#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 -0.03 -0.10 3.15 2.01 -1.26 -0.49 115.64 118.91 1t35 s THR 3 Ca 0.00 0.12 0.02 0.00 0.31 0.00 0.00 61.69 62.14 1t35 s THR 3 Cb 0.00 -0.33 0.02 0.00 0.01 0.00 0.00 72.50 72.20 1t35 s THR 3 CO 0.00 0.05 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.21 1t35 s ILE 4 N 0.98 1.39 -0.21 1.82 1.01 0.29 -1.08 121.20 125.40 1t35 s ILE 4 Ca -0.07 -0.58 -0.28 0.00 0.00 0.00 0.00 60.65 59.72 1t35 s ILE 4 Cb -0.09 -1.28 0.00 0.00 0.01 0.00 0.00 42.46 41.11 1t35 s ILE 4 CO -0.06 0.42 0.97 0.00 0.00 0.00 0.00 174.94 176.27 1t35 s VAL 6 N 2.86 2.65 -0.27 0.00 1.01 -0.93 -1.04 120.40 124.68 1t35 s VAL 6 Ca 0.42 -1.91 -0.16 0.00 0.00 0.00 0.00 61.98 60.33 1t35 s VAL 6 Cb -0.16 -2.29 0.08 0.00 0.00 0.00 0.00 36.38 34.01 1t35 s VAL 6 CO 0.08 -0.12 0.68 0.72 0.00 0.00 0.00 175.10 176.46 1t35 s PHE 7 N -1.71 -1.03 0.00 5.22 -0.12 -1.00 -4.73 117.98 114.60 1t35 s PHE 7 Ca 0.23 2.09 0.00 0.00 -0.05 0.00 0.00 56.93 59.19 1t35 s PHE 7 Cb -0.08 0.60 0.00 0.00 -0.63 0.00 0.00 43.02 42.91 1t35 s PHE 7 CO 0.12 -0.51 0.00 0.00 -0.05 0.00 0.00 175.22 174.78 1t35 n ALA 8 N 4.25 0.00 -2.00 1.99 0.00 -1.26 -4.43 120.51 119.06 1t35 n ALA 8 Ca -0.20 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 52.95 1t35 n ALA 8 Cb 0.59 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.06 1t35 n ALA 8 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1t35 s GLY 9 N -0.65 1.61 0.00 0.00 0.00 -0.90 -4.66 107.32 102.71 1t35 s GLY 9 Ca 0.00 -0.35 0.15 0.00 0.00 0.00 0.00 44.72 44.53 1t35 s GLY 9 CO 0.00 -0.07 1.51 -1.14 0.00 0.00 0.00 173.10 173.39 1t35 n SER 10 N -2.68 0.61 -4.35 1.64 3.41 -1.26 -2.69 113.62 108.30 1t35 n SER 10 Ca 0.05 -1.65 -0.19 0.00 -0.26 0.00 0.00 58.87 56.82 1t35 n SER 10 Cb 0.56 -0.05 -0.10 0.00 -0.26 0.00 0.00 64.21 64.36 1t35 n SER 10 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1t35 s ASN 11 N -1.43 2.63 0.21 4.04 0.01 -1.26 -3.80 114.94 115.34 1t35 s ASN 11 Ca 0.24 -1.01 0.06 0.00 -0.71 0.00 0.00 52.86 51.44 1t35 s ASN 11 Cb 0.12 -0.15 0.15 0.00 0.41 0.00 0.00 41.25 41.78 1t35 s ASN 11 CO 0.19 -0.15 1.48 1.55 -1.51 0.00 0.00 177.10 178.66 1t35 h PRO 12 N 2.59 0.11 0.00 -0.60 0.13 -1.92 -3.34 132.00 128.97 1t35 h PRO 12 Ca -0.38 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1t35 h PRO 12 Cb 1.22 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1t35 h PRO 12 CO 0.61 0.80 0.00 0.41 -0.23 0.00 0.00 178.00 179.59 1t35 n GLY 13 N 0.59 1.76 0.03 1.56 0.00 -1.26 -4.39 105.19 103.48 1t35 n GLY 13 Ca -0.02 -1.88 0.12 0.00 0.00 0.00 0.00 46.02 44.24 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 1.70 -1.43 3.50 -0.02 0.00 -1.26 -4.72 105.19 102.96 1t35 n GLY 14 Ca 0.00 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 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 -3.45 4.64 0.63 1.61 3.84 -1.26 -5.00 114.94 115.95 1t35 s ASN 15 Ca 0.11 -0.13 0.39 0.00 0.21 0.00 0.00 52.86 53.44 1t35 s ASN 15 Cb 0.15 -1.59 2.10 0.00 -0.55 0.00 0.00 41.25 41.36 1t35 s ASN 15 CO 0.48 0.22 2.28 -0.08 -2.79 0.00 0.00 177.10 177.22 1t35 h GLU 16 N 6.29 0.00 -0.51 0.43 4.22 -1.92 -2.85 114.58 120.23 1t35 h GLU 16 Ca -0.35 0.00 -0.12 0.00 0.08 0.00 0.00 59.36 58.97 1t35 h GLU 16 Cb 1.19 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.42 1t35 h GLU 16 CO 0.59 0.01 -0.16 0.00 -2.18 0.00 0.00 179.01 177.27 1t35 h ALA 17 N 1.99 0.74 -0.95 2.92 0.00 -1.95 -2.89 119.26 119.12 1t35 h ALA 17 Ca -0.00 -0.37 0.18 0.00 0.00 0.00 0.00 54.91 54.72 1t35 h ALA 17 Cb 0.09 -0.18 -0.11 0.00 0.00 0.00 0.00 17.79 17.59 1t35 h ALA 17 CO 0.00 0.67 0.54 1.88 0.00 0.00 0.00 179.25 182.34 1t35 h TYR 18 N 0.88 0.94 -0.02 0.00 0.05 -1.78 0.20 116.97 117.25 1t35 h TYR 18 Ca 0.13 0.04 -0.07 0.00 0.05 0.00 0.00 58.73 58.87 1t35 h TYR 18 Cb 0.73 -0.27 0.01 0.00 1.01 0.00 0.00 36.73 38.20 1t35 h TYR 18 CO 0.05 0.19 -0.28 -0.22 -1.05 0.00 0.00 178.16 176.85 1t35 h LYS 19 N 0.68 0.22 0.43 4.88 3.64 -1.72 -2.64 116.57 122.07 1t35 h LYS 19 Ca 0.55 -0.22 -0.01 0.00 -1.27 0.00 0.00 60.65 59.70 1t35 h LYS 19 Cb 0.85 0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.70 1t35 h LYS 19 CO -0.39 0.91 -0.47 -0.09 -2.27 0.00 0.00 179.45 177.14 1t35 h ARG 20 N -0.39 -0.88 -0.30 1.90 2.43 -1.14 -0.53 114.38 115.47 1t35 h ARG 20 Ca -0.03 0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.29 1t35 h ARG 20 Cb 1.00 0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.74 1t35 h ARG 20 CO 0.06 -0.59 0.24 0.87 -1.51 0.00 0.00 179.97 179.04 1t35 h LYS 21 N -0.92 0.00 -0.04 0.20 1.79 -0.76 0.73 116.57 117.58 1t35 h LYS 21 Ca -0.05 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 1t35 h LYS 21 Cb 0.80 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.45 1t35 h LYS 21 CO -0.08 0.00 0.00 0.00 -1.08 0.00 0.00 179.45 178.29 1t35 h ALA 22 N 1.80 0.05 -0.27 3.86 0.00 -0.86 -1.91 119.26 121.93 1t35 h ALA 22 Ca 0.14 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1t35 h ALA 22 Cb 0.62 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1t35 h ALA 22 CO -0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 179.25 178.92 1t35 h ALA 23 N 0.72 1.43 -0.85 0.00 0.00 0.39 -2.46 119.26 118.48 1t35 h ALA 23 Ca 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1t35 h ALA 23 Cb 0.32 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1t35 h ALA 23 CO 0.00 0.40 0.51 1.49 0.00 0.00 0.00 179.25 181.65 1t35 h GLU 24 N 0.40 1.16 0.00 0.00 4.81 -0.54 -1.23 114.58 119.18 1t35 h GLU 24 Ca 0.09 -0.10 -0.09 0.00 -0.13 0.00 0.00 59.36 59.12 1t35 h GLU 24 Cb 0.33 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 1t35 h GLU 24 CO 0.01 0.81 -0.44 1.25 -0.73 0.00 0.00 179.01 179.91 1t35 h LEU 25 N 1.18 0.00 -0.29 1.64 5.85 -0.92 -2.38 115.31 120.39 1t35 h LEU 25 Ca 0.31 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.85 1t35 h LEU 25 Cb -0.04 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 40.99 1t35 h LEU 25 CO -0.06 0.44 -0.49 1.23 -0.34 0.00 0.00 178.44 179.22 1t35 h GLY 26 N 2.07 0.92 0.73 3.75 0.00 -0.84 -3.25 103.07 106.44 1t35 h GLY 26 Ca -0.00 -1.06 -0.08 0.00 0.00 0.00 0.00 47.33 46.19 1t35 h GLY 26 CO 0.06 0.95 -0.25 -0.39 0.00 0.00 0.00 176.54 176.90 1t35 h VAL 27 N 0.61 1.39 0.00 4.60 -1.51 -1.18 -2.90 116.25 117.25 1t35 h VAL 27 Ca 0.02 -1.55 0.00 0.00 -1.23 0.00 0.00 66.70 63.94 1t35 h VAL 27 Cb 1.10 2.10 0.00 0.00 -2.13 0.00 0.00 31.29 32.37 1t35 h VAL 27 CO 0.11 0.45 0.00 0.00 -1.23 0.00 0.00 177.57 176.90 1t35 n TYR 28 N -4.46 0.00 0.00 5.19 9.36 -0.91 -0.61 117.16 125.73 1t35 n TYR 28 Ca -0.07 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.15 1t35 n TYR 28 Cb 0.45 -0.03 0.00 0.00 -0.63 0.00 0.00 39.34 39.13 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 0.56 0.00 0.29 2.98 0.00 -1.09 -0.83 120.51 122.42 1t35 n ALA 30 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.63 1t35 n ALA 30 Cb 0.00 0.00 0.94 0.00 0.00 0.00 0.00 19.45 20.39 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 -0.39 0.00 5.08 -1.13 0.08 114.58 118.22 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 -2.84 2.49 -1.36 2.33 1.13 -0.01 -4.94 117.38 114.19 1t35 n GLN 32 Ca -0.02 -2.26 -0.13 0.00 -1.94 0.00 0.00 57.00 52.66 1t35 n GLN 32 Cb 0.11 -1.51 -0.05 0.00 0.11 0.00 0.00 30.24 28.89 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 1.50 1.32 3.73 1.08 0.00 0.01 -4.98 105.19 107.86 1t35 n GLY 33 Ca 0.19 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.39 4.95 0.36 -0.61 1.01 -1.26 -4.90 121.20 118.37 1t35 s ILE 34 Ca 0.00 1.40 -0.05 0.00 0.00 0.00 0.00 60.65 62.00 1t35 s ILE 34 Cb 0.00 -4.01 -0.05 0.00 0.01 0.00 0.00 42.46 38.41 1t35 s ILE 34 CO 0.00 0.32 0.64 -0.83 0.00 0.00 0.00 174.94 175.08 1t35 s GLY 35 N 0.35 1.72 -0.10 6.18 0.00 0.35 -4.27 107.32 111.56 1t35 s GLY 35 Ca 0.35 -0.53 0.00 0.00 0.00 0.00 0.00 44.72 44.55 1t35 s GLY 35 CO 0.18 -0.40 -0.09 -2.27 0.00 0.00 0.00 173.10 170.53 1t35 s LEU 36 N -3.96 3.01 -0.09 0.66 2.96 -0.82 0.11 118.68 120.54 1t35 s LEU 36 Ca 0.46 -0.15 0.03 0.00 -0.22 0.00 0.00 54.13 54.25 1t35 s LEU 36 Cb -0.10 -1.67 0.00 0.00 0.50 0.00 0.00 46.19 44.92 1t35 s LEU 36 CO 0.34 0.27 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.75 1t35 s VAL 37 N -0.26 1.73 0.29 1.68 1.01 -0.78 -0.81 120.40 123.26 1t35 s VAL 37 Ca 0.03 -0.83 -0.15 0.00 0.00 0.00 0.00 61.98 61.03 1t35 s VAL 37 Cb -0.13 -1.51 0.06 0.00 0.00 0.00 0.00 36.38 34.80 1t35 s VAL 37 CO 0.03 0.49 0.79 0.00 0.00 0.00 0.00 175.10 176.40 1t35 n TYR 38 N 3.61 -1.92 0.27 5.22 4.11 -0.96 -2.20 117.16 125.29 1t35 n TYR 38 Ca -0.20 -1.51 0.16 0.00 -0.00 0.00 0.00 57.90 56.35 1t35 n TYR 38 Cb 0.53 0.75 0.83 0.00 -0.00 0.00 0.00 39.34 41.44 1t35 n TYR 38 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.86 177.64 1t35 h GLY 39 N 1.79 0.00 -1.57 -7.48 0.00 -1.88 0.33 103.07 94.27 1t35 h GLY 39 Ca -0.29 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.89 1t35 h GLY 39 CO 0.37 0.00 -0.21 0.61 0.00 0.00 0.00 176.54 177.30 1t35 n GLY 40 N -0.91 0.14 3.14 4.60 0.00 -1.26 -4.21 105.19 106.70 1t35 n GLY 40 Ca -0.01 -0.50 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 1t35 n GLY 40 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1t35 s SER 41 N -2.77 4.00 -0.99 1.61 1.04 -1.26 -4.92 113.70 110.41 1t35 s SER 41 Ca 0.06 -0.94 -0.24 0.00 0.48 0.00 0.00 55.95 55.31 1t35 s SER 41 Cb -0.03 -1.58 -0.06 0.00 0.10 0.00 0.00 66.02 64.45 1t35 s SER 41 CO 0.07 -0.10 1.96 -0.13 0.98 0.00 0.00 173.24 176.02 1t35 s ARG 42 N 1.26 2.49 -0.07 4.02 0.52 -1.26 -4.38 118.95 121.53 1t35 s ARG 42 Ca -0.01 -0.54 -0.05 0.00 -0.52 0.00 0.00 55.73 54.61 1t35 s ARG 42 Cb -0.16 -5.11 0.03 0.00 0.52 0.00 0.00 34.95 30.22 1t35 s ARG 42 CO -0.07 -3.63 0.18 0.14 0.02 0.00 0.00 175.30 171.94 1t35 s VAL 43 N 10.61 -0.02 0.00 3.52 -7.23 -1.26 -4.81 120.40 121.21 1t35 s VAL 43 Ca 0.70 0.08 0.00 0.00 -1.81 0.00 0.00 61.98 60.96 1t35 s VAL 43 Cb -0.05 -0.27 0.00 0.00 0.56 0.00 0.00 36.38 36.62 1t35 s VAL 43 CO 0.04 0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.47 1t35 n GLY 44 N 3.59 1.00 1.69 2.32 0.00 -1.25 -2.78 105.19 109.76 1t35 n GLY 44 Ca -0.19 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.24 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 4.77 -1.10 -2.52 117.00 119.15 1t35 n LEU 45 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1t35 n LEU 45 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1t35 n LEU 45 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 1t35 n GLY 47 N 1.28 0.00 0.19 -0.72 0.00 -1.12 -1.12 105.19 103.71 1t35 n GLY 47 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 0.72 0.00 2.61 2.02 -1.79 -1.75 112.91 114.72 1t35 h THR 48 Ca 0.00 -0.29 -0.04 0.00 0.77 0.00 0.00 66.41 66.85 1t35 h THR 48 Cb 0.00 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1t35 h THR 48 CO 0.00 0.06 -0.18 -0.29 0.37 0.00 0.00 175.52 175.48 1t35 h ILE 49 N -0.57 1.11 -0.49 3.11 2.10 -1.34 -1.50 117.51 119.94 1t35 h ILE 49 Ca -0.04 -0.64 -0.13 0.00 1.08 0.00 0.00 64.86 65.13 1t35 h ILE 49 Cb 0.42 1.35 -0.01 0.00 -1.09 0.00 0.00 36.82 37.48 1t35 h ILE 49 CO 0.07 0.18 -0.21 0.00 -1.08 0.00 0.00 178.15 177.12 1t35 h ALA 50 N 1.82 0.70 -0.09 0.18 0.00 -1.75 -2.43 119.26 117.69 1t35 h ALA 50 Ca -0.00 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 1t35 h ALA 50 Cb 0.33 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1t35 h ALA 50 CO 0.02 0.68 -0.10 -0.44 0.00 0.00 0.00 179.25 179.41 1t35 h ASP 51 N 0.86 0.25 -0.47 0.00 5.19 -0.81 -3.02 116.42 118.43 1t35 h ASP 51 Ca 0.11 -0.49 0.14 0.00 -0.62 0.00 0.00 57.03 56.17 1t35 h ASP 51 Cb 0.78 -0.07 -0.02 0.00 0.18 0.00 0.00 39.33 40.20 1t35 h ASP 51 CO 0.07 0.69 0.40 0.00 -3.12 0.00 0.00 179.24 177.27 1t35 h ALA 52 N 0.57 2.30 -0.07 3.45 0.00 -1.25 0.19 119.26 124.44 1t35 h ALA 52 Ca 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1t35 h ALA 52 Cb 0.63 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1t35 h ALA 52 CO 0.02 -0.64 0.01 -0.89 0.00 0.00 0.00 179.25 177.76 1t35 n ILE 53 N -4.06 0.43 0.00 0.00 5.41 -0.92 -3.54 119.36 116.69 1t35 n ILE 53 Ca 0.08 -0.18 0.00 0.00 1.00 0.00 0.00 62.75 63.66 1t35 n ILE 53 Cb 0.60 -0.52 0.00 0.00 -0.71 0.00 0.00 39.64 39.01 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 0.10 0.00 -0.81 0.38 1.02 0.68 -0.50 120.64 121.52 1t35 n GLU 55 Ca 0.04 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 57.02 1t35 n GLU 55 Cb 0.39 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.88 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 5.18 -3.88 1.62 3.02 -1.23 -4.85 115.26 115.12 1t35 n ASN 56 Ca 0.00 -3.00 -0.26 0.00 -0.03 0.00 0.00 54.58 51.29 1t35 n ASN 56 Cb 0.00 -0.89 0.01 0.00 -0.61 0.00 0.00 39.78 38.29 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 -0.03 -0.34 0.00 7.41 0.00 -1.23 -4.67 105.19 106.34 1t35 n GLY 57 Ca 0.32 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.49 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 -1.70 1.93 2.92 -0.02 0.00 0.35 -4.99 105.19 103.68 1t35 n GLY 58 Ca -0.18 -2.05 -0.13 0.00 0.00 0.00 0.00 46.02 43.66 1t35 n GLY 58 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1t35 s THR 59 N 1.84 0.17 -0.18 2.61 -1.32 -1.26 -4.99 115.64 112.51 1t35 s THR 59 Ca 0.00 -0.27 -0.04 0.00 -1.21 0.00 0.00 61.69 60.17 1t35 s THR 59 Cb 0.00 -0.18 0.08 0.00 -1.51 0.00 0.00 72.50 70.89 1t35 s THR 59 CO 0.00 -0.07 0.23 0.00 -2.21 0.00 0.00 174.62 172.57 1t35 s ALA 60 N -0.34 -0.34 -0.20 11.08 0.00 -1.26 -1.94 121.76 128.75 1t35 s ALA 60 Ca -0.02 0.45 -0.17 0.00 0.00 0.00 0.00 51.96 52.21 1t35 s ALA 60 Cb -0.03 -1.22 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 1t35 s ALA 60 CO -0.00 -1.03 0.44 0.42 0.00 0.00 0.00 175.76 175.59 1t35 s ILE 61 N 2.35 5.17 -0.24 0.00 1.01 0.01 -1.28 121.20 128.22 1t35 s ILE 61 Ca 0.06 0.80 -0.06 0.00 0.00 0.00 0.00 60.65 61.44 1t35 s ILE 61 Cb -0.15 -3.77 -0.02 0.00 0.01 0.00 0.00 42.46 38.54 1t35 s ILE 61 CO -0.11 0.22 0.03 -0.83 0.00 0.00 0.00 174.94 174.25 1t35 s GLY 62 N 1.09 1.70 0.15 6.18 0.00 -0.80 -2.28 107.32 113.36 1t35 s GLY 62 Ca 0.21 -1.15 -0.11 0.00 0.00 0.00 0.00 44.72 43.67 1t35 s GLY 62 CO 0.09 0.50 0.49 0.14 0.00 0.00 0.00 173.10 174.31 1t35 s VAL 63 N 1.56 4.98 0.05 1.40 1.01 0.12 -2.53 120.40 126.99 1t35 s VAL 63 Ca 0.06 0.55 0.05 0.00 0.00 0.00 0.00 61.98 62.63 1t35 s VAL 63 Cb -0.15 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 1t35 s VAL 63 CO 0.01 0.15 -0.05 -2.16 0.00 0.00 0.00 175.10 173.05 1t35 s PRO 65 N -2.24 2.46 0.61 2.72 0.04 -1.26 -4.35 135.00 132.98 1t35 s PRO 65 Ca 0.39 -0.82 -0.16 0.00 0.04 0.00 0.00 61.00 60.45 1t35 s PRO 65 Cb -0.13 -2.47 -0.02 0.00 0.04 0.00 0.00 34.50 31.91 1t35 s PRO 65 CO 0.20 0.56 1.09 -1.54 0.04 0.00 0.00 177.00 177.35 1t35 s SER 66 N -1.87 5.51 0.00 6.66 1.04 -0.64 -3.96 113.70 120.44 1t35 s SER 66 Ca 0.21 1.93 0.00 0.00 0.48 0.00 0.00 55.95 58.57 1t35 s SER 66 Cb -0.11 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.46 1t35 s SER 66 CO 0.12 -1.35 0.00 0.61 0.98 0.00 0.00 173.24 173.60 1t35 n GLY 67 N -0.66 0.72 3.81 7.32 0.00 -1.26 -4.98 105.19 110.14 1t35 n GLY 67 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 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 4.44 0.62 0.99 1.43 -1.25 -5.05 118.68 119.84 1t35 s LEU 68 Ca 0.00 1.38 -0.15 0.00 -1.03 0.00 0.00 54.13 54.32 1t35 s LEU 68 Cb 0.00 -3.32 -0.02 0.00 0.03 0.00 0.00 46.19 42.88 1t35 s LEU 68 CO 0.00 0.14 1.08 -0.36 0.23 0.00 0.00 176.35 177.43 1t35 s PHE 69 N -1.34 2.85 0.38 0.29 0.08 -1.26 -4.93 117.98 114.05 1t35 s PHE 69 Ca 0.37 1.52 0.10 0.00 0.12 0.00 0.00 56.93 59.05 1t35 s PHE 69 Cb -0.18 -3.07 0.86 0.00 -0.57 0.00 0.00 43.02 40.05 1t35 s PHE 69 CO 0.21 -1.33 1.92 1.03 -0.10 0.00 0.00 175.22 176.95 1t35 h SER 70 N 0.30 0.58 0.79 1.36 0.87 -2.00 -0.79 113.55 114.66 1t35 h SER 70 Ca -0.47 0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.10 1t35 h SER 70 Cb 1.23 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 63.09 1t35 h SER 70 CO 0.56 0.33 -0.06 1.23 -0.53 0.00 0.00 176.83 178.36 1t35 h GLY 71 N 0.63 0.00 -1.00 5.77 0.00 -2.01 -2.09 103.07 104.37 1t35 h GLY 71 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1t35 h GLY 71 CO -0.14 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.58 1t35 n GLU 72 N -3.23 1.81 0.00 4.80 1.02 -0.30 -4.25 120.64 120.50 1t35 n GLU 72 Ca -0.00 -1.22 0.00 0.00 -0.02 0.00 0.00 57.16 55.91 1t35 n GLU 72 Cb 0.29 -1.39 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 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 0.45 0.00 0.01 2.62 0.31 -0.83 -4.81 118.33 116.09 1t35 n VAL 73 Ca 0.16 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.36 1t35 n VAL 73 Cb 0.35 -0.84 -0.01 0.00 -0.91 0.00 0.00 33.84 32.43 1t35 n VAL 73 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1t35 h VAL 74 N 0.00 1.33 0.00 2.52 2.07 -1.61 -3.18 116.25 117.37 1t35 h VAL 74 Ca 0.00 -2.02 0.00 0.00 0.82 0.00 0.00 66.70 65.50 1t35 h VAL 74 Cb 0.87 2.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.65 1t35 h VAL 74 CO 0.00 0.63 0.00 1.41 0.02 0.00 0.00 177.57 179.63 1t35 n HIS 75 N -3.90 0.00 0.31 1.57 8.25 -1.26 -2.14 115.22 118.05 1t35 n HIS 75 Ca -0.05 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.46 1t35 n HIS 75 Cb 0.71 -0.04 -0.07 0.00 1.12 0.00 0.00 29.99 31.71 1t35 n HIS 75 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1t35 n GLN 76 N -0.15 2.45 -3.55 -0.41 3.00 -1.20 -4.93 117.38 112.59 1t35 n GLN 76 Ca 0.00 -0.03 -0.30 0.00 -0.01 0.00 0.00 57.00 56.65 1t35 n GLN 76 Cb 0.10 -1.08 0.02 0.00 0.00 0.00 0.00 30.24 29.29 1t35 n GLN 76 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 1t35 n ASN 77 N -1.46 -5.53 -4.90 1.08 5.15 -0.91 -4.94 115.26 103.75 1t35 n ASN 77 Ca 0.01 -0.40 -0.34 0.00 -0.60 0.00 0.00 54.58 53.25 1t35 n ASN 77 Cb 0.20 -2.06 -0.05 0.00 -0.53 0.00 0.00 39.78 37.34 1t35 n ASN 77 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1t35 s LEU 78 N -3.42 4.37 0.15 1.20 1.43 -1.26 -4.97 118.68 116.18 1t35 s LEU 78 Ca 0.22 0.40 -0.13 0.00 -1.03 0.00 0.00 54.13 53.60 1t35 s LEU 78 Cb -0.03 -2.62 0.04 0.00 0.03 0.00 0.00 46.19 43.61 1t35 s LEU 78 CO 0.87 0.26 1.66 0.74 0.23 0.00 0.00 176.35 180.12 1t35 h THR 79 N 2.89 1.24 -3.46 5.49 2.02 -1.55 -3.45 112.91 116.09 1t35 h THR 79 Ca -0.49 -0.85 -0.13 0.00 0.77 0.00 0.00 66.41 65.71 1t35 h THR 79 Cb 1.19 0.80 -0.20 0.00 -1.74 0.00 0.00 68.15 68.20 1t35 h THR 79 CO 0.68 0.31 -0.43 -0.70 0.37 0.00 0.00 175.52 175.74 1t35 s GLU 80 N -5.32 0.57 -0.07 6.66 2.12 -1.22 -5.01 118.70 116.43 1t35 s GLU 80 Ca -0.13 -0.44 0.05 0.00 0.36 0.00 0.00 54.97 54.82 1t35 s GLU 80 Cb 0.12 0.24 -0.01 0.00 0.26 0.00 0.00 34.13 34.74 1t35 s GLU 80 CO 0.80 -0.15 -0.24 -1.17 -0.54 0.00 0.00 175.26 173.96 1t35 s LEU 81 N -1.57 2.05 -0.10 2.70 2.96 -1.26 -1.91 118.68 121.54 1t35 s LEU 81 Ca -0.12 -0.51 0.01 0.00 -0.22 0.00 0.00 54.13 53.29 1t35 s LEU 81 Cb -0.05 -1.34 0.02 0.00 0.50 0.00 0.00 46.19 45.32 1t35 s LEU 81 CO 0.01 0.21 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.51 1t35 s ILE 82 N 0.01 1.18 0.26 6.68 1.01 -1.05 -4.99 121.20 124.28 1t35 s ILE 82 Ca -0.08 -0.42 -0.05 0.00 0.00 0.00 0.00 60.65 60.10 1t35 s ILE 82 Cb -0.15 -1.13 -0.05 0.00 0.01 0.00 0.00 42.46 41.14 1t35 s ILE 82 CO 0.05 0.38 0.51 -0.70 0.00 0.00 0.00 174.94 175.18 1t35 s GLU 83 N 1.31 3.63 0.10 2.79 2.12 -1.26 -4.36 118.70 123.03 1t35 s GLU 83 Ca -0.02 -0.04 -0.16 0.00 0.36 0.00 0.00 54.97 55.11 1t35 s GLU 83 Cb -0.14 -2.70 0.03 0.00 0.26 0.00 0.00 34.13 31.59 1t35 s GLU 83 CO -0.04 0.28 0.38 0.14 -0.54 0.00 0.00 175.26 175.47 1t35 s VAL 84 N -1.99 0.07 -0.45 3.70 -7.23 -1.26 -4.93 120.40 108.32 1t35 s VAL 84 Ca 0.43 -0.61 -0.13 0.00 -1.81 0.00 0.00 61.98 59.86 1t35 s VAL 84 Cb -0.11 -1.13 0.07 0.00 0.56 0.00 0.00 36.38 35.77 1t35 s VAL 84 CO 0.29 -0.34 0.33 0.20 -0.31 0.00 0.00 175.10 175.27 1t35 s ASN 85 N -2.62 5.94 0.34 4.85 0.01 -1.26 -1.61 114.94 120.59 1t35 s ASN 85 Ca 0.01 -1.36 0.00 0.00 -0.71 0.00 0.00 52.86 50.80 1t35 s ASN 85 Cb 0.01 -2.10 0.00 0.00 0.41 0.00 0.00 41.25 39.57 1t35 s ASN 85 CO -0.10 -0.59 0.00 0.61 -1.51 0.00 0.00 177.10 175.51 1t35 n GLY 86 N 5.09 0.67 2.87 0.66 0.00 -1.26 -4.28 105.19 108.94 1t35 n GLY 86 Ca -0.12 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.78 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 5.94 0.00 -0.21 1.61 -0.00 -1.26 -1.37 115.22 119.93 1t35 n HIS 88 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.69 1t35 n HIS 88 Cb 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 29.99 30.07 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 0.62 0.10 1.57 5.08 -1.98 -0.25 114.58 119.72 1t35 h GLU 89 Ca 0.00 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1t35 h GLU 89 Cb 0.00 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 1t35 h GLU 89 CO 0.00 0.41 -0.13 -0.09 -1.00 0.00 0.00 179.01 178.20 1t35 h ARG 90 N 0.64 -0.26 -0.49 2.33 2.43 -1.51 0.77 114.38 118.28 1t35 h ARG 90 Ca 0.27 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.45 1t35 h ARG 90 Cb 0.16 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 1t35 h ARG 90 CO -0.17 -0.17 0.25 0.87 -1.51 0.00 0.00 179.97 179.24 1t35 h LYS 91 N -0.27 0.70 -0.39 0.20 1.57 -1.78 -2.97 116.57 113.64 1t35 h LYS 91 Ca 0.01 -0.09 0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1t35 h LYS 91 Cb 0.27 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 1t35 h LYS 91 CO -0.05 0.57 0.22 0.00 -0.57 0.00 0.00 179.45 179.62 1t35 h ALA 92 N 1.09 0.48 0.00 3.86 0.00 -0.79 -2.47 119.26 121.44 1t35 h ALA 92 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1t35 h ALA 92 Cb 0.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1t35 h ALA 92 CO -0.02 -0.12 0.00 1.17 0.00 0.00 0.00 179.25 180.28 1t35 n LYS 93 N -4.88 0.27 0.00 0.00 3.00 0.24 -2.08 118.16 114.72 1t35 n LYS 93 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.32 1t35 n LYS 93 Cb 0.06 -1.36 0.00 0.00 0.00 0.00 0.00 35.03 33.73 1t35 n LYS 93 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1t35 n SER 95 N 0.92 0.00 0.01 3.14 3.41 -0.93 -2.38 113.62 117.79 1t35 n SER 95 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 1t35 n SER 95 Cb 0.14 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.99 1t35 n SER 95 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1t35 h GLU 96 N 0.00 -0.11 0.00 4.33 4.81 -1.68 -3.15 114.58 118.78 1t35 h GLU 96 Ca 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1t35 h GLU 96 Cb 0.00 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1t35 h GLU 96 CO 0.00 0.42 0.00 1.28 -0.73 0.00 0.00 179.01 179.98 1t35 n LEU 97 N -4.86 0.00 -4.83 1.64 4.77 -1.00 -4.81 117.00 107.91 1t35 n LEU 97 Ca -0.08 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.57 1t35 n LEU 97 Cb 0.29 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.32 1t35 n LEU 97 CO 0.30 0.00 -0.22 0.00 -1.33 0.00 0.00 177.39 176.14 1t35 s ALA 98 N -2.00 3.73 -0.85 -1.18 0.00 -1.19 -4.82 121.76 115.44 1t35 s ALA 98 Ca 0.25 -0.86 0.19 0.00 0.00 0.00 0.00 51.96 51.54 1t35 s ALA 98 Cb 0.11 -1.67 -0.22 0.00 0.00 0.00 0.00 23.12 21.35 1t35 s ALA 98 CO 0.19 0.73 0.80 -0.25 0.00 0.00 0.00 175.76 177.23 1t35 n ASP 99 N 0.92 0.88 -3.69 0.00 8.00 -0.24 -4.97 116.55 117.45 1t35 n ASP 99 Ca -0.11 -0.89 0.01 0.00 0.71 0.00 0.00 54.79 54.52 1t35 n ASP 99 Cb 0.52 1.07 0.01 0.00 -0.02 0.00 0.00 41.12 42.70 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 -2.94 -0.23 0.07 0.44 0.00 -1.23 -4.19 107.32 99.24 1t35 s GLY 100 Ca 0.06 0.28 0.04 0.00 0.00 0.00 0.00 44.72 45.10 1t35 s GLY 100 CO 0.80 2.80 -0.12 -1.36 0.00 0.00 0.00 173.10 175.22 1t35 s PHE 101 N -2.24 1.08 0.02 1.90 0.40 -0.63 -1.14 117.98 117.37 1t35 s PHE 101 Ca 0.22 -0.50 0.03 0.00 -0.60 0.00 0.00 56.93 56.08 1t35 s PHE 101 Cb 0.02 -0.61 -0.02 0.00 0.51 0.00 0.00 43.02 42.92 1t35 s PHE 101 CO -0.01 0.02 -0.10 0.42 0.70 0.00 0.00 175.22 176.25 1t35 s ILE 102 N -1.50 0.77 0.40 0.64 1.01 -0.20 -0.27 121.20 122.05 1t35 s ILE 102 Ca -0.02 -0.72 0.04 0.00 0.00 0.00 0.00 60.65 59.94 1t35 s ILE 102 Cb -0.09 -0.71 -0.04 0.00 0.01 0.00 0.00 42.46 41.63 1t35 s ILE 102 CO 0.02 -0.00 0.06 -0.55 0.00 0.00 0.00 174.94 174.47 1t35 s SER 103 N -0.81 3.04 0.27 3.58 0.15 0.24 -2.38 113.70 117.79 1t35 s SER 103 Ca -0.00 -1.53 -0.27 0.00 0.70 0.00 0.00 55.95 54.84 1t35 s SER 103 Cb -0.06 0.19 -0.09 0.00 -1.71 0.00 0.00 66.02 64.35 1t35 s SER 103 CO 0.00 -0.74 0.91 -2.84 1.20 0.00 0.00 173.24 171.78 1t35 s PRO 105 N -3.81 4.69 0.24 5.44 0.02 -1.26 -1.05 135.00 139.27 1t35 s PRO 105 Ca 0.26 1.36 -0.16 0.00 0.02 0.00 0.00 61.00 62.48 1t35 s PRO 105 Cb 0.05 -3.06 0.06 0.00 0.02 0.00 0.00 34.50 31.57 1t35 s PRO 105 CO 0.13 0.42 0.80 0.41 -0.33 0.00 0.00 177.00 178.43 1t35 n GLY 106 N 1.08 0.88 0.00 0.52 0.00 -1.26 -2.13 105.19 104.28 1t35 n GLY 106 Ca -0.01 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1t35 n GLY 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1t35 n GLY 107 N -0.55 0.74 0.30 -0.02 0.00 -1.26 -4.79 105.19 99.60 1t35 n GLY 107 Ca -0.04 -1.87 0.13 0.00 0.00 0.00 0.00 46.02 44.24 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 -0.05 0.00 -0.49 1.61 0.04 -2.01 -0.55 116.94 115.49 1t35 h PHE 108 Ca 0.00 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.71 1t35 h PHE 108 Cb 0.00 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.13 1t35 h PHE 108 CO 0.00 0.00 0.09 0.78 -0.60 0.00 0.00 178.31 178.58 1t35 h GLY 109 N 0.00 0.87 0.93 -1.45 0.00 -1.96 0.13 103.07 101.59 1t35 h GLY 109 Ca 0.05 -0.57 -0.04 0.00 0.00 0.00 0.00 47.33 46.77 1t35 h GLY 109 CO -0.00 0.53 0.08 -0.84 0.00 0.00 0.00 176.54 176.31 1t35 h THR 110 N 0.68 1.23 -0.33 4.70 2.02 -1.40 -2.02 112.91 117.80 1t35 h THR 110 Ca 0.15 -0.82 -0.06 0.00 0.77 0.00 0.00 66.41 66.46 1t35 h THR 110 Cb 0.38 1.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 1t35 h THR 110 CO 0.01 0.28 -0.04 1.88 0.37 0.00 0.00 175.52 178.02 1t35 h TYR 111 N 0.47 0.55 0.07 3.16 0.05 -1.23 -0.02 116.97 120.02 1t35 h TYR 111 Ca 0.12 -0.06 -0.00 0.00 0.05 0.00 0.00 58.73 58.83 1t35 h TYR 111 Cb 0.34 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 37.92 1t35 h TYR 111 CO 0.02 0.56 -0.03 1.49 -1.05 0.00 0.00 178.16 179.15 1t35 h GLU 112 N 0.50 -0.09 -0.59 4.88 4.22 -0.21 -2.06 114.58 121.23 1t35 h GLU 112 Ca 0.10 0.01 -0.07 0.00 0.08 0.00 0.00 59.36 59.48 1t35 h GLU 112 Cb 0.38 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1t35 h GLU 112 CO 0.02 0.02 0.10 0.93 -2.18 0.00 0.00 179.01 177.90 1t35 h GLU 113 N -0.18 0.97 0.12 1.92 5.08 -1.06 -2.00 114.58 119.44 1t35 h GLU 113 Ca -0.01 -0.26 0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1t35 h GLU 113 Cb 0.15 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1t35 h GLU 113 CO 0.02 0.92 -0.17 1.25 -1.00 0.00 0.00 179.01 180.02 1t35 h LEU 114 N 0.87 -0.47 -1.97 1.33 5.85 -0.86 -0.96 115.31 119.09 1t35 h LEU 114 Ca 0.18 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.94 1t35 h LEU 114 Cb 0.41 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 1t35 h LEU 114 CO 0.01 -0.25 -0.08 -0.26 -0.34 0.00 0.00 178.44 177.52 1t35 h PHE 115 N -0.35 0.00 -0.05 1.25 -1.00 -1.35 -1.83 116.94 113.62 1t35 h PHE 115 Ca 0.02 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.75 1t35 h PHE 115 Cb 0.35 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.92 1t35 h PHE 115 CO -0.17 0.08 -0.17 1.49 -1.61 0.00 0.00 178.31 177.94 1t35 h GLU 116 N 0.00 0.20 -0.87 1.51 4.81 -0.59 -1.64 114.58 118.01 1t35 h GLU 116 Ca -0.00 -0.15 0.06 0.00 -0.13 0.00 0.00 59.36 59.14 1t35 h GLU 116 Cb 0.33 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 29.68 1t35 h GLU 116 CO 0.01 0.77 0.54 0.28 -0.73 0.00 0.00 179.01 179.89 1t35 h VAL 117 N -0.33 1.05 -0.55 0.32 2.07 -0.68 -0.20 116.25 117.93 1t35 h VAL 117 Ca -0.01 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.15 1t35 h VAL 117 Cb 0.79 -0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 1t35 h VAL 117 CO 0.04 0.18 0.24 -0.07 0.02 0.00 0.00 177.57 177.97 1t35 h LEU 118 N 1.00 0.71 -2.20 2.57 3.38 -1.33 -0.98 115.31 118.46 1t35 h LEU 118 Ca 0.38 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 1t35 h LEU 118 Cb 0.16 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1t35 h LEU 118 CO -0.17 0.63 -0.03 0.00 0.09 0.00 0.00 178.44 178.97 1t35 n TRP 120 N -3.23 0.19 -0.23 0.00 7.02 -0.58 -4.67 117.44 115.94 1t35 n TRP 120 Ca -0.01 0.06 -0.06 0.00 -1.02 0.00 0.00 57.50 56.46 1t35 n TRP 120 Cb 0.19 -0.55 -0.05 0.00 -2.42 0.00 0.00 31.31 28.48 1t35 n TRP 120 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1t35 n ALA 121 N -2.17 -0.33 0.05 6.99 0.00 -0.48 -1.62 120.51 122.95 1t35 n ALA 121 Ca -0.02 0.48 -0.13 0.00 0.00 0.00 0.00 53.44 53.77 1t35 n ALA 121 Cb 0.54 -0.09 -0.08 0.00 0.00 0.00 0.00 19.45 19.82 1t35 n ALA 121 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1t35 h GLN 122 N 0.00 -0.06 -6.60 0.00 7.50 -1.83 -3.45 115.11 110.68 1t35 h GLN 122 Ca 0.10 0.00 -0.54 0.00 0.50 0.00 0.00 58.65 58.71 1t35 h GLN 122 Cb 0.24 0.01 0.21 0.00 0.05 0.00 0.00 27.48 27.99 1t35 h GLN 122 CO -0.53 0.06 -0.76 -0.89 -1.50 0.00 0.00 178.83 175.22 1t35 n ILE 123 N -5.07 0.49 0.00 2.54 5.41 -0.64 -4.80 119.36 117.30 1t35 n ILE 123 Ca -0.08 -0.31 0.00 0.00 1.00 0.00 0.00 62.75 63.36 1t35 n ILE 123 Cb 0.10 -0.53 0.00 0.00 -0.71 0.00 0.00 39.64 38.50 1t35 n ILE 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1t35 n GLY 124 N 1.90 -1.63 0.09 7.39 0.00 -1.26 -4.82 105.19 106.85 1t35 n GLY 124 Ca 0.06 -1.44 -0.05 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.81 1.32 -3.37 -0.61 0.13 -1.26 -4.64 119.36 110.12 1t35 n ILE 125 Ca 0.00 -0.77 -0.46 0.00 -1.10 0.00 0.00 62.75 60.42 1t35 n ILE 125 Cb 0.00 -0.70 -0.03 0.00 -0.84 0.00 0.00 39.64 38.07 1t35 n ILE 125 CO 0.00 0.00 0.00 -2.28 2.80 0.00 0.00 176.55 177.07 1t35 s HIS 126 N -2.71 3.67 0.61 9.51 2.46 -1.26 -5.06 115.29 122.51 1t35 s HIS 126 Ca -0.06 -2.01 -0.10 0.00 0.47 0.00 0.00 55.06 53.36 1t35 s HIS 126 Cb 0.08 -3.74 -0.03 0.00 -0.13 0.00 0.00 32.58 28.75 1t35 s HIS 126 CO 0.83 -0.98 1.01 -0.65 -2.47 0.00 0.00 174.74 172.48 1t35 s GLN 127 N 0.28 3.52 0.07 2.88 -0.21 -1.26 -5.09 119.66 119.84 1t35 s GLN 127 Ca 0.16 0.66 0.05 0.00 0.02 0.00 0.00 55.36 56.25 1t35 s GLN 127 Cb -0.13 -2.11 -0.03 0.00 1.00 0.00 0.00 33.01 31.74 1t35 s GLN 127 CO -0.07 -0.57 -0.14 0.15 -2.12 0.00 0.00 175.29 172.54 1t35 s LYS 128 N -5.15 0.81 0.42 2.91 1.02 -1.26 -5.06 119.74 113.43 1t35 s LYS 128 Ca 0.54 -0.92 -0.22 0.00 0.02 0.00 0.00 55.97 55.39 1t35 s LYS 128 Cb -0.11 -0.81 -0.10 0.00 -0.52 0.00 0.00 37.83 36.29 1t35 s LYS 128 CO 0.53 0.18 0.97 -1.25 -0.92 0.00 0.00 175.35 174.86 1t35 s PRO 129 N -1.66 4.21 -0.20 -1.68 0.04 -1.26 -4.91 135.00 129.54 1t35 s PRO 129 Ca -0.02 1.24 0.01 0.00 0.04 0.00 0.00 61.00 62.27 1t35 s PRO 129 Cb -0.10 -2.30 0.03 0.00 0.04 0.00 0.00 34.50 32.17 1t35 s PRO 129 CO 0.02 -0.06 -0.15 0.42 0.04 0.00 0.00 177.00 177.27 1t35 s ILE 130 N -2.00 1.92 -0.16 0.56 1.01 0.25 -1.60 121.20 121.19 1t35 s ILE 130 Ca 0.61 -1.06 -0.02 0.00 0.00 0.00 0.00 60.65 60.17 1t35 s ILE 130 Cb -0.13 -1.87 -0.02 0.00 0.01 0.00 0.00 42.46 40.45 1t35 s ILE 130 CO 0.17 0.32 -0.07 -0.83 0.00 0.00 0.00 174.94 174.54 1t35 s GLY 131 N 1.30 1.63 -0.31 6.18 0.00 0.63 -0.78 107.32 115.97 1t35 s GLY 131 Ca 0.01 -0.91 -0.18 0.00 0.00 0.00 0.00 44.72 43.63 1t35 s GLY 131 CO -0.10 -0.02 0.53 1.08 0.00 0.00 0.00 173.10 174.59 1t35 s LEU 132 N 0.57 4.19 -1.01 0.66 1.43 0.86 -0.59 118.68 124.79 1t35 s LEU 132 Ca -0.05 0.25 -0.23 0.00 -1.03 0.00 0.00 54.13 53.07 1t35 s LEU 132 Cb -0.15 -2.65 0.05 0.00 0.03 0.00 0.00 46.19 43.47 1t35 s LEU 132 CO 0.03 -0.41 1.47 -0.47 0.23 0.00 0.00 176.35 177.20 1t35 s TYR 133 N 2.40 2.50 -0.02 0.29 5.04 -0.21 -2.12 117.35 125.22 1t35 s TYR 133 Ca 0.21 -0.77 -0.03 0.00 -2.44 0.00 0.00 57.07 54.04 1t35 s TYR 133 Cb -0.15 -4.67 -0.13 0.00 0.35 0.00 0.00 41.96 37.36 1t35 s TYR 133 CO 0.12 -1.93 2.01 -1.71 -1.34 0.00 0.00 175.55 172.69 1t35 n ASN 134 N 9.11 2.58 -4.66 4.32 5.15 0.36 -4.39 115.26 127.73 1t35 n ASN 134 Ca 0.33 -1.98 -0.42 0.00 -0.60 0.00 0.00 54.58 51.91 1t35 n ASN 134 Cb 0.51 -0.69 -0.03 0.00 -0.53 0.00 0.00 39.78 39.03 1t35 n ASN 134 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1t35 s VAL 135 N 2.08 3.02 -1.95 3.44 1.01 -1.26 -1.64 120.40 125.10 1t35 s VAL 135 Ca 0.32 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.33 1t35 s VAL 135 Cb 0.15 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.51 1t35 s VAL 135 CO -0.00 -0.00 0.00 -3.20 0.00 0.00 0.00 175.10 171.90 1t35 n ASN 136 N 7.51 -5.33 -1.10 3.32 2.85 -1.26 -1.86 115.26 119.39 1t35 n ASN 136 Ca 0.20 0.33 -0.12 0.00 -0.11 0.00 0.00 54.58 54.88 1t35 n ASN 136 Cb 0.41 -4.63 -0.03 0.00 1.24 0.00 0.00 39.78 36.77 1t35 n ASN 136 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1t35 n GLY 137 N -0.57 0.65 0.23 8.20 0.00 -0.65 -4.93 105.19 108.11 1t35 n GLY 137 Ca -0.21 -0.44 0.01 0.00 0.00 0.00 0.00 46.02 45.38 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 0.00 0.04 -0.00 1.61 3.20 -1.56 -1.85 116.97 118.41 1t35 h TYR 138 Ca -0.26 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.65 1t35 h TYR 138 Cb 0.97 0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.31 1t35 h TYR 138 CO 0.32 -0.12 0.00 1.19 -1.64 0.00 0.00 178.16 177.91 1t35 n PHE 139 N -5.23 0.00 0.02 -3.82 3.72 -1.26 -3.99 117.46 106.90 1t35 n PHE 139 Ca 0.09 -0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.37 1t35 n PHE 139 Cb 0.34 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.81 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 0.03 0.03 -5.02 -1.08 4.39 -1.73 -3.42 114.58 107.78 1t35 h GLU 140 Ca 0.00 -0.00 -0.36 0.00 0.34 0.00 0.00 59.36 59.34 1t35 h GLU 140 Cb 0.01 -0.01 0.09 0.00 -0.10 0.00 0.00 28.75 28.74 1t35 h GLU 140 CO 0.00 0.10 0.90 -2.30 -1.16 0.00 0.00 179.01 176.55 1t35 n PRO 141 N -5.03 0.03 -0.87 2.33 -0.02 -1.26 -5.04 135.00 125.14 1t35 n PRO 141 Ca -0.07 -1.09 0.00 0.00 -2.02 0.00 0.00 63.50 60.32 1t35 n PRO 141 Cb 0.07 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 30.79 1t35 n PRO 141 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1t35 n LYS 144 N 7.58 0.00 0.00 -0.52 4.81 -1.26 -5.05 118.16 123.72 1t35 n LYS 144 Ca 0.40 0.16 0.00 0.00 -0.87 0.00 0.00 58.31 58.00 1t35 n LYS 144 Cb 0.42 -2.26 0.00 0.00 0.02 0.00 0.00 35.03 33.22 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 -2.69 0.00 -0.11 3.15 0.31 -1.26 -1.24 118.33 116.49 1t35 n VAL 146 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.27 1t35 n VAL 146 Cb 0.14 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 33.08 1t35 n VAL 146 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1t35 h LYS 147 N 0.00 0.31 -0.43 5.55 1.63 -1.99 -0.94 116.57 120.70 1t35 h LYS 147 Ca 0.00 -0.02 0.03 0.00 -0.85 0.00 0.00 60.65 59.81 1t35 h LYS 147 Cb 0.00 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.52 1t35 h LYS 147 CO 0.00 0.21 0.23 1.88 -3.45 0.00 0.00 179.45 178.31 1t35 h TYR 148 N 0.32 0.42 -0.79 1.91 0.05 -1.61 0.06 116.97 117.34 1t35 h TYR 148 Ca 0.16 0.02 0.15 0.00 0.05 0.00 0.00 58.73 59.11 1t35 h TYR 148 Cb 0.11 -0.13 -0.10 0.00 1.01 0.00 0.00 36.73 37.62 1t35 h TYR 148 CO -0.12 0.22 0.33 1.03 -1.05 0.00 0.00 178.16 178.58 1t35 h SER 149 N 0.45 0.33 -0.40 3.88 0.87 -1.62 -0.29 113.55 116.78 1t35 h SER 149 Ca 0.18 0.11 -0.06 0.00 -1.23 0.00 0.00 61.79 60.79 1t35 h SER 149 Cb 0.07 0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.09 1t35 h SER 149 CO -0.12 0.12 0.03 0.40 -0.53 0.00 0.00 176.83 176.73 1t35 h ILE 150 N 0.48 1.25 -0.27 2.23 2.04 0.13 -1.73 117.51 121.64 1t35 h ILE 150 Ca 0.44 -0.96 -0.04 0.00 1.00 0.00 0.00 64.86 65.30 1t35 h ILE 150 Cb 0.67 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 1t35 h ILE 150 CO -0.41 0.33 0.00 1.56 0.00 0.00 0.00 178.15 179.63 1t35 h GLN 151 N 0.53 0.40 -0.00 2.37 4.20 0.38 -1.39 115.11 121.60 1t35 h GLN 151 Ca 0.12 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1t35 h GLN 151 Cb 0.43 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1t35 h GLN 151 CO 0.02 0.43 -0.02 0.39 -0.67 0.00 0.00 178.83 178.97 1t35 n GLU 152 N -4.33 0.81 -0.89 1.46 -0.58 -0.26 -4.91 120.64 111.94 1t35 n GLU 152 Ca 0.01 -0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.63 1t35 n GLU 152 Cb 0.21 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.58 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 1.16 0.47 0.08 0.62 0.00 -0.52 -4.93 105.19 102.07 1t35 n GLY 153 Ca 0.19 -0.72 0.11 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.89 0.66 -4.57 1.61 3.72 -0.67 -4.93 117.46 110.38 1t35 n PHE 154 Ca 0.00 0.19 -0.26 0.00 -0.05 0.00 0.00 57.45 57.33 1t35 n PHE 154 Cb 0.00 -0.80 -0.11 0.00 -0.94 0.00 0.00 39.48 37.63 1t35 n PHE 154 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1t35 s SER 155 N -5.04 3.67 -0.05 4.37 0.01 -1.14 -4.98 113.70 110.54 1t35 s SER 155 Ca -0.02 -1.30 0.06 0.00 1.31 0.00 0.00 55.95 55.99 1t35 s SER 155 Cb 0.11 -0.35 -0.01 0.00 0.21 0.00 0.00 66.02 65.98 1t35 s SER 155 CO 0.82 -0.37 -0.22 0.21 0.41 0.00 0.00 173.24 174.09 1t35 s ASN 156 N -3.64 2.75 0.00 2.44 3.84 -1.26 -4.58 114.94 114.49 1t35 s ASN 156 Ca 0.34 -0.46 0.10 0.00 0.21 0.00 0.00 52.86 53.05 1t35 s ASN 156 Cb 0.07 -0.75 0.45 0.00 -0.55 0.00 0.00 41.25 40.48 1t35 s ASN 156 CO 0.17 0.22 1.26 1.21 -2.79 0.00 0.00 177.10 177.17 1t35 n GLU 157 N 3.00 0.06 -0.17 0.43 2.13 -1.26 -2.74 120.64 122.10 1t35 n GLU 157 Ca -0.18 0.27 -0.05 0.00 0.66 0.00 0.00 57.16 57.86 1t35 n GLU 157 Cb 0.52 -1.50 0.04 0.00 0.27 0.00 0.00 31.44 30.77 1t35 n GLU 157 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 1t35 h SER 158 N 0.00 0.47 0.00 4.31 0.02 -2.04 -1.08 113.55 115.24 1t35 h SER 158 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1t35 h SER 158 Cb 0.13 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.58 1t35 h SER 158 CO 0.00 0.33 0.00 1.41 -1.14 0.00 0.00 176.83 177.43 1t35 n HIS 159 N -4.81 0.00 0.72 3.45 8.25 -1.11 -2.40 115.22 119.32 1t35 n HIS 159 Ca 0.04 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.60 1t35 n HIS 159 Cb 0.08 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.16 1t35 n HIS 159 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1t35 n LEU 160 N -0.94 0.68 -0.03 2.41 0.00 -0.41 -4.26 117.00 114.46 1t35 n LEU 160 Ca 0.05 -0.21 0.14 0.00 0.00 0.00 0.00 56.01 55.99 1t35 n LEU 160 Cb 0.02 -0.06 0.56 0.00 0.00 0.00 0.00 43.42 43.94 1t35 n LEU 160 CO 0.04 0.13 0.84 2.29 0.00 0.00 0.00 177.39 180.69 1t35 n LYS 161 N -1.76 0.21 -0.07 1.96 2.85 -1.01 -3.26 118.16 117.08 1t35 n LYS 161 Ca 0.02 -0.05 0.12 0.00 -1.05 0.00 0.00 58.31 57.35 1t35 n LYS 161 Cb 0.40 -1.50 0.14 0.00 -0.65 0.00 0.00 35.03 33.42 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 -1.35 3.17 -4.91 -5.58 4.32 -1.26 -4.95 117.00 106.44 1t35 n LEU 162 Ca 0.09 -1.20 -0.30 0.00 -0.02 0.00 0.00 56.01 54.59 1t35 n LEU 162 Cb 0.31 -0.10 -0.04 0.00 -1.62 0.00 0.00 43.42 41.97 1t35 n LEU 162 CO 0.27 0.59 -0.00 -0.63 -1.22 0.00 0.00 177.39 176.40 1t35 s ILE 163 N -1.78 5.22 -0.09 -0.08 1.01 -1.20 0.87 121.20 125.15 1t35 s ILE 163 Ca 0.32 -0.17 -0.10 0.00 0.00 0.00 0.00 60.65 60.70 1t35 s ILE 163 Cb 0.21 -3.66 0.03 0.00 0.01 0.00 0.00 42.46 39.05 1t35 s ILE 163 CO 0.30 -0.01 0.27 -1.00 0.00 0.00 0.00 174.94 174.50 1t35 s HIS 164 N -1.70 -0.28 -0.06 3.97 3.76 0.04 -4.91 115.29 116.11 1t35 s HIS 164 Ca 0.39 0.67 0.02 0.00 -0.15 0.00 0.00 55.06 55.99 1t35 s HIS 164 Cb -0.12 0.10 0.01 0.00 1.11 0.00 0.00 32.58 33.68 1t35 s HIS 164 CO 0.27 -0.16 -0.12 0.45 -0.85 0.00 0.00 174.74 174.32 1t35 s SER 165 N -0.01 1.76 -0.08 1.40 0.15 -1.26 -0.10 113.70 115.56 1t35 s SER 165 Ca -0.01 -0.29 -0.30 0.00 0.70 0.00 0.00 55.95 56.05 1t35 s SER 165 Cb -0.02 -0.81 0.11 0.00 -1.71 0.00 0.00 66.02 63.59 1t35 s SER 165 CO 0.01 0.03 0.92 -0.55 1.20 0.00 0.00 173.24 174.85 1t35 s SER 166 N 0.65 -0.39 0.00 5.45 0.15 -0.90 -4.92 113.70 113.73 1t35 s SER 166 Ca -0.14 0.24 0.17 0.00 0.70 0.00 0.00 55.95 56.92 1t35 s SER 166 Cb -0.16 0.36 0.05 0.00 -1.71 0.00 0.00 66.02 64.57 1t35 s SER 166 CO 0.04 -0.49 0.96 -1.54 1.20 0.00 0.00 173.24 173.40 1t35 n SER 167 N 0.29 2.00 -4.50 5.45 3.41 -1.26 -0.49 113.62 118.52 1t35 n SER 167 Ca -0.10 -1.50 -0.36 0.00 -0.26 0.00 0.00 58.87 56.65 1t35 n SER 167 Cb 0.60 0.28 -0.12 0.00 -0.26 0.00 0.00 64.21 64.71 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 -1.78 3.76 0.13 4.33 0.52 -1.26 -4.84 118.95 119.81 1t35 s ARG 168 Ca 0.17 -0.43 -0.32 0.00 -0.52 0.00 0.00 55.73 54.63 1t35 s ARG 168 Cb 0.14 -3.36 -0.10 0.00 0.52 0.00 0.00 34.95 32.14 1t35 s ARG 168 CO 0.35 -0.11 1.54 -1.35 0.02 0.00 0.00 175.30 175.74 1t35 h PRO 169 N 8.00 -0.34 -0.85 3.54 0.11 -1.93 -0.25 132.00 140.29 1t35 h PRO 169 Ca -0.37 0.02 0.17 0.00 0.11 0.00 0.00 66.00 65.93 1t35 h PRO 169 Cb 1.18 0.08 -0.11 0.00 0.11 0.00 0.00 31.00 32.26 1t35 h PRO 169 CO 0.59 -0.22 0.39 0.38 -0.21 0.00 0.00 178.00 178.93 1t35 h ASP 170 N -0.35 0.40 0.29 -2.05 2.03 -1.96 -2.10 116.42 112.68 1t35 h ASP 170 Ca 0.08 0.12 -0.22 0.00 -0.73 0.00 0.00 57.03 56.28 1t35 h ASP 170 Cb 0.56 0.07 0.00 0.00 -0.83 0.00 0.00 39.33 39.14 1t35 h ASP 170 CO -0.62 0.11 -0.89 -0.08 -1.03 0.00 0.00 179.24 176.72 1t35 h GLU 171 N 0.50 0.43 0.27 4.15 4.81 -1.76 -2.51 114.58 120.47 1t35 h GLU 171 Ca 0.49 -0.43 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1t35 h GLU 171 Cb 0.81 0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.31 1t35 h GLU 171 CO -0.44 1.09 -0.13 1.25 -0.73 0.00 0.00 179.01 180.05 1t35 h LEU 172 N 0.26 -0.31 -1.99 1.64 6.46 -0.52 -1.69 115.31 119.16 1t35 h LEU 172 Ca -0.07 -0.17 0.02 0.00 -0.12 0.00 0.00 57.88 57.54 1t35 h LEU 172 Cb 1.52 0.08 -0.00 0.00 -0.73 0.00 0.00 40.66 41.52 1t35 h LEU 172 CO 0.16 0.02 0.06 0.40 -0.62 0.00 0.00 178.44 178.46 1t35 h ILE 173 N -0.66 0.96 0.45 4.05 2.04 -1.51 -2.53 117.51 120.31 1t35 h ILE 173 Ca -0.04 -0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 1t35 h ILE 173 Cb 0.46 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 1t35 h ILE 173 CO 0.06 0.00 -0.22 -0.33 0.00 0.00 0.00 178.15 177.66 1t35 h GLU 174 N 0.01 -0.59 -1.95 2.37 4.39 -1.18 -0.45 114.58 117.18 1t35 h GLU 174 Ca 0.04 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.78 1t35 h GLU 174 Cb 0.16 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 1t35 h GLU 174 CO -0.00 -0.29 0.00 1.04 -1.16 0.00 0.00 179.01 178.60 1t35 n GLN 175 N -5.26 0.11 -2.13 2.33 6.02 -0.66 -4.83 117.38 112.96 1t35 n GLN 175 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 1t35 n GLN 175 Cb 0.30 -1.45 0.00 0.00 1.02 0.00 0.00 30.24 30.11 1t35 n GLN 175 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1t35 n GLN 177 N 1.53 -4.97 -4.43 -1.09 -0.06 -0.18 -4.99 117.38 103.18 1t35 n GLN 177 Ca 0.00 3.61 -0.32 0.00 -2.00 0.00 0.00 57.00 58.29 1t35 n GLN 177 Cb 0.05 -4.24 -0.10 0.00 -4.06 0.00 0.00 30.24 21.89 1t35 n GLN 177 CO 0.00 0.00 0.00 1.21 -0.20 0.00 0.00 177.06 178.07 1t35 s ASN 178 N -0.52 4.61 0.00 1.69 2.47 -1.26 -5.15 114.94 116.77 1t35 s ASN 178 Ca 0.00 -0.17 0.23 0.00 0.42 0.00 0.00 52.86 53.35 1t35 s ASN 178 Cb 0.00 -1.06 1.39 0.00 -1.45 0.00 0.00 41.25 40.13 1t35 s ASN 178 CO 0.00 0.27 1.76 -1.22 -3.72 0.00 0.00 177.10 174.19