#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 1.41 -1.71 -0.78 -0.02 -1.26 -4.87 135.00 127.78 1ovm n PRO 4 Ca 0.00 0.52 -0.42 0.00 -2.02 0.00 0.00 63.50 61.58 1ovm n PRO 4 Cb 0.00 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.17 1ovm n PRO 4 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1ovm n TYR 5 N -0.95 2.71 -4.37 6.00 9.36 -1.26 -4.99 117.16 123.66 1ovm n TYR 5 Ca 0.10 -0.05 -0.21 0.00 3.32 0.00 0.00 57.90 61.06 1ovm n TYR 5 Cb 0.43 -2.70 -0.08 0.00 -0.63 0.00 0.00 39.34 36.35 1ovm n TYR 5 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1ovm h VAL 7 N 2.05 0.41 -0.78 0.00 2.07 -0.97 0.37 116.25 119.40 1ovm h VAL 7 Ca -0.31 -0.10 0.11 0.00 0.82 0.00 0.00 66.70 67.22 1ovm h VAL 7 Cb 1.25 0.08 -0.08 0.00 -1.52 0.00 0.00 31.29 31.03 1ovm h VAL 7 CO 0.47 0.06 0.40 0.00 0.02 0.00 0.00 177.57 178.52 1ovm h ALA 8 N 1.73 1.11 -0.41 1.67 0.00 -1.69 0.05 119.26 121.72 1ovm h ALA 8 Ca 0.54 0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.37 1ovm h ALA 8 Cb 1.04 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1ovm h ALA 8 CO -0.58 -0.03 -0.28 -0.44 0.00 0.00 0.00 179.25 177.92 1ovm h ASP 9 N 0.65 0.95 -0.64 0.00 3.32 -0.63 -2.50 116.42 117.57 1ovm h ASP 9 Ca 0.39 -0.43 0.03 0.00 0.02 0.00 0.00 57.03 57.04 1ovm h ASP 9 Cb 0.45 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.70 1ovm h ASP 9 CO -0.30 1.18 0.39 0.22 -1.72 0.00 0.00 179.24 179.02 1ovm h TYR 10 N 0.73 0.73 0.37 4.55 5.03 -0.12 -0.66 116.97 127.60 1ovm h TYR 10 Ca 0.08 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.39 1ovm h TYR 10 Cb 0.87 -0.24 0.00 0.00 1.55 0.00 0.00 36.73 38.91 1ovm h TYR 10 CO 0.06 0.41 -0.18 1.25 -1.32 0.00 0.00 178.16 178.39 1ovm h LEU 11 N 0.77 -0.42 -0.63 2.82 5.85 -0.92 -2.12 115.31 120.66 1ovm h LEU 11 Ca 0.26 -0.00 0.09 0.00 0.84 0.00 0.00 57.88 59.07 1ovm h LEU 11 Cb 0.03 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.09 1ovm h LEU 11 CO -0.11 -0.28 0.25 -0.07 -0.34 0.00 0.00 178.44 177.90 1ovm h LEU 12 N -0.52 0.27 -0.98 2.25 -0.00 -1.16 -0.78 115.31 114.40 1ovm h LEU 12 Ca -0.05 0.07 0.09 0.00 -0.00 0.00 0.00 57.88 57.99 1ovm h LEU 12 Cb 0.40 0.04 -0.07 0.00 -0.00 0.00 0.00 40.66 41.03 1ovm h LEU 12 CO 0.08 0.16 0.62 0.44 -0.00 0.00 0.00 178.44 179.74 1ovm h ASP 13 N 0.44 0.95 0.27 -0.43 3.32 -0.90 0.30 116.42 120.37 1ovm h ASP 13 Ca 0.31 0.03 -0.10 0.00 0.02 0.00 0.00 57.03 57.29 1ovm h ASP 13 Cb 0.38 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1ovm h ASP 13 CO -0.30 0.57 -0.41 0.03 -1.72 0.00 0.00 179.24 177.40 1ovm h ARG 14 N 1.06 0.19 -0.12 3.56 2.47 -0.51 -1.37 114.38 119.66 1ovm h ARG 14 Ca 0.45 -0.09 -0.00 0.00 -1.26 0.00 0.00 59.98 59.08 1ovm h ARG 14 Cb 0.30 -0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.62 1ovm h ARG 14 CO -0.21 0.58 0.06 -0.07 0.56 0.00 0.00 179.97 180.89 1ovm h LEU 15 N 0.16 0.15 -0.81 3.04 4.07 0.34 -1.43 115.31 120.84 1ovm h LEU 15 Ca 0.01 -0.09 -0.03 0.00 0.08 0.00 0.00 57.88 57.85 1ovm h LEU 15 Cb 0.80 -0.04 -0.04 0.00 1.08 0.00 0.00 40.66 42.47 1ovm h LEU 15 CO 0.06 0.20 0.40 0.71 -1.08 0.00 0.00 178.44 178.73 1ovm h THR 16 N 0.09 1.25 -0.79 0.22 1.35 -1.05 -1.31 112.91 112.67 1ovm h THR 16 Ca 0.04 -0.69 0.09 0.00 -0.55 0.00 0.00 66.41 65.31 1ovm h THR 16 Cb 0.09 0.21 -0.05 0.00 -1.73 0.00 0.00 68.15 66.67 1ovm h THR 16 CO -0.01 0.30 0.52 0.44 -0.25 0.00 0.00 175.52 176.52 1ovm h ASP 17 N 1.14 0.66 0.55 5.36 3.32 -0.83 -0.68 116.42 125.94 1ovm h ASP 17 Ca 0.28 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.35 1ovm h ASP 17 Cb 0.10 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1ovm h ASP 17 CO -0.04 0.40 0.00 0.00 -1.72 0.00 0.00 179.24 177.88 1ovm n GLY 19 N 1.15 1.00 3.80 0.00 0.00 -0.26 -4.64 105.19 106.24 1ovm n GLY 19 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 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 3.74 -0.26 4.61 0.00 -0.98 -4.77 121.76 122.10 1ovm s ALA 20 Ca 0.00 -0.53 0.02 0.00 0.00 0.00 0.00 51.96 51.45 1ovm s ALA 20 Cb 0.00 -2.19 0.01 0.00 0.00 0.00 0.00 23.12 20.94 1ovm s ALA 20 CO 0.00 0.37 0.47 -0.25 0.00 0.00 0.00 175.76 176.34 1ovm n ASP 21 N 2.68 0.95 -4.14 0.00 8.00 -1.26 -3.80 116.55 118.98 1ovm n ASP 21 Ca -0.16 -0.98 -0.11 0.00 0.71 0.00 0.00 54.79 54.25 1ovm n ASP 21 Cb 0.53 0.23 -0.10 0.00 -0.02 0.00 0.00 41.12 41.75 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 -0.43 0.83 -0.10 1.24 3.76 -1.26 -0.11 115.29 119.23 1ovm s HIS 22 Ca 0.02 -0.79 0.00 0.00 -0.15 0.00 0.00 55.06 54.15 1ovm s HIS 22 Cb 0.02 -0.48 0.02 0.00 1.11 0.00 0.00 32.58 33.25 1ovm s HIS 22 CO 0.04 -0.13 -0.08 -1.17 -0.85 0.00 0.00 174.74 172.56 1ovm s LEU 23 N -2.60 1.23 0.20 0.89 2.96 0.42 -4.40 118.68 117.38 1ovm s LEU 23 Ca 0.05 -0.28 0.02 0.00 -0.22 0.00 0.00 54.13 53.71 1ovm s LEU 23 Cb 0.01 -0.79 -0.04 0.00 0.50 0.00 0.00 46.19 45.87 1ovm s LEU 23 CO -0.03 -0.09 0.34 -0.36 -1.32 0.00 0.00 176.35 174.89 1ovm s PHE 24 N 1.50 3.48 -5.00 5.38 0.08 -0.92 -0.12 117.98 122.38 1ovm s PHE 24 Ca 0.01 0.15 0.00 0.00 0.12 0.00 0.00 56.93 57.20 1ovm s PHE 24 Cb -0.13 -1.70 0.00 0.00 -0.57 0.00 0.00 43.02 40.62 1ovm s PHE 24 CO -0.05 0.44 0.00 0.41 -0.10 0.00 0.00 175.22 175.92 1ovm n GLY 25 N -0.86 -0.65 2.82 4.36 0.00 -1.09 0.46 105.19 110.24 1ovm n GLY 25 Ca -0.07 -1.52 -0.15 0.00 0.00 0.00 0.00 46.02 44.28 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 -2.37 0.09 1.03 1.61 -7.23 -1.11 -1.30 120.40 111.13 1ovm s VAL 26 Ca 0.00 0.09 -0.14 0.00 -1.81 0.00 0.00 61.98 60.13 1ovm s VAL 26 Cb 0.00 -0.18 0.13 0.00 0.56 0.00 0.00 36.38 36.89 1ovm s VAL 26 CO 0.00 0.10 0.58 -0.81 -0.31 0.00 0.00 175.10 174.67 1ovm n PRO 27 N 3.91 -1.10 -3.60 4.82 -0.04 -1.26 -4.43 135.00 133.30 1ovm n PRO 27 Ca -0.24 -0.28 -0.09 0.00 -0.04 0.00 0.00 63.50 62.85 1ovm n PRO 27 Cb 0.52 -1.99 -0.05 0.00 -0.04 0.00 0.00 33.50 31.94 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 -2.18 -0.18 0.12 0.55 0.00 -1.26 -4.84 107.32 99.53 1ovm s GLY 28 Ca 0.61 2.30 -0.10 0.00 0.00 0.00 0.00 44.72 47.53 1ovm s GLY 28 CO 0.65 1.22 0.84 1.34 0.00 0.00 0.00 173.10 177.14 1ovm n ASP 29 N 1.01 -0.35 0.00 1.64 2.03 -1.26 0.02 116.55 119.63 1ovm n ASP 29 Ca -0.10 0.94 0.11 0.00 0.52 0.00 0.00 54.79 56.26 1ovm n ASP 29 Cb 0.58 -0.21 0.57 0.00 -0.72 0.00 0.00 41.12 41.33 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 -4.79 0.00 -0.32 -0.67 4.01 -1.26 -3.51 117.16 110.61 1ovm n TYR 30 Ca 0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.79 1ovm n TYR 30 Cb 0.21 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 39.06 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 -1.18 0.97 -0.01 7.72 0.23 0.10 -4.04 115.26 119.05 1ovm n ASN 31 Ca 0.12 -1.29 -0.09 0.00 -0.53 0.00 0.00 54.58 52.79 1ovm n ASN 31 Cb 0.13 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.80 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 -0.23 -0.98 -4.53 4.07 -1.54 0.37 115.31 112.48 1ovm h LEU 32 Ca 0.00 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.02 1ovm h LEU 32 Cb 0.37 0.12 -0.05 0.00 1.08 0.00 0.00 40.66 42.19 1ovm h LEU 32 CO 0.00 -0.09 0.63 1.56 -1.08 0.00 0.00 178.44 179.45 1ovm h GLN 33 N -0.06 1.30 -0.72 1.13 1.08 -1.88 -1.13 115.11 114.85 1ovm h GLN 33 Ca 0.07 -0.09 -0.05 0.00 -1.45 0.00 0.00 58.65 57.13 1ovm h GLN 33 Cb 0.17 -0.29 -0.03 0.00 -0.05 0.00 0.00 27.48 27.28 1ovm h GLN 33 CO -0.17 0.88 0.24 0.35 -0.95 0.00 0.00 178.83 179.18 1ovm h PHE 34 N 1.34 1.13 -0.73 2.96 3.57 -1.79 -2.41 116.94 121.00 1ovm h PHE 34 Ca 0.36 -0.10 0.11 0.00 3.53 0.00 0.00 57.97 61.86 1ovm h PHE 34 Cb -0.12 -0.33 -0.05 0.00 2.79 0.00 0.00 35.95 38.24 1ovm h PHE 34 CO 0.00 0.88 0.48 1.25 -2.23 0.00 0.00 178.31 178.70 1ovm h LEU 35 N 1.06 0.53 -0.39 0.59 5.85 0.34 -1.68 115.31 121.61 1ovm h LEU 35 Ca 0.23 0.02 0.07 0.00 0.84 0.00 0.00 57.88 59.04 1ovm h LEU 35 Cb 0.27 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.15 1ovm h LEU 35 CO -0.01 0.31 0.04 0.44 -0.34 0.00 0.00 178.44 178.88 1ovm h ASP 36 N 0.58 -0.07 -0.93 1.25 3.32 -0.97 -1.41 116.42 118.18 1ovm h ASP 36 Ca 0.34 0.08 0.03 0.00 0.02 0.00 0.00 57.03 57.50 1ovm h ASP 36 Cb 0.55 0.12 -0.05 0.00 0.22 0.00 0.00 39.33 40.17 1ovm h ASP 36 CO -0.12 0.00 0.61 0.45 -1.72 0.00 0.00 179.24 178.46 1ovm h HIS 37 N 0.16 1.14 -0.12 4.55 3.86 -1.39 0.63 115.15 123.98 1ovm h HIS 37 Ca 0.19 0.03 -0.14 0.00 -1.16 0.00 0.00 60.37 59.29 1ovm h HIS 37 Cb 0.25 -0.38 -0.01 0.00 1.06 0.00 0.00 27.41 28.32 1ovm h HIS 37 CO -0.23 0.68 -0.53 -0.24 0.86 0.00 0.00 177.93 178.47 1ovm h VAL 38 N 1.20 1.35 -0.12 2.45 3.04 -1.26 0.09 116.25 122.99 1ovm h VAL 38 Ca 0.36 -1.81 -0.15 0.00 -1.01 0.00 0.00 66.70 64.10 1ovm h VAL 38 Cb -0.03 1.84 -0.01 0.00 -2.01 0.00 0.00 31.29 31.09 1ovm h VAL 38 CO -0.10 0.54 -0.58 0.40 -1.01 0.00 0.00 177.57 176.82 1ovm h ILE 39 N 0.26 1.35 0.00 3.17 2.04 -0.46 -2.91 117.51 120.97 1ovm h ILE 39 Ca 0.01 -1.88 0.00 0.00 1.00 0.00 0.00 64.86 63.98 1ovm h ILE 39 Cb 1.02 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 39.00 1ovm h ILE 39 CO 0.09 0.57 -0.06 0.44 0.00 0.00 0.00 178.15 179.19 1ovm h ASP 40 N 0.29 0.00 -3.58 1.72 3.32 -0.69 -3.45 116.42 114.03 1ovm h ASP 40 Ca -0.00 -0.01 -0.52 0.00 0.02 0.00 0.00 57.03 56.52 1ovm h ASP 40 Cb 1.09 0.00 0.04 0.00 0.22 0.00 0.00 39.33 40.69 1ovm h ASP 40 CO 0.10 0.00 0.64 -0.55 -1.72 0.00 0.00 179.24 177.72 1ovm s SER 41 N -5.42 6.86 0.00 6.45 0.15 -0.00 -4.90 113.70 116.84 1ovm s SER 41 Ca 0.08 2.51 0.27 0.00 0.70 0.00 0.00 55.95 59.51 1ovm s SER 41 Cb 0.08 -2.63 0.83 0.00 -1.71 0.00 0.00 66.02 62.60 1ovm s SER 41 CO 0.65 -0.51 1.62 -0.81 1.20 0.00 0.00 173.24 175.38 1ovm n PRO 42 N 1.89 0.60 -0.01 5.44 -0.04 -1.26 -4.08 135.00 137.54 1ovm n PRO 42 Ca 0.04 -0.31 0.08 0.00 -0.04 0.00 0.00 63.50 63.26 1ovm n PRO 42 Cb 0.42 -1.49 -0.11 0.00 -0.04 0.00 0.00 33.50 32.28 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 -0.93 1.37 -4.22 3.54 8.00 -1.26 -4.95 116.55 118.10 1ovm n ASP 43 Ca 0.11 -0.14 -0.32 0.00 0.71 0.00 0.00 54.79 55.14 1ovm n ASP 43 Cb 0.33 1.58 -0.17 0.00 -0.02 0.00 0.00 41.12 42.84 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 -2.95 2.15 -0.19 0.53 -1.09 -1.26 -4.56 121.20 113.83 1ovm s ILE 44 Ca -0.04 -0.98 -0.08 0.00 -2.23 0.00 0.00 60.65 57.33 1ovm s ILE 44 Cb 0.10 -1.84 -0.04 0.00 -1.58 0.00 0.00 42.46 39.10 1ovm s ILE 44 CO 0.63 0.55 0.07 0.00 -1.23 0.00 0.00 174.94 174.97 1ovm s TRP 46 N 0.42 3.75 -0.33 0.00 -0.11 -1.26 -0.44 118.94 120.97 1ovm s TRP 46 Ca 0.04 1.62 0.01 0.00 1.22 0.00 0.00 56.10 58.99 1ovm s TRP 46 Cb -0.12 -2.95 0.10 0.00 -1.50 0.00 0.00 33.47 29.00 1ovm s TRP 46 CO 0.00 0.21 0.10 0.08 -4.62 0.00 0.00 176.95 172.72 1ovm s VAL 47 N 0.12 1.37 0.27 5.86 1.01 0.84 -4.90 120.40 124.97 1ovm s VAL 47 Ca 0.43 -1.82 -0.29 0.00 0.00 0.00 0.00 61.98 60.30 1ovm s VAL 47 Cb -0.22 -2.02 -0.09 0.00 0.00 0.00 0.00 36.38 34.05 1ovm s VAL 47 CO 0.26 -0.68 1.01 -0.83 0.00 0.00 0.00 175.10 174.86 1ovm s GLY 48 N 1.26 3.07 0.45 4.51 0.00 -1.26 -2.67 107.32 112.67 1ovm s GLY 48 Ca 0.11 0.73 0.06 0.00 0.00 0.00 0.00 44.72 45.62 1ovm s GLY 48 CO -0.17 1.30 0.14 0.00 0.00 0.00 0.00 173.10 174.36 1ovm h ALA 50 N 1.40 0.85 -2.79 0.00 0.00 -1.89 -3.45 119.26 113.37 1ovm h ALA 50 Ca -0.43 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.03 1ovm h ALA 50 Cb 1.27 -0.13 -0.11 0.00 0.00 0.00 0.00 17.79 18.82 1ovm h ALA 50 CO 0.72 0.64 -0.06 0.54 0.00 0.00 0.00 179.25 181.08 1ovm s ASN 51 N -6.81 -0.20 0.37 0.00 2.20 -1.26 -5.06 114.94 104.18 1ovm s ASN 51 Ca -0.09 -0.50 0.09 0.00 -0.94 0.00 0.00 52.86 51.42 1ovm s ASN 51 Cb 0.13 0.52 0.72 0.00 -2.00 0.00 0.00 41.25 40.61 1ovm s ASN 51 CO 0.83 -0.96 1.87 -0.33 -2.94 0.00 0.00 177.10 175.57 1ovm h GLU 52 N 2.31 0.23 0.16 3.55 3.07 -1.89 -2.15 114.58 119.87 1ovm h GLU 52 Ca -0.31 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.48 1ovm h GLU 52 Cb 1.25 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.14 1ovm h GLU 52 CO 0.42 0.42 -0.08 1.25 -1.40 0.00 0.00 179.01 179.63 1ovm h LEU 53 N 0.21 -0.18 -0.76 1.33 6.46 -1.90 -0.18 115.31 120.30 1ovm h LEU 53 Ca 0.04 -0.06 0.04 0.00 -0.12 0.00 0.00 57.88 57.78 1ovm h LEU 53 Cb 0.47 0.05 -0.05 0.00 -0.73 0.00 0.00 40.66 40.40 1ovm h LEU 53 CO 0.03 -0.06 0.47 0.78 -0.62 0.00 0.00 178.44 179.04 1ovm h ASN 54 N -0.29 0.77 -0.47 1.25 -0.26 -1.87 -1.39 115.58 113.31 1ovm h ASN 54 Ca -0.02 0.00 0.05 0.00 -0.56 0.00 0.00 56.30 55.78 1ovm h ASN 54 Cb 0.23 -0.16 -0.05 0.00 -1.06 0.00 0.00 38.32 37.28 1ovm h ASN 54 CO 0.04 0.52 0.19 0.00 -1.06 0.00 0.00 177.43 177.12 1ovm h ALA 55 N 1.33 0.58 -0.73 -0.83 0.00 -1.01 0.24 119.26 118.85 1ovm h ALA 55 Ca 0.31 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.21 1ovm h ALA 55 Cb 0.05 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1ovm h ALA 55 CO -0.13 -0.18 0.26 0.66 0.00 0.00 0.00 179.25 179.86 1ovm h SER 56 N 0.39 1.03 -0.43 0.00 4.64 -0.35 0.61 113.55 119.44 1ovm h SER 56 Ca 0.22 -0.17 -0.03 0.00 -0.47 0.00 0.00 61.79 61.34 1ovm h SER 56 Cb 0.19 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 61.99 1ovm h SER 56 CO -0.20 0.93 0.15 1.88 -0.87 0.00 0.00 176.83 178.72 1ovm h TYR 57 N 1.07 0.68 -0.78 4.77 0.05 -0.25 -1.22 116.97 121.30 1ovm h TYR 57 Ca 0.24 -0.06 -0.00 0.00 0.05 0.00 0.00 58.73 58.96 1ovm h TYR 57 Cb 0.25 -0.20 -0.04 0.00 1.01 0.00 0.00 36.73 37.76 1ovm h TYR 57 CO 0.02 0.61 0.48 0.00 -1.05 0.00 0.00 178.16 178.23 1ovm h ALA 58 N 1.00 0.99 -0.76 3.88 0.00 -0.07 -0.29 119.26 124.01 1ovm h ALA 58 Ca 0.14 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ovm h ALA 58 Cb 0.24 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1ovm h ALA 58 CO -0.01 0.44 0.34 0.00 0.00 0.00 0.00 179.25 180.02 1ovm h ALA 59 N 1.26 1.17 -0.16 0.00 0.00 -0.57 0.60 119.26 121.55 1ovm h ALA 59 Ca 0.28 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ovm h ALA 59 Cb -0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1ovm h ALA 59 CO -0.06 0.62 0.08 0.22 0.00 0.00 0.00 179.25 180.11 1ovm h ASP 60 N 1.08 0.21 -0.65 0.00 1.82 -0.35 0.10 116.42 118.63 1ovm h ASP 60 Ca 0.26 -0.11 0.00 0.00 -0.39 0.00 0.00 57.03 56.79 1ovm h ASP 60 Cb 0.15 -0.05 -0.03 0.00 0.68 0.00 0.00 39.33 40.08 1ovm h ASP 60 CO -0.03 0.26 0.41 1.23 -1.61 0.00 0.00 179.24 179.49 1ovm h GLY 61 N 0.14 0.93 0.82 -0.78 0.00 -0.65 -1.38 103.07 102.15 1ovm h GLY 61 Ca 0.06 -0.37 0.02 0.00 0.00 0.00 0.00 47.33 47.04 1ovm h GLY 61 CO -0.01 0.36 -0.00 -1.82 0.00 0.00 0.00 176.54 175.07 1ovm h TYR 62 N 0.88 -0.01 0.00 5.60 5.03 -0.64 -2.08 116.97 125.75 1ovm h TYR 62 Ca 0.23 0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.55 1ovm h TYR 62 Cb -0.06 0.02 -0.00 0.00 1.55 0.00 0.00 36.73 38.24 1ovm h TYR 62 CO -0.02 -0.02 -0.02 0.00 -1.32 0.00 0.00 178.16 176.78 1ovm h ALA 63 N 1.10 1.71 0.00 1.82 0.00 -0.32 0.11 119.26 123.68 1ovm h ALA 63 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ovm h ALA 63 Cb 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ovm h ALA 63 CO -0.09 0.02 0.00 0.54 0.00 0.00 0.00 179.25 179.72 1ovm n ARG 64 N -4.14 0.11 -0.09 0.00 1.74 -0.56 0.13 116.66 113.85 1ovm n ARG 64 Ca -0.03 0.09 -0.14 0.00 -0.77 0.00 0.00 57.85 57.00 1ovm n ARG 64 Cb 0.10 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 29.97 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 -3.18 1.48 -0.96 0.00 5.02 -0.07 -4.98 118.16 115.48 1ovm n LYS 66 Ca -0.32 -1.30 0.00 0.00 -2.02 0.00 0.00 58.31 54.67 1ovm n LYS 66 Cb 0.81 -1.32 0.00 0.00 -0.02 0.00 0.00 35.03 34.51 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 1.03 0.91 3.58 0.72 0.00 0.12 -4.91 105.19 106.64 1ovm n GLY 67 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 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 -3.64 -0.43 0.17 1.61 2.19 -1.22 -4.72 117.98 111.93 1ovm s PHE 68 Ca 0.00 0.81 -0.17 0.00 0.33 0.00 0.00 56.93 57.90 1ovm s PHE 68 Cb 0.00 0.43 0.03 0.00 -1.31 0.00 0.00 43.02 42.17 1ovm s PHE 68 CO 0.00 -0.35 0.48 0.00 1.83 0.00 0.00 175.22 177.18 1ovm s ALA 69 N -0.83 -0.94 0.01 11.12 0.00 -0.96 -4.16 121.76 125.99 1ovm s ALA 69 Ca -0.02 -0.15 0.02 0.00 0.00 0.00 0.00 51.96 51.81 1ovm s ALA 69 Cb -0.01 0.81 -0.01 0.00 0.00 0.00 0.00 23.12 23.91 1ovm s ALA 69 CO 0.01 -0.75 -0.05 0.00 0.00 0.00 0.00 175.76 174.97 1ovm s ALA 70 N -3.85 0.43 -0.03 0.00 0.00 -1.26 -0.50 121.76 116.55 1ovm s ALA 70 Ca 0.07 -0.33 0.05 0.00 0.00 0.00 0.00 51.96 51.75 1ovm s ALA 70 Cb 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 1ovm s ALA 70 CO -0.06 0.07 -0.19 -1.17 0.00 0.00 0.00 175.76 174.41 1ovm s LEU 71 N -0.45 1.98 -0.17 0.00 2.96 0.19 -2.16 118.68 121.03 1ovm s LEU 71 Ca -0.01 -0.37 0.01 0.00 -0.22 0.00 0.00 54.13 53.53 1ovm s LEU 71 Cb -0.04 -1.04 0.02 0.00 0.50 0.00 0.00 46.19 45.64 1ovm s LEU 71 CO -0.00 0.20 -0.16 -0.22 -1.32 0.00 0.00 176.35 174.84 1ovm s LEU 72 N -0.17 1.92 0.41 -0.68 1.98 0.17 0.27 118.68 122.59 1ovm s LEU 72 Ca 0.00 -0.58 0.04 0.00 -2.89 0.00 0.00 54.13 50.70 1ovm s LEU 72 Cb -0.10 -1.31 -0.02 0.00 0.66 0.00 0.00 46.19 45.41 1ovm s LEU 72 CO 0.01 -0.04 0.13 0.42 -1.89 0.00 0.00 176.35 174.98 1ovm s THR 73 N 1.40 0.60 0.06 3.68 -4.23 -0.26 -2.76 115.64 114.12 1ovm s THR 73 Ca 0.05 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.59 1ovm s THR 73 Cb -0.13 -2.34 -0.04 0.00 1.34 0.00 0.00 72.50 71.33 1ovm s THR 73 CO -0.11 0.00 0.03 0.28 -0.54 0.00 0.00 174.62 174.28 1ovm s THR 74 N -3.20 4.26 0.12 3.99 -1.32 -1.26 -1.47 115.64 116.77 1ovm s THR 74 Ca 0.23 -0.79 -0.33 0.00 -1.21 0.00 0.00 61.69 59.59 1ovm s THR 74 Cb 0.02 -3.01 -0.18 0.00 -1.51 0.00 0.00 72.50 67.82 1ovm s THR 74 CO 0.14 0.19 0.76 0.33 -2.21 0.00 0.00 174.62 173.84 1ovm n PHE 75 N 0.75 0.02 0.00 9.09 7.35 -0.34 -1.31 117.46 133.01 1ovm n PHE 75 Ca -0.11 1.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.58 1ovm n PHE 75 Cb 0.52 -2.02 0.00 0.00 0.35 0.00 0.00 39.48 38.33 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 1.79 0.85 0.36 7.13 0.00 -1.26 -3.89 105.19 110.17 1ovm n GLY 76 Ca 0.19 0.47 0.11 0.00 0.00 0.00 0.00 46.02 46.78 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 0.90 0.05 1.61 -1.51 -1.81 -1.32 116.25 114.17 1ovm h VAL 77 Ca 0.00 -0.20 -0.00 0.00 -1.23 0.00 0.00 66.70 65.27 1ovm h VAL 77 Cb 0.00 0.27 0.00 0.00 -2.13 0.00 0.00 31.29 29.43 1ovm h VAL 77 CO 0.00 0.11 -0.03 1.23 -1.23 0.00 0.00 177.57 177.65 1ovm h GLY 78 N 0.58 -0.07 0.99 5.19 0.00 -1.31 -3.27 103.07 105.18 1ovm h GLY 78 Ca 0.34 0.03 0.01 0.00 0.00 0.00 0.00 47.33 47.71 1ovm h GLY 78 CO -0.12 -0.03 0.47 1.05 0.00 0.00 0.00 176.54 177.91 1ovm h GLU 79 N -0.97 0.93 -0.03 4.80 4.11 -1.30 -2.58 114.58 119.54 1ovm h GLU 79 Ca -0.01 -0.06 -0.08 0.00 0.07 0.00 0.00 59.36 59.29 1ovm h GLU 79 Cb 0.49 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1ovm h GLU 79 CO 0.01 0.61 -0.35 -0.07 0.07 0.00 0.00 179.01 179.29 1ovm h LEU 80 N 0.96 0.06 -2.00 3.06 3.38 -1.42 -1.85 115.31 117.50 1ovm h LEU 80 Ca 0.27 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 1ovm h LEU 80 Cb -0.09 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1ovm h LEU 80 CO -0.06 0.41 -0.02 0.28 0.09 0.00 0.00 178.44 179.13 1ovm h SER 81 N 0.06 0.00 -0.02 -0.43 0.02 -1.51 -2.44 113.55 109.22 1ovm h SER 81 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ovm h SER 81 Cb 0.65 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1ovm h SER 81 CO 0.05 0.02 -0.13 0.00 -1.14 0.00 0.00 176.83 175.63 1ovm n ALA 82 N -2.11 2.76 -0.18 3.77 0.00 -0.72 -3.37 120.51 120.66 1ovm n ALA 82 Ca -0.01 -0.67 -0.06 0.00 0.00 0.00 0.00 53.44 52.70 1ovm n ALA 82 Cb 0.23 -0.81 -0.01 0.00 0.00 0.00 0.00 19.45 18.85 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 4.03 -0.19 -0.45 0.00 2.07 -1.18 -0.73 114.93 118.48 1ovm h MET 83 Ca 0.00 0.01 0.09 0.00 -2.07 0.00 0.00 59.70 57.74 1ovm h MET 83 Cb 0.92 0.04 -0.02 0.00 -1.87 0.00 0.00 31.60 30.67 1ovm h MET 83 CO 0.00 -0.13 0.31 -0.97 1.07 0.00 0.00 176.91 177.19 1ovm h ASN 84 N -0.20 0.17 0.09 1.22 -0.00 -1.82 -0.29 115.58 114.76 1ovm h ASN 84 Ca 0.21 0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.51 1ovm h ASN 84 Cb 0.55 -0.03 0.00 0.00 -0.00 0.00 0.00 38.32 38.84 1ovm h ASN 84 CO -0.64 0.11 -0.04 1.23 -0.00 0.00 0.00 177.43 178.08 1ovm h GLY 85 N 0.19 -0.13 0.85 1.57 0.00 -1.48 -2.30 103.07 101.77 1ovm h GLY 85 Ca 0.21 0.05 0.04 0.00 0.00 0.00 0.00 47.33 47.62 1ovm h GLY 85 CO -0.03 -0.05 0.48 -2.22 0.00 0.00 0.00 176.54 174.72 1ovm h ILE 86 N -0.68 1.10 -0.50 2.60 1.08 -0.93 -0.77 117.51 119.42 1ovm h ILE 86 Ca -0.01 -0.32 0.06 0.00 -0.39 0.00 0.00 64.86 64.19 1ovm h ILE 86 Cb 0.54 0.08 -0.05 0.00 -3.07 0.00 0.00 36.82 34.32 1ovm h ILE 86 CO 0.02 0.17 0.21 0.00 -0.69 0.00 0.00 178.15 177.86 1ovm h ALA 87 N 1.33 0.62 -0.85 1.87 0.00 -1.10 0.15 119.26 121.29 1ovm h ALA 87 Ca 0.31 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1ovm h ALA 87 Cb 0.04 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1ovm h ALA 87 CO -0.12 -0.17 0.44 0.78 0.00 0.00 0.00 179.25 180.18 1ovm h GLY 88 N 0.41 1.28 0.99 0.00 0.00 -0.71 0.19 103.07 105.22 1ovm h GLY 88 Ca 0.23 -0.60 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 1ovm h GLY 88 CO -0.21 0.58 0.27 1.76 0.00 0.00 0.00 176.54 178.94 1ovm h SER 89 N 1.19 0.77 -0.47 0.19 0.02 -0.25 -1.00 113.55 113.99 1ovm h SER 89 Ca 0.29 -0.14 -0.08 0.00 -0.84 0.00 0.00 61.79 61.03 1ovm h SER 89 Cb 0.07 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 1ovm h SER 89 CO -0.04 0.69 -0.02 0.22 -1.14 0.00 0.00 176.83 176.54 1ovm h TYR 90 N 0.79 0.92 -0.89 3.45 5.03 -0.22 0.30 116.97 126.35 1ovm h TYR 90 Ca 0.20 -0.17 -0.01 0.00 2.58 0.00 0.00 58.73 61.33 1ovm h TYR 90 Cb 0.13 -0.24 -0.04 0.00 1.55 0.00 0.00 36.73 38.13 1ovm h TYR 90 CO 0.00 0.88 0.51 0.00 -1.32 0.00 0.00 178.16 178.24 1ovm h ALA 91 N 0.91 1.22 -0.47 1.82 0.00 -0.35 -2.99 119.26 119.41 1ovm h ALA 91 Ca 0.13 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1ovm h ALA 91 Cb 0.53 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1ovm h ALA 91 CO 0.03 0.65 0.04 0.39 0.00 0.00 0.00 179.25 180.36 1ovm n GLU 92 N -4.34 3.75 -3.58 0.00 1.02 -0.41 -4.92 120.64 112.16 1ovm n GLU 92 Ca 0.10 -3.03 -0.24 0.00 -0.02 0.00 0.00 57.16 53.97 1ovm n GLU 92 Cb 0.08 -2.07 0.05 0.00 -0.02 0.00 0.00 31.44 29.48 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 -0.07 -2.05 -3.89 -0.32 8.25 -0.42 -5.00 115.22 111.73 1ovm n HIS 93 Ca 0.28 0.69 -0.35 0.00 -0.26 0.00 0.00 57.72 58.07 1ovm n HIS 93 Cb 1.10 -3.95 -0.14 0.00 1.12 0.00 0.00 29.99 28.13 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 -3.52 3.38 -0.98 1.59 1.01 0.92 -4.64 120.40 118.15 1ovm s VAL 94 Ca 0.31 -0.67 -0.24 0.00 0.00 0.00 0.00 61.98 61.38 1ovm s VAL 94 Cb -0.08 -2.63 -0.06 0.00 0.00 0.00 0.00 36.38 33.62 1ovm s VAL 94 CO 0.81 0.29 1.93 -2.16 0.00 0.00 0.00 175.10 175.98 1ovm s PRO 95 N 1.44 2.57 -0.17 2.72 0.04 -1.25 -3.33 135.00 137.01 1ovm s PRO 95 Ca 0.04 -0.56 -0.01 0.00 0.04 0.00 0.00 61.00 60.51 1ovm s PRO 95 Cb -0.15 -5.12 -0.00 0.00 0.04 0.00 0.00 34.50 29.26 1ovm s PRO 95 CO -0.02 -3.52 -0.12 0.08 0.04 0.00 0.00 177.00 173.46 1ovm s VAL 96 N 10.22 2.91 -0.17 -0.36 1.01 -1.26 -2.27 120.40 130.48 1ovm s VAL 96 Ca 0.69 -0.67 -0.20 0.00 0.00 0.00 0.00 61.98 61.80 1ovm s VAL 96 Cb -0.05 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 1ovm s VAL 96 CO 0.03 0.49 0.57 -0.22 0.00 0.00 0.00 175.10 175.97 1ovm s LEU 97 N 1.00 4.19 -0.35 3.92 2.96 0.35 -1.95 118.68 128.79 1ovm s LEU 97 Ca -0.01 0.83 -0.10 0.00 -0.22 0.00 0.00 54.13 54.63 1ovm s LEU 97 Cb -0.15 -2.82 0.02 0.00 0.50 0.00 0.00 46.19 43.74 1ovm s LEU 97 CO -0.02 -0.17 0.17 -2.28 -1.32 0.00 0.00 176.35 172.73 1ovm s HIS 98 N 1.43 3.22 -0.19 5.38 5.65 0.06 0.53 115.29 131.38 1ovm s HIS 98 Ca 0.28 -0.96 -0.07 0.00 0.25 0.00 0.00 55.06 54.56 1ovm s HIS 98 Cb -0.16 -2.38 -0.04 0.00 -1.18 0.00 0.00 32.58 28.82 1ovm s HIS 98 CO 0.11 -0.62 0.05 0.42 -0.65 0.00 0.00 174.74 174.05 1ovm s ILE 99 N 1.54 4.56 -0.17 0.89 1.01 0.14 -1.36 121.20 127.81 1ovm s ILE 99 Ca 0.02 -0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.57 1ovm s ILE 99 Cb -0.19 -3.06 0.02 0.00 0.01 0.00 0.00 42.46 39.25 1ovm s ILE 99 CO 0.06 0.44 -0.17 0.54 0.00 0.00 0.00 174.94 175.81 1ovm s VAL 100 N 0.59 1.86 0.17 2.92 0.11 -0.58 -1.11 120.40 124.37 1ovm s VAL 100 Ca 0.02 -0.86 -0.30 0.00 -2.93 0.00 0.00 61.98 57.91 1ovm s VAL 100 Cb -0.13 -1.73 -0.08 0.00 -1.53 0.00 0.00 36.38 32.91 1ovm s VAL 100 CO 0.02 0.46 1.30 -0.83 -3.33 0.00 0.00 175.10 172.72 1ovm s GLY 101 N 1.36 2.40 0.24 6.54 0.00 -0.54 -1.05 107.32 116.27 1ovm s GLY 101 Ca 0.04 1.07 0.03 0.00 0.00 0.00 0.00 44.72 45.85 1ovm s GLY 101 CO -0.12 2.09 0.03 0.00 0.00 0.00 0.00 173.10 175.10 1ovm s ALA 102 N 0.33 1.78 0.95 3.20 0.00 -0.71 -1.20 121.76 126.11 1ovm s ALA 102 Ca 0.58 -1.80 -0.11 0.00 0.00 0.00 0.00 51.96 50.63 1ovm s ALA 102 Cb -0.35 0.68 0.15 0.00 0.00 0.00 0.00 23.12 23.59 1ovm s ALA 102 CO 0.36 -0.33 1.03 -2.30 0.00 0.00 0.00 175.76 174.52 1ovm n PRO 103 N -0.43 -0.66 -1.92 0.00 -0.02 -1.26 -0.92 135.00 129.79 1ovm n PRO 103 Ca -0.04 -0.13 -0.37 0.00 -2.02 0.00 0.00 63.50 60.95 1ovm n PRO 103 Cb 0.65 -2.29 0.04 0.00 -0.02 0.00 0.00 33.50 31.88 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 -2.53 2.80 0.25 -1.23 0.00 -1.26 -4.13 107.32 101.22 1ovm s GLY 104 Ca 0.66 1.11 -0.03 0.00 0.00 0.00 0.00 44.72 46.46 1ovm s GLY 104 CO 0.60 1.53 1.76 -0.91 0.00 0.00 0.00 173.10 176.08 1ovm h THR 105 N 0.92 0.75 -0.09 0.90 1.35 -1.92 -1.41 112.91 113.41 1ovm h THR 105 Ca -0.51 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 1ovm h THR 105 Cb 1.31 0.09 -0.00 0.00 -1.73 0.00 0.00 68.15 67.81 1ovm h THR 105 CO 0.55 0.11 0.06 0.00 -0.25 0.00 0.00 175.52 175.99 1ovm h ALA 106 N 1.53 0.12 -0.70 6.62 0.00 -2.00 -0.72 119.26 124.11 1ovm h ALA 106 Ca 0.44 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.38 1ovm h ALA 106 Cb 0.59 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1ovm h ALA 106 CO -0.35 -0.38 0.46 0.00 0.00 0.00 0.00 179.25 178.98 1ovm h ALA 107 N 1.02 1.66 -0.29 0.00 0.00 -1.69 -1.46 119.26 118.49 1ovm h ALA 107 Ca 0.03 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1ovm h ALA 107 Cb 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1ovm h ALA 107 CO -0.01 0.24 -0.20 1.96 0.00 0.00 0.00 179.25 181.24 1ovm h GLN 108 N 0.78 0.66 -0.75 0.00 4.20 -0.78 -2.86 115.11 116.36 1ovm h GLN 108 Ca 0.29 -0.31 0.02 0.00 0.06 0.00 0.00 58.65 58.71 1ovm h GLN 108 Cb 0.17 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.90 1ovm h GLN 108 CO -0.09 0.91 0.49 1.96 -0.67 0.00 0.00 178.83 181.44 1ovm h GLN 109 N 0.40 0.94 0.00 1.46 1.08 -0.43 -1.25 115.11 117.31 1ovm h GLN 109 Ca 0.06 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1ovm h GLN 109 Cb 0.75 -0.21 0.00 0.00 -0.05 0.00 0.00 27.48 27.97 1ovm h GLN 109 CO 0.06 0.62 0.00 0.00 -0.95 0.00 0.00 178.83 178.55 1ovm h ARG 110 N 0.96 0.00 -5.11 1.46 3.08 -1.09 -3.47 114.38 110.21 1ovm h ARG 110 Ca 0.29 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 60.00 1ovm h ARG 110 Cb -0.03 0.00 0.12 0.00 0.08 0.00 0.00 29.97 30.14 1ovm h ARG 110 CO -0.07 0.00 -0.59 0.41 -1.07 0.00 0.00 179.97 178.65 1ovm n GLY 111 N -0.06 -0.31 3.81 0.04 0.00 -0.47 -4.99 105.19 103.21 1ovm n GLY 111 Ca 0.01 0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 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 -5.99 3.01 -1.34 1.61 2.02 -1.24 -4.29 118.70 112.48 1ovm s GLU 112 Ca 0.43 1.02 -0.14 0.00 0.02 0.00 0.00 54.97 56.31 1ovm s GLU 112 Cb -0.19 -2.00 0.10 0.00 0.10 0.00 0.00 34.13 32.14 1ovm s GLU 112 CO 0.62 -1.05 1.91 1.28 0.02 0.00 0.00 175.26 178.04 1ovm n LEU 113 N -2.87 6.10 -4.86 1.80 4.77 -1.26 -4.39 117.00 116.28 1ovm n LEU 113 Ca 0.08 -4.25 -0.32 0.00 -0.03 0.00 0.00 56.01 51.49 1ovm n LEU 113 Cb 0.53 -1.63 -0.05 0.00 -2.33 0.00 0.00 43.42 39.94 1ovm n LEU 113 CO 0.54 0.88 0.40 -0.76 -1.33 0.00 0.00 177.39 177.11 1ovm s LEU 114 N 2.06 4.00 0.65 2.23 1.02 -1.26 -5.05 118.68 122.33 1ovm s LEU 114 Ca 0.46 1.19 -0.17 0.00 0.02 0.00 0.00 54.13 55.63 1ovm s LEU 114 Cb 0.08 -4.01 -0.01 0.00 0.02 0.00 0.00 46.19 42.27 1ovm s LEU 114 CO -0.01 -0.25 1.18 -1.38 0.02 0.00 0.00 176.35 175.91 1ovm s HIS 115 N -2.08 2.34 -0.38 0.29 -3.43 -1.26 -3.03 115.29 107.74 1ovm s HIS 115 Ca 0.52 1.55 0.00 0.00 -0.80 0.00 0.00 55.06 56.34 1ovm s HIS 115 Cb -0.10 -3.40 0.00 0.00 -1.43 0.00 0.00 32.58 27.64 1ovm s HIS 115 CO 0.22 -2.20 0.00 0.72 -2.00 0.00 0.00 174.74 171.48 1ovm n HIS 116 N -2.10 -0.03 -4.59 0.38 8.25 -1.26 -5.04 115.22 110.84 1ovm n HIS 116 Ca 0.13 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.32 1ovm n HIS 116 Cb 0.50 -1.10 -0.10 0.00 1.12 0.00 0.00 29.99 30.42 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 -2.14 1.50 -2.01 1.59 -4.23 -1.17 -4.28 115.64 104.89 1ovm s THR 117 Ca 0.00 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 58.82 1ovm s THR 117 Cb 0.00 -2.74 0.84 0.00 1.34 0.00 0.00 72.50 71.94 1ovm s THR 117 CO 0.00 0.00 2.16 0.18 -0.54 0.00 0.00 174.62 176.42 1ovm n LEU 118 N -0.94 0.18 -0.02 4.79 4.32 -1.26 -4.89 117.00 119.18 1ovm n LEU 118 Ca -0.07 -0.04 -0.00 0.00 -0.02 0.00 0.00 56.01 55.88 1ovm n LEU 118 Cb 0.67 -0.02 -0.00 0.00 -1.62 0.00 0.00 43.42 42.45 1ovm n LEU 118 CO 0.44 0.03 -0.00 0.61 -1.22 0.00 0.00 177.39 177.25 1ovm n GLY 119 N 1.04 0.37 0.00 -0.72 0.00 -1.26 -4.95 105.19 99.68 1ovm n GLY 119 Ca 0.23 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 1.97 1.35 0.00 1.61 5.75 -1.26 -4.99 116.55 120.97 1ovm n ASP 120 Ca -0.00 -1.46 0.00 0.00 -0.01 0.00 0.00 54.79 53.32 1ovm n ASP 120 Cb 0.31 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 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 -0.23 0.66 3.78 6.12 0.00 -1.26 -5.02 105.19 109.23 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 -0.08 4.04 0.00 1.61 0.41 -1.26 -4.41 118.70 119.01 1ovm s GLU 122 Ca 0.00 0.13 0.00 0.00 -0.41 0.00 0.00 54.97 54.69 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 0.43 0.89 1.19 -0.49 0.00 0.00 175.26 177.28 1ovm n PHE 123 N 2.91 0.00 0.25 1.61 3.01 -1.26 -4.67 117.46 119.30 1ovm n PHE 123 Ca -0.14 -0.39 0.06 0.00 1.01 0.00 0.00 57.45 57.99 1ovm n PHE 123 Cb 0.52 -0.04 0.09 0.00 -0.01 0.00 0.00 39.48 40.05 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 -0.39 1.46 0.24 -1.08 5.12 -1.26 -4.70 116.66 116.05 1ovm n ARG 124 Ca 0.00 -1.53 -0.16 0.00 -1.93 0.00 0.00 57.85 54.23 1ovm n ARG 124 Cb 0.22 -1.25 -0.08 0.00 -1.16 0.00 0.00 32.46 30.19 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 2.27 -0.95 -0.28 -1.55 3.86 -2.00 -1.63 115.15 114.87 1ovm h HIS 125 Ca 0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 1ovm h HIS 125 Cb 0.59 0.36 -0.02 0.00 1.06 0.00 0.00 27.41 29.41 1ovm h HIS 125 CO 0.09 -0.51 -0.05 0.74 0.86 0.00 0.00 177.93 179.06 1ovm h PHE 126 N -0.76 0.46 -0.27 2.45 0.04 -1.95 -0.48 116.94 116.43 1ovm h PHE 126 Ca -0.03 -0.05 -0.00 0.00 2.80 0.00 0.00 57.97 60.68 1ovm h PHE 126 Cb 0.67 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.68 1ovm h PHE 126 CO -0.18 0.50 0.16 -0.92 -0.60 0.00 0.00 178.31 177.26 1ovm h TYR 127 N 0.42 0.36 -0.23 -0.55 3.20 -1.81 -2.26 116.97 116.11 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 0.36 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 1ovm h TYR 127 CO 0.01 0.29 -0.30 0.45 -1.64 0.00 0.00 178.16 176.97 1ovm h HIS 128 N 0.33 0.54 0.00 -3.82 3.86 -0.76 -2.60 115.15 112.70 1ovm h HIS 128 Ca 0.10 -0.13 -0.02 0.00 -1.16 0.00 0.00 60.37 59.16 1ovm h HIS 128 Cb 0.04 -0.13 -0.00 0.00 1.06 0.00 0.00 27.41 28.38 1ovm h HIS 128 CO -0.04 0.73 -0.07 0.52 0.86 0.00 0.00 177.93 179.92 1ovm h MET 129 N 0.41 0.00 -0.01 2.45 2.86 -0.77 -2.57 114.93 117.30 1ovm h MET 129 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1ovm h MET 129 Cb 0.74 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.40 1ovm h MET 129 CO 0.06 0.07 -0.33 0.45 1.06 0.00 0.00 176.91 178.22 1ovm n SER 130 N -3.42 1.13 -0.32 1.22 2.88 -0.88 -4.40 113.62 109.82 1ovm n SER 130 Ca -0.02 -0.93 -0.04 0.00 -1.33 0.00 0.00 58.87 56.55 1ovm n SER 130 Cb 0.22 0.22 0.08 0.00 -0.75 0.00 0.00 64.21 63.98 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 1.26 1.22 0.00 -1.46 4.22 -1.42 -2.96 114.58 115.44 1ovm h GLU 131 Ca 0.00 -0.15 0.00 0.00 0.08 0.00 0.00 59.36 59.29 1ovm h GLU 131 Cb 0.54 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1ovm h GLU 131 CO 0.00 0.90 0.00 -1.35 -2.18 0.00 0.00 179.01 176.38 1ovm h PRO 132 N 1.22 0.00 -0.25 0.92 0.11 -1.79 -3.15 132.00 129.05 1ovm h PRO 132 Ca 0.30 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.40 1ovm h PRO 132 Cb 0.05 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.14 1ovm h PRO 132 CO -0.05 0.00 -0.00 0.44 -0.21 0.00 0.00 178.00 178.18 1ovm n ILE 133 N -3.00 2.29 -4.09 4.15 -5.35 -1.12 -4.98 119.36 107.26 1ovm n ILE 133 Ca 0.00 -1.99 -0.10 0.00 -0.27 0.00 0.00 62.75 60.40 1ovm n ILE 133 Cb 0.27 -0.26 -0.10 0.00 -1.74 0.00 0.00 39.64 37.80 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 -2.88 0.41 -0.57 7.28 -4.23 -1.19 -4.58 115.64 109.87 1ovm s THR 134 Ca 0.42 -1.55 0.22 0.00 -1.18 0.00 0.00 61.69 59.60 1ovm s THR 134 Cb 0.34 -1.17 -0.20 0.00 1.34 0.00 0.00 72.50 72.82 1ovm s THR 134 CO 0.08 -0.75 0.86 1.33 -0.54 0.00 0.00 174.62 175.59 1ovm n VAL 135 N 0.59 0.09 -3.63 2.29 0.24 -0.38 -4.92 118.33 112.61 1ovm n VAL 135 Ca -0.17 -0.24 -0.15 0.00 -2.04 0.00 0.00 64.34 61.74 1ovm n VAL 135 Cb 0.59 0.37 -0.07 0.00 -1.47 0.00 0.00 33.84 33.25 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 -1.54 0.13 2.33 0.00 -1.26 -5.00 121.76 113.20 1ovm s ALA 136 Ca 0.02 1.48 -0.18 0.00 0.00 0.00 0.00 51.96 53.29 1ovm s ALA 136 Cb 0.15 -0.60 0.04 0.00 0.00 0.00 0.00 23.12 22.71 1ovm s ALA 136 CO 0.85 -0.31 0.44 1.14 0.00 0.00 0.00 175.76 177.87 1ovm s GLN 137 N -0.30 1.10 -0.18 0.00 -2.07 -1.26 -1.12 119.66 115.82 1ovm s GLN 137 Ca -0.05 -0.64 -0.28 0.00 -1.82 0.00 0.00 55.36 52.58 1ovm s GLN 137 Cb -0.03 0.49 0.08 0.00 -1.09 0.00 0.00 33.01 32.46 1ovm s GLN 137 CO 0.04 -0.44 0.76 0.00 -1.32 0.00 0.00 175.29 174.34 1ovm s ALA 138 N -3.71 -1.81 -0.53 2.60 0.00 -0.31 -4.95 121.76 113.06 1ovm s ALA 138 Ca 0.02 1.72 -0.19 0.00 0.00 0.00 0.00 51.96 53.51 1ovm s ALA 138 Cb 0.01 -0.74 0.07 0.00 0.00 0.00 0.00 23.12 22.46 1ovm s ALA 138 CO -0.12 -0.34 0.65 0.08 0.00 0.00 0.00 175.76 176.03 1ovm s VAL 139 N -0.34 4.86 0.26 0.00 1.01 -1.26 -1.23 120.40 123.71 1ovm s VAL 139 Ca -0.04 -0.62 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 1ovm s VAL 139 Cb -0.03 -4.35 -0.11 0.00 0.00 0.00 0.00 36.38 31.90 1ovm s VAL 139 CO 0.04 -0.89 1.51 -0.76 0.00 0.00 0.00 175.10 175.00 1ovm s LEU 140 N 2.65 4.37 0.23 3.92 1.02 -0.36 -4.95 118.68 125.55 1ovm s LEU 140 Ca 0.14 2.78 0.03 0.00 0.02 0.00 0.00 54.13 57.10 1ovm s LEU 140 Cb -0.20 -3.63 -0.05 0.00 0.02 0.00 0.00 46.19 42.33 1ovm s LEU 140 CO 0.10 -0.79 0.01 0.42 0.02 0.00 0.00 176.35 176.11 1ovm s THR 141 N 0.05 0.94 0.57 5.49 -4.23 -1.26 -4.51 115.64 112.70 1ovm s THR 141 Ca 0.61 -2.02 0.26 0.00 -1.18 0.00 0.00 61.69 59.37 1ovm s THR 141 Cb -0.44 -2.38 0.33 0.00 1.34 0.00 0.00 72.50 71.35 1ovm s THR 141 CO 0.45 -0.29 2.23 -0.08 -0.54 0.00 0.00 174.62 176.39 1ovm h GLU 142 N 2.47 0.00 -0.01 3.99 4.81 -1.95 -0.77 114.58 123.12 1ovm h GLU 142 Ca -0.38 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1ovm h GLU 142 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1ovm h GLU 142 CO 0.64 0.00 -0.47 1.04 -0.73 0.00 0.00 179.01 179.49 1ovm n GLN 143 N -4.02 0.84 0.00 1.92 3.00 -1.26 -4.51 117.38 113.36 1ovm n GLN 143 Ca -0.03 -0.63 0.00 0.00 -0.01 0.00 0.00 57.00 56.34 1ovm n GLN 143 Cb 0.09 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 28.84 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 -0.53 0.23 0.00 1.08 2.04 -0.99 -4.99 115.26 112.10 1ovm n ASN 144 Ca 0.09 -0.20 0.00 0.00 -0.44 0.00 0.00 54.58 54.03 1ovm n ASN 144 Cb 0.40 0.45 0.00 0.00 -2.53 0.00 0.00 39.78 38.10 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 -0.47 0.00 -0.09 -2.53 0.00 -0.33 -1.48 120.51 115.61 1ovm n ALA 145 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1ovm n ALA 145 Cb 0.00 0.03 -0.00 0.00 0.00 0.00 0.00 19.45 19.48 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 -0.14 0.00 -0.05 0.00 -0.00 -1.89 -1.45 116.97 113.45 1ovm h TYR 147 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 58.73 58.67 1ovm h TYR 147 Cb 0.39 0.00 0.01 0.00 0.00 0.00 0.00 36.73 37.13 1ovm h TYR 147 CO -0.39 0.36 -0.90 0.93 -0.00 0.00 0.00 178.16 178.16 1ovm h GLU 148 N 0.00 0.58 -0.76 0.10 4.39 -0.98 -0.83 114.58 117.08 1ovm h GLU 148 Ca -0.00 -0.56 -0.00 0.00 0.34 0.00 0.00 59.36 59.13 1ovm h GLU 148 Cb 0.93 0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 29.69 1ovm h GLU 148 CO 0.05 1.18 0.46 0.82 -1.16 0.00 0.00 179.01 180.36 1ovm h ILE 149 N 0.36 1.22 -0.10 3.13 2.04 -0.75 -1.85 117.51 121.55 1ovm h ILE 149 Ca -0.08 -0.48 -0.15 0.00 1.00 0.00 0.00 64.86 65.16 1ovm h ILE 149 Cb 1.53 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1ovm h ILE 149 CO 0.17 0.22 -0.58 0.44 0.00 0.00 0.00 178.15 178.41 1ovm h ASP 150 N 1.04 0.35 0.08 1.72 3.32 -1.23 -2.94 116.42 118.77 1ovm h ASP 150 Ca 0.27 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 1ovm h ASP 150 Cb -0.04 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.41 1ovm h ASP 150 CO -0.05 0.85 -0.04 -0.09 -1.72 0.00 0.00 179.24 178.19 1ovm h ARG 151 N 0.24 -0.10 -0.44 3.56 2.43 -0.57 -1.17 114.38 118.33 1ovm h ARG 151 Ca -0.00 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 1ovm h ARG 151 Cb 1.08 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.64 1ovm h ARG 151 CO 0.09 0.18 0.14 -0.39 -1.51 0.00 0.00 179.97 178.49 1ovm h VAL 152 N -0.38 1.22 -0.60 0.20 -1.51 -1.43 -0.67 116.25 113.07 1ovm h VAL 152 Ca -0.01 -0.72 0.05 0.00 -1.23 0.00 0.00 66.70 64.79 1ovm h VAL 152 Cb 0.33 0.86 -0.05 0.00 -2.13 0.00 0.00 31.29 30.30 1ovm h VAL 152 CO 0.02 0.26 0.34 -0.07 -1.23 0.00 0.00 177.57 176.88 1ovm h LEU 153 N 0.57 0.51 -0.53 4.19 3.38 -1.54 0.73 115.31 122.61 1ovm h LEU 153 Ca 0.14 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1ovm h LEU 153 Cb 0.26 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1ovm h LEU 153 CO -0.01 0.34 0.29 0.74 0.09 0.00 0.00 178.44 179.90 1ovm h THR 154 N 0.64 1.18 -0.46 0.22 2.02 -0.84 -1.47 112.91 114.21 1ovm h THR 154 Ca 0.26 -0.47 -0.06 0.00 0.77 0.00 0.00 66.41 66.91 1ovm h THR 154 Cb 0.13 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 1ovm h THR 154 CO -0.15 0.20 0.02 0.74 0.37 0.00 0.00 175.52 176.70 1ovm h THR 155 N 0.71 1.23 -0.30 3.16 2.02 -0.57 -1.96 112.91 117.20 1ovm h THR 155 Ca 0.19 -0.92 -0.00 0.00 0.77 0.00 0.00 66.41 66.44 1ovm h THR 155 Cb 0.06 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 1ovm h THR 155 CO -0.03 0.32 0.17 0.24 0.37 0.00 0.00 175.52 176.60 1ovm h MET 156 N 0.69 0.42 -0.35 6.66 2.07 -0.26 -0.64 114.93 123.53 1ovm h MET 156 Ca 0.14 -0.04 -0.07 0.00 -2.07 0.00 0.00 59.70 57.66 1ovm h MET 156 Cb 0.39 -0.08 -0.02 0.00 -1.87 0.00 0.00 31.60 30.02 1ovm h MET 156 CO 0.01 0.34 -0.07 -0.07 1.07 0.00 0.00 176.91 178.20 1ovm h LEU 157 N 0.38 0.55 0.16 1.22 4.07 -1.07 0.68 115.31 121.30 1ovm h LEU 157 Ca 0.11 -0.13 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 1ovm h LEU 157 Cb 0.04 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 41.64 1ovm h LEU 157 CO -0.02 0.67 -0.08 -0.09 -1.08 0.00 0.00 178.44 177.84 1ovm h ARG 158 N 0.53 -0.21 0.00 1.13 2.43 -1.04 -3.31 114.38 113.91 1ovm h ARG 158 Ca 0.10 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1ovm h ARG 158 Cb 0.45 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 1ovm h ARG 158 CO 0.02 0.19 -0.35 0.39 -1.51 0.00 0.00 179.97 178.72 1ovm n GLU 159 N -4.98 0.10 -3.40 0.20 -0.58 -0.28 -4.97 120.64 106.74 1ovm n GLU 159 Ca -0.09 0.04 -0.17 0.00 -0.42 0.00 0.00 57.16 56.53 1ovm n GLU 159 Cb 0.26 -1.58 0.08 0.00 -0.57 0.00 0.00 31.44 29.63 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 -1.73 -5.44 -4.11 3.49 5.12 0.23 -4.98 116.66 109.25 1ovm n ARG 160 Ca 0.05 0.84 -0.11 0.00 -1.93 0.00 0.00 57.85 56.71 1ovm n ARG 160 Cb 0.37 -5.81 -0.08 0.00 -1.16 0.00 0.00 32.46 25.78 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 -5.16 1.28 0.58 5.56 0.52 -1.11 -3.00 118.95 117.62 1ovm s ARG 161 Ca 0.12 -1.45 -0.20 0.00 -0.52 0.00 0.00 55.73 53.68 1ovm s ARG 161 Cb -0.02 0.34 -0.04 0.00 0.52 0.00 0.00 34.95 35.76 1ovm s ARG 161 CO 0.74 -0.46 1.30 -2.14 0.02 0.00 0.00 175.30 174.76 1ovm s PRO 162 N -4.09 2.99 0.16 3.54 0.02 -1.21 -4.17 135.00 132.25 1ovm s PRO 162 Ca 0.30 2.09 0.07 0.00 0.02 0.00 0.00 61.00 63.49 1ovm s PRO 162 Cb 0.04 -2.10 -0.04 0.00 0.02 0.00 0.00 34.50 32.42 1ovm s PRO 162 CO 0.09 -1.27 -0.16 0.20 -0.33 0.00 0.00 177.00 175.54 1ovm s GLY 163 N -1.20 1.30 -0.05 0.52 0.00 -0.82 -1.25 107.32 105.82 1ovm s GLY 163 Ca 0.75 -1.49 0.02 0.00 0.00 0.00 0.00 44.72 44.01 1ovm s GLY 163 CO 0.42 -1.55 -0.10 -0.47 0.00 0.00 0.00 173.10 171.40 1ovm s TYR 164 N -2.41 1.15 -0.11 1.90 6.14 -0.28 -0.76 117.35 122.98 1ovm s TYR 164 Ca 0.16 -0.36 -0.01 0.00 0.64 0.00 0.00 57.07 57.50 1ovm s TYR 164 Cb -0.04 -0.86 0.03 0.00 0.42 0.00 0.00 41.96 41.51 1ovm s TYR 164 CO 0.05 -0.19 -0.06 -0.51 0.64 0.00 0.00 175.55 175.48 1ovm s LEU 165 N 0.53 1.05 -0.30 6.97 1.43 -0.46 -1.16 118.68 126.74 1ovm s LEU 165 Ca -0.10 -0.26 -0.17 0.00 -1.03 0.00 0.00 54.13 52.57 1ovm s LEU 165 Cb -0.13 -0.75 -0.02 0.00 0.03 0.00 0.00 46.19 45.32 1ovm s LEU 165 CO 0.02 -0.14 0.48 -0.32 0.23 0.00 0.00 176.35 176.62 1ovm s MET 166 N 1.77 3.86 -0.54 1.70 -2.45 -0.36 -1.52 119.30 121.75 1ovm s MET 166 Ca 0.05 0.05 -0.06 0.00 -1.25 0.00 0.00 55.69 54.48 1ovm s MET 166 Cb -0.13 -3.72 0.14 0.00 1.25 0.00 0.00 34.83 32.37 1ovm s MET 166 CO -0.08 -0.47 0.38 -1.17 1.05 0.00 0.00 175.02 174.74 1ovm s LEU 167 N 2.30 5.51 0.30 4.11 2.96 -0.22 -1.23 118.68 132.42 1ovm s LEU 167 Ca 0.19 -2.36 -0.30 0.00 -0.22 0.00 0.00 54.13 51.44 1ovm s LEU 167 Cb -0.16 -1.92 -0.11 0.00 0.50 0.00 0.00 46.19 44.50 1ovm s LEU 167 CO 0.11 -0.53 1.55 -2.84 -1.32 0.00 0.00 176.35 173.33 1ovm s PRO 168 N 0.67 4.14 0.27 0.98 0.02 -1.26 -1.74 135.00 138.08 1ovm s PRO 168 Ca 0.12 2.54 -0.01 0.00 0.02 0.00 0.00 61.00 63.66 1ovm s PRO 168 Cb -0.22 -3.03 0.60 0.00 0.02 0.00 0.00 34.50 31.88 1ovm s PRO 168 CO -0.03 -0.58 1.69 0.00 -0.33 0.00 0.00 177.00 177.74 1ovm h ALA 169 N 4.57 1.19 -0.30 -1.55 0.00 -1.18 -1.01 119.26 120.98 1ovm h ALA 169 Ca -0.47 0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.50 1ovm h ALA 169 Cb 1.22 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 1ovm h ALA 169 CO 0.77 -0.35 -0.28 0.38 0.00 0.00 0.00 179.25 179.77 1ovm h ASP 170 N 0.32 0.61 -0.33 0.00 2.03 -1.88 -2.70 116.42 114.48 1ovm h ASP 170 Ca 0.49 -0.23 -0.04 0.00 -0.73 0.00 0.00 57.03 56.52 1ovm h ASP 170 Cb 0.89 -0.17 -0.02 0.00 -0.83 0.00 0.00 39.33 39.21 1ovm h ASP 170 CO -0.54 0.87 0.08 0.58 -1.03 0.00 0.00 179.24 179.20 1ovm h VAL 171 N 0.52 1.19 -0.67 4.15 2.07 -1.57 -2.25 116.25 119.69 1ovm h VAL 171 Ca 0.07 -0.70 0.05 0.00 0.82 0.00 0.00 66.70 66.94 1ovm h VAL 171 Cb 0.75 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 1ovm h VAL 171 CO 0.06 0.25 0.44 0.00 0.02 0.00 0.00 177.57 178.34 1ovm h ALA 172 N 1.50 1.69 0.00 1.67 0.00 -1.07 -1.82 119.26 121.23 1ovm h ALA 172 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ovm h ALA 172 Cb 0.25 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ovm h ALA 172 CO -0.00 0.22 -0.04 1.63 0.00 0.00 0.00 179.25 181.05 1ovm n LYS 173 N -4.47 0.05 -1.87 0.00 5.02 -0.86 -2.00 118.16 114.03 1ovm n LYS 173 Ca 0.09 0.04 -0.39 0.00 -2.02 0.00 0.00 58.31 56.03 1ovm n LYS 173 Cb 0.18 -1.56 0.02 0.00 -0.02 0.00 0.00 35.03 33.65 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 -3.02 3.47 0.43 1.97 3.01 -0.69 -4.78 119.74 120.14 1ovm s LYS 174 Ca 0.13 2.23 -0.25 0.00 -1.01 0.00 0.00 55.97 57.07 1ovm s LYS 174 Cb 0.18 -2.45 -0.08 0.00 -1.01 0.00 0.00 37.83 34.46 1ovm s LYS 174 CO 0.56 -0.92 1.29 0.00 0.51 0.00 0.00 175.35 176.78 1ovm s ALA 175 N -1.29 3.15 0.18 5.17 0.00 -1.26 -0.81 121.76 126.89 1ovm s ALA 175 Ca 0.66 1.19 -0.12 0.00 0.00 0.00 0.00 51.96 53.69 1ovm s ALA 175 Cb -0.40 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.25 1ovm s ALA 175 CO 0.49 -0.87 0.37 0.00 0.00 0.00 0.00 175.76 175.75 1ovm s ALA 176 N -1.32 -0.30 -0.06 0.00 0.00 -0.93 -4.63 121.76 114.52 1ovm s ALA 176 Ca 0.60 -0.68 0.06 0.00 0.00 0.00 0.00 51.96 51.94 1ovm s ALA 176 Cb -0.37 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 23.60 1ovm s ALA 176 CO 0.46 -0.71 -0.23 -0.08 0.00 0.00 0.00 175.76 175.21 1ovm s THR 177 N -3.94 2.25 0.27 0.00 -1.32 -1.26 -4.43 115.64 107.21 1ovm s THR 177 Ca 0.15 -1.00 -0.30 0.00 -1.21 0.00 0.00 61.69 59.33 1ovm s THR 177 Cb 0.02 -1.83 -0.14 0.00 -1.51 0.00 0.00 72.50 69.05 1ovm s THR 177 CO -0.00 0.57 1.23 -2.65 -2.21 0.00 0.00 174.62 171.56 1ovm n PRO 178 N 2.83 1.76 -2.21 7.08 -0.02 -1.26 -4.94 135.00 138.24 1ovm n PRO 178 Ca -0.17 0.62 -0.41 0.00 -2.02 0.00 0.00 63.50 61.52 1ovm n PRO 178 Cb 0.52 -2.16 -0.03 0.00 -0.02 0.00 0.00 33.50 31.81 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 -1.12 4.41 0.13 0.52 0.02 -1.26 -4.93 135.00 132.76 1ovm s PRO 179 Ca 0.63 2.08 -0.05 0.00 0.02 0.00 0.00 61.00 63.67 1ovm s PRO 179 Cb -0.67 -3.15 -0.09 0.00 0.02 0.00 0.00 34.50 30.61 1ovm s PRO 179 CO 0.56 -0.18 1.32 0.28 -0.33 0.00 0.00 177.00 178.65 1ovm h VAL 180 N 3.43 1.37 -4.41 3.83 2.07 -2.07 -3.45 116.25 117.03 1ovm h VAL 180 Ca -0.46 -2.33 -0.68 0.00 0.82 0.00 0.00 66.70 64.04 1ovm h VAL 180 Cb 1.22 2.32 -0.28 0.00 -1.52 0.00 0.00 31.29 33.03 1ovm h VAL 180 CO 0.72 0.70 -0.88 0.20 0.02 0.00 0.00 177.57 178.33 1ovm s ASN 181 N -7.09 3.04 0.54 0.57 0.02 -1.26 -5.12 114.94 105.65 1ovm s ASN 181 Ca -0.07 -0.53 -0.20 0.00 -1.02 0.00 0.00 52.86 51.04 1ovm s ASN 181 Cb 0.09 -0.30 -0.05 0.00 0.02 0.00 0.00 41.25 41.01 1ovm s ASN 181 CO 0.87 0.27 1.21 0.00 0.02 0.00 0.00 177.10 179.47 1ovm s ALA 182 N -0.72 2.73 0.07 0.60 0.00 -1.26 -4.89 121.76 118.29 1ovm s ALA 182 Ca 0.11 1.01 -0.31 0.00 0.00 0.00 0.00 51.96 52.76 1ovm s ALA 182 Cb -0.10 -3.44 -0.10 0.00 0.00 0.00 0.00 23.12 19.48 1ovm s ALA 182 CO 0.01 -0.99 1.88 -0.11 0.00 0.00 0.00 175.76 176.54 1ovm n LEU 183 N -1.16 3.96 -4.87 0.00 7.94 -1.26 -4.95 117.00 116.67 1ovm n LEU 183 Ca 0.11 0.96 -0.32 0.00 -1.11 0.00 0.00 56.01 55.65 1ovm n LEU 183 Cb 0.49 -1.51 -0.06 0.00 0.53 0.00 0.00 43.42 42.87 1ovm n LEU 183 CO 0.46 0.13 0.29 0.42 -1.11 0.00 0.00 177.39 177.58 1ovm s THR 184 N 3.42 4.85 -0.11 1.96 -4.23 -1.26 -4.91 115.64 115.35 1ovm s THR 184 Ca 0.86 0.62 -0.08 0.00 -1.18 0.00 0.00 61.69 61.91 1ovm s THR 184 Cb -0.50 -3.62 -0.03 0.00 1.34 0.00 0.00 72.50 69.69 1ovm s THR 184 CO 0.41 -0.12 -0.15 1.41 -0.54 0.00 0.00 174.62 175.63 1ovm n HIS 185 N -0.24 0.60 -2.52 3.99 -0.00 -1.26 -5.01 115.22 110.79 1ovm n HIS 185 Ca 0.01 0.26 -0.19 0.00 -0.00 0.00 0.00 57.72 57.81 1ovm n HIS 185 Cb 0.53 -0.60 0.02 0.00 -0.00 0.00 0.00 29.99 29.93 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 -4.03 -0.96 -2.45 -0.41 4.81 -1.26 -4.84 118.16 109.02 1ovm n LYS 186 Ca -0.06 0.65 -0.41 0.00 -0.87 0.00 0.00 58.31 57.62 1ovm n LYS 186 Cb 0.23 -1.06 -0.04 0.00 0.02 0.00 0.00 35.03 34.18 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 -1.81 4.54 0.66 1.64 -0.21 -1.26 -4.99 119.66 118.23 1ovm s GLN 187 Ca 0.15 1.78 -0.17 0.00 0.02 0.00 0.00 55.36 57.15 1ovm s GLN 187 Cb -0.02 -3.27 -0.00 0.00 1.00 0.00 0.00 33.01 30.73 1ovm s GLN 187 CO 0.46 -0.02 1.26 0.00 -2.12 0.00 0.00 175.29 174.87 1ovm s ALA 188 N -0.07 2.33 0.53 6.09 0.00 -1.26 -5.02 121.76 124.36 1ovm s ALA 188 Ca 0.51 1.10 -0.06 0.00 0.00 0.00 0.00 51.96 53.51 1ovm s ALA 188 Cb -0.31 -3.52 -0.02 0.00 0.00 0.00 0.00 23.12 19.27 1ovm s ALA 188 CO 0.35 -1.62 0.85 -1.01 0.00 0.00 0.00 175.76 174.34 1ovm s HIS 189 N -1.58 3.46 0.61 0.00 3.76 -1.26 -4.82 115.29 115.46 1ovm s HIS 189 Ca 0.80 0.80 -0.13 0.00 -0.15 0.00 0.00 55.06 56.38 1ovm s HIS 189 Cb -0.34 -2.50 -0.04 0.00 1.11 0.00 0.00 32.58 30.81 1ovm s HIS 189 CO 0.40 -0.51 1.03 0.00 -0.85 0.00 0.00 174.74 174.81 1ovm s ALA 190 N -2.88 2.99 0.03 -1.40 0.00 -1.26 -4.97 121.76 114.27 1ovm s ALA 190 Ca 0.50 0.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.21 1ovm s ALA 190 Cb -0.10 -3.12 -0.07 0.00 0.00 0.00 0.00 23.12 19.82 1ovm s ALA 190 CO 0.46 -0.69 1.64 0.34 0.00 0.00 0.00 175.76 177.51 1ovm s ASP 191 N -3.73 6.64 0.29 0.00 2.15 -1.26 -4.87 116.67 115.89 1ovm s ASP 191 Ca 0.57 2.38 0.04 0.00 0.43 0.00 0.00 52.55 55.97 1ovm s ASP 191 Cb -0.12 -2.55 0.72 0.00 -0.30 0.00 0.00 42.92 40.67 1ovm s ASP 191 CO 0.47 -0.88 1.71 0.77 -0.17 0.00 0.00 175.17 177.07 1ovm h SER 192 N 8.68 0.40 -0.50 -0.34 4.64 -1.98 -0.62 113.55 123.84 1ovm h SER 192 Ca -0.41 0.14 -0.02 0.00 -0.47 0.00 0.00 61.79 61.03 1ovm h SER 192 Cb 1.19 0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.36 1ovm h SER 192 CO 0.93 0.05 0.23 0.00 -0.87 0.00 0.00 176.83 177.17 1ovm h ALA 193 N 1.69 0.65 -0.41 5.18 0.00 -2.00 -1.12 119.26 123.25 1ovm h ALA 193 Ca 0.56 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.28 1ovm h ALA 193 Cb 1.02 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1ovm h ALA 193 CO -0.50 0.22 0.02 0.00 0.00 0.00 0.00 179.25 178.99 1ovm h LEU 195 N 0.56 0.84 -0.09 0.00 5.85 -1.07 -1.12 115.31 120.28 1ovm h LEU 195 Ca 0.12 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 1ovm h LEU 195 Cb 0.46 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.27 1ovm h LEU 195 CO 0.02 0.63 0.04 0.50 -0.34 0.00 0.00 178.44 179.28 1ovm h LYS 196 N 0.98 0.13 -0.86 1.25 3.11 -0.85 0.17 116.57 120.51 1ovm h LYS 196 Ca 0.26 -0.02 0.06 0.00 -2.81 0.00 0.00 60.65 58.14 1ovm h LYS 196 Cb -0.08 -0.02 -0.06 0.00 -1.00 0.00 0.00 32.23 31.06 1ovm h LYS 196 CO -0.05 0.24 0.53 0.00 -2.81 0.00 0.00 179.45 177.35 1ovm h ALA 197 N 0.89 1.19 -0.17 5.00 0.00 -0.81 0.18 119.26 125.54 1ovm h ALA 197 Ca 0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1ovm h ALA 197 Cb 0.15 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1ovm h ALA 197 CO -0.00 0.27 0.01 0.35 0.00 0.00 0.00 179.25 179.88 1ovm h PHE 198 N 0.96 0.30 -0.29 0.00 3.57 -0.87 -2.15 116.94 118.45 1ovm h PHE 198 Ca 0.38 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.88 1ovm h PHE 198 Cb 0.19 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 1ovm h PHE 198 CO -0.03 0.47 0.04 -0.09 -2.23 0.00 0.00 178.31 176.47 1ovm h ARG 199 N 0.05 0.14 -0.60 1.11 2.43 0.32 -0.07 114.38 117.76 1ovm h ARG 199 Ca 0.05 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1ovm h ARG 199 Cb 0.34 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 1ovm h ARG 199 CO 0.01 0.09 0.36 -0.44 -1.51 0.00 0.00 179.97 178.48 1ovm h ASP 200 N 0.14 0.72 -0.72 -3.80 3.32 -0.64 0.01 116.42 115.45 1ovm h ASP 200 Ca 0.14 -0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.06 1ovm h ASP 200 Cb 0.16 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 1ovm h ASP 200 CO -0.20 0.57 0.18 0.00 -1.72 0.00 0.00 179.24 178.07 1ovm h ALA 201 N 1.18 0.95 -0.30 3.45 0.00 -1.01 -1.96 119.26 121.58 1ovm h ALA 201 Ca 0.22 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1ovm h ALA 201 Cb -0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1ovm h ALA 201 CO -0.04 0.67 0.05 0.00 0.00 0.00 0.00 179.25 179.93 1ovm h ALA 202 N 1.09 0.40 0.03 0.00 0.00 -0.64 -2.83 119.26 117.31 1ovm h ALA 202 Ca 0.23 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ovm h ALA 202 Cb 0.37 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1ovm h ALA 202 CO 0.00 0.09 -0.09 1.49 0.00 0.00 0.00 179.25 180.74 1ovm h GLU 203 N 0.32 -0.16 -0.99 0.00 4.81 -0.81 0.98 114.58 118.73 1ovm h GLU 203 Ca 0.09 0.01 0.14 0.00 -0.13 0.00 0.00 59.36 59.47 1ovm h GLU 203 Cb 0.33 0.04 -0.09 0.00 0.63 0.00 0.00 28.75 29.66 1ovm h GLU 203 CO 0.00 -0.11 0.62 -0.91 -0.73 0.00 0.00 179.01 177.89 1ovm h ASN 204 N -0.17 0.85 -0.02 1.04 4.21 -1.36 0.59 115.58 120.73 1ovm h ASN 204 Ca 0.03 0.06 -0.01 0.00 1.21 0.00 0.00 56.30 57.59 1ovm h ASN 204 Cb 0.20 -0.11 -0.00 0.00 -1.12 0.00 0.00 38.32 37.28 1ovm h ASN 204 CO -0.07 0.42 -0.02 0.50 -1.29 0.00 0.00 177.43 176.97 1ovm h LYS 205 N 0.90 0.04 -0.31 0.81 1.63 -1.13 -3.24 116.57 115.26 1ovm h LYS 205 Ca 0.51 -0.02 -0.09 0.00 -0.85 0.00 0.00 60.65 60.20 1ovm h LYS 205 Cb 0.62 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.23 1ovm h LYS 205 CO -0.28 0.53 -0.18 -0.07 -3.45 0.00 0.00 179.45 176.00 1ovm h LEU 206 N -0.44 0.55 -2.23 5.20 4.07 -0.32 -3.03 115.31 119.11 1ovm h LEU 206 Ca 0.00 -0.16 0.04 0.00 0.08 0.00 0.00 57.88 57.84 1ovm h LEU 206 Cb 0.52 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.11 1ovm h LEU 206 CO 0.00 0.74 0.13 0.00 -1.08 0.00 0.00 178.44 178.23 1ovm h ALA 207 N 1.31 1.83 -0.33 1.53 0.00 0.15 -1.50 119.26 122.25 1ovm h ALA 207 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ovm h ALA 207 Cb 0.59 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1ovm h ALA 207 CO 0.04 -0.20 0.00 -1.33 0.00 0.00 0.00 179.25 177.76 1ovm n MET 208 N -4.00 2.61 -2.77 0.00 2.81 -1.15 -4.99 117.12 109.63 1ovm n MET 208 Ca 0.00 -1.99 -0.42 0.00 -1.81 0.00 0.00 57.70 53.49 1ovm n MET 208 Cb 0.25 -1.28 -0.03 0.00 -0.71 0.00 0.00 33.22 31.44 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 -1.00 7.29 -0.05 7.83 0.15 -0.57 -4.96 113.70 122.39 1ovm s SER 209 Ca 0.23 1.56 -0.24 0.00 0.70 0.00 0.00 55.95 58.21 1ovm s SER 209 Cb 0.12 -2.54 -0.19 0.00 -1.71 0.00 0.00 66.02 61.71 1ovm s SER 209 CO 0.17 -0.25 1.01 0.11 1.20 0.00 0.00 173.24 175.47 1ovm h LYS 210 N 6.83 -0.11 -4.34 5.44 1.79 -1.94 -3.46 116.57 120.78 1ovm h LYS 210 Ca -0.40 0.01 -0.30 0.00 -2.18 0.00 0.00 60.65 57.77 1ovm h LYS 210 Cb 1.21 0.02 -0.26 0.00 -1.58 0.00 0.00 32.23 31.62 1ovm h LYS 210 CO 0.76 0.42 -0.75 0.50 -1.08 0.00 0.00 179.45 179.30 1ovm s ARG 211 N -3.58 0.43 0.01 3.15 3.52 -1.26 -4.92 118.95 116.30 1ovm s ARG 211 Ca -0.15 -0.34 0.08 0.00 -0.13 0.00 0.00 55.73 55.19 1ovm s ARG 211 Cb 0.00 -0.35 -0.02 0.00 -1.56 0.00 0.00 34.95 33.02 1ovm s ARG 211 CO 0.58 0.09 -0.24 0.99 -0.81 0.00 0.00 175.30 175.90 1ovm s THR 212 N -0.49 1.92 0.09 4.11 2.01 -1.26 -2.65 115.64 119.38 1ovm s THR 212 Ca -0.02 -1.15 0.07 0.00 0.31 0.00 0.00 61.69 60.90 1ovm s THR 212 Cb -0.04 -1.62 -0.03 0.00 0.01 0.00 0.00 72.50 70.82 1ovm s THR 212 CO -0.00 0.43 -0.18 0.00 -0.69 0.00 0.00 174.62 174.19 1ovm s ALA 213 N -0.67 1.53 -0.15 7.40 0.00 -0.75 -4.10 121.76 125.02 1ovm s ALA 213 Ca 0.10 -1.15 -0.03 0.00 0.00 0.00 0.00 51.96 50.87 1ovm s ALA 213 Cb -0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.83 1ovm s ALA 213 CO 0.00 0.26 -0.06 -1.17 0.00 0.00 0.00 175.76 174.79 1ovm s LEU 214 N -1.90 3.10 -0.20 0.00 0.20 0.12 0.16 118.68 120.16 1ovm s LEU 214 Ca 0.03 -0.19 -0.00 0.00 0.69 0.00 0.00 54.13 54.66 1ovm s LEU 214 Cb -0.09 -1.74 0.05 0.00 -0.43 0.00 0.00 46.19 43.98 1ovm s LEU 214 CO 0.03 0.16 -0.06 -0.22 -0.29 0.00 0.00 176.35 175.98 1ovm s LEU 215 N 0.42 2.02 0.14 -0.68 2.96 0.18 -1.08 118.68 122.63 1ovm s LEU 215 Ca -0.05 -0.89 0.10 0.00 -0.22 0.00 0.00 54.13 53.07 1ovm s LEU 215 Cb -0.15 -1.04 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 1ovm s LEU 215 CO 0.03 -0.20 -0.24 0.00 -1.32 0.00 0.00 176.35 174.62 1ovm s ALA 216 N 1.53 2.20 0.15 5.97 0.00 -0.54 -0.02 121.76 131.04 1ovm s ALA 216 Ca -0.02 -1.44 0.03 0.00 0.00 0.00 0.00 51.96 50.53 1ovm s ALA 216 Cb -0.17 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.63 1ovm s ALA 216 CO -0.07 0.44 0.14 -3.47 0.00 0.00 0.00 175.76 172.79 1ovm n ASP 217 N 0.79 -0.35 -0.29 0.00 2.03 -0.35 -3.56 116.55 114.82 1ovm n ASP 217 Ca -0.17 -1.94 0.27 0.00 0.52 0.00 0.00 54.79 53.47 1ovm n ASP 217 Cb 0.54 0.78 0.48 0.00 -0.72 0.00 0.00 41.12 42.20 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 -0.27 0.74 0.20 -0.67 -1.74 -1.26 -1.14 117.46 113.33 1ovm n PHE 218 Ca 0.03 0.75 0.14 0.00 -0.56 0.00 0.00 57.45 57.81 1ovm n PHE 218 Cb 0.26 -1.17 0.73 0.00 1.52 0.00 0.00 39.48 40.83 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 -0.71 5.98 3.38 -1.86 0.13 115.31 122.23 1ovm h LEU 219 Ca 0.66 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.52 1ovm h LEU 219 Cb 1.90 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.63 1ovm h LEU 219 CO -0.49 0.00 -0.51 1.62 0.09 0.00 0.00 178.44 179.14 1ovm h VAL 220 N 0.00 1.12 -0.11 1.22 3.04 -1.37 -1.74 116.25 118.41 1ovm h VAL 220 Ca 0.07 -1.94 -0.05 0.00 -1.01 0.00 0.00 66.70 63.78 1ovm h VAL 220 Cb 0.31 2.12 -0.00 0.00 -2.01 0.00 0.00 31.29 31.72 1ovm h VAL 220 CO -0.00 0.50 -0.12 -0.07 -1.01 0.00 0.00 177.57 176.87 1ovm h LEU 221 N 0.00 0.29 -1.41 3.16 3.38 -0.93 0.01 115.31 119.82 1ovm h LEU 221 Ca -0.01 -0.49 -0.02 0.00 0.09 0.00 0.00 57.88 57.45 1ovm h LEU 221 Cb 1.08 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1ovm h LEU 221 CO 0.07 0.73 0.16 0.03 0.09 0.00 0.00 178.44 179.52 1ovm h ARG 222 N -0.13 0.56 -0.64 1.13 2.47 -1.15 -2.23 114.38 114.38 1ovm h ARG 222 Ca 0.02 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 1ovm h ARG 222 Cb 0.65 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.86 1ovm h ARG 222 CO 0.03 0.46 0.00 0.72 0.56 0.00 0.00 179.97 181.74 1ovm n HIS 223 N -4.38 1.22 -3.69 3.04 8.25 -0.67 -4.94 115.22 114.05 1ovm n HIS 223 Ca 0.03 -0.46 -0.26 0.00 -0.26 0.00 0.00 57.72 56.77 1ovm n HIS 223 Cb 0.14 -0.26 0.06 0.00 1.12 0.00 0.00 29.99 31.05 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 0.76 -0.52 0.92 -1.41 0.00 -0.84 -4.92 105.19 99.18 1ovm n GLY 224 Ca 0.19 0.23 0.01 0.00 0.00 0.00 0.00 46.02 46.45 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 -4.87 3.66 0.01 0.99 4.77 -0.02 -4.69 117.00 116.85 1ovm n LEU 225 Ca 0.00 -3.63 -0.12 0.00 -0.03 0.00 0.00 56.01 52.23 1ovm n LEU 225 Cb 0.56 -0.58 -0.07 0.00 -2.33 0.00 0.00 43.42 40.99 1ovm n LEU 225 CO 0.68 1.16 0.80 0.50 -1.33 0.00 0.00 177.39 179.20 1ovm h LYS 226 N 1.02 0.04 -0.73 3.23 3.64 -1.89 -2.48 116.57 119.41 1ovm h LYS 226 Ca 0.13 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.45 1ovm h LYS 226 Cb 1.44 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.23 1ovm h LYS 226 CO 0.26 0.19 0.26 0.45 -2.27 0.00 0.00 179.45 178.34 1ovm h HIS 227 N -0.12 1.14 -0.94 1.91 3.86 -1.91 -1.69 115.15 117.40 1ovm h HIS 227 Ca 0.01 -0.10 0.07 0.00 -1.16 0.00 0.00 60.37 59.19 1ovm h HIS 227 Cb 0.17 -0.34 -0.07 0.00 1.06 0.00 0.00 27.41 28.23 1ovm h HIS 227 CO -0.02 0.89 0.60 0.00 0.86 0.00 0.00 177.93 180.26 1ovm h ALA 228 N 1.13 1.31 -0.06 2.45 0.00 -1.85 0.62 119.26 122.86 1ovm h ALA 228 Ca 0.24 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.89 1ovm h ALA 228 Cb 0.26 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.79 1ovm h ALA 228 CO -0.01 0.36 -0.92 -0.07 0.00 0.00 0.00 179.25 178.61 1ovm h LEU 229 N 1.08 0.88 -0.02 0.00 4.07 -1.12 -1.19 115.31 119.01 1ovm h LEU 229 Ca 0.41 -0.65 -0.00 0.00 0.08 0.00 0.00 57.88 57.72 1ovm h LEU 229 Cb 0.18 -0.27 -0.00 0.00 1.08 0.00 0.00 40.66 41.66 1ovm h LEU 229 CO -0.18 1.45 0.01 1.56 -1.08 0.00 0.00 178.44 180.21 1ovm h GLN 230 N 0.44 0.03 -0.39 1.13 4.20 -0.92 -1.36 115.11 118.25 1ovm h GLN 230 Ca -0.09 -0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.67 1ovm h GLN 230 Cb 1.56 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 29.29 1ovm h GLN 230 CO 0.18 0.07 0.11 -0.22 -0.67 0.00 0.00 178.83 178.31 1ovm h LYS 231 N -0.02 0.25 -0.00 1.46 3.64 -0.91 -1.25 116.57 119.74 1ovm h LYS 231 Ca 0.01 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1ovm h LYS 231 Cb 0.05 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.78 1ovm h LYS 231 CO -0.00 0.16 -0.30 2.35 -2.27 0.00 0.00 179.45 179.39 1ovm h TRP 232 N 0.25 -0.87 -0.02 1.91 2.91 -0.79 0.23 115.95 119.57 1ovm h TRP 232 Ca 0.18 0.03 0.01 0.00 1.13 0.00 0.00 58.89 60.24 1ovm h TRP 232 Cb 0.19 0.38 -0.00 0.00 -0.51 0.00 0.00 29.16 29.22 1ovm h TRP 232 CO -0.17 -0.32 0.04 -0.24 -1.03 0.00 0.00 178.44 176.72 1ovm h VAL 233 N -0.37 0.34 0.01 2.65 3.04 -1.10 0.14 116.25 120.95 1ovm h VAL 233 Ca 0.01 0.00 -0.12 0.00 -1.01 0.00 0.00 66.70 65.58 1ovm h VAL 233 Cb 0.40 0.97 0.01 0.00 -2.01 0.00 0.00 31.29 30.66 1ovm h VAL 233 CO -0.20 0.00 -0.46 0.50 -1.01 0.00 0.00 177.57 176.40 1ovm h LYS 234 N 0.00 0.30 -0.27 4.17 3.64 -0.13 -3.24 116.57 121.05 1ovm h LYS 234 Ca 0.01 -0.33 -0.16 0.00 -1.27 0.00 0.00 60.65 58.90 1ovm h LYS 234 Cb 0.08 0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1ovm h LYS 234 CO -0.00 1.04 -0.46 0.93 -2.27 0.00 0.00 179.45 178.68 1ovm h GLU 235 N -0.29 0.78 -3.41 1.90 5.08 -0.19 -3.38 114.58 115.07 1ovm h GLU 235 Ca -0.06 -0.49 -0.67 0.00 -1.00 0.00 0.00 59.36 57.14 1ovm h GLU 235 Cb 1.20 0.05 -0.38 0.00 0.50 0.00 0.00 28.75 30.13 1ovm h GLU 235 CO 0.09 1.12 -0.42 0.08 -1.00 0.00 0.00 179.01 178.88 1ovm s VAL 236 N -4.14 3.42 0.18 3.13 1.01 0.40 -5.07 120.40 119.33 1ovm s VAL 236 Ca -0.11 -3.38 -0.33 0.00 0.00 0.00 0.00 61.98 58.16 1ovm s VAL 236 Cb 0.09 -3.24 -0.13 0.00 0.00 0.00 0.00 36.38 33.10 1ovm s VAL 236 CO 0.87 -0.91 1.65 -2.65 0.00 0.00 0.00 175.10 174.05 1ovm n PRO 237 N 3.00 2.43 -3.67 2.72 -0.02 -1.22 -4.49 135.00 133.75 1ovm n PRO 237 Ca 0.11 0.88 -0.05 0.00 -2.02 0.00 0.00 63.50 62.42 1ovm n PRO 237 Cb 0.36 -2.68 -0.01 0.00 -0.02 0.00 0.00 33.50 31.14 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 1.09 1.02 0.21 -0.52 0.23 -1.26 -4.92 119.30 115.16 1ovm s MET 238 Ca 0.77 -0.52 -0.30 0.00 -1.03 0.00 0.00 55.69 54.61 1ovm s MET 238 Cb -0.60 0.38 -0.10 0.00 -1.53 0.00 0.00 34.83 32.98 1ovm s MET 238 CO 0.36 -0.46 1.44 0.00 -2.03 0.00 0.00 175.02 174.32 1ovm s ALA 239 N -3.17 3.64 -0.04 3.16 0.00 -1.26 -4.58 121.76 119.51 1ovm s ALA 239 Ca 0.10 1.29 -0.16 0.00 0.00 0.00 0.00 51.96 53.19 1ovm s ALA 239 Cb -0.01 -3.56 0.03 0.00 0.00 0.00 0.00 23.12 19.59 1ovm s ALA 239 CO -0.01 -0.71 0.36 -3.38 0.00 0.00 0.00 175.76 172.02 1ovm s HIS 240 N 0.32 -0.27 0.35 0.00 -3.43 -0.66 -0.70 115.29 110.91 1ovm s HIS 240 Ca 0.61 0.48 -0.13 0.00 -0.80 0.00 0.00 55.06 55.22 1ovm s HIS 240 Cb -0.41 0.14 0.03 0.00 -1.43 0.00 0.00 32.58 30.91 1ovm s HIS 240 CO 0.39 -0.38 0.69 0.00 -2.00 0.00 0.00 174.74 173.44 1ovm s ALA 241 N -1.05 -0.45 0.23 -1.38 0.00 -0.24 -4.34 121.76 114.53 1ovm s ALA 241 Ca -0.11 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 50.99 1ovm s ALA 241 Cb -0.04 0.83 -0.05 0.00 0.00 0.00 0.00 23.12 23.86 1ovm s ALA 241 CO 0.04 -0.94 0.11 0.95 0.00 0.00 0.00 175.76 175.92 1ovm s THR 242 N -2.82 0.29 0.58 0.00 -4.23 -1.26 -1.47 115.64 106.73 1ovm s THR 242 Ca 0.19 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.79 1ovm s THR 242 Cb -0.04 -2.57 0.09 0.00 1.34 0.00 0.00 72.50 71.31 1ovm s THR 242 CO 0.13 0.00 0.76 -0.04 -0.54 0.00 0.00 174.62 174.93 1ovm s MET 243 N -4.09 2.27 0.23 3.99 -1.94 -1.23 -1.47 119.30 117.06 1ovm s MET 243 Ca 0.38 -1.70 -0.11 0.00 -1.71 0.00 0.00 55.69 52.55 1ovm s MET 243 Cb 0.07 -2.59 0.32 0.00 2.01 0.00 0.00 34.83 34.65 1ovm s MET 243 CO 0.13 -0.87 1.61 1.25 -0.01 0.00 0.00 175.02 177.13 1ovm h LEU 244 N 0.21 -0.64 -0.82 -0.03 6.46 -1.88 -2.13 115.31 116.48 1ovm h LEU 244 Ca -0.30 0.22 0.03 0.00 -0.12 0.00 0.00 57.88 57.71 1ovm h LEU 244 Cb 1.29 0.44 -0.05 0.00 -0.73 0.00 0.00 40.66 41.61 1ovm h LEU 244 CO 0.42 -0.24 0.53 0.24 -0.62 0.00 0.00 178.44 178.77 1ovm h MET 245 N 0.01 1.01 -0.08 1.25 2.86 -1.94 -2.74 114.93 115.29 1ovm h MET 245 Ca 0.36 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.94 1ovm h MET 245 Cb 0.57 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.00 1ovm h MET 245 CO -0.75 0.67 0.00 0.41 1.06 0.00 0.00 176.91 178.30 1ovm n GLY 246 N -1.32 0.08 3.62 8.32 0.00 -0.86 -4.31 105.19 110.72 1ovm n GLY 246 Ca 0.10 -0.42 -0.50 0.00 0.00 0.00 0.00 46.02 45.20 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 0.19 1.49 0.00 1.61 4.81 -0.86 -2.47 118.16 122.93 1ovm n LYS 247 Ca 0.18 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 58.15 1ovm n LYS 247 Cb 0.33 -2.23 0.00 0.00 0.02 0.00 0.00 35.03 33.15 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 2.87 1.92 0.17 3.14 0.00 -1.26 -4.29 105.19 107.74 1ovm n GLY 248 Ca 0.18 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.25 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 0.87 -3.33 -0.61 3.07 -1.80 -3.44 117.51 112.28 1ovm h ILE 249 Ca 0.00 -1.77 -0.65 0.00 1.55 0.00 0.00 64.86 63.99 1ovm h ILE 249 Cb 0.00 2.10 -0.14 0.00 -0.27 0.00 0.00 36.82 38.52 1ovm h ILE 249 CO 0.00 0.42 -0.70 -0.36 -1.05 0.00 0.00 178.15 176.45 1ovm s PHE 250 N -3.37 2.81 -0.74 0.16 0.08 -1.26 -4.66 117.98 111.00 1ovm s PHE 250 Ca 0.01 -0.12 -0.27 0.00 0.12 0.00 0.00 56.93 56.67 1ovm s PHE 250 Cb 0.10 -1.44 0.03 0.00 -0.57 0.00 0.00 43.02 41.14 1ovm s PHE 250 CO 0.70 0.46 1.34 0.34 -0.10 0.00 0.00 175.22 177.97 1ovm s ASP 251 N -2.42 6.09 0.00 1.36 -1.08 -1.26 -4.88 116.67 114.47 1ovm s ASP 251 Ca 0.24 -0.41 0.07 0.00 -0.52 0.00 0.00 52.55 51.93 1ovm s ASP 251 Cb -0.11 -2.56 0.42 0.00 -1.46 0.00 0.00 42.92 39.21 1ovm s ASP 251 CO 0.16 -1.88 0.86 -0.62 0.52 0.00 0.00 175.17 174.21 1ovm n GLU 252 N 9.35 0.47 0.00 4.34 1.02 -0.50 -2.23 120.64 133.08 1ovm n GLU 252 Ca 0.06 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.30 1ovm n GLU 252 Cb 0.49 -1.23 0.02 0.00 -0.02 0.00 0.00 31.44 30.70 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 -0.73 0.09 -1.72 3.49 1.74 -1.25 -4.83 116.66 113.46 1ovm n ARG 253 Ca 0.05 -0.07 -0.29 0.00 -0.77 0.00 0.00 57.85 56.77 1ovm n ARG 253 Cb 0.02 -1.50 0.11 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 -2.96 1.62 0.24 5.56 -1.52 -0.95 -5.02 119.66 116.64 1ovm s GLN 254 Ca 0.10 0.23 -0.30 0.00 -1.95 0.00 0.00 55.36 53.44 1ovm s GLN 254 Cb 0.17 -1.90 -0.09 0.00 -0.22 0.00 0.00 33.01 30.97 1ovm s GLN 254 CO 0.79 -1.85 1.23 0.00 -0.25 0.00 0.00 175.29 175.20 1ovm s ALA 255 N -3.41 3.47 0.00 6.09 0.00 -1.26 -3.31 121.76 123.34 1ovm s ALA 255 Ca 0.63 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.63 1ovm s ALA 255 Cb -0.13 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1ovm s ALA 255 CO 0.51 -0.42 0.00 0.41 0.00 0.00 0.00 175.76 176.26 1ovm n GLY 256 N 1.77 0.75 3.60 0.00 0.00 -1.26 -4.79 105.19 105.25 1ovm n GLY 256 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.17 3.23 -0.85 1.61 2.19 -1.21 -1.65 117.98 119.13 1ovm s PHE 257 Ca 0.00 0.10 0.07 0.00 0.33 0.00 0.00 56.93 57.43 1ovm s PHE 257 Cb 0.00 -2.34 0.08 0.00 -1.31 0.00 0.00 43.02 39.45 1ovm s PHE 257 CO 0.00 -0.12 0.80 0.66 1.83 0.00 0.00 175.22 178.40 1ovm n TYR 258 N 4.85 0.05 0.00 10.12 4.02 -1.26 -4.93 117.16 130.01 1ovm n TYR 258 Ca -0.14 -0.09 0.00 0.00 -0.01 0.00 0.00 57.90 57.66 1ovm n TYR 258 Cb 0.52 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.83 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 0.36 1.68 3.77 2.72 0.00 -1.26 -4.52 105.19 107.94 1ovm n GLY 259 Ca 0.05 -1.98 -0.40 0.00 0.00 0.00 0.00 46.02 43.69 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 -1.34 4.39 -0.00 2.61 2.01 -1.26 -4.61 115.64 117.44 1ovm s THR 260 Ca 0.00 1.74 -0.21 0.00 0.31 0.00 0.00 61.69 63.53 1ovm s THR 260 Cb 0.00 -4.16 -0.05 0.00 0.01 0.00 0.00 72.50 68.30 1ovm s THR 260 CO 0.00 0.50 0.63 -0.47 -0.69 0.00 0.00 174.62 174.58 1ovm s TYR 261 N -0.98 3.68 -0.42 4.92 5.04 -0.54 -4.77 117.35 124.28 1ovm s TYR 261 Ca 0.37 1.24 0.08 0.00 -2.44 0.00 0.00 57.07 56.32 1ovm s TYR 261 Cb -0.23 -2.65 0.35 0.00 0.35 0.00 0.00 41.96 39.77 1ovm s TYR 261 CO 0.26 0.32 1.09 -1.13 -1.34 0.00 0.00 175.55 174.76 1ovm n SER 262 N 2.81 -1.50 0.00 4.32 3.41 -1.26 -4.28 113.62 117.12 1ovm n SER 262 Ca -0.06 -3.29 0.00 0.00 -0.26 0.00 0.00 58.87 55.27 1ovm n SER 262 Cb 0.51 1.18 0.00 0.00 -0.26 0.00 0.00 64.21 65.64 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 0.13 1.06 0.17 5.00 0.00 -1.26 -2.69 105.19 107.60 1ovm n GLY 263 Ca 0.08 -0.66 0.13 0.00 0.00 0.00 0.00 46.02 45.57 1ovm n GLY 263 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1ovm h SER 264 N 8.98 0.00 0.20 1.61 4.64 -1.74 -1.41 113.55 125.82 1ovm h SER 264 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ovm h SER 264 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ovm h SER 264 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1ovm n ALA 265 N -1.82 2.61 -1.45 5.18 0.00 -1.10 -4.84 120.51 119.09 1ovm n ALA 265 Ca 0.00 -0.18 -0.30 0.00 0.00 0.00 0.00 53.44 52.97 1ovm n ALA 265 Cb 0.16 -1.51 0.11 0.00 0.00 0.00 0.00 19.45 18.21 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 -2.20 4.06 0.65 0.00 0.01 -0.53 -4.88 113.70 110.81 1ovm s SER 266 Ca 0.41 1.31 -0.12 0.00 1.31 0.00 0.00 55.95 58.85 1ovm s SER 266 Cb 0.21 -2.01 -0.01 0.00 0.21 0.00 0.00 66.02 64.42 1ovm s SER 266 CO 0.40 -2.24 1.05 0.42 0.41 0.00 0.00 173.24 173.28 1ovm s THR 267 N -3.11 4.10 0.34 1.44 -4.23 -1.26 -4.80 115.64 108.12 1ovm s THR 267 Ca 0.62 0.76 0.07 0.00 -1.18 0.00 0.00 61.69 61.96 1ovm s THR 267 Cb -0.15 -3.47 0.31 0.00 1.34 0.00 0.00 72.50 70.52 1ovm s THR 267 CO 0.55 -0.81 1.89 1.23 -0.54 0.00 0.00 174.62 176.94 1ovm h GLY 268 N -0.32 1.19 0.98 3.99 0.00 -1.95 -0.13 103.07 106.82 1ovm h GLY 268 Ca -0.45 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 46.54 1ovm h GLY 268 CO 0.58 0.16 -0.23 0.00 0.00 0.00 0.00 176.54 177.04 1ovm h ALA 269 N 1.58 -0.65 -0.03 3.60 0.00 -1.93 -0.79 119.26 121.05 1ovm h ALA 269 Ca 0.41 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1ovm h ALA 269 Cb 0.52 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1ovm h ALA 269 CO -0.18 -0.85 0.02 0.28 0.00 0.00 0.00 179.25 178.52 1ovm h VAL 270 N -0.68 1.01 -0.96 0.00 2.07 -1.67 0.43 116.25 116.45 1ovm h VAL 270 Ca -0.07 -0.03 0.16 0.00 0.82 0.00 0.00 66.70 67.57 1ovm h VAL 270 Cb 0.51 0.98 -0.10 0.00 -1.52 0.00 0.00 31.29 31.17 1ovm h VAL 270 CO 0.11 0.01 0.57 0.50 0.02 0.00 0.00 177.57 178.78 1ovm h LYS 271 N 0.03 0.77 -0.07 1.57 3.64 -0.99 0.19 116.57 121.71 1ovm h LYS 271 Ca 0.01 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.23 1ovm h LYS 271 Cb 0.00 -0.17 0.01 0.00 -0.41 0.00 0.00 32.23 31.66 1ovm h LYS 271 CO -0.00 0.51 -0.42 0.93 -2.27 0.00 0.00 179.45 178.20 1ovm h GLU 272 N 0.80 0.41 -0.78 1.90 4.39 -0.69 -0.06 114.58 120.55 1ovm h GLU 272 Ca 0.52 -0.35 -0.02 0.00 0.34 0.00 0.00 59.36 59.86 1ovm h GLU 272 Cb 0.70 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.39 1ovm h GLU 272 CO -0.34 0.99 0.42 0.00 -1.16 0.00 0.00 179.01 178.92 1ovm h ALA 273 N 0.43 1.28 0.00 3.43 0.00 -0.23 -0.73 119.26 123.44 1ovm h ALA 273 Ca -0.03 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1ovm h ALA 273 Cb 1.07 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1ovm h ALA 273 CO 0.09 0.59 -0.38 -0.89 0.00 0.00 0.00 179.25 178.66 1ovm n ILE 274 N -4.35 0.86 0.30 0.00 2.08 -0.01 -4.16 119.36 114.09 1ovm n ILE 274 Ca 0.08 0.32 0.18 0.00 0.56 0.00 0.00 62.75 63.89 1ovm n ILE 274 Cb 0.10 -2.03 0.86 0.00 -0.75 0.00 0.00 39.64 37.82 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 -0.60 0.00 0.00 0.38 5.08 -1.16 -2.71 114.58 115.57 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 0.38 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1ovm h GLU 275 CO 0.00 0.00 -0.12 0.78 -1.00 0.00 0.00 179.01 178.67 1ovm h GLY 276 N 1.10 0.00 -2.62 -3.84 0.00 -1.01 -3.46 103.07 93.24 1ovm h GLY 276 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.83 1ovm h GLY 276 CO 0.00 0.00 0.46 0.00 0.00 0.00 0.00 176.54 177.00 1ovm s ALA 277 N -3.19 2.96 -0.92 3.60 0.00 -1.03 -4.92 121.76 118.26 1ovm s ALA 277 Ca 0.06 0.85 0.28 0.00 0.00 0.00 0.00 51.96 53.14 1ovm s ALA 277 Cb 0.06 -3.35 1.10 0.00 0.00 0.00 0.00 23.12 20.93 1ovm s ALA 277 CO 0.68 -0.55 1.87 -0.40 0.00 0.00 0.00 175.76 177.36 1ovm n ASP 278 N -0.52 0.22 -3.67 0.00 5.75 -1.08 -4.61 116.55 112.65 1ovm n ASP 278 Ca 0.07 0.52 -0.14 0.00 -0.01 0.00 0.00 54.79 55.24 1ovm n ASP 278 Cb 0.49 -0.58 -0.13 0.00 -1.03 0.00 0.00 41.12 39.86 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 -3.03 -0.39 -0.10 2.12 -4.23 -1.21 -4.60 115.64 104.19 1ovm s THR 279 Ca 0.13 0.29 0.04 0.00 -1.18 0.00 0.00 61.69 60.96 1ovm s THR 279 Cb 0.17 -0.43 -0.00 0.00 1.34 0.00 0.00 72.50 73.58 1ovm s THR 279 CO 0.54 0.12 -0.23 0.54 -0.54 0.00 0.00 174.62 175.04 1ovm s VAL 280 N 2.38 2.11 -0.37 2.29 0.11 -0.44 -1.81 120.40 124.68 1ovm s VAL 280 Ca 0.01 -1.00 -0.22 0.00 -2.93 0.00 0.00 61.98 57.85 1ovm s VAL 280 Cb -0.12 -1.81 0.01 0.00 -1.53 0.00 0.00 36.38 32.93 1ovm s VAL 280 CO -0.08 0.56 0.71 -0.76 -3.33 0.00 0.00 175.10 172.19 1ovm s LEU 281 N 0.36 4.21 -0.44 2.54 1.43 0.12 -2.61 118.68 124.30 1ovm s LEU 281 Ca -0.18 0.21 -0.15 0.00 -1.03 0.00 0.00 54.13 52.98 1ovm s LEU 281 Cb -0.18 -2.90 0.05 0.00 0.03 0.00 0.00 46.19 43.19 1ovm s LEU 281 CO 0.08 -0.67 0.34 0.00 0.23 0.00 0.00 176.35 176.33 1ovm s VAL 283 N 1.65 3.73 -1.62 0.00 1.01 0.97 -1.21 120.40 124.92 1ovm s VAL 283 Ca 0.04 -0.37 -0.03 0.00 0.00 0.00 0.00 61.98 61.61 1ovm s VAL 283 Cb -0.22 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.46 1ovm s VAL 283 CO 0.08 0.40 0.44 0.61 0.00 0.00 0.00 175.10 176.63 1ovm n GLY 284 N 4.74 -0.52 3.85 4.51 0.00 -0.68 -1.22 105.19 115.89 1ovm n GLY 284 Ca -0.17 0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.14 4.87 -0.24 2.61 -1.32 -1.26 -3.11 115.64 114.05 1ovm s THR 285 Ca 0.22 0.72 -0.03 0.00 -1.21 0.00 0.00 61.69 61.39 1ovm s THR 285 Cb -0.10 -3.69 0.11 0.00 -1.51 0.00 0.00 72.50 67.31 1ovm s THR 285 CO 0.28 0.12 0.25 -0.60 -2.21 0.00 0.00 174.62 172.46 1ovm s ARG 286 N -2.30 0.25 -1.29 7.08 6.06 -1.26 -5.04 118.95 122.45 1ovm s ARG 286 Ca 0.42 0.08 -0.16 0.00 -2.50 0.00 0.00 55.73 53.58 1ovm s ARG 286 Cb -0.13 -0.97 0.11 0.00 0.06 0.00 0.00 34.95 34.02 1ovm s ARG 286 CO 0.20 -0.79 1.70 1.19 -2.50 0.00 0.00 175.30 175.09 1ovm n PHE 287 N 5.32 4.55 -1.74 5.12 3.72 -1.26 -4.97 117.46 128.20 1ovm n PHE 287 Ca -0.04 -3.02 -0.30 0.00 -0.05 0.00 0.00 57.45 54.04 1ovm n PHE 287 Cb 0.48 -2.44 0.07 0.00 -0.94 0.00 0.00 39.48 36.65 1ovm n PHE 287 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1ovm s THR 288 N 3.01 3.10 0.20 4.37 -4.23 -1.26 -4.90 115.64 115.92 1ovm s THR 288 Ca 0.49 0.36 -0.10 0.00 -1.18 0.00 0.00 61.69 61.26 1ovm s THR 288 Cb 0.03 -3.24 0.13 0.00 1.34 0.00 0.00 72.50 70.75 1ovm s THR 288 CO 0.03 -0.47 1.78 -2.24 -0.54 0.00 0.00 174.62 173.19 1ovm h ASP 289 N -0.91 0.94 -0.18 3.99 2.03 -1.96 -2.45 116.42 117.89 1ovm h ASP 289 Ca -0.46 -0.14 -0.10 0.00 -0.73 0.00 0.00 57.03 55.60 1ovm h ASP 289 Cb 1.27 -0.24 -0.02 0.00 -0.83 0.00 0.00 39.33 39.51 1ovm h ASP 289 CO 0.62 0.83 -0.20 0.71 -1.03 0.00 0.00 179.24 180.17 1ovm h THR 290 N 1.00 1.26 0.00 1.15 1.35 -1.93 0.01 112.91 115.75 1ovm h THR 290 Ca 0.24 -1.23 0.00 0.00 -0.55 0.00 0.00 66.41 64.87 1ovm h THR 290 Cb 0.14 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 67.79 1ovm h THR 290 CO -0.03 0.40 0.00 -0.07 -0.25 0.00 0.00 175.52 175.58 1ovm h LEU 291 N 0.55 0.00 -3.00 3.87 4.07 -1.87 -3.30 115.31 115.63 1ovm h LEU 291 Ca 0.09 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.05 1ovm h LEU 291 Cb 0.65 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.39 1ovm h LEU 291 CO 0.05 0.00 0.00 0.35 -1.08 0.00 0.00 178.44 177.76 1ovm n THR 292 N -2.96 1.26 -3.52 0.22 -2.24 -0.94 -4.17 114.28 101.93 1ovm n THR 292 Ca 0.03 -1.30 -0.20 0.00 -2.27 0.00 0.00 64.05 60.31 1ovm n THR 292 Cb 0.43 0.31 0.06 0.00 -2.10 0.00 0.00 70.33 69.02 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 -0.48 -2.15 -2.23 6.98 0.00 -0.77 -1.62 120.51 120.24 1ovm n ALA 293 Ca 0.07 -0.08 -0.01 0.00 0.00 0.00 0.00 53.44 53.42 1ovm n ALA 293 Cb 0.40 -2.99 0.00 0.00 0.00 0.00 0.00 19.45 16.86 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 -1.37 0.60 3.16 0.00 0.00 -0.08 -4.04 105.19 103.47 1ovm n GLY 294 Ca -0.24 -0.78 -0.17 0.00 0.00 0.00 0.00 46.02 44.83 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 -3.38 -2.15 -0.88 1.61 3.72 -1.18 -4.93 117.46 110.27 1ovm n PHE 295 Ca -0.00 0.83 0.08 0.00 -0.05 0.00 0.00 57.45 58.30 1ovm n PHE 295 Cb 0.50 -4.53 0.38 0.00 -0.94 0.00 0.00 39.48 34.89 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 -4.13 2.57 -2.58 4.37 -2.24 -0.64 -4.96 114.28 106.67 1ovm n THR 296 Ca -0.12 -1.45 -0.40 0.00 -2.27 0.00 0.00 64.05 59.80 1ovm n THR 296 Cb 0.60 -0.21 -0.05 0.00 -2.10 0.00 0.00 70.33 68.57 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 -2.65 3.73 -0.96 4.78 -3.43 -1.26 -2.86 115.29 112.65 1ovm s HIS 297 Ca 0.52 1.78 -0.03 0.00 -0.80 0.00 0.00 55.06 56.53 1ovm s HIS 297 Cb 0.39 -3.17 0.26 0.00 -1.43 0.00 0.00 32.58 28.63 1ovm s HIS 297 CO 0.16 -0.18 1.05 1.04 -2.00 0.00 0.00 174.74 174.81 1ovm n GLN 298 N 1.33 3.34 -4.42 -0.38 1.13 -1.26 -5.00 117.38 112.12 1ovm n GLN 298 Ca -0.01 -4.53 -0.21 0.00 -1.94 0.00 0.00 57.00 50.30 1ovm n GLN 298 Cb 0.46 -2.44 -0.16 0.00 0.11 0.00 0.00 30.24 28.20 1ovm n GLN 298 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1ovm s LEU 299 N -1.95 1.69 0.25 1.08 1.43 -1.26 -4.82 118.68 115.09 1ovm s LEU 299 Ca 0.31 -0.21 0.09 0.00 -1.03 0.00 0.00 54.13 53.29 1ovm s LEU 299 Cb -0.01 -0.61 -0.04 0.00 0.03 0.00 0.00 46.19 45.56 1ovm s LEU 299 CO -0.03 0.04 0.03 0.42 0.23 0.00 0.00 176.35 177.04 1ovm s THR 300 N 0.40 3.65 0.15 5.49 -4.23 -1.26 -5.03 115.64 114.81 1ovm s THR 300 Ca -0.07 -1.76 -0.18 0.00 -1.18 0.00 0.00 61.69 58.50 1ovm s THR 300 Cb -0.11 -2.94 0.06 0.00 1.34 0.00 0.00 72.50 70.84 1ovm s THR 300 CO 0.01 -0.33 1.68 -0.65 -0.54 0.00 0.00 174.62 174.78 1ovm h PRO 301 N 1.94 -0.01 -0.71 3.99 0.11 -1.91 -1.54 132.00 133.86 1ovm h PRO 301 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1ovm h PRO 301 Cb 1.24 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 1ovm h PRO 301 CO 0.60 -0.01 0.46 0.00 -0.21 0.00 0.00 178.00 178.84 1ovm h ALA 302 N 1.31 1.48 0.00 -0.75 0.00 -1.96 -2.11 119.26 117.23 1ovm h ALA 302 Ca 0.16 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ovm h ALA 302 Cb 0.26 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1ovm h ALA 302 CO -0.35 0.48 0.00 0.94 0.00 0.00 0.00 179.25 180.32 1ovm n GLN 303 N -4.42 0.22 -4.55 0.00 7.27 -0.67 -4.65 117.38 110.58 1ovm n GLN 303 Ca 0.07 0.30 -0.26 0.00 0.07 0.00 0.00 57.00 57.18 1ovm n GLN 303 Cb 0.04 -1.82 -0.11 0.00 2.41 0.00 0.00 30.24 30.77 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 -3.19 2.21 -0.14 1.69 -4.23 -0.67 -1.33 115.64 109.99 1ovm s THR 304 Ca 0.08 -2.17 -0.04 0.00 -1.18 0.00 0.00 61.69 58.38 1ovm s THR 304 Cb 0.11 -2.70 0.05 0.00 1.34 0.00 0.00 72.50 71.30 1ovm s THR 304 CO 0.50 -0.17 0.06 -0.63 -0.54 0.00 0.00 174.62 173.84 1ovm s ILE 305 N -2.62 0.11 0.06 2.99 1.01 -1.07 -2.19 121.20 119.49 1ovm s ILE 305 Ca 0.33 -0.12 0.09 0.00 0.00 0.00 0.00 60.65 60.95 1ovm s ILE 305 Cb 0.04 -0.60 -0.03 0.00 0.01 0.00 0.00 42.46 41.87 1ovm s ILE 305 CO 0.17 -0.12 -0.25 -1.83 0.00 0.00 0.00 174.94 172.91 1ovm s GLU 306 N 2.06 1.77 -0.10 2.79 -1.05 -0.23 -0.67 118.70 123.27 1ovm s GLU 306 Ca 0.02 -1.14 0.04 0.00 -0.15 0.00 0.00 54.97 53.74 1ovm s GLU 306 Cb -0.15 -2.00 0.00 0.00 -0.44 0.00 0.00 34.13 31.54 1ovm s GLU 306 CO -0.07 0.50 -0.22 0.14 0.95 0.00 0.00 175.26 176.56 1ovm s VAL 307 N -0.88 1.95 0.43 1.83 -7.23 -0.35 0.55 120.40 116.70 1ovm s VAL 307 Ca 0.13 -0.95 0.07 0.00 -1.81 0.00 0.00 61.98 59.41 1ovm s VAL 307 Cb -0.10 -1.70 -0.05 0.00 0.56 0.00 0.00 36.38 35.09 1ovm s VAL 307 CO 0.03 0.54 0.14 -1.10 -0.31 0.00 0.00 175.10 174.40 1ovm s GLN 308 N 0.41 2.16 0.29 4.82 -1.52 0.18 -1.68 119.66 124.31 1ovm s GLN 308 Ca -0.18 -1.97 0.01 0.00 -1.95 0.00 0.00 55.36 51.26 1ovm s GLN 308 Cb -0.18 -1.86 0.69 0.00 -0.22 0.00 0.00 33.01 31.44 1ovm s GLN 308 CO 0.08 -0.16 1.61 -1.35 -0.25 0.00 0.00 175.29 175.22 1ovm h PRO 309 N 1.46 0.09 0.00 2.91 0.11 -1.97 -3.08 132.00 131.52 1ovm h PRO 309 Ca -0.43 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1ovm h PRO 309 Cb 1.26 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1ovm h PRO 309 CO 0.72 0.06 0.00 0.72 -0.21 0.00 0.00 178.00 179.29 1ovm n HIS 310 N -5.36 0.00 -3.64 0.65 8.25 -1.26 -1.14 115.22 112.72 1ovm n HIS 310 Ca 0.21 -0.36 -0.15 0.00 -0.26 0.00 0.00 57.72 57.16 1ovm n HIS 310 Cb 0.69 -0.04 -0.07 0.00 1.12 0.00 0.00 29.99 31.69 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 -0.72 -1.24 0.14 -1.41 0.00 -1.15 -0.79 121.76 116.58 1ovm s ALA 311 Ca 0.00 0.73 0.06 0.00 0.00 0.00 0.00 51.96 52.75 1ovm s ALA 311 Cb 0.00 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.19 1ovm s ALA 311 CO 0.00 -0.35 -0.14 0.00 0.00 0.00 0.00 175.76 175.27 1ovm s ALA 312 N -1.52 1.56 0.02 0.00 0.00 -0.82 0.48 121.76 121.48 1ovm s ALA 312 Ca -0.11 -1.37 0.03 0.00 0.00 0.00 0.00 51.96 50.51 1ovm s ALA 312 Cb -0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.02 1ovm s ALA 312 CO 0.05 0.07 -0.09 0.50 0.00 0.00 0.00 175.76 176.29 1ovm s ARG 313 N -2.94 0.64 -0.15 0.00 3.52 0.19 0.27 118.95 120.49 1ovm s ARG 313 Ca 0.12 -0.52 -0.02 0.00 -0.13 0.00 0.00 55.73 55.18 1ovm s ARG 313 Cb -0.03 -0.57 0.05 0.00 -1.56 0.00 0.00 34.95 32.83 1ovm s ARG 313 CO 0.03 0.14 0.01 0.14 -0.81 0.00 0.00 175.30 174.81 1ovm s VAL 314 N -0.68 0.55 0.00 7.11 -7.23 -0.57 -1.07 120.40 118.52 1ovm s VAL 314 Ca -0.01 -0.32 0.00 0.00 -1.81 0.00 0.00 61.98 59.84 1ovm s VAL 314 Cb -0.06 -0.89 0.00 0.00 0.56 0.00 0.00 36.38 35.99 1ovm s VAL 314 CO 0.00 0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.41 1ovm n GLY 315 N 5.06 3.30 0.45 2.32 0.00 -0.93 -2.07 105.19 113.32 1ovm n GLY 315 Ca -0.09 -0.06 0.10 0.00 0.00 0.00 0.00 46.02 45.97 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 9.27 1.88 -4.77 1.61 8.00 -1.26 -4.59 116.55 126.69 1ovm n ASP 316 Ca 0.00 -1.44 -0.36 0.00 0.71 0.00 0.00 54.79 53.70 1ovm n ASP 316 Cb 0.00 0.48 -0.07 0.00 -0.02 0.00 0.00 41.12 41.50 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 -2.26 5.40 -0.02 2.53 1.01 -0.88 -5.09 120.40 121.10 1ovm s VAL 317 Ca 0.16 0.28 -0.01 0.00 0.00 0.00 0.00 61.98 62.42 1ovm s VAL 317 Cb 0.16 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 1ovm s VAL 317 CO 0.51 0.48 0.06 0.26 0.00 0.00 0.00 175.10 176.41 1ovm s TRP 318 N -0.03 3.25 -0.42 5.22 0.52 -1.26 -1.51 118.94 124.71 1ovm s TRP 318 Ca 0.12 0.20 0.03 0.00 0.02 0.00 0.00 56.10 56.47 1ovm s TRP 318 Cb -0.12 -1.74 0.12 0.00 -1.15 0.00 0.00 33.47 30.58 1ovm s TRP 318 CO 0.01 0.53 0.15 -0.06 0.02 0.00 0.00 176.95 177.61 1ovm s PHE 319 N -1.13 3.13 0.37 -1.98 0.40 0.14 -4.99 117.98 113.91 1ovm s PHE 319 Ca 0.21 -2.87 -0.21 0.00 -0.60 0.00 0.00 56.93 53.45 1ovm s PHE 319 Cb -0.12 -2.64 -0.10 0.00 0.51 0.00 0.00 43.02 40.67 1ovm s PHE 319 CO 0.11 -0.85 0.89 0.95 0.70 0.00 0.00 175.22 177.03 1ovm s THR 320 N 0.47 4.41 0.00 0.64 -4.23 -1.26 -1.94 115.64 113.73 1ovm s THR 320 Ca 0.14 1.46 0.00 0.00 -1.18 0.00 0.00 61.69 62.11 1ovm s THR 320 Cb -0.22 -3.72 0.00 0.00 1.34 0.00 0.00 72.50 69.90 1ovm s THR 320 CO -0.06 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.49 1ovm n GLY 321 N -0.18 1.10 3.05 3.99 0.00 0.03 -4.98 105.19 108.20 1ovm n GLY 321 Ca 0.04 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.34 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 1.84 0.27 -0.61 1.01 -0.40 -4.16 121.20 117.16 1ovm s ILE 322 Ca 0.00 -1.04 -0.30 0.00 0.00 0.00 0.00 60.65 59.31 1ovm s ILE 322 Cb 0.00 -1.82 -0.11 0.00 0.01 0.00 0.00 42.46 40.54 1ovm s ILE 322 CO 0.00 0.29 1.57 -2.84 0.00 0.00 0.00 174.94 173.96 1ovm s PRO 323 N 1.33 4.16 0.26 2.79 0.02 -1.26 -2.91 135.00 139.39 1ovm s PRO 323 Ca 0.00 2.51 -0.05 0.00 0.02 0.00 0.00 61.00 63.49 1ovm s PRO 323 Cb -0.15 -3.05 0.51 0.00 0.02 0.00 0.00 34.50 31.83 1ovm s PRO 323 CO -0.09 -0.60 1.62 1.98 -0.33 0.00 0.00 177.00 179.58 1ovm h MET 324 N 5.13 0.09 -0.89 5.54 1.85 -1.26 -0.58 114.93 124.81 1ovm h MET 324 Ca -0.46 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 58.62 1ovm h MET 324 Cb 1.22 -0.02 -0.04 0.00 0.43 0.00 0.00 31.60 33.18 1ovm h MET 324 CO 0.81 0.06 0.57 -2.95 -0.40 0.00 0.00 176.91 174.99 1ovm h ASN 325 N 0.09 1.04 -0.06 1.39 -1.07 -1.90 -1.35 115.58 113.72 1ovm h ASN 325 Ca 0.46 -0.04 -0.13 0.00 0.07 0.00 0.00 56.30 56.65 1ovm h ASN 325 Cb 0.84 -0.26 -0.01 0.00 -2.07 0.00 0.00 38.32 36.82 1ovm h ASN 325 CO -0.73 0.77 -0.38 1.56 0.07 0.00 0.00 177.43 178.73 1ovm h GLN 326 N 1.21 0.57 -0.62 4.14 4.20 -1.51 -1.56 115.11 121.54 1ovm h GLN 326 Ca 0.32 -0.28 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 1ovm h GLN 326 Cb -0.10 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 1ovm h GLN 326 CO -0.07 0.86 0.12 0.00 -0.67 0.00 0.00 178.83 179.08 1ovm h ALA 327 N 1.11 0.82 -0.57 3.87 0.00 -0.90 -0.75 119.26 122.83 1ovm h ALA 327 Ca 0.05 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 1ovm h ALA 327 Cb 0.87 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1ovm h ALA 327 CO 0.07 0.56 0.02 0.82 0.00 0.00 0.00 179.25 180.72 1ovm h ILE 328 N 0.92 1.26 -0.34 0.00 2.04 -1.11 -1.51 117.51 118.77 1ovm h ILE 328 Ca 0.19 -1.10 0.03 0.00 1.00 0.00 0.00 64.86 64.98 1ovm h ILE 328 Cb 0.40 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1ovm h ILE 328 CO 0.01 0.40 0.14 -0.08 0.00 0.00 0.00 178.15 178.62 1ovm h GLU 329 N 0.88 0.29 -0.64 2.37 4.57 -0.91 -0.51 114.58 120.64 1ovm h GLU 329 Ca 0.16 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 1ovm h GLU 329 Cb 0.52 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.02 1ovm h GLU 329 CO 0.03 0.19 0.40 1.15 -1.18 0.00 0.00 179.01 179.60 1ovm h THR 330 N 0.30 1.18 -0.65 0.32 2.02 -0.91 -2.35 112.91 112.82 1ovm h THR 330 Ca 0.15 -0.36 -0.04 0.00 0.77 0.00 0.00 66.41 66.93 1ovm h THR 330 Cb 0.10 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 66.75 1ovm h THR 330 CO -0.14 0.18 0.23 -0.07 0.37 0.00 0.00 175.52 176.09 1ovm h LEU 331 N 0.87 0.90 -0.38 2.58 4.07 -0.74 -2.16 115.31 120.44 1ovm h LEU 331 Ca 0.23 -0.14 -0.04 0.00 0.08 0.00 0.00 57.88 58.02 1ovm h LEU 331 Cb -0.06 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.43 1ovm h LEU 331 CO -0.05 0.82 0.09 0.58 -1.08 0.00 0.00 178.44 178.81 1ovm h VAL 332 N 0.95 1.23 -0.46 1.22 2.07 -0.69 -0.55 116.25 120.01 1ovm h VAL 332 Ca 0.22 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 66.97 1ovm h VAL 332 Cb 0.23 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 1ovm h VAL 332 CO -0.01 0.27 0.30 -0.33 0.02 0.00 0.00 177.57 177.81 1ovm h GLU 333 N 0.46 0.58 -0.24 1.57 5.08 -1.20 -2.66 114.58 118.17 1ovm h GLU 333 Ca 0.12 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.35 1ovm h GLU 333 Cb 0.31 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1ovm h GLU 333 CO 0.00 0.39 -0.24 -0.07 -1.00 0.00 0.00 179.01 178.09 1ovm h LEU 334 N 0.60 0.45 -0.78 1.33 3.38 -1.24 -3.11 115.31 115.94 1ovm h LEU 334 Ca 0.17 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1ovm h LEU 334 Cb -0.05 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1ovm h LEU 334 CO -0.05 0.69 0.16 0.00 0.09 0.00 0.00 178.44 179.33 1ovm h LYS 336 N 1.03 0.00 -0.00 0.00 1.57 -1.42 -1.05 116.57 116.70 1ovm h LYS 336 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1ovm h LYS 336 Cb 0.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1ovm h LYS 336 CO 0.00 0.03 -0.11 1.04 -0.57 0.00 0.00 179.45 179.84 1ovm n GLN 337 N -3.27 0.30 -3.52 3.15 6.02 -0.84 -4.35 117.38 114.87 1ovm n GLN 337 Ca -0.02 -0.07 -0.27 0.00 -0.01 0.00 0.00 57.00 56.63 1ovm n GLN 337 Cb 0.17 -1.50 -0.10 0.00 1.02 0.00 0.00 30.24 29.83 1ovm n GLN 337 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1ovm n HIS 338 N -1.29 0.65 -2.79 1.08 8.25 -0.40 -5.10 115.22 115.63 1ovm n HIS 338 Ca 0.10 -3.68 -0.41 0.00 -0.26 0.00 0.00 57.72 53.47 1ovm n HIS 338 Cb 0.30 -0.11 -0.04 0.00 1.12 0.00 0.00 29.99 31.25 1ovm n HIS 338 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1ovm s VAL 339 N -0.69 4.58 -0.30 1.59 -7.23 -1.26 -4.95 120.40 112.14 1ovm s VAL 339 Ca 0.31 1.96 0.01 0.00 -1.81 0.00 0.00 61.98 62.45 1ovm s VAL 339 Cb 0.04 -4.27 0.14 0.00 0.56 0.00 0.00 36.38 32.85 1ovm s VAL 339 CO -0.17 0.32 0.33 -1.00 -0.31 0.00 0.00 175.10 174.27 1ovm s HIS 340 N 0.04 -0.53 0.00 2.82 3.76 -1.26 -5.18 115.29 114.95 1ovm s HIS 340 Ca 0.45 -0.20 0.00 0.00 -0.15 0.00 0.00 55.06 55.16 1ovm s HIS 340 Cb -0.22 -0.40 0.00 0.00 1.11 0.00 0.00 32.58 33.06 1ovm s HIS 340 CO 0.28 -0.94 0.00 0.00 -0.85 0.00 0.00 174.74 173.23 1ovm n ALA 341 N 5.14 -1.98 0.00 -1.40 0.00 -1.26 -5.00 120.51 116.01 1ovm n ALA 341 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1ovm n ALA 341 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 1ovm n ALA 341 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1ovm n PRO 356 N 0.00 0.00 -2.42 0.00 -0.02 -1.26 -5.06 135.00 126.23 1ovm n PRO 356 Ca 0.00 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.43 1ovm n PRO 356 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 33.49 1ovm n PRO 356 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1ovm n ASP 357 N 0.00 -1.02 0.00 2.55 5.75 -1.26 -4.67 116.55 117.90 1ovm n ASP 357 Ca 0.00 -1.80 0.00 0.00 -0.01 0.00 0.00 54.79 52.98 1ovm n ASP 357 Cb 0.00 1.73 0.00 0.00 -1.03 0.00 0.00 41.12 41.82 1ovm n ASP 357 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ovm n GLY 358 N -0.26 -1.80 3.72 6.12 0.00 -1.26 -4.78 105.19 106.94 1ovm n GLY 358 Ca -0.03 -1.86 -0.43 0.00 0.00 0.00 0.00 46.02 43.70 1ovm n GLY 358 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ovm n SER 359 N 0.17 3.37 -4.77 1.61 2.88 -1.26 -0.75 113.62 114.87 1ovm n SER 359 Ca 0.00 1.17 -0.39 0.00 -1.33 0.00 0.00 58.87 58.32 1ovm n SER 359 Cb 0.00 -1.53 -0.01 0.00 -0.75 0.00 0.00 64.21 61.91 1ovm n SER 359 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1ovm s LEU 360 N -0.65 4.24 0.11 2.46 1.43 0.01 -4.71 118.68 121.58 1ovm s LEU 360 Ca 0.62 2.55 -0.10 0.00 -1.03 0.00 0.00 54.13 56.16 1ovm s LEU 360 Cb -0.55 -3.90 0.00 0.00 0.03 0.00 0.00 46.19 41.77 1ovm s LEU 360 CO 0.53 -0.74 0.25 0.42 0.23 0.00 0.00 176.35 177.05 1ovm s THR 361 N -1.29 0.11 0.28 5.49 -4.23 -1.26 -4.62 115.64 110.12 1ovm s THR 361 Ca 0.56 -1.13 0.01 0.00 -1.18 0.00 0.00 61.69 59.95 1ovm s THR 361 Cb -0.36 -1.43 0.27 0.00 1.34 0.00 0.00 72.50 72.32 1ovm s THR 361 CO 0.46 -0.51 1.81 1.56 -0.54 0.00 0.00 174.62 177.39 1ovm h GLN 362 N 2.63 0.83 0.07 3.99 1.08 -1.93 0.53 115.11 122.32 1ovm h GLN 362 Ca -0.33 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 56.82 1ovm h GLN 362 Cb 1.22 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 28.45 1ovm h GLN 362 CO 0.53 0.55 -0.16 1.49 -0.95 0.00 0.00 178.83 180.28 1ovm h GLU 363 N 0.86 -0.25 0.00 1.46 4.57 -1.96 -2.17 114.58 117.09 1ovm h GLU 363 Ca 0.50 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.70 1ovm h GLU 363 Cb 0.59 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.24 1ovm h GLU 363 CO -0.31 -0.17 0.00 -2.95 -1.18 0.00 0.00 179.01 174.41 1ovm h ASN 364 N -0.26 0.00 0.12 1.04 7.08 -1.88 -2.82 115.58 118.86 1ovm h ASN 364 Ca -0.01 0.00 -0.01 0.00 -3.08 0.00 0.00 56.30 53.21 1ovm h ASN 364 Cb 0.25 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.49 1ovm h ASN 364 CO -0.07 0.00 -0.06 0.15 -2.08 0.00 0.00 177.43 175.38 1ovm h PHE 365 N 0.00 -0.14 -0.02 4.14 3.57 -0.69 -1.81 116.94 121.98 1ovm h PHE 365 Ca 0.00 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.42 1ovm h PHE 365 Cb 0.49 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 1ovm h PHE 365 CO 0.00 0.25 -0.33 -1.49 -2.23 0.00 0.00 178.31 174.51 1ovm h TRP 366 N -0.58 0.05 -0.53 0.41 4.06 -1.37 -0.94 115.95 117.04 1ovm h TRP 366 Ca -0.02 -0.01 -0.09 0.00 2.06 0.00 0.00 58.89 60.84 1ovm h TRP 366 Cb 0.46 -0.01 -0.02 0.00 -1.00 0.00 0.00 29.16 28.59 1ovm h TRP 366 CO 0.06 0.38 -0.01 -0.09 -3.56 0.00 0.00 178.44 175.21 1ovm h ARG 367 N 0.04 0.95 -0.09 0.49 9.65 -1.47 -1.72 114.38 122.23 1ovm h ARG 367 Ca 0.00 -0.31 -0.01 0.00 -1.10 0.00 0.00 59.98 58.57 1ovm h ARG 367 Cb 0.61 -0.08 -0.00 0.00 -1.39 0.00 0.00 29.97 29.10 1ovm h ARG 367 CO 0.04 0.97 0.02 1.15 2.80 0.00 0.00 179.97 184.95 1ovm h THR 368 N 0.82 1.20 -0.40 0.20 2.02 -0.83 -2.72 112.91 113.21 1ovm h THR 368 Ca 0.15 -0.62 0.07 0.00 0.77 0.00 0.00 66.41 66.79 1ovm h THR 368 Cb 0.55 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 68.38 1ovm h THR 368 CO 0.03 0.18 0.27 0.25 0.37 0.00 0.00 175.52 176.62 1ovm h LEU 369 N -0.08 0.19 -0.87 2.58 5.85 -1.06 -1.97 115.31 119.95 1ovm h LEU 369 Ca 0.03 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.79 1ovm h LEU 369 Cb 0.26 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.19 1ovm h LEU 369 CO 0.00 0.12 0.56 -0.61 -0.34 0.00 0.00 178.44 178.17 1ovm h GLN 370 N 0.22 1.03 0.00 1.25 5.75 -0.98 -1.24 115.11 121.14 1ovm h GLN 370 Ca 0.18 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.62 1ovm h GLN 370 Cb 0.43 -0.23 0.00 0.00 1.07 0.00 0.00 27.48 28.75 1ovm h GLN 370 CO -0.03 0.68 0.00 0.25 -2.65 0.00 0.00 178.83 177.08 1ovm n THR 371 N -4.56 0.23 -0.04 2.39 -2.24 -0.75 -3.81 114.28 105.50 1ovm n THR 371 Ca 0.12 0.06 -0.18 0.00 -2.27 0.00 0.00 64.05 61.78 1ovm n THR 371 Cb 0.12 -0.63 -0.14 0.00 -2.10 0.00 0.00 70.33 67.59 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 -1.40 0.86 -1.89 4.78 7.35 -0.50 -4.97 117.46 121.69 1ovm n PHE 372 Ca 0.09 0.21 -0.40 0.00 -0.76 0.00 0.00 57.45 56.59 1ovm n PHE 372 Cb 0.25 -1.12 0.01 0.00 0.35 0.00 0.00 39.48 38.97 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 2.26 0.09 -2.13 -4.36 -1.03 -5.03 121.20 108.44 1ovm s ILE 373 Ca -0.21 0.24 0.02 0.00 -0.26 0.00 0.00 60.65 60.44 1ovm s ILE 373 Cb 0.07 -3.14 -0.04 0.00 1.25 0.00 0.00 42.46 40.60 1ovm s ILE 373 CO 0.75 0.04 -0.07 -0.60 0.24 0.00 0.00 174.94 175.30 1ovm s ARG 374 N -2.30 0.77 0.58 0.37 6.06 -1.26 -4.94 118.95 118.22 1ovm s ARG 374 Ca 0.58 -1.21 -0.19 0.00 -2.50 0.00 0.00 55.73 52.41 1ovm s ARG 374 Cb -0.42 -0.23 -0.06 0.00 0.06 0.00 0.00 34.95 34.29 1ovm s ARG 374 CO 0.55 -0.00 0.90 -2.30 -2.50 0.00 0.00 175.30 171.95 1ovm n PRO 375 N 0.29 0.88 -0.65 5.12 -0.02 -1.26 -2.34 135.00 137.02 1ovm n PRO 375 Ca -0.15 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 1ovm n PRO 375 Cb 0.59 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 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 1.36 1.16 3.79 -1.23 0.00 0.68 -4.98 105.19 105.96 1ovm n GLY 376 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 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 -3.10 4.95 -0.27 1.61 1.01 -0.99 -4.26 116.67 115.62 1ovm s ASP 377 Ca 0.00 1.76 0.00 0.00 0.71 0.00 0.00 52.55 55.02 1ovm s ASP 377 Cb 0.00 -2.51 0.08 0.00 1.01 0.00 0.00 42.92 41.49 1ovm s ASP 377 CO 0.00 -1.74 0.02 -0.63 0.21 0.00 0.00 175.17 173.04 1ovm s ILE 378 N -2.89 1.29 -0.15 0.77 1.01 -0.41 -0.70 121.20 120.12 1ovm s ILE 378 Ca 0.61 -1.36 -0.03 0.00 0.00 0.00 0.00 60.65 59.87 1ovm s ILE 378 Cb -0.16 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 1ovm s ILE 378 CO 0.53 -0.38 -0.05 -0.63 0.00 0.00 0.00 174.94 174.42 1ovm s ILE 379 N 1.46 3.83 -0.06 2.92 1.01 -0.06 -0.39 121.20 129.91 1ovm s ILE 379 Ca 0.02 -0.38 0.05 0.00 0.00 0.00 0.00 60.65 60.33 1ovm s ILE 379 Cb -0.18 -2.67 -0.00 0.00 0.01 0.00 0.00 42.46 39.62 1ovm s ILE 379 CO -0.13 0.50 -0.19 -0.76 0.00 0.00 0.00 174.94 174.36 1ovm s LEU 380 N 0.27 1.95 -0.04 2.97 1.02 -0.11 0.33 118.68 125.07 1ovm s LEU 380 Ca -0.04 -0.41 0.01 0.00 0.02 0.00 0.00 54.13 53.72 1ovm s LEU 380 Cb -0.14 -1.11 0.02 0.00 0.02 0.00 0.00 46.19 44.98 1ovm s LEU 380 CO 0.03 0.17 -0.06 0.00 0.02 0.00 0.00 176.35 176.51 1ovm s ALA 381 N 0.08 0.76 0.70 4.21 0.00 -0.99 0.21 121.76 126.73 1ovm s ALA 381 Ca -0.07 -0.13 -0.06 0.00 0.00 0.00 0.00 51.96 51.70 1ovm s ALA 381 Cb -0.13 -0.42 0.06 0.00 0.00 0.00 0.00 23.12 22.63 1ovm s ALA 381 CO 0.04 0.03 1.01 0.34 0.00 0.00 0.00 175.76 177.18 1ovm s ASP 382 N 0.77 4.81 0.47 0.00 -1.08 -0.70 -4.52 116.67 116.41 1ovm s ASP 382 Ca -0.11 0.43 -0.24 0.00 -0.52 0.00 0.00 52.55 52.10 1ovm s ASP 382 Cb -0.14 -1.07 -0.08 0.00 -1.46 0.00 0.00 42.92 40.17 1ovm s ASP 382 CO 0.01 -1.60 1.42 1.67 0.52 0.00 0.00 175.17 177.19 1ovm n GLN 383 N -2.91 2.12 0.00 4.34 -0.06 -1.26 -1.12 117.38 118.49 1ovm n GLN 383 Ca 0.08 0.76 0.00 0.00 -2.00 0.00 0.00 57.00 55.84 1ovm n GLN 383 Cb 0.60 -2.62 0.00 0.00 -4.06 0.00 0.00 30.24 24.17 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 0.62 0.11 0.30 1.69 0.00 -1.26 -4.63 105.19 102.02 1ovm n GLY 384 Ca 0.06 -2.11 0.09 0.00 0.00 0.00 0.00 46.02 44.07 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 0.97 0.72 2.61 1.35 -1.96 -2.49 112.91 114.11 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 0.00 175.52 175.09 1ovm h SER 386 N 0.15 -1.26 -0.47 5.36 0.02 -1.82 -0.86 113.55 114.67 1ovm h SER 386 Ca 0.10 0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 61.08 1ovm h SER 386 Cb 0.20 0.38 -0.02 0.00 0.14 0.00 0.00 62.40 63.10 1ovm h SER 386 CO -0.01 -0.73 0.12 0.00 -1.14 0.00 0.00 176.83 175.07 1ovm h ALA 387 N -1.05 0.62 -0.06 3.77 0.00 -0.95 -0.33 119.26 121.26 1ovm h ALA 387 Ca -0.09 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1ovm h ALA 387 Cb 0.94 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1ovm h ALA 387 CO 0.07 0.30 0.00 1.19 0.00 0.00 0.00 179.25 180.80 1ovm n PHE 388 N -4.50 0.08 -0.09 0.00 3.72 -0.95 -2.23 117.46 113.49 1ovm n PHE 388 Ca 0.01 -0.04 -0.16 0.00 -0.05 0.00 0.00 57.45 57.21 1ovm n PHE 388 Cb 0.21 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.68 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 0.84 -0.27 0.29 1.37 0.00 -0.33 -4.44 105.19 102.65 1ovm n GLY 389 Ca 0.12 -0.10 0.19 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.34 1.00 0.00 4.61 0.00 -1.01 -2.49 119.26 121.03 1ovm h ALA 390 Ca -0.43 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1ovm h ALA 390 Cb 1.51 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.30 1ovm h ALA 390 CO -0.18 0.00 -0.01 0.97 0.00 0.00 0.00 179.25 180.03 1ovm h ILE 391 N 0.00 0.09 -0.01 0.00 2.10 -1.66 -1.63 117.51 116.40 1ovm h ILE 391 Ca 0.00 -0.16 0.00 0.00 1.08 0.00 0.00 64.86 65.78 1ovm h ILE 391 Cb 0.16 1.14 0.00 0.00 -1.09 0.00 0.00 36.82 37.03 1ovm h ILE 391 CO 0.00 0.01 -0.25 0.47 -1.08 0.00 0.00 178.15 177.30 1ovm n ASP 392 N -3.19 1.34 -4.75 2.19 8.00 -0.94 -4.64 116.55 114.56 1ovm n ASP 392 Ca -0.02 -1.13 -0.41 0.00 0.71 0.00 0.00 54.79 53.94 1ovm n ASP 392 Cb 0.14 0.17 -0.02 0.00 -0.02 0.00 0.00 41.12 41.39 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 -2.41 4.36 -0.56 0.64 1.43 -0.62 -4.93 118.68 116.60 1ovm s LEU 393 Ca 0.25 2.86 -0.18 0.00 -1.03 0.00 0.00 54.13 56.03 1ovm s LEU 393 Cb 0.19 -3.63 0.10 0.00 0.03 0.00 0.00 46.19 42.88 1ovm s LEU 393 CO 0.49 -0.84 0.64 -0.60 0.23 0.00 0.00 176.35 176.27 1ovm s ARG 394 N -0.51 3.04 0.18 1.70 3.52 -1.26 -5.00 118.95 120.63 1ovm s ARG 394 Ca 0.62 -1.32 -0.30 0.00 -0.13 0.00 0.00 55.73 54.59 1ovm s ARG 394 Cb -0.46 -4.24 -0.08 0.00 -1.56 0.00 0.00 34.95 28.62 1ovm s ARG 394 CO 0.47 -1.42 1.09 -0.51 -0.81 0.00 0.00 175.30 174.12 1ovm s LEU 395 N 2.42 4.50 0.00 -0.88 1.02 -1.26 -4.92 118.68 119.56 1ovm s LEU 395 Ca 0.10 2.09 0.00 0.00 0.02 0.00 0.00 54.13 56.34 1ovm s LEU 395 Cb -0.24 -3.60 0.00 0.00 0.02 0.00 0.00 46.19 42.36 1ovm s LEU 395 CO 0.07 -0.20 0.00 -2.65 0.02 0.00 0.00 176.35 173.58 1ovm n PRO 396 N 2.30 0.11 -2.10 1.29 -0.02 -1.26 -1.42 135.00 133.90 1ovm n PRO 396 Ca 0.02 0.00 -0.28 0.00 -2.02 0.00 0.00 63.50 61.22 1ovm n PRO 396 Cb 0.46 0.00 0.05 0.00 -0.02 0.00 0.00 33.50 33.99 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 -3.60 3.04 -1.49 3.55 0.00 -1.26 -4.37 121.76 117.63 1ovm s ALA 397 Ca 0.00 -0.57 -0.01 0.00 0.00 0.00 0.00 51.96 51.38 1ovm s ALA 397 Cb 0.00 -2.82 0.01 0.00 0.00 0.00 0.00 23.12 20.31 1ovm s ALA 397 CO 0.00 -1.10 0.24 -0.25 0.00 0.00 0.00 175.76 174.64 1ovm n ASP 398 N -2.89 0.17 -4.23 0.00 8.00 -1.26 -3.28 116.55 113.07 1ovm n ASP 398 Ca 0.06 -1.14 -0.31 0.00 0.71 0.00 0.00 54.79 54.12 1ovm n ASP 398 Cb 0.58 -2.34 -0.17 0.00 -0.02 0.00 0.00 41.12 39.18 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 -4.13 1.95 -0.41 2.53 0.11 -1.26 -0.23 120.40 118.95 1ovm s VAL 399 Ca 0.04 -0.99 -0.17 0.00 -2.93 0.00 0.00 61.98 57.93 1ovm s VAL 399 Cb -0.02 -1.66 0.02 0.00 -1.53 0.00 0.00 36.38 33.19 1ovm s VAL 399 CO 0.94 0.54 0.40 0.21 -3.33 0.00 0.00 175.10 173.86 1ovm s ASN 400 N 0.02 6.17 -0.36 3.54 3.04 0.12 -4.77 114.94 122.69 1ovm s ASN 400 Ca -0.08 -0.72 -0.15 0.00 0.04 0.00 0.00 52.86 51.95 1ovm s ASN 400 Cb -0.15 -2.21 -0.00 0.00 -1.54 0.00 0.00 41.25 37.36 1ovm s ASN 400 CO 0.05 -0.54 0.32 0.12 -3.04 0.00 0.00 177.10 174.02 1ovm s PHE 401 N 2.01 3.22 -0.30 0.43 5.36 -1.26 -0.88 117.98 126.55 1ovm s PHE 401 Ca 0.10 -0.23 -0.07 0.00 -0.96 0.00 0.00 56.93 55.78 1ovm s PHE 401 Cb -0.18 -2.63 0.01 0.00 -0.34 0.00 0.00 43.02 39.89 1ovm s PHE 401 CO 0.13 -0.47 0.08 0.42 -1.46 0.00 0.00 175.22 173.91 1ovm s ILE 402 N 1.89 3.95 0.05 3.12 1.01 0.15 -4.85 121.20 126.51 1ovm s ILE 402 Ca 0.09 -0.73 -0.00 0.00 0.00 0.00 0.00 60.65 60.00 1ovm s ILE 402 Cb -0.17 -3.05 -0.03 0.00 0.01 0.00 0.00 42.46 39.21 1ovm s ILE 402 CO 0.11 0.06 -0.04 0.54 0.00 0.00 0.00 174.94 175.61 1ovm s VAL 403 N 1.49 0.27 -0.48 2.92 0.11 -1.26 -2.34 120.40 121.11 1ovm s VAL 403 Ca 0.02 -1.56 0.07 0.00 -2.93 0.00 0.00 61.98 57.58 1ovm s VAL 403 Cb -0.17 -1.18 0.23 0.00 -1.53 0.00 0.00 36.38 33.73 1ovm s VAL 403 CO 0.02 -0.82 0.55 1.67 -3.33 0.00 0.00 175.10 173.19 1ovm n GLN 404 N 0.54 1.20 0.10 1.54 7.27 -1.26 -4.95 117.38 121.82 1ovm n GLN 404 Ca -0.17 -3.70 -0.04 0.00 0.07 0.00 0.00 57.00 53.17 1ovm n GLN 404 Cb 0.59 -1.64 0.14 0.00 2.41 0.00 0.00 30.24 31.74 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 4.41 0.17 0.09 3.69 0.11 -1.96 -1.01 132.00 137.50 1ovm h PRO 405 Ca 0.14 -0.11 -0.00 0.00 0.11 0.00 0.00 66.00 66.13 1ovm h PRO 405 Cb 0.82 0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1ovm h PRO 405 CO 0.57 0.72 -0.04 1.25 -0.21 0.00 0.00 178.00 180.28 1ovm h LEU 406 N 0.13 -0.10 -0.02 2.35 5.85 -1.96 -3.36 115.31 118.20 1ovm h LEU 406 Ca -0.01 -0.40 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 1ovm h LEU 406 Cb 1.09 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.14 1ovm h LEU 406 CO 0.09 0.55 -0.03 -0.25 -0.34 0.00 0.00 178.44 178.46 1ovm h TRP 407 N -0.95 0.07 -5.01 1.25 -0.00 -1.90 -3.48 115.95 105.92 1ovm h TRP 407 Ca -0.01 -0.02 -0.31 0.00 -0.00 0.00 0.00 58.89 58.54 1ovm h TRP 407 Cb 0.50 -0.01 0.12 0.00 -0.00 0.00 0.00 29.16 29.77 1ovm h TRP 407 CO 0.11 0.61 -0.58 0.41 -0.00 0.00 0.00 178.44 178.98 1ovm n GLY 408 N 0.43 -0.27 3.58 2.65 0.00 -0.38 -5.00 105.19 106.20 1ovm n GLY 408 Ca -0.08 0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.52 6.47 0.40 1.61 0.15 -1.26 -4.94 113.70 112.60 1ovm s SER 409 Ca 0.34 0.22 -0.26 0.00 0.70 0.00 0.00 55.95 56.96 1ovm s SER 409 Cb -0.15 -2.35 -0.09 0.00 -1.71 0.00 0.00 66.02 61.73 1ovm s SER 409 CO 0.60 -0.63 1.21 0.27 1.20 0.00 0.00 173.24 175.90 1ovm s ILE 410 N 2.81 2.98 0.00 6.45 -4.36 -1.26 -2.74 121.20 125.09 1ovm s ILE 410 Ca 0.26 0.85 0.00 0.00 -0.26 0.00 0.00 60.65 61.50 1ovm s ILE 410 Cb -0.14 -3.49 0.00 0.00 1.25 0.00 0.00 42.46 40.08 1ovm s ILE 410 CO 0.15 0.10 0.00 0.61 0.24 0.00 0.00 174.94 176.04 1ovm n GLY 411 N 0.67 2.58 0.22 6.27 0.00 -1.24 -4.93 105.19 108.77 1ovm n GLY 411 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.38 -0.72 1.61 3.20 -1.83 -3.09 116.97 115.76 1ovm h TYR 412 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1ovm h TYR 412 Cb 0.00 0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.47 1ovm h TYR 412 CO 0.00 -0.24 0.47 1.79 -1.64 0.00 0.00 178.16 178.53 1ovm h THR 413 N -0.07 1.19 -0.38 1.81 1.35 -1.91 0.15 112.91 115.05 1ovm h THR 413 Ca 0.20 -0.36 -0.01 0.00 -0.55 0.00 0.00 66.41 65.70 1ovm h THR 413 Cb 0.38 0.14 -0.02 0.00 -1.73 0.00 0.00 68.15 66.93 1ovm h THR 413 CO -0.47 0.18 0.20 0.25 -0.25 0.00 0.00 175.52 175.44 1ovm h LEU 414 N 0.97 0.48 -0.32 3.87 5.85 -1.93 0.58 115.31 124.82 1ovm h LEU 414 Ca 0.26 -0.10 -0.20 0.00 0.84 0.00 0.00 57.88 58.68 1ovm h LEU 414 Cb -0.10 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 40.81 1ovm h LEU 414 CO -0.06 0.45 -0.75 0.00 -0.34 0.00 0.00 178.44 177.74 1ovm h ALA 415 N 1.06 0.50 -0.83 1.25 0.00 -1.56 -2.96 119.26 116.71 1ovm h ALA 415 Ca 0.13 -0.61 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1ovm h ALA 415 Cb 0.08 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1ovm h ALA 415 CO -0.02 0.74 0.46 0.00 0.00 0.00 0.00 179.25 180.43 1ovm h ALA 416 N 0.81 1.25 -0.86 0.00 0.00 -0.49 -2.26 119.26 117.71 1ovm h ALA 416 Ca -0.04 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.79 1ovm h ALA 416 Cb 1.35 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 1ovm h ALA 416 CO 0.14 0.61 0.55 0.00 0.00 0.00 0.00 179.25 180.55 1ovm h ALA 417 N 1.35 1.15 -0.57 0.00 0.00 -0.72 0.59 119.26 121.06 1ovm h ALA 417 Ca 0.29 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.21 1ovm h ALA 417 Cb 0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 1ovm h ALA 417 CO -0.05 0.36 0.33 0.35 0.00 0.00 0.00 179.25 180.25 1ovm h PHE 418 N 1.05 0.62 -0.69 0.00 3.57 -1.31 0.56 116.94 120.75 1ovm h PHE 418 Ca 0.35 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.83 1ovm h PHE 418 Cb 0.05 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.57 1ovm h PHE 418 CO -0.02 0.34 0.27 0.78 -2.23 0.00 0.00 178.31 177.44 1ovm h GLY 419 N 0.65 1.10 0.93 2.40 0.00 -0.79 -1.37 103.07 105.99 1ovm h GLY 419 Ca 0.24 -0.61 -0.03 0.00 0.00 0.00 0.00 47.33 46.94 1ovm h GLY 419 CO -0.12 0.57 0.12 0.00 0.00 0.00 0.00 176.54 177.11 1ovm h ALA 420 N 1.12 0.47 -0.75 3.60 0.00 -0.25 -1.85 119.26 121.60 1ovm h ALA 420 Ca 0.23 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ovm h ALA 420 Cb 0.22 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1ovm h ALA 420 CO -0.02 0.10 0.48 1.96 0.00 0.00 0.00 179.25 181.77 1ovm h GLN 421 N 0.43 1.00 -0.93 0.00 1.08 -0.74 0.14 115.11 116.09 1ovm h GLN 421 Ca 0.12 -0.07 0.06 0.00 -1.45 0.00 0.00 58.65 57.31 1ovm h GLN 421 Cb 0.23 -0.22 -0.06 0.00 -0.05 0.00 0.00 27.48 27.38 1ovm h GLN 421 CO -0.01 0.68 0.61 1.15 -0.95 0.00 0.00 178.83 180.31 1ovm h THR 422 N 1.02 1.09 0.00 -0.54 2.02 -0.94 -2.21 112.91 113.35 1ovm h THR 422 Ca 0.27 -0.37 -0.20 0.00 0.77 0.00 0.00 66.41 66.88 1ovm h THR 422 Cb -0.09 -0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 66.20 1ovm h THR 422 CO -0.06 0.20 -0.95 0.00 0.37 0.00 0.00 175.52 175.09 1ovm h ALA 423 N 1.49 0.44 -2.33 6.16 0.00 -0.49 -3.39 119.26 121.14 1ovm h ALA 423 Ca 0.40 -0.85 -0.59 0.00 0.00 0.00 0.00 54.91 53.86 1ovm h ALA 423 Cb 0.16 -0.15 -0.40 0.00 0.00 0.00 0.00 17.79 17.40 1ovm h ALA 423 CO -0.15 1.17 -0.82 0.00 0.00 0.00 0.00 179.25 179.45 1ovm h PRO 425 N 4.63 0.35 -0.62 0.00 0.11 -1.62 -2.34 132.00 132.51 1ovm h PRO 425 Ca 0.16 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1ovm h PRO 425 Cb 0.79 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.82 1ovm h PRO 425 CO 0.61 0.23 0.00 0.09 -0.21 0.00 0.00 178.00 178.72 1ovm n ASN 426 N -4.46 5.30 -4.47 -2.05 3.02 -1.26 -4.93 115.26 106.41 1ovm n ASN 426 Ca 0.14 -2.79 -0.30 0.00 -0.03 0.00 0.00 54.58 51.60 1ovm n ASN 426 Cb 0.54 -0.66 -0.12 0.00 -0.61 0.00 0.00 39.78 38.93 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 -2.51 1.87 -0.19 3.52 0.52 -0.88 -5.09 118.95 116.19 1ovm s ARG 427 Ca 0.51 -1.12 -0.29 0.00 -0.52 0.00 0.00 55.73 54.31 1ovm s ARG 427 Cb 0.38 -2.13 -0.00 0.00 0.52 0.00 0.00 34.95 33.72 1ovm s ARG 427 CO 0.17 0.50 1.09 0.50 0.02 0.00 0.00 175.30 177.57 1ovm s ARG 428 N -1.88 4.29 -0.28 3.54 3.52 -1.26 -4.95 118.95 121.93 1ovm s ARG 428 Ca 0.17 1.44 -0.09 0.00 -0.13 0.00 0.00 55.73 57.11 1ovm s ARG 428 Cb -0.11 -3.64 -0.03 0.00 -1.56 0.00 0.00 34.95 29.61 1ovm s ARG 428 CO 0.08 -0.58 0.14 0.08 -0.81 0.00 0.00 175.30 174.21 1ovm s VAL 429 N 3.01 4.75 -0.25 7.11 1.01 -1.26 -1.29 120.40 133.48 1ovm s VAL 429 Ca 0.47 -0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.23 1ovm s VAL 429 Cb -0.17 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 1ovm s VAL 429 CO 0.10 0.21 0.09 -0.63 0.00 0.00 0.00 175.10 174.88 1ovm s ILE 430 N 1.66 4.52 -0.30 2.22 1.09 0.48 -1.23 121.20 129.65 1ovm s ILE 430 Ca 0.06 -0.10 -0.06 0.00 -1.10 0.00 0.00 60.65 59.45 1ovm s ILE 430 Cb -0.16 -3.12 0.01 0.00 -1.06 0.00 0.00 42.46 38.14 1ovm s ILE 430 CO 0.07 0.33 0.07 -0.69 -0.10 0.00 0.00 174.94 174.62 1ovm s VAL 431 N 1.54 3.82 -0.37 2.92 1.01 -0.66 -0.93 120.40 127.73 1ovm s VAL 431 Ca 0.06 -0.79 -0.10 0.00 0.00 0.00 0.00 61.98 61.16 1ovm s VAL 431 Cb -0.15 -2.99 0.03 0.00 0.00 0.00 0.00 36.38 33.27 1ovm s VAL 431 CO 0.05 0.06 0.18 -0.76 0.00 0.00 0.00 175.10 174.63 1ovm s LEU 432 N 1.47 4.64 0.04 3.92 1.43 0.13 -0.41 118.68 129.89 1ovm s LEU 432 Ca 0.02 -1.06 0.02 0.00 -1.03 0.00 0.00 54.13 52.08 1ovm s LEU 432 Cb -0.17 -1.98 -0.02 0.00 0.03 0.00 0.00 46.19 44.04 1ovm s LEU 432 CO 0.02 -0.38 -0.07 0.28 0.23 0.00 0.00 176.35 176.43 1ovm s THR 433 N 1.51 0.43 0.71 5.49 -1.32 -0.81 -1.72 115.64 119.93 1ovm s THR 433 Ca 0.01 -1.07 -0.09 0.00 -1.21 0.00 0.00 61.69 59.32 1ovm s THR 433 Cb -0.19 -0.57 0.04 0.00 -1.51 0.00 0.00 72.50 70.27 1ovm s THR 433 CO 0.06 -0.43 1.06 -0.83 -2.21 0.00 0.00 174.62 172.26 1ovm s GLY 434 N -1.61 1.63 0.23 6.08 0.00 -1.26 -1.09 107.32 111.30 1ovm s GLY 434 Ca -0.11 -0.62 0.06 0.00 0.00 0.00 0.00 44.72 44.06 1ovm s GLY 434 CO -0.00 -0.23 1.54 1.29 0.00 0.00 0.00 173.10 175.70 1ovm h ASP 435 N -0.65 0.16 -0.14 1.64 3.04 -1.77 -2.32 116.42 116.38 1ovm h ASP 435 Ca -0.45 -0.10 -0.05 0.00 -3.24 0.00 0.00 57.03 53.19 1ovm h ASP 435 Cb 1.29 -0.05 -0.00 0.00 -1.04 0.00 0.00 39.33 39.53 1ovm h ASP 435 CO 0.63 0.78 -0.10 1.23 -2.04 0.00 0.00 179.24 179.74 1ovm h GLY 436 N 1.71 0.34 0.96 7.15 0.00 -1.87 -3.24 103.07 108.12 1ovm h GLY 436 Ca -0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 1ovm h GLY 436 CO 0.10 0.29 0.18 0.00 0.00 0.00 0.00 176.54 177.10 1ovm h ALA 437 N 0.64 0.43 -0.10 3.60 0.00 -1.92 -2.95 119.26 118.96 1ovm h ALA 437 Ca 0.03 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.89 1ovm h ALA 437 Cb 0.59 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1ovm h ALA 437 CO 0.03 -0.04 0.10 0.00 0.00 0.00 0.00 179.25 179.34 1ovm h ALA 438 N 1.04 1.74 0.00 0.00 0.00 -1.49 -2.33 119.26 118.23 1ovm h ALA 438 Ca 0.12 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1ovm h ALA 438 Cb 0.08 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1ovm h ALA 438 CO -0.02 -0.15 -0.27 1.96 0.00 0.00 0.00 179.25 180.77 1ovm h GLN 439 N 0.00 0.00 0.00 0.00 4.20 -1.54 -1.12 115.11 116.65 1ovm h GLN 439 Ca 0.05 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 1ovm h GLN 439 Cb 0.25 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 1ovm h GLN 439 CO -0.00 0.27 -0.22 -0.07 -0.67 0.00 0.00 178.83 178.14 1ovm h LEU 440 N 0.00 0.00 -2.33 1.46 4.07 -1.55 -3.32 115.31 113.64 1ovm h LEU 440 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1ovm h LEU 440 Cb 0.50 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.24 1ovm h LEU 440 CO 0.04 0.22 -0.31 0.35 -1.08 0.00 0.00 178.44 177.66 1ovm n THR 441 N -3.34 0.66 -0.31 0.22 -2.24 -1.15 -4.91 114.28 103.21 1ovm n THR 441 Ca 0.00 -0.79 0.15 0.00 -2.27 0.00 0.00 64.05 61.15 1ovm n THR 441 Cb 0.45 0.26 0.33 0.00 -2.10 0.00 0.00 70.33 69.27 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 4.42 0.33 0.00 2.28 6.09 -1.30 -1.64 117.51 127.68 1ovm h ILE 442 Ca 0.00 -0.09 0.00 0.00 -1.37 0.00 0.00 64.86 63.40 1ovm h ILE 442 Cb 1.24 0.05 0.00 0.00 0.47 0.00 0.00 36.82 38.58 1ovm h ILE 442 CO 0.00 0.05 0.24 0.06 -3.07 0.00 0.00 178.15 175.43 1ovm h GLN 443 N 0.26 0.00 0.00 2.19 -0.00 -1.90 0.30 115.11 115.96 1ovm h GLN 443 Ca 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.25 1ovm h GLN 443 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.71 1ovm h GLN 443 CO -0.63 0.00 0.00 -1.91 -0.00 0.00 0.00 178.83 176.29 1ovm n GLU 444 N -2.77 0.17 0.23 0.06 4.07 -0.62 -1.53 120.64 120.26 1ovm n GLU 444 Ca -0.02 0.29 0.09 0.00 -0.06 0.00 0.00 57.16 57.46 1ovm n GLU 444 Cb 0.29 -1.77 0.57 0.00 -0.06 0.00 0.00 31.44 30.47 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 -0.88 4.31 5.85 -0.59 -0.96 115.31 123.04 1ovm h LEU 445 Ca 0.00 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 1ovm h LEU 445 Cb 0.49 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 1ovm h LEU 445 CO 0.00 0.21 -0.52 1.23 -0.34 0.00 0.00 178.44 179.02 1ovm h GLY 446 N 1.20 0.00 1.39 3.75 0.00 -1.42 -2.29 103.07 105.69 1ovm h GLY 446 Ca -0.00 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.12 1ovm h GLY 446 CO 0.03 0.00 -0.80 1.76 0.00 0.00 0.00 176.54 177.52 1ovm h SER 447 N 0.00 0.72 -0.50 0.19 0.02 -1.26 -0.65 113.55 112.07 1ovm h SER 447 Ca -0.01 -0.49 -0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1ovm h SER 447 Cb 0.98 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.28 1ovm h SER 447 CO 0.07 1.27 0.30 0.24 -1.14 0.00 0.00 176.83 177.57 1ovm h MET 448 N 0.39 0.67 0.08 3.45 2.07 -1.19 -0.84 114.93 119.56 1ovm h MET 448 Ca -0.05 -0.06 -0.00 0.00 -2.07 0.00 0.00 59.70 57.51 1ovm h MET 448 Cb 1.42 -0.14 0.00 0.00 -1.87 0.00 0.00 31.60 31.00 1ovm h MET 448 CO 0.15 0.48 -0.04 -0.07 1.07 0.00 0.00 176.91 178.51 1ovm h LEU 449 N 0.67 -0.09 -0.98 1.22 4.07 -1.33 -0.77 115.31 118.09 1ovm h LEU 449 Ca 0.18 -0.14 0.11 0.00 0.08 0.00 0.00 57.88 58.11 1ovm h LEU 449 Cb -0.02 0.02 -0.08 0.00 1.08 0.00 0.00 40.66 41.66 1ovm h LEU 449 CO -0.03 0.09 0.61 -0.09 -1.08 0.00 0.00 178.44 177.94 1ovm h ARG 450 N -0.27 0.95 -0.26 1.13 2.43 -0.86 0.56 114.38 118.06 1ovm h ARG 450 Ca -0.01 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1ovm h ARG 450 Cb 0.23 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1ovm h ARG 450 CO 0.02 0.63 0.00 -0.25 -1.51 0.00 0.00 179.97 178.86 1ovm n ASP 451 N -4.63 1.57 -3.88 -3.80 8.00 -0.34 -4.94 116.55 108.53 1ovm n ASP 451 Ca 0.18 -1.90 -0.25 0.00 0.71 0.00 0.00 54.79 53.53 1ovm n ASP 451 Cb 0.33 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.26 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 0.33 -4.03 -2.66 -1.24 5.02 0.19 -4.98 118.16 110.79 1ovm n LYS 452 Ca 0.12 0.49 -0.30 0.00 -2.02 0.00 0.00 58.31 56.60 1ovm n LYS 452 Cb 0.27 -4.87 -0.02 0.00 -0.02 0.00 0.00 35.03 30.39 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 -6.38 3.75 -0.59 1.97 -0.21 -0.40 -4.98 119.66 112.82 1ovm s GLN 453 Ca 0.10 0.53 0.05 0.00 0.02 0.00 0.00 55.36 56.06 1ovm s GLN 453 Cb -0.05 -2.32 0.32 0.00 1.00 0.00 0.00 33.01 31.96 1ovm s GLN 453 CO 0.86 -0.15 0.90 0.72 -2.12 0.00 0.00 175.29 175.50 1ovm n HIS 454 N -1.63 3.87 -1.78 0.91 8.25 -1.26 -3.69 115.22 119.88 1ovm n HIS 454 Ca 0.03 -4.03 -0.34 0.00 -0.26 0.00 0.00 57.72 53.13 1ovm n HIS 454 Cb 0.54 -0.50 0.05 0.00 1.12 0.00 0.00 29.99 31.20 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 -3.22 2.77 -0.38 -0.41 0.02 -1.26 -4.63 135.00 127.88 1ovm s PRO 455 Ca 0.47 1.51 -0.04 0.00 0.02 0.00 0.00 61.00 62.96 1ovm s PRO 455 Cb 0.25 -1.94 0.09 0.00 0.02 0.00 0.00 34.50 32.92 1ovm s PRO 455 CO -0.11 -1.29 0.16 -1.50 -0.33 0.00 0.00 177.00 173.93 1ovm s ILE 456 N -2.15 3.45 -0.23 2.83 1.10 -0.36 -1.42 121.20 124.41 1ovm s ILE 456 Ca 0.70 -1.72 -0.12 0.00 -0.51 0.00 0.00 60.65 59.00 1ovm s ILE 456 Cb -0.23 -3.20 -0.05 0.00 0.15 0.00 0.00 42.46 39.13 1ovm s ILE 456 CO 0.40 -0.49 0.22 -0.63 -2.11 0.00 0.00 174.94 172.32 1ovm s ILE 457 N 1.24 5.31 -0.21 2.00 1.01 0.17 -1.66 121.20 129.07 1ovm s ILE 457 Ca 0.04 0.31 -0.02 0.00 0.00 0.00 0.00 60.65 60.98 1ovm s ILE 457 Cb -0.22 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.69 1ovm s ILE 457 CO -0.02 0.31 -0.09 -0.76 0.00 0.00 0.00 174.94 174.38 1ovm s LEU 458 N 1.19 2.68 -0.30 2.97 1.02 0.45 -0.22 118.68 126.48 1ovm s LEU 458 Ca 0.10 -0.52 -0.10 0.00 0.02 0.00 0.00 54.13 53.63 1ovm s LEU 458 Cb -0.14 -1.65 -0.03 0.00 0.02 0.00 0.00 46.19 44.39 1ovm s LEU 458 CO 0.06 -0.02 0.17 -0.69 0.02 0.00 0.00 176.35 175.88 1ovm s VAL 459 N 1.41 4.92 -0.73 -1.59 1.01 -0.33 -1.92 120.40 123.17 1ovm s VAL 459 Ca 0.05 -0.15 -0.26 0.00 0.00 0.00 0.00 61.98 61.63 1ovm s VAL 459 Cb -0.14 -3.43 0.04 0.00 0.00 0.00 0.00 36.38 32.85 1ovm s VAL 459 CO -0.06 0.15 1.21 -0.76 0.00 0.00 0.00 175.10 175.64 1ovm s LEU 460 N 1.68 3.46 -0.66 3.92 1.43 -0.25 -0.58 118.68 127.69 1ovm s LEU 460 Ca 0.06 -0.62 -0.21 0.00 -1.03 0.00 0.00 54.13 52.33 1ovm s LEU 460 Cb -0.16 -2.53 0.09 0.00 0.03 0.00 0.00 46.19 43.62 1ovm s LEU 460 CO 0.08 -1.73 0.90 0.21 0.23 0.00 0.00 176.35 176.04 1ovm s ASN 461 N 3.77 6.22 -0.17 2.29 3.84 0.54 -2.40 114.94 129.02 1ovm s ASN 461 Ca 0.32 -1.24 0.14 0.00 0.21 0.00 0.00 52.86 52.29 1ovm s ASN 461 Cb -0.10 -2.38 0.39 0.00 -0.55 0.00 0.00 41.25 38.61 1ovm s ASN 461 CO 0.13 -1.30 1.20 -0.46 -2.79 0.00 0.00 177.10 173.88 1ovm n ASN 462 N 7.13 1.74 -3.83 -4.21 0.23 -1.26 -0.58 115.26 114.48 1ovm n ASN 462 Ca -0.03 -3.55 -0.28 0.00 -0.53 0.00 0.00 54.58 50.20 1ovm n ASN 462 Cb 0.45 -0.48 0.01 0.00 -2.08 0.00 0.00 39.78 37.67 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 -1.02 -2.67 0.00 -3.83 1.02 -1.26 -4.11 120.64 108.77 1ovm n GLU 463 Ca 0.17 0.44 0.00 0.00 -0.02 0.00 0.00 57.16 57.75 1ovm n GLU 463 Cb 0.72 -4.40 0.00 0.00 -0.02 0.00 0.00 31.44 27.74 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 -1.84 0.84 3.41 0.62 0.00 -1.26 -4.61 105.19 102.35 1ovm n GLY 464 Ca -0.23 -1.99 -0.45 0.00 0.00 0.00 0.00 46.02 43.35 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 -1.91 3.80 0.38 1.61 2.02 -0.93 -4.45 117.35 117.86 1ovm s TYR 465 Ca 0.00 -2.31 0.09 0.00 -0.37 0.00 0.00 57.07 54.48 1ovm s TYR 465 Cb 0.00 -4.11 0.75 0.00 -0.40 0.00 0.00 41.96 38.21 1ovm s TYR 465 CO 0.00 -1.21 1.91 1.79 -1.57 0.00 0.00 175.55 176.47 1ovm h THR 466 N 4.33 1.18 -0.80 -0.71 1.35 -1.87 -1.69 112.91 114.71 1ovm h THR 466 Ca 0.25 -0.79 -0.03 0.00 -0.55 0.00 0.00 66.41 65.29 1ovm h THR 466 Cb 0.89 1.18 -0.04 0.00 -1.73 0.00 0.00 68.15 68.45 1ovm h THR 466 CO 1.13 0.25 0.40 -0.37 -0.25 0.00 0.00 175.52 176.67 1ovm h VAL 467 N 0.26 1.25 -0.61 6.82 -1.51 -1.92 0.11 116.25 120.65 1ovm h VAL 467 Ca 0.05 -0.68 -0.10 0.00 -1.23 0.00 0.00 66.70 64.75 1ovm h VAL 467 Cb 0.37 0.22 -0.02 0.00 -2.13 0.00 0.00 31.29 29.74 1ovm h VAL 467 CO 0.02 0.29 0.01 -0.33 -1.23 0.00 0.00 177.57 176.33 1ovm h GLU 468 N 1.13 1.08 -0.92 5.19 4.39 -1.80 -1.44 114.58 122.20 1ovm h GLU 468 Ca 0.28 -0.34 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1ovm h GLU 468 Cb 0.10 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 28.60 1ovm h GLU 468 CO -0.04 1.05 0.59 0.00 -1.16 0.00 0.00 179.01 179.45 1ovm h ARG 469 N 0.98 1.23 0.00 2.33 3.08 -0.71 0.10 114.38 121.39 1ovm h ARG 469 Ca 0.18 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 60.08 1ovm h ARG 469 Cb 0.55 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 1ovm h ARG 469 CO 0.03 0.83 -0.29 0.00 -1.07 0.00 0.00 179.97 179.46 1ovm h ALA 470 N 1.40 1.28 0.13 0.04 0.00 -0.29 -3.14 119.26 118.69 1ovm h ALA 470 Ca 0.34 -0.27 -0.25 0.00 0.00 0.00 0.00 54.91 54.73 1ovm h ALA 470 Cb -0.12 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.63 1ovm h ALA 470 CO -0.07 0.37 -1.19 0.82 0.00 0.00 0.00 179.25 179.17 1ovm h ILE 471 N 0.00 1.23 -1.30 0.00 2.04 -0.06 -3.45 117.51 115.97 1ovm h ILE 471 Ca -0.00 -2.47 0.15 0.00 1.00 0.00 0.00 64.86 63.53 1ovm h ILE 471 Cb 0.61 2.92 -0.28 0.00 -0.74 0.00 0.00 36.82 39.32 1ovm h ILE 471 CO 0.04 0.72 0.72 -2.28 0.00 0.00 0.00 178.15 177.34 1ovm s HIS 472 N -2.47 -0.22 -0.86 1.37 5.04 0.19 -4.64 115.29 113.69 1ovm s HIS 472 Ca -0.17 0.49 -0.00 0.00 -1.54 0.00 0.00 55.06 53.84 1ovm s HIS 472 Cb 0.03 0.45 -0.01 0.00 0.04 0.00 0.00 32.58 33.09 1ovm s HIS 472 CO 0.80 -0.14 0.72 0.41 -2.34 0.00 0.00 174.74 174.19 1ovm n GLY 473 N 1.39 -0.19 0.40 1.59 0.00 -1.26 -4.33 105.19 102.78 1ovm n GLY 473 Ca -0.09 -0.02 0.19 0.00 0.00 0.00 0.00 46.02 46.10 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 0.58 2.25 -0.41 4.61 0.00 -1.86 -0.78 119.26 123.66 1ovm h ALA 474 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1ovm h ALA 474 Cb 1.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1ovm h ALA 474 CO 0.36 -0.49 0.00 0.39 0.00 0.00 0.00 179.25 179.51 1ovm n GLU 475 N -4.46 3.30 -2.85 0.00 1.02 -1.26 -4.89 120.64 111.49 1ovm n GLU 475 Ca 0.16 -2.68 -0.40 0.00 -0.02 0.00 0.00 57.16 54.22 1ovm n GLU 475 Cb 0.64 -1.75 -0.06 0.00 -0.02 0.00 0.00 31.44 30.26 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 -2.11 4.73 0.48 3.49 -1.52 -0.30 -4.96 119.66 119.47 1ovm s GLN 476 Ca 0.41 1.34 0.20 0.00 -1.95 0.00 0.00 55.36 55.36 1ovm s GLN 476 Cb 0.29 -3.26 1.22 0.00 -0.22 0.00 0.00 33.01 31.04 1ovm s GLN 476 CO 0.15 0.54 1.98 -0.09 -0.25 0.00 0.00 175.29 177.62 1ovm h ARG 477 N 4.20 0.19 0.00 2.91 2.43 -1.94 -2.12 114.38 120.06 1ovm h ARG 477 Ca -0.46 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 1ovm h ARG 477 Cb 1.20 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1ovm h ARG 477 CO 0.67 0.13 0.00 2.48 -1.51 0.00 0.00 179.97 181.74 1ovm n TYR 478 N -4.43 0.07 0.97 2.20 0.18 -1.26 -1.76 117.16 113.12 1ovm n TYR 478 Ca 0.10 0.03 0.12 0.00 1.88 0.00 0.00 57.90 60.03 1ovm n TYR 478 Cb 0.51 -0.55 0.24 0.00 -0.38 0.00 0.00 39.34 39.17 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 -1.56 2.67 -4.93 9.48 3.02 -0.80 -4.91 115.26 118.22 1ovm n ASN 479 Ca 0.03 -1.87 -0.25 0.00 -0.03 0.00 0.00 54.58 52.46 1ovm n ASN 479 Cb 0.14 -0.07 0.01 0.00 -0.61 0.00 0.00 39.78 39.26 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 -1.84 5.89 0.10 6.41 1.01 -0.72 -2.20 116.67 125.32 1ovm s ASP 480 Ca 0.33 0.55 -0.03 0.00 0.71 0.00 0.00 52.55 54.11 1ovm s ASP 480 Cb 0.21 -1.77 -0.03 0.00 1.01 0.00 0.00 42.92 42.34 1ovm s ASP 480 CO 0.31 -0.74 0.07 0.27 0.21 0.00 0.00 175.17 175.29 1ovm s ILE 481 N -2.69 0.14 0.27 0.77 -4.36 -1.26 -4.89 121.20 109.17 1ovm s ILE 481 Ca 0.49 -1.72 -0.31 0.00 -0.26 0.00 0.00 60.65 58.85 1ovm s ILE 481 Cb -0.10 -1.75 -0.12 0.00 1.25 0.00 0.00 42.46 41.75 1ovm s ILE 481 CO 0.41 -0.66 1.65 0.00 0.24 0.00 0.00 174.94 176.58 1ovm s ALA 482 N -3.97 3.82 -0.39 2.27 0.00 -1.26 -4.91 121.76 117.32 1ovm s ALA 482 Ca 0.15 1.59 -0.24 0.00 0.00 0.00 0.00 51.96 53.46 1ovm s ALA 482 Cb 0.07 -3.67 0.01 0.00 0.00 0.00 0.00 23.12 19.53 1ovm s ALA 482 CO -0.04 -0.97 0.82 -0.51 0.00 0.00 0.00 175.76 175.06 1ovm s LEU 483 N 0.07 4.11 0.48 0.00 1.43 -1.26 -5.03 118.68 118.49 1ovm s LEU 483 Ca 0.67 0.28 0.00 0.00 -1.03 0.00 0.00 54.13 54.06 1ovm s LEU 483 Cb -0.49 -3.07 0.01 0.00 0.03 0.00 0.00 46.19 42.67 1ovm s LEU 483 CO 0.43 -0.82 0.71 0.26 0.23 0.00 0.00 176.35 177.15 1ovm s TRP 484 N 3.27 3.12 -0.95 0.29 0.51 -1.26 -5.03 118.94 118.89 1ovm s TRP 484 Ca 0.33 0.18 -0.01 0.00 -2.12 0.00 0.00 56.10 54.47 1ovm s TRP 484 Cb -0.12 -2.44 0.29 0.00 -0.81 0.00 0.00 33.47 30.39 1ovm s TRP 484 CO 0.19 -0.51 1.28 -1.71 -0.51 0.00 0.00 176.95 175.70 1ovm n ASN 485 N -2.16 5.70 -0.33 2.95 4.05 -1.26 -4.95 115.26 119.25 1ovm n ASN 485 Ca 0.03 -3.44 0.13 0.00 0.45 0.00 0.00 54.58 51.76 1ovm n ASN 485 Cb 0.58 -1.09 0.27 0.00 1.23 0.00 0.00 39.78 40.77 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 5.03 -0.02 0.00 1.20 4.06 -2.02 -0.79 115.95 123.41 1ovm h TRP 486 Ca 0.21 0.07 0.00 0.00 2.06 0.00 0.00 58.89 61.22 1ovm h TRP 486 Cb 0.62 0.16 0.00 0.00 -1.00 0.00 0.00 29.16 28.94 1ovm h TRP 486 CO 0.94 -0.39 0.00 0.25 -3.56 0.00 0.00 178.44 175.68 1ovm n THR 487 N -5.45 1.39 0.38 1.49 -2.24 -1.26 -1.85 114.28 106.74 1ovm n THR 487 Ca 0.22 0.35 0.09 0.00 -2.27 0.00 0.00 64.05 62.43 1ovm n THR 487 Cb 0.72 -1.20 0.13 0.00 -2.10 0.00 0.00 70.33 67.88 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 -1.49 0.26 -0.07 4.78 8.25 -0.30 -4.60 115.22 122.04 1ovm n HIS 488 Ca 0.02 -0.17 -0.13 0.00 -0.26 0.00 0.00 57.72 57.18 1ovm n HIS 488 Cb 0.10 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.15 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 3.39 1.32 -0.47 1.59 2.04 -1.45 -3.23 117.51 120.70 1ovm h ILE 489 Ca 0.00 -1.29 0.08 0.00 1.00 0.00 0.00 64.86 64.65 1ovm h ILE 489 Cb 0.78 1.68 -0.07 0.00 -0.74 0.00 0.00 36.82 38.48 1ovm h ILE 489 CO 0.00 0.39 0.08 -0.65 0.00 0.00 0.00 178.15 177.97 1ovm h PRO 490 N 0.18 0.20 0.00 2.37 0.11 -1.81 0.60 132.00 133.66 1ovm h PRO 490 Ca 0.04 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.14 1ovm h PRO 490 Cb 0.69 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.75 1ovm h PRO 490 CO 0.04 0.14 0.00 0.00 -0.21 0.00 0.00 178.00 177.97 1ovm n GLN 491 N -5.12 0.48 -0.07 1.05 0.00 -1.23 -1.70 117.38 110.78 1ovm n GLN 491 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 57.00 56.98 1ovm n GLN 491 Cb 0.23 -1.46 -0.13 0.00 0.00 0.00 0.00 30.24 28.89 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 -0.96 1.71 -0.96 2.61 0.00 0.11 -4.44 120.51 118.58 1ovm n ALA 492 Ca 0.10 -0.98 0.04 0.00 0.00 0.00 0.00 53.44 52.61 1ovm n ALA 492 Cb 0.05 -0.14 0.36 0.00 0.00 0.00 0.00 19.45 19.72 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 -2.54 5.51 -3.54 0.00 4.77 -0.64 -4.93 117.00 115.64 1ovm n LEU 493 Ca -0.24 -3.03 -0.15 0.00 -0.03 0.00 0.00 56.01 52.57 1ovm n LEU 493 Cb 0.96 -0.68 -0.06 0.00 -2.33 0.00 0.00 43.42 41.32 1ovm n LEU 493 CO 0.34 0.68 0.58 -0.55 -1.33 0.00 0.00 177.39 177.11 1ovm s SER 494 N -1.06 -0.54 0.21 -1.43 0.15 -1.00 -4.69 113.70 105.35 1ovm s SER 494 Ca 0.53 0.59 0.21 0.00 0.70 0.00 0.00 55.95 57.97 1ovm s SER 494 Cb 0.41 0.44 0.03 0.00 -1.71 0.00 0.00 66.02 65.19 1ovm s SER 494 CO 0.14 -0.50 1.11 -0.07 1.20 0.00 0.00 173.24 175.12 1ovm h LEU 495 N 2.82 0.00 -5.79 3.45 3.38 -1.88 -3.41 115.31 113.88 1ovm h LEU 495 Ca -0.23 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.30 1ovm h LEU 495 Cb 1.15 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.60 1ovm h LEU 495 CO 0.36 0.17 -0.84 -0.67 0.09 0.00 0.00 178.44 177.54 1ovm n ASP 496 N -2.83 -1.31 -4.63 -0.43 -0.08 -1.26 -5.12 116.55 100.89 1ovm n ASP 496 Ca -0.01 -2.70 -0.43 0.00 -1.51 0.00 0.00 54.79 50.14 1ovm n ASP 496 Cb 0.62 0.26 -0.03 0.00 2.34 0.00 0.00 41.12 44.32 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 0.01 3.72 -1.40 -0.67 0.02 -1.26 -4.88 135.00 130.53 1ovm s PRO 497 Ca 0.33 2.02 -0.12 0.00 0.02 0.00 0.00 61.00 63.25 1ovm s PRO 497 Cb 0.09 -4.16 0.08 0.00 0.02 0.00 0.00 34.50 30.53 1ovm s PRO 497 CO -0.15 -1.41 2.13 1.04 -0.33 0.00 0.00 177.00 178.28 1ovm n GLN 498 N 7.91 3.20 -3.95 5.54 3.00 -1.26 -4.88 117.38 126.95 1ovm n GLN 498 Ca 0.22 -2.94 -0.09 0.00 -0.01 0.00 0.00 57.00 54.17 1ovm n GLN 498 Cb 0.44 -3.12 -0.06 0.00 0.00 0.00 0.00 30.24 27.50 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 2.24 -0.05 -0.03 1.08 1.04 -1.26 -2.06 113.70 114.66 1ovm s SER 499 Ca 0.45 -0.85 0.03 0.00 0.48 0.00 0.00 55.95 56.06 1ovm s SER 499 Cb 0.13 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.76 1ovm s SER 499 CO -0.05 -1.01 -0.10 -1.61 0.98 0.00 0.00 173.24 171.44 1ovm s GLU 500 N -3.98 1.07 0.08 4.02 0.41 -0.36 -4.97 118.70 114.98 1ovm s GLU 500 Ca 0.19 -0.35 0.07 0.00 -0.41 0.00 0.00 54.97 54.47 1ovm s GLU 500 Cb 0.01 -0.99 -0.03 0.00 -1.78 0.00 0.00 34.13 31.34 1ovm s GLU 500 CO 0.03 0.14 -0.19 0.00 -0.49 0.00 0.00 175.26 174.75 1ovm s TRP 502 N -1.07 -0.17 -0.36 0.00 0.51 -0.30 -4.98 118.94 112.58 1ovm s TRP 502 Ca 0.05 0.39 -0.02 0.00 -2.12 0.00 0.00 56.10 54.40 1ovm s TRP 502 Cb -0.10 0.05 0.08 0.00 -0.81 0.00 0.00 33.47 32.70 1ovm s TRP 502 CO 0.03 -0.15 0.11 0.50 -0.51 0.00 0.00 176.95 176.93 1ovm s ARG 503 N -0.25 2.19 -0.02 4.98 3.52 -1.26 0.84 118.95 128.96 1ovm s ARG 503 Ca -0.03 -1.56 -0.01 0.00 -0.13 0.00 0.00 55.73 53.99 1ovm s ARG 503 Cb -0.03 -3.41 -0.04 0.00 -1.56 0.00 0.00 34.95 29.92 1ovm s ARG 503 CO 0.01 -0.86 0.09 0.08 -0.81 0.00 0.00 175.30 173.80 1ovm s VAL 504 N 1.19 4.81 0.00 7.11 1.01 0.21 -4.97 120.40 129.76 1ovm s VAL 504 Ca 0.02 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.66 1ovm s VAL 504 Cb -0.21 -3.19 0.00 0.00 0.00 0.00 0.00 36.38 32.98 1ovm s VAL 504 CO -0.03 0.38 0.00 -1.54 0.00 0.00 0.00 175.10 173.91 1ovm n SER 505 N 1.26 0.00 -4.30 3.32 3.41 -1.26 -1.41 113.62 114.64 1ovm n SER 505 Ca -0.14 -0.61 -0.27 0.00 -0.26 0.00 0.00 58.87 57.60 1ovm n SER 505 Cb 0.53 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.34 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 -0.00 1.41 0.41 4.33 0.41 -1.26 -0.81 118.70 123.19 1ovm s GLU 506 Ca 0.00 -1.09 0.09 0.00 -0.41 0.00 0.00 54.97 53.56 1ovm s GLU 506 Cb 0.00 -1.63 0.89 0.00 -1.78 0.00 0.00 34.13 31.61 1ovm s GLU 506 CO 0.00 0.41 2.01 0.00 -0.49 0.00 0.00 175.26 177.19 1ovm h ALA 507 N 4.52 1.81 -0.45 5.21 0.00 -1.22 -1.38 119.26 127.75 1ovm h ALA 507 Ca -0.45 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.31 1ovm h ALA 507 Cb 1.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1ovm h ALA 507 CO 0.42 0.11 -0.21 0.93 0.00 0.00 0.00 179.25 180.51 1ovm h GLU 508 N 0.55 0.90 0.12 0.00 4.39 -1.83 0.16 114.58 118.87 1ovm h GLU 508 Ca 0.23 -0.37 -0.01 0.00 0.34 0.00 0.00 59.36 59.55 1ovm h GLU 508 Cb 0.21 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1ovm h GLU 508 CO -0.06 1.02 -0.06 1.96 -1.16 0.00 0.00 179.01 180.71 1ovm h GLN 509 N 0.78 -0.16 -0.36 2.33 4.20 -1.66 -0.68 115.11 119.57 1ovm h GLN 509 Ca 0.11 0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.86 1ovm h GLN 509 Cb 0.75 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.54 1ovm h GLN 509 CO 0.06 0.02 0.17 1.25 -0.67 0.00 0.00 178.83 179.66 1ovm h LEU 510 N -0.31 0.23 -0.50 1.46 6.46 -1.29 -0.14 115.31 121.22 1ovm h LEU 510 Ca -0.02 0.02 0.09 0.00 -0.12 0.00 0.00 57.88 57.86 1ovm h LEU 510 Cb 0.25 -0.02 -0.08 0.00 -0.73 0.00 0.00 40.66 40.09 1ovm h LEU 510 CO 0.03 0.17 0.05 0.00 -0.62 0.00 0.00 178.44 178.07 1ovm h ALA 511 N 1.20 0.52 -0.30 1.25 0.00 -0.46 -0.91 119.26 120.56 1ovm h ALA 511 Ca 0.16 0.13 -0.18 0.00 0.00 0.00 0.00 54.91 55.02 1ovm h ALA 511 Cb 0.09 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1ovm h ALA 511 CO -0.13 -0.35 -0.50 -0.44 0.00 0.00 0.00 179.25 177.83 1ovm h ASP 512 N 0.17 0.97 -0.58 0.00 3.32 -0.54 -2.80 116.42 116.97 1ovm h ASP 512 Ca 0.25 -0.52 -0.06 0.00 0.02 0.00 0.00 57.03 56.72 1ovm h ASP 512 Cb 0.37 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 1ovm h ASP 512 CO -0.37 1.31 0.15 0.58 -1.72 0.00 0.00 179.24 179.18 1ovm h VAL 513 N 0.67 1.24 -0.08 -1.35 2.07 -0.77 -1.69 116.25 116.35 1ovm h VAL 513 Ca 0.02 -0.89 -0.07 0.00 0.82 0.00 0.00 66.70 66.58 1ovm h VAL 513 Cb 1.11 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 1ovm h VAL 513 CO 0.12 0.34 -0.26 -0.07 0.02 0.00 0.00 177.57 177.71 1ovm h LEU 514 N 0.92 0.14 -0.47 2.57 3.38 -1.13 0.05 115.31 120.77 1ovm h LEU 514 Ca 0.20 -0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.96 1ovm h LEU 514 Cb 0.33 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1ovm h LEU 514 CO -0.00 0.41 -0.72 -0.08 0.09 0.00 0.00 178.44 178.14 1ovm h GLU 515 N 0.13 0.28 0.09 1.13 4.81 -1.14 -1.61 114.58 118.26 1ovm h GLU 515 Ca 0.02 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.01 1ovm h GLU 515 Cb 0.54 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1ovm h GLU 515 CO 0.04 0.88 -0.04 0.87 -0.73 0.00 0.00 179.01 180.03 1ovm h LYS 516 N 0.19 -0.11 -0.00 1.92 1.57 -0.43 -3.21 116.57 116.50 1ovm h LYS 516 Ca -0.02 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1ovm h LYS 516 Cb 1.27 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1ovm h LYS 516 CO 0.11 0.17 -0.03 1.33 -0.57 0.00 0.00 179.45 180.47 1ovm n VAL 517 N -5.01 0.00 -0.31 0.50 0.24 -0.08 -4.40 118.33 109.27 1ovm n VAL 517 Ca -0.08 -0.05 0.24 0.00 -2.04 0.00 0.00 64.34 62.40 1ovm n VAL 517 Cb 0.18 -0.25 0.45 0.00 -1.47 0.00 0.00 33.84 32.75 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 -0.85 0.78 -0.69 2.33 0.00 -0.61 -0.25 120.51 121.21 1ovm n ALA 518 Ca 0.20 0.98 -0.01 0.00 0.00 0.00 0.00 53.44 54.60 1ovm n ALA 518 Cb 0.21 -0.87 0.30 0.00 0.00 0.00 0.00 19.45 19.08 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 -5.22 2.01 -2.81 0.00 8.25 -1.26 -4.99 115.22 111.20 1ovm n HIS 519 Ca 0.30 -0.89 -0.07 0.00 -0.26 0.00 0.00 57.72 56.80 1ovm n HIS 519 Cb 1.02 -0.56 0.00 0.00 1.12 0.00 0.00 29.99 31.57 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 0.15 -0.56 1.45 4.41 1.44 0.65 -4.77 115.22 117.99 1ovm n HIS 520 Ca 0.31 0.23 0.14 0.00 -2.01 0.00 0.00 57.72 56.39 1ovm n HIS 520 Cb 1.18 -0.73 0.54 0.00 0.12 0.00 0.00 29.99 31.10 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 -1.04 1.10 -3.50 -1.40 4.71 -1.26 -4.83 120.64 114.42 1ovm n GLU 521 Ca -0.09 -0.54 -0.11 0.00 -0.01 0.00 0.00 57.16 56.41 1ovm n GLU 521 Cb 0.19 -1.49 -0.02 0.00 -1.01 0.00 0.00 31.44 29.11 1ovm n GLU 521 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 1ovm s ARG 522 N -2.27 1.32 0.19 3.49 0.52 -1.26 -5.01 118.95 115.92 1ovm s ARG 522 Ca 0.32 -0.54 -0.32 0.00 -0.52 0.00 0.00 55.73 54.68 1ovm s ARG 522 Cb 0.20 0.57 -0.12 0.00 0.52 0.00 0.00 34.95 36.13 1ovm s ARG 522 CO 0.43 -0.58 1.74 -0.11 0.02 0.00 0.00 175.30 176.79 1ovm n LEU 523 N -0.38 3.97 -4.04 2.53 -0.00 -0.88 -4.52 117.00 113.69 1ovm n LEU 523 Ca -0.14 1.05 -0.26 0.00 -0.00 0.00 0.00 56.01 56.66 1ovm n LEU 523 Cb 0.64 -1.56 -0.17 0.00 -0.00 0.00 0.00 43.42 42.33 1ovm n LEU 523 CO 0.12 0.16 -0.48 -0.94 -0.00 0.00 0.00 177.39 176.26 1ovm s SER 524 N 1.42 1.95 -0.20 1.96 1.04 -0.50 -1.22 113.70 118.16 1ovm s SER 524 Ca 0.76 -0.33 -0.01 0.00 0.48 0.00 0.00 55.95 56.86 1ovm s SER 524 Cb -0.51 -0.90 0.01 0.00 0.10 0.00 0.00 66.02 64.73 1ovm s SER 524 CO 0.33 0.04 -0.14 -0.22 0.98 0.00 0.00 173.24 174.23 1ovm s LEU 525 N 0.70 2.44 -0.29 2.42 2.96 -0.12 -0.65 118.68 126.15 1ovm s LEU 525 Ca -0.14 -0.60 -0.04 0.00 -0.22 0.00 0.00 54.13 53.14 1ovm s LEU 525 Cb -0.16 -1.57 0.03 0.00 0.50 0.00 0.00 46.19 44.99 1ovm s LEU 525 CO 0.03 -0.02 0.02 -0.63 -1.32 0.00 0.00 176.35 174.43 1ovm s ILE 526 N 1.35 3.31 -0.44 6.68 1.01 0.69 -1.15 121.20 132.64 1ovm s ILE 526 Ca 0.05 -1.08 -0.24 0.00 0.00 0.00 0.00 60.65 59.38 1ovm s ILE 526 Cb -0.14 -2.79 0.02 0.00 0.01 0.00 0.00 42.46 39.57 1ovm s ILE 526 CO -0.09 0.02 0.84 -0.70 0.00 0.00 0.00 174.94 175.00 1ovm s GLU 527 N 1.36 3.50 -0.49 2.79 2.12 0.25 -1.19 118.70 127.03 1ovm s GLU 527 Ca -0.01 0.05 -0.17 0.00 0.36 0.00 0.00 54.97 55.20 1ovm s GLU 527 Cb -0.18 -3.92 0.07 0.00 0.26 0.00 0.00 34.13 30.36 1ovm s GLU 527 CO -0.01 -1.13 0.47 0.08 -0.54 0.00 0.00 175.26 174.14 1ovm s VAL 528 N 3.45 5.12 0.03 3.70 1.01 0.25 -0.62 120.40 133.34 1ovm s VAL 528 Ca 0.33 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 61.09 1ovm s VAL 528 Cb -0.11 -4.19 -0.06 0.00 0.00 0.00 0.00 36.38 32.01 1ovm s VAL 528 CO 0.23 -0.67 1.34 -0.04 0.00 0.00 0.00 175.10 175.97 1ovm s MET 529 N 1.95 4.32 0.07 2.72 1.00 -0.50 -0.34 119.30 128.52 1ovm s MET 529 Ca 0.07 1.93 0.01 0.00 0.00 0.00 0.00 55.69 57.70 1ovm s MET 529 Cb -0.23 -3.46 -0.04 0.00 0.00 0.00 0.00 34.83 31.10 1ovm s MET 529 CO 0.08 -0.48 -0.05 -0.51 0.00 0.00 0.00 175.02 174.06 1ovm s LEU 530 N 1.86 2.47 0.35 -0.03 1.43 0.25 -4.77 118.68 120.25 1ovm s LEU 530 Ca 0.62 -0.94 -0.28 0.00 -1.03 0.00 0.00 54.13 52.50 1ovm s LEU 530 Cb -0.32 0.01 -0.10 0.00 0.03 0.00 0.00 46.19 45.81 1ovm s LEU 530 CO 0.27 -0.47 1.37 -2.84 0.23 0.00 0.00 176.35 174.91 1ovm s PRO 531 N -3.54 4.24 0.40 1.29 0.02 -1.26 -4.12 135.00 132.03 1ovm s PRO 531 Ca 0.07 2.33 0.13 0.00 0.02 0.00 0.00 61.00 63.55 1ovm s PRO 531 Cb 0.04 -3.01 0.96 0.00 0.02 0.00 0.00 34.50 32.51 1ovm s PRO 531 CO -0.06 -0.33 1.92 -0.22 -0.33 0.00 0.00 177.00 177.98 1ovm h LYS 532 N 3.20 0.50 -0.06 5.54 3.64 -1.93 -2.56 116.57 124.89 1ovm h LYS 532 Ca -0.50 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 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 0.65 0.33 0.00 0.00 -2.27 0.00 0.00 179.45 178.16 1ovm n ALA 533 N -2.49 2.46 -2.03 5.00 0.00 -1.26 -4.62 120.51 117.57 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 -0.59 -0.03 0.00 0.00 0.00 0.00 19.45 19.30 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 -1.41 6.69 0.02 0.00 -1.08 -0.97 -5.00 116.67 114.92 1ovm s ASP 534 Ca 0.21 2.29 0.05 0.00 -0.52 0.00 0.00 52.55 54.59 1ovm s ASP 534 Cb 0.15 -2.55 -0.02 0.00 -1.46 0.00 0.00 42.92 39.04 1ovm s ASP 534 CO 0.22 -0.87 -0.16 -0.63 0.52 0.00 0.00 175.17 174.25 1ovm s ILE 535 N 3.20 1.26 0.61 4.11 1.09 -1.26 -4.91 121.20 125.31 1ovm s ILE 535 Ca 0.71 -0.89 -0.17 0.00 -1.10 0.00 0.00 60.65 59.21 1ovm s ILE 535 Cb -0.35 -1.10 -0.03 0.00 -1.06 0.00 0.00 42.46 39.93 1ovm s ILE 535 CO 0.30 0.19 1.11 -2.84 -0.10 0.00 0.00 174.94 173.60 1ovm s PRO 536 N -0.81 3.05 0.08 2.79 0.02 -1.26 -4.90 135.00 133.97 1ovm s PRO 536 Ca 0.05 1.47 -0.18 0.00 0.02 0.00 0.00 61.00 62.36 1ovm s PRO 536 Cb -0.07 -1.98 -0.05 0.00 0.02 0.00 0.00 34.50 32.42 1ovm s PRO 536 CO 0.01 -1.07 1.30 -1.35 -0.33 0.00 0.00 177.00 175.56 1ovm h PRO 537 N 0.51 -0.08 -0.55 5.54 0.11 -1.99 -2.17 132.00 133.38 1ovm h PRO 537 Ca -0.48 0.01 0.10 0.00 0.11 0.00 0.00 66.00 65.74 1ovm h PRO 537 Cb 1.25 0.02 -0.08 0.00 0.11 0.00 0.00 31.00 32.30 1ovm h PRO 537 CO 0.55 -0.05 0.08 1.25 -0.21 0.00 0.00 178.00 179.63 1ovm h LEU 538 N -0.08 -0.06 -1.44 2.35 5.85 -1.90 -2.26 115.31 117.77 1ovm h LEU 538 Ca 0.07 0.11 0.22 0.00 0.84 0.00 0.00 57.88 59.12 1ovm h LEU 538 Cb 0.27 0.17 -0.08 0.00 0.37 0.00 0.00 40.66 41.39 1ovm h LEU 538 CO -0.46 -0.01 0.62 0.25 -0.34 0.00 0.00 178.44 178.50 1ovm h LEU 539 N 0.21 0.45 -0.37 2.25 5.85 -1.61 -0.62 115.31 121.46 1ovm h LEU 539 Ca 0.28 0.06 0.02 0.00 0.84 0.00 0.00 57.88 59.08 1ovm h LEU 539 Cb 0.42 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1ovm h LEU 539 CO -0.39 0.16 0.20 1.23 -0.34 0.00 0.00 178.44 179.30 1ovm h GLY 540 N 0.43 0.51 0.90 3.75 0.00 -1.21 0.11 103.07 107.57 1ovm h GLY 540 Ca 0.51 -0.15 -0.04 0.00 0.00 0.00 0.00 47.33 47.65 1ovm h GLY 540 CO -0.22 0.12 -0.45 0.00 0.00 0.00 0.00 176.54 175.99 1ovm h ALA 541 N 1.18 -1.20 -0.93 3.60 0.00 -1.21 -1.16 119.26 119.54 1ovm h ALA 541 Ca 0.15 -0.25 0.14 0.00 0.00 0.00 0.00 54.91 54.95 1ovm h ALA 541 Cb 0.03 0.53 -0.08 0.00 0.00 0.00 0.00 17.79 18.28 1ovm h ALA 541 CO -0.09 -1.19 0.59 1.25 0.00 0.00 0.00 179.25 179.82 1ovm h LEU 542 N -1.18 0.75 -0.36 0.00 5.85 -1.39 -1.79 115.31 117.19 1ovm h LEU 542 Ca -0.11 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 1ovm h LEU 542 Cb 0.93 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.84 1ovm h LEU 542 CO 0.14 0.38 0.10 0.00 -0.34 0.00 0.00 178.44 178.73 1ovm h THR 543 N 0.80 1.21 -0.15 1.05 1.03 -0.55 -2.11 112.91 114.20 1ovm h THR 543 Ca 0.47 -0.71 -0.06 0.00 -0.01 0.00 0.00 66.41 66.09 1ovm h THR 543 Cb 0.64 1.00 -0.01 0.00 -1.07 0.00 0.00 68.15 68.71 1ovm h THR 543 CO -0.23 0.24 -0.19 0.50 -0.01 0.00 0.00 175.52 175.83 1ovm h LYS 544 N 0.43 0.26 -0.14 0.00 3.64 -0.38 -2.84 116.57 117.54 1ovm h LYS 544 Ca 0.11 -0.07 -0.22 0.00 -1.27 0.00 0.00 60.65 59.20 1ovm h LYS 544 Cb 0.27 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1ovm h LYS 544 CO -0.00 0.45 -0.78 0.00 -2.27 0.00 0.00 179.45 176.85 1ovm h ALA 545 N 1.57 0.36 -0.40 5.00 0.00 -1.21 -2.71 119.26 121.86 1ovm h ALA 545 Ca 0.04 -0.60 -0.02 0.00 0.00 0.00 0.00 54.91 54.33 1ovm h ALA 545 Cb 0.49 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1ovm h ALA 545 CO 0.03 0.70 0.19 -0.07 0.00 0.00 0.00 179.25 180.10 1ovm h LEU 546 N 0.50 0.53 -1.14 0.00 3.38 -1.15 -2.35 115.31 115.07 1ovm h LEU 546 Ca -0.05 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 1ovm h LEU 546 Cb 1.40 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1ovm h LEU 546 CO 0.16 0.52 -0.30 -0.08 0.09 0.00 0.00 178.44 178.82 1ovm h GLU 547 N 0.51 0.00 -0.27 1.13 4.57 -1.59 -2.12 114.58 116.81 1ovm h GLU 547 Ca 0.14 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.26 1ovm h GLU 547 Cb 0.13 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 1ovm h GLU 547 CO -0.02 0.30 -0.10 0.00 -1.18 0.00 0.00 179.01 178.01 1ovm h ALA 548 N 1.70 1.32 -0.01 2.92 0.00 -1.10 -2.02 119.26 122.07 1ovm h ALA 548 Ca -0.00 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 1ovm h ALA 548 Cb 0.76 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1ovm h ALA 548 CO 0.04 0.46 -0.57 0.00 0.00 0.00 0.00 179.25 179.17 1ovm n ASN 550 N -3.86 0.20 -0.03 0.00 3.02 -0.78 -5.13 115.26 108.68 1ovm n ASN 550 Ca -0.01 0.53 0.00 0.00 -0.03 0.00 0.00 54.58 55.07 1ovm n ASN 550 Cb 0.58 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1ovm n ASN 550 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23