#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t35 s THR 3 N 0.00 1.04 -0.04 -0.18 -4.23 -1.26 0.73 115.64 111.70 1t35 s THR 3 Ca 0.00 -0.56 0.03 0.00 -1.18 0.00 0.00 61.69 59.98 1t35 s THR 3 Cb 0.00 -0.87 0.00 0.00 1.34 0.00 0.00 72.50 72.97 1t35 s THR 3 CO 0.00 0.30 -0.14 -0.63 -0.54 0.00 0.00 174.62 173.61 1t35 s ILE 4 N -0.28 1.15 0.07 2.99 1.01 0.10 -1.88 121.20 124.37 1t35 s ILE 4 Ca 0.04 -0.56 -0.25 0.00 0.00 0.00 0.00 60.65 59.88 1t35 s ILE 4 Cb -0.05 -1.00 -0.06 0.00 0.01 0.00 0.00 42.46 41.35 1t35 s ILE 4 CO -0.00 0.34 0.77 0.00 0.00 0.00 0.00 174.94 176.05 1t35 s VAL 6 N -0.24 0.25 -0.00 0.00 1.01 -1.19 -1.21 120.40 119.01 1t35 s VAL 6 Ca 0.38 -0.09 -0.03 0.00 0.00 0.00 0.00 61.98 62.24 1t35 s VAL 6 Cb -0.21 -0.24 -0.00 0.00 0.00 0.00 0.00 36.38 35.93 1t35 s VAL 6 CO 0.24 0.09 0.05 0.72 0.00 0.00 0.00 175.10 176.19 1t35 s PHE 7 N 0.16 0.07 0.35 5.22 -0.71 -1.04 -4.73 117.98 117.31 1t35 s PHE 7 Ca -0.01 -0.14 -0.10 0.00 -1.04 0.00 0.00 56.93 55.64 1t35 s PHE 7 Cb -0.04 -0.07 0.03 0.00 -1.21 0.00 0.00 43.02 41.73 1t35 s PHE 7 CO -0.00 -0.14 0.62 0.00 -1.34 0.00 0.00 175.22 174.36 1t35 s ALA 8 N -0.80 -0.03 0.18 1.99 0.00 -1.26 -4.44 121.76 117.40 1t35 s ALA 8 Ca -0.09 -1.10 -0.31 0.00 0.00 0.00 0.00 51.96 50.47 1t35 s ALA 8 Cb -0.05 0.93 -0.10 0.00 0.00 0.00 0.00 23.12 23.90 1t35 s ALA 8 CO 0.00 -0.89 1.50 0.20 0.00 0.00 0.00 175.76 176.57 1t35 s GLY 9 N -3.14 1.84 0.00 0.00 0.00 -0.14 -4.77 107.32 101.11 1t35 s GLY 9 Ca 0.23 1.31 0.12 0.00 0.00 0.00 0.00 44.72 46.38 1t35 s GLY 9 CO 0.15 2.48 1.39 1.44 0.00 0.00 0.00 173.10 178.56 1t35 n SER 10 N 3.52 0.00 -4.96 1.64 7.64 -1.26 -2.35 113.62 117.84 1t35 n SER 10 Ca 0.11 0.44 -0.22 0.00 1.01 0.00 0.00 58.87 60.22 1t35 n SER 10 Cb 0.40 -0.47 -0.02 0.00 -1.01 0.00 0.00 64.21 63.11 1t35 n SER 10 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1t35 s ASN 11 N -2.93 6.31 0.24 6.43 0.01 -1.26 -1.23 114.94 122.50 1t35 s ASN 11 Ca 0.07 0.14 -0.04 0.00 -0.71 0.00 0.00 52.86 52.32 1t35 s ASN 11 Cb 0.08 -1.89 0.26 0.00 0.41 0.00 0.00 41.25 40.11 1t35 s ASN 11 CO 0.22 -0.12 1.72 1.55 -1.51 0.00 0.00 177.10 178.97 1t35 h PRO 12 N 1.08 0.88 0.00 -0.60 0.13 -1.87 -3.35 132.00 128.27 1t35 h PRO 12 Ca -0.51 -0.25 0.00 0.00 -0.87 0.00 0.00 66.00 64.37 1t35 h PRO 12 Cb 1.23 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1t35 h PRO 12 CO 0.61 0.87 0.00 0.41 -0.23 0.00 0.00 178.00 179.66 1t35 n GLY 13 N -0.57 0.79 5.00 1.56 0.00 -1.26 -4.46 105.19 106.25 1t35 n GLY 13 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1t35 n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t35 n GLY 14 N -2.30 1.20 3.75 -0.02 0.00 -1.26 -4.87 105.19 101.69 1t35 n GLY 14 Ca 0.00 -0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1t35 n GLY 14 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1t35 s ASN 15 N 0.00 6.38 0.26 1.61 3.84 -1.26 -4.91 114.94 120.86 1t35 s ASN 15 Ca 0.00 2.95 0.01 0.00 0.21 0.00 0.00 52.86 56.03 1t35 s ASN 15 Cb 0.00 -2.63 0.35 0.00 -0.55 0.00 0.00 41.25 38.42 1t35 s ASN 15 CO 0.00 -0.91 1.68 -0.08 -2.79 0.00 0.00 177.10 175.00 1t35 h GLU 16 N 4.87 0.49 -0.80 0.43 4.22 -1.91 -3.27 114.58 118.62 1t35 h GLU 16 Ca -0.47 -0.21 0.19 0.00 0.08 0.00 0.00 59.36 58.95 1t35 h GLU 16 Cb 1.22 -0.02 -0.12 0.00 0.50 0.00 0.00 28.75 30.33 1t35 h GLU 16 CO 0.79 0.75 0.21 0.00 -2.18 0.00 0.00 179.01 178.58 1t35 h ALA 17 N 1.25 1.08 -0.63 2.92 0.00 -1.96 0.18 119.26 122.11 1t35 h ALA 17 Ca 0.05 0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.23 1t35 h ALA 17 Cb 0.75 0.25 -0.07 0.00 0.00 0.00 0.00 17.79 18.72 1t35 h ALA 17 CO 0.06 -0.37 0.29 1.88 0.00 0.00 0.00 179.25 181.11 1t35 h TYR 18 N 0.27 0.51 0.01 0.00 0.05 -1.87 0.46 116.97 116.40 1t35 h TYR 18 Ca 0.47 0.03 -0.19 0.00 0.05 0.00 0.00 58.73 59.08 1t35 h TYR 18 Cb 0.85 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 38.44 1t35 h TYR 18 CO -0.26 0.18 -0.89 -0.22 -1.05 0.00 0.00 178.16 175.93 1t35 h LYS 19 N 0.51 0.12 0.10 4.88 3.64 -1.43 -2.21 116.57 122.18 1t35 h LYS 19 Ca 0.30 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1t35 h LYS 19 Cb 0.31 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1t35 h LYS 19 CO -0.26 0.93 -0.05 -0.09 -2.27 0.00 0.00 179.45 177.72 1t35 h ARG 20 N 0.06 -0.12 -0.40 1.90 2.43 -0.24 -2.96 114.38 115.04 1t35 h ARG 20 Ca -0.03 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 1t35 h ARG 20 Cb 1.53 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 31.09 1t35 h ARG 20 CO 0.13 0.28 0.06 0.87 -1.51 0.00 0.00 179.97 179.80 1t35 h LYS 21 N -0.56 0.61 0.08 0.20 1.79 -0.21 -2.19 116.57 116.29 1t35 h LYS 21 Ca -0.01 -0.12 0.02 0.00 -2.18 0.00 0.00 60.65 58.36 1t35 h LYS 21 Cb 0.46 -0.09 -0.04 0.00 -1.58 0.00 0.00 32.23 30.97 1t35 h LYS 21 CO 0.02 0.59 -0.34 0.00 -1.08 0.00 0.00 179.45 178.65 1t35 h ALA 22 N 1.47 -0.55 -0.41 3.86 0.00 -1.34 -0.23 119.26 122.07 1t35 h ALA 22 Ca 0.13 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1t35 h ALA 22 Cb 0.29 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1t35 h ALA 22 CO 0.00 -0.87 0.27 0.00 0.00 0.00 0.00 179.25 178.65 1t35 h ALA 23 N 0.12 1.79 -0.03 0.00 0.00 -1.33 -2.55 119.26 117.26 1t35 h ALA 23 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1t35 h ALA 23 Cb 0.59 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1t35 h ALA 23 CO -0.23 0.17 0.02 1.49 0.00 0.00 0.00 179.25 180.70 1t35 h GLU 24 N 0.48 0.04 0.00 0.00 4.81 -0.45 -1.98 114.58 117.48 1t35 h GLU 24 Ca 0.16 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1t35 h GLU 24 Cb 0.05 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 1t35 h GLU 24 CO -0.04 0.05 -0.02 1.25 -0.73 0.00 0.00 179.01 179.52 1t35 h LEU 25 N 0.02 0.00 0.67 1.64 5.85 -0.85 -2.98 115.31 119.66 1t35 h LEU 25 Ca 0.01 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1t35 h LEU 25 Cb 0.02 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.05 1t35 h LEU 25 CO -0.00 0.02 -0.32 1.23 -0.34 0.00 0.00 178.44 179.03 1t35 h GLY 26 N 0.08 -0.94 -0.15 3.75 0.00 -1.09 -3.18 103.07 101.53 1t35 h GLY 26 Ca -0.00 0.35 0.25 0.00 0.00 0.00 0.00 47.33 47.92 1t35 h GLY 26 CO 0.00 -0.34 0.59 -0.39 0.00 0.00 0.00 176.54 176.40 1t35 h VAL 27 N -1.04 0.53 0.00 4.60 -1.51 -1.34 -1.95 116.25 115.54 1t35 h VAL 27 Ca -0.09 -0.20 0.00 0.00 -1.23 0.00 0.00 66.70 65.18 1t35 h VAL 27 Cb 0.69 -0.09 0.00 0.00 -2.13 0.00 0.00 31.29 29.75 1t35 h VAL 27 CO 0.15 0.11 0.00 0.00 -1.23 0.00 0.00 177.57 176.60 1t35 n TYR 28 N -4.89 0.00 0.00 5.19 9.36 -1.15 -1.17 117.16 124.51 1t35 n TYR 28 Ca 0.27 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.49 1t35 n TYR 28 Cb 0.75 -0.01 0.00 0.00 -0.63 0.00 0.00 39.34 39.45 1t35 n TYR 28 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1t35 n ALA 30 N 0.44 0.00 0.31 2.98 0.00 -0.73 0.21 120.51 123.72 1t35 n ALA 30 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.62 1t35 n ALA 30 Cb 0.02 0.00 0.95 0.00 0.00 0.00 0.00 19.45 20.42 1t35 n ALA 30 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1t35 h GLU 31 N 0.00 0.00 -0.14 0.00 5.08 -1.41 0.16 114.58 118.27 1t35 h GLU 31 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1t35 h GLU 31 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1t35 h GLU 31 CO 0.00 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.05 1t35 n GLN 32 N -3.11 1.86 -2.83 2.33 1.13 0.13 -4.94 117.38 111.95 1t35 n GLN 32 Ca -0.01 -1.27 -0.09 0.00 -1.94 0.00 0.00 57.00 53.68 1t35 n GLN 32 Cb 0.28 -1.44 0.04 0.00 0.11 0.00 0.00 30.24 29.23 1t35 n GLN 32 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1t35 n GLY 33 N 1.21 0.17 3.13 1.08 0.00 0.57 -5.04 105.19 106.31 1t35 n GLY 33 Ca 0.17 -0.23 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 1t35 n GLY 33 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1t35 s ILE 34 N -3.16 2.04 0.43 -0.61 1.01 -1.26 -4.70 121.20 114.96 1t35 s ILE 34 Ca 0.14 -0.94 -0.10 0.00 0.00 0.00 0.00 60.65 59.75 1t35 s ILE 34 Cb -0.06 -1.83 -0.06 0.00 0.01 0.00 0.00 42.46 40.52 1t35 s ILE 34 CO 0.34 0.54 0.79 -0.83 0.00 0.00 0.00 174.94 175.78 1t35 s GLY 35 N 1.15 1.85 0.07 6.18 0.00 0.22 -4.08 107.32 112.71 1t35 s GLY 35 Ca 0.01 -0.24 0.02 0.00 0.00 0.00 0.00 44.72 44.52 1t35 s GLY 35 CO -0.10 -0.04 0.11 -2.27 0.00 0.00 0.00 173.10 170.80 1t35 s LEU 36 N -4.09 3.95 -0.22 0.66 2.96 0.31 -0.72 118.68 121.53 1t35 s LEU 36 Ca 0.51 0.08 -0.03 0.00 -0.22 0.00 0.00 54.13 54.46 1t35 s LEU 36 Cb -0.10 -2.58 0.10 0.00 0.50 0.00 0.00 46.19 44.10 1t35 s LEU 36 CO 0.35 0.18 0.23 -0.69 -1.32 0.00 0.00 176.35 175.10 1t35 s VAL 37 N -1.40 -0.33 0.14 1.68 1.01 -1.03 -0.55 120.40 119.91 1t35 s VAL 37 Ca 0.30 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 62.11 1t35 s VAL 37 Cb -0.12 -0.75 -0.01 0.00 0.00 0.00 0.00 36.38 35.50 1t35 s VAL 37 CO 0.23 -0.27 0.11 0.00 0.00 0.00 0.00 175.10 175.17 1t35 n TYR 38 N 5.32 -0.31 0.45 5.22 4.11 -0.88 -3.17 117.16 127.91 1t35 n TYR 38 Ca -0.05 -1.18 0.05 0.00 -0.00 0.00 0.00 57.90 56.72 1t35 n TYR 38 Cb 0.49 0.11 0.19 0.00 -0.00 0.00 0.00 39.34 40.13 1t35 n TYR 38 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1t35 n GLY 39 N -0.17 1.42 2.35 -7.48 0.00 -1.26 -1.00 105.19 99.05 1t35 n GLY 39 Ca 0.03 -0.45 -0.03 0.00 0.00 0.00 0.00 46.02 45.57 1t35 n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t35 n GLY 40 N 0.80 -4.54 3.17 -0.02 0.00 -1.26 -4.61 105.19 98.72 1t35 n GLY 40 Ca 0.14 1.04 -0.11 0.00 0.00 0.00 0.00 46.02 47.09 1t35 n GLY 40 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1t35 s SER 41 N -0.69 0.02 -0.42 1.61 0.15 -1.26 -5.06 113.70 108.05 1t35 s SER 41 Ca -0.17 -0.32 0.09 0.00 0.70 0.00 0.00 55.95 56.25 1t35 s SER 41 Cb 0.01 0.28 0.33 0.00 -1.71 0.00 0.00 66.02 64.93 1t35 s SER 41 CO 0.60 -0.53 0.93 -1.14 1.20 0.00 0.00 173.24 174.30 1t35 n ARG 42 N 0.81 0.99 0.01 5.44 0.00 -1.26 -3.85 116.66 118.80 1t35 n ARG 42 Ca -0.19 -2.61 0.00 0.00 -0.00 0.00 0.00 57.85 55.05 1t35 n ARG 42 Cb 0.58 -1.35 0.00 0.00 0.00 0.00 0.00 32.46 31.69 1t35 n ARG 42 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 1t35 n VAL 43 N 0.35 0.08 0.00 5.15 0.24 -1.26 -4.83 118.33 118.06 1t35 n VAL 43 Ca 0.15 0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.48 1t35 n VAL 43 Cb 0.68 -1.10 0.00 0.00 -1.47 0.00 0.00 33.84 31.95 1t35 n VAL 43 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1t35 n GLY 44 N 2.42 2.83 1.54 7.63 0.00 -0.37 -4.80 105.19 114.43 1t35 n GLY 44 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1t35 n GLY 44 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1t35 n LEU 45 N 0.00 0.00 0.00 0.99 4.32 -0.99 -2.24 117.00 119.08 1t35 n LEU 45 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1t35 n LEU 45 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1t35 n LEU 45 CO 0.00 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.78 1t35 n GLY 47 N 1.52 0.00 0.12 -0.72 0.00 -1.25 -1.28 105.19 103.58 1t35 n GLY 47 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1t35 n GLY 47 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1t35 h THR 48 N 0.00 1.48 -0.06 2.61 2.02 -1.79 -2.15 112.91 115.02 1t35 h THR 48 Ca 0.00 -2.14 -0.12 0.00 0.77 0.00 0.00 66.41 64.91 1t35 h THR 48 Cb 0.00 2.78 -0.01 0.00 -1.74 0.00 0.00 68.15 69.18 1t35 h THR 48 CO 0.00 0.61 -0.51 -0.29 0.37 0.00 0.00 175.52 175.70 1t35 h ILE 49 N -0.28 1.36 -0.04 3.11 2.10 -1.43 -1.35 117.51 120.99 1t35 h ILE 49 Ca -0.07 -1.77 -0.17 0.00 1.08 0.00 0.00 64.86 63.93 1t35 h ILE 49 Cb 1.29 1.88 0.01 0.00 -1.09 0.00 0.00 36.82 38.91 1t35 h ILE 49 CO 0.10 0.52 -0.64 0.00 -1.08 0.00 0.00 178.15 177.06 1t35 h ALA 50 N 1.34 0.13 0.00 0.18 0.00 -1.80 -2.47 119.26 116.63 1t35 h ALA 50 Ca 0.00 -0.57 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 1t35 h ALA 50 Cb 0.95 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 1t35 h ALA 50 CO 0.08 0.42 -0.05 0.22 0.00 0.00 0.00 179.25 179.91 1t35 h ASP 51 N 0.06 0.00 0.02 0.00 1.82 -1.28 -2.98 116.42 114.05 1t35 h ASP 51 Ca -0.07 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.54 1t35 h ASP 51 Cb 1.32 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.33 1t35 h ASP 51 CO 0.13 0.05 -0.14 0.00 -1.61 0.00 0.00 179.24 177.67 1t35 h ALA 52 N 1.95 -0.00 0.00 -0.78 0.00 -1.14 -3.21 119.26 116.07 1t35 h ALA 52 Ca -0.00 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1t35 h ALA 52 Cb 0.27 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1t35 h ALA 52 CO 0.01 0.07 0.00 -0.89 0.00 0.00 0.00 179.25 178.43 1t35 n ILE 53 N -4.54 0.00 0.00 0.00 5.41 -0.94 -3.29 119.36 116.00 1t35 n ILE 53 Ca -0.11 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.64 1t35 n ILE 53 Cb 0.53 -0.15 0.00 0.00 -0.71 0.00 0.00 39.64 39.30 1t35 n ILE 53 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1t35 n GLU 55 N 0.63 0.00 -1.10 0.38 1.02 -1.22 -0.48 120.64 119.87 1t35 n GLU 55 Ca 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.10 1t35 n GLU 55 Cb 0.00 -0.07 0.14 0.00 -0.02 0.00 0.00 31.44 31.50 1t35 n GLU 55 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1t35 n ASN 56 N 0.00 2.74 -1.66 1.62 3.02 -1.21 -4.92 115.26 114.85 1t35 n ASN 56 Ca 0.00 -3.80 -0.19 0.00 -0.03 0.00 0.00 54.58 50.56 1t35 n ASN 56 Cb 0.00 -0.46 -0.06 0.00 -0.61 0.00 0.00 39.78 38.64 1t35 n ASN 56 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1t35 n GLY 57 N -0.95 1.28 3.46 7.41 0.00 -1.24 -4.69 105.19 110.45 1t35 n GLY 57 Ca 0.27 -0.09 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 1t35 n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t35 n GLY 58 N -0.71 -1.70 3.08 -0.02 0.00 0.36 -5.04 105.19 101.16 1t35 n GLY 58 Ca -0.20 -1.67 -0.29 0.00 0.00 0.00 0.00 46.02 43.86 1t35 n GLY 58 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t35 s THR 59 N -3.50 1.58 -0.17 2.61 2.01 -1.26 -4.93 115.64 111.97 1t35 s THR 59 Ca 0.68 -0.70 -0.01 0.00 0.31 0.00 0.00 61.69 61.97 1t35 s THR 59 Cb -0.03 -1.42 0.04 0.00 0.01 0.00 0.00 72.50 71.11 1t35 s THR 59 CO 0.48 0.46 -0.04 0.00 -0.69 0.00 0.00 174.62 174.83 1t35 s ALA 60 N 0.85 1.40 -0.12 7.40 0.00 -1.26 0.11 121.76 130.14 1t35 s ALA 60 Ca -0.09 -0.80 -0.06 0.00 0.00 0.00 0.00 51.96 51.01 1t35 s ALA 60 Cb -0.15 -1.12 -0.04 0.00 0.00 0.00 0.00 23.12 21.80 1t35 s ALA 60 CO 0.00 -0.84 0.12 0.42 0.00 0.00 0.00 175.76 175.47 1t35 s ILE 61 N 1.67 5.33 -0.05 0.00 1.01 0.28 -0.23 121.20 129.22 1t35 s ILE 61 Ca 0.00 0.14 0.06 0.00 0.00 0.00 0.00 60.65 60.85 1t35 s ILE 61 Cb -0.15 -3.31 -0.02 0.00 0.01 0.00 0.00 42.46 38.98 1t35 s ILE 61 CO -0.07 0.61 -0.23 -0.83 0.00 0.00 0.00 174.94 174.42 1t35 s GLY 62 N -0.97 1.35 -0.04 6.18 0.00 -0.84 -2.06 107.32 110.93 1t35 s GLY 62 Ca 0.15 -1.05 0.06 0.00 0.00 0.00 0.00 44.72 43.87 1t35 s GLY 62 CO 0.04 -0.75 -0.20 0.14 0.00 0.00 0.00 173.10 172.32 1t35 s VAL 63 N -0.41 2.53 0.10 1.40 1.01 -0.17 -0.44 120.40 124.42 1t35 s VAL 63 Ca 0.04 -0.92 -0.16 0.00 0.00 0.00 0.00 61.98 60.94 1t35 s VAL 63 Cb -0.12 -1.94 -0.07 0.00 0.00 0.00 0.00 36.38 34.25 1t35 s VAL 63 CO 0.01 0.58 0.53 -2.84 0.00 0.00 0.00 175.10 173.38 1t35 s PRO 65 N -0.61 4.03 0.45 2.72 0.02 -1.26 -4.41 135.00 135.93 1t35 s PRO 65 Ca 0.09 0.54 0.23 0.00 0.02 0.00 0.00 61.00 61.88 1t35 s PRO 65 Cb -0.11 -3.07 1.04 0.00 0.02 0.00 0.00 34.50 32.39 1t35 s PRO 65 CO 0.00 0.56 1.90 0.66 -0.33 0.00 0.00 177.00 179.79 1t35 h SER 66 N 4.03 0.00 0.00 2.53 4.64 -1.66 -3.17 113.55 119.92 1t35 h SER 66 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1t35 h SER 66 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1t35 h SER 66 CO 0.64 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 177.45 1t35 n GLY 67 N -0.19 2.02 3.80 -0.77 0.00 -1.26 -4.91 105.19 103.88 1t35 n GLY 67 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1t35 n GLY 67 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1t35 s LEU 68 N 0.00 3.76 0.25 0.99 1.43 -1.20 -5.05 118.68 118.86 1t35 s LEU 68 Ca 0.00 1.91 -0.02 0.00 -1.03 0.00 0.00 54.13 55.00 1t35 s LEU 68 Cb 0.00 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.62 1t35 s LEU 68 CO 0.00 -0.89 0.46 -0.36 0.23 0.00 0.00 176.35 175.79 1t35 s PHE 69 N -2.08 3.48 0.24 0.29 0.40 -1.26 -4.99 117.98 114.06 1t35 s PHE 69 Ca 0.67 0.43 -0.05 0.00 -0.60 0.00 0.00 56.93 57.38 1t35 s PHE 69 Cb -0.17 -1.93 0.40 0.00 0.51 0.00 0.00 43.02 41.83 1t35 s PHE 69 CO 0.24 0.29 1.79 0.77 0.70 0.00 0.00 175.22 179.01 1t35 h SER 70 N 1.75 0.57 0.00 1.36 0.02 -2.02 -1.32 113.55 113.91 1t35 h SER 70 Ca -0.48 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1t35 h SER 70 Cb 1.19 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.69 1t35 h SER 70 CO 0.67 0.31 0.00 0.61 -1.14 0.00 0.00 176.83 177.28 1t35 n GLY 71 N -1.31 1.19 0.19 -3.77 0.00 -1.26 -1.73 105.19 98.50 1t35 n GLY 71 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1t35 n GLY 71 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1t35 n GLU 72 N 0.70 0.00 0.00 1.61 1.02 -0.50 -4.89 120.64 118.58 1t35 n GLU 72 Ca 0.00 -0.52 0.00 0.00 -0.02 0.00 0.00 57.16 56.62 1t35 n GLU 72 Cb 0.30 -0.37 0.00 0.00 -0.02 0.00 0.00 31.44 31.34 1t35 n GLU 72 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1t35 n VAL 73 N 0.00 0.00 -0.31 2.62 0.31 -0.71 -4.86 118.33 115.38 1t35 n VAL 73 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 1t35 n VAL 73 Cb 0.56 -0.47 -0.09 0.00 -0.91 0.00 0.00 33.84 32.93 1t35 n VAL 73 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 1t35 h VAL 74 N 0.00 0.00 -3.35 2.52 -1.51 -1.90 -3.28 116.25 108.73 1t35 h VAL 74 Ca 0.00 0.00 -0.61 0.00 -1.23 0.00 0.00 66.70 64.86 1t35 h VAL 74 Cb 0.70 0.00 -0.12 0.00 -2.13 0.00 0.00 31.29 29.74 1t35 h VAL 74 CO 0.00 0.00 0.56 -1.00 -1.23 0.00 0.00 177.57 175.90 1t35 s HIS 75 N -5.17 2.84 0.00 5.19 3.76 -1.26 -4.68 115.29 115.97 1t35 s HIS 75 Ca -0.11 0.11 0.00 0.00 -0.15 0.00 0.00 55.06 54.91 1t35 s HIS 75 Cb 0.09 -4.02 0.00 0.00 1.11 0.00 0.00 32.58 29.76 1t35 s HIS 75 CO 0.53 -1.26 0.00 1.04 -0.85 0.00 0.00 174.74 174.20 1t35 n GLN 76 N 7.35 0.00 -2.99 1.40 1.13 -1.24 -5.02 117.38 118.01 1t35 n GLN 76 Ca 0.03 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 55.00 1t35 n GLN 76 Cb 0.48 -0.05 0.01 0.00 0.11 0.00 0.00 30.24 30.79 1t35 n GLN 76 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1t35 n ASN 77 N -2.32 -7.64 -4.01 1.08 3.02 -1.26 -5.02 115.26 99.10 1t35 n ASN 77 Ca 0.00 0.27 -0.20 0.00 -0.03 0.00 0.00 54.58 54.62 1t35 n ASN 77 Cb 0.00 -4.99 -0.15 0.00 -0.61 0.00 0.00 39.78 34.03 1t35 n ASN 77 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1t35 s LEU 78 N -3.06 1.84 0.22 3.41 1.43 -1.26 -4.90 118.68 116.36 1t35 s LEU 78 Ca 0.18 -0.19 -0.07 0.00 -1.03 0.00 0.00 54.13 53.02 1t35 s LEU 78 Cb -0.05 -0.56 0.18 0.00 0.03 0.00 0.00 46.19 45.79 1t35 s LEU 78 CO 0.78 0.08 1.74 0.74 0.23 0.00 0.00 176.35 179.92 1t35 h THR 79 N 5.27 1.26 -3.54 5.49 2.02 -0.96 -3.45 112.91 119.00 1t35 h THR 79 Ca -0.33 -0.96 -0.10 0.00 0.77 0.00 0.00 66.41 65.80 1t35 h THR 79 Cb 1.17 0.57 -0.16 0.00 -1.74 0.00 0.00 68.15 67.99 1t35 h THR 79 CO 0.49 0.37 -0.33 -0.70 0.37 0.00 0.00 175.52 175.71 1t35 s GLU 80 N -5.27 0.79 -0.06 6.66 2.12 -1.19 -5.01 118.70 116.72 1t35 s GLU 80 Ca -0.12 -0.69 -0.01 0.00 0.36 0.00 0.00 54.97 54.52 1t35 s GLU 80 Cb 0.15 0.33 0.03 0.00 0.26 0.00 0.00 34.13 34.89 1t35 s GLU 80 CO 0.84 -0.25 -0.01 -1.17 -0.54 0.00 0.00 175.26 174.13 1t35 s LEU 81 N -2.32 0.79 -0.18 2.70 0.20 -1.26 -2.00 118.68 116.62 1t35 s LEU 81 Ca -0.02 -0.10 -0.02 0.00 0.69 0.00 0.00 54.13 54.68 1t35 s LEU 81 Cb 0.01 -0.44 -0.01 0.00 -0.43 0.00 0.00 46.19 45.31 1t35 s LEU 81 CO -0.06 -0.16 -0.08 -0.63 -0.29 0.00 0.00 176.35 175.13 1t35 s ILE 82 N 1.69 3.25 0.01 6.68 1.01 0.41 -4.97 121.20 129.28 1t35 s ILE 82 Ca 0.01 -0.56 -0.04 0.00 0.00 0.00 0.00 60.65 60.05 1t35 s ILE 82 Cb -0.13 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.87 1t35 s ILE 82 CO -0.04 0.47 0.23 -1.61 0.00 0.00 0.00 174.94 174.00 1t35 s GLU 83 N 0.92 3.51 0.09 2.79 2.02 -1.26 -4.29 118.70 122.48 1t35 s GLU 83 Ca -0.02 -0.20 -0.03 0.00 0.02 0.00 0.00 54.97 54.74 1t35 s GLU 83 Cb -0.15 -3.07 -0.03 0.00 0.10 0.00 0.00 34.13 30.98 1t35 s GLU 83 CO 0.00 0.65 0.05 0.14 0.02 0.00 0.00 175.26 176.13 1t35 s VAL 84 N -1.34 0.16 -0.28 2.63 -7.23 -1.26 -4.90 120.40 108.18 1t35 s VAL 84 Ca 0.28 -1.70 -0.09 0.00 -1.81 0.00 0.00 61.98 58.67 1t35 s VAL 84 Cb -0.13 -1.66 -0.02 0.00 0.56 0.00 0.00 36.38 35.14 1t35 s VAL 84 CO 0.18 -0.74 0.12 0.20 -0.31 0.00 0.00 175.10 174.54 1t35 s ASN 85 N -2.95 5.40 0.42 4.85 0.01 -1.26 -1.66 114.94 119.75 1t35 s ASN 85 Ca 0.12 -0.36 0.00 0.00 -0.71 0.00 0.00 52.86 51.91 1t35 s ASN 85 Cb 0.07 -1.97 0.00 0.00 0.41 0.00 0.00 41.25 39.76 1t35 s ASN 85 CO -0.06 -0.12 0.00 0.61 -1.51 0.00 0.00 177.10 176.02 1t35 n GLY 86 N 4.96 0.79 1.05 0.66 0.00 -1.26 -4.26 105.19 107.13 1t35 n GLY 86 Ca -0.15 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1t35 n GLY 86 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1t35 n HIS 88 N 5.01 0.00 -0.22 1.61 -0.00 -1.26 -3.99 115.22 116.37 1t35 n HIS 88 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 57.76 1t35 n HIS 88 Cb 0.00 0.00 0.29 0.00 -0.00 0.00 0.00 29.99 30.28 1t35 n HIS 88 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.34 177.27 1t35 h GLU 89 N 0.00 0.87 0.20 1.57 5.08 -1.99 -0.55 114.58 119.76 1t35 h GLU 89 Ca 0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1t35 h GLU 89 Cb 0.00 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.06 1t35 h GLU 89 CO 0.00 0.58 -0.10 -0.09 -1.00 0.00 0.00 179.01 178.40 1t35 h ARG 90 N 0.90 -0.26 -0.31 2.33 2.43 -1.84 -1.29 114.38 116.34 1t35 h ARG 90 Ca 0.32 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.53 1t35 h ARG 90 Cb 0.12 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 1t35 h ARG 90 CO -0.10 0.04 0.13 0.87 -1.51 0.00 0.00 179.97 179.40 1t35 h LYS 91 N -0.58 0.27 -0.86 0.20 1.57 -1.83 -2.37 116.57 112.97 1t35 h LYS 91 Ca -0.03 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.79 1t35 h LYS 91 Cb 0.43 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.62 1t35 h LYS 91 CO 0.05 0.18 0.56 0.00 -0.57 0.00 0.00 179.45 179.67 1t35 h ALA 92 N 1.18 1.53 0.00 3.86 0.00 -1.08 -0.61 119.26 124.13 1t35 h ALA 92 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1t35 h ALA 92 Cb 0.08 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1t35 h ALA 92 CO -0.12 0.36 0.00 1.17 0.00 0.00 0.00 179.25 180.66 1t35 n LYS 93 N -4.47 0.26 0.00 0.00 3.00 -0.49 -0.97 118.16 115.49 1t35 n LYS 93 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.43 1t35 n LYS 93 Cb 0.17 -1.07 0.00 0.00 0.00 0.00 0.00 35.03 34.14 1t35 n LYS 93 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1t35 n SER 95 N -0.05 0.00 0.02 3.14 2.88 -0.24 -0.59 113.62 118.78 1t35 n SER 95 Ca 0.00 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.48 1t35 n SER 95 Cb 0.03 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.45 1t35 n SER 95 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1t35 h GLU 96 N 0.00 -0.15 -0.59 -1.46 4.81 -1.28 -3.36 114.58 112.55 1t35 h GLU 96 Ca 0.00 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.31 1t35 h GLU 96 Cb 0.00 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.35 1t35 h GLU 96 CO 0.00 0.12 0.27 -0.07 -0.73 0.00 0.00 179.01 178.60 1t35 h LEU 97 N -1.00 0.34-10.06 1.64 3.38 -1.11 -3.43 115.31 105.07 1t35 h LEU 97 Ca -0.02 0.05 -0.48 0.00 0.09 0.00 0.00 57.88 57.53 1t35 h LEU 97 Cb 0.34 -0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.13 1t35 h LEU 97 CO 0.03 0.22 0.40 0.00 0.09 0.00 0.00 178.44 179.18 1t35 s ALA 98 N -6.10 2.86 -0.40 1.53 0.00 -1.26 -4.80 121.76 113.59 1t35 s ALA 98 Ca -0.13 0.69 0.10 0.00 0.00 0.00 0.00 51.96 52.62 1t35 s ALA 98 Cb 0.16 -3.29 -0.12 0.00 0.00 0.00 0.00 23.12 19.87 1t35 s ALA 98 CO 0.74 -0.42 0.40 -0.25 0.00 0.00 0.00 175.76 176.24 1t35 n ASP 99 N -0.92 0.88 -3.28 0.00 8.00 -0.79 -4.90 116.55 115.54 1t35 n ASP 99 Ca 0.09 -0.60 -0.11 0.00 0.71 0.00 0.00 54.79 54.87 1t35 n ASP 99 Cb 0.52 1.09 -0.02 0.00 -0.02 0.00 0.00 41.12 42.69 1t35 n ASP 99 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1t35 s GLY 100 N -2.23 0.85 0.03 0.44 0.00 -1.25 -3.97 107.32 101.20 1t35 s GLY 100 Ca 0.02 -1.08 0.03 0.00 0.00 0.00 0.00 44.72 43.70 1t35 s GLY 100 CO 0.43 -0.64 -0.08 -1.36 0.00 0.00 0.00 173.10 171.45 1t35 s PHE 101 N -2.99 0.73 -0.08 1.90 0.40 0.13 -2.09 117.98 115.98 1t35 s PHE 101 Ca 0.23 -0.40 -0.04 0.00 -0.60 0.00 0.00 56.93 56.12 1t35 s PHE 101 Cb -0.02 -0.44 0.04 0.00 0.51 0.00 0.00 43.02 43.11 1t35 s PHE 101 CO 0.15 -0.05 0.18 0.42 0.70 0.00 0.00 175.22 176.62 1t35 s ILE 102 N -1.07 -0.04 0.41 0.64 1.01 -0.35 0.22 121.20 122.01 1t35 s ILE 102 Ca -0.06 0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.76 1t35 s ILE 102 Cb -0.08 -0.29 0.01 0.00 0.01 0.00 0.00 42.46 42.11 1t35 s ILE 102 CO 0.01 0.07 0.06 -0.24 0.00 0.00 0.00 174.94 174.84 1t35 n SER 103 N 4.17 2.98 -4.77 3.58 2.88 0.90 -2.50 113.62 120.86 1t35 n SER 103 Ca -0.26 -2.71 -0.40 0.00 -1.33 0.00 0.00 58.87 54.17 1t35 n SER 103 Cb 0.52 0.22 -0.03 0.00 -0.75 0.00 0.00 64.21 64.17 1t35 n SER 103 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 1t35 s PRO 105 N -3.52 4.38 -0.05 -1.46 0.02 -1.26 -0.70 135.00 132.42 1t35 s PRO 105 Ca 0.05 1.90 -0.31 0.00 0.02 0.00 0.00 61.00 62.66 1t35 s PRO 105 Cb -0.00 -2.98 0.12 0.00 0.02 0.00 0.00 34.50 31.66 1t35 s PRO 105 CO 0.03 -0.05 1.35 0.20 -0.33 0.00 0.00 177.00 178.20 1t35 s GLY 106 N -0.89 -0.35 0.00 0.52 0.00 -1.26 -0.96 107.32 104.37 1t35 s GLY 106 Ca 0.50 0.55 0.00 0.00 0.00 0.00 0.00 44.72 45.77 1t35 s GLY 106 CO 0.42 2.36 0.00 0.61 0.00 0.00 0.00 173.10 176.50 1t35 n GLY 107 N -0.66 1.47 0.34 0.20 0.00 -1.26 -4.73 105.19 100.55 1t35 n GLY 107 Ca -0.04 -1.89 0.19 0.00 0.00 0.00 0.00 46.02 44.28 1t35 n GLY 107 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1t35 h PHE 108 N 0.00 0.20 -0.06 1.61 0.04 -2.03 -0.34 116.94 116.37 1t35 h PHE 108 Ca 0.00 0.06 -0.00 0.00 2.80 0.00 0.00 57.97 60.83 1t35 h PHE 108 Cb 0.00 0.08 -0.00 0.00 2.20 0.00 0.00 35.95 38.22 1t35 h PHE 108 CO 0.00 -0.44 0.03 0.78 -0.60 0.00 0.00 178.31 178.08 1t35 h GLY 109 N 0.01 0.09 0.98 -1.45 0.00 -1.99 -0.09 103.07 100.63 1t35 h GLY 109 Ca 0.67 -0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.94 1t35 h GLY 109 CO -0.88 0.04 0.27 -0.84 0.00 0.00 0.00 176.54 175.14 1t35 h THR 110 N -0.03 1.20 -0.39 4.70 2.02 -1.39 -2.21 112.91 116.81 1t35 h THR 110 Ca 0.02 -0.55 0.01 0.00 0.77 0.00 0.00 66.41 66.65 1t35 h THR 110 Cb 0.12 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 1t35 h THR 110 CO -0.00 0.22 0.25 1.88 0.37 0.00 0.00 175.52 178.24 1t35 h TYR 111 N 0.74 0.48 -0.88 3.16 0.05 -1.20 0.43 116.97 119.74 1t35 h TYR 111 Ca 0.19 0.01 0.17 0.00 0.05 0.00 0.00 58.73 59.15 1t35 h TYR 111 Cb 0.11 -0.16 -0.10 0.00 1.01 0.00 0.00 36.73 37.58 1t35 h TYR 111 CO -0.01 0.30 0.45 1.49 -1.05 0.00 0.00 178.16 179.34 1t35 h GLU 112 N 0.52 0.58 -0.18 4.88 4.22 -0.68 0.23 114.58 124.15 1t35 h GLU 112 Ca 0.15 -0.04 -0.14 0.00 0.08 0.00 0.00 59.36 59.41 1t35 h GLU 112 Cb -0.05 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 1t35 h GLU 112 CO -0.04 0.39 -0.48 1.49 -2.18 0.00 0.00 179.01 178.19 1t35 h GLU 113 N 0.60 0.45 -0.49 1.92 4.81 -0.70 -0.56 114.58 120.61 1t35 h GLU 113 Ca 0.49 -0.25 -0.07 0.00 -0.13 0.00 0.00 59.36 59.40 1t35 h GLU 113 Cb 0.76 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 1t35 h GLU 113 CO -0.39 0.84 0.03 1.25 -0.73 0.00 0.00 179.01 180.00 1t35 h LEU 114 N 0.36 0.82 -0.35 1.64 5.85 0.14 -2.15 115.31 121.63 1t35 h LEU 114 Ca 0.02 -0.29 -0.10 0.00 0.84 0.00 0.00 57.88 58.35 1t35 h LEU 114 Cb 0.97 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 1t35 h LEU 114 CO 0.09 0.91 -0.17 -0.26 -0.34 0.00 0.00 178.44 178.66 1t35 h PHE 115 N 0.71 0.86 -0.67 1.25 0.04 -0.60 -2.28 116.94 116.24 1t35 h PHE 115 Ca 0.14 -0.21 0.13 0.00 2.80 0.00 0.00 57.97 60.83 1t35 h PHE 115 Cb 0.47 -0.20 -0.09 0.00 2.20 0.00 0.00 35.95 38.33 1t35 h PHE 115 CO 0.04 0.94 0.19 1.49 -0.60 0.00 0.00 178.31 180.37 1t35 h GLU 116 N 0.53 0.31 -0.26 1.51 4.22 -0.87 0.17 114.58 120.19 1t35 h GLU 116 Ca 0.08 -0.02 -0.10 0.00 0.08 0.00 0.00 59.36 59.40 1t35 h GLU 116 Cb 0.72 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1t35 h GLU 116 CO 0.05 0.21 -0.27 0.28 -2.18 0.00 0.00 179.01 177.10 1t35 h VAL 117 N 0.32 1.27 -0.38 0.32 2.07 -1.27 -3.08 116.25 115.50 1t35 h VAL 117 Ca 0.36 -1.31 -0.09 0.00 0.82 0.00 0.00 66.70 66.48 1t35 h VAL 117 Cb 0.56 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1t35 h VAL 117 CO -0.42 0.42 -0.12 -0.07 0.02 0.00 0.00 177.57 177.40 1t35 h LEU 118 N 0.45 0.77 -0.45 2.57 3.38 -0.19 -3.29 115.31 118.55 1t35 h LEU 118 Ca 0.06 -0.38 0.05 0.00 0.09 0.00 0.00 57.88 57.70 1t35 h LEU 118 Cb 0.70 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 41.17 1t35 h LEU 118 CO 0.05 0.97 -0.39 0.00 0.09 0.00 0.00 178.44 179.16 1t35 s TRP 120 N -4.77 3.51 0.00 0.00 0.52 -1.24 -4.70 118.94 112.27 1t35 s TRP 120 Ca -0.09 -1.66 0.00 0.00 0.02 0.00 0.00 56.10 54.37 1t35 s TRP 120 Cb 0.06 -3.85 0.00 0.00 -1.15 0.00 0.00 33.47 28.53 1t35 s TRP 120 CO 0.42 -1.05 0.00 0.00 0.02 0.00 0.00 176.95 176.34 1t35 n ALA 121 N 4.69 2.81 0.19 0.98 0.00 -1.21 -4.85 120.51 123.11 1t35 n ALA 121 Ca 0.04 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.56 1t35 n ALA 121 Cb 0.45 0.14 0.15 0.00 0.00 0.00 0.00 19.45 20.19 1t35 n ALA 121 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1t35 h GLN 122 N 0.00 0.00 -6.41 0.00 5.75 -1.85 -3.39 115.11 109.21 1t35 h GLN 122 Ca 0.00 0.00 -0.53 0.00 -0.15 0.00 0.00 58.65 57.97 1t35 h GLN 122 Cb 0.28 0.00 0.02 0.00 1.07 0.00 0.00 27.48 28.85 1t35 h GLN 122 CO 0.00 0.24 1.07 0.42 -2.65 0.00 0.00 178.83 177.91 1t35 s ILE 123 N -3.15 3.05 0.00 2.39 1.01 -1.26 -4.63 121.20 118.60 1t35 s ILE 123 Ca 0.05 0.39 0.00 0.00 0.00 0.00 0.00 60.65 61.09 1t35 s ILE 123 Cb 0.07 -3.25 0.00 0.00 0.01 0.00 0.00 42.46 39.29 1t35 s ILE 123 CO 0.70 -0.01 0.00 0.61 0.00 0.00 0.00 174.94 176.23 1t35 n GLY 124 N 4.14 0.16 0.00 6.18 0.00 -1.26 -4.71 105.19 109.70 1t35 n GLY 124 Ca 0.17 -1.77 0.00 0.00 0.00 0.00 0.00 46.02 44.42 1t35 n GLY 124 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1t35 n ILE 125 N 0.00 0.00 -0.14 -0.61 0.13 -1.26 -4.88 119.36 112.60 1t35 n ILE 125 Ca 0.00 0.00 -0.05 0.00 -1.10 0.00 0.00 62.75 61.60 1t35 n ILE 125 Cb 0.00 1.53 0.02 0.00 -0.84 0.00 0.00 39.64 40.35 1t35 n ILE 125 CO 0.00 0.00 0.00 0.45 2.80 0.00 0.00 176.55 179.80 1t35 h HIS 126 N 0.00 -0.51 -6.48 9.51 3.86 -1.90 -3.45 115.15 116.18 1t35 h HIS 126 Ca 0.00 0.05 -0.50 0.00 -1.16 0.00 0.00 60.37 58.76 1t35 h HIS 126 Cb 0.31 0.29 -0.06 0.00 1.06 0.00 0.00 27.41 29.01 1t35 h HIS 126 CO 0.00 -0.29 -0.87 1.04 0.86 0.00 0.00 177.93 178.67 1t35 n GLN 127 N -5.39 -3.50 -2.25 2.45 6.02 -1.26 -4.89 117.38 108.56 1t35 n GLN 127 Ca 0.03 0.43 -0.41 0.00 -0.01 0.00 0.00 57.00 57.04 1t35 n GLN 127 Cb 0.30 -4.67 -0.03 0.00 1.02 0.00 0.00 30.24 26.85 1t35 n GLN 127 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1t35 s LYS 128 N -6.55 4.46 0.85 -1.09 1.02 -1.26 -4.99 119.74 112.17 1t35 s LYS 128 Ca 0.10 2.06 -0.10 0.00 0.02 0.00 0.00 55.97 58.04 1t35 s LYS 128 Cb -0.05 -3.13 0.10 0.00 -0.52 0.00 0.00 37.83 34.23 1t35 s LYS 128 CO 0.88 -0.06 1.13 -2.14 -0.92 0.00 0.00 175.35 174.24 1t35 s PRO 129 N -1.48 1.58 -0.21 -1.68 0.02 -1.26 -4.82 135.00 127.17 1t35 s PRO 129 Ca 0.48 1.40 -0.05 0.00 0.02 0.00 0.00 61.00 62.86 1t35 s PRO 129 Cb -0.37 -1.80 0.07 0.00 0.02 0.00 0.00 34.50 32.42 1t35 s PRO 129 CO 0.47 -2.19 0.11 0.42 -0.33 0.00 0.00 177.00 175.48 1t35 s ILE 130 N -2.72 -0.09 0.04 2.83 1.01 -1.03 0.18 121.20 121.42 1t35 s ILE 130 Ca 0.65 -0.35 -0.00 0.00 0.00 0.00 0.00 60.65 60.94 1t35 s ILE 130 Cb -0.21 -0.70 -0.04 0.00 0.01 0.00 0.00 42.46 41.52 1t35 s ILE 130 CO 0.56 -0.42 0.17 -0.83 0.00 0.00 0.00 174.94 174.42 1t35 s GLY 131 N 2.13 2.14 -0.37 6.18 0.00 0.59 -1.61 107.32 116.38 1t35 s GLY 131 Ca 0.04 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 43.92 1t35 s GLY 131 CO -0.18 -0.79 0.11 1.08 0.00 0.00 0.00 173.10 173.32 1t35 s LEU 132 N -2.24 4.90 -1.01 0.66 1.43 -0.35 -0.07 118.68 122.00 1t35 s LEU 132 Ca 0.30 -2.03 -0.25 0.00 -1.03 0.00 0.00 54.13 51.13 1t35 s LEU 132 Cb -0.13 -1.72 -0.11 0.00 0.03 0.00 0.00 46.19 44.26 1t35 s LEU 132 CO 0.23 -0.44 2.06 -0.47 0.23 0.00 0.00 176.35 177.96 1t35 s TYR 133 N 1.04 1.61 -0.93 0.29 5.04 0.13 -2.93 117.35 121.60 1t35 s TYR 133 Ca 0.08 1.16 -0.24 0.00 -2.44 0.00 0.00 57.07 55.63 1t35 s TYR 133 Cb -0.21 -3.78 0.04 0.00 0.35 0.00 0.00 41.96 38.36 1t35 s TYR 133 CO -0.06 -1.32 1.45 1.21 -1.34 0.00 0.00 175.55 175.50 1t35 s ASN 134 N 8.15 6.29 -0.32 4.32 2.47 0.19 -4.12 114.94 131.93 1t35 s ASN 134 Ca 0.76 -1.10 -0.14 0.00 0.42 0.00 0.00 52.86 52.80 1t35 s ASN 134 Cb -0.06 -2.57 -0.03 0.00 -1.45 0.00 0.00 41.25 37.15 1t35 s ASN 134 CO 0.09 -1.70 0.30 -0.69 -3.72 0.00 0.00 177.10 171.38 1t35 s VAL 135 N 5.64 5.23 -1.17 -5.21 1.01 -1.26 -3.92 120.40 120.71 1t35 s VAL 135 Ca 0.46 0.09 -0.03 0.00 0.00 0.00 0.00 61.98 62.49 1t35 s VAL 135 Cb -0.03 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.64 1t35 s VAL 135 CO -0.02 0.04 0.44 0.59 0.00 0.00 0.00 175.10 176.14 1t35 n ASN 136 N 5.24 -4.97 -3.81 3.32 4.13 -1.26 -2.57 115.26 115.34 1t35 n ASN 136 Ca -0.11 -0.21 -0.27 0.00 1.68 0.00 0.00 54.58 55.67 1t35 n ASN 136 Cb 0.50 -3.83 0.04 0.00 -1.54 0.00 0.00 39.78 34.95 1t35 n ASN 136 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1t35 n GLY 137 N -1.32 -0.47 0.25 7.41 0.00 -1.26 -4.88 105.19 104.92 1t35 n GLY 137 Ca -0.09 0.19 -0.09 0.00 0.00 0.00 0.00 46.02 46.03 1t35 n GLY 137 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1t35 h TYR 138 N -2.16 0.86 -0.42 1.61 3.20 -1.77 -3.12 116.97 115.16 1t35 h TYR 138 Ca -0.58 -0.23 0.00 0.00 3.14 0.00 0.00 58.73 61.06 1t35 h TYR 138 Cb 1.37 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.45 1t35 h TYR 138 CO 0.53 0.97 0.00 1.19 -1.64 0.00 0.00 178.16 179.21 1t35 n PHE 139 N -4.07 1.05 0.04 -3.82 3.72 -1.26 -4.33 117.46 108.80 1t35 n PHE 139 Ca -0.01 -0.41 -0.12 0.00 -0.05 0.00 0.00 57.45 56.86 1t35 n PHE 139 Cb 0.49 -0.21 -0.08 0.00 -0.94 0.00 0.00 39.48 38.74 1t35 n PHE 139 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1t35 h GLU 140 N 2.69 -0.04 -5.12 -1.08 4.39 -1.93 -3.42 114.58 110.07 1t35 h GLU 140 Ca 0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 1t35 h GLU 140 Cb 1.11 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.77 1t35 h GLU 140 CO 0.18 0.08 0.05 -2.14 -1.16 0.00 0.00 179.01 176.03 1t35 s PRO 141 N -5.74 1.16 0.00 2.33 0.02 -1.26 -5.07 135.00 126.43 1t35 s PRO 141 Ca -0.14 -0.40 0.00 0.00 0.02 0.00 0.00 61.00 60.48 1t35 s PRO 141 Cb 0.05 -4.97 0.00 0.00 0.02 0.00 0.00 34.50 29.60 1t35 s PRO 141 CO 0.66 -5.51 0.00 1.17 -0.33 0.00 0.00 177.00 172.99 1t35 n LYS 144 N 8.19 0.00 0.00 5.54 4.81 -1.26 -5.06 118.16 130.38 1t35 n LYS 144 Ca 0.42 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.86 1t35 n LYS 144 Cb 0.47 -2.74 0.00 0.00 0.02 0.00 0.00 35.03 32.77 1t35 n LYS 144 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1t35 n VAL 146 N -3.17 0.00 -0.35 3.15 0.31 -1.26 -1.48 118.33 115.54 1t35 n VAL 146 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.47 1t35 n VAL 146 Cb 0.42 0.00 0.34 0.00 -0.91 0.00 0.00 33.84 33.70 1t35 n VAL 146 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1t35 h LYS 147 N 0.00 0.70 0.00 5.55 1.57 -1.99 0.11 116.57 122.50 1t35 h LYS 147 Ca 0.00 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.59 1t35 h LYS 147 Cb 0.00 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 1t35 h LYS 147 CO 0.00 0.46 -0.69 -0.92 -0.57 0.00 0.00 179.45 177.73 1t35 h TYR 148 N 0.72 0.00 0.00 -1.35 3.20 -1.70 -2.44 116.97 115.40 1t35 h TYR 148 Ca 0.59 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 62.37 1t35 h TYR 148 Cb 0.97 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.23 1t35 h TYR 148 CO -0.00 0.69 -0.40 0.77 -1.64 0.00 0.00 178.16 177.58 1t35 h SER 149 N 0.00 0.00 0.22 -2.11 0.02 -1.09 -2.55 113.55 108.04 1t35 h SER 149 Ca -0.01 0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 60.64 1t35 h SER 149 Cb 1.38 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.95 1t35 h SER 149 CO 0.09 0.40 -1.34 0.40 -1.14 0.00 0.00 176.83 175.23 1t35 h ILE 150 N 0.00 1.29 -0.74 3.27 2.04 -1.07 -0.86 117.51 121.44 1t35 h ILE 150 Ca -0.00 -2.63 0.06 0.00 1.00 0.00 0.00 64.86 63.29 1t35 h ILE 150 Cb 1.16 3.05 -0.06 0.00 -0.74 0.00 0.00 36.82 40.23 1t35 h ILE 150 CO 0.05 0.79 0.43 -0.61 0.00 0.00 0.00 178.15 178.81 1t35 h GLN 151 N -0.01 0.76 0.00 2.37 4.15 -1.40 0.14 115.11 121.12 1t35 h GLN 151 Ca -0.24 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.13 1t35 h GLN 151 Cb 2.02 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 29.54 1t35 h GLN 151 CO 0.23 0.50 0.00 0.39 -1.93 0.00 0.00 178.83 178.02 1t35 n GLU 152 N -4.73 0.85 -2.93 1.69 -0.58 -0.97 -4.90 120.64 109.08 1t35 n GLU 152 Ca 0.10 0.00 -0.11 0.00 -0.42 0.00 0.00 57.16 56.73 1t35 n GLU 152 Cb 0.18 -1.46 0.04 0.00 -0.57 0.00 0.00 31.44 29.63 1t35 n GLU 152 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1t35 n GLY 153 N 0.67 0.13 0.05 0.62 0.00 0.47 -4.96 105.19 102.17 1t35 n GLY 153 Ca 0.19 -0.20 0.05 0.00 0.00 0.00 0.00 46.02 46.06 1t35 n GLY 153 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1t35 n PHE 154 N -3.31 0.00 -3.64 1.61 3.72 -0.33 -5.02 117.46 110.49 1t35 n PHE 154 Ca -0.05 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.19 1t35 n PHE 154 Cb 0.55 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.02 1t35 n PHE 154 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1t35 s SER 155 N -1.88 -0.44 0.41 4.37 1.04 -1.23 -5.00 113.70 110.97 1t35 s SER 155 Ca 0.05 0.45 -0.27 0.00 0.48 0.00 0.00 55.95 56.67 1t35 s SER 155 Cb 0.08 0.47 -0.10 0.00 0.10 0.00 0.00 66.02 66.58 1t35 s SER 155 CO 0.40 -0.51 1.47 0.21 0.98 0.00 0.00 173.24 175.80 1t35 s ASN 156 N -1.15 6.11 0.32 7.02 3.04 -1.26 -4.54 114.94 124.49 1t35 s ASN 156 Ca -0.11 3.02 0.17 0.00 0.04 0.00 0.00 52.86 55.98 1t35 s ASN 156 Cb -0.03 -2.66 0.41 0.00 -1.54 0.00 0.00 41.25 37.43 1t35 s ASN 156 CO 0.07 -1.03 1.60 -0.08 -3.04 0.00 0.00 177.10 174.62 1t35 h GLU 157 N 2.68 0.00 0.00 0.43 4.22 -2.00 -3.13 114.58 116.79 1t35 h GLU 157 Ca -0.51 0.00 -0.04 0.00 0.08 0.00 0.00 59.36 58.89 1t35 h GLU 157 Cb 1.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 1t35 h GLU 157 CO 0.63 0.46 -0.17 0.66 -2.18 0.00 0.00 179.01 178.41 1t35 h SER 158 N 0.00 0.00 0.03 1.04 4.64 -2.04 -2.23 113.55 115.00 1t35 h SER 158 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1t35 h SER 158 Cb 1.13 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1t35 h SER 158 CO 0.06 0.17 -0.01 0.45 -0.87 0.00 0.00 176.83 176.63 1t35 h HIS 159 N 0.00 0.00 -0.94 4.77 3.86 -1.94 -2.50 115.15 118.40 1t35 h HIS 159 Ca -0.00 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 1t35 h HIS 159 Cb 0.44 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.86 1t35 h HIS 159 CO 0.00 0.01 0.62 1.25 0.86 0.00 0.00 177.93 180.67 1t35 h LEU 160 N 0.00 1.03 0.00 2.43 7.12 -1.60 -1.86 115.31 122.44 1t35 h LEU 160 Ca -0.00 -0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.00 1t35 h LEU 160 Cb 0.03 -0.24 0.00 0.00 -0.53 0.00 0.00 40.66 39.92 1t35 h LEU 160 CO 0.00 0.72 0.00 2.29 -0.13 0.00 0.00 178.44 181.32 1t35 n LYS 161 N -4.43 0.13 -0.04 1.25 2.85 -0.94 -2.00 118.16 114.97 1t35 n LYS 161 Ca 0.12 0.17 -0.10 0.00 -1.05 0.00 0.00 58.31 57.45 1t35 n LYS 161 Cb 0.08 -1.50 -0.15 0.00 -0.65 0.00 0.00 35.03 32.82 1t35 n LYS 161 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1t35 n LEU 162 N -1.23 0.84 -4.85 -5.58 4.32 -0.70 -4.94 117.00 104.86 1t35 n LEU 162 Ca 0.04 0.27 -0.33 0.00 -0.02 0.00 0.00 56.01 55.97 1t35 n LEU 162 Cb 0.05 0.13 -0.06 0.00 -1.62 0.00 0.00 43.42 41.92 1t35 n LEU 162 CO 0.05 0.47 0.36 -0.51 -1.22 0.00 0.00 177.39 176.54 1t35 s ILE 163 N -2.56 4.74 0.04 -0.08 2.07 -0.85 -2.45 121.20 122.11 1t35 s ILE 163 Ca -0.08 0.86 -0.01 0.00 -1.41 0.00 0.00 60.65 60.00 1t35 s ILE 163 Cb 0.07 -3.64 -0.03 0.00 0.13 0.00 0.00 42.46 38.99 1t35 s ILE 163 CO 0.81 -0.09 -0.01 -1.00 -1.91 0.00 0.00 174.94 172.74 1t35 s HIS 164 N -1.87 0.37 0.01 3.50 3.76 -0.63 -4.96 115.29 115.47 1t35 s HIS 164 Ca 0.50 -0.78 0.01 0.00 -0.15 0.00 0.00 55.06 54.64 1t35 s HIS 164 Cb -0.11 -0.27 -0.01 0.00 1.11 0.00 0.00 32.58 33.29 1t35 s HIS 164 CO 0.19 -0.31 -0.03 0.45 -0.85 0.00 0.00 174.74 174.19 1t35 s SER 165 N -2.27 0.28 -0.02 1.40 0.15 -1.26 -1.21 113.70 110.77 1t35 s SER 165 Ca -0.03 -0.20 -0.30 0.00 0.70 0.00 0.00 55.95 56.11 1t35 s SER 165 Cb 0.00 0.01 0.12 0.00 -1.71 0.00 0.00 66.02 64.44 1t35 s SER 165 CO -0.06 -0.08 1.31 -0.55 1.20 0.00 0.00 173.24 175.05 1t35 s SER 166 N -0.55 -0.04 0.00 5.45 0.15 -1.15 -4.94 113.70 112.62 1t35 s SER 166 Ca -0.05 -0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.47 1t35 s SER 166 Cb -0.04 0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.41 1t35 s SER 166 CO -0.00 -0.27 0.14 -1.54 1.20 0.00 0.00 173.24 172.77 1t35 n SER 167 N -0.61 0.27 -4.40 5.45 3.41 -1.25 0.57 113.62 117.05 1t35 n SER 167 Ca -0.06 -0.61 -0.41 0.00 -0.26 0.00 0.00 58.87 57.52 1t35 n SER 167 Cb 0.62 0.53 -0.11 0.00 -0.26 0.00 0.00 64.21 64.99 1t35 n SER 167 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1t35 s ARG 168 N -0.53 2.87 0.22 4.33 1.81 -1.26 -4.93 118.95 121.46 1t35 s ARG 168 Ca 0.00 -1.07 -0.20 0.00 -1.72 0.00 0.00 55.73 52.74 1t35 s ARG 168 Cb 0.00 -3.83 0.17 0.00 -0.45 0.00 0.00 34.95 30.85 1t35 s ARG 168 CO 0.00 -0.73 1.55 -1.35 -0.68 0.00 0.00 175.30 174.09 1t35 h PRO 169 N 8.51 -0.00 -0.13 3.54 0.11 -1.94 0.60 132.00 142.68 1t35 h PRO 169 Ca -0.26 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.89 1t35 h PRO 169 Cb 1.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1t35 h PRO 169 CO 0.69 -0.00 0.09 0.38 -0.21 0.00 0.00 178.00 178.95 1t35 h ASP 170 N -0.00 0.00 0.03 -2.05 2.03 -1.97 -2.67 116.42 111.79 1t35 h ASP 170 Ca 0.31 0.00 -0.17 0.00 -0.73 0.00 0.00 57.03 56.44 1t35 h ASP 170 Cb 0.56 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 39.07 1t35 h ASP 170 CO -0.98 0.00 -0.67 -0.08 -1.03 0.00 0.00 179.24 176.48 1t35 h GLU 171 N 0.00 0.41 0.63 4.15 4.81 -0.28 -3.00 114.58 121.29 1t35 h GLU 171 Ca 0.06 -0.47 -0.03 0.00 -0.13 0.00 0.00 59.36 58.79 1t35 h GLU 171 Cb 0.25 0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 1t35 h GLU 171 CO -0.00 1.14 -0.40 1.25 -0.73 0.00 0.00 179.01 180.27 1t35 h LEU 172 N -0.12 -1.02 -2.14 1.64 6.46 -0.87 -0.70 115.31 118.56 1t35 h LEU 172 Ca -0.09 0.06 0.08 0.00 -0.12 0.00 0.00 57.88 57.80 1t35 h LEU 172 Cb 1.40 0.30 -0.01 0.00 -0.73 0.00 0.00 40.66 41.62 1t35 h LEU 172 CO 0.13 -0.61 0.28 0.40 -0.62 0.00 0.00 178.44 178.02 1t35 h ILE 173 N -0.97 0.47 0.19 4.05 2.04 -1.65 -2.27 117.51 119.37 1t35 h ILE 173 Ca -0.08 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1t35 h ILE 173 Cb 0.78 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1t35 h ILE 173 CO 0.08 0.00 -0.09 -0.08 0.00 0.00 0.00 178.15 178.06 1t35 h GLU 174 N 0.00 -0.25 -1.98 2.37 4.22 -1.23 -2.63 114.58 115.08 1t35 h GLU 174 Ca 0.12 0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.58 1t35 h GLU 174 Cb 0.68 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.98 1t35 h GLU 174 CO -0.00 0.16 0.00 1.04 -2.18 0.00 0.00 179.01 178.03 1t35 n GLN 175 N -4.96 0.06 0.00 1.92 6.02 -0.34 -1.81 117.38 118.26 1t35 n GLN 175 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.91 1t35 n GLN 175 Cb 0.26 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.05 1t35 n GLN 175 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1t35 n GLN 177 N 1.65 0.00 -0.84 -1.09 6.02 -0.99 -4.64 117.38 117.48 1t35 n GLN 177 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.70 1t35 n GLN 177 Cb 0.03 0.00 0.19 0.00 1.02 0.00 0.00 30.24 31.48 1t35 n GLN 177 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1t35 s ASN 178 N 0.00 2.30 0.00 1.08 3.04 -0.75 -5.21 114.94 115.40 1t35 s ASN 178 Ca 0.00 1.62 0.00 0.00 0.04 0.00 0.00 52.86 54.52 1t35 s ASN 178 Cb 0.00 -2.28 0.00 0.00 -1.54 0.00 0.00 41.25 37.43 1t35 s ASN 178 CO 0.00 -3.39 0.00 -1.22 -3.04 0.00 0.00 177.10 169.45