#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klm n LYS 2 N 0.00 0.34 -0.59 3.17 4.01 -1.26 -5.01 118.16 118.83 2klm n LYS 2 Ca 0.00 -3.05 0.08 0.00 -0.51 0.00 0.00 58.31 54.83 2klm n LYS 2 Cb 0.00 -0.40 -0.03 0.00 -0.51 0.00 0.00 35.03 34.10 2klm n LYS 2 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 2klm n LYS 3 N -2.50 -1.25 -4.10 1.97 4.81 -1.26 -5.00 118.16 110.83 2klm n LYS 3 Ca 0.17 0.90 -0.08 0.00 -0.87 0.00 0.00 58.31 58.42 2klm n LYS 3 Cb 0.61 -1.51 -0.10 0.00 0.02 0.00 0.00 35.03 34.05 2klm n LYS 3 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2klm s VAL 4 N -2.14 0.36 -0.01 3.15 1.01 -1.26 -4.82 120.40 116.68 2klm s VAL 4 Ca 0.00 -1.74 0.02 0.00 0.00 0.00 0.00 61.98 60.26 2klm s VAL 4 Cb 0.00 -1.42 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 2klm s VAL 4 CO 0.00 -0.90 0.02 1.33 0.00 0.00 0.00 175.10 175.56 2klm n VAL 5 N 0.25 0.09 -3.52 2.92 0.24 -0.67 -4.94 118.33 112.70 2klm n VAL 5 Ca -0.15 -0.07 -0.05 0.00 -2.04 0.00 0.00 64.34 62.03 2klm n VAL 5 Cb 0.60 -0.41 -0.07 0.00 -1.47 0.00 0.00 33.84 32.50 2klm n VAL 5 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2klm s ALA 6 N -2.09 -1.53 -0.31 2.33 0.00 -0.82 -5.03 121.76 114.30 2klm s ALA 6 Ca -0.01 1.65 -0.06 0.00 0.00 0.00 0.00 51.96 53.55 2klm s ALA 6 Cb 0.01 -1.63 0.03 0.00 0.00 0.00 0.00 23.12 21.52 2klm s ALA 6 CO 0.09 -0.98 0.07 0.54 0.00 0.00 0.00 175.76 175.47 2klm s VAL 7 N 2.71 3.69 -0.89 0.00 0.11 -1.26 0.07 120.40 124.84 2klm s VAL 7 Ca 0.03 -0.98 -0.17 0.00 -2.93 0.00 0.00 61.98 57.93 2klm s VAL 7 Cb -0.13 -3.00 0.16 0.00 -1.53 0.00 0.00 36.38 31.87 2klm s VAL 7 CO -0.16 -0.04 1.00 -0.69 -3.33 0.00 0.00 175.10 171.88 2klm s VAL 8 N 1.42 5.00 -0.18 2.04 1.01 -0.63 -4.82 120.40 124.24 2klm s VAL 8 Ca -0.00 -1.83 -0.29 0.00 0.00 0.00 0.00 61.98 59.86 2klm s VAL 8 Cb -0.18 -4.67 -0.01 0.00 0.00 0.00 0.00 36.38 31.51 2klm s VAL 8 CO 0.02 -1.35 1.21 -0.75 0.00 0.00 0.00 175.10 174.23 2klm s LYS 9 N 1.92 4.24 0.03 2.72 2.20 -1.26 -1.59 119.74 127.99 2klm s LYS 9 Ca 0.27 1.60 -0.12 0.00 -0.36 0.00 0.00 55.97 57.36 2klm s LYS 9 Cb -0.07 -3.73 0.04 0.00 -1.51 0.00 0.00 37.83 32.56 2klm s LYS 9 CO -0.09 -0.68 0.56 1.47 -0.36 0.00 0.00 175.35 176.25 2klm n LEU 10 N 6.51 0.00 -4.95 5.43 -0.00 -0.60 -5.02 117.00 118.37 2klm n LEU 10 Ca 0.13 -0.38 -0.24 0.00 -0.00 0.00 0.00 56.01 55.52 2klm n LEU 10 Cb 0.45 1.05 -0.02 0.00 -0.00 0.00 0.00 43.42 44.90 2klm n LEU 10 CO 0.55 -0.13 0.11 -1.10 -0.00 0.00 0.00 177.39 176.82 2klm s GLN 11 N -2.01 3.48 -0.36 1.47 1.11 -1.26 -1.47 119.66 120.62 2klm s GLN 11 Ca 0.13 -0.43 -0.00 0.00 0.01 0.00 0.00 55.36 55.07 2klm s GLN 11 Cb -0.01 -2.73 0.13 0.00 -1.01 0.00 0.00 33.01 29.39 2klm s GLN 11 CO 0.01 0.24 0.19 -1.17 0.01 0.00 0.00 175.29 174.57 2klm s LEU 12 N -4.13 1.45 0.55 2.90 0.20 -0.03 -4.81 118.68 114.81 2klm s LEU 12 Ca 0.38 -2.07 -0.21 0.00 0.69 0.00 0.00 54.13 52.92 2klm s LEU 12 Cb -0.10 -0.59 -0.05 0.00 -0.43 0.00 0.00 46.19 45.02 2klm s LEU 12 CO 0.34 -0.33 1.33 -2.65 -0.29 0.00 0.00 176.35 174.74 2klm n PRO 13 N 4.23 1.62 -3.97 0.98 -0.02 -1.26 -2.16 135.00 134.43 2klm n PRO 13 Ca 0.06 0.60 -0.35 0.00 -2.02 0.00 0.00 63.50 61.80 2klm n PRO 13 Cb 0.38 -2.54 -0.06 0.00 -0.02 0.00 0.00 33.50 31.26 2klm n PRO 13 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2klm s ALA 14 N -1.30 3.81 -1.52 3.55 0.00 0.17 -3.70 121.76 122.76 2klm s ALA 14 Ca 0.72 -0.74 -0.09 0.00 0.00 0.00 0.00 51.96 51.85 2klm s ALA 14 Cb -0.42 -1.83 0.07 0.00 0.00 0.00 0.00 23.12 20.94 2klm s ALA 14 CO 0.49 0.68 0.69 0.41 0.00 0.00 0.00 175.76 178.03 2klm n GLY 15 N 1.47 -0.36 0.00 0.00 0.00 -1.26 -1.69 105.19 103.35 2klm n GLY 15 Ca -0.15 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2klm n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2klm n LYS 16 N -4.45 0.00 -2.82 1.61 5.02 -1.26 -4.81 118.16 111.45 2klm n LYS 16 Ca -0.11 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.85 2klm n LYS 16 Cb 0.59 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 35.53 2klm n LYS 16 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2klm s ALA 17 N 0.00 3.06 0.25 7.82 0.00 -1.24 -4.94 121.76 126.71 2klm s ALA 17 Ca 0.00 0.40 -0.20 0.00 0.00 0.00 0.00 51.96 52.16 2klm s ALA 17 Cb 0.00 -3.15 0.03 0.00 0.00 0.00 0.00 23.12 20.00 2klm s ALA 17 CO 0.00 0.14 0.67 0.95 0.00 0.00 0.00 175.76 177.51 2klm s THR 18 N -2.14 0.00 0.00 0.00 -4.23 -1.26 -5.01 115.64 103.01 2klm s THR 18 Ca 0.61 -0.86 -0.00 0.00 -1.18 0.00 0.00 61.69 60.26 2klm s THR 18 Cb -0.10 -1.83 -0.00 0.00 1.34 0.00 0.00 72.50 71.91 2klm s THR 18 CO 0.14 -0.01 0.11 -2.65 -0.54 0.00 0.00 174.62 171.67 2klm n PRO 19 N -0.43 0.01 -2.68 3.99 -0.02 -1.26 -3.09 135.00 131.52 2klm n PRO 19 Ca -0.06 -0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.37 2klm n PRO 19 Cb 0.60 -1.50 0.10 0.00 -0.02 0.00 0.00 33.50 32.68 2klm n PRO 19 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2klm n ALA 20 N 2.19 -2.34 -1.81 3.55 0.00 -1.26 -5.08 120.51 115.77 2klm n ALA 20 Ca 0.00 -0.70 -0.29 0.00 0.00 0.00 0.00 53.44 52.45 2klm n ALA 20 Cb 0.00 -2.38 0.13 0.00 0.00 0.00 0.00 19.45 17.20 2klm n ALA 20 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2klm s PRO 21 N 0.10 1.38 0.61 0.00 0.04 -1.18 -4.91 135.00 131.05 2klm s PRO 21 Ca 0.19 0.01 0.31 0.00 0.04 0.00 0.00 61.00 61.55 2klm s PRO 21 Cb 0.28 -1.89 1.72 0.00 0.04 0.00 0.00 34.50 34.65 2klm s PRO 21 CO -0.15 -1.98 2.07 -1.35 0.04 0.00 0.00 177.00 175.64 2klm h PRO 22 N -1.33 0.00 0.00 0.56 0.11 -1.96 -2.85 132.00 126.52 2klm h PRO 22 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2klm h PRO 22 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2klm h PRO 22 CO 0.57 0.00 -0.08 0.28 -0.21 0.00 0.00 178.00 178.56 2klm h VAL 23 N 0.00 0.00 0.00 3.15 2.07 -1.99 -3.46 116.25 116.02 2klm h VAL 23 Ca 0.07 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 67.05 2klm h VAL 23 Cb 0.56 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2klm h VAL 23 CO -0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 2klm n GLY 24 N 1.82 0.54 0.46 2.17 0.00 -1.08 -1.22 105.19 107.89 2klm n GLY 24 Ca -0.01 0.60 -0.14 0.00 0.00 0.00 0.00 46.02 46.47 2klm n GLY 24 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2klm h PRO 25 N 0.00 -0.47 -0.49 1.61 0.11 -1.88 0.92 132.00 131.81 2klm h PRO 25 Ca 0.00 0.03 0.14 0.00 0.11 0.00 0.00 66.00 66.28 2klm h PRO 25 Cb 0.00 0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.20 2klm h PRO 25 CO 0.00 -0.31 0.74 0.00 -0.21 0.00 0.00 178.00 178.22 2klm h ALA 26 N -0.17 2.24 -0.13 -0.75 0.00 -1.52 1.78 119.26 120.71 2klm h ALA 26 Ca 0.05 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2klm h ALA 26 Cb 0.63 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 2klm h ALA 26 CO -0.52 -0.99 -0.22 -0.11 0.00 0.00 0.00 179.25 177.41 2klm n LEU 27 N -3.27 3.18 -2.71 0.00 0.00 0.26 -4.63 117.00 109.83 2klm n LEU 27 Ca 0.10 -3.62 -0.02 0.00 0.00 0.00 0.00 56.01 52.47 2klm n LEU 27 Cb 0.92 -0.54 0.11 0.00 0.00 0.00 0.00 43.42 43.90 2klm n LEU 27 CO 0.20 1.15 0.44 0.61 0.00 0.00 0.00 177.39 179.80 2klm n GLY 28 N -1.12 1.90 0.00 -3.96 0.00 0.60 -4.78 105.19 97.83 2klm n GLY 28 Ca 0.23 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2klm n GLY 28 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2klm n GLN 29 N -1.18 0.64 0.16 1.61 -0.06 -0.98 -4.77 117.38 112.79 2klm n GLN 29 Ca -0.10 0.00 0.13 0.00 -2.00 0.00 0.00 57.00 55.03 2klm n GLN 29 Cb 0.86 -0.05 0.56 0.00 -4.06 0.00 0.00 30.24 27.54 2klm n GLN 29 CO 0.00 0.00 0.00 1.12 -0.20 0.00 0.00 177.06 177.98 2klm h HIS 30 N 0.00 0.00 0.00 3.69 2.07 -1.87 -3.45 115.15 115.59 2klm h HIS 30 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2klm h HIS 30 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 2klm h HIS 30 CO 0.00 0.00 0.00 0.41 -3.07 0.00 0.00 177.93 175.27 2klm n GLY 31 N -0.36 2.95 0.00 6.13 0.00 -1.26 -5.04 105.19 107.61 2klm n GLY 31 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2klm n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2klm n ALA 32 N -0.65 0.00 -3.30 4.61 0.00 -1.26 -5.06 120.51 114.84 2klm n ALA 32 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2klm n ALA 32 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2klm n ALA 32 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2klm n ASN 33 N 0.00 0.65 0.00 0.00 4.13 -1.26 -5.04 115.26 113.74 2klm n ASN 33 Ca 0.00 -0.93 0.00 0.00 1.68 0.00 0.00 54.58 55.33 2klm n ASN 33 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 2klm n ASN 33 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2klm n ILE 34 N 0.00 0.00 -0.33 2.41 2.08 -1.26 -4.72 119.36 117.54 2klm n ILE 34 Ca 0.00 0.00 0.26 0.00 0.56 0.00 0.00 62.75 63.57 2klm n ILE 34 Cb 0.00 -0.28 0.48 0.00 -0.75 0.00 0.00 39.64 39.09 2klm n ILE 34 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2klm h MET 35 N 0.00 0.01 -0.26 0.38 -0.00 -1.97 1.99 114.93 115.07 2klm h MET 35 Ca 0.00 -0.00 0.06 0.00 -0.00 0.00 0.00 59.70 59.76 2klm h MET 35 Cb 0.00 -0.00 -0.06 0.00 -0.00 0.00 0.00 31.60 31.53 2klm h MET 35 CO 0.00 0.01 -0.15 1.49 -0.00 0.00 0.00 176.91 178.25 2klm h GLU 36 N 0.01 -0.12 0.02 -0.10 4.57 -1.97 3.88 114.58 120.86 2klm h GLU 36 Ca 0.76 0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.96 2klm h GLU 36 Cb 1.88 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 30.48 2klm h GLU 36 CO -0.82 -0.08 -0.21 0.35 -1.18 0.00 0.00 179.01 177.07 2klm h PHE 37 N -0.13 -0.61 -0.25 0.92 3.57 0.28 -1.40 116.94 119.33 2klm h PHE 37 Ca 0.14 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.69 2klm h PHE 37 Cb 0.34 0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.32 2klm h PHE 37 CO -0.33 -0.23 0.06 0.28 -2.23 0.00 0.00 178.31 175.86 2klm h VAL 38 N -0.28 0.91 -0.61 1.41 2.07 -0.66 -1.70 116.25 117.39 2klm h VAL 38 Ca 0.00 -0.06 0.08 0.00 0.82 0.00 0.00 66.70 67.54 2klm h VAL 38 Cb 0.29 0.73 -0.10 0.00 -1.52 0.00 0.00 31.29 30.68 2klm h VAL 38 CO -0.13 0.03 -0.51 0.11 0.02 0.00 0.00 177.57 177.09 2klm h LYS 39 N 0.17 -0.23 -0.63 1.57 1.57 0.76 2.11 116.57 121.89 2klm h LYS 39 Ca 0.11 0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.95 2klm h LYS 39 Cb 0.10 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.41 2klm h LYS 39 CO -0.13 -0.15 0.36 0.00 -0.57 0.00 0.00 179.45 178.95 2klm h ALA 40 N 0.37 0.83 -1.19 3.86 0.00 -0.91 1.08 119.26 123.30 2klm h ALA 40 Ca 0.14 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2klm h ALA 40 Cb 0.55 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2klm h ALA 40 CO -0.72 0.05 0.00 0.34 0.00 0.00 0.00 179.25 178.93 2klm n PHE 41 N -4.78 0.00 -0.32 0.00 7.35 0.48 -1.27 117.46 118.92 2klm n PHE 41 Ca 0.07 0.00 0.28 0.00 -0.76 0.00 0.00 57.45 57.04 2klm n PHE 41 Cb 0.14 -0.30 0.53 0.00 0.35 0.00 0.00 39.48 40.19 2klm n PHE 41 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 2klm n ASN 42 N -1.41 0.26 -0.04 -2.13 2.85 0.69 0.17 115.26 115.65 2klm n ASN 42 Ca 0.00 1.66 0.01 0.00 -0.11 0.00 0.00 54.58 56.14 2klm n ASN 42 Cb 0.00 -0.77 0.33 0.00 1.24 0.00 0.00 39.78 40.58 2klm n ASN 42 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2klm h ALA 43 N 1.99 1.49 0.12 5.20 0.00 0.14 1.68 119.26 129.86 2klm h ALA 43 Ca 0.80 -0.12 -0.28 0.00 0.00 0.00 0.00 54.91 55.31 2klm h ALA 43 Cb 2.04 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.64 2klm h ALA 43 CO -0.80 0.40 -1.46 0.00 0.00 0.00 0.00 179.25 177.39 2klm h ALA 44 N 1.58 0.20 -0.39 0.00 0.00 0.32 -1.49 119.26 119.48 2klm h ALA 44 Ca 0.15 -1.11 -0.05 0.00 0.00 0.00 0.00 54.91 53.91 2klm h ALA 44 Cb 0.12 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2klm h ALA 44 CO -0.02 0.86 0.05 1.79 0.00 0.00 0.00 179.25 181.93 2klm h THR 45 N -0.28 1.20 -0.40 0.00 1.35 -0.51 0.28 112.91 114.55 2klm h THR 45 Ca -0.32 -0.74 -0.10 0.00 -0.55 0.00 0.00 66.41 64.70 2klm h THR 45 Cb 1.78 0.85 -0.01 0.00 -1.73 0.00 0.00 68.15 69.04 2klm h THR 45 CO 0.06 0.26 -0.15 0.00 -0.25 0.00 0.00 175.52 175.44 2klm h ALA 46 N 1.49 0.56 0.00 6.62 0.00 0.24 2.40 119.26 130.56 2klm h ALA 46 Ca 0.13 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2klm h ALA 46 Cb 0.29 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 2klm h ALA 46 CO 0.00 0.47 -0.00 -0.97 0.00 0.00 0.00 179.25 178.76 2klm h ASN 47 N 0.62 0.00 0.00 0.00 -0.73 -0.07 -3.36 115.58 112.04 2klm h ASN 47 Ca 0.09 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.26 2klm h ASN 47 Cb 0.69 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.28 2klm h ASN 47 CO 0.05 0.00 0.00 0.80 -0.37 0.00 0.00 177.43 177.91 2klm n MET 48 N -3.10 0.00 0.00 6.67 1.56 0.87 -5.06 117.12 118.06 2klm n MET 48 Ca -0.02 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.41 2klm n MET 48 Cb 0.14 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.51 2klm n MET 48 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2klm n GLY 49 N 3.30 1.04 3.76 -5.12 0.00 0.79 -5.04 105.19 103.92 2klm n GLY 49 Ca 0.00 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.65 2klm n GLY 49 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2klm s ASP 50 N 0.00 6.66 0.00 1.61 -4.77 -1.26 -4.31 116.67 114.60 2klm s ASP 50 Ca 0.00 2.71 0.00 0.00 -3.30 0.00 0.00 52.55 51.96 2klm s ASP 50 Cb 0.00 -2.64 0.00 0.00 -1.09 0.00 0.00 42.92 39.19 2klm s ASP 50 CO 0.00 -0.66 0.00 0.00 0.70 0.00 0.00 175.17 175.21 2klm n ALA 51 N 1.67 0.00 -3.68 2.11 0.00 -0.68 -4.87 120.51 115.06 2klm n ALA 51 Ca 0.04 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.34 2klm n ALA 51 Cb 0.41 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.71 2klm n ALA 51 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2klm s ILE 52 N -1.48 -0.05 -0.04 0.00 -1.09 -1.26 0.43 121.20 117.72 2klm s ILE 52 Ca 0.00 0.18 0.00 0.00 -2.23 0.00 0.00 60.65 58.60 2klm s ILE 52 Cb 0.00 -0.15 0.03 0.00 -1.58 0.00 0.00 42.46 40.76 2klm s ILE 52 CO 0.00 0.07 -0.01 0.68 -1.23 0.00 0.00 174.94 174.46 2klm s VAL 53 N 1.02 0.26 0.50 2.92 -7.23 -0.92 -4.91 120.40 112.04 2klm s VAL 53 Ca -0.08 0.07 -0.21 0.00 -1.81 0.00 0.00 61.98 59.94 2klm s VAL 53 Cb -0.11 -0.36 -0.07 0.00 0.56 0.00 0.00 36.38 36.40 2klm s VAL 53 CO -0.04 0.18 1.12 -2.16 -0.31 0.00 0.00 175.10 173.89 2klm s PRO 54 N 1.19 3.61 0.14 4.82 0.04 -1.26 -0.85 135.00 142.69 2klm s PRO 54 Ca -0.07 1.61 -0.16 0.00 0.04 0.00 0.00 61.00 62.42 2klm s PRO 54 Cb -0.13 -2.18 0.03 0.00 0.04 0.00 0.00 34.50 32.26 2klm s PRO 54 CO -0.02 -0.63 0.41 0.54 0.04 0.00 0.00 177.00 177.34 2klm s VAL 55 N -1.73 0.06 -0.25 -0.36 0.11 -0.54 -4.83 120.40 112.86 2klm s VAL 55 Ca 0.68 -0.65 -0.04 0.00 -2.93 0.00 0.00 61.98 59.04 2klm s VAL 55 Cb -0.24 -1.26 0.09 0.00 -1.53 0.00 0.00 36.38 33.44 2klm s VAL 55 CO 0.28 -0.29 0.11 -1.61 -3.33 0.00 0.00 175.10 170.27 2klm s GLU 56 N -3.82 0.19 -0.97 1.54 2.02 -1.26 -1.56 118.70 114.84 2klm s GLU 56 Ca 0.05 -0.42 -0.24 0.00 0.02 0.00 0.00 54.97 54.37 2klm s GLU 56 Cb 0.01 -1.42 -0.08 0.00 0.10 0.00 0.00 34.13 32.75 2klm s GLU 56 CO -0.10 -0.91 2.01 0.42 0.02 0.00 0.00 175.26 176.70 2klm s ILE 57 N 2.08 3.40 -0.54 -1.63 1.01 -0.62 -4.65 121.20 120.24 2klm s ILE 57 Ca 0.07 -0.45 -0.27 0.00 0.00 0.00 0.00 60.65 59.99 2klm s ILE 57 Cb -0.16 -4.03 -0.01 0.00 0.01 0.00 0.00 42.46 38.26 2klm s ILE 57 CO -0.28 -0.80 1.74 -0.89 0.00 0.00 0.00 174.94 174.71 2klm s THR 58 N 11.24 3.48 -0.21 2.92 2.01 -0.60 -1.61 115.64 132.87 2klm s THR 58 Ca 0.73 0.37 -0.08 0.00 0.31 0.00 0.00 61.69 63.02 2klm s THR 58 Cb -0.06 -4.00 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 2klm s THR 58 CO 0.05 -0.88 0.08 -0.63 -0.69 0.00 0.00 174.62 172.56 2klm s ILE 59 N 7.92 4.75 -0.08 1.82 1.01 0.11 -0.14 121.20 136.59 2klm s ILE 59 Ca 0.66 -0.04 -0.03 0.00 0.00 0.00 0.00 60.65 61.24 2klm s ILE 59 Cb -0.14 -3.18 -0.04 0.00 0.01 0.00 0.00 42.46 39.11 2klm s ILE 59 CO 0.24 0.40 0.06 -0.31 0.00 0.00 0.00 174.94 175.34 2klm s TYR 60 N 0.88 3.33 0.64 3.97 1.51 -0.18 -1.67 117.35 125.84 2klm s TYR 60 Ca 0.04 0.31 0.26 0.00 -1.01 0.00 0.00 57.07 56.68 2klm s TYR 60 Cb -0.14 -1.83 1.38 0.00 -0.11 0.00 0.00 41.96 41.27 2klm s TYR 60 CO 0.03 0.58 1.79 0.00 -1.11 0.00 0.00 175.55 176.83 2klm h ALA 61 N 4.88 1.74 0.00 3.71 0.00 -1.90 0.87 119.26 128.57 2klm h ALA 61 Ca -0.52 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2klm h ALA 61 Cb 1.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2klm h ALA 61 CO 0.57 -0.58 0.00 -3.47 0.00 0.00 0.00 179.25 175.77 2klm n ASP 62 N -3.13 0.00 -3.00 0.00 2.03 -1.26 -4.77 116.55 106.42 2klm n ASP 62 Ca 0.03 -0.72 -0.01 0.00 0.52 0.00 0.00 54.79 54.60 2klm n ASP 62 Cb 0.58 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.99 2klm n ASP 62 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2klm n ARG 63 N -0.54 -1.35 -3.75 -0.67 1.74 0.30 -5.05 116.66 107.34 2klm n ARG 63 Ca 0.01 1.39 -0.13 0.00 -0.77 0.00 0.00 57.85 58.35 2klm n ARG 63 Cb 0.00 -5.57 -0.13 0.00 -1.02 0.00 0.00 32.46 25.74 2klm n ARG 63 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2klm s SER 64 N -3.00 -0.24 -0.42 0.55 0.01 -0.86 -4.98 113.70 104.76 2klm s SER 64 Ca 0.05 0.49 -0.06 0.00 1.31 0.00 0.00 55.95 57.73 2klm s SER 64 Cb -0.01 0.40 0.10 0.00 0.21 0.00 0.00 66.02 66.72 2klm s SER 64 CO 0.71 -0.14 0.24 -0.36 0.41 0.00 0.00 173.24 174.10 2klm s PHE 65 N 0.99 3.44 -0.27 2.43 0.40 -1.26 -1.01 117.98 122.69 2klm s PHE 65 Ca -0.07 -1.95 -0.15 0.00 -0.60 0.00 0.00 56.93 54.16 2klm s PHE 65 Cb -0.08 -3.12 -0.03 0.00 0.51 0.00 0.00 43.02 40.29 2klm s PHE 65 CO -0.06 -0.92 0.38 0.99 0.70 0.00 0.00 175.22 176.30 2klm s THR 66 N 1.30 5.17 0.00 0.64 2.01 0.80 -4.90 115.64 120.65 2klm s THR 66 Ca 0.05 0.55 0.00 0.00 0.31 0.00 0.00 61.69 62.60 2klm s THR 66 Cb -0.23 -3.72 0.00 0.00 0.01 0.00 0.00 72.50 68.56 2klm s THR 66 CO -0.01 0.13 0.00 2.22 -0.69 0.00 0.00 174.62 176.27 2klm n PHE 67 N 5.35 0.00 -3.69 4.92 -1.74 -1.26 -1.56 117.46 119.48 2klm n PHE 67 Ca -0.08 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.69 2klm n PHE 67 Cb 0.51 0.00 -0.09 0.00 1.52 0.00 0.00 39.48 41.41 2klm n PHE 67 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 2klm s VAL 68 N 0.00 -0.01 0.00 1.97 1.01 -1.26 -5.02 120.40 117.10 2klm s VAL 68 Ca 0.00 0.02 -0.02 0.00 0.00 0.00 0.00 61.98 61.98 2klm s VAL 68 Cb 0.00 -0.73 -0.01 0.00 0.00 0.00 0.00 36.38 35.64 2klm s VAL 68 CO 0.00 0.01 0.03 0.42 0.00 0.00 0.00 175.10 175.56 2klm s THR 69 N 0.69 0.07 0.22 3.92 -4.23 -1.26 -5.10 115.64 109.95 2klm s THR 69 Ca -0.03 -0.59 -0.02 0.00 -1.18 0.00 0.00 61.69 59.86 2klm s THR 69 Cb -0.05 -0.25 -0.03 0.00 1.34 0.00 0.00 72.50 73.51 2klm s THR 69 CO -0.05 -0.33 0.20 -0.54 -0.54 0.00 0.00 174.62 173.36 2klm s LYS 70 N -1.01 1.31 -1.00 3.99 1.02 -1.26 -5.01 119.74 117.79 2klm s LYS 70 Ca -0.11 -1.62 -0.27 0.00 0.02 0.00 0.00 55.97 53.99 2klm s LYS 70 Cb -0.07 0.31 -0.24 0.00 -0.52 0.00 0.00 37.83 37.31 2klm s LYS 70 CO -0.00 -0.46 2.59 -2.37 -0.92 0.00 0.00 175.35 174.19 2klm n THR 71 N -0.32 -0.00 -0.73 2.17 5.66 -1.26 -4.84 114.28 114.95 2klm n THR 71 Ca 0.02 -0.10 -0.14 0.00 -3.05 0.00 0.00 64.05 60.78 2klm n THR 71 Cb 0.65 -0.42 0.05 0.00 -1.55 0.00 0.00 70.33 69.06 2klm n THR 71 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 2klm n PRO 72 N 7.93 -0.71 -1.54 1.09 -0.02 -1.26 -4.62 135.00 135.88 2klm n PRO 72 Ca 0.66 -0.21 -0.52 0.00 -2.02 0.00 0.00 63.50 61.42 2klm n PRO 72 Cb 0.06 -1.16 -0.07 0.00 -0.02 0.00 0.00 33.50 32.31 2klm n PRO 72 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2klm n PRO 73 N 0.86 1.28 -0.68 0.52 -0.02 -1.26 -4.55 135.00 131.15 2klm n PRO 73 Ca 0.01 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 2klm n PRO 73 Cb 0.27 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.32 2klm n PRO 73 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2klm n ALA 74 N 8.50 0.00 0.02 3.55 0.00 -1.26 -4.93 120.51 126.39 2klm n ALA 74 Ca 0.35 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.93 2klm n ALA 74 Cb 0.22 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.88 2klm n ALA 74 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2klm n SER 75 N 0.00 0.00 -0.35 0.00 3.41 -1.26 0.86 113.62 116.28 2klm n SER 75 Ca 0.00 0.55 0.25 0.00 -0.26 0.00 0.00 58.87 59.41 2klm n SER 75 Cb 0.00 -0.13 0.53 0.00 -0.26 0.00 0.00 64.21 64.35 2klm n SER 75 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2klm h TYR 76 N 0.00 0.67 0.00 7.33 3.20 -1.84 -1.65 116.97 124.68 2klm h TYR 76 Ca 0.24 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.11 2klm h TYR 76 Cb 2.15 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 40.23 2klm h TYR 76 CO 0.00 -0.01 -1.08 1.28 -1.64 0.00 0.00 178.16 176.72 2klm n LEU 77 N -4.68 1.27 -0.34 2.82 4.32 0.25 -4.65 117.00 115.99 2klm n LEU 77 Ca 0.28 -0.00 0.21 0.00 -0.02 0.00 0.00 56.01 56.48 2klm n LEU 77 Cb 0.98 -0.01 0.45 0.00 -1.62 0.00 0.00 43.42 43.23 2klm n LEU 77 CO 0.23 0.24 1.19 0.40 -1.22 0.00 0.00 177.39 178.22 2klm h ILE 78 N 0.00 0.50 -0.65 -0.08 2.04 -1.28 0.40 117.51 118.43 2klm h ILE 78 Ca -0.03 -0.16 0.12 0.00 1.00 0.00 0.00 64.86 65.79 2klm h ILE 78 Cb 1.06 -0.01 -0.09 0.00 -0.74 0.00 0.00 36.82 37.04 2klm h ILE 78 CO -0.00 0.09 0.18 0.03 0.00 0.00 0.00 178.15 178.45 2klm h ARG 79 N 0.47 0.31 0.46 2.37 2.47 -1.55 1.76 114.38 120.67 2klm h ARG 79 Ca 0.64 -0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 59.32 2klm h ARG 79 Cb 1.42 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.68 2klm h ARG 79 CO -0.41 0.21 -0.22 -0.22 0.56 0.00 0.00 179.97 179.89 2klm h LYS 80 N 0.32 -0.59 0.00 0.04 3.11 -0.48 0.65 116.57 119.61 2klm h LYS 80 Ca 0.35 0.04 0.00 0.00 -2.81 0.00 0.00 60.65 58.23 2klm h LYS 80 Cb 0.52 0.14 0.00 0.00 -1.00 0.00 0.00 32.23 31.89 2klm h LYS 80 CO -0.40 -0.40 0.37 0.00 -2.81 0.00 0.00 179.45 176.21 2klm h ALA 81 N -1.50 1.36 -2.29 5.00 0.00 -0.98 -3.14 119.26 117.72 2klm h ALA 81 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2klm h ALA 81 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2klm h ALA 81 CO 0.10 -0.36 0.00 0.00 0.00 0.00 0.00 179.25 179.00 2klm n ALA 82 N -1.82 0.00 0.00 0.00 0.00 0.60 -4.31 120.51 114.97 2klm n ALA 82 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2klm n ALA 82 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 2klm n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2klm n GLY 83 N 2.32 0.94 3.54 0.00 0.00 0.22 -4.34 105.19 107.87 2klm n GLY 83 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2klm n GLY 83 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2klm s LEU 84 N 0.00 4.49 -0.17 0.99 1.43 -1.25 -4.84 118.68 119.34 2klm s LEU 84 Ca 0.00 -0.35 -0.16 0.00 -1.03 0.00 0.00 54.13 52.59 2klm s LEU 84 Cb 0.00 -2.22 -0.22 0.00 0.03 0.00 0.00 46.19 43.78 2klm s LEU 84 CO 0.00 -0.27 0.28 1.05 0.23 0.00 0.00 176.35 177.64 2klm h GLU 85 N 8.48 0.11 -3.14 1.70 4.11 -1.99 -3.49 114.58 120.36 2klm h GLU 85 Ca -0.31 -0.19 -0.11 0.00 0.07 0.00 0.00 59.36 58.83 2klm h GLU 85 Cb 1.15 0.07 -0.19 0.00 0.50 0.00 0.00 28.75 30.28 2klm h GLU 85 CO 0.66 1.09 -0.26 -1.59 0.07 0.00 0.00 179.01 178.98 2klm s LYS 86 N -2.44 0.73 0.00 1.06 -2.85 -1.26 -5.00 119.74 109.98 2klm s LYS 86 Ca -0.26 -0.32 0.00 0.00 -1.00 0.00 0.00 55.97 54.39 2klm s LYS 86 Cb 0.06 0.32 0.00 0.00 -2.06 0.00 0.00 37.83 36.15 2klm s LYS 86 CO 0.66 -0.22 0.78 0.41 0.10 0.00 0.00 175.35 177.09 2klm n GLY 87 N 0.97 -0.29 1.03 0.59 0.00 -1.26 -4.92 105.19 101.32 2klm n GLY 87 Ca -0.20 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.95 2klm n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2klm n ALA 88 N -1.28 -3.20 0.21 4.61 0.00 -1.26 -4.99 120.51 114.60 2klm n ALA 88 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2klm n ALA 88 Cb 0.01 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.42 2klm n ALA 88 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2klm n HIS 89 N -3.07 -4.09 -2.83 0.00 8.25 -1.26 -5.12 115.22 107.09 2klm n HIS 89 Ca 0.01 1.28 -0.35 0.00 -0.26 0.00 0.00 57.72 58.40 2klm n HIS 89 Cb 0.45 3.03 -0.07 0.00 1.12 0.00 0.00 29.99 34.53 2klm n HIS 89 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 2klm s LYS 90 N -1.95 4.37 0.52 -0.41 -2.85 -1.26 -5.01 119.74 113.15 2klm s LYS 90 Ca 0.00 1.18 -0.21 0.00 -1.00 0.00 0.00 55.97 55.94 2klm s LYS 90 Cb 0.00 -2.48 -0.07 0.00 -2.06 0.00 0.00 37.83 33.22 2klm s LYS 90 CO 0.00 0.12 1.00 -2.30 0.10 0.00 0.00 175.35 174.28 2klm n PRO 91 N -0.07 1.18 0.00 1.78 -0.02 -1.26 -4.94 135.00 131.66 2klm n PRO 91 Ca 0.04 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2klm n PRO 91 Cb 0.52 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 2klm n PRO 91 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2klm n GLY 92 N 1.21 1.64 3.80 -1.23 0.00 -1.26 -5.12 105.19 104.22 2klm n GLY 92 Ca 0.11 -0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 2klm n GLY 92 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2klm s ARG 93 N 1.15 3.91 0.00 1.61 6.06 -1.26 -4.96 118.95 125.45 2klm s ARG 93 Ca 0.00 0.02 0.00 0.00 -2.50 0.00 0.00 55.73 53.25 2klm s ARG 93 Cb 0.00 -3.31 0.00 0.00 0.06 0.00 0.00 34.95 31.70 2klm s ARG 93 CO 0.00 0.51 0.87 -0.85 -2.50 0.00 0.00 175.30 173.33 2klm n GLU 94 N 2.71 0.89 -3.45 5.12 0.28 -1.26 -4.49 120.64 120.44 2klm n GLU 94 Ca -0.16 0.00 -0.21 0.00 -0.16 0.00 0.00 57.16 56.64 2klm n GLU 94 Cb 0.53 -1.08 -0.12 0.00 1.43 0.00 0.00 31.44 32.21 2klm n GLU 94 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2klm s LYS 95 N 0.04 0.27 0.05 3.44 1.02 -1.26 -5.14 119.74 118.15 2klm s LYS 95 Ca 0.00 -0.21 -0.07 0.00 0.02 0.00 0.00 55.97 55.70 2klm s LYS 95 Cb 0.00 -0.88 -0.01 0.00 -0.52 0.00 0.00 37.83 36.43 2klm s LYS 95 CO 0.00 -0.98 0.14 0.54 -0.92 0.00 0.00 175.35 174.13 2klm s VAL 96 N 2.28 0.13 -0.39 3.17 0.11 -1.26 -5.00 120.40 119.43 2klm s VAL 96 Ca 0.09 -1.07 -0.12 0.00 -2.93 0.00 0.00 61.98 57.95 2klm s VAL 96 Cb -0.15 -1.01 0.01 0.00 -1.53 0.00 0.00 36.38 33.71 2klm s VAL 96 CO -0.31 -0.59 0.44 0.61 -3.33 0.00 0.00 175.10 171.91 2klm n GLY 97 N 0.57 -2.05 2.68 6.54 0.00 -1.26 -4.56 105.19 107.11 2klm n GLY 97 Ca -0.18 1.04 -0.29 0.00 0.00 0.00 0.00 46.02 46.59 2klm n GLY 97 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2klm s ARG 98 N -2.33 0.54 0.08 1.61 3.52 -1.26 -1.62 118.95 119.50 2klm s ARG 98 Ca 0.18 -0.66 0.02 0.00 -0.13 0.00 0.00 55.73 55.14 2klm s ARG 98 Cb -0.05 -1.84 -0.04 0.00 -1.56 0.00 0.00 34.95 31.46 2klm s ARG 98 CO 0.75 -0.85 0.11 0.96 -0.81 0.00 0.00 175.30 175.46 2klm s ILE 99 N 1.84 4.71 0.39 4.11 -4.36 -1.11 -4.64 121.20 122.14 2klm s ILE 99 Ca 0.05 -0.70 -0.08 0.00 -0.26 0.00 0.00 60.65 59.66 2klm s ILE 99 Cb -0.17 -3.28 -0.06 0.00 1.25 0.00 0.00 42.46 40.21 2klm s ILE 99 CO -0.21 0.12 0.72 0.42 0.24 0.00 0.00 174.94 176.23 2klm s THR 100 N -1.43 4.87 0.07 8.37 -4.23 -1.26 -1.42 115.64 120.61 2klm s THR 100 Ca 0.30 0.39 -0.29 0.00 -1.18 0.00 0.00 61.69 60.92 2klm s THR 100 Cb -0.12 -3.76 -0.18 0.00 1.34 0.00 0.00 72.50 69.78 2klm s THR 100 CO 0.23 -0.53 1.60 -0.25 -0.54 0.00 0.00 174.62 175.13 2klm h TRP 101 N 1.17 -0.55 -0.97 3.99 2.91 -1.93 -2.05 115.95 118.51 2klm h TRP 101 Ca -0.47 -0.01 0.03 0.00 1.13 0.00 0.00 58.89 59.56 2klm h TRP 101 Cb 1.19 0.18 -0.05 0.00 -0.51 0.00 0.00 29.16 29.97 2klm h TRP 101 CO 0.59 -0.32 0.64 1.49 -1.03 0.00 0.00 178.44 179.81 2klm h GLU 102 N -0.65 1.22 -0.31 2.65 4.57 -1.98 -1.29 114.58 118.79 2klm h GLU 102 Ca -0.06 -0.07 0.01 0.00 -1.18 0.00 0.00 59.36 58.06 2klm h GLU 102 Cb 0.48 -0.28 -0.02 0.00 -0.16 0.00 0.00 28.75 28.78 2klm h GLU 102 CO 0.10 0.81 0.18 1.96 -1.18 0.00 0.00 179.01 180.88 2klm h GLN 103 N 1.26 0.37 0.00 1.92 4.20 -1.93 -0.06 115.11 120.87 2klm h GLN 103 Ca 0.38 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 59.01 2klm h GLN 103 Cb -0.05 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 2klm h GLN 103 CO -0.11 0.24 -0.25 -0.39 -0.67 0.00 0.00 178.83 177.65 2klm h VAL 104 N 0.38 1.09 0.00 -0.54 -1.51 -0.96 -0.64 116.25 114.06 2klm h VAL 104 Ca 0.12 -0.88 0.00 0.00 -1.23 0.00 0.00 66.70 64.71 2klm h VAL 104 Cb -0.01 1.49 0.00 0.00 -2.13 0.00 0.00 31.29 30.64 2klm h VAL 104 CO -0.05 0.24 0.00 0.18 -1.23 0.00 0.00 177.57 176.71 2klm n LEU 105 N -4.11 0.27 -0.28 4.19 4.77 -0.29 0.26 117.00 121.81 2klm n LEU 105 Ca -0.02 0.69 0.05 0.00 -0.03 0.00 0.00 56.01 56.70 2klm n LEU 105 Cb 0.31 -0.30 0.14 0.00 -2.33 0.00 0.00 43.42 41.25 2klm n LEU 105 CO 0.36 -0.30 0.75 -0.33 -1.33 0.00 0.00 177.39 176.55 2klm h GLU 106 N 0.00 0.03 0.00 3.23 5.08 -1.10 3.12 114.58 124.94 2klm h GLU 106 Ca 0.00 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2klm h GLU 106 Cb 0.00 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2klm h GLU 106 CO 0.00 0.02 -0.02 0.82 -1.00 0.00 0.00 179.01 178.84 2klm h ILE 107 N 0.04 0.54 -0.02 3.13 2.04 -1.13 0.17 117.51 122.28 2klm h ILE 107 Ca 0.43 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 66.22 2klm h ILE 107 Cb 0.72 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 2klm h ILE 107 CO -0.79 0.02 -0.02 0.00 0.00 0.00 0.00 178.15 177.35 2klm n ALA 108 N -2.32 2.52 -0.47 1.87 0.00 0.76 -3.94 120.51 118.93 2klm n ALA 108 Ca -0.03 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.78 2klm n ALA 108 Cb 0.10 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 18.97 2klm n ALA 108 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2klm n LYS 109 N 0.90 0.00 -0.05 0.00 0.00 0.87 -4.67 118.16 115.21 2klm n LYS 109 Ca 0.10 0.14 -0.16 0.00 0.00 0.00 0.00 58.31 58.39 2klm n LYS 109 Cb 0.43 -0.53 -0.06 0.00 0.00 0.00 0.00 35.03 34.86 2klm n LYS 109 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.40 179.36 2klm h GLN 110 N 0.00 0.76 -4.76 1.64 4.20 -1.73 -3.37 115.11 111.84 2klm h GLN 110 Ca 0.00 -0.56 -0.62 0.00 0.06 0.00 0.00 58.65 57.54 2klm h GLN 110 Cb 0.00 0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 2klm h GLN 110 CO 0.00 1.18 2.31 1.63 -0.67 0.00 0.00 178.83 183.28 2klm n LYS 111 N -4.05 2.22 -2.66 1.46 4.01 -1.25 -4.33 118.16 113.56 2klm n LYS 111 Ca -0.06 -2.43 -0.03 0.00 -0.51 0.00 0.00 58.31 55.27 2klm n LYS 111 Cb 0.66 -3.28 0.11 0.00 -0.51 0.00 0.00 35.03 32.01 2klm n LYS 111 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2klm n MET 112 N 7.21 0.12 -0.28 1.97 0.00 -1.26 -4.59 117.12 120.30 2klm n MET 112 Ca 0.49 -0.67 0.05 0.00 0.00 0.00 0.00 57.70 57.58 2klm n MET 112 Cb 0.42 -0.13 0.20 0.00 0.00 0.00 0.00 33.22 33.70 2klm n MET 112 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 175.97 174.62 2klm h PRO 113 N 2.29 0.58 0.00 3.17 0.11 -1.91 -3.42 132.00 132.82 2klm h PRO 113 Ca -0.31 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.76 2klm h PRO 113 Cb 1.22 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2klm h PRO 113 CO -0.05 0.38 0.00 -3.47 -0.21 0.00 0.00 178.00 174.66 2klm n ASP 114 N -4.88 -0.58 0.00 -2.05 2.03 -1.26 -5.04 116.55 104.77 2klm n ASP 114 Ca 0.15 0.46 0.00 0.00 0.52 0.00 0.00 54.79 55.92 2klm n ASP 114 Cb 0.39 0.73 0.00 0.00 -0.72 0.00 0.00 41.12 41.52 2klm n ASP 114 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2klm n LEU 115 N -3.32 0.00 0.00 -2.67 0.00 -1.26 -2.53 117.00 107.21 2klm n LEU 115 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 2klm n LEU 115 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.42 2klm n LEU 115 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 177.39 174.19 2klm n ASN 116 N 0.97 0.00 -4.06 1.96 5.15 -1.26 -5.16 115.26 112.86 2klm n ASN 116 Ca 0.00 -0.26 -0.12 0.00 -0.60 0.00 0.00 54.58 53.59 2klm n ASN 116 Cb 0.00 0.00 -0.09 0.00 -0.53 0.00 0.00 39.78 39.16 2klm n ASN 116 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2klm s THR 117 N 0.00 0.00 0.00 -0.44 -4.23 -1.05 -4.98 115.64 104.94 2klm s THR 117 Ca 0.00 -1.91 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 2klm s THR 117 Cb 0.00 -2.47 0.00 0.00 1.34 0.00 0.00 72.50 71.37 2klm s THR 117 CO 0.00 0.00 0.00 1.07 -0.54 0.00 0.00 174.62 175.15 2klm n THR 118 N -0.33 0.00 -2.76 3.99 5.66 -1.26 -4.80 114.28 114.79 2klm n THR 118 Ca 0.02 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.71 2klm n THR 118 Cb 0.65 -0.04 -0.04 0.00 -1.55 0.00 0.00 70.33 69.35 2klm n THR 118 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2klm s ASP 119 N -3.03 6.64 0.15 1.09 1.01 -1.26 -4.92 116.67 116.36 2klm s ASP 119 Ca 0.00 1.36 -0.17 0.00 0.71 0.00 0.00 52.55 54.45 2klm s ASP 119 Cb 0.00 -2.41 0.00 0.00 1.01 0.00 0.00 42.92 41.52 2klm s ASP 119 CO 0.00 -0.42 1.80 -0.07 0.21 0.00 0.00 175.17 176.69 2klm h LEU 120 N 1.40 0.44 -0.85 1.23 3.38 -1.98 -1.03 115.31 117.89 2klm h LEU 120 Ca -0.47 -0.02 0.10 0.00 0.09 0.00 0.00 57.88 57.58 2klm h LEU 120 Cb 1.18 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 41.75 2klm h LEU 120 CO 0.63 0.33 0.49 -0.33 0.09 0.00 0.00 178.44 179.65 2klm h GLU 121 N 0.51 0.78 0.17 1.13 5.08 -1.97 2.18 114.58 122.46 2klm h GLU 121 Ca 0.14 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2klm h GLU 121 Cb -0.04 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.03 2klm h GLU 121 CO -0.03 0.52 -0.08 0.00 -1.00 0.00 0.00 179.01 178.42 2klm h ALA 122 N 1.48 -0.58 -0.93 3.43 0.00 -1.81 -1.22 119.26 119.62 2klm h ALA 122 Ca 0.42 -0.05 0.21 0.00 0.00 0.00 0.00 54.91 55.49 2klm h ALA 122 Cb 0.41 0.09 -0.12 0.00 0.00 0.00 0.00 17.79 18.17 2klm h ALA 122 CO -0.26 -0.57 0.48 0.00 0.00 0.00 0.00 179.25 178.90 2klm h ALA 123 N -1.75 1.54 -0.96 0.00 0.00 -1.09 0.75 119.26 117.75 2klm h ALA 123 Ca -0.02 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2klm h ALA 123 Cb 0.17 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2klm h ALA 123 CO 0.04 -0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.04 2klm n ALA 124 N -2.41 -0.22 -0.53 0.00 0.00 0.73 -1.10 120.51 116.97 2klm n ALA 124 Ca 0.23 0.00 0.44 0.00 0.00 0.00 0.00 53.44 54.11 2klm n ALA 124 Cb 0.64 0.15 0.76 0.00 0.00 0.00 0.00 19.45 21.00 2klm n ALA 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2klm h ARG 125 N 0.00 0.03 0.00 0.00 3.08 -0.58 0.21 114.38 117.12 2klm h ARG 125 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2klm h ARG 125 Cb 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2klm h ARG 125 CO 0.00 0.02 0.00 -0.12 -1.07 0.00 0.00 179.97 178.80 2klm n MET 126 N -4.16 0.00 -0.19 0.04 1.56 0.20 0.35 117.12 114.92 2klm n MET 126 Ca 0.37 0.34 -0.01 0.00 -0.27 0.00 0.00 57.70 58.13 2klm n MET 126 Cb 1.64 -1.33 0.07 0.00 2.15 0.00 0.00 33.22 35.75 2klm n MET 126 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 2klm h ILE 127 N 0.00 0.46 0.00 1.12 5.03 0.38 2.64 117.51 127.13 2klm h ILE 127 Ca 0.00 -0.01 0.00 0.00 -0.12 0.00 0.00 64.86 64.73 2klm h ILE 127 Cb 0.00 0.42 0.00 0.00 -3.03 0.00 0.00 36.82 34.21 2klm h ILE 127 CO 0.00 0.01 0.00 0.00 -0.68 0.00 0.00 178.15 177.48 2klm n ALA 128 N -2.90 -0.31 -0.31 1.87 0.00 -0.10 -0.20 120.51 118.56 2klm n ALA 128 Ca 0.07 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.57 2klm n ALA 128 Cb 0.31 0.00 0.15 0.00 0.00 0.00 0.00 19.45 19.91 2klm n ALA 128 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2klm h GLY 129 N 0.00 0.75 0.45 0.00 0.00 0.62 2.24 103.07 107.13 2klm h GLY 129 Ca 0.00 0.26 0.10 0.00 0.00 0.00 0.00 47.33 47.69 2klm h GLY 129 CO 0.00 -0.36 0.42 1.76 0.00 0.00 0.00 176.54 178.37 2klm h SER 130 N 0.01 0.57 -0.38 0.19 0.02 0.47 0.39 113.55 114.82 2klm h SER 130 Ca 0.45 0.06 0.05 0.00 -0.84 0.00 0.00 61.79 61.51 2klm h SER 130 Cb 0.74 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.19 2klm h SER 130 CO -0.89 0.31 0.10 0.00 -1.14 0.00 0.00 176.83 175.21 2klm h ALA 131 N 1.46 0.42 -0.89 3.77 0.00 0.69 0.38 119.26 125.09 2klm h ALA 131 Ca 0.39 0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.46 2klm h ALA 131 Cb 0.42 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.19 2klm h ALA 131 CO -0.27 -0.30 0.53 -0.09 0.00 0.00 0.00 179.25 179.12 2klm h ARG 132 N 0.24 0.85 0.00 0.00 1.12 0.21 1.12 114.38 117.93 2klm h ARG 132 Ca 0.18 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 58.99 2klm h ARG 132 Cb 0.18 -0.19 0.00 0.00 -0.01 0.00 0.00 29.97 29.95 2klm h ARG 132 CO -0.21 0.57 0.00 0.45 -3.11 0.00 0.00 179.97 177.67 2klm n SER 133 N -4.69 0.00 -0.27 -3.80 2.88 0.11 -2.82 113.62 105.02 2klm n SER 133 Ca 0.15 0.94 -0.09 0.00 -1.33 0.00 0.00 58.87 58.54 2klm n SER 133 Cb 0.29 -0.44 -0.08 0.00 -0.75 0.00 0.00 64.21 63.24 2klm n SER 133 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 2klm h MET 134 N 0.00 -0.08 0.00 -1.46 2.86 0.05 -3.45 114.93 112.84 2klm h MET 134 Ca 0.00 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2klm h MET 134 Cb 0.00 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.68 2klm h MET 134 CO 0.00 -0.06 0.00 0.41 1.06 0.00 0.00 176.91 178.32 2klm n GLY 135 N -1.23 0.00 3.26 8.32 0.00 0.36 -5.09 105.19 110.82 2klm n GLY 135 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 2klm n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2klm s VAL 136 N 0.00 0.76 0.12 1.61 1.01 0.44 -4.81 120.40 119.53 2klm s VAL 136 Ca 0.00 -2.00 0.03 0.00 0.00 0.00 0.00 61.98 60.01 2klm s VAL 136 Cb 0.00 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 2klm s VAL 136 CO 0.00 -0.42 -0.08 -1.61 0.00 0.00 0.00 175.10 172.98 2klm s GLU 137 N -3.91 0.92 0.22 2.72 2.02 -0.64 -2.86 118.70 117.17 2klm s GLU 137 Ca 0.25 -1.35 -0.01 0.00 0.02 0.00 0.00 54.97 53.89 2klm s GLU 137 Cb 0.06 -0.41 -0.04 0.00 0.10 0.00 0.00 34.13 33.83 2klm s GLU 137 CO 0.05 0.03 0.42 0.08 0.02 0.00 0.00 175.26 175.86 2klm s VAL 138 N -3.33 5.18 -1.85 2.63 1.01 -1.26 -2.74 120.40 120.04 2klm s VAL 138 Ca 0.13 -0.35 0.30 0.00 0.00 0.00 0.00 61.98 62.05 2klm s VAL 138 Cb 0.03 -3.75 0.62 0.00 0.00 0.00 0.00 36.38 33.28 2klm s VAL 138 CO -0.02 -0.22 1.98 0.55 0.00 0.00 0.00 175.10 177.39 2klm n VAL 139 N -0.79 0.00 -3.31 2.92 3.14 -0.51 -4.60 118.33 115.18 2klm n VAL 139 Ca -0.05 -0.06 -0.09 0.00 -2.96 0.00 0.00 64.34 61.19 2klm n VAL 139 Cb 0.54 -0.18 -0.06 0.00 -1.06 0.00 0.00 33.84 33.08 2klm n VAL 139 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 2klm s GLY 140 N -2.27 -0.54 -0.47 7.55 0.00 -1.26 -4.98 107.32 105.35 2klm s GLY 140 Ca 0.36 0.47 0.06 0.00 0.00 0.00 0.00 44.72 45.61 2klm s GLY 140 CO 0.42 2.95 0.89 0.00 0.00 0.00 0.00 173.10 177.36 2klm n ALA 141 N 5.36 -0.89 -1.76 3.20 0.00 -1.26 -4.82 120.51 120.33 2klm n ALA 141 Ca -0.01 -1.63 -0.39 0.00 0.00 0.00 0.00 53.44 51.40 2klm n ALA 141 Cb 0.50 -1.25 0.02 0.00 0.00 0.00 0.00 19.45 18.72 2klm n ALA 141 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2klm s PRO 142 N 0.39 3.52 0.44 0.00 0.02 -1.26 -4.99 135.00 133.12 2klm s PRO 142 Ca 0.31 2.39 -0.15 0.00 0.02 0.00 0.00 61.00 63.56 2klm s PRO 142 Cb 0.24 -2.55 -0.08 0.00 0.02 0.00 0.00 34.50 32.13 2klm s PRO 142 CO -0.20 -0.94 0.88 -2.00 -0.33 0.00 0.00 177.00 174.41 2klm s GLU 143 N -2.58 3.97 -0.12 5.54 2.12 -1.26 -5.01 118.70 121.35 2klm s GLU 143 Ca 0.64 0.81 -0.29 0.00 0.36 0.00 0.00 54.97 56.48 2klm s GLU 143 Cb -0.43 -2.26 -0.02 0.00 0.26 0.00 0.00 34.13 31.67 2klm s GLU 143 CO 0.55 -0.09 1.24 0.08 -0.54 0.00 0.00 175.26 176.50 2klm s VAL 144 N -2.37 4.26 0.21 3.70 1.01 -1.26 -4.81 120.40 121.14 2klm s VAL 144 Ca 0.57 1.55 0.00 0.00 0.00 0.00 0.00 61.98 64.10 2klm s VAL 144 Cb -0.10 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.28 2klm s VAL 144 CO 0.25 -0.09 0.00 0.29 0.00 0.00 0.00 175.10 175.56 2klm n LYS 145 N 6.10 -1.67 0.00 2.72 5.02 -1.26 -5.02 118.16 124.06 2klm n LYS 145 Ca 0.13 1.13 0.00 0.00 -2.02 0.00 0.00 58.31 57.55 2klm n LYS 145 Cb 0.45 -2.07 0.00 0.00 -0.02 0.00 0.00 35.03 33.40 2klm n LYS 145 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2klm n ASP 146 N -4.35 0.00 0.00 4.39 -0.08 -1.26 -5.21 116.55 110.04 2klm n ASP 146 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2klm n ASP 146 Cb 0.60 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.06 2klm n ASP 146 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32