#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s1i n ASN 23 N 0.00 0.00 0.06 -2.24 2.85 -1.26 -5.04 115.26 109.63 1s1i n ASN 23 Ca 0.00 0.00 -0.12 0.00 -0.11 0.00 0.00 54.58 54.35 1s1i n ASN 23 Cb 0.00 0.00 -0.06 0.00 1.24 0.00 0.00 39.78 40.96 1s1i n ASN 23 CO 0.00 0.00 0.00 1.62 -2.11 0.00 0.00 177.26 176.77 1s1i h VAL 24 N 0.00 0.82 -0.59 3.44 3.04 -2.05 -0.71 116.25 120.21 1s1i h VAL 24 Ca 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.64 1s1i h VAL 24 Cb 0.00 0.82 -0.02 0.00 -2.01 0.00 0.00 31.29 30.08 1s1i h VAL 24 CO 0.00 0.00 0.18 0.10 -1.01 0.00 0.00 177.57 176.84 1s1i h TYR 25 N -0.14 0.95 -0.60 3.17 -0.00 -2.01 -2.54 116.97 115.81 1s1i h TYR 25 Ca 0.02 -0.10 -0.03 0.00 0.00 0.00 0.00 58.73 58.62 1s1i h TYR 25 Cb 0.16 -0.27 -0.03 0.00 0.00 0.00 0.00 36.73 36.59 1s1i h TYR 25 CO -0.13 0.80 0.27 1.25 -0.00 0.00 0.00 178.16 180.35 1s1i h LEU 26 N 0.83 0.80 0.10 0.10 5.85 -1.93 -2.90 115.31 118.16 1s1i h LEU 26 Ca 0.19 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1s1i h LEU 26 Cb 0.30 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.12 1s1i h LEU 26 CO -0.00 0.72 -0.05 0.11 -0.34 0.00 0.00 178.44 178.87 1s1i h LYS 27 N 0.82 -0.13 -0.42 1.25 1.79 -0.80 -2.81 116.57 116.27 1s1i h LYS 27 Ca 0.20 0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.65 1s1i h LYS 27 Cb 0.14 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 1s1i h LYS 27 CO -0.02 0.19 0.13 -0.07 -1.08 0.00 0.00 179.45 178.60 1s1i h LEU 28 N -0.46 0.61 -0.37 2.94 3.38 -1.49 -1.91 115.31 118.00 1s1i h LEU 28 Ca -0.01 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1s1i h LEU 28 Cb 0.38 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1s1i h LEU 28 CO 0.02 0.65 0.16 -0.07 0.09 0.00 0.00 178.44 179.29 1s1i h LEU 29 N 0.54 0.51 -0.62 1.67 3.38 -1.58 0.28 115.31 119.48 1s1i h LEU 29 Ca 0.14 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 1s1i h LEU 29 Cb 0.26 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 1s1i h LEU 29 CO -0.00 0.53 0.16 -0.37 0.09 0.00 0.00 178.44 178.84 1s1i h VAL 30 N 0.46 1.25 -0.83 1.22 -1.51 -1.27 -1.18 116.25 114.40 1s1i h VAL 30 Ca 0.13 -0.91 -0.04 0.00 -1.23 0.00 0.00 66.70 64.64 1s1i h VAL 30 Cb 0.17 0.65 -0.04 0.00 -2.13 0.00 0.00 31.29 29.95 1s1i h VAL 30 CO -0.01 0.34 0.36 0.50 -1.23 0.00 0.00 177.57 177.53 1s1i h LYS 31 N 0.91 1.22 -0.32 5.19 1.63 -0.77 -2.29 116.57 122.14 1s1i h LYS 31 Ca 0.20 -0.20 -0.03 0.00 -0.85 0.00 0.00 60.65 59.77 1s1i h LYS 31 Cb 0.35 -0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 31.76 1s1i h LYS 31 CO 0.00 0.96 0.10 1.25 -3.45 0.00 0.00 179.45 178.31 1s1i h LEU 32 N 1.19 0.47 -6.56 5.20 7.12 0.21 -2.65 115.31 120.30 1s1i h LEU 32 Ca 0.28 -0.21 -0.77 0.00 0.13 0.00 0.00 57.88 57.31 1s1i h LEU 32 Cb 0.18 -0.12 -0.19 0.00 -0.53 0.00 0.00 40.66 40.00 1s1i h LEU 32 CO -0.03 0.56 1.72 0.00 -0.13 0.00 0.00 178.44 180.55 1s1i n TYR 33 N -4.67 2.74 0.00 1.25 4.11 -0.51 -1.24 117.16 118.84 1s1i n TYR 33 Ca -0.02 -2.73 0.00 0.00 -0.00 0.00 0.00 57.90 55.15 1s1i n TYR 33 Cb 0.17 -1.77 0.00 0.00 -0.00 0.00 0.00 39.34 37.74 1s1i n TYR 33 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.86 174.49 1s1i n THR 34 N 2.80 0.00 -1.95 -3.48 5.66 -1.00 -4.24 114.28 112.07 1s1i n THR 34 Ca 0.36 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.98 1s1i n THR 34 Cb 0.35 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 69.12 1s1i n THR 34 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 1s1i n PHE 35 N -1.36 2.44 0.18 1.09 3.72 -0.37 -2.73 117.46 120.43 1s1i n PHE 35 Ca 0.00 -2.65 0.00 0.00 -0.05 0.00 0.00 57.45 54.75 1s1i n PHE 35 Cb 0.00 -1.71 0.00 0.00 -0.94 0.00 0.00 39.48 36.83 1s1i n PHE 35 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1s1i n LEU 36 N 1.44 -1.66 -0.02 4.37 4.77 -1.25 -4.68 117.00 119.98 1s1i n LEU 36 Ca 0.59 0.65 -0.11 0.00 -0.03 0.00 0.00 56.01 57.11 1s1i n LEU 36 Cb 0.30 1.70 -0.05 0.00 -2.33 0.00 0.00 43.42 43.03 1s1i n LEU 36 CO 0.61 -0.40 0.88 0.00 -1.33 0.00 0.00 177.39 177.15 1s1i h ALA 37 N 0.00 0.15 -0.12 -1.18 0.00 -1.60 -1.50 119.26 115.00 1s1i h ALA 37 Ca 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1s1i h ALA 37 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1s1i h ALA 37 CO 0.00 -0.32 -0.35 0.00 0.00 0.00 0.00 179.25 178.58 1s1i h ARG 38 N 0.10 0.46 -0.58 0.00 2.47 -1.79 -3.15 114.38 111.88 1s1i h ARG 38 Ca 0.04 -0.33 -0.04 0.00 -1.26 0.00 0.00 59.98 58.40 1s1i h ARG 38 Cb 0.07 0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 28.42 1s1i h ARG 38 CO -0.01 0.95 0.22 -0.09 0.56 0.00 0.00 179.97 181.60 1s1i h ARG 39 N 0.05 0.88 0.00 0.04 2.43 -1.78 -3.43 114.38 112.57 1s1i h ARG 39 Ca -0.01 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 1s1i h ARG 39 Cb 0.97 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 1s1i h ARG 39 CO 0.08 0.76 0.00 2.41 -1.51 0.00 0.00 179.97 181.71 1s1i n THR 40 N -4.46 0.00 0.00 0.20 -1.04 -0.57 -5.04 114.28 103.37 1s1i n THR 40 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1s1i n THR 40 Cb 0.17 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.68 1s1i n THR 40 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1s1i n ASP 41 N 0.00 0.00 -4.36 8.00 8.00 -1.23 -4.86 116.55 122.10 1s1i n ASP 41 Ca 0.00 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.07 1s1i n ASP 41 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1s1i n ASP 41 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1s1i n ALA 42 N -3.00 -2.47 0.27 2.24 0.00 -1.26 -4.69 120.51 111.60 1s1i n ALA 42 Ca 0.00 0.17 0.14 0.00 0.00 0.00 0.00 53.44 53.75 1s1i n ALA 42 Cb 0.00 -1.59 0.75 0.00 0.00 0.00 0.00 19.45 18.61 1s1i n ALA 42 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1s1i h PRO 43 N 0.57 0.00 -7.26 0.00 0.11 -1.96 -3.39 132.00 120.07 1s1i h PRO 43 Ca -0.37 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.22 1s1i h PRO 43 Cb 1.43 0.00 0.17 0.00 0.11 0.00 0.00 31.00 32.71 1s1i h PRO 43 CO 0.50 0.10 0.28 -0.06 -0.21 0.00 0.00 178.00 178.61 1s1i s PHE 44 N -4.17 1.91 -0.83 0.65 0.08 -1.26 -1.15 117.98 113.21 1s1i s PHE 44 Ca -0.03 1.71 0.00 0.00 0.12 0.00 0.00 56.93 58.73 1s1i s PHE 44 Cb 0.13 -3.31 0.00 0.00 -0.57 0.00 0.00 43.02 39.27 1s1i s PHE 44 CO 0.57 -2.55 0.00 0.09 -0.10 0.00 0.00 175.22 173.23 1s1i n ASN 45 N -3.77 -4.01 0.00 1.36 3.02 -1.26 -4.41 115.26 106.19 1s1i n ASN 45 Ca 0.12 0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.86 1s1i n ASN 45 Cb 0.52 -2.19 0.00 0.00 -0.61 0.00 0.00 39.78 37.50 1s1i n ASN 45 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1s1i n LYS 46 N -2.68 0.00 -0.22 3.52 0.00 -0.30 -2.98 118.16 115.50 1s1i n LYS 46 Ca -0.08 0.00 -0.08 0.00 0.00 0.00 0.00 58.31 58.16 1s1i n LYS 46 Cb 0.27 -0.10 0.03 0.00 0.00 0.00 0.00 35.03 35.23 1s1i n LYS 46 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 1s1i h VAL 47 N 0.00 1.24 -0.16 3.15 2.07 -1.48 -1.95 116.25 119.12 1s1i h VAL 47 Ca 0.00 -0.82 -0.04 0.00 0.82 0.00 0.00 66.70 66.66 1s1i h VAL 47 Cb 0.00 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1s1i h VAL 47 CO 0.00 0.31 -0.08 1.62 0.02 0.00 0.00 177.57 179.45 1s1i h VAL 48 N 0.87 1.15 -0.45 2.57 3.04 -1.87 0.18 116.25 121.76 1s1i h VAL 48 Ca 0.20 -0.64 -0.03 0.00 -1.01 0.00 0.00 66.70 65.22 1s1i h VAL 48 Cb 0.28 1.12 -0.02 0.00 -2.01 0.00 0.00 31.29 30.66 1s1i h VAL 48 CO -0.01 0.20 0.18 0.25 -1.01 0.00 0.00 177.57 177.18 1s1i h LEU 49 N 0.23 0.62 -0.45 3.16 5.85 -1.54 -2.96 115.31 120.22 1s1i h LEU 49 Ca 0.05 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.58 1s1i h LEU 49 Cb 0.29 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1s1i h LEU 49 CO 0.01 0.62 0.18 0.11 -0.34 0.00 0.00 178.44 179.03 1s1i h LYS 50 N 0.58 0.67 -0.46 1.25 1.79 -0.52 0.34 116.57 120.22 1s1i h LYS 50 Ca 0.15 -0.12 -0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1s1i h LYS 50 Cb 0.20 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 30.72 1s1i h LYS 50 CO -0.01 0.61 0.27 0.00 -1.08 0.00 0.00 179.45 179.24 1s1i h ALA 51 N 1.03 0.58 -0.27 3.86 0.00 -1.29 0.75 119.26 123.91 1s1i h ALA 51 Ca 0.15 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1s1i h ALA 51 Cb 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1s1i h ALA 51 CO -0.01 0.08 -0.19 -0.07 0.00 0.00 0.00 179.25 179.05 1s1i h LEU 52 N 0.60 0.48 -4.08 0.00 3.38 -1.32 -2.25 115.31 112.13 1s1i h LEU 52 Ca 0.16 -0.15 -0.24 0.00 0.09 0.00 0.00 57.88 57.75 1s1i h LEU 52 Cb 0.01 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 40.54 1s1i h LEU 52 CO -0.03 0.69 -0.24 0.33 0.09 0.00 0.00 178.44 179.28 1s1i n PHE 53 N -4.16 0.29 -4.07 1.13 7.35 0.12 -4.70 117.46 113.41 1s1i n PHE 53 Ca 0.00 -1.57 -0.14 0.00 -0.76 0.00 0.00 57.45 54.98 1s1i n PHE 53 Cb 0.37 -1.54 -0.04 0.00 0.35 0.00 0.00 39.48 38.62 1s1i n PHE 53 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 1s1i s LEU 54 N -0.39 0.97 0.62 -2.13 2.96 -0.85 -4.89 118.68 114.97 1s1i s LEU 54 Ca 0.64 -1.47 -0.19 0.00 -0.22 0.00 0.00 54.13 52.89 1s1i s LEU 54 Cb 0.33 1.55 -0.02 0.00 0.50 0.00 0.00 46.19 48.54 1s1i s LEU 54 CO -0.04 -1.33 1.28 -0.44 -1.32 0.00 0.00 176.35 174.50 1s1i s SER 55 N -3.23 4.87 0.21 3.68 0.01 -1.26 -4.88 113.70 113.09 1s1i s SER 55 Ca 0.30 2.57 -0.07 0.00 1.31 0.00 0.00 55.95 60.06 1s1i s SER 55 Cb -0.01 -2.61 0.15 0.00 0.21 0.00 0.00 66.02 63.76 1s1i s SER 55 CO 0.20 -1.82 1.70 0.50 0.41 0.00 0.00 173.24 174.23 1s1i h LYS 56 N 0.77 1.05 -5.29 12.44 1.63 -1.91 -3.21 116.57 122.06 1s1i h LYS 56 Ca -0.51 -0.28 -0.70 0.00 -0.85 0.00 0.00 60.65 58.31 1s1i h LYS 56 Cb 1.32 -0.12 -0.10 0.00 -0.60 0.00 0.00 32.23 32.73 1s1i h LYS 56 CO 0.54 0.98 2.13 -0.89 -3.45 0.00 0.00 179.45 178.76 1s1i n ILE 57 N -4.21 3.97 0.05 2.00 2.08 -1.26 -2.48 119.36 119.52 1s1i n ILE 57 Ca 0.04 -4.13 0.00 0.00 0.56 0.00 0.00 62.75 59.22 1s1i n ILE 57 Cb 0.30 -2.41 0.00 0.00 -0.75 0.00 0.00 39.64 36.78 1s1i n ILE 57 CO 0.00 0.00 0.00 -3.20 0.56 0.00 0.00 176.55 173.91 1s1i n ASN 58 N 7.32 -0.97 -4.82 4.38 5.15 -1.21 -5.11 115.26 120.00 1s1i n ASN 58 Ca 0.46 0.21 -0.31 0.00 -0.60 0.00 0.00 54.58 54.35 1s1i n ASN 58 Cb 0.44 1.27 0.06 0.00 -0.53 0.00 0.00 39.78 41.02 1s1i n ASN 58 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1s1i s ARG 59 N -1.22 2.67 0.00 1.20 3.00 -1.04 -4.43 118.95 119.14 1s1i s ARG 59 Ca 0.00 0.84 0.00 0.00 -1.00 0.00 0.00 55.73 55.57 1s1i s ARG 59 Cb 0.00 -1.97 0.00 0.00 0.00 0.00 0.00 34.95 32.98 1s1i s ARG 59 CO 0.00 -1.26 0.34 -2.30 0.00 0.00 0.00 175.30 172.09 1s1i n PRO 60 N -3.22 0.00 -1.37 5.12 -0.02 -1.26 -4.91 135.00 129.34 1s1i n PRO 60 Ca 0.07 0.32 -0.12 0.00 -2.02 0.00 0.00 63.50 61.75 1s1i n PRO 60 Cb 0.54 -1.03 0.07 0.00 -0.02 0.00 0.00 33.50 33.06 1s1i n PRO 60 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1s1i n PRO 61 N -1.45 0.05 0.00 0.52 -0.02 -1.26 -4.75 135.00 128.09 1s1i n PRO 61 Ca 0.00 -1.19 0.00 0.00 -2.02 0.00 0.00 63.50 60.29 1s1i n PRO 61 Cb 0.00 -0.39 0.00 0.00 -0.02 0.00 0.00 33.50 33.09 1s1i n PRO 61 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 1s1i n VAL 62 N -2.27 0.00 -2.97 -1.45 3.14 -1.25 -4.81 118.33 108.72 1s1i n VAL 62 Ca 0.08 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.44 1s1i n VAL 62 Cb 0.27 -0.19 -0.01 0.00 -1.06 0.00 0.00 33.84 32.86 1s1i n VAL 62 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1s1i n SER 63 N -2.20 -5.89 -4.57 6.55 7.64 -1.23 -4.62 113.62 109.29 1s1i n SER 63 Ca 0.00 0.98 -0.21 0.00 1.01 0.00 0.00 58.87 60.65 1s1i n SER 63 Cb 0.00 -2.64 -0.07 0.00 -1.01 0.00 0.00 64.21 60.49 1s1i n SER 63 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1s1i s VAL 64 N -0.45 3.28 -0.30 0.44 -7.23 0.20 -4.09 120.40 112.25 1s1i s VAL 64 Ca -0.06 -0.34 -0.16 0.00 -1.81 0.00 0.00 61.98 59.60 1s1i s VAL 64 Cb 0.00 -3.89 0.18 0.00 0.56 0.00 0.00 36.38 33.24 1s1i s VAL 64 CO 0.23 -0.55 1.14 -0.94 -0.31 0.00 0.00 175.10 174.67 1s1i s SER 65 N 8.50 -0.28 0.00 4.85 1.04 -1.26 -2.44 113.70 124.10 1s1i s SER 65 Ca 0.78 0.43 0.00 0.00 0.48 0.00 0.00 55.95 57.63 1s1i s SER 65 Cb -0.07 1.21 0.00 0.00 0.10 0.00 0.00 66.02 67.26 1s1i s SER 65 CO 0.08 -0.06 0.00 -1.14 0.98 0.00 0.00 173.24 173.10 1s1i n ARG 66 N 3.92 0.00 -3.19 4.02 0.00 -1.25 -4.76 116.66 115.40 1s1i n ARG 66 Ca -0.14 0.00 -0.44 0.00 -0.00 0.00 0.00 57.85 57.27 1s1i n ARG 66 Cb 0.56 -1.99 0.00 0.00 0.00 0.00 0.00 32.46 31.04 1s1i n ARG 66 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 1s1i n ILE 67 N -1.96 4.92 0.00 5.15 2.08 -1.26 -4.54 119.36 123.75 1s1i n ILE 67 Ca 0.00 -5.64 0.00 0.00 0.56 0.00 0.00 62.75 57.67 1s1i n ILE 67 Cb 0.00 -2.35 0.00 0.00 -0.75 0.00 0.00 39.64 36.54 1s1i n ILE 67 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1s1i n ALA 68 N 2.03 0.00 -1.69 -1.39 0.00 -1.26 -4.72 120.51 113.48 1s1i n ALA 68 Ca 0.25 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.25 1s1i n ALA 68 Cb 0.36 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.78 1s1i n ALA 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1s1i n ARG 69 N 0.00 2.29 -4.39 0.00 1.74 -1.26 -4.16 116.66 110.88 1s1i n ARG 69 Ca 0.00 0.82 -0.27 0.00 -0.77 0.00 0.00 57.85 57.63 1s1i n ARG 69 Cb 0.00 -2.55 -0.12 0.00 -1.02 0.00 0.00 32.46 28.77 1s1i n ARG 69 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1s1i s ALA 70 N 0.33 2.35 0.19 7.54 0.00 -1.25 -3.93 121.76 126.98 1s1i s ALA 70 Ca 0.71 -1.52 -0.11 0.00 0.00 0.00 0.00 51.96 51.04 1s1i s ALA 70 Cb -0.61 -0.32 0.12 0.00 0.00 0.00 0.00 23.12 22.31 1s1i s ALA 70 CO 0.45 0.44 1.79 1.25 0.00 0.00 0.00 175.76 179.68 1s1i h LEU 71 N 3.54 0.90-10.41 0.00 5.85 -1.90 -3.42 115.31 109.85 1s1i h LEU 71 Ca -0.48 -0.12 -0.46 0.00 0.84 0.00 0.00 57.88 57.66 1s1i h LEU 71 Cb 1.19 -0.23 0.14 0.00 0.37 0.00 0.00 40.66 42.13 1s1i h LEU 71 CO 0.44 0.77 0.26 -0.54 -0.34 0.00 0.00 178.44 179.03 1s1i s LYS 72 N -5.74 1.04 0.34 1.25 -0.14 -1.26 -4.89 119.74 110.34 1s1i s LYS 72 Ca -0.13 0.49 0.01 0.00 -1.36 0.00 0.00 55.97 54.98 1s1i s LYS 72 Cb 0.14 -1.81 0.59 0.00 -1.68 0.00 0.00 37.83 35.07 1s1i s LYS 72 CO 0.80 -2.31 1.99 -0.56 -0.76 0.00 0.00 175.35 174.51 1s1i h GLN 73 N -1.58 0.87 -6.83 1.68 -0.00 -2.04 -3.41 115.11 103.80 1s1i h GLN 73 Ca -0.51 -0.06 -0.57 0.00 -0.00 0.00 0.00 58.65 57.51 1s1i h GLN 73 Cb 1.32 -0.19 0.16 0.00 -0.00 0.00 0.00 27.48 28.77 1s1i h GLN 73 CO 0.59 0.59 0.13 -0.85 -0.00 0.00 0.00 178.83 179.29 1s1i n GLU 74 N -4.42 0.92 0.00 0.06 -0.00 -1.26 -4.82 120.64 111.12 1s1i n GLU 74 Ca 0.07 0.36 0.00 0.00 -0.00 0.00 0.00 57.16 57.58 1s1i n GLU 74 Cb 0.05 -2.17 0.00 0.00 -0.00 0.00 0.00 31.44 29.33 1s1i n GLU 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1s1i n GLY 75 N 1.28 -0.66 3.79 -1.84 0.00 -1.26 -3.94 105.19 102.55 1s1i n GLY 75 Ca 0.13 0.64 -0.36 0.00 0.00 0.00 0.00 46.02 46.44 1s1i n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s1i s ALA 76 N -1.00 3.60 0.00 4.61 0.00 -1.26 -4.89 121.76 122.82 1s1i s ALA 76 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 51.96 51.22 1s1i s ALA 76 Cb 0.00 -1.72 0.00 0.00 0.00 0.00 0.00 23.12 21.40 1s1i s ALA 76 CO 0.00 0.62 0.00 0.00 0.00 0.00 0.00 175.76 176.38 1s1i n ALA 77 N 1.94 0.00 -2.11 0.00 0.00 -1.26 -5.00 120.51 114.07 1s1i n ALA 77 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.83 1s1i n ALA 77 Cb 0.54 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.99 1s1i n ALA 77 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1s1i n ASN 78 N 0.38 4.34 -3.48 0.00 3.02 -1.26 -3.96 115.26 114.29 1s1i n ASN 78 Ca 0.00 -2.87 -0.14 0.00 -0.03 0.00 0.00 54.58 51.53 1s1i n ASN 78 Cb 0.00 -1.70 -0.04 0.00 -0.61 0.00 0.00 39.78 37.43 1s1i n ASN 78 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 1s1i s LYS 79 N 3.70 1.09 0.52 3.52 0.00 -1.26 -4.91 119.74 122.39 1s1i s LYS 79 Ca 0.50 -0.08 -0.03 0.00 0.00 0.00 0.00 55.97 56.37 1s1i s LYS 79 Cb 0.09 0.51 0.00 0.00 0.00 0.00 0.00 37.83 38.43 1s1i s LYS 79 CO -0.01 -0.41 0.79 0.95 0.00 0.00 0.00 175.35 176.67 1s1i s THR 80 N -2.33 3.90 -0.31 3.79 -4.23 -1.08 -4.51 115.64 110.86 1s1i s THR 80 Ca -0.04 -0.22 -0.01 0.00 -1.18 0.00 0.00 61.69 60.24 1s1i s THR 80 Cb -0.01 -3.49 0.10 0.00 1.34 0.00 0.00 72.50 70.45 1s1i s THR 80 CO -0.01 -0.43 0.11 0.68 -0.54 0.00 0.00 174.62 174.43 1s1i s VAL 81 N -2.77 0.75 0.60 2.29 -7.23 -1.26 -1.36 120.40 111.42 1s1i s VAL 81 Ca 0.51 -1.35 -0.11 0.00 -1.81 0.00 0.00 61.98 59.22 1s1i s VAL 81 Cb -0.10 -1.57 -0.04 0.00 0.56 0.00 0.00 36.38 35.22 1s1i s VAL 81 CO 0.42 -0.70 1.01 0.54 -0.31 0.00 0.00 175.10 176.07 1s1i s VAL 82 N 1.64 4.70 0.03 1.32 0.11 -0.38 -4.58 120.40 123.24 1s1i s VAL 82 Ca 0.10 0.88 0.05 0.00 -2.93 0.00 0.00 61.98 60.08 1s1i s VAL 82 Cb -0.17 -3.86 -0.02 0.00 -1.53 0.00 0.00 36.38 30.80 1s1i s VAL 82 CO -0.26 -1.09 -0.14 0.68 -3.33 0.00 0.00 175.10 170.96 1s1i s VAL 83 N -3.11 1.07 -0.37 2.04 -7.23 -1.22 -4.03 120.40 107.54 1s1i s VAL 83 Ca 0.55 -0.87 -0.21 0.00 -1.81 0.00 0.00 61.98 59.64 1s1i s VAL 83 Cb -0.11 -0.95 0.01 0.00 0.56 0.00 0.00 36.38 35.89 1s1i s VAL 83 CO 0.51 0.08 0.67 0.54 -0.31 0.00 0.00 175.10 176.60 1s1i s VAL 84 N -0.70 4.84 -1.15 1.32 0.11 -1.26 -4.02 120.40 119.54 1s1i s VAL 84 Ca 0.02 0.57 0.00 0.00 -2.93 0.00 0.00 61.98 59.64 1s1i s VAL 84 Cb -0.07 -4.13 0.00 0.00 -1.53 0.00 0.00 36.38 30.65 1s1i s VAL 84 CO 0.01 -0.40 0.00 0.61 -3.33 0.00 0.00 175.10 171.99 1s1i n GLY 85 N 4.71 0.51 3.93 6.54 0.00 -1.26 -4.26 105.19 115.37 1s1i n GLY 85 Ca -0.00 -2.22 -0.25 0.00 0.00 0.00 0.00 46.02 43.54 1s1i n GLY 85 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1s1i s THR 86 N -0.59 3.79 0.07 2.61 -1.32 -1.26 -1.00 115.64 117.95 1s1i s THR 86 Ca 0.00 -0.17 0.07 0.00 -1.21 0.00 0.00 61.69 60.39 1s1i s THR 86 Cb 0.00 -3.47 -0.04 0.00 -1.51 0.00 0.00 72.50 67.49 1s1i s THR 86 CO 0.00 -0.43 -0.16 0.54 -2.21 0.00 0.00 174.62 172.36 1s1i s VAL 87 N -2.83 2.97 0.11 5.08 0.11 -1.26 -3.80 120.40 120.77 1s1i s VAL 87 Ca 0.52 -1.26 0.03 0.00 -2.93 0.00 0.00 61.98 58.33 1s1i s VAL 87 Cb -0.10 -2.31 -0.04 0.00 -1.53 0.00 0.00 36.38 32.40 1s1i s VAL 87 CO 0.43 0.23 -0.08 0.28 -3.33 0.00 0.00 175.10 172.63 1s1i s THR 88 N -1.04 0.84 -0.37 5.04 -1.32 -1.26 -3.75 115.64 113.78 1s1i s THR 88 Ca 0.17 -1.89 -0.13 0.00 -1.21 0.00 0.00 61.69 58.63 1s1i s THR 88 Cb -0.11 -1.63 0.01 0.00 -1.51 0.00 0.00 72.50 69.27 1s1i s THR 88 CO 0.08 -0.77 0.25 1.51 -2.21 0.00 0.00 174.62 173.47 1s1i s ASP 89 N -2.92 5.93 -0.10 8.08 -4.77 -1.26 0.59 116.67 122.22 1s1i s ASP 89 Ca 0.11 -0.79 0.21 0.00 -3.30 0.00 0.00 52.55 48.78 1s1i s ASP 89 Cb 0.03 -2.10 0.39 0.00 -1.09 0.00 0.00 42.92 40.15 1s1i s ASP 89 CO -0.02 -0.36 1.16 -0.90 0.70 0.00 0.00 175.17 175.74 1s1i n ASP 90 N 5.08 0.69 0.00 2.11 5.75 -1.26 -4.71 116.55 124.21 1s1i n ASP 90 Ca -0.12 -2.02 0.00 0.00 -0.01 0.00 0.00 54.79 52.64 1s1i n ASP 90 Cb 0.47 -0.19 0.00 0.00 -1.03 0.00 0.00 41.12 40.38 1s1i n ASP 90 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1s1i n ALA 91 N -0.05 0.00 -0.70 2.12 0.00 -1.02 -4.80 120.51 116.07 1s1i n ALA 91 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1s1i n ALA 91 Cb 0.97 0.00 0.25 0.00 0.00 0.00 0.00 19.45 20.67 1s1i n ALA 91 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1s1i s ARG 92 N -0.10 -1.64 0.35 0.00 1.04 -1.21 -4.83 118.95 112.56 1s1i s ARG 92 Ca 0.00 0.28 0.07 0.00 -1.04 0.00 0.00 55.73 55.05 1s1i s ARG 92 Cb 0.00 -1.52 -0.07 0.00 -2.04 0.00 0.00 34.95 31.33 1s1i s ARG 92 CO 0.00 -4.06 -0.04 0.96 -0.04 0.00 0.00 175.30 172.12 1s1i s ILE 93 N -2.60 1.93 0.82 4.99 -4.36 -1.26 -4.38 121.20 116.35 1s1i s ILE 93 Ca 0.69 -2.10 -0.13 0.00 -0.26 0.00 0.00 60.65 58.85 1s1i s ILE 93 Cb -0.16 -2.75 0.09 0.00 1.25 0.00 0.00 42.46 40.90 1s1i s ILE 93 CO 0.59 -0.13 1.20 0.49 0.24 0.00 0.00 174.94 177.33 1s1i n PHE 94 N -0.80 1.24 -0.12 1.37 3.72 -1.26 -5.01 117.46 116.60 1s1i n PHE 94 Ca -0.05 0.41 0.00 0.00 -0.05 0.00 0.00 57.45 57.76 1s1i n PHE 94 Cb 0.65 -2.10 0.00 0.00 -0.94 0.00 0.00 39.48 37.09 1s1i n PHE 94 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 176.76 175.86 1s1i n GLU 95 N -3.42 3.38 -0.28 -1.08 0.28 -1.26 -3.96 120.64 114.30 1s1i n GLU 95 Ca 0.13 0.00 0.04 0.00 -0.16 0.00 0.00 57.16 57.18 1s1i n GLU 95 Cb 0.51 0.00 0.26 0.00 1.43 0.00 0.00 31.44 33.63 1s1i n GLU 95 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 177.13 177.71 1s1i h PHE 96 N 0.00 1.00 -3.98 -1.84 -1.00 -1.96 -1.94 116.94 107.23 1s1i h PHE 96 Ca 0.00 0.03 -0.55 0.00 2.81 0.00 0.00 57.97 60.25 1s1i h PHE 96 Cb 0.00 -0.33 0.14 0.00 3.61 0.00 0.00 35.95 39.37 1s1i h PHE 96 CO 0.00 0.53 0.57 -2.30 -1.61 0.00 0.00 178.31 175.50 1s1i n PRO 97 N -4.48 1.66 0.27 1.51 -0.01 -1.26 -4.31 135.00 128.38 1s1i n PRO 97 Ca 0.13 0.61 0.18 0.00 -0.01 0.00 0.00 63.50 64.41 1s1i n PRO 97 Cb 0.19 -2.55 0.81 0.00 -0.01 0.00 0.00 33.50 31.95 1s1i n PRO 97 CO 0.00 0.00 0.00 -0.22 -0.01 0.00 0.00 175.50 175.27 1s1i h LYS 98 N 1.40 0.00 -3.12 -0.52 1.63 -1.82 -2.31 116.57 111.83 1s1i h LYS 98 Ca -0.51 0.00 -0.31 0.00 -0.85 0.00 0.00 60.65 58.99 1s1i h LYS 98 Cb 1.31 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 32.88 1s1i h LYS 98 CO 0.57 0.00 1.11 2.41 -3.45 0.00 0.00 179.45 180.09 1s1i n THR 99 N -2.96 0.00 -4.04 1.00 -1.04 -1.25 0.79 114.28 106.77 1s1i n THR 99 Ca -0.00 -0.02 -0.12 0.00 -2.04 0.00 0.00 64.05 61.86 1s1i n THR 99 Cb 0.22 -0.29 -0.12 0.00 -1.82 0.00 0.00 70.33 68.32 1s1i n THR 99 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1s1i s THR 100 N 5.28 0.36 0.15 12.58 -1.32 -1.26 -3.65 115.64 127.78 1s1i s THR 100 Ca 0.85 -0.79 -0.05 0.00 -1.21 0.00 0.00 61.69 60.49 1s1i s THR 100 Cb -0.77 -0.42 -0.03 0.00 -1.51 0.00 0.00 72.50 69.77 1s1i s THR 100 CO 0.31 -0.29 0.16 -0.69 -2.21 0.00 0.00 174.62 171.90 1s1i s VAL 101 N -1.06 0.08 0.58 5.08 1.01 -1.26 -4.49 120.40 120.34 1s1i s VAL 101 Ca -0.08 -1.68 -0.10 0.00 0.00 0.00 0.00 61.98 60.11 1s1i s VAL 101 Cb -0.08 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 1s1i s VAL 101 CO -0.00 -0.38 0.97 0.00 0.00 0.00 0.00 175.10 175.69 1s1i s ALA 102 N -4.01 3.16 0.15 5.51 0.00 -1.26 -3.16 121.76 122.15 1s1i s ALA 102 Ca 0.21 -0.15 -0.23 0.00 0.00 0.00 0.00 51.96 51.79 1s1i s ALA 102 Cb 0.06 -2.98 0.08 0.00 0.00 0.00 0.00 23.12 20.28 1s1i s ALA 102 CO 0.01 -0.56 1.06 0.00 0.00 0.00 0.00 175.76 176.27 1s1i s ALA 103 N -3.02 -1.71 0.77 0.00 0.00 -1.20 -3.46 121.76 113.13 1s1i s ALA 103 Ca 0.54 -0.18 -0.11 0.00 0.00 0.00 0.00 51.96 52.21 1s1i s ALA 103 Cb -0.11 0.73 0.05 0.00 0.00 0.00 0.00 23.12 23.80 1s1i s ALA 103 CO 0.50 -1.07 1.08 -1.17 0.00 0.00 0.00 175.76 175.10 1s1i s LEU 104 N -3.35 2.98 0.38 0.00 0.20 -0.17 -4.00 118.68 114.71 1s1i s LEU 104 Ca 0.21 1.73 -0.25 0.00 0.69 0.00 0.00 54.13 56.51 1s1i s LEU 104 Cb -0.02 -4.45 -0.12 0.00 -0.43 0.00 0.00 46.19 41.17 1s1i s LEU 104 CO 0.04 -1.95 0.79 -2.11 -0.29 0.00 0.00 176.35 172.83 1s1i n ARG 105 N -3.46 0.94 -4.64 1.98 -4.01 -1.26 -4.13 116.66 102.07 1s1i n ARG 105 Ca 0.08 0.34 -0.23 0.00 -1.04 0.00 0.00 57.85 57.00 1s1i n ARG 105 Cb 0.53 -1.71 -0.15 0.00 -3.04 0.00 0.00 32.46 28.09 1s1i n ARG 105 CO 0.00 0.00 0.00 -0.59 -3.04 0.00 0.00 177.63 174.00 1s1i s PHE 106 N -1.29 1.35 0.10 2.89 -0.71 -1.26 -4.18 117.98 114.89 1s1i s PHE 106 Ca 0.62 -0.28 0.01 0.00 -1.04 0.00 0.00 56.93 56.25 1s1i s PHE 106 Cb -0.63 -0.86 -0.04 0.00 -1.21 0.00 0.00 43.02 40.28 1s1i s PHE 106 CO 0.58 -0.01 -0.03 0.99 -1.34 0.00 0.00 175.22 175.41 1s1i s THR 107 N -0.45 0.52 0.00 -4.49 2.01 -1.17 -4.73 115.64 107.33 1s1i s THR 107 Ca 0.05 -1.91 0.00 0.00 0.31 0.00 0.00 61.69 60.14 1s1i s THR 107 Cb -0.06 -1.76 0.00 0.00 0.01 0.00 0.00 72.50 70.69 1s1i s THR 107 CO -0.00 -0.79 0.00 0.00 -0.69 0.00 0.00 174.62 173.14 1s1i n ALA 108 N -0.05 0.00 -0.23 7.40 0.00 -1.26 -3.87 120.51 122.51 1s1i n ALA 108 Ca -0.11 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.37 1s1i n ALA 108 Cb 0.62 0.00 0.29 0.00 0.00 0.00 0.00 19.45 20.35 1s1i n ALA 108 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1s1i h GLY 109 N 0.00 1.10 -7.20 0.00 0.00 -1.95 -3.27 103.07 91.75 1s1i h GLY 109 Ca 0.00 -0.36 -0.53 0.00 0.00 0.00 0.00 47.33 46.43 1s1i h GLY 109 CO 0.00 0.30 1.28 0.00 0.00 0.00 0.00 176.54 178.12 1s1i s ALA 110 N -5.80 2.53 0.00 3.60 0.00 -1.25 -1.86 121.76 118.97 1s1i s ALA 110 Ca -0.11 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.54 1s1i s ALA 110 Cb 0.19 -4.16 0.00 0.00 0.00 0.00 0.00 23.12 19.15 1s1i s ALA 110 CO 0.78 -3.28 0.00 2.89 0.00 0.00 0.00 175.76 176.16 1s1i n ARG 111 N 8.80 0.00 -0.81 0.00 -4.01 -1.23 -3.02 116.66 116.39 1s1i n ARG 111 Ca 0.20 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 57.01 1s1i n ARG 111 Cb 0.50 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.92 1s1i n ARG 111 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 1s1i n ALA 112 N 0.75 0.00 0.00 2.89 0.00 -1.26 -4.46 120.51 118.43 1s1i n ALA 112 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1s1i n ALA 112 Cb 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 18.94 1s1i n ALA 112 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1s1i n LYS 113 N -1.84 0.62 -2.95 0.00 4.76 -0.78 -4.67 118.16 113.30 1s1i n LYS 113 Ca 0.00 0.00 -0.44 0.00 -2.87 0.00 0.00 58.31 55.00 1s1i n LYS 113 Cb 0.04 -0.78 -0.01 0.00 -1.84 0.00 0.00 35.03 32.44 1s1i n LYS 113 CO 0.00 0.00 0.00 -1.50 -1.37 0.00 0.00 177.40 174.53 1s1i s ILE 114 N -1.57 4.90 0.29 -0.18 1.10 -1.25 -4.77 121.20 119.72 1s1i s ILE 114 Ca 0.00 -2.07 -0.19 0.00 -0.51 0.00 0.00 60.65 57.87 1s1i s ILE 114 Cb 0.00 -4.82 0.06 0.00 0.15 0.00 0.00 42.46 37.85 1s1i s ILE 114 CO 0.00 -1.53 0.87 -0.69 -2.11 0.00 0.00 174.94 171.48 1s1i s VAL 115 N 2.08 0.00 0.00 4.00 1.01 -1.09 -3.68 120.40 122.72 1s1i s VAL 115 Ca 0.36 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1s1i s VAL 115 Cb -0.04 -2.69 0.00 0.00 0.00 0.00 0.00 36.38 33.65 1s1i s VAL 115 CO -0.06 0.00 0.00 2.29 0.00 0.00 0.00 175.10 177.33 1s1i n LYS 116 N -0.57 0.00 -1.54 2.72 0.00 -1.26 -4.47 118.16 113.04 1s1i n LYS 116 Ca -0.06 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 57.89 1s1i n LYS 116 Cb 0.60 0.00 0.09 0.00 -0.00 0.00 0.00 35.03 35.71 1s1i n LYS 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1s1i n ALA 117 N 6.85 0.76 -0.48 0.58 0.00 -1.26 -4.12 120.51 122.84 1s1i n ALA 117 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1s1i n ALA 117 Cb 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.16 1s1i n ALA 117 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s1i n GLY 118 N 0.83 2.01 0.00 0.00 0.00 -0.73 -4.78 105.19 102.53 1s1i n GLY 118 Ca 0.15 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1s1i n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s1i n GLY 119 N 0.00 4.18 3.63 -0.02 0.00 0.24 -3.62 105.19 109.59 1s1i n GLY 119 Ca 0.00 -1.29 -0.34 0.00 0.00 0.00 0.00 46.02 44.39 1s1i n GLY 119 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1s1i s GLU 120 N 0.11 3.75 0.60 1.61 2.56 -1.26 -2.65 118.70 123.43 1s1i s GLU 120 Ca 0.00 -0.37 -0.16 0.00 0.00 0.00 0.00 54.97 54.43 1s1i s GLU 120 Cb 0.00 -3.10 -0.03 0.00 2.00 0.00 0.00 34.13 33.01 1s1i s GLU 120 CO 0.00 0.36 1.09 0.00 -0.56 0.00 0.00 175.26 176.15 1s1i s ILE 122 N -2.23 0.63 0.44 0.00 -5.25 -1.19 -4.94 121.20 108.66 1s1i s ILE 122 Ca 0.67 -2.00 0.20 0.00 -0.99 0.00 0.00 60.65 58.53 1s1i s ILE 122 Cb -0.20 -2.54 0.23 0.00 2.95 0.00 0.00 42.46 42.90 1s1i s ILE 122 CO 0.36 0.00 2.03 0.00 -1.79 0.00 0.00 174.94 175.54 1s1i h THR 123 N 2.09 0.89 0.00 8.37 1.03 -1.92 -3.18 112.91 120.19 1s1i h THR 123 Ca -0.36 -0.58 0.00 0.00 -0.01 0.00 0.00 66.41 65.46 1s1i h THR 123 Cb 1.26 1.33 0.00 0.00 -1.07 0.00 0.00 68.15 69.67 1s1i h THR 123 CO 0.58 0.15 0.00 -0.11 -0.01 0.00 0.00 175.52 176.14 1s1i n LEU 124 N -4.03 0.00 -0.03 0.00 7.94 -1.26 -4.32 117.00 115.31 1s1i n LEU 124 Ca -0.02 0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 54.79 1s1i n LEU 124 Cb 0.24 0.00 0.07 0.00 0.53 0.00 0.00 43.42 44.26 1s1i n LEU 124 CO 0.34 0.00 0.57 0.44 -1.11 0.00 0.00 177.39 177.62 1s1i h ASP 125 N 0.00 0.68 -0.64 1.96 3.32 -1.89 0.16 116.42 120.03 1s1i h ASP 125 Ca 0.00 -0.32 -0.06 0.00 0.02 0.00 0.00 57.03 56.68 1s1i h ASP 125 Cb 0.00 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 1s1i h ASP 125 CO 0.00 1.02 0.18 -0.61 -1.72 0.00 0.00 179.24 178.11 1s1i h GLN 126 N 0.52 1.01 0.00 3.56 5.75 -1.83 0.45 115.11 124.56 1s1i h GLN 126 Ca 0.04 -0.23 -0.02 0.00 -0.15 0.00 0.00 58.65 58.29 1s1i h GLN 126 Cb 0.95 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 29.36 1s1i h GLN 126 CO 0.09 0.90 -0.10 1.25 -2.65 0.00 0.00 178.83 178.31 1s1i h LEU 127 N 0.93 0.00 -0.38 -2.39 7.12 -1.64 0.42 115.31 119.37 1s1i h LEU 127 Ca 0.20 0.00 -0.18 0.00 0.13 0.00 0.00 57.88 58.03 1s1i h LEU 127 Cb 0.33 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.45 1s1i h LEU 127 CO -0.00 0.10 -0.81 0.00 -0.13 0.00 0.00 178.44 177.60 1s1i h ALA 128 N 1.90 0.61 -3.15 1.25 0.00 0.25 -3.41 119.26 116.70 1s1i h ALA 128 Ca -0.00 -0.68 -0.70 0.00 0.00 0.00 0.00 54.91 53.53 1s1i h ALA 128 Cb 0.27 -0.08 -0.29 0.00 0.00 0.00 0.00 17.79 17.68 1s1i h ALA 128 CO 0.01 0.87 -0.60 0.54 0.00 0.00 0.00 179.25 180.08 1s1i s VAL 129 N -3.34 3.70 -0.62 0.00 0.11 0.15 -4.74 120.40 115.66 1s1i s VAL 129 Ca -0.03 -1.26 0.00 0.00 -2.93 0.00 0.00 61.98 57.76 1s1i s VAL 129 Cb 0.11 -3.15 0.00 0.00 -1.53 0.00 0.00 36.38 31.80 1s1i s VAL 129 CO 0.82 -0.24 0.00 -2.11 -3.33 0.00 0.00 175.10 170.23 1s1i n ARG 130 N 4.79 0.00 -2.75 1.54 0.00 -1.24 -4.69 116.66 114.30 1s1i n ARG 130 Ca -0.12 0.00 -0.43 0.00 -0.00 0.00 0.00 57.85 57.31 1s1i n ARG 130 Cb 0.44 0.00 -0.03 0.00 -0.00 0.00 0.00 32.46 32.87 1s1i n ARG 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1s1i s ALA 131 N -1.00 3.54 0.91 2.89 0.00 -1.26 -5.02 121.76 121.82 1s1i s ALA 131 Ca 0.00 -0.15 -0.12 0.00 0.00 0.00 0.00 51.96 51.69 1s1i s ALA 131 Cb 0.00 -3.52 0.13 0.00 0.00 0.00 0.00 23.12 19.74 1s1i s ALA 131 CO 0.00 -1.30 1.11 -1.25 0.00 0.00 0.00 175.76 174.32 1s1i s PRO 132 N 3.32 1.18 0.00 0.00 0.04 -1.26 -4.75 135.00 133.53 1s1i s PRO 132 Ca 0.40 0.54 0.00 0.00 0.04 0.00 0.00 61.00 61.99 1s1i s PRO 132 Cb -0.13 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.58 1s1i s PRO 132 CO 0.13 -2.22 0.00 1.17 0.04 0.00 0.00 177.00 176.11 1s1i n LYS 133 N -3.83 0.00 -1.73 4.56 0.00 -1.26 -4.80 118.16 111.10 1s1i n LYS 133 Ca 0.06 0.09 -0.42 0.00 0.00 0.00 0.00 58.31 58.05 1s1i n LYS 133 Cb 0.57 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.57 1s1i n LYS 133 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 1s1i s GLY 134 N -0.80 1.33 0.00 3.14 0.00 -1.26 -4.81 107.32 104.93 1s1i s GLY 134 Ca 0.00 1.46 0.00 0.00 0.00 0.00 0.00 44.72 46.18 1s1i s GLY 134 CO 0.00 3.08 0.00 -1.06 0.00 0.00 0.00 173.10 175.12 1s1i n GLN 135 N 5.39 2.18 -1.72 2.90 1.13 -1.26 -4.72 117.38 121.28 1s1i n GLN 135 Ca 0.17 0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.82 1s1i n GLN 135 Cb 0.38 0.00 -0.03 0.00 0.11 0.00 0.00 30.24 30.70 1s1i n GLN 135 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 1s1i s ASN 136 N -0.70 5.28 0.05 1.08 0.01 -1.26 -4.86 114.94 114.54 1s1i s ASN 136 Ca 0.00 1.43 -0.01 0.00 -0.71 0.00 0.00 52.86 53.57 1s1i s ASN 136 Cb 0.00 -2.51 -0.04 0.00 0.41 0.00 0.00 41.25 39.11 1s1i s ASN 136 CO 0.00 -2.17 -0.03 0.28 -1.51 0.00 0.00 177.10 173.67 1s1i s THR 137 N 9.03 0.21 0.03 1.60 -1.32 -1.26 -2.62 115.64 121.31 1s1i s THR 137 Ca 0.92 -1.70 0.05 0.00 -1.21 0.00 0.00 61.69 59.75 1s1i s THR 137 Cb -0.25 -1.37 -0.02 0.00 -1.51 0.00 0.00 72.50 69.35 1s1i s THR 137 CO 0.31 -0.94 -0.14 -0.76 -2.21 0.00 0.00 174.62 170.88 1s1i s LEU 138 N -2.75 2.13 0.02 9.08 1.02 -0.46 -4.95 118.68 122.76 1s1i s LEU 138 Ca 0.04 -0.40 -0.24 0.00 0.02 0.00 0.00 54.13 53.55 1s1i s LEU 138 Cb 0.06 -0.63 -0.17 0.00 0.02 0.00 0.00 46.19 45.46 1s1i s LEU 138 CO -0.09 0.07 1.39 0.40 0.02 0.00 0.00 176.35 178.14 1s1i h ILE 139 N 4.58 1.30 -6.72 -0.59 2.04 -1.91 -1.01 117.51 115.20 1s1i h ILE 139 Ca -0.37 -0.92 -0.50 0.00 1.00 0.00 0.00 64.86 64.07 1s1i h ILE 139 Cb 1.18 1.84 0.00 0.00 -0.74 0.00 0.00 36.82 39.09 1s1i h ILE 139 CO 0.45 0.25 -1.01 0.18 0.00 0.00 0.00 178.15 178.02 1s1i n LEU 140 N -4.85 -1.63 0.00 1.44 4.77 -1.26 -4.11 117.00 111.37 1s1i n LEU 140 Ca -0.07 -1.04 0.11 0.00 -0.03 0.00 0.00 56.01 54.98 1s1i n LEU 140 Cb 0.22 -1.75 0.66 0.00 -2.33 0.00 0.00 43.42 40.21 1s1i n LEU 140 CO 0.34 0.46 0.85 0.54 -1.33 0.00 0.00 177.39 178.26