#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 1.19 -1.77 -0.78 -0.02 -1.26 -4.86 135.00 127.50 1ovm n PRO 4 Ca 0.00 0.44 -0.42 0.00 -2.02 0.00 0.00 63.50 61.50 1ovm n PRO 4 Cb 0.00 -2.16 -0.03 0.00 -0.02 0.00 0.00 33.50 31.29 1ovm n PRO 4 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1ovm s TYR 5 N -1.40 2.70 0.34 6.00 5.04 -1.26 -4.99 117.35 123.77 1ovm s TYR 5 Ca 0.70 0.28 0.05 0.00 -2.44 0.00 0.00 57.07 55.66 1ovm s TYR 5 Cb -0.47 -4.11 -0.03 0.00 0.35 0.00 0.00 41.96 37.70 1ovm s TYR 5 CO 0.52 -4.31 0.19 0.00 -1.34 0.00 0.00 175.55 170.60 1ovm h VAL 7 N 2.07 0.42 -0.94 0.00 2.07 -0.98 0.33 116.25 119.22 1ovm h VAL 7 Ca -0.31 -0.09 0.13 0.00 0.82 0.00 0.00 66.70 67.25 1ovm h VAL 7 Cb 1.25 0.14 -0.09 0.00 -1.52 0.00 0.00 31.29 31.07 1ovm h VAL 7 CO 0.48 0.05 0.56 0.00 0.02 0.00 0.00 177.57 178.68 1ovm h ALA 8 N 1.70 1.44 -0.23 1.67 0.00 -1.69 0.21 119.26 122.35 1ovm h ALA 8 Ca 0.49 0.05 -0.19 0.00 0.00 0.00 0.00 54.91 55.25 1ovm h ALA 8 Cb 0.91 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1ovm h ALA 8 CO -0.58 0.09 -0.61 -0.44 0.00 0.00 0.00 179.25 177.72 1ovm h ASP 9 N 0.85 0.90 -0.39 0.00 3.32 -0.70 -2.59 116.42 117.79 1ovm h ASP 9 Ca 0.49 -0.51 0.02 0.00 0.02 0.00 0.00 57.03 57.05 1ovm h ASP 9 Cb 0.57 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 1ovm h ASP 9 CO -0.30 1.30 0.21 0.22 -1.72 0.00 0.00 179.24 178.95 1ovm h TYR 10 N 0.59 0.40 0.19 4.55 5.03 0.17 -0.88 116.97 127.02 1ovm h TYR 10 Ca -0.00 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.32 1ovm h TYR 10 Cb 1.21 -0.12 -0.02 0.00 1.55 0.00 0.00 36.73 39.35 1ovm h TYR 10 CO 0.07 0.22 -0.18 1.25 -1.32 0.00 0.00 178.16 178.20 1ovm h LEU 11 N 0.43 -0.48 -0.70 2.82 5.85 -0.97 -1.79 115.31 120.47 1ovm h LEU 11 Ca 0.16 0.05 0.09 0.00 0.84 0.00 0.00 57.88 59.02 1ovm h LEU 11 Cb 0.04 0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.17 1ovm h LEU 11 CO -0.10 -0.27 0.35 -0.07 -0.34 0.00 0.00 178.44 178.01 1ovm h LEU 12 N -0.40 0.45 -0.99 2.25 -0.00 -1.17 -0.81 115.31 114.64 1ovm h LEU 12 Ca 0.00 0.06 0.04 0.00 -0.00 0.00 0.00 57.88 57.98 1ovm h LEU 12 Cb 0.37 -0.02 -0.06 0.00 -0.00 0.00 0.00 40.66 40.96 1ovm h LEU 12 CO -0.04 0.26 0.65 0.44 -0.00 0.00 0.00 178.44 179.75 1ovm h ASP 13 N 0.59 1.08 0.50 -0.43 3.32 -0.73 -0.65 116.42 120.10 1ovm h ASP 13 Ca 0.35 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.31 1ovm h ASP 13 Cb 0.37 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1ovm h ASP 13 CO -0.27 0.73 -0.39 0.03 -1.72 0.00 0.00 179.24 177.61 1ovm h ARG 14 N 1.24 0.00 -0.02 3.56 2.47 -0.37 -1.10 114.38 120.16 1ovm h ARG 14 Ca 0.40 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 59.12 1ovm h ARG 14 Cb 0.03 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.35 1ovm h ARG 14 CO -0.13 0.39 0.00 -0.07 0.56 0.00 0.00 179.97 180.72 1ovm h LEU 15 N 0.00 0.03 -0.99 3.04 4.07 0.17 -1.89 115.31 119.74 1ovm h LEU 15 Ca -0.00 -0.24 -0.02 0.00 0.08 0.00 0.00 57.88 57.70 1ovm h LEU 15 Cb 0.75 -0.01 -0.04 0.00 1.08 0.00 0.00 40.66 42.44 1ovm h LEU 15 CO 0.05 0.26 0.42 0.71 -1.08 0.00 0.00 178.44 178.80 1ovm h THR 16 N -0.20 1.24 -0.71 0.22 1.35 -1.04 -1.12 112.91 112.64 1ovm h THR 16 Ca 0.01 -0.63 0.05 0.00 -0.55 0.00 0.00 66.41 65.28 1ovm h THR 16 Cb 0.24 0.17 -0.04 0.00 -1.73 0.00 0.00 68.15 66.79 1ovm h THR 16 CO 0.00 0.28 0.47 0.44 -0.25 0.00 0.00 175.52 176.46 1ovm h ASP 17 N 1.14 0.69 0.74 5.36 5.19 -1.00 -1.51 116.42 127.02 1ovm h ASP 17 Ca 0.28 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.69 1ovm h ASP 17 Cb 0.06 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.42 1ovm h ASP 17 CO -0.04 0.45 0.00 0.00 -3.12 0.00 0.00 179.24 176.53 1ovm n GLY 19 N 1.18 1.05 3.80 0.00 0.00 -0.57 -4.66 105.19 106.00 1ovm n GLY 19 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 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 3.71 0.00 4.61 0.00 -0.96 -4.79 121.76 122.33 1ovm s ALA 20 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 51.53 1ovm s ALA 20 Cb 0.00 -2.27 0.00 0.00 0.00 0.00 0.00 23.12 20.85 1ovm s ALA 20 CO 0.00 0.36 0.38 -0.25 0.00 0.00 0.00 175.76 176.25 1ovm n ASP 21 N 2.57 0.76 -4.20 0.00 8.00 -1.26 -3.81 116.55 118.60 1ovm n ASP 21 Ca -0.15 -0.88 -0.12 0.00 0.71 0.00 0.00 54.79 54.36 1ovm n ASP 21 Cb 0.53 0.24 -0.10 0.00 -0.02 0.00 0.00 41.12 41.77 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 -0.24 1.02 -0.07 1.24 3.76 -1.26 -0.10 115.29 119.64 1ovm s HIS 22 Ca 0.00 -0.98 -0.01 0.00 -0.15 0.00 0.00 55.06 53.92 1ovm s HIS 22 Cb 0.00 -0.58 0.03 0.00 1.11 0.00 0.00 32.58 33.13 1ovm s HIS 22 CO 0.00 -0.20 -0.01 -1.17 -0.85 0.00 0.00 174.74 172.51 1ovm s LEU 23 N -3.10 0.68 0.20 0.89 2.96 0.37 -4.46 118.68 116.21 1ovm s LEU 23 Ca 0.18 -0.11 0.00 0.00 -0.22 0.00 0.00 54.13 53.98 1ovm s LEU 23 Cb 0.06 -0.48 -0.04 0.00 0.50 0.00 0.00 46.19 46.22 1ovm s LEU 23 CO -0.01 -0.18 0.37 -0.36 -1.32 0.00 0.00 176.35 174.86 1ovm s PHE 24 N 1.91 3.48 -5.00 5.38 0.08 -0.97 -0.48 117.98 122.38 1ovm s PHE 24 Ca 0.04 0.28 0.00 0.00 0.12 0.00 0.00 56.93 57.37 1ovm s PHE 24 Cb -0.12 -1.80 0.00 0.00 -0.57 0.00 0.00 43.02 40.53 1ovm s PHE 24 CO -0.05 0.40 0.00 0.41 -0.10 0.00 0.00 175.22 175.88 1ovm n GLY 25 N -0.73 -0.76 2.88 4.36 0.00 -1.14 0.66 105.19 110.47 1ovm n GLY 25 Ca -0.05 -1.54 -0.17 0.00 0.00 0.00 0.00 46.02 44.25 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 -2.17 0.35 1.01 1.61 -7.23 -1.11 -1.66 120.40 111.19 1ovm s VAL 26 Ca 0.00 -0.06 -0.14 0.00 -1.81 0.00 0.00 61.98 59.97 1ovm s VAL 26 Cb 0.00 -0.38 0.10 0.00 0.56 0.00 0.00 36.38 36.66 1ovm s VAL 26 CO 0.00 0.16 0.51 -0.81 -0.31 0.00 0.00 175.10 174.64 1ovm n PRO 27 N 3.77 -0.84 -3.58 4.82 -0.04 -1.26 -4.44 135.00 133.43 1ovm n PRO 27 Ca -0.23 -0.20 -0.11 0.00 -0.04 0.00 0.00 63.50 62.92 1ovm n PRO 27 Cb 0.53 -1.94 -0.06 0.00 -0.04 0.00 0.00 33.50 31.99 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 -2.12 -0.28 0.10 0.55 0.00 -1.26 -4.85 107.32 99.45 1ovm s GLY 28 Ca 0.60 2.08 -0.11 0.00 0.00 0.00 0.00 44.72 47.28 1ovm s GLY 28 CO 0.65 1.17 0.74 1.34 0.00 0.00 0.00 173.10 177.00 1ovm n ASP 29 N 1.02 -0.38 0.00 1.64 2.03 -1.26 0.03 116.55 119.63 1ovm n ASP 29 Ca -0.11 0.84 0.09 0.00 0.52 0.00 0.00 54.79 56.12 1ovm n ASP 29 Cb 0.57 -0.16 0.49 0.00 -0.72 0.00 0.00 41.12 41.30 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 -4.66 0.00 -0.36 -0.67 4.01 -1.26 -3.55 117.16 110.67 1ovm n TYR 30 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1ovm n TYR 30 Cb 0.17 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.00 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 -1.20 1.01 0.10 7.72 0.23 0.10 -4.05 115.26 119.18 1ovm n ASN 31 Ca 0.10 -1.37 -0.12 0.00 -0.53 0.00 0.00 54.58 52.66 1ovm n ASN 31 Cb 0.12 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 37.76 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 -0.44 -1.45 -4.53 4.07 -1.54 -0.23 115.31 111.20 1ovm h LEU 32 Ca 0.00 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.01 1ovm h LEU 32 Cb 0.47 0.16 -0.03 0.00 1.08 0.00 0.00 40.66 42.34 1ovm h LEU 32 CO 0.00 -0.23 0.37 1.56 -1.08 0.00 0.00 178.44 179.05 1ovm h GLN 33 N -0.32 0.73 -0.42 1.13 4.20 -1.88 -0.29 115.11 118.26 1ovm h GLN 33 Ca 0.02 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.55 1ovm h GLN 33 Cb 0.33 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 1ovm h GLN 33 CO -0.08 0.49 -0.26 0.35 -0.67 0.00 0.00 178.83 178.66 1ovm h PHE 34 N 0.76 1.02 -0.72 2.96 3.57 -1.82 -2.85 116.94 119.86 1ovm h PHE 34 Ca 0.20 -0.26 0.10 0.00 3.53 0.00 0.00 57.97 61.55 1ovm h PHE 34 Cb -0.08 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.37 1ovm h PHE 34 CO 0.00 1.04 0.47 1.25 -2.23 0.00 0.00 178.31 178.85 1ovm h LEU 35 N 0.76 0.53 -0.55 0.59 5.85 0.73 -1.34 115.31 121.88 1ovm h LEU 35 Ca 0.09 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.90 1ovm h LEU 35 Cb 0.81 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.69 1ovm h LEU 35 CO 0.07 0.31 0.21 0.44 -0.34 0.00 0.00 178.44 179.13 1ovm h ASP 36 N 0.58 0.24 -0.90 1.25 3.32 -1.18 -1.30 116.42 118.43 1ovm h ASP 36 Ca 0.33 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.44 1ovm h ASP 36 Cb 0.52 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.06 1ovm h ASP 36 CO -0.12 0.16 0.53 0.45 -1.72 0.00 0.00 179.24 178.54 1ovm h HIS 37 N 0.41 1.21 -0.03 4.55 3.86 -1.34 -0.29 115.15 123.53 1ovm h HIS 37 Ca 0.26 -0.01 -0.11 0.00 -1.16 0.00 0.00 60.37 59.35 1ovm h HIS 37 Cb 0.28 -0.39 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 1ovm h HIS 37 CO -0.15 0.82 -0.51 -0.24 0.86 0.00 0.00 177.93 178.70 1ovm h VAL 38 N 1.26 1.36 -0.06 2.45 3.04 -1.25 0.34 116.25 123.39 1ovm h VAL 38 Ca 0.32 -1.76 -0.18 0.00 -1.01 0.00 0.00 66.70 64.07 1ovm h VAL 38 Cb -0.02 1.92 -0.01 0.00 -2.01 0.00 0.00 31.29 31.17 1ovm h VAL 38 CO -0.06 0.51 -0.74 0.40 -1.01 0.00 0.00 177.57 176.67 1ovm h ILE 39 N 0.06 1.40 0.00 3.17 2.04 -0.63 -3.04 117.51 120.50 1ovm h ILE 39 Ca -0.00 -2.20 0.00 0.00 1.00 0.00 0.00 64.86 63.66 1ovm h ILE 39 Cb 0.93 2.16 0.00 0.00 -0.74 0.00 0.00 36.82 39.17 1ovm h ILE 39 CO 0.07 0.66 -0.11 0.47 0.00 0.00 0.00 178.15 179.24 1ovm n ASP 40 N -3.81 0.82 -4.76 1.72 8.00 -0.18 -4.82 116.55 113.52 1ovm n ASP 40 Ca -0.04 0.50 -0.41 0.00 0.71 0.00 0.00 54.79 55.55 1ovm n ASP 40 Cb 0.71 -0.64 -0.03 0.00 -0.02 0.00 0.00 41.12 41.14 1ovm n ASP 40 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1ovm s SER 41 N -4.52 7.03 0.00 -2.24 0.15 0.09 -4.91 113.70 109.29 1ovm s SER 41 Ca 0.10 2.44 0.26 0.00 0.70 0.00 0.00 55.95 59.45 1ovm s SER 41 Cb 0.12 -2.63 0.69 0.00 -1.71 0.00 0.00 66.02 62.49 1ovm s SER 41 CO 0.62 -0.35 1.53 -0.81 1.20 0.00 0.00 173.24 175.43 1ovm n PRO 42 N 1.31 0.87 -0.00 5.44 -0.04 -1.26 -4.16 135.00 137.15 1ovm n PRO 42 Ca 0.01 -0.53 0.06 0.00 -0.04 0.00 0.00 63.50 62.99 1ovm n PRO 42 Cb 0.43 -1.49 -0.08 0.00 -0.04 0.00 0.00 33.50 32.32 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 -0.60 1.28 -4.17 3.54 8.00 -1.26 -4.95 116.55 118.39 1ovm n ASP 43 Ca 0.12 -0.42 -0.30 0.00 0.71 0.00 0.00 54.79 54.90 1ovm n ASP 43 Cb 0.36 1.28 -0.17 0.00 -0.02 0.00 0.00 41.12 42.57 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 -2.51 1.80 -0.18 0.53 -1.09 -1.26 -4.54 121.20 113.95 1ovm s ILE 44 Ca 0.00 -0.87 -0.07 0.00 -2.23 0.00 0.00 60.65 57.49 1ovm s ILE 44 Cb 0.09 -1.57 -0.04 0.00 -1.58 0.00 0.00 42.46 39.36 1ovm s ILE 44 CO 0.52 0.50 0.04 0.00 -1.23 0.00 0.00 174.94 174.78 1ovm s TRP 46 N 0.49 3.80 -0.37 0.00 -0.11 -1.26 -0.48 118.94 121.00 1ovm s TRP 46 Ca 0.02 1.78 0.01 0.00 1.22 0.00 0.00 56.10 59.13 1ovm s TRP 46 Cb -0.13 -3.08 0.11 0.00 -1.50 0.00 0.00 33.47 28.87 1ovm s TRP 46 CO 0.01 0.11 0.15 0.08 -4.62 0.00 0.00 176.95 172.68 1ovm s VAL 47 N -0.13 1.33 0.21 5.86 1.01 0.37 -4.89 120.40 124.16 1ovm s VAL 47 Ca 0.47 -2.04 -0.30 0.00 0.00 0.00 0.00 61.98 60.11 1ovm s VAL 47 Cb -0.24 -1.97 -0.08 0.00 0.00 0.00 0.00 36.38 34.09 1ovm s VAL 47 CO 0.31 -0.76 1.06 -0.83 0.00 0.00 0.00 175.10 174.88 1ovm s GLY 48 N 0.96 2.97 0.43 4.51 0.00 -1.26 -2.86 107.32 112.07 1ovm s GLY 48 Ca 0.13 0.79 0.07 0.00 0.00 0.00 0.00 44.72 45.71 1ovm s GLY 48 CO -0.12 1.51 0.18 0.00 0.00 0.00 0.00 173.10 174.67 1ovm h ALA 50 N 1.39 0.90 -2.70 0.00 0.00 -1.90 -3.45 119.26 113.51 1ovm h ALA 50 Ca -0.42 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.09 1ovm h ALA 50 Cb 1.26 -0.18 -0.13 0.00 0.00 0.00 0.00 17.79 18.73 1ovm h ALA 50 CO 0.70 0.63 -0.14 0.54 0.00 0.00 0.00 179.25 180.98 1ovm s ASN 51 N -6.68 -0.15 0.57 0.00 2.20 -1.26 -5.06 114.94 104.56 1ovm s ASN 51 Ca -0.10 -0.40 0.36 0.00 -0.94 0.00 0.00 52.86 51.78 1ovm s ASN 51 Cb 0.13 0.44 1.56 0.00 -2.00 0.00 0.00 41.25 41.38 1ovm s ASN 51 CO 0.84 -0.82 2.05 1.05 -2.94 0.00 0.00 177.10 177.28 1ovm h GLU 52 N 2.46 0.00 -0.15 3.55 9.09 -1.89 -1.86 114.58 125.79 1ovm h GLU 52 Ca -0.34 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 59.03 1ovm h GLU 52 Cb 1.24 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.34 1ovm h GLU 52 CO 0.49 0.00 -0.07 1.25 0.05 0.00 0.00 179.01 180.74 1ovm h LEU 53 N 0.00 0.33 -0.56 3.06 6.46 -1.91 -0.85 115.31 121.83 1ovm h LEU 53 Ca -0.00 -0.41 -0.00 0.00 -0.12 0.00 0.00 57.88 57.35 1ovm h LEU 53 Cb 0.42 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.23 1ovm h LEU 53 CO 0.00 0.66 0.34 0.78 -0.62 0.00 0.00 178.44 179.60 1ovm h ASN 54 N -0.01 0.68 -0.43 1.25 -0.26 -1.82 -1.74 115.58 113.24 1ovm h ASN 54 Ca 0.03 -0.06 0.08 0.00 -0.56 0.00 0.00 56.30 55.80 1ovm h ASN 54 Cb 0.53 -0.17 -0.07 0.00 -1.06 0.00 0.00 38.32 37.56 1ovm h ASN 54 CO 0.02 0.53 0.04 0.00 -1.06 0.00 0.00 177.43 176.97 1ovm h ALA 55 N 1.17 0.44 -0.53 -0.83 0.00 -1.15 0.32 119.26 118.69 1ovm h ALA 55 Ca 0.20 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 1ovm h ALA 55 Cb -0.02 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1ovm h ALA 55 CO -0.04 -0.36 0.14 0.66 0.00 0.00 0.00 179.25 179.65 1ovm h SER 56 N 0.16 0.74 -0.34 0.00 4.64 -0.73 0.61 113.55 118.62 1ovm h SER 56 Ca 0.22 -0.12 -0.05 0.00 -0.47 0.00 0.00 61.79 61.36 1ovm h SER 56 Cb 0.30 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 1ovm h SER 56 CO -0.32 0.72 0.02 1.88 -0.87 0.00 0.00 176.83 178.25 1ovm h TYR 57 N 0.77 0.65 -0.48 4.77 0.05 -0.25 -1.61 116.97 120.86 1ovm h TYR 57 Ca 0.17 -0.10 0.05 0.00 0.05 0.00 0.00 58.73 58.90 1ovm h TYR 57 Cb 0.26 -0.17 -0.05 0.00 1.01 0.00 0.00 36.73 37.79 1ovm h TYR 57 CO 0.01 0.69 0.22 0.00 -1.05 0.00 0.00 178.16 178.03 1ovm h ALA 58 N 0.87 0.60 -0.71 3.88 0.00 0.15 -0.46 119.26 123.60 1ovm h ALA 58 Ca 0.10 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1ovm h ALA 58 Cb 0.42 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1ovm h ALA 58 CO 0.01 -0.15 0.35 0.00 0.00 0.00 0.00 179.25 179.46 1ovm h ALA 59 N 1.28 1.27 -0.03 0.00 0.00 -0.75 0.52 119.26 121.56 1ovm h ALA 59 Ca 0.22 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ovm h ALA 59 Cb 0.17 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1ovm h ALA 59 CO -0.18 0.57 0.02 0.22 0.00 0.00 0.00 179.25 179.87 1ovm h ASP 60 N 1.01 0.04 -0.28 0.00 1.82 -0.26 0.22 116.42 118.97 1ovm h ASP 60 Ca 0.25 -0.11 0.03 0.00 -0.39 0.00 0.00 57.03 56.81 1ovm h ASP 60 Cb 0.09 -0.01 -0.03 0.00 0.68 0.00 0.00 39.33 40.06 1ovm h ASP 60 CO -0.03 0.15 0.08 1.23 -1.61 0.00 0.00 179.24 179.05 1ovm h GLY 61 N -0.06 0.33 0.40 -0.78 0.00 -0.72 -1.21 103.07 101.04 1ovm h GLY 61 Ca 0.01 -0.04 0.08 0.00 0.00 0.00 0.00 47.33 47.38 1ovm h GLY 61 CO -0.00 0.01 0.15 -1.82 0.00 0.00 0.00 176.54 174.88 1ovm h TYR 62 N 0.19 0.26 0.00 5.60 5.03 -0.71 -0.84 116.97 126.50 1ovm h TYR 62 Ca 0.13 0.03 -0.04 0.00 2.58 0.00 0.00 58.73 61.43 1ovm h TYR 62 Cb 0.11 -0.03 -0.01 0.00 1.55 0.00 0.00 36.73 38.35 1ovm h TYR 62 CO -0.15 0.04 -0.19 0.00 -1.32 0.00 0.00 178.16 176.55 1ovm h ALA 63 N 1.38 1.33 0.00 1.82 0.00 -0.37 -0.09 119.26 123.34 1ovm h ALA 63 Ca 0.26 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ovm h ALA 63 Cb 0.33 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1ovm h ALA 63 CO -0.30 0.24 0.00 0.54 0.00 0.00 0.00 179.25 179.72 1ovm n ARG 64 N -3.79 0.15 -0.10 0.00 1.74 -0.34 0.03 116.66 114.34 1ovm n ARG 64 Ca -0.02 0.08 -0.18 0.00 -0.77 0.00 0.00 57.85 56.96 1ovm n ARG 64 Cb 0.29 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.15 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 -3.56 1.69 -0.88 0.00 5.02 -0.16 -4.98 118.16 115.28 1ovm n LYS 66 Ca -0.37 -1.41 0.00 0.00 -2.02 0.00 0.00 58.31 54.50 1ovm n LYS 66 Cb 0.81 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 34.44 1ovm n LYS 66 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ovm n GLY 67 N 1.19 0.91 3.59 0.72 0.00 0.10 -4.92 105.19 106.77 1ovm n GLY 67 Ca 0.10 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.01 1ovm n GLY 67 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ovm s PHE 68 N -3.60 -0.42 0.17 1.61 2.19 -1.22 -4.71 117.98 112.00 1ovm s PHE 68 Ca 0.00 0.79 -0.17 0.00 0.33 0.00 0.00 56.93 57.88 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 -0.34 0.49 0.00 1.83 0.00 0.00 175.22 177.19 1ovm s ALA 69 N -0.83 -0.94 0.01 11.12 0.00 -0.91 -4.18 121.76 126.03 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 -0.06 0.00 0.00 0.00 0.00 175.76 174.96 1ovm s ALA 70 N -3.85 0.47 -0.02 0.00 0.00 -1.26 -0.34 121.76 116.76 1ovm s ALA 70 Ca 0.07 -0.44 0.05 0.00 0.00 0.00 0.00 51.96 51.65 1ovm s ALA 70 Cb -0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 1ovm s ALA 70 CO -0.06 0.05 -0.17 -1.17 0.00 0.00 0.00 175.76 174.41 1ovm s LEU 71 N -0.72 2.00 -0.14 0.00 2.96 0.14 -2.29 118.68 120.64 1ovm s LEU 71 Ca -0.03 -0.32 0.00 0.00 -0.22 0.00 0.00 54.13 53.56 1ovm s LEU 71 Cb -0.05 -0.90 0.02 0.00 0.50 0.00 0.00 46.19 45.76 1ovm s LEU 71 CO 0.00 0.20 -0.12 -0.22 -1.32 0.00 0.00 176.35 174.89 1ovm s LEU 72 N -0.31 1.59 0.40 -0.68 2.96 0.21 0.05 118.68 122.90 1ovm s LEU 72 Ca 0.04 -0.47 0.03 0.00 -0.22 0.00 0.00 54.13 53.52 1ovm s LEU 72 Cb -0.08 -1.09 -0.03 0.00 0.50 0.00 0.00 46.19 45.49 1ovm s LEU 72 CO -0.00 -0.08 0.10 0.42 -1.32 0.00 0.00 176.35 175.47 1ovm s THR 73 N 1.54 0.76 0.08 3.68 -4.23 -0.20 -2.74 115.64 114.53 1ovm s THR 73 Ca 0.05 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.59 1ovm s THR 73 Cb -0.13 -2.41 -0.04 0.00 1.34 0.00 0.00 72.50 71.26 1ovm s THR 73 CO -0.10 0.00 0.06 0.28 -0.54 0.00 0.00 174.62 174.32 1ovm s THR 74 N -3.20 4.38 0.15 3.99 -1.32 -1.26 -1.44 115.64 116.94 1ovm s THR 74 Ca 0.24 -0.83 -0.33 0.00 -1.21 0.00 0.00 61.69 59.57 1ovm s THR 74 Cb 0.04 -3.10 -0.17 0.00 -1.51 0.00 0.00 72.50 67.75 1ovm s THR 74 CO 0.14 0.13 0.90 0.33 -2.21 0.00 0.00 174.62 173.90 1ovm n PHE 75 N 0.50 0.49 0.00 9.09 7.35 -0.49 -1.33 117.46 133.07 1ovm n PHE 75 Ca -0.09 0.88 0.00 0.00 -0.76 0.00 0.00 57.45 57.48 1ovm n PHE 75 Cb 0.52 -2.11 0.00 0.00 0.35 0.00 0.00 39.48 38.23 1ovm n PHE 75 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1ovm n GLY 76 N 1.81 1.06 0.36 7.13 0.00 -1.26 -3.94 105.19 110.35 1ovm n GLY 76 Ca 0.17 0.39 0.09 0.00 0.00 0.00 0.00 46.02 46.67 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 0.95 0.06 1.61 -1.51 -1.81 -1.17 116.25 114.38 1ovm h VAL 77 Ca 0.00 -0.25 -0.00 0.00 -1.23 0.00 0.00 66.70 65.22 1ovm h VAL 77 Cb 0.00 0.16 0.00 0.00 -2.13 0.00 0.00 31.29 29.32 1ovm h VAL 77 CO 0.00 0.13 -0.03 1.23 -1.23 0.00 0.00 177.57 177.67 1ovm h GLY 78 N 0.72 -0.09 1.01 5.19 0.00 -1.33 -3.24 103.07 105.34 1ovm h GLY 78 Ca 0.36 0.03 -0.00 0.00 0.00 0.00 0.00 47.33 47.73 1ovm h GLY 78 CO -0.14 -0.03 0.54 1.05 0.00 0.00 0.00 176.54 177.96 1ovm h GLU 79 N -0.96 1.18 -0.25 4.80 4.11 -1.29 -2.64 114.58 119.53 1ovm h GLU 79 Ca -0.01 -0.10 -0.09 0.00 0.07 0.00 0.00 59.36 59.23 1ovm h GLU 79 Cb 0.50 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1ovm h GLU 79 CO 0.01 0.81 -0.24 -0.07 0.07 0.00 0.00 179.01 179.60 1ovm h LEU 80 N 1.20 0.48 -2.30 3.06 3.38 -1.38 -2.20 115.31 117.54 1ovm h LEU 80 Ca 0.32 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1ovm h LEU 80 Cb -0.07 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 1ovm h LEU 80 CO -0.06 0.72 -0.05 0.28 0.09 0.00 0.00 178.44 179.42 1ovm h SER 81 N 0.43 0.00 0.06 -0.43 0.02 -1.50 -1.96 113.55 110.17 1ovm h SER 81 Ca 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 1ovm h SER 81 Cb 0.65 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1ovm h SER 81 CO 0.05 0.05 -0.30 0.00 -1.14 0.00 0.00 176.83 175.49 1ovm n ALA 82 N -2.24 3.16 -0.26 3.77 0.00 -0.85 -3.74 120.51 120.36 1ovm n ALA 82 Ca -0.02 -0.55 -0.01 0.00 0.00 0.00 0.00 53.44 52.85 1ovm n ALA 82 Cb 0.15 -0.94 0.05 0.00 0.00 0.00 0.00 19.45 18.71 1ovm n ALA 82 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1ovm h MET 83 N 2.34 -0.07 -0.28 0.00 2.07 -1.15 0.49 114.93 118.34 1ovm h MET 83 Ca 0.00 0.00 -0.00 0.00 -2.07 0.00 0.00 59.70 57.63 1ovm h MET 83 Cb 0.68 0.02 -0.01 0.00 -1.87 0.00 0.00 31.60 30.41 1ovm h MET 83 CO 0.00 -0.04 0.17 -0.97 1.07 0.00 0.00 176.91 177.13 1ovm h ASN 84 N -0.07 0.32 0.22 1.22 -0.00 -1.81 -0.86 115.58 114.61 1ovm h ASN 84 Ca 0.31 -0.01 -0.01 0.00 -0.00 0.00 0.00 56.30 56.59 1ovm h ASN 84 Cb 0.56 -0.08 0.00 0.00 -0.00 0.00 0.00 38.32 38.80 1ovm h ASN 84 CO -0.77 0.25 -0.11 1.23 -0.00 0.00 0.00 177.43 178.03 1ovm h GLY 85 N 0.41 -0.31 0.77 1.57 0.00 -1.24 -1.95 103.07 102.32 1ovm h GLY 85 Ca 0.10 0.12 0.05 0.00 0.00 0.00 0.00 47.33 47.59 1ovm h GLY 85 CO -0.02 -0.11 0.39 -2.22 0.00 0.00 0.00 176.54 174.58 1ovm h ILE 86 N -0.71 1.02 -0.56 2.60 1.08 -1.16 -0.82 117.51 118.96 1ovm h ILE 86 Ca -0.03 -0.25 0.08 0.00 -0.39 0.00 0.00 64.86 64.27 1ovm h ILE 86 Cb 0.49 0.21 -0.07 0.00 -3.07 0.00 0.00 36.82 34.39 1ovm h ILE 86 CO 0.05 0.14 0.21 0.00 -0.69 0.00 0.00 178.15 177.85 1ovm h ALA 87 N 1.32 0.71 -0.75 1.87 0.00 -1.15 0.23 119.26 121.49 1ovm h ALA 87 Ca 0.28 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1ovm h ALA 87 Cb 0.11 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1ovm h ALA 87 CO -0.15 -0.20 0.40 0.78 0.00 0.00 0.00 179.25 180.09 1ovm h GLY 88 N 0.39 1.12 0.98 0.00 0.00 -0.47 0.19 103.07 105.28 1ovm h GLY 88 Ca 0.28 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 1ovm h GLY 88 CO -0.28 0.50 0.26 1.76 0.00 0.00 0.00 176.54 178.78 1ovm h SER 89 N 1.04 0.70 -0.55 0.19 0.02 0.10 -0.83 113.55 114.23 1ovm h SER 89 Ca 0.26 -0.13 -0.05 0.00 -0.84 0.00 0.00 61.79 61.04 1ovm h SER 89 Cb 0.05 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 1ovm h SER 89 CO -0.04 0.63 0.16 0.22 -1.14 0.00 0.00 176.83 176.66 1ovm h TYR 90 N 0.72 0.89 -0.74 3.45 5.03 -0.12 0.24 116.97 126.44 1ovm h TYR 90 Ca 0.18 -0.09 -0.02 0.00 2.58 0.00 0.00 58.73 61.38 1ovm h TYR 90 Cb 0.11 -0.26 -0.03 0.00 1.55 0.00 0.00 36.73 38.10 1ovm h TYR 90 CO -0.01 0.76 0.37 0.00 -1.32 0.00 0.00 178.16 177.96 1ovm h ALA 91 N 1.03 1.25 -0.43 1.82 0.00 -0.27 -2.97 119.26 119.69 1ovm h ALA 91 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ovm h ALA 91 Cb 0.30 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ovm h ALA 91 CO -0.00 0.58 0.00 0.39 0.00 0.00 0.00 179.25 180.22 1ovm n GLU 92 N -4.33 3.95 -3.51 0.00 1.02 -0.35 -4.91 120.64 112.51 1ovm n GLU 92 Ca 0.07 -3.00 -0.24 0.00 -0.02 0.00 0.00 57.16 53.97 1ovm n GLU 92 Cb 0.13 -2.05 0.05 0.00 -0.02 0.00 0.00 31.44 29.55 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 0.13 -2.13 -4.00 -0.32 8.25 -0.24 -5.00 115.22 111.92 1ovm n HIS 93 Ca 0.25 0.65 -0.34 0.00 -0.26 0.00 0.00 57.72 58.02 1ovm n HIS 93 Cb 1.04 -3.81 -0.15 0.00 1.12 0.00 0.00 29.99 28.20 1ovm n HIS 93 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1ovm s VAL 94 N -3.45 2.67 -1.02 1.59 1.01 0.68 -4.66 120.40 117.20 1ovm s VAL 94 Ca 0.42 -1.03 -0.24 0.00 0.00 0.00 0.00 61.98 61.13 1ovm s VAL 94 Cb -0.11 -2.32 -0.09 0.00 0.00 0.00 0.00 36.38 33.86 1ovm s VAL 94 CO 0.81 0.27 2.01 -2.16 0.00 0.00 0.00 175.10 176.03 1ovm s PRO 95 N 1.31 2.27 -0.17 2.72 0.04 -1.25 -3.45 135.00 136.47 1ovm s PRO 95 Ca 0.01 -0.57 -0.03 0.00 0.04 0.00 0.00 61.00 60.45 1ovm s PRO 95 Cb -0.16 -5.10 -0.02 0.00 0.04 0.00 0.00 34.50 29.27 1ovm s PRO 95 CO -0.06 -3.98 -0.07 0.08 0.04 0.00 0.00 177.00 173.00 1ovm s VAL 96 N 11.78 3.39 -0.17 -0.36 1.01 -1.26 -2.15 120.40 132.64 1ovm s VAL 96 Ca 0.73 -0.52 -0.19 0.00 0.00 0.00 0.00 61.98 62.01 1ovm s VAL 96 Cb -0.05 -2.49 -0.03 0.00 0.00 0.00 0.00 36.38 33.81 1ovm s VAL 96 CO 0.08 0.48 0.52 -0.22 0.00 0.00 0.00 175.10 175.96 1ovm s LEU 97 N 0.81 4.19 -0.31 3.92 2.96 0.54 -1.77 118.68 129.03 1ovm s LEU 97 Ca -0.02 0.75 -0.08 0.00 -0.22 0.00 0.00 54.13 54.55 1ovm s LEU 97 Cb -0.15 -2.73 0.00 0.00 0.50 0.00 0.00 46.19 43.81 1ovm s LEU 97 CO 0.01 -0.13 0.13 -2.28 -1.32 0.00 0.00 176.35 172.76 1ovm s HIS 98 N 1.31 3.17 -0.20 5.38 5.65 0.07 0.29 115.29 130.95 1ovm s HIS 98 Ca 0.26 -0.79 -0.05 0.00 0.25 0.00 0.00 55.06 54.72 1ovm s HIS 98 Cb -0.15 -2.32 -0.03 0.00 -1.18 0.00 0.00 32.58 28.90 1ovm s HIS 98 CO 0.10 -0.53 0.01 0.42 -0.65 0.00 0.00 174.74 174.09 1ovm s ILE 99 N 1.56 4.06 -0.18 0.89 1.01 0.11 -1.03 121.20 127.61 1ovm s ILE 99 Ca 0.03 -0.28 0.01 0.00 0.00 0.00 0.00 60.65 60.41 1ovm s ILE 99 Cb -0.17 -2.83 0.02 0.00 0.01 0.00 0.00 42.46 39.49 1ovm s ILE 99 CO 0.05 0.43 -0.19 0.54 0.00 0.00 0.00 174.94 175.76 1ovm s VAL 100 N 0.91 2.01 0.13 2.92 0.11 -0.56 -1.04 120.40 124.89 1ovm s VAL 100 Ca 0.01 -0.92 -0.31 0.00 -2.93 0.00 0.00 61.98 57.84 1ovm s VAL 100 Cb -0.14 -1.83 -0.07 0.00 -1.53 0.00 0.00 36.38 32.80 1ovm s VAL 100 CO 0.02 0.52 1.28 -0.83 -3.33 0.00 0.00 175.10 172.76 1ovm s GLY 101 N 1.31 2.32 0.25 6.54 0.00 -0.52 -0.90 107.32 116.31 1ovm s GLY 101 Ca 0.05 1.00 0.05 0.00 0.00 0.00 0.00 44.72 45.82 1ovm s GLY 101 CO -0.13 2.12 -0.02 0.00 0.00 0.00 0.00 173.10 175.07 1ovm s ALA 102 N 0.71 2.03 1.01 3.20 0.00 -0.51 -1.40 121.76 126.80 1ovm s ALA 102 Ca 0.59 -1.83 -0.12 0.00 0.00 0.00 0.00 51.96 50.60 1ovm s ALA 102 Cb -0.34 0.40 0.17 0.00 0.00 0.00 0.00 23.12 23.34 1ovm s ALA 102 CO 0.32 -0.19 0.90 -2.30 0.00 0.00 0.00 175.76 174.49 1ovm n PRO 103 N -0.49 -1.07 -1.98 0.00 -0.02 -1.26 -0.82 135.00 129.36 1ovm n PRO 103 Ca -0.05 -0.26 -0.37 0.00 -2.02 0.00 0.00 63.50 60.80 1ovm n PRO 103 Cb 0.64 -2.18 0.03 0.00 -0.02 0.00 0.00 33.50 31.97 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 -2.41 2.79 0.28 -1.23 0.00 -1.26 -4.06 107.32 101.44 1ovm s GLY 104 Ca 0.65 1.09 0.02 0.00 0.00 0.00 0.00 44.72 46.48 1ovm s GLY 104 CO 0.62 1.52 1.78 -0.91 0.00 0.00 0.00 173.10 176.11 1ovm h THR 105 N 1.15 0.74 -0.39 0.90 1.35 -1.92 -1.03 112.91 113.71 1ovm h THR 105 Ca -0.50 -0.25 -0.03 0.00 -0.55 0.00 0.00 66.41 65.08 1ovm h THR 105 Cb 1.29 -0.05 -0.02 0.00 -1.73 0.00 0.00 68.15 67.64 1ovm h THR 105 CO 0.56 0.13 0.12 0.00 -0.25 0.00 0.00 175.52 176.09 1ovm h ALA 106 N 1.60 0.51 -0.74 6.62 0.00 -1.99 -1.10 119.26 124.15 1ovm h ALA 106 Ca 0.52 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.26 1ovm h ALA 106 Cb 0.75 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1ovm h ALA 106 CO -0.36 0.16 0.45 0.00 0.00 0.00 0.00 179.25 179.49 1ovm h ALA 107 N 0.97 1.39 -0.33 0.00 0.00 -1.61 -1.65 119.26 118.03 1ovm h ALA 107 Ca 0.13 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1ovm h ALA 107 Cb 0.25 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1ovm h ALA 107 CO -0.00 0.53 -0.15 1.96 0.00 0.00 0.00 179.25 181.59 1ovm h GLN 108 N 1.02 0.68 -0.77 0.00 4.20 -0.92 -2.83 115.11 116.49 1ovm h GLN 108 Ca 0.27 -0.29 0.03 0.00 0.06 0.00 0.00 58.65 58.72 1ovm h GLN 108 Cb -0.04 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.67 1ovm h GLN 108 CO -0.05 0.89 0.51 1.96 -0.67 0.00 0.00 178.83 181.46 1ovm h GLN 109 N 0.45 0.92 0.00 1.46 1.08 -0.73 -1.09 115.11 117.21 1ovm h GLN 109 Ca 0.08 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1ovm h GLN 109 Cb 0.67 -0.21 0.00 0.00 -0.05 0.00 0.00 27.48 27.90 1ovm h GLN 109 CO 0.05 0.61 0.00 0.00 -0.95 0.00 0.00 178.83 178.53 1ovm h ARG 110 N 0.95 0.00 -5.83 1.46 3.08 -1.08 -3.47 114.38 109.49 1ovm h ARG 110 Ca 0.31 0.00 -0.38 0.00 0.07 0.00 0.00 59.98 59.97 1ovm h ARG 110 Cb 0.04 0.00 0.14 0.00 0.08 0.00 0.00 29.97 30.23 1ovm h ARG 110 CO -0.09 0.00 -0.72 0.41 -1.07 0.00 0.00 179.97 178.51 1ovm n GLY 111 N -0.04 -0.48 3.84 0.04 0.00 -0.41 -4.98 105.19 103.15 1ovm n GLY 111 Ca 0.02 0.21 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 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 -6.05 3.04 -1.37 1.61 2.02 -1.24 -4.30 118.70 112.41 1ovm s GLU 112 Ca 0.41 0.81 -0.13 0.00 0.02 0.00 0.00 54.97 56.08 1ovm s GLU 112 Cb -0.18 -2.01 0.09 0.00 0.10 0.00 0.00 34.13 32.13 1ovm s GLU 112 CO 0.74 -0.99 2.01 1.28 0.02 0.00 0.00 175.26 178.33 1ovm n LEU 113 N -3.04 6.49 -4.85 1.80 4.77 -1.26 -4.35 117.00 116.57 1ovm n LEU 113 Ca 0.07 -4.30 -0.32 0.00 -0.03 0.00 0.00 56.01 51.43 1ovm n LEU 113 Cb 0.54 -1.61 -0.06 0.00 -2.33 0.00 0.00 43.42 39.97 1ovm n LEU 113 CO 0.57 1.07 0.46 -0.76 -1.33 0.00 0.00 177.39 177.40 1ovm s LEU 114 N 1.62 3.99 0.67 2.23 1.02 -1.26 -5.04 118.68 121.91 1ovm s LEU 114 Ca 0.45 1.32 -0.16 0.00 0.02 0.00 0.00 54.13 55.76 1ovm s LEU 114 Cb 0.10 -4.15 0.01 0.00 0.02 0.00 0.00 46.19 42.17 1ovm s LEU 114 CO -0.04 -0.27 1.17 -1.38 0.02 0.00 0.00 176.35 175.86 1ovm s HIS 115 N -2.10 2.32 -0.47 0.29 -3.43 -1.26 -3.04 115.29 107.60 1ovm s HIS 115 Ca 0.55 1.57 0.00 0.00 -0.80 0.00 0.00 55.06 56.38 1ovm s HIS 115 Cb -0.10 -3.37 0.00 0.00 -1.43 0.00 0.00 32.58 27.68 1ovm s HIS 115 CO 0.20 -2.20 0.00 0.72 -2.00 0.00 0.00 174.74 171.46 1ovm n HIS 116 N -2.33 -0.02 -4.56 0.38 8.25 -1.26 -5.03 115.22 110.65 1ovm n HIS 116 Ca 0.12 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.33 1ovm n HIS 116 Cb 0.51 -1.19 -0.10 0.00 1.12 0.00 0.00 29.99 30.32 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 -2.17 1.47 -2.01 1.59 -4.23 -1.17 -4.26 115.64 104.86 1ovm s THR 117 Ca 0.00 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 58.81 1ovm s THR 117 Cb 0.00 -2.78 0.86 0.00 1.34 0.00 0.00 72.50 71.92 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 -0.88 0.02 -0.22 4.79 4.32 -1.26 -4.88 117.00 118.89 1ovm n LEU 118 Ca -0.05 -0.01 -0.02 0.00 -0.02 0.00 0.00 56.01 55.91 1ovm n LEU 118 Cb 0.67 -0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 42.46 1ovm n LEU 118 CO 0.44 0.00 -0.03 0.61 -1.22 0.00 0.00 177.39 177.20 1ovm n GLY 119 N 0.98 0.37 0.00 -0.72 0.00 -1.26 -4.94 105.19 99.62 1ovm n GLY 119 Ca 0.23 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1ovm n GLY 119 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ovm n ASP 120 N 1.61 1.47 -0.04 1.61 5.75 -1.26 -5.00 116.55 120.69 1ovm n ASP 120 Ca -0.02 -1.67 -0.01 0.00 -0.01 0.00 0.00 54.79 53.08 1ovm n ASP 120 Cb 0.37 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.46 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 -0.33 0.39 3.77 6.12 0.00 -1.26 -5.01 105.19 108.87 1ovm n GLY 121 Ca 0.00 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.78 3.86 0.00 1.61 0.41 -1.26 -4.45 118.70 118.09 1ovm s GLU 122 Ca 0.00 -0.21 0.00 0.00 -0.41 0.00 0.00 54.97 54.35 1ovm s GLU 122 Cb 0.00 -3.29 0.01 0.00 -1.78 0.00 0.00 34.13 29.07 1ovm s GLU 122 CO 0.00 0.48 0.90 1.19 -0.49 0.00 0.00 175.26 177.33 1ovm n PHE 123 N 2.94 0.01 0.26 1.61 3.01 -1.26 -4.65 117.46 119.38 1ovm n PHE 123 Ca -0.18 -0.39 0.06 0.00 1.01 0.00 0.00 57.45 57.96 1ovm n PHE 123 Cb 0.53 -0.04 0.09 0.00 -0.01 0.00 0.00 39.48 40.06 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 -0.36 1.50 0.21 -1.08 5.12 -1.26 -4.69 116.66 116.10 1ovm n ARG 124 Ca 0.00 -1.56 -0.16 0.00 -1.93 0.00 0.00 57.85 54.21 1ovm n ARG 124 Cb 0.20 -1.26 -0.08 0.00 -1.16 0.00 0.00 32.46 30.16 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 2.37 -1.11 -0.21 -1.55 3.86 -2.00 -1.32 115.15 115.18 1ovm h HIS 125 Ca 0.00 0.01 -0.07 0.00 -1.16 0.00 0.00 60.37 59.16 1ovm h HIS 125 Cb 0.60 0.45 -0.01 0.00 1.06 0.00 0.00 27.41 29.51 1ovm h HIS 125 CO 0.09 -0.54 -0.16 0.74 0.86 0.00 0.00 177.93 178.92 1ovm h PHE 126 N -0.77 0.37 -0.35 2.45 0.04 -1.95 -0.85 116.94 115.88 1ovm h PHE 126 Ca -0.02 -0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.69 1ovm h PHE 126 Cb 0.72 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.75 1ovm h PHE 126 CO -0.26 0.50 0.19 -0.92 -0.60 0.00 0.00 178.31 177.22 1ovm h TYR 127 N 0.32 0.48 -0.16 -0.55 3.20 -1.78 -1.96 116.97 116.52 1ovm h TYR 127 Ca 0.06 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.80 1ovm h TYR 127 Cb 0.48 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 1ovm h TYR 127 CO 0.01 0.38 -0.41 0.45 -1.64 0.00 0.00 178.16 176.95 1ovm h HIS 128 N 0.44 0.42 0.00 -3.82 3.86 -0.82 -2.69 115.15 112.54 1ovm h HIS 128 Ca 0.12 -0.12 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 1ovm h HIS 128 Cb 0.05 -0.09 -0.00 0.00 1.06 0.00 0.00 27.41 28.43 1ovm h HIS 128 CO -0.03 0.71 -0.09 0.52 0.86 0.00 0.00 177.93 179.90 1ovm h MET 129 N 0.30 0.00 -0.01 2.45 2.86 -0.77 -2.49 114.93 117.26 1ovm h MET 129 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1ovm h MET 129 Cb 0.85 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.51 1ovm h MET 129 CO 0.07 0.09 -0.27 0.45 1.06 0.00 0.00 176.91 178.31 1ovm n SER 130 N -3.47 1.14 -0.28 1.22 2.88 -0.77 -4.38 113.62 109.96 1ovm n SER 130 Ca -0.02 -0.97 -0.04 0.00 -1.33 0.00 0.00 58.87 56.52 1ovm n SER 130 Cb 0.23 0.17 0.12 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 1.36 1.15 0.00 -1.46 4.22 -1.42 -2.91 114.58 115.53 1ovm h GLU 131 Ca 0.00 -0.16 -0.01 0.00 0.08 0.00 0.00 59.36 59.27 1ovm h GLU 131 Cb 0.53 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.57 1ovm h GLU 131 CO 0.00 0.88 -0.03 -1.35 -2.18 0.00 0.00 179.01 176.34 1ovm h PRO 132 N 1.14 0.00 -0.37 0.92 0.11 -1.79 -3.15 132.00 128.86 1ovm h PRO 132 Ca 0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 1ovm h PRO 132 Cb 0.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.22 1ovm h PRO 132 CO -0.04 0.03 0.00 0.44 -0.21 0.00 0.00 178.00 178.22 1ovm n ILE 133 N -3.13 2.25 -4.14 4.15 -5.35 -1.10 -4.96 119.36 107.07 1ovm n ILE 133 Ca 0.00 -1.64 -0.11 0.00 -0.27 0.00 0.00 62.75 60.73 1ovm n ILE 133 Cb 0.31 -0.16 -0.10 0.00 -1.74 0.00 0.00 39.64 37.94 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 -2.57 0.67 -0.70 7.28 -4.23 -1.19 -4.56 115.64 110.33 1ovm s THR 134 Ca 0.44 -1.71 0.21 0.00 -1.18 0.00 0.00 61.69 59.45 1ovm s THR 134 Cb 0.34 -1.41 -0.25 0.00 1.34 0.00 0.00 72.50 72.52 1ovm s THR 134 CO 0.12 -0.74 0.79 1.33 -0.54 0.00 0.00 174.62 175.58 1ovm n VAL 135 N 0.35 0.01 -3.61 2.29 0.24 -0.61 -4.93 118.33 112.06 1ovm n VAL 135 Ca -0.15 -0.16 -0.15 0.00 -2.04 0.00 0.00 64.34 61.84 1ovm n VAL 135 Cb 0.59 0.66 -0.07 0.00 -1.47 0.00 0.00 33.84 33.55 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 -3.16 -1.71 0.17 2.33 0.00 -1.26 -4.99 121.76 113.14 1ovm s ALA 136 Ca 0.03 1.76 -0.14 0.00 0.00 0.00 0.00 51.96 53.61 1ovm s ALA 136 Cb 0.15 -0.81 0.02 0.00 0.00 0.00 0.00 23.12 22.48 1ovm s ALA 136 CO 0.88 -0.34 0.42 1.14 0.00 0.00 0.00 175.76 177.86 1ovm s GLN 137 N -0.08 1.24 -0.18 0.00 -2.07 -1.26 -1.25 119.66 116.06 1ovm s GLN 137 Ca -0.03 -0.94 -0.28 0.00 -1.82 0.00 0.00 55.36 52.29 1ovm s GLN 137 Cb -0.04 0.46 0.10 0.00 -1.09 0.00 0.00 33.01 32.45 1ovm s GLN 137 CO 0.03 -0.50 0.87 0.00 -1.32 0.00 0.00 175.29 174.38 1ovm s ALA 138 N -3.89 -1.87 -0.50 2.60 0.00 -0.49 -4.95 121.76 112.66 1ovm s ALA 138 Ca 0.10 1.66 -0.17 0.00 0.00 0.00 0.00 51.96 53.55 1ovm s ALA 138 Cb 0.01 -0.78 0.07 0.00 0.00 0.00 0.00 23.12 22.42 1ovm s ALA 138 CO -0.04 -0.31 0.51 0.08 0.00 0.00 0.00 175.76 176.00 1ovm s VAL 139 N -0.54 5.06 0.22 0.00 1.01 -1.26 -1.20 120.40 123.68 1ovm s VAL 139 Ca -0.03 -0.85 -0.31 0.00 0.00 0.00 0.00 61.98 60.80 1ovm s VAL 139 Cb -0.02 -4.23 -0.10 0.00 0.00 0.00 0.00 36.38 32.03 1ovm s VAL 139 CO 0.02 -0.72 1.48 -0.76 0.00 0.00 0.00 175.10 175.11 1ovm s LEU 140 N 2.11 4.38 0.24 3.92 1.02 -0.33 -4.95 118.68 125.07 1ovm s LEU 140 Ca 0.09 2.63 0.04 0.00 0.02 0.00 0.00 54.13 56.92 1ovm s LEU 140 Cb -0.23 -3.61 -0.05 0.00 0.02 0.00 0.00 46.19 42.32 1ovm s LEU 140 CO 0.09 -0.74 -0.02 0.42 0.02 0.00 0.00 176.35 176.12 1ovm s THR 141 N 0.41 1.21 0.59 5.49 -4.23 -1.26 -4.48 115.64 113.36 1ovm s THR 141 Ca 0.63 -2.06 0.30 0.00 -1.18 0.00 0.00 61.69 59.38 1ovm s THR 141 Cb -0.42 -2.37 0.36 0.00 1.34 0.00 0.00 72.50 71.40 1ovm s THR 141 CO 0.39 -0.32 2.24 -0.08 -0.54 0.00 0.00 174.62 176.31 1ovm h GLU 142 N 2.41 0.00 0.00 3.99 4.81 -1.96 -0.46 114.58 123.38 1ovm h GLU 142 Ca -0.39 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 1ovm h GLU 142 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1ovm h GLU 142 CO 0.65 0.00 -0.87 1.04 -0.73 0.00 0.00 179.01 179.10 1ovm n GLN 143 N -3.83 0.13 0.00 1.92 3.00 -1.26 -4.52 117.38 112.82 1ovm n GLN 143 Ca -0.03 -0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 1ovm n GLN 143 Cb 0.11 -1.54 0.00 0.00 0.00 0.00 0.00 30.24 28.81 1ovm n GLN 143 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1ovm n ASN 144 N -1.70 0.69 0.00 1.08 2.04 -0.93 -4.96 115.26 111.48 1ovm n ASN 144 Ca 0.03 -0.31 0.00 0.00 -0.44 0.00 0.00 54.58 53.86 1ovm n ASN 144 Cb 0.38 0.76 0.00 0.00 -2.53 0.00 0.00 39.78 38.39 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 -0.83 0.00 -0.09 -2.53 0.00 -0.23 -1.60 120.51 115.23 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 0.02 0.01 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 -0.09 0.00 -0.00 -1.84 -1.66 116.97 113.52 1ovm h TYR 147 Ca 0.16 0.00 -0.19 0.00 0.00 0.00 0.00 58.73 58.70 1ovm h TYR 147 Cb 0.19 0.00 0.01 0.00 0.00 0.00 0.00 36.73 36.93 1ovm h TYR 147 CO -0.20 0.34 -0.68 0.93 -0.00 0.00 0.00 178.16 178.55 1ovm h GLU 148 N 0.00 0.62 -0.64 0.10 4.39 -1.06 -1.21 114.58 116.79 1ovm h GLU 148 Ca -0.00 -0.55 0.04 0.00 0.34 0.00 0.00 59.36 59.19 1ovm h GLU 148 Cb 1.08 0.13 -0.05 0.00 -0.10 0.00 0.00 28.75 29.81 1ovm h GLU 148 CO 0.04 1.16 0.37 0.82 -1.16 0.00 0.00 179.01 180.25 1ovm h ILE 149 N 0.26 1.02 -0.21 3.13 2.04 -0.98 -1.55 117.51 121.21 1ovm h ILE 149 Ca -0.06 -0.24 -0.12 0.00 1.00 0.00 0.00 64.86 65.44 1ovm h ILE 149 Cb 1.33 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 1ovm h ILE 149 CO 0.14 0.13 -0.37 0.44 0.00 0.00 0.00 178.15 178.49 1ovm h ASP 150 N 0.71 0.49 0.11 1.72 3.32 -1.27 -2.89 116.42 118.61 1ovm h ASP 150 Ca 0.27 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 1ovm h ASP 150 Cb 0.11 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1ovm h ASP 150 CO -0.14 0.81 -0.05 -0.09 -1.72 0.00 0.00 179.24 178.05 1ovm h ARG 151 N 0.39 -0.14 -0.41 3.56 2.43 -0.33 -0.84 114.38 119.04 1ovm h ARG 151 Ca 0.04 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1ovm h ARG 151 Cb 0.82 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.39 1ovm h ARG 151 CO 0.07 0.12 0.17 -0.39 -1.51 0.00 0.00 179.97 178.44 1ovm h VAL 152 N -0.41 1.19 -0.69 0.20 -1.51 -1.36 -0.61 116.25 113.06 1ovm h VAL 152 Ca -0.02 -0.57 0.06 0.00 -1.23 0.00 0.00 66.70 64.94 1ovm h VAL 152 Cb 0.33 0.81 -0.05 0.00 -2.13 0.00 0.00 31.29 30.25 1ovm h VAL 152 CO 0.03 0.21 0.39 -0.07 -1.23 0.00 0.00 177.57 176.89 1ovm h LEU 153 N 0.51 0.59 -0.51 4.19 3.38 -1.52 0.18 115.31 122.13 1ovm h LEU 153 Ca 0.14 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1ovm h LEU 153 Cb 0.17 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1ovm h LEU 153 CO -0.01 0.38 0.20 0.74 0.09 0.00 0.00 178.44 179.84 1ovm h THR 154 N 0.72 1.21 -0.77 0.22 2.02 -0.76 -1.49 112.91 114.06 1ovm h THR 154 Ca 0.30 -0.67 -0.05 0.00 0.77 0.00 0.00 66.41 66.76 1ovm h THR 154 Cb 0.17 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 1ovm h THR 154 CO -0.17 0.25 0.27 0.74 0.37 0.00 0.00 175.52 176.98 1ovm h THR 155 N 0.69 1.26 -0.04 3.16 2.02 -0.38 -2.06 112.91 117.56 1ovm h THR 155 Ca 0.17 -0.87 0.02 0.00 0.77 0.00 0.00 66.41 66.50 1ovm h THR 155 Cb 0.20 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 1ovm h THR 155 CO -0.01 0.35 -0.11 0.24 0.37 0.00 0.00 175.52 176.36 1ovm h MET 156 N 1.14 -0.16 -0.16 6.66 2.07 -0.24 -0.68 114.93 123.56 1ovm h MET 156 Ca 0.25 0.01 -0.03 0.00 -2.07 0.00 0.00 59.70 57.87 1ovm h MET 156 Cb 0.27 0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 30.02 1ovm h MET 156 CO -0.01 -0.11 -0.03 -0.07 1.07 0.00 0.00 176.91 177.76 1ovm h LEU 157 N -0.17 0.21 0.05 1.22 4.07 -1.08 0.82 115.31 120.42 1ovm h LEU 157 Ca 0.06 -0.03 -0.00 0.00 0.08 0.00 0.00 57.88 57.99 1ovm h LEU 157 Cb 0.24 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 41.93 1ovm h LEU 157 CO -0.14 0.27 -0.02 -0.09 -1.08 0.00 0.00 178.44 177.38 1ovm h ARG 158 N 0.22 -0.06 0.00 1.13 2.43 -0.77 -3.33 114.38 114.00 1ovm h ARG 158 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1ovm h ARG 158 Cb 0.20 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1ovm h ARG 158 CO 0.01 0.51 -0.53 0.39 -1.51 0.00 0.00 179.97 178.83 1ovm n GLU 159 N -4.83 0.21 -3.26 0.20 -0.58 -0.32 -4.97 120.64 107.09 1ovm n GLU 159 Ca -0.09 0.07 -0.15 0.00 -0.42 0.00 0.00 57.16 56.57 1ovm n GLU 159 Cb 0.30 -1.64 0.08 0.00 -0.57 0.00 0.00 31.44 29.60 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 -1.96 -5.87 -4.19 3.49 5.12 0.28 -4.98 116.66 108.56 1ovm n ARG 160 Ca 0.04 0.75 -0.13 0.00 -1.93 0.00 0.00 57.85 56.58 1ovm n ARG 160 Cb 0.41 -5.46 -0.09 0.00 -1.16 0.00 0.00 32.46 26.16 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 -5.23 1.31 0.68 5.56 0.52 -1.16 -2.73 118.95 117.90 1ovm s ARG 161 Ca 0.02 -1.64 -0.16 0.00 -0.52 0.00 0.00 55.73 53.43 1ovm s ARG 161 Cb -0.01 0.30 0.01 0.00 0.52 0.00 0.00 34.95 35.77 1ovm s ARG 161 CO 0.64 -0.45 1.22 -2.14 0.02 0.00 0.00 175.30 174.59 1ovm s PRO 162 N -4.04 2.44 0.14 3.54 0.02 -1.22 -4.12 135.00 131.75 1ovm s PRO 162 Ca 0.37 1.81 0.05 0.00 0.02 0.00 0.00 61.00 63.25 1ovm s PRO 162 Cb 0.06 -1.86 -0.04 0.00 0.02 0.00 0.00 34.50 32.67 1ovm s PRO 162 CO 0.14 -1.62 -0.11 0.20 -0.33 0.00 0.00 177.00 175.27 1ovm s GLY 163 N -1.85 1.08 -0.03 0.52 0.00 -0.73 -1.58 107.32 104.73 1ovm s GLY 163 Ca 0.76 -1.43 0.01 0.00 0.00 0.00 0.00 44.72 44.07 1ovm s GLY 163 CO 0.41 -1.52 -0.05 -0.47 0.00 0.00 0.00 173.10 171.47 1ovm s TYR 164 N -2.92 0.73 -0.11 1.90 6.14 -0.38 -0.75 117.35 121.96 1ovm s TYR 164 Ca 0.14 -0.19 -0.01 0.00 0.64 0.00 0.00 57.07 57.65 1ovm s TYR 164 Cb -0.00 -0.61 0.03 0.00 0.42 0.00 0.00 41.96 41.80 1ovm s TYR 164 CO 0.02 -0.15 -0.04 -0.51 0.64 0.00 0.00 175.55 175.51 1ovm s LEU 165 N 0.64 0.99 -0.29 6.97 1.43 -0.20 -1.40 118.68 126.81 1ovm s LEU 165 Ca -0.09 -0.27 -0.18 0.00 -1.03 0.00 0.00 54.13 52.56 1ovm s LEU 165 Cb -0.12 -0.68 -0.02 0.00 0.03 0.00 0.00 46.19 45.40 1ovm s LEU 165 CO 0.00 -0.16 0.54 -0.32 0.23 0.00 0.00 176.35 176.64 1ovm s MET 166 N 1.81 3.93 -0.51 1.70 -2.45 -0.34 -1.49 119.30 121.95 1ovm s MET 166 Ca 0.04 0.21 -0.05 0.00 -1.25 0.00 0.00 55.69 54.64 1ovm s MET 166 Cb -0.13 -3.70 0.13 0.00 1.25 0.00 0.00 34.83 32.38 1ovm s MET 166 CO -0.07 -0.47 0.34 -1.17 1.05 0.00 0.00 175.02 174.70 1ovm s LEU 167 N 2.40 5.44 0.27 4.11 2.96 -0.08 -1.19 118.68 132.58 1ovm s LEU 167 Ca 0.21 -2.29 -0.30 0.00 -0.22 0.00 0.00 54.13 51.53 1ovm s LEU 167 Cb -0.15 -1.90 -0.11 0.00 0.50 0.00 0.00 46.19 44.53 1ovm s LEU 167 CO 0.11 -0.53 1.51 -2.84 -1.32 0.00 0.00 176.35 173.28 1ovm s PRO 168 N 0.77 4.20 0.28 0.98 0.02 -1.26 -1.42 135.00 138.57 1ovm s PRO 168 Ca 0.11 2.43 0.02 0.00 0.02 0.00 0.00 61.00 63.57 1ovm s PRO 168 Cb -0.22 -3.07 0.67 0.00 0.02 0.00 0.00 34.50 31.90 1ovm s PRO 168 CO -0.03 -0.52 1.68 0.00 -0.33 0.00 0.00 177.00 177.80 1ovm h ALA 169 N 5.01 1.31 -0.29 -1.55 0.00 -1.12 -0.75 119.26 121.87 1ovm h ALA 169 Ca -0.46 0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 1ovm h ALA 169 Cb 1.22 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 1ovm h ALA 169 CO 0.79 -0.37 -0.31 0.38 0.00 0.00 0.00 179.25 179.74 1ovm h ASP 170 N 0.33 0.62 -0.26 0.00 2.03 -1.87 -2.73 116.42 114.54 1ovm h ASP 170 Ca 0.53 -0.24 -0.05 0.00 -0.73 0.00 0.00 57.03 56.54 1ovm h ASP 170 Cb 1.00 -0.17 -0.02 0.00 -0.83 0.00 0.00 39.33 39.31 1ovm h ASP 170 CO -0.55 0.89 0.01 0.58 -1.03 0.00 0.00 179.24 179.14 1ovm h VAL 171 N 0.52 1.20 -0.43 4.15 2.07 -1.53 -2.24 116.25 119.99 1ovm h VAL 171 Ca 0.06 -0.81 0.03 0.00 0.82 0.00 0.00 66.70 66.80 1ovm h VAL 171 Cb 0.79 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1ovm h VAL 171 CO 0.06 0.28 0.29 0.00 0.02 0.00 0.00 177.57 178.22 1ovm h ALA 172 N 1.47 1.80 0.00 1.67 0.00 -1.07 -1.76 119.26 121.37 1ovm h ALA 172 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ovm h ALA 172 Cb 0.34 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ovm h ALA 172 CO 0.01 0.15 -0.04 0.87 0.00 0.00 0.00 179.25 180.24 1ovm h LYS 173 N 0.49 0.00 -6.95 0.00 1.57 -1.39 -2.29 116.57 107.99 1ovm h LYS 173 Ca 0.17 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.40 1ovm h LYS 173 Cb 0.09 0.00 0.13 0.00 0.08 0.00 0.00 32.23 32.53 1ovm h LYS 173 CO -0.04 0.00 0.61 1.63 -0.57 0.00 0.00 179.45 181.08 1ovm n LYS 174 N -2.29 2.01 -1.94 3.15 4.01 -0.66 -4.72 118.16 117.71 1ovm n LYS 174 Ca 0.05 0.72 -0.39 0.00 -0.51 0.00 0.00 58.31 58.18 1ovm n LYS 174 Cb 0.44 -2.54 0.01 0.00 -0.51 0.00 0.00 35.03 32.42 1ovm n LYS 174 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1ovm s ALA 175 N -1.22 3.16 0.17 7.82 0.00 -1.26 -0.84 121.76 129.60 1ovm s ALA 175 Ca 0.64 1.31 -0.12 0.00 0.00 0.00 0.00 51.96 53.79 1ovm s ALA 175 Cb -0.46 -3.53 0.01 0.00 0.00 0.00 0.00 23.12 19.14 1ovm s ALA 175 CO 0.55 -1.03 0.37 0.00 0.00 0.00 0.00 175.76 175.66 1ovm s ALA 176 N -1.27 -0.37 -0.04 0.00 0.00 -1.00 -4.63 121.76 114.44 1ovm s ALA 176 Ca 0.61 -0.62 0.06 0.00 0.00 0.00 0.00 51.96 52.01 1ovm s ALA 176 Cb -0.40 0.84 -0.02 0.00 0.00 0.00 0.00 23.12 23.55 1ovm s ALA 176 CO 0.50 -0.70 -0.22 -0.08 0.00 0.00 0.00 175.76 175.26 1ovm s THR 177 N -3.93 2.39 0.32 0.00 -1.32 -1.26 -4.43 115.64 107.41 1ovm s THR 177 Ca 0.14 -0.97 -0.28 0.00 -1.21 0.00 0.00 61.69 59.36 1ovm s THR 177 Cb 0.02 -1.88 -0.13 0.00 -1.51 0.00 0.00 72.50 69.00 1ovm s THR 177 CO -0.02 0.58 1.27 -2.65 -2.21 0.00 0.00 174.62 171.59 1ovm n PRO 178 N 2.59 2.00 -2.24 7.08 -0.02 -1.26 -4.94 135.00 138.22 1ovm n PRO 178 Ca -0.17 0.70 -0.40 0.00 -2.02 0.00 0.00 63.50 61.62 1ovm n PRO 178 Cb 0.52 -2.26 -0.02 0.00 -0.02 0.00 0.00 33.50 31.71 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 -1.61 4.27 0.08 0.52 0.02 -1.26 -4.94 135.00 132.09 1ovm s PRO 179 Ca 0.58 2.00 -0.00 0.00 0.02 0.00 0.00 61.00 63.60 1ovm s PRO 179 Cb -0.60 -2.93 -0.26 0.00 0.02 0.00 0.00 34.50 30.73 1ovm s PRO 179 CO 0.60 -0.19 1.16 0.28 -0.33 0.00 0.00 177.00 178.52 1ovm h VAL 180 N 2.75 1.54 -4.29 3.83 2.07 -2.07 -3.46 116.25 116.62 1ovm h VAL 180 Ca -0.48 -3.16 -0.64 0.00 0.82 0.00 0.00 66.70 63.24 1ovm h VAL 180 Cb 1.23 2.90 -0.27 0.00 -1.52 0.00 0.00 31.29 33.63 1ovm h VAL 180 CO 0.64 0.91 -0.86 0.20 0.02 0.00 0.00 177.57 178.48 1ovm s ASN 181 N -6.98 2.79 0.50 0.57 0.02 -1.26 -5.12 114.94 105.45 1ovm s ASN 181 Ca -0.03 -0.53 -0.22 0.00 -1.02 0.00 0.00 52.86 51.07 1ovm s ASN 181 Cb 0.08 -0.26 -0.06 0.00 0.02 0.00 0.00 41.25 41.03 1ovm s ASN 181 CO 0.86 0.23 1.18 0.00 0.02 0.00 0.00 177.10 179.39 1ovm s ALA 182 N -0.74 2.87 0.04 0.60 0.00 -1.26 -4.90 121.76 118.36 1ovm s ALA 182 Ca 0.09 0.96 -0.32 0.00 0.00 0.00 0.00 51.96 52.70 1ovm s ALA 182 Cb -0.09 -3.40 -0.11 0.00 0.00 0.00 0.00 23.12 19.52 1ovm s ALA 182 CO 0.01 -0.80 1.88 -0.11 0.00 0.00 0.00 175.76 176.74 1ovm n LEU 183 N -0.80 3.85 -4.86 0.00 7.94 -1.26 -4.94 117.00 116.93 1ovm n LEU 183 Ca 0.09 0.96 -0.32 0.00 -1.11 0.00 0.00 56.01 55.63 1ovm n LEU 183 Cb 0.48 -1.48 -0.06 0.00 0.53 0.00 0.00 43.42 42.90 1ovm n LEU 183 CO 0.47 0.09 0.29 0.42 -1.11 0.00 0.00 177.39 177.55 1ovm s THR 184 N 3.56 4.84 -0.10 1.96 -4.23 -1.26 -4.92 115.64 115.48 1ovm s THR 184 Ca 0.87 0.66 -0.07 0.00 -1.18 0.00 0.00 61.69 61.97 1ovm s THR 184 Cb -0.54 -3.62 -0.02 0.00 1.34 0.00 0.00 72.50 69.66 1ovm s THR 184 CO 0.43 -0.11 -0.13 1.41 -0.54 0.00 0.00 174.62 175.68 1ovm n HIS 185 N -0.20 0.61 -2.42 3.99 -0.00 -1.26 -5.01 115.22 110.94 1ovm n HIS 185 Ca 0.01 0.27 -0.21 0.00 -0.00 0.00 0.00 57.72 57.79 1ovm n HIS 185 Cb 0.53 -0.60 0.02 0.00 -0.00 0.00 0.00 29.99 29.94 1ovm n HIS 185 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 1ovm n LYS 186 N -3.90 -1.02 -2.56 -0.41 4.81 -1.26 -4.84 118.16 108.98 1ovm n LYS 186 Ca -0.05 0.74 -0.41 0.00 -0.87 0.00 0.00 58.31 57.72 1ovm n LYS 186 Cb 0.20 -1.08 -0.04 0.00 0.02 0.00 0.00 35.03 34.12 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 -1.48 4.64 0.64 1.64 -0.21 -1.26 -5.00 119.66 118.63 1ovm s GLN 187 Ca 0.19 1.68 -0.18 0.00 0.02 0.00 0.00 55.36 57.08 1ovm s GLN 187 Cb -0.02 -3.28 -0.01 0.00 1.00 0.00 0.00 33.01 30.70 1ovm s GLN 187 CO 0.47 0.15 1.25 0.00 -2.12 0.00 0.00 175.29 175.05 1ovm s ALA 188 N -0.44 2.39 0.61 6.09 0.00 -1.26 -5.02 121.76 124.13 1ovm s ALA 188 Ca 0.48 1.08 -0.07 0.00 0.00 0.00 0.00 51.96 53.45 1ovm s ALA 188 Cb -0.29 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.34 1ovm s ALA 188 CO 0.35 -1.50 0.94 -1.01 0.00 0.00 0.00 175.76 174.54 1ovm s HIS 189 N -1.57 3.28 0.52 0.00 3.76 -1.26 -4.82 115.29 115.18 1ovm s HIS 189 Ca 0.79 0.74 -0.13 0.00 -0.15 0.00 0.00 55.06 56.31 1ovm s HIS 189 Cb -0.33 -2.80 -0.06 0.00 1.11 0.00 0.00 32.58 30.49 1ovm s HIS 189 CO 0.38 -0.89 0.94 0.00 -0.85 0.00 0.00 174.74 174.32 1ovm s ALA 190 N -3.07 3.15 0.04 -1.40 0.00 -1.26 -4.95 121.76 114.27 1ovm s ALA 190 Ca 0.55 -0.00 -0.30 0.00 0.00 0.00 0.00 51.96 52.20 1ovm s ALA 190 Cb -0.11 -2.99 -0.07 0.00 0.00 0.00 0.00 23.12 19.95 1ovm s ALA 190 CO 0.47 -0.31 1.61 0.34 0.00 0.00 0.00 175.76 177.87 1ovm s ASP 191 N -3.41 6.66 0.26 0.00 2.15 -1.26 -4.88 116.67 116.19 1ovm s ASP 191 Ca 0.56 2.38 -0.02 0.00 0.43 0.00 0.00 52.55 55.89 1ovm s ASP 191 Cb -0.10 -2.56 0.55 0.00 -0.30 0.00 0.00 42.92 40.51 1ovm s ASP 191 CO 0.37 -0.86 1.67 0.77 -0.17 0.00 0.00 175.17 176.96 1ovm h SER 192 N 8.45 0.02 -0.83 -0.34 4.64 -1.98 -0.47 113.55 123.05 1ovm h SER 192 Ca -0.41 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1ovm h SER 192 Cb 1.19 0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 63.46 1ovm h SER 192 CO 0.93 -0.07 0.53 0.00 -0.87 0.00 0.00 176.83 177.35 1ovm h ALA 193 N 1.67 1.05 -0.36 5.18 0.00 -2.00 -0.48 119.26 124.33 1ovm h ALA 193 Ca 0.47 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.21 1ovm h ALA 193 Cb 0.85 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1ovm h ALA 193 CO -0.56 0.48 -0.17 0.00 0.00 0.00 0.00 179.25 178.99 1ovm h LEU 195 N 0.55 0.46 -0.02 0.00 5.85 -0.91 -1.41 115.31 119.81 1ovm h LEU 195 Ca 0.08 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 1ovm h LEU 195 Cb 0.72 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.63 1ovm h LEU 195 CO 0.05 0.46 0.00 0.50 -0.34 0.00 0.00 178.44 179.11 1ovm h LYS 196 N 0.50 0.04 -0.94 1.25 3.11 -0.84 0.34 116.57 120.04 1ovm h LYS 196 Ca 0.12 -0.01 0.09 0.00 -2.81 0.00 0.00 60.65 58.04 1ovm h LYS 196 Cb 0.18 -0.00 -0.07 0.00 -1.00 0.00 0.00 32.23 31.33 1ovm h LYS 196 CO -0.01 0.32 0.58 0.00 -2.81 0.00 0.00 179.45 177.53 1ovm h ALA 197 N 0.72 1.34 -0.27 5.00 0.00 -0.88 0.24 119.26 125.41 1ovm h ALA 197 Ca 0.01 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1ovm h ALA 197 Cb 0.30 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1ovm h ALA 197 CO 0.00 0.27 -0.03 0.35 0.00 0.00 0.00 179.25 179.83 1ovm h PHE 198 N 0.99 0.55 -0.17 0.00 3.57 -1.07 -2.21 116.94 118.60 1ovm h PHE 198 Ca 0.43 -0.11 0.02 0.00 3.53 0.00 0.00 57.97 61.85 1ovm h PHE 198 Cb 0.31 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 1ovm h PHE 198 CO -0.02 0.68 0.04 -0.09 -2.23 0.00 0.00 178.31 176.69 1ovm h ARG 199 N 0.26 0.12 -0.70 1.11 2.43 0.33 -0.19 114.38 117.73 1ovm h ARG 199 Ca 0.07 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.24 1ovm h ARG 199 Cb 0.49 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.97 1ovm h ARG 199 CO 0.02 0.08 0.47 -0.44 -1.51 0.00 0.00 179.97 178.58 1ovm h ASP 200 N 0.12 0.80 -0.49 -3.80 3.32 -0.56 0.10 116.42 115.92 1ovm h ASP 200 Ca 0.08 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 1ovm h ASP 200 Cb 0.06 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 1ovm h ASP 200 CO -0.09 0.58 0.06 0.00 -1.72 0.00 0.00 179.24 178.06 1ovm h ALA 201 N 1.26 0.65 -0.32 3.45 0.00 -1.10 -2.29 119.26 120.91 1ovm h ALA 201 Ca 0.26 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1ovm h ALA 201 Cb -0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1ovm h ALA 201 CO -0.06 0.40 0.12 0.00 0.00 0.00 0.00 179.25 179.71 1ovm h ALA 202 N 0.95 0.41 0.20 0.00 0.00 -0.63 -2.78 119.26 117.41 1ovm h ALA 202 Ca 0.14 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ovm h ALA 202 Cb 0.43 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1ovm h ALA 202 CO 0.01 0.02 -0.26 1.49 0.00 0.00 0.00 179.25 180.52 1ovm h GLU 203 N 0.36 -0.49 -0.98 0.00 4.81 -0.89 0.87 114.58 118.26 1ovm h GLU 203 Ca 0.11 0.03 0.19 0.00 -0.13 0.00 0.00 59.36 59.56 1ovm h GLU 203 Cb 0.20 0.11 -0.09 0.00 0.63 0.00 0.00 28.75 29.60 1ovm h GLU 203 CO -0.01 -0.33 0.61 -0.91 -0.73 0.00 0.00 179.01 177.65 1ovm h ASN 204 N -0.51 0.66 -0.04 1.04 4.21 -1.39 0.62 115.58 120.17 1ovm h ASN 204 Ca 0.01 0.08 -0.03 0.00 1.21 0.00 0.00 56.30 57.57 1ovm h ASN 204 Cb 0.50 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.65 1ovm h ASN 204 CO -0.09 0.25 -0.08 0.50 -1.29 0.00 0.00 177.43 176.72 1ovm h LYS 205 N 0.65 0.12 0.00 0.81 1.63 -1.09 -3.26 116.57 115.43 1ovm h LYS 205 Ca 0.54 -0.08 -0.08 0.00 -0.85 0.00 0.00 60.65 60.19 1ovm h LYS 205 Cb 0.99 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.62 1ovm h LYS 205 CO -0.30 0.65 -0.37 -0.07 -3.45 0.00 0.00 179.45 175.91 1ovm h LEU 206 N -0.40 0.00 -1.81 5.20 4.07 0.04 -3.06 115.31 119.35 1ovm h LEU 206 Ca 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.93 1ovm h LEU 206 Cb 0.65 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.39 1ovm h LEU 206 CO 0.02 0.37 -0.15 0.00 -1.08 0.00 0.00 178.44 177.60 1ovm h ALA 207 N 1.63 1.50 -0.29 1.53 0.00 0.17 -2.64 119.26 121.16 1ovm h ALA 207 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ovm h ALA 207 Cb 0.80 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1ovm h ALA 207 CO 0.05 0.18 0.00 -1.33 0.00 0.00 0.00 179.25 178.15 1ovm n MET 208 N -4.00 2.13 -2.66 0.00 2.81 -1.16 -4.98 117.12 109.27 1ovm n MET 208 Ca -0.02 -1.91 -0.42 0.00 -1.81 0.00 0.00 57.70 53.53 1ovm n MET 208 Cb 0.23 -1.34 -0.03 0.00 -0.71 0.00 0.00 33.22 31.38 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 -1.12 7.25 -0.03 7.83 0.15 -1.00 -4.95 113.70 121.84 1ovm s SER 209 Ca 0.26 1.61 -0.26 0.00 0.70 0.00 0.00 55.95 58.27 1ovm s SER 209 Cb 0.15 -2.56 -0.20 0.00 -1.71 0.00 0.00 66.02 61.70 1ovm s SER 209 CO 0.21 -0.42 1.22 0.11 1.20 0.00 0.00 173.24 175.56 1ovm h LYS 210 N 7.06 -0.02 -4.16 5.44 1.79 -1.93 -3.45 116.57 121.29 1ovm h LYS 210 Ca -0.34 0.00 -0.25 0.00 -2.18 0.00 0.00 60.65 57.88 1ovm h LYS 210 Cb 1.17 0.01 -0.25 0.00 -1.58 0.00 0.00 32.23 31.58 1ovm h LYS 210 CO 0.83 0.48 -0.73 0.50 -1.08 0.00 0.00 179.45 179.46 1ovm s ARG 211 N -4.12 0.32 0.02 3.15 3.52 -1.26 -4.94 118.95 115.64 1ovm s ARG 211 Ca -0.16 -0.39 0.07 0.00 -0.13 0.00 0.00 55.73 55.12 1ovm s ARG 211 Cb 0.01 -0.15 -0.02 0.00 -1.56 0.00 0.00 34.95 33.23 1ovm s ARG 211 CO 0.66 0.03 -0.22 0.99 -0.81 0.00 0.00 175.30 175.95 1ovm s THR 212 N -0.74 1.73 0.11 4.11 2.01 -1.26 -2.80 115.64 118.81 1ovm s THR 212 Ca -0.06 -1.10 0.07 0.00 0.31 0.00 0.00 61.69 60.91 1ovm s THR 212 Cb -0.06 -1.48 -0.04 0.00 0.01 0.00 0.00 72.50 70.94 1ovm s THR 212 CO -0.00 0.34 -0.17 0.00 -0.69 0.00 0.00 174.62 174.10 1ovm s ALA 213 N -0.67 1.59 -0.16 7.40 0.00 -0.83 -4.07 121.76 125.00 1ovm s ALA 213 Ca 0.08 -1.25 -0.01 0.00 0.00 0.00 0.00 51.96 50.79 1ovm s ALA 213 Cb -0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 1ovm s ALA 213 CO 0.01 0.21 -0.12 -1.17 0.00 0.00 0.00 175.76 174.68 1ovm s LEU 214 N -2.18 2.65 -0.20 0.00 0.20 0.04 0.02 118.68 119.21 1ovm s LEU 214 Ca 0.07 -0.41 0.01 0.00 0.69 0.00 0.00 54.13 54.49 1ovm s LEU 214 Cb -0.07 -1.62 0.04 0.00 -0.43 0.00 0.00 46.19 44.11 1ovm s LEU 214 CO 0.04 0.08 -0.11 -0.22 -0.29 0.00 0.00 176.35 175.85 1ovm s LEU 215 N 0.85 2.36 0.08 -0.68 2.96 0.26 -0.93 118.68 123.57 1ovm s LEU 215 Ca -0.04 -0.90 0.08 0.00 -0.22 0.00 0.00 54.13 53.05 1ovm s LEU 215 Cb -0.15 -1.29 -0.03 0.00 0.50 0.00 0.00 46.19 45.22 1ovm s LEU 215 CO 0.00 -0.13 -0.21 0.00 -1.32 0.00 0.00 176.35 174.69 1ovm s ALA 216 N 1.36 1.79 0.18 5.97 0.00 -0.50 0.15 121.76 130.71 1ovm s ALA 216 Ca -0.01 -1.18 0.04 0.00 0.00 0.00 0.00 51.96 50.81 1ovm s ALA 216 Cb -0.16 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.66 1ovm s ALA 216 CO -0.08 0.37 0.14 -3.47 0.00 0.00 0.00 175.76 172.72 1ovm n ASP 217 N 1.37 -0.10 -0.33 0.00 2.03 -0.12 -3.70 116.55 115.70 1ovm n ASP 217 Ca -0.19 -2.17 0.29 0.00 0.52 0.00 0.00 54.79 53.25 1ovm n ASP 217 Cb 0.53 0.83 0.50 0.00 -0.72 0.00 0.00 41.12 42.27 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 -0.37 0.66 0.14 -0.67 -1.74 -1.25 -1.24 117.46 112.99 1ovm n PHE 218 Ca 0.03 0.66 0.13 0.00 -0.56 0.00 0.00 57.45 57.72 1ovm n PHE 218 Cb 0.32 -1.08 0.66 0.00 1.52 0.00 0.00 39.48 40.90 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 0.01 -0.69 5.98 3.38 -1.87 0.12 115.31 122.24 1ovm h LEU 219 Ca 0.68 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.51 1ovm h LEU 219 Cb 2.06 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.80 1ovm h LEU 219 CO -0.44 0.00 -0.58 -0.37 0.09 0.00 0.00 178.44 177.15 1ovm h VAL 220 N 0.01 1.38 -0.26 1.22 -1.51 -1.41 -1.47 116.25 114.21 1ovm h VAL 220 Ca 0.12 -1.94 -0.03 0.00 -1.23 0.00 0.00 66.70 63.62 1ovm h VAL 220 Cb 0.45 1.97 -0.01 0.00 -2.13 0.00 0.00 31.29 31.58 1ovm h VAL 220 CO -0.00 0.57 0.04 -0.07 -1.23 0.00 0.00 177.57 176.88 1ovm h LEU 221 N 0.17 0.41 -1.26 4.19 3.38 -0.97 -0.52 115.31 120.71 1ovm h LEU 221 Ca -0.00 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 1ovm h LEU 221 Cb 1.07 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1ovm h LEU 221 CO 0.09 0.57 0.14 0.03 0.09 0.00 0.00 178.44 179.36 1ovm h ARG 222 N 0.24 0.65 -0.77 1.13 2.47 -1.05 -2.65 114.38 114.40 1ovm h ARG 222 Ca 0.08 -0.10 -0.12 0.00 -1.26 0.00 0.00 59.98 58.57 1ovm h ARG 222 Cb 0.33 -0.11 -0.07 0.00 -1.65 0.00 0.00 29.97 28.47 1ovm h ARG 222 CO 0.01 0.57 0.16 0.72 0.56 0.00 0.00 179.97 181.98 1ovm n HIS 223 N -4.33 1.90 -3.91 3.04 8.25 -0.57 -4.94 115.22 114.67 1ovm n HIS 223 Ca 0.03 -0.88 -0.28 0.00 -0.26 0.00 0.00 57.72 56.33 1ovm n HIS 223 Cb 0.18 -0.54 0.01 0.00 1.12 0.00 0.00 29.99 30.76 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 0.10 -0.39 0.59 -1.41 0.00 -1.00 -4.90 105.19 98.18 1ovm n GLY 224 Ca 0.30 0.16 0.06 0.00 0.00 0.00 0.00 46.02 46.54 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 -4.50 3.11 0.38 0.99 4.77 -0.23 -4.74 117.00 116.78 1ovm n LEU 225 Ca -0.09 -3.41 -0.16 0.00 -0.03 0.00 0.00 56.01 52.32 1ovm n LEU 225 Cb 0.58 -0.52 -0.08 0.00 -2.33 0.00 0.00 43.42 41.08 1ovm n LEU 225 CO 0.75 0.98 0.53 0.50 -1.33 0.00 0.00 177.39 178.82 1ovm h LYS 226 N 0.81 -0.96 -0.90 3.23 3.64 -1.90 -2.24 116.57 118.25 1ovm h LYS 226 Ca 0.05 0.07 0.22 0.00 -1.27 0.00 0.00 60.65 59.71 1ovm h LYS 226 Cb 1.23 0.22 -0.13 0.00 -0.41 0.00 0.00 32.23 33.14 1ovm h LYS 226 CO 0.13 -0.64 0.39 0.45 -2.27 0.00 0.00 179.45 177.50 1ovm h HIS 227 N -1.00 0.64 -0.63 1.91 3.86 -1.90 0.23 115.15 118.26 1ovm h HIS 227 Ca -0.10 0.04 0.06 0.00 -1.16 0.00 0.00 60.37 59.22 1ovm h HIS 227 Cb 0.78 -0.14 -0.06 0.00 1.06 0.00 0.00 27.41 29.05 1ovm h HIS 227 CO 0.02 -0.06 0.33 0.00 0.86 0.00 0.00 177.93 179.07 1ovm h ALA 228 N 1.72 0.83 -0.22 2.45 0.00 -1.84 0.37 119.26 122.57 1ovm h ALA 228 Ca 0.56 0.03 -0.18 0.00 0.00 0.00 0.00 54.91 55.32 1ovm h ALA 228 Cb 1.08 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1ovm h ALA 228 CO -0.54 -0.02 -0.56 -0.07 0.00 0.00 0.00 179.25 178.07 1ovm h LEU 229 N 0.60 0.88 -0.25 0.00 4.07 -0.01 -0.88 115.31 119.72 1ovm h LEU 229 Ca 0.29 -0.57 -0.00 0.00 0.08 0.00 0.00 57.88 57.68 1ovm h LEU 229 Cb 0.21 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 41.69 1ovm h LEU 229 CO -0.20 1.29 0.16 1.56 -1.08 0.00 0.00 178.44 180.16 1ovm h GLN 230 N 0.51 0.34 -0.72 1.13 4.20 -0.79 -1.06 115.11 118.72 1ovm h GLN 230 Ca -0.01 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.68 1ovm h GLN 230 Cb 1.17 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.84 1ovm h GLN 230 CO 0.12 0.26 0.48 -0.22 -0.67 0.00 0.00 178.83 178.80 1ovm h LYS 231 N 0.32 0.95 0.47 1.46 3.64 -0.92 -1.65 116.57 120.84 1ovm h LYS 231 Ca 0.09 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1ovm h LYS 231 Cb 0.00 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.59 1ovm h LYS 231 CO -0.02 0.63 -0.44 2.35 -2.27 0.00 0.00 179.45 179.70 1ovm h TRP 232 N 0.98 -1.22 -0.04 1.91 2.91 -0.51 -1.04 115.95 118.93 1ovm h TRP 232 Ca 0.27 0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.30 1ovm h TRP 232 Cb -0.11 0.47 -0.00 0.00 -0.51 0.00 0.00 29.16 29.01 1ovm h TRP 232 CO -0.02 -0.59 0.04 -0.24 -1.03 0.00 0.00 178.44 176.59 1ovm h VAL 233 N -0.90 0.66 -0.08 2.65 3.04 -1.12 0.15 116.25 120.66 1ovm h VAL 233 Ca -0.06 0.00 -0.08 0.00 -1.01 0.00 0.00 66.70 65.55 1ovm h VAL 233 Cb 0.77 0.97 0.00 0.00 -2.01 0.00 0.00 31.29 31.03 1ovm h VAL 233 CO -0.04 0.00 -0.27 0.50 -1.01 0.00 0.00 177.57 176.75 1ovm h LYS 234 N 0.00 0.32 -0.19 4.17 3.64 -0.86 -3.19 116.57 120.46 1ovm h LYS 234 Ca 0.02 -0.24 -0.20 0.00 -1.27 0.00 0.00 60.65 58.96 1ovm h LYS 234 Cb 0.09 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1ovm h LYS 234 CO -0.00 0.87 -0.67 0.93 -2.27 0.00 0.00 179.45 178.32 1ovm h GLU 235 N -0.17 0.74 -3.45 1.90 5.08 -0.58 -3.38 114.58 114.71 1ovm h GLU 235 Ca -0.01 -0.54 -0.65 0.00 -1.00 0.00 0.00 59.36 57.16 1ovm h GLU 235 Cb 0.91 0.09 -0.40 0.00 0.50 0.00 0.00 28.75 29.85 1ovm h GLU 235 CO 0.06 1.16 -0.58 0.08 -1.00 0.00 0.00 179.01 178.73 1ovm s VAL 236 N -3.89 2.82 0.19 3.13 1.01 0.46 -5.08 120.40 119.04 1ovm s VAL 236 Ca -0.09 -3.23 -0.32 0.00 0.00 0.00 0.00 61.98 58.34 1ovm s VAL 236 Cb 0.10 -2.93 -0.11 0.00 0.00 0.00 0.00 36.38 33.44 1ovm s VAL 236 CO 0.88 -0.81 1.69 -2.84 0.00 0.00 0.00 175.10 174.02 1ovm s PRO 237 N -0.23 4.15 0.17 2.72 0.02 -1.20 -4.44 135.00 136.19 1ovm s PRO 237 Ca 0.17 2.55 -0.24 0.00 0.02 0.00 0.00 61.00 63.50 1ovm s PRO 237 Cb -0.25 -3.11 0.06 0.00 0.02 0.00 0.00 34.50 31.22 1ovm s PRO 237 CO -0.01 -0.72 0.90 0.00 -0.33 0.00 0.00 177.00 176.84 1ovm s MET 238 N 1.22 1.30 0.20 5.54 0.23 -1.26 -4.95 119.30 121.59 1ovm s MET 238 Ca 0.74 -0.71 -0.30 0.00 -1.03 0.00 0.00 55.69 54.39 1ovm s MET 238 Cb -0.48 0.45 -0.09 0.00 -1.53 0.00 0.00 34.83 33.18 1ovm s MET 238 CO 0.32 -0.60 1.39 0.00 -2.03 0.00 0.00 175.02 174.11 1ovm s ALA 239 N -3.42 3.60 -0.09 3.16 0.00 -1.26 -4.55 121.76 119.20 1ovm s ALA 239 Ca 0.11 1.22 -0.15 0.00 0.00 0.00 0.00 51.96 53.14 1ovm s ALA 239 Cb -0.02 -3.53 0.03 0.00 0.00 0.00 0.00 23.12 19.60 1ovm s ALA 239 CO 0.02 -0.65 0.38 -3.38 0.00 0.00 0.00 175.76 172.14 1ovm s HIS 240 N 0.29 -0.35 0.31 0.00 -3.43 -0.33 -0.78 115.29 110.99 1ovm s HIS 240 Ca 0.60 0.76 -0.12 0.00 -0.80 0.00 0.00 55.06 55.49 1ovm s HIS 240 Cb -0.39 0.15 0.01 0.00 -1.43 0.00 0.00 32.58 30.92 1ovm s HIS 240 CO 0.38 -0.31 0.58 0.00 -2.00 0.00 0.00 174.74 173.40 1ovm s ALA 241 N -0.50 -0.27 0.21 -1.38 0.00 -0.11 -4.33 121.76 115.38 1ovm s ALA 241 Ca -0.06 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.00 1ovm s ALA 241 Cb -0.04 0.97 -0.05 0.00 0.00 0.00 0.00 23.12 24.01 1ovm s ALA 241 CO 0.03 -0.90 0.06 0.95 0.00 0.00 0.00 175.76 175.90 1ovm s THR 242 N -3.40 0.51 0.60 0.00 -4.23 -1.26 -1.40 115.64 106.46 1ovm s THR 242 Ca 0.21 -1.98 0.08 0.00 -1.18 0.00 0.00 61.69 58.82 1ovm s THR 242 Cb -0.02 -2.36 0.10 0.00 1.34 0.00 0.00 72.50 71.56 1ovm s THR 242 CO 0.12 -0.24 0.84 0.23 -0.54 0.00 0.00 174.62 175.03 1ovm n MET 243 N -0.32 0.48 -0.24 3.99 2.81 -1.24 -1.70 117.12 120.90 1ovm n MET 243 Ca -0.03 -3.05 0.01 0.00 -1.81 0.00 0.00 57.70 52.81 1ovm n MET 243 Cb 0.65 -0.31 0.08 0.00 -0.71 0.00 0.00 33.22 32.92 1ovm n MET 243 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1ovm h LEU 244 N 0.00 -0.64 -0.97 4.03 6.46 -1.88 -2.18 115.31 120.13 1ovm h LEU 244 Ca -0.28 0.21 0.03 0.00 -0.12 0.00 0.00 57.88 57.72 1ovm h LEU 244 Cb 1.24 0.43 -0.06 0.00 -0.73 0.00 0.00 40.66 41.55 1ovm h LEU 244 CO 0.38 -0.23 0.63 0.24 -0.62 0.00 0.00 178.44 178.84 1ovm h MET 245 N 0.00 1.19 -0.19 1.25 2.86 -1.94 -2.73 114.93 115.38 1ovm h MET 245 Ca 0.34 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.91 1ovm h MET 245 Cb 0.52 -0.27 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1ovm h MET 245 CO -0.72 0.79 0.00 0.41 1.06 0.00 0.00 176.91 178.45 1ovm n GLY 246 N -1.36 0.47 3.65 8.32 0.00 -0.87 -4.29 105.19 111.10 1ovm n GLY 246 Ca 0.13 -0.46 -0.49 0.00 0.00 0.00 0.00 46.02 45.19 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 0.48 1.76 0.00 1.61 4.81 -0.89 -2.54 118.16 123.39 1ovm n LYS 247 Ca 0.17 0.64 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 1ovm n LYS 247 Cb 0.37 -2.37 0.00 0.00 0.02 0.00 0.00 35.03 33.05 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 3.33 1.28 0.14 3.14 0.00 -1.26 -4.27 105.19 107.54 1ovm n GLY 248 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.23 1ovm n GLY 248 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1ovm h ILE 249 N 0.00 0.88 -3.38 -0.61 3.07 -1.81 -3.44 117.51 112.23 1ovm h ILE 249 Ca 0.00 -2.20 -0.65 0.00 1.55 0.00 0.00 64.86 63.56 1ovm h ILE 249 Cb 0.00 2.40 -0.15 0.00 -0.27 0.00 0.00 36.82 38.80 1ovm h ILE 249 CO 0.00 0.49 -0.73 -0.36 -1.05 0.00 0.00 178.15 176.51 1ovm s PHE 250 N -3.00 2.73 -0.72 0.16 0.08 -1.26 -4.66 117.98 111.31 1ovm s PHE 250 Ca 0.04 -0.17 -0.27 0.00 0.12 0.00 0.00 56.93 56.65 1ovm s PHE 250 Cb 0.08 -1.40 0.03 0.00 -0.57 0.00 0.00 43.02 41.16 1ovm s PHE 250 CO 0.74 0.45 1.28 0.34 -0.10 0.00 0.00 175.22 177.94 1ovm s ASP 251 N -2.41 6.18 0.00 1.36 -1.08 -1.26 -4.89 116.67 114.56 1ovm s ASP 251 Ca 0.23 -0.37 0.10 0.00 -0.52 0.00 0.00 52.55 51.99 1ovm s ASP 251 Cb -0.10 -2.56 0.61 0.00 -1.46 0.00 0.00 42.92 39.41 1ovm s ASP 251 CO 0.14 -1.81 1.04 -0.62 0.52 0.00 0.00 175.17 174.44 1ovm n GLU 252 N 9.27 0.43 0.00 4.34 1.02 -0.46 -2.30 120.64 132.93 1ovm n GLU 252 Ca 0.04 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.29 1ovm n GLU 252 Cb 0.49 -1.38 0.11 0.00 -0.02 0.00 0.00 31.44 30.65 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 -0.88 0.61 -1.87 3.49 1.74 -1.25 -4.83 116.66 113.68 1ovm n ARG 253 Ca 0.08 -0.45 -0.29 0.00 -0.77 0.00 0.00 57.85 56.41 1ovm n ARG 253 Cb 0.04 -1.49 0.09 0.00 -1.02 0.00 0.00 32.46 30.08 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 -2.70 1.92 0.22 5.56 -1.52 -0.97 -5.03 119.66 117.14 1ovm s GLN 254 Ca 0.16 0.13 -0.30 0.00 -1.95 0.00 0.00 55.36 53.40 1ovm s GLN 254 Cb 0.18 -1.94 -0.09 0.00 -0.22 0.00 0.00 33.01 30.94 1ovm s GLN 254 CO 0.65 -1.63 1.18 0.00 -0.25 0.00 0.00 175.29 175.24 1ovm s ALA 255 N -3.56 3.44 0.00 6.09 0.00 -1.26 -3.34 121.76 123.13 1ovm s ALA 255 Ca 0.62 0.97 0.00 0.00 0.00 0.00 0.00 51.96 53.55 1ovm s ALA 255 Cb -0.11 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1ovm s ALA 255 CO 0.49 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 176.32 1ovm n GLY 256 N 1.80 0.16 3.51 0.00 0.00 -1.26 -4.79 105.19 104.60 1ovm n GLY 256 Ca 0.02 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 -2.00 3.14 -1.07 1.61 2.19 -1.21 -1.18 117.98 119.46 1ovm s PHE 257 Ca 0.00 -0.19 0.09 0.00 0.33 0.00 0.00 56.93 57.16 1ovm s PHE 257 Cb 0.00 -2.30 0.11 0.00 -1.31 0.00 0.00 43.02 39.52 1ovm s PHE 257 CO 0.00 -0.27 0.89 0.66 1.83 0.00 0.00 175.22 178.33 1ovm n TYR 258 N 4.98 0.09 0.00 10.12 4.02 -1.26 -4.93 117.16 130.18 1ovm n TYR 258 Ca -0.15 -0.11 0.00 0.00 -0.01 0.00 0.00 57.90 57.63 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 0.48 1.72 3.74 2.72 0.00 -1.26 -4.51 105.19 108.08 1ovm n GLY 259 Ca 0.06 -2.01 -0.40 0.00 0.00 0.00 0.00 46.02 43.67 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 -1.37 4.60 0.10 2.61 2.01 -1.26 -4.62 115.64 117.71 1ovm s THR 260 Ca 0.00 1.84 -0.24 0.00 0.31 0.00 0.00 61.69 63.60 1ovm s THR 260 Cb 0.00 -4.21 -0.07 0.00 0.01 0.00 0.00 72.50 68.23 1ovm s THR 260 CO 0.00 0.35 0.73 -0.47 -0.69 0.00 0.00 174.62 174.54 1ovm s TYR 261 N -0.11 3.82 -0.41 4.92 5.04 -0.69 -4.78 117.35 125.14 1ovm s TYR 261 Ca 0.42 1.50 0.09 0.00 -2.44 0.00 0.00 57.07 56.64 1ovm s TYR 261 Cb -0.22 -2.74 0.37 0.00 0.35 0.00 0.00 41.96 39.72 1ovm s TYR 261 CO 0.26 0.43 1.22 -1.13 -1.34 0.00 0.00 175.55 174.99 1ovm n SER 262 N 2.10 -1.65 0.00 4.32 3.41 -1.26 -4.24 113.62 116.29 1ovm n SER 262 Ca -0.05 -2.92 0.00 0.00 -0.26 0.00 0.00 58.87 55.64 1ovm n SER 262 Cb 0.50 1.12 0.00 0.00 -0.26 0.00 0.00 64.21 65.57 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 -0.20 0.78 0.16 5.00 0.00 -1.26 -2.91 105.19 106.77 1ovm n GLY 263 Ca 0.02 -0.75 0.13 0.00 0.00 0.00 0.00 46.02 45.42 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 8.82 0.00 0.36 1.61 4.64 -1.74 -1.75 113.55 125.49 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 2.43 -1.54 5.18 0.00 -1.15 -4.83 120.51 118.79 1ovm n ALA 265 Ca 0.01 -0.15 -0.30 0.00 0.00 0.00 0.00 53.44 53.01 1ovm n ALA 265 Cb 0.19 -1.45 0.09 0.00 0.00 0.00 0.00 19.45 18.28 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 -2.39 4.41 0.66 0.00 0.01 -0.66 -4.88 113.70 110.84 1ovm s SER 266 Ca 0.31 1.30 -0.13 0.00 1.31 0.00 0.00 55.95 58.75 1ovm s SER 266 Cb 0.19 -2.03 -0.00 0.00 0.21 0.00 0.00 66.02 64.39 1ovm s SER 266 CO 0.39 -2.02 1.07 0.42 0.41 0.00 0.00 173.24 173.50 1ovm s THR 267 N -3.15 3.82 0.34 1.44 -4.23 -1.26 -4.78 115.64 107.81 1ovm s THR 267 Ca 0.61 0.70 0.06 0.00 -1.18 0.00 0.00 61.69 61.89 1ovm s THR 267 Cb -0.15 -3.32 0.31 0.00 1.34 0.00 0.00 72.50 70.68 1ovm s THR 267 CO 0.54 -0.66 1.88 1.23 -0.54 0.00 0.00 174.62 177.08 1ovm h GLY 268 N -0.28 1.25 0.94 3.99 0.00 -1.95 0.38 103.07 107.40 1ovm h GLY 268 Ca -0.45 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 46.53 1ovm h GLY 268 CO 0.56 0.15 -0.16 0.00 0.00 0.00 0.00 176.54 177.09 1ovm h ALA 269 N 1.58 -0.45 0.04 3.60 0.00 -1.93 -0.68 119.26 121.42 1ovm h ALA 269 Ca 0.43 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 1ovm h ALA 269 Cb 0.54 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1ovm h ALA 269 CO -0.19 -0.72 -0.02 0.28 0.00 0.00 0.00 179.25 178.60 1ovm h VAL 270 N -0.51 0.99 -0.91 0.00 2.07 -1.65 0.61 116.25 116.84 1ovm h VAL 270 Ca -0.05 -0.07 0.14 0.00 0.82 0.00 0.00 66.70 67.55 1ovm h VAL 270 Cb 0.39 1.04 -0.09 0.00 -1.52 0.00 0.00 31.29 31.10 1ovm h VAL 270 CO 0.08 0.02 0.52 0.50 0.02 0.00 0.00 177.57 178.70 1ovm h LYS 271 N -0.08 0.73 -0.10 1.57 3.64 -0.91 -0.43 116.57 121.00 1ovm h LYS 271 Ca -0.00 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.27 1ovm h LYS 271 Cb 0.07 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 1ovm h LYS 271 CO 0.01 0.48 -0.20 0.93 -2.27 0.00 0.00 179.45 178.40 1ovm h GLU 272 N 0.75 0.30 -0.79 1.90 4.39 -0.71 0.02 114.58 120.44 1ovm h GLU 272 Ca 0.49 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 60.00 1ovm h GLU 272 Cb 0.64 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.28 1ovm h GLU 272 CO -0.33 0.79 0.51 0.00 -1.16 0.00 0.00 179.01 178.82 1ovm h ALA 273 N 0.51 1.41 0.00 3.43 0.00 -0.28 -0.25 119.26 124.08 1ovm h ALA 273 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ovm h ALA 273 Cb 0.79 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1ovm h ALA 273 CO 0.04 0.53 -0.29 -0.89 0.00 0.00 0.00 179.25 178.65 1ovm n ILE 274 N -4.40 0.63 0.31 0.00 2.08 -0.23 -4.12 119.36 113.63 1ovm n ILE 274 Ca 0.09 0.37 0.20 0.00 0.56 0.00 0.00 62.75 63.96 1ovm n ILE 274 Cb 0.04 -1.89 0.99 0.00 -0.75 0.00 0.00 39.64 38.03 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 -0.44 0.00 0.00 0.38 5.08 -1.14 -2.70 114.58 115.76 1ovm h GLU 275 Ca 0.00 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 1ovm h GLU 275 Cb 0.29 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1ovm h GLU 275 CO 0.00 0.00 -0.50 0.78 -1.00 0.00 0.00 179.01 178.29 1ovm h GLY 276 N 0.84 0.00 -2.89 -3.84 0.00 -0.92 -3.45 103.07 92.81 1ovm h GLY 276 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 1ovm h GLY 276 CO 0.00 0.00 0.52 0.00 0.00 0.00 0.00 176.54 177.06 1ovm s ALA 277 N -3.26 3.02 -1.03 3.60 0.00 -1.02 -4.92 121.76 118.14 1ovm s ALA 277 Ca 0.02 1.03 0.28 0.00 0.00 0.00 0.00 51.96 53.29 1ovm s ALA 277 Cb 0.10 -3.42 1.20 0.00 0.00 0.00 0.00 23.12 20.99 1ovm s ALA 277 CO 0.73 -0.76 1.89 -0.40 0.00 0.00 0.00 175.76 177.22 1ovm n ASP 278 N -0.39 0.00 -3.67 0.00 5.75 -1.12 -4.60 116.55 112.52 1ovm n ASP 278 Ca 0.07 0.45 -0.12 0.00 -0.01 0.00 0.00 54.79 55.17 1ovm n ASP 278 Cb 0.47 -0.48 -0.12 0.00 -1.03 0.00 0.00 41.12 39.95 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 -2.97 -0.42 -0.10 2.12 -4.23 -1.21 -4.61 115.64 104.22 1ovm s THR 279 Ca 0.14 0.25 0.04 0.00 -1.18 0.00 0.00 61.69 60.94 1ovm s THR 279 Cb 0.18 -0.48 0.00 0.00 1.34 0.00 0.00 72.50 73.54 1ovm s THR 279 CO 0.50 0.10 -0.22 0.54 -0.54 0.00 0.00 174.62 175.00 1ovm s VAL 280 N 2.36 1.89 -0.31 2.29 0.11 -0.23 -1.96 120.40 124.54 1ovm s VAL 280 Ca -0.00 -0.92 -0.21 0.00 -2.93 0.00 0.00 61.98 57.92 1ovm s VAL 280 Cb -0.12 -1.64 -0.00 0.00 -1.53 0.00 0.00 36.38 33.08 1ovm s VAL 280 CO -0.09 0.52 0.69 -0.76 -3.33 0.00 0.00 175.10 172.13 1ovm s LEU 281 N 0.43 4.14 -0.45 2.54 1.43 0.10 -2.54 118.68 124.34 1ovm s LEU 281 Ca -0.17 0.47 -0.15 0.00 -1.03 0.00 0.00 54.13 53.25 1ovm s LEU 281 Cb -0.17 -2.91 0.06 0.00 0.03 0.00 0.00 46.19 43.20 1ovm s LEU 281 CO 0.07 -0.55 0.36 0.00 0.23 0.00 0.00 176.35 176.46 1ovm s VAL 283 N 1.63 3.39 -1.49 0.00 1.01 0.12 -1.18 120.40 123.89 1ovm s VAL 283 Ca 0.04 -0.49 -0.07 0.00 0.00 0.00 0.00 61.98 61.46 1ovm s VAL 283 Cb -0.23 -2.53 0.02 0.00 0.00 0.00 0.00 36.38 33.65 1ovm s VAL 283 CO 0.07 0.44 0.71 0.61 0.00 0.00 0.00 175.10 176.92 1ovm n GLY 284 N 4.60 -0.52 3.83 4.51 0.00 -0.82 -0.95 105.19 115.84 1ovm n GLY 284 Ca -0.18 0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.17 4.90 -0.24 2.61 -1.32 -1.26 -3.08 115.64 114.07 1ovm s THR 285 Ca 0.39 0.92 -0.03 0.00 -1.21 0.00 0.00 61.69 61.75 1ovm s THR 285 Cb -0.18 -3.77 0.10 0.00 -1.51 0.00 0.00 72.50 67.14 1ovm s THR 285 CO 0.48 0.45 0.19 -0.60 -2.21 0.00 0.00 174.62 172.93 1ovm s ARG 286 N -1.41 0.20 -1.31 7.08 6.06 -1.26 -5.05 118.95 123.26 1ovm s ARG 286 Ca 0.30 -0.13 -0.16 0.00 -2.50 0.00 0.00 55.73 53.24 1ovm s ARG 286 Cb -0.17 -1.18 0.08 0.00 0.06 0.00 0.00 34.95 33.74 1ovm s ARG 286 CO 0.17 -0.85 1.78 1.19 -2.50 0.00 0.00 175.30 175.10 1ovm n PHE 287 N 5.29 4.45 -1.83 5.12 3.72 -1.26 -4.97 117.46 127.98 1ovm n PHE 287 Ca -0.05 -2.94 -0.30 0.00 -0.05 0.00 0.00 57.45 54.11 1ovm n PHE 287 Cb 0.47 -2.53 0.07 0.00 -0.94 0.00 0.00 39.48 36.55 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 3.47 2.91 0.19 4.37 -4.23 -1.26 -4.91 115.64 116.18 1ovm s THR 288 Ca 0.50 0.30 -0.10 0.00 -1.18 0.00 0.00 61.69 61.21 1ovm s THR 288 Cb 0.05 -3.25 0.11 0.00 1.34 0.00 0.00 72.50 70.76 1ovm s THR 288 CO 0.04 -0.39 1.76 -2.24 -0.54 0.00 0.00 174.62 173.25 1ovm h ASP 289 N -0.88 0.93 -0.03 3.99 2.03 -1.96 -2.52 116.42 117.98 1ovm h ASP 289 Ca -0.46 -0.16 -0.10 0.00 -0.73 0.00 0.00 57.03 55.58 1ovm h ASP 289 Cb 1.28 -0.24 -0.01 0.00 -0.83 0.00 0.00 39.33 39.53 1ovm h ASP 289 CO 0.64 0.84 -0.26 0.71 -1.03 0.00 0.00 179.24 180.14 1ovm h THR 290 N 0.97 1.27 0.00 1.15 1.35 -1.94 0.04 112.91 115.75 1ovm h THR 290 Ca 0.23 -1.27 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 1ovm h THR 290 Cb 0.19 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 1ovm h THR 290 CO -0.02 0.40 0.00 -0.07 -0.25 0.00 0.00 175.52 175.58 1ovm h LEU 291 N 0.41 0.00 -3.00 3.87 4.07 -1.88 -3.30 115.31 115.47 1ovm h LEU 291 Ca 0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.02 1ovm h LEU 291 Cb 0.67 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.41 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 -2.68 1.41 -3.63 0.22 -2.24 -0.97 -4.19 114.28 102.19 1ovm n THR 292 Ca 0.04 -1.56 -0.21 0.00 -2.27 0.00 0.00 64.05 60.05 1ovm n THR 292 Cb 0.44 0.17 0.04 0.00 -2.10 0.00 0.00 70.33 68.88 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 -0.87 -2.10 -2.27 6.98 0.00 -0.81 -1.43 120.51 120.01 1ovm n ALA 293 Ca 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1ovm n ALA 293 Cb 0.43 -2.50 0.00 0.00 0.00 0.00 0.00 19.45 17.39 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 -1.51 0.77 3.39 0.00 0.00 -0.06 -4.07 105.19 103.70 1ovm n GLY 294 Ca -0.26 -0.74 -0.19 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 -2.97 -2.37 -0.89 1.61 3.72 -1.16 -4.92 117.46 110.47 1ovm n PHE 295 Ca 0.00 0.93 0.08 0.00 -0.05 0.00 0.00 57.45 58.40 1ovm n PHE 295 Cb 0.49 -4.89 0.38 0.00 -0.94 0.00 0.00 39.48 34.51 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 -4.38 2.59 -2.62 4.37 -2.24 -0.52 -4.96 114.28 106.52 1ovm n THR 296 Ca -0.15 -1.47 -0.40 0.00 -2.27 0.00 0.00 64.05 59.76 1ovm n THR 296 Cb 0.62 -0.23 -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 -2.68 3.78 -0.97 4.78 -3.43 -1.26 -2.71 115.29 112.81 1ovm s HIS 297 Ca 0.52 1.79 -0.03 0.00 -0.80 0.00 0.00 55.06 56.54 1ovm s HIS 297 Cb 0.40 -3.13 0.25 0.00 -1.43 0.00 0.00 32.58 28.67 1ovm s HIS 297 CO 0.16 -0.04 1.00 1.04 -2.00 0.00 0.00 174.74 174.89 1ovm n GLN 298 N 1.60 3.20 -4.32 -0.38 1.13 -1.26 -4.99 117.38 112.36 1ovm n GLN 298 Ca -0.01 -4.51 -0.20 0.00 -1.94 0.00 0.00 57.00 50.34 1ovm n GLN 298 Cb 0.46 -2.45 -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 -1.73 1.63 0.31 1.08 1.43 -1.26 -4.81 118.68 115.33 1ovm s LEU 299 Ca 0.30 -0.17 0.08 0.00 -1.03 0.00 0.00 54.13 53.31 1ovm s LEU 299 Cb -0.04 -0.52 -0.04 0.00 0.03 0.00 0.00 46.19 45.62 1ovm s LEU 299 CO -0.06 0.02 0.16 0.42 0.23 0.00 0.00 176.35 177.11 1ovm s THR 300 N 0.47 3.47 0.12 5.49 -4.23 -1.26 -5.03 115.64 114.66 1ovm s THR 300 Ca -0.07 -1.62 -0.21 0.00 -1.18 0.00 0.00 61.69 58.61 1ovm s THR 300 Cb -0.11 -3.07 -0.07 0.00 1.34 0.00 0.00 72.50 70.59 1ovm s THR 300 CO 0.01 -0.25 1.71 -0.65 -0.54 0.00 0.00 174.62 174.90 1ovm h PRO 301 N 1.54 -0.04 -0.97 3.99 0.11 -1.92 -2.10 132.00 132.62 1ovm h PRO 301 Ca -0.45 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.70 1ovm h PRO 301 Cb 1.25 0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.31 1ovm h PRO 301 CO 0.61 -0.02 0.63 0.00 -0.21 0.00 0.00 178.00 179.01 1ovm h ALA 302 N 1.07 1.39 0.00 -0.75 0.00 -1.96 -2.11 119.26 116.89 1ovm h ALA 302 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ovm h ALA 302 Cb 0.13 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1ovm h ALA 302 CO -0.14 0.51 0.00 0.37 0.00 0.00 0.00 179.25 179.99 1ovm h GLN 303 N 1.21 0.00 -6.07 0.00 4.15 -1.71 -3.42 115.11 109.25 1ovm h GLN 303 Ca 0.39 0.00 -0.59 0.00 0.77 0.00 0.00 58.65 59.21 1ovm h GLN 303 Cb 0.03 0.00 -0.12 0.00 0.21 0.00 0.00 27.48 27.60 1ovm h GLN 303 CO -0.12 0.00 -0.67 0.95 -1.93 0.00 0.00 178.83 177.06 1ovm s THR 304 N -3.35 2.63 -0.09 2.39 -4.23 -0.79 -1.07 115.64 111.12 1ovm s THR 304 Ca 0.05 -2.12 -0.02 0.00 -1.18 0.00 0.00 61.69 58.42 1ovm s THR 304 Cb 0.09 -2.65 0.04 0.00 1.34 0.00 0.00 72.50 71.32 1ovm s THR 304 CO 0.48 -0.27 0.02 -0.63 -0.54 0.00 0.00 174.62 173.68 1ovm s ILE 305 N -2.51 0.29 0.09 2.99 1.01 -1.05 -2.49 121.20 119.53 1ovm s ILE 305 Ca 0.33 0.04 0.09 0.00 0.00 0.00 0.00 60.65 61.11 1ovm s ILE 305 Cb -0.02 -0.56 -0.03 0.00 0.01 0.00 0.00 42.46 41.86 1ovm s ILE 305 CO 0.18 0.14 -0.24 -1.83 0.00 0.00 0.00 174.94 173.19 1ovm s GLU 306 N 2.00 1.37 -0.07 2.79 -1.05 0.05 -0.63 118.70 123.14 1ovm s GLU 306 Ca 0.04 -1.16 0.04 0.00 -0.15 0.00 0.00 54.97 53.74 1ovm s GLU 306 Cb -0.13 -1.66 0.00 0.00 -0.44 0.00 0.00 34.13 31.90 1ovm s GLU 306 CO -0.06 0.40 -0.20 0.14 0.95 0.00 0.00 175.26 176.50 1ovm s VAL 307 N -1.00 1.69 0.43 1.83 -7.23 -0.32 0.55 120.40 116.35 1ovm s VAL 307 Ca 0.10 -0.82 0.06 0.00 -1.81 0.00 0.00 61.98 59.51 1ovm s VAL 307 Cb -0.10 -1.47 -0.06 0.00 0.56 0.00 0.00 36.38 35.32 1ovm s VAL 307 CO 0.04 0.48 0.08 -1.10 -0.31 0.00 0.00 175.10 174.29 1ovm s GLN 308 N 0.31 2.09 0.30 4.82 -1.52 0.21 -1.94 119.66 123.93 1ovm s GLN 308 Ca -0.13 -2.05 0.01 0.00 -1.95 0.00 0.00 55.36 51.24 1ovm s GLN 308 Cb -0.16 -1.76 0.73 0.00 -0.22 0.00 0.00 33.01 31.60 1ovm s GLN 308 CO 0.06 -0.13 1.60 -1.35 -0.25 0.00 0.00 175.29 175.21 1ovm h PRO 309 N 1.56 0.07 0.00 2.91 0.11 -1.97 -3.04 132.00 131.65 1ovm h PRO 309 Ca -0.43 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 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 0.76 0.05 -0.01 0.72 -0.21 0.00 0.00 178.00 179.31 1ovm n HIS 310 N -5.39 0.00 -3.61 0.65 8.25 -1.26 -1.30 115.22 112.57 1ovm n HIS 310 Ca 0.22 -0.38 -0.16 0.00 -0.26 0.00 0.00 57.72 57.14 1ovm n HIS 310 Cb 0.72 -0.04 -0.07 0.00 1.12 0.00 0.00 29.99 31.73 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 -0.80 -1.39 0.16 -1.41 0.00 -1.15 -0.73 121.76 116.45 1ovm s ALA 311 Ca 0.01 0.91 0.06 0.00 0.00 0.00 0.00 51.96 52.94 1ovm s ALA 311 Cb 0.01 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.15 1ovm s ALA 311 CO 0.00 -0.35 -0.13 0.00 0.00 0.00 0.00 175.76 175.28 1ovm s ALA 312 N -1.37 1.68 0.01 0.00 0.00 -0.77 0.65 121.76 121.96 1ovm s ALA 312 Ca -0.11 -1.48 0.01 0.00 0.00 0.00 0.00 51.96 50.38 1ovm s ALA 312 Cb -0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 1ovm s ALA 312 CO 0.07 0.04 -0.03 0.50 0.00 0.00 0.00 175.76 176.33 1ovm s ARG 313 N -3.31 0.27 -0.12 0.00 3.52 0.19 0.13 118.95 119.63 1ovm s ARG 313 Ca 0.16 -0.23 -0.01 0.00 -0.13 0.00 0.00 55.73 55.52 1ovm s ARG 313 Cb -0.01 -0.19 0.03 0.00 -1.56 0.00 0.00 34.95 33.22 1ovm s ARG 313 CO 0.04 0.05 -0.03 0.14 -0.81 0.00 0.00 175.30 174.68 1ovm s VAL 314 N -0.35 0.77 0.00 7.11 -7.23 -0.47 -0.77 120.40 119.45 1ovm s VAL 314 Ca -0.02 -0.28 0.00 0.00 -1.81 0.00 0.00 61.98 59.88 1ovm s VAL 314 Cb -0.03 -0.94 0.00 0.00 0.56 0.00 0.00 36.38 35.97 1ovm s VAL 314 CO -0.00 0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.60 1ovm n GLY 315 N 5.01 3.86 0.02 2.32 0.00 -1.04 -1.76 105.19 113.60 1ovm n GLY 315 Ca -0.10 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.03 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 8.91 0.91 -4.77 1.61 8.00 -1.26 -4.62 116.55 125.33 1ovm n ASP 316 Ca 0.00 -0.83 -0.37 0.00 0.71 0.00 0.00 54.79 54.31 1ovm n ASP 316 Cb 0.00 0.78 -0.07 0.00 -0.02 0.00 0.00 41.12 41.81 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 -2.97 5.31 -0.01 2.53 1.01 -0.73 -5.08 120.40 120.47 1ovm s VAL 317 Ca 0.09 0.48 -0.00 0.00 0.00 0.00 0.00 61.98 62.56 1ovm s VAL 317 Cb 0.17 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 1ovm s VAL 317 CO 0.81 0.47 0.06 0.26 0.00 0.00 0.00 175.10 176.70 1ovm s TRP 318 N -0.08 3.23 -0.38 5.22 0.52 -1.26 -1.37 118.94 124.83 1ovm s TRP 318 Ca 0.16 0.18 0.03 0.00 0.02 0.00 0.00 56.10 56.49 1ovm s TRP 318 Cb -0.13 -1.72 0.11 0.00 -1.15 0.00 0.00 33.47 30.58 1ovm s TRP 318 CO 0.05 0.53 0.12 -0.06 0.02 0.00 0.00 176.95 177.60 1ovm s PHE 319 N -1.16 2.99 0.31 -1.98 0.40 0.12 -5.00 117.98 113.66 1ovm s PHE 319 Ca 0.22 -2.68 -0.20 0.00 -0.60 0.00 0.00 56.93 53.67 1ovm s PHE 319 Cb -0.12 -2.51 -0.09 0.00 0.51 0.00 0.00 43.02 40.81 1ovm s PHE 319 CO 0.13 -0.88 0.81 0.95 0.70 0.00 0.00 175.22 176.93 1ovm s THR 320 N 0.79 4.51 0.00 0.64 -4.23 -1.26 -1.84 115.64 114.24 1ovm s THR 320 Ca 0.13 1.31 0.00 0.00 -1.18 0.00 0.00 61.69 61.95 1ovm s THR 320 Cb -0.20 -3.76 0.00 0.00 1.34 0.00 0.00 72.50 69.87 1ovm s THR 320 CO -0.09 -0.02 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 1ovm n GLY 321 N 0.11 1.16 3.05 3.99 0.00 0.09 -4.99 105.19 108.61 1ovm n GLY 321 Ca 0.02 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 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 1.87 0.31 -0.61 1.01 -0.69 -4.17 121.20 116.92 1ovm s ILE 322 Ca 0.00 -1.08 -0.30 0.00 0.00 0.00 0.00 60.65 59.28 1ovm s ILE 322 Cb 0.00 -1.85 -0.11 0.00 0.01 0.00 0.00 42.46 40.51 1ovm s ILE 322 CO 0.00 0.27 1.55 -2.84 0.00 0.00 0.00 174.94 173.92 1ovm s PRO 323 N 1.31 4.14 0.22 2.79 0.02 -1.26 -3.00 135.00 139.23 1ovm s PRO 323 Ca -0.00 2.54 -0.14 0.00 0.02 0.00 0.00 61.00 63.41 1ovm s PRO 323 Cb -0.16 -3.02 0.26 0.00 0.02 0.00 0.00 34.50 31.60 1ovm s PRO 323 CO -0.09 -0.58 1.60 1.98 -0.33 0.00 0.00 177.00 179.57 1ovm h MET 324 N 4.44 -0.04 -0.86 5.54 1.85 -1.33 -0.90 114.93 123.63 1ovm h MET 324 Ca -0.48 0.00 0.07 0.00 -0.61 0.00 0.00 59.70 58.68 1ovm h MET 324 Cb 1.22 0.01 -0.06 0.00 0.43 0.00 0.00 31.60 33.21 1ovm h MET 324 CO 0.76 -0.03 0.56 -2.95 -0.40 0.00 0.00 176.91 174.85 1ovm h ASN 325 N -0.04 0.84 0.16 1.39 -1.07 -1.90 -0.98 115.58 113.98 1ovm h ASN 325 Ca 0.33 0.01 -0.19 0.00 0.07 0.00 0.00 56.30 56.52 1ovm h ASN 325 Cb 0.56 -0.17 -0.00 0.00 -2.07 0.00 0.00 38.32 36.63 1ovm h ASN 325 CO -0.77 0.54 -0.71 1.56 0.07 0.00 0.00 177.43 178.12 1ovm h GLN 326 N 0.95 0.48 -0.51 4.14 4.20 -1.57 -1.97 115.11 120.84 1ovm h GLN 326 Ca 0.37 -0.38 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 1ovm h GLN 326 Cb 0.23 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 1ovm h GLN 326 CO -0.14 1.01 0.04 0.00 -0.67 0.00 0.00 178.83 179.07 1ovm h ALA 327 N 0.89 0.68 -0.61 3.87 0.00 -0.68 -1.25 119.26 122.16 1ovm h ALA 327 Ca -0.03 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 1ovm h ALA 327 Cb 1.29 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1ovm h ALA 327 CO 0.13 0.45 0.24 0.82 0.00 0.00 0.00 179.25 180.89 1ovm h ILE 328 N 0.74 1.23 -0.66 0.00 2.04 -1.18 -1.22 117.51 118.45 1ovm h ILE 328 Ca 0.15 -0.74 0.02 0.00 1.00 0.00 0.00 64.86 65.29 1ovm h ILE 328 Cb 0.47 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 1ovm h ILE 328 CO 0.02 0.29 0.42 -0.08 0.00 0.00 0.00 178.15 178.80 1ovm h GLU 329 N 0.86 0.82 -0.62 2.37 4.57 -1.11 -1.03 114.58 120.44 1ovm h GLU 329 Ca 0.20 -0.05 -0.05 0.00 -1.18 0.00 0.00 59.36 58.29 1ovm h GLU 329 Cb 0.22 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.59 1ovm h GLU 329 CO -0.02 0.55 0.21 1.15 -1.18 0.00 0.00 179.01 179.72 1ovm h THR 330 N 0.85 1.24 -0.40 0.32 2.02 -0.89 -2.56 112.91 113.48 1ovm h THR 330 Ca 0.26 -0.81 -0.06 0.00 0.77 0.00 0.00 66.41 66.56 1ovm h THR 330 Cb -0.04 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 1ovm h THR 330 CO -0.08 0.31 0.00 -0.07 0.37 0.00 0.00 175.52 176.05 1ovm h LEU 331 N 0.89 0.61 -0.36 2.58 4.07 -0.72 -2.18 115.31 120.19 1ovm h LEU 331 Ca 0.20 -0.13 -0.06 0.00 0.08 0.00 0.00 57.88 57.97 1ovm h LEU 331 Cb 0.27 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 1ovm h LEU 331 CO -0.01 0.68 -0.02 0.58 -1.08 0.00 0.00 178.44 178.59 1ovm h VAL 332 N 0.61 1.26 -0.34 1.22 2.07 -0.97 -0.76 116.25 119.35 1ovm h VAL 332 Ca 0.13 -1.02 -0.00 0.00 0.82 0.00 0.00 66.70 66.62 1ovm h VAL 332 Cb 0.38 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1ovm h VAL 332 CO 0.01 0.34 0.21 -0.33 0.02 0.00 0.00 177.57 177.83 1ovm h GLU 333 N 0.46 0.46 -0.39 1.57 5.08 -1.25 -2.58 114.58 117.93 1ovm h GLU 333 Ca 0.10 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.33 1ovm h GLU 333 Cb 0.49 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1ovm h GLU 333 CO 0.02 0.34 -0.15 -0.07 -1.00 0.00 0.00 179.01 178.14 1ovm h LEU 334 N 0.45 0.70 -1.52 1.33 3.38 -1.32 -2.88 115.31 115.46 1ovm h LEU 334 Ca 0.12 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 1ovm h LEU 334 Cb -0.01 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1ovm h LEU 334 CO -0.02 0.87 -0.25 0.00 0.09 0.00 0.00 178.44 179.13 1ovm h LYS 336 N 0.00 0.00 -0.00 0.00 1.57 -1.26 -3.13 116.57 113.75 1ovm h LYS 336 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ovm h LYS 336 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 1ovm h LYS 336 CO 0.03 0.27 -0.02 0.94 -0.57 0.00 0.00 179.45 180.10 1ovm n GLN 337 N -3.28 0.07 -3.12 3.15 7.27 -0.35 -4.17 117.38 116.95 1ovm n GLN 337 Ca 0.01 -0.00 -0.20 0.00 0.07 0.00 0.00 57.00 56.88 1ovm n GLN 337 Cb 0.53 -1.50 -0.04 0.00 2.41 0.00 0.00 30.24 31.65 1ovm n GLN 337 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1ovm n HIS 338 N -1.46 -0.60 -2.55 3.69 8.25 -1.12 -5.10 115.22 116.33 1ovm n HIS 338 Ca 0.08 -3.40 -0.34 0.00 -0.26 0.00 0.00 57.72 53.80 1ovm n HIS 338 Cb 0.33 -0.08 -0.04 0.00 1.12 0.00 0.00 29.99 31.32 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 -1.36 3.78 0.03 1.59 -7.23 -1.25 -4.95 120.40 111.00 1ovm s VAL 339 Ca 0.36 1.14 -0.02 0.00 -1.81 0.00 0.00 61.98 61.65 1ovm s VAL 339 Cb 0.25 -3.48 -0.02 0.00 0.56 0.00 0.00 36.38 33.68 1ovm s VAL 339 CO -0.11 -0.21 0.01 -1.00 -0.31 0.00 0.00 175.10 173.49 1ovm s HIS 340 N -1.93 0.27 0.77 2.82 3.76 -1.26 -5.16 115.29 114.55 1ovm s HIS 340 Ca 0.66 -0.57 -0.07 0.00 -0.15 0.00 0.00 55.06 54.93 1ovm s HIS 340 Cb -0.17 -0.20 0.10 0.00 1.11 0.00 0.00 32.58 33.42 1ovm s HIS 340 CO 0.21 -0.27 0.20 0.00 -0.85 0.00 0.00 174.74 174.03 1ovm n ALA 341 N 1.18 2.02 0.00 -1.40 0.00 -1.26 -5.06 120.51 115.99 1ovm n ALA 341 Ca -0.21 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.67 1ovm n ALA 341 Cb 0.57 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.57 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 -0.08 0.00 0.00 0.00 -0.02 -1.26 -5.14 135.00 128.50 1ovm n PRO 356 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1ovm n PRO 356 Cb 0.18 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.66 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 0.25 0.00 2.55 5.75 -1.26 -4.94 116.55 118.90 1ovm n ASP 357 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1ovm n ASP 357 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 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 3.04 -0.52 3.76 6.12 0.00 -1.26 -4.87 105.19 111.46 1ovm n GLY 358 Ca 0.00 -1.97 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 1ovm n GLY 358 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ovm s SER 359 N -4.00 6.65 0.33 1.61 0.15 -1.26 -0.21 113.70 116.96 1ovm s SER 359 Ca 0.00 2.76 -0.28 0.00 0.70 0.00 0.00 55.95 59.12 1ovm s SER 359 Cb 0.00 -2.64 -0.10 0.00 -1.71 0.00 0.00 66.02 61.57 1ovm s SER 359 CO 0.00 -0.65 1.25 -0.76 1.20 0.00 0.00 173.24 174.27 1ovm s LEU 360 N -1.40 4.43 0.11 3.45 1.43 -0.75 -4.63 118.68 121.31 1ovm s LEU 360 Ca 0.53 2.57 -0.08 0.00 -1.03 0.00 0.00 54.13 56.12 1ovm s LEU 360 Cb -0.42 -3.69 -0.01 0.00 0.03 0.00 0.00 46.19 42.11 1ovm s LEU 360 CO 0.52 -0.47 0.20 0.42 0.23 0.00 0.00 176.35 177.25 1ovm s THR 361 N -1.17 0.12 0.26 5.49 -4.23 -1.26 -4.60 115.64 110.24 1ovm s THR 361 Ca 0.49 -1.33 -0.02 0.00 -1.18 0.00 0.00 61.69 59.65 1ovm s THR 361 Cb -0.37 -1.56 0.23 0.00 1.34 0.00 0.00 72.50 72.15 1ovm s THR 361 CO 0.49 -0.54 1.77 1.56 -0.54 0.00 0.00 174.62 177.36 1ovm h GLN 362 N 2.71 0.63 0.02 3.99 1.08 -1.93 0.50 115.11 122.11 1ovm h GLN 362 Ca -0.33 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 56.83 1ovm h GLN 362 Cb 1.21 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 28.49 1ovm h GLN 362 CO 0.54 0.42 -0.08 1.49 -0.95 0.00 0.00 178.83 180.25 1ovm h GLU 363 N 0.65 -0.11 0.00 1.46 4.57 -1.96 -2.15 114.58 117.04 1ovm h GLU 363 Ca 0.45 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.63 1ovm h GLU 363 Cb 0.59 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 1ovm h GLU 363 CO -0.34 -0.07 0.00 -2.95 -1.18 0.00 0.00 179.01 174.47 1ovm h ASN 364 N -0.12 0.00 0.00 1.04 7.08 -1.88 -2.78 115.58 118.93 1ovm h ASN 364 Ca -0.00 0.00 -0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1ovm h ASN 364 Cb 0.12 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.36 1ovm h ASN 364 CO -0.05 0.00 -0.00 0.15 -2.08 0.00 0.00 177.43 175.45 1ovm h PHE 365 N 0.00 -0.00 0.00 4.14 3.57 -0.65 -1.71 116.94 122.28 1ovm h PHE 365 Ca 0.00 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.42 1ovm h PHE 365 Cb 0.43 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 1ovm h PHE 365 CO 0.00 0.41 -0.39 -1.49 -2.23 0.00 0.00 178.31 174.61 1ovm h TRP 366 N -0.43 0.00 -0.49 0.41 4.06 -1.33 -1.24 115.95 116.94 1ovm h TRP 366 Ca -0.00 0.00 -0.12 0.00 2.06 0.00 0.00 58.89 60.83 1ovm h TRP 366 Cb 0.42 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.57 1ovm h TRP 366 CO 0.07 0.39 -0.15 -0.09 -3.56 0.00 0.00 178.44 175.10 1ovm h ARG 367 N 0.00 0.96 -0.22 0.49 9.65 -1.45 -1.85 114.38 121.96 1ovm h ARG 367 Ca -0.00 -0.39 -0.06 0.00 -1.10 0.00 0.00 59.98 58.44 1ovm h ARG 367 Cb 0.82 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.35 1ovm h ARG 367 CO 0.05 1.05 -0.08 1.15 2.80 0.00 0.00 179.97 184.95 1ovm h THR 368 N 0.82 1.29 -0.39 0.20 2.02 -0.95 -2.85 112.91 113.05 1ovm h THR 368 Ca 0.12 -1.11 0.05 0.00 0.77 0.00 0.00 66.41 66.24 1ovm h THR 368 Cb 0.72 1.56 -0.02 0.00 -1.74 0.00 0.00 68.15 68.67 1ovm h THR 368 CO 0.06 0.34 0.26 0.25 0.37 0.00 0.00 175.52 176.80 1ovm h LEU 369 N 0.16 0.30 -0.60 2.58 5.85 -1.13 -2.30 115.31 120.16 1ovm h LEU 369 Ca 0.05 -0.00 0.07 0.00 0.84 0.00 0.00 57.88 58.84 1ovm h LEU 369 Cb 0.55 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.46 1ovm h LEU 369 CO 0.03 0.20 0.28 -0.61 -0.34 0.00 0.00 178.44 178.00 1ovm h GLN 370 N 0.34 0.50 0.00 1.25 5.75 -1.08 -0.34 115.11 121.52 1ovm h GLN 370 Ca 0.17 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.64 1ovm h GLN 370 Cb 0.23 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 28.67 1ovm h GLN 370 CO -0.04 0.33 0.00 0.25 -2.65 0.00 0.00 178.83 176.72 1ovm n THR 371 N -4.91 0.32 -0.05 2.39 -2.24 -0.87 -3.68 114.28 105.24 1ovm n THR 371 Ca 0.08 0.08 -0.17 0.00 -2.27 0.00 0.00 64.05 61.76 1ovm n THR 371 Cb 0.22 -0.70 -0.14 0.00 -2.10 0.00 0.00 70.33 67.61 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 -1.33 0.76 -1.86 4.78 7.35 -0.17 -4.96 117.46 122.03 1ovm n PHE 372 Ca 0.10 0.18 -0.41 0.00 -0.76 0.00 0.00 57.45 56.57 1ovm n PHE 372 Cb 0.20 -1.11 0.00 0.00 0.35 0.00 0.00 39.48 38.92 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 2.19 0.09 -2.13 -4.36 -1.02 -5.02 121.20 108.40 1ovm s ILE 373 Ca -0.22 0.18 0.03 0.00 -0.26 0.00 0.00 60.65 60.38 1ovm s ILE 373 Cb 0.07 -3.11 -0.04 0.00 1.25 0.00 0.00 42.46 40.63 1ovm s ILE 373 CO 0.74 0.04 -0.08 -0.60 0.24 0.00 0.00 174.94 175.28 1ovm s ARG 374 N -2.16 0.81 0.66 0.37 6.06 -1.26 -4.94 118.95 118.49 1ovm s ARG 374 Ca 0.55 -1.20 -0.17 0.00 -2.50 0.00 0.00 55.73 52.40 1ovm s ARG 374 Cb -0.44 -0.35 -0.04 0.00 0.06 0.00 0.00 34.95 34.17 1ovm s ARG 374 CO 0.59 0.03 0.72 -2.30 -2.50 0.00 0.00 175.30 171.84 1ovm n PRO 375 N 0.35 0.52 -0.97 5.12 -0.02 -1.26 -2.28 135.00 136.46 1ovm n PRO 375 Ca -0.15 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 1ovm n PRO 375 Cb 0.59 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.11 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 1.49 0.97 3.82 -1.23 0.00 0.46 -4.98 105.19 105.71 1ovm n GLY 376 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.97 6.04 -0.26 1.61 1.01 -0.97 -4.23 116.67 116.90 1ovm s ASP 377 Ca 0.00 1.73 0.02 0.00 0.71 0.00 0.00 52.55 55.01 1ovm s ASP 377 Cb 0.00 -2.52 0.07 0.00 1.01 0.00 0.00 42.92 41.47 1ovm s ASP 377 CO 0.00 -0.99 -0.06 -0.63 0.21 0.00 0.00 175.17 173.70 1ovm s ILE 378 N -2.54 1.89 -0.16 0.77 1.01 -0.18 -0.91 121.20 121.08 1ovm s ILE 378 Ca 0.62 -1.57 -0.03 0.00 0.00 0.00 0.00 60.65 59.67 1ovm s ILE 378 Cb -0.14 -2.13 -0.02 0.00 0.01 0.00 0.00 42.46 40.18 1ovm s ILE 378 CO 0.36 -0.16 -0.06 -0.63 0.00 0.00 0.00 174.94 174.45 1ovm s ILE 379 N 1.20 3.59 -0.07 2.92 1.01 -0.25 0.20 121.20 129.80 1ovm s ILE 379 Ca -0.04 -0.46 0.05 0.00 0.00 0.00 0.00 60.65 60.19 1ovm s ILE 379 Cb -0.19 -2.57 -0.00 0.00 0.01 0.00 0.00 42.46 39.71 1ovm s ILE 379 CO -0.07 0.49 -0.22 -0.76 0.00 0.00 0.00 174.94 174.38 1ovm s LEU 380 N 0.54 2.02 -0.05 2.97 1.02 -0.06 0.09 118.68 125.21 1ovm s LEU 380 Ca -0.05 -0.49 0.02 0.00 0.02 0.00 0.00 54.13 53.63 1ovm s LEU 380 Cb -0.15 -1.28 0.02 0.00 0.02 0.00 0.00 46.19 44.80 1ovm s LEU 380 CO 0.03 0.18 -0.08 0.00 0.02 0.00 0.00 176.35 176.50 1ovm s ALA 381 N 0.11 0.93 0.73 4.21 0.00 -1.03 0.38 121.76 127.09 1ovm s ALA 381 Ca -0.10 -0.22 -0.07 0.00 0.00 0.00 0.00 51.96 51.57 1ovm s ALA 381 Cb -0.15 -0.47 0.07 0.00 0.00 0.00 0.00 23.12 22.57 1ovm s ALA 381 CO 0.05 0.06 1.04 0.34 0.00 0.00 0.00 175.76 177.26 1ovm s ASP 382 N 0.74 4.71 0.58 0.00 -1.08 -0.58 -4.52 116.67 116.52 1ovm s ASP 382 Ca -0.12 0.47 -0.20 0.00 -0.52 0.00 0.00 52.55 52.17 1ovm s ASP 382 Cb -0.15 -1.08 -0.04 0.00 -1.46 0.00 0.00 42.92 40.20 1ovm s ASP 382 CO 0.02 -1.68 1.32 1.67 0.52 0.00 0.00 175.17 177.02 1ovm n GLN 383 N -3.00 1.48 0.00 4.34 -0.06 -1.26 -1.14 117.38 117.75 1ovm n GLN 383 Ca 0.08 0.55 0.00 0.00 -2.00 0.00 0.00 57.00 55.64 1ovm n GLN 383 Cb 0.60 -2.54 0.00 0.00 -4.06 0.00 0.00 30.24 24.24 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 0.83 0.06 0.26 1.69 0.00 -1.26 -4.59 105.19 102.19 1ovm n GLY 384 Ca 0.12 -2.04 0.05 0.00 0.00 0.00 0.00 46.02 44.16 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 1.08 0.47 2.61 1.35 -1.97 -2.53 112.91 113.93 1ovm h THR 385 Ca 0.00 -0.27 -0.02 0.00 -0.55 0.00 0.00 66.41 65.57 1ovm h THR 385 Cb 0.00 0.95 -0.01 0.00 -1.73 0.00 0.00 68.15 67.36 1ovm h THR 385 CO 0.00 0.09 -0.36 0.28 -0.25 0.00 0.00 175.52 175.29 1ovm h SER 386 N 0.19 -0.93 -0.46 5.36 0.02 -1.81 -0.63 113.55 115.29 1ovm h SER 386 Ca 0.05 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1ovm h SER 386 Cb 0.09 0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.90 1ovm h SER 386 CO -0.00 -0.51 0.29 0.00 -1.14 0.00 0.00 176.83 175.47 1ovm h ALA 387 N -1.28 0.58 -0.01 3.77 0.00 -1.04 0.15 119.26 121.44 1ovm h ALA 387 Ca -0.06 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1ovm h ALA 387 Cb 0.66 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1ovm h ALA 387 CO 0.02 0.06 0.00 1.19 0.00 0.00 0.00 179.25 180.52 1ovm n PHE 388 N -4.74 0.01 -0.12 0.00 3.72 -0.96 -2.23 117.46 113.14 1ovm n PHE 388 Ca 0.02 -0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.21 1ovm n PHE 388 Cb 0.04 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.48 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 0.97 -0.35 0.31 1.37 0.00 -0.25 -4.37 105.19 102.87 1ovm n GLY 389 Ca 0.21 -0.14 0.20 0.00 0.00 0.00 0.00 46.02 46.29 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 -0.33 1.00 0.00 4.61 0.00 -0.90 -2.49 119.26 121.15 1ovm h ALA 390 Ca -0.55 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1ovm h ALA 390 Cb 1.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1ovm h ALA 390 CO -0.19 0.00 0.00 0.97 0.00 0.00 0.00 179.25 180.03 1ovm h ILE 391 N 0.00 0.00 -0.01 0.00 2.10 -1.65 -1.22 117.51 116.73 1ovm h ILE 391 Ca 0.00 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 65.82 1ovm h ILE 391 Cb 0.21 1.10 0.00 0.00 -1.09 0.00 0.00 36.82 37.03 1ovm h ILE 391 CO 0.00 0.00 -0.23 0.47 -1.08 0.00 0.00 178.15 177.31 1ovm n ASP 392 N -3.03 1.73 -4.72 2.19 8.00 -0.94 -4.63 116.55 115.15 1ovm n ASP 392 Ca -0.02 -1.37 -0.42 0.00 0.71 0.00 0.00 54.79 53.69 1ovm n ASP 392 Cb 0.13 0.19 -0.03 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 -2.32 4.37 -0.58 0.64 1.43 -0.46 -4.94 118.68 116.82 1ovm s LEU 393 Ca 0.26 2.58 -0.23 0.00 -1.03 0.00 0.00 54.13 55.72 1ovm s LEU 393 Cb 0.19 -3.59 0.06 0.00 0.03 0.00 0.00 46.19 42.88 1ovm s LEU 393 CO 0.47 -0.81 0.88 -0.60 0.23 0.00 0.00 176.35 176.51 1ovm s ARG 394 N 1.25 3.21 0.20 1.70 3.52 -1.26 -5.02 118.95 122.56 1ovm s ARG 394 Ca 0.70 -0.59 -0.29 0.00 -0.13 0.00 0.00 55.73 55.42 1ovm s ARG 394 Cb -0.43 -4.12 -0.08 0.00 -1.56 0.00 0.00 34.95 28.76 1ovm s ARG 394 CO 0.31 -1.54 0.90 -0.51 -0.81 0.00 0.00 175.30 173.65 1ovm s LEU 395 N 3.70 4.62 0.00 -0.88 1.43 -1.26 -4.92 118.68 121.36 1ovm s LEU 395 Ca 0.24 1.85 0.00 0.00 -1.03 0.00 0.00 54.13 55.19 1ovm s LEU 395 Cb -0.15 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.54 1ovm s LEU 395 CO 0.15 0.15 0.00 -2.65 0.23 0.00 0.00 176.35 174.22 1ovm n PRO 396 N 1.68 0.30 -2.32 1.29 -0.02 -1.26 -1.36 135.00 133.31 1ovm n PRO 396 Ca -0.02 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.19 1ovm n PRO 396 Cb 0.48 0.00 0.04 0.00 -0.02 0.00 0.00 33.50 34.00 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 -3.67 3.25 -1.54 3.55 0.00 -1.26 -4.40 121.76 117.69 1ovm s ALA 397 Ca 0.00 -0.74 -0.05 0.00 0.00 0.00 0.00 51.96 51.17 1ovm s ALA 397 Cb 0.00 -2.62 0.04 0.00 0.00 0.00 0.00 23.12 20.55 1ovm s ALA 397 CO 0.00 -0.95 0.36 -0.25 0.00 0.00 0.00 175.76 174.92 1ovm n ASP 398 N -2.69 -0.53 -4.26 0.00 8.00 -1.26 -3.27 116.55 112.54 1ovm n ASP 398 Ca 0.06 -1.11 -0.32 0.00 0.71 0.00 0.00 54.79 54.12 1ovm n ASP 398 Cb 0.58 -2.43 -0.16 0.00 -0.02 0.00 0.00 41.12 39.09 1ovm n ASP 398 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ovm s VAL 399 N -3.93 2.19 -0.42 2.53 0.11 -1.26 -0.41 120.40 119.21 1ovm s VAL 399 Ca 0.19 -0.99 -0.18 0.00 -2.93 0.00 0.00 61.98 58.07 1ovm s VAL 399 Cb -0.11 -1.83 0.02 0.00 -1.53 0.00 0.00 36.38 32.94 1ovm s VAL 399 CO 0.94 0.56 0.45 0.21 -3.33 0.00 0.00 175.10 173.94 1ovm s ASN 400 N 0.14 6.20 -0.44 3.54 3.04 -0.09 -4.77 114.94 122.57 1ovm s ASN 400 Ca -0.12 -0.66 -0.16 0.00 0.04 0.00 0.00 52.86 51.96 1ovm s ASN 400 Cb -0.16 -2.23 0.04 0.00 -1.54 0.00 0.00 41.25 37.36 1ovm s ASN 400 CO 0.07 -0.60 0.38 0.12 -3.04 0.00 0.00 177.10 174.02 1ovm s PHE 401 N 2.19 3.22 -0.32 0.43 5.36 -1.26 -1.09 117.98 126.51 1ovm s PHE 401 Ca 0.13 -0.65 -0.10 0.00 -0.96 0.00 0.00 56.93 55.35 1ovm s PHE 401 Cb -0.17 -2.89 -0.01 0.00 -0.34 0.00 0.00 43.02 39.61 1ovm s PHE 401 CO 0.14 -0.71 0.16 0.42 -1.46 0.00 0.00 175.22 173.78 1ovm s ILE 402 N 1.82 4.67 0.05 3.12 1.01 0.11 -4.83 121.20 127.15 1ovm s ILE 402 Ca 0.07 -0.41 -0.00 0.00 0.00 0.00 0.00 60.65 60.30 1ovm s ILE 402 Cb -0.20 -3.39 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 1ovm s ILE 402 CO 0.10 0.05 -0.04 0.54 0.00 0.00 0.00 174.94 175.59 1ovm s VAL 403 N 1.62 0.27 -0.49 2.92 0.11 -1.26 -2.45 120.40 121.12 1ovm s VAL 403 Ca 0.05 -1.61 0.07 0.00 -2.93 0.00 0.00 61.98 57.56 1ovm s VAL 403 Cb -0.17 -1.24 0.26 0.00 -1.53 0.00 0.00 36.38 33.70 1ovm s VAL 403 CO 0.07 -0.85 0.63 1.67 -3.33 0.00 0.00 175.10 173.29 1ovm n GLN 404 N 0.46 1.51 0.03 1.54 7.27 -1.26 -4.95 117.38 121.97 1ovm n GLN 404 Ca -0.16 -3.84 -0.03 0.00 0.07 0.00 0.00 57.00 53.03 1ovm n GLN 404 Cb 0.59 -1.67 0.20 0.00 2.41 0.00 0.00 30.24 31.77 1ovm n GLN 404 CO 0.00 0.00 0.00 -1.35 0.07 0.00 0.00 177.06 175.78 1ovm h PRO 405 N 3.99 0.44 0.21 3.69 0.11 -1.96 -0.19 132.00 138.29 1ovm h PRO 405 Ca 0.12 -0.18 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 1ovm h PRO 405 Cb 0.79 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.88 1ovm h PRO 405 CO 0.62 0.69 -0.10 1.25 -0.21 0.00 0.00 178.00 180.25 1ovm h LEU 406 N 0.39 -0.24 -0.13 2.35 5.85 -1.96 -3.36 115.31 118.21 1ovm h LEU 406 Ca 0.05 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 1ovm h LEU 406 Cb 0.71 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.80 1ovm h LEU 406 CO 0.05 0.25 -0.01 -0.25 -0.34 0.00 0.00 178.44 178.14 1ovm h TRP 407 N -1.05 0.26 -5.79 1.25 -0.00 -1.90 -3.48 115.95 105.23 1ovm h TRP 407 Ca -0.03 -0.05 -0.36 0.00 -0.00 0.00 0.00 58.89 58.45 1ovm h TRP 407 Cb 0.29 -0.07 0.13 0.00 -0.00 0.00 0.00 29.16 29.52 1ovm h TRP 407 CO 0.02 0.50 -0.79 0.41 -0.00 0.00 0.00 178.44 178.58 1ovm n GLY 408 N -0.21 -0.34 3.53 2.65 0.00 -0.08 -4.99 105.19 105.74 1ovm n GLY 408 Ca -0.06 0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 -4.33 6.32 0.41 1.61 0.15 -1.26 -4.95 113.70 111.65 1ovm s SER 409 Ca 0.02 -0.21 -0.26 0.00 0.70 0.00 0.00 55.95 56.20 1ovm s SER 409 Cb -0.01 -2.29 -0.08 0.00 -1.71 0.00 0.00 66.02 61.92 1ovm s SER 409 CO 0.76 -0.64 1.28 0.27 1.20 0.00 0.00 173.24 176.10 1ovm s ILE 410 N 2.59 2.72 0.00 6.45 -4.36 -1.26 -2.64 121.20 124.70 1ovm s ILE 410 Ca 0.20 0.63 0.00 0.00 -0.26 0.00 0.00 60.65 61.22 1ovm s ILE 410 Cb -0.15 -3.37 0.00 0.00 1.25 0.00 0.00 42.46 40.20 1ovm s ILE 410 CO 0.16 0.08 0.00 0.61 0.24 0.00 0.00 174.94 176.03 1ovm n GLY 411 N 0.67 3.03 0.19 6.27 0.00 -1.25 -4.92 105.19 109.18 1ovm n GLY 411 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.36 -0.74 1.61 3.20 -1.83 -3.21 116.97 115.64 1ovm h TYR 412 Ca 0.00 0.02 0.07 0.00 3.14 0.00 0.00 58.73 61.96 1ovm h TYR 412 Cb 0.00 0.18 -0.06 0.00 1.54 0.00 0.00 36.73 38.39 1ovm h TYR 412 CO 0.00 -0.21 0.42 1.79 -1.64 0.00 0.00 178.16 178.52 1ovm h THR 413 N -0.17 0.95 -0.74 1.81 1.35 -1.91 0.23 112.91 114.43 1ovm h THR 413 Ca 0.10 -0.26 0.02 0.00 -0.55 0.00 0.00 66.41 65.72 1ovm h THR 413 Cb 0.31 0.14 -0.04 0.00 -1.73 0.00 0.00 68.15 66.83 1ovm h THR 413 CO -0.25 0.14 0.48 0.25 -0.25 0.00 0.00 175.52 175.89 1ovm h LEU 414 N 0.75 0.81 -0.05 3.87 5.85 -1.94 0.27 115.31 124.86 1ovm h LEU 414 Ca 0.34 -0.01 -0.23 0.00 0.84 0.00 0.00 57.88 58.82 1ovm h LEU 414 Cb 0.25 -0.19 0.02 0.00 0.37 0.00 0.00 40.66 41.10 1ovm h LEU 414 CO -0.21 0.57 -0.85 0.00 -0.34 0.00 0.00 178.44 177.61 1ovm h ALA 415 N 1.30 0.17 -0.97 1.25 0.00 -1.53 -3.11 119.26 116.37 1ovm h ALA 415 Ca 0.29 -0.63 0.06 0.00 0.00 0.00 0.00 54.91 54.63 1ovm h ALA 415 Cb -0.04 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 1ovm h ALA 415 CO -0.09 0.60 0.63 0.00 0.00 0.00 0.00 179.25 180.39 1ovm h ALA 416 N 0.43 1.43 -0.63 0.00 0.00 -0.12 -1.39 119.26 118.99 1ovm h ALA 416 Ca -0.09 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.83 1ovm h ALA 416 Cb 1.51 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 1ovm h ALA 416 CO 0.17 0.43 0.36 0.00 0.00 0.00 0.00 179.25 180.21 1ovm h ALA 417 N 1.47 0.83 -0.89 0.00 0.00 -0.42 0.36 119.26 120.61 1ovm h ALA 417 Ca 0.41 0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.40 1ovm h ALA 417 Cb 0.15 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.73 1ovm h ALA 417 CO -0.16 0.07 0.55 0.35 0.00 0.00 0.00 179.25 180.06 1ovm h PHE 418 N 0.69 1.01 -0.49 0.00 3.57 -1.20 0.13 116.94 120.65 1ovm h PHE 418 Ca 0.27 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.73 1ovm h PHE 418 Cb 0.10 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.50 1ovm h PHE 418 CO -0.07 0.48 0.04 0.78 -2.23 0.00 0.00 178.31 177.31 1ovm h GLY 419 N 0.97 0.90 0.85 2.40 0.00 -0.72 -1.79 103.07 105.69 1ovm h GLY 419 Ca 0.40 -0.63 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 1ovm h GLY 419 CO -0.20 0.59 0.02 0.00 0.00 0.00 0.00 176.54 176.94 1ovm h ALA 420 N 0.95 0.05 -0.71 3.60 0.00 0.05 -1.84 119.26 121.37 1ovm h ALA 420 Ca 0.14 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.07 1ovm h ALA 420 Cb 0.46 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.16 1ovm h ALA 420 CO 0.02 -0.36 0.34 1.96 0.00 0.00 0.00 179.25 181.21 1ovm h GLN 421 N -0.09 0.56 -0.52 0.00 1.08 -0.73 0.35 115.11 115.77 1ovm h GLN 421 Ca 0.01 -0.03 0.02 0.00 -1.45 0.00 0.00 58.65 57.20 1ovm h GLN 421 Cb 0.16 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 1ovm h GLN 421 CO -0.00 0.37 0.35 1.15 -0.95 0.00 0.00 178.83 179.75 1ovm h THR 422 N 0.58 1.08 0.07 -0.54 2.02 -0.98 -2.21 112.91 112.92 1ovm h THR 422 Ca 0.35 -0.21 -0.25 0.00 0.77 0.00 0.00 66.41 67.07 1ovm h THR 422 Cb 0.39 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 1ovm h THR 422 CO -0.28 0.11 -1.15 0.00 0.37 0.00 0.00 175.52 174.58 1ovm h ALA 423 N 1.69 0.22 -2.58 6.16 0.00 -0.05 -3.39 119.26 121.31 1ovm h ALA 423 Ca 0.20 -0.91 -0.60 0.00 0.00 0.00 0.00 54.91 53.60 1ovm h ALA 423 Cb 0.05 -0.05 -0.40 0.00 0.00 0.00 0.00 17.79 17.38 1ovm h ALA 423 CO -0.05 1.11 -0.78 0.00 0.00 0.00 0.00 179.25 179.53 1ovm h PRO 425 N 5.14 0.00 -0.66 0.00 0.11 -1.64 -2.65 132.00 132.30 1ovm h PRO 425 Ca 0.19 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.08 1ovm h PRO 425 Cb 0.81 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 31.79 1ovm h PRO 425 CO 0.58 0.00 0.23 0.09 -0.21 0.00 0.00 178.00 178.70 1ovm n ASN 426 N -4.45 4.29 -4.29 -2.05 3.02 -1.26 -4.94 115.26 105.58 1ovm n ASN 426 Ca 0.02 -3.32 -0.28 0.00 -0.03 0.00 0.00 54.58 50.97 1ovm n ASN 426 Cb 0.28 -0.72 -0.14 0.00 -0.61 0.00 0.00 39.78 38.59 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 -3.05 1.56 -0.19 3.52 0.52 -1.00 -5.10 118.95 115.22 1ovm s ARG 427 Ca 0.52 -1.02 -0.29 0.00 -0.52 0.00 0.00 55.73 54.42 1ovm s ARG 427 Cb 0.43 -1.71 -0.00 0.00 0.52 0.00 0.00 34.95 34.18 1ovm s ARG 427 CO 0.11 0.44 1.15 0.50 0.02 0.00 0.00 175.30 177.52 1ovm s ARG 428 N -1.23 4.25 -0.29 3.54 3.52 -1.26 -4.93 118.95 122.54 1ovm s ARG 428 Ca 0.09 1.52 -0.10 0.00 -0.13 0.00 0.00 55.73 57.11 1ovm s ARG 428 Cb -0.09 -3.70 -0.02 0.00 -1.56 0.00 0.00 34.95 29.58 1ovm s ARG 428 CO 0.02 -0.65 0.16 0.08 -0.81 0.00 0.00 175.30 174.10 1ovm s VAL 429 N 3.28 4.84 -0.27 7.11 1.01 -1.26 -1.01 120.40 134.10 1ovm s VAL 429 Ca 0.50 -0.18 -0.09 0.00 0.00 0.00 0.00 61.98 62.21 1ovm s VAL 429 Cb -0.19 -3.39 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 1ovm s VAL 429 CO 0.11 0.16 0.12 -0.63 0.00 0.00 0.00 175.10 174.86 1ovm s ILE 430 N 1.67 4.66 -0.30 2.22 1.09 0.13 -1.28 121.20 129.39 1ovm s ILE 430 Ca 0.06 -0.13 -0.08 0.00 -1.10 0.00 0.00 60.65 59.40 1ovm s ILE 430 Cb -0.16 -3.24 0.00 0.00 -1.06 0.00 0.00 42.46 38.00 1ovm s ILE 430 CO 0.08 0.25 0.11 -0.69 -0.10 0.00 0.00 174.94 174.59 1ovm s VAL 431 N 1.66 4.24 -0.41 2.92 1.01 -0.39 -0.89 120.40 128.54 1ovm s VAL 431 Ca 0.06 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.36 1ovm s VAL 431 Cb -0.16 -3.18 0.06 0.00 0.00 0.00 0.00 36.38 33.10 1ovm s VAL 431 CO 0.06 0.07 0.24 -0.76 0.00 0.00 0.00 175.10 174.71 1ovm s LEU 432 N 1.55 5.01 0.03 3.92 1.43 0.16 -0.48 118.68 130.29 1ovm s LEU 432 Ca 0.03 -1.32 0.02 0.00 -1.03 0.00 0.00 54.13 51.83 1ovm s LEU 432 Cb -0.17 -2.01 -0.02 0.00 0.03 0.00 0.00 46.19 44.03 1ovm s LEU 432 CO 0.04 -0.49 -0.08 0.28 0.23 0.00 0.00 176.35 176.33 1ovm s THR 433 N 1.48 0.57 0.76 5.49 -1.32 -0.84 -1.53 115.64 120.25 1ovm s THR 433 Ca 0.02 -0.78 -0.12 0.00 -1.21 0.00 0.00 61.69 59.61 1ovm s THR 433 Cb -0.22 -0.57 0.05 0.00 -1.51 0.00 0.00 72.50 70.25 1ovm s THR 433 CO 0.04 -0.16 1.11 -0.83 -2.21 0.00 0.00 174.62 172.56 1ovm s GLY 434 N -1.04 1.62 0.26 6.08 0.00 -1.26 -1.05 107.32 111.93 1ovm s GLY 434 Ca -0.04 -0.36 0.09 0.00 0.00 0.00 0.00 44.72 44.41 1ovm s GLY 434 CO 0.00 0.06 1.59 1.29 0.00 0.00 0.00 173.10 176.05 1ovm h ASP 435 N -0.90 0.05 -0.04 1.64 2.03 -1.80 -2.16 116.42 115.23 1ovm h ASP 435 Ca -0.46 -0.03 -0.01 0.00 -0.73 0.00 0.00 57.03 55.80 1ovm h ASP 435 Cb 1.27 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 39.76 1ovm h ASP 435 CO 0.63 0.67 -0.02 1.23 -1.03 0.00 0.00 179.24 180.71 1ovm h GLY 436 N 1.81 0.09 0.73 7.15 0.00 -1.87 -3.23 103.07 107.74 1ovm h GLY 436 Ca -0.01 -0.08 0.02 0.00 0.00 0.00 0.00 47.33 47.27 1ovm h GLY 436 CO 0.08 0.07 -0.05 0.00 0.00 0.00 0.00 176.54 176.65 1ovm h ALA 437 N 0.60 0.04 -0.28 3.60 0.00 -1.91 -2.79 119.26 118.53 1ovm h ALA 437 Ca 0.01 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.04 1ovm h ALA 437 Cb 0.45 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1ovm h ALA 437 CO 0.01 -0.51 0.27 0.00 0.00 0.00 0.00 179.25 179.02 1ovm h ALA 438 N 1.06 1.99 -0.14 0.00 0.00 -1.46 -1.91 119.26 118.80 1ovm h ALA 438 Ca 0.06 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1ovm h ALA 438 Cb 0.13 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1ovm h ALA 438 CO -0.13 -0.42 -0.22 1.96 0.00 0.00 0.00 179.25 180.44 1ovm h GLN 439 N 0.00 0.24 0.00 0.00 4.20 -1.51 -0.77 115.11 117.27 1ovm h GLN 439 Ca 0.13 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.70 1ovm h GLN 439 Cb 0.68 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.43 1ovm h GLN 439 CO -0.00 0.46 -0.32 -0.07 -0.67 0.00 0.00 178.83 178.23 1ovm h LEU 440 N 0.22 0.00 -2.52 1.46 4.07 -1.47 -3.29 115.31 113.78 1ovm h LEU 440 Ca 0.04 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.98 1ovm h LEU 440 Cb 0.52 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.23 1ovm h LEU 440 CO 0.04 0.32 -0.36 0.35 -1.08 0.00 0.00 178.44 177.71 1ovm n THR 441 N -3.89 0.85 -0.29 0.22 -2.24 -1.16 -4.90 114.28 102.87 1ovm n THR 441 Ca -0.02 -1.13 0.11 0.00 -2.27 0.00 0.00 64.05 60.74 1ovm n THR 441 Cb 0.39 0.22 0.26 0.00 -2.10 0.00 0.00 70.33 69.09 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 4.00 0.37 0.00 2.28 6.09 -1.21 -1.58 117.51 127.45 1ovm h ILE 442 Ca -0.02 -0.08 0.00 0.00 -1.37 0.00 0.00 64.86 63.39 1ovm h ILE 442 Cb 1.27 0.12 0.00 0.00 0.47 0.00 0.00 36.82 38.68 1ovm h ILE 442 CO 0.01 0.04 0.23 0.06 -3.07 0.00 0.00 178.15 175.41 1ovm h GLN 443 N 0.23 0.00 0.00 2.19 -0.00 -1.89 0.26 115.11 115.90 1ovm h GLN 443 Ca 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.16 1ovm h GLN 443 Cb 0.99 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.47 1ovm h GLN 443 CO -0.62 0.00 0.00 1.49 -0.00 0.00 0.00 178.83 179.70 1ovm h GLU 444 N 0.00 0.00 0.00 0.06 4.57 -1.68 -2.13 114.58 115.40 1ovm h GLU 444 Ca 0.00 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.13 1ovm h GLU 444 Cb 0.45 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 1ovm h GLU 444 CO 0.00 0.00 -0.23 1.25 -1.18 0.00 0.00 179.01 178.85 1ovm h LEU 445 N 0.00 0.00 -1.10 1.64 5.85 -0.66 -0.39 115.31 120.65 1ovm h LEU 445 Ca 0.00 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.64 1ovm h LEU 445 Cb 0.59 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 1ovm h LEU 445 CO 0.00 0.23 -0.37 1.23 -0.34 0.00 0.00 178.44 179.18 1ovm h GLY 446 N 0.99 0.00 1.62 3.75 0.00 -1.53 -2.16 103.07 105.73 1ovm h GLY 446 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.09 1ovm h GLY 446 CO 0.03 0.00 -1.06 1.76 0.00 0.00 0.00 176.54 177.27 1ovm h SER 447 N 0.00 0.45 -0.40 0.19 0.02 -1.17 -1.23 113.55 111.41 1ovm h SER 447 Ca -0.00 -0.41 -0.01 0.00 -0.84 0.00 0.00 61.79 60.52 1ovm h SER 447 Cb 0.81 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.19 1ovm h SER 447 CO 0.05 1.25 0.19 0.24 -1.14 0.00 0.00 176.83 177.42 1ovm h MET 448 N 0.15 0.58 0.16 3.45 2.07 -1.11 -1.30 114.93 118.93 1ovm h MET 448 Ca -0.10 -0.08 -0.01 0.00 -2.07 0.00 0.00 59.70 57.44 1ovm h MET 448 Cb 1.74 -0.10 0.00 0.00 -1.87 0.00 0.00 31.60 31.36 1ovm h MET 448 CO 0.18 0.51 -0.08 -0.07 1.07 0.00 0.00 176.91 178.51 1ovm h LEU 449 N 0.51 -0.18 -0.97 1.22 4.07 -1.39 -0.86 115.31 117.71 1ovm h LEU 449 Ca 0.14 -0.05 0.12 0.00 0.08 0.00 0.00 57.88 58.17 1ovm h LEU 449 Cb 0.12 0.05 -0.08 0.00 1.08 0.00 0.00 40.66 41.82 1ovm h LEU 449 CO -0.02 -0.07 0.60 -0.09 -1.08 0.00 0.00 178.44 177.78 1ovm h ARG 450 N -0.28 0.91 -0.23 1.13 2.43 -1.04 0.71 114.38 118.01 1ovm h ARG 450 Ca -0.02 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1ovm h ARG 450 Cb 0.22 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1ovm h ARG 450 CO 0.04 0.60 0.00 -0.25 -1.51 0.00 0.00 179.97 178.85 1ovm n ASP 451 N -4.66 1.52 -3.81 -3.80 8.00 -0.50 -4.94 116.55 108.36 1ovm n ASP 451 Ca 0.18 -1.85 -0.23 0.00 0.71 0.00 0.00 54.79 53.60 1ovm n ASP 451 Cb 0.36 -0.15 0.01 0.00 -0.02 0.00 0.00 41.12 41.31 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 0.28 -4.13 -2.55 -1.24 5.02 0.24 -4.98 118.16 110.80 1ovm n LYS 452 Ca 0.13 0.52 -0.29 0.00 -2.02 0.00 0.00 58.31 56.64 1ovm n LYS 452 Cb 0.27 -4.87 -0.01 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 -6.23 3.67 -0.50 1.97 -0.21 -0.46 -4.99 119.66 112.91 1ovm s GLN 453 Ca 0.01 0.46 0.06 0.00 0.02 0.00 0.00 55.36 55.91 1ovm s GLN 453 Cb -0.00 -2.31 0.38 0.00 1.00 0.00 0.00 33.01 32.08 1ovm s GLN 453 CO 0.85 -0.22 0.99 0.72 -2.12 0.00 0.00 175.29 175.51 1ovm n HIS 454 N -1.96 3.35 -2.38 0.91 8.25 -1.26 -3.71 115.22 118.42 1ovm n HIS 454 Ca 0.03 -3.61 -0.31 0.00 -0.26 0.00 0.00 57.72 53.56 1ovm n HIS 454 Cb 0.54 -0.34 -0.02 0.00 1.12 0.00 0.00 29.99 31.30 1ovm n HIS 454 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1ovm s PRO 455 N -3.39 3.79 -0.38 -0.41 0.04 -1.26 -4.68 135.00 128.70 1ovm s PRO 455 Ca 0.47 0.73 -0.10 0.00 0.04 0.00 0.00 61.00 62.14 1ovm s PRO 455 Cb 0.34 -2.20 0.04 0.00 0.04 0.00 0.00 34.50 32.72 1ovm s PRO 455 CO -0.14 -0.29 0.21 -1.50 0.04 0.00 0.00 177.00 175.31 1ovm s ILE 456 N -2.72 4.39 -0.24 0.56 1.10 -0.41 -2.00 121.20 121.88 1ovm s ILE 456 Ca 0.55 -1.03 -0.10 0.00 -0.51 0.00 0.00 60.65 59.57 1ovm s ILE 456 Cb -0.10 -3.51 -0.04 0.00 0.15 0.00 0.00 42.46 38.95 1ovm s ILE 456 CO 0.38 -0.30 0.14 -0.63 -2.11 0.00 0.00 174.94 172.42 1ovm s ILE 457 N 1.50 5.05 -0.26 2.00 1.01 0.14 -1.26 121.20 129.38 1ovm s ILE 457 Ca 0.02 0.07 -0.03 0.00 0.00 0.00 0.00 60.65 60.70 1ovm s ILE 457 Cb -0.20 -3.36 0.02 0.00 0.01 0.00 0.00 42.46 38.93 1ovm s ILE 457 CO 0.05 0.34 -0.01 -0.76 0.00 0.00 0.00 174.94 174.55 1ovm s LEU 458 N 1.25 3.38 -0.37 2.97 1.02 0.36 -0.20 118.68 127.10 1ovm s LEU 458 Ca 0.06 -0.78 -0.15 0.00 0.02 0.00 0.00 54.13 53.29 1ovm s LEU 458 Cb -0.14 -1.74 0.00 0.00 0.02 0.00 0.00 46.19 44.33 1ovm s LEU 458 CO 0.05 -0.14 0.33 -0.69 0.02 0.00 0.00 176.35 175.92 1ovm s VAL 459 N 1.39 5.21 -0.80 -1.59 1.01 -0.34 -1.99 120.40 123.30 1ovm s VAL 459 Ca 0.01 -0.29 -0.26 0.00 0.00 0.00 0.00 61.98 61.45 1ovm s VAL 459 Cb -0.17 -3.86 0.02 0.00 0.00 0.00 0.00 36.38 32.37 1ovm s VAL 459 CO -0.02 -0.19 1.46 -0.76 0.00 0.00 0.00 175.10 175.59 1ovm s LEU 460 N 1.87 3.26 -0.66 3.92 1.43 -0.22 -0.92 118.68 127.37 1ovm s LEU 460 Ca 0.08 -0.57 -0.23 0.00 -1.03 0.00 0.00 54.13 52.38 1ovm s LEU 460 Cb -0.18 -2.56 0.07 0.00 0.03 0.00 0.00 46.19 43.55 1ovm s LEU 460 CO 0.11 -1.91 0.98 0.21 0.23 0.00 0.00 176.35 175.97 1ovm s ASN 461 N 5.04 6.18 -0.16 2.29 3.84 0.72 -2.65 114.94 130.21 1ovm s ASN 461 Ca 0.45 -0.92 0.14 0.00 0.21 0.00 0.00 52.86 52.74 1ovm s ASN 461 Cb -0.07 -2.43 0.36 0.00 -0.55 0.00 0.00 41.25 38.56 1ovm s ASN 461 CO 0.09 -1.45 1.18 -0.46 -2.79 0.00 0.00 177.10 173.67 1ovm n ASN 462 N 7.80 1.81 -3.71 -4.21 0.23 -1.26 -0.47 115.26 115.44 1ovm n ASN 462 Ca -0.03 -3.43 -0.23 0.00 -0.53 0.00 0.00 54.58 50.36 1ovm n ASN 462 Cb 0.46 -0.47 0.03 0.00 -2.08 0.00 0.00 39.78 37.72 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 -1.08 -3.77 0.00 -3.83 1.02 -1.26 -4.07 120.64 107.65 1ovm n GLU 463 Ca 0.16 0.57 0.00 0.00 -0.02 0.00 0.00 57.16 57.87 1ovm n GLU 463 Cb 0.70 -4.91 0.00 0.00 -0.02 0.00 0.00 31.44 27.22 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 -1.65 0.80 3.39 0.62 0.00 -1.26 -4.60 105.19 102.50 1ovm n GLY 464 Ca -0.25 -2.02 -0.44 0.00 0.00 0.00 0.00 46.02 43.31 1ovm n GLY 464 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ovm n TYR 465 N 6.19 4.91 0.22 1.61 4.01 -0.99 -4.47 117.16 128.64 1ovm n TYR 465 Ca 0.00 -3.47 0.06 0.00 -0.16 0.00 0.00 57.90 54.33 1ovm n TYR 465 Cb 0.00 -2.03 0.51 0.00 -0.31 0.00 0.00 39.34 37.51 1ovm n TYR 465 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 1ovm h THR 466 N 4.30 1.10 -0.73 -0.72 1.35 -1.87 -1.30 112.91 115.05 1ovm h THR 466 Ca 0.28 -0.65 -0.06 0.00 -0.55 0.00 0.00 66.41 65.43 1ovm h THR 466 Cb 0.85 1.36 -0.03 0.00 -1.73 0.00 0.00 68.15 68.60 1ovm h THR 466 CO 1.21 0.19 0.22 -0.37 -0.25 0.00 0.00 175.52 176.51 1ovm h VAL 467 N 0.00 1.26 -0.46 6.82 -1.51 -1.92 0.81 116.25 121.25 1ovm h VAL 467 Ca -0.00 -0.92 -0.13 0.00 -1.23 0.00 0.00 66.70 64.42 1ovm h VAL 467 Cb 0.34 0.47 -0.01 0.00 -2.13 0.00 0.00 31.29 29.95 1ovm h VAL 467 CO 0.02 0.36 -0.21 -0.33 -1.23 0.00 0.00 177.57 176.18 1ovm h GLU 468 N 1.09 0.95 -0.87 5.19 4.39 -1.77 -2.06 114.58 121.51 1ovm h GLU 468 Ca 0.23 -0.41 0.02 0.00 0.34 0.00 0.00 59.36 59.54 1ovm h GLU 468 Cb 0.32 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.89 1ovm h GLU 468 CO -0.01 1.08 0.57 0.00 -1.16 0.00 0.00 179.01 179.49 1ovm h ARG 469 N 0.80 1.10 0.00 2.33 3.08 -0.80 0.54 114.38 121.43 1ovm h ARG 469 Ca 0.10 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 1ovm h ARG 469 Cb 0.79 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.58 1ovm h ARG 469 CO 0.06 0.73 -0.30 0.00 -1.07 0.00 0.00 179.97 179.39 1ovm h ALA 470 N 1.48 1.37 0.11 0.04 0.00 -0.54 -3.15 119.26 118.56 1ovm h ALA 470 Ca 0.33 -0.27 -0.22 0.00 0.00 0.00 0.00 54.91 54.75 1ovm h ALA 470 Cb -0.07 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1ovm h ALA 470 CO -0.08 0.38 -1.07 0.82 0.00 0.00 0.00 179.25 179.29 1ovm h ILE 471 N 0.00 1.27 -1.31 0.00 2.04 -0.44 -3.45 117.51 115.61 1ovm h ILE 471 Ca -0.00 -2.44 0.14 0.00 1.00 0.00 0.00 64.86 63.56 1ovm h ILE 471 Cb 0.58 2.92 -0.28 0.00 -0.74 0.00 0.00 36.82 39.30 1ovm h ILE 471 CO 0.04 0.68 0.71 -2.28 0.00 0.00 0.00 178.15 177.29 1ovm s HIS 472 N -2.43 -0.23 -0.77 1.37 5.04 0.04 -4.65 115.29 113.64 1ovm s HIS 472 Ca -0.18 0.51 -0.00 0.00 -1.54 0.00 0.00 55.06 53.85 1ovm s HIS 472 Cb 0.03 0.44 -0.00 0.00 0.04 0.00 0.00 32.58 33.09 1ovm s HIS 472 CO 0.78 -0.14 0.65 0.41 -2.34 0.00 0.00 174.74 174.09 1ovm n GLY 473 N 1.43 -0.11 0.41 1.59 0.00 -1.26 -4.35 105.19 102.90 1ovm n GLY 473 Ca -0.09 -0.07 0.21 0.00 0.00 0.00 0.00 46.02 46.06 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 0.54 2.35 -0.32 4.61 0.00 -1.86 -0.72 119.26 123.86 1ovm h ALA 474 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1ovm h ALA 474 Cb 1.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1ovm h ALA 474 CO 0.32 -0.61 0.00 0.39 0.00 0.00 0.00 179.25 179.35 1ovm n GLU 475 N -4.45 3.12 -2.95 0.00 1.02 -1.26 -4.89 120.64 111.24 1ovm n GLU 475 Ca 0.18 -2.73 -0.39 0.00 -0.02 0.00 0.00 57.16 54.20 1ovm n GLU 475 Cb 0.72 -1.78 -0.06 0.00 -0.02 0.00 0.00 31.44 30.31 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 -2.43 4.61 0.48 3.49 -1.52 -0.28 -4.96 119.66 119.06 1ovm s GLN 476 Ca 0.40 1.21 0.20 0.00 -1.95 0.00 0.00 55.36 55.22 1ovm s GLN 476 Cb 0.31 -3.27 1.23 0.00 -0.22 0.00 0.00 33.01 31.06 1ovm s GLN 476 CO 0.12 0.56 1.98 -0.09 -0.25 0.00 0.00 175.29 177.61 1ovm h ARG 477 N 4.32 0.18 0.00 2.91 2.43 -1.94 -2.08 114.38 120.20 1ovm h ARG 477 Ca -0.47 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1ovm h ARG 477 Cb 1.21 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1ovm h ARG 477 CO 0.66 0.12 0.00 2.48 -1.51 0.00 0.00 179.97 181.72 1ovm n TYR 478 N -4.43 0.00 0.55 2.20 0.18 -1.26 -1.79 117.16 112.61 1ovm n TYR 478 Ca 0.10 0.00 0.12 0.00 1.88 0.00 0.00 57.90 60.00 1ovm n TYR 478 Cb 0.52 -0.46 0.22 0.00 -0.38 0.00 0.00 39.34 39.24 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 -1.46 3.14 -4.96 9.48 3.02 -0.78 -4.92 115.26 118.78 1ovm n ASN 479 Ca 0.04 -1.95 -0.23 0.00 -0.03 0.00 0.00 54.58 52.41 1ovm n ASN 479 Cb 0.14 -0.19 0.01 0.00 -0.61 0.00 0.00 39.78 39.12 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 -1.58 5.89 0.09 6.41 1.01 -0.74 -2.36 116.67 125.39 1ovm s ASP 480 Ca 0.36 0.26 -0.03 0.00 0.71 0.00 0.00 52.55 53.84 1ovm s ASP 480 Cb 0.22 -1.55 -0.03 0.00 1.01 0.00 0.00 42.92 42.57 1ovm s ASP 480 CO 0.31 -0.63 0.07 0.27 0.21 0.00 0.00 175.17 175.39 1ovm s ILE 481 N -2.49 0.16 0.23 0.77 -4.36 -1.26 -4.90 121.20 109.35 1ovm s ILE 481 Ca 0.47 -1.65 -0.31 0.00 -0.26 0.00 0.00 60.65 58.90 1ovm s ILE 481 Cb -0.10 -1.61 -0.11 0.00 1.25 0.00 0.00 42.46 41.89 1ovm s ILE 481 CO 0.37 -0.75 1.66 0.00 0.24 0.00 0.00 174.94 176.46 1ovm s ALA 482 N -3.94 3.85 -0.43 2.27 0.00 -1.26 -4.90 121.76 117.36 1ovm s ALA 482 Ca 0.11 1.55 -0.26 0.00 0.00 0.00 0.00 51.96 53.36 1ovm s ALA 482 Cb 0.07 -3.67 0.02 0.00 0.00 0.00 0.00 23.12 19.54 1ovm s ALA 482 CO -0.07 -0.92 0.94 -0.51 0.00 0.00 0.00 175.76 175.20 1ovm s LEU 483 N 0.64 3.97 0.44 0.00 1.43 -1.26 -5.04 118.68 118.87 1ovm s LEU 483 Ca 0.70 0.30 -0.01 0.00 -1.03 0.00 0.00 54.13 54.09 1ovm s LEU 483 Cb -0.48 -3.24 -0.01 0.00 0.03 0.00 0.00 46.19 42.48 1ovm s LEU 483 CO 0.37 -1.00 0.67 0.26 0.23 0.00 0.00 176.35 176.88 1ovm s TRP 484 N 3.71 3.32 -1.01 0.29 0.52 -1.26 -5.03 118.94 119.48 1ovm s TRP 484 Ca 0.38 0.34 -0.03 0.00 0.02 0.00 0.00 56.10 56.82 1ovm s TRP 484 Cb -0.10 -2.26 0.29 0.00 -1.15 0.00 0.00 33.47 30.25 1ovm s TRP 484 CO 0.24 -0.29 1.32 -1.71 0.02 0.00 0.00 176.95 176.53 1ovm n ASN 485 N -2.07 5.87 -0.31 2.95 4.05 -1.26 -4.95 115.26 119.55 1ovm n ASN 485 Ca 0.00 -3.39 0.09 0.00 0.45 0.00 0.00 54.58 51.74 1ovm n ASN 485 Cb 0.57 -1.17 0.21 0.00 1.23 0.00 0.00 39.78 40.61 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 5.33 -0.12 0.00 1.20 4.06 -2.01 -0.96 115.95 123.46 1ovm h TRP 486 Ca 0.20 0.07 0.00 0.00 2.06 0.00 0.00 58.89 61.21 1ovm h TRP 486 Cb 0.64 0.19 0.00 0.00 -1.00 0.00 0.00 29.16 29.00 1ovm h TRP 486 CO 0.94 -0.34 0.00 0.25 -3.56 0.00 0.00 178.44 175.73 1ovm n THR 487 N -5.44 0.98 0.73 1.49 -2.24 -1.26 -1.79 114.28 106.75 1ovm n THR 487 Ca 0.18 0.64 0.12 0.00 -2.27 0.00 0.00 64.05 62.71 1ovm n THR 487 Cb 0.59 -1.62 0.14 0.00 -2.10 0.00 0.00 70.33 67.34 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 -2.27 0.19 -0.04 4.78 8.25 -0.36 -4.56 115.22 121.21 1ovm n HIS 488 Ca -0.01 -0.10 -0.12 0.00 -0.26 0.00 0.00 57.72 57.24 1ovm n HIS 488 Cb 0.08 -0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.12 1ovm n HIS 488 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1ovm h ILE 489 N 4.61 1.25 -0.56 1.59 2.04 -1.44 -3.20 117.51 121.80 1ovm h ILE 489 Ca 0.00 -0.81 0.10 0.00 1.00 0.00 0.00 64.86 65.15 1ovm h ILE 489 Cb 0.99 1.56 -0.08 0.00 -0.74 0.00 0.00 36.82 38.55 1ovm h ILE 489 CO 0.00 0.23 0.11 -0.65 0.00 0.00 0.00 178.15 177.85 1ovm h PRO 490 N -0.06 0.24 0.00 2.37 0.11 -1.80 0.18 132.00 133.04 1ovm h PRO 490 Ca 0.03 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.13 1ovm h PRO 490 Cb 0.36 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.41 1ovm h PRO 490 CO 0.01 0.16 0.00 0.00 -0.21 0.00 0.00 178.00 177.96 1ovm n GLN 491 N -5.12 0.55 -0.09 1.05 0.00 -1.22 -2.05 117.38 110.49 1ovm n GLN 491 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 57.00 56.97 1ovm n GLN 491 Cb 0.29 -1.48 -0.13 0.00 0.00 0.00 0.00 30.24 28.92 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 -0.98 1.55 -0.77 2.61 0.00 0.52 -4.40 120.51 119.04 1ovm n ALA 492 Ca 0.13 -1.13 0.01 0.00 0.00 0.00 0.00 53.44 52.45 1ovm n ALA 492 Cb 0.06 -0.10 0.33 0.00 0.00 0.00 0.00 19.45 19.74 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 -2.78 5.50 -3.56 0.00 4.77 -0.61 -4.91 117.00 115.42 1ovm n LEU 493 Ca -0.32 -2.82 -0.14 0.00 -0.03 0.00 0.00 56.01 52.71 1ovm n LEU 493 Cb 1.04 -0.70 -0.06 0.00 -2.33 0.00 0.00 43.42 41.38 1ovm n LEU 493 CO 0.34 0.66 0.63 -0.55 -1.33 0.00 0.00 177.39 177.14 1ovm s SER 494 N -0.77 -0.50 0.22 -1.43 0.15 -1.05 -4.69 113.70 105.63 1ovm s SER 494 Ca 0.50 0.60 0.23 0.00 0.70 0.00 0.00 55.95 57.98 1ovm s SER 494 Cb 0.39 0.48 0.10 0.00 -1.71 0.00 0.00 66.02 65.28 1ovm s SER 494 CO 0.14 -0.43 1.16 -0.07 1.20 0.00 0.00 173.24 175.24 1ovm h LEU 495 N 2.93 0.00 -5.61 3.45 3.38 -1.88 -3.41 115.31 114.17 1ovm h LEU 495 Ca -0.23 -0.04 -0.38 0.00 0.09 0.00 0.00 57.88 57.33 1ovm h LEU 495 Cb 1.15 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 41.63 1ovm h LEU 495 CO 0.32 0.02 -0.77 -0.67 0.09 0.00 0.00 178.44 177.43 1ovm n ASP 496 N -2.64 -1.71 -4.61 -0.43 -0.08 -1.26 -5.12 116.55 100.70 1ovm n ASP 496 Ca 0.01 -2.79 -0.43 0.00 -1.51 0.00 0.00 54.79 50.08 1ovm n ASP 496 Cb 0.53 0.59 -0.03 0.00 2.34 0.00 0.00 41.12 44.55 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 0.17 3.41 -1.21 -0.67 0.02 -1.26 -4.85 135.00 130.61 1ovm s PRO 497 Ca 0.32 1.94 -0.09 0.00 0.02 0.00 0.00 61.00 63.20 1ovm s PRO 497 Cb 0.09 -4.26 -0.12 0.00 0.02 0.00 0.00 34.50 30.24 1ovm s PRO 497 CO -0.15 -1.77 3.09 1.04 -0.33 0.00 0.00 177.00 178.87 1ovm n GLN 498 N 8.36 3.34 -4.22 5.54 1.13 -1.26 -4.86 117.38 125.41 1ovm n GLN 498 Ca 0.25 -2.00 -0.14 0.00 -1.94 0.00 0.00 57.00 53.18 1ovm n GLN 498 Cb 0.45 -2.59 -0.10 0.00 0.11 0.00 0.00 30.24 28.10 1ovm n GLN 498 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1ovm s SER 499 N 1.99 1.64 -0.12 1.08 1.04 -1.26 -1.74 113.70 116.32 1ovm s SER 499 Ca 0.68 -0.95 -0.00 0.00 0.48 0.00 0.00 55.95 56.16 1ovm s SER 499 Cb 0.22 0.00 0.03 0.00 0.10 0.00 0.00 66.02 66.37 1ovm s SER 499 CO -0.05 -0.32 -0.07 -1.61 0.98 0.00 0.00 173.24 172.17 1ovm s GLU 500 N -3.43 1.50 0.00 4.02 0.41 0.52 -4.95 118.70 116.77 1ovm s GLU 500 Ca 0.13 -0.30 0.05 0.00 -0.41 0.00 0.00 54.97 54.43 1ovm s GLU 500 Cb 0.01 -1.67 -0.03 0.00 -1.78 0.00 0.00 34.13 30.66 1ovm s GLU 500 CO -0.00 -0.30 -0.13 0.00 -0.49 0.00 0.00 175.26 174.33 1ovm s TRP 502 N -0.89 0.16 -0.25 0.00 0.51 -0.52 -4.99 118.94 112.97 1ovm s TRP 502 Ca 0.14 -0.33 -0.01 0.00 -2.12 0.00 0.00 56.10 53.78 1ovm s TRP 502 Cb -0.11 -0.12 0.03 0.00 -0.81 0.00 0.00 33.47 32.46 1ovm s TRP 502 CO 0.05 -0.18 -0.07 0.50 -0.51 0.00 0.00 176.95 176.74 1ovm s ARG 503 N -1.18 2.77 -0.04 4.98 3.52 -1.26 -0.42 118.95 127.32 1ovm s ARG 503 Ca -0.13 -1.02 0.01 0.00 -0.13 0.00 0.00 55.73 54.46 1ovm s ARG 503 Cb -0.08 -2.97 -0.03 0.00 -1.56 0.00 0.00 34.95 30.31 1ovm s ARG 503 CO -0.00 -0.42 -0.03 0.08 -0.81 0.00 0.00 175.30 174.12 1ovm s VAL 504 N 1.30 3.96 0.00 7.11 1.01 0.62 -4.96 120.40 129.43 1ovm s VAL 504 Ca -0.01 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.44 1ovm s VAL 504 Cb -0.17 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.51 1ovm s VAL 504 CO -0.05 0.49 0.03 -1.54 0.00 0.00 0.00 175.10 174.03 1ovm n SER 505 N 1.80 0.07 -4.20 3.32 3.41 -1.26 -1.08 113.62 115.69 1ovm n SER 505 Ca -0.16 -0.51 -0.23 0.00 -0.26 0.00 0.00 58.87 57.71 1ovm n SER 505 Cb 0.53 0.08 -0.14 0.00 -0.26 0.00 0.00 64.21 64.42 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 -0.08 1.14 0.20 4.33 0.41 -1.26 -1.81 118.70 121.63 1ovm s GLU 506 Ca 0.00 -0.86 -0.12 0.00 -0.41 0.00 0.00 54.97 53.58 1ovm s GLU 506 Cb 0.00 -1.21 0.25 0.00 -1.78 0.00 0.00 34.13 31.39 1ovm s GLU 506 CO 0.00 0.30 1.67 0.00 -0.49 0.00 0.00 175.26 176.74 1ovm h ALA 507 N 4.86 0.54 -0.08 5.21 0.00 -0.85 -1.87 119.26 127.08 1ovm h ALA 507 Ca -0.40 0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.72 1ovm h ALA 507 Cb 1.17 0.31 -0.06 0.00 0.00 0.00 0.00 17.79 19.21 1ovm h ALA 507 CO 0.44 -0.39 -0.42 0.93 0.00 0.00 0.00 179.25 179.80 1ovm h GLU 508 N 0.11 -0.51 -0.54 0.00 5.08 -1.92 -0.39 114.58 116.41 1ovm h GLU 508 Ca 0.29 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.79 1ovm h GLU 508 Cb 0.46 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.75 1ovm h GLU 508 CO -0.49 -0.34 0.08 1.96 -1.00 0.00 0.00 179.01 179.22 1ovm h GLN 509 N -0.53 0.20 0.31 2.33 4.20 -1.78 0.28 115.11 120.12 1ovm h GLN 509 Ca 0.06 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1ovm h GLN 509 Cb 0.64 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.35 1ovm h GLN 509 CO -0.36 0.13 -0.35 1.25 -0.67 0.00 0.00 178.83 178.82 1ovm h LEU 510 N 0.20 -0.98 -1.06 1.46 7.12 -0.72 0.30 115.31 121.65 1ovm h LEU 510 Ca 0.28 0.09 0.10 0.00 0.13 0.00 0.00 57.88 58.48 1ovm h LEU 510 Cb 0.41 0.34 -0.08 0.00 -0.53 0.00 0.00 40.66 40.80 1ovm h LEU 510 CO -0.39 -0.48 0.63 0.00 -0.13 0.00 0.00 178.44 178.06 1ovm h ALA 511 N -0.22 1.52 0.75 1.25 0.00 -0.55 0.07 119.26 122.08 1ovm h ALA 511 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1ovm h ALA 511 Cb 0.65 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ovm h ALA 511 CO -0.09 0.27 -0.40 0.22 0.00 0.00 0.00 179.25 179.24 1ovm h ASP 512 N 1.02 -0.99 0.01 0.00 3.58 0.65 -2.77 116.42 117.92 1ovm h ASP 512 Ca 0.46 0.04 -0.00 0.00 0.42 0.00 0.00 57.03 57.95 1ovm h ASP 512 Cb 0.39 0.27 -0.00 0.00 1.72 0.00 0.00 39.33 41.71 1ovm h ASP 512 CO -0.22 -0.65 -0.01 0.58 -2.88 0.00 0.00 179.24 176.06 1ovm h VAL 513 N -1.06 0.95 -0.57 2.25 2.07 -0.16 -2.39 116.25 117.34 1ovm h VAL 513 Ca -0.10 -0.04 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 1ovm h VAL 513 Cb 0.83 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 1ovm h VAL 513 CO 0.14 0.01 0.24 -0.07 0.02 0.00 0.00 177.57 177.91 1ovm h LEU 514 N 0.00 0.79 -0.88 2.57 3.38 -0.81 -2.42 115.31 117.93 1ovm h LEU 514 Ca -0.00 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.69 1ovm h LEU 514 Cb 0.02 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1ovm h LEU 514 CO 0.00 0.73 -0.55 -0.08 0.09 0.00 0.00 178.44 178.64 1ovm h GLU 515 N 0.79 0.03 0.00 1.13 4.81 -1.16 0.20 114.58 120.38 1ovm h GLU 515 Ca 0.19 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1ovm h GLU 515 Cb 0.19 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1ovm h GLU 515 CO -0.02 0.57 0.00 0.87 -0.73 0.00 0.00 179.01 179.70 1ovm h LYS 516 N 0.02 0.00 -0.00 1.92 1.57 -1.12 -3.16 116.57 115.80 1ovm h LYS 516 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ovm h LYS 516 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1ovm h LYS 516 CO 0.07 0.00 -0.02 1.33 -0.57 0.00 0.00 179.45 180.26 1ovm n VAL 517 N -3.05 0.00 0.00 0.50 0.24 -0.94 -4.76 118.33 110.32 1ovm n VAL 517 Ca -0.00 -0.49 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 1ovm n VAL 517 Cb 0.24 1.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.61 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 -0.72 0.20 -0.02 2.33 0.00 0.65 0.59 120.51 123.55 1ovm n ALA 518 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ovm n ALA 518 Cb 0.01 -0.18 0.00 0.00 0.00 0.00 0.00 19.45 19.28 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 -0.98 0.00 -3.49 0.00 8.25 -1.26 -5.06 115.22 112.67 1ovm n HIS 519 Ca 0.00 -0.43 -0.19 0.00 -0.26 0.00 0.00 57.72 56.83 1ovm n HIS 519 Cb 0.32 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.38 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 -0.43 -1.42 1.57 4.41 1.44 0.20 -4.85 115.22 116.14 1ovm n HIS 520 Ca 0.00 0.55 0.14 0.00 -2.01 0.00 0.00 57.72 56.41 1ovm n HIS 520 Cb 0.22 -1.98 0.61 0.00 0.12 0.00 0.00 29.99 28.97 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 -2.21 1.31 -3.59 -1.40 4.71 -1.26 -4.83 120.64 113.37 1ovm n GLU 521 Ca -0.23 -0.62 -0.09 0.00 -0.01 0.00 0.00 57.16 56.22 1ovm n GLU 521 Cb 0.50 -1.49 -0.02 0.00 -1.01 0.00 0.00 31.44 29.42 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 -2.11 1.26 0.06 3.49 0.52 -1.26 -5.02 118.95 115.88 1ovm s ARG 522 Ca 0.38 -0.57 -0.30 0.00 -0.52 0.00 0.00 55.73 54.71 1ovm s ARG 522 Cb 0.21 0.51 -0.09 0.00 0.52 0.00 0.00 34.95 36.11 1ovm s ARG 522 CO 0.38 -0.56 1.75 -1.17 0.02 0.00 0.00 175.30 175.72 1ovm s LEU 523 N -2.75 4.38 -0.11 2.53 2.96 -0.71 -4.51 118.68 120.47 1ovm s LEU 523 Ca 0.06 2.55 0.03 0.00 -0.22 0.00 0.00 54.13 56.55 1ovm s LEU 523 Cb -0.02 -3.55 0.01 0.00 0.50 0.00 0.00 46.19 43.12 1ovm s LEU 523 CO -0.05 -0.95 -0.21 -0.94 -1.32 0.00 0.00 176.35 172.88 1ovm s SER 524 N 2.94 2.89 -0.20 3.68 1.04 -0.85 -0.36 113.70 122.85 1ovm s SER 524 Ca 0.78 -0.53 -0.02 0.00 0.48 0.00 0.00 55.95 56.66 1ovm s SER 524 Cb -0.41 -1.33 0.00 0.00 0.10 0.00 0.00 66.02 64.39 1ovm s SER 524 CO 0.34 0.10 -0.11 -0.22 0.98 0.00 0.00 173.24 174.33 1ovm s LEU 525 N 0.64 2.56 -0.29 2.42 2.96 -0.22 -0.68 118.68 126.07 1ovm s LEU 525 Ca -0.12 -0.50 -0.02 0.00 -0.22 0.00 0.00 54.13 53.27 1ovm s LEU 525 Cb -0.16 -1.62 0.04 0.00 0.50 0.00 0.00 46.19 44.95 1ovm s LEU 525 CO 0.03 -0.00 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.42 1ovm s ILE 526 N 1.33 3.05 -0.46 6.68 1.01 0.73 -1.43 121.20 132.10 1ovm s ILE 526 Ca 0.04 -1.24 -0.25 0.00 0.00 0.00 0.00 60.65 59.20 1ovm s ILE 526 Cb -0.14 -2.69 0.03 0.00 0.01 0.00 0.00 42.46 39.67 1ovm s ILE 526 CO -0.07 -0.02 0.89 -0.70 0.00 0.00 0.00 174.94 175.04 1ovm s GLU 527 N 1.29 3.49 -0.47 2.79 2.12 0.44 -1.19 118.70 127.17 1ovm s GLU 527 Ca -0.03 0.08 -0.17 0.00 0.36 0.00 0.00 54.97 55.21 1ovm s GLU 527 Cb -0.19 -3.93 0.06 0.00 0.26 0.00 0.00 34.13 30.32 1ovm s GLU 527 CO -0.02 -1.21 0.46 0.08 -0.54 0.00 0.00 175.26 174.04 1ovm s VAL 528 N 3.65 5.11 -0.04 3.70 1.01 -0.09 -0.28 120.40 133.45 1ovm s VAL 528 Ca 0.35 -0.75 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 1ovm s VAL 528 Cb -0.11 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 1ovm s VAL 528 CO 0.25 -0.60 1.30 -0.04 0.00 0.00 0.00 175.10 176.01 1ovm s MET 529 N 2.02 4.31 0.10 2.72 1.00 -0.24 -0.20 119.30 129.01 1ovm s MET 529 Ca 0.09 1.80 0.03 0.00 0.00 0.00 0.00 55.69 57.60 1ovm s MET 529 Cb -0.21 -3.60 -0.04 0.00 0.00 0.00 0.00 34.83 30.98 1ovm s MET 529 CO 0.10 -0.53 -0.08 -0.51 0.00 0.00 0.00 175.02 173.99 1ovm s LEU 530 N 2.46 2.47 0.34 -0.03 1.43 0.38 -4.76 118.68 120.97 1ovm s LEU 530 Ca 0.59 -0.93 -0.29 0.00 -1.03 0.00 0.00 54.13 52.48 1ovm s LEU 530 Cb -0.27 -0.17 -0.11 0.00 0.03 0.00 0.00 46.19 45.67 1ovm s LEU 530 CO 0.23 -0.38 1.39 -2.84 0.23 0.00 0.00 176.35 174.98 1ovm s PRO 531 N -3.41 4.26 0.44 1.29 0.02 -1.26 -4.12 135.00 132.22 1ovm s PRO 531 Ca 0.09 2.35 0.15 0.00 0.02 0.00 0.00 61.00 63.62 1ovm s PRO 531 Cb 0.02 -3.04 1.07 0.00 0.02 0.00 0.00 34.50 32.57 1ovm s PRO 531 CO -0.02 -0.34 1.97 -0.22 -0.33 0.00 0.00 177.00 178.06 1ovm h LYS 532 N 3.43 0.36 -0.08 5.54 3.64 -1.93 -2.53 116.57 125.00 1ovm h LYS 532 Ca -0.49 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1ovm h LYS 532 Cb 1.23 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 1ovm h LYS 532 CO 0.66 0.24 0.00 0.00 -2.27 0.00 0.00 179.45 178.08 1ovm n ALA 533 N -2.53 2.45 -2.09 5.00 0.00 -1.26 -4.60 120.51 117.47 1ovm n ALA 533 Ca 0.11 -0.70 -0.42 0.00 0.00 0.00 0.00 53.44 52.42 1ovm n ALA 533 Cb 0.43 -0.59 -0.03 0.00 0.00 0.00 0.00 19.45 19.27 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 -1.37 6.71 0.01 0.00 -1.08 -0.96 -5.00 116.67 114.97 1ovm s ASP 534 Ca 0.22 2.09 0.06 0.00 -0.52 0.00 0.00 52.55 54.40 1ovm s ASP 534 Cb 0.15 -2.53 -0.02 0.00 -1.46 0.00 0.00 42.92 39.05 1ovm s ASP 534 CO 0.22 -0.91 -0.19 -0.63 0.52 0.00 0.00 175.17 174.17 1ovm s ILE 535 N 4.00 1.51 0.62 4.11 1.09 -1.26 -4.88 121.20 126.39 1ovm s ILE 535 Ca 0.70 -0.94 -0.17 0.00 -1.10 0.00 0.00 60.65 59.14 1ovm s ILE 535 Cb -0.31 -1.28 -0.02 0.00 -1.06 0.00 0.00 42.46 39.79 1ovm s ILE 535 CO 0.27 0.33 1.13 -2.84 -0.10 0.00 0.00 174.94 173.72 1ovm s PRO 536 N -0.71 2.95 0.04 2.79 0.02 -1.26 -4.89 135.00 133.93 1ovm s PRO 536 Ca 0.07 1.53 -0.08 0.00 0.02 0.00 0.00 61.00 62.54 1ovm s PRO 536 Cb -0.08 -1.96 -0.02 0.00 0.02 0.00 0.00 34.50 32.46 1ovm s PRO 536 CO 0.00 -1.16 1.14 -1.35 -0.33 0.00 0.00 177.00 175.30 1ovm h PRO 537 N 0.47 -0.02 -0.49 5.54 0.11 -2.00 -2.26 132.00 133.35 1ovm h PRO 537 Ca -0.48 0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.73 1ovm h PRO 537 Cb 1.26 0.01 -0.10 0.00 0.11 0.00 0.00 31.00 32.28 1ovm h PRO 537 CO 0.55 -0.02 -0.23 1.25 -0.21 0.00 0.00 178.00 179.34 1ovm h LEU 538 N -0.03 -0.78 -1.34 2.35 5.85 -1.90 -1.79 115.31 117.67 1ovm h LEU 538 Ca 0.04 0.18 0.31 0.00 0.84 0.00 0.00 57.88 59.24 1ovm h LEU 538 Cb 0.12 0.42 -0.11 0.00 0.37 0.00 0.00 40.66 41.46 1ovm h LEU 538 CO -0.22 -0.25 0.70 0.25 -0.34 0.00 0.00 178.44 178.58 1ovm h LEU 539 N -0.12 0.41 -0.37 2.25 5.85 -1.64 0.13 115.31 121.83 1ovm h LEU 539 Ca 0.23 0.10 0.03 0.00 0.84 0.00 0.00 57.88 59.08 1ovm h LEU 539 Cb 0.47 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.52 1ovm h LEU 539 CO -0.56 0.01 0.17 1.23 -0.34 0.00 0.00 178.44 178.95 1ovm h GLY 540 N 0.33 0.50 0.94 3.75 0.00 -1.11 0.17 103.07 107.65 1ovm h GLY 540 Ca 0.66 -0.12 -0.04 0.00 0.00 0.00 0.00 47.33 47.83 1ovm h GLY 540 CO -0.35 0.08 -0.41 0.00 0.00 0.00 0.00 176.54 175.85 1ovm h ALA 541 N 1.21 -1.11 -0.95 3.60 0.00 -0.83 -1.18 119.26 120.00 1ovm h ALA 541 Ca 0.16 -0.24 0.12 0.00 0.00 0.00 0.00 54.91 54.96 1ovm h ALA 541 Cb 0.09 0.47 -0.08 0.00 0.00 0.00 0.00 17.79 18.28 1ovm h ALA 541 CO -0.13 -1.13 0.60 1.25 0.00 0.00 0.00 179.25 179.85 1ovm h LEU 542 N -1.10 0.82 -0.56 0.00 5.85 -1.34 -1.87 115.31 117.10 1ovm h LEU 542 Ca -0.10 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.60 1ovm h LEU 542 Cb 0.86 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 1ovm h LEU 542 CO 0.15 0.44 0.14 0.00 -0.34 0.00 0.00 178.44 178.82 1ovm h THR 543 N 0.88 1.25 -0.02 1.05 1.03 -0.42 -2.12 112.91 114.56 1ovm h THR 543 Ca 0.47 -0.88 -0.10 0.00 -0.01 0.00 0.00 66.41 65.89 1ovm h THR 543 Cb 0.55 0.74 -0.01 0.00 -1.07 0.00 0.00 68.15 68.36 1ovm h THR 543 CO -0.23 0.33 -0.45 0.50 -0.01 0.00 0.00 175.52 175.65 1ovm h LYS 544 N 0.80 0.05 -0.12 0.00 3.64 -0.44 -2.98 116.57 117.53 1ovm h LYS 544 Ca 0.18 -0.02 -0.22 0.00 -1.27 0.00 0.00 60.65 59.31 1ovm h LYS 544 Cb 0.34 -0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1ovm h LYS 544 CO 0.00 0.49 -0.81 0.00 -2.27 0.00 0.00 179.45 176.86 1ovm h ALA 545 N 1.51 0.34 -0.41 5.00 0.00 -1.20 -2.80 119.26 121.70 1ovm h ALA 545 Ca -0.00 -0.62 -0.02 0.00 0.00 0.00 0.00 54.91 54.27 1ovm h ALA 545 Cb 0.82 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1ovm h ALA 545 CO 0.06 0.70 0.16 -0.07 0.00 0.00 0.00 179.25 180.11 1ovm h LEU 546 N 0.47 0.56 -1.06 0.00 3.38 -1.30 -2.47 115.31 114.89 1ovm h LEU 546 Ca -0.06 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 1ovm h LEU 546 Cb 1.44 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 1ovm h LEU 546 CO 0.16 0.58 -0.30 -0.08 0.09 0.00 0.00 178.44 178.88 1ovm h GLU 547 N 0.51 0.00 -0.04 1.13 4.57 -1.61 -2.23 114.58 116.91 1ovm h GLU 547 Ca 0.13 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.24 1ovm h GLU 547 Cb 0.19 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 1ovm h GLU 547 CO -0.01 0.30 -0.32 0.00 -1.18 0.00 0.00 179.01 177.80 1ovm h ALA 548 N 1.70 1.39 0.00 2.92 0.00 -1.18 -2.03 119.26 122.05 1ovm h ALA 548 Ca -0.00 -0.31 -0.13 0.00 0.00 0.00 0.00 54.91 54.46 1ovm h ALA 548 Cb 0.80 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1ovm h ALA 548 CO 0.04 0.45 -0.61 0.00 0.00 0.00 0.00 179.25 179.12 1ovm n ASN 550 N -3.54 0.51 -0.16 0.00 3.02 -0.79 -5.13 115.26 109.18 1ovm n ASN 550 Ca -0.00 0.58 0.02 0.00 -0.03 0.00 0.00 54.58 55.15 1ovm n ASN 550 Cb 0.67 -0.71 0.02 0.00 -0.61 0.00 0.00 39.78 39.15 1ovm n ASN 550 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23