#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ovm n PRO 4 N 0.00 1.42 -1.75 -0.78 -0.02 -1.26 -4.88 135.00 127.72 1ovm n PRO 4 Ca 0.00 0.53 -0.42 0.00 -2.02 0.00 0.00 63.50 61.59 1ovm n PRO 4 Cb 0.00 -2.40 -0.03 0.00 -0.02 0.00 0.00 33.50 31.05 1ovm n PRO 4 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1ovm s TYR 5 N -1.35 2.44 0.37 6.00 5.04 -1.26 -4.99 117.35 123.60 1ovm s TYR 5 Ca 0.72 0.15 0.05 0.00 -2.44 0.00 0.00 57.07 55.55 1ovm s TYR 5 Cb -0.43 -4.13 -0.03 0.00 0.35 0.00 0.00 41.96 37.72 1ovm s TYR 5 CO 0.49 -4.53 0.18 0.00 -1.34 0.00 0.00 175.55 170.35 1ovm h VAL 7 N 1.97 0.51 -0.73 0.00 2.07 -0.94 0.26 116.25 119.39 1ovm h VAL 7 Ca -0.32 -0.14 0.10 0.00 0.82 0.00 0.00 66.70 67.17 1ovm h VAL 7 Cb 1.26 0.08 -0.08 0.00 -1.52 0.00 0.00 31.29 31.03 1ovm h VAL 7 CO 0.50 0.07 0.35 0.00 0.02 0.00 0.00 177.57 178.51 1ovm h ALA 8 N 1.67 1.01 -0.52 1.67 0.00 -1.69 -0.48 119.26 120.92 1ovm h ALA 8 Ca 0.52 0.07 -0.12 0.00 0.00 0.00 0.00 54.91 55.38 1ovm h ALA 8 Cb 0.94 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1ovm h ALA 8 CO -0.51 -0.07 -0.14 -0.44 0.00 0.00 0.00 179.25 178.09 1ovm h ASP 9 N 0.58 1.02 -0.34 0.00 3.32 -0.83 -2.35 116.42 117.82 1ovm h ASP 9 Ca 0.37 -0.35 0.01 0.00 0.02 0.00 0.00 57.03 57.08 1ovm h ASP 9 Cb 0.43 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1ovm h ASP 9 CO -0.30 1.15 0.20 0.22 -1.72 0.00 0.00 179.24 178.80 1ovm h TYR 10 N 0.89 0.38 -0.17 4.55 5.03 -0.25 -0.67 116.97 126.74 1ovm h TYR 10 Ca 0.13 0.01 0.03 0.00 2.58 0.00 0.00 58.73 61.48 1ovm h TYR 10 Cb 0.71 -0.12 -0.03 0.00 1.55 0.00 0.00 36.73 38.85 1ovm h TYR 10 CO 0.05 0.23 0.01 1.25 -1.32 0.00 0.00 178.16 178.37 1ovm h LEU 11 N 0.41 -0.05 -0.66 2.82 5.85 -0.98 -1.44 115.31 121.27 1ovm h LEU 11 Ca 0.13 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.92 1ovm h LEU 11 Cb -0.01 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1ovm h LEU 11 CO -0.06 -0.00 0.40 -0.07 -0.34 0.00 0.00 178.44 178.37 1ovm h LEU 12 N 0.06 0.64 -1.09 2.25 -0.00 -1.08 -1.07 115.31 115.03 1ovm h LEU 12 Ca 0.08 0.01 0.03 0.00 -0.00 0.00 0.00 57.88 58.00 1ovm h LEU 12 Cb 0.09 -0.13 -0.05 0.00 -0.00 0.00 0.00 40.66 40.57 1ovm h LEU 12 CO -0.13 0.44 0.62 0.44 -0.00 0.00 0.00 178.44 179.81 1ovm h ASP 13 N 0.77 1.02 0.07 -0.43 3.32 -0.56 -1.21 116.42 119.41 1ovm h ASP 13 Ca 0.27 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 57.20 1ovm h ASP 13 Cb 0.05 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 1ovm h ASP 13 CO -0.12 0.70 -0.36 0.03 -1.72 0.00 0.00 179.24 177.78 1ovm h ARG 14 N 1.18 0.40 -0.02 3.56 2.47 -0.63 -1.53 114.38 119.82 1ovm h ARG 14 Ca 0.37 -0.18 0.00 0.00 -1.26 0.00 0.00 59.98 58.91 1ovm h ARG 14 Cb 0.00 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.31 1ovm h ARG 14 CO -0.11 0.71 0.01 -0.07 0.56 0.00 0.00 179.97 181.07 1ovm h LEU 15 N 0.34 0.01 -0.78 3.04 4.07 -0.06 -1.47 115.31 120.47 1ovm h LEU 15 Ca 0.04 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.99 1ovm h LEU 15 Cb 0.79 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.50 1ovm h LEU 15 CO 0.06 0.01 0.43 0.71 -1.08 0.00 0.00 178.44 178.57 1ovm h THR 16 N 0.02 1.23 -0.55 0.22 1.35 -1.17 -1.26 112.91 112.75 1ovm h THR 16 Ca 0.01 -0.57 0.11 0.00 -0.55 0.00 0.00 66.41 65.41 1ovm h THR 16 Cb 0.01 0.19 -0.03 0.00 -1.73 0.00 0.00 68.15 66.59 1ovm h THR 16 CO -0.01 0.26 0.37 0.44 -0.25 0.00 0.00 175.52 176.33 1ovm h ASP 17 N 1.08 0.24 0.59 5.36 3.32 -0.73 0.38 116.42 126.65 1ovm h ASP 17 Ca 0.27 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.33 1ovm h ASP 17 Cb 0.03 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1ovm h ASP 17 CO -0.04 0.14 -0.09 0.00 -1.72 0.00 0.00 179.24 177.53 1ovm n GLY 19 N 1.36 0.91 3.81 0.00 0.00 0.12 -4.64 105.19 106.76 1ovm n GLY 19 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 1ovm n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ovm s ALA 20 N -2.00 3.68 0.00 4.61 0.00 -0.98 -4.80 121.76 122.27 1ovm s ALA 20 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 51.67 1ovm s ALA 20 Cb 0.00 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 20.75 1ovm s ALA 20 CO 0.00 0.39 0.44 -0.25 0.00 0.00 0.00 175.76 176.34 1ovm n ASP 21 N 2.28 0.88 -4.12 0.00 8.00 -1.26 -3.82 116.55 118.50 1ovm n ASP 21 Ca -0.14 -0.97 -0.09 0.00 0.71 0.00 0.00 54.79 54.31 1ovm n ASP 21 Cb 0.52 0.05 -0.10 0.00 -0.02 0.00 0.00 41.12 41.57 1ovm n ASP 21 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1ovm s HIS 22 N -0.05 0.67 -0.09 1.24 3.76 -1.26 -0.36 115.29 119.20 1ovm s HIS 22 Ca 0.00 -0.96 -0.01 0.00 -0.15 0.00 0.00 55.06 53.94 1ovm s HIS 22 Cb 0.00 -0.43 0.03 0.00 1.11 0.00 0.00 32.58 33.28 1ovm s HIS 22 CO 0.00 -0.26 -0.04 -1.17 -0.85 0.00 0.00 174.74 172.41 1ovm s LEU 23 N -2.86 0.95 0.20 0.89 2.96 0.24 -4.45 118.68 116.61 1ovm s LEU 23 Ca 0.07 -0.21 0.00 0.00 -0.22 0.00 0.00 54.13 53.78 1ovm s LEU 23 Cb 0.05 -0.66 -0.04 0.00 0.50 0.00 0.00 46.19 46.04 1ovm s LEU 23 CO -0.07 -0.15 0.38 -0.36 -1.32 0.00 0.00 176.35 174.84 1ovm s PHE 24 N 1.78 3.48 -5.00 5.38 0.08 -1.01 -0.36 117.98 122.33 1ovm s PHE 24 Ca 0.04 0.29 0.00 0.00 0.12 0.00 0.00 56.93 57.38 1ovm s PHE 24 Cb -0.13 -1.81 0.00 0.00 -0.57 0.00 0.00 43.02 40.52 1ovm s PHE 24 CO -0.07 0.39 0.00 0.41 -0.10 0.00 0.00 175.22 175.85 1ovm n GLY 25 N -0.75 -0.65 2.85 4.36 0.00 -1.11 0.46 105.19 110.35 1ovm n GLY 25 Ca -0.05 -1.51 -0.16 0.00 0.00 0.00 0.00 46.02 44.30 1ovm n GLY 25 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ovm s VAL 26 N -2.40 0.17 1.03 1.61 -7.23 -1.13 -1.32 120.40 111.12 1ovm s VAL 26 Ca 0.00 0.02 -0.13 0.00 -1.81 0.00 0.00 61.98 60.06 1ovm s VAL 26 Cb 0.00 -0.22 0.15 0.00 0.56 0.00 0.00 36.38 36.87 1ovm s VAL 26 CO 0.00 0.10 0.73 -0.81 -0.31 0.00 0.00 175.10 174.81 1ovm n PRO 27 N 3.68 -1.11 -3.58 4.82 -0.04 -1.26 -4.45 135.00 133.06 1ovm n PRO 27 Ca -0.21 -0.28 -0.11 0.00 -0.04 0.00 0.00 63.50 62.86 1ovm n PRO 27 Cb 0.54 -2.08 -0.05 0.00 -0.04 0.00 0.00 33.50 31.87 1ovm n PRO 27 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1ovm s GLY 28 N -2.28 -0.29 0.19 0.55 0.00 -1.26 -4.85 107.32 99.38 1ovm s GLY 28 Ca 0.63 2.01 -0.08 0.00 0.00 0.00 0.00 44.72 47.28 1ovm s GLY 28 CO 0.64 1.08 1.11 1.34 0.00 0.00 0.00 173.10 177.26 1ovm n ASP 29 N 0.85 -0.33 0.00 1.64 2.03 -1.26 -0.31 116.55 119.17 1ovm n ASP 29 Ca -0.11 1.23 0.13 0.00 0.52 0.00 0.00 54.79 56.55 1ovm n ASP 29 Cb 0.58 -0.34 0.74 0.00 -0.72 0.00 0.00 41.12 41.38 1ovm n ASP 29 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 1ovm n TYR 30 N -5.12 0.00 -0.39 -0.67 4.01 -1.26 -3.69 117.16 110.05 1ovm n TYR 30 Ca 0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.84 1ovm n TYR 30 Cb 0.33 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.33 1ovm n TYR 30 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1ovm n ASN 31 N -1.03 0.82 -0.06 7.72 0.23 0.58 -3.95 115.26 119.56 1ovm n ASN 31 Ca 0.18 -1.21 -0.08 0.00 -0.53 0.00 0.00 54.58 52.95 1ovm n ASN 31 Cb 0.10 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 37.79 1ovm n ASN 31 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 1ovm h LEU 32 N 0.00 0.01 -1.11 -4.53 4.07 -1.57 -0.14 115.31 112.04 1ovm h LEU 32 Ca 0.00 0.04 -0.05 0.00 0.08 0.00 0.00 57.88 57.95 1ovm h LEU 32 Cb 0.36 0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.13 1ovm h LEU 32 CO 0.00 0.04 0.10 1.56 -1.08 0.00 0.00 178.44 179.06 1ovm h GLN 33 N 0.14 0.73 -0.51 1.13 4.20 -1.88 -1.69 115.11 117.23 1ovm h GLN 33 Ca 0.12 -0.14 -0.10 0.00 0.06 0.00 0.00 58.65 58.58 1ovm h GLN 33 Cb 0.12 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 1ovm h GLN 33 CO -0.16 0.67 -0.09 0.35 -0.67 0.00 0.00 178.83 178.93 1ovm h PHE 34 N 0.70 1.04 -0.72 2.96 3.57 -1.81 -2.87 116.94 119.81 1ovm h PHE 34 Ca 0.16 -0.20 0.10 0.00 3.53 0.00 0.00 57.97 61.55 1ovm h PHE 34 Cb 0.29 -0.26 -0.05 0.00 2.79 0.00 0.00 35.95 38.71 1ovm h PHE 34 CO 0.01 0.98 0.48 -0.07 -2.23 0.00 0.00 178.31 177.48 1ovm h LEU 35 N 0.85 0.54 -0.68 0.59 4.07 -0.10 -1.49 115.31 119.08 1ovm h LEU 35 Ca 0.14 0.01 0.07 0.00 0.08 0.00 0.00 57.88 58.18 1ovm h LEU 35 Cb 0.63 -0.10 -0.06 0.00 1.08 0.00 0.00 40.66 42.21 1ovm h LEU 35 CO 0.04 0.32 0.37 0.44 -1.08 0.00 0.00 178.44 178.53 1ovm h ASP 36 N 0.59 0.52 -0.80 -0.43 3.32 -1.23 -1.32 116.42 117.08 1ovm h ASP 36 Ca 0.33 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.41 1ovm h ASP 36 Cb 0.51 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.97 1ovm h ASP 36 CO -0.12 0.32 0.44 0.45 -1.72 0.00 0.00 179.24 178.62 1ovm h HIS 37 N 0.66 1.09 -0.14 4.55 3.86 -1.37 -0.08 115.15 123.72 1ovm h HIS 37 Ca 0.32 -0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.40 1ovm h HIS 37 Cb 0.25 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.36 1ovm h HIS 37 CO -0.09 0.76 -0.37 -0.24 0.86 0.00 0.00 177.93 178.85 1ovm h VAL 38 N 1.10 1.29 -0.23 2.45 3.04 -1.28 0.86 116.25 123.49 1ovm h VAL 38 Ca 0.28 -1.44 -0.17 0.00 -1.01 0.00 0.00 66.70 64.36 1ovm h VAL 38 Cb 0.03 1.60 -0.00 0.00 -2.01 0.00 0.00 31.29 30.90 1ovm h VAL 38 CO -0.05 0.44 -0.53 0.40 -1.01 0.00 0.00 177.57 176.82 1ovm h ILE 39 N 0.25 1.30 0.00 3.17 2.04 -0.76 -2.97 117.51 120.55 1ovm h ILE 39 Ca 0.03 -1.74 0.00 0.00 1.00 0.00 0.00 64.86 64.14 1ovm h ILE 39 Cb 0.77 1.69 0.00 0.00 -0.74 0.00 0.00 36.82 38.54 1ovm h ILE 39 CO 0.06 0.55 0.00 0.44 0.00 0.00 0.00 178.15 179.20 1ovm h ASP 40 N 0.52 0.00 -3.71 1.72 3.32 -0.67 -3.45 116.42 114.15 1ovm h ASP 40 Ca 0.02 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.54 1ovm h ASP 40 Cb 1.09 0.00 0.06 0.00 0.22 0.00 0.00 39.33 40.69 1ovm h ASP 40 CO 0.11 0.00 0.65 -0.55 -1.72 0.00 0.00 179.24 177.73 1ovm s SER 41 N -5.59 6.80 0.00 6.45 0.15 0.27 -4.90 113.70 116.88 1ovm s SER 41 Ca 0.07 2.61 0.26 0.00 0.70 0.00 0.00 55.95 59.59 1ovm s SER 41 Cb 0.08 -2.64 0.70 0.00 -1.71 0.00 0.00 66.02 62.45 1ovm s SER 41 CO 0.61 -0.54 1.53 -0.81 1.20 0.00 0.00 173.24 175.24 1ovm n PRO 42 N 1.38 0.88 -0.00 5.44 -0.04 -1.26 -4.13 135.00 137.26 1ovm n PRO 42 Ca 0.02 -0.54 0.07 0.00 -0.04 0.00 0.00 63.50 63.01 1ovm n PRO 42 Cb 0.42 -1.49 -0.10 0.00 -0.04 0.00 0.00 33.50 32.29 1ovm n PRO 42 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1ovm n ASP 43 N -0.59 1.68 -4.21 3.54 8.00 -1.26 -4.96 116.55 118.75 1ovm n ASP 43 Ca 0.12 -0.18 -0.32 0.00 0.71 0.00 0.00 54.79 55.12 1ovm n ASP 43 Cb 0.36 1.47 -0.17 0.00 -0.02 0.00 0.00 41.12 42.76 1ovm n ASP 43 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ovm s ILE 44 N -2.76 2.08 -0.19 0.53 -1.09 -1.26 -4.57 121.20 113.95 1ovm s ILE 44 Ca -0.03 -1.00 -0.07 0.00 -2.23 0.00 0.00 60.65 57.32 1ovm s ILE 44 Cb 0.09 -1.80 -0.04 0.00 -1.58 0.00 0.00 42.46 39.12 1ovm s ILE 44 CO 0.54 0.56 0.06 0.00 -1.23 0.00 0.00 174.94 174.87 1ovm s TRP 46 N 0.47 3.74 -0.37 0.00 -0.11 -1.26 -0.60 118.94 120.81 1ovm s TRP 46 Ca 0.03 1.73 0.02 0.00 1.22 0.00 0.00 56.10 59.10 1ovm s TRP 46 Cb -0.13 -3.11 0.11 0.00 -1.50 0.00 0.00 33.47 28.84 1ovm s TRP 46 CO 0.01 -0.01 0.14 0.08 -4.62 0.00 0.00 176.95 172.54 1ovm s VAL 47 N 0.17 1.56 0.24 5.86 1.01 0.51 -4.90 120.40 124.86 1ovm s VAL 47 Ca 0.49 -2.15 -0.30 0.00 0.00 0.00 0.00 61.98 60.02 1ovm s VAL 47 Cb -0.24 -2.14 -0.09 0.00 0.00 0.00 0.00 36.38 33.91 1ovm s VAL 47 CO 0.30 -0.73 1.04 -0.83 0.00 0.00 0.00 175.10 174.89 1ovm s GLY 48 N 0.90 3.04 0.43 4.51 0.00 -1.26 -2.77 107.32 112.17 1ovm s GLY 48 Ca 0.13 0.78 0.07 0.00 0.00 0.00 0.00 44.72 45.70 1ovm s GLY 48 CO -0.11 1.43 0.19 0.00 0.00 0.00 0.00 173.10 174.60 1ovm h ALA 50 N 1.37 0.59 -2.65 0.00 0.00 -1.90 -3.45 119.26 113.24 1ovm h ALA 50 Ca -0.42 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.16 1ovm h ALA 50 Cb 1.26 -0.17 -0.12 0.00 0.00 0.00 0.00 17.79 18.76 1ovm h ALA 50 CO 0.69 0.33 -0.29 0.54 0.00 0.00 0.00 179.25 180.52 1ovm s ASN 51 N -6.17 0.02 0.49 0.00 2.20 -1.26 -5.06 114.94 105.16 1ovm s ASN 51 Ca -0.13 -0.81 0.30 0.00 -0.94 0.00 0.00 52.86 51.28 1ovm s ASN 51 Cb 0.11 0.44 1.11 0.00 -2.00 0.00 0.00 41.25 40.90 1ovm s ASN 51 CO 0.79 -0.89 1.88 1.05 -2.94 0.00 0.00 177.10 176.99 1ovm h GLU 52 N 2.53 0.00 -0.06 3.55 9.09 -1.89 -2.03 114.58 125.77 1ovm h GLU 52 Ca -0.32 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.08 1ovm h GLU 52 Cb 1.23 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.33 1ovm h GLU 52 CO 0.48 0.00 -0.02 1.25 0.05 0.00 0.00 179.01 180.77 1ovm h LEU 53 N 0.00 0.12 -0.67 3.06 6.46 -1.91 -0.90 115.31 121.47 1ovm h LEU 53 Ca 0.00 -0.39 0.02 0.00 -0.12 0.00 0.00 57.88 57.40 1ovm h LEU 53 Cb 0.60 -0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.46 1ovm h LEU 53 CO 0.00 0.48 0.43 0.78 -0.62 0.00 0.00 178.44 179.50 1ovm h ASN 54 N -0.24 0.71 -0.43 1.25 -0.26 -1.87 -1.31 115.58 113.42 1ovm h ASN 54 Ca 0.01 -0.01 0.06 0.00 -0.56 0.00 0.00 56.30 55.81 1ovm h ASN 54 Cb 0.43 -0.16 -0.05 0.00 -1.06 0.00 0.00 38.32 37.47 1ovm h ASN 54 CO 0.01 0.50 0.14 0.00 -1.06 0.00 0.00 177.43 177.02 1ovm h ALA 55 N 1.28 0.51 -0.59 -0.83 0.00 -1.18 0.20 119.26 118.64 1ovm h ALA 55 Ca 0.26 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 1ovm h ALA 55 Cb -0.02 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1ovm h ALA 55 CO -0.09 -0.26 0.19 0.66 0.00 0.00 0.00 179.25 179.75 1ovm h SER 56 N 0.30 0.82 -0.50 0.00 4.64 -0.62 0.38 113.55 118.57 1ovm h SER 56 Ca 0.21 -0.13 -0.07 0.00 -0.47 0.00 0.00 61.79 61.32 1ovm h SER 56 Cb 0.21 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1ovm h SER 56 CO -0.22 0.77 0.04 1.88 -0.87 0.00 0.00 176.83 178.43 1ovm h TYR 57 N 0.86 0.92 -0.47 4.77 0.05 -0.09 -1.44 116.97 121.58 1ovm h TYR 57 Ca 0.20 -0.14 0.01 0.00 0.05 0.00 0.00 58.73 58.84 1ovm h TYR 57 Cb 0.25 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 1ovm h TYR 57 CO 0.02 0.85 0.31 0.00 -1.05 0.00 0.00 178.16 178.28 1ovm h ALA 58 N 0.95 0.60 -0.84 3.88 0.00 -0.14 -0.77 119.26 122.93 1ovm h ALA 58 Ca 0.15 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1ovm h ALA 58 Cb 0.46 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1ovm h ALA 58 CO 0.02 0.03 0.44 0.00 0.00 0.00 0.00 179.25 179.74 1ovm h ALA 59 N 1.18 1.18 -0.06 0.00 0.00 -0.76 0.13 119.26 120.92 1ovm h ALA 59 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ovm h ALA 59 Cb -0.06 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.39 1ovm h ALA 59 CO -0.05 0.64 0.04 0.22 0.00 0.00 0.00 179.25 180.11 1ovm h ASP 60 N 1.19 0.07 -0.93 0.00 1.82 -0.64 0.67 116.42 118.61 1ovm h ASP 60 Ca 0.29 -0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.93 1ovm h ASP 60 Cb 0.07 -0.02 -0.05 0.00 0.68 0.00 0.00 39.33 40.02 1ovm h ASP 60 CO -0.04 0.05 0.57 1.23 -1.61 0.00 0.00 179.24 179.44 1ovm h GLY 61 N 0.08 1.35 0.98 -0.78 0.00 -0.66 -1.16 103.07 102.88 1ovm h GLY 61 Ca 0.02 -0.55 -0.00 0.00 0.00 0.00 0.00 47.33 46.80 1ovm h GLY 61 CO -0.00 0.54 0.24 -1.82 0.00 0.00 0.00 176.54 175.49 1ovm h TYR 62 N 1.28 0.53 0.00 5.60 5.03 -0.37 -2.23 116.97 126.81 1ovm h TYR 62 Ca 0.33 -0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.61 1ovm h TYR 62 Cb -0.07 -0.17 -0.01 0.00 1.55 0.00 0.00 36.73 38.04 1ovm h TYR 62 CO 0.00 0.38 -0.17 0.00 -1.32 0.00 0.00 178.16 177.06 1ovm h ALA 63 N 1.10 1.39 0.00 1.82 0.00 -0.26 0.11 119.26 123.42 1ovm h ALA 63 Ca 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ovm h ALA 63 Cb 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1ovm h ALA 63 CO -0.03 0.21 0.00 0.54 0.00 0.00 0.00 179.25 179.97 1ovm n ARG 64 N -3.85 0.23 -0.07 0.00 1.74 -0.50 0.10 116.66 114.32 1ovm n ARG 64 Ca -0.02 0.09 -0.10 0.00 -0.77 0.00 0.00 57.85 57.05 1ovm n ARG 64 Cb 0.27 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.14 1ovm n ARG 64 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ovm n LYS 66 N -3.01 1.49 -0.85 0.00 5.02 -0.12 -4.98 118.16 115.70 1ovm n LYS 66 Ca -0.25 -1.59 0.00 0.00 -2.02 0.00 0.00 58.31 54.45 1ovm n LYS 66 Cb 0.75 -1.32 0.00 0.00 -0.02 0.00 0.00 35.03 34.44 1ovm n LYS 66 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ovm n GLY 67 N 0.91 1.28 3.59 0.72 0.00 0.11 -4.90 105.19 106.89 1ovm n GLY 67 Ca 0.11 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 1ovm n GLY 67 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ovm s PHE 68 N -3.82 -0.46 0.17 1.61 2.19 -1.23 -4.69 117.98 111.75 1ovm s PHE 68 Ca 0.00 0.91 -0.15 0.00 0.33 0.00 0.00 56.93 58.02 1ovm s PHE 68 Cb 0.00 0.41 0.02 0.00 -1.31 0.00 0.00 43.02 42.14 1ovm s PHE 68 CO 0.00 -0.36 0.43 0.00 1.83 0.00 0.00 175.22 177.12 1ovm s ALA 69 N -0.72 -0.73 0.01 11.12 0.00 -0.92 -4.23 121.76 126.30 1ovm s ALA 69 Ca -0.02 -0.31 0.02 0.00 0.00 0.00 0.00 51.96 51.65 1ovm s ALA 69 Cb -0.02 0.80 -0.01 0.00 0.00 0.00 0.00 23.12 23.89 1ovm s ALA 69 CO 0.01 -0.72 -0.07 0.00 0.00 0.00 0.00 175.76 174.98 1ovm s ALA 70 N -3.87 0.60 -0.02 0.00 0.00 -1.26 -0.42 121.76 116.78 1ovm s ALA 70 Ca 0.09 -0.44 0.06 0.00 0.00 0.00 0.00 51.96 51.66 1ovm s ALA 70 Cb 0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.02 1ovm s ALA 70 CO -0.05 0.10 -0.19 -1.17 0.00 0.00 0.00 175.76 174.45 1ovm s LEU 71 N -0.57 2.01 -0.16 0.00 2.96 0.17 -2.39 118.68 120.70 1ovm s LEU 71 Ca -0.01 -0.36 0.00 0.00 -0.22 0.00 0.00 54.13 53.55 1ovm s LEU 71 Cb -0.05 -1.02 0.03 0.00 0.50 0.00 0.00 46.19 45.66 1ovm s LEU 71 CO 0.00 0.22 -0.12 -0.22 -1.32 0.00 0.00 176.35 174.91 1ovm s LEU 72 N -0.33 1.80 0.44 -0.68 1.98 0.17 0.01 118.68 122.07 1ovm s LEU 72 Ca 0.04 -0.59 0.04 0.00 -2.89 0.00 0.00 54.13 50.73 1ovm s LEU 72 Cb -0.09 -1.15 -0.01 0.00 0.66 0.00 0.00 46.19 45.60 1ovm s LEU 72 CO 0.00 -0.09 0.13 0.42 -1.89 0.00 0.00 176.35 174.91 1ovm s THR 73 N 1.49 0.58 0.10 3.68 -4.23 -0.24 -2.83 115.64 114.19 1ovm s THR 73 Ca 0.03 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.59 1ovm s THR 73 Cb -0.14 -2.24 -0.04 0.00 1.34 0.00 0.00 72.50 71.42 1ovm s THR 73 CO -0.10 0.00 0.00 0.28 -0.54 0.00 0.00 174.62 174.27 1ovm s THR 74 N -3.13 4.02 0.14 3.99 -1.32 -1.26 -1.50 115.64 116.59 1ovm s THR 74 Ca 0.19 -1.01 -0.32 0.00 -1.21 0.00 0.00 61.69 59.33 1ovm s THR 74 Cb 0.01 -2.93 -0.17 0.00 -1.51 0.00 0.00 72.50 67.90 1ovm s THR 74 CO 0.13 0.10 0.83 0.33 -2.21 0.00 0.00 174.62 173.80 1ovm n PHE 75 N 0.51 0.30 0.00 9.09 7.35 -0.41 -1.46 117.46 132.83 1ovm n PHE 75 Ca -0.11 0.92 0.00 0.00 -0.76 0.00 0.00 57.45 57.51 1ovm n PHE 75 Cb 0.52 -2.08 0.00 0.00 0.35 0.00 0.00 39.48 38.27 1ovm n PHE 75 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1ovm n GLY 76 N 1.81 0.86 0.37 7.13 0.00 -1.26 -3.89 105.19 110.20 1ovm n GLY 76 Ca 0.17 0.48 0.05 0.00 0.00 0.00 0.00 46.02 46.73 1ovm n GLY 76 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1ovm h VAL 77 N 0.00 1.00 0.27 1.61 -1.51 -1.81 -1.29 116.25 114.53 1ovm h VAL 77 Ca 0.00 -0.36 -0.01 0.00 -1.23 0.00 0.00 66.70 65.10 1ovm h VAL 77 Cb 0.00 -0.14 0.00 0.00 -2.13 0.00 0.00 31.29 29.03 1ovm h VAL 77 CO 0.00 0.19 -0.13 1.23 -1.23 0.00 0.00 177.57 177.63 1ovm h GLY 78 N 1.05 -0.38 0.72 5.19 0.00 -1.37 -3.21 103.07 105.07 1ovm h GLY 78 Ca 0.45 0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.97 1ovm h GLY 78 CO -0.20 -0.14 0.40 1.05 0.00 0.00 0.00 176.54 177.65 1ovm h GLU 79 N -1.06 0.73 -0.19 4.80 4.11 -1.31 -2.10 114.58 119.56 1ovm h GLU 79 Ca -0.04 -0.04 -0.05 0.00 0.07 0.00 0.00 59.36 59.30 1ovm h GLU 79 Cb 0.36 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1ovm h GLU 79 CO 0.06 0.48 -0.11 -0.07 0.07 0.00 0.00 179.01 179.44 1ovm h LEU 80 N 0.75 0.28 -1.89 3.06 3.38 -1.39 -1.59 115.31 117.91 1ovm h LEU 80 Ca 0.31 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.20 1ovm h LEU 80 Cb 0.16 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 1ovm h LEU 80 CO -0.17 0.43 -0.10 0.28 0.09 0.00 0.00 178.44 178.97 1ovm h SER 81 N 0.28 0.00 0.07 -0.43 0.02 -1.38 -2.55 113.55 109.56 1ovm h SER 81 Ca 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1ovm h SER 81 Cb 0.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1ovm h SER 81 CO 0.02 0.10 -0.27 0.00 -1.14 0.00 0.00 176.83 175.54 1ovm n ALA 82 N -2.22 3.11 -0.22 3.77 0.00 -0.62 -3.72 120.51 120.62 1ovm n ALA 82 Ca -0.01 -0.54 -0.02 0.00 0.00 0.00 0.00 53.44 52.87 1ovm n ALA 82 Cb 0.25 -0.97 0.05 0.00 0.00 0.00 0.00 19.45 18.78 1ovm n ALA 82 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1ovm h MET 83 N 2.30 -0.05 -0.36 0.00 2.07 -1.23 -0.39 114.93 117.27 1ovm h MET 83 Ca 0.00 0.00 0.03 0.00 -2.07 0.00 0.00 59.70 57.67 1ovm h MET 83 Cb 0.67 0.01 -0.02 0.00 -1.87 0.00 0.00 31.60 30.39 1ovm h MET 83 CO 0.00 -0.03 0.24 -0.97 1.07 0.00 0.00 176.91 177.22 1ovm h ASN 84 N -0.05 0.32 0.01 1.22 -0.00 -1.82 -0.52 115.58 114.74 1ovm h ASN 84 Ca 0.29 -0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.59 1ovm h ASN 84 Cb 0.51 -0.07 0.00 0.00 -0.00 0.00 0.00 38.32 38.75 1ovm h ASN 84 CO -0.68 0.22 -0.01 1.23 -0.00 0.00 0.00 177.43 178.19 1ovm h GLY 85 N 0.37 -0.02 0.96 1.57 0.00 -1.41 -2.23 103.07 102.31 1ovm h GLY 85 Ca 0.15 0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.50 1ovm h GLY 85 CO -0.03 -0.01 0.55 -2.22 0.00 0.00 0.00 176.54 174.83 1ovm h ILE 86 N -0.57 1.18 -0.57 2.60 1.08 -1.08 -0.63 117.51 119.52 1ovm h ILE 86 Ca -0.00 -0.38 0.04 0.00 -0.39 0.00 0.00 64.86 64.13 1ovm h ILE 86 Cb 0.55 -0.01 -0.04 0.00 -3.07 0.00 0.00 36.82 34.25 1ovm h ILE 86 CO 0.00 0.20 0.32 0.00 -0.69 0.00 0.00 178.15 177.98 1ovm h ALA 87 N 1.32 0.74 -0.54 1.87 0.00 -1.12 0.47 119.26 122.00 1ovm h ALA 87 Ca 0.32 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1ovm h ALA 87 Cb -0.08 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1ovm h ALA 87 CO -0.08 -0.00 0.24 0.78 0.00 0.00 0.00 179.25 180.19 1ovm h GLY 88 N 0.61 0.86 0.98 0.00 0.00 -0.72 0.15 103.07 104.95 1ovm h GLY 88 Ca 0.25 -0.44 0.01 0.00 0.00 0.00 0.00 47.33 47.14 1ovm h GLY 88 CO -0.14 0.42 0.48 1.76 0.00 0.00 0.00 176.54 179.06 1ovm h SER 89 N 0.74 0.82 -0.50 0.19 0.02 -0.48 -0.93 113.55 113.41 1ovm h SER 89 Ca 0.18 -0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.06 1ovm h SER 89 Cb 0.16 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1ovm h SER 89 CO -0.02 0.59 0.08 0.22 -1.14 0.00 0.00 176.83 176.56 1ovm h TYR 90 N 0.97 0.88 -0.48 3.45 5.03 -0.49 0.33 116.97 126.66 1ovm h TYR 90 Ca 0.27 -0.12 -0.04 0.00 2.58 0.00 0.00 58.73 61.42 1ovm h TYR 90 Cb -0.09 -0.24 -0.02 0.00 1.55 0.00 0.00 36.73 37.93 1ovm h TYR 90 CO -0.03 0.80 0.13 0.00 -1.32 0.00 0.00 178.16 177.75 1ovm h ALA 91 N 0.97 1.34 -0.42 1.82 0.00 -0.25 -3.04 119.26 119.68 1ovm h ALA 91 Ca 0.15 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ovm h ALA 91 Cb 0.40 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ovm h ALA 91 CO 0.01 0.48 0.00 0.39 0.00 0.00 0.00 179.25 180.13 1ovm n GLU 92 N -4.31 3.46 -3.46 0.00 1.02 -0.39 -4.90 120.64 112.06 1ovm n GLU 92 Ca 0.03 -2.78 -0.19 0.00 -0.02 0.00 0.00 57.16 54.20 1ovm n GLU 92 Cb 0.20 -1.83 0.06 0.00 -0.02 0.00 0.00 31.44 29.85 1ovm n GLU 92 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1ovm n HIS 93 N 0.25 -2.19 -3.89 -0.32 8.25 -0.24 -5.00 115.22 112.07 1ovm n HIS 93 Ca 0.22 0.83 -0.35 0.00 -0.26 0.00 0.00 57.72 58.15 1ovm n HIS 93 Cb 0.87 -4.38 -0.14 0.00 1.12 0.00 0.00 29.99 27.46 1ovm n HIS 93 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1ovm s VAL 94 N -3.45 3.43 -1.00 1.59 1.01 0.99 -4.63 120.40 118.34 1ovm s VAL 94 Ca 0.23 -0.53 -0.24 0.00 0.00 0.00 0.00 61.98 61.44 1ovm s VAL 94 Cb -0.04 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1ovm s VAL 94 CO 0.77 0.38 1.89 -2.16 0.00 0.00 0.00 175.10 175.97 1ovm s PRO 95 N 1.48 2.69 -0.15 2.72 0.04 -1.25 -3.19 135.00 137.33 1ovm s PRO 95 Ca 0.05 -0.64 -0.01 0.00 0.04 0.00 0.00 61.00 60.44 1ovm s PRO 95 Cb -0.15 -5.15 -0.01 0.00 0.04 0.00 0.00 34.50 29.23 1ovm s PRO 95 CO -0.03 -3.37 -0.12 0.08 0.04 0.00 0.00 177.00 173.61 1ovm s VAL 96 N 9.59 3.01 -0.19 -0.36 1.01 -1.26 -2.16 120.40 130.04 1ovm s VAL 96 Ca 0.67 -0.66 -0.17 0.00 0.00 0.00 0.00 61.98 61.82 1ovm s VAL 96 Cb -0.04 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1ovm s VAL 96 CO 0.02 0.50 0.45 -0.22 0.00 0.00 0.00 175.10 175.85 1ovm s LEU 97 N 0.68 4.17 -0.34 3.92 2.96 0.43 -1.66 118.68 128.85 1ovm s LEU 97 Ca -0.06 0.61 -0.09 0.00 -0.22 0.00 0.00 54.13 54.37 1ovm s LEU 97 Cb -0.15 -2.60 0.02 0.00 0.50 0.00 0.00 46.19 43.95 1ovm s LEU 97 CO 0.02 -0.09 0.15 -2.28 -1.32 0.00 0.00 176.35 172.83 1ovm s HIS 98 N 1.29 3.21 -0.21 5.38 5.65 0.00 0.44 115.29 131.05 1ovm s HIS 98 Ca 0.22 -0.91 -0.07 0.00 0.25 0.00 0.00 55.06 54.55 1ovm s HIS 98 Cb -0.15 -2.36 -0.03 0.00 -1.18 0.00 0.00 32.58 28.86 1ovm s HIS 98 CO 0.09 -0.59 0.05 0.42 -0.65 0.00 0.00 174.74 174.05 1ovm s ILE 99 N 1.54 4.39 -0.16 0.89 1.01 0.10 -1.19 121.20 127.79 1ovm s ILE 99 Ca 0.02 -0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.52 1ovm s ILE 99 Cb -0.18 -3.00 0.02 0.00 0.01 0.00 0.00 42.46 39.30 1ovm s ILE 99 CO 0.05 0.41 -0.18 0.54 0.00 0.00 0.00 174.94 175.76 1ovm s VAL 100 N 0.95 1.86 0.15 2.92 0.11 -0.59 -1.08 120.40 124.72 1ovm s VAL 100 Ca 0.03 -0.82 -0.30 0.00 -2.93 0.00 0.00 61.98 57.95 1ovm s VAL 100 Cb -0.14 -1.70 -0.08 0.00 -1.53 0.00 0.00 36.38 32.93 1ovm s VAL 100 CO 0.03 0.51 1.28 -0.83 -3.33 0.00 0.00 175.10 172.75 1ovm s GLY 101 N 1.29 2.39 0.26 6.54 0.00 -0.56 -0.98 107.32 116.25 1ovm s GLY 101 Ca 0.03 1.02 0.04 0.00 0.00 0.00 0.00 44.72 45.81 1ovm s GLY 101 CO -0.10 2.07 0.02 0.00 0.00 0.00 0.00 173.10 175.09 1ovm s ALA 102 N 0.48 1.97 0.93 3.20 0.00 -0.53 -1.29 121.76 126.52 1ovm s ALA 102 Ca 0.58 -1.85 -0.10 0.00 0.00 0.00 0.00 51.96 50.58 1ovm s ALA 102 Cb -0.34 0.57 0.15 0.00 0.00 0.00 0.00 23.12 23.49 1ovm s ALA 102 CO 0.34 -0.27 1.10 -2.30 0.00 0.00 0.00 175.76 174.63 1ovm n PRO 103 N -0.50 -0.54 -1.75 0.00 -0.02 -1.26 -0.85 135.00 130.08 1ovm n PRO 103 Ca -0.04 -0.09 -0.35 0.00 -2.02 0.00 0.00 63.50 61.00 1ovm n PRO 103 Cb 0.65 -2.34 0.06 0.00 -0.02 0.00 0.00 33.50 31.85 1ovm n PRO 103 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1ovm s GLY 104 N -2.59 2.59 0.27 -1.23 0.00 -1.26 -4.10 107.32 100.99 1ovm s GLY 104 Ca 0.66 0.97 -0.00 0.00 0.00 0.00 0.00 44.72 46.35 1ovm s GLY 104 CO 0.59 1.37 1.82 -0.91 0.00 0.00 0.00 173.10 175.97 1ovm h THR 105 N 0.36 0.89 -0.30 0.90 1.35 -1.92 -1.68 112.91 112.50 1ovm h THR 105 Ca -0.49 -0.31 -0.02 0.00 -0.55 0.00 0.00 66.41 65.04 1ovm h THR 105 Cb 1.30 -0.08 -0.01 0.00 -1.73 0.00 0.00 68.15 67.62 1ovm h THR 105 CO 0.53 0.16 0.10 0.00 -0.25 0.00 0.00 175.52 176.06 1ovm h ALA 106 N 1.52 0.40 -0.59 6.62 0.00 -2.00 -1.22 119.26 124.00 1ovm h ALA 106 Ca 0.47 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1ovm h ALA 106 Cb 0.49 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1ovm h ALA 106 CO -0.27 0.02 0.34 0.00 0.00 0.00 0.00 179.25 179.34 1ovm h ALA 107 N 0.94 1.50 -0.35 0.00 0.00 -1.76 -1.61 119.26 117.98 1ovm h ALA 107 Ca 0.10 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1ovm h ALA 107 Cb 0.23 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ovm h ALA 107 CO -0.00 0.43 -0.21 1.96 0.00 0.00 0.00 179.25 181.42 1ovm h GLN 108 N 0.81 0.77 -0.77 0.00 4.20 -1.04 -2.90 115.11 116.18 1ovm h GLN 108 Ca 0.21 -0.35 -0.00 0.00 0.06 0.00 0.00 58.65 58.57 1ovm h GLN 108 Cb -0.02 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.71 1ovm h GLN 108 CO -0.04 0.97 0.47 1.96 -0.67 0.00 0.00 178.83 181.53 1ovm h GLN 109 N 0.55 1.03 0.00 1.46 1.08 -0.71 -1.87 115.11 116.65 1ovm h GLN 109 Ca 0.07 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1ovm h GLN 109 Cb 0.77 -0.22 0.00 0.00 -0.05 0.00 0.00 27.48 27.97 1ovm h GLN 109 CO 0.06 0.71 0.00 0.00 -0.95 0.00 0.00 178.83 178.65 1ovm h ARG 110 N 1.05 0.00 -5.62 1.46 3.08 -1.13 -3.47 114.38 109.75 1ovm h ARG 110 Ca 0.28 0.00 -0.36 0.00 0.07 0.00 0.00 59.98 59.96 1ovm h ARG 110 Cb -0.06 0.00 0.14 0.00 0.08 0.00 0.00 29.97 30.14 1ovm h ARG 110 CO -0.05 0.00 -0.68 0.41 -1.07 0.00 0.00 179.97 178.57 1ovm n GLY 111 N -0.15 -0.44 3.83 0.04 0.00 -0.70 -4.99 105.19 102.78 1ovm n GLY 111 Ca 0.01 0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1ovm n GLY 111 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ovm s GLU 112 N -5.97 3.18 -1.33 1.61 2.02 -1.24 -4.32 118.70 112.65 1ovm s GLU 112 Ca 0.39 0.90 -0.14 0.00 0.02 0.00 0.00 54.97 56.14 1ovm s GLU 112 Cb -0.17 -2.02 0.10 0.00 0.10 0.00 0.00 34.13 32.14 1ovm s GLU 112 CO 0.70 -0.91 1.87 1.28 0.02 0.00 0.00 175.26 178.23 1ovm n LEU 113 N -2.93 5.96 -4.88 1.80 4.77 -1.26 -4.38 117.00 116.08 1ovm n LEU 113 Ca 0.07 -4.24 -0.30 0.00 -0.03 0.00 0.00 56.01 51.51 1ovm n LEU 113 Cb 0.54 -1.64 -0.03 0.00 -2.33 0.00 0.00 43.42 39.95 1ovm n LEU 113 CO 0.56 0.82 0.40 -0.76 -1.33 0.00 0.00 177.39 177.08 1ovm s LEU 114 N 2.19 3.89 0.60 2.23 1.02 -1.26 -5.05 118.68 122.30 1ovm s LEU 114 Ca 0.47 1.08 -0.18 0.00 0.02 0.00 0.00 54.13 55.53 1ovm s LEU 114 Cb 0.07 -3.95 -0.03 0.00 0.02 0.00 0.00 46.19 42.31 1ovm s LEU 114 CO -0.00 -0.34 1.15 -1.38 0.02 0.00 0.00 176.35 175.79 1ovm s HIS 115 N -2.28 2.52 -0.34 0.29 -3.43 -1.26 -3.19 115.29 107.60 1ovm s HIS 115 Ca 0.50 1.54 0.00 0.00 -0.80 0.00 0.00 55.06 56.31 1ovm s HIS 115 Cb -0.10 -3.33 0.00 0.00 -1.43 0.00 0.00 32.58 27.72 1ovm s HIS 115 CO 0.29 -1.87 0.00 0.72 -2.00 0.00 0.00 174.74 171.88 1ovm n HIS 116 N -1.80 -0.03 -4.53 0.38 8.25 -1.26 -5.04 115.22 111.19 1ovm n HIS 116 Ca 0.12 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.33 1ovm n HIS 116 Cb 0.51 -1.08 -0.11 0.00 1.12 0.00 0.00 29.99 30.43 1ovm n HIS 116 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1ovm s THR 117 N -2.13 1.55 -2.00 1.59 -4.23 -1.19 -4.26 115.64 104.96 1ovm s THR 117 Ca 0.00 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.76 1ovm s THR 117 Cb 0.00 -2.88 0.71 0.00 1.34 0.00 0.00 72.50 71.67 1ovm s THR 117 CO 0.00 0.00 1.93 0.18 -0.54 0.00 0.00 174.62 176.19 1ovm n LEU 118 N -0.82 0.00 -0.33 4.79 4.32 -1.26 -4.88 117.00 118.82 1ovm n LEU 118 Ca -0.04 0.00 -0.03 0.00 -0.02 0.00 0.00 56.01 55.92 1ovm n LEU 118 Cb 0.67 0.00 -0.01 0.00 -1.62 0.00 0.00 43.42 42.46 1ovm n LEU 118 CO 0.45 0.00 -0.04 0.61 -1.22 0.00 0.00 177.39 177.19 1ovm n GLY 119 N 0.82 0.40 0.00 -0.72 0.00 -1.26 -4.94 105.19 99.49 1ovm n GLY 119 Ca 0.19 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1ovm n GLY 119 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ovm n ASP 120 N 1.40 1.45 0.00 1.61 5.75 -1.26 -5.00 116.55 120.50 1ovm n ASP 120 Ca -0.04 -1.53 0.00 0.00 -0.01 0.00 0.00 54.79 53.21 1ovm n ASP 120 Cb 0.36 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.45 1ovm n ASP 120 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ovm n GLY 121 N -0.27 0.84 3.78 6.12 0.00 -1.26 -5.02 105.19 109.38 1ovm n GLY 121 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1ovm n GLY 121 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ovm s GLU 122 N -0.05 4.11 0.00 1.61 0.41 -1.26 -4.41 118.70 119.10 1ovm s GLU 122 Ca 0.00 0.32 0.00 0.00 -0.41 0.00 0.00 54.97 54.88 1ovm s GLU 122 Cb 0.00 -3.34 0.00 0.00 -1.78 0.00 0.00 34.13 29.01 1ovm s GLU 122 CO 0.00 0.42 0.96 1.19 -0.49 0.00 0.00 175.26 177.34 1ovm n PHE 123 N 2.83 0.00 0.38 1.61 3.01 -1.26 -4.67 117.46 119.37 1ovm n PHE 123 Ca -0.12 -0.46 0.05 0.00 1.01 0.00 0.00 57.45 57.94 1ovm n PHE 123 Cb 0.52 -0.05 0.05 0.00 -0.01 0.00 0.00 39.48 40.00 1ovm n PHE 123 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1ovm n ARG 124 N -0.46 0.70 0.20 -1.08 5.12 -1.26 -4.71 116.66 115.17 1ovm n ARG 124 Ca 0.00 -1.22 -0.16 0.00 -1.93 0.00 0.00 57.85 54.54 1ovm n ARG 124 Cb 0.26 -1.21 -0.09 0.00 -1.16 0.00 0.00 32.46 30.27 1ovm n ARG 124 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1ovm h HIS 125 N 2.07 -1.27 -0.27 -1.55 3.86 -2.00 -1.44 115.15 114.54 1ovm h HIS 125 Ca 0.00 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.19 1ovm h HIS 125 Cb 0.47 0.52 -0.02 0.00 1.06 0.00 0.00 27.41 29.44 1ovm h HIS 125 CO 0.02 -0.59 -0.02 0.74 0.86 0.00 0.00 177.93 178.95 1ovm h PHE 126 N -0.82 0.43 -0.24 2.45 0.04 -1.95 -0.42 116.94 116.43 1ovm h PHE 126 Ca -0.02 -0.04 -0.00 0.00 2.80 0.00 0.00 57.97 60.71 1ovm h PHE 126 Cb 0.76 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.78 1ovm h PHE 126 CO -0.31 0.45 0.14 -0.92 -0.60 0.00 0.00 178.31 177.07 1ovm h TYR 127 N 0.40 0.32 -0.29 -0.55 3.20 -1.79 -1.94 116.97 116.34 1ovm h TYR 127 Ca 0.09 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.85 1ovm h TYR 127 Cb 0.30 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 1ovm h TYR 127 CO 0.01 0.26 -0.27 0.45 -1.64 0.00 0.00 178.16 176.97 1ovm h HIS 128 N 0.29 0.65 0.00 -3.82 3.86 -0.74 -2.68 115.15 112.71 1ovm h HIS 128 Ca 0.09 -0.15 -0.02 0.00 -1.16 0.00 0.00 60.37 59.13 1ovm h HIS 128 Cb 0.03 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 28.35 1ovm h HIS 128 CO -0.04 0.78 -0.08 0.52 0.86 0.00 0.00 177.93 179.98 1ovm h MET 129 N 0.50 0.00 -0.01 2.45 2.86 -0.65 -2.24 114.93 117.84 1ovm h MET 129 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1ovm h MET 129 Cb 0.72 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.38 1ovm h MET 129 CO 0.06 0.08 -0.31 0.45 1.06 0.00 0.00 176.91 178.24 1ovm n SER 130 N -3.67 0.88 -0.30 1.22 2.88 -0.77 -4.39 113.62 109.48 1ovm n SER 130 Ca -0.02 -0.72 -0.04 0.00 -1.33 0.00 0.00 58.87 56.75 1ovm n SER 130 Cb 0.18 0.15 0.07 0.00 -0.75 0.00 0.00 64.21 63.87 1ovm n SER 130 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1ovm h GLU 131 N 0.89 1.10 0.00 -1.46 4.22 -1.37 -2.80 114.58 115.16 1ovm h GLU 131 Ca 0.00 -0.10 0.00 0.00 0.08 0.00 0.00 59.36 59.34 1ovm h GLU 131 Cb 0.50 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.52 1ovm h GLU 131 CO 0.00 0.77 0.00 -1.35 -2.18 0.00 0.00 179.01 176.25 1ovm h PRO 132 N 1.11 0.00 -0.35 0.92 0.11 -1.79 -3.09 132.00 128.91 1ovm h PRO 132 Ca 0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.40 1ovm h PRO 132 Cb -0.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.06 1ovm h PRO 132 CO -0.06 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 178.17 1ovm n ILE 133 N -3.06 2.19 -4.11 4.15 -5.35 -1.06 -4.96 119.36 107.16 1ovm n ILE 133 Ca -0.00 -1.65 -0.10 0.00 -0.27 0.00 0.00 62.75 60.73 1ovm n ILE 133 Cb 0.25 -0.14 -0.10 0.00 -1.74 0.00 0.00 39.64 37.91 1ovm n ILE 133 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1ovm s THR 134 N -2.53 0.47 -0.59 7.28 -4.23 -1.17 -4.59 115.64 110.29 1ovm s THR 134 Ca 0.43 -1.62 0.22 0.00 -1.18 0.00 0.00 61.69 59.53 1ovm s THR 134 Cb 0.33 -1.28 -0.21 0.00 1.34 0.00 0.00 72.50 72.68 1ovm s THR 134 CO 0.12 -0.77 0.84 1.33 -0.54 0.00 0.00 174.62 175.60 1ovm n VAL 135 N 0.47 0.07 -3.61 2.29 0.24 -0.57 -4.92 118.33 112.30 1ovm n VAL 135 Ca -0.16 -0.23 -0.16 0.00 -2.04 0.00 0.00 64.34 61.76 1ovm n VAL 135 Cb 0.59 0.42 -0.07 0.00 -1.47 0.00 0.00 33.84 33.31 1ovm n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ovm s ALA 136 N -3.22 -1.55 0.15 2.33 0.00 -1.26 -5.01 121.76 113.20 1ovm s ALA 136 Ca 0.02 1.40 -0.18 0.00 0.00 0.00 0.00 51.96 53.20 1ovm s ALA 136 Cb 0.15 -0.46 0.04 0.00 0.00 0.00 0.00 23.12 22.86 1ovm s ALA 136 CO 0.85 -0.32 0.48 1.14 0.00 0.00 0.00 175.76 177.91 1ovm s GLN 137 N -0.52 1.18 -0.19 0.00 -2.07 -1.26 -1.18 119.66 115.62 1ovm s GLN 137 Ca -0.06 -0.67 -0.27 0.00 -1.82 0.00 0.00 55.36 52.53 1ovm s GLN 137 Cb -0.03 0.51 0.08 0.00 -1.09 0.00 0.00 33.01 32.49 1ovm s GLN 137 CO 0.05 -0.49 0.77 0.00 -1.32 0.00 0.00 175.29 174.31 1ovm s ALA 138 N -3.80 -1.81 -0.55 2.60 0.00 -0.29 -4.95 121.76 112.95 1ovm s ALA 138 Ca 0.03 1.74 -0.18 0.00 0.00 0.00 0.00 51.96 53.55 1ovm s ALA 138 Cb 0.01 -0.78 0.09 0.00 0.00 0.00 0.00 23.12 22.44 1ovm s ALA 138 CO -0.11 -0.33 0.63 0.08 0.00 0.00 0.00 175.76 176.03 1ovm s VAL 139 N -0.28 4.93 0.25 0.00 1.01 -1.26 -1.23 120.40 123.81 1ovm s VAL 139 Ca -0.03 -0.97 -0.31 0.00 0.00 0.00 0.00 61.98 60.67 1ovm s VAL 139 Cb -0.03 -4.39 -0.11 0.00 0.00 0.00 0.00 36.38 31.85 1ovm s VAL 139 CO 0.03 -0.97 1.59 -0.76 0.00 0.00 0.00 175.10 175.00 1ovm s LEU 140 N 2.42 4.36 0.29 3.92 1.02 -0.45 -4.96 118.68 125.28 1ovm s LEU 140 Ca 0.10 2.84 0.03 0.00 0.02 0.00 0.00 54.13 57.12 1ovm s LEU 140 Cb -0.24 -3.62 -0.06 0.00 0.02 0.00 0.00 46.19 42.29 1ovm s LEU 140 CO 0.07 -0.88 0.05 0.42 0.02 0.00 0.00 176.35 176.03 1ovm s THR 141 N 0.43 1.02 0.49 5.49 -4.23 -1.26 -4.48 115.64 113.09 1ovm s THR 141 Ca 0.66 -2.01 0.27 0.00 -1.18 0.00 0.00 61.69 59.43 1ovm s THR 141 Cb -0.47 -2.64 0.31 0.00 1.34 0.00 0.00 72.50 71.04 1ovm s THR 141 CO 0.41 -0.08 2.14 -0.08 -0.54 0.00 0.00 174.62 176.46 1ovm h GLU 142 N 2.26 0.00 0.00 3.99 4.81 -1.95 -0.80 114.58 122.90 1ovm h GLU 142 Ca -0.40 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 1ovm h GLU 142 Cb 1.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.62 1ovm h GLU 142 CO 0.66 0.08 -0.79 1.04 -0.73 0.00 0.00 179.01 179.27 1ovm n GLN 143 N -3.79 0.08 0.00 1.92 3.00 -1.26 -4.50 117.38 112.83 1ovm n GLN 143 Ca -0.02 -0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 1ovm n GLN 143 Cb 0.18 -1.52 0.00 0.00 0.00 0.00 0.00 30.24 28.89 1ovm n GLN 143 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1ovm n ASN 144 N -1.62 0.37 0.00 1.08 2.04 -1.05 -4.96 115.26 111.11 1ovm n ASN 144 Ca 0.04 -0.30 0.00 0.00 -0.44 0.00 0.00 54.58 53.88 1ovm n ASN 144 Cb 0.36 0.67 0.00 0.00 -2.53 0.00 0.00 39.78 38.28 1ovm n ASN 144 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ovm n ALA 145 N -0.70 0.00 -0.06 -2.53 0.00 -0.33 -1.58 120.51 115.31 1ovm n ALA 145 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1ovm n ALA 145 Cb 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 19.45 19.46 1ovm n ALA 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ovm h TYR 147 N -0.09 0.00 -0.00 0.00 -0.00 -1.86 -1.21 116.97 113.81 1ovm h TYR 147 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 58.73 58.63 1ovm h TYR 147 Cb 0.28 0.00 0.01 0.00 0.00 0.00 0.00 36.73 37.02 1ovm h TYR 147 CO -0.30 0.28 -0.96 0.93 -0.00 0.00 0.00 178.16 178.12 1ovm h GLU 148 N 0.00 0.48 -0.45 0.10 4.39 -1.04 -1.07 114.58 116.98 1ovm h GLU 148 Ca -0.00 -0.51 -0.01 0.00 0.34 0.00 0.00 59.36 59.18 1ovm h GLU 148 Cb 0.87 0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.64 1ovm h GLU 148 CO 0.04 1.15 0.24 0.82 -1.16 0.00 0.00 179.01 180.10 1ovm h ILE 149 N 0.27 1.17 -0.40 3.13 2.04 -0.73 -2.12 117.51 120.86 1ovm h ILE 149 Ca -0.09 -0.44 -0.10 0.00 1.00 0.00 0.00 64.86 65.23 1ovm h ILE 149 Cb 1.60 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.30 1ovm h ILE 149 CO 0.17 0.18 -0.15 0.44 0.00 0.00 0.00 178.15 178.79 1ovm h ASP 150 N 0.59 0.73 -0.26 1.72 3.32 -1.19 -2.79 116.42 118.54 1ovm h ASP 150 Ca 0.16 -0.23 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 1ovm h ASP 150 Cb 0.07 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1ovm h ASP 150 CO -0.02 0.89 0.04 -0.09 -1.72 0.00 0.00 179.24 178.33 1ovm h ARG 151 N 0.66 0.43 -0.37 3.56 2.43 -0.82 -0.60 114.38 119.67 1ovm h ARG 151 Ca 0.11 -0.12 -0.13 0.00 -0.81 0.00 0.00 59.98 59.03 1ovm h ARG 151 Cb 0.63 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 1ovm h ARG 151 CO 0.04 0.56 -0.27 -0.39 -1.51 0.00 0.00 179.97 178.40 1ovm h VAL 152 N 0.24 1.28 -0.63 0.20 -1.51 -1.41 -1.27 116.25 113.16 1ovm h VAL 152 Ca 0.08 -1.43 0.02 0.00 -1.23 0.00 0.00 66.70 64.14 1ovm h VAL 152 Cb 0.34 1.39 -0.03 0.00 -2.13 0.00 0.00 31.29 30.86 1ovm h VAL 152 CO 0.01 0.47 0.40 -0.07 -1.23 0.00 0.00 177.57 177.15 1ovm h LEU 153 N 0.62 0.68 -0.46 4.19 3.38 -1.47 0.11 115.31 122.36 1ovm h LEU 153 Ca 0.07 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1ovm h LEU 153 Cb 0.84 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1ovm h LEU 153 CO 0.07 0.49 0.25 0.74 0.09 0.00 0.00 178.44 180.07 1ovm h THR 154 N 0.81 1.17 -0.48 0.22 2.02 -0.97 -1.38 112.91 114.31 1ovm h THR 154 Ca 0.24 -0.45 -0.04 0.00 0.77 0.00 0.00 66.41 66.92 1ovm h THR 154 Cb -0.05 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1ovm h THR 154 CO -0.07 0.18 0.11 0.74 0.37 0.00 0.00 175.52 176.85 1ovm h THR 155 N 0.61 1.21 -0.34 3.16 2.02 -0.74 -1.86 112.91 116.97 1ovm h THR 155 Ca 0.16 -0.75 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 1ovm h THR 155 Cb 0.07 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 1ovm h THR 155 CO -0.02 0.28 0.16 0.24 0.37 0.00 0.00 175.52 176.54 1ovm h MET 156 N 0.70 0.49 -0.46 6.66 2.07 -0.18 -1.20 114.93 123.02 1ovm h MET 156 Ca 0.16 -0.07 -0.06 0.00 -2.07 0.00 0.00 59.70 57.66 1ovm h MET 156 Cb 0.26 -0.09 -0.02 0.00 -1.87 0.00 0.00 31.60 29.89 1ovm h MET 156 CO -0.00 0.45 0.04 -0.07 1.07 0.00 0.00 176.91 178.40 1ovm h LEU 157 N 0.41 0.69 0.20 1.22 4.07 -0.96 0.54 115.31 121.47 1ovm h LEU 157 Ca 0.12 -0.14 -0.01 0.00 0.08 0.00 0.00 57.88 57.92 1ovm h LEU 157 Cb 0.12 -0.18 0.00 0.00 1.08 0.00 0.00 40.66 41.68 1ovm h LEU 157 CO -0.01 0.73 -0.09 -0.09 -1.08 0.00 0.00 178.44 177.89 1ovm h ARG 158 N 0.69 -0.25 0.00 1.13 2.43 -1.09 -3.30 114.38 113.99 1ovm h ARG 158 Ca 0.14 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1ovm h ARG 158 Cb 0.37 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1ovm h ARG 158 CO 0.01 0.12 -0.32 0.39 -1.51 0.00 0.00 179.97 178.67 1ovm n GLU 159 N -5.02 0.01 -3.45 0.20 -0.58 -0.47 -4.96 120.64 106.37 1ovm n GLU 159 Ca -0.09 0.01 -0.18 0.00 -0.42 0.00 0.00 57.16 56.48 1ovm n GLU 159 Cb 0.26 -1.51 0.07 0.00 -0.57 0.00 0.00 31.44 29.68 1ovm n GLU 159 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1ovm n ARG 160 N -1.53 -4.69 -4.05 3.49 5.12 0.19 -4.98 116.66 110.20 1ovm n ARG 160 Ca 0.06 0.78 -0.10 0.00 -1.93 0.00 0.00 57.85 56.66 1ovm n ARG 160 Cb 0.34 -5.60 -0.08 0.00 -1.16 0.00 0.00 32.46 25.96 1ovm n ARG 160 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1ovm s ARG 161 N -5.26 1.19 0.62 5.56 0.52 -1.10 -3.04 118.95 117.43 1ovm s ARG 161 Ca 0.16 -1.33 -0.19 0.00 -0.52 0.00 0.00 55.73 53.85 1ovm s ARG 161 Cb -0.03 0.35 -0.02 0.00 0.52 0.00 0.00 34.95 35.76 1ovm s ARG 161 CO 0.76 -0.42 1.32 -2.14 0.02 0.00 0.00 175.30 174.84 1ovm s PRO 162 N -4.03 2.73 0.17 3.54 0.02 -1.19 -4.22 135.00 132.01 1ovm s PRO 162 Ca 0.24 2.14 0.07 0.00 0.02 0.00 0.00 61.00 63.47 1ovm s PRO 162 Cb 0.04 -1.98 -0.04 0.00 0.02 0.00 0.00 34.50 32.54 1ovm s PRO 162 CO 0.04 -1.48 -0.14 0.20 -0.33 0.00 0.00 177.00 175.29 1ovm s GLY 163 N -1.22 1.27 -0.05 0.52 0.00 -0.66 -1.51 107.32 105.67 1ovm s GLY 163 Ca 0.79 -1.51 0.02 0.00 0.00 0.00 0.00 44.72 44.02 1ovm s GLY 163 CO 0.43 -1.59 -0.08 -0.47 0.00 0.00 0.00 173.10 171.39 1ovm s TYR 164 N -2.65 1.06 -0.12 1.90 6.14 -0.32 -0.82 117.35 122.53 1ovm s TYR 164 Ca 0.17 -0.35 -0.01 0.00 0.64 0.00 0.00 57.07 57.52 1ovm s TYR 164 Cb -0.02 -0.83 0.03 0.00 0.42 0.00 0.00 41.96 41.56 1ovm s TYR 164 CO 0.05 -0.22 -0.05 -0.51 0.64 0.00 0.00 175.55 175.46 1ovm s LEU 165 N 0.74 1.18 -0.27 6.97 1.43 -0.33 -1.14 118.68 127.27 1ovm s LEU 165 Ca -0.13 -0.37 -0.19 0.00 -1.03 0.00 0.00 54.13 52.42 1ovm s LEU 165 Cb -0.15 -0.78 -0.02 0.00 0.03 0.00 0.00 46.19 45.27 1ovm s LEU 165 CO 0.02 -0.15 0.55 -0.32 0.23 0.00 0.00 176.35 176.67 1ovm s MET 166 N 1.74 4.04 -0.47 1.70 -2.45 -0.36 -1.55 119.30 121.96 1ovm s MET 166 Ca 0.04 0.35 -0.04 0.00 -1.25 0.00 0.00 55.69 54.79 1ovm s MET 166 Cb -0.13 -3.67 0.12 0.00 1.25 0.00 0.00 34.83 32.41 1ovm s MET 166 CO -0.08 -0.40 0.28 -1.17 1.05 0.00 0.00 175.02 174.71 1ovm s LEU 167 N 2.39 5.33 0.30 4.11 2.96 -0.15 -1.34 118.68 132.27 1ovm s LEU 167 Ca 0.23 -2.22 -0.29 0.00 -0.22 0.00 0.00 54.13 51.63 1ovm s LEU 167 Cb -0.16 -1.86 -0.11 0.00 0.50 0.00 0.00 46.19 44.56 1ovm s LEU 167 CO 0.09 -0.52 1.49 -2.84 -1.32 0.00 0.00 176.35 173.25 1ovm s PRO 168 N 0.88 4.19 0.26 0.98 0.02 -1.26 -1.45 135.00 138.61 1ovm s PRO 168 Ca 0.10 2.45 -0.02 0.00 0.02 0.00 0.00 61.00 63.55 1ovm s PRO 168 Cb -0.23 -3.04 0.54 0.00 0.02 0.00 0.00 34.50 31.79 1ovm s PRO 168 CO -0.04 -0.49 1.69 0.00 -0.33 0.00 0.00 177.00 177.84 1ovm h ALA 169 N 4.29 1.11 -0.38 -1.55 0.00 -1.15 -1.19 119.26 120.40 1ovm h ALA 169 Ca -0.48 0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.49 1ovm h ALA 169 Cb 1.22 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 1ovm h ALA 169 CO 0.74 -0.32 -0.18 0.38 0.00 0.00 0.00 179.25 179.87 1ovm h ASP 170 N 0.34 0.71 -0.61 0.00 2.03 -1.87 -2.75 116.42 114.26 1ovm h ASP 170 Ca 0.46 -0.23 -0.02 0.00 -0.73 0.00 0.00 57.03 56.50 1ovm h ASP 170 Cb 0.80 -0.19 -0.03 0.00 -0.83 0.00 0.00 39.33 39.07 1ovm h ASP 170 CO -0.50 0.89 0.30 0.58 -1.03 0.00 0.00 179.24 179.48 1ovm h VAL 171 N 0.63 1.21 -0.37 4.15 2.07 -1.60 -1.95 116.25 120.39 1ovm h VAL 171 Ca 0.10 -0.59 0.04 0.00 0.82 0.00 0.00 66.70 67.08 1ovm h VAL 171 Cb 0.65 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1ovm h VAL 171 CO 0.05 0.25 0.25 0.00 0.02 0.00 0.00 177.57 178.13 1ovm h ALA 172 N 1.43 1.94 0.00 1.67 0.00 -1.10 -1.35 119.26 121.86 1ovm h ALA 172 Ca 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1ovm h ALA 172 Cb 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1ovm h ALA 172 CO -0.03 -0.00 -0.15 1.63 0.00 0.00 0.00 179.25 180.69 1ovm n LYS 173 N -4.48 0.07 -1.87 0.00 5.02 -0.74 -2.01 118.16 114.14 1ovm n LYS 173 Ca 0.04 0.04 -0.40 0.00 -2.02 0.00 0.00 58.31 55.98 1ovm n LYS 173 Cb 0.21 -1.57 0.01 0.00 -0.02 0.00 0.00 35.03 33.66 1ovm n LYS 173 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ovm s LYS 174 N -3.03 3.78 0.51 1.97 3.01 -0.51 -4.75 119.74 120.72 1ovm s LYS 174 Ca 0.12 2.35 -0.23 0.00 -1.01 0.00 0.00 55.97 57.20 1ovm s LYS 174 Cb 0.17 -2.69 -0.06 0.00 -1.01 0.00 0.00 37.83 34.24 1ovm s LYS 174 CO 0.59 -0.72 1.34 0.00 0.51 0.00 0.00 175.35 177.07 1ovm s ALA 175 N -1.22 2.93 0.18 5.17 0.00 -1.26 -0.73 121.76 126.83 1ovm s ALA 175 Ca 0.60 1.30 -0.14 0.00 0.00 0.00 0.00 51.96 53.71 1ovm s ALA 175 Cb -0.42 -3.54 0.02 0.00 0.00 0.00 0.00 23.12 19.17 1ovm s ALA 175 CO 0.54 -1.22 0.43 0.00 0.00 0.00 0.00 175.76 175.51 1ovm s ALA 176 N -1.32 -0.62 -0.02 0.00 0.00 -0.93 -4.60 121.76 114.28 1ovm s ALA 176 Ca 0.68 -0.44 0.06 0.00 0.00 0.00 0.00 51.96 52.27 1ovm s ALA 176 Cb -0.39 0.83 -0.03 0.00 0.00 0.00 0.00 23.12 23.54 1ovm s ALA 176 CO 0.47 -0.74 -0.20 -0.08 0.00 0.00 0.00 175.76 175.22 1ovm s THR 177 N -3.90 2.62 0.29 0.00 -1.32 -1.26 -4.42 115.64 107.65 1ovm s THR 177 Ca 0.11 -0.98 -0.30 0.00 -1.21 0.00 0.00 61.69 59.31 1ovm s THR 177 Cb 0.01 -2.01 -0.12 0.00 -1.51 0.00 0.00 72.50 68.87 1ovm s THR 177 CO -0.03 0.53 1.58 -2.65 -2.21 0.00 0.00 174.62 171.84 1ovm n PRO 178 N 2.17 2.66 -2.00 7.08 -0.02 -1.26 -4.95 135.00 138.68 1ovm n PRO 178 Ca -0.17 0.95 -0.41 0.00 -2.02 0.00 0.00 63.50 61.85 1ovm n PRO 178 Cb 0.52 -2.72 -0.02 0.00 -0.02 0.00 0.00 33.50 31.26 1ovm n PRO 178 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1ovm s PRO 179 N -0.59 4.26 0.09 0.52 0.02 -1.26 -4.92 135.00 133.12 1ovm s PRO 179 Ca 0.64 2.32 -0.11 0.00 0.02 0.00 0.00 61.00 63.87 1ovm s PRO 179 Cb -0.50 -3.08 -0.18 0.00 0.02 0.00 0.00 34.50 30.75 1ovm s PRO 179 CO 0.49 -0.40 1.24 0.28 -0.33 0.00 0.00 177.00 178.29 1ovm h VAL 180 N 3.38 1.30 -3.94 3.83 2.07 -2.07 -3.45 116.25 117.38 1ovm h VAL 180 Ca -0.47 -2.22 -0.68 0.00 0.82 0.00 0.00 66.70 64.14 1ovm h VAL 180 Cb 1.22 2.29 -0.22 0.00 -1.52 0.00 0.00 31.29 33.07 1ovm h VAL 180 CO 0.74 0.69 -0.81 0.20 0.02 0.00 0.00 177.57 178.41 1ovm s ASN 181 N -7.21 3.79 0.43 0.57 0.02 -1.26 -5.11 114.94 106.18 1ovm s ASN 181 Ca -0.09 -0.45 -0.23 0.00 -1.02 0.00 0.00 52.86 51.06 1ovm s ASN 181 Cb 0.08 -0.59 -0.08 0.00 0.02 0.00 0.00 41.25 40.68 1ovm s ASN 181 CO 0.91 0.24 1.12 0.00 0.02 0.00 0.00 177.10 179.40 1ovm s ALA 182 N -0.95 3.03 -0.07 0.60 0.00 -1.26 -4.90 121.76 118.20 1ovm s ALA 182 Ca 0.15 0.85 -0.34 0.00 0.00 0.00 0.00 51.96 52.62 1ovm s ALA 182 Cb -0.10 -3.34 -0.12 0.00 0.00 0.00 0.00 23.12 19.56 1ovm s ALA 182 CO 0.06 -0.49 1.87 -0.11 0.00 0.00 0.00 175.76 177.09 1ovm n LEU 183 N -0.31 3.49 -4.85 0.00 7.94 -1.26 -4.93 117.00 117.08 1ovm n LEU 183 Ca 0.06 0.97 -0.33 0.00 -1.11 0.00 0.00 56.01 55.61 1ovm n LEU 183 Cb 0.48 -1.39 -0.06 0.00 0.53 0.00 0.00 43.42 42.99 1ovm n LEU 183 CO 0.47 -0.04 0.36 0.42 -1.11 0.00 0.00 177.39 177.48 1ovm s THR 184 N 3.93 4.74 -0.08 1.96 -4.23 -1.26 -4.92 115.64 115.79 1ovm s THR 184 Ca 0.92 0.85 -0.05 0.00 -1.18 0.00 0.00 61.69 62.22 1ovm s THR 184 Cb -0.67 -3.64 -0.02 0.00 1.34 0.00 0.00 72.50 69.51 1ovm s THR 184 CO 0.50 -0.10 -0.10 1.41 -0.54 0.00 0.00 174.62 175.79 1ovm n HIS 185 N -0.16 0.52 -2.98 3.99 -0.00 -1.26 -5.01 115.22 110.32 1ovm n HIS 185 Ca 0.02 0.23 -0.24 0.00 -0.00 0.00 0.00 57.72 57.73 1ovm n HIS 185 Cb 0.53 -0.54 0.02 0.00 -0.00 0.00 0.00 29.99 29.99 1ovm n HIS 185 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 1ovm n LYS 186 N -3.59 -1.23 -2.40 -0.41 4.81 -1.26 -4.85 118.16 109.23 1ovm n LYS 186 Ca -0.04 0.80 -0.42 0.00 -0.87 0.00 0.00 58.31 57.79 1ovm n LYS 186 Cb 0.15 -1.42 -0.03 0.00 0.02 0.00 0.00 35.03 33.75 1ovm n LYS 186 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 1ovm s GLN 187 N -2.56 4.46 0.71 1.64 -0.21 -1.26 -4.99 119.66 117.45 1ovm s GLN 187 Ca 0.17 1.82 -0.16 0.00 0.02 0.00 0.00 55.36 57.20 1ovm s GLN 187 Cb -0.02 -3.30 0.02 0.00 1.00 0.00 0.00 33.01 30.72 1ovm s GLN 187 CO 0.61 -0.18 1.27 0.00 -2.12 0.00 0.00 175.29 174.87 1ovm n ALA 188 N 3.30 0.75 -2.05 6.09 0.00 -1.26 -5.02 120.51 122.32 1ovm n ALA 188 Ca 0.07 -0.12 -0.27 0.00 0.00 0.00 0.00 53.44 53.12 1ovm n ALA 188 Cb 0.45 -2.30 0.03 0.00 0.00 0.00 0.00 19.45 17.64 1ovm n ALA 188 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1ovm s HIS 189 N -1.64 3.26 0.55 0.00 3.76 -1.26 -4.83 115.29 115.12 1ovm s HIS 189 Ca 0.80 0.70 -0.11 0.00 -0.15 0.00 0.00 55.06 56.30 1ovm s HIS 189 Cb -0.35 -2.80 -0.05 0.00 1.11 0.00 0.00 32.58 30.49 1ovm s HIS 189 CO 0.44 -0.89 0.95 0.00 -0.85 0.00 0.00 174.74 174.39 1ovm s ALA 190 N -3.05 3.17 0.07 -1.40 0.00 -1.26 -4.95 121.76 114.33 1ovm s ALA 190 Ca 0.55 -0.11 -0.31 0.00 0.00 0.00 0.00 51.96 52.09 1ovm s ALA 190 Cb -0.11 -2.96 -0.08 0.00 0.00 0.00 0.00 23.12 19.97 1ovm s ALA 190 CO 0.46 -0.45 1.53 0.34 0.00 0.00 0.00 175.76 177.64 1ovm s ASP 191 N -3.80 6.71 0.27 0.00 2.15 -1.26 -4.88 116.67 115.86 1ovm s ASP 191 Ca 0.54 2.36 0.01 0.00 0.43 0.00 0.00 52.55 55.90 1ovm s ASP 191 Cb -0.11 -2.57 0.62 0.00 -0.30 0.00 0.00 42.92 40.56 1ovm s ASP 191 CO 0.45 -0.80 1.74 0.77 -0.17 0.00 0.00 175.17 177.16 1ovm h SER 192 N 7.78 0.45 -0.76 -0.34 4.64 -1.98 -1.10 113.55 122.25 1ovm h SER 192 Ca -0.41 0.12 -0.06 0.00 -0.47 0.00 0.00 61.79 60.97 1ovm h SER 192 Cb 1.20 0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 63.31 1ovm h SER 192 CO 0.91 0.13 0.25 0.00 -0.87 0.00 0.00 176.83 177.25 1ovm h ALA 193 N 1.62 0.99 -0.35 5.18 0.00 -1.99 -0.80 119.26 123.91 1ovm h ALA 193 Ca 0.50 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 1ovm h ALA 193 Cb 0.83 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1ovm h ALA 193 CO -0.43 0.66 -0.09 0.00 0.00 0.00 0.00 179.25 179.40 1ovm h LEU 195 N 0.47 0.73 -0.14 0.00 5.85 -1.06 -1.36 115.31 119.78 1ovm h LEU 195 Ca 0.09 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1ovm h LEU 195 Cb 0.59 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 1ovm h LEU 195 CO 0.04 0.61 0.04 0.50 -0.34 0.00 0.00 178.44 179.29 1ovm h LYS 196 N 0.81 0.23 -0.99 1.25 3.11 -0.92 0.11 116.57 120.17 1ovm h LYS 196 Ca 0.20 -0.05 0.03 0.00 -2.81 0.00 0.00 60.65 58.03 1ovm h LYS 196 Cb 0.07 -0.03 -0.06 0.00 -1.00 0.00 0.00 32.23 31.21 1ovm h LYS 196 CO -0.03 0.36 0.65 0.00 -2.81 0.00 0.00 179.45 177.62 1ovm h ALA 197 N 0.86 1.35 -0.15 5.00 0.00 -0.88 0.13 119.26 125.56 1ovm h ALA 197 Ca 0.05 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1ovm h ALA 197 Cb 0.23 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1ovm h ALA 197 CO -0.00 0.57 0.02 0.35 0.00 0.00 0.00 179.25 180.19 1ovm h PHE 198 N 1.27 0.26 -0.22 0.00 3.57 -0.95 -2.13 116.94 118.73 1ovm h PHE 198 Ca 0.39 -0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.89 1ovm h PHE 198 Cb -0.03 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.60 1ovm h PHE 198 CO -0.00 0.43 -0.02 -0.09 -2.23 0.00 0.00 178.31 176.39 1ovm h ARG 199 N 0.02 0.04 -0.79 1.11 2.43 -0.04 0.10 114.38 117.24 1ovm h ARG 199 Ca 0.04 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1ovm h ARG 199 Cb 0.31 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.81 1ovm h ARG 199 CO 0.00 0.03 0.49 -0.44 -1.51 0.00 0.00 179.97 178.53 1ovm h ASP 200 N 0.04 0.95 -0.45 -3.80 3.32 -0.73 -0.08 116.42 115.66 1ovm h ASP 200 Ca 0.11 -0.06 -0.06 0.00 0.02 0.00 0.00 57.03 57.03 1ovm h ASP 200 Cb 0.15 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 1ovm h ASP 200 CO -0.20 0.73 0.03 0.00 -1.72 0.00 0.00 179.24 178.08 1ovm h ALA 201 N 1.26 0.60 -0.56 3.45 0.00 -0.94 -2.23 119.26 120.84 1ovm h ALA 201 Ca 0.29 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1ovm h ALA 201 Cb -0.05 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1ovm h ALA 201 CO -0.05 0.37 0.21 0.00 0.00 0.00 0.00 179.25 179.77 1ovm h ALA 202 N 0.93 0.73 0.12 0.00 0.00 -0.63 -2.71 119.26 117.70 1ovm h ALA 202 Ca 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1ovm h ALA 202 Cb 0.45 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ovm h ALA 202 CO 0.02 0.37 -0.06 1.49 0.00 0.00 0.00 179.25 181.07 1ovm h GLU 203 N 0.78 -0.15 -0.97 0.00 4.81 -0.91 0.58 114.58 118.72 1ovm h GLU 203 Ca 0.19 0.01 0.15 0.00 -0.13 0.00 0.00 59.36 59.57 1ovm h GLU 203 Cb 0.23 0.03 -0.08 0.00 0.63 0.00 0.00 28.75 29.56 1ovm h GLU 203 CO -0.01 -0.09 0.61 -0.91 -0.73 0.00 0.00 179.01 177.88 1ovm h ASN 204 N -0.17 0.78 0.03 1.04 4.21 -1.34 0.58 115.58 120.72 1ovm h ASN 204 Ca -0.02 0.06 -0.00 0.00 1.21 0.00 0.00 56.30 57.55 1ovm h ASN 204 Cb 0.13 -0.09 0.00 0.00 -1.12 0.00 0.00 38.32 37.24 1ovm h ASN 204 CO 0.03 0.37 -0.02 0.50 -1.29 0.00 0.00 177.43 177.02 1ovm h LYS 205 N 0.81 -0.04 -0.11 0.81 1.63 -1.12 -3.26 116.57 115.30 1ovm h LYS 205 Ca 0.50 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 60.23 1ovm h LYS 205 Cb 0.70 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.33 1ovm h LYS 205 CO -0.27 0.46 -0.29 -0.07 -3.45 0.00 0.00 179.45 175.83 1ovm h LEU 206 N -0.56 0.21 -2.18 5.20 4.07 -0.37 -2.98 115.31 118.70 1ovm h LEU 206 Ca -0.00 -0.07 -0.01 0.00 0.08 0.00 0.00 57.88 57.88 1ovm h LEU 206 Cb 0.52 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 42.20 1ovm h LEU 206 CO 0.01 0.50 -0.05 0.00 -1.08 0.00 0.00 178.44 177.82 1ovm h ALA 207 N 1.52 1.57 -0.38 1.53 0.00 0.12 -2.19 119.26 121.43 1ovm h ALA 207 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ovm h ALA 207 Cb 0.61 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1ovm h ALA 207 CO 0.04 0.06 0.00 -1.33 0.00 0.00 0.00 179.25 178.02 1ovm n MET 208 N -3.98 2.63 -2.76 0.00 2.81 -1.13 -4.98 117.12 109.71 1ovm n MET 208 Ca -0.03 -2.08 -0.42 0.00 -1.81 0.00 0.00 57.70 53.37 1ovm n MET 208 Cb 0.13 -1.32 -0.03 0.00 -0.71 0.00 0.00 33.22 31.29 1ovm n MET 208 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1ovm s SER 209 N -1.01 7.27 -0.05 7.83 0.15 -0.83 -4.95 113.70 122.11 1ovm s SER 209 Ca 0.27 1.55 -0.26 0.00 0.70 0.00 0.00 55.95 58.21 1ovm s SER 209 Cb 0.14 -2.54 -0.21 0.00 -1.71 0.00 0.00 66.02 61.71 1ovm s SER 209 CO 0.19 -0.29 1.08 0.11 1.20 0.00 0.00 173.24 175.53 1ovm h LYS 210 N 6.88 -0.04 -4.24 5.44 1.79 -1.94 -3.46 116.57 121.01 1ovm h LYS 210 Ca -0.38 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 57.82 1ovm h LYS 210 Cb 1.20 0.01 -0.25 0.00 -1.58 0.00 0.00 32.23 31.61 1ovm h LYS 210 CO 0.78 0.55 -0.73 0.50 -1.08 0.00 0.00 179.45 179.46 1ovm s ARG 211 N -3.65 0.36 -0.02 3.15 3.52 -1.26 -4.92 118.95 116.13 1ovm s ARG 211 Ca -0.16 -0.40 0.07 0.00 -0.13 0.00 0.00 55.73 55.11 1ovm s ARG 211 Cb 0.00 -0.22 -0.02 0.00 -1.56 0.00 0.00 34.95 33.16 1ovm s ARG 211 CO 0.64 0.05 -0.22 0.99 -0.81 0.00 0.00 175.30 175.95 1ovm s THR 212 N -0.71 1.74 0.14 4.11 2.01 -1.26 -2.76 115.64 118.91 1ovm s THR 212 Ca -0.05 -0.95 0.08 0.00 0.31 0.00 0.00 61.69 61.08 1ovm s THR 212 Cb -0.05 -1.45 -0.04 0.00 0.01 0.00 0.00 72.50 70.97 1ovm s THR 212 CO -0.00 0.49 -0.19 0.00 -0.69 0.00 0.00 174.62 174.23 1ovm s ALA 213 N -0.53 1.88 -0.16 7.40 0.00 -0.80 -4.09 121.76 125.45 1ovm s ALA 213 Ca 0.09 -1.38 -0.01 0.00 0.00 0.00 0.00 51.96 50.65 1ovm s ALA 213 Cb -0.09 -0.19 -0.01 0.00 0.00 0.00 0.00 23.12 22.84 1ovm s ALA 213 CO -0.01 0.26 -0.12 -1.17 0.00 0.00 0.00 175.76 174.72 1ovm s LEU 214 N -2.39 2.63 -0.20 0.00 0.20 0.33 0.05 118.68 119.31 1ovm s LEU 214 Ca 0.12 -0.41 0.01 0.00 0.69 0.00 0.00 54.13 54.53 1ovm s LEU 214 Cb -0.07 -1.61 0.04 0.00 -0.43 0.00 0.00 46.19 44.11 1ovm s LEU 214 CO 0.05 0.08 -0.12 -0.22 -0.29 0.00 0.00 176.35 175.86 1ovm s LEU 215 N 0.84 2.32 0.08 -0.68 2.96 0.19 -0.85 118.68 123.55 1ovm s LEU 215 Ca -0.04 -0.88 0.08 0.00 -0.22 0.00 0.00 54.13 53.08 1ovm s LEU 215 Cb -0.15 -1.28 -0.03 0.00 0.50 0.00 0.00 46.19 45.23 1ovm s LEU 215 CO 0.00 -0.13 -0.22 0.00 -1.32 0.00 0.00 176.35 174.69 1ovm s ALA 216 N 1.37 1.87 0.25 5.97 0.00 -0.57 0.22 121.76 130.87 1ovm s ALA 216 Ca -0.01 -1.20 0.05 0.00 0.00 0.00 0.00 51.96 50.80 1ovm s ALA 216 Cb -0.16 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.63 1ovm s ALA 216 CO -0.09 0.40 0.19 -3.47 0.00 0.00 0.00 175.76 172.80 1ovm n ASP 217 N 1.38 -0.30 -0.32 0.00 2.03 -0.18 -3.67 116.55 115.48 1ovm n ASP 217 Ca -0.18 -2.59 0.27 0.00 0.52 0.00 0.00 54.79 52.81 1ovm n ASP 217 Cb 0.53 1.15 0.45 0.00 -0.72 0.00 0.00 41.12 42.54 1ovm n ASP 217 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 1ovm n PHE 218 N -0.49 0.43 0.28 -0.67 -1.74 -1.26 -1.16 117.46 112.85 1ovm n PHE 218 Ca 0.04 0.43 0.13 0.00 -0.56 0.00 0.00 57.45 57.49 1ovm n PHE 218 Cb 0.44 -0.82 0.79 0.00 1.52 0.00 0.00 39.48 41.41 1ovm n PHE 218 CO 0.00 0.00 0.00 -0.07 -0.56 0.00 0.00 176.76 176.13 1ovm h LEU 219 N 0.00 0.00 -0.60 5.98 3.38 -1.86 0.12 115.31 122.33 1ovm h LEU 219 Ca 0.58 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.40 1ovm h LEU 219 Cb 1.91 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.64 1ovm h LEU 219 CO -0.28 0.06 -0.68 1.62 0.09 0.00 0.00 178.44 179.24 1ovm h VAL 220 N 0.00 1.46 -0.29 1.22 3.04 -1.38 -1.74 116.25 118.56 1ovm h VAL 220 Ca -0.00 -2.28 -0.06 0.00 -1.01 0.00 0.00 66.70 63.36 1ovm h VAL 220 Cb 0.13 2.22 -0.01 0.00 -2.01 0.00 0.00 31.29 31.62 1ovm h VAL 220 CO 0.01 0.66 -0.05 -0.07 -1.01 0.00 0.00 177.57 177.10 1ovm h LEU 221 N 0.05 0.54 -1.12 3.16 3.38 -0.95 -0.23 115.31 120.14 1ovm h LEU 221 Ca -0.01 -0.35 -0.07 0.00 0.09 0.00 0.00 57.88 57.54 1ovm h LEU 221 Cb 1.21 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 1ovm h LEU 221 CO 0.09 0.77 -0.13 0.03 0.09 0.00 0.00 178.44 179.29 1ovm h ARG 222 N 0.31 0.46 -0.66 1.13 2.47 -1.15 -2.76 114.38 114.18 1ovm h ARG 222 Ca 0.08 -0.13 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1ovm h ARG 222 Cb 0.52 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.79 1ovm h ARG 222 CO 0.02 0.59 0.00 0.72 0.56 0.00 0.00 179.97 181.87 1ovm n HIS 223 N -4.21 1.27 -3.69 3.04 8.25 -0.66 -4.94 115.22 114.28 1ovm n HIS 223 Ca 0.00 -0.46 -0.26 0.00 -0.26 0.00 0.00 57.72 56.73 1ovm n HIS 223 Cb 0.32 -0.30 0.05 0.00 1.12 0.00 0.00 29.99 31.19 1ovm n HIS 223 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ovm n GLY 224 N 0.64 -0.53 0.93 -1.41 0.00 -1.04 -4.91 105.19 98.88 1ovm n GLY 224 Ca 0.19 0.22 0.06 0.00 0.00 0.00 0.00 46.02 46.49 1ovm n GLY 224 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ovm n LEU 225 N -4.80 3.93 0.23 0.99 4.77 -0.12 -4.70 117.00 117.30 1ovm n LEU 225 Ca 0.02 -3.17 -0.15 0.00 -0.03 0.00 0.00 56.01 52.67 1ovm n LEU 225 Cb 0.55 -0.56 -0.08 0.00 -2.33 0.00 0.00 43.42 41.00 1ovm n LEU 225 CO 0.68 0.79 0.68 0.50 -1.33 0.00 0.00 177.39 178.71 1ovm h LYS 226 N 1.57 -0.63 -0.94 3.23 3.64 -1.89 -2.18 116.57 119.37 1ovm h LYS 226 Ca 0.05 0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.52 1ovm h LYS 226 Cb 1.50 0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 33.40 1ovm h LYS 226 CO 0.26 -0.42 0.62 0.45 -2.27 0.00 0.00 179.45 178.09 1ovm h HIS 227 N -0.65 1.13 -1.00 1.91 3.86 -1.91 -1.33 115.15 117.17 1ovm h HIS 227 Ca -0.04 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.22 1ovm h HIS 227 Cb 0.56 -0.38 -0.05 0.00 1.06 0.00 0.00 27.41 28.60 1ovm h HIS 227 CO -0.13 0.64 0.66 0.00 0.86 0.00 0.00 177.93 179.97 1ovm h ALA 228 N 1.46 1.28 -0.03 2.45 0.00 -1.81 0.05 119.26 122.66 1ovm h ALA 228 Ca 0.38 -0.06 -0.25 0.00 0.00 0.00 0.00 54.91 54.98 1ovm h ALA 228 Cb 0.05 -0.39 0.01 0.00 0.00 0.00 0.00 17.79 17.46 1ovm h ALA 228 CO -0.12 0.63 -0.97 -0.07 0.00 0.00 0.00 179.25 178.72 1ovm h LEU 229 N 1.33 0.83 -0.23 0.00 4.07 -0.75 -1.28 115.31 119.28 1ovm h LEU 229 Ca 0.37 -0.64 -0.01 0.00 0.08 0.00 0.00 57.88 57.69 1ovm h LEU 229 Cb -0.12 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 41.36 1ovm h LEU 229 CO -0.09 1.43 0.12 1.56 -1.08 0.00 0.00 178.44 180.38 1ovm h GLN 230 N 0.38 0.32 -0.46 1.13 4.20 -1.02 -1.30 115.11 118.37 1ovm h GLN 230 Ca -0.10 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.59 1ovm h GLN 230 Cb 1.61 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 29.30 1ovm h GLN 230 CO 0.19 0.31 0.26 -0.22 -0.67 0.00 0.00 178.83 178.69 1ovm h LYS 231 N 0.25 0.50 0.09 1.46 3.64 -1.02 -1.43 116.57 120.06 1ovm h LYS 231 Ca 0.08 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1ovm h LYS 231 Cb 0.09 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.76 1ovm h LYS 231 CO -0.01 0.33 -0.34 2.35 -2.27 0.00 0.00 179.45 179.51 1ovm h TRP 232 N 0.51 -0.98 -0.06 1.91 2.91 -0.73 -0.32 115.95 119.20 1ovm h TRP 232 Ca 0.19 0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.25 1ovm h TRP 232 Cb 0.05 0.41 -0.00 0.00 -0.51 0.00 0.00 29.16 29.11 1ovm h TRP 232 CO -0.08 -0.39 0.06 -0.24 -1.03 0.00 0.00 178.44 176.77 1ovm h VAL 233 N -0.49 0.57 -0.07 2.65 3.04 -1.14 0.11 116.25 120.92 1ovm h VAL 233 Ca -0.01 0.00 -0.09 0.00 -1.01 0.00 0.00 66.70 65.59 1ovm h VAL 233 Cb 0.49 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 30.73 1ovm h VAL 233 CO -0.18 0.00 -0.31 0.50 -1.01 0.00 0.00 177.57 176.57 1ovm h LYS 234 N 0.00 0.33 -0.11 4.17 3.64 -0.45 -3.20 116.57 120.95 1ovm h LYS 234 Ca 0.03 -0.27 -0.19 0.00 -1.27 0.00 0.00 60.65 58.95 1ovm h LYS 234 Cb 0.15 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1ovm h LYS 234 CO -0.00 0.91 -0.73 0.93 -2.27 0.00 0.00 179.45 178.29 1ovm h GLU 235 N -0.17 0.52 -3.36 1.90 5.08 -0.38 -3.38 114.58 114.79 1ovm h GLU 235 Ca -0.02 -0.41 -0.64 0.00 -1.00 0.00 0.00 59.36 57.28 1ovm h GLU 235 Cb 0.97 0.08 -0.41 0.00 0.50 0.00 0.00 28.75 29.89 1ovm h GLU 235 CO 0.07 1.04 -0.62 0.08 -1.00 0.00 0.00 179.01 178.58 1ovm s VAL 236 N -3.68 2.66 0.22 3.13 1.01 0.32 -5.07 120.40 118.98 1ovm s VAL 236 Ca -0.07 -3.41 -0.32 0.00 0.00 0.00 0.00 61.98 58.18 1ovm s VAL 236 Cb 0.10 -2.83 -0.12 0.00 0.00 0.00 0.00 36.38 33.53 1ovm s VAL 236 CO 0.86 -0.82 1.72 -2.65 0.00 0.00 0.00 175.10 174.20 1ovm n PRO 237 N 3.01 2.78 -3.69 2.72 -0.02 -1.21 -4.45 135.00 134.14 1ovm n PRO 237 Ca 0.06 1.00 -0.05 0.00 -2.02 0.00 0.00 63.50 62.50 1ovm n PRO 237 Cb 0.32 -2.85 -0.01 0.00 -0.02 0.00 0.00 33.50 30.94 1ovm n PRO 237 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ovm s MET 238 N 1.06 1.09 0.16 -0.52 0.23 -1.26 -4.94 119.30 115.12 1ovm s MET 238 Ca 0.74 -0.57 -0.31 0.00 -1.03 0.00 0.00 55.69 54.53 1ovm s MET 238 Cb -0.50 0.40 -0.09 0.00 -1.53 0.00 0.00 34.83 33.10 1ovm s MET 238 CO 0.33 -0.50 1.48 0.00 -2.03 0.00 0.00 175.02 174.30 1ovm s ALA 239 N -3.23 3.68 -0.08 3.16 0.00 -1.26 -4.58 121.76 119.45 1ovm s ALA 239 Ca 0.11 1.26 -0.12 0.00 0.00 0.00 0.00 51.96 53.21 1ovm s ALA 239 Cb -0.01 -3.58 0.03 0.00 0.00 0.00 0.00 23.12 19.56 1ovm s ALA 239 CO -0.01 -0.70 0.31 -3.38 0.00 0.00 0.00 175.76 171.98 1ovm s HIS 240 N 0.94 -0.28 0.34 0.00 -3.43 -0.43 -0.52 115.29 111.91 1ovm s HIS 240 Ca 0.66 0.62 -0.08 0.00 -0.80 0.00 0.00 55.06 55.46 1ovm s HIS 240 Cb -0.41 0.11 0.02 0.00 -1.43 0.00 0.00 32.58 30.86 1ovm s HIS 240 CO 0.33 -0.25 0.56 0.00 -2.00 0.00 0.00 174.74 173.37 1ovm s ALA 241 N -0.42 0.16 0.22 -1.38 0.00 -0.03 -4.33 121.76 115.98 1ovm s ALA 241 Ca -0.05 -1.18 -0.00 0.00 0.00 0.00 0.00 51.96 50.72 1ovm s ALA 241 Cb -0.04 1.01 -0.04 0.00 0.00 0.00 0.00 23.12 24.05 1ovm s ALA 241 CO 0.02 -0.86 0.11 0.95 0.00 0.00 0.00 175.76 175.98 1ovm s THR 242 N -3.04 0.24 0.59 0.00 -4.23 -1.26 -1.51 115.64 106.43 1ovm s THR 242 Ca 0.25 -1.99 0.09 0.00 -1.18 0.00 0.00 61.69 58.86 1ovm s THR 242 Cb -0.02 -2.51 0.09 0.00 1.34 0.00 0.00 72.50 71.40 1ovm s THR 242 CO 0.16 -0.05 0.76 -0.04 -0.54 0.00 0.00 174.62 174.91 1ovm s MET 243 N -4.10 2.25 0.22 3.99 -1.94 -1.24 -1.41 119.30 117.07 1ovm s MET 243 Ca 0.37 -1.75 -0.13 0.00 -1.71 0.00 0.00 55.69 52.48 1ovm s MET 243 Cb 0.07 -2.55 0.28 0.00 2.01 0.00 0.00 34.83 34.64 1ovm s MET 243 CO 0.12 -0.89 1.61 1.25 -0.01 0.00 0.00 175.02 177.10 1ovm h LEU 244 N 0.21 -0.69 -0.80 -0.03 6.46 -1.88 -2.14 115.31 116.44 1ovm h LEU 244 Ca -0.30 0.21 0.04 0.00 -0.12 0.00 0.00 57.88 57.72 1ovm h LEU 244 Cb 1.29 0.45 -0.05 0.00 -0.73 0.00 0.00 40.66 41.62 1ovm h LEU 244 CO 0.43 -0.24 0.50 0.24 -0.62 0.00 0.00 178.44 178.75 1ovm h MET 245 N -0.01 0.93 -0.15 1.25 2.86 -1.94 -2.72 114.93 115.15 1ovm h MET 245 Ca 0.34 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.92 1ovm h MET 245 Cb 0.52 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 31.97 1ovm h MET 245 CO -0.73 0.62 0.00 0.41 1.06 0.00 0.00 176.91 178.26 1ovm n GLY 246 N -1.32 0.23 3.63 8.32 0.00 -0.86 -4.29 105.19 110.91 1ovm n GLY 246 Ca 0.10 -0.41 -0.49 0.00 0.00 0.00 0.00 46.02 45.21 1ovm n GLY 246 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1ovm n LYS 247 N 0.28 1.60 0.00 1.61 4.81 -0.90 -2.47 118.16 123.09 1ovm n LYS 247 Ca 0.16 0.58 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 1ovm n LYS 247 Cb 0.33 -2.28 0.00 0.00 0.02 0.00 0.00 35.03 33.10 1ovm n LYS 247 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ovm n GLY 248 N 2.93 2.16 0.17 3.14 0.00 -1.26 -4.30 105.19 108.03 1ovm n GLY 248 Ca 0.18 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.23 1ovm n GLY 248 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1ovm h ILE 249 N 0.00 1.11 -3.19 -0.61 3.07 -1.80 -3.44 117.51 112.65 1ovm h ILE 249 Ca 0.00 -1.74 -0.63 0.00 1.55 0.00 0.00 64.86 64.04 1ovm h ILE 249 Cb 0.00 2.00 -0.12 0.00 -0.27 0.00 0.00 36.82 38.43 1ovm h ILE 249 CO 0.00 0.46 -0.68 -0.36 -1.05 0.00 0.00 178.15 176.52 1ovm s PHE 250 N -3.63 2.87 -0.72 0.16 0.08 -1.26 -4.68 117.98 110.80 1ovm s PHE 250 Ca -0.01 -0.11 -0.27 0.00 0.12 0.00 0.00 56.93 56.67 1ovm s PHE 250 Cb 0.12 -1.44 0.03 0.00 -0.57 0.00 0.00 43.02 41.15 1ovm s PHE 250 CO 0.72 0.48 1.28 0.34 -0.10 0.00 0.00 175.22 177.94 1ovm s ASP 251 N -2.56 6.18 0.00 1.36 -1.08 -1.26 -4.89 116.67 114.42 1ovm s ASP 251 Ca 0.25 -0.36 0.10 0.00 -0.52 0.00 0.00 52.55 52.02 1ovm s ASP 251 Cb -0.10 -2.56 0.59 0.00 -1.46 0.00 0.00 42.92 39.39 1ovm s ASP 251 CO 0.17 -1.80 1.05 -0.62 0.52 0.00 0.00 175.17 174.49 1ovm n GLU 252 N 9.25 0.52 0.00 4.34 1.02 -0.62 -2.41 120.64 132.74 1ovm n GLU 252 Ca 0.04 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.30 1ovm n GLU 252 Cb 0.49 -1.30 0.10 0.00 -0.02 0.00 0.00 31.44 30.71 1ovm n GLU 252 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1ovm n ARG 253 N -0.80 0.82 -1.92 3.49 1.74 -1.24 -4.83 116.66 113.92 1ovm n ARG 253 Ca 0.07 -0.63 -0.29 0.00 -0.77 0.00 0.00 57.85 56.24 1ovm n ARG 253 Cb 0.03 -1.49 0.08 0.00 -1.02 0.00 0.00 32.46 30.07 1ovm n ARG 253 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1ovm s GLN 254 N -2.61 2.13 0.18 5.56 -1.52 -1.01 -5.03 119.66 117.37 1ovm s GLN 254 Ca 0.18 0.14 -0.30 0.00 -1.95 0.00 0.00 55.36 53.43 1ovm s GLN 254 Cb 0.18 -1.98 -0.08 0.00 -0.22 0.00 0.00 33.01 30.91 1ovm s GLN 254 CO 0.62 -1.48 1.20 0.00 -0.25 0.00 0.00 175.29 175.38 1ovm s ALA 255 N -3.52 3.44 0.00 6.09 0.00 -1.26 -3.33 121.76 123.18 1ovm s ALA 255 Ca 0.61 0.96 0.00 0.00 0.00 0.00 0.00 51.96 53.53 1ovm s ALA 255 Cb -0.11 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.59 1ovm s ALA 255 CO 0.49 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 176.28 1ovm n GLY 256 N 2.20 0.30 3.53 0.00 0.00 -1.26 -4.78 105.19 105.17 1ovm n GLY 256 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1ovm n GLY 256 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ovm s PHE 257 N -2.00 3.16 -0.88 1.61 2.19 -1.21 -1.32 117.98 119.53 1ovm s PHE 257 Ca 0.00 -0.11 0.08 0.00 0.33 0.00 0.00 56.93 57.23 1ovm s PHE 257 Cb 0.00 -2.32 0.14 0.00 -1.31 0.00 0.00 43.02 39.53 1ovm s PHE 257 CO 0.00 -0.24 0.95 0.66 1.83 0.00 0.00 175.22 178.42 1ovm n TYR 258 N 4.98 0.15 0.00 10.12 4.02 -1.26 -4.93 117.16 130.24 1ovm n TYR 258 Ca -0.15 -0.22 0.00 0.00 -0.01 0.00 0.00 57.90 57.52 1ovm n TYR 258 Cb 0.52 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.82 1ovm n TYR 258 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ovm n GLY 259 N 0.37 2.27 3.74 2.72 0.00 -1.26 -4.49 105.19 108.53 1ovm n GLY 259 Ca 0.06 -2.00 -0.41 0.00 0.00 0.00 0.00 46.02 43.68 1ovm n GLY 259 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ovm s THR 260 N -1.67 4.25 0.02 2.61 2.01 -1.26 -4.63 115.64 116.96 1ovm s THR 260 Ca 0.00 2.02 -0.22 0.00 0.31 0.00 0.00 61.69 63.80 1ovm s THR 260 Cb 0.00 -4.29 -0.06 0.00 0.01 0.00 0.00 72.50 68.17 1ovm s THR 260 CO 0.00 0.38 0.65 -0.47 -0.69 0.00 0.00 174.62 174.49 1ovm s TYR 261 N -0.50 3.71 -0.42 4.92 5.04 -0.50 -4.77 117.35 124.84 1ovm s TYR 261 Ca 0.45 1.30 0.09 0.00 -2.44 0.00 0.00 57.07 56.46 1ovm s TYR 261 Cb -0.25 -2.66 0.36 0.00 0.35 0.00 0.00 41.96 39.75 1ovm s TYR 261 CO 0.31 0.35 1.15 -1.13 -1.34 0.00 0.00 175.55 174.90 1ovm n SER 262 N 2.64 -1.54 0.00 4.32 3.41 -1.26 -4.27 113.62 116.92 1ovm n SER 262 Ca -0.06 -3.10 0.00 0.00 -0.26 0.00 0.00 58.87 55.45 1ovm n SER 262 Cb 0.51 1.13 0.00 0.00 -0.26 0.00 0.00 64.21 65.59 1ovm n SER 262 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ovm n GLY 263 N -0.03 0.88 0.14 5.00 0.00 -1.26 -2.86 105.19 107.07 1ovm n GLY 263 Ca 0.05 -0.70 0.12 0.00 0.00 0.00 0.00 46.02 45.48 1ovm n GLY 263 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ovm n SER 264 N -1.45 0.63 0.00 1.61 3.41 -1.15 -1.45 113.62 115.22 1ovm n SER 264 Ca 0.00 0.70 0.15 0.00 -0.26 0.00 0.00 58.87 59.47 1ovm n SER 264 Cb 0.00 -0.82 0.85 0.00 -0.26 0.00 0.00 64.21 63.98 1ovm n SER 264 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ovm n ALA 265 N -1.78 2.57 -1.49 7.33 0.00 -1.13 -4.83 120.51 121.18 1ovm n ALA 265 Ca 0.01 -0.17 -0.29 0.00 0.00 0.00 0.00 53.44 52.98 1ovm n ALA 265 Cb 0.16 -1.50 0.12 0.00 0.00 0.00 0.00 19.45 18.22 1ovm n ALA 265 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1ovm s SER 266 N -2.30 3.88 0.68 0.00 0.01 -0.53 -4.88 113.70 110.57 1ovm s SER 266 Ca 0.38 1.18 -0.11 0.00 1.31 0.00 0.00 55.95 58.71 1ovm s SER 266 Cb 0.21 -1.84 -0.00 0.00 0.21 0.00 0.00 66.02 64.60 1ovm s SER 266 CO 0.41 -2.34 1.06 0.42 0.41 0.00 0.00 173.24 173.20 1ovm s THR 267 N -3.17 4.12 0.27 1.44 -4.23 -1.26 -4.80 115.64 108.01 1ovm s THR 267 Ca 0.62 0.69 -0.02 0.00 -1.18 0.00 0.00 61.69 61.81 1ovm s THR 267 Cb -0.15 -3.50 0.26 0.00 1.34 0.00 0.00 72.50 70.45 1ovm s THR 267 CO 0.54 -0.90 1.85 1.23 -0.54 0.00 0.00 174.62 176.80 1ovm h GLY 268 N -0.64 1.51 0.86 3.99 0.00 -1.96 0.15 103.07 106.98 1ovm h GLY 268 Ca -0.44 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.48 1ovm h GLY 268 CO 0.58 0.22 -0.13 0.00 0.00 0.00 0.00 176.54 177.22 1ovm h ALA 269 N 1.48 -0.26 0.02 3.60 0.00 -1.92 -0.12 119.26 122.06 1ovm h ALA 269 Ca 0.45 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.32 1ovm h ALA 269 Cb 0.34 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ovm h ALA 269 CO -0.23 -0.66 -0.01 0.28 0.00 0.00 0.00 179.25 178.63 1ovm h VAL 270 N -0.29 1.07 -0.94 0.00 2.07 -1.69 0.31 116.25 116.78 1ovm h VAL 270 Ca 0.00 -0.25 0.13 0.00 0.82 0.00 0.00 66.70 67.40 1ovm h VAL 270 Cb 0.27 1.24 -0.08 0.00 -1.52 0.00 0.00 31.29 31.20 1ovm h VAL 270 CO -0.02 0.07 0.60 0.50 0.02 0.00 0.00 177.57 178.73 1ovm h LYS 271 N -0.13 0.79 -0.03 1.57 3.64 -0.86 -0.07 116.57 121.48 1ovm h LYS 271 Ca -0.00 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.23 1ovm h LYS 271 Cb 0.13 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1ovm h LYS 271 CO 0.00 0.52 -0.37 0.93 -2.27 0.00 0.00 179.45 178.27 1ovm h GLU 272 N 0.82 0.30 -0.92 1.90 4.39 -0.73 -0.98 114.58 119.36 1ovm h GLU 272 Ca 0.47 -0.28 0.01 0.00 0.34 0.00 0.00 59.36 59.90 1ovm h GLU 272 Cb 0.62 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.30 1ovm h GLU 272 CO -0.23 0.96 0.61 0.00 -1.16 0.00 0.00 179.01 179.19 1ovm h ALA 273 N 0.34 1.35 0.00 3.43 0.00 -0.31 -0.37 119.26 123.71 1ovm h ALA 273 Ca -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ovm h ALA 273 Cb 1.07 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1ovm h ALA 273 CO 0.07 0.59 -0.33 -0.89 0.00 0.00 0.00 179.25 178.70 1ovm n ILE 274 N -4.40 0.74 0.31 0.00 2.08 -0.10 -4.12 119.36 113.87 1ovm n ILE 274 Ca 0.11 0.34 0.20 0.00 0.56 0.00 0.00 62.75 63.96 1ovm n ILE 274 Cb 0.03 -1.95 1.01 0.00 -0.75 0.00 0.00 39.64 37.98 1ovm n ILE 274 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 1ovm h GLU 275 N -0.52 0.00 0.00 0.38 5.08 -1.33 -2.71 114.58 115.49 1ovm h GLU 275 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1ovm h GLU 275 Cb 0.33 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 1ovm h GLU 275 CO 0.00 0.01 -0.15 0.78 -1.00 0.00 0.00 179.01 178.65 1ovm h GLY 276 N 0.62 0.00 -2.50 -3.84 0.00 -0.96 -3.46 103.07 92.94 1ovm h GLY 276 Ca -0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 1ovm h GLY 276 CO 0.00 0.00 0.44 0.00 0.00 0.00 0.00 176.54 176.98 1ovm s ALA 277 N -3.30 2.93 -0.88 3.60 0.00 -1.02 -4.93 121.76 118.16 1ovm s ALA 277 Ca 0.04 0.79 0.27 0.00 0.00 0.00 0.00 51.96 53.06 1ovm s ALA 277 Cb 0.07 -3.32 1.04 0.00 0.00 0.00 0.00 23.12 20.91 1ovm s ALA 277 CO 0.66 -0.49 1.84 -0.40 0.00 0.00 0.00 175.76 177.37 1ovm n ASP 278 N -0.61 0.33 -3.67 0.00 5.75 -1.11 -4.61 116.55 112.63 1ovm n ASP 278 Ca 0.08 0.53 -0.15 0.00 -0.01 0.00 0.00 54.79 55.25 1ovm n ASP 278 Cb 0.50 -0.62 -0.14 0.00 -1.03 0.00 0.00 41.12 39.82 1ovm n ASP 278 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1ovm s THR 279 N -3.05 -0.32 -0.09 2.12 -4.23 -1.21 -4.61 115.64 104.25 1ovm s THR 279 Ca 0.12 0.30 0.04 0.00 -1.18 0.00 0.00 61.69 60.96 1ovm s THR 279 Cb 0.16 -0.38 0.00 0.00 1.34 0.00 0.00 72.50 73.62 1ovm s THR 279 CO 0.54 0.12 -0.22 0.54 -0.54 0.00 0.00 174.62 175.06 1ovm s VAL 280 N 2.25 1.89 -0.32 2.29 0.11 -0.39 -1.91 120.40 124.32 1ovm s VAL 280 Ca 0.01 -0.92 -0.21 0.00 -2.93 0.00 0.00 61.98 57.93 1ovm s VAL 280 Cb -0.12 -1.64 -0.00 0.00 -1.53 0.00 0.00 36.38 33.09 1ovm s VAL 280 CO -0.07 0.52 0.69 -0.76 -3.33 0.00 0.00 175.10 172.15 1ovm s LEU 281 N 0.42 4.14 -0.45 2.54 1.43 0.11 -2.61 118.68 124.26 1ovm s LEU 281 Ca -0.18 0.45 -0.13 0.00 -1.03 0.00 0.00 54.13 53.24 1ovm s LEU 281 Cb -0.18 -2.91 0.07 0.00 0.03 0.00 0.00 46.19 43.21 1ovm s LEU 281 CO 0.08 -0.56 0.34 0.00 0.23 0.00 0.00 176.35 176.43 1ovm s VAL 283 N 1.57 3.87 -1.62 0.00 1.01 0.13 -1.21 120.40 124.16 1ovm s VAL 283 Ca 0.04 -0.33 -0.03 0.00 0.00 0.00 0.00 61.98 61.66 1ovm s VAL 283 Cb -0.23 -2.77 0.01 0.00 0.00 0.00 0.00 36.38 33.38 1ovm s VAL 283 CO 0.05 0.40 0.37 0.61 0.00 0.00 0.00 175.10 176.53 1ovm n GLY 284 N 4.65 -0.51 3.84 4.51 0.00 -0.70 -1.01 105.19 115.97 1ovm n GLY 284 Ca -0.17 0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1ovm n GLY 284 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ovm s THR 285 N -3.10 4.81 -0.21 2.61 -1.32 -1.26 -3.08 115.64 114.08 1ovm s THR 285 Ca 0.19 0.91 -0.04 0.00 -1.21 0.00 0.00 61.69 61.54 1ovm s THR 285 Cb -0.08 -3.76 0.09 0.00 -1.51 0.00 0.00 72.50 67.24 1ovm s THR 285 CO 0.23 0.24 0.18 -0.60 -2.21 0.00 0.00 174.62 172.47 1ovm s ARG 286 N -1.94 0.17 -1.25 7.08 6.06 -1.26 -5.04 118.95 122.77 1ovm s ARG 286 Ca 0.38 0.01 -0.16 0.00 -2.50 0.00 0.00 55.73 53.46 1ovm s ARG 286 Cb -0.15 -1.31 0.12 0.00 0.06 0.00 0.00 34.95 33.67 1ovm s ARG 286 CO 0.19 -0.74 1.59 -0.06 -2.50 0.00 0.00 175.30 173.78 1ovm s PHE 287 N 2.26 3.11 0.69 5.12 0.08 -1.26 -4.97 117.98 123.01 1ovm s PHE 287 Ca 0.06 -1.85 -0.10 0.00 0.12 0.00 0.00 56.93 55.16 1ovm s PHE 287 Cb -0.16 -4.55 0.02 0.00 -0.57 0.00 0.00 43.02 37.77 1ovm s PHE 287 CO -0.16 -1.62 1.06 0.95 -0.10 0.00 0.00 175.22 175.35 1ovm s THR 288 N 3.00 3.35 0.24 0.64 -4.23 -1.26 -4.92 115.64 112.47 1ovm s THR 288 Ca 0.48 0.32 -0.06 0.00 -1.18 0.00 0.00 61.69 61.25 1ovm s THR 288 Cb 0.01 -3.42 0.21 0.00 1.34 0.00 0.00 72.50 70.64 1ovm s THR 288 CO 0.04 -0.52 1.87 -2.24 -0.54 0.00 0.00 174.62 173.22 1ovm h ASP 289 N -0.59 1.10 0.14 3.99 2.03 -1.96 -2.39 116.42 118.73 1ovm h ASP 289 Ca -0.45 -0.10 -0.12 0.00 -0.73 0.00 0.00 57.03 55.64 1ovm h ASP 289 Cb 1.26 -0.28 -0.01 0.00 -0.83 0.00 0.00 39.33 39.47 1ovm h ASP 289 CO 0.63 0.88 -0.42 0.71 -1.03 0.00 0.00 179.24 180.02 1ovm h THR 290 N 1.23 1.31 0.00 1.15 1.35 -1.94 0.31 112.91 116.32 1ovm h THR 290 Ca 0.31 -1.56 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 1ovm h THR 290 Cb 0.03 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 1ovm h THR 290 CO -0.05 0.47 0.00 -0.07 -0.25 0.00 0.00 175.52 175.62 1ovm h LEU 291 N 0.29 0.00 -2.99 3.87 4.07 -1.85 -3.31 115.31 115.38 1ovm h LEU 291 Ca 0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1ovm h LEU 291 Cb 0.86 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.60 1ovm h LEU 291 CO 0.07 0.00 0.00 0.35 -1.08 0.00 0.00 178.44 177.78 1ovm n THR 292 N -3.08 1.28 -3.51 0.22 -2.24 -0.92 -4.16 114.28 101.86 1ovm n THR 292 Ca 0.04 -1.28 -0.21 0.00 -2.27 0.00 0.00 64.05 60.32 1ovm n THR 292 Cb 0.50 0.31 0.06 0.00 -2.10 0.00 0.00 70.33 69.10 1ovm n THR 292 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ovm n ALA 293 N -0.30 -2.31 -2.62 6.98 0.00 -0.87 -1.51 120.51 119.87 1ovm n ALA 293 Ca 0.09 -0.07 -0.04 0.00 0.00 0.00 0.00 53.44 53.41 1ovm n ALA 293 Cb 0.44 -3.85 0.01 0.00 0.00 0.00 0.00 19.45 16.05 1ovm n ALA 293 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ovm n GLY 294 N -1.43 0.62 3.51 0.00 0.00 0.04 -3.95 105.19 103.99 1ovm n GLY 294 Ca -0.17 -0.53 -0.19 0.00 0.00 0.00 0.00 46.02 45.13 1ovm n GLY 294 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ovm n PHE 295 N -3.10 -2.25 -0.81 1.61 3.72 -1.19 -4.92 117.46 110.51 1ovm n PHE 295 Ca -0.00 0.93 0.08 0.00 -0.05 0.00 0.00 57.45 58.41 1ovm n PHE 295 Cb 0.51 -4.94 0.33 0.00 -0.94 0.00 0.00 39.48 34.45 1ovm n PHE 295 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1ovm n THR 296 N -4.30 2.27 -2.50 4.37 -2.24 -0.57 -4.98 114.28 106.33 1ovm n THR 296 Ca -0.24 -1.47 -0.40 0.00 -2.27 0.00 0.00 64.05 59.67 1ovm n THR 296 Cb 0.65 -0.11 -0.04 0.00 -2.10 0.00 0.00 70.33 68.72 1ovm n THR 296 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 1ovm s HIS 297 N -2.43 3.62 -0.96 4.78 -3.43 -1.26 -2.94 115.29 112.66 1ovm s HIS 297 Ca 0.48 1.71 -0.04 0.00 -0.80 0.00 0.00 55.06 56.41 1ovm s HIS 297 Cb 0.35 -3.26 0.24 0.00 -1.43 0.00 0.00 32.58 28.48 1ovm s HIS 297 CO 0.16 -0.47 0.89 -0.65 -2.00 0.00 0.00 174.74 172.67 1ovm s GLN 298 N -1.35 3.56 -0.04 -0.38 -1.52 -1.26 -5.00 119.66 113.68 1ovm s GLN 298 Ca 0.44 -3.29 0.01 0.00 -1.95 0.00 0.00 55.36 50.58 1ovm s GLN 298 Cb -0.31 -4.13 0.02 0.00 -0.22 0.00 0.00 33.01 28.37 1ovm s GLN 298 CO 0.40 -1.26 -0.03 -0.51 -0.25 0.00 0.00 175.29 173.64 1ovm s LEU 299 N -1.37 1.31 0.26 2.90 1.43 -1.26 -4.80 118.68 117.15 1ovm s LEU 299 Ca 0.29 -0.10 0.08 0.00 -1.03 0.00 0.00 54.13 53.36 1ovm s LEU 299 Cb -0.08 -0.39 -0.04 0.00 0.03 0.00 0.00 46.19 45.71 1ovm s LEU 299 CO -0.11 -0.06 0.17 0.42 0.23 0.00 0.00 176.35 176.99 1ovm s THR 300 N 0.91 4.21 0.16 5.49 -4.23 -1.26 -5.02 115.64 115.89 1ovm s THR 300 Ca -0.11 -1.49 -0.16 0.00 -1.18 0.00 0.00 61.69 58.74 1ovm s THR 300 Cb -0.14 -3.29 0.02 0.00 1.34 0.00 0.00 72.50 70.43 1ovm s THR 300 CO -0.00 -0.34 1.76 -0.65 -0.54 0.00 0.00 174.62 174.84 1ovm h PRO 301 N 1.55 0.30 -0.57 3.99 0.11 -1.92 -1.77 132.00 133.68 1ovm h PRO 301 Ca -0.48 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 1ovm h PRO 301 Cb 1.24 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 1ovm h PRO 301 CO 0.61 0.20 0.29 0.00 -0.21 0.00 0.00 178.00 178.88 1ovm h ALA 302 N 1.22 1.44 0.00 -0.75 0.00 -1.96 -2.16 119.26 117.05 1ovm h ALA 302 Ca 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ovm h ALA 302 Cb 0.12 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1ovm h ALA 302 CO -0.15 0.45 0.00 0.94 0.00 0.00 0.00 179.25 180.49 1ovm n GLN 303 N -4.38 0.06 -4.55 0.00 7.27 -0.82 -4.65 117.38 110.32 1ovm n GLN 303 Ca 0.05 0.14 -0.26 0.00 0.07 0.00 0.00 57.00 57.00 1ovm n GLN 303 Cb 0.11 -1.59 -0.11 0.00 2.41 0.00 0.00 30.24 31.07 1ovm n GLN 303 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1ovm s THR 304 N -3.05 2.14 -0.13 1.69 -4.23 -0.73 -1.26 115.64 110.07 1ovm s THR 304 Ca 0.11 -2.16 -0.04 0.00 -1.18 0.00 0.00 61.69 58.42 1ovm s THR 304 Cb 0.15 -2.70 0.05 0.00 1.34 0.00 0.00 72.50 71.34 1ovm s THR 304 CO 0.46 -0.17 0.10 -0.63 -0.54 0.00 0.00 174.62 173.85 1ovm s ILE 305 N -2.67 -0.13 0.08 2.99 1.01 -1.07 -2.37 121.20 119.04 1ovm s ILE 305 Ca 0.33 0.04 0.10 0.00 0.00 0.00 0.00 60.65 61.12 1ovm s ILE 305 Cb 0.04 -0.45 -0.03 0.00 0.01 0.00 0.00 42.46 42.03 1ovm s ILE 305 CO 0.16 -0.12 -0.26 -1.83 0.00 0.00 0.00 174.94 172.89 1ovm s GLU 306 N 2.18 1.64 -0.09 2.79 -1.05 -0.04 -0.73 118.70 123.39 1ovm s GLU 306 Ca 0.03 -1.21 0.04 0.00 -0.15 0.00 0.00 54.97 53.68 1ovm s GLU 306 Cb -0.15 -1.95 0.00 0.00 -0.44 0.00 0.00 34.13 31.59 1ovm s GLU 306 CO -0.07 0.49 -0.21 0.14 0.95 0.00 0.00 175.26 176.55 1ovm s VAL 307 N -0.92 1.81 0.46 1.83 -7.23 -0.35 0.69 120.40 116.71 1ovm s VAL 307 Ca 0.13 -0.88 0.05 0.00 -1.81 0.00 0.00 61.98 59.47 1ovm s VAL 307 Cb -0.10 -1.58 -0.03 0.00 0.56 0.00 0.00 36.38 35.23 1ovm s VAL 307 CO 0.04 0.51 0.14 -1.10 -0.31 0.00 0.00 175.10 174.38 1ovm s GLN 308 N 0.42 2.18 0.34 4.82 -1.52 0.15 -1.72 119.66 124.33 1ovm s GLN 308 Ca -0.18 -2.08 0.12 0.00 -1.95 0.00 0.00 55.36 51.27 1ovm s GLN 308 Cb -0.17 -1.82 0.97 0.00 -0.22 0.00 0.00 33.01 31.77 1ovm s GLN 308 CO 0.08 -0.27 1.72 -1.35 -0.25 0.00 0.00 175.29 175.22 1ovm h PRO 309 N 1.34 0.48 0.00 2.91 0.11 -1.97 -3.15 132.00 131.72 1ovm h PRO 309 Ca -0.42 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1ovm h PRO 309 Cb 1.28 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1ovm h PRO 309 CO 0.71 0.32 -0.04 0.72 -0.21 0.00 0.00 178.00 179.50 1ovm n HIS 310 N -4.88 0.00 -3.58 0.65 8.25 -1.26 -1.98 115.22 112.43 1ovm n HIS 310 Ca 0.28 -0.31 -0.17 0.00 -0.26 0.00 0.00 57.72 57.26 1ovm n HIS 310 Cb 0.83 -0.04 -0.07 0.00 1.12 0.00 0.00 29.99 31.83 1ovm n HIS 310 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ovm s ALA 311 N -0.69 -1.55 0.14 -1.41 0.00 -1.14 -0.91 121.76 116.20 1ovm s ALA 311 Ca 0.03 1.13 0.07 0.00 0.00 0.00 0.00 51.96 53.19 1ovm s ALA 311 Cb 0.02 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 1ovm s ALA 311 CO 0.00 -0.34 -0.16 0.00 0.00 0.00 0.00 175.76 175.26 1ovm s ALA 312 N -1.15 1.72 0.01 0.00 0.00 -0.69 0.33 121.76 121.98 1ovm s ALA 312 Ca -0.11 -1.38 0.02 0.00 0.00 0.00 0.00 51.96 50.50 1ovm s ALA 312 Cb -0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.97 1ovm s ALA 312 CO 0.08 0.16 -0.07 0.50 0.00 0.00 0.00 175.76 176.44 1ovm s ARG 313 N -2.71 0.55 -0.15 0.00 3.52 0.22 0.32 118.95 120.69 1ovm s ARG 313 Ca 0.12 -0.35 -0.01 0.00 -0.13 0.00 0.00 55.73 55.36 1ovm s ARG 313 Cb -0.05 -0.50 0.04 0.00 -1.56 0.00 0.00 34.95 32.88 1ovm s ARG 313 CO 0.05 0.13 -0.03 0.14 -0.81 0.00 0.00 175.30 174.77 1ovm s VAL 314 N -0.38 0.91 0.00 7.11 -7.23 -0.55 -0.86 120.40 119.39 1ovm s VAL 314 Ca 0.01 -0.48 0.00 0.00 -1.81 0.00 0.00 61.98 59.70 1ovm s VAL 314 Cb -0.04 -1.12 0.00 0.00 0.56 0.00 0.00 36.38 35.78 1ovm s VAL 314 CO -0.00 0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.52 1ovm n GLY 315 N 4.95 3.60 0.27 2.32 0.00 -1.00 -1.97 105.19 113.36 1ovm n GLY 315 Ca -0.11 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.01 1ovm n GLY 315 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ovm n ASP 316 N 9.18 1.55 -4.77 1.61 8.00 -1.26 -4.61 116.55 126.25 1ovm n ASP 316 Ca 0.00 -1.27 -0.37 0.00 0.71 0.00 0.00 54.79 53.86 1ovm n ASP 316 Cb 0.00 0.70 -0.07 0.00 -0.02 0.00 0.00 41.12 41.74 1ovm n ASP 316 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ovm s VAL 317 N -2.72 5.28 -0.05 2.53 1.01 -0.83 -5.08 120.40 120.54 1ovm s VAL 317 Ca 0.14 0.55 -0.01 0.00 0.00 0.00 0.00 61.98 62.66 1ovm s VAL 317 Cb 0.17 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1ovm s VAL 317 CO 0.71 0.46 0.02 0.26 0.00 0.00 0.00 175.10 176.54 1ovm s TRP 318 N -0.07 3.16 -0.37 5.22 0.52 -1.26 -1.49 118.94 124.65 1ovm s TRP 318 Ca 0.18 0.17 0.04 0.00 0.02 0.00 0.00 56.10 56.50 1ovm s TRP 318 Cb -0.14 -1.75 0.11 0.00 -1.15 0.00 0.00 33.47 30.54 1ovm s TRP 318 CO 0.06 0.49 0.09 -0.06 0.02 0.00 0.00 176.95 177.55 1ovm s PHE 319 N -0.99 3.49 0.45 -1.98 0.40 0.15 -4.99 117.98 114.51 1ovm s PHE 319 Ca 0.17 -2.94 -0.14 0.00 -0.60 0.00 0.00 56.93 53.41 1ovm s PHE 319 Cb -0.11 -2.81 -0.08 0.00 0.51 0.00 0.00 43.02 40.53 1ovm s PHE 319 CO 0.06 -0.91 0.88 0.95 0.70 0.00 0.00 175.22 176.91 1ovm s THR 320 N 0.73 4.63 0.00 0.64 -4.23 -1.26 -1.71 115.64 114.44 1ovm s THR 320 Ca 0.12 0.99 0.00 0.00 -1.18 0.00 0.00 61.69 61.62 1ovm s THR 320 Cb -0.20 -3.71 0.00 0.00 1.34 0.00 0.00 72.50 69.93 1ovm s THR 320 CO -0.08 -0.56 0.00 0.61 -0.54 0.00 0.00 174.62 174.05 1ovm n GLY 321 N -1.31 0.74 3.11 3.99 0.00 -0.09 -4.97 105.19 106.66 1ovm n GLY 321 Ca 0.05 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 45.11 1ovm n GLY 321 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ovm s ILE 322 N -2.00 2.14 0.30 -0.61 1.01 -0.72 -4.20 121.20 117.13 1ovm s ILE 322 Ca 0.00 -1.18 -0.29 0.00 0.00 0.00 0.00 60.65 59.18 1ovm s ILE 322 Cb 0.00 -2.03 -0.11 0.00 0.01 0.00 0.00 42.46 40.33 1ovm s ILE 322 CO 0.00 0.33 1.51 -2.84 0.00 0.00 0.00 174.94 173.95 1ovm s PRO 323 N 1.23 4.17 0.22 2.79 0.02 -1.26 -2.87 135.00 139.30 1ovm s PRO 323 Ca 0.00 2.48 -0.13 0.00 0.02 0.00 0.00 61.00 63.38 1ovm s PRO 323 Cb -0.16 -3.04 0.28 0.00 0.02 0.00 0.00 34.50 31.61 1ovm s PRO 323 CO -0.10 -0.53 1.61 1.98 -0.33 0.00 0.00 177.00 179.64 1ovm h MET 324 N 4.39 -0.00 -0.81 5.54 1.85 -1.52 -1.08 114.93 123.29 1ovm h MET 324 Ca -0.48 0.00 0.04 0.00 -0.61 0.00 0.00 59.70 58.66 1ovm h MET 324 Cb 1.22 0.00 -0.05 0.00 0.43 0.00 0.00 31.60 33.21 1ovm h MET 324 CO 0.75 -0.00 0.53 -2.95 -0.40 0.00 0.00 176.91 174.84 1ovm h ASN 325 N -0.00 0.84 0.12 1.39 -1.07 -1.90 -1.20 115.58 113.75 1ovm h ASN 325 Ca 0.34 -0.01 -0.19 0.00 0.07 0.00 0.00 56.30 56.51 1ovm h ASN 325 Cb 0.52 -0.19 -0.00 0.00 -2.07 0.00 0.00 38.32 36.58 1ovm h ASN 325 CO -0.73 0.57 -0.71 1.56 0.07 0.00 0.00 177.43 178.20 1ovm h GLN 326 N 0.97 0.52 -0.60 4.14 4.20 -1.60 -2.22 115.11 120.53 1ovm h GLN 326 Ca 0.33 -0.41 -0.05 0.00 0.06 0.00 0.00 58.65 58.58 1ovm h GLN 326 Cb 0.10 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.93 1ovm h GLN 326 CO -0.10 1.03 0.17 0.00 -0.67 0.00 0.00 178.83 179.26 1ovm h ALA 327 N 0.86 0.78 -0.13 3.87 0.00 -0.76 -0.95 119.26 122.93 1ovm h ALA 327 Ca -0.03 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1ovm h ALA 327 Cb 1.29 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 1ovm h ALA 327 CO 0.13 0.46 0.08 0.82 0.00 0.00 0.00 179.25 180.74 1ovm h ILE 328 N 0.85 1.08 -0.55 0.00 2.04 -1.23 -1.22 117.51 118.49 1ovm h ILE 328 Ca 0.19 -0.23 0.08 0.00 1.00 0.00 0.00 64.86 65.91 1ovm h ILE 328 Cb 0.31 1.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.32 1ovm h ILE 328 CO -0.00 0.08 0.19 -0.08 0.00 0.00 0.00 178.15 178.33 1ovm h GLU 329 N 0.13 0.35 -0.76 2.37 4.57 -1.11 -0.38 114.58 119.74 1ovm h GLU 329 Ca 0.05 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.18 1ovm h GLU 329 Cb 0.06 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.54 1ovm h GLU 329 CO -0.01 0.23 0.38 1.15 -1.18 0.00 0.00 179.01 179.58 1ovm h THR 330 N 0.36 1.24 -0.45 0.32 2.02 -0.85 -2.36 112.91 113.19 1ovm h THR 330 Ca 0.27 -0.65 -0.07 0.00 0.77 0.00 0.00 66.41 66.74 1ovm h THR 330 Cb 0.33 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 1ovm h THR 330 CO -0.29 0.28 -0.00 -0.07 0.37 0.00 0.00 175.52 175.80 1ovm h LEU 331 N 1.06 0.70 -0.25 2.58 4.07 -0.11 -2.36 115.31 120.99 1ovm h LEU 331 Ca 0.26 -0.16 -0.02 0.00 0.08 0.00 0.00 57.88 58.04 1ovm h LEU 331 Cb 0.09 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 41.64 1ovm h LEU 331 CO -0.04 0.77 0.06 0.58 -1.08 0.00 0.00 178.44 178.73 1ovm h VAL 332 N 0.69 1.21 -0.44 1.22 2.07 -0.75 -0.79 116.25 119.45 1ovm h VAL 332 Ca 0.14 -0.68 0.02 0.00 0.82 0.00 0.00 66.70 67.00 1ovm h VAL 332 Cb 0.42 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 1ovm h VAL 332 CO 0.02 0.22 0.26 -0.33 0.02 0.00 0.00 177.57 177.75 1ovm h GLU 333 N 0.23 0.50 -0.39 1.57 5.08 -1.28 -2.34 114.58 117.96 1ovm h GLU 333 Ca 0.08 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.31 1ovm h GLU 333 Cb 0.27 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1ovm h GLU 333 CO 0.00 0.33 -0.15 -0.07 -1.00 0.00 0.00 179.01 178.12 1ovm h LEU 334 N 0.52 0.70 -0.93 1.33 3.38 -1.30 -2.94 115.31 116.07 1ovm h LEU 334 Ca 0.18 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1ovm h LEU 334 Cb 0.02 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1ovm h LEU 334 CO -0.09 0.86 0.34 0.00 0.09 0.00 0.00 178.44 179.65 1ovm h LYS 336 N 1.10 0.00 -0.00 0.00 1.57 -1.25 -1.51 116.57 116.48 1ovm h LYS 336 Ca 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 1ovm h LYS 336 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1ovm h LYS 336 CO -0.03 0.04 -0.13 1.04 -0.57 0.00 0.00 179.45 179.80 1ovm n GLN 337 N -3.33 0.02 -3.52 3.15 6.02 -0.53 -4.53 117.38 114.66 1ovm n GLN 337 Ca -0.02 -0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.68 1ovm n GLN 337 Cb 0.17 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 29.80 1ovm n GLN 337 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1ovm s HIS 338 N -2.98 0.81 0.25 1.08 3.76 -0.57 -5.11 115.29 112.53 1ovm s HIS 338 Ca 0.14 -1.53 -0.00 0.00 -0.15 0.00 0.00 55.06 53.51 1ovm s HIS 338 Cb 0.19 -1.06 -0.04 0.00 1.11 0.00 0.00 32.58 32.78 1ovm s HIS 338 CO 0.57 -0.83 0.44 0.14 -0.85 0.00 0.00 174.74 174.21 1ovm s VAL 339 N 1.28 5.17 0.03 -0.90 -7.23 -1.26 -4.89 120.40 112.60 1ovm s VAL 339 Ca 0.15 -0.42 -0.01 0.00 -1.81 0.00 0.00 61.98 59.90 1ovm s VAL 339 Cb -0.21 -3.78 -0.03 0.00 0.56 0.00 0.00 36.38 32.92 1ovm s VAL 339 CO -0.10 -0.30 -0.02 -2.28 -0.31 0.00 0.00 175.10 172.09 1ovm s HIS 340 N -2.01 0.36 0.00 2.82 5.04 -1.26 -5.15 115.29 115.09 1ovm s HIS 340 Ca 0.39 -0.75 0.00 0.00 -1.54 0.00 0.00 55.06 53.16 1ovm s HIS 340 Cb -0.10 -0.27 0.00 0.00 0.04 0.00 0.00 32.58 32.25 1ovm s HIS 340 CO 0.31 -0.28 0.00 0.00 -2.34 0.00 0.00 174.74 172.43 1ovm n ALA 341 N 0.94 0.00 -2.36 1.58 0.00 -1.26 -5.09 120.51 114.32 1ovm n ALA 341 Ca -0.20 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.04 1ovm n ALA 341 Cb 0.58 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.94 1ovm n ALA 341 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1ovm s PRO 356 N 0.00 1.70 0.00 0.00 0.02 -1.26 -5.19 135.00 130.27 1ovm s PRO 356 Ca 0.00 -1.99 0.00 0.00 0.02 0.00 0.00 61.00 59.03 1ovm s PRO 356 Cb 0.00 -0.08 0.00 0.00 0.02 0.00 0.00 34.50 34.44 1ovm s PRO 356 CO 0.00 -0.51 0.00 -0.25 -0.33 0.00 0.00 177.00 175.91 1ovm n ASP 357 N -1.16 0.00 0.00 2.53 9.92 -1.26 -5.12 116.55 121.45 1ovm n ASP 357 Ca 0.01 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.27 1ovm n ASP 357 Cb 0.64 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.12 1ovm n ASP 357 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ovm n GLY 358 N 5.00 0.11 3.74 0.44 0.00 -1.26 -4.63 105.19 108.59 1ovm n GLY 358 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1ovm n GLY 358 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ovm s SER 359 N 1.00 6.90 0.35 1.61 0.15 -1.26 0.01 113.70 122.45 1ovm s SER 359 Ca 0.00 2.41 -0.28 0.00 0.70 0.00 0.00 55.95 58.78 1ovm s SER 359 Cb 0.00 -2.61 -0.10 0.00 -1.71 0.00 0.00 66.02 61.60 1ovm s SER 359 CO 0.00 -0.52 1.24 -0.76 1.20 0.00 0.00 173.24 174.40 1ovm s LEU 360 N -0.16 4.37 0.10 3.45 1.43 -0.78 -4.73 118.68 122.36 1ovm s LEU 360 Ca 0.56 2.54 -0.08 0.00 -1.03 0.00 0.00 54.13 56.12 1ovm s LEU 360 Cb -0.36 -3.76 -0.01 0.00 0.03 0.00 0.00 46.19 42.09 1ovm s LEU 360 CO 0.39 -0.54 0.20 0.42 0.23 0.00 0.00 176.35 177.04 1ovm s THR 361 N -1.22 0.13 0.27 5.49 -4.23 -1.26 -4.60 115.64 110.21 1ovm s THR 361 Ca 0.51 -1.26 0.00 0.00 -1.18 0.00 0.00 61.69 59.76 1ovm s THR 361 Cb -0.36 -1.46 0.25 0.00 1.34 0.00 0.00 72.50 72.27 1ovm s THR 361 CO 0.47 -0.59 1.77 1.56 -0.54 0.00 0.00 174.62 177.29 1ovm h GLN 362 N 2.73 0.65 0.10 3.99 1.08 -1.93 0.29 115.11 122.02 1ovm h GLN 362 Ca -0.34 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 56.83 1ovm h GLN 362 Cb 1.20 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 28.47 1ovm h GLN 362 CO 0.55 0.43 -0.27 1.49 -0.95 0.00 0.00 178.83 180.08 1ovm h GLU 363 N 0.67 -0.39 0.00 1.46 4.57 -1.96 -2.03 114.58 116.90 1ovm h GLU 363 Ca 0.48 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.69 1ovm h GLU 363 Cb 0.67 0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.35 1ovm h GLU 363 CO -0.36 -0.26 0.00 -2.95 -1.18 0.00 0.00 179.01 174.26 1ovm h ASN 364 N -0.41 0.00 0.05 1.04 7.08 -1.87 -2.83 115.58 118.64 1ovm h ASN 364 Ca -0.01 0.00 -0.00 0.00 -3.08 0.00 0.00 56.30 53.21 1ovm h ASN 364 Cb 0.40 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.64 1ovm h ASN 364 CO -0.12 0.00 -0.02 0.15 -2.08 0.00 0.00 177.43 175.35 1ovm h PHE 365 N 0.00 -0.06 -0.29 4.14 3.57 -0.68 -2.07 116.94 121.55 1ovm h PHE 365 Ca 0.00 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 1ovm h PHE 365 Cb 0.55 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 1ovm h PHE 365 CO 0.00 0.42 -0.13 -1.49 -2.23 0.00 0.00 178.31 174.88 1ovm h TRP 366 N -0.57 0.54 -0.73 0.41 4.06 -1.37 -1.14 115.95 117.15 1ovm h TRP 366 Ca -0.01 -0.08 -0.05 0.00 2.06 0.00 0.00 58.89 60.81 1ovm h TRP 366 Cb 0.51 -0.14 -0.03 0.00 -1.00 0.00 0.00 29.16 28.49 1ovm h TRP 366 CO 0.09 0.62 0.26 -0.09 -3.56 0.00 0.00 178.44 175.76 1ovm h ARG 367 N 0.46 1.09 -0.19 0.49 9.65 -1.51 -0.87 114.38 123.51 1ovm h ARG 367 Ca 0.08 -0.21 -0.06 0.00 -1.10 0.00 0.00 59.98 58.69 1ovm h ARG 367 Cb 0.51 -0.17 -0.00 0.00 -1.39 0.00 0.00 29.97 28.91 1ovm h ARG 367 CO 0.03 0.91 -0.14 1.15 2.80 0.00 0.00 179.97 184.72 1ovm h THR 368 N 1.06 1.32 -0.47 0.20 2.02 -0.89 -3.00 112.91 113.15 1ovm h THR 368 Ca 0.24 -1.25 0.04 0.00 0.77 0.00 0.00 66.41 66.21 1ovm h THR 368 Cb 0.24 1.74 -0.03 0.00 -1.74 0.00 0.00 68.15 68.36 1ovm h THR 368 CO -0.02 0.38 0.31 0.25 0.37 0.00 0.00 175.52 176.81 1ovm h LEU 369 N 0.09 0.43 -0.80 2.58 5.85 -0.88 -2.30 115.31 120.28 1ovm h LEU 369 Ca 0.04 -0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.84 1ovm h LEU 369 Cb 0.65 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.51 1ovm h LEU 369 CO 0.04 0.29 0.46 -0.61 -0.34 0.00 0.00 178.44 178.28 1ovm h GLN 370 N 0.50 0.77 0.00 1.25 5.75 -1.02 -0.15 115.11 122.21 1ovm h GLN 370 Ca 0.19 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.65 1ovm h GLN 370 Cb 0.15 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 28.53 1ovm h GLN 370 CO -0.05 0.51 0.00 0.25 -2.65 0.00 0.00 178.83 176.89 1ovm n THR 371 N -4.74 0.22 -0.03 2.39 -2.24 -0.87 -3.79 114.28 105.22 1ovm n THR 371 Ca 0.12 0.05 -0.20 0.00 -2.27 0.00 0.00 64.05 61.76 1ovm n THR 371 Cb 0.25 -0.63 -0.14 0.00 -2.10 0.00 0.00 70.33 67.71 1ovm n THR 371 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1ovm n PHE 372 N -1.37 0.97 -1.78 4.78 7.35 -0.10 -4.97 117.46 122.34 1ovm n PHE 372 Ca 0.10 0.21 -0.41 0.00 -0.76 0.00 0.00 57.45 56.59 1ovm n PHE 372 Cb 0.24 -1.13 0.01 0.00 0.35 0.00 0.00 39.48 38.95 1ovm n PHE 372 CO 0.00 0.00 0.00 0.96 -0.76 0.00 0.00 176.76 176.96 1ovm s ILE 373 N -2.55 2.02 0.10 -2.13 -4.36 -1.02 -5.02 121.20 108.23 1ovm s ILE 373 Ca -0.25 0.02 0.03 0.00 -0.26 0.00 0.00 60.65 60.19 1ovm s ILE 373 Cb 0.07 -3.01 -0.04 0.00 1.25 0.00 0.00 42.46 40.73 1ovm s ILE 373 CO 0.73 0.00 -0.08 -0.60 0.24 0.00 0.00 174.94 175.24 1ovm s ARG 374 N -2.23 0.84 0.50 0.37 6.06 -1.26 -4.94 118.95 118.29 1ovm s ARG 374 Ca 0.56 -1.26 -0.22 0.00 -2.50 0.00 0.00 55.73 52.31 1ovm s ARG 374 Cb -0.46 -0.35 -0.08 0.00 0.06 0.00 0.00 34.95 34.12 1ovm s ARG 374 CO 0.61 0.02 0.99 -2.30 -2.50 0.00 0.00 175.30 172.13 1ovm n PRO 375 N 0.21 1.17 -0.45 5.12 -0.02 -1.26 -2.29 135.00 137.49 1ovm n PRO 375 Ca -0.14 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 1ovm n PRO 375 Cb 0.59 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 1ovm n PRO 375 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ovm n GLY 376 N 1.23 1.02 3.80 -1.23 0.00 0.11 -4.98 105.19 105.13 1ovm n GLY 376 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1ovm n GLY 376 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ovm s ASP 377 N -3.04 5.92 -0.25 1.61 1.01 -0.97 -4.26 116.67 116.69 1ovm s ASP 377 Ca 0.00 1.86 0.02 0.00 0.71 0.00 0.00 52.55 55.14 1ovm s ASP 377 Cb 0.00 -2.54 0.05 0.00 1.01 0.00 0.00 42.92 41.44 1ovm s ASP 377 CO 0.00 -1.07 -0.11 -0.63 0.21 0.00 0.00 175.17 173.57 1ovm s ILE 378 N -2.30 2.28 -0.15 0.77 1.01 -0.08 -1.04 121.20 121.68 1ovm s ILE 378 Ca 0.65 -1.45 -0.01 0.00 0.00 0.00 0.00 60.65 59.84 1ovm s ILE 378 Cb -0.16 -2.26 -0.01 0.00 0.01 0.00 0.00 42.46 40.04 1ovm s ILE 378 CO 0.32 0.08 -0.12 -0.63 0.00 0.00 0.00 174.94 174.59 1ovm s ILE 379 N 1.16 3.01 -0.06 2.92 1.01 -0.26 0.04 121.20 129.02 1ovm s ILE 379 Ca -0.06 -0.66 0.06 0.00 0.00 0.00 0.00 60.65 59.99 1ovm s ILE 379 Cb -0.18 -2.29 -0.01 0.00 0.01 0.00 0.00 42.46 39.99 1ovm s ILE 379 CO -0.06 0.50 -0.24 -0.76 0.00 0.00 0.00 174.94 174.38 1ovm s LEU 380 N 0.69 2.06 -0.05 2.97 1.02 -0.14 0.23 118.68 125.46 1ovm s LEU 380 Ca -0.06 -0.51 0.01 0.00 0.02 0.00 0.00 54.13 53.59 1ovm s LEU 380 Cb -0.15 -1.35 0.02 0.00 0.02 0.00 0.00 46.19 44.73 1ovm s LEU 380 CO 0.02 0.23 -0.05 0.00 0.02 0.00 0.00 176.35 176.57 1ovm s ALA 381 N -0.09 0.77 0.71 4.21 0.00 -0.97 0.21 121.76 126.61 1ovm s ALA 381 Ca -0.06 -0.12 -0.07 0.00 0.00 0.00 0.00 51.96 51.71 1ovm s ALA 381 Cb -0.14 -0.47 0.06 0.00 0.00 0.00 0.00 23.12 22.57 1ovm s ALA 381 CO 0.04 -0.03 1.03 0.34 0.00 0.00 0.00 175.76 177.14 1ovm s ASP 382 N 0.96 4.83 0.48 0.00 -1.08 -0.70 -4.52 116.67 116.63 1ovm s ASP 382 Ca -0.10 0.51 -0.24 0.00 -0.52 0.00 0.00 52.55 52.20 1ovm s ASP 382 Cb -0.14 -1.17 -0.08 0.00 -1.46 0.00 0.00 42.92 40.08 1ovm s ASP 382 CO 0.00 -1.60 1.32 1.67 0.52 0.00 0.00 175.17 177.08 1ovm n GLN 383 N -2.95 1.88 0.00 4.34 -0.06 -1.26 -1.21 117.38 118.12 1ovm n GLN 383 Ca 0.08 0.68 0.00 0.00 -2.00 0.00 0.00 57.00 55.76 1ovm n GLN 383 Cb 0.60 -2.50 0.00 0.00 -4.06 0.00 0.00 30.24 24.29 1ovm n GLN 383 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1ovm n GLY 384 N 0.76 0.02 0.30 1.69 0.00 -1.26 -4.62 105.19 102.08 1ovm n GLY 384 Ca 0.08 -2.11 0.10 0.00 0.00 0.00 0.00 46.02 44.09 1ovm n GLY 384 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1ovm h THR 385 N 0.00 0.96 0.77 2.61 1.35 -1.97 -2.43 112.91 114.20 1ovm h THR 385 Ca 0.00 -0.05 -0.03 0.00 -0.55 0.00 0.00 66.41 65.78 1ovm h THR 385 Cb 0.00 0.81 -0.01 0.00 -1.73 0.00 0.00 68.15 67.22 1ovm h THR 385 CO 0.00 0.03 -0.49 0.28 -0.25 0.00 0.00 175.52 175.08 1ovm h SER 386 N 0.14 -1.26 -0.41 5.36 0.02 -1.82 -0.57 113.55 115.01 1ovm h SER 386 Ca 0.10 0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 61.10 1ovm h SER 386 Cb 0.24 0.37 -0.02 0.00 0.14 0.00 0.00 62.40 63.14 1ovm h SER 386 CO -0.01 -0.75 0.14 0.00 -1.14 0.00 0.00 176.83 175.07 1ovm h ALA 387 N -1.11 0.54 0.00 3.77 0.00 -0.96 -0.36 119.26 121.13 1ovm h ALA 387 Ca -0.10 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1ovm h ALA 387 Cb 0.96 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1ovm h ALA 387 CO 0.09 0.17 0.00 1.19 0.00 0.00 0.00 179.25 180.70 1ovm n PHE 388 N -4.60 0.00 -0.13 0.00 3.72 -0.93 -2.22 117.46 113.30 1ovm n PHE 388 Ca -0.00 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.19 1ovm n PHE 388 Cb 0.17 -0.06 -0.11 0.00 -0.94 0.00 0.00 39.48 38.54 1ovm n PHE 388 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ovm n GLY 389 N 0.93 -0.37 0.31 1.37 0.00 -0.22 -4.39 105.19 102.81 1ovm n GLY 389 Ca 0.20 -0.15 0.19 0.00 0.00 0.00 0.00 46.02 46.26 1ovm n GLY 389 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ovm h ALA 390 N -0.32 1.06 0.00 4.61 0.00 -1.00 -2.44 119.26 121.18 1ovm h ALA 390 Ca -0.60 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.29 1ovm h ALA 390 Cb 1.77 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.56 1ovm h ALA 390 CO -0.20 0.02 -0.01 0.97 0.00 0.00 0.00 179.25 180.04 1ovm h ILE 391 N 0.00 0.29 -0.01 0.00 2.10 -1.65 -1.01 117.51 117.22 1ovm h ILE 391 Ca -0.00 -0.06 0.00 0.00 1.08 0.00 0.00 64.86 65.88 1ovm h ILE 391 Cb 0.22 1.05 0.00 0.00 -1.09 0.00 0.00 36.82 36.99 1ovm h ILE 391 CO 0.00 0.01 -0.11 0.47 -1.08 0.00 0.00 178.15 177.44 1ovm n ASP 392 N -3.48 1.54 -4.72 2.19 8.00 -0.92 -4.64 116.55 114.52 1ovm n ASP 392 Ca -0.03 -1.36 -0.42 0.00 0.71 0.00 0.00 54.79 53.70 1ovm n ASP 392 Cb 0.10 0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.24 1ovm n ASP 392 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1ovm s LEU 393 N -2.19 4.37 -0.59 0.64 1.43 -0.39 -4.95 118.68 117.00 1ovm s LEU 393 Ca 0.31 2.58 -0.21 0.00 -1.03 0.00 0.00 54.13 55.78 1ovm s LEU 393 Cb 0.20 -3.59 0.07 0.00 0.03 0.00 0.00 46.19 42.90 1ovm s LEU 393 CO 0.41 -0.79 0.82 -0.60 0.23 0.00 0.00 176.35 176.42 1ovm s ARG 394 N 1.01 3.13 0.21 1.70 3.52 -1.26 -5.01 118.95 122.24 1ovm s ARG 394 Ca 0.68 -0.88 -0.30 0.00 -0.13 0.00 0.00 55.73 55.11 1ovm s ARG 394 Cb -0.42 -4.18 -0.08 0.00 -1.56 0.00 0.00 34.95 28.70 1ovm s ARG 394 CO 0.32 -1.57 1.09 -0.51 -0.81 0.00 0.00 175.30 173.82 1ovm s LEU 395 N 3.39 4.52 0.00 -0.88 1.02 -1.26 -4.92 118.68 120.54 1ovm s LEU 395 Ca 0.19 2.13 0.00 0.00 0.02 0.00 0.00 54.13 56.47 1ovm s LEU 395 Cb -0.19 -3.61 0.00 0.00 0.02 0.00 0.00 46.19 42.41 1ovm s LEU 395 CO 0.11 -0.17 0.00 -2.65 0.02 0.00 0.00 176.35 173.66 1ovm n PRO 396 N 2.00 0.40 -2.29 1.29 -0.02 -1.26 -1.58 135.00 133.54 1ovm n PRO 396 Ca 0.01 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.22 1ovm n PRO 396 Cb 0.46 0.00 0.04 0.00 -0.02 0.00 0.00 33.50 33.98 1ovm n PRO 396 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ovm s ALA 397 N -3.74 3.22 -1.52 3.55 0.00 -1.26 -4.39 121.76 117.61 1ovm s ALA 397 Ca 0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 51.96 51.24 1ovm s ALA 397 Cb 0.00 -2.67 0.05 0.00 0.00 0.00 0.00 23.12 20.50 1ovm s ALA 397 CO 0.00 -0.91 0.43 -0.25 0.00 0.00 0.00 175.76 175.03 1ovm n ASP 398 N -2.69 -0.84 -4.26 0.00 8.00 -1.26 -3.30 116.55 112.19 1ovm n ASP 398 Ca 0.05 -1.07 -0.32 0.00 0.71 0.00 0.00 54.79 54.17 1ovm n ASP 398 Cb 0.58 -2.67 -0.16 0.00 -0.02 0.00 0.00 41.12 38.84 1ovm n ASP 398 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ovm s VAL 399 N -3.86 2.21 -0.44 2.53 0.11 -1.26 -0.71 120.40 118.98 1ovm s VAL 399 Ca 0.21 -0.98 -0.18 0.00 -2.93 0.00 0.00 61.98 58.09 1ovm s VAL 399 Cb -0.11 -1.84 0.03 0.00 -1.53 0.00 0.00 36.38 32.93 1ovm s VAL 399 CO 0.92 0.56 0.50 0.21 -3.33 0.00 0.00 175.10 173.96 1ovm s ASN 400 N 0.15 6.21 -0.38 3.54 3.04 -0.20 -4.76 114.94 122.54 1ovm s ASN 400 Ca -0.12 -0.72 -0.16 0.00 0.04 0.00 0.00 52.86 51.90 1ovm s ASN 400 Cb -0.16 -2.25 0.01 0.00 -1.54 0.00 0.00 41.25 37.31 1ovm s ASN 400 CO 0.07 -0.67 0.37 0.12 -3.04 0.00 0.00 177.10 173.95 1ovm s PHE 401 N 2.28 3.20 -0.30 0.43 5.36 -1.26 -1.10 117.98 126.59 1ovm s PHE 401 Ca 0.13 -0.25 -0.08 0.00 -0.96 0.00 0.00 56.93 55.78 1ovm s PHE 401 Cb -0.18 -2.73 0.01 0.00 -0.34 0.00 0.00 43.02 39.78 1ovm s PHE 401 CO 0.14 -0.55 0.10 0.42 -1.46 0.00 0.00 175.22 173.86 1ovm s ILE 402 N 2.00 4.13 0.04 3.12 1.01 0.14 -4.84 121.20 126.80 1ovm s ILE 402 Ca 0.11 -0.62 -0.00 0.00 0.00 0.00 0.00 60.65 60.13 1ovm s ILE 402 Cb -0.17 -3.13 -0.03 0.00 0.01 0.00 0.00 42.46 39.14 1ovm s ILE 402 CO 0.12 0.07 -0.04 0.54 0.00 0.00 0.00 174.94 175.64 1ovm s VAL 403 N 1.53 0.25 -0.51 2.92 0.11 -1.26 -2.30 120.40 121.13 1ovm s VAL 403 Ca 0.03 -1.46 0.07 0.00 -2.93 0.00 0.00 61.98 57.69 1ovm s VAL 403 Cb -0.17 -1.04 0.26 0.00 -1.53 0.00 0.00 36.38 33.90 1ovm s VAL 403 CO 0.03 -0.77 0.66 1.67 -3.33 0.00 0.00 175.10 173.36 1ovm n GLN 404 N 0.70 1.70 0.17 1.54 7.27 -1.26 -4.94 117.38 122.56 1ovm n GLN 404 Ca -0.18 -3.99 0.02 0.00 0.07 0.00 0.00 57.00 52.93 1ovm n GLN 404 Cb 0.58 -1.77 0.30 0.00 2.41 0.00 0.00 30.24 31.77 1ovm n GLN 404 CO 0.00 0.00 0.00 -1.35 0.07 0.00 0.00 177.06 175.78 1ovm h PRO 405 N 3.98 0.00 0.05 3.69 0.11 -1.96 0.16 132.00 138.03 1ovm h PRO 405 Ca 0.13 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.24 1ovm h PRO 405 Cb 0.76 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1ovm h PRO 405 CO 0.66 0.45 -0.02 1.25 -0.21 0.00 0.00 178.00 180.12 1ovm h LEU 406 N 0.00 -0.05 -0.08 2.35 5.85 -1.95 -3.37 115.31 118.05 1ovm h LEU 406 Ca -0.00 -0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.37 1ovm h LEU 406 Cb 0.86 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.90 1ovm h LEU 406 CO 0.06 0.58 -0.13 -0.25 -0.34 0.00 0.00 178.44 178.35 1ovm h TRP 407 N -1.00 0.28 -5.21 1.25 -0.00 -1.90 -3.48 115.95 105.89 1ovm h TRP 407 Ca -0.01 -0.10 -0.33 0.00 -0.00 0.00 0.00 58.89 58.46 1ovm h TRP 407 Cb 0.35 -0.05 0.13 0.00 -0.00 0.00 0.00 29.16 29.58 1ovm h TRP 407 CO 0.08 0.73 -0.62 0.41 -0.00 0.00 0.00 178.44 179.04 1ovm n GLY 408 N 0.39 -0.32 3.57 2.65 0.00 0.05 -4.99 105.19 106.54 1ovm n GLY 408 Ca -0.08 0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1ovm n GLY 408 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ovm s SER 409 N -3.60 6.44 0.37 1.61 0.15 -1.26 -4.94 113.70 112.46 1ovm s SER 409 Ca 0.33 0.17 -0.27 0.00 0.70 0.00 0.00 55.95 56.88 1ovm s SER 409 Cb -0.15 -2.33 -0.09 0.00 -1.71 0.00 0.00 66.02 61.74 1ovm s SER 409 CO 0.64 -0.60 1.19 0.27 1.20 0.00 0.00 173.24 175.93 1ovm s ILE 410 N 2.73 3.12 0.00 6.45 -4.36 -1.26 -2.73 121.20 125.14 1ovm s ILE 410 Ca 0.25 1.00 0.00 0.00 -0.26 0.00 0.00 60.65 61.64 1ovm s ILE 410 Cb -0.14 -3.59 0.00 0.00 1.25 0.00 0.00 42.46 39.97 1ovm s ILE 410 CO 0.15 0.15 0.00 0.61 0.24 0.00 0.00 174.94 176.09 1ovm n GLY 411 N 0.76 2.58 0.19 6.27 0.00 -1.24 -4.91 105.19 108.83 1ovm n GLY 411 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.02 1ovm n GLY 411 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1ovm h TYR 412 N 0.00 -0.01 -0.39 1.61 3.20 -1.83 -3.13 116.97 116.42 1ovm h TYR 412 Ca 0.00 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.86 1ovm h TYR 412 Cb 0.00 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 1ovm h TYR 412 CO 0.00 -0.10 0.05 1.79 -1.64 0.00 0.00 178.16 178.26 1ovm h THR 413 N 0.12 1.20 -0.22 1.81 1.35 -1.91 0.15 112.91 115.41 1ovm h THR 413 Ca 0.24 -0.75 -0.00 0.00 -0.55 0.00 0.00 66.41 65.35 1ovm h THR 413 Cb 0.35 0.85 -0.01 0.00 -1.73 0.00 0.00 68.15 67.61 1ovm h THR 413 CO -0.39 0.27 0.12 0.25 -0.25 0.00 0.00 175.52 175.52 1ovm h LEU 414 N 0.58 0.27 -0.26 3.87 5.85 -1.93 -0.14 115.31 123.55 1ovm h LEU 414 Ca 0.13 -0.08 -0.16 0.00 0.84 0.00 0.00 57.88 58.61 1ovm h LEU 414 Cb 0.29 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.25 1ovm h LEU 414 CO 0.00 0.27 -0.47 0.00 -0.34 0.00 0.00 178.44 177.91 1ovm h ALA 415 N 1.01 0.41 -0.82 1.25 0.00 -1.58 -2.95 119.26 116.58 1ovm h ALA 415 Ca 0.08 -0.48 0.05 0.00 0.00 0.00 0.00 54.91 54.56 1ovm h ALA 415 Cb 0.06 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1ovm h ALA 415 CO -0.01 0.56 0.53 0.00 0.00 0.00 0.00 179.25 180.34 1ovm h ALA 416 N 0.65 1.56 -0.97 0.00 0.00 -0.57 -1.09 119.26 118.85 1ovm h ALA 416 Ca 0.01 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1ovm h ALA 416 Cb 1.08 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 1ovm h ALA 416 CO 0.11 0.33 0.64 0.00 0.00 0.00 0.00 179.25 180.32 1ovm h ALA 417 N 1.54 1.33 -0.71 0.00 0.00 -0.85 0.26 119.26 120.83 1ovm h ALA 417 Ca 0.34 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 1ovm h ALA 417 Cb 0.15 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1ovm h ALA 417 CO -0.11 0.60 0.44 0.35 0.00 0.00 0.00 179.25 180.53 1ovm h PHE 418 N 1.28 0.93 -0.57 0.00 3.57 -1.11 -0.19 116.94 120.84 1ovm h PHE 418 Ca 0.36 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.81 1ovm h PHE 418 Cb -0.10 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.31 1ovm h PHE 418 CO -0.00 0.62 0.13 0.78 -2.23 0.00 0.00 178.31 177.61 1ovm h GLY 419 N 0.97 0.99 0.94 2.40 0.00 -0.77 -1.74 103.07 105.86 1ovm h GLY 419 Ca 0.26 -0.63 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 1ovm h GLY 419 CO -0.05 0.59 0.14 0.00 0.00 0.00 0.00 176.54 177.22 1ovm h ALA 420 N 1.02 0.49 -0.75 3.60 0.00 -0.59 -1.69 119.26 121.34 1ovm h ALA 420 Ca 0.18 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ovm h ALA 420 Cb 0.36 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1ovm h ALA 420 CO 0.00 0.10 0.46 1.96 0.00 0.00 0.00 179.25 181.77 1ovm h GLN 421 N 0.46 1.02 -0.94 0.00 1.08 -0.94 0.23 115.11 116.02 1ovm h GLN 421 Ca 0.12 -0.09 0.05 0.00 -1.45 0.00 0.00 58.65 57.28 1ovm h GLN 421 Cb 0.20 -0.21 -0.06 0.00 -0.05 0.00 0.00 27.48 27.36 1ovm h GLN 421 CO -0.01 0.72 0.62 1.15 -0.95 0.00 0.00 178.83 180.36 1ovm h THR 422 N 1.03 1.13 0.01 -0.54 2.02 -1.02 -2.19 112.91 113.35 1ovm h THR 422 Ca 0.27 -0.40 -0.20 0.00 0.77 0.00 0.00 66.41 66.86 1ovm h THR 422 Cb -0.04 -0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.23 1ovm h THR 422 CO -0.05 0.21 -0.92 0.00 0.37 0.00 0.00 175.52 175.13 1ovm h ALA 423 N 1.46 0.48 -2.45 6.16 0.00 -0.41 -3.39 119.26 121.12 1ovm h ALA 423 Ca 0.39 -0.80 -0.59 0.00 0.00 0.00 0.00 54.91 53.91 1ovm h ALA 423 Cb 0.07 -0.11 -0.40 0.00 0.00 0.00 0.00 17.79 17.35 1ovm h ALA 423 CO -0.13 1.05 -0.81 0.00 0.00 0.00 0.00 179.25 179.36 1ovm h PRO 425 N 4.90 0.34 -0.69 0.00 0.11 -1.62 -2.56 132.00 132.47 1ovm h PRO 425 Ca 0.18 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 66.13 1ovm h PRO 425 Cb 0.81 -0.08 -0.08 0.00 0.11 0.00 0.00 31.00 31.75 1ovm h PRO 425 CO 0.59 0.22 0.18 0.09 -0.21 0.00 0.00 178.00 178.87 1ovm n ASN 426 N -4.46 5.22 -4.34 -2.05 3.02 -1.26 -4.92 115.26 106.47 1ovm n ASN 426 Ca 0.10 -3.12 -0.29 0.00 -0.03 0.00 0.00 54.58 51.23 1ovm n ASN 426 Cb 0.41 -0.73 -0.14 0.00 -0.61 0.00 0.00 39.78 38.71 1ovm n ASN 426 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1ovm s ARG 427 N -2.92 1.60 -0.17 3.52 0.52 -0.97 -5.09 118.95 115.44 1ovm s ARG 427 Ca 0.55 -1.16 -0.29 0.00 -0.52 0.00 0.00 55.73 54.31 1ovm s ARG 427 Cb 0.44 -1.87 -0.01 0.00 0.52 0.00 0.00 34.95 34.03 1ovm s ARG 427 CO 0.15 0.47 1.21 0.50 0.02 0.00 0.00 175.30 177.65 1ovm s ARG 428 N -1.50 4.25 -0.26 3.54 3.52 -1.26 -4.93 118.95 122.31 1ovm s ARG 428 Ca 0.12 1.60 -0.09 0.00 -0.13 0.00 0.00 55.73 57.23 1ovm s ARG 428 Cb -0.10 -3.72 -0.04 0.00 -1.56 0.00 0.00 34.95 29.53 1ovm s ARG 428 CO 0.03 -0.67 0.11 0.08 -0.81 0.00 0.00 175.30 174.04 1ovm s VAL 429 N 3.34 4.67 -0.26 7.11 1.01 -1.26 -0.90 120.40 134.10 1ovm s VAL 429 Ca 0.52 -0.05 -0.07 0.00 0.00 0.00 0.00 61.98 62.38 1ovm s VAL 429 Cb -0.20 -3.19 -0.02 0.00 0.00 0.00 0.00 36.38 32.96 1ovm s VAL 429 CO 0.13 0.32 0.08 -0.63 0.00 0.00 0.00 175.10 175.00 1ovm s ILE 430 N 1.59 4.28 -0.29 2.22 1.09 0.11 -1.39 121.20 128.80 1ovm s ILE 430 Ca 0.06 -0.28 -0.08 0.00 -1.10 0.00 0.00 60.65 59.26 1ovm s ILE 430 Cb -0.15 -3.05 -0.00 0.00 -1.06 0.00 0.00 42.46 38.19 1ovm s ILE 430 CO 0.06 0.28 0.11 -0.69 -0.10 0.00 0.00 174.94 174.59 1ovm s VAL 431 N 1.60 4.30 -0.38 2.92 1.01 -0.68 -0.97 120.40 128.20 1ovm s VAL 431 Ca 0.06 -0.48 -0.09 0.00 0.00 0.00 0.00 61.98 61.46 1ovm s VAL 431 Cb -0.16 -3.17 0.05 0.00 0.00 0.00 0.00 36.38 33.10 1ovm s VAL 431 CO 0.04 0.12 0.19 -0.76 0.00 0.00 0.00 175.10 174.69 1ovm s LEU 432 N 1.57 4.75 0.02 3.92 1.43 0.13 -0.45 118.68 130.04 1ovm s LEU 432 Ca 0.04 -1.20 0.01 0.00 -1.03 0.00 0.00 54.13 51.95 1ovm s LEU 432 Cb -0.17 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 44.07 1ovm s LEU 432 CO 0.04 -0.42 -0.05 0.28 0.23 0.00 0.00 176.35 176.44 1ovm s THR 433 N 1.47 0.32 0.75 5.49 -1.32 -0.78 -1.73 115.64 119.84 1ovm s THR 433 Ca 0.01 -0.58 -0.11 0.00 -1.21 0.00 0.00 61.69 59.79 1ovm s THR 433 Cb -0.20 -0.35 0.04 0.00 -1.51 0.00 0.00 72.50 70.47 1ovm s THR 433 CO 0.04 -0.18 1.10 -0.83 -2.21 0.00 0.00 174.62 172.54 1ovm s GLY 434 N -0.82 1.62 0.26 6.08 0.00 -1.26 -1.24 107.32 111.97 1ovm s GLY 434 Ca -0.06 -0.28 0.06 0.00 0.00 0.00 0.00 44.72 44.44 1ovm s GLY 434 CO -0.00 0.12 1.62 1.29 0.00 0.00 0.00 173.10 176.12 1ovm h ASP 435 N -0.88 0.22 -0.02 1.64 2.03 -1.78 -2.00 116.42 115.63 1ovm h ASP 435 Ca -0.46 -0.12 -0.01 0.00 -0.73 0.00 0.00 57.03 55.72 1ovm h ASP 435 Cb 1.26 -0.06 -0.00 0.00 -0.83 0.00 0.00 39.33 39.70 1ovm h ASP 435 CO 0.62 0.72 -0.01 1.23 -1.03 0.00 0.00 179.24 180.77 1ovm h GLY 436 N 1.44 0.05 0.85 7.15 0.00 -1.87 -3.23 103.07 107.46 1ovm h GLY 436 Ca 0.00 -0.04 0.02 0.00 0.00 0.00 0.00 47.33 47.31 1ovm h GLY 436 CO 0.08 0.04 0.09 0.00 0.00 0.00 0.00 176.54 176.75 1ovm h ALA 437 N 0.64 0.27 -0.05 3.60 0.00 -1.91 -2.72 119.26 119.10 1ovm h ALA 437 Ca 0.01 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1ovm h ALA 437 Cb 0.38 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1ovm h ALA 437 CO 0.00 -0.32 0.09 0.00 0.00 0.00 0.00 179.25 179.03 1ovm h ALA 438 N 1.13 1.39 -0.10 0.00 0.00 -1.42 -2.34 119.26 117.92 1ovm h ALA 438 Ca 0.10 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 1ovm h ALA 438 Cb 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1ovm h ALA 438 CO -0.09 -0.12 -0.40 1.96 0.00 0.00 0.00 179.25 180.61 1ovm h GLN 439 N 0.00 0.22 0.00 0.00 4.20 -1.49 -1.56 115.11 116.47 1ovm h GLN 439 Ca 0.02 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.58 1ovm h GLN 439 Cb 0.21 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 1ovm h GLN 439 CO -0.00 0.59 -0.23 -0.07 -0.67 0.00 0.00 178.83 178.45 1ovm h LEU 440 N 0.18 0.00 -2.43 1.46 4.07 -1.55 -3.27 115.31 113.77 1ovm h LEU 440 Ca 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.97 1ovm h LEU 440 Cb 0.79 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.51 1ovm h LEU 440 CO 0.06 0.23 -0.36 0.35 -1.08 0.00 0.00 178.44 177.64 1ovm n THR 441 N -3.70 0.72 -0.32 0.22 -2.24 -1.19 -4.91 114.28 102.86 1ovm n THR 441 Ca -0.01 -0.94 0.16 0.00 -2.27 0.00 0.00 64.05 60.99 1ovm n THR 441 Cb 0.34 0.25 0.36 0.00 -2.10 0.00 0.00 70.33 69.18 1ovm n THR 441 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1ovm h ILE 442 N 4.41 0.46 0.00 2.28 6.09 -1.34 -1.57 117.51 127.83 1ovm h ILE 442 Ca -0.01 -0.15 0.00 0.00 -1.37 0.00 0.00 64.86 63.33 1ovm h ILE 442 Cb 1.28 -0.02 0.00 0.00 0.47 0.00 0.00 36.82 38.55 1ovm h ILE 442 CO 0.01 0.08 0.08 0.00 -3.07 0.00 0.00 178.15 175.24 1ovm n GLN 443 N -5.00 0.11 0.01 2.19 0.00 -1.26 -0.25 117.38 113.18 1ovm n GLN 443 Ca 0.25 0.60 0.13 0.00 0.00 0.00 0.00 57.00 57.98 1ovm n GLN 443 Cb 0.74 -1.95 0.56 0.00 0.00 0.00 0.00 30.24 29.59 1ovm n GLN 443 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.06 175.15 1ovm n GLU 444 N -2.12 0.02 0.18 2.61 4.07 -0.59 -2.07 120.64 122.75 1ovm n GLU 444 Ca -0.01 0.06 0.03 0.00 -0.06 0.00 0.00 57.16 57.18 1ovm n GLU 444 Cb 0.10 -1.52 0.35 0.00 -0.06 0.00 0.00 31.44 30.31 1ovm n GLU 444 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1ovm h LEU 445 N 0.00 0.00 -1.24 4.31 5.85 -0.81 -1.82 115.31 121.60 1ovm h LEU 445 Ca 0.00 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 1ovm h LEU 445 Cb 0.47 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1ovm h LEU 445 CO 0.00 0.40 -0.33 1.23 -0.34 0.00 0.00 178.44 179.40 1ovm h GLY 446 N 1.36 0.09 1.47 3.75 0.00 -1.56 -1.84 103.07 106.34 1ovm h GLY 446 Ca -0.00 -0.07 -0.21 0.00 0.00 0.00 0.00 47.33 47.04 1ovm h GLY 446 CO 0.05 0.06 -0.84 1.76 0.00 0.00 0.00 176.54 177.57 1ovm h SER 447 N 0.07 0.62 -0.40 0.19 0.02 -1.42 -0.86 113.55 111.78 1ovm h SER 447 Ca 0.01 -0.45 -0.01 0.00 -0.84 0.00 0.00 61.79 60.50 1ovm h SER 447 Cb 0.62 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 1ovm h SER 447 CO 0.05 1.22 0.22 0.24 -1.14 0.00 0.00 176.83 177.42 1ovm h MET 448 N 0.32 0.56 0.15 3.45 2.07 -1.05 -0.93 114.93 119.49 1ovm h MET 448 Ca -0.06 -0.06 -0.01 0.00 -2.07 0.00 0.00 59.70 57.50 1ovm h MET 448 Cb 1.46 -0.11 0.00 0.00 -1.87 0.00 0.00 31.60 31.08 1ovm h MET 448 CO 0.15 0.45 -0.07 -0.07 1.07 0.00 0.00 176.91 178.44 1ovm h LEU 449 N 0.52 -0.17 -0.84 1.22 4.07 -1.27 -1.12 115.31 117.72 1ovm h LEU 449 Ca 0.14 -0.04 0.10 0.00 0.08 0.00 0.00 57.88 58.17 1ovm h LEU 449 Cb 0.05 0.04 -0.08 0.00 1.08 0.00 0.00 40.66 41.76 1ovm h LEU 449 CO -0.02 -0.08 0.48 -0.09 -1.08 0.00 0.00 178.44 177.65 1ovm h ARG 450 N -0.25 0.77 -0.26 1.13 2.43 -0.94 0.23 114.38 117.50 1ovm h ARG 450 Ca -0.02 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1ovm h ARG 450 Cb 0.19 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1ovm h ARG 450 CO 0.03 0.51 0.00 -0.25 -1.51 0.00 0.00 179.97 178.75 1ovm n ASP 451 N -4.74 1.42 -3.91 -3.80 8.00 -0.37 -4.94 116.55 108.21 1ovm n ASP 451 Ca 0.14 -1.99 -0.25 0.00 0.71 0.00 0.00 54.79 53.40 1ovm n ASP 451 Cb 0.30 -0.17 -0.01 0.00 -0.02 0.00 0.00 41.12 41.22 1ovm n ASP 451 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1ovm n LYS 452 N 0.27 -3.80 -2.73 -1.24 5.02 0.07 -4.98 118.16 110.78 1ovm n LYS 452 Ca 0.09 0.46 -0.30 0.00 -2.02 0.00 0.00 58.31 56.54 1ovm n LYS 452 Cb 0.23 -4.78 -0.03 0.00 -0.02 0.00 0.00 35.03 30.43 1ovm n LYS 452 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1ovm s GLN 453 N -6.45 3.77 -0.63 1.97 -0.21 -0.54 -4.99 119.66 112.59 1ovm s GLN 453 Ca 0.09 0.53 0.05 0.00 0.02 0.00 0.00 55.36 56.05 1ovm s GLN 453 Cb -0.05 -2.34 0.32 0.00 1.00 0.00 0.00 33.01 31.94 1ovm s GLN 453 CO 0.87 -0.11 0.98 0.72 -2.12 0.00 0.00 175.29 175.63 1ovm n HIS 454 N -1.49 3.88 -1.45 0.91 8.25 -1.26 -3.78 115.22 120.28 1ovm n HIS 454 Ca 0.03 -3.91 -0.34 0.00 -0.26 0.00 0.00 57.72 53.24 1ovm n HIS 454 Cb 0.54 -0.56 0.09 0.00 1.12 0.00 0.00 29.99 31.18 1ovm n HIS 454 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 1ovm s PRO 455 N -3.35 2.23 -0.34 -0.41 0.02 -1.26 -4.68 135.00 127.20 1ovm s PRO 455 Ca 0.46 1.62 0.00 0.00 0.02 0.00 0.00 61.00 63.11 1ovm s PRO 455 Cb 0.25 -1.86 0.09 0.00 0.02 0.00 0.00 34.50 33.00 1ovm s PRO 455 CO -0.11 -1.74 0.07 -1.50 -0.33 0.00 0.00 177.00 173.39 1ovm s ILE 456 N -2.17 2.74 -0.26 2.83 1.10 -0.49 -1.26 121.20 123.70 1ovm s ILE 456 Ca 0.71 -1.97 -0.11 0.00 -0.51 0.00 0.00 60.65 58.77 1ovm s ILE 456 Cb -0.26 -2.83 -0.05 0.00 0.15 0.00 0.00 42.46 39.47 1ovm s ILE 456 CO 0.46 -0.46 0.20 -0.63 -2.11 0.00 0.00 174.94 172.40 1ovm s ILE 457 N 1.08 5.31 -0.24 2.00 1.01 0.15 -1.69 121.20 128.82 1ovm s ILE 457 Ca 0.04 0.24 -0.04 0.00 0.00 0.00 0.00 60.65 60.89 1ovm s ILE 457 Cb -0.21 -3.54 0.01 0.00 0.01 0.00 0.00 42.46 38.73 1ovm s ILE 457 CO -0.05 0.28 -0.03 -0.76 0.00 0.00 0.00 174.94 174.38 1ovm s LEU 458 N 1.47 3.13 -0.30 2.97 1.02 0.40 -0.26 118.68 127.11 1ovm s LEU 458 Ca 0.09 -0.59 -0.11 0.00 0.02 0.00 0.00 54.13 53.53 1ovm s LEU 458 Cb -0.15 -1.74 -0.03 0.00 0.02 0.00 0.00 46.19 44.29 1ovm s LEU 458 CO 0.08 -0.08 0.19 -0.69 0.02 0.00 0.00 176.35 175.87 1ovm s VAL 459 N 1.43 5.11 -0.74 -1.59 1.01 -0.27 -1.87 120.40 123.48 1ovm s VAL 459 Ca 0.04 -0.05 -0.25 0.00 0.00 0.00 0.00 61.98 61.71 1ovm s VAL 459 Cb -0.15 -3.51 0.04 0.00 0.00 0.00 0.00 36.38 32.76 1ovm s VAL 459 CO -0.03 0.16 1.20 -0.76 0.00 0.00 0.00 175.10 175.67 1ovm s LEU 460 N 1.72 3.56 -0.68 3.92 1.43 -0.37 -0.51 118.68 127.75 1ovm s LEU 460 Ca 0.06 -0.70 -0.21 0.00 -1.03 0.00 0.00 54.13 52.25 1ovm s LEU 460 Cb -0.16 -2.52 0.08 0.00 0.03 0.00 0.00 46.19 43.62 1ovm s LEU 460 CO 0.09 -1.69 0.93 0.21 0.23 0.00 0.00 176.35 176.12 1ovm s ASN 461 N 3.80 6.23 -0.19 2.29 3.84 0.93 -2.47 114.94 129.38 1ovm s ASN 461 Ca 0.32 -1.21 0.13 0.00 0.21 0.00 0.00 52.86 52.31 1ovm s ASN 461 Cb -0.10 -2.39 0.41 0.00 -0.55 0.00 0.00 41.25 38.62 1ovm s ASN 461 CO 0.11 -1.33 1.21 -0.46 -2.79 0.00 0.00 177.10 173.84 1ovm n ASN 462 N 7.29 1.67 -3.90 -4.21 0.23 -1.26 -0.73 115.26 114.35 1ovm n ASN 462 Ca -0.02 -3.69 -0.25 0.00 -0.53 0.00 0.00 54.58 50.10 1ovm n ASN 462 Cb 0.45 -0.50 -0.01 0.00 -2.08 0.00 0.00 39.78 37.64 1ovm n ASN 462 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1ovm n GLU 463 N -0.98 -3.71 0.00 -3.83 1.02 -1.26 -4.15 120.64 107.73 1ovm n GLU 463 Ca 0.18 0.46 0.00 0.00 -0.02 0.00 0.00 57.16 57.77 1ovm n GLU 463 Cb 0.73 -4.71 0.00 0.00 -0.02 0.00 0.00 31.44 27.44 1ovm n GLU 463 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ovm n GLY 464 N -1.87 0.90 3.44 0.62 0.00 -1.26 -4.54 105.19 102.47 1ovm n GLY 464 Ca -0.30 -1.96 -0.44 0.00 0.00 0.00 0.00 46.02 43.33 1ovm n GLY 464 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ovm s TYR 465 N -2.07 3.64 0.41 1.61 2.02 -0.91 -4.48 117.35 117.58 1ovm s TYR 465 Ca 0.00 -2.24 0.11 0.00 -0.37 0.00 0.00 57.07 54.58 1ovm s TYR 465 Cb 0.00 -4.23 0.88 0.00 -0.40 0.00 0.00 41.96 38.21 1ovm s TYR 465 CO 0.00 -1.31 1.96 1.79 -1.57 0.00 0.00 175.55 176.41 1ovm h THR 466 N 4.48 1.15 -0.55 -0.71 1.35 -1.87 -1.35 112.91 115.42 1ovm h THR 466 Ca 0.29 -0.68 -0.02 0.00 -0.55 0.00 0.00 66.41 65.46 1ovm h THR 466 Cb 0.87 1.22 -0.03 0.00 -1.73 0.00 0.00 68.15 68.49 1ovm h THR 466 CO 1.20 0.21 0.28 -0.37 -0.25 0.00 0.00 175.52 176.59 1ovm h VAL 467 N 0.15 1.19 -0.56 6.82 -1.51 -1.92 0.11 116.25 120.54 1ovm h VAL 467 Ca 0.03 -0.53 -0.03 0.00 -1.23 0.00 0.00 66.70 64.94 1ovm h VAL 467 Cb 0.33 0.54 -0.02 0.00 -2.13 0.00 0.00 31.29 30.00 1ovm h VAL 467 CO 0.02 0.21 0.23 -0.33 -1.23 0.00 0.00 177.57 176.47 1ovm h GLU 468 N 0.73 0.84 -0.95 5.19 4.39 -1.78 -1.22 114.58 121.78 1ovm h GLU 468 Ca 0.19 -0.15 0.04 0.00 0.34 0.00 0.00 59.36 59.78 1ovm h GLU 468 Cb 0.09 -0.14 -0.06 0.00 -0.10 0.00 0.00 28.75 28.55 1ovm h GLU 468 CO -0.03 0.72 0.62 0.00 -1.16 0.00 0.00 179.01 179.16 1ovm h ARG 469 N 0.77 1.13 0.00 2.33 3.08 -0.73 0.13 114.38 121.08 1ovm h ARG 469 Ca 0.19 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.11 1ovm h ARG 469 Cb 0.19 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1ovm h ARG 469 CO -0.02 0.75 -0.30 0.00 -1.07 0.00 0.00 179.97 179.33 1ovm h ALA 470 N 1.46 1.26 0.10 0.04 0.00 -0.12 -3.16 119.26 118.83 1ovm h ALA 470 Ca 0.39 -0.28 -0.18 0.00 0.00 0.00 0.00 54.91 54.84 1ovm h ALA 470 Cb 0.06 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.81 1ovm h ALA 470 CO -0.13 0.38 -0.87 0.82 0.00 0.00 0.00 179.25 179.46 1ovm h ILE 471 N 0.00 1.38 -1.42 0.00 2.04 0.17 -3.45 117.51 116.23 1ovm h ILE 471 Ca -0.00 -2.44 0.12 0.00 1.00 0.00 0.00 64.86 63.54 1ovm h ILE 471 Cb 0.63 3.03 -0.25 0.00 -0.74 0.00 0.00 36.82 39.49 1ovm h ILE 471 CO 0.04 0.66 0.64 -2.28 0.00 0.00 0.00 178.15 177.21 1ovm s HIS 472 N -2.40 -0.30 -1.01 1.37 5.04 0.25 -4.64 115.29 113.60 1ovm s HIS 472 Ca -0.18 0.58 -0.00 0.00 -1.54 0.00 0.00 55.06 53.92 1ovm s HIS 472 Cb 0.02 0.44 0.00 0.00 0.04 0.00 0.00 32.58 33.08 1ovm s HIS 472 CO 0.77 -0.23 0.85 0.41 -2.34 0.00 0.00 174.74 174.19 1ovm n GLY 473 N 1.07 -0.23 0.43 1.59 0.00 -1.26 -4.27 105.19 102.51 1ovm n GLY 473 Ca -0.09 0.01 0.24 0.00 0.00 0.00 0.00 46.02 46.18 1ovm n GLY 473 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ovm h ALA 474 N 0.76 2.49 -0.37 4.61 0.00 -1.86 -0.07 119.26 124.82 1ovm h ALA 474 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1ovm h ALA 474 Cb 1.29 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1ovm h ALA 474 CO 0.42 -0.77 0.00 0.39 0.00 0.00 0.00 179.25 179.29 1ovm n GLU 475 N -4.42 3.11 -2.84 0.00 1.02 -1.26 -4.89 120.64 111.36 1ovm n GLU 475 Ca 0.19 -2.56 -0.40 0.00 -0.02 0.00 0.00 57.16 54.38 1ovm n GLU 475 Cb 0.83 -1.64 -0.06 0.00 -0.02 0.00 0.00 31.44 30.55 1ovm n GLU 475 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1ovm s GLN 476 N -1.95 4.71 0.49 3.49 -1.52 -0.04 -4.96 119.66 119.88 1ovm s GLN 476 Ca 0.37 1.34 0.23 0.00 -1.95 0.00 0.00 55.36 55.35 1ovm s GLN 476 Cb 0.26 -3.30 1.28 0.00 -0.22 0.00 0.00 33.01 31.03 1ovm s GLN 476 CO 0.15 0.46 1.92 -0.09 -0.25 0.00 0.00 175.29 177.48 1ovm h ARG 477 N 4.61 0.17 0.00 2.91 2.43 -1.94 -1.80 114.38 120.76 1ovm h ARG 477 Ca -0.45 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 1ovm h ARG 477 Cb 1.20 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 1ovm h ARG 477 CO 0.68 0.11 0.00 2.48 -1.51 0.00 0.00 179.97 181.74 1ovm n TYR 478 N -4.40 0.00 0.75 2.20 0.18 -1.26 -1.96 117.16 112.67 1ovm n TYR 478 Ca 0.15 0.00 0.12 0.00 1.88 0.00 0.00 57.90 60.05 1ovm n TYR 478 Cb 0.70 -0.43 0.18 0.00 -0.38 0.00 0.00 39.34 39.41 1ovm n TYR 478 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 1ovm n ASN 479 N -1.43 3.08 -4.94 9.48 3.02 -0.67 -4.93 115.26 118.87 1ovm n ASN 479 Ca 0.04 -1.97 -0.24 0.00 -0.03 0.00 0.00 54.58 52.38 1ovm n ASN 479 Cb 0.13 -0.10 0.02 0.00 -0.61 0.00 0.00 39.78 39.21 1ovm n ASN 479 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1ovm s ASP 480 N -1.78 5.75 0.09 6.41 1.01 -0.83 -2.13 116.67 125.19 1ovm s ASP 480 Ca 0.33 0.41 -0.04 0.00 0.71 0.00 0.00 52.55 53.96 1ovm s ASP 480 Cb 0.21 -1.57 -0.03 0.00 1.01 0.00 0.00 42.92 42.54 1ovm s ASP 480 CO 0.31 -0.82 0.08 0.27 0.21 0.00 0.00 175.17 175.22 1ovm s ILE 481 N -2.69 0.16 0.23 0.77 -4.36 -1.26 -4.88 121.20 109.17 1ovm s ILE 481 Ca 0.50 -1.62 -0.32 0.00 -0.26 0.00 0.00 60.65 58.95 1ovm s ILE 481 Cb -0.10 -1.61 -0.12 0.00 1.25 0.00 0.00 42.46 41.88 1ovm s ILE 481 CO 0.40 -0.73 1.69 0.00 0.24 0.00 0.00 174.94 176.54 1ovm n ALA 482 N -0.01 2.75 -2.59 2.27 0.00 -1.26 -4.90 120.51 116.77 1ovm n ALA 482 Ca -0.12 0.40 -0.43 0.00 0.00 0.00 0.00 53.44 53.29 1ovm n ALA 482 Cb 0.62 -2.51 -0.04 0.00 0.00 0.00 0.00 19.45 17.53 1ovm n ALA 482 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ovm s LEU 483 N 0.79 3.98 0.44 0.00 1.43 -1.26 -5.03 118.68 119.02 1ovm s LEU 483 Ca 0.73 0.43 0.01 0.00 -1.03 0.00 0.00 54.13 54.26 1ovm s LEU 483 Cb -0.51 -3.25 -0.01 0.00 0.03 0.00 0.00 46.19 42.46 1ovm s LEU 483 CO 0.36 -0.93 0.65 0.26 0.23 0.00 0.00 176.35 176.92 1ovm s TRP 484 N 3.60 3.24 -1.02 0.29 0.51 -1.26 -5.03 118.94 119.27 1ovm s TRP 484 Ca 0.38 0.23 -0.03 0.00 -2.12 0.00 0.00 56.10 54.56 1ovm s TRP 484 Cb -0.11 -2.27 0.29 0.00 -0.81 0.00 0.00 33.47 30.57 1ovm s TRP 484 CO 0.22 -0.30 1.30 -1.71 -0.51 0.00 0.00 176.95 175.94 1ovm n ASN 485 N -2.04 5.84 -0.30 2.95 4.05 -1.26 -4.94 115.26 119.56 1ovm n ASN 485 Ca 0.01 -3.35 0.11 0.00 0.45 0.00 0.00 54.58 51.80 1ovm n ASN 485 Cb 0.57 -1.20 0.25 0.00 1.23 0.00 0.00 39.78 40.64 1ovm n ASN 485 CO 0.00 0.00 0.00 -0.50 -3.05 0.00 0.00 177.26 173.71 1ovm h TRP 486 N 5.47 0.09 0.00 1.20 4.06 -2.02 -1.29 115.95 123.46 1ovm h TRP 486 Ca 0.19 0.06 0.00 0.00 2.06 0.00 0.00 58.89 61.20 1ovm h TRP 486 Cb 0.67 0.10 0.00 0.00 -1.00 0.00 0.00 29.16 28.93 1ovm h TRP 486 CO 0.92 -0.30 0.00 0.25 -3.56 0.00 0.00 178.44 175.75 1ovm n THR 487 N -5.36 1.13 0.83 1.49 -2.24 -1.26 -2.32 114.28 106.56 1ovm n THR 487 Ca 0.20 0.37 0.12 0.00 -2.27 0.00 0.00 64.05 62.47 1ovm n THR 487 Cb 0.66 -1.27 0.12 0.00 -2.10 0.00 0.00 70.33 67.74 1ovm n THR 487 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1ovm n HIS 488 N -1.87 0.10 -0.11 4.78 8.25 -0.49 -4.55 115.22 121.34 1ovm n HIS 488 Ca 0.02 -0.05 -0.11 0.00 -0.26 0.00 0.00 57.72 57.31 1ovm n HIS 488 Cb 0.14 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.22 1ovm n HIS 488 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1ovm h ILE 489 N 4.55 1.26 -0.78 1.59 2.04 -1.54 -3.17 117.51 121.46 1ovm h ILE 489 Ca 0.00 -1.00 0.06 0.00 1.00 0.00 0.00 64.86 64.92 1ovm h ILE 489 Cb 0.98 1.26 -0.06 0.00 -0.74 0.00 0.00 36.82 38.25 1ovm h ILE 489 CO 0.00 0.33 0.47 -0.65 0.00 0.00 0.00 178.15 178.30 1ovm h PRO 490 N 0.40 0.83 0.00 2.37 0.11 -1.80 -0.24 132.00 133.66 1ovm h PRO 490 Ca 0.09 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1ovm h PRO 490 Cb 0.48 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.40 1ovm h PRO 490 CO 0.02 0.55 0.00 0.00 -0.21 0.00 0.00 178.00 178.36 1ovm n GLN 491 N -4.69 0.47 -0.10 1.05 0.00 -1.21 -2.26 117.38 110.64 1ovm n GLN 491 Ca 0.11 0.05 -0.11 0.00 0.00 0.00 0.00 57.00 57.04 1ovm n GLN 491 Cb 0.18 -1.50 -0.15 0.00 0.00 0.00 0.00 30.24 28.76 1ovm n GLN 491 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ovm n ALA 492 N -1.12 1.49 -1.00 2.61 0.00 -0.20 -4.35 120.51 117.94 1ovm n ALA 492 Ca 0.12 -1.30 -0.02 0.00 0.00 0.00 0.00 53.44 52.25 1ovm n ALA 492 Cb 0.10 -0.18 0.34 0.00 0.00 0.00 0.00 19.45 19.71 1ovm n ALA 492 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ovm n LEU 493 N -2.82 6.00 -3.56 0.00 4.77 -0.64 -4.92 117.00 115.83 1ovm n LEU 493 Ca -0.34 -3.13 -0.13 0.00 -0.03 0.00 0.00 56.01 52.37 1ovm n LEU 493 Cb 1.14 -0.73 -0.05 0.00 -2.33 0.00 0.00 43.42 41.45 1ovm n LEU 493 CO 0.41 0.75 0.65 -0.55 -1.33 0.00 0.00 177.39 177.32 1ovm s SER 494 N -0.96 -0.48 0.22 -1.43 0.15 -1.07 -4.70 113.70 105.44 1ovm s SER 494 Ca 0.55 0.54 0.23 0.00 0.70 0.00 0.00 55.95 57.97 1ovm s SER 494 Cb 0.43 0.41 0.09 0.00 -1.71 0.00 0.00 66.02 65.24 1ovm s SER 494 CO 0.14 -0.43 1.15 -0.07 1.20 0.00 0.00 173.24 175.23 1ovm h LEU 495 N 2.78 0.00 -5.63 3.45 3.38 -1.88 -3.41 115.31 114.00 1ovm h LEU 495 Ca -0.22 -0.03 -0.39 0.00 0.09 0.00 0.00 57.88 57.34 1ovm h LEU 495 Cb 1.15 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 41.63 1ovm h LEU 495 CO 0.33 0.01 -0.78 -0.67 0.09 0.00 0.00 178.44 177.43 1ovm n ASP 496 N -2.66 -1.65 -4.64 -0.43 -0.08 -1.26 -5.12 116.55 100.70 1ovm n ASP 496 Ca 0.01 -2.78 -0.42 0.00 -1.51 0.00 0.00 54.79 50.08 1ovm n ASP 496 Cb 0.53 0.54 -0.03 0.00 2.34 0.00 0.00 41.12 44.51 1ovm n ASP 496 CO 0.00 0.00 0.00 -2.84 0.12 0.00 0.00 177.20 174.48 1ovm s PRO 497 N 0.13 3.85 -1.34 -0.67 0.02 -1.26 -4.88 135.00 130.85 1ovm s PRO 497 Ca 0.32 2.25 -0.10 0.00 0.02 0.00 0.00 61.00 63.49 1ovm s PRO 497 Cb 0.10 -4.16 0.12 0.00 0.02 0.00 0.00 34.50 30.57 1ovm s PRO 497 CO -0.15 -1.26 2.07 1.04 -0.33 0.00 0.00 177.00 178.36 1ovm n GLN 498 N 7.78 3.56 -4.05 5.54 3.00 -1.26 -4.89 117.38 127.07 1ovm n GLN 498 Ca 0.22 -3.24 -0.10 0.00 -0.01 0.00 0.00 57.00 53.86 1ovm n GLN 498 Cb 0.43 -2.97 -0.06 0.00 0.00 0.00 0.00 30.24 27.64 1ovm n GLN 498 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 1ovm s SER 499 N 1.39 0.09 -0.00 1.08 1.04 -1.26 -2.00 113.70 114.05 1ovm s SER 499 Ca 0.44 -1.10 0.02 0.00 0.48 0.00 0.00 55.95 55.79 1ovm s SER 499 Cb 0.12 0.56 -0.01 0.00 0.10 0.00 0.00 66.02 66.80 1ovm s SER 499 CO -0.03 -1.11 -0.06 -1.61 0.98 0.00 0.00 173.24 171.41 1ovm s GLU 500 N -3.89 0.49 0.03 4.02 2.02 -0.11 -4.94 118.70 116.31 1ovm s GLU 500 Ca 0.27 -0.23 0.02 0.00 0.02 0.00 0.00 54.97 55.04 1ovm s GLU 500 Cb 0.01 -0.46 -0.02 0.00 0.10 0.00 0.00 34.13 33.76 1ovm s GLU 500 CO 0.11 0.13 -0.07 0.00 0.02 0.00 0.00 175.26 175.44 1ovm s TRP 502 N -1.07 -0.23 -0.12 0.00 0.51 -0.67 -4.98 118.94 112.39 1ovm s TRP 502 Ca -0.07 0.55 -0.13 0.00 -2.12 0.00 0.00 56.10 54.33 1ovm s TRP 502 Cb -0.08 0.08 -0.05 0.00 -0.81 0.00 0.00 33.47 32.61 1ovm s TRP 502 CO 0.00 -0.13 0.30 0.50 -0.51 0.00 0.00 176.95 177.11 1ovm s ARG 503 N 0.02 4.04 -0.05 4.98 3.52 -1.26 -0.49 118.95 129.71 1ovm s ARG 503 Ca -0.01 0.14 0.03 0.00 -0.13 0.00 0.00 55.73 55.76 1ovm s ARG 503 Cb -0.02 -3.34 0.00 0.00 -1.56 0.00 0.00 34.95 30.04 1ovm s ARG 503 CO 0.00 0.43 -0.15 0.08 -0.81 0.00 0.00 175.30 174.86 1ovm s VAL 504 N -0.15 1.29 0.00 7.11 1.01 0.14 -4.92 120.40 124.89 1ovm s VAL 504 Ca 0.18 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.55 1ovm s VAL 504 Cb -0.14 -1.14 0.00 0.00 0.00 0.00 0.00 36.38 35.10 1ovm s VAL 504 CO 0.06 0.38 0.00 -1.54 0.00 0.00 0.00 175.10 174.01 1ovm n SER 505 N 3.44 1.55 -4.53 3.32 3.41 -1.26 -1.09 113.62 118.46 1ovm n SER 505 Ca -0.20 -0.16 -0.30 0.00 -0.26 0.00 0.00 58.87 57.95 1ovm n SER 505 Cb 0.53 0.63 -0.11 0.00 -0.26 0.00 0.00 64.21 64.99 1ovm n SER 505 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1ovm s GLU 506 N -0.94 2.02 0.46 4.33 0.41 -1.26 -1.86 118.70 121.86 1ovm s GLU 506 Ca 0.00 -1.05 0.14 0.00 -0.41 0.00 0.00 54.97 53.65 1ovm s GLU 506 Cb 0.00 -2.23 1.05 0.00 -1.78 0.00 0.00 34.13 31.17 1ovm s GLU 506 CO 0.00 0.51 2.03 0.00 -0.49 0.00 0.00 175.26 177.31 1ovm h ALA 507 N 3.89 1.76 -0.31 5.21 0.00 -0.70 -1.82 119.26 127.28 1ovm h ALA 507 Ca -0.49 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.26 1ovm h ALA 507 Cb 1.16 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1ovm h ALA 507 CO 0.49 0.18 0.06 0.93 0.00 0.00 0.00 179.25 180.91 1ovm h GLU 508 N 0.03 0.51 -0.78 0.00 3.07 -1.82 -2.48 114.58 113.10 1ovm h GLU 508 Ca 0.01 -0.13 -0.05 0.00 -0.50 0.00 0.00 59.36 58.68 1ovm h GLU 508 Cb 0.24 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.05 1ovm h GLU 508 CO 0.02 0.59 0.29 1.96 -1.40 0.00 0.00 179.01 180.47 1ovm h GLN 509 N 0.34 1.18 0.07 2.33 4.20 -1.79 -1.66 115.11 119.79 1ovm h GLN 509 Ca 0.09 -0.23 -0.00 0.00 0.06 0.00 0.00 58.65 58.57 1ovm h GLN 509 Cb 0.33 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1ovm h GLN 509 CO 0.00 0.97 -0.04 1.25 -0.67 0.00 0.00 178.83 180.35 1ovm h LEU 510 N 1.15 -0.08 -0.27 1.46 6.46 -1.23 0.21 115.31 123.01 1ovm h LEU 510 Ca 0.26 -0.09 0.03 0.00 -0.12 0.00 0.00 57.88 57.95 1ovm h LEU 510 Cb 0.25 0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.17 1ovm h LEU 510 CO -0.02 0.04 0.08 0.00 -0.62 0.00 0.00 178.44 177.93 1ovm h ALA 511 N 0.71 0.30 0.43 1.25 0.00 -1.36 0.75 119.26 121.34 1ovm h ALA 511 Ca -0.01 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ovm h ALA 511 Cb 0.17 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1ovm h ALA 511 CO 0.02 -0.33 -0.42 0.22 0.00 0.00 0.00 179.25 178.74 1ovm h ASP 512 N 0.20 -1.14 -0.61 0.00 3.58 -1.10 -2.03 116.42 115.32 1ovm h ASP 512 Ca 0.12 0.09 0.07 0.00 0.42 0.00 0.00 57.03 57.74 1ovm h ASP 512 Cb 0.10 0.38 -0.06 0.00 1.72 0.00 0.00 39.33 41.47 1ovm h ASP 512 CO -0.13 -0.57 0.30 0.58 -2.88 0.00 0.00 179.24 176.53 1ovm h VAL 513 N -0.86 0.89 -0.24 2.25 2.07 -0.75 -0.45 116.25 119.16 1ovm h VAL 513 Ca -0.04 -0.19 0.07 0.00 0.82 0.00 0.00 66.70 67.36 1ovm h VAL 513 Cb 0.76 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 1ovm h VAL 513 CO -0.06 0.10 0.19 -0.07 0.02 0.00 0.00 177.57 177.75 1ovm h LEU 514 N 0.55 0.00 -0.09 2.57 3.38 -0.53 0.55 115.31 121.72 1ovm h LEU 514 Ca 0.29 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.02 1ovm h LEU 514 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1ovm h LEU 514 CO -0.22 0.00 -1.03 -0.33 0.09 0.00 0.00 178.44 176.95 1ovm h GLU 515 N 0.00 0.37 -0.69 1.13 4.39 -0.37 -2.16 114.58 117.25 1ovm h GLU 515 Ca 0.12 -0.45 -0.07 0.00 0.34 0.00 0.00 59.36 59.30 1ovm h GLU 515 Cb 0.50 0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.27 1ovm h GLU 515 CO -0.00 1.14 0.16 0.87 -1.16 0.00 0.00 179.01 180.02 1ovm h LYS 516 N 0.18 1.10 -0.01 2.33 1.57 -0.24 -3.13 116.57 118.38 1ovm h LYS 516 Ca -0.10 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1ovm h LYS 516 Cb 1.69 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.85 1ovm h LYS 516 CO 0.17 0.98 -0.24 1.33 -0.57 0.00 0.00 179.45 181.12 1ovm n VAL 517 N -4.26 0.00 -0.27 0.50 0.24 -0.59 -4.59 118.33 109.37 1ovm n VAL 517 Ca 0.05 -0.19 0.12 0.00 -2.04 0.00 0.00 64.34 62.28 1ovm n VAL 517 Cb 0.26 0.61 0.24 0.00 -1.47 0.00 0.00 33.84 33.47 1ovm n VAL 517 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ovm n ALA 518 N -0.32 0.41 -0.26 2.33 0.00 -0.81 0.30 120.51 122.17 1ovm n ALA 518 Ca 0.13 0.83 0.07 0.00 0.00 0.00 0.00 53.44 54.46 1ovm n ALA 518 Cb 0.38 -0.61 0.29 0.00 0.00 0.00 0.00 19.45 19.51 1ovm n ALA 518 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1ovm n HIS 519 N -5.07 1.34 -3.03 0.00 8.25 -1.26 -4.99 115.22 110.46 1ovm n HIS 519 Ca 0.19 -0.50 -0.12 0.00 -0.26 0.00 0.00 57.72 57.03 1ovm n HIS 519 Cb 0.61 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 31.44 1ovm n HIS 519 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1ovm n HIS 520 N 0.70 -0.94 1.30 4.41 1.44 0.15 -4.79 115.22 117.49 1ovm n HIS 520 Ca 0.21 0.39 0.13 0.00 -2.01 0.00 0.00 57.72 56.44 1ovm n HIS 520 Cb 0.82 -1.22 0.44 0.00 0.12 0.00 0.00 29.99 30.16 1ovm n HIS 520 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1ovm n GLU 521 N -1.39 0.89 -3.67 -1.40 1.02 -1.26 -4.83 120.64 110.00 1ovm n GLU 521 Ca -0.14 -0.48 -0.10 0.00 -0.02 0.00 0.00 57.16 56.42 1ovm n GLU 521 Cb 0.32 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.22 1ovm n GLU 521 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1ovm s ARG 522 N -2.45 1.47 0.15 3.49 0.52 -1.26 -5.00 118.95 115.87 1ovm s ARG 522 Ca 0.27 -0.77 -0.31 0.00 -0.52 0.00 0.00 55.73 54.39 1ovm s ARG 522 Cb 0.20 0.57 -0.10 0.00 0.52 0.00 0.00 34.95 36.14 1ovm s ARG 522 CO 0.49 -0.64 1.60 -1.17 0.02 0.00 0.00 175.30 175.59 1ovm s LEU 523 N -2.85 4.37 -0.08 2.53 1.98 -0.84 -4.49 118.68 119.30 1ovm s LEU 523 Ca 0.07 2.60 0.03 0.00 -2.89 0.00 0.00 54.13 53.94 1ovm s LEU 523 Cb -0.02 -3.59 0.01 0.00 0.66 0.00 0.00 46.19 43.25 1ovm s LEU 523 CO -0.03 -0.85 -0.16 -0.94 -1.89 0.00 0.00 176.35 172.48 1ovm s SER 524 N 1.43 2.23 -0.20 3.68 1.04 -0.39 -0.93 113.70 120.56 1ovm s SER 524 Ca 0.71 -0.39 -0.01 0.00 0.48 0.00 0.00 55.95 56.74 1ovm s SER 524 Cb -0.43 -1.02 0.01 0.00 0.10 0.00 0.00 66.02 64.67 1ovm s SER 524 CO 0.32 0.06 -0.13 -0.22 0.98 0.00 0.00 173.24 174.25 1ovm s LEU 525 N 0.64 2.49 -0.27 2.42 2.96 0.08 -0.68 118.68 126.33 1ovm s LEU 525 Ca -0.14 -0.52 -0.02 0.00 -0.22 0.00 0.00 54.13 53.22 1ovm s LEU 525 Cb -0.16 -1.60 0.03 0.00 0.50 0.00 0.00 46.19 44.96 1ovm s LEU 525 CO 0.04 -0.00 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.41 1ovm s ILE 526 N 1.34 3.01 -0.44 6.68 1.01 0.64 -1.66 121.20 131.77 1ovm s ILE 526 Ca 0.05 -1.13 -0.23 0.00 0.00 0.00 0.00 60.65 59.33 1ovm s ILE 526 Cb -0.14 -2.60 0.02 0.00 0.01 0.00 0.00 42.46 39.75 1ovm s ILE 526 CO -0.08 0.08 0.81 -0.70 0.00 0.00 0.00 174.94 175.04 1ovm s GLU 527 N 1.31 3.48 -0.47 2.79 2.12 0.36 -1.11 118.70 127.18 1ovm s GLU 527 Ca -0.02 0.00 -0.17 0.00 0.36 0.00 0.00 54.97 55.15 1ovm s GLU 527 Cb -0.18 -3.92 0.06 0.00 0.26 0.00 0.00 34.13 30.35 1ovm s GLU 527 CO -0.03 -1.09 0.46 0.08 -0.54 0.00 0.00 175.26 174.14 1ovm s VAL 528 N 3.34 5.12 -0.09 3.70 1.01 0.34 0.24 120.40 134.05 1ovm s VAL 528 Ca 0.31 -0.78 -0.30 0.00 0.00 0.00 0.00 61.98 61.21 1ovm s VAL 528 Cb -0.12 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 1ovm s VAL 528 CO 0.22 -0.60 1.29 -0.04 0.00 0.00 0.00 175.10 175.97 1ovm s MET 529 N 1.98 4.28 0.11 2.72 1.00 -0.25 -0.05 119.30 129.10 1ovm s MET 529 Ca 0.08 1.76 0.03 0.00 0.00 0.00 0.00 55.69 57.56 1ovm s MET 529 Cb -0.22 -3.67 -0.04 0.00 0.00 0.00 0.00 34.83 30.90 1ovm s MET 529 CO 0.09 -0.60 -0.08 -0.51 0.00 0.00 0.00 175.02 173.92 1ovm s LEU 530 N 2.89 2.50 0.34 -0.03 1.43 0.09 -4.75 118.68 121.14 1ovm s LEU 530 Ca 0.58 -0.97 -0.29 0.00 -1.03 0.00 0.00 54.13 52.43 1ovm s LEU 530 Cb -0.25 -0.20 -0.11 0.00 0.03 0.00 0.00 46.19 45.66 1ovm s LEU 530 CO 0.20 -0.38 1.41 -2.84 0.23 0.00 0.00 176.35 174.97 1ovm s PRO 531 N -3.59 4.24 0.41 1.29 0.02 -1.26 -4.12 135.00 131.98 1ovm s PRO 531 Ca 0.12 2.39 0.13 0.00 0.02 0.00 0.00 61.00 63.66 1ovm s PRO 531 Cb 0.03 -3.03 0.98 0.00 0.02 0.00 0.00 34.50 32.49 1ovm s PRO 531 CO -0.02 -0.37 1.92 -0.22 -0.33 0.00 0.00 177.00 177.98 1ovm h LYS 532 N 3.45 0.48 -0.06 5.54 3.64 -1.93 -2.56 116.57 125.14 1ovm h LYS 532 Ca -0.49 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1ovm h LYS 532 Cb 1.23 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1ovm h LYS 532 CO 0.67 0.32 0.00 0.00 -2.27 0.00 0.00 179.45 178.17 1ovm n ALA 533 N -2.50 2.46 -1.98 5.00 0.00 -1.26 -4.60 120.51 117.63 1ovm n ALA 533 Ca 0.14 -0.68 -0.42 0.00 0.00 0.00 0.00 53.44 52.48 1ovm n ALA 533 Cb 0.47 -0.58 -0.03 0.00 0.00 0.00 0.00 19.45 19.31 1ovm n ALA 533 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ovm s ASP 534 N -1.39 6.65 0.02 0.00 -1.08 -0.97 -4.99 116.67 114.91 1ovm s ASP 534 Ca 0.21 2.30 0.06 0.00 -0.52 0.00 0.00 52.55 54.60 1ovm s ASP 534 Cb 0.15 -2.54 -0.02 0.00 -1.46 0.00 0.00 42.92 39.05 1ovm s ASP 534 CO 0.22 -0.92 -0.18 -0.63 0.52 0.00 0.00 175.17 174.17 1ovm s ILE 535 N 3.77 1.46 0.68 4.11 1.09 -1.26 -4.89 121.20 126.15 1ovm s ILE 535 Ca 0.74 -0.96 -0.14 0.00 -1.10 0.00 0.00 60.65 59.19 1ovm s ILE 535 Cb -0.35 -1.25 0.01 0.00 -1.06 0.00 0.00 42.46 39.80 1ovm s ILE 535 CO 0.31 0.27 1.10 -2.84 -0.10 0.00 0.00 174.94 173.67 1ovm s PRO 536 N -0.81 2.76 0.05 2.79 0.02 -1.26 -4.90 135.00 133.65 1ovm s PRO 536 Ca 0.06 1.30 -0.12 0.00 0.02 0.00 0.00 61.00 62.27 1ovm s PRO 536 Cb -0.08 -1.95 -0.03 0.00 0.02 0.00 0.00 34.50 32.46 1ovm s PRO 536 CO 0.01 -1.27 1.20 -1.35 -0.33 0.00 0.00 177.00 175.25 1ovm h PRO 537 N -0.19 -0.08 -0.63 5.54 0.11 -1.99 -2.50 132.00 132.26 1ovm h PRO 537 Ca -0.46 0.01 0.13 0.00 0.11 0.00 0.00 66.00 65.78 1ovm h PRO 537 Cb 1.24 0.02 -0.09 0.00 0.11 0.00 0.00 31.00 32.27 1ovm h PRO 537 CO 0.54 -0.05 0.13 1.25 -0.21 0.00 0.00 178.00 179.65 1ovm h LEU 538 N -0.08 -0.03 -1.44 2.35 5.85 -1.90 -2.15 115.31 117.92 1ovm h LEU 538 Ca 0.04 0.12 0.19 0.00 0.84 0.00 0.00 57.88 59.07 1ovm h LEU 538 Cb 0.19 0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.32 1ovm h LEU 538 CO -0.27 -0.01 0.59 0.25 -0.34 0.00 0.00 178.44 178.65 1ovm h LEU 539 N 0.25 0.48 -0.43 2.25 5.85 -1.68 -1.00 115.31 121.03 1ovm h LEU 539 Ca 0.34 0.05 0.03 0.00 0.84 0.00 0.00 57.88 59.14 1ovm h LEU 539 Cb 0.53 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 1ovm h LEU 539 CO -0.44 0.20 0.22 1.23 -0.34 0.00 0.00 178.44 179.31 1ovm h GLY 540 N 0.48 0.59 1.00 3.75 0.00 -1.22 0.12 103.07 107.79 1ovm h GLY 540 Ca 0.47 -0.16 -0.04 0.00 0.00 0.00 0.00 47.33 47.60 1ovm h GLY 540 CO -0.20 0.12 -0.37 0.00 0.00 0.00 0.00 176.54 176.09 1ovm h ALA 541 N 1.22 -1.03 -0.99 3.60 0.00 -1.28 -1.29 119.26 119.49 1ovm h ALA 541 Ca 0.18 -0.23 0.11 0.00 0.00 0.00 0.00 54.91 54.98 1ovm h ALA 541 Cb 0.08 0.40 -0.08 0.00 0.00 0.00 0.00 17.79 18.18 1ovm h ALA 541 CO -0.12 -1.07 0.63 -0.07 0.00 0.00 0.00 179.25 178.62 1ovm h LEU 542 N -1.05 0.91 -0.46 0.00 3.38 -1.35 -1.97 115.31 114.77 1ovm h LEU 542 Ca -0.11 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 1ovm h LEU 542 Cb 0.79 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 1ovm h LEU 542 CO 0.17 0.50 0.13 0.00 0.09 0.00 0.00 178.44 179.34 1ovm h THR 543 N 0.99 1.23 -0.17 0.22 1.03 -0.56 -2.15 112.91 113.48 1ovm h THR 543 Ca 0.48 -0.77 -0.07 0.00 -0.01 0.00 0.00 66.41 66.04 1ovm h THR 543 Cb 0.47 0.86 -0.01 0.00 -1.07 0.00 0.00 68.15 68.39 1ovm h THR 543 CO -0.24 0.28 -0.22 0.50 -0.01 0.00 0.00 175.52 175.82 1ovm h LYS 544 N 0.61 0.30 -0.20 0.00 3.64 -0.51 -2.81 116.57 117.59 1ovm h LYS 544 Ca 0.15 -0.10 -0.19 0.00 -1.27 0.00 0.00 60.65 59.24 1ovm h LYS 544 Cb 0.28 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1ovm h LYS 544 CO -0.00 0.51 -0.65 0.00 -2.27 0.00 0.00 179.45 177.04 1ovm h ALA 545 N 1.50 0.48 -0.33 5.00 0.00 -1.20 -2.63 119.26 122.07 1ovm h ALA 545 Ca 0.05 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 1ovm h ALA 545 Cb 0.55 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ovm h ALA 545 CO 0.04 0.69 0.08 -0.07 0.00 0.00 0.00 179.25 179.99 1ovm h LEU 546 N 0.53 0.51 -1.33 0.00 3.38 -1.21 -2.44 115.31 114.76 1ovm h LEU 546 Ca -0.01 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 1ovm h LEU 546 Cb 1.25 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 1ovm h LEU 546 CO 0.13 0.62 -0.29 -0.08 0.09 0.00 0.00 178.44 178.91 1ovm h GLU 547 N 0.38 0.00 -0.12 1.13 4.57 -1.57 -2.28 114.58 116.69 1ovm h GLU 547 Ca 0.10 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.24 1ovm h GLU 547 Cb 0.31 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.89 1ovm h GLU 547 CO 0.00 0.29 -0.13 0.00 -1.18 0.00 0.00 179.01 177.99 1ovm h ALA 548 N 1.71 1.55 0.00 2.92 0.00 -1.07 -1.45 119.26 122.92 1ovm h ALA 548 Ca -0.00 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 1ovm h ALA 548 Cb 0.65 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1ovm h ALA 548 CO 0.04 0.32 -0.62 0.00 0.00 0.00 0.00 179.25 178.99 1ovm n ASN 550 N -3.49 0.27 -0.01 0.00 3.02 -0.57 -5.13 115.26 109.35 1ovm n ASN 550 Ca 0.00 0.54 0.00 0.00 -0.03 0.00 0.00 54.58 55.09 1ovm n ASN 550 Cb 0.69 -0.61 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 1ovm n ASN 550 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23