#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2uwv h LEU 12 N 0.00 0.36 -0.47 -2.12 7.12 -2.05 -1.77 115.31 116.38 2uwv h LEU 12 Ca 0.00 -0.03 -0.14 0.00 0.13 0.00 0.00 57.88 57.84 2uwv h LEU 12 Cb 0.00 -0.09 -0.01 0.00 -0.53 0.00 0.00 40.66 40.03 2uwv h LEU 12 CO 0.00 0.33 -0.25 0.00 -0.13 0.00 0.00 178.44 178.38 2uwv h ALA 13 N 1.73 0.66 -0.69 1.25 0.00 -2.05 0.27 119.26 120.43 2uwv h ALA 13 Ca 0.10 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 2uwv h ALA 13 Cb 0.08 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2uwv h ALA 13 CO -0.01 0.68 0.41 0.77 0.00 0.00 0.00 179.25 181.10 2uwv h SER 14 N 0.85 0.82 -0.37 0.00 0.02 -1.85 -0.81 113.55 112.21 2uwv h SER 14 Ca 0.10 -0.06 -0.04 0.00 -0.84 0.00 0.00 61.79 60.95 2uwv h SER 14 Cb 0.84 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.16 2uwv h SER 14 CO 0.07 0.64 0.09 0.25 -1.14 0.00 0.00 176.83 176.74 2uwv h LEU 15 N 0.93 0.56 -0.66 5.07 5.85 -1.18 -2.25 115.31 123.63 2uwv h LEU 15 Ca 0.25 -0.23 -0.07 0.00 0.84 0.00 0.00 57.88 58.67 2uwv h LEU 15 Cb -0.03 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 2uwv h LEU 15 CO -0.05 0.65 0.15 0.00 -0.34 0.00 0.00 178.44 178.85 2uwv h ALA 16 N 0.93 0.87 -0.31 1.25 0.00 -0.66 -0.89 119.26 120.45 2uwv h ALA 16 Ca 0.12 -0.24 -0.18 0.00 0.00 0.00 0.00 54.91 54.60 2uwv h ALA 16 Cb 0.31 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2uwv h ALA 16 CO 0.00 0.59 -0.52 0.97 0.00 0.00 0.00 179.25 180.29 2uwv h ILE 17 N 0.98 1.27 -0.20 0.00 6.09 -1.05 -0.34 117.51 124.26 2uwv h ILE 17 Ca 0.21 -1.70 -0.02 0.00 -1.37 0.00 0.00 64.86 61.98 2uwv h ILE 17 Cb 0.38 1.58 -0.01 0.00 0.47 0.00 0.00 36.82 39.24 2uwv h ILE 17 CO 0.00 0.56 0.06 0.22 -3.07 0.00 0.00 178.15 175.93 2uwv h TYR 18 N 0.69 0.31 -0.56 2.19 3.20 -1.32 -2.31 116.97 119.17 2uwv h TYR 18 Ca 0.02 -0.03 0.09 0.00 3.14 0.00 0.00 58.73 61.95 2uwv h TYR 18 Cb 1.13 -0.09 -0.07 0.00 1.54 0.00 0.00 36.73 39.24 2uwv h TYR 18 CO 0.07 0.39 0.19 0.77 -1.64 0.00 0.00 178.16 177.94 2uwv h SER 19 N 0.14 0.17 -0.54 -2.11 0.02 -1.08 -2.57 113.55 107.59 2uwv h SER 19 Ca 0.06 0.08 0.01 0.00 -0.84 0.00 0.00 61.79 61.10 2uwv h SER 19 Cb 0.23 0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.80 2uwv h SER 19 CO -0.00 0.11 0.35 0.15 -1.14 0.00 0.00 176.83 176.30 2uwv h PHE 20 N 0.36 0.66 -0.14 3.45 3.57 -0.73 0.22 116.94 124.33 2uwv h PHE 20 Ca 0.28 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.74 2uwv h PHE 20 Cb 0.34 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.85 2uwv h PHE 20 CO -0.18 0.40 -0.17 -1.49 -2.23 0.00 0.00 178.31 174.65 2uwv h TRP 21 N 0.70 0.23 -0.19 0.41 4.06 -1.23 0.42 115.95 120.35 2uwv h TRP 21 Ca 0.20 -0.03 -0.11 0.00 2.06 0.00 0.00 58.89 61.02 2uwv h TRP 21 Cb -0.05 -0.06 -0.00 0.00 -1.00 0.00 0.00 29.16 28.04 2uwv h TRP 21 CO -0.04 0.39 -0.29 0.82 -3.56 0.00 0.00 178.44 175.75 2uwv h ILE 22 N 0.21 1.34 -0.47 1.49 2.04 -0.97 -1.48 117.51 119.66 2uwv h ILE 22 Ca 0.04 -1.50 0.02 0.00 1.00 0.00 0.00 64.86 64.41 2uwv h ILE 22 Cb 0.42 1.84 -0.03 0.00 -0.74 0.00 0.00 36.82 38.32 2uwv h ILE 22 CO 0.03 0.46 0.29 0.15 0.00 0.00 0.00 178.15 179.07 2uwv h PHE 23 N 0.20 0.54 -0.65 1.37 3.57 0.11 -2.18 116.94 119.90 2uwv h PHE 23 Ca 0.02 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 2uwv h PHE 23 Cb 0.87 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.41 2uwv h PHE 23 CO 0.09 0.31 0.12 1.25 -2.23 0.00 0.00 178.31 177.85 2uwv h LEU 24 N 0.57 1.02 -0.48 0.59 5.85 -0.04 0.49 115.31 123.32 2uwv h LEU 24 Ca 0.19 -0.26 0.05 0.00 0.84 0.00 0.00 57.88 58.70 2uwv h LEU 24 Cb 0.00 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.71 2uwv h LEU 24 CO -0.08 1.02 0.21 0.00 -0.34 0.00 0.00 178.44 179.25 2uwv h ALA 25 N 1.04 0.60 -0.78 1.25 0.00 -1.05 -0.77 119.26 119.55 2uwv h ALA 25 Ca 0.20 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.19 2uwv h ALA 25 Cb 0.42 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 2uwv h ALA 25 CO 0.01 -0.16 0.51 0.78 0.00 0.00 0.00 179.25 180.40 2uwv h GLY 26 N 0.42 1.09 1.12 0.00 0.00 -0.89 -1.78 103.07 103.02 2uwv h GLY 26 Ca 0.22 -0.36 -0.22 0.00 0.00 0.00 0.00 47.33 46.97 2uwv h GLY 26 CO -0.18 0.30 -0.77 -2.00 0.00 0.00 0.00 176.54 173.89 2uwv h LEU 27 N 0.92 0.89 -0.88 3.11 5.85 -0.28 -1.43 115.31 123.49 2uwv h LEU 27 Ca 0.32 -0.65 -0.07 0.00 0.84 0.00 0.00 57.88 58.32 2uwv h LEU 27 Cb 0.11 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2uwv h LEU 27 CO -0.10 1.40 0.07 0.40 -0.34 0.00 0.00 178.44 179.87 2uwv h ILE 28 N 0.44 1.25 0.45 4.05 2.04 -1.01 0.12 117.51 124.85 2uwv h ILE 28 Ca -0.06 -0.96 -0.02 0.00 1.00 0.00 0.00 64.86 64.81 2uwv h ILE 28 Cb 1.40 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.22 2uwv h ILE 28 CO 0.16 0.35 -0.22 0.22 0.00 0.00 0.00 178.15 178.66 2uwv h TYR 29 N 0.86 -0.56 -0.62 1.37 3.20 -1.26 0.58 116.97 120.54 2uwv h TYR 29 Ca 0.17 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.15 2uwv h TYR 29 Cb 0.40 0.18 -0.09 0.00 1.54 0.00 0.00 36.73 38.76 2uwv h TYR 29 CO 0.02 -0.34 0.10 -0.92 -1.64 0.00 0.00 178.16 175.39 2uwv h TYR 30 N -0.62 0.14 -0.13 -3.82 3.20 -0.94 -1.52 116.97 113.29 2uwv h TYR 30 Ca -0.06 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 2uwv h TYR 30 Cb 0.47 0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.77 2uwv h TYR 30 CO -0.04 -0.07 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.29 2uwv h LEU 31 N 0.22 0.26 -0.53 2.82 3.38 -0.55 -0.17 115.31 120.74 2uwv h LEU 31 Ca 0.33 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2uwv h LEU 31 Cb 0.51 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 2uwv h LEU 31 CO -0.45 0.59 0.31 -0.61 0.09 0.00 0.00 178.44 178.38 2uwv h GLN 32 N -0.08 0.73 -0.46 1.13 5.75 -0.73 -1.80 115.11 119.64 2uwv h GLN 32 Ca 0.03 -0.07 -0.10 0.00 -0.15 0.00 0.00 58.65 58.36 2uwv h GLN 32 Cb 0.49 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.87 2uwv h GLN 32 CO 0.02 0.54 -0.10 1.79 -2.65 0.00 0.00 178.83 178.43 2uwv h THR 33 N 0.71 1.26 -0.88 2.39 1.35 -1.18 -1.66 112.91 114.91 2uwv h THR 33 Ca 0.19 -1.18 0.10 0.00 -0.55 0.00 0.00 66.41 64.97 2uwv h THR 33 Cb 0.01 1.01 -0.06 0.00 -1.73 0.00 0.00 68.15 67.37 2uwv h THR 33 CO -0.03 0.41 0.57 -0.33 -0.25 0.00 0.00 175.52 175.88 2uwv h GLU 34 N 0.76 0.81 -0.24 4.72 4.39 -0.84 -0.72 114.58 123.46 2uwv h GLU 34 Ca 0.13 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.78 2uwv h GLU 34 Cb 0.60 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 2uwv h GLU 34 CO 0.04 0.54 0.00 0.09 -1.16 0.00 0.00 179.01 178.52 2uwv n ASN 35 N -4.53 0.84 -1.02 1.42 3.02 -0.65 -2.83 115.26 111.51 2uwv n ASN 35 Ca 0.15 -2.02 0.08 0.00 -0.03 0.00 0.00 54.58 52.76 2uwv n ASN 35 Cb 0.33 -0.15 0.25 0.00 -0.61 0.00 0.00 39.78 39.60 2uwv n ASN 35 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2uwv n MET 36 N -0.09 3.12 0.06 3.52 2.81 -0.28 -4.58 117.12 121.69 2uwv n MET 36 Ca 0.04 -2.52 0.10 0.00 -1.81 0.00 0.00 57.70 53.51 2uwv n MET 36 Cb 0.15 -1.60 0.40 0.00 -0.71 0.00 0.00 33.22 31.46 2uwv n MET 36 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2uwv n ARG 37 N 0.53 0.09 -4.14 0.03 1.74 -1.13 -4.44 116.66 109.34 2uwv n ARG 37 Ca 0.19 0.30 -0.16 0.00 -0.77 0.00 0.00 57.85 57.41 2uwv n ARG 37 Cb 0.68 -1.66 -0.12 0.00 -1.02 0.00 0.00 32.46 30.34 2uwv n ARG 37 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2uwv s GLU 38 N -3.13 0.68 0.00 5.56 0.41 -1.26 -4.04 118.70 116.92 2uwv s GLU 38 Ca 0.06 -0.81 0.00 0.00 -0.41 0.00 0.00 54.97 53.81 2uwv s GLU 38 Cb 0.10 -0.58 0.00 0.00 -1.78 0.00 0.00 34.13 31.87 2uwv s GLU 38 CO 0.35 0.13 0.00 0.41 -0.49 0.00 0.00 175.26 175.65 2uwv n GLY 39 N 1.50 2.27 3.55 -1.39 0.00 -1.26 -5.02 105.19 104.84 2uwv n GLY 39 Ca -0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 2uwv n GLY 39 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2uwv s TYR 40 N -2.99 2.64 0.66 1.61 1.51 -1.26 -4.33 117.35 115.18 2uwv s TYR 40 Ca 0.00 -0.21 -0.16 0.00 -1.01 0.00 0.00 57.07 55.69 2uwv s TYR 40 Cb 0.00 -1.36 -0.00 0.00 -0.11 0.00 0.00 41.96 40.49 2uwv s TYR 40 CO 0.00 0.44 1.16 -2.14 -1.11 0.00 0.00 175.55 173.90 2uwv s PRO 41 N -2.38 2.69 0.68 -1.71 0.02 -1.26 -4.86 135.00 128.19 2uwv s PRO 41 Ca 0.21 1.61 -0.17 0.00 0.02 0.00 0.00 61.00 62.67 2uwv s PRO 41 Cb -0.10 -1.92 0.01 0.00 0.02 0.00 0.00 34.50 32.51 2uwv s PRO 41 CO 0.13 -1.38 1.24 -0.51 -0.33 0.00 0.00 177.00 176.15 2uwv s LEU 42 N -4.69 3.46 0.14 -5.54 1.43 -1.26 -4.91 118.68 107.30 2uwv s LEU 42 Ca 0.72 2.46 0.07 0.00 -1.03 0.00 0.00 54.13 56.35 2uwv s LEU 42 Cb -0.25 -4.60 -0.04 0.00 0.03 0.00 0.00 46.19 41.33 2uwv s LEU 42 CO 0.39 -2.08 -0.17 -1.61 0.23 0.00 0.00 176.35 173.11 2uwv s GLU 43 N -3.63 1.14 0.83 1.70 2.02 -1.26 -1.26 118.70 118.23 2uwv s GLU 43 Ca 0.78 -1.29 -0.12 0.00 0.02 0.00 0.00 54.97 54.36 2uwv s GLU 43 Cb -0.32 -1.16 0.09 0.00 0.10 0.00 0.00 34.13 32.83 2uwv s GLU 43 CO 0.41 0.24 1.14 -0.80 0.02 0.00 0.00 175.26 176.28 2uwv s ASN 44 N -2.43 4.31 0.44 -0.19 0.01 0.31 -4.62 114.94 112.77 2uwv s ASN 44 Ca 0.11 0.96 0.26 0.00 -0.71 0.00 0.00 52.86 53.48 2uwv s ASN 44 Cb -0.06 -1.55 1.43 0.00 0.41 0.00 0.00 41.25 41.47 2uwv s ASN 44 CO 0.05 -2.05 1.79 -0.33 -1.51 0.00 0.00 177.10 175.04 2uwv h GLU 45 N -1.15 0.00 -0.03 -0.60 5.08 -2.01 -0.44 114.58 115.42 2uwv h GLU 45 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2uwv h GLU 45 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 2uwv h GLU 45 CO 0.63 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.24 2uwv n ASP 46 N -2.48 2.14 0.00 1.42 5.68 -1.26 -4.97 116.55 117.08 2uwv n ASP 46 Ca -0.02 -1.71 0.00 0.00 -0.50 0.00 0.00 54.79 52.56 2uwv n ASP 46 Cb 0.14 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.11 2uwv n ASP 46 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2uwv n GLY 47 N 1.25 0.70 3.89 6.12 0.00 -0.17 -5.07 105.19 111.90 2uwv n GLY 47 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2uwv n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2uwv s THR 48 N -2.33 4.82 0.24 2.61 -4.23 -1.26 -4.78 115.64 110.72 2uwv s THR 48 Ca 0.00 0.49 -0.31 0.00 -1.18 0.00 0.00 61.69 60.69 2uwv s THR 48 Cb 0.00 -3.84 -0.12 0.00 1.34 0.00 0.00 72.50 69.89 2uwv s THR 48 CO 0.00 -0.86 1.66 -2.84 -0.54 0.00 0.00 174.62 172.04 2uwv s PRO 49 N -4.67 4.13 0.55 3.99 0.02 -1.26 -0.53 135.00 137.22 2uwv s PRO 49 Ca 0.50 2.59 -0.18 0.00 0.02 0.00 0.00 61.00 63.93 2uwv s PRO 49 Cb -0.10 -3.05 -0.06 0.00 0.02 0.00 0.00 34.50 31.31 2uwv s PRO 49 CO 0.44 -0.70 1.07 0.00 -0.33 0.00 0.00 177.00 177.49 2uwv s ALA 50 N 0.67 2.75 0.13 -1.55 0.00 -0.39 -4.64 121.76 118.72 2uwv s ALA 50 Ca 0.70 0.60 -0.16 0.00 0.00 0.00 0.00 51.96 53.10 2uwv s ALA 50 Cb -0.49 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 19.34 2uwv s ALA 50 CO 0.39 -0.67 1.64 0.00 0.00 0.00 0.00 175.76 177.12 2uwv h ALA 51 N 0.99 0.51 -2.41 0.00 0.00 -1.93 -3.41 119.26 113.02 2uwv h ALA 51 Ca -0.49 -0.17 -0.72 0.00 0.00 0.00 0.00 54.91 53.53 2uwv h ALA 51 Cb 1.23 -0.15 -0.21 0.00 0.00 0.00 0.00 17.79 18.67 2uwv h ALA 51 CO 0.57 0.17 -0.34 1.21 0.00 0.00 0.00 179.25 180.86 2uwv s ASN 52 N -5.94 6.14 0.00 0.00 2.47 -1.26 -4.91 114.94 111.44 2uwv s ASN 52 Ca -0.13 -0.95 0.26 0.00 0.42 0.00 0.00 52.86 52.46 2uwv s ASN 52 Cb 0.10 -2.19 0.58 0.00 -1.45 0.00 0.00 41.25 38.30 2uwv s ASN 52 CO 0.76 -0.54 1.47 0.00 -3.72 0.00 0.00 177.10 175.06 2uwv n GLN 53 N 5.31 1.45 0.00 0.43 1.13 -1.26 -4.93 117.38 119.51 2uwv n GLN 53 Ca -0.10 -1.02 0.00 0.00 -1.94 0.00 0.00 57.00 53.94 2uwv n GLN 53 Cb 0.46 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.33 2uwv n GLN 53 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2uwv n GLY 54 N 1.31 -1.46 0.01 1.08 0.00 -1.26 -4.65 105.19 100.22 2uwv n GLY 54 Ca 0.14 -1.54 0.14 0.00 0.00 0.00 0.00 46.02 44.76 2uwv n GLY 54 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2uwv n PRO 55 N -1.47 0.03 -3.50 1.61 -0.04 -1.26 -4.77 135.00 125.61 2uwv n PRO 55 Ca 0.00 0.02 -0.37 0.00 -0.04 0.00 0.00 63.50 63.11 2uwv n PRO 55 Cb 0.00 -1.53 -0.08 0.00 -0.04 0.00 0.00 33.50 31.85 2uwv n PRO 55 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2uwv s PHE 56 N -3.01 3.41 0.55 0.54 0.08 -1.26 -5.09 117.98 113.19 2uwv s PHE 56 Ca 0.13 0.55 -0.07 0.00 0.12 0.00 0.00 56.93 57.65 2uwv s PHE 56 Cb 0.18 -2.40 -0.03 0.00 -0.57 0.00 0.00 43.02 40.20 2uwv s PHE 56 CO 0.56 0.12 0.89 -1.25 -0.10 0.00 0.00 175.22 175.44 2uwv s PRO 57 N 0.88 3.43 0.43 0.24 0.04 -1.26 -5.05 135.00 133.71 2uwv s PRO 57 Ca 0.16 0.33 -0.25 0.00 0.04 0.00 0.00 61.00 61.28 2uwv s PRO 57 Cb -0.14 -2.26 -0.08 0.00 0.04 0.00 0.00 34.50 32.06 2uwv s PRO 57 CO 0.05 -0.42 1.37 -0.51 0.04 0.00 0.00 177.00 177.53 2uwv s LEU 58 N -4.93 4.15 0.71 -3.56 1.43 -1.26 -4.84 118.68 110.38 2uwv s LEU 58 Ca 0.51 2.79 -0.11 0.00 -1.03 0.00 0.00 54.13 56.29 2uwv s LEU 58 Cb -0.11 -3.93 0.02 0.00 0.03 0.00 0.00 46.19 42.20 2uwv s LEU 58 CO 0.48 -1.04 1.07 -2.16 0.23 0.00 0.00 176.35 174.93 2uwv s PRO 59 N -2.37 2.75 0.35 1.29 0.04 -1.26 -5.02 135.00 130.77 2uwv s PRO 59 Ca 0.59 1.03 -0.27 0.00 0.04 0.00 0.00 61.00 62.40 2uwv s PRO 59 Cb -0.41 -1.96 -0.12 0.00 0.04 0.00 0.00 34.50 32.04 2uwv s PRO 59 CO 0.52 -1.25 1.07 1.63 0.04 0.00 0.00 177.00 179.02 2uwv n LYS 60 N -3.20 1.53 -1.26 4.56 5.02 -1.26 -4.61 118.16 118.94 2uwv n LYS 60 Ca 0.08 0.54 -0.34 0.00 -2.02 0.00 0.00 58.31 56.57 2uwv n LYS 60 Cb 0.53 -2.02 0.11 0.00 -0.02 0.00 0.00 35.03 33.63 2uwv n LYS 60 CO 0.00 0.00 0.00 -2.14 -0.52 0.00 0.00 177.40 174.74 2uwv s PRO 61 N -1.79 1.83 0.13 1.97 0.02 -1.26 -4.72 135.00 131.19 2uwv s PRO 61 Ca 0.59 1.85 0.04 0.00 0.02 0.00 0.00 61.00 63.50 2uwv s PRO 61 Cb -0.62 -1.79 -0.04 0.00 0.02 0.00 0.00 34.50 32.07 2uwv s PRO 61 CO 0.59 -2.09 -0.10 -1.59 -0.33 0.00 0.00 177.00 173.49 2uwv s LYS 62 N -3.95 1.01 -0.10 5.54 -2.85 -0.39 -4.95 119.74 114.06 2uwv s LYS 62 Ca 0.76 -1.41 0.03 0.00 -1.00 0.00 0.00 55.97 54.34 2uwv s LYS 62 Cb -0.31 -0.55 0.01 0.00 -2.06 0.00 0.00 37.83 34.92 2uwv s LYS 62 CO 0.48 0.06 -0.17 0.99 0.10 0.00 0.00 175.35 176.81 2uwv s THR 63 N -3.31 1.60 -0.15 3.79 2.01 -1.26 -2.03 115.64 116.29 2uwv s THR 63 Ca 0.15 -0.73 -0.16 0.00 0.31 0.00 0.00 61.69 61.25 2uwv s THR 63 Cb 0.03 -1.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.06 2uwv s THR 63 CO -0.00 0.46 0.41 -0.36 -0.69 0.00 0.00 174.62 174.43 2uwv s PHE 64 N 0.69 3.46 -0.32 4.92 0.08 0.65 -4.92 117.98 122.55 2uwv s PHE 64 Ca -0.12 0.74 -0.24 0.00 0.12 0.00 0.00 56.93 57.43 2uwv s PHE 64 Cb -0.16 -2.49 0.00 0.00 -0.57 0.00 0.00 43.02 39.81 2uwv s PHE 64 CO 0.03 0.15 0.83 0.42 -0.10 0.00 0.00 175.22 176.54 2uwv s ILE 65 N 0.74 4.74 0.23 0.64 1.01 -1.26 -1.42 121.20 125.88 2uwv s ILE 65 Ca 0.22 1.20 -0.22 0.00 0.00 0.00 0.00 60.65 61.85 2uwv s ILE 65 Cb -0.14 -4.20 -0.08 0.00 0.01 0.00 0.00 42.46 38.04 2uwv s ILE 65 CO 0.08 -0.32 0.77 -0.76 0.00 0.00 0.00 174.94 174.70 2uwv s LEU 66 N 3.09 4.39 0.75 2.97 1.43 -0.09 -5.01 118.68 126.22 2uwv s LEU 66 Ca 0.34 1.53 -0.11 0.00 -1.03 0.00 0.00 54.13 54.85 2uwv s LEU 66 Cb -0.14 -3.60 0.04 0.00 0.03 0.00 0.00 46.19 42.53 2uwv s LEU 66 CO 0.14 0.05 1.09 -2.16 0.23 0.00 0.00 176.35 175.70 2uwv s PRO 67 N -1.83 2.47 -1.29 1.29 0.04 -1.26 -4.25 135.00 130.17 2uwv s PRO 67 Ca 0.43 0.61 -0.03 0.00 0.04 0.00 0.00 61.00 62.04 2uwv s PRO 67 Cb -0.18 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.40 2uwv s PRO 67 CO 0.22 -1.34 0.43 0.72 0.04 0.00 0.00 177.00 177.07 2uwv n HIS 68 N -3.24 -1.50 -1.25 0.56 8.25 -1.26 -2.77 115.22 114.01 2uwv n HIS 68 Ca 0.07 0.37 -0.09 0.00 -0.26 0.00 0.00 57.72 57.82 2uwv n HIS 68 Cb 0.56 -3.81 -0.04 0.00 1.12 0.00 0.00 29.99 27.83 2uwv n HIS 68 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2uwv n GLY 69 N -1.34 1.01 0.00 -1.41 0.00 -1.26 -4.89 105.19 97.31 2uwv n GLY 69 Ca -0.11 -0.42 0.14 0.00 0.00 0.00 0.00 46.02 45.63 2uwv n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2uwv n ARG 70 N -2.32 0.11 0.00 1.61 5.12 -1.12 -5.02 116.66 115.04 2uwv n ARG 70 Ca -0.09 -0.01 0.00 0.00 -1.93 0.00 0.00 57.85 55.83 2uwv n ARG 70 Cb 0.34 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.14 2uwv n ARG 70 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2uwv n GLY 71 N 1.45 0.43 3.21 -0.13 0.00 -1.26 -4.93 105.19 103.96 2uwv n GLY 71 Ca 0.09 -1.80 -0.13 0.00 0.00 0.00 0.00 46.02 44.18 2uwv n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2uwv s THR 72 N 0.00 0.03 -0.04 2.61 -4.23 -1.26 -0.91 115.64 111.84 2uwv s THR 72 Ca 0.00 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.52 2uwv s THR 72 Cb 0.00 -2.51 0.02 0.00 1.34 0.00 0.00 72.50 71.36 2uwv s THR 72 CO 0.00 0.00 -0.03 -0.22 -0.54 0.00 0.00 174.62 173.83 2uwv s LEU 73 N -3.19 1.33 -0.09 4.79 2.96 -0.51 -4.93 118.68 119.05 2uwv s LEU 73 Ca 0.39 -0.09 0.04 0.00 -0.22 0.00 0.00 54.13 54.25 2uwv s LEU 73 Cb 0.07 -0.37 -0.00 0.00 0.50 0.00 0.00 46.19 46.39 2uwv s LEU 73 CO 0.13 -0.06 -0.23 -0.89 -1.32 0.00 0.00 176.35 173.98 2uwv s THR 74 N 0.87 1.99 -0.06 3.68 2.01 -1.26 -0.25 115.64 122.61 2uwv s THR 74 Ca -0.11 -0.99 -0.08 0.00 0.31 0.00 0.00 61.69 60.82 2uwv s THR 74 Cb -0.14 -1.72 0.02 0.00 0.01 0.00 0.00 72.50 70.67 2uwv s THR 74 CO -0.00 0.55 0.21 0.68 -0.69 0.00 0.00 174.62 175.37 2uwv s VAL 75 N 0.30 0.02 0.68 3.82 -7.23 -0.86 -3.94 120.40 113.19 2uwv s VAL 75 Ca -0.17 -0.18 -0.16 0.00 -1.81 0.00 0.00 61.98 59.67 2uwv s VAL 75 Cb -0.17 -0.37 0.01 0.00 0.56 0.00 0.00 36.38 36.41 2uwv s VAL 75 CO 0.08 -0.10 1.18 -2.16 -0.31 0.00 0.00 175.10 173.79 2uwv s PRO 76 N -0.31 2.49 0.28 4.82 0.05 -1.26 -1.26 135.00 139.82 2uwv s PRO 76 Ca -0.04 1.67 -0.07 0.00 0.05 0.00 0.00 61.00 62.61 2uwv s PRO 76 Cb -0.03 -1.89 -0.01 0.00 0.05 0.00 0.00 34.50 32.63 2uwv s PRO 76 CO 0.01 -1.54 0.43 0.20 0.05 0.00 0.00 177.00 176.15 2uwv s GLY 77 N -2.09 1.02 0.21 0.56 0.00 -1.25 -4.76 107.32 101.00 2uwv s GLY 77 Ca 0.73 -1.23 -0.32 0.00 0.00 0.00 0.00 44.72 43.89 2uwv s GLY 77 CO 0.41 -0.87 1.48 -1.55 0.00 0.00 0.00 173.10 172.58 2uwv n PRO 78 N -0.43 2.10 -4.11 2.90 -0.04 -1.26 -4.94 135.00 129.21 2uwv n PRO 78 Ca -0.00 0.75 -0.34 0.00 -0.04 0.00 0.00 63.50 63.86 2uwv n PRO 78 Cb 0.62 -2.46 -0.10 0.00 -0.04 0.00 0.00 33.50 31.52 2uwv n PRO 78 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2uwv s GLU 79 N 0.13 3.80 0.01 0.54 0.41 -1.26 -5.09 118.70 117.24 2uwv s GLU 79 Ca 0.72 -0.37 -0.13 0.00 -0.41 0.00 0.00 54.97 54.78 2uwv s GLU 79 Cb -0.66 -3.11 0.02 0.00 -1.78 0.00 0.00 34.13 28.60 2uwv s GLU 79 CO 0.45 0.34 0.28 -1.54 -0.49 0.00 0.00 175.26 174.29 2uwv s SER 80 N 0.17 -0.12 0.32 -0.19 1.04 -1.26 -5.05 113.70 108.62 2uwv s SER 80 Ca 0.03 -0.10 0.02 0.00 0.48 0.00 0.00 55.95 56.38 2uwv s SER 80 Cb -0.13 0.31 0.53 0.00 0.10 0.00 0.00 66.02 66.83 2uwv s SER 80 CO 0.01 -0.51 1.88 -0.33 0.98 0.00 0.00 173.24 175.27 2uwv h GLU 81 N 3.63 0.71 -2.32 4.02 4.39 -2.02 -3.47 114.58 119.52 2uwv h GLU 81 Ca -0.31 -0.12 -0.35 0.00 0.34 0.00 0.00 59.36 58.92 2uwv h GLU 81 Cb 1.19 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.69 2uwv h GLU 81 CO 0.43 0.63 -0.43 -0.25 -1.16 0.00 0.00 179.01 178.23 2uwv n ASP 82 N -4.31 -5.09 -3.51 1.42 8.00 -1.26 -4.44 116.55 107.37 2uwv n ASP 82 Ca 0.03 0.02 -0.12 0.00 0.71 0.00 0.00 54.79 55.43 2uwv n ASP 82 Cb 0.20 -4.17 -0.04 0.00 -0.02 0.00 0.00 41.12 37.09 2uwv n ASP 82 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2uwv s ARG 83 N -4.74 0.93 0.30 -1.24 1.70 -1.26 -4.93 118.95 109.71 2uwv s ARG 83 Ca 0.00 -0.07 -0.29 0.00 -0.47 0.00 0.00 55.73 54.90 2uwv s ARG 83 Cb 0.00 0.43 -0.10 0.00 -0.57 0.00 0.00 34.95 34.71 2uwv s ARG 83 CO 0.00 -0.35 1.17 -1.25 -1.08 0.00 0.00 175.30 173.79 2uwv s PRO 84 N -2.20 4.53 -0.37 3.89 0.04 -1.26 -5.04 135.00 134.59 2uwv s PRO 84 Ca -0.02 1.94 -0.01 0.00 0.04 0.00 0.00 61.00 62.95 2uwv s PRO 84 Cb -0.01 -3.13 0.09 0.00 0.04 0.00 0.00 34.50 31.50 2uwv s PRO 84 CO -0.02 0.06 0.12 0.42 0.04 0.00 0.00 177.00 177.63 2uwv s ILE 85 N -1.16 3.00 -1.41 0.56 -1.09 -1.26 -5.02 121.20 114.81 2uwv s ILE 85 Ca 0.46 -1.97 -0.12 0.00 -2.23 0.00 0.00 60.65 56.79 2uwv s ILE 85 Cb -0.34 -3.01 -0.04 0.00 -1.58 0.00 0.00 42.46 37.49 2uwv s ILE 85 CO 0.45 -0.54 2.48 0.00 -1.23 0.00 0.00 174.94 176.09 2uwv n ALA 86 N 4.53 6.05 -2.43 9.38 0.00 -1.26 -4.86 120.51 131.91 2uwv n ALA 86 Ca -0.03 -3.51 -0.18 0.00 0.00 0.00 0.00 53.44 49.72 2uwv n ALA 86 Cb 0.42 -3.44 -0.11 0.00 0.00 0.00 0.00 19.45 16.32 2uwv n ALA 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2uwv s LEU 87 N 1.12 2.45 0.02 0.00 1.43 -1.26 -1.19 118.68 121.25 2uwv s LEU 87 Ca 0.56 -0.88 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 2uwv s LEU 87 Cb 0.15 -0.54 -0.02 0.00 0.03 0.00 0.00 46.19 45.81 2uwv s LEU 87 CO -0.05 -0.18 -0.05 0.00 0.23 0.00 0.00 176.35 176.30 2uwv s ALA 88 N -2.46 0.30 0.51 4.21 0.00 -0.53 -4.87 121.76 118.92 2uwv s ALA 88 Ca 0.12 -0.54 -0.20 0.00 0.00 0.00 0.00 51.96 51.35 2uwv s ALA 88 Cb -0.03 0.06 -0.10 0.00 0.00 0.00 0.00 23.12 23.06 2uwv s ALA 88 CO 0.03 -0.06 0.61 0.54 0.00 0.00 0.00 175.76 176.88 2uwv n ARG 89 N 1.89 0.65 -0.01 0.00 1.74 -1.26 -1.41 116.66 118.26 2uwv n ARG 89 Ca -0.21 0.24 0.03 0.00 -0.77 0.00 0.00 57.85 57.14 2uwv n ARG 89 Cb 0.56 -1.71 0.03 0.00 -1.02 0.00 0.00 32.46 30.32 2uwv n ARG 89 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2uwv n THR 90 N -1.32 0.10 -4.18 0.55 -2.24 -1.21 -4.73 114.28 101.25 2uwv n THR 90 Ca 0.11 -0.55 -0.12 0.00 -2.27 0.00 0.00 64.05 61.23 2uwv n THR 90 Cb 0.44 1.05 -0.10 0.00 -2.10 0.00 0.00 70.33 69.63 2uwv n THR 90 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2uwv s ALA 91 N -0.51 1.04 -2.35 6.98 0.00 -1.26 -5.05 121.76 120.61 2uwv s ALA 91 Ca 0.07 -1.62 0.25 0.00 0.00 0.00 0.00 51.96 50.66 2uwv s ALA 91 Cb 0.05 1.36 0.50 0.00 0.00 0.00 0.00 23.12 25.03 2uwv s ALA 91 CO 0.07 -0.61 1.42 1.33 0.00 0.00 0.00 175.76 177.96 2uwv n VAL 92 N -0.28 0.00 -4.40 0.00 0.24 -1.26 -4.95 118.33 107.68 2uwv n VAL 92 Ca 0.02 -0.29 -0.20 0.00 -2.04 0.00 0.00 64.34 61.83 2uwv n VAL 92 Cb 0.66 0.92 -0.10 0.00 -1.47 0.00 0.00 33.84 33.84 2uwv n VAL 92 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2uwv s SER 93 N -2.23 2.01 0.53 -1.34 1.04 -1.26 -5.14 113.70 107.31 2uwv s SER 93 Ca 0.28 -1.36 -0.21 0.00 0.48 0.00 0.00 55.95 55.13 2uwv s SER 93 Cb 0.20 -0.01 -0.05 0.00 0.10 0.00 0.00 66.02 66.25 2uwv s SER 93 CO 0.43 -0.63 1.27 -1.61 0.98 0.00 0.00 173.24 173.68 2uwv s GLU 94 N -3.92 3.26 0.00 4.02 0.41 -1.26 -4.28 118.70 116.92 2uwv s GLU 94 Ca 0.36 2.01 0.00 0.00 -0.41 0.00 0.00 54.97 56.94 2uwv s GLU 94 Cb 0.08 -2.22 0.00 0.00 -1.78 0.00 0.00 34.13 30.21 2uwv s GLU 94 CO 0.14 -1.02 0.00 0.41 -0.49 0.00 0.00 175.26 174.30 2uwv n GLY 95 N 0.61 0.90 3.83 -1.39 0.00 -1.26 -5.08 105.19 102.80 2uwv n GLY 95 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 2uwv n GLY 95 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2uwv s PHE 96 N -2.00 2.92 0.79 1.61 0.40 -1.26 -5.11 117.98 115.34 2uwv s PHE 96 Ca 0.00 -0.26 -0.11 0.00 -0.60 0.00 0.00 56.93 55.96 2uwv s PHE 96 Cb 0.00 -1.67 0.07 0.00 0.51 0.00 0.00 43.02 41.93 2uwv s PHE 96 CO 0.00 0.29 1.11 -2.14 0.70 0.00 0.00 175.22 175.19 2uwv s PRO 97 N -3.93 2.04 -0.22 0.24 0.02 -1.26 -4.90 135.00 126.98 2uwv s PRO 97 Ca 0.38 1.31 -0.02 0.00 0.02 0.00 0.00 61.00 62.69 2uwv s PRO 97 Cb -0.06 -1.86 0.01 0.00 0.02 0.00 0.00 34.50 32.61 2uwv s PRO 97 CO 0.26 -1.83 -0.07 -1.01 -0.33 0.00 0.00 177.00 174.01 2uwv s HIS 98 N -2.74 2.97 0.14 6.54 3.76 -1.26 -3.31 115.29 121.39 2uwv s HIS 98 Ca 0.64 -1.27 -0.30 0.00 -0.15 0.00 0.00 55.06 53.97 2uwv s HIS 98 Cb -0.19 -2.06 -0.07 0.00 1.11 0.00 0.00 32.58 31.37 2uwv s HIS 98 CO 0.54 -0.66 1.12 0.00 -0.85 0.00 0.00 174.74 174.90 2uwv s ALA 99 N 1.39 3.37 0.32 -1.40 0.00 -0.50 -4.72 121.76 120.22 2uwv s ALA 99 Ca 0.04 0.81 -0.29 0.00 0.00 0.00 0.00 51.96 52.53 2uwv s ALA 99 Cb -0.15 -3.38 -0.12 0.00 0.00 0.00 0.00 23.12 19.47 2uwv s ALA 99 CO -0.05 -0.28 1.32 -2.30 0.00 0.00 0.00 175.76 174.45 2uwv n PRO 100 N 2.85 2.12 0.05 0.00 -0.02 -1.26 -1.45 135.00 137.29 2uwv n PRO 100 Ca 0.04 0.75 0.12 0.00 -2.02 0.00 0.00 63.50 62.39 2uwv n PRO 100 Cb 0.46 -2.34 0.08 0.00 -0.02 0.00 0.00 33.50 31.68 2uwv n PRO 100 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2uwv n THR 101 N 0.66 0.32 0.00 3.45 -2.24 -0.34 -4.87 114.28 111.26 2uwv n THR 101 Ca 0.06 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 2uwv n THR 101 Cb 0.35 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 2uwv n THR 101 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2uwv n GLY 102 N 1.32 4.37 3.55 3.38 0.00 -1.26 -5.09 105.19 111.46 2uwv n GLY 102 Ca 0.02 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.94 2uwv n GLY 102 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2uwv s ASP 103 N 1.00 6.37 0.47 1.61 -1.08 -1.26 -4.95 116.67 118.84 2uwv s ASP 103 Ca 0.00 -0.08 0.23 0.00 -0.52 0.00 0.00 52.55 52.18 2uwv s ASP 103 Cb 0.00 -2.32 1.17 0.00 -1.46 0.00 0.00 42.92 40.31 2uwv s ASP 103 CO 0.00 -0.68 1.96 1.55 0.52 0.00 0.00 175.17 178.52 2uwv h PRO 104 N 8.66 0.00 0.14 4.34 0.13 -1.94 0.23 132.00 143.57 2uwv h PRO 104 Ca -0.26 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 2uwv h PRO 104 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2uwv h PRO 104 CO 0.86 0.20 -0.07 0.52 -0.23 0.00 0.00 178.00 179.28 2uwv h MET 105 N 0.00 -0.19 -0.48 0.86 2.86 -1.92 0.16 114.93 116.22 2uwv h MET 105 Ca -0.00 0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.60 2uwv h MET 105 Cb 0.49 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.17 2uwv h MET 105 CO 0.03 0.12 0.10 0.87 1.06 0.00 0.00 176.91 179.08 2uwv h LYS 106 N -0.50 0.73 0.00 1.72 1.57 -1.87 -3.12 116.57 115.10 2uwv h LYS 106 Ca -0.02 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2uwv h LYS 106 Cb 0.39 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.59 2uwv h LYS 106 CO 0.03 0.67 -0.35 -0.25 -0.57 0.00 0.00 179.45 178.99 2uwv n ASP 107 N -4.28 0.68 -1.97 0.86 8.00 0.78 -4.97 116.55 115.64 2uwv n ASP 107 Ca 0.03 0.28 -0.08 0.00 0.71 0.00 0.00 54.79 55.73 2uwv n ASP 107 Cb 0.22 -0.23 0.04 0.00 -0.02 0.00 0.00 41.12 41.13 2uwv n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2uwv n GLY 108 N 1.35 0.17 3.53 0.44 0.00 0.54 -4.75 105.19 106.46 2uwv n GLY 108 Ca 0.05 -0.25 -0.25 0.00 0.00 0.00 0.00 46.02 45.57 2uwv n GLY 108 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2uwv s VAL 109 N -3.15 1.01 0.00 1.61 -7.23 -1.06 -3.74 120.40 107.84 2uwv s VAL 109 Ca 0.08 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.25 2uwv s VAL 109 Cb -0.03 -2.54 0.00 0.00 0.56 0.00 0.00 36.38 34.36 2uwv s VAL 109 CO 0.31 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.71 2uwv n GLY 110 N -0.88 2.37 0.00 2.32 0.00 -1.26 -1.72 105.19 106.02 2uwv n GLY 110 Ca -0.06 -0.42 0.08 0.00 0.00 0.00 0.00 46.02 45.62 2uwv n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2uwv n PRO 111 N 10.29 0.02 -0.06 1.61 -0.04 -1.26 -1.29 135.00 144.27 2uwv n PRO 111 Ca 0.00 0.21 0.03 0.00 -0.04 0.00 0.00 63.50 63.70 2uwv n PRO 111 Cb 0.00 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.06 2uwv n PRO 111 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2uwv n ALA 112 N -1.48 2.49 -1.75 0.55 0.00 -0.70 -3.35 120.51 116.27 2uwv n ALA 112 Ca 0.04 -0.23 -0.36 0.00 0.00 0.00 0.00 53.44 52.89 2uwv n ALA 112 Cb 0.18 -1.01 0.04 0.00 0.00 0.00 0.00 19.45 18.66 2uwv n ALA 112 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2uwv s SER 113 N -1.06 5.17 0.15 0.00 0.01 -0.41 -3.92 113.70 113.64 2uwv s SER 113 Ca 0.11 2.43 0.04 0.00 1.31 0.00 0.00 55.95 59.84 2uwv s SER 113 Cb 0.06 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 2uwv s SER 113 CO 0.08 -1.61 -0.10 -1.66 0.41 0.00 0.00 173.24 170.36 2uwv s TRP 114 N -1.55 1.28 0.03 2.43 1.48 -1.25 -4.33 118.94 117.03 2uwv s TRP 114 Ca 0.77 -0.77 0.02 0.00 -1.06 0.00 0.00 56.10 55.07 2uwv s TRP 114 Cb -0.32 -0.66 -0.04 0.00 -1.16 0.00 0.00 33.47 31.30 2uwv s TRP 114 CO 0.34 0.08 0.01 0.08 -4.06 0.00 0.00 176.95 173.40 2uwv s VAL 115 N -3.33 4.19 -1.34 -0.66 1.01 -1.26 -5.01 120.40 113.99 2uwv s VAL 115 Ca 0.17 -0.71 -0.13 0.00 0.00 0.00 0.00 61.98 61.31 2uwv s VAL 115 Cb 0.03 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.45 2uwv s VAL 115 CO 0.01 0.28 2.38 0.00 0.00 0.00 0.00 175.10 177.77 2uwv n ALA 116 N 1.06 5.70 -1.40 5.51 0.00 -1.26 -4.84 120.51 125.29 2uwv n ALA 116 Ca -0.13 -3.49 -0.30 0.00 0.00 0.00 0.00 53.44 49.52 2uwv n ALA 116 Cb 0.52 -3.45 0.09 0.00 0.00 0.00 0.00 19.45 16.62 2uwv n ALA 116 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2uwv s ARG 117 N 3.20 2.09 0.14 0.00 0.52 -1.26 -4.96 118.95 118.68 2uwv s ARG 117 Ca 0.54 0.88 -0.34 0.00 -0.52 0.00 0.00 55.73 56.29 2uwv s ARG 117 Cb 0.15 -1.90 -0.16 0.00 0.52 0.00 0.00 34.95 33.56 2uwv s ARG 117 CO -0.04 -1.68 1.14 -2.13 0.02 0.00 0.00 175.30 172.61 2uwv n ARG 118 N -3.51 0.97 -1.23 3.54 0.63 -1.26 -4.03 116.66 111.76 2uwv n ARG 118 Ca 0.08 0.35 -0.20 0.00 -0.92 0.00 0.00 57.85 57.15 2uwv n ARG 118 Cb 0.55 -1.83 -0.07 0.00 0.45 0.00 0.00 32.46 31.55 2uwv n ARG 118 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2uwv n ASP 119 N 2.03 6.12 -4.25 6.15 2.03 -1.26 -1.77 116.55 125.59 2uwv n ASP 119 Ca 0.16 -2.97 -0.19 0.00 0.52 0.00 0.00 54.79 52.31 2uwv n ASP 119 Cb 0.22 -1.25 -0.11 0.00 -0.72 0.00 0.00 41.12 39.26 2uwv n ASP 119 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2uwv s LEU 120 N -1.49 2.39 0.46 -2.67 1.43 -1.26 -4.91 118.68 112.63 2uwv s LEU 120 Ca 0.54 -0.79 -0.22 0.00 -1.03 0.00 0.00 54.13 52.63 2uwv s LEU 120 Cb 0.33 -0.60 -0.08 0.00 0.03 0.00 0.00 46.19 45.87 2uwv s LEU 120 CO -0.12 -0.11 1.10 -2.84 0.23 0.00 0.00 176.35 174.61 2uwv s PRO 121 N -2.56 3.81 0.45 1.29 0.02 -1.26 -0.46 135.00 136.30 2uwv s PRO 121 Ca 0.09 1.60 -0.24 0.00 0.02 0.00 0.00 61.00 62.46 2uwv s PRO 121 Cb -0.06 -2.32 -0.08 0.00 0.02 0.00 0.00 34.50 32.07 2uwv s PRO 121 CO 0.03 -0.47 1.33 -2.00 -0.33 0.00 0.00 177.00 175.56 2uwv s GLU 122 N -2.84 3.69 0.07 5.54 2.12 -1.26 -4.86 118.70 121.16 2uwv s GLU 122 Ca 0.64 2.19 0.08 0.00 0.36 0.00 0.00 54.97 58.24 2uwv s GLU 122 Cb -0.24 -2.58 -0.04 0.00 0.26 0.00 0.00 34.13 31.54 2uwv s GLU 122 CO 0.29 -0.74 -0.17 -0.51 -0.54 0.00 0.00 175.26 173.59 2uwv s LEU 123 N -2.82 2.70 0.00 2.70 1.43 -1.26 -1.15 118.68 120.29 2uwv s LEU 123 Ca 0.62 -0.45 -0.09 0.00 -1.03 0.00 0.00 54.13 53.17 2uwv s LEU 123 Cb -0.39 -1.57 0.14 0.00 0.03 0.00 0.00 46.19 44.41 2uwv s LEU 123 CO 0.49 0.22 0.87 -0.90 0.23 0.00 0.00 176.35 177.26 2uwv n ASP 124 N 1.22 0.23 0.06 2.29 5.68 0.42 -4.73 116.55 121.72 2uwv n ASP 124 Ca -0.16 -1.41 0.10 0.00 -0.50 0.00 0.00 54.79 52.82 2uwv n ASP 124 Cb 0.52 -0.65 0.42 0.00 -1.14 0.00 0.00 41.12 40.28 2uwv n ASP 124 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2uwv n GLY 125 N -0.81 -1.24 0.25 6.12 0.00 -1.26 -1.57 105.19 106.68 2uwv n GLY 125 Ca 0.11 -0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.24 2uwv n GLY 125 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2uwv n HIS 126 N -1.86 0.00 -0.21 1.61 8.25 -1.26 -4.97 115.22 116.79 2uwv n HIS 126 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 2uwv n HIS 126 Cb 0.24 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.31 2uwv n HIS 126 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2uwv n GLY 127 N 1.45 0.89 3.94 -1.41 0.00 -0.61 -5.08 105.19 104.37 2uwv n GLY 127 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 2uwv n GLY 127 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2uwv s HIS 128 N -2.01 3.50 -0.07 1.61 3.76 -1.26 -4.80 115.29 116.02 2uwv s HIS 128 Ca 0.00 0.32 -0.35 0.00 -0.15 0.00 0.00 55.06 54.88 2uwv s HIS 128 Cb 0.00 -1.87 -0.13 0.00 1.11 0.00 0.00 32.58 31.70 2uwv s HIS 128 CO 0.00 0.15 1.81 0.09 -0.85 0.00 0.00 174.74 175.93 2uwv n ASN 129 N -1.76 3.23 -0.29 1.40 3.02 -1.26 -0.44 115.26 119.17 2uwv n ASN 129 Ca -0.05 1.00 -0.05 0.00 -0.03 0.00 0.00 54.58 55.45 2uwv n ASN 129 Cb 0.56 -1.35 0.07 0.00 -0.61 0.00 0.00 39.78 38.45 2uwv n ASN 129 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2uwv h LYS 130 N 8.37 1.07 -5.27 3.52 3.64 -1.42 -3.42 116.57 123.05 2uwv h LYS 130 Ca -0.48 -0.11 -0.65 0.00 -1.27 0.00 0.00 60.65 58.14 2uwv h LYS 130 Cb 1.28 -0.22 -0.26 0.00 -0.41 0.00 0.00 32.23 32.62 2uwv h LYS 130 CO 0.94 0.78 -0.74 0.42 -2.27 0.00 0.00 179.45 178.57 2uwv s ILE 131 N -5.91 3.25 0.04 2.00 1.01 -1.26 -1.03 121.20 119.29 2uwv s ILE 131 Ca -0.13 -0.58 -0.01 0.00 0.00 0.00 0.00 60.65 59.93 2uwv s ILE 131 Cb 0.15 -2.39 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 2uwv s ILE 131 CO 0.80 0.51 -0.02 -0.54 0.00 0.00 0.00 174.94 175.69 2uwv s LYS 132 N 0.49 0.48 0.51 2.79 1.02 -0.62 -4.65 119.74 119.76 2uwv s LYS 132 Ca -0.07 -0.92 -0.23 0.00 0.02 0.00 0.00 55.97 54.77 2uwv s LYS 132 Cb -0.15 0.17 -0.06 0.00 -0.52 0.00 0.00 37.83 37.27 2uwv s LYS 132 CO 0.04 -0.09 1.33 -1.25 -0.92 0.00 0.00 175.35 174.46 2uwv s PRO 133 N -2.74 3.36 0.23 -1.68 0.04 -1.26 -1.02 135.00 131.93 2uwv s PRO 133 Ca -0.04 2.17 -0.05 0.00 0.04 0.00 0.00 61.00 63.12 2uwv s PRO 133 Cb -0.01 -2.36 0.24 0.00 0.04 0.00 0.00 34.50 32.41 2uwv s PRO 133 CO -0.06 -0.99 1.76 1.98 0.04 0.00 0.00 177.00 179.74 2uwv h MET 134 N 1.74 1.01 -0.72 4.56 4.05 -1.17 -1.71 114.93 122.68 2uwv h MET 134 Ca -0.51 -0.23 0.21 0.00 -0.28 0.00 0.00 59.70 58.90 2uwv h MET 134 Cb 1.28 -0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 31.91 2uwv h MET 134 CO 0.59 0.90 0.73 1.57 0.23 0.00 0.00 176.91 180.92 2uwv h LYS 135 N 0.96 0.00 -0.16 0.39 2.10 -1.90 0.22 116.57 118.18 2uwv h LYS 135 Ca 0.20 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.85 2uwv h LYS 135 Cb 0.34 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.67 2uwv h LYS 135 CO 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.45 2uwv n ALA 136 N -2.39 2.40 -3.07 0.07 0.00 -0.66 -4.85 120.51 112.02 2uwv n ALA 136 Ca 0.15 -0.79 -0.41 0.00 0.00 0.00 0.00 53.44 52.38 2uwv n ALA 136 Cb 0.98 -0.54 -0.10 0.00 0.00 0.00 0.00 19.45 19.79 2uwv n ALA 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uwv s ALA 137 N -1.19 3.32 -0.01 0.00 0.00 0.76 -4.96 121.76 119.68 2uwv s ALA 137 Ca 0.22 -1.99 -0.28 0.00 0.00 0.00 0.00 51.96 49.91 2uwv s ALA 137 Cb 0.14 -2.69 -0.04 0.00 0.00 0.00 0.00 23.12 20.54 2uwv s ALA 137 CO 0.20 -1.57 0.88 0.00 0.00 0.00 0.00 175.76 175.27 2uwv s ALA 138 N 1.50 3.23 -0.64 0.00 0.00 -1.26 -1.15 121.76 123.44 2uwv s ALA 138 Ca 0.03 0.41 -0.04 0.00 0.00 0.00 0.00 51.96 52.35 2uwv s ALA 138 Cb -0.22 -3.20 0.16 0.00 0.00 0.00 0.00 23.12 19.87 2uwv s ALA 138 CO 0.04 -0.15 0.46 0.20 0.00 0.00 0.00 175.76 176.31 2uwv s GLY 139 N 0.79 2.51 0.40 0.00 0.00 -1.26 -5.09 107.32 104.66 2uwv s GLY 139 Ca 0.46 -3.25 -0.23 0.00 0.00 0.00 0.00 44.72 41.70 2uwv s GLY 139 CO 0.25 1.11 0.99 -1.36 0.00 0.00 0.00 173.10 174.10 2uwv s PHE 140 N -0.01 3.35 0.05 1.90 0.40 -0.30 -5.09 117.98 118.28 2uwv s PHE 140 Ca 0.17 1.66 -0.24 0.00 -0.60 0.00 0.00 56.93 57.92 2uwv s PHE 140 Cb -0.19 -2.99 0.06 0.00 0.51 0.00 0.00 43.02 40.40 2uwv s PHE 140 CO -0.04 -0.29 0.56 -3.38 0.70 0.00 0.00 175.22 172.77 2uwv s HIS 141 N -1.83 -0.48 0.10 0.36 -3.43 -1.26 -4.92 115.29 103.83 2uwv s HIS 141 Ca 0.58 0.53 -0.36 0.00 -0.80 0.00 0.00 55.06 55.02 2uwv s HIS 141 Cb -0.17 0.39 -0.15 0.00 -1.43 0.00 0.00 32.58 31.22 2uwv s HIS 141 CO 0.21 -0.68 1.47 0.28 -2.00 0.00 0.00 174.74 174.03 2uwv n VAL 142 N 0.33 0.03 0.07 -5.38 0.31 -1.26 -4.91 118.33 107.51 2uwv n VAL 142 Ca -0.18 -0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.15 2uwv n VAL 142 Cb 0.61 -1.16 0.00 0.00 -0.91 0.00 0.00 33.84 32.38 2uwv n VAL 142 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2uwv n SER 143 N 3.09 0.78 -3.65 4.52 3.41 -1.26 -5.07 113.62 115.46 2uwv n SER 143 Ca 0.18 -0.89 -0.02 0.00 -0.26 0.00 0.00 58.87 57.88 2uwv n SER 143 Cb 0.23 0.33 -0.04 0.00 -0.26 0.00 0.00 64.21 64.47 2uwv n SER 143 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2uwv s ALA 144 N -0.47 -2.14 0.00 7.33 0.00 -1.26 -5.17 121.76 120.05 2uwv s ALA 144 Ca 0.01 1.89 0.00 0.00 0.00 0.00 0.00 51.96 53.86 2uwv s ALA 144 Cb 0.01 -1.60 0.00 0.00 0.00 0.00 0.00 23.12 21.53 2uwv s ALA 144 CO 0.03 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 175.99 2uwv n GLY 145 N 0.62 -1.15 3.68 0.00 0.00 -1.26 -4.85 105.19 102.24 2uwv n GLY 145 Ca -0.01 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 43.97 2uwv n GLY 145 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2uwv s LYS 146 N -2.00 4.20 -0.30 1.61 2.47 -1.26 -4.94 119.74 119.53 2uwv s LYS 146 Ca 0.00 2.27 -0.29 0.00 -1.56 0.00 0.00 55.97 56.39 2uwv s LYS 146 Cb 0.00 -3.69 -0.01 0.00 -1.46 0.00 0.00 37.83 32.67 2uwv s LYS 146 CO 0.00 -0.74 1.59 1.21 0.16 0.00 0.00 175.35 177.56 2uwv s ASN 147 N 2.58 6.27 0.37 1.43 3.84 -1.26 -4.90 114.94 123.28 2uwv s ASN 147 Ca 0.73 1.32 0.28 0.00 0.21 0.00 0.00 52.86 55.40 2uwv s ASN 147 Cb -0.38 -2.53 1.10 0.00 -0.55 0.00 0.00 41.25 38.89 2uwv s ASN 147 CO 0.31 -1.40 1.82 1.55 -2.79 0.00 0.00 177.10 176.59 2uwv h PRO 148 N 11.14 0.00 -6.27 0.43 0.13 -1.96 -3.45 132.00 132.02 2uwv h PRO 148 Ca -0.32 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.27 2uwv h PRO 148 Cb 1.14 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 2uwv h PRO 148 CO 1.03 0.00 1.16 0.42 -0.23 0.00 0.00 178.00 180.38 2uwv s ILE 149 N -3.43 3.42 0.00 -3.56 1.01 -1.26 -1.51 121.20 115.86 2uwv s ILE 149 Ca 0.04 0.50 0.00 0.00 0.00 0.00 0.00 60.65 61.18 2uwv s ILE 149 Cb 0.09 -3.35 0.00 0.00 0.01 0.00 0.00 42.46 39.21 2uwv s ILE 149 CO 0.47 -0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.94 2uwv n GLY 150 N 4.44 1.51 3.79 6.18 0.00 0.01 -5.01 105.19 116.11 2uwv n GLY 150 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 2uwv n GLY 150 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2uwv s LEU 151 N 0.00 4.02 0.60 0.99 1.43 -0.57 -4.67 118.68 120.48 2uwv s LEU 151 Ca 0.00 1.98 -0.17 0.00 -1.03 0.00 0.00 54.13 54.91 2uwv s LEU 151 Cb 0.00 -4.34 -0.03 0.00 0.03 0.00 0.00 46.19 41.85 2uwv s LEU 151 CO 0.00 -0.59 1.10 -2.16 0.23 0.00 0.00 176.35 174.93 2uwv s PRO 152 N -2.80 3.13 -0.17 1.29 0.04 -1.26 -1.39 135.00 133.84 2uwv s PRO 152 Ca 0.61 1.44 -0.01 0.00 0.04 0.00 0.00 61.00 63.08 2uwv s PRO 152 Cb -0.19 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.35 2uwv s PRO 152 CO 0.24 -0.99 -0.12 0.08 0.04 0.00 0.00 177.00 176.25 2uwv s VAL 153 N -2.14 2.94 -0.03 -0.36 1.01 0.63 -0.70 120.40 121.75 2uwv s VAL 153 Ca 0.68 -0.67 0.04 0.00 0.00 0.00 0.00 61.98 62.04 2uwv s VAL 153 Cb -0.21 -2.27 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 2uwv s VAL 153 CO 0.34 0.49 -0.15 -0.60 0.00 0.00 0.00 175.10 175.19 2uwv s ARG 154 N 0.91 2.44 0.57 2.72 3.52 0.24 -0.30 118.95 129.05 2uwv s ARG 154 Ca -0.03 -0.74 0.09 0.00 -0.13 0.00 0.00 55.73 54.92 2uwv s ARG 154 Cb -0.15 -2.35 0.08 0.00 -1.56 0.00 0.00 34.95 30.97 2uwv s ARG 154 CO -0.01 0.61 0.71 0.20 -0.81 0.00 0.00 175.30 176.00 2uwv s GLY 155 N -0.86 1.87 0.00 8.12 0.00 -0.58 -0.66 107.32 115.21 2uwv s GLY 155 Ca 0.12 -1.95 0.16 0.00 0.00 0.00 0.00 44.72 43.05 2uwv s GLY 155 CO 0.01 -1.75 1.50 0.00 0.00 0.00 0.00 173.10 172.86 2uwv n ASP 157 N -1.38 1.34 -1.56 0.00 5.75 -1.25 -4.57 116.55 114.88 2uwv n ASP 157 Ca 0.06 -1.91 -0.19 0.00 -0.01 0.00 0.00 54.79 52.75 2uwv n ASP 157 Cb 0.16 -0.15 -0.07 0.00 -1.03 0.00 0.00 41.12 40.03 2uwv n ASP 157 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2uwv n LEU 158 N 0.20 -1.45 -4.79 -2.12 4.77 0.87 -5.00 117.00 109.48 2uwv n LEU 158 Ca 0.10 0.38 -0.30 0.00 -0.03 0.00 0.00 56.01 56.16 2uwv n LEU 158 Cb 0.23 -2.63 -0.06 0.00 -2.33 0.00 0.00 43.42 38.62 2uwv n LEU 158 CO 0.07 -0.85 -0.25 -1.61 -1.33 0.00 0.00 177.39 173.42 2uwv s GLU 159 N -3.82 2.94 0.00 3.23 0.41 -1.25 -4.90 118.70 115.31 2uwv s GLU 159 Ca 0.00 -0.67 -0.30 0.00 -0.41 0.00 0.00 54.97 53.59 2uwv s GLU 159 Cb 0.00 -2.76 -0.04 0.00 -1.78 0.00 0.00 34.13 29.55 2uwv s GLU 159 CO 0.00 0.57 1.10 0.42 -0.49 0.00 0.00 175.26 176.86 2uwv s ILE 160 N -1.41 4.44 -0.12 -1.63 -1.09 -1.26 -1.53 121.20 118.60 2uwv s ILE 160 Ca 0.30 1.75 0.19 0.00 -2.23 0.00 0.00 60.65 60.66 2uwv s ILE 160 Cb -0.12 -4.12 -0.28 0.00 -1.58 0.00 0.00 42.46 36.36 2uwv s ILE 160 CO 0.23 0.10 0.24 0.00 -1.23 0.00 0.00 174.94 174.28 2uwv n ALA 161 N 4.23 2.06 0.00 9.38 0.00 0.58 -4.96 120.51 131.81 2uwv n ALA 161 Ca 0.08 -0.96 0.00 0.00 0.00 0.00 0.00 53.44 52.56 2uwv n ALA 161 Cb 0.48 -0.41 0.00 0.00 0.00 0.00 0.00 19.45 19.52 2uwv n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2uwv n GLY 162 N 1.57 -0.65 3.24 0.00 0.00 -1.21 -4.21 105.19 103.94 2uwv n GLY 162 Ca -0.20 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.15 2uwv n GLY 162 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2uwv s LYS 163 N -1.00 0.68 -0.00 1.61 -2.85 -0.91 -0.27 119.74 117.01 2uwv s LYS 163 Ca 0.00 -0.18 -0.28 0.00 -1.00 0.00 0.00 55.97 54.51 2uwv s LYS 163 Cb 0.00 0.30 -0.04 0.00 -2.06 0.00 0.00 37.83 36.03 2uwv s LYS 163 CO 0.00 -0.19 0.88 0.08 0.10 0.00 0.00 175.35 176.22 2uwv s VAL 164 N -1.33 4.86 -0.05 1.79 1.01 -0.49 -0.75 120.40 125.45 2uwv s VAL 164 Ca -0.14 1.84 0.02 0.00 0.00 0.00 0.00 61.98 63.70 2uwv s VAL 164 Cb -0.05 -4.22 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 2uwv s VAL 164 CO 0.04 0.22 0.06 1.33 0.00 0.00 0.00 175.10 176.75 2uwv n VAL 165 N 3.63 0.00 -3.81 2.92 0.24 0.12 -0.81 118.33 120.61 2uwv n VAL 165 Ca 0.03 -0.35 -0.02 0.00 -2.04 0.00 0.00 64.34 61.96 2uwv n VAL 165 Cb 0.51 0.85 0.00 0.00 -1.47 0.00 0.00 33.84 33.73 2uwv n VAL 165 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2uwv s ASP 166 N -1.43 -0.06 -0.03 -1.34 2.15 -1.16 -4.93 116.67 109.87 2uwv s ASP 166 Ca 0.00 -0.48 0.06 0.00 0.43 0.00 0.00 52.55 52.56 2uwv s ASP 166 Cb 0.01 0.42 -0.01 0.00 -0.30 0.00 0.00 42.92 43.04 2uwv s ASP 166 CO 0.06 -0.82 -0.22 -0.63 -0.17 0.00 0.00 175.17 173.40 2uwv s ILE 167 N -2.54 1.74 -0.17 4.11 1.01 -1.26 -1.39 121.20 122.69 2uwv s ILE 167 Ca 0.18 -0.91 -0.11 0.00 0.00 0.00 0.00 60.65 59.81 2uwv s ILE 167 Cb -0.01 -1.46 -0.05 0.00 0.01 0.00 0.00 42.46 40.95 2uwv s ILE 167 CO 0.03 0.49 0.18 0.26 0.00 0.00 0.00 174.94 175.90 2uwv s TRP 168 N -0.28 3.47 0.07 3.97 0.52 0.75 -0.53 118.94 126.91 2uwv s TRP 168 Ca 0.02 0.46 0.09 0.00 0.02 0.00 0.00 56.10 56.69 2uwv s TRP 168 Cb -0.11 -2.17 -0.03 0.00 -1.15 0.00 0.00 33.47 30.01 2uwv s TRP 168 CO 0.01 0.37 -0.24 0.14 0.02 0.00 0.00 176.95 177.25 2uwv s VAL 169 N 0.09 1.95 -0.37 4.03 -7.23 -0.19 -0.42 120.40 118.26 2uwv s VAL 169 Ca 0.12 -1.41 -0.27 0.00 -1.81 0.00 0.00 61.98 58.61 2uwv s VAL 169 Cb -0.12 -1.70 0.02 0.00 0.56 0.00 0.00 36.38 35.14 2uwv s VAL 169 CO 0.01 0.21 1.01 -0.62 -0.31 0.00 0.00 175.10 175.41 2uwv s ASP 170 N -1.44 6.77 0.02 4.85 -1.08 0.20 -1.59 116.67 124.40 2uwv s ASP 170 Ca 0.10 0.74 -0.20 0.00 -0.52 0.00 0.00 52.55 52.67 2uwv s ASP 170 Cb -0.10 -2.51 -0.11 0.00 -1.46 0.00 0.00 42.92 38.75 2uwv s ASP 170 CO 0.03 -0.93 1.07 0.40 0.52 0.00 0.00 175.17 176.26 2uwv h ILE 171 N 5.85 0.00 0.00 4.11 5.03 -1.40 0.89 117.51 131.99 2uwv h ILE 171 Ca -0.22 -0.16 -0.01 0.00 -0.12 0.00 0.00 64.86 64.35 2uwv h ILE 171 Cb 1.07 0.00 -0.00 0.00 -3.03 0.00 0.00 36.82 34.86 2uwv h ILE 171 CO 1.02 0.00 -0.03 1.55 -0.68 0.00 0.00 178.15 180.01 2uwv h PRO 172 N -0.89 0.00 -0.01 2.37 0.13 -1.94 -2.53 132.00 129.12 2uwv h PRO 172 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2uwv h PRO 172 Cb 0.56 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.69 2uwv h PRO 172 CO 0.12 0.03 -0.22 0.39 -0.23 0.00 0.00 178.00 178.10 2uwv n GLU 173 N -3.54 1.59 -3.57 0.86 1.02 -1.22 -5.01 120.64 110.77 2uwv n GLU 173 Ca -0.02 -0.98 -0.27 0.00 -0.02 0.00 0.00 57.16 55.87 2uwv n GLU 173 Cb 0.14 -1.26 0.05 0.00 -0.02 0.00 0.00 31.44 30.34 2uwv n GLU 173 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2uwv n GLN 174 N 0.17 -1.52 -4.01 3.49 6.02 0.29 -5.00 117.38 116.82 2uwv n GLN 174 Ca 0.07 0.56 -0.08 0.00 -0.01 0.00 0.00 57.00 57.54 2uwv n GLN 174 Cb 0.34 -4.56 -0.11 0.00 1.02 0.00 0.00 30.24 26.93 2uwv n GLN 174 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2uwv s MET 175 N -5.58 0.43 0.03 -1.09 0.23 -1.10 -4.98 119.30 107.24 2uwv s MET 175 Ca 0.47 -0.80 -0.30 0.00 -1.03 0.00 0.00 55.69 54.03 2uwv s MET 175 Cb -0.14 0.15 -0.05 0.00 -1.53 0.00 0.00 34.83 33.26 2uwv s MET 175 CO 0.83 -0.08 1.15 0.00 -2.03 0.00 0.00 175.02 174.90 2uwv s ALA 176 N -2.28 3.36 -0.07 3.16 0.00 -1.26 -0.62 121.76 124.04 2uwv s ALA 176 Ca -0.08 0.75 0.00 0.00 0.00 0.00 0.00 51.96 52.63 2uwv s ALA 176 Cb -0.04 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.60 2uwv s ALA 176 CO -0.04 -0.44 -0.06 0.54 0.00 0.00 0.00 175.76 175.76 2uwv n ARG 177 N 4.11 0.17 -4.09 0.00 1.74 0.44 -4.83 116.66 114.20 2uwv n ARG 177 Ca 0.09 0.04 -0.11 0.00 -0.77 0.00 0.00 57.85 57.09 2uwv n ARG 177 Cb 0.47 -1.13 -0.11 0.00 -1.02 0.00 0.00 32.46 30.67 2uwv n ARG 177 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2uwv s PHE 178 N -2.14 0.70 -0.16 -1.55 0.40 -0.99 -0.67 117.98 113.58 2uwv s PHE 178 Ca -0.09 -0.69 -0.12 0.00 -0.60 0.00 0.00 56.93 55.42 2uwv s PHE 178 Cb 0.02 -0.42 -0.05 0.00 0.51 0.00 0.00 43.02 43.08 2uwv s PHE 178 CO 0.16 -0.14 0.24 -0.51 0.70 0.00 0.00 175.22 175.67 2uwv s LEU 179 N -2.19 4.26 -0.18 -0.37 1.43 -0.10 -0.18 118.68 121.35 2uwv s LEU 179 Ca -0.02 0.46 -0.23 0.00 -1.03 0.00 0.00 54.13 53.32 2uwv s LEU 179 Cb -0.03 -2.28 -0.02 0.00 0.03 0.00 0.00 46.19 43.88 2uwv s LEU 179 CO -0.02 0.16 0.71 -0.70 0.23 0.00 0.00 176.35 176.72 2uwv s GLU 180 N 0.20 4.25 -0.11 1.70 2.12 -0.49 -0.70 118.70 125.68 2uwv s GLU 180 Ca 0.15 0.77 0.02 0.00 0.36 0.00 0.00 54.97 56.27 2uwv s GLU 180 Cb -0.13 -3.57 -0.01 0.00 0.26 0.00 0.00 34.13 30.69 2uwv s GLU 180 CO 0.03 -0.25 -0.20 0.08 -0.54 0.00 0.00 175.26 174.38 2uwv s VAL 181 N 1.93 2.44 -0.13 3.70 1.01 0.65 -0.70 120.40 129.31 2uwv s VAL 181 Ca 0.33 -0.88 -0.17 0.00 0.00 0.00 0.00 61.98 61.26 2uwv s VAL 181 Cb -0.16 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 2uwv s VAL 181 CO 0.11 0.55 0.42 -0.70 0.00 0.00 0.00 175.10 175.48 2uwv s GLU 182 N 0.33 4.31 0.71 2.72 2.12 0.07 -0.40 118.70 128.56 2uwv s GLU 182 Ca -0.16 0.33 -0.03 0.00 0.36 0.00 0.00 54.97 55.47 2uwv s GLU 182 Cb -0.17 -3.44 0.10 0.00 0.26 0.00 0.00 34.13 30.89 2uwv s GLU 182 CO 0.08 0.18 0.98 -0.51 -0.54 0.00 0.00 175.26 175.45 2uwv s LEU 183 N 0.60 2.99 0.56 2.70 1.43 0.78 -2.13 118.68 125.60 2uwv s LEU 183 Ca 0.23 -0.10 0.26 0.00 -1.03 0.00 0.00 54.13 53.48 2uwv s LEU 183 Cb -0.14 -2.37 1.51 0.00 0.03 0.00 0.00 46.19 45.21 2uwv s LEU 183 CO 0.08 -1.76 2.07 0.50 0.23 0.00 0.00 176.35 177.47 2uwv h LYS 184 N -0.53 0.00 -0.13 1.70 3.64 -1.87 -1.12 116.57 118.26 2uwv h LYS 184 Ca -0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 2uwv h LYS 184 Cb 1.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 2uwv h LYS 184 CO 0.46 0.00 0.00 -0.40 -2.27 0.00 0.00 179.45 177.24 2uwv n ASP 185 N -4.10 1.98 0.00 4.20 5.75 -1.26 -4.93 116.55 118.19 2uwv n ASP 185 Ca 0.04 -1.71 0.00 0.00 -0.01 0.00 0.00 54.79 53.11 2uwv n ASP 185 Cb 0.39 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 2uwv n ASP 185 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2uwv n GLY 186 N 1.22 0.93 3.92 6.12 0.00 -0.42 -5.06 105.19 111.89 2uwv n GLY 186 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 2uwv n GLY 186 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2uwv s SER 187 N -2.52 5.34 0.32 1.61 1.04 -1.26 -4.77 113.70 113.46 2uwv s SER 187 Ca 0.00 0.70 0.10 0.00 0.48 0.00 0.00 55.95 57.22 2uwv s SER 187 Cb 0.00 -1.56 -0.05 0.00 0.10 0.00 0.00 66.02 64.51 2uwv s SER 187 CO 0.00 -1.26 -0.04 0.42 0.98 0.00 0.00 173.24 173.33 2uwv s THR 188 N -3.12 2.64 0.16 2.02 -4.23 -1.26 -0.16 115.64 111.69 2uwv s THR 188 Ca 0.56 -2.08 0.05 0.00 -1.18 0.00 0.00 61.69 59.05 2uwv s THR 188 Cb -0.11 -2.69 -0.04 0.00 1.34 0.00 0.00 72.50 71.00 2uwv s THR 188 CO 0.46 -0.26 -0.12 -0.13 -0.54 0.00 0.00 174.62 174.04 2uwv s ARG 189 N -3.66 1.11 -0.06 3.99 1.81 0.46 -4.86 118.95 117.74 2uwv s ARG 189 Ca 0.33 -1.45 -0.14 0.00 -1.72 0.00 0.00 55.73 52.75 2uwv s ARG 189 Cb -0.01 -0.76 -0.05 0.00 -0.45 0.00 0.00 34.95 33.67 2uwv s ARG 189 CO 0.18 0.11 0.36 -0.51 -0.68 0.00 0.00 175.30 174.77 2uwv s LEU 190 N -3.09 4.39 -0.12 2.53 1.43 -1.26 -0.25 118.68 122.30 2uwv s LEU 190 Ca 0.17 0.79 0.03 0.00 -1.03 0.00 0.00 54.13 54.08 2uwv s LEU 190 Cb 0.01 -2.50 0.00 0.00 0.03 0.00 0.00 46.19 43.73 2uwv s LEU 190 CO 0.02 0.24 -0.22 -0.76 0.23 0.00 0.00 176.35 175.86 2uwv s LEU 191 N -0.49 2.17 0.26 1.79 2.01 0.12 -4.97 118.68 119.57 2uwv s LEU 191 Ca 0.22 -0.56 -0.31 0.00 0.01 0.00 0.00 54.13 53.49 2uwv s LEU 191 Cb -0.15 -1.45 -0.12 0.00 0.01 0.00 0.00 46.19 44.47 2uwv s LEU 191 CO 0.10 0.12 1.58 -2.65 1.01 0.00 0.00 176.35 176.51 2uwv n PRO 192 N 3.81 2.55 -0.37 1.29 -0.02 -1.26 -0.92 135.00 140.08 2uwv n PRO 192 Ca -0.19 0.91 0.05 0.00 -2.02 0.00 0.00 63.50 62.24 2uwv n PRO 192 Cb 0.52 -2.68 0.21 0.00 -0.02 0.00 0.00 33.50 31.53 2uwv n PRO 192 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 2uwv h MET 193 N 5.12 1.06 0.00 -0.52 4.05 -1.21 -0.74 114.93 122.69 2uwv h MET 193 Ca -0.46 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 58.90 2uwv h MET 193 Cb 1.23 -0.24 0.00 0.00 -0.80 0.00 0.00 31.60 31.79 2uwv h MET 193 CO 0.82 0.70 0.00 1.04 0.23 0.00 0.00 176.91 179.71 2uwv n GLN 194 N -4.55 0.04 -0.02 0.39 3.00 -1.26 -2.46 117.38 112.51 2uwv n GLN 194 Ca 0.17 0.31 0.02 0.00 -0.01 0.00 0.00 57.00 57.49 2uwv n GLN 194 Cb 0.26 -1.50 0.03 0.00 0.00 0.00 0.00 30.24 29.03 2uwv n GLN 194 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 2uwv n MET 195 N -1.36 2.79 -4.37 -1.09 2.81 -0.29 -5.00 117.12 110.61 2uwv n MET 195 Ca 0.01 -1.68 -0.22 0.00 -1.81 0.00 0.00 57.70 54.01 2uwv n MET 195 Cb 0.03 -1.08 -0.11 0.00 -0.71 0.00 0.00 33.22 31.35 2uwv n MET 195 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2uwv s VAL 196 N -1.24 1.98 -0.27 2.03 -7.23 -1.03 -4.48 120.40 110.15 2uwv s VAL 196 Ca 0.06 -2.11 0.03 0.00 -1.81 0.00 0.00 61.98 58.15 2uwv s VAL 196 Cb 0.04 -2.02 0.07 0.00 0.56 0.00 0.00 36.38 35.03 2uwv s VAL 196 CO 0.01 -0.39 -0.08 -0.75 -0.31 0.00 0.00 175.10 173.58 2uwv s LYS 197 N -3.16 2.10 -0.38 4.82 2.20 0.39 -4.96 119.74 120.74 2uwv s LYS 197 Ca 0.21 -1.45 -0.29 0.00 -0.36 0.00 0.00 55.97 54.08 2uwv s LYS 197 Cb -0.04 -2.95 0.01 0.00 -1.51 0.00 0.00 37.83 33.33 2uwv s LYS 197 CO 0.09 -0.64 1.41 0.08 -0.36 0.00 0.00 175.35 175.93 2uwv s VAL 198 N 1.06 3.93 0.57 4.02 1.01 -1.26 -0.38 120.40 129.35 2uwv s VAL 198 Ca -0.05 0.97 0.07 0.00 0.00 0.00 0.00 61.98 62.97 2uwv s VAL 198 Cb -0.20 -4.15 0.07 0.00 0.00 0.00 0.00 36.38 32.10 2uwv s VAL 198 CO -0.06 -0.67 0.56 -1.10 0.00 0.00 0.00 175.10 173.84 2uwv s GLN 199 N 4.79 2.24 0.21 2.72 -0.21 0.09 -5.01 119.66 124.49 2uwv s GLN 199 Ca 0.61 -1.94 -0.05 0.00 0.02 0.00 0.00 55.36 54.00 2uwv s GLN 199 Cb -0.15 -2.28 0.16 0.00 1.00 0.00 0.00 33.01 31.75 2uwv s GLN 199 CO 0.31 -0.77 1.63 0.66 -2.12 0.00 0.00 175.29 174.99 2uwv h SER 200 N 0.49 0.84 -0.05 5.90 4.64 -2.02 -3.30 113.55 120.06 2uwv h SER 200 Ca -0.33 -0.29 0.00 0.00 -0.47 0.00 0.00 61.79 60.70 2uwv h SER 200 Cb 1.30 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2uwv h SER 200 CO 0.51 1.01 0.00 -0.46 -0.87 0.00 0.00 176.83 177.02 2uwv n ASN 201 N -4.13 1.84 -3.66 4.97 6.94 -1.26 -5.07 115.26 114.90 2uwv n ASN 201 Ca 0.01 -1.44 -0.06 0.00 -0.02 0.00 0.00 54.58 53.06 2uwv n ASN 201 Cb 0.42 -0.03 -0.02 0.00 -2.36 0.00 0.00 39.78 37.79 2uwv n ASN 201 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2uwv s ARG 202 N -0.74 1.18 -0.18 -3.83 1.70 -1.24 -4.42 118.95 111.42 2uwv s ARG 202 Ca 0.11 -0.58 -0.04 0.00 -0.47 0.00 0.00 55.73 54.75 2uwv s ARG 202 Cb 0.07 0.45 -0.02 0.00 -0.57 0.00 0.00 34.95 34.88 2uwv s ARG 202 CO 0.11 -0.53 -0.04 0.08 -1.08 0.00 0.00 175.30 173.83 2uwv s VAL 203 N -3.38 3.67 -0.15 4.99 1.01 0.12 -0.73 120.40 125.94 2uwv s VAL 203 Ca 0.09 -0.42 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 2uwv s VAL 203 Cb -0.02 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.69 2uwv s VAL 203 CO -0.02 0.46 0.02 -2.28 0.00 0.00 0.00 175.10 173.28 2uwv s HIS 204 N 0.84 3.18 -0.36 5.22 2.46 0.48 -0.59 115.29 126.52 2uwv s HIS 204 Ca -0.01 0.01 0.04 0.00 0.47 0.00 0.00 55.06 55.57 2uwv s HIS 204 Cb -0.15 -1.97 0.10 0.00 -0.13 0.00 0.00 32.58 30.44 2uwv s HIS 204 CO 0.02 0.19 0.07 0.08 -2.47 0.00 0.00 174.74 172.63 2uwv s VAL 205 N 0.03 2.32 0.30 0.89 1.01 0.16 -0.46 120.40 124.64 2uwv s VAL 205 Ca 0.04 -2.46 0.08 0.00 0.00 0.00 0.00 61.98 59.64 2uwv s VAL 205 Cb -0.13 -2.70 0.03 0.00 0.00 0.00 0.00 36.38 33.57 2uwv s VAL 205 CO 0.02 -0.62 1.69 -1.13 0.00 0.00 0.00 175.10 175.05 2uwv h ASN 206 N 7.48 0.15 -0.73 3.32 -1.24 -1.85 -2.40 115.58 120.32 2uwv h ASN 206 Ca -0.04 -0.07 -0.00 0.00 0.71 0.00 0.00 56.30 56.90 2uwv h ASN 206 Cb 1.01 -0.04 -0.04 0.00 0.73 0.00 0.00 38.32 39.98 2uwv h ASN 206 CO 0.54 0.60 0.45 0.00 -1.29 0.00 0.00 177.43 177.73 2uwv h ALA 207 N 1.41 1.41 -3.78 1.57 0.00 -1.87 -3.40 119.26 114.60 2uwv h ALA 207 Ca 0.01 -0.08 -0.67 0.00 0.00 0.00 0.00 54.91 54.17 2uwv h ALA 207 Cb 0.88 -0.30 -0.32 0.00 0.00 0.00 0.00 17.79 18.05 2uwv h ALA 207 CO 0.07 0.51 -0.88 -0.51 0.00 0.00 0.00 179.25 178.45 2uwv s LEU 208 N -9.79 2.04 0.80 0.00 1.43 -1.24 -3.46 118.68 108.46 2uwv s LEU 208 Ca -0.11 -0.50 -0.11 0.00 -1.03 0.00 0.00 54.13 52.38 2uwv s LEU 208 Cb 0.17 -1.32 0.07 0.00 0.03 0.00 0.00 46.19 45.15 2uwv s LEU 208 CO 0.79 0.20 1.09 -0.94 0.23 0.00 0.00 176.35 177.71 2uwv s SER 209 N 0.04 4.40 0.36 2.29 1.04 -1.26 -0.79 113.70 119.77 2uwv s SER 209 Ca -0.09 1.53 0.14 0.00 0.48 0.00 0.00 55.95 58.02 2uwv s SER 209 Cb -0.15 -2.27 0.68 0.00 0.10 0.00 0.00 66.02 64.37 2uwv s SER 209 CO 0.05 -2.06 1.77 0.77 0.98 0.00 0.00 173.24 174.76 2uwv h SER 210 N -1.15 0.00 0.50 7.02 4.64 -1.88 -1.91 113.55 120.78 2uwv h SER 210 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2uwv h SER 210 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2uwv h SER 210 CO 0.56 0.42 0.00 -0.90 -0.87 0.00 0.00 176.83 176.03 2uwv n ASP 211 N -3.88 0.00 -0.36 4.97 5.75 -1.26 -2.80 116.55 118.97 2uwv n ASP 211 Ca -0.01 0.36 0.12 0.00 -0.01 0.00 0.00 54.79 55.24 2uwv n ASP 211 Cb 0.47 -0.43 0.16 0.00 -1.03 0.00 0.00 41.12 40.28 2uwv n ASP 211 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2uwv n LEU 212 N -1.43 1.53 -0.10 -2.12 4.77 -0.72 -4.29 117.00 114.64 2uwv n LEU 212 Ca 0.05 -0.52 -0.06 0.00 -0.03 0.00 0.00 56.01 55.45 2uwv n LEU 212 Cb 0.18 -0.06 0.12 0.00 -2.33 0.00 0.00 43.42 41.34 2uwv n LEU 212 CO 0.15 0.29 0.79 -0.26 -1.33 0.00 0.00 177.39 177.03 2uwv h PHE 213 N 1.76 0.85 -0.33 -1.77 -1.00 -1.62 -2.85 116.94 111.99 2uwv h PHE 213 Ca 0.00 -0.16 -0.05 0.00 2.81 0.00 0.00 57.97 60.57 2uwv h PHE 213 Cb 0.64 -0.22 -0.02 0.00 3.61 0.00 0.00 35.95 39.96 2uwv h PHE 213 CO 0.00 0.85 -0.02 0.00 -1.61 0.00 0.00 178.31 177.53 2uwv h ALA 214 N 1.17 1.35 0.00 2.45 0.00 -1.81 -1.88 119.26 120.54 2uwv h ALA 214 Ca 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2uwv h ALA 214 Cb 0.60 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2uwv h ALA 214 CO 0.04 0.45 0.00 0.78 0.00 0.00 0.00 179.25 180.52 2uwv h GLY 215 N 0.85 0.00 -5.26 0.00 0.00 -1.76 -3.45 103.07 93.45 2uwv h GLY 215 Ca 0.10 0.00 -0.63 0.00 0.00 0.00 0.00 47.33 46.81 2uwv h GLY 215 CO 0.01 0.00 0.69 1.39 0.00 0.00 0.00 176.54 178.64 2uwv n ILE 216 N -2.80 0.05 -1.63 2.60 5.41 -0.71 -4.86 119.36 117.42 2uwv n ILE 216 Ca 0.01 -0.01 -0.46 0.00 1.00 0.00 0.00 62.75 63.29 2uwv n ILE 216 Cb 0.25 -1.27 -0.03 0.00 -0.71 0.00 0.00 39.64 37.87 2uwv n ILE 216 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2uwv n PRO 217 N 3.37 1.63 -3.31 0.38 -0.02 -1.26 -4.97 135.00 130.82 2uwv n PRO 217 Ca 0.18 0.58 -0.23 0.00 -2.02 0.00 0.00 63.50 62.01 2uwv n PRO 217 Cb 0.24 -2.13 -0.01 0.00 -0.02 0.00 0.00 33.50 31.59 2uwv n PRO 217 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2uwv s THR 218 N -0.36 4.82 0.13 3.45 -4.23 -1.26 -4.76 115.64 113.43 2uwv s THR 218 Ca 0.67 -0.51 0.02 0.00 -1.18 0.00 0.00 61.69 60.70 2uwv s THR 218 Cb -0.72 -3.76 -0.04 0.00 1.34 0.00 0.00 72.50 69.33 2uwv s THR 218 CO 0.53 -0.49 0.25 0.27 -0.54 0.00 0.00 174.62 174.65 2uwv s ILE 219 N -2.35 5.24 0.01 2.99 -4.36 -1.26 -5.02 121.20 116.44 2uwv s ILE 219 Ca 0.42 -0.68 -0.12 0.00 -0.26 0.00 0.00 60.65 60.01 2uwv s ILE 219 Cb -0.10 -3.67 -0.33 0.00 1.25 0.00 0.00 42.46 39.61 2uwv s ILE 219 CO 0.36 -0.05 0.90 0.07 0.24 0.00 0.00 174.94 176.46 2uwv h LYS 220 N 2.34 0.45 -5.98 0.37 2.10 -1.99 -3.44 116.57 110.42 2uwv h LYS 220 Ca -0.48 -0.77 -0.68 0.00 -2.00 0.00 0.00 60.65 56.72 2uwv h LYS 220 Cb 1.19 0.29 -0.23 0.00 -0.90 0.00 0.00 32.23 32.58 2uwv h LYS 220 CO 0.69 1.36 -0.74 -1.12 -2.00 0.00 0.00 179.45 177.64 2uwv s SER 221 N -7.41 4.27 0.26 7.07 0.01 -1.26 -5.03 113.70 111.60 2uwv s SER 221 Ca -0.11 -0.17 0.25 0.00 1.31 0.00 0.00 55.95 57.24 2uwv s SER 221 Cb 0.05 -1.17 0.90 0.00 0.21 0.00 0.00 66.02 66.01 2uwv s SER 221 CO 0.91 0.30 1.75 -0.65 0.41 0.00 0.00 173.24 175.96 2uwv h PRO 222 N 5.70 0.00 -0.24 12.44 0.11 -2.05 -3.15 132.00 144.81 2uwv h PRO 222 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2uwv h PRO 222 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2uwv h PRO 222 CO 0.53 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.57 2uwv n THR 223 N -2.32 0.86 -4.00 -1.15 -2.24 -1.26 -4.94 114.28 99.22 2uwv n THR 223 Ca 0.04 -0.93 -0.10 0.00 -2.27 0.00 0.00 64.05 60.79 2uwv n THR 223 Cb 0.33 0.60 -0.08 0.00 -2.10 0.00 0.00 70.33 69.09 2uwv n THR 223 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2uwv s GLU 224 N -0.96 1.14 -0.02 -0.78 -1.05 -1.19 -4.53 118.70 111.30 2uwv s GLU 224 Ca 0.18 -1.24 -0.01 0.00 -0.15 0.00 0.00 54.97 53.74 2uwv s GLU 224 Cb 0.09 0.35 0.01 0.00 -0.44 0.00 0.00 34.13 34.15 2uwv s GLU 224 CO 0.13 -0.40 0.05 0.54 0.95 0.00 0.00 175.26 176.52 2uwv s VAL 225 N -3.99 -0.01 0.33 1.83 0.11 -1.26 -4.52 120.40 112.88 2uwv s VAL 225 Ca 0.19 0.04 0.01 0.00 -2.93 0.00 0.00 61.98 59.30 2uwv s VAL 225 Cb 0.04 -0.09 -0.03 0.00 -1.53 0.00 0.00 36.38 34.77 2uwv s VAL 225 CO 0.01 0.02 0.52 0.42 -3.33 0.00 0.00 175.10 172.74 2uwv s THR 226 N 0.25 5.13 0.33 5.04 -4.23 -1.26 -4.16 115.64 116.74 2uwv s THR 226 Ca -0.02 -0.53 0.06 0.00 -1.18 0.00 0.00 61.69 60.02 2uwv s THR 226 Cb -0.03 -3.86 0.31 0.00 1.34 0.00 0.00 72.50 70.26 2uwv s THR 226 CO -0.01 -0.53 1.88 -0.07 -0.54 0.00 0.00 174.62 175.35 2uwv h LEU 227 N 0.81 0.74 -0.19 4.79 3.38 -0.75 0.61 115.31 124.70 2uwv h LEU 227 Ca -0.50 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.48 2uwv h LEU 227 Cb 1.22 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 2uwv h LEU 227 CO 0.61 0.40 0.04 0.25 0.09 0.00 0.00 178.44 179.84 2uwv h LEU 228 N 0.80 0.29 -0.97 1.67 5.85 -1.49 -2.48 115.31 118.98 2uwv h LEU 228 Ca 0.44 -0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.90 2uwv h LEU 228 Cb 0.56 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 2uwv h LEU 228 CO -0.20 0.45 0.45 -0.33 -0.34 0.00 0.00 178.44 178.47 2uwv h GLU 229 N 0.11 1.18 -0.85 1.25 5.08 -1.67 -2.08 114.58 117.60 2uwv h GLU 229 Ca 0.06 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2uwv h GLU 229 Cb 0.27 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 2uwv h GLU 229 CO 0.00 0.87 0.56 0.93 -1.00 0.00 0.00 179.01 180.37 2uwv h GLU 230 N 1.18 1.11 -0.26 2.33 5.08 -0.79 0.17 114.58 123.41 2uwv h GLU 230 Ca 0.30 -0.07 -0.17 0.00 -1.00 0.00 0.00 59.36 58.42 2uwv h GLU 230 Cb 0.04 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 29.04 2uwv h GLU 230 CO -0.05 0.74 -0.52 -0.44 -1.00 0.00 0.00 179.01 177.75 2uwv h ASP 231 N 1.15 0.81 -0.19 1.42 5.19 -1.08 0.40 116.42 124.11 2uwv h ASP 231 Ca 0.31 -0.42 -0.09 0.00 -0.62 0.00 0.00 57.03 56.21 2uwv h ASP 231 Cb -0.13 -0.23 -0.00 0.00 0.18 0.00 0.00 39.33 39.15 2uwv h ASP 231 CO -0.07 1.17 -0.24 0.11 -3.12 0.00 0.00 179.24 177.10 2uwv h LYS 232 N 0.57 0.50 0.44 3.56 1.57 -0.89 0.55 116.57 122.87 2uwv h LYS 232 Ca 0.02 -0.28 -0.02 0.00 -1.87 0.00 0.00 60.65 58.50 2uwv h LYS 232 Cb 1.09 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.42 2uwv h LYS 232 CO 0.11 0.87 -0.21 0.82 -0.57 0.00 0.00 179.45 180.46 2uwv h ILE 233 N 0.16 0.57 -0.70 1.86 2.04 -0.85 -1.85 117.51 118.73 2uwv h ILE 233 Ca 0.02 -0.06 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 2uwv h ILE 233 Cb 0.80 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 2uwv h ILE 233 CO 0.06 0.01 0.26 0.00 0.00 0.00 0.00 178.15 178.48 2uwv h GLY 235 N 1.08 0.88 0.90 0.00 0.00 -0.90 -1.68 103.07 103.35 2uwv h GLY 235 Ca 0.23 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 2uwv h GLY 235 CO -0.02 0.47 -0.06 -1.82 0.00 0.00 0.00 176.54 175.11 2uwv h TYR 236 N 0.74 -0.15 -0.24 5.60 3.20 -1.01 -0.93 116.97 124.18 2uwv h TYR 236 Ca 0.18 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.07 2uwv h TYR 236 Cb 0.23 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.53 2uwv h TYR 236 CO 0.01 -0.01 0.07 0.28 -1.64 0.00 0.00 178.16 176.87 2uwv h VAL 237 N -0.26 0.92 -0.18 1.81 2.07 -1.33 -2.03 116.25 117.24 2uwv h VAL 237 Ca -0.02 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2uwv h VAL 237 Cb 0.21 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 2uwv h VAL 237 CO 0.03 0.03 0.12 0.00 0.02 0.00 0.00 177.57 177.77 2uwv h ALA 238 N 1.16 1.87 0.00 1.67 0.00 -1.26 -2.24 119.26 120.46 2uwv h ALA 238 Ca 0.11 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2uwv h ALA 238 Cb 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2uwv h ALA 238 CO -0.12 0.12 -0.26 0.78 0.00 0.00 0.00 179.25 179.77 2uwv h GLY 239 N 0.25 0.00 1.46 0.00 0.00 -0.43 -1.67 103.07 102.68 2uwv h GLY 239 Ca 0.07 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.47 2uwv h GLY 239 CO -0.01 0.00 0.21 -1.33 0.00 0.00 0.00 176.54 175.41 2uwv h GLY 240 N 0.99 0.12 0.08 4.60 0.00 -1.11 0.10 103.07 107.85 2uwv h GLY 240 Ca -0.00 -0.04 0.06 0.00 0.00 0.00 0.00 47.33 47.35 2uwv h GLY 240 CO 0.03 0.03 -0.28 1.41 0.00 0.00 0.00 176.54 177.74 2uwv h LEU 241 N 0.09 -0.89 -0.03 3.11 3.38 -1.33 0.10 115.31 119.76 2uwv h LEU 241 Ca 0.14 0.15 -0.08 0.00 0.09 0.00 0.00 57.88 58.18 2uwv h LEU 241 Cb 0.43 0.41 0.01 0.00 0.09 0.00 0.00 40.66 41.60 2uwv h LEU 241 CO -0.01 -0.31 -0.29 -0.03 0.09 0.00 0.00 178.44 177.89 2uwv h MET 242 N -0.28 0.25 0.00 1.13 4.05 -1.64 -3.35 114.93 115.08 2uwv h MET 242 Ca 0.14 -0.23 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2uwv h MET 242 Cb 0.50 0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.35 2uwv h MET 242 CO -0.41 0.91 -0.68 1.88 0.23 0.00 0.00 176.91 178.85 2uwv h TYR 243 N -0.33 0.00 -0.32 1.39 0.05 -0.75 -3.11 116.97 113.89 2uwv h TYR 243 Ca -0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.75 2uwv h TYR 243 Cb 0.99 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.73 2uwv h TYR 243 CO 0.15 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.26 2uwv n ALA 244 N -1.99 2.45 -0.36 3.88 0.00 0.33 -4.60 120.51 120.23 2uwv n ALA 244 Ca 0.02 -0.85 0.07 0.00 0.00 0.00 0.00 53.44 52.68 2uwv n ALA 244 Cb 0.49 -0.93 0.25 0.00 0.00 0.00 0.00 19.45 19.25 2uwv n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2uwv h ALA 245 N 4.38 1.54 -0.71 0.00 0.00 -1.64 -0.45 119.26 122.38 2uwv h ALA 245 Ca 0.00 0.02 0.19 0.00 0.00 0.00 0.00 54.91 55.12 2uwv h ALA 245 Cb 0.84 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 2uwv h ALA 245 CO 0.00 0.22 0.50 -1.35 0.00 0.00 0.00 179.25 178.62 2uwv h PRO 246 N 0.99 0.10 -0.66 0.00 0.11 -1.84 -2.51 132.00 128.18 2uwv h PRO 246 Ca 0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.60 2uwv h PRO 246 Cb 0.49 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.58 2uwv h PRO 246 CO -0.26 0.07 0.00 1.63 -0.21 0.00 0.00 178.00 179.23 2uwv n LYS 247 N -4.38 3.79 -3.85 1.05 5.02 -0.18 -4.86 118.16 114.75 2uwv n LYS 247 Ca 0.14 -2.41 -0.14 0.00 -2.02 0.00 0.00 58.31 53.88 2uwv n LYS 247 Cb 0.71 -2.00 -0.15 0.00 -0.02 0.00 0.00 35.03 33.57 2uwv n LYS 247 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2uwv s ARG 248 N -2.19 0.04 0.00 1.97 3.52 -0.95 -3.88 118.95 117.46 2uwv s ARG 248 Ca 0.42 0.09 0.00 0.00 -0.13 0.00 0.00 55.73 56.11 2uwv s ARG 248 Cb 0.31 -0.19 0.00 0.00 -1.56 0.00 0.00 34.95 33.51 2uwv s ARG 248 CO 0.15 -0.09 0.00 1.17 -0.81 0.00 0.00 175.30 175.72 2uwv n LYS 249 N 3.70 0.00 -1.63 5.12 3.00 -1.26 -4.86 118.16 122.22 2uwv n LYS 249 Ca -0.21 0.00 -0.48 0.00 -0.00 0.00 0.00 58.31 57.62 2uwv n LYS 249 Cb 0.54 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 35.53 2uwv n LYS 249 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2uwv n SER 250 N 0.00 2.33 0.00 3.14 3.41 -1.26 -5.02 113.62 116.22 2uwv n SER 250 Ca 0.00 1.12 0.00 0.00 -0.26 0.00 0.00 58.87 59.73 2uwv n SER 250 Cb 0.00 -1.33 0.00 0.00 -0.26 0.00 0.00 64.21 62.62 2uwv n SER 250 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40