#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uws h LEU 12 N 0.00 0.47 -0.23 -2.12 7.12 -2.05 -1.12 115.31 117.37 2uws h LEU 12 Ca 0.00 0.04 -0.21 0.00 0.13 0.00 0.00 57.88 57.83 2uws h LEU 12 Cb 0.00 -0.05 0.01 0.00 -0.53 0.00 0.00 40.66 40.08 2uws h LEU 12 CO 0.00 0.21 -0.76 0.00 -0.13 0.00 0.00 178.44 177.76 2uws h ALA 13 N 1.62 0.39 -0.25 1.25 0.00 -2.06 -2.16 119.26 118.05 2uws h ALA 13 Ca 0.44 -0.60 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2uws h ALA 13 Cb 0.97 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2uws h ALA 13 CO -0.17 0.71 0.13 0.77 0.00 0.00 0.00 179.25 180.69 2uws h SER 14 N 0.47 0.32 -0.07 0.00 0.02 -1.70 -1.16 113.55 111.43 2uws h SER 14 Ca -0.05 -0.10 0.04 0.00 -0.84 0.00 0.00 61.79 60.85 2uws h SER 14 Cb 1.38 -0.08 -0.05 0.00 0.14 0.00 0.00 62.40 63.78 2uws h SER 14 CO 0.15 0.32 -0.26 0.25 -1.14 0.00 0.00 176.83 176.15 2uws h LEU 15 N 0.29 -0.79 -0.93 5.07 5.85 -1.26 -2.30 115.31 121.24 2uws h LEU 15 Ca 0.09 0.12 0.06 0.00 0.84 0.00 0.00 57.88 58.99 2uws h LEU 15 Cb 0.08 0.34 -0.06 0.00 0.37 0.00 0.00 40.66 41.38 2uws h LEU 15 CO -0.01 -0.32 0.59 0.00 -0.34 0.00 0.00 178.44 178.35 2uws h ALA 16 N 0.50 1.28 0.00 1.25 0.00 -1.10 0.34 119.26 121.54 2uws h ALA 16 Ca 0.08 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.80 2uws h ALA 16 Cb 0.48 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2uws h ALA 16 CO -0.28 0.35 -0.85 0.97 0.00 0.00 0.00 179.25 179.45 2uws h ILE 17 N 1.07 1.58 -0.11 0.00 6.09 -1.11 -1.70 117.51 123.32 2uws h ILE 17 Ca 0.40 -2.93 -0.08 0.00 -1.37 0.00 0.00 64.86 60.88 2uws h ILE 17 Cb 0.17 2.59 0.00 0.00 0.47 0.00 0.00 36.82 40.05 2uws h ILE 17 CO -0.17 0.83 -0.26 0.22 -3.07 0.00 0.00 178.15 175.69 2uws h TYR 18 N 0.00 0.47 -0.88 2.19 3.20 -0.95 -2.54 116.97 118.45 2uws h TYR 18 Ca -0.01 -0.18 0.07 0.00 3.14 0.00 0.00 58.73 61.76 2uws h TYR 18 Cb 1.52 -0.08 -0.07 0.00 1.54 0.00 0.00 36.73 39.64 2uws h TYR 18 CO 0.00 0.87 0.54 0.77 -1.64 0.00 0.00 178.16 178.70 2uws h SER 19 N -0.08 0.83 -0.37 -2.11 0.02 -0.94 -2.19 113.55 108.71 2uws h SER 19 Ca -0.00 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 2uws h SER 19 Cb 0.86 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.24 2uws h SER 19 CO 0.06 0.51 0.16 0.15 -1.14 0.00 0.00 176.83 176.57 2uws h PHE 20 N 0.95 0.56 -0.57 3.45 3.57 -1.23 0.27 116.94 123.94 2uws h PHE 20 Ca 0.40 -0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.83 2uws h PHE 20 Cb 0.24 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 2uws h PHE 20 CO -0.03 0.50 0.25 -1.49 -2.23 0.00 0.00 178.31 175.30 2uws h TRP 21 N 0.46 0.81 0.83 0.41 4.06 -1.21 0.36 115.95 121.67 2uws h TRP 21 Ca 0.13 -0.03 -0.04 0.00 2.06 0.00 0.00 58.89 61.00 2uws h TRP 21 Cb 0.17 -0.25 0.01 0.00 -1.00 0.00 0.00 29.16 28.08 2uws h TRP 21 CO -0.01 0.61 -0.40 0.82 -3.56 0.00 0.00 178.44 175.91 2uws h ILE 22 N 0.81 0.08 -1.00 1.49 2.04 -0.75 -2.13 117.51 118.05 2uws h ILE 22 Ca 0.20 -0.13 0.21 0.00 1.00 0.00 0.00 64.86 66.13 2uws h ILE 22 Cb 0.13 0.10 -0.11 0.00 -0.74 0.00 0.00 36.82 36.19 2uws h ILE 22 CO -0.02 0.01 0.60 0.15 0.00 0.00 0.00 178.15 178.88 2uws h PHE 23 N -1.24 1.04 -0.31 1.37 3.57 0.12 -0.83 116.94 120.67 2uws h PHE 23 Ca -0.11 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.31 2uws h PHE 23 Cb 0.86 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 2uws h PHE 23 CO -0.00 0.18 -0.26 1.25 -2.23 0.00 0.00 178.31 177.25 2uws h LEU 24 N 0.70 0.62 0.05 0.59 5.85 -0.16 -0.21 115.31 122.75 2uws h LEU 24 Ca 0.60 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 59.09 2uws h LEU 24 Cb 1.00 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.86 2uws h LEU 24 CO -0.42 0.86 -0.02 0.00 -0.34 0.00 0.00 178.44 178.52 2uws h ALA 25 N 1.19 -0.07 -0.69 1.25 0.00 -0.48 0.29 119.26 120.75 2uws h ALA 25 Ca 0.07 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.10 2uws h ALA 25 Cb 0.72 0.03 -0.13 0.00 0.00 0.00 0.00 17.79 18.41 2uws h ALA 25 CO 0.06 -0.54 -0.17 0.78 0.00 0.00 0.00 179.25 179.37 2uws h GLY 26 N -0.07 0.49 0.95 0.00 0.00 -1.03 -0.91 103.07 102.48 2uws h GLY 26 Ca -0.01 0.23 -0.05 0.00 0.00 0.00 0.00 47.33 47.51 2uws h GLY 26 CO 0.01 -0.26 0.08 -2.00 0.00 0.00 0.00 176.54 174.37 2uws h LEU 27 N -0.00 0.65 -0.90 3.11 5.85 -0.76 0.82 115.31 124.09 2uws h LEU 27 Ca 0.33 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.82 2uws h LEU 27 Cb 0.50 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 2uws h LEU 27 CO -0.71 0.73 0.60 0.40 -0.34 0.00 0.00 178.44 179.12 2uws h ILE 28 N 0.55 1.22 0.27 4.05 2.04 -0.30 0.44 117.51 125.78 2uws h ILE 28 Ca 0.13 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 2uws h ILE 28 Cb 0.35 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 2uws h ILE 28 CO 0.01 0.22 -0.23 0.22 0.00 0.00 0.00 178.15 178.36 2uws h TYR 29 N 1.21 -0.64 -0.89 1.37 3.20 -0.79 0.29 116.97 120.72 2uws h TYR 29 Ca 0.33 0.00 0.18 0.00 3.14 0.00 0.00 58.73 62.38 2uws h TYR 29 Cb -0.12 0.24 -0.17 0.00 1.54 0.00 0.00 36.73 38.22 2uws h TYR 29 CO -0.01 -0.32 -0.23 -0.92 -1.64 0.00 0.00 178.16 175.04 2uws h TYR 30 N -0.50 -0.51 -0.41 -3.82 3.20 -0.55 -0.37 116.97 114.01 2uws h TYR 30 Ca -0.04 0.08 -0.05 0.00 3.14 0.00 0.00 58.73 61.86 2uws h TYR 30 Cb 0.42 0.36 -0.02 0.00 1.54 0.00 0.00 36.73 39.04 2uws h TYR 30 CO -0.11 -0.39 0.05 -0.07 -1.64 0.00 0.00 178.16 176.01 2uws h LEU 31 N -0.00 0.67 -0.51 2.82 3.38 0.13 -1.17 115.31 120.64 2uws h LEU 31 Ca 0.42 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2uws h LEU 31 Cb 0.65 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2uws h LEU 31 CO -0.92 0.78 0.29 -0.61 0.09 0.00 0.00 178.44 178.07 2uws h GLN 32 N 0.55 0.69 0.07 1.13 5.75 0.41 -1.75 115.11 121.96 2uws h GLN 32 Ca 0.12 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.55 2uws h GLN 32 Cb 0.40 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.81 2uws h GLN 32 CO 0.01 0.52 -0.03 1.79 -2.65 0.00 0.00 178.83 178.47 2uws h THR 33 N 0.67 1.18 -0.99 2.39 1.35 -1.04 -2.44 112.91 114.03 2uws h THR 33 Ca 0.18 -0.93 0.36 0.00 -0.55 0.00 0.00 66.41 65.47 2uws h THR 33 Cb 0.01 1.78 -0.18 0.00 -1.73 0.00 0.00 68.15 68.04 2uws h THR 33 CO -0.03 0.23 0.40 -0.33 -0.25 0.00 0.00 175.52 175.54 2uws h GLU 34 N -0.52 0.05 -0.04 4.72 4.39 -1.15 0.62 114.58 122.65 2uws h GLU 34 Ca -0.01 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2uws h GLU 34 Cb 0.45 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2uws h GLU 34 CO 0.02 0.03 0.00 0.09 -1.16 0.00 0.00 179.01 177.99 2uws n ASN 35 N -5.29 0.27 -1.37 1.42 3.02 -0.67 -3.20 115.26 109.44 2uws n ASN 35 Ca 0.33 -1.66 0.11 0.00 -0.03 0.00 0.00 54.58 53.33 2uws n ASN 35 Cb 1.09 -0.02 0.32 0.00 -0.61 0.00 0.00 39.78 40.56 2uws n ASN 35 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2uws n MET 36 N -0.52 2.92 0.00 3.52 2.81 0.22 -4.54 117.12 121.53 2uws n MET 36 Ca 0.10 -2.69 0.05 0.00 -1.81 0.00 0.00 57.70 53.35 2uws n MET 36 Cb 0.08 -1.62 0.31 0.00 -0.71 0.00 0.00 33.22 31.29 2uws n MET 36 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2uws n ARG 37 N 1.51 0.81 -3.71 0.03 1.74 -1.19 -4.47 116.66 111.37 2uws n ARG 37 Ca 0.24 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 57.18 2uws n ARG 37 Cb 0.66 -1.20 -0.08 0.00 -1.02 0.00 0.00 32.46 30.82 2uws n ARG 37 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2uws s GLU 38 N -2.00 0.69 0.00 5.56 0.41 -1.26 -4.17 118.70 117.93 2uws s GLU 38 Ca 0.16 0.12 0.00 0.00 -0.41 0.00 0.00 54.97 54.83 2uws s GLU 38 Cb 0.07 0.32 0.00 0.00 -1.78 0.00 0.00 34.13 32.74 2uws s GLU 38 CO 0.12 -0.17 0.00 0.41 -0.49 0.00 0.00 175.26 175.13 2uws n GLY 39 N 1.66 0.53 3.37 -1.39 0.00 -1.26 -5.02 105.19 103.08 2uws n GLY 39 Ca -0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.54 2uws n GLY 39 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2uws s TYR 40 N -2.35 2.26 0.65 1.61 1.51 -1.26 -4.32 117.35 115.45 2uws s TYR 40 Ca 0.00 -0.39 -0.15 0.00 -1.01 0.00 0.00 57.07 55.52 2uws s TYR 40 Cb 0.00 -1.26 -0.00 0.00 -0.11 0.00 0.00 41.96 40.59 2uws s TYR 40 CO 0.00 0.27 1.12 -2.14 -1.11 0.00 0.00 175.55 173.69 2uws s PRO 41 N -1.83 2.81 0.73 -1.71 0.02 -1.26 -4.79 135.00 128.97 2uws s PRO 41 Ca 0.13 1.44 -0.16 0.00 0.02 0.00 0.00 61.00 62.43 2uws s PRO 41 Cb -0.10 -1.95 0.02 0.00 0.02 0.00 0.00 34.50 32.49 2uws s PRO 41 CO 0.05 -1.25 1.01 1.28 -0.33 0.00 0.00 177.00 177.76 2uws n LEU 42 N -2.32 3.74 -4.37 -5.54 4.77 -1.26 -4.93 117.00 107.08 2uws n LEU 42 Ca 0.11 0.66 -0.19 0.00 -0.03 0.00 0.00 56.01 56.55 2uws n LEU 42 Cb 0.52 -1.43 -0.10 0.00 -2.33 0.00 0.00 43.42 40.08 2uws n LEU 42 CO 0.47 -1.95 -0.41 -1.61 -1.33 0.00 0.00 177.39 172.56 2uws s GLU 43 N -3.46 1.39 0.64 3.23 2.02 -1.26 -1.87 118.70 119.39 2uws s GLU 43 Ca 0.74 -1.65 -0.05 0.00 0.02 0.00 0.00 54.97 54.03 2uws s GLU 43 Cb -0.34 -1.11 0.04 0.00 0.10 0.00 0.00 34.13 32.83 2uws s GLU 43 CO 0.50 0.13 0.93 -0.80 0.02 0.00 0.00 175.26 176.04 2uws s ASN 44 N -3.35 5.09 0.50 -0.19 0.01 0.23 -4.53 114.94 112.70 2uws s ASN 44 Ca 0.25 0.40 0.34 0.00 -0.71 0.00 0.00 52.86 53.13 2uws s ASN 44 Cb 0.01 -1.18 1.84 0.00 0.41 0.00 0.00 41.25 42.33 2uws s ASN 44 CO 0.08 -1.37 2.04 -0.33 -1.51 0.00 0.00 177.10 176.01 2uws h GLU 45 N -0.35 0.00 -0.01 -0.60 5.08 -2.01 -1.30 114.58 115.39 2uws h GLU 45 Ca -0.44 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 2uws h GLU 45 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 2uws h GLU 45 CO 0.59 0.00 -0.22 -0.40 -1.00 0.00 0.00 179.01 177.97 2uws n ASP 46 N -2.69 0.99 0.00 1.42 5.68 -1.26 -4.96 116.55 115.73 2uws n ASP 46 Ca -0.02 -0.89 0.00 0.00 -0.50 0.00 0.00 54.79 53.38 2uws n ASP 46 Cb 0.06 0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.14 2uws n ASP 46 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2uws n GLY 47 N 1.32 0.48 3.91 6.12 0.00 -0.49 -5.08 105.19 111.45 2uws n GLY 47 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 2uws n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2uws s THR 48 N -2.00 5.10 -0.33 2.61 -4.23 -1.26 -4.74 115.64 110.78 2uws s THR 48 Ca 0.00 -0.11 -0.31 0.00 -1.18 0.00 0.00 61.69 60.09 2uws s THR 48 Cb 0.00 -3.73 -0.09 0.00 1.34 0.00 0.00 72.50 70.03 2uws s THR 48 CO 0.00 -0.24 2.25 -2.65 -0.54 0.00 0.00 174.62 173.44 2uws n PRO 49 N -0.76 1.39 -1.50 3.99 -0.02 -1.26 -0.60 135.00 136.23 2uws n PRO 49 Ca -0.03 0.34 -0.39 0.00 -2.02 0.00 0.00 63.50 61.40 2uws n PRO 49 Cb 0.54 -2.85 0.03 0.00 -0.02 0.00 0.00 33.50 31.20 2uws n PRO 49 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2uws n ALA 50 N 11.30 -0.87 0.34 3.55 0.00 -0.78 -4.79 120.51 129.26 2uws n ALA 50 Ca 0.37 0.05 -0.15 0.00 0.00 0.00 0.00 53.44 53.71 2uws n ALA 50 Cb 0.35 -1.88 -0.07 0.00 0.00 0.00 0.00 19.45 17.84 2uws n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uws h ALA 51 N 0.55 -0.89 -1.87 0.00 0.00 -1.91 -3.41 119.26 111.74 2uws h ALA 51 Ca -0.45 -0.21 -0.60 0.00 0.00 0.00 0.00 54.91 53.65 2uws h ALA 51 Cb 1.39 0.34 -0.11 0.00 0.00 0.00 0.00 17.79 19.41 2uws h ALA 51 CO 0.50 -0.86 0.61 1.21 0.00 0.00 0.00 179.25 180.70 2uws s ASN 52 N -4.53 6.46 0.01 0.00 2.47 -1.26 -4.91 114.94 113.17 2uws s ASN 52 Ca -0.15 0.01 0.25 0.00 0.42 0.00 0.00 52.86 53.39 2uws s ASN 52 Cb 0.02 -2.46 0.51 0.00 -1.45 0.00 0.00 41.25 37.87 2uws s ASN 52 CO 0.46 -1.12 1.42 0.00 -3.72 0.00 0.00 177.10 174.14 2uws n GLN 53 N 7.33 0.02 0.00 0.43 1.13 -1.26 -4.97 117.38 120.06 2uws n GLN 53 Ca 0.05 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.12 2uws n GLN 53 Cb 0.48 -1.51 0.00 0.00 0.11 0.00 0.00 30.24 29.32 2uws n GLN 53 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2uws n GLY 54 N 1.49 -1.48 0.03 1.08 0.00 -1.26 -4.62 105.19 100.43 2uws n GLY 54 Ca 0.05 -1.53 0.10 0.00 0.00 0.00 0.00 46.02 44.65 2uws n GLY 54 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2uws n PRO 55 N -1.48 0.05 -3.48 1.61 -0.04 -1.26 -4.72 135.00 125.68 2uws n PRO 55 Ca 0.00 0.20 -0.37 0.00 -0.04 0.00 0.00 63.50 63.29 2uws n PRO 55 Cb 0.00 -1.58 -0.08 0.00 -0.04 0.00 0.00 33.50 31.80 2uws n PRO 55 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2uws s PHE 56 N -3.06 3.37 0.58 0.54 0.08 -1.26 -5.08 117.98 113.16 2uws s PHE 56 Ca 0.09 0.51 -0.11 0.00 0.12 0.00 0.00 56.93 57.55 2uws s PHE 56 Cb 0.12 -2.43 -0.04 0.00 -0.57 0.00 0.00 43.02 40.10 2uws s PHE 56 CO 0.39 0.05 0.99 -1.25 -0.10 0.00 0.00 175.22 175.29 2uws s PRO 57 N 1.11 3.63 0.53 0.24 0.04 -1.26 -5.04 135.00 134.25 2uws s PRO 57 Ca 0.16 0.69 -0.20 0.00 0.04 0.00 0.00 61.00 61.68 2uws s PRO 57 Cb -0.14 -2.13 -0.06 0.00 0.04 0.00 0.00 34.50 32.20 2uws s PRO 57 CO 0.06 -0.48 1.15 -0.51 0.04 0.00 0.00 177.00 177.26 2uws s LEU 58 N -4.97 3.80 0.81 -3.56 1.43 -1.26 -4.84 118.68 110.09 2uws s LEU 58 Ca 0.54 2.23 -0.11 0.00 -1.03 0.00 0.00 54.13 55.76 2uws s LEU 58 Cb -0.11 -4.50 0.08 0.00 0.03 0.00 0.00 46.19 41.69 2uws s LEU 58 CO 0.50 -1.18 1.09 -2.16 0.23 0.00 0.00 176.35 174.83 2uws s PRO 59 N -3.15 1.96 0.35 1.29 0.04 -1.26 -5.01 135.00 129.22 2uws s PRO 59 Ca 0.71 0.70 -0.28 0.00 0.04 0.00 0.00 61.00 62.17 2uws s PRO 59 Cb -0.26 -1.90 -0.12 0.00 0.04 0.00 0.00 34.50 32.27 2uws s PRO 59 CO 0.29 -1.72 1.44 1.63 0.04 0.00 0.00 177.00 178.68 2uws n LYS 60 N -3.51 2.49 -0.74 4.56 5.02 -1.26 -4.66 118.16 120.06 2uws n LYS 60 Ca 0.07 0.87 -0.32 0.00 -2.02 0.00 0.00 58.31 56.91 2uws n LYS 60 Cb 0.56 -2.57 0.14 0.00 -0.02 0.00 0.00 35.03 33.15 2uws n LYS 60 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2uws n PRO 61 N 0.82 -0.42 -3.92 1.97 -0.02 -1.26 -4.72 135.00 127.44 2uws n PRO 61 Ca 0.04 -0.07 -0.10 0.00 -2.02 0.00 0.00 63.50 61.34 2uws n PRO 61 Cb 0.37 -2.07 -0.11 0.00 -0.02 0.00 0.00 33.50 31.68 2uws n PRO 61 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2uws s LYS 62 N -4.04 0.37 -0.19 -0.52 -2.85 0.59 -4.92 119.74 108.19 2uws s LYS 62 Ca 0.61 -0.47 0.01 0.00 -1.00 0.00 0.00 55.97 55.12 2uws s LYS 62 Cb -0.22 0.15 0.03 0.00 -2.06 0.00 0.00 37.83 35.73 2uws s LYS 62 CO 0.64 -0.08 -0.14 0.99 0.10 0.00 0.00 175.35 176.86 2uws s THR 63 N -1.33 1.81 -0.18 3.79 2.01 -1.26 -1.93 115.64 118.56 2uws s THR 63 Ca -0.14 -0.98 -0.21 0.00 0.31 0.00 0.00 61.69 60.67 2uws s THR 63 Cb -0.08 -1.77 -0.03 0.00 0.01 0.00 0.00 72.50 70.63 2uws s THR 63 CO 0.00 0.32 0.61 -0.36 -0.69 0.00 0.00 174.62 174.51 2uws s PHE 64 N 1.35 3.41 -0.45 4.92 0.08 0.15 -4.96 117.98 122.48 2uws s PHE 64 Ca 0.01 0.94 -0.26 0.00 0.12 0.00 0.00 56.93 57.74 2uws s PHE 64 Cb -0.15 -2.76 0.03 0.00 -0.57 0.00 0.00 43.02 39.56 2uws s PHE 64 CO -0.10 -0.11 0.97 0.42 -0.10 0.00 0.00 175.22 176.31 2uws s ILE 65 N 1.64 4.43 0.27 0.64 1.01 -1.26 -1.57 121.20 126.36 2uws s ILE 65 Ca 0.29 0.92 -0.29 0.00 0.00 0.00 0.00 60.65 61.56 2uws s ILE 65 Cb -0.16 -4.46 -0.09 0.00 0.01 0.00 0.00 42.46 37.76 2uws s ILE 65 CO 0.11 -0.83 1.04 -0.76 0.00 0.00 0.00 174.94 174.50 2uws s LEU 66 N 3.87 4.55 0.78 2.97 1.43 -0.48 -5.01 118.68 126.79 2uws s LEU 66 Ca 0.40 2.13 -0.11 0.00 -1.03 0.00 0.00 54.13 55.52 2uws s LEU 66 Cb -0.10 -3.67 0.07 0.00 0.03 0.00 0.00 46.19 42.53 2uws s LEU 66 CO 0.26 -0.06 1.13 -2.16 0.23 0.00 0.00 176.35 175.76 2uws s PRO 67 N -1.44 2.05 -0.95 1.29 0.04 -1.26 -4.02 135.00 130.71 2uws s PRO 67 Ca 0.44 0.02 -0.04 0.00 0.04 0.00 0.00 61.00 61.46 2uws s PRO 67 Cb -0.29 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.25 2uws s PRO 67 CO 0.37 -1.49 0.58 0.72 0.04 0.00 0.00 177.00 177.21 2uws n HIS 68 N -3.21 -1.57 -3.06 0.56 8.25 -1.26 -2.44 115.22 112.49 2uws n HIS 68 Ca 0.08 0.49 -0.18 0.00 -0.26 0.00 0.00 57.72 57.85 2uws n HIS 68 Cb 0.61 -3.44 -0.01 0.00 1.12 0.00 0.00 29.99 28.27 2uws n HIS 68 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2uws n GLY 69 N -1.36 -0.49 0.46 -1.41 0.00 -1.26 -4.87 105.19 96.26 2uws n GLY 69 Ca -0.04 0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.15 2uws n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2uws n ARG 70 N -3.34 1.61 0.00 1.61 1.74 -1.02 -5.02 116.66 112.24 2uws n ARG 70 Ca -0.04 -0.91 0.00 0.00 -0.77 0.00 0.00 57.85 56.13 2uws n ARG 70 Cb 0.55 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.59 2uws n ARG 70 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2uws n GLY 71 N 1.09 0.62 3.20 -0.13 0.00 -1.26 -4.93 105.19 103.78 2uws n GLY 71 Ca 0.17 -1.74 -0.12 0.00 0.00 0.00 0.00 46.02 44.33 2uws n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2uws s THR 72 N 0.00 0.33 0.02 2.61 -4.23 -1.26 -1.38 115.64 111.73 2uws s THR 72 Ca 0.00 -1.95 0.08 0.00 -1.18 0.00 0.00 61.69 58.64 2uws s THR 72 Cb 0.00 -2.14 -0.02 0.00 1.34 0.00 0.00 72.50 71.68 2uws s THR 72 CO 0.00 -0.41 -0.23 -0.22 -0.54 0.00 0.00 174.62 173.21 2uws s LEU 73 N -3.12 2.11 -0.09 4.79 2.96 -0.61 -4.92 118.68 119.80 2uws s LEU 73 Ca 0.26 -0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 53.67 2uws s LEU 73 Cb 0.07 -1.15 0.03 0.00 0.50 0.00 0.00 46.19 45.64 2uws s LEU 73 CO 0.04 0.24 -0.04 -0.89 -1.32 0.00 0.00 176.35 174.38 2uws s THR 74 N -0.68 0.74 -0.03 3.68 2.01 -1.26 -0.67 115.64 119.43 2uws s THR 74 Ca 0.09 -0.11 -0.03 0.00 0.31 0.00 0.00 61.69 61.95 2uws s THR 74 Cb -0.09 -0.82 0.01 0.00 0.01 0.00 0.00 72.50 71.60 2uws s THR 74 CO 0.01 0.32 0.08 0.68 -0.69 0.00 0.00 174.62 175.02 2uws s VAL 75 N 1.82 0.00 0.69 3.82 -7.23 -0.81 -3.78 120.40 114.90 2uws s VAL 75 Ca 0.05 -0.00 -0.15 0.00 -1.81 0.00 0.00 61.98 60.06 2uws s VAL 75 Cb -0.12 -0.12 0.02 0.00 0.56 0.00 0.00 36.38 36.71 2uws s VAL 75 CO -0.07 -0.00 1.16 -2.16 -0.31 0.00 0.00 175.10 173.72 2uws s PRO 76 N 0.04 2.50 0.37 4.82 0.04 -1.26 -0.30 135.00 141.21 2uws s PRO 76 Ca -0.00 1.60 -0.06 0.00 0.04 0.00 0.00 61.00 62.57 2uws s PRO 76 Cb -0.01 -1.89 0.02 0.00 0.04 0.00 0.00 34.50 32.66 2uws s PRO 76 CO 0.00 -1.52 0.59 0.20 0.04 0.00 0.00 177.00 176.31 2uws s GLY 77 N -2.24 1.16 0.17 0.56 0.00 -1.25 -4.79 107.32 100.93 2uws s GLY 77 Ca 0.71 -1.29 -0.33 0.00 0.00 0.00 0.00 44.72 43.81 2uws s GLY 77 CO 0.42 -0.78 1.64 -1.05 0.00 0.00 0.00 173.10 173.34 2uws n PRO 78 N -0.57 2.39 -3.46 2.90 -0.02 -1.26 -4.92 135.00 130.06 2uws n PRO 78 Ca -0.02 0.86 -0.43 0.00 -2.02 0.00 0.00 63.50 61.89 2uws n PRO 78 Cb 0.61 -2.66 -0.09 0.00 -0.02 0.00 0.00 33.50 31.34 2uws n PRO 78 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2uws s GLU 79 N 1.09 2.90 0.08 -0.52 0.41 -1.26 -5.08 118.70 116.33 2uws s GLU 79 Ca 0.78 -1.26 0.07 0.00 -0.41 0.00 0.00 54.97 54.14 2uws s GLU 79 Cb -0.61 -4.00 -0.03 0.00 -1.78 0.00 0.00 34.13 27.70 2uws s GLU 79 CO 0.36 -0.92 -0.18 -1.54 -0.49 0.00 0.00 175.26 172.49 2uws s SER 80 N 2.21 2.21 0.24 -0.19 1.04 -1.26 -5.03 113.70 112.92 2uws s SER 80 Ca 0.04 -0.62 -0.05 0.00 0.48 0.00 0.00 55.95 55.79 2uws s SER 80 Cb -0.22 -0.12 0.41 0.00 0.10 0.00 0.00 66.02 66.18 2uws s SER 80 CO 0.07 0.03 1.76 -0.33 0.98 0.00 0.00 173.24 175.75 2uws h GLU 81 N 4.32 0.53 -3.29 4.02 4.39 -2.01 -3.47 114.58 119.08 2uws h GLU 81 Ca -0.43 -0.03 -0.31 0.00 0.34 0.00 0.00 59.36 58.92 2uws h GLU 81 Cb 1.18 -0.12 0.04 0.00 -0.10 0.00 0.00 28.75 29.75 2uws h GLU 81 CO 0.41 0.35 -0.46 -0.25 -1.16 0.00 0.00 179.01 177.90 2uws n ASP 82 N -4.92 -5.02 -3.57 1.42 8.00 -1.26 -4.48 116.55 106.73 2uws n ASP 82 Ca 0.13 -0.18 -0.13 0.00 0.71 0.00 0.00 54.79 55.32 2uws n ASP 82 Cb 0.35 -3.92 -0.06 0.00 -0.02 0.00 0.00 41.12 37.47 2uws n ASP 82 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2uws s ARG 83 N -5.30 0.72 0.62 -1.24 1.70 -1.26 -4.94 118.95 109.25 2uws s ARG 83 Ca 0.19 0.24 -0.19 0.00 -0.47 0.00 0.00 55.73 55.50 2uws s ARG 83 Cb -0.08 0.34 -0.02 0.00 -0.57 0.00 0.00 34.95 34.62 2uws s ARG 83 CO 0.23 -0.21 1.28 -1.25 -1.08 0.00 0.00 175.30 174.27 2uws s PRO 84 N -0.98 2.71 -0.45 3.89 0.04 -1.26 -5.01 135.00 133.93 2uws s PRO 84 Ca -0.04 2.02 0.04 0.00 0.04 0.00 0.00 61.00 63.06 2uws s PRO 84 Cb -0.01 -1.90 0.12 0.00 0.04 0.00 0.00 34.50 32.75 2uws s PRO 84 CO 0.03 -1.46 0.18 0.42 0.04 0.00 0.00 177.00 176.21 2uws s ILE 85 N -1.43 2.50 -0.02 0.56 -1.09 -1.26 -5.01 121.20 115.44 2uws s ILE 85 Ca 0.80 -2.94 -0.00 0.00 -2.23 0.00 0.00 60.65 56.28 2uws s ILE 85 Cb -0.36 -2.77 -0.01 0.00 -1.58 0.00 0.00 42.46 37.74 2uws s ILE 85 CO 0.39 -0.72 0.82 0.00 -1.23 0.00 0.00 174.94 174.19 2uws n ALA 86 N 3.55 1.17 -2.45 9.38 0.00 -1.26 -4.82 120.51 126.08 2uws n ALA 86 Ca 0.05 -0.08 -0.26 0.00 0.00 0.00 0.00 53.44 53.15 2uws n ALA 86 Cb 0.36 -2.38 -0.12 0.00 0.00 0.00 0.00 19.45 17.30 2uws n ALA 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2uws s LEU 87 N 0.00 2.35 0.04 0.00 1.43 -1.26 -1.20 118.68 120.04 2uws s LEU 87 Ca 0.02 -0.77 0.02 0.00 -1.03 0.00 0.00 54.13 52.37 2uws s LEU 87 Cb 0.01 -1.06 -0.02 0.00 0.03 0.00 0.00 46.19 45.14 2uws s LEU 87 CO -0.00 0.10 -0.07 0.00 0.23 0.00 0.00 176.35 176.61 2uws s ALA 88 N -1.35 0.55 0.71 4.21 0.00 0.46 -4.86 121.76 121.48 2uws s ALA 88 Ca 0.14 -0.78 -0.16 0.00 0.00 0.00 0.00 51.96 51.15 2uws s ALA 88 Cb -0.09 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 2uws s ALA 88 CO 0.06 -0.05 0.65 0.54 0.00 0.00 0.00 175.76 176.97 2uws n ARG 89 N 1.38 0.37 0.00 0.00 1.74 -1.26 -0.84 116.66 118.05 2uws n ARG 89 Ca -0.22 0.17 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 2uws n ARG 89 Cb 0.55 -1.93 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 2uws n ARG 89 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2uws n THR 90 N -2.38 0.71 -3.58 0.55 -2.24 -1.23 -4.67 114.28 101.43 2uws n THR 90 Ca 0.11 -0.74 -0.12 0.00 -2.27 0.00 0.00 64.05 61.03 2uws n THR 90 Cb 0.50 0.67 -0.04 0.00 -2.10 0.00 0.00 70.33 69.35 2uws n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2uws s ALA 91 N -0.71 -1.16 -1.95 6.98 0.00 -1.26 -5.05 121.76 118.62 2uws s ALA 91 Ca 0.00 0.24 0.30 0.00 0.00 0.00 0.00 51.96 52.51 2uws s ALA 91 Cb 0.00 0.62 1.56 0.00 0.00 0.00 0.00 23.12 25.30 2uws s ALA 91 CO 0.00 -0.61 2.04 1.33 0.00 0.00 0.00 175.76 178.52 2uws n VAL 92 N -0.03 0.00 -4.24 0.00 0.24 -1.26 -4.91 118.33 108.13 2uws n VAL 92 Ca -0.17 -0.06 -0.13 0.00 -2.04 0.00 0.00 64.34 61.94 2uws n VAL 92 Cb 0.63 -0.23 -0.10 0.00 -1.47 0.00 0.00 33.84 32.66 2uws n VAL 92 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2uws s SER 93 N -2.17 1.18 0.49 -1.34 1.04 -1.26 -5.14 113.70 106.51 2uws s SER 93 Ca 0.40 -1.18 -0.21 0.00 0.48 0.00 0.00 55.95 55.44 2uws s SER 93 Cb 0.21 0.13 -0.10 0.00 0.10 0.00 0.00 66.02 66.36 2uws s SER 93 CO 0.40 -0.58 0.66 -0.62 0.98 0.00 0.00 173.24 174.07 2uws n GLU 94 N -0.24 0.72 -0.09 4.02 -0.58 -1.26 -4.29 120.64 118.92 2uws n GLU 94 Ca -0.06 0.27 0.00 0.00 -0.42 0.00 0.00 57.16 56.95 2uws n GLU 94 Cb 0.63 -1.73 0.00 0.00 -0.57 0.00 0.00 31.44 29.77 2uws n GLU 94 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2uws n GLY 95 N 1.63 0.92 3.90 0.62 0.00 -1.26 -5.08 105.19 105.92 2uws n GLY 95 Ca 0.11 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.93 2uws n GLY 95 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2uws s PHE 96 N -2.01 2.85 0.60 1.61 0.40 -1.26 -5.10 117.98 115.06 2uws s PHE 96 Ca 0.00 -0.37 -0.20 0.00 -0.60 0.00 0.00 56.93 55.76 2uws s PHE 96 Cb 0.00 -2.03 -0.03 0.00 0.51 0.00 0.00 43.02 41.47 2uws s PHE 96 CO 0.00 -0.02 1.29 -2.14 0.70 0.00 0.00 175.22 175.05 2uws s PRO 97 N -4.11 2.88 -0.30 0.24 0.02 -1.26 -4.91 135.00 127.56 2uws s PRO 97 Ca 0.46 2.05 -0.05 0.00 0.02 0.00 0.00 61.00 63.48 2uws s PRO 97 Cb -0.06 -2.01 0.03 0.00 0.02 0.00 0.00 34.50 32.48 2uws s PRO 97 CO 0.28 -1.34 0.05 -1.01 -0.33 0.00 0.00 177.00 174.66 2uws s HIS 98 N -1.42 3.18 0.19 6.54 3.76 -1.26 -3.56 115.29 122.72 2uws s HIS 98 Ca 0.77 -1.35 -0.30 0.00 -0.15 0.00 0.00 55.06 54.03 2uws s HIS 98 Cb -0.36 -2.20 -0.09 0.00 1.11 0.00 0.00 32.58 31.04 2uws s HIS 98 CO 0.40 -0.68 1.32 0.00 -0.85 0.00 0.00 174.74 174.93 2uws s ALA 99 N 1.40 3.53 0.24 -1.40 0.00 -0.02 -4.61 121.76 120.91 2uws s ALA 99 Ca -0.00 1.11 -0.31 0.00 0.00 0.00 0.00 51.96 52.75 2uws s ALA 99 Cb -0.18 -3.49 -0.12 0.00 0.00 0.00 0.00 23.12 19.33 2uws s ALA 99 CO 0.01 -0.55 1.60 -2.30 0.00 0.00 0.00 175.76 174.52 2uws n PRO 100 N 2.79 2.53 0.07 0.00 -0.02 -1.26 -0.40 135.00 138.71 2uws n PRO 100 Ca 0.07 0.91 0.07 0.00 -2.02 0.00 0.00 63.50 62.53 2uws n PRO 100 Cb 0.43 -2.68 -0.04 0.00 -0.02 0.00 0.00 33.50 31.18 2uws n PRO 100 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2uws n THR 101 N 2.77 0.80 -0.23 3.45 -2.24 -0.34 -4.86 114.28 113.62 2uws n THR 101 Ca 0.12 -0.60 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 2uws n THR 101 Cb 0.34 -0.46 0.00 0.00 -2.10 0.00 0.00 70.33 68.11 2uws n THR 101 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2uws n GLY 102 N 1.27 5.28 3.60 3.38 0.00 -1.26 -5.09 105.19 112.36 2uws n GLY 102 Ca -0.04 -1.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.06 2uws n GLY 102 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2uws s ASP 103 N 1.00 6.61 0.33 1.61 -1.08 -1.26 -4.96 116.67 118.92 2uws s ASP 103 Ca 0.00 0.47 0.04 0.00 -0.52 0.00 0.00 52.55 52.55 2uws s ASP 103 Cb 0.00 -2.42 0.59 0.00 -1.46 0.00 0.00 42.92 39.63 2uws s ASP 103 CO 0.00 -0.77 1.87 1.55 0.52 0.00 0.00 175.17 178.34 2uws h PRO 104 N 8.44 0.52 0.41 4.34 0.13 -1.94 0.45 132.00 144.34 2uws h PRO 104 Ca -0.24 -0.12 -0.01 0.00 -0.87 0.00 0.00 66.00 64.76 2uws h PRO 104 Cb 1.09 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.13 2uws h PRO 104 CO 0.94 0.56 -0.40 0.52 -0.23 0.00 0.00 178.00 179.39 2uws h MET 105 N 0.50 -0.77 -0.87 0.86 2.86 -1.93 0.17 114.93 115.74 2uws h MET 105 Ca 0.11 0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.81 2uws h MET 105 Cb 0.35 0.18 -0.05 0.00 0.06 0.00 0.00 31.60 32.14 2uws h MET 105 CO 0.01 -0.51 0.57 0.87 1.06 0.00 0.00 176.91 178.91 2uws h LYS 106 N -0.80 1.13 0.00 1.72 1.57 -1.80 -2.74 116.57 115.65 2uws h LYS 106 Ca -0.05 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2uws h LYS 106 Cb 0.69 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2uws h LYS 106 CO -0.05 0.75 0.00 -0.25 -0.57 0.00 0.00 179.45 179.33 2uws n ASP 107 N -4.49 0.57 -2.14 0.86 8.00 0.15 -4.94 116.55 114.56 2uws n ASP 107 Ca 0.10 0.57 -0.11 0.00 0.71 0.00 0.00 54.79 56.05 2uws n ASP 107 Cb 0.03 -0.72 0.04 0.00 -0.02 0.00 0.00 41.12 40.46 2uws n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2uws n GLY 108 N 1.11 0.14 3.68 0.44 0.00 0.53 -4.76 105.19 106.32 2uws n GLY 108 Ca 0.05 -0.19 -0.25 0.00 0.00 0.00 0.00 46.02 45.63 2uws n GLY 108 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2uws s VAL 109 N -3.17 2.41 0.00 1.61 -7.23 -0.79 -3.52 120.40 109.71 2uws s VAL 109 Ca 0.22 -1.86 0.00 0.00 -1.81 0.00 0.00 61.98 58.53 2uws s VAL 109 Cb -0.09 -2.92 0.00 0.00 0.56 0.00 0.00 36.38 33.93 2uws s VAL 109 CO 0.38 -0.09 0.00 0.61 -0.31 0.00 0.00 175.10 175.69 2uws n GLY 110 N -1.08 0.78 0.00 2.32 0.00 -1.26 -0.93 105.19 105.02 2uws n GLY 110 Ca -0.03 -0.78 0.02 0.00 0.00 0.00 0.00 46.02 45.23 2uws n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2uws n PRO 111 N 4.23 0.07 -0.02 1.61 -0.04 -1.26 -0.87 135.00 138.73 2uws n PRO 111 Ca 0.00 0.23 0.13 0.00 -0.04 0.00 0.00 63.50 63.82 2uws n PRO 111 Cb 0.00 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.41 2uws n PRO 111 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2uws n ALA 112 N -1.27 2.55 -1.72 0.55 0.00 -0.11 -1.92 120.51 118.59 2uws n ALA 112 Ca 0.02 -0.49 -0.42 0.00 0.00 0.00 0.00 53.44 52.55 2uws n ALA 112 Cb 0.03 -1.11 -0.00 0.00 0.00 0.00 0.00 19.45 18.37 2uws n ALA 112 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2uws n SER 113 N 0.35 3.00 -4.49 0.00 7.64 -0.05 -3.89 113.62 116.18 2uws n SER 113 Ca 0.18 1.19 -0.24 0.00 1.01 0.00 0.00 58.87 61.01 2uws n SER 113 Cb 0.38 -1.53 -0.10 0.00 -1.01 0.00 0.00 64.21 61.96 2uws n SER 113 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 2uws s TRP 114 N -1.12 2.33 0.23 1.43 1.48 -1.23 -4.38 118.94 117.67 2uws s TRP 114 Ca 0.56 -0.36 0.05 0.00 -1.06 0.00 0.00 56.10 55.30 2uws s TRP 114 Cb -0.53 -1.08 -0.03 0.00 -1.16 0.00 0.00 33.47 30.67 2uws s TRP 114 CO 0.62 0.69 0.30 0.08 -4.06 0.00 0.00 176.95 174.58 2uws s VAL 115 N -2.52 5.03 -1.16 -0.66 1.01 -1.26 -5.02 120.40 115.82 2uws s VAL 115 Ca 0.31 -1.07 -0.08 0.00 0.00 0.00 0.00 61.98 61.14 2uws s VAL 115 Cb -0.04 -3.71 0.25 0.00 0.00 0.00 0.00 36.38 32.88 2uws s VAL 115 CO 0.16 -0.30 1.49 0.00 0.00 0.00 0.00 175.10 176.44 2uws n ALA 116 N -1.22 4.80 -1.84 5.51 0.00 -1.26 -4.80 120.51 121.70 2uws n ALA 116 Ca -0.08 -4.57 -0.29 0.00 0.00 0.00 0.00 53.44 48.49 2uws n ALA 116 Cb 0.57 -2.64 0.14 0.00 0.00 0.00 0.00 19.45 17.52 2uws n ALA 116 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2uws s ARG 117 N -0.98 1.15 0.32 0.00 1.70 -1.26 -5.01 118.95 114.86 2uws s ARG 117 Ca 0.35 -0.12 -0.28 0.00 -0.47 0.00 0.00 55.73 55.22 2uws s ARG 117 Cb 0.01 -1.88 -0.13 0.00 -0.57 0.00 0.00 34.95 32.38 2uws s ARG 117 CO 0.02 -2.12 1.07 -2.13 -1.08 0.00 0.00 175.30 171.07 2uws n ARG 118 N -3.63 1.54 -1.95 3.89 0.63 -1.26 -3.95 116.66 111.92 2uws n ARG 118 Ca 0.11 0.54 -0.38 0.00 -0.92 0.00 0.00 57.85 57.21 2uws n ARG 118 Cb 0.60 -1.98 0.02 0.00 0.45 0.00 0.00 32.46 31.55 2uws n ARG 118 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2uws n ASP 119 N 1.03 7.35 -4.31 6.15 2.03 -1.26 -1.32 116.55 126.22 2uws n ASP 119 Ca 0.08 -3.68 -0.23 0.00 0.52 0.00 0.00 54.79 51.48 2uws n ASP 119 Cb 0.34 -1.12 -0.09 0.00 -0.72 0.00 0.00 41.12 39.52 2uws n ASP 119 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2uws s LEU 120 N -3.71 2.05 0.10 -2.67 1.43 -1.26 -4.94 118.68 109.68 2uws s LEU 120 Ca 0.51 -1.51 -0.16 0.00 -1.03 0.00 0.00 54.13 51.95 2uws s LEU 120 Cb 0.38 -0.24 -0.07 0.00 0.03 0.00 0.00 46.19 46.30 2uws s LEU 120 CO -0.33 -0.76 0.54 -2.84 0.23 0.00 0.00 176.35 173.19 2uws s PRO 121 N -3.83 4.05 0.23 1.29 0.02 -1.25 0.32 135.00 135.82 2uws s PRO 121 Ca 0.31 0.57 -0.31 0.00 0.02 0.00 0.00 61.00 61.58 2uws s PRO 121 Cb 0.06 -3.08 -0.14 0.00 0.02 0.00 0.00 34.50 31.37 2uws s PRO 121 CO 0.15 0.56 1.38 -1.91 -0.33 0.00 0.00 177.00 176.85 2uws n GLU 122 N 1.26 1.93 -4.66 5.54 2.13 -1.26 -4.88 120.64 120.70 2uws n GLU 122 Ca -0.08 0.69 -0.34 0.00 0.66 0.00 0.00 57.16 58.09 2uws n GLU 122 Cb 0.51 -2.33 -0.11 0.00 0.27 0.00 0.00 31.44 29.78 2uws n GLU 122 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2uws s LEU 123 N 0.17 3.11 0.00 4.31 1.43 -1.26 -1.23 118.68 125.21 2uws s LEU 123 Ca 0.69 -0.05 -0.11 0.00 -1.03 0.00 0.00 54.13 53.64 2uws s LEU 123 Cb -0.67 -1.67 0.17 0.00 0.03 0.00 0.00 46.19 44.04 2uws s LEU 123 CO 0.50 0.36 0.47 -0.90 0.23 0.00 0.00 176.35 177.00 2uws n ASP 124 N 2.23 -2.33 0.03 2.29 5.68 0.19 -4.75 116.55 119.89 2uws n ASP 124 Ca -0.18 -0.61 0.12 0.00 -0.50 0.00 0.00 54.79 53.62 2uws n ASP 124 Cb 0.53 -0.48 0.50 0.00 -1.14 0.00 0.00 41.12 40.53 2uws n ASP 124 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2uws n GLY 125 N -1.92 -1.39 1.21 6.12 0.00 -1.26 -1.48 105.19 106.47 2uws n GLY 125 Ca 0.07 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.15 2uws n GLY 125 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2uws n HIS 126 N -1.68 0.62 -0.91 1.61 8.25 -1.26 -4.95 115.22 116.90 2uws n HIS 126 Ca 0.06 -0.31 0.00 0.00 -0.26 0.00 0.00 57.72 57.20 2uws n HIS 126 Cb 0.30 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.41 2uws n HIS 126 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2uws n GLY 127 N 1.54 0.69 3.91 -1.41 0.00 -0.55 -5.04 105.19 104.33 2uws n GLY 127 Ca 0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 2uws n GLY 127 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2uws s HIS 128 N -2.63 3.48 -0.22 1.61 3.76 -1.26 -4.78 115.29 115.25 2uws s HIS 128 Ca 0.00 0.50 -0.39 0.00 -0.15 0.00 0.00 55.06 55.02 2uws s HIS 128 Cb 0.00 -1.98 -0.15 0.00 1.11 0.00 0.00 32.58 31.56 2uws s HIS 128 CO 0.00 0.28 1.74 0.09 -0.85 0.00 0.00 174.74 176.00 2uws n ASN 129 N -0.78 2.54 -0.26 1.40 3.02 -1.26 0.53 115.26 120.44 2uws n ASN 129 Ca -0.03 1.06 0.08 0.00 -0.03 0.00 0.00 54.58 55.66 2uws n ASN 129 Cb 0.54 -1.19 0.32 0.00 -0.61 0.00 0.00 39.78 38.84 2uws n ASN 129 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2uws h LYS 130 N 7.39 0.81 -4.59 3.52 3.64 -1.46 -3.42 116.57 122.45 2uws h LYS 130 Ca -0.47 -0.05 -0.62 0.00 -1.27 0.00 0.00 60.65 58.25 2uws h LYS 130 Cb 1.31 -0.18 -0.37 0.00 -0.41 0.00 0.00 32.23 32.58 2uws h LYS 130 CO 0.95 0.53 -0.81 0.42 -2.27 0.00 0.00 179.45 178.27 2uws s ILE 131 N -5.76 1.65 0.27 2.00 1.01 -1.26 -1.18 121.20 117.93 2uws s ILE 131 Ca -0.10 -0.99 0.10 0.00 0.00 0.00 0.00 60.65 59.66 2uws s ILE 131 Cb 0.21 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.92 2uws s ILE 131 CO 0.79 0.19 -0.05 -0.54 0.00 0.00 0.00 174.94 175.33 2uws s LYS 132 N 1.40 2.16 0.72 2.79 1.02 -0.82 -4.59 119.74 122.41 2uws s LYS 132 Ca -0.01 -1.49 -0.16 0.00 0.02 0.00 0.00 55.97 54.33 2uws s LYS 132 Cb -0.16 -2.08 0.03 0.00 -0.52 0.00 0.00 37.83 35.10 2uws s LYS 132 CO -0.08 0.36 1.26 -1.25 -0.92 0.00 0.00 175.35 174.71 2uws s PRO 133 N -3.62 2.16 0.20 -1.68 0.04 -1.26 -0.05 135.00 130.79 2uws s PRO 133 Ca 0.31 1.93 -0.05 0.00 0.04 0.00 0.00 61.00 63.23 2uws s PRO 133 Cb -0.06 -1.82 0.15 0.00 0.04 0.00 0.00 34.50 32.81 2uws s PRO 133 CO 0.19 -1.86 1.58 1.98 0.04 0.00 0.00 177.00 178.93 2uws h MET 134 N -0.08 0.74 -0.41 4.56 4.05 -0.87 -2.32 114.93 120.60 2uws h MET 134 Ca -0.49 -0.34 0.12 0.00 -0.28 0.00 0.00 59.70 58.71 2uws h MET 134 Cb 1.32 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 32.09 2uws h MET 134 CO 0.50 0.96 0.62 1.57 0.23 0.00 0.00 176.91 180.79 2uws h LYS 135 N 0.63 0.00 -0.12 0.39 2.10 -1.91 0.64 116.57 118.29 2uws h LYS 135 Ca 0.07 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.72 2uws h LYS 135 Cb 0.84 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.17 2uws h LYS 135 CO 0.07 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.52 2uws n ALA 136 N -2.15 2.35 -4.04 0.07 0.00 -0.88 -4.94 120.51 110.92 2uws n ALA 136 Ca 0.08 -1.88 -0.33 0.00 0.00 0.00 0.00 53.44 51.31 2uws n ALA 136 Cb 0.78 -0.37 -0.16 0.00 0.00 0.00 0.00 19.45 19.70 2uws n ALA 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uws s ALA 137 N -2.06 2.32 -0.18 0.00 0.00 0.22 -4.94 121.76 117.13 2uws s ALA 137 Ca 0.25 -1.20 -0.10 0.00 0.00 0.00 0.00 51.96 50.90 2uws s ALA 137 Cb 0.19 -1.16 -0.05 0.00 0.00 0.00 0.00 23.12 22.11 2uws s ALA 137 CO 0.06 -0.30 0.17 0.00 0.00 0.00 0.00 175.76 175.69 2uws s ALA 138 N 1.21 3.70 -0.46 0.00 0.00 -1.26 -1.06 121.76 123.89 2uws s ALA 138 Ca 0.03 -0.63 -0.06 0.00 0.00 0.00 0.00 51.96 51.30 2uws s ALA 138 Cb -0.13 -2.19 0.12 0.00 0.00 0.00 0.00 23.12 20.92 2uws s ALA 138 CO -0.11 0.22 0.29 0.20 0.00 0.00 0.00 175.76 176.37 2uws s GLY 139 N 0.14 2.05 0.08 0.00 0.00 -1.26 -5.11 107.32 103.22 2uws s GLY 139 Ca 0.11 -2.58 -0.14 0.00 0.00 0.00 0.00 44.72 42.10 2uws s GLY 139 CO 0.00 1.08 0.49 -1.36 0.00 0.00 0.00 173.10 173.31 2uws s PHE 140 N 1.18 3.66 0.05 1.90 0.40 -0.22 -5.08 117.98 119.87 2uws s PHE 140 Ca 0.08 1.02 -0.12 0.00 -0.60 0.00 0.00 56.93 57.30 2uws s PHE 140 Cb -0.24 -2.32 0.01 0.00 0.51 0.00 0.00 43.02 40.98 2uws s PHE 140 CO -0.02 0.53 0.27 -3.38 0.70 0.00 0.00 175.22 173.31 2uws s HIS 141 N -1.30 -0.04 0.14 0.36 -3.43 -1.26 -4.92 115.29 104.83 2uws s HIS 141 Ca 0.32 -0.14 -0.34 0.00 -0.80 0.00 0.00 55.06 54.10 2uws s HIS 141 Cb -0.16 0.06 -0.14 0.00 -1.43 0.00 0.00 32.58 30.91 2uws s HIS 141 CO 0.17 -0.49 1.61 0.28 -2.00 0.00 0.00 174.74 174.31 2uws n VAL 142 N 0.53 0.06 0.45 -5.38 0.31 -1.26 -4.91 118.33 108.13 2uws n VAL 142 Ca -0.18 -0.01 0.05 0.00 -0.01 0.00 0.00 64.34 64.18 2uws n VAL 142 Cb 0.60 -1.58 -0.01 0.00 -0.91 0.00 0.00 33.84 31.93 2uws n VAL 142 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2uws n SER 143 N 3.77 1.05 -3.63 4.52 3.41 -1.26 -5.06 113.62 116.42 2uws n SER 143 Ca 0.18 -1.02 -0.03 0.00 -0.26 0.00 0.00 58.87 57.73 2uws n SER 143 Cb 0.29 0.59 -0.03 0.00 -0.26 0.00 0.00 64.21 64.80 2uws n SER 143 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2uws s ALA 144 N -1.49 -2.12 0.04 7.33 0.00 -1.26 -5.16 121.76 119.10 2uws s ALA 144 Ca 0.07 1.83 0.00 0.00 0.00 0.00 0.00 51.96 53.87 2uws s ALA 144 Cb 0.08 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 22.24 2uws s ALA 144 CO 0.29 -0.38 0.00 0.41 0.00 0.00 0.00 175.76 176.08 2uws n GLY 145 N 0.30 -2.32 3.70 0.00 0.00 -1.26 -4.84 105.19 100.78 2uws n GLY 145 Ca 0.01 -1.44 -0.42 0.00 0.00 0.00 0.00 46.02 44.16 2uws n GLY 145 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2uws s LYS 146 N -2.57 4.19 -0.18 1.61 2.47 -1.26 -4.95 119.74 119.06 2uws s LYS 146 Ca 0.00 2.41 -0.29 0.00 -1.56 0.00 0.00 55.97 56.53 2uws s LYS 146 Cb 0.00 -3.36 -0.02 0.00 -1.46 0.00 0.00 37.83 32.98 2uws s LYS 146 CO 0.00 -0.70 1.45 1.21 0.16 0.00 0.00 175.35 177.48 2uws s ASN 147 N 1.81 6.68 0.45 1.43 3.84 -1.26 -4.91 114.94 122.97 2uws s ASN 147 Ca 0.73 1.72 0.24 0.00 0.21 0.00 0.00 52.86 55.76 2uws s ASN 147 Cb -0.43 -2.54 0.54 0.00 -0.55 0.00 0.00 41.25 38.27 2uws s ASN 147 CO 0.32 -0.99 1.68 1.55 -2.79 0.00 0.00 177.10 176.87 2uws h PRO 148 N 9.37 0.00 -6.52 0.43 0.13 -1.95 -3.45 132.00 130.00 2uws h PRO 148 Ca -0.31 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.29 2uws h PRO 148 Cb 1.13 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.30 2uws h PRO 148 CO 0.99 0.06 1.11 0.42 -0.23 0.00 0.00 178.00 180.34 2uws s ILE 149 N -3.29 2.47 0.00 -3.56 1.01 -1.26 -0.77 121.20 115.80 2uws s ILE 149 Ca 0.05 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.73 2uws s ILE 149 Cb 0.06 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 39.51 2uws s ILE 149 CO 0.65 0.00 0.00 0.61 0.00 0.00 0.00 174.94 176.20 2uws n GLY 150 N 4.22 2.67 3.77 6.18 0.00 0.23 -4.99 105.19 117.26 2uws n GLY 150 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 2uws n GLY 150 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2uws s LEU 151 N 0.00 4.44 0.47 0.99 1.43 0.05 -4.65 118.68 121.41 2uws s LEU 151 Ca 0.00 2.57 -0.24 0.00 -1.03 0.00 0.00 54.13 55.44 2uws s LEU 151 Cb 0.00 -3.67 -0.07 0.00 0.03 0.00 0.00 46.19 42.48 2uws s LEU 151 CO 0.00 -0.46 1.29 -2.16 0.23 0.00 0.00 176.35 175.25 2uws s PRO 152 N -1.76 3.64 -0.22 1.29 0.04 -1.26 -0.96 135.00 135.77 2uws s PRO 152 Ca 0.49 2.09 -0.08 0.00 0.04 0.00 0.00 61.00 63.53 2uws s PRO 152 Cb -0.37 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.63 2uws s PRO 152 CO 0.49 -0.74 0.09 0.08 0.04 0.00 0.00 177.00 176.96 2uws s VAL 153 N -1.35 4.81 -0.11 -0.36 1.01 -0.77 -1.11 120.40 122.52 2uws s VAL 153 Ca 0.63 -0.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.59 2uws s VAL 153 Cb -0.36 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 2uws s VAL 153 CO 0.45 0.39 -0.06 -0.60 0.00 0.00 0.00 175.10 175.29 2uws s ARG 154 N 0.89 3.23 0.50 2.72 3.52 -0.06 0.05 118.95 129.80 2uws s ARG 154 Ca 0.05 -0.54 0.05 0.00 -0.13 0.00 0.00 55.73 55.16 2uws s ARG 154 Cb -0.14 -2.75 0.03 0.00 -1.56 0.00 0.00 34.95 30.53 2uws s ARG 154 CO 0.03 0.44 0.69 0.20 -0.81 0.00 0.00 175.30 175.85 2uws s GLY 155 N -0.19 1.88 0.00 8.12 0.00 -0.72 0.21 107.32 116.62 2uws s GLY 155 Ca 0.03 -1.53 0.15 0.00 0.00 0.00 0.00 44.72 43.37 2uws s GLY 155 CO 0.03 -1.27 1.43 0.00 0.00 0.00 0.00 173.10 173.28 2uws n ASP 157 N -1.37 0.95 -2.48 0.00 5.75 -1.25 -4.54 116.55 113.61 2uws n ASP 157 Ca 0.06 -1.92 -0.18 0.00 -0.01 0.00 0.00 54.79 52.74 2uws n ASP 157 Cb 0.14 -0.11 -0.01 0.00 -1.03 0.00 0.00 41.12 40.11 2uws n ASP 157 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2uws n LEU 158 N -0.01 -1.68 -4.75 -2.12 4.77 0.92 -5.01 117.00 109.11 2uws n LEU 158 Ca 0.08 0.04 -0.29 0.00 -0.03 0.00 0.00 56.01 55.80 2uws n LEU 158 Cb 0.16 -2.63 -0.07 0.00 -2.33 0.00 0.00 43.42 38.56 2uws n LEU 158 CO 0.06 -0.15 -0.28 -1.61 -1.33 0.00 0.00 177.39 174.08 2uws s GLU 159 N -5.11 2.77 0.15 3.23 0.41 -1.24 -4.91 118.70 113.99 2uws s GLU 159 Ca 0.03 -0.80 -0.30 0.00 -0.41 0.00 0.00 54.97 53.49 2uws s GLU 159 Cb -0.01 -2.63 -0.07 0.00 -1.78 0.00 0.00 34.13 29.63 2uws s GLU 159 CO 0.04 0.53 1.08 0.42 -0.49 0.00 0.00 175.26 176.84 2uws s ILE 160 N -1.48 4.03 -0.70 -1.63 -1.09 -1.26 -1.76 121.20 117.31 2uws s ILE 160 Ca 0.29 1.69 0.08 0.00 -2.23 0.00 0.00 60.65 60.48 2uws s ILE 160 Cb -0.11 -4.08 -0.00 0.00 -1.58 0.00 0.00 42.46 36.68 2uws s ILE 160 CO 0.21 0.26 0.55 0.00 -1.23 0.00 0.00 174.94 174.73 2uws n ALA 161 N 2.65 2.70 0.00 9.38 0.00 0.11 -4.92 120.51 130.42 2uws n ALA 161 Ca 0.03 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.08 2uws n ALA 161 Cb 0.47 -0.27 0.00 0.00 0.00 0.00 0.00 19.45 19.65 2uws n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2uws n GLY 162 N 0.79 -0.49 3.46 0.00 0.00 -1.23 -4.37 105.19 103.35 2uws n GLY 162 Ca 0.03 -0.84 -0.16 0.00 0.00 0.00 0.00 46.02 45.05 2uws n GLY 162 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2uws s LYS 163 N -2.00 1.02 -0.10 1.61 -2.85 -0.88 -1.85 119.74 114.69 2uws s LYS 163 Ca 0.00 0.08 -0.26 0.00 -1.00 0.00 0.00 55.97 54.80 2uws s LYS 163 Cb 0.00 0.47 -0.02 0.00 -2.06 0.00 0.00 37.83 36.22 2uws s LYS 163 CO 0.00 -0.33 0.83 0.08 0.10 0.00 0.00 175.35 176.03 2uws s VAL 164 N -1.54 4.93 -0.15 1.79 1.01 -0.13 -0.28 120.40 126.02 2uws s VAL 164 Ca -0.10 1.68 0.05 0.00 0.00 0.00 0.00 61.98 63.61 2uws s VAL 164 Cb -0.01 -4.15 -0.06 0.00 0.00 0.00 0.00 36.38 32.16 2uws s VAL 164 CO 0.06 0.12 0.17 1.33 0.00 0.00 0.00 175.10 176.79 2uws n VAL 165 N 4.25 0.00 -3.90 2.92 0.24 0.02 -0.60 118.33 121.27 2uws n VAL 165 Ca 0.03 -0.29 -0.02 0.00 -2.04 0.00 0.00 64.34 62.03 2uws n VAL 165 Cb 0.50 0.77 0.02 0.00 -1.47 0.00 0.00 33.84 33.66 2uws n VAL 165 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2uws s ASP 166 N -1.87 0.00 -0.08 -1.34 2.15 -1.20 -4.93 116.67 109.39 2uws s ASP 166 Ca 0.00 -0.58 0.02 0.00 0.43 0.00 0.00 52.55 52.43 2uws s ASP 166 Cb 0.04 0.43 0.01 0.00 -0.30 0.00 0.00 42.92 43.10 2uws s ASP 166 CO 0.20 -0.86 -0.14 -0.63 -0.17 0.00 0.00 175.17 173.57 2uws s ILE 167 N -2.16 1.33 -0.05 4.11 1.01 -1.26 -2.37 121.20 121.80 2uws s ILE 167 Ca 0.23 -0.58 -0.17 0.00 0.00 0.00 0.00 60.65 60.13 2uws s ILE 167 Cb -0.02 -1.21 -0.05 0.00 0.01 0.00 0.00 42.46 41.19 2uws s ILE 167 CO 0.04 0.40 0.47 0.26 0.00 0.00 0.00 174.94 176.11 2uws s TRP 168 N 0.72 3.63 0.12 3.97 0.52 0.15 -0.11 118.94 127.94 2uws s TRP 168 Ca -0.13 0.99 0.06 0.00 0.02 0.00 0.00 56.10 57.04 2uws s TRP 168 Cb -0.16 -2.46 -0.04 0.00 -1.15 0.00 0.00 33.47 29.66 2uws s TRP 168 CO 0.03 0.39 -0.15 0.14 0.02 0.00 0.00 176.95 177.37 2uws s VAL 169 N -0.20 1.41 -0.35 4.03 -7.23 0.93 -0.85 120.40 118.15 2uws s VAL 169 Ca 0.26 -1.68 -0.19 0.00 -1.81 0.00 0.00 61.98 58.57 2uws s VAL 169 Cb -0.16 -1.52 -0.00 0.00 0.56 0.00 0.00 36.38 35.26 2uws s VAL 169 CO 0.13 -0.34 0.54 -0.62 -0.31 0.00 0.00 175.10 174.50 2uws s ASP 170 N -2.34 6.34 0.01 4.85 -1.08 0.36 -1.94 116.67 122.88 2uws s ASP 170 Ca 0.08 -0.01 -0.25 0.00 -0.52 0.00 0.00 52.55 51.85 2uws s ASP 170 Cb -0.06 -2.28 -0.16 0.00 -1.46 0.00 0.00 42.92 38.95 2uws s ASP 170 CO 0.04 -0.51 1.22 0.40 0.52 0.00 0.00 175.17 176.83 2uws h ILE 171 N 5.63 0.63 0.00 4.11 5.03 -1.47 0.38 117.51 131.84 2uws h ILE 171 Ca -0.27 -0.58 -0.03 0.00 -0.12 0.00 0.00 64.86 63.86 2uws h ILE 171 Cb 1.12 0.91 -0.00 0.00 -3.03 0.00 0.00 36.82 35.82 2uws h ILE 171 CO 0.79 0.10 -0.13 1.55 -0.68 0.00 0.00 178.15 179.79 2uws h PRO 172 N -0.80 0.00 -0.01 2.37 0.13 -1.94 -2.65 132.00 129.10 2uws h PRO 172 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2uws h PRO 172 Cb 0.52 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.65 2uws h PRO 172 CO 0.08 0.13 -0.03 0.39 -0.23 0.00 0.00 178.00 178.33 2uws n GLU 173 N -3.59 0.80 -3.61 0.86 1.02 -1.21 -5.01 120.64 109.89 2uws n GLU 173 Ca -0.02 -1.12 -0.24 0.00 -0.02 0.00 0.00 57.16 55.77 2uws n GLU 173 Cb 0.26 -1.21 0.02 0.00 -0.02 0.00 0.00 31.44 30.49 2uws n GLU 173 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2uws n GLN 174 N 0.54 -1.27 -3.69 3.49 6.02 0.13 -4.98 117.38 117.62 2uws n GLN 174 Ca 0.06 0.75 -0.12 0.00 -0.01 0.00 0.00 57.00 57.68 2uws n GLN 174 Cb 0.28 -3.82 -0.06 0.00 1.02 0.00 0.00 30.24 27.66 2uws n GLN 174 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2uws s MET 175 N -5.12 0.92 0.13 -1.09 0.23 -1.08 -4.95 119.30 108.34 2uws s MET 175 Ca 0.23 -0.50 -0.30 0.00 -1.03 0.00 0.00 55.69 54.09 2uws s MET 175 Cb -0.09 0.40 -0.07 0.00 -1.53 0.00 0.00 34.83 33.54 2uws s MET 175 CO 0.86 -0.32 1.20 0.00 -2.03 0.00 0.00 175.02 174.73 2uws s ALA 176 N -2.82 3.42 -0.03 3.16 0.00 -1.26 -0.48 121.76 123.75 2uws s ALA 176 Ca -0.03 0.91 0.00 0.00 0.00 0.00 0.00 51.96 52.84 2uws s ALA 176 Cb -0.00 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 2uws s ALA 176 CO -0.05 -0.39 -0.02 0.54 0.00 0.00 0.00 175.76 175.83 2uws n ARG 177 N 3.11 0.07 -4.13 0.00 5.12 -0.03 -4.81 116.66 115.99 2uws n ARG 177 Ca 0.06 0.02 -0.10 0.00 -1.93 0.00 0.00 57.85 55.90 2uws n ARG 177 Cb 0.45 -1.03 -0.10 0.00 -1.16 0.00 0.00 32.46 30.62 2uws n ARG 177 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 2uws s PHE 178 N -2.05 0.74 -0.34 -1.55 0.40 -1.06 -0.15 117.98 113.98 2uws s PHE 178 Ca -0.04 -0.87 -0.12 0.00 -0.60 0.00 0.00 56.93 55.30 2uws s PHE 178 Cb 0.01 -0.45 -0.01 0.00 0.51 0.00 0.00 43.02 43.07 2uws s PHE 178 CO 0.06 -0.19 0.23 -0.51 0.70 0.00 0.00 175.22 175.51 2uws s LEU 179 N -2.71 4.50 -0.09 -0.37 1.43 0.08 -0.67 118.68 120.84 2uws s LEU 179 Ca 0.06 -0.47 -0.30 0.00 -1.03 0.00 0.00 54.13 52.40 2uws s LEU 179 Cb 0.03 -2.12 -0.03 0.00 0.03 0.00 0.00 46.19 44.10 2uws s LEU 179 CO -0.05 -0.24 1.32 -0.70 0.23 0.00 0.00 176.35 176.91 2uws s GLU 180 N 1.70 4.27 -0.09 1.70 2.12 -1.00 -1.59 118.70 125.81 2uws s GLU 180 Ca 0.06 1.79 0.04 0.00 0.36 0.00 0.00 54.97 57.22 2uws s GLU 180 Cb -0.17 -3.70 -0.01 0.00 0.26 0.00 0.00 34.13 30.51 2uws s GLU 180 CO 0.10 -0.63 -0.23 0.08 -0.54 0.00 0.00 175.26 174.04 2uws s VAL 181 N 3.02 2.17 -0.18 3.70 1.01 0.85 -0.80 120.40 130.17 2uws s VAL 181 Ca 0.59 -1.00 -0.14 0.00 0.00 0.00 0.00 61.98 61.43 2uws s VAL 181 Cb -0.26 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 2uws s VAL 181 CO 0.21 0.56 0.31 -0.70 0.00 0.00 0.00 175.10 175.47 2uws s GLU 182 N 0.15 4.21 0.42 2.72 2.12 0.61 -0.16 118.70 128.77 2uws s GLU 182 Ca -0.12 0.08 0.01 0.00 0.36 0.00 0.00 54.97 55.30 2uws s GLU 182 Cb -0.16 -3.47 -0.01 0.00 0.26 0.00 0.00 34.13 30.75 2uws s GLU 182 CO 0.07 0.13 0.63 -0.51 -0.54 0.00 0.00 175.26 175.04 2uws s LEU 183 N 0.79 3.73 0.34 2.70 1.43 0.54 -2.07 118.68 126.15 2uws s LEU 183 Ca 0.16 0.23 0.22 0.00 -1.03 0.00 0.00 54.13 53.71 2uws s LEU 183 Cb -0.14 -3.11 1.21 0.00 0.03 0.00 0.00 46.19 44.19 2uws s LEU 183 CO 0.05 -0.62 1.35 1.17 0.23 0.00 0.00 176.35 178.52 2uws n LYS 184 N -1.99 -0.04 -0.21 1.70 4.81 -1.26 -0.13 118.16 121.03 2uws n LYS 184 Ca 0.01 1.13 0.05 0.00 -0.87 0.00 0.00 58.31 58.63 2uws n LYS 184 Cb 0.58 -2.12 0.16 0.00 0.02 0.00 0.00 35.03 33.66 2uws n LYS 184 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2uws n ASP 185 N -4.70 2.05 0.00 3.14 5.68 -1.26 -4.93 116.55 116.52 2uws n ASP 185 Ca 0.34 -2.08 0.00 0.00 -0.50 0.00 0.00 54.79 52.55 2uws n ASP 185 Cb 1.21 -0.29 0.00 0.00 -1.14 0.00 0.00 41.12 40.90 2uws n ASP 185 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2uws n GLY 186 N 0.90 2.74 3.89 6.12 0.00 0.81 -5.04 105.19 114.61 2uws n GLY 186 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 2uws n GLY 186 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2uws s SER 187 N -3.66 5.85 0.32 1.61 1.04 -1.26 -4.75 113.70 112.85 2uws s SER 187 Ca 0.00 1.10 0.07 0.00 0.48 0.00 0.00 55.95 57.60 2uws s SER 187 Cb 0.00 -2.10 -0.03 0.00 0.10 0.00 0.00 66.02 64.00 2uws s SER 187 CO 0.00 -1.02 0.31 0.42 0.98 0.00 0.00 173.24 173.94 2uws s THR 188 N -3.13 3.86 0.09 2.02 -4.23 -1.26 -0.34 115.64 112.66 2uws s THR 188 Ca 0.55 -1.29 0.04 0.00 -1.18 0.00 0.00 61.69 59.81 2uws s THR 188 Cb -0.11 -3.29 -0.03 0.00 1.34 0.00 0.00 72.50 70.41 2uws s THR 188 CO 0.50 -0.21 -0.12 -0.13 -0.54 0.00 0.00 174.62 174.12 2uws s ARG 189 N -4.00 0.84 0.00 3.99 1.81 0.77 -4.91 118.95 117.45 2uws s ARG 189 Ca 0.40 -1.07 -0.24 0.00 -1.72 0.00 0.00 55.73 53.09 2uws s ARG 189 Cb -0.07 -0.67 -0.05 0.00 -0.45 0.00 0.00 34.95 33.71 2uws s ARG 189 CO 0.27 0.13 0.73 -0.51 -0.68 0.00 0.00 175.30 175.24 2uws s LEU 190 N -2.15 4.40 -0.11 2.53 1.43 -1.26 -0.11 118.68 123.41 2uws s LEU 190 Ca 0.02 1.33 0.03 0.00 -1.03 0.00 0.00 54.13 54.48 2uws s LEU 190 Cb -0.06 -3.15 -0.00 0.00 0.03 0.00 0.00 46.19 43.00 2uws s LEU 190 CO 0.01 -0.03 -0.21 -0.76 0.23 0.00 0.00 176.35 175.60 2uws s LEU 191 N 0.25 2.27 0.26 1.79 2.01 -0.62 -4.96 118.68 119.67 2uws s LEU 191 Ca 0.38 -0.50 -0.31 0.00 0.01 0.00 0.00 54.13 53.72 2uws s LEU 191 Cb -0.19 -1.47 -0.13 0.00 0.01 0.00 0.00 46.19 44.41 2uws s LEU 191 CO 0.21 0.16 1.41 -2.65 1.01 0.00 0.00 176.35 176.49 2uws n PRO 192 N 3.55 2.12 -0.29 1.29 -0.02 -1.26 -0.74 135.00 139.65 2uws n PRO 192 Ca -0.19 0.75 0.11 0.00 -2.02 0.00 0.00 63.50 62.16 2uws n PRO 192 Cb 0.53 -2.41 0.27 0.00 -0.02 0.00 0.00 33.50 31.87 2uws n PRO 192 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 2uws h MET 193 N 4.04 0.37 0.00 -0.52 2.86 -0.85 -1.90 114.93 118.94 2uws h MET 193 Ca -0.45 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 2uws h MET 193 Cb 1.27 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.85 2uws h MET 193 CO 0.74 0.25 0.00 1.04 1.06 0.00 0.00 176.91 180.00 2uws n GLN 194 N -5.06 0.55 0.00 1.72 3.00 -1.26 -3.07 117.38 113.26 2uws n GLN 194 Ca 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.19 2uws n GLN 194 Cb 0.60 -1.30 0.00 0.00 0.00 0.00 0.00 30.24 29.54 2uws n GLN 194 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 2uws n MET 195 N -0.80 1.83 -4.31 -1.09 2.81 -0.71 -5.02 117.12 109.81 2uws n MET 195 Ca 0.08 -1.11 -0.25 0.00 -1.81 0.00 0.00 57.70 54.60 2uws n MET 195 Cb 0.04 -0.84 -0.13 0.00 -0.71 0.00 0.00 33.22 31.58 2uws n MET 195 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2uws s VAL 196 N -0.62 1.86 -0.34 2.03 -7.23 -1.17 -4.30 120.40 110.62 2uws s VAL 196 Ca 0.00 -1.61 -0.04 0.00 -1.81 0.00 0.00 61.98 58.53 2uws s VAL 196 Cb 0.00 -1.68 0.06 0.00 0.56 0.00 0.00 36.38 35.33 2uws s VAL 196 CO 0.00 -0.03 0.09 -0.75 -0.31 0.00 0.00 175.10 174.10 2uws s LYS 197 N -1.97 2.39 -0.46 4.82 2.20 0.83 -4.94 119.74 122.61 2uws s LYS 197 Ca 0.09 -1.38 -0.28 0.00 -0.36 0.00 0.00 55.97 54.03 2uws s LYS 197 Cb -0.10 -3.38 -0.00 0.00 -1.51 0.00 0.00 37.83 32.84 2uws s LYS 197 CO 0.05 -0.76 1.57 0.08 -0.36 0.00 0.00 175.35 175.93 2uws s VAL 198 N 1.27 3.69 0.00 4.02 1.01 -1.26 0.32 120.40 129.45 2uws s VAL 198 Ca -0.01 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.62 2uws s VAL 198 Cb -0.21 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.09 2uws s VAL 198 CO -0.01 -0.80 0.00 0.00 0.00 0.00 0.00 175.10 174.29 2uws n GLN 199 N 8.47 1.50 0.00 2.72 6.02 0.04 -4.99 117.38 131.15 2uws n GLN 199 Ca 0.18 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 57.15 2uws n GLN 199 Cb 0.49 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.64 2uws n GLN 199 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2uws n SER 200 N -2.24 0.64 -0.35 1.08 3.41 -1.26 -4.06 113.62 110.84 2uws n SER 200 Ca 0.00 0.28 0.04 0.00 -0.26 0.00 0.00 58.87 58.93 2uws n SER 200 Cb 0.00 0.45 0.06 0.00 -0.26 0.00 0.00 64.21 64.46 2uws n SER 200 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2uws n ASN 201 N -2.82 2.01 -3.54 4.04 6.94 -1.26 -5.05 115.26 115.58 2uws n ASN 201 Ca -0.13 -1.58 -0.08 0.00 -0.02 0.00 0.00 54.58 52.76 2uws n ASN 201 Cb 0.88 -0.06 -0.02 0.00 -2.36 0.00 0.00 39.78 38.22 2uws n ASN 201 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2uws s ARG 202 N -0.77 1.02 -0.17 -3.83 1.70 -1.26 -4.50 118.95 111.14 2uws s ARG 202 Ca 0.11 -0.42 -0.05 0.00 -0.47 0.00 0.00 55.73 54.90 2uws s ARG 202 Cb 0.07 0.44 -0.03 0.00 -0.57 0.00 0.00 34.95 34.85 2uws s ARG 202 CO 0.10 -0.45 -0.00 0.08 -1.08 0.00 0.00 175.30 173.95 2uws s VAL 203 N -3.31 4.17 -0.19 4.99 1.01 -0.27 -0.78 120.40 126.02 2uws s VAL 203 Ca 0.06 -0.25 -0.07 0.00 0.00 0.00 0.00 61.98 61.71 2uws s VAL 203 Cb -0.01 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 2uws s VAL 203 CO -0.07 0.47 0.06 -2.28 0.00 0.00 0.00 175.10 173.28 2uws s HIS 204 N 0.47 3.21 -0.36 5.22 2.46 0.15 -0.88 115.29 125.57 2uws s HIS 204 Ca -0.01 -0.01 0.02 0.00 0.47 0.00 0.00 55.06 55.53 2uws s HIS 204 Cb -0.14 -2.09 0.10 0.00 -0.13 0.00 0.00 32.58 30.33 2uws s HIS 204 CO 0.02 0.08 0.09 0.08 -2.47 0.00 0.00 174.74 172.54 2uws s VAL 205 N 0.52 2.54 0.04 0.89 1.01 0.13 -0.12 120.40 125.41 2uws s VAL 205 Ca 0.03 -2.27 -0.17 0.00 0.00 0.00 0.00 61.98 59.58 2uws s VAL 205 Cb -0.13 -2.83 -0.25 0.00 0.00 0.00 0.00 36.38 33.17 2uws s VAL 205 CO 0.01 -0.62 1.13 -1.13 0.00 0.00 0.00 175.10 174.50 2uws h ASN 206 N 7.73 0.76 -1.01 3.32 -1.24 -1.82 -2.58 115.58 120.73 2uws h ASN 206 Ca -0.06 -0.77 0.28 0.00 0.71 0.00 0.00 56.30 56.46 2uws h ASN 206 Cb 1.03 -0.23 -0.13 0.00 0.73 0.00 0.00 38.32 39.71 2uws h ASN 206 CO 0.57 1.43 0.60 0.00 -1.29 0.00 0.00 177.43 178.73 2uws h ALA 207 N 0.34 1.90 -4.53 1.57 0.00 -1.87 -3.39 119.26 113.28 2uws h ALA 207 Ca -0.12 0.14 -0.66 0.00 0.00 0.00 0.00 54.91 54.28 2uws h ALA 207 Cb 1.59 0.07 -0.30 0.00 0.00 0.00 0.00 17.79 19.16 2uws h ALA 207 CO 0.18 -0.43 -0.88 -0.51 0.00 0.00 0.00 179.25 177.61 2uws s LEU 208 N -10.31 2.05 0.82 0.00 1.43 -1.25 -3.35 118.68 108.07 2uws s LEU 208 Ca -0.10 -0.43 -0.11 0.00 -1.03 0.00 0.00 54.13 52.45 2uws s LEU 208 Cb 0.28 -1.22 0.08 0.00 0.03 0.00 0.00 46.19 45.36 2uws s LEU 208 CO 0.79 0.29 1.09 -0.94 0.23 0.00 0.00 176.35 177.82 2uws s SER 209 N -0.57 4.24 0.06 2.29 1.04 -1.26 -0.63 113.70 118.87 2uws s SER 209 Ca 0.09 1.38 -0.23 0.00 0.48 0.00 0.00 55.95 57.67 2uws s SER 209 Cb -0.09 -2.10 -0.15 0.00 0.10 0.00 0.00 66.02 63.78 2uws s SER 209 CO -0.01 -2.14 1.61 0.77 0.98 0.00 0.00 173.24 174.45 2uws h SER 210 N -1.20 0.04 0.00 7.02 4.64 -1.85 -1.98 113.55 120.21 2uws h SER 210 Ca -0.47 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 60.70 2uws h SER 210 Cb 1.27 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2uws h SER 210 CO 0.58 0.17 0.14 -0.90 -0.87 0.00 0.00 176.83 175.95 2uws n ASP 211 N -4.99 0.17 -0.67 4.97 5.75 -1.26 -1.85 116.55 118.66 2uws n ASP 211 Ca -0.07 0.48 0.13 0.00 -0.01 0.00 0.00 54.79 55.32 2uws n ASP 211 Cb 0.10 -0.48 0.36 0.00 -1.03 0.00 0.00 41.12 40.06 2uws n ASP 211 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2uws n LEU 212 N -1.68 2.09 -0.00 -2.12 4.77 -0.75 -4.35 117.00 114.97 2uws n LEU 212 Ca -0.00 -0.73 -0.18 0.00 -0.03 0.00 0.00 56.01 55.06 2uws n LEU 212 Cb 0.15 -0.02 -0.09 0.00 -2.33 0.00 0.00 43.42 41.13 2uws n LEU 212 CO 0.03 0.36 0.21 -0.26 -1.33 0.00 0.00 177.39 176.41 2uws h PHE 213 N 3.19 1.01 -0.68 -1.77 -1.00 -1.49 -3.08 116.94 113.12 2uws h PHE 213 Ca 0.00 -0.49 0.07 0.00 2.81 0.00 0.00 57.97 60.37 2uws h PHE 213 Cb 0.68 -0.14 -0.04 0.00 3.61 0.00 0.00 35.95 40.06 2uws h PHE 213 CO 0.02 1.32 0.45 0.00 -1.61 0.00 0.00 178.31 178.49 2uws h ALA 214 N 0.48 1.78 0.00 2.45 0.00 -1.80 -1.84 119.26 120.33 2uws h ALA 214 Ca -0.08 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2uws h ALA 214 Cb 1.47 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 2uws h ALA 214 CO 0.17 0.10 -0.00 0.78 0.00 0.00 0.00 179.25 180.30 2uws h GLY 215 N 0.66 0.00 -5.39 0.00 0.00 -1.80 -3.45 103.07 93.09 2uws h GLY 215 Ca 0.30 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.98 2uws h GLY 215 CO -0.10 0.00 0.66 1.39 0.00 0.00 0.00 176.54 178.50 2uws n ILE 216 N -3.10 0.07 -1.47 2.60 5.41 -0.70 -4.86 119.36 117.32 2uws n ILE 216 Ca -0.00 -0.01 -0.58 0.00 1.00 0.00 0.00 62.75 63.16 2uws n ILE 216 Cb 0.24 -1.18 -0.08 0.00 -0.71 0.00 0.00 39.64 37.90 2uws n ILE 216 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2uws n PRO 217 N 3.40 0.00 -1.83 0.38 -0.02 -1.26 -4.99 135.00 130.67 2uws n PRO 217 Ca 0.19 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.37 2uws n PRO 217 Cb 0.23 -1.35 0.18 0.00 -0.02 0.00 0.00 33.50 32.54 2uws n PRO 217 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2uws s THR 218 N 1.48 1.96 0.21 3.45 -4.23 -1.26 -4.79 115.64 112.47 2uws s THR 218 Ca 0.89 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 61.49 2uws s THR 218 Cb -1.26 -2.94 -0.05 0.00 1.34 0.00 0.00 72.50 69.60 2uws s THR 218 CO 0.64 0.00 -0.18 0.27 -0.54 0.00 0.00 174.62 174.81 2uws s ILE 219 N -3.75 2.01 -0.18 2.99 -4.36 -1.26 -5.01 121.20 111.64 2uws s ILE 219 Ca 0.72 -2.16 -0.23 0.00 -0.26 0.00 0.00 60.65 58.72 2uws s ILE 219 Cb -0.06 -2.06 -0.22 0.00 1.25 0.00 0.00 42.46 41.38 2uws s ILE 219 CO 0.53 -0.42 0.41 0.07 0.24 0.00 0.00 174.94 175.77 2uws h LYS 220 N 2.74 0.03 -5.37 0.37 2.10 -2.00 -3.43 116.57 111.01 2uws h LYS 220 Ca -0.40 -0.05 -0.61 0.00 -2.00 0.00 0.00 60.65 57.58 2uws h LYS 220 Cb 1.23 0.02 -0.11 0.00 -0.90 0.00 0.00 32.23 32.47 2uws h LYS 220 CO 0.57 1.03 -0.47 -1.12 -2.00 0.00 0.00 179.45 177.45 2uws s SER 221 N -6.70 6.27 0.00 7.07 0.01 -1.26 -5.01 113.70 114.08 2uws s SER 221 Ca -0.25 0.31 0.25 0.00 1.31 0.00 0.00 55.95 57.57 2uws s SER 221 Cb 0.03 -2.09 1.47 0.00 0.21 0.00 0.00 66.02 65.64 2uws s SER 221 CO 0.64 0.23 1.83 -2.65 0.41 0.00 0.00 173.24 173.70 2uws n PRO 222 N 3.17 0.78 -0.17 12.44 -0.02 -1.26 -2.89 135.00 147.04 2uws n PRO 222 Ca -0.17 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.41 2uws n PRO 222 Cb 0.53 -1.49 0.17 0.00 -0.02 0.00 0.00 33.50 32.68 2uws n PRO 222 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2uws n THR 223 N -0.99 1.98 -3.81 3.45 -2.24 -1.26 -4.95 114.28 106.45 2uws n THR 223 Ca 0.18 -2.14 -0.10 0.00 -2.27 0.00 0.00 64.05 59.73 2uws n THR 223 Cb 0.08 -0.23 -0.05 0.00 -2.10 0.00 0.00 70.33 68.03 2uws n THR 223 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2uws s GLU 224 N -2.83 1.22 0.00 -0.78 -1.05 -1.14 -4.59 118.70 109.54 2uws s GLU 224 Ca 0.34 -0.96 0.02 0.00 -0.15 0.00 0.00 54.97 54.22 2uws s GLU 224 Cb 0.29 0.45 -0.01 0.00 -0.44 0.00 0.00 34.13 34.42 2uws s GLU 224 CO 0.05 -0.48 -0.06 0.54 0.95 0.00 0.00 175.26 176.26 2uws s VAL 225 N -3.90 0.43 0.12 1.83 0.11 -1.26 -4.61 120.40 113.12 2uws s VAL 225 Ca 0.11 -0.37 -0.01 0.00 -2.93 0.00 0.00 61.98 58.78 2uws s VAL 225 Cb 0.01 -0.39 -0.04 0.00 -1.53 0.00 0.00 36.38 34.43 2uws s VAL 225 CO -0.04 0.03 0.30 0.42 -3.33 0.00 0.00 175.10 172.48 2uws s THR 226 N -0.34 5.28 0.27 5.04 -4.23 -1.26 -3.84 115.64 116.56 2uws s THR 226 Ca -0.00 -0.29 -0.06 0.00 -1.18 0.00 0.00 61.69 60.16 2uws s THR 226 Cb -0.03 -3.66 0.36 0.00 1.34 0.00 0.00 72.50 70.51 2uws s THR 226 CO -0.00 0.03 1.59 -0.07 -0.54 0.00 0.00 174.62 175.64 2uws h LEU 227 N 2.72 -0.60 -0.43 4.79 3.38 -0.20 0.53 115.31 125.50 2uws h LEU 227 Ca -0.46 0.25 0.07 0.00 0.09 0.00 0.00 57.88 57.83 2uws h LEU 227 Cb 1.17 0.47 -0.06 0.00 0.09 0.00 0.00 40.66 42.33 2uws h LEU 227 CO 0.73 -0.27 0.05 0.25 0.09 0.00 0.00 178.44 179.28 2uws h LEU 228 N 0.03 -0.08 -0.43 1.67 5.85 -1.33 -1.68 115.31 119.35 2uws h LEU 228 Ca 0.46 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 59.23 2uws h LEU 228 Cb 0.80 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 2uws h LEU 228 CO -0.84 -0.01 0.13 -0.33 -0.34 0.00 0.00 178.44 177.06 2uws h GLU 229 N 0.16 0.67 -0.11 1.25 5.08 -0.46 -2.31 114.58 118.87 2uws h GLU 229 Ca 0.21 -0.14 0.04 0.00 -1.00 0.00 0.00 59.36 58.47 2uws h GLU 229 Cb 0.28 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.37 2uws h GLU 229 CO -0.31 0.66 -0.34 0.93 -1.00 0.00 0.00 179.01 178.95 2uws h GLU 230 N 0.56 -0.41 -0.98 2.33 5.08 -0.39 -0.88 114.58 119.90 2uws h GLU 230 Ca 0.14 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.63 2uws h GLU 230 Cb 0.26 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.53 2uws h GLU 230 CO -0.00 -0.27 0.62 -0.44 -1.00 0.00 0.00 179.01 177.92 2uws h ASP 231 N -0.42 0.92 0.03 1.42 5.19 -1.20 0.15 116.42 122.50 2uws h ASP 231 Ca 0.09 0.03 -0.14 0.00 -0.62 0.00 0.00 57.03 56.39 2uws h ASP 231 Cb 0.56 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.91 2uws h ASP 231 CO -0.35 0.52 -0.46 0.11 -3.12 0.00 0.00 179.24 175.94 2uws h LYS 232 N 1.00 0.51 -0.01 3.56 1.57 -0.85 -0.10 116.57 122.24 2uws h LYS 232 Ca 0.46 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 2uws h LYS 232 Cb 0.41 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2uws h LYS 232 CO -0.22 0.86 -0.03 0.82 -0.57 0.00 0.00 179.45 180.31 2uws h ILE 233 N 0.41 1.46 0.01 1.86 2.04 -0.11 -1.19 117.51 121.99 2uws h ILE 233 Ca 0.03 -1.41 -0.00 0.00 1.00 0.00 0.00 64.86 64.47 2uws h ILE 233 Cb 0.96 2.38 0.00 0.00 -0.74 0.00 0.00 36.82 39.42 2uws h ILE 233 CO 0.09 0.37 -0.00 0.00 0.00 0.00 0.00 178.15 178.60 2uws h GLY 235 N -0.10 -0.50 0.66 0.00 0.00 -1.07 -0.93 103.07 101.13 2uws h GLY 235 Ca -0.00 0.45 0.06 0.00 0.00 0.00 0.00 47.33 47.84 2uws h GLY 235 CO 0.00 -0.22 0.30 -1.82 0.00 0.00 0.00 176.54 174.81 2uws h TYR 236 N -0.39 0.55 0.02 5.60 3.20 -1.00 -1.01 116.97 123.93 2uws h TYR 236 Ca 0.11 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.00 2uws h TYR 236 Cb 0.57 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.68 2uws h TYR 236 CO -0.48 0.25 -0.01 0.28 -1.64 0.00 0.00 178.16 176.57 2uws h VAL 237 N 0.57 1.34 -0.81 1.81 2.07 -0.78 -2.91 116.25 117.53 2uws h VAL 237 Ca 0.27 -1.08 0.16 0.00 0.82 0.00 0.00 66.70 66.86 2uws h VAL 237 Cb 0.19 2.06 -0.10 0.00 -1.52 0.00 0.00 31.29 31.92 2uws h VAL 237 CO -0.19 0.28 0.35 0.00 0.02 0.00 0.00 177.57 178.03 2uws h ALA 238 N 0.48 1.19 0.00 1.67 0.00 -1.05 -1.45 119.26 120.10 2uws h ALA 238 Ca -0.00 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2uws h ALA 238 Cb 0.47 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2uws h ALA 238 CO 0.00 -0.21 -0.01 0.78 0.00 0.00 0.00 179.25 179.82 2uws h GLY 239 N 0.48 0.00 1.18 0.00 0.00 -0.48 -0.93 103.07 103.31 2uws h GLY 239 Ca 0.46 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.81 2uws h GLY 239 CO -0.42 0.00 0.50 -1.33 0.00 0.00 0.00 176.54 175.29 2uws h GLY 240 N 0.14 1.07 0.67 4.60 0.00 -1.07 0.20 103.07 108.68 2uws h GLY 240 Ca -0.00 -0.38 0.03 0.00 0.00 0.00 0.00 47.33 46.98 2uws h GLY 240 CO 0.00 0.35 -0.05 1.41 0.00 0.00 0.00 176.54 178.25 2uws h LEU 241 N 0.97 -0.18 -0.14 3.11 3.38 -1.16 0.98 115.31 122.27 2uws h LEU 241 Ca 0.29 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.26 2uws h LEU 241 Cb -0.02 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2uws h LEU 241 CO -0.08 -0.07 -0.12 -0.03 0.09 0.00 0.00 178.44 178.23 2uws h MET 242 N -0.03 0.33 0.00 1.13 4.05 -1.65 -3.32 114.93 115.44 2uws h MET 242 Ca 0.07 -0.17 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2uws h MET 242 Cb 0.14 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.94 2uws h MET 242 CO -0.16 0.70 -0.61 0.66 0.23 0.00 0.00 176.91 177.72 2uws n TYR 243 N -4.59 0.43 1.06 1.39 4.01 0.67 -3.43 117.16 116.69 2uws n TYR 243 Ca -0.06 0.12 0.12 0.00 -0.16 0.00 0.00 57.90 57.92 2uws n TYR 243 Cb 0.34 -0.57 0.14 0.00 -0.31 0.00 0.00 39.34 38.95 2uws n TYR 243 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2uws n ALA 244 N -1.76 3.76 -0.34 -0.72 0.00 0.33 -4.64 120.51 117.14 2uws n ALA 244 Ca 0.04 -0.47 0.18 0.00 0.00 0.00 0.00 53.44 53.19 2uws n ALA 244 Cb 0.42 -0.98 0.40 0.00 0.00 0.00 0.00 19.45 19.28 2uws n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uws h ALA 245 N 3.29 1.80 -0.98 0.00 0.00 -1.65 0.17 119.26 121.89 2uws h ALA 245 Ca 0.00 0.14 0.19 0.00 0.00 0.00 0.00 54.91 55.23 2uws h ALA 245 Cb 0.54 0.04 -0.18 0.00 0.00 0.00 0.00 17.79 18.19 2uws h ALA 245 CO 0.00 -0.31 -0.28 -1.35 0.00 0.00 0.00 179.25 177.31 2uws h PRO 246 N 0.54 -0.00 -0.86 0.00 0.11 -1.86 -2.61 132.00 127.32 2uws h PRO 246 Ca 0.66 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.75 2uws h PRO 246 Cb 1.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 2uws h PRO 246 CO -0.50 -0.00 0.02 1.63 -0.21 0.00 0.00 178.00 178.94 2uws n LYS 247 N -5.58 2.35 -3.90 1.05 5.02 0.59 -4.88 118.16 112.81 2uws n LYS 247 Ca 0.14 -1.14 -0.11 0.00 -2.02 0.00 0.00 58.31 55.19 2uws n LYS 247 Cb 0.47 -1.76 -0.10 0.00 -0.02 0.00 0.00 35.03 33.62 2uws n LYS 247 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2uws s ARG 248 N -1.61 0.43 0.00 1.97 3.52 -0.98 -3.83 118.95 118.45 2uws s ARG 248 Ca 0.20 -0.42 0.00 0.00 -0.13 0.00 0.00 55.73 55.38 2uws s ARG 248 Cb 0.15 0.17 0.00 0.00 -1.56 0.00 0.00 34.95 33.71 2uws s ARG 248 CO 0.06 -0.09 0.00 1.63 -0.81 0.00 0.00 175.30 176.08 2uws n LYS 249 N 1.56 0.00 0.00 5.12 5.02 -1.26 -4.91 118.16 123.69 2uws n LYS 249 Ca -0.23 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.06 2uws n LYS 249 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.57 2uws n LYS 249 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2uws n SER 250 N 0.00 0.57 0.00 4.39 3.41 -1.26 -4.80 113.62 115.93 2uws n SER 250 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2uws n SER 250 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2uws n SER 250 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40