#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c6b s ASN 2 N 0.00 0.27 0.26 6.12 2.20 -1.26 -5.02 114.94 117.50 1c6b s ASN 2 Ca 0.00 -1.22 -0.02 0.00 -0.94 0.00 0.00 52.86 50.68 1c6b s ASN 2 Cb 0.00 0.79 0.47 0.00 -2.00 0.00 0.00 41.25 40.51 1c6b s ASN 2 CO 0.00 -1.55 1.80 -0.29 -2.94 0.00 0.00 177.10 174.12 1c6b h ILE 3 N 2.04 0.84 0.42 0.54 6.09 -1.98 0.99 117.51 126.45 1c6b h ILE 3 Ca -0.30 -0.26 -0.02 0.00 -1.37 0.00 0.00 64.86 62.91 1c6b h ILE 3 Cb 1.25 0.02 0.00 0.00 0.47 0.00 0.00 36.82 38.56 1c6b h ILE 3 CO 0.39 0.14 -0.20 -0.26 -3.07 0.00 0.00 178.15 175.15 1c6b h PHE 4 N 0.76 -0.52 -0.83 2.19 0.04 -1.98 0.35 116.94 116.94 1c6b h PHE 4 Ca 0.44 -0.01 0.06 0.00 2.80 0.00 0.00 57.97 61.26 1c6b h PHE 4 Cb 0.50 0.17 -0.05 0.00 2.20 0.00 0.00 35.95 38.76 1c6b h PHE 4 CO -0.06 -0.21 0.54 0.93 -0.60 0.00 0.00 178.31 178.92 1c6b h GLU 5 N -0.83 0.90 0.23 1.51 5.08 -1.91 -0.11 114.58 119.45 1c6b h GLU 5 Ca -0.06 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1c6b h GLU 5 Cb 0.55 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1c6b h GLU 5 CO 0.09 0.59 -0.11 1.98 -1.00 0.00 0.00 179.01 180.56 1c6b h MET 6 N 0.92 -0.30 0.00 2.33 4.05 -0.46 -2.45 114.93 119.02 1c6b h MET 6 Ca 0.36 0.02 -0.09 0.00 -0.28 0.00 0.00 59.70 59.71 1c6b h MET 6 Cb 0.22 0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.07 1c6b h MET 6 CO -0.13 -0.07 -0.42 -0.07 0.23 0.00 0.00 176.91 176.45 1c6b h LEU 7 N -0.49 0.00 -1.48 3.39 3.38 -0.02 -1.79 115.31 118.30 1c6b h LEU 7 Ca -0.03 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 1c6b h LEU 7 Cb 0.37 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1c6b h LEU 7 CO 0.05 0.42 -0.06 -0.09 0.09 0.00 0.00 178.44 178.84 1c6b h ARG 8 N 0.00 0.26 -0.03 1.13 9.65 -0.98 0.23 114.38 124.65 1c6b h ARG 8 Ca -0.00 -0.05 -0.09 0.00 -1.10 0.00 0.00 59.98 58.74 1c6b h ARG 8 Cb 0.76 -0.04 0.01 0.00 -1.39 0.00 0.00 29.97 29.31 1c6b h ARG 8 CO 0.05 0.34 -0.35 0.82 2.80 0.00 0.00 179.97 183.64 1c6b h ILE 9 N 0.25 1.47 0.00 1.20 2.04 -0.93 -2.23 117.51 119.31 1c6b h ILE 9 Ca 0.06 -1.88 -0.05 0.00 1.00 0.00 0.00 64.86 63.98 1c6b h ILE 9 Cb 0.28 2.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.92 1c6b h ILE 9 CO 0.01 0.53 -0.24 0.44 0.00 0.00 0.00 178.15 178.90 1c6b h ASP 10 N -0.29 0.00 0.00 1.72 3.32 -0.89 -3.31 116.42 116.96 1c6b h ASP 10 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1c6b h ASP 10 Cb 1.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.60 1c6b h ASP 10 CO 0.07 0.24 -1.46 -0.62 -1.72 0.00 0.00 179.24 175.75 1c6b n GLU 11 N -3.32 0.85 -0.10 3.56 -0.58 0.78 -5.08 120.64 116.74 1c6b n GLU 11 Ca 0.01 -0.11 0.01 0.00 -0.42 0.00 0.00 57.16 56.65 1c6b n GLU 11 Cb 0.48 -1.32 -0.00 0.00 -0.57 0.00 0.00 31.44 30.03 1c6b n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1c6b n GLY 12 N 1.58 -1.66 2.87 0.62 0.00 -0.84 -4.42 105.19 103.34 1c6b n GLY 12 Ca -0.02 -1.26 -0.23 0.00 0.00 0.00 0.00 46.02 44.52 1c6b n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1c6b s LEU 13 N 0.00 1.09 -0.02 0.99 2.96 -1.26 -4.21 118.68 118.23 1c6b s LEU 13 Ca 0.00 -0.17 -0.00 0.00 -0.22 0.00 0.00 54.13 53.74 1c6b s LEU 13 Cb 0.00 -0.57 0.03 0.00 0.50 0.00 0.00 46.19 46.15 1c6b s LEU 13 CO 0.00 -0.10 0.03 -0.13 -1.32 0.00 0.00 176.35 174.83 1c6b s ARG 14 N 1.40 -0.02 0.00 1.98 0.52 0.05 -4.98 118.95 117.90 1c6b s ARG 14 Ca -0.03 0.17 0.26 0.00 -0.52 0.00 0.00 55.73 55.61 1c6b s ARG 14 Cb -0.13 -0.20 0.61 0.00 0.52 0.00 0.00 34.95 35.74 1c6b s ARG 14 CO -0.03 -0.14 1.48 1.28 0.02 0.00 0.00 175.30 177.91 1c6b n LEU 15 N 4.00 1.70 -4.40 2.53 4.77 -1.26 0.53 117.00 124.87 1c6b n LEU 15 Ca -0.25 -0.55 -0.29 0.00 -0.03 0.00 0.00 56.01 54.88 1c6b n LEU 15 Cb 0.52 -0.04 -0.13 0.00 -2.33 0.00 0.00 43.42 41.44 1c6b n LEU 15 CO 0.22 0.30 -0.56 -0.54 -1.33 0.00 0.00 177.39 175.48 1c6b s LYS 16 N -2.25 1.47 0.16 3.23 3.01 -1.26 -1.83 119.74 122.26 1c6b s LYS 16 Ca 0.28 -1.32 -0.34 0.00 -1.01 0.00 0.00 55.97 53.58 1c6b s LYS 16 Cb 0.20 -1.93 -0.14 0.00 -1.01 0.00 0.00 37.83 34.94 1c6b s LYS 16 CO 0.43 0.46 1.48 -0.89 0.51 0.00 0.00 175.35 177.34 1c6b n ILE 17 N 0.94 0.19 -4.40 2.17 5.41 -0.71 -4.70 119.36 118.26 1c6b n ILE 17 Ca -0.18 -0.05 -0.22 0.00 1.00 0.00 0.00 62.75 63.30 1c6b n ILE 17 Cb 0.53 -1.34 -0.08 0.00 -0.71 0.00 0.00 39.64 38.04 1c6b n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1c6b s TYR 18 N 0.61 1.73 -0.09 1.39 1.13 -0.18 -4.98 117.35 116.95 1c6b s TYR 18 Ca 0.78 -1.41 0.01 0.00 -1.41 0.00 0.00 57.07 55.04 1c6b s TYR 18 Cb -0.74 -0.96 -0.02 0.00 -1.10 0.00 0.00 41.96 39.14 1c6b s TYR 18 CO 0.42 -0.52 -0.12 0.15 -2.51 0.00 0.00 175.55 172.98 1c6b s LYS 19 N -3.67 2.95 0.93 -3.49 1.02 -1.26 -1.48 119.74 114.75 1c6b s LYS 19 Ca 0.32 -0.65 -0.16 0.00 0.02 0.00 0.00 55.97 55.50 1c6b s LYS 19 Cb 0.03 -2.55 0.23 0.00 -0.52 0.00 0.00 37.83 35.02 1c6b s LYS 19 CO 0.19 0.46 0.94 -0.40 -0.92 0.00 0.00 175.35 175.62 1c6b n ASP 20 N 2.82 -1.31 0.32 2.83 5.75 0.15 -4.77 116.55 122.35 1c6b n ASP 20 Ca -0.18 -1.14 0.22 0.00 -0.01 0.00 0.00 54.79 53.68 1c6b n ASP 20 Cb 0.53 -0.82 1.10 0.00 -1.03 0.00 0.00 41.12 40.90 1c6b n ASP 20 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1c6b h THR 21 N -2.24 0.00 -0.02 2.12 1.35 -2.00 0.46 112.91 112.59 1c6b h THR 21 Ca -0.34 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 1c6b h THR 21 Cb 1.00 1.11 0.00 0.00 -1.73 0.00 0.00 68.15 68.53 1c6b h THR 21 CO 0.23 0.00 -0.10 -0.62 -0.25 0.00 0.00 175.52 174.78 1c6b n GLU 22 N -3.07 1.64 -0.48 4.72 -0.58 -1.26 -4.94 120.64 116.67 1c6b n GLU 22 Ca -0.02 -1.14 0.00 0.00 -0.42 0.00 0.00 57.16 55.58 1c6b n GLU 22 Cb 0.12 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.52 1c6b n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1c6b n GLY 23 N 1.28 0.76 3.92 0.62 0.00 0.16 -5.07 105.19 106.86 1c6b n GLY 23 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 1c6b n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1c6b s TYR 24 N -2.06 3.48 -0.04 1.61 2.02 -1.26 -4.63 117.35 116.48 1c6b s TYR 24 Ca 0.00 0.35 -0.30 0.00 -0.37 0.00 0.00 57.07 56.75 1c6b s TYR 24 Cb 0.00 -1.86 -0.04 0.00 -0.40 0.00 0.00 41.96 39.66 1c6b s TYR 24 CO 0.00 0.39 1.24 0.71 -1.57 0.00 0.00 175.55 176.32 1c6b s TYR 25 N -1.84 3.14 0.13 2.71 2.02 -1.19 0.34 117.35 122.67 1c6b s TYR 25 Ca 0.38 1.14 -0.01 0.00 -0.37 0.00 0.00 57.07 58.21 1c6b s TYR 25 Cb -0.11 -3.47 -0.04 0.00 -0.40 0.00 0.00 41.96 37.94 1c6b s TYR 25 CO 0.29 -1.53 0.06 0.99 -1.57 0.00 0.00 175.55 173.79 1c6b s THR 26 N 2.17 0.10 0.12 -0.71 2.01 -0.55 -0.12 115.64 118.66 1c6b s THR 26 Ca 0.58 -1.89 -0.16 0.00 0.31 0.00 0.00 61.69 60.52 1c6b s THR 26 Cb -0.26 -2.03 0.04 0.00 0.01 0.00 0.00 72.50 70.25 1c6b s THR 26 CO 0.23 -0.46 0.41 -0.51 -0.69 0.00 0.00 174.62 173.60 1c6b s ILE 27 N -4.04 0.07 0.00 1.82 2.07 -0.67 -1.01 121.20 119.42 1c6b s ILE 27 Ca 0.24 -0.54 0.00 0.00 -1.41 0.00 0.00 60.65 58.93 1c6b s ILE 27 Cb 0.07 -1.15 0.00 0.00 0.13 0.00 0.00 42.46 41.51 1c6b s ILE 27 CO 0.02 -0.30 0.00 0.61 -1.91 0.00 0.00 174.94 173.36 1c6b n GLY 28 N -0.21 3.11 2.91 1.50 0.00 0.19 -1.29 105.19 111.40 1c6b n GLY 28 Ca -0.16 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 1c6b n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1c6b n ILE 29 N 0.00 5.42 -1.20 -0.61 5.41 -1.26 -0.77 119.36 126.35 1c6b n ILE 29 Ca 0.00 -5.93 -0.03 0.00 1.00 0.00 0.00 62.75 57.78 1c6b n ILE 29 Cb 0.00 -1.96 -0.01 0.00 -0.71 0.00 0.00 39.64 36.96 1c6b n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1c6b n GLY 30 N 0.99 0.59 3.50 7.39 0.00 -1.24 -4.92 105.19 111.50 1c6b n GLY 30 Ca 0.31 -0.91 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 1c6b n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1c6b s HIS 31 N -2.13 2.51 0.27 1.61 5.04 -0.41 -4.89 115.29 117.29 1c6b s HIS 31 Ca 0.00 -0.35 -0.30 0.00 -1.54 0.00 0.00 55.06 52.87 1c6b s HIS 31 Cb 0.00 -4.45 -0.11 0.00 0.04 0.00 0.00 32.58 28.06 1c6b s HIS 31 CO 0.00 -1.84 1.62 -1.17 -2.34 0.00 0.00 174.74 171.01 1c6b s LEU 32 N 4.79 4.35 -0.25 8.88 2.96 -1.26 -1.68 118.68 136.46 1c6b s LEU 32 Ca 0.28 2.93 0.00 0.00 -0.22 0.00 0.00 54.13 57.12 1c6b s LEU 32 Cb -0.13 -3.63 -0.16 0.00 0.50 0.00 0.00 46.19 42.78 1c6b s LEU 32 CO 0.12 -0.93 -0.24 0.18 -1.32 0.00 0.00 176.35 174.16 1c6b n LEU 33 N 2.58 2.85 -3.56 -0.68 4.77 0.83 -4.92 117.00 118.86 1c6b n LEU 33 Ca 0.10 -0.08 -0.08 0.00 -0.03 0.00 0.00 56.01 55.92 1c6b n LEU 33 Cb 0.37 -0.87 -0.03 0.00 -2.33 0.00 0.00 43.42 40.56 1c6b n LEU 33 CO 0.64 0.88 0.83 0.28 -1.33 0.00 0.00 177.39 178.68 1c6b s THR 34 N -2.50 0.00 -2.47 -5.08 -1.32 -1.09 -4.92 115.64 98.25 1c6b s THR 34 Ca -0.34 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 60.37 1c6b s THR 34 Cb 0.09 -1.00 0.42 0.00 -1.51 0.00 0.00 72.50 70.50 1c6b s THR 34 CO 0.56 0.00 1.43 0.29 -2.21 0.00 0.00 174.62 174.69 1c6b n LYS 35 N 0.20 2.34 -2.68 7.08 5.02 -1.26 -3.14 118.16 125.71 1c6b n LYS 35 Ca -0.07 -2.01 -0.37 0.00 -2.02 0.00 0.00 58.31 53.85 1c6b n LYS 35 Cb 0.59 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 34.06 1c6b n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1c6b s SER 36 N -1.54 7.11 0.00 4.39 0.15 -1.26 -4.97 113.70 117.58 1c6b s SER 36 Ca 0.37 1.93 0.30 0.00 0.70 0.00 0.00 55.95 59.25 1c6b s SER 36 Cb 0.21 -2.58 1.40 0.00 -1.71 0.00 0.00 66.02 63.34 1c6b s SER 36 CO 0.30 -0.24 1.96 -0.81 1.20 0.00 0.00 173.24 175.66 1c6b n PRO 37 N 0.33 0.80 -3.13 5.44 -0.04 -1.26 -4.66 135.00 132.47 1c6b n PRO 37 Ca 0.03 -0.21 -0.39 0.00 -0.04 0.00 0.00 63.50 62.88 1c6b n PRO 37 Cb 0.50 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.41 1c6b n PRO 37 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1c6b s SER 38 N -2.35 6.80 0.41 3.54 0.15 -1.26 -4.90 113.70 116.09 1c6b s SER 38 Ca 0.34 0.97 0.26 0.00 0.70 0.00 0.00 55.95 58.21 1c6b s SER 38 Cb 0.21 -2.36 0.74 0.00 -1.71 0.00 0.00 66.02 62.89 1c6b s SER 38 CO 0.44 -0.16 1.74 0.25 1.20 0.00 0.00 173.24 176.71 1c6b h LEU 39 N 7.35 0.00 -0.10 3.45 5.85 -1.99 -1.34 115.31 128.54 1c6b h LEU 39 Ca -0.37 0.00 -0.19 0.00 0.84 0.00 0.00 57.88 58.16 1c6b h LEU 39 Cb 1.17 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.21 1c6b h LEU 39 CO 0.76 0.00 -0.69 0.78 -0.34 0.00 0.00 178.44 178.95 1c6b h ASN 40 N 0.00 0.77 -0.46 1.25 2.35 -1.98 0.73 115.58 118.25 1c6b h ASN 40 Ca 0.00 -0.66 -0.01 0.00 -0.55 0.00 0.00 56.30 55.08 1c6b h ASN 40 Cb 0.77 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.89 1c6b h ASN 40 CO 0.00 1.32 0.25 0.00 -1.65 0.00 0.00 177.43 177.35 1c6b h ALA 41 N 0.47 0.59 -0.33 -0.83 0.00 -1.85 -1.45 119.26 115.86 1c6b h ALA 41 Ca -0.06 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.83 1c6b h ALA 41 Cb 1.34 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.88 1c6b h ALA 41 CO 0.14 0.11 -0.09 0.00 0.00 0.00 0.00 179.25 179.41 1c6b h ALA 42 N 1.10 0.20 -0.90 0.00 0.00 -1.01 -1.46 119.26 117.19 1c6b h ALA 42 Ca 0.16 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1c6b h ALA 42 Cb 0.05 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1c6b h ALA 42 CO -0.03 -0.47 0.49 0.87 0.00 0.00 0.00 179.25 180.12 1c6b h LYS 43 N -0.01 1.26 0.03 0.00 1.57 -0.57 -0.65 116.57 118.20 1c6b h LYS 43 Ca 0.16 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1c6b h LYS 43 Cb 0.25 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1c6b h LYS 43 CO -0.34 0.92 -0.02 1.03 -0.57 0.00 0.00 179.45 180.47 1c6b h SER 44 N 1.27 -0.04 -0.93 0.86 0.87 -0.50 -0.86 113.55 114.22 1c6b h SER 44 Ca 0.32 -0.17 0.11 0.00 -1.23 0.00 0.00 61.79 60.82 1c6b h SER 44 Cb 0.03 0.01 -0.08 0.00 -0.44 0.00 0.00 62.40 61.92 1c6b h SER 44 CO -0.05 0.15 0.57 -0.33 -0.53 0.00 0.00 176.83 176.64 1c6b h GLU 45 N -0.22 0.89 -0.51 2.24 4.39 -1.16 -0.27 114.58 119.94 1c6b h GLU 45 Ca -0.00 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.60 1c6b h GLU 45 Cb 0.20 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 1c6b h GLU 45 CO 0.01 0.59 0.14 1.25 -1.16 0.00 0.00 179.01 179.84 1c6b h LEU 46 N 0.91 0.75 -1.17 1.33 5.85 -0.61 0.08 115.31 122.46 1c6b h LEU 46 Ca 0.46 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.94 1c6b h LEU 46 Cb 0.44 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1c6b h LEU 46 CO -0.26 0.78 0.32 0.44 -0.34 0.00 0.00 178.44 179.37 1c6b h ASP 47 N 0.70 0.81 -0.10 1.25 3.32 -0.08 -0.28 116.42 122.04 1c6b h ASP 47 Ca 0.16 -0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1c6b h ASP 47 Cb 0.30 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 1c6b h ASP 47 CO -0.00 0.68 -0.02 0.50 -1.72 0.00 0.00 179.24 178.68 1c6b h LYS 48 N 0.90 0.19 -0.16 3.56 3.64 -0.81 0.76 116.57 124.64 1c6b h LYS 48 Ca 0.22 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.49 1c6b h LYS 48 Cb 0.07 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1c6b h LYS 48 CO -0.03 0.49 -0.12 0.00 -2.27 0.00 0.00 179.45 177.52 1c6b h ALA 49 N 0.70 1.50 0.00 5.00 0.00 -0.72 -3.15 119.26 122.60 1c6b h ALA 49 Ca 0.03 -0.20 -0.25 0.00 0.00 0.00 0.00 54.91 54.49 1c6b h ALA 49 Cb 0.41 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1c6b h ALA 49 CO 0.01 0.35 -1.72 -0.89 0.00 0.00 0.00 179.25 177.00 1c6b n ILE 50 N -4.28 1.36 -1.02 0.00 2.08 -0.14 -4.98 119.36 112.38 1c6b n ILE 50 Ca -0.01 -0.76 0.00 0.00 0.56 0.00 0.00 62.75 62.55 1c6b n ILE 50 Cb 0.26 -0.80 0.00 0.00 -0.75 0.00 0.00 39.64 38.36 1c6b n ILE 50 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1c6b n GLY 51 N 1.52 0.65 3.66 7.39 0.00 0.26 -5.04 105.19 113.63 1c6b n GLY 51 Ca -0.16 -0.74 -0.07 0.00 0.00 0.00 0.00 46.02 45.05 1c6b n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1c6b s ARG 52 N -2.15 1.25 -0.66 1.61 1.70 -1.05 -5.05 118.95 114.59 1c6b s ARG 52 Ca 0.00 -0.62 -0.24 0.00 -0.47 0.00 0.00 55.73 54.40 1c6b s ARG 52 Cb 0.00 0.47 0.05 0.00 -0.57 0.00 0.00 34.95 34.91 1c6b s ARG 52 CO 0.00 -0.56 1.06 1.21 -1.08 0.00 0.00 175.30 175.92 1c6b s ASN 53 N -2.80 6.21 0.12 -2.89 2.47 -1.26 -4.35 114.94 112.43 1c6b s ASN 53 Ca 0.08 -0.69 0.12 0.00 0.42 0.00 0.00 52.86 52.80 1c6b s ASN 53 Cb -0.02 -2.47 -0.13 0.00 -1.45 0.00 0.00 41.25 37.18 1c6b s ASN 53 CO -0.02 -1.52 1.11 0.00 -3.72 0.00 0.00 177.10 172.95 1c6b n ASN 55 N -3.17 -5.32 -0.11 0.00 5.15 -1.26 -2.76 115.26 107.80 1c6b n ASN 55 Ca -0.05 -0.29 -0.01 0.00 -0.60 0.00 0.00 54.58 53.63 1c6b n ASN 55 Cb 0.89 -4.09 -0.01 0.00 -0.53 0.00 0.00 39.78 36.04 1c6b n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1c6b n GLY 56 N -1.47 0.44 3.02 8.20 0.00 -1.26 -5.02 105.19 109.09 1c6b n GLY 56 Ca -0.06 -0.13 -0.16 0.00 0.00 0.00 0.00 46.02 45.67 1c6b n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c6b s VAL 57 N -1.76 0.57 0.31 1.61 1.01 -1.11 -1.73 120.40 119.31 1c6b s VAL 57 Ca 0.00 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.43 1c6b s VAL 57 Cb 0.00 -0.54 -0.05 0.00 0.00 0.00 0.00 36.38 35.80 1c6b s VAL 57 CO 0.00 -0.02 0.10 0.27 0.00 0.00 0.00 175.10 175.45 1c6b s ILE 58 N -0.57 0.70 0.60 2.22 -4.36 -0.76 -4.70 121.20 114.32 1c6b s ILE 58 Ca -0.01 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.39 1c6b s ILE 58 Cb -0.05 -2.60 0.06 0.00 1.25 0.00 0.00 42.46 41.11 1c6b s ILE 58 CO 0.00 0.00 0.84 0.42 0.24 0.00 0.00 174.94 176.44 1c6b s THR 59 N -3.50 2.50 0.24 8.37 -4.23 -1.26 -4.82 115.64 112.94 1c6b s THR 59 Ca 0.34 -0.65 -0.04 0.00 -1.18 0.00 0.00 61.69 60.16 1c6b s THR 59 Cb 0.07 -2.85 0.13 0.00 1.34 0.00 0.00 72.50 71.19 1c6b s THR 59 CO 0.15 0.00 1.77 0.50 -0.54 0.00 0.00 174.62 176.50 1c6b h LYS 60 N -0.10 0.96 -0.14 3.99 3.64 -1.99 -1.80 116.57 121.13 1c6b h LYS 60 Ca -0.40 -0.22 -0.00 0.00 -1.27 0.00 0.00 60.65 58.76 1c6b h LYS 60 Cb 1.29 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.97 1c6b h LYS 60 CO 0.49 0.86 0.07 -0.44 -2.27 0.00 0.00 179.45 178.17 1c6b h ASP 61 N 0.91 0.17 -0.74 4.20 5.19 -1.98 -0.67 116.42 123.50 1c6b h ASP 61 Ca 0.19 -0.09 0.02 0.00 -0.62 0.00 0.00 57.03 56.54 1c6b h ASP 61 Cb 0.35 -0.04 -0.04 0.00 0.18 0.00 0.00 39.33 39.77 1c6b h ASP 61 CO 0.00 0.21 0.47 -0.33 -3.12 0.00 0.00 179.24 176.48 1c6b h GLU 62 N 0.12 0.91 -0.64 3.56 5.08 -1.87 0.27 114.58 122.01 1c6b h GLU 62 Ca 0.05 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1c6b h GLU 62 Cb 0.08 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 1c6b h GLU 62 CO -0.01 0.60 0.33 0.00 -1.00 0.00 0.00 179.01 178.93 1c6b h ALA 63 N 1.30 1.37 -0.25 3.43 0.00 -1.16 -0.04 119.26 123.91 1c6b h ALA 63 Ca 0.29 -0.12 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 1c6b h ALA 63 Cb -0.02 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1c6b h ALA 63 CO -0.10 0.50 -0.55 0.93 0.00 0.00 0.00 179.25 180.03 1c6b h GLU 64 N 0.89 0.76 -0.27 0.00 4.39 0.23 -0.99 114.58 119.59 1c6b h GLU 64 Ca 0.22 -0.48 -0.04 0.00 0.34 0.00 0.00 59.36 59.40 1c6b h GLU 64 Cb 0.06 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1c6b h GLU 64 CO -0.03 1.11 0.03 -0.22 -1.16 0.00 0.00 179.01 178.74 1c6b h LYS 65 N 0.58 0.46 -0.89 2.33 3.64 -0.15 -0.89 116.57 121.65 1c6b h LYS 65 Ca 0.01 -0.13 0.01 0.00 -1.27 0.00 0.00 60.65 59.27 1c6b h LYS 65 Cb 1.14 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.86 1c6b h LYS 65 CO 0.12 0.59 0.59 -0.07 -2.27 0.00 0.00 179.45 178.41 1c6b h LEU 66 N 0.26 1.03 -0.67 5.20 3.38 -0.89 -1.89 115.31 121.73 1c6b h LEU 66 Ca 0.08 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1c6b h LEU 66 Cb 0.37 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1c6b h LEU 66 CO 0.01 0.75 0.37 0.15 0.09 0.00 0.00 178.44 179.81 1c6b h PHE 67 N 1.21 0.92 -0.43 1.13 3.57 -0.89 0.61 116.94 123.07 1c6b h PHE 67 Ca 0.33 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.83 1c6b h PHE 67 Cb -0.13 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 38.28 1c6b h PHE 67 CO -0.01 0.66 0.23 -0.91 -2.23 0.00 0.00 178.31 176.05 1c6b h ASN 68 N 0.92 0.35 -0.42 0.41 2.35 -0.79 -0.23 115.58 118.17 1c6b h ASN 68 Ca 0.24 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.96 1c6b h ASN 68 Cb 0.04 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 1c6b h ASN 68 CO -0.04 0.25 0.13 1.56 -1.65 0.00 0.00 177.43 177.69 1c6b h GLN 69 N 0.46 0.73 -0.52 0.81 4.20 -0.92 -1.80 115.11 118.07 1c6b h GLN 69 Ca 0.18 -0.13 -0.10 0.00 0.06 0.00 0.00 58.65 58.65 1c6b h GLN 69 Cb 0.05 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1c6b h GLN 69 CO -0.10 0.65 -0.08 -0.44 -0.67 0.00 0.00 178.83 178.19 1c6b h ASP 70 N 0.71 0.94 -0.21 1.46 3.32 -0.13 -2.03 116.42 120.47 1c6b h ASP 70 Ca 0.16 -0.29 -0.04 0.00 0.02 0.00 0.00 57.03 56.88 1c6b h ASP 70 Cb 0.25 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1c6b h ASP 70 CO -0.00 1.04 -0.03 0.58 -1.72 0.00 0.00 179.24 179.11 1c6b h VAL 71 N 0.86 1.27 -0.25 -1.35 2.07 -0.84 -1.87 116.25 116.15 1c6b h VAL 71 Ca 0.14 -0.97 0.06 0.00 0.82 0.00 0.00 66.70 66.75 1c6b h VAL 71 Cb 0.61 1.50 -0.06 0.00 -1.52 0.00 0.00 31.29 31.82 1c6b h VAL 71 CO 0.04 0.30 -0.18 -0.78 0.02 0.00 0.00 177.57 176.97 1c6b h ASP 72 N 0.12 -0.58 -0.70 0.57 3.58 -1.33 0.18 116.42 118.26 1c6b h ASP 72 Ca 0.05 0.12 0.04 0.00 0.42 0.00 0.00 57.03 57.66 1c6b h ASP 72 Cb 0.46 0.29 -0.05 0.00 1.72 0.00 0.00 39.33 41.76 1c6b h ASP 72 CO 0.02 -0.22 0.42 0.00 -2.88 0.00 0.00 179.24 176.58 1c6b h ALA 73 N 0.97 0.92 -0.16 -0.78 0.00 -1.38 0.24 119.26 119.08 1c6b h ALA 73 Ca 0.14 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1c6b h ALA 73 Cb 0.38 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1c6b h ALA 73 CO -0.35 0.17 0.10 0.00 0.00 0.00 0.00 179.25 179.17 1c6b h ALA 74 N 1.32 0.20 -0.05 0.00 0.00 -0.18 0.40 119.26 120.95 1c6b h ALA 74 Ca 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1c6b h ALA 74 Cb 0.07 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1c6b h ALA 74 CO -0.13 -0.30 0.02 0.28 0.00 0.00 0.00 179.25 179.12 1c6b h VAL 75 N 0.19 0.99 -0.81 0.00 2.07 -0.19 -0.75 116.25 117.76 1c6b h VAL 75 Ca 0.06 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.57 1c6b h VAL 75 Cb 0.01 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 30.69 1c6b h VAL 75 CO -0.01 0.01 0.53 0.03 0.02 0.00 0.00 177.57 178.15 1c6b h ARG 76 N 0.04 1.05 -0.54 1.57 3.08 -0.34 0.10 114.38 119.34 1c6b h ARG 76 Ca 0.02 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 1c6b h ARG 76 Cb 0.01 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 29.80 1c6b h ARG 76 CO -0.02 0.69 0.25 0.78 -1.07 0.00 0.00 179.97 180.60 1c6b h GLY 77 N 1.08 0.84 0.21 0.04 0.00 0.77 -0.77 103.07 105.24 1c6b h GLY 77 Ca 0.30 -0.43 0.10 0.00 0.00 0.00 0.00 47.33 47.30 1c6b h GLY 77 CO -0.07 0.41 0.08 -2.22 0.00 0.00 0.00 176.54 174.74 1c6b h ILE 78 N 0.72 0.64 0.00 2.60 2.04 -0.21 -1.14 117.51 122.18 1c6b h ILE 78 Ca 0.18 -0.07 -0.05 0.00 1.00 0.00 0.00 64.86 65.92 1c6b h ILE 78 Cb 0.14 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1c6b h ILE 78 CO -0.02 0.04 -0.25 -0.07 0.00 0.00 0.00 178.15 177.85 1c6b h LEU 79 N 0.20 0.00 0.00 1.44 3.38 -0.10 -1.55 115.31 118.69 1c6b h LEU 79 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1c6b h LEU 79 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1c6b h LEU 79 CO -0.39 0.25 -0.43 0.08 0.09 0.00 0.00 178.44 178.04 1c6b h ARG 80 N 0.00 0.00 -5.68 1.13 -0.00 -0.45 -3.44 114.38 105.94 1c6b h ARG 80 Ca -0.00 0.00 -0.63 0.00 -0.00 0.00 0.00 59.98 59.35 1c6b h ARG 80 Cb 0.56 0.00 -0.13 0.00 -0.00 0.00 0.00 29.97 30.40 1c6b h ARG 80 CO 0.03 0.00 0.29 1.21 -0.00 0.00 0.00 179.97 181.51 1c6b s ASN 81 N -4.77 6.45 0.63 0.08 3.84 -0.50 -4.93 114.94 115.75 1c6b s ASN 81 Ca 0.06 0.08 0.27 0.00 0.21 0.00 0.00 52.86 53.48 1c6b s ASN 81 Cb 0.11 -2.37 1.40 0.00 -0.55 0.00 0.00 41.25 39.84 1c6b s ASN 81 CO 0.69 -0.77 1.80 0.00 -2.79 0.00 0.00 177.10 176.03 1c6b h ALA 82 N 8.69 1.82 0.00 1.71 0.00 -1.87 0.51 119.26 130.11 1c6b h ALA 82 Ca -0.25 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 1c6b h ALA 82 Cb 1.09 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1c6b h ALA 82 CO 0.91 -0.62 -1.59 0.36 0.00 0.00 0.00 179.25 178.31 1c6b n LYS 83 N -3.21 0.64 -0.05 0.00 0.00 -1.26 -4.48 118.16 109.80 1c6b n LYS 83 Ca 0.04 0.01 -0.22 0.00 -0.00 0.00 0.00 58.31 58.13 1c6b n LYS 83 Cb 0.61 -1.68 -0.13 0.00 -0.00 0.00 0.00 35.03 33.83 1c6b n LYS 83 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.40 177.33 1c6b h LEU 84 N 0.00 0.22 -0.87 -5.58 3.38 -0.45 -3.39 115.31 108.62 1c6b h LEU 84 Ca -0.08 -0.73 0.23 0.00 0.09 0.00 0.00 57.88 57.38 1c6b h LEU 84 Cb 1.22 -0.07 -0.14 0.00 0.09 0.00 0.00 40.66 41.76 1c6b h LEU 84 CO 0.01 1.67 0.19 0.50 0.09 0.00 0.00 178.44 180.91 1c6b h LYS 85 N -0.46 0.18 -0.40 1.13 3.64 -0.23 -1.35 116.57 119.07 1c6b h LYS 85 Ca -0.38 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 58.92 1c6b h LYS 85 Cb 1.67 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.43 1c6b h LYS 85 CO -0.06 0.12 -0.03 -1.00 -2.27 0.00 0.00 179.45 176.21 1c6b h PRO 86 N 0.18 0.66 0.02 1.90 0.13 -1.81 0.34 132.00 133.42 1c6b h PRO 86 Ca 0.53 -0.17 -0.00 0.00 -0.87 0.00 0.00 66.00 65.49 1c6b h PRO 86 Cb 1.06 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1c6b h PRO 86 CO -0.67 0.70 -0.01 0.28 -0.23 0.00 0.00 178.00 178.07 1c6b h VAL 87 N 0.62 1.28 -0.33 1.56 2.07 -1.53 -2.12 116.25 117.80 1c6b h VAL 87 Ca 0.12 -0.96 0.06 0.00 0.82 0.00 0.00 66.70 66.74 1c6b h VAL 87 Cb 0.43 1.93 -0.05 0.00 -1.52 0.00 0.00 31.29 32.07 1c6b h VAL 87 CO 0.02 0.24 0.02 0.22 0.02 0.00 0.00 177.57 178.09 1c6b h TYR 88 N -0.45 0.02 0.00 1.57 5.03 -0.89 0.92 116.97 123.17 1c6b h TYR 88 Ca -0.00 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.32 1c6b h TYR 88 Cb 0.42 0.04 -0.00 0.00 1.55 0.00 0.00 36.73 38.74 1c6b h TYR 88 CO 0.07 -0.04 -0.05 -0.44 -1.32 0.00 0.00 178.16 176.38 1c6b h ASP 89 N 0.12 0.00 0.97 -2.11 3.32 -0.33 -1.82 116.42 116.57 1c6b h ASP 89 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1c6b h ASP 89 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1c6b h ASP 89 CO -0.25 0.05 -0.05 -1.54 -1.72 0.00 0.00 179.24 175.73 1c6b n SER 90 N -4.37 0.08 -4.84 6.45 3.41 0.27 -4.89 113.62 109.73 1c6b n SER 90 Ca -0.03 0.43 -0.32 0.00 -0.26 0.00 0.00 58.87 58.69 1c6b n SER 90 Cb 0.14 -0.44 -0.05 0.00 -0.26 0.00 0.00 64.21 63.60 1c6b n SER 90 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1c6b s LEU 91 N -3.06 3.81 0.89 1.04 1.43 -0.69 -5.08 118.68 117.03 1c6b s LEU 91 Ca 0.14 1.49 -0.14 0.00 -1.03 0.00 0.00 54.13 54.59 1c6b s LEU 91 Cb 0.19 -4.38 0.14 0.00 0.03 0.00 0.00 46.19 42.17 1c6b s LEU 91 CO 0.55 -0.44 1.24 1.51 0.23 0.00 0.00 176.35 179.44 1c6b s ASP 92 N -2.73 3.73 0.19 2.29 -4.77 -1.26 -4.84 116.67 109.28 1c6b s ASP 92 Ca 0.58 0.56 -0.12 0.00 -3.30 0.00 0.00 52.55 50.27 1c6b s ASP 92 Cb -0.10 -0.85 0.10 0.00 -1.09 0.00 0.00 42.92 40.98 1c6b s ASP 92 CO 0.24 -2.37 1.84 0.00 0.70 0.00 0.00 175.17 175.58 1c6b h ALA 93 N -1.39 0.80 -0.30 2.11 0.00 -1.97 -2.58 119.26 115.94 1c6b h ALA 93 Ca -0.46 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 1c6b h ALA 93 Cb 1.29 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1c6b h ALA 93 CO 0.53 0.27 0.15 0.28 0.00 0.00 0.00 179.25 180.47 1c6b h VAL 94 N 0.86 1.15 -0.67 0.00 2.07 -1.94 -3.15 116.25 114.55 1c6b h VAL 94 Ca 0.23 -0.41 0.01 0.00 0.82 0.00 0.00 66.70 67.35 1c6b h VAL 94 Cb -0.05 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1c6b h VAL 94 CO -0.04 0.15 0.45 0.03 0.02 0.00 0.00 177.57 178.17 1c6b h ARG 95 N 0.35 0.89 -0.54 1.57 3.08 -1.81 -1.02 114.38 116.90 1c6b h ARG 95 Ca 0.10 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1c6b h ARG 95 Cb 0.10 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 29.92 1c6b h ARG 95 CO -0.01 0.59 0.30 0.00 -1.07 0.00 0.00 179.97 179.77 1c6b h ARG 96 N 0.91 0.74 -0.63 0.04 3.08 -1.43 -0.33 114.38 116.77 1c6b h ARG 96 Ca 0.25 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 60.18 1c6b h ARG 96 Cb -0.11 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 29.76 1c6b h ARG 96 CO -0.05 0.54 0.19 0.00 -1.07 0.00 0.00 179.97 179.58 1c6b h ALA 98 N 1.28 1.05 -0.32 0.00 0.00 -0.75 -1.08 119.26 119.44 1c6b h ALA 98 Ca 0.20 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.65 1c6b h ALA 98 Cb 0.27 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1c6b h ALA 98 CO -0.01 0.58 -0.47 1.25 0.00 0.00 0.00 179.25 180.61 1c6b h LEU 99 N 0.69 0.94 -0.90 0.00 5.85 -0.06 -2.63 115.31 119.21 1c6b h LEU 99 Ca 0.12 -0.47 -0.09 0.00 0.84 0.00 0.00 57.88 58.29 1c6b h LEU 99 Cb 0.54 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1c6b h LEU 99 CO 0.03 1.25 -0.12 0.40 -0.34 0.00 0.00 178.44 179.67 1c6b h ILE 100 N 0.69 1.25 -0.23 4.05 2.04 0.49 -2.89 117.51 122.91 1c6b h ILE 100 Ca 0.04 -1.13 0.05 0.00 1.00 0.00 0.00 64.86 64.82 1c6b h ILE 100 Cb 1.06 1.08 -0.05 0.00 -0.74 0.00 0.00 36.82 38.17 1c6b h ILE 100 CO 0.11 0.38 -0.07 -1.13 0.00 0.00 0.00 178.15 177.44 1c6b h ASN 101 N 0.62 -0.24 -0.81 1.72 -0.73 -0.96 0.26 115.58 115.45 1c6b h ASN 101 Ca 0.11 0.07 -0.00 0.00 1.87 0.00 0.00 56.30 58.35 1c6b h ASN 101 Cb 0.56 0.15 -0.04 0.00 0.27 0.00 0.00 38.32 39.26 1c6b h ASN 101 CO 0.03 -0.09 0.49 0.24 -0.37 0.00 0.00 177.43 177.74 1c6b h MET 102 N -0.01 1.09 -0.53 6.67 2.86 -1.40 0.27 114.93 123.88 1c6b h MET 102 Ca 0.11 -0.09 -0.08 0.00 -2.06 0.00 0.00 59.70 57.58 1c6b h MET 102 Cb 0.18 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 1c6b h MET 102 CO -0.24 0.76 0.01 0.28 1.06 0.00 0.00 176.91 178.77 1c6b h VAL 103 N 1.10 1.26 -0.47 -2.22 2.07 -1.11 0.33 116.25 117.22 1c6b h VAL 103 Ca 0.29 -1.09 0.04 0.00 0.82 0.00 0.00 66.70 66.77 1c6b h VAL 103 Cb -0.05 0.92 -0.04 0.00 -1.52 0.00 0.00 31.29 30.59 1c6b h VAL 103 CO -0.06 0.39 0.22 0.15 0.02 0.00 0.00 177.57 178.29 1c6b h PHE 104 N 0.80 0.41 -0.12 1.57 3.04 -0.12 0.34 116.94 122.85 1c6b h PHE 104 Ca 0.15 0.02 -0.20 0.00 3.98 0.00 0.00 57.97 61.92 1c6b h PHE 104 Cb 0.52 -0.11 0.01 0.00 2.56 0.00 0.00 35.95 38.92 1c6b h PHE 104 CO 0.04 0.19 -0.70 0.37 -2.02 0.00 0.00 178.31 176.20 1c6b h GLN 105 N 0.44 0.68 0.00 1.11 4.15 -0.37 -3.39 115.11 117.73 1c6b h GLN 105 Ca 0.21 -0.57 0.00 0.00 0.77 0.00 0.00 58.65 59.05 1c6b h GLN 105 Cb 0.13 0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.95 1c6b h GLN 105 CO -0.16 1.19 0.00 0.00 -1.93 0.00 0.00 178.83 177.93 1c6b n MET 106 N -4.05 0.83 -0.02 1.69 0.00 0.11 -5.09 117.12 110.59 1c6b n MET 106 Ca -0.08 -0.91 0.00 0.00 0.00 0.00 0.00 57.70 56.71 1c6b n MET 106 Cb 0.70 -0.95 -0.00 0.00 0.00 0.00 0.00 33.22 32.97 1c6b n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1c6b n GLY 107 N -0.22 -2.72 0.27 3.17 0.00 0.12 -3.46 105.19 102.36 1c6b n GLY 107 Ca 0.00 -1.37 -0.06 0.00 0.00 0.00 0.00 46.02 44.59 1c6b n GLY 107 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1c6b h GLU 108 N -0.01 0.92 -0.46 1.61 4.11 -1.92 0.30 114.58 119.14 1c6b h GLU 108 Ca -0.00 -0.11 -0.01 0.00 0.07 0.00 0.00 59.36 59.32 1c6b h GLU 108 Cb 0.02 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 1c6b h GLU 108 CO 0.00 0.69 0.26 1.79 0.07 0.00 0.00 179.01 181.83 1c6b h THR 109 N 0.91 1.15 0.10 -1.06 1.35 -1.96 0.66 112.91 114.06 1c6b h THR 109 Ca 0.23 -0.36 0.02 0.00 -0.55 0.00 0.00 66.41 65.75 1c6b h THR 109 Cb 0.03 0.57 -0.04 0.00 -1.73 0.00 0.00 68.15 66.98 1c6b h THR 109 CO -0.04 0.16 -0.28 1.23 -0.25 0.00 0.00 175.52 176.34 1c6b h GLY 110 N 0.60 -0.51 0.88 5.82 0.00 -1.25 -2.55 103.07 106.06 1c6b h GLY 110 Ca 0.16 0.33 0.03 0.00 0.00 0.00 0.00 47.33 47.85 1c6b h GLY 110 CO -0.03 -0.23 0.38 -2.08 0.00 0.00 0.00 176.54 174.58 1c6b h VAL 111 N -0.48 1.08 -0.16 4.60 2.07 -0.60 -1.34 116.25 121.41 1c6b h VAL 111 Ca 0.04 -0.26 0.05 0.00 0.82 0.00 0.00 66.70 67.35 1c6b h VAL 111 Cb 0.52 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1c6b h VAL 111 CO -0.18 0.14 0.33 0.00 0.02 0.00 0.00 177.57 177.88 1c6b h ALA 112 N 1.26 1.65 0.00 1.67 0.00 0.62 0.33 119.26 124.79 1c6b h ALA 112 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1c6b h ALA 112 Cb 0.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1c6b h ALA 112 CO -0.10 -0.42 0.00 0.41 0.00 0.00 0.00 179.25 179.15 1c6b n GLY 113 N -1.33 -1.29 2.34 0.00 0.00 -0.51 -3.91 105.19 100.49 1c6b n GLY 113 Ca 0.02 -0.04 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 1c6b n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1c6b n PHE 114 N -1.70 2.20 -0.23 1.61 3.01 0.11 -4.72 117.46 117.75 1c6b n PHE 114 Ca 0.05 -2.81 -0.10 0.00 1.01 0.00 0.00 57.45 55.60 1c6b n PHE 114 Cb 0.27 -2.16 -0.06 0.00 -0.01 0.00 0.00 39.48 37.52 1c6b n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1c6b h THR 115 N 2.73 0.04 -0.61 4.37 2.02 -1.82 -0.83 112.91 118.82 1c6b h THR 115 Ca 0.74 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.85 1c6b h THR 115 Cb 0.43 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 1c6b h THR 115 CO 1.50 0.00 0.11 0.78 0.37 0.00 0.00 175.52 178.29 1c6b h ASN 116 N -0.23 0.96 -0.19 4.18 2.35 -1.95 -2.53 115.58 118.16 1c6b h ASN 116 Ca 0.15 -0.25 -0.15 0.00 -0.55 0.00 0.00 56.30 55.50 1c6b h ASN 116 Cb 0.55 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 1c6b h ASN 116 CO -0.72 0.96 -0.42 0.28 -1.65 0.00 0.00 177.43 175.89 1c6b h SER 117 N 0.91 0.79 -0.59 5.81 0.02 -1.79 -1.91 113.55 116.79 1c6b h SER 117 Ca 0.19 -0.37 0.05 0.00 -0.84 0.00 0.00 61.79 60.82 1c6b h SER 117 Cb 0.40 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.67 1c6b h SER 117 CO 0.01 1.11 0.32 -0.07 -1.14 0.00 0.00 176.83 177.06 1c6b h LEU 118 N 0.60 0.47 -0.58 5.07 3.38 -1.10 0.21 115.31 123.37 1c6b h LEU 118 Ca 0.04 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1c6b h LEU 118 Cb 0.97 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 1c6b h LEU 118 CO 0.09 0.32 0.17 -0.09 0.09 0.00 0.00 178.44 179.02 1c6b h ARG 119 N 0.61 0.91 -0.57 1.13 2.43 -1.29 -1.49 114.38 116.10 1c6b h ARG 119 Ca 0.26 -0.20 -0.08 0.00 -0.81 0.00 0.00 59.98 59.15 1c6b h ARG 119 Cb 0.15 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1c6b h ARG 119 CO -0.17 0.82 0.02 0.52 -1.51 0.00 0.00 179.97 179.66 1c6b h MET 120 N 0.82 0.96 -0.55 0.20 2.86 -0.60 -0.85 114.93 117.77 1c6b h MET 120 Ca 0.19 -0.28 -0.04 0.00 -2.06 0.00 0.00 59.70 57.51 1c6b h MET 120 Cb 0.30 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.83 1c6b h MET 120 CO -0.00 0.94 0.19 -0.07 1.06 0.00 0.00 176.91 179.02 1c6b h LEU 121 N 0.89 0.79 -1.76 1.22 3.38 -0.35 -1.36 115.31 118.13 1c6b h LEU 121 Ca 0.17 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 57.97 1c6b h LEU 121 Cb 0.49 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 1c6b h LEU 121 CO 0.02 0.78 0.20 -0.61 0.09 0.00 0.00 178.44 178.92 1c6b h GLN 122 N 0.76 0.31 -0.22 1.13 4.15 -0.91 0.71 115.11 121.04 1c6b h GLN 122 Ca 0.18 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.58 1c6b h GLN 122 Cb 0.26 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.88 1c6b h GLN 122 CO -0.01 0.20 0.00 1.04 -1.93 0.00 0.00 178.83 178.13 1c6b n GLN 123 N -4.49 1.80 -2.46 1.69 6.02 -0.36 -4.92 117.38 114.66 1c6b n GLN 123 Ca 0.02 -1.20 -0.18 0.00 -0.01 0.00 0.00 57.00 55.63 1c6b n GLN 123 Cb 0.14 -1.38 0.00 0.00 1.02 0.00 0.00 30.24 30.02 1c6b n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1c6b n LYS 124 N 0.44 -2.02 -3.15 -1.09 5.02 0.24 -4.92 118.16 112.68 1c6b n LYS 124 Ca 0.16 0.82 -0.42 0.00 -2.02 0.00 0.00 58.31 56.84 1c6b n LYS 124 Cb 0.34 -5.30 -0.00 0.00 -0.02 0.00 0.00 35.03 30.05 1c6b n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1c6b n ARG 125 N -2.85 4.04 0.22 1.97 1.74 -0.73 -4.92 116.66 116.13 1c6b n ARG 125 Ca -0.18 -4.54 -0.16 0.00 -0.77 0.00 0.00 57.85 52.21 1c6b n ARG 125 Cb 0.64 -2.50 -0.08 0.00 -1.02 0.00 0.00 32.46 29.51 1c6b n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1c6b h TRP 126 N 5.70 -1.00 -0.98 -1.55 -0.00 -1.90 -0.12 115.95 116.09 1c6b h TRP 126 Ca 0.19 0.01 0.05 0.00 -0.00 0.00 0.00 58.89 59.14 1c6b h TRP 126 Cb 0.69 0.39 -0.06 0.00 -0.00 0.00 0.00 29.16 30.18 1c6b h TRP 126 CO 0.92 -0.51 0.64 -0.44 -0.00 0.00 0.00 178.44 179.04 1c6b h ASP 127 N -0.74 1.04 -0.54 -3.49 5.19 -1.91 -1.45 116.42 114.53 1c6b h ASP 127 Ca -0.02 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.29 1c6b h ASP 127 Cb 0.68 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.95 1c6b h ASP 127 CO -0.08 0.69 -0.05 -0.33 -3.12 0.00 0.00 179.24 176.35 1c6b h GLU 128 N 1.19 0.98 -0.53 3.56 5.08 -1.91 -1.85 114.58 121.10 1c6b h GLU 128 Ca 0.41 -0.34 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1c6b h GLU 128 Cb 0.09 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1c6b h GLU 128 CO -0.15 1.01 0.23 0.00 -1.00 0.00 0.00 179.01 179.09 1c6b h ALA 129 N 0.94 1.40 -0.29 3.43 0.00 -0.23 -2.06 119.26 122.45 1c6b h ALA 129 Ca 0.15 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 1c6b h ALA 129 Cb 0.60 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1c6b h ALA 129 CO 0.04 0.46 -0.38 0.00 0.00 0.00 0.00 179.25 179.37 1c6b h ALA 130 N 1.50 0.44 -0.33 0.00 0.00 -1.00 -1.06 119.26 118.80 1c6b h ALA 130 Ca 0.18 -0.44 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 1c6b h ALA 130 Cb 0.13 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1c6b h ALA 130 CO -0.02 0.53 -0.31 0.28 0.00 0.00 0.00 179.25 179.73 1c6b h VAL 131 N 0.53 1.28 -0.12 0.00 2.07 -1.24 -2.95 116.25 115.83 1c6b h VAL 131 Ca 0.04 -1.45 -0.01 0.00 0.82 0.00 0.00 66.70 66.10 1c6b h VAL 131 Cb 0.96 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 1c6b h VAL 131 CO 0.09 0.47 0.06 -1.13 0.02 0.00 0.00 177.57 177.08 1c6b h ASN 132 N 0.60 0.16 0.68 0.57 -0.73 -1.19 -3.09 115.58 112.59 1c6b h ASN 132 Ca 0.07 -0.13 -0.00 0.00 1.87 0.00 0.00 56.30 58.11 1c6b h ASN 132 Cb 0.83 -0.04 -0.00 0.00 0.27 0.00 0.00 38.32 39.38 1c6b h ASN 132 CO 0.07 0.25 -0.00 0.00 -0.37 0.00 0.00 177.43 177.38 1c6b h ALA 133 N 0.92 1.00 0.00 1.57 0.00 -1.18 -2.07 119.26 119.50 1c6b h ALA 133 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1c6b h ALA 133 Cb 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1c6b h ALA 133 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 1c6b h ALA 134 N 2.00 1.00 -0.20 0.00 0.00 -1.43 -3.33 119.26 117.30 1c6b h ALA 134 Ca -0.00 0.00 -0.71 0.00 0.00 0.00 0.00 54.91 54.20 1c6b h ALA 134 Cb 0.34 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1c6b h ALA 134 CO 0.00 0.00 3.08 1.63 0.00 0.00 0.00 179.25 183.96 1c6b n LYS 135 N -2.73 3.32 -3.76 0.00 5.02 -0.78 -4.65 118.16 114.59 1c6b n LYS 135 Ca 0.03 -2.72 -0.10 0.00 -2.02 0.00 0.00 58.31 53.50 1c6b n LYS 135 Cb 0.36 -3.06 -0.06 0.00 -0.02 0.00 0.00 35.03 32.25 1c6b n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1c6b s SER 136 N 2.34 -0.04 0.31 4.39 1.04 -1.25 -5.00 113.70 115.49 1c6b s SER 136 Ca 0.52 -0.48 0.07 0.00 0.48 0.00 0.00 55.95 56.54 1c6b s SER 136 Cb 0.15 0.39 0.50 0.00 0.10 0.00 0.00 66.02 67.16 1c6b s SER 136 CO -0.07 -0.77 1.73 -0.09 0.98 0.00 0.00 173.24 175.03 1c6b h ARG 137 N 2.65 0.25 0.09 4.02 2.43 -1.92 -2.62 114.38 119.27 1c6b h ARG 137 Ca -0.34 -0.11 0.02 0.00 -0.81 0.00 0.00 59.98 58.75 1c6b h ARG 137 Cb 1.22 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.72 1c6b h ARG 137 CO 0.52 0.58 -0.36 2.35 -1.51 0.00 0.00 179.97 181.55 1c6b h TRP 138 N 0.21 -0.99 -0.50 2.20 7.01 -1.94 -0.42 115.95 121.52 1c6b h TRP 138 Ca 0.02 0.03 0.03 0.00 2.11 0.00 0.00 58.89 61.08 1c6b h TRP 138 Cb 0.74 0.42 -0.04 0.00 -2.10 0.00 0.00 29.16 28.18 1c6b h TRP 138 CO 0.01 -0.46 0.28 -0.92 -2.79 0.00 0.00 178.44 174.57 1c6b h TYR 139 N -0.57 0.53 -0.22 2.65 3.20 -1.79 -1.48 116.97 119.29 1c6b h TYR 139 Ca 0.04 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.85 1c6b h TYR 139 Cb 0.61 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 1c6b h TYR 139 CO -0.33 0.29 -0.19 -0.91 -1.64 0.00 0.00 178.16 175.38 1c6b h ASN 140 N 0.56 0.37 -0.02 -2.11 4.21 -1.19 -2.10 115.58 115.30 1c6b h ASN 140 Ca 0.21 -0.10 -0.02 0.00 1.21 0.00 0.00 56.30 57.59 1c6b h ASN 140 Cb 0.06 -0.10 0.00 0.00 -1.12 0.00 0.00 38.32 37.16 1c6b h ASN 140 CO -0.12 0.58 -0.08 1.56 -1.29 0.00 0.00 177.43 178.09 1c6b h GLN 141 N 0.35 0.08 -2.16 0.81 1.08 -0.95 -3.39 115.11 110.93 1c6b h GLN 141 Ca 0.06 -0.06 -0.59 0.00 -1.45 0.00 0.00 58.65 56.61 1c6b h GLN 141 Cb 0.54 0.01 -0.41 0.00 -0.05 0.00 0.00 27.48 27.57 1c6b h GLN 141 CO 0.04 0.73 -0.76 0.25 -0.95 0.00 0.00 178.83 178.13 1c6b n THR 142 N -4.69 1.33 -0.26 -0.54 -2.24 -0.57 -4.98 114.28 102.33 1c6b n THR 142 Ca -0.09 -4.81 -0.05 0.00 -2.27 0.00 0.00 64.05 56.84 1c6b n THR 142 Cb 0.37 -2.05 0.06 0.00 -2.10 0.00 0.00 70.33 66.61 1c6b n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1c6b h PRO 143 N 4.17 0.94 -0.12 -0.78 0.13 -1.58 -1.22 132.00 133.55 1c6b h PRO 143 Ca 0.16 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1c6b h PRO 143 Cb 0.74 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 31.65 1c6b h PRO 143 CO 0.71 0.62 0.07 -0.91 -0.23 0.00 0.00 178.00 178.26 1c6b h ASN 144 N 0.97 0.11 -0.32 1.44 4.21 -1.93 -1.00 115.58 119.05 1c6b h ASN 144 Ca 0.27 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 57.72 1c6b h ASN 144 Cb -0.10 -0.02 -0.01 0.00 -1.12 0.00 0.00 38.32 37.07 1c6b h ASN 144 CO -0.06 0.08 -0.04 -0.09 -1.29 0.00 0.00 177.43 176.03 1c6b h ARG 145 N 0.14 0.59 -0.74 0.81 2.43 -1.95 -2.49 114.38 113.16 1c6b h ARG 145 Ca 0.05 -0.21 0.01 0.00 -0.81 0.00 0.00 59.98 59.02 1c6b h ARG 145 Cb -0.00 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.46 1c6b h ARG 145 CO -0.02 0.75 0.49 0.00 -1.51 0.00 0.00 179.97 179.68 1c6b h ALA 146 N 0.82 1.47 -0.64 2.80 0.00 -1.03 -1.63 119.26 121.06 1c6b h ALA 146 Ca 0.09 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1c6b h ALA 146 Cb 0.51 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1c6b h ALA 146 CO 0.02 0.49 0.18 0.87 0.00 0.00 0.00 179.25 180.81 1c6b h LYS 147 N 1.00 1.00 -0.61 0.00 1.57 -0.99 0.75 116.57 119.30 1c6b h LYS 147 Ca 0.27 -0.23 -0.06 0.00 -1.87 0.00 0.00 60.65 58.76 1c6b h LYS 147 Cb -0.11 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.04 1c6b h LYS 147 CO -0.06 0.89 0.14 0.00 -0.57 0.00 0.00 179.45 179.86 1c6b h ARG 148 N 0.93 0.98 -0.37 3.15 3.08 -0.89 -0.47 114.38 120.79 1c6b h ARG 148 Ca 0.20 -0.24 -0.07 0.00 0.07 0.00 0.00 59.98 59.94 1c6b h ARG 148 Cb 0.32 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 1c6b h ARG 148 CO -0.00 0.90 -0.04 0.28 -1.07 0.00 0.00 179.97 180.04 1c6b h VAL 149 N 0.89 1.27 -0.63 2.04 2.07 -1.10 -2.45 116.25 118.34 1c6b h VAL 149 Ca 0.19 -1.07 -0.09 0.00 0.82 0.00 0.00 66.70 66.56 1c6b h VAL 149 Cb 0.36 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 1c6b h VAL 149 CO 0.00 0.35 0.06 0.40 0.02 0.00 0.00 177.57 178.41 1c6b h ILE 150 N 0.49 1.26 -0.37 4.57 2.04 -0.77 -1.02 117.51 123.71 1c6b h ILE 150 Ca 0.10 -1.08 -0.04 0.00 1.00 0.00 0.00 64.86 64.84 1c6b h ILE 150 Cb 0.52 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.30 1c6b h ILE 150 CO 0.03 0.40 0.08 0.74 0.00 0.00 0.00 178.15 179.40 1c6b h THR 151 N 0.99 1.18 -0.57 -0.27 2.02 -1.07 0.28 112.91 115.47 1c6b h THR 151 Ca 0.19 -0.63 -0.11 0.00 0.77 0.00 0.00 66.41 66.63 1c6b h THR 151 Cb 0.49 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1c6b h THR 151 CO 0.02 0.23 -0.06 0.74 0.37 0.00 0.00 175.52 176.82 1c6b h THR 152 N 0.54 1.27 -0.53 3.16 2.02 -0.93 0.44 112.91 118.88 1c6b h THR 152 Ca 0.13 -1.21 -0.12 0.00 0.77 0.00 0.00 66.41 65.97 1c6b h THR 152 Cb 0.22 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.51 1c6b h THR 152 CO -0.00 0.43 -0.14 -0.26 0.37 0.00 0.00 175.52 175.92 1c6b h PHE 153 N 0.93 1.16 -0.33 3.16 0.04 -0.63 0.31 116.94 121.59 1c6b h PHE 153 Ca 0.15 -0.26 -0.04 0.00 2.80 0.00 0.00 57.97 60.63 1c6b h PHE 153 Cb 0.62 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.48 1c6b h PHE 153 CO 0.04 1.09 0.06 -0.09 -0.60 0.00 0.00 178.31 178.81 1c6b h ARG 154 N 0.91 0.53 0.00 1.51 2.43 -0.70 -3.34 114.38 115.72 1c6b h ARG 154 Ca 0.13 -0.14 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1c6b h ARG 154 Cb 0.72 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1c6b h ARG 154 CO 0.06 0.61 -1.72 0.25 -1.51 0.00 0.00 179.97 177.65 1c6b n THR 155 N -4.62 0.27 -1.43 0.20 -2.24 0.12 -4.77 114.28 101.81 1c6b n THR 155 Ca -0.02 -0.53 -0.15 0.00 -2.27 0.00 0.00 64.05 61.08 1c6b n THR 155 Cb 0.21 -0.14 -0.06 0.00 -2.10 0.00 0.00 70.33 68.24 1c6b n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1c6b n GLY 156 N 1.26 1.51 3.54 3.38 0.00 0.10 -5.00 105.19 109.99 1c6b n GLY 156 Ca -0.04 -0.30 -0.25 0.00 0.00 0.00 0.00 46.02 45.42 1c6b n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1c6b s THR 157 N -2.53 1.36 -1.86 2.61 -4.23 -1.26 -4.74 115.64 105.00 1c6b s THR 157 Ca 0.00 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 58.70 1c6b s THR 157 Cb 0.00 -2.73 0.57 0.00 1.34 0.00 0.00 72.50 71.68 1c6b s THR 157 CO 0.00 0.00 1.48 0.79 -0.54 0.00 0.00 174.62 176.35 1c6b n TRP 158 N -0.86 0.93 -0.29 3.99 7.02 -1.26 -4.63 117.44 122.34 1c6b n TRP 158 Ca -0.05 -0.44 0.24 0.00 -1.02 0.00 0.00 57.50 56.23 1c6b n TRP 158 Cb 0.67 -0.04 0.56 0.00 -2.42 0.00 0.00 31.31 30.08 1c6b n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1c6b h ASP 159 N 3.69 0.33 1.00 -0.99 3.32 -1.96 1.43 116.42 123.24 1c6b h ASP 159 Ca 0.00 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1c6b h ASP 159 Cb 0.93 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.48 1c6b h ASP 159 CO 0.04 0.08 0.00 0.00 -1.72 0.00 0.00 179.24 177.64 1c6b h ALA 160 N 1.58 1.00 -0.35 3.45 0.00 -1.89 -2.09 119.26 120.96 1c6b h ALA 160 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1c6b h ALA 160 Cb 1.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1c6b h ALA 160 CO -0.20 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.71 1c6b n TYR 161 N -2.32 0.46 1.29 0.00 4.02 0.49 -4.95 117.16 116.15 1c6b n TYR 161 Ca 0.03 -0.37 0.13 0.00 -0.01 0.00 0.00 57.90 57.68 1c6b n TYR 161 Cb 0.30 -0.01 0.35 0.00 -0.02 0.00 0.00 39.34 39.96 1c6b n TYR 161 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48