU 238 CO -0.00 0.52 0.16 0.24 -0.34 0.00 0.00 178.44 179.02 3ihm h MET 239 N 0.58 0.33 -0.53 1.25 2.86 -0.78 0.23 114.93 118.88 3ihm h MET 239 Ca 0.16 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.75 3ihm h MET 239 Cb 0.09 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 3ihm h MET 239 CO -0.02 0.22 0.24 -0.07 1.06 0.00 0.00 176.91 178.34 3ihm h LEU 240 N 0.34 0.68 -0.08 1.22 3.38 -0.79 0.30 115.31 120.36 3ihm h LEU 240 Ca 0.13 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3ihm h LEU 240 Cb 0.04 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 3ihm h LEU 240 CO -0.09 0.59 -0.05 -0.08 0.09 0.00 0.00 178.44 178.90 3ihm h GLU 241 N 0.75 0.17 -0.37 1.13 4.81 -0.73 -1.91 114.58 118.43 3ihm h GLU 241 Ca 0.19 -0.08 -0.15 0.00 -0.13 0.00 0.00 59.36 59.19 3ihm h GLU 241 Cb 0.10 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 3ihm h GLU 241 CO -0.02 0.55 -0.36 0.87 -0.73 0.00 0.00 179.01 179.32 3ihm h LYS 242 N -0.22 0.88 -0.35 1.92 1.79 -0.76 -2.38 116.57 117.45 3ihm h LYS 242 Ca 0.02 -0.44 -0.16 0.00 -2.18 0.00 0.00 60.65 57.88 3ihm h LYS 242 Cb 0.51 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.16 3ihm h LYS 242 CO 0.01 1.09 -0.40 -0.07 -1.08 0.00 0.00 179.45 179.00 3ihm h LEU 243 N 0.72 0.93 -1.06 2.94 3.38 -1.03 0.28 115.31 121.48 3ihm h LEU 243 Ca 0.07 -0.43 0.03 0.00 0.09 0.00 0.00 57.88 57.63 3ihm h LEU 243 Cb 0.94 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 3ihm h LEU 243 CO 0.09 1.21 0.64 1.23 0.09 0.00 0.00 178.44 181.69 3ihm h GLY 244 N 0.83 1.39 0.19 0.83 0.00 -1.27 0.06 103.07 105.09 3ihm h GLY 244 Ca 0.05 -0.49 -0.00 0.00 0.00 0.00 0.00 47.33 46.89 3ihm h GLY 244 CO 0.10 0.43 -0.05 1.70 0.00 0.00 0.00 176.54 178.72 3ihm h LYS 245 N 1.24 -0.13 0.02 4.80 1.63 -1.34 -3.38 116.57 119.41 3ihm h LYS 245 Ca 0.38 0.01 -0.32 0.00 -0.85 0.00 0.00 60.65 59.86 3ihm h LYS 245 Cb -0.03 0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 31.58 3ihm h LYS 245 CO -0.11 0.30 -1.93 0.72 -3.45 0.00 0.00 179.45 174.99 3ihm n HIS 246 N -4.83 0.80 -3.24 1.91 8.25 0.08 -4.60 115.22 113.59 3ihm n HIS 246 Ca -0.06 0.26 -0.24 0.00 -0.26 0.00 0.00 57.72 57.41 3ihm n HIS 246 Cb 0.24 -1.14 -0.06 0.00 1.12 0.00 0.00 29.99 30.15 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 -3.07 1.33 0.21 4.41 8.25 -0.01 -4.43 115.22 121.91 3ihm n HIS 247 Ca -0.24 -3.82 0.06 0.00 -0.26 0.00 0.00 57.72 53.46 3ihm n HIS 247 Cb 1.07 -0.44 0.45 0.00 1.12 0.00 0.00 29.99 32.19 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 3.81 0.00 0.00 -0.41 0.13 -1.69 -2.24 132.00 131.60 3ihm h PRO 248 Ca 0.12 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.20 3ihm h PRO 248 Cb 0.79 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.91 3ihm h PRO 248 CO 0.61 0.30 -0.24 0.66 -0.23 0.00 0.00 178.00 179.11 3ihm h SER 249 N 0.00 0.00 0.14 1.44 4.64 -1.94 0.12 113.55 117.95 3ihm h SER 249 Ca -0.00 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.02 3ihm h SER 249 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 3ihm h SER 249 CO 0.04 0.24 -1.50 0.58 -0.87 0.00 0.00 176.83 175.31 3ihm h VAL 250 N 0.00 1.02 -0.36 0.95 2.07 -1.87 -3.38 116.25 114.68 3ihm h VAL 250 Ca -0.00 -2.45 -0.01 0.00 0.82 0.00 0.00 66.70 65.06 3ihm h VAL 250 Cb 0.47 2.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.98 3ihm h VAL 250 CO 0.03 0.76 0.18 0.00 0.02 0.00 0.00 177.57 178.56 3ihm h ALA 251 N 0.02 1.65 0.00 1.67 0.00 -1.01 -2.07 119.26 119.52 3ihm h ALA 251 Ca -0.31 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 3ihm h ALA 251 Cb 1.88 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 3ihm h ALA 251 CO 0.11 0.29 -0.05 0.93 0.00 0.00 0.00 179.25 180.53 3ihm h GLU 252 N 0.49 0.00 -0.27 0.00 5.08 -0.96 -2.37 114.58 116.56 3ihm h GLU 252 Ca 0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3ihm h GLU 252 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 3ihm h GLU 252 CO -0.02 0.05 0.00 0.54 -1.00 0.00 0.00 179.01 178.58 3ihm n ARG 253 N -3.65 2.20 -3.24 2.33 1.74 -0.78 -4.92 116.66 110.34 3ihm n ARG 253 Ca -0.02 -1.80 -0.39 0.00 -0.77 0.00 0.00 57.85 54.87 3ihm n ARG 253 Cb 0.16 -1.47 -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 -1.65 5.14 -0.49 0.55 1.01 -0.89 -0.11 121.20 124.75 3ihm s ILE 254 Ca 0.35 1.07 -0.22 0.00 0.00 0.00 0.00 60.65 61.86 3ihm s ILE 254 Cb 0.21 -3.87 0.04 0.00 0.01 0.00 0.00 42.46 38.84 3ihm s ILE 254 CO 0.30 0.28 0.74 -0.62 0.00 0.00 0.00 174.94 175.63 3ihm s ASP 255 N 0.76 6.31 0.55 3.58 -1.08 0.41 -4.95 116.67 122.26 3ihm s ASP 255 Ca 0.28 -0.48 0.30 0.00 -0.52 0.00 0.00 52.55 52.13 3ihm s ASP 255 Cb -0.16 -2.35 1.63 0.00 -1.46 0.00 0.00 42.92 40.59 3ihm s ASP 255 CO 0.12 -0.96 2.14 1.55 0.52 0.00 0.00 175.17 178.55 3ihm h PRO 256 N 9.05 0.00 -0.08 4.34 0.13 -1.94 0.12 132.00 143.61 3ihm h PRO 256 Ca -0.26 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.72 3ihm h PRO 256 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 3ihm h PRO 256 CO 0.98 0.07 -0.62 0.00 -0.23 0.00 0.00 178.00 178.20 3ihm h ALA 257 N 1.93 0.79 0.00 -0.56 0.00 -1.96 -3.30 119.26 116.16 3ihm h ALA 257 Ca -0.00 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.36 3ihm h ALA 257 Cb 0.23 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3ihm h ALA 257 CO 0.01 0.73 -1.99 -1.91 0.00 0.00 0.00 179.25 176.09 3ihm n GLU 258 N -3.87 0.65 -1.54 0.00 2.13 -0.80 -4.97 120.64 112.25 3ihm n GLU 258 Ca -0.03 -0.20 -0.46 0.00 0.66 0.00 0.00 57.16 57.14 3ihm n GLU 258 Cb 0.63 -1.51 -0.05 0.00 0.27 0.00 0.00 31.44 30.78 3ihm n GLU 258 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3ihm n PHE 259 N -2.25 1.82 -3.84 4.31 7.35 0.35 -4.43 117.46 120.77 3ihm n PHE 259 Ca -0.04 0.02 -0.09 0.00 -0.76 0.00 0.00 57.45 56.59 3ihm n PHE 259 Cb 0.56 -2.66 0.01 0.00 0.35 0.00 0.00 39.48 37.75 3ihm n PHE 259 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3ihm s ASP 260 N 8.07 -0.01 0.47 -2.13 -1.08 -1.20 -5.00 116.67 115.79 3ihm s ASP 260 Ca 1.04 -1.04 -0.24 0.00 -0.52 0.00 0.00 52.55 51.79 3ihm s ASP 260 Cb -0.52 0.81 -0.07 0.00 -1.46 0.00 0.00 42.92 41.68 3ihm s ASP 260 CO 0.40 -1.59 1.32 -0.76 0.52 0.00 0.00 175.17 175.06 3ihm s LEU 261 N -3.05 4.04 0.21 -1.34 1.43 -1.26 -1.39 118.68 117.32 3ihm s LEU 261 Ca 0.15 2.68 -0.10 0.00 -1.03 0.00 0.00 54.13 55.83 3ihm s LEU 261 Cb -0.05 -4.09 0.16 0.00 0.03 0.00 0.00 46.19 42.24 3ihm s LEU 261 CO 0.11 -1.16 1.88 0.00 0.23 0.00 0.00 176.35 177.41 3ihm h ALA 262 N 2.10 0.96 0.00 4.21 0.00 -1.04 -3.41 119.26 122.08 3ihm h ALA 262 Ca -0.50 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3ihm h ALA 262 Cb 1.27 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3ihm h ALA 262 CO 0.60 0.37 -0.66 -1.71 0.00 0.00 0.00 179.25 177.85 3ihm n ASN 263 N -4.56 0.01 -3.01 0.00 2.85 -1.26 -4.80 115.26 104.49 3ihm n ASN 263 Ca 0.07 0.00 -0.10 0.00 -0.11 0.00 0.00 54.58 54.45 3ihm n ASN 263 Cb 0.02 -0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.05 3ihm n ASN 263 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 3ihm s SER 264 N -5.01 0.18 0.14 1.20 1.04 -1.26 -5.03 113.70 104.96 3ihm s SER 264 Ca 0.00 -1.20 0.14 0.00 0.48 0.00 0.00 55.95 55.37 3ihm s SER 264 Cb 0.00 0.81 0.64 0.00 0.10 0.00 0.00 66.02 67.58 3ihm s SER 264 CO 0.00 -1.61 1.42 -1.54 0.98 0.00 0.00 173.24 172.49 3ihm n SER 265 N -1.39 0.28 -0.11 7.02 3.41 -1.26 -1.88 113.62 119.68 3ihm n SER 265 Ca -0.06 0.60 0.15 0.00 -0.26 0.00 0.00 58.87 59.29 3ihm n SER 265 Cb 0.60 -0.65 0.70 0.00 -0.26 0.00 0.00 64.21 64.60 3ihm n SER 265 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3ihm n LEU 266 N -1.85 0.41 -1.50 1.04 4.77 -1.26 -4.03 117.00 114.59 3ihm n LEU 266 Ca 0.01 -0.01 -0.09 0.00 -0.03 0.00 0.00 56.01 55.88 3ihm n LEU 266 Cb 0.09 -0.13 0.06 0.00 -2.33 0.00 0.00 43.42 41.11 3ihm n LEU 266 CO 0.10 0.07 0.84 0.47 -1.33 0.00 0.00 177.39 177.54 3ihm n ASP 267 N -0.88 3.68 -3.80 -1.43 8.00 -0.79 -0.61 116.55 120.71 3ihm n ASP 267 Ca 0.17 -2.63 -0.13 0.00 0.71 0.00 0.00 54.79 52.91 3ihm n ASP 267 Cb 0.24 -0.69 -0.14 0.00 -0.02 0.00 0.00 41.12 40.52 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 -1.28 -0.02 -0.05 0.53 2.07 -1.26 -1.72 121.20 119.47 3ihm s ILE 268 Ca 0.21 0.09 0.02 0.00 -1.41 0.00 0.00 60.65 59.56 3ihm s ILE 268 Cb 0.18 -0.15 0.01 0.00 0.13 0.00 0.00 42.46 42.62 3ihm s ILE 268 CO 0.03 0.04 -0.11 -0.22 -1.91 0.00 0.00 174.94 172.77 3ihm s LEU 269 N 0.53 1.66 0.02 8.50 0.20 0.90 -4.60 118.68 125.89 3ihm s LEU 269 Ca -0.04 -0.27 0.05 0.00 0.69 0.00 0.00 54.13 54.57 3ihm s LEU 269 Cb -0.06 -0.75 -0.02 0.00 -0.43 0.00 0.00 46.19 44.94 3ihm s LEU 269 CO -0.02 0.04 -0.15 -1.10 -0.29 0.00 0.00 176.35 174.83 3ihm s GLN 270 N 0.55 1.12 0.00 1.98 -0.21 -1.26 -0.83 119.66 121.01 3ihm s GLN 270 Ca -0.11 -0.68 0.00 0.00 0.02 0.00 0.00 55.36 54.59 3ihm s GLN 270 Cb -0.14 -1.12 0.00 0.00 1.00 0.00 0.00 33.01 32.75 3ihm s GLN 270 CO 0.03 0.29 0.00 0.41 -2.12 0.00 0.00 175.29 173.90 3ihm n GLY 271 N 2.27 -0.27 3.48 3.09 0.00 -0.81 -5.01 105.19 107.94 3ihm n GLY 271 Ca -0.16 -0.45 -0.13 0.00 0.00 0.00 0.00 46.02 45.28 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 -0.55 -0.12 -0.02 0.00 -1.26 -0.14 107.32 105.22 3ihm s GLY 272 Ca 0.00 0.99 0.03 0.00 0.00 0.00 0.00 44.72 45.74 3ihm s GLY 272 CO 0.00 0.54 -0.22 0.14 0.00 0.00 0.00 173.10 173.56 3ihm s VAL 273 N -2.54 2.19 -0.43 1.40 1.01 -1.26 -4.99 120.40 115.79 3ihm s VAL 273 Ca -0.03 -0.96 -0.20 0.00 0.00 0.00 0.00 61.98 60.80 3ihm s VAL 273 Cb -0.01 -1.86 0.02 0.00 0.00 0.00 0.00 36.38 34.53 3ihm s VAL 273 CO -0.03 0.55 0.57 -0.69 0.00 0.00 0.00 175.10 175.50 3ihm s VAL 274 N 0.53 4.92 0.29 2.92 1.01 -1.26 -4.12 120.40 124.68 3ihm s VAL 274 Ca -0.14 -0.01 -0.29 0.00 0.00 0.00 0.00 61.98 61.54 3ihm s VAL 274 Cb -0.17 -4.14 -0.10 0.00 0.00 0.00 0.00 36.38 31.97 3ihm s VAL 274 CO 0.05 -0.52 1.31 -2.84 0.00 0.00 0.00 175.10 173.10 3ihm s PRO 275 N 2.59 4.37 -0.09 2.72 0.02 -1.26 -4.85 135.00 138.50 3ihm s PRO 275 Ca 0.19 2.16 -0.21 0.00 0.02 0.00 0.00 61.00 63.16 3ihm s PRO 275 Cb -0.15 -3.11 0.05 0.00 0.02 0.00 0.00 34.50 31.30 3ihm s PRO 275 CO 0.17 -0.21 0.51 0.00 -0.33 0.00 0.00 177.00 177.14 3ihm s ALA 276 N -0.69 -1.28 -0.10 -1.55 0.00 -0.51 -4.65 121.76 112.97 3ihm s ALA 276 Ca 0.52 1.06 0.00 0.00 0.00 0.00 0.00 51.96 53.54 3ihm s ALA 276 Cb -0.39 -0.29 0.02 0.00 0.00 0.00 0.00 23.12 22.46 3ihm s ALA 276 CO 0.47 -0.29 -0.08 0.12 0.00 0.00 0.00 175.76 175.98 3ihm s PHE 277 N -0.69 1.38 0.35 0.00 5.36 -1.26 -0.52 117.98 122.60 3ihm s PHE 277 Ca -0.08 -0.63 0.08 0.00 -0.96 0.00 0.00 56.93 55.34 3ihm s PHE 277 Cb -0.03 -1.14 -0.07 0.00 -0.34 0.00 0.00 43.02 41.44 3ihm s PHE 277 CO 0.05 -0.44 -0.06 1.03 -1.46 0.00 0.00 175.22 174.34 3ihm s ARG 278 N 1.49 1.82 0.40 10.12 0.52 0.15 -0.70 118.95 132.74 3ihm s ARG 278 Ca 0.00 -1.96 -0.26 0.00 -0.52 0.00 0.00 55.73 52.99 3ihm s ARG 278 Cb -0.13 -1.61 -0.11 0.00 0.52 0.00 0.00 34.95 33.62 3ihm s ARG 278 CO -0.05 0.07 1.19 -0.25 0.02 0.00 0.00 175.30 176.29 3ihm n ASP 279 N -0.81 2.20 -0.16 0.23 8.00 -0.09 -4.78 116.55 121.13 3ihm n ASP 279 Ca -0.05 1.12 0.14 0.00 0.71 0.00 0.00 54.79 56.71 3ihm n ASP 279 Cb 0.64 -1.45 0.76 0.00 -0.02 0.00 0.00 41.12 41.05 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 0.92 -0.65 3.19 0.44 0.00 -1.26 -4.75 105.19 103.08 3ihm n GLY 280 Ca 0.07 -0.27 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 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 0.33 -0.07 1.61 -3.43 -1.26 -0.32 115.29 110.15 3ihm s HIS 281 Ca 0.42 -0.77 -0.10 0.00 -0.80 0.00 0.00 55.06 53.81 3ihm s HIS 281 Cb 0.20 -0.17 0.02 0.00 -1.43 0.00 0.00 32.58 31.20 3ihm s HIS 281 CO 0.34 -0.52 0.25 0.00 -2.00 0.00 0.00 174.74 172.81 3ihm s ALA 282 N -3.90 -0.63 -0.25 -1.38 0.00 -0.33 -4.72 121.76 110.55 3ihm s ALA 282 Ca 0.08 0.56 -0.08 0.00 0.00 0.00 0.00 51.96 52.52 3ihm s ALA 282 Cb 0.06 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 3ihm s ALA 282 CO -0.08 -0.16 0.10 0.99 0.00 0.00 0.00 175.76 176.61 3ihm s THR 283 N -0.30 4.62 0.77 0.00 2.01 -1.26 -0.69 115.64 120.78 3ihm s THR 283 Ca -0.04 -0.07 -0.08 0.00 0.31 0.00 0.00 61.69 61.80 3ihm s THR 283 Cb -0.03 -3.16 0.10 0.00 0.01 0.00 0.00 72.50 69.42 3ihm s THR 283 CO 0.01 0.34 1.09 -0.76 -0.69 0.00 0.00 174.62 174.61 3ihm s LEU 284 N 1.45 2.77 0.58 4.42 1.43 -0.69 -4.95 118.68 123.69 3ihm s LEU 284 Ca 0.06 0.37 0.33 0.00 -1.03 0.00 0.00 54.13 53.86 3ihm s LEU 284 Cb -0.15 -2.85 1.80 0.00 0.03 0.00 0.00 46.19 45.02 3ihm s LEU 284 CO 0.05 -1.88 2.20 0.78 0.23 0.00 0.00 176.35 177.73 3ihm h ASN 285 N -0.84 0.00 -0.01 2.29 2.35 -1.99 -1.23 115.58 116.14 3ihm h ASN 285 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 3ihm h ASN 285 Cb 1.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.67 3ihm h ASN 285 CO 0.55 0.04 0.00 -0.46 -1.65 0.00 0.00 177.43 175.91 3ihm n ASN 286 N -3.51 0.57 0.00 5.81 6.94 -1.26 -4.91 115.26 118.90 3ihm n ASN 286 Ca -0.02 -1.24 0.00 0.00 -0.02 0.00 0.00 54.58 53.30 3ihm n ASN 286 Cb 0.16 -0.01 0.00 0.00 -2.36 0.00 0.00 39.78 37.57 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 1.04 0.94 3.80 4.83 0.00 -0.46 -5.05 105.19 110.29 3ihm n GLY 287 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.43 4.33 -0.07 1.61 1.02 -1.26 -4.81 119.74 120.13 3ihm s LYS 288 Ca 0.00 0.92 -0.19 0.00 0.02 0.00 0.00 55.97 56.71 3ihm s LYS 288 Cb 0.00 -3.10 -0.05 0.00 -0.52 0.00 0.00 37.83 34.17 3ihm s LYS 288 CO 0.00 0.52 0.53 0.99 -0.92 0.00 0.00 175.35 176.47 3ihm s THR 289 N -1.30 5.07 0.11 2.17 2.01 -1.26 -1.71 115.64 120.73 3ihm s THR 289 Ca 0.37 1.08 0.09 0.00 0.31 0.00 0.00 61.69 63.54 3ihm s THR 289 Cb -0.19 -3.87 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 3ihm s THR 289 CO 0.22 0.37 -0.17 0.27 -0.69 0.00 0.00 174.62 174.62 3ihm s ILE 290 N 0.23 2.91 -0.14 1.82 -4.36 0.13 -4.60 121.20 117.19 3ihm s ILE 290 Ca 0.28 -1.45 -0.04 0.00 -0.26 0.00 0.00 60.65 59.18 3ihm s ILE 290 Cb -0.16 -2.33 -0.03 0.00 1.25 0.00 0.00 42.46 41.18 3ihm s ILE 290 CO 0.13 0.12 -0.01 -0.63 0.24 0.00 0.00 174.94 174.79 3ihm s ILE 291 N -1.14 4.16 0.08 8.37 -1.09 -0.81 -1.19 121.20 129.59 3ihm s ILE 291 Ca 0.18 -0.27 -0.14 0.00 -2.23 0.00 0.00 60.65 58.19 3ihm s ILE 291 Cb -0.11 -2.81 -0.06 0.00 -1.58 0.00 0.00 42.46 37.90 3ihm s ILE 291 CO 0.10 0.52 0.48 -0.83 -1.23 0.00 0.00 174.94 173.98 3ihm s GLY 292 N -0.00 2.46 -0.03 6.18 0.00 0.56 -0.86 107.32 115.64 3ihm s GLY 292 Ca 0.02 -0.19 -0.06 0.00 0.00 0.00 0.00 44.72 44.49 3ihm s GLY 292 CO 0.02 0.11 0.14 -2.27 0.00 0.00 0.00 173.10 171.10 3ihm s LEU 293 N -1.62 1.50 0.00 0.66 2.96 -0.03 -4.80 118.68 117.35 3ihm s LEU 293 Ca 0.32 0.07 0.00 0.00 -0.22 0.00 0.00 54.13 54.30 3ihm s LEU 293 Cb -0.16 0.57 0.00 0.00 0.50 0.00 0.00 46.19 47.10 3ihm s LEU 293 CO 0.17 -0.19 0.00 0.61 -1.32 0.00 0.00 176.35 175.63 3ihm n GLY 294 N 2.33 3.12 0.23 7.98 0.00 -1.26 -3.21 105.19 114.38 3ihm n GLY 294 Ca -0.17 -0.17 0.03 0.00 0.00 0.00 0.00 46.02 45.71 3ihm n GLY 294 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3ihm h ASP 295 N 0.00 0.15 0.95 1.61 1.82 -1.71 -2.09 116.42 117.15 3ihm h ASP 295 Ca 0.00 -0.03 -0.07 0.00 -0.39 0.00 0.00 57.03 56.54 3ihm h ASP 295 Cb 0.00 -0.04 -0.01 0.00 0.68 0.00 0.00 39.33 39.96 3ihm h ASP 295 CO 0.00 0.32 -0.32 -0.29 -1.61 0.00 0.00 179.24 177.34 3ihm h ILE 296 N 0.15 0.73 0.00 2.25 2.10 -1.69 -3.06 117.51 117.99 3ihm h ILE 296 Ca 0.03 -1.40 -0.17 0.00 1.08 0.00 0.00 64.86 64.40 3ihm h ILE 296 Cb 0.36 1.90 -0.03 0.00 -1.09 0.00 0.00 36.82 37.96 3ihm h ILE 296 CO 0.02 0.31 -1.96 0.00 -1.08 0.00 0.00 178.15 175.45 3ihm n GLN 297 N -3.44 0.66 -3.39 2.19 -0.00 -1.08 -4.69 117.38 107.63 3ihm n GLN 297 Ca 0.00 -0.02 -0.12 0.00 -0.00 0.00 0.00 57.00 56.86 3ihm n GLN 297 Cb 0.49 -1.60 -0.09 0.00 -0.00 0.00 0.00 30.24 29.04 3ihm n GLN 297 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3ihm s ALA 298 N -3.00 -0.82 -0.30 2.61 0.00 -0.81 0.33 121.76 119.77 3ihm s ALA 298 Ca -0.07 0.61 -0.16 0.00 0.00 0.00 0.00 51.96 52.34 3ihm s ALA 298 Cb 0.10 -1.60 -0.03 0.00 0.00 0.00 0.00 23.12 21.59 3ihm s ALA 298 CO 0.85 -1.30 0.40 0.99 0.00 0.00 0.00 175.76 176.70 3ihm s THR 299 N 2.47 5.14 0.04 0.00 2.01 0.32 -4.08 115.64 121.54 3ihm s THR 299 Ca 0.11 0.45 0.06 0.00 0.31 0.00 0.00 61.69 62.62 3ihm s THR 299 Cb -0.15 -3.77 -0.03 0.00 0.01 0.00 0.00 72.50 68.55 3ihm s THR 299 CO -0.17 0.05 -0.13 0.54 -0.69 0.00 0.00 174.62 174.22 3ihm s VAL 300 N 2.13 3.17 0.28 3.82 0.11 -1.26 -1.43 120.40 127.22 3ihm s VAL 300 Ca 0.15 -1.07 -0.29 0.00 -2.93 0.00 0.00 61.98 57.84 3ihm s VAL 300 Cb -0.16 -2.38 -0.10 0.00 -1.53 0.00 0.00 36.38 32.21 3ihm s VAL 300 CO 0.11 0.31 1.29 -0.62 -3.33 0.00 0.00 175.10 172.86 3ihm s ASP 301 N -1.57 6.87 0.00 3.54 -1.08 -1.26 -4.91 116.67 118.26 3ihm s ASP 301 Ca 0.17 2.54 0.18 0.00 -0.52 0.00 0.00 52.55 54.91 3ihm s ASP 301 Cb -0.11 -2.63 1.00 0.00 -1.46 0.00 0.00 42.92 39.72 3ihm s ASP 301 CO 0.08 -0.49 1.48 -2.65 0.52 0.00 0.00 175.17 174.11 3ihm n PRO 302 N 1.54 0.45 -0.15 4.34 -0.02 -1.26 -4.12 135.00 135.77 3ihm n PRO 302 Ca 0.02 0.04 0.11 0.00 -2.02 0.00 0.00 63.50 61.66 3ihm n PRO 302 Cb 0.42 -1.50 0.45 0.00 -0.02 0.00 0.00 33.50 32.85 3ihm n PRO 302 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3ihm h VAL 303 N 0.00 0.90 -0.08 -1.45 3.04 -1.97 -1.29 116.25 115.40 3ihm h VAL 303 Ca 0.00 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.51 3ihm h VAL 303 Cb 0.06 0.31 0.00 0.00 -2.01 0.00 0.00 31.29 29.65 3ihm h VAL 303 CO 0.00 0.10 0.00 0.18 -1.01 0.00 0.00 177.57 176.84 3ihm n LEU 304 N -4.49 2.44 -3.62 3.16 4.32 -1.26 -4.98 117.00 112.58 3ihm n LEU 304 Ca 0.12 -1.12 -0.20 0.00 -0.02 0.00 0.00 56.01 54.78 3ihm n LEU 304 Cb 0.38 -0.04 0.05 0.00 -1.62 0.00 0.00 43.42 42.20 3ihm n LEU 304 CO 0.33 0.47 0.01 0.61 -1.22 0.00 0.00 177.39 177.59 3ihm n GLY 305 N 0.90 -0.33 0.07 -0.72 0.00 -0.49 -4.93 105.19 99.68 3ihm n GLY 305 Ca 0.10 0.13 0.01 0.00 0.00 0.00 0.00 46.02 46.26 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 -4.28 0.65 -0.09 1.61 1.13 -1.26 -4.70 117.38 110.45 3ihm n GLN 306 Ca -0.27 0.03 -0.09 0.00 -1.94 0.00 0.00 57.00 54.73 3ihm n GLN 306 Cb 0.66 -1.64 -0.04 0.00 0.11 0.00 0.00 30.24 29.33 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 3.90 -0.45 1.06 1.08 0.00 -1.91 -1.26 103.07 105.49 3ihm h GLY 307 Ca -0.21 0.47 -0.09 0.00 0.00 0.00 0.00 47.33 47.50 3ihm h GLY 307 CO 0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 176.54 176.35 3ihm h ALA 308 N 0.50 0.75 -0.70 3.60 0.00 -1.87 -1.48 119.26 120.06 3ihm h ALA 308 Ca 0.14 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 3ihm h ALA 308 Cb 0.57 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3ihm h ALA 308 CO -0.51 0.59 0.28 -0.91 0.00 0.00 0.00 179.25 178.71 3ihm h ASN 309 N 0.88 0.95 0.01 0.00 2.35 -1.75 -0.77 115.58 117.25 3ihm h ASN 309 Ca 0.16 -0.14 -0.16 0.00 -0.55 0.00 0.00 56.30 55.61 3ihm h ASN 309 Cb 0.56 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 3ihm h ASN 309 CO 0.03 0.84 -0.54 0.24 -1.65 0.00 0.00 177.43 176.35 3ihm h MET 310 N 1.01 0.57 -0.14 0.81 2.86 -1.08 -0.04 114.93 118.92 3ihm h MET 310 Ca 0.24 -0.35 -0.00 0.00 -2.06 0.00 0.00 59.70 57.52 3ihm h MET 310 Cb 0.19 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 3ihm h MET 310 CO -0.02 0.96 0.07 0.00 1.06 0.00 0.00 176.91 178.98 3ihm h ALA 311 N 0.97 0.18 -0.49 6.32 0.00 -0.93 -1.06 119.26 124.24 3ihm h ALA 311 Ca 0.01 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3ihm h ALA 311 Cb 1.08 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 3ihm h ALA 311 CO 0.10 -0.26 0.19 1.03 0.00 0.00 0.00 179.25 180.31 3ihm h SER 312 N 0.10 0.69 -0.21 0.00 0.87 -1.11 -2.17 113.55 111.73 3ihm h SER 312 Ca 0.05 -0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 60.43 3ihm h SER 312 Cb 0.11 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 3ihm h SER 312 CO -0.01 0.68 0.12 0.22 -0.53 0.00 0.00 176.83 177.31 3ihm h TYR 313 N 0.66 0.28 -0.06 2.24 3.20 -0.89 -2.61 116.97 119.79 3ihm h TYR 313 Ca 0.16 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.90 3ihm h TYR 313 Cb 0.21 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 3ihm h TYR 313 CO 0.01 0.24 -0.53 0.00 -1.64 0.00 0.00 178.16 176.23 3ihm h ALA 314 N 1.02 1.00 -0.70 1.82 0.00 -1.19 -2.60 119.26 118.60 3ihm h ALA 314 Ca 0.07 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 3ihm h ALA 314 Cb 0.05 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3ihm h ALA 314 CO -0.01 0.68 0.33 0.00 0.00 0.00 0.00 179.25 180.24 3ihm h ALA 315 N 1.32 0.91 -0.34 0.00 0.00 -1.27 0.08 119.26 119.96 3ihm h ALA 315 Ca 0.00 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 3ihm h ALA 315 Cb 0.98 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3ihm h ALA 315 CO 0.08 0.48 0.07 2.35 0.00 0.00 0.00 179.25 182.23 3ihm h TRP 316 N 0.98 0.58 -0.07 0.00 2.91 -1.29 0.40 115.95 119.45 3ihm h TRP 316 Ca 0.24 -0.07 -0.01 0.00 1.13 0.00 0.00 58.89 60.18 3ihm h TRP 316 Cb 0.14 -0.16 -0.00 0.00 -0.51 0.00 0.00 29.16 28.62 3ihm h TRP 316 CO 0.01 0.60 0.02 0.82 -1.03 0.00 0.00 178.44 178.86 3ihm h ILE 317 N 0.39 1.16 -0.68 2.65 1.08 -1.31 -1.45 117.51 119.35 3ihm h ILE 317 Ca 0.10 -0.50 0.01 0.00 -0.39 0.00 0.00 64.86 64.09 3ihm h ILE 317 Cb 0.32 1.36 -0.03 0.00 -3.07 0.00 0.00 36.82 35.39 3ihm h ILE 317 CO 0.00 0.14 0.45 0.25 -0.69 0.00 0.00 178.15 178.30 3ihm h LEU 318 N -0.06 0.77 -0.46 1.44 5.85 -0.98 -1.40 115.31 120.46 3ihm h LEU 318 Ca 0.02 -0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.80 3ihm h LEU 318 Cb 0.20 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.98 3ihm h LEU 318 CO -0.00 0.55 0.09 1.23 -0.34 0.00 0.00 178.44 179.97 3ihm h GLY 319 N 0.91 0.56 1.02 3.75 0.00 -0.74 -0.56 103.07 108.00 3ihm h GLY 319 Ca 0.25 -0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.52 3ihm h GLY 319 CO -0.06 -0.06 0.25 0.83 0.00 0.00 0.00 176.54 177.50 3ihm h GLU 320 N 0.23 1.01 -0.03 4.80 5.08 -0.85 -3.05 114.58 121.76 3ihm h GLU 320 Ca 0.23 -0.19 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 3ihm h GLU 320 Cb 0.30 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 3ihm h GLU 320 CO -0.30 0.86 -0.53 0.93 -1.00 0.00 0.00 179.01 178.97 3ihm h GLU 321 N 0.96 0.09 -0.62 2.33 4.39 -0.86 -2.62 114.58 118.25 3ihm h GLU 321 Ca 0.22 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.84 3ihm h GLU 321 Cb 0.23 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.86 3ihm h GLU 321 CO -0.02 0.59 0.28 0.82 -1.16 0.00 0.00 179.01 179.53 3ihm h ILE 322 N 0.07 1.21 -0.03 3.13 2.04 -1.01 -1.80 117.51 121.12 3ihm h ILE 322 Ca -0.00 -0.62 -0.16 0.00 1.00 0.00 0.00 64.86 65.08 3ihm h ILE 322 Cb 0.96 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 3ihm h ILE 322 CO 0.07 0.25 -0.70 -0.07 0.00 0.00 0.00 178.15 177.70 3ihm h LEU 323 N 0.88 0.20 0.00 1.44 3.38 -1.44 -3.29 115.31 116.49 3ihm h LEU 323 Ca 0.21 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3ihm h LEU 323 Cb 0.13 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3ihm h LEU 323 CO -0.02 0.84 -0.23 0.00 0.09 0.00 0.00 178.44 179.12 3ihm h ALA 324 N 1.16 0.88 -2.90 1.53 0.00 -1.09 -3.46 119.26 115.37 3ihm h ALA 324 Ca -0.02 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.25 3ihm h ALA 324 Cb 1.25 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.88 3ihm h ALA 324 CO 0.10 0.00 -0.79 -1.01 0.00 0.00 0.00 179.25 177.56 3ihm s HIS 325 N -3.21 2.36 -0.00 0.00 3.76 -0.71 -5.03 115.29 112.45 3ihm s HIS 325 Ca 0.06 -0.33 0.00 0.00 -0.15 0.00 0.00 55.06 54.65 3ihm s HIS 325 Cb 0.08 -1.13 -0.01 0.00 1.11 0.00 0.00 32.58 32.63 3ihm s HIS 325 CO 0.68 0.56 0.01 -1.13 -0.85 0.00 0.00 174.74 174.01 3ihm n SER 326 N -0.01 3.64 -4.26 1.40 3.41 -1.26 -4.84 113.62 111.70 3ihm n SER 326 Ca -0.10 -0.13 -0.35 0.00 -0.26 0.00 0.00 58.87 58.02 3ihm n SER 326 Cb 0.57 1.01 -0.14 0.00 -0.26 0.00 0.00 64.21 65.39 3ihm n SER 326 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3ihm s VAL 327 N -1.77 3.19 -0.97 -3.33 1.01 -1.26 -5.06 120.40 112.21 3ihm s VAL 327 Ca -0.00 -0.80 -0.09 0.00 0.00 0.00 0.00 61.98 61.09 3ihm s VAL 327 Cb 0.00 -2.57 0.25 0.00 0.00 0.00 0.00 36.38 34.06 3ihm s VAL 327 CO 0.02 0.26 0.93 -0.31 0.00 0.00 0.00 175.10 175.99 3ihm s TYR 328 N 1.40 4.03 0.00 5.22 2.02 -1.26 -4.52 117.35 124.24 3ihm s TYR 328 Ca 0.02 -2.56 0.00 0.00 -0.37 0.00 0.00 57.07 54.16 3ihm s TYR 328 Cb -0.16 -3.71 0.00 0.00 -0.40 0.00 0.00 41.96 37.70 3ihm s TYR 328 CO -0.03 -0.92 0.00 -0.40 -1.57 0.00 0.00 175.55 172.63 3ihm n ASP 329 N 3.03 0.58 -0.24 2.29 5.68 -1.26 -4.38 116.55 122.24 3ihm n ASP 329 Ca 0.20 0.00 -0.07 0.00 -0.50 0.00 0.00 54.79 54.42 3ihm n ASP 329 Cb 0.41 0.00 0.06 0.00 -1.14 0.00 0.00 41.12 40.45 3ihm n ASP 329 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 3ihm h LEU 330 N 0.00 1.06 -0.66 -2.12 5.85 -1.99 -0.97 115.31 116.49 3ihm h LEU 330 Ca 0.00 -0.22 -0.05 0.00 0.84 0.00 0.00 57.88 58.45 3ihm h LEU 330 Cb 0.00 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.72 3ihm h LEU 330 CO 0.00 1.01 0.23 -0.09 -0.34 0.00 0.00 178.44 179.25 3ihm h ARG 331 N 1.06 1.01 -0.64 1.25 9.65 -1.96 -0.59 114.38 124.14 3ihm h ARG 331 Ca 0.22 -0.20 0.03 0.00 -1.10 0.00 0.00 59.98 58.92 3ihm h ARG 331 Cb 0.37 -0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 28.76 3ihm h ARG 331 CO 0.00 0.86 0.40 0.35 2.80 0.00 0.00 179.97 184.38 3ihm h PHE 332 N 0.94 0.74 -0.57 2.20 3.57 -1.74 -2.35 116.94 119.73 3ihm h PHE 332 Ca 0.22 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.72 3ihm h PHE 332 Cb 0.26 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 3ihm h PHE 332 CO 0.02 0.43 0.28 1.03 -2.23 0.00 0.00 178.31 177.84 3ihm h SER 333 N 0.78 0.72 -0.41 0.41 0.87 -0.67 -2.10 113.55 113.15 3ihm h SER 333 Ca 0.26 -0.06 -0.04 0.00 -1.23 0.00 0.00 61.79 60.71 3ihm h SER 333 Cb 0.02 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 3ihm h SER 333 CO -0.10 0.60 0.09 -0.33 -0.53 0.00 0.00 176.83 176.55 3ihm h GLU 334 N 0.80 0.67 -0.80 2.24 5.08 -0.77 -0.38 114.58 121.43 3ihm h GLU 334 Ca 0.20 -0.17 0.04 0.00 -1.00 0.00 0.00 59.36 58.43 3ihm h GLU 334 Cb 0.07 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.19 3ihm h GLU 334 CO -0.03 0.70 0.50 0.45 -1.00 0.00 0.00 179.01 179.64 3ihm h HIS 335 N 0.53 0.94 0.13 4.33 3.86 -1.09 -1.52 115.15 122.33 3ihm h HIS 335 Ca 0.13 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.36 3ihm h HIS 335 Cb 0.34 -0.31 0.00 0.00 1.06 0.00 0.00 27.41 28.50 3ihm h HIS 335 CO 0.02 0.53 -0.06 1.25 0.86 0.00 0.00 177.93 180.54 3ihm h LEU 336 N 0.98 -0.14 -0.75 2.43 5.85 -1.21 -3.13 115.31 119.33 3ihm h LEU 336 Ca 0.32 -0.26 0.03 0.00 0.84 0.00 0.00 57.88 58.80 3ihm h LEU 336 Cb 0.03 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 3ihm h LEU 336 CO -0.12 0.20 0.48 -0.33 -0.34 0.00 0.00 178.44 178.32 3ihm h GLU 337 N -0.50 0.91 0.00 1.25 3.07 -0.96 -1.12 114.58 117.23 3ihm h GLU 337 Ca -0.02 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 58.77 3ihm h GLU 337 Cb 0.40 -0.21 -0.00 0.00 -0.84 0.00 0.00 28.75 28.10 3ihm h GLU 337 CO 0.03 0.60 -0.09 0.07 -1.40 0.00 0.00 179.01 178.22 3ihm h ARG 338 N 0.94 0.00 0.08 2.33 0.11 -1.34 0.27 114.38 116.77 3ihm h ARG 338 Ca 0.29 0.00 -0.25 0.00 0.10 0.00 0.00 59.98 60.13 3ihm h ARG 338 Cb -0.01 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.06 3ihm h ARG 338 CO -0.10 0.09 -1.28 0.00 0.10 0.00 0.00 179.97 178.78 3ihm h ARG 339 N 0.00 0.17 0.00 0.08 3.08 -1.35 -3.42 114.38 112.94 3ihm h ARG 339 Ca -0.00 -0.29 -0.16 0.00 0.07 0.00 0.00 59.98 59.60 3ihm h ARG 339 Cb 0.38 0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.51 3ihm h ARG 339 CO 0.01 1.14 -1.75 2.89 -1.07 0.00 0.00 179.97 181.19 3ihm n ARG 340 N -4.07 0.65 0.09 0.04 1.85 -0.48 -4.66 116.66 110.07 3ihm n ARG 340 Ca -0.26 0.06 -0.13 0.00 -1.00 0.00 0.00 57.85 56.53 3ihm n ARG 340 Cb 0.82 -1.67 -0.07 0.00 -1.05 0.00 0.00 32.46 30.49 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 -0.17 -0.35 2.89 4.20 -1.15 -3.02 115.11 117.51 3ihm h GLN 341 Ca -0.20 0.01 0.08 0.00 0.06 0.00 0.00 58.65 58.60 3ihm h GLN 341 Cb 1.55 0.04 -0.08 0.00 0.30 0.00 0.00 27.48 29.29 3ihm h GLN 341 CO 0.03 -0.11 -0.20 0.22 -0.67 0.00 0.00 178.83 178.10 3ihm h ASP 342 N -0.17 -0.67 -0.15 1.46 3.58 -1.83 0.52 116.42 119.16 3ihm h ASP 342 Ca -0.01 0.14 -0.01 0.00 0.42 0.00 0.00 57.03 57.58 3ihm h ASP 342 Cb 0.15 0.35 -0.01 0.00 1.72 0.00 0.00 39.33 41.54 3ihm h ASP 342 CO -0.00 -0.23 0.06 -0.09 -2.88 0.00 0.00 179.24 176.10 3ihm h ARG 343 N -0.15 0.23 -0.45 0.28 2.43 -1.88 0.14 114.38 114.98 3ihm h ARG 343 Ca 0.17 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.24 3ihm h ARG 343 Cb 0.42 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 3ihm h ARG 343 CO -0.44 0.31 0.04 0.28 -1.51 0.00 0.00 179.97 178.65 3ihm h VAL 344 N 0.10 1.25 -0.40 0.20 2.07 -1.29 -0.96 116.25 117.23 3ihm h VAL 344 Ca 0.05 -0.98 -0.08 0.00 0.82 0.00 0.00 66.70 66.52 3ihm h VAL 344 Cb 0.17 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 3ihm h VAL 344 CO -0.00 0.34 -0.04 0.25 0.02 0.00 0.00 177.57 178.13 3ihm h LEU 345 N 0.63 0.73 -1.43 2.57 5.85 0.06 -2.75 115.31 120.98 3ihm h LEU 345 Ca 0.13 -0.33 -0.05 0.00 0.84 0.00 0.00 57.88 58.47 3ihm h LEU 345 Cb 0.44 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 3ihm h LEU 345 CO 0.02 0.89 -0.19 0.00 -0.34 0.00 0.00 178.44 178.82 3ihm h ALA 347 N 1.68 0.93 -0.18 0.00 0.00 -1.06 0.11 119.26 120.75 3ihm h ALA 347 Ca 0.02 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3ihm h ALA 347 Cb 0.41 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3ihm h ALA 347 CO 0.03 0.62 -0.01 1.15 0.00 0.00 0.00 179.25 181.04 3ihm h THR 348 N 1.05 1.26 -0.23 0.00 2.02 -1.04 -2.08 112.91 113.89 3ihm h THR 348 Ca 0.23 -0.88 -0.01 0.00 0.77 0.00 0.00 66.41 66.52 3ihm h THR 348 Cb 0.31 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 3ihm h THR 348 CO -0.01 0.26 0.13 0.03 0.37 0.00 0.00 175.52 176.30 3ihm h ARG 349 N 0.06 0.33 -0.61 6.66 3.08 -0.70 -0.98 114.38 122.21 3ihm h ARG 349 Ca 0.05 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.01 3ihm h ARG 349 Cb 0.40 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 3ihm h ARG 349 CO 0.01 0.30 0.18 2.35 -1.07 0.00 0.00 179.97 181.74 3ihm h TRP 350 N 0.26 1.00 -0.28 3.04 7.01 -0.84 0.43 115.95 126.58 3ihm h TRP 350 Ca 0.08 -0.11 -0.03 0.00 2.11 0.00 0.00 58.89 60.95 3ihm h TRP 350 Cb 0.07 -0.29 -0.01 0.00 -2.10 0.00 0.00 29.16 26.83 3ihm h TRP 350 CO -0.03 0.83 0.08 1.15 -2.79 0.00 0.00 178.44 177.68 3ihm h THR 351 N 0.88 1.21 -0.46 2.65 2.02 -1.28 -1.40 112.91 116.53 3ihm h THR 351 Ca 0.20 -0.68 -0.05 0.00 0.77 0.00 0.00 66.41 66.65 3ihm h THR 351 Cb 0.31 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.82 3ihm h THR 351 CO -0.00 0.22 0.09 0.78 0.37 0.00 0.00 175.52 176.98 3ihm h ASN 352 N 0.29 0.71 -0.58 4.18 2.35 -1.04 -0.61 115.58 120.89 3ihm h ASN 352 Ca 0.09 -0.25 0.04 0.00 -0.55 0.00 0.00 56.30 55.63 3ihm h ASN 352 Cb 0.27 -0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.40 3ihm h ASN 352 CO -0.00 0.78 0.32 0.15 -1.65 0.00 0.00 177.43 177.03 3ihm h PHE 353 N 0.62 0.59 -0.40 1.19 3.57 -0.90 -1.93 116.94 119.67 3ihm h PHE 353 Ca 0.14 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 3ihm h PHE 353 Cb 0.36 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 3ihm h PHE 353 CO 0.02 0.30 0.06 1.15 -2.23 0.00 0.00 178.31 177.61 3ihm h THR 354 N 0.61 1.24 -0.41 4.41 2.02 -1.00 0.32 112.91 120.10 3ihm h THR 354 Ca 0.25 -0.88 0.06 0.00 0.77 0.00 0.00 66.41 66.60 3ihm h THR 354 Cb 0.12 1.05 -0.05 0.00 -1.74 0.00 0.00 68.15 67.52 3ihm h THR 354 CO -0.15 0.30 0.12 -0.07 0.37 0.00 0.00 175.52 176.09 3ihm h LEU 355 N 0.51 0.10 -0.33 2.58 3.38 -0.94 -1.08 115.31 119.53 3ihm h LEU 355 Ca 0.12 0.06 -0.18 0.00 0.09 0.00 0.00 57.88 57.97 3ihm h LEU 355 Cb 0.38 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 3ihm h LEU 355 CO 0.01 0.09 -0.48 0.28 0.09 0.00 0.00 178.44 178.43 3ihm h SER 356 N 0.27 0.99 -0.10 -0.43 0.02 -1.23 -3.19 113.55 109.88 3ihm h SER 356 Ca 0.19 -0.51 -0.10 0.00 -0.84 0.00 0.00 61.79 60.54 3ihm h SER 356 Cb 0.21 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 3ihm h SER 356 CO -0.22 1.30 -0.24 0.00 -1.14 0.00 0.00 176.83 176.53 3ihm h ALA 357 N 0.72 1.06 -0.01 3.77 0.00 -0.73 -1.40 119.26 122.67 3ihm h ALA 357 Ca 0.03 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.48 3ihm h ALA 357 Cb 1.09 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 3ihm h ALA 357 CO 0.11 0.57 -0.56 -0.07 0.00 0.00 0.00 179.25 179.30 3ihm h LEU 358 N 0.48 0.02 0.11 0.00 3.38 -1.24 0.30 115.31 118.35 3ihm h LEU 358 Ca 0.07 -0.01 -0.32 0.00 0.09 0.00 0.00 57.88 57.71 3ihm h LEU 358 Cb 0.67 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 3ihm h LEU 358 CO 0.05 0.58 -1.66 0.77 0.09 0.00 0.00 178.44 178.27 3ihm h SER 359 N 0.01 0.36 0.42 -0.43 4.64 -1.51 -3.39 113.55 113.66 3ihm h SER 359 Ca -0.01 -0.57 -0.30 0.00 -0.47 0.00 0.00 61.79 60.44 3ihm h SER 359 Cb 1.00 -0.12 -0.05 0.00 -0.31 0.00 0.00 62.40 62.92 3ihm h SER 359 CO 0.07 1.49 -1.76 0.00 -0.87 0.00 0.00 176.83 175.76 3ihm n ALA 360 N -2.73 1.39 -3.35 5.18 0.00 -0.54 -4.86 120.51 115.60 3ihm n ALA 360 Ca -0.20 -0.74 -0.13 0.00 0.00 0.00 0.00 53.44 52.37 3ihm n ALA 360 Cb 1.05 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.69 3ihm n ALA 360 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3ihm n LEU 361 N -3.11 -4.75 -4.76 0.00 4.77 0.11 -4.99 117.00 104.27 3ihm n LEU 361 Ca -0.20 -0.37 -0.31 0.00 -0.03 0.00 0.00 56.01 55.11 3ihm n LEU 361 Cb 1.05 -2.57 0.10 0.00 -2.33 0.00 0.00 43.42 39.67 3ihm n LEU 361 CO 0.45 -0.58 0.70 -2.84 -1.33 0.00 0.00 177.39 173.78 3ihm s PRO 362 N -3.67 2.11 0.26 3.23 0.02 -1.26 -4.86 135.00 130.83 3ihm s PRO 362 Ca 0.05 1.16 -0.05 0.00 0.02 0.00 0.00 61.00 62.18 3ihm s PRO 362 Cb -0.01 -1.88 0.31 0.00 0.02 0.00 0.00 34.50 32.94 3ihm s PRO 362 CO 0.82 -1.74 1.93 -1.00 -0.33 0.00 0.00 177.00 176.67 3ihm h PRO 363 N -1.20 1.27 0.00 5.54 0.13 -2.00 -2.18 132.00 133.56 3ihm h PRO 363 Ca -0.44 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 3ihm h PRO 363 Cb 1.24 -0.29 0.00 0.00 0.13 0.00 0.00 31.00 32.08 3ihm h PRO 363 CO 0.51 0.84 0.00 1.05 -0.23 0.00 0.00 178.00 180.17 3ihm h GLU 364 N 1.31 0.00 0.22 0.86 -0.00 -1.98 -2.40 114.58 112.58 3ihm h GLU 364 Ca 0.37 0.00 -0.33 0.00 -0.00 0.00 0.00 59.36 59.40 3ihm h GLU 364 Cb -0.10 0.00 0.02 0.00 -0.00 0.00 0.00 28.75 28.67 3ihm h GLU 364 CO -0.09 0.00 -1.57 0.35 -0.00 0.00 0.00 179.01 177.70 3ihm h PHE 365 N 0.00 0.83 -0.35 2.06 3.57 -1.78 -3.02 116.94 118.25 3ihm h PHE 365 Ca 0.00 -0.61 -0.11 0.00 3.53 0.00 0.00 57.97 60.78 3ihm h PHE 365 Cb 0.60 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.29 3ihm h PHE 365 CO 0.00 1.61 -0.23 -0.07 -2.23 0.00 0.00 178.31 177.39 3ihm h LEU 366 N 0.08 0.71 -0.86 0.59 3.38 -1.38 -1.52 115.31 116.31 3ihm h LEU 366 Ca -0.29 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 57.36 3ihm h LEU 366 Cb 2.10 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 42.63 3ihm h LEU 366 CO 0.22 0.92 0.11 0.00 0.09 0.00 0.00 178.44 179.78 3ihm h ALA 367 N 1.13 1.06 -0.20 1.53 0.00 -1.56 -2.01 119.26 119.22 3ihm h ALA 367 Ca 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3ihm h ALA 367 Cb 0.72 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3ihm h ALA 367 CO 0.06 0.61 0.08 0.35 0.00 0.00 0.00 179.25 180.35 3ihm h PHE 368 N 0.92 0.31 -0.91 0.00 3.57 -1.36 -2.55 116.94 116.91 3ihm h PHE 368 Ca 0.19 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.76 3ihm h PHE 368 Cb 0.38 -0.09 -0.08 0.00 2.79 0.00 0.00 35.95 38.95 3ihm h PHE 368 CO 0.02 0.35 0.55 -0.07 -2.23 0.00 0.00 178.31 176.94 3ihm h LEU 369 N 0.17 0.82 -0.17 0.59 4.07 -1.11 0.20 115.31 119.89 3ihm h LEU 369 Ca 0.07 0.04 -0.01 0.00 0.08 0.00 0.00 57.88 58.06 3ihm h LEU 369 Cb 0.18 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.78 3ihm h LEU 369 CO -0.01 0.47 0.06 1.56 -1.08 0.00 0.00 178.44 179.45 3ihm h GLN 370 N 0.93 0.26 -0.47 1.13 4.20 -1.23 -1.69 115.11 118.24 3ihm h GLN 370 Ca 0.43 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.98 3ihm h GLN 370 Cb 0.36 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 3ihm h GLN 370 CO -0.24 0.36 -0.16 0.82 -0.67 0.00 0.00 178.83 178.95 3ihm h ILE 371 N 0.11 1.27 -0.89 2.54 1.08 -1.20 -3.14 117.51 117.28 3ihm h ILE 371 Ca 0.06 -1.30 -0.02 0.00 -0.39 0.00 0.00 64.86 63.21 3ihm h ILE 371 Cb 0.21 1.14 -0.04 0.00 -3.07 0.00 0.00 36.82 35.05 3ihm h ILE 371 CO -0.00 0.45 0.48 0.25 -0.69 0.00 0.00 178.15 178.64 3ihm h LEU 372 N 0.77 1.12 -1.35 1.44 5.85 -0.90 -1.87 115.31 120.37 3ihm h LEU 372 Ca 0.11 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 3ihm h LEU 372 Cb 0.72 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 3ihm h LEU 372 CO 0.05 0.90 -0.03 0.77 -0.34 0.00 0.00 178.44 179.79 3ihm h SER 373 N 1.25 0.00 -0.01 1.25 4.64 -1.29 -3.14 113.55 116.25 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 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3ihm h SER 373 CO -0.05 0.03 -0.50 0.00 -0.87 0.00 0.00 176.83 175.44 3ihm n GLN 374 N -3.14 1.90 -4.04 4.77 1.13 -1.00 -4.84 117.38 112.16 3ihm n GLN 374 Ca 0.01 -0.41 -0.32 0.00 -1.94 0.00 0.00 57.00 54.34 3ihm n GLN 374 Cb 0.33 -1.23 -0.15 0.00 0.11 0.00 0.00 30.24 29.30 3ihm n GLN 374 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3ihm s SER 375 N -2.12 4.37 0.20 1.08 0.15 -0.74 -4.99 113.70 111.67 3ihm s SER 375 Ca 0.09 -1.43 -0.08 0.00 0.70 0.00 0.00 55.95 55.23 3ihm s SER 375 Cb 0.12 -1.49 0.14 0.00 -1.71 0.00 0.00 66.02 63.08 3ihm s SER 375 CO 0.50 -0.22 1.75 -0.09 1.20 0.00 0.00 173.24 176.38 3ihm h ARG 376 N 7.79 1.15 -0.98 5.44 9.65 -1.89 -0.95 114.38 134.59 3ihm h ARG 376 Ca -0.17 -0.23 0.03 0.00 -1.10 0.00 0.00 59.98 58.51 3ihm h ARG 376 Cb 1.04 -0.17 -0.06 0.00 -1.39 0.00 0.00 29.97 29.39 3ihm h ARG 376 CO 0.46 0.96 0.64 0.93 2.80 0.00 0.00 179.97 185.76 3ihm h GLU 377 N 1.10 1.22 -0.23 0.20 3.07 -1.94 0.44 114.58 118.44 3ihm h GLU 377 Ca 0.25 -0.07 -0.18 0.00 -0.50 0.00 0.00 59.36 58.85 3ihm h GLU 377 Cb 0.27 -0.27 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3ihm h GLU 377 CO -0.01 0.80 -0.55 1.98 -1.40 0.00 0.00 179.01 179.83 3ihm h MET 378 N 1.25 0.78 -0.88 2.33 4.05 -1.85 -2.30 114.93 118.32 3ihm h MET 378 Ca 0.39 -0.53 -0.02 0.00 -0.28 0.00 0.00 59.70 59.26 3ihm h MET 378 Cb -0.02 0.08 -0.04 0.00 -0.80 0.00 0.00 31.60 30.82 3ihm h MET 378 CO -0.11 1.16 0.48 0.00 0.23 0.00 0.00 176.91 178.67 3ihm h ALA 379 N 0.62 1.12 -0.40 0.39 0.00 -0.51 0.36 119.26 120.84 3ihm h ALA 379 Ca -0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 3ihm h ALA 379 Cb 1.17 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 3ihm h ALA 379 CO 0.12 0.63 0.12 -0.44 0.00 0.00 0.00 179.25 179.68 3ihm h ASP 380 N 1.22 0.59 -0.23 0.00 3.32 -0.14 -0.79 116.42 120.39 3ihm h ASP 380 Ca 0.31 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 3ihm h ASP 380 Cb 0.02 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 3ihm h ASP 380 CO -0.05 0.65 0.07 -0.08 -1.72 0.00 0.00 179.24 178.10 3ihm h GLU 381 N 0.51 0.36 -0.53 3.56 4.81 -1.16 -1.68 114.58 120.44 3ihm h GLU 381 Ca 0.13 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 3ihm h GLU 381 Cb 0.27 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 3ihm h GLU 381 CO -0.00 0.46 0.29 0.35 -0.73 0.00 0.00 179.01 179.37 3ihm h PHE 382 N 0.20 0.73 0.42 0.92 3.57 -0.89 -1.55 116.94 120.34 3ihm h PHE 382 Ca 0.07 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 3ihm h PHE 382 Cb 0.25 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.76 3ihm h PHE 382 CO 0.01 0.54 -0.20 1.15 -2.23 0.00 0.00 178.31 177.57 3ihm h THR 383 N 0.71 0.58 -0.16 4.41 2.02 -1.09 -3.03 112.91 116.34 3ihm h THR 383 Ca 0.19 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 3ihm h THR 383 Cb 0.05 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 3ihm h THR 383 CO -0.03 0.04 0.05 -0.78 0.37 0.00 0.00 175.52 175.16 3ihm h ASP 384 N -0.67 0.20 0.03 4.18 3.58 -1.28 -2.10 116.42 120.36 3ihm h ASP 384 Ca -0.06 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.38 3ihm h ASP 384 Cb 0.49 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.49 3ihm h ASP 384 CO 0.10 0.20 0.00 0.59 -2.88 0.00 0.00 179.24 177.25 3ihm n ASN 385 N -4.45 0.00 0.29 2.28 3.02 -0.59 -1.42 115.26 114.39 3ihm n ASN 385 Ca -0.01 -0.48 0.15 0.00 -0.03 0.00 0.00 54.58 54.22 3ihm n ASN 385 Cb 0.13 -0.03 0.86 0.00 -0.61 0.00 0.00 39.78 40.13 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 -1.41 -0.65 116.94 118.02 3ihm h PHE 386 Ca 0.00 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.72 3ihm h PHE 386 Cb 0.02 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 3ihm h PHE 386 CO 0.00 0.05 -0.24 -0.91 -0.60 0.00 0.00 178.31 176.62 3ihm h ASN 387 N 0.00 0.00 -2.71 2.17 2.35 -1.47 -3.40 115.58 112.52 3ihm h ASN 387 Ca -0.00 0.00 -0.60 0.00 -0.55 0.00 0.00 56.30 55.15 3ihm h ASN 387 Cb 0.16 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 38.13 3ihm h ASN 387 CO 0.01 0.24 -0.79 -0.31 -1.65 0.00 0.00 177.43 174.93 3ihm s TYR 388 N -3.71 2.26 0.42 1.19 2.02 -0.25 -4.96 117.35 114.32 3ihm s TYR 388 Ca 0.00 -2.80 0.14 0.00 -0.37 0.00 0.00 57.07 54.03 3ihm s TYR 388 Cb 0.11 -1.76 1.00 0.00 -0.40 0.00 0.00 41.96 40.91 3ihm s TYR 388 CO 0.64 -0.69 1.95 -1.35 -1.57 0.00 0.00 175.55 174.53 3ihm h PRO 389 N 5.53 0.44 -0.27 -1.71 0.11 -1.79 -0.89 132.00 133.42 3ihm h PRO 389 Ca 0.21 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.25 3ihm h PRO 389 Cb 0.84 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.83 3ihm h PRO 389 CO 0.53 0.29 -0.04 1.05 -0.21 0.00 0.00 178.00 179.63 3ihm h GLU 390 N 0.45 0.42 -0.09 1.05 9.09 -1.85 -1.39 114.58 122.26 3ihm h GLU 390 Ca 0.32 -0.09 -0.16 0.00 0.05 0.00 0.00 59.36 59.48 3ihm h GLU 390 Cb 0.63 -0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 27.66 3ihm h GLU 390 CO -0.10 0.48 -0.63 0.00 0.05 0.00 0.00 179.01 178.81 3ihm h ARG 391 N 0.40 0.34 -0.53 1.06 3.08 -1.50 -2.43 114.38 114.80 3ihm h ARG 391 Ca 0.09 -0.24 -0.09 0.00 0.07 0.00 0.00 59.98 59.80 3ihm h ARG 391 Cb 0.33 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 3ihm h ARG 391 CO 0.01 0.86 -0.04 1.96 -1.07 0.00 0.00 179.97 181.69 3ihm h GLN 392 N 0.25 0.95 0.00 0.04 1.08 -1.13 -2.91 115.11 113.40 3ihm h GLN 392 Ca -0.01 -0.32 -0.07 0.00 -1.45 0.00 0.00 58.65 56.79 3ihm h GLN 392 Cb 1.16 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 28.50 3ihm h GLN 392 CO 0.10 0.99 -0.35 2.35 -0.95 0.00 0.00 178.83 180.97 3ihm h TRP 393 N 0.82 0.00 0.00 2.96 -0.00 -1.24 -0.48 115.95 118.02 3ihm h TRP 393 Ca 0.14 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 59.03 3ihm h TRP 393 Cb 0.58 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.74 3ihm h TRP 393 CO 0.04 0.35 -0.04 -0.44 -0.00 0.00 0.00 178.44 178.36 3ihm h ASP 394 N 0.00 0.00 0.10 2.65 3.32 -1.24 -1.61 116.42 119.64 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 0.78 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.30 3ihm h ASP 394 CO 0.05 0.04 -2.00 0.54 -1.72 0.00 0.00 179.24 176.15 3ihm n ARG 395 N -3.95 0.73 0.00 3.56 5.12 -0.58 -4.63 116.66 116.90 3ihm n ARG 395 Ca -0.03 0.28 0.10 0.00 -1.93 0.00 0.00 57.85 56.28 3ihm n ARG 395 Cb 0.13 -1.69 -0.05 0.00 -1.16 0.00 0.00 32.46 29.69 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 -3.56 0.00 0.27 -1.55 3.72 -0.29 -2.02 117.46 114.03 3ihm n PHE 396 Ca -0.34 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.19 3ihm n PHE 396 Cb 1.01 -0.06 0.78 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 -5.03 4.37 4.64 -1.54 -3.43 113.55 112.56 3ihm h SER 397 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 3ihm h SER 397 Cb 0.51 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 62.41 3ihm h SER 397 CO 0.00 0.08 -0.51 -0.94 -0.87 0.00 0.00 176.83 174.59 3ihm s SER 398 N -6.26 0.10 0.39 4.97 1.04 -1.26 -5.05 113.70 107.62 3ihm s SER 398 Ca -0.04 -0.36 0.09 0.00 0.48 0.00 0.00 55.95 56.13 3ihm s SER 398 Cb 0.14 0.21 0.87 0.00 0.10 0.00 0.00 66.02 67.34 3ihm s SER 398 CO 0.58 -0.43 1.97 -0.65 0.98 0.00 0.00 173.24 175.68 3ihm h PRO 399 N 4.00 0.58 -0.77 4.02 0.11 -1.92 -1.84 132.00 136.19 3ihm h PRO 399 Ca -0.32 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.74 3ihm h PRO 399 Cb 1.19 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 3ihm h PRO 399 CO 0.45 0.39 0.41 1.49 -0.21 0.00 0.00 178.00 180.53 3ihm h GLU 400 N 0.60 1.08 -0.19 1.05 4.81 -1.96 -0.24 114.58 119.73 3ihm h GLU 400 Ca 0.30 -0.13 -0.14 0.00 -0.13 0.00 0.00 59.36 59.26 3ihm h GLU 400 Cb 0.39 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 3ihm h GLU 400 CO -0.10 0.81 -0.47 0.00 -0.73 0.00 0.00 179.01 178.52 3ihm h ARG 401 N 1.07 0.49 -0.30 1.92 3.08 -1.62 -1.09 114.38 117.93 3ihm h ARG 401 Ca 0.27 -0.27 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 3ihm h ARG 401 Cb 0.05 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 3ihm h ARG 401 CO -0.04 0.86 0.05 0.82 -1.07 0.00 0.00 179.97 180.59 3ihm h ILE 402 N 0.39 1.23 -0.59 2.04 2.04 -0.74 -2.57 117.51 119.31 3ihm h ILE 402 Ca 0.02 -0.79 -0.07 0.00 1.00 0.00 0.00 64.86 65.02 3ihm h ILE 402 Cb 0.98 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 38.21 3ihm h ILE 402 CO 0.09 0.26 0.08 1.23 0.00 0.00 0.00 178.15 179.81 3ihm h GLY 403 N 0.31 1.03 1.02 5.37 0.00 -0.92 -1.66 103.07 108.21 3ihm h GLY 403 Ca 0.09 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.70 3ihm h GLY 403 CO 0.00 0.62 0.17 -1.61 0.00 0.00 0.00 176.54 175.72 3ihm h GLN 404 N 0.90 0.96 -0.70 4.80 4.15 -1.20 -1.33 115.11 122.69 3ihm h GLN 404 Ca 0.18 -0.22 -0.07 0.00 0.77 0.00 0.00 58.65 59.31 3ihm h GLN 404 Cb 0.41 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.94 3ihm h GLN 404 CO 0.01 0.87 0.15 2.35 -1.93 0.00 0.00 178.83 180.28 3ihm h TRP 405 N 0.88 1.20 -0.39 3.99 7.01 -1.27 -2.77 115.95 124.59 3ihm h TRP 405 Ca 0.19 -0.15 -0.08 0.00 2.11 0.00 0.00 58.89 60.96 3ihm h TRP 405 Cb 0.33 -0.33 -0.02 0.00 -2.10 0.00 0.00 29.16 27.03 3ihm h TRP 405 CO 0.02 0.98 -0.10 0.00 -2.79 0.00 0.00 178.44 176.55 3ihm h SER 407 N 0.62 0.00 0.46 0.00 4.64 -1.00 -0.77 113.55 117.50 3ihm h SER 407 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3ihm h SER 407 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 3ihm h SER 407 CO 0.03 0.56 -0.05 0.00 -0.87 0.00 0.00 176.83 176.50 3ihm n GLN 408 N -3.87 0.55 -0.00 4.77 10.64 -1.07 -3.65 117.38 124.75 3ihm n GLN 408 Ca -0.01 -0.09 0.01 0.00 -1.83 0.00 0.00 57.00 55.07 3ihm n GLN 408 Cb 0.57 -1.50 -0.01 0.00 -0.86 0.00 0.00 30.24 28.44 3ihm n GLN 408 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 3ihm n PHE 409 N -1.15 0.00 1.83 2.61 3.72 -1.08 -5.12 117.46 118.27 3ihm n PHE 409 Ca 0.15 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.70 3ihm n PHE 409 Cb 0.25 -0.02 0.81 0.00 -0.94 0.00 0.00 39.48 39.58 3ihm n PHE 409 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71