#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 241l s ASN 2 N 0.00 0.45 0.29 6.12 2.20 -1.26 -5.04 114.94 117.70 241l s ASN 2 Ca 0.00 -1.28 0.02 0.00 -0.94 0.00 0.00 52.86 50.65 241l s ASN 2 Cb 0.00 0.59 0.57 0.00 -2.00 0.00 0.00 41.25 40.41 241l s ASN 2 CO 0.00 -1.17 1.85 -0.29 -2.94 0.00 0.00 177.10 174.55 241l h ILE 3 N 2.24 0.94 -0.27 0.54 6.09 -1.98 -0.00 117.51 125.07 241l h ILE 3 Ca -0.29 -0.34 -0.08 0.00 -1.37 0.00 0.00 64.86 62.78 241l h ILE 3 Cb 1.24 -0.14 -0.01 0.00 0.47 0.00 0.00 36.82 38.39 241l h ILE 3 CO 0.40 0.18 -0.15 -0.26 -3.07 0.00 0.00 178.15 175.25 241l h PHE 4 N 0.99 0.68 -0.31 2.19 0.04 -1.98 -0.20 116.94 118.34 241l h PHE 4 Ca 0.48 -0.17 -0.07 0.00 2.80 0.00 0.00 57.97 61.00 241l h PHE 4 Cb 0.47 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.45 241l h PHE 4 CO -0.00 0.84 -0.12 0.93 -0.60 0.00 0.00 178.31 179.35 241l h GLU 5 N 0.32 0.52 0.09 1.51 5.08 -1.82 -0.10 114.58 120.17 241l h GLU 5 Ca 0.06 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 241l h GLU 5 Cb 0.67 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.87 241l h GLU 5 CO 0.04 0.64 -0.04 1.98 -1.00 0.00 0.00 179.01 180.63 241l h MET 6 N 0.48 -0.11 0.00 2.33 4.05 -0.85 -2.36 114.93 118.47 241l h MET 6 Ca 0.09 0.01 -0.06 0.00 -0.28 0.00 0.00 59.70 59.45 241l h MET 6 Cb 0.50 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.32 241l h MET 6 CO 0.03 0.17 -0.31 -0.07 0.23 0.00 0.00 176.91 176.96 241l h LEU 7 N -0.39 0.00 -1.05 3.39 3.38 -0.88 -1.78 115.31 117.98 241l h LEU 7 Ca -0.01 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 241l h LEU 7 Cb 0.33 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 241l h LEU 7 CO 0.02 0.31 -0.12 -0.09 0.09 0.00 0.00 178.44 178.65 241l h ARG 8 N 0.00 0.53 -0.29 1.13 9.65 -0.83 0.40 114.38 124.98 241l h ARG 8 Ca -0.00 -0.16 -0.12 0.00 -1.10 0.00 0.00 59.98 58.60 241l h ARG 8 Cb 0.58 -0.06 -0.00 0.00 -1.39 0.00 0.00 29.97 29.11 241l h ARG 8 CO 0.04 0.65 -0.31 0.82 2.80 0.00 0.00 179.97 183.97 241l h ILE 9 N 0.49 1.30 -0.16 1.20 2.04 -0.92 -0.56 117.51 120.91 241l h ILE 9 Ca 0.09 -1.48 -0.18 0.00 1.00 0.00 0.00 64.86 64.29 241l h ILE 9 Cb 0.50 1.60 -0.00 0.00 -0.74 0.00 0.00 36.82 38.18 241l h ILE 9 CO 0.03 0.48 -0.62 0.44 0.00 0.00 0.00 178.15 178.47 241l h ASP 10 N 0.46 0.65 0.00 1.72 3.32 -0.88 -3.37 116.42 118.33 241l h ASP 10 Ca 0.04 -0.38 -0.18 0.00 0.02 0.00 0.00 57.03 56.53 241l h ASP 10 Cb 0.88 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.21 241l h ASP 10 CO 0.08 1.12 -2.00 -0.62 -1.72 0.00 0.00 179.24 176.09 241l n GLU 11 N -3.93 1.01 0.00 3.56 -0.58 0.14 -5.08 120.64 115.76 241l n GLU 11 Ca -0.04 -0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.63 241l n GLU 11 Cb 0.65 -1.42 0.00 0.00 -0.57 0.00 0.00 31.44 30.10 241l n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 241l n GLY 12 N 1.80 -1.98 2.66 0.62 0.00 -0.22 -4.46 105.19 103.61 241l n GLY 12 Ca -0.17 -1.40 -0.10 0.00 0.00 0.00 0.00 46.02 44.34 241l n GLY 12 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 241l n LEU 13 N 0.00 -2.63 -4.75 0.99 7.94 -1.26 -4.08 117.00 113.22 241l n LEU 13 Ca 0.00 -3.35 -0.40 0.00 -1.11 0.00 0.00 56.01 51.16 241l n LEU 13 Cb 0.00 0.72 -0.05 0.00 0.53 0.00 0.00 43.42 44.62 241l n LEU 13 CO 0.00 1.93 0.42 -0.13 -1.11 0.00 0.00 177.39 178.50 241l s ARG 14 N 0.60 4.44 0.00 1.96 0.52 -1.11 -4.90 118.95 120.46 241l s ARG 14 Ca 0.31 0.96 0.25 0.00 -0.52 0.00 0.00 55.73 56.74 241l s ARG 14 Cb 0.04 -3.36 0.51 0.00 0.52 0.00 0.00 34.95 32.66 241l s ARG 14 CO -0.11 0.30 1.42 1.28 0.02 0.00 0.00 175.30 178.21 241l n LEU 15 N 2.83 1.92 -4.35 2.53 4.77 -1.26 0.10 117.00 123.54 241l n LEU 15 Ca -0.04 -0.64 -0.27 0.00 -0.03 0.00 0.00 56.01 55.03 241l n LEU 15 Cb 0.50 -0.03 -0.13 0.00 -2.33 0.00 0.00 43.42 41.44 241l n LEU 15 CO 0.46 0.33 -0.55 -0.75 -1.33 0.00 0.00 177.39 175.55 241l s LYS 16 N -2.22 1.36 0.23 3.23 2.47 -1.26 -1.78 119.74 121.76 241l s LYS 16 Ca 0.28 -1.24 -0.31 0.00 -1.56 0.00 0.00 55.97 53.13 241l s LYS 16 Cb 0.20 -1.73 -0.14 0.00 -1.46 0.00 0.00 37.83 34.69 241l s LYS 16 CO 0.42 0.42 1.33 -0.89 0.16 0.00 0.00 175.35 176.79 241l n ILE 17 N 1.12 0.98 -4.20 5.43 5.41 -0.93 -4.71 119.36 122.46 241l n ILE 17 Ca -0.18 -0.25 -0.13 0.00 1.00 0.00 0.00 62.75 63.19 241l n ILE 17 Cb 0.53 -1.31 -0.09 0.00 -0.71 0.00 0.00 39.64 38.06 241l n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 241l s TYR 18 N -0.14 1.22 -0.14 1.39 1.13 0.27 -4.96 117.35 116.13 241l s TYR 18 Ca 0.69 -1.39 -0.06 0.00 -1.41 0.00 0.00 57.07 54.89 241l s TYR 18 Cb -0.70 -0.54 -0.04 0.00 -1.10 0.00 0.00 41.96 39.58 241l s TYR 18 CO 0.51 -0.71 0.09 0.15 -2.51 0.00 0.00 175.55 173.07 241l s LYS 19 N -4.00 3.56 0.14 -3.49 1.02 -1.26 -0.65 119.74 115.05 241l s LYS 19 Ca 0.38 -0.26 -0.02 0.00 0.02 0.00 0.00 55.97 56.09 241l s LYS 19 Cb 0.06 -3.13 0.03 0.00 -0.52 0.00 0.00 37.83 34.27 241l s LYS 19 CO 0.15 0.58 0.19 -0.40 -0.92 0.00 0.00 175.35 174.95 241l n ASP 20 N 2.59 -0.04 0.28 2.83 5.68 0.80 -4.80 116.55 123.90 241l n ASP 20 Ca -0.18 -1.05 0.15 0.00 -0.50 0.00 0.00 54.79 53.21 241l n ASP 20 Cb 0.54 -0.15 0.89 0.00 -1.14 0.00 0.00 41.12 41.26 241l n ASP 20 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 241l h THR 21 N -1.14 0.54 -0.14 2.12 1.35 -1.99 0.50 112.91 114.15 241l h THR 21 Ca -0.06 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 241l h THR 21 Cb 0.17 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 241l h THR 21 CO 0.04 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 174.69 241l n GLU 22 N -3.88 2.06 -0.67 4.72 -0.58 -1.26 -4.94 120.64 116.10 241l n GLU 22 Ca -0.02 -1.57 0.00 0.00 -0.42 0.00 0.00 57.16 55.14 241l n GLU 22 Cb 0.12 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.53 241l n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 241l n GLY 23 N 1.29 0.62 3.89 0.62 0.00 0.17 -5.06 105.19 106.72 241l n GLY 23 Ca 0.17 -0.43 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 241l n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 241l s TYR 24 N -2.00 3.56 0.15 1.61 2.02 -1.26 -4.69 117.35 116.75 241l s TYR 24 Ca 0.00 0.46 -0.31 0.00 -0.37 0.00 0.00 57.07 56.84 241l s TYR 24 Cb 0.00 -1.90 -0.10 0.00 -0.40 0.00 0.00 41.96 39.56 241l s TYR 24 CO 0.00 0.63 1.57 0.71 -1.57 0.00 0.00 175.55 176.89 241l s TYR 25 N -1.31 3.00 0.19 2.71 2.02 -1.21 -0.14 117.35 122.61 241l s TYR 25 Ca 0.27 0.61 -0.05 0.00 -0.37 0.00 0.00 57.07 57.53 241l s TYR 25 Cb -0.13 -3.91 -0.03 0.00 -0.40 0.00 0.00 41.96 37.49 241l s TYR 25 CO 0.17 -3.40 0.23 0.99 -1.57 0.00 0.00 175.55 171.97 241l s THR 26 N 1.32 0.03 0.13 -0.71 2.01 0.17 -0.72 115.64 117.87 241l s THR 26 Ca 0.70 -1.74 -0.13 0.00 0.31 0.00 0.00 61.69 60.84 241l s THR 26 Cb -0.43 -2.24 0.02 0.00 0.01 0.00 0.00 72.50 69.86 241l s THR 26 CO 0.31 -0.13 0.33 -0.51 -0.69 0.00 0.00 174.62 173.94 241l s ILE 27 N -4.07 0.09 0.00 1.82 2.07 -0.58 -0.56 121.20 119.96 241l s ILE 27 Ca 0.29 -0.90 0.00 0.00 -1.41 0.00 0.00 60.65 58.62 241l s ILE 27 Cb 0.05 -1.37 0.00 0.00 0.13 0.00 0.00 42.46 41.26 241l s ILE 27 CO 0.08 -0.39 0.00 0.61 -1.91 0.00 0.00 174.94 173.33 241l n GLY 28 N -0.19 2.16 3.00 1.50 0.00 0.12 -1.38 105.19 110.40 241l n GLY 28 Ca -0.14 -0.54 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 241l n GLY 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 241l n ALA 29 N 8.74 5.06 -1.54 4.61 0.00 -1.26 -2.76 120.51 133.36 241l n ALA 29 Ca 0.00 -4.41 -0.09 0.00 0.00 0.00 0.00 53.44 48.94 241l n ALA 29 Cb 0.00 -2.86 -0.03 0.00 0.00 0.00 0.00 19.45 16.57 241l n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 241l n GLY 30 N 2.72 0.74 3.56 0.00 0.00 -1.24 -4.95 105.19 106.01 241l n GLY 30 Ca 0.36 -0.60 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 241l n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 241l s HIS 31 N -2.36 2.37 0.18 1.61 5.04 -0.48 -4.90 115.29 116.75 241l s HIS 31 Ca 0.00 0.07 -0.32 0.00 -1.54 0.00 0.00 55.06 53.27 241l s HIS 31 Cb 0.00 -4.60 -0.11 0.00 0.04 0.00 0.00 32.58 27.92 241l s HIS 31 CO 0.00 -1.95 1.60 -1.17 -2.34 0.00 0.00 174.74 170.89 241l s LEU 32 N 5.52 4.37 -0.21 8.88 2.96 -1.26 -1.53 118.68 137.40 241l s LEU 32 Ca 0.37 2.69 -0.13 0.00 -0.22 0.00 0.00 54.13 56.83 241l s LEU 32 Cb -0.08 -3.60 -0.19 0.00 0.50 0.00 0.00 46.19 42.83 241l s LEU 32 CO 0.18 -0.86 0.06 0.18 -1.32 0.00 0.00 176.35 174.58 241l n LEU 33 N 3.87 2.20 -3.55 -0.68 4.77 0.10 -4.94 117.00 118.77 241l n LEU 33 Ca 0.14 0.28 -0.10 0.00 -0.03 0.00 0.00 56.01 56.30 241l n LEU 33 Cb 0.38 -0.96 -0.04 0.00 -2.33 0.00 0.00 43.42 40.46 241l n LEU 33 CO 0.62 0.56 0.73 0.28 -1.33 0.00 0.00 177.39 178.25 241l s THR 34 N -2.46 0.00 -1.76 -5.08 -1.32 -1.17 -4.90 115.64 98.94 241l s THR 34 Ca -0.31 0.00 0.25 0.00 -1.21 0.00 0.00 61.69 60.43 241l s THR 34 Cb 0.09 -1.00 0.19 0.00 -1.51 0.00 0.00 72.50 70.27 241l s THR 34 CO 0.61 0.00 1.45 0.29 -2.21 0.00 0.00 174.62 174.76 241l n LYS 35 N 0.49 0.86 -2.60 7.08 5.02 -1.26 -3.30 118.16 124.45 241l n LYS 35 Ca -0.10 -0.56 -0.36 0.00 -2.02 0.00 0.00 58.31 55.26 241l n LYS 35 Cb 0.59 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 34.06 241l n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 241l s SER 36 N -2.53 6.80 0.00 4.39 0.15 -1.26 -4.93 113.70 116.32 241l s SER 36 Ca 0.22 1.97 0.20 0.00 0.70 0.00 0.00 55.95 59.04 241l s SER 36 Cb 0.19 -2.58 1.01 0.00 -1.71 0.00 0.00 66.02 62.93 241l s SER 36 CO 0.55 -0.46 1.63 -2.65 1.20 0.00 0.00 173.24 173.50 241l n PRO 37 N -0.14 0.29 -3.00 5.44 -0.02 -1.26 -4.73 135.00 131.58 241l n PRO 37 Ca 0.05 0.10 -0.41 0.00 -2.02 0.00 0.00 63.50 61.21 241l n PRO 37 Cb 0.50 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.43 241l n PRO 37 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 241l s SER 38 N -2.57 6.66 0.46 2.55 0.15 -1.26 -4.91 113.70 114.78 241l s SER 38 Ca 0.19 0.73 0.14 0.00 0.70 0.00 0.00 55.95 57.71 241l s SER 38 Cb 0.13 -2.38 1.04 0.00 -1.71 0.00 0.00 66.02 63.10 241l s SER 38 CO 0.30 -0.51 2.03 0.25 1.20 0.00 0.00 173.24 176.52 241l h LEU 39 N 9.21 0.07 -0.30 3.45 5.85 -1.99 -0.96 115.31 130.64 241l h LEU 39 Ca -0.25 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.33 241l h LEU 39 Cb 1.11 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 241l h LEU 39 CO 0.84 0.17 -0.33 0.78 -0.34 0.00 0.00 178.44 179.56 241l h ASN 40 N 0.08 0.81 -0.89 1.25 2.35 -1.98 0.14 115.58 117.35 241l h ASN 40 Ca 0.02 -0.48 0.01 0.00 -0.55 0.00 0.00 56.30 55.29 241l h ASN 40 Cb 0.20 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.30 241l h ASN 40 CO 0.01 1.13 0.59 0.00 -1.65 0.00 0.00 177.43 177.51 241l h ALA 41 N 0.70 1.37 -0.33 -0.83 0.00 -1.62 0.64 119.26 119.19 241l h ALA 41 Ca 0.04 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 241l h ALA 41 Cb 0.92 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 241l h ALA 41 CO 0.08 0.59 0.09 0.00 0.00 0.00 0.00 179.25 180.01 241l h ALA 42 N 1.45 0.44 -0.43 0.00 0.00 -0.81 -1.07 119.26 118.83 241l h ALA 42 Ca 0.32 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 241l h ALA 42 Cb -0.14 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 241l h ALA 42 CO -0.07 0.10 0.12 0.87 0.00 0.00 0.00 179.25 180.26 241l h LYS 43 N 0.38 0.64 -0.29 0.00 1.57 -0.35 0.16 116.57 118.67 241l h LYS 43 Ca 0.10 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 241l h LYS 43 Cb 0.29 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 241l h LYS 43 CO 0.00 0.57 0.06 1.03 -0.57 0.00 0.00 179.45 180.54 241l h SER 44 N 0.62 0.46 -0.33 0.86 0.87 -0.47 -0.86 113.55 114.70 241l h SER 44 Ca 0.15 -0.25 -0.07 0.00 -1.23 0.00 0.00 61.79 60.39 241l h SER 44 Cb 0.22 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 241l h SER 44 CO -0.01 0.59 -0.03 -0.33 -0.53 0.00 0.00 176.83 176.52 241l h GLU 45 N 0.31 0.70 -0.35 2.24 4.39 -0.68 -1.80 114.58 119.39 241l h GLU 45 Ca 0.09 -0.19 -0.05 0.00 0.34 0.00 0.00 59.36 59.55 241l h GLU 45 Cb 0.31 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 241l h GLU 45 CO 0.00 0.73 0.01 1.25 -1.16 0.00 0.00 179.01 179.85 241l h LEU 46 N 0.66 0.60 -1.18 1.33 5.85 -0.28 -1.34 115.31 120.94 241l h LEU 46 Ca 0.13 -0.30 -0.04 0.00 0.84 0.00 0.00 57.88 58.51 241l h LEU 46 Cb 0.45 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 241l h LEU 46 CO 0.02 0.75 0.09 0.44 -0.34 0.00 0.00 178.44 179.40 241l h ASP 47 N 0.43 0.61 0.23 1.25 3.32 -0.89 -1.50 116.42 119.88 241l h ASP 47 Ca 0.10 -0.10 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 241l h ASP 47 Cb 0.44 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 241l h ASP 47 CO 0.02 0.62 -0.42 0.50 -1.72 0.00 0.00 179.24 178.24 241l h LYS 48 N 0.64 0.25 -0.09 3.56 3.64 -1.06 0.23 116.57 123.72 241l h LYS 48 Ca 0.14 -0.12 -0.18 0.00 -1.27 0.00 0.00 60.65 59.22 241l h LYS 48 Cb 0.27 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.08 241l h LYS 48 CO -0.00 0.63 -0.70 0.00 -2.27 0.00 0.00 179.45 177.11 241l h ALA 49 N 1.36 0.61 0.00 5.00 0.00 -0.35 -3.31 119.26 122.58 241l h ALA 49 Ca 0.02 -0.59 -0.24 0.00 0.00 0.00 0.00 54.91 54.09 241l h ALA 49 Cb 0.83 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 241l h ALA 49 CO 0.07 0.75 -1.74 -0.89 0.00 0.00 0.00 179.25 177.44 241l n ILE 50 N -3.86 1.31 -1.67 0.00 2.08 -0.65 -5.01 119.36 111.56 241l n ILE 50 Ca -0.04 -0.75 0.00 0.00 0.56 0.00 0.00 62.75 62.52 241l n ILE 50 Cb 0.69 -0.75 0.00 0.00 -0.75 0.00 0.00 39.64 38.83 241l n ILE 50 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 241l n GLY 51 N 1.51 0.62 3.60 7.39 0.00 0.78 -5.06 105.19 114.03 241l n GLY 51 Ca -0.16 -0.75 -0.09 0.00 0.00 0.00 0.00 46.02 45.01 241l n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 241l s ARG 52 N -3.50 1.48 -0.59 1.61 1.70 -1.13 -5.05 118.95 113.47 241l s ARG 52 Ca 0.00 -0.83 -0.28 0.00 -0.47 0.00 0.00 55.73 54.15 241l s ARG 52 Cb 0.00 0.56 0.03 0.00 -0.57 0.00 0.00 34.95 34.97 241l s ARG 52 CO 0.00 -0.65 1.20 -0.80 -1.08 0.00 0.00 175.30 173.96 241l s ASN 53 N -2.86 6.44 -0.01 -2.89 -0.87 -1.26 -4.43 114.94 109.05 241l s ASN 53 Ca 0.08 0.08 0.16 0.00 -1.57 0.00 0.00 52.86 51.61 241l s ASN 53 Cb -0.02 -2.55 -0.19 0.00 -0.02 0.00 0.00 41.25 38.46 241l s ASN 53 CO -0.02 -1.50 0.65 0.35 -2.57 0.00 0.00 177.10 174.02 241l n THR 54 N 6.66 1.27 -2.77 1.60 -2.24 -1.26 -4.97 114.28 112.57 241l n THR 54 Ca 0.08 -0.74 -0.18 0.00 -2.27 0.00 0.00 64.05 60.94 241l n THR 54 Cb 0.49 -0.75 0.02 0.00 -2.10 0.00 0.00 70.33 68.00 241l n THR 54 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 241l n ASN 55 N -2.88 -5.34 0.00 3.42 5.15 -1.26 -2.76 115.26 111.59 241l n ASN 55 Ca -0.15 -0.19 0.00 0.00 -0.60 0.00 0.00 54.58 53.64 241l n ASN 55 Cb 0.93 -4.23 0.00 0.00 -0.53 0.00 0.00 39.78 35.95 241l n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 241l n GLY 56 N -1.32 0.49 3.00 8.20 0.00 -1.26 -5.01 105.19 109.30 241l n GLY 56 Ca -0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.68 241l n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 241l s VAL 57 N -2.16 0.88 0.33 1.61 1.01 -1.11 -2.18 120.40 118.78 241l s VAL 57 Ca 0.00 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 61.65 241l s VAL 57 Cb 0.00 -0.80 -0.07 0.00 0.00 0.00 0.00 36.38 35.51 241l s VAL 57 CO 0.00 0.28 0.04 0.27 0.00 0.00 0.00 175.10 175.69 241l s ILE 58 N 0.44 1.38 0.52 2.22 -4.36 -0.73 -4.79 121.20 115.88 241l s ILE 58 Ca -0.08 -2.01 0.03 0.00 -0.26 0.00 0.00 60.65 58.33 241l s ILE 58 Cb -0.12 -2.79 0.03 0.00 1.25 0.00 0.00 42.46 40.83 241l s ILE 58 CO 0.01 -0.03 0.73 0.42 0.24 0.00 0.00 174.94 176.31 241l s THR 59 N -3.17 2.73 0.15 8.37 -4.23 -1.26 -4.82 115.64 113.41 241l s THR 59 Ca 0.36 -0.75 -0.17 0.00 -1.18 0.00 0.00 61.69 59.95 241l s THR 59 Cb 0.08 -2.98 -0.00 0.00 1.34 0.00 0.00 72.50 70.94 241l s THR 59 CO 0.16 0.00 1.78 0.50 -0.54 0.00 0.00 174.62 176.52 241l h LYS 60 N 0.20 0.37 -0.95 3.99 3.64 -1.99 -0.56 116.57 121.26 241l h LYS 60 Ca -0.41 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 58.98 241l h LYS 60 Cb 1.29 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.98 241l h LYS 60 CO 0.50 0.24 0.62 -0.44 -2.27 0.00 0.00 179.45 178.11 241l h ASP 61 N 0.38 1.05 -0.70 4.20 3.32 -1.98 0.53 116.42 123.20 241l h ASP 61 Ca 0.14 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.14 241l h ASP 61 Cb 0.03 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.31 241l h ASP 61 CO -0.08 0.72 0.30 -0.33 -1.72 0.00 0.00 179.24 178.13 241l h GLU 62 N 1.22 1.04 -0.48 3.56 5.08 -1.77 0.37 114.58 123.60 241l h GLU 62 Ca 0.38 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 241l h GLU 62 Cb -0.02 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.03 241l h GLU 62 CO -0.12 0.85 0.20 0.00 -1.00 0.00 0.00 179.01 178.94 241l h ALA 63 N 1.14 0.62 -0.11 3.43 0.00 -0.30 -2.29 119.26 121.75 241l h ALA 63 Ca 0.24 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 241l h ALA 63 Cb 0.18 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 241l h ALA 63 CO -0.02 0.22 -0.32 0.93 0.00 0.00 0.00 179.25 180.06 241l h GLU 64 N 0.63 0.21 -0.31 0.00 5.08 -0.67 -1.67 114.58 117.86 241l h GLU 64 Ca 0.16 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 241l h GLU 64 Cb 0.17 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 241l h GLU 64 CO -0.02 0.51 0.05 -0.22 -1.00 0.00 0.00 179.01 178.34 241l h LYS 65 N 0.19 0.52 -0.71 2.33 3.64 -0.61 0.27 116.57 122.19 241l h LYS 65 Ca 0.03 -0.14 0.02 0.00 -1.27 0.00 0.00 60.65 59.29 241l h LYS 65 Cb 0.66 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.38 241l h LYS 65 CO 0.05 0.62 0.47 -0.07 -2.27 0.00 0.00 179.45 178.25 241l h LEU 66 N 0.34 0.77 0.00 5.20 3.38 -1.13 -0.97 115.31 122.91 241l h LEU 66 Ca 0.09 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 241l h LEU 66 Cb 0.35 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.92 241l h LEU 66 CO 0.01 0.54 -0.00 0.15 0.09 0.00 0.00 178.44 179.23 241l h PHE 67 N 0.90 -0.00 -0.65 1.13 3.57 -0.86 0.13 116.94 121.17 241l h PHE 67 Ca 0.28 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.82 241l h PHE 67 Cb -0.01 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.69 241l h PHE 67 CO -0.00 0.25 0.37 -0.91 -2.23 0.00 0.00 178.31 175.79 241l h ASN 68 N -0.26 0.57 -0.64 0.41 2.35 -0.63 -0.29 115.58 117.09 241l h ASN 68 Ca -0.00 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 241l h ASN 68 Cb 0.25 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.50 241l h ASN 68 CO 0.00 0.38 0.31 1.56 -1.65 0.00 0.00 177.43 178.03 241l h GLN 69 N 0.70 0.92 -0.55 0.81 4.20 -0.87 -1.80 115.11 118.52 241l h GLN 69 Ca 0.28 -0.13 -0.09 0.00 0.06 0.00 0.00 58.65 58.76 241l h GLN 69 Cb 0.12 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 241l h GLN 69 CO -0.15 0.73 -0.03 -0.44 -0.67 0.00 0.00 178.83 178.28 241l h ASP 70 N 0.89 0.94 -0.28 1.46 3.32 -0.27 -0.15 116.42 122.33 241l h ASP 70 Ca 0.22 -0.26 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 241l h ASP 70 Cb 0.11 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 241l h ASP 70 CO -0.03 1.01 0.02 0.58 -1.72 0.00 0.00 179.24 179.10 241l h VAL 71 N 0.87 1.25 -0.35 -1.35 2.07 -1.00 -1.02 116.25 116.72 241l h VAL 71 Ca 0.16 -0.86 0.04 0.00 0.82 0.00 0.00 66.70 66.86 241l h VAL 71 Cb 0.55 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.55 241l h VAL 71 CO 0.03 0.28 0.11 -0.78 0.02 0.00 0.00 177.57 177.22 241l h ASP 72 N 0.27 0.10 -0.22 0.57 3.58 -1.20 -0.49 116.42 119.03 241l h ASP 72 Ca 0.08 0.04 -0.04 0.00 0.42 0.00 0.00 57.03 57.53 241l h ASP 72 Cb 0.39 0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.46 241l h ASP 72 CO 0.01 0.09 0.02 0.00 -2.88 0.00 0.00 179.24 176.48 241l h ALA 73 N 1.24 1.44 -0.12 -0.78 0.00 -0.86 -1.54 119.26 118.64 241l h ALA 73 Ca 0.16 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 241l h ALA 73 Cb 0.15 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 241l h ALA 73 CO -0.18 0.40 -0.02 0.00 0.00 0.00 0.00 179.25 179.46 241l h ALA 74 N 1.56 0.16 -0.68 0.00 0.00 -0.04 0.10 119.26 120.36 241l h ALA 74 Ca 0.10 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 54.87 241l h ALA 74 Cb 0.28 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 241l h ALA 74 CO 0.01 -0.12 0.37 0.28 0.00 0.00 0.00 179.25 179.79 241l h VAL 75 N -0.08 0.94 -0.06 0.00 2.07 -0.92 -1.48 116.25 116.72 241l h VAL 75 Ca 0.03 -0.23 -0.12 0.00 0.82 0.00 0.00 66.70 67.20 241l h VAL 75 Cb 0.41 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 241l h VAL 75 CO 0.01 0.12 -0.51 0.03 0.02 0.00 0.00 177.57 177.24 241l h ARG 76 N 0.67 0.16 -0.44 1.57 3.08 -1.15 -1.93 114.38 116.34 241l h ARG 76 Ca 0.31 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 60.23 241l h ARG 76 Cb 0.23 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 241l h ARG 76 CO -0.20 0.64 0.12 0.78 -1.07 0.00 0.00 179.97 180.24 241l h GLY 77 N 1.42 0.74 0.74 0.04 0.00 -0.13 -1.70 103.07 104.19 241l h GLY 77 Ca 0.00 -0.45 0.03 0.00 0.00 0.00 0.00 47.33 46.91 241l h GLY 77 CO 0.07 0.42 0.03 -2.22 0.00 0.00 0.00 176.54 174.85 241l h ILE 78 N 0.57 0.89 0.00 2.60 2.04 -1.03 -1.62 117.51 120.96 241l h ILE 78 Ca 0.14 -0.04 -0.04 0.00 1.00 0.00 0.00 64.86 65.93 241l h ILE 78 Cb 0.29 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 241l h ILE 78 CO -0.00 0.02 -0.17 -0.07 0.00 0.00 0.00 178.15 177.93 241l h LEU 79 N 0.11 0.00 0.00 1.44 3.38 -1.04 -1.79 115.31 117.41 241l h LEU 79 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 241l h LEU 79 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 241l h LEU 79 CO -0.14 0.17 -0.91 0.54 0.09 0.00 0.00 178.44 178.19 241l n ARG 80 N -3.98 0.35 -2.86 1.13 5.12 -0.67 -4.77 116.66 110.98 241l n ARG 80 Ca -0.02 0.04 -0.41 0.00 -1.93 0.00 0.00 57.85 55.53 241l n ARG 80 Cb 0.25 -1.66 -0.04 0.00 -1.16 0.00 0.00 32.46 29.86 241l n ARG 80 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 241l s ASN 81 N -4.26 7.02 0.52 0.55 3.84 -0.63 -4.93 114.94 117.04 241l s ASN 81 Ca 0.04 1.25 0.24 0.00 0.21 0.00 0.00 52.86 54.60 241l s ASN 81 Cb 0.13 -2.47 1.41 0.00 -0.55 0.00 0.00 41.25 39.77 241l s ASN 81 CO 0.77 -0.39 2.09 0.00 -2.79 0.00 0.00 177.10 176.79 241l h ALA 82 N 7.23 1.45 0.03 1.71 0.00 -1.89 0.97 119.26 128.76 241l h ALA 82 Ca -0.31 -0.10 -0.31 0.00 0.00 0.00 0.00 54.91 54.20 241l h ALA 82 Cb 1.14 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.87 241l h ALA 82 CO 0.83 0.13 -1.77 1.63 0.00 0.00 0.00 179.25 180.08 241l n LYS 83 N -3.87 0.66 0.10 0.00 4.01 -1.26 -4.41 118.16 113.39 241l n LYS 83 Ca -0.02 0.29 -0.23 0.00 -0.51 0.00 0.00 58.31 57.84 241l n LYS 83 Cb 0.20 -1.78 -0.15 0.00 -0.51 0.00 0.00 35.03 32.79 241l n LYS 83 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 241l h LEU 84 N 0.02 0.68 -0.45 -0.35 3.38 -1.71 -3.38 115.31 113.51 241l h LEU 84 Ca -0.32 -0.92 0.09 0.00 0.09 0.00 0.00 57.88 56.82 241l h LEU 84 Cb 2.02 -0.22 -0.09 0.00 0.09 0.00 0.00 40.66 42.46 241l h LEU 84 CO 0.08 1.67 -0.15 0.50 0.09 0.00 0.00 178.44 180.63 241l h LYS 85 N -0.00 -0.05 -0.47 1.13 3.64 -0.54 -1.09 116.57 119.19 241l h LYS 85 Ca -0.26 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.14 241l h LYS 85 Cb 2.02 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 33.83 241l h LYS 85 CO 0.21 -0.03 0.31 -1.35 -2.27 0.00 0.00 179.45 176.32 241l h PRO 86 N -0.05 0.56 0.02 1.90 0.11 -1.78 0.23 132.00 132.99 241l h PRO 86 Ca 0.22 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.29 241l h PRO 86 Cb 0.38 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.36 241l h PRO 86 CO -0.49 0.37 -0.01 0.28 -0.21 0.00 0.00 178.00 177.94 241l h VAL 87 N 0.58 1.28 -0.55 3.15 2.07 -1.41 -2.60 116.25 118.77 241l h VAL 87 Ca 0.18 -0.98 0.09 0.00 0.82 0.00 0.00 66.70 66.82 241l h VAL 87 Cb 0.02 1.94 -0.07 0.00 -1.52 0.00 0.00 31.29 31.66 241l h VAL 87 CO -0.04 0.25 0.15 0.22 0.02 0.00 0.00 177.57 178.17 241l h TYR 88 N -0.46 0.26 -0.08 1.57 3.20 -0.85 -1.46 116.97 119.15 241l h TYR 88 Ca -0.00 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 241l h TYR 88 Cb 0.43 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 241l h TYR 88 CO 0.07 0.03 -0.02 -0.44 -1.64 0.00 0.00 178.16 176.16 241l h ASP 89 N 0.30 0.10 1.58 -2.11 3.32 -0.93 -2.23 116.42 116.45 241l h ASP 89 Ca 0.28 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.32 241l h ASP 89 Cb 0.36 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.89 241l h ASP 89 CO -0.32 0.15 0.00 0.77 -1.72 0.00 0.00 179.24 178.11 241l h SER 90 N 0.11 0.00 -3.11 6.45 4.64 -0.86 -3.47 113.55 117.31 241l h SER 90 Ca 0.03 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.87 241l h SER 90 Cb 0.12 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.23 241l h SER 90 CO 0.00 0.00 -0.05 -0.76 -0.87 0.00 0.00 176.83 175.15 241l s LEU 91 N -4.97 3.79 0.92 5.97 1.43 -0.84 -5.07 118.68 119.91 241l s LEU 91 Ca 0.09 0.61 -0.14 0.00 -1.03 0.00 0.00 54.13 53.66 241l s LEU 91 Cb 0.10 -3.51 0.15 0.00 0.03 0.00 0.00 46.19 42.97 241l s LEU 91 CO 0.61 -0.49 1.20 1.51 0.23 0.00 0.00 176.35 179.41 241l s ASP 92 N -4.10 3.46 0.26 2.29 -4.77 -1.26 -4.79 116.67 107.76 241l s ASP 92 Ca 0.44 0.66 -0.05 0.00 -3.30 0.00 0.00 52.55 50.31 241l s ASP 92 Cb -0.10 -1.02 0.30 0.00 -1.09 0.00 0.00 42.92 41.01 241l s ASP 92 CO 0.40 -2.55 1.93 0.00 0.70 0.00 0.00 175.17 175.64 241l h ALA 93 N -1.51 1.29 -0.19 2.11 0.00 -1.97 -0.70 119.26 118.30 241l h ALA 93 Ca -0.47 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.32 241l h ALA 93 Cb 1.30 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 241l h ALA 93 CO 0.53 0.64 -0.07 0.28 0.00 0.00 0.00 179.25 180.63 241l h VAL 94 N 1.29 1.30 -0.08 0.00 2.07 -1.94 -2.88 116.25 116.02 241l h VAL 94 Ca 0.35 -1.09 -0.07 0.00 0.82 0.00 0.00 66.70 66.70 241l h VAL 94 Cb -0.12 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 241l h VAL 94 CO -0.07 0.33 -0.28 0.03 0.02 0.00 0.00 177.57 177.59 241l h ARG 95 N 0.09 0.15 -0.91 1.57 3.08 -1.82 -1.37 114.38 115.17 241l h ARG 95 Ca 0.05 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.05 241l h ARG 95 Cb 0.54 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.53 241l h ARG 95 CO 0.02 0.43 0.59 0.00 -1.07 0.00 0.00 179.97 179.94 241l h ARG 96 N 0.14 1.20 -0.50 0.04 3.08 -1.04 -1.29 114.38 116.00 241l h ARG 96 Ca 0.02 -0.08 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 241l h ARG 96 Cb 0.58 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 241l h ARG 96 CO 0.04 0.80 0.11 0.00 -1.07 0.00 0.00 179.97 179.85 241l h ALA 97 N 1.42 1.25 -0.47 0.04 0.00 -1.04 -1.12 119.26 119.33 241l h ALA 97 Ca 0.33 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 241l h ALA 97 Cb -0.13 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 241l h ALA 97 CO -0.07 0.52 0.04 0.00 0.00 0.00 0.00 179.25 179.74 241l h ALA 98 N 1.38 1.18 -0.38 0.00 0.00 -0.84 -0.60 119.26 119.99 241l h ALA 98 Ca 0.16 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 241l h ALA 98 Cb 0.30 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 241l h ALA 98 CO 0.00 0.54 -0.33 1.25 0.00 0.00 0.00 179.25 180.71 241l h LEU 99 N 0.72 0.90 -0.68 0.00 5.85 -0.77 -2.32 115.31 119.01 241l h LEU 99 Ca 0.15 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.49 241l h LEU 99 Cb 0.39 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 241l h LEU 99 CO 0.01 1.15 0.43 0.40 -0.34 0.00 0.00 178.44 180.09 241l h ILE 100 N 0.72 1.19 -0.32 4.05 2.04 -0.75 -1.84 117.51 122.59 241l h ILE 100 Ca 0.07 -0.37 0.05 0.00 1.00 0.00 0.00 64.86 65.61 241l h ILE 100 Cb 0.90 0.22 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 241l h ILE 100 CO 0.08 0.19 0.03 -1.13 0.00 0.00 0.00 178.15 177.32 241l h ASN 101 N 0.92 -0.06 -0.78 1.72 -0.73 -0.93 0.19 115.58 115.90 241l h ASN 101 Ca 0.25 0.06 -0.02 0.00 1.87 0.00 0.00 56.30 58.46 241l h ASN 101 Cb -0.07 0.10 -0.04 0.00 0.27 0.00 0.00 38.32 38.59 241l h ASN 101 CO -0.05 0.00 0.41 0.24 -0.37 0.00 0.00 177.43 177.67 241l h MET 102 N 0.13 1.10 -0.61 6.67 2.86 -1.03 -1.51 114.93 122.54 241l h MET 102 Ca 0.15 -0.14 -0.07 0.00 -2.06 0.00 0.00 59.70 57.58 241l h MET 102 Cb 0.19 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.61 241l h MET 102 CO -0.23 0.83 0.10 0.28 1.06 0.00 0.00 176.91 178.94 241l h VAL 103 N 1.09 1.25 -0.72 -2.22 2.07 -0.66 0.92 116.25 117.97 241l h VAL 103 Ca 0.27 -0.98 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 241l h VAL 103 Cb 0.06 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 241l h VAL 103 CO -0.04 0.37 0.39 0.15 0.02 0.00 0.00 177.57 178.46 241l h PHE 104 N 0.93 1.00 0.00 1.57 3.04 -0.21 0.13 116.94 123.40 241l h PHE 104 Ca 0.19 -0.03 -0.00 0.00 3.98 0.00 0.00 57.97 62.11 241l h PHE 104 Cb 0.41 -0.32 0.00 0.00 2.56 0.00 0.00 35.95 38.60 241l h PHE 104 CO 0.03 0.71 -0.00 0.37 -2.02 0.00 0.00 178.31 177.39 241l h GLN 105 N 1.00 -0.00 -0.01 1.11 4.15 -0.82 -3.39 115.11 117.14 241l h GLN 105 Ca 0.25 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.67 241l h GLN 105 Cb 0.05 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.74 241l h GLN 105 CO -0.04 0.65 -0.02 0.00 -1.93 0.00 0.00 178.83 177.49 241l n MET 106 N -4.78 0.73 0.00 1.69 0.00 0.27 -5.11 117.12 109.92 241l n MET 106 Ca -0.09 -1.14 0.00 0.00 0.00 0.00 0.00 57.70 56.47 241l n MET 106 Cb 0.32 -1.21 0.00 0.00 0.00 0.00 0.00 33.22 32.33 241l n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 241l n GLY 107 N 0.67 -1.59 0.33 3.17 0.00 0.46 -3.92 105.19 104.33 241l n GLY 107 Ca 0.07 -1.47 -0.04 0.00 0.00 0.00 0.00 46.02 44.58 241l n GLY 107 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 241l h GLU 108 N 0.00 1.15 -0.43 1.61 4.11 -1.93 -2.11 114.58 116.98 241l h GLU 108 Ca 0.00 -0.08 -0.01 0.00 0.07 0.00 0.00 59.36 59.34 241l h GLU 108 Cb 0.00 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 28.98 241l h GLU 108 CO 0.00 0.78 0.22 1.15 0.07 0.00 0.00 179.01 181.23 241l h THR 109 N 1.18 1.17 0.03 -1.06 2.02 -1.97 1.00 112.91 115.28 241l h THR 109 Ca 0.31 -0.46 0.02 0.00 0.77 0.00 0.00 66.41 67.05 241l h THR 109 Cb -0.10 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 241l h THR 109 CO -0.06 0.18 -0.12 1.23 0.37 0.00 0.00 175.52 177.12 241l h GLY 110 N 0.56 -0.17 1.24 2.16 0.00 -1.57 -2.62 103.07 102.67 241l h GLY 110 Ca 0.15 0.14 -0.12 0.00 0.00 0.00 0.00 47.33 47.50 241l h GLY 110 CO -0.02 -0.12 -0.18 -2.08 0.00 0.00 0.00 176.54 174.14 241l h VAL 111 N -0.22 1.27 -0.13 4.60 2.07 -1.24 -2.63 116.25 119.97 241l h VAL 111 Ca 0.03 -1.31 0.04 0.00 0.82 0.00 0.00 66.70 66.28 241l h VAL 111 Cb 0.26 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 241l h VAL 111 CO -0.10 0.45 0.21 0.00 0.02 0.00 0.00 177.57 178.14 241l h ALA 112 N 1.02 1.60 0.00 1.67 0.00 -0.57 -0.40 119.26 122.57 241l h ALA 112 Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 241l h ALA 112 Cb 0.71 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.51 241l h ALA 112 CO 0.05 -0.27 0.00 0.41 0.00 0.00 0.00 179.25 179.44 241l n GLY 113 N -1.32 -1.41 2.35 0.00 0.00 -0.99 -4.02 105.19 99.80 241l n GLY 113 Ca 0.00 -0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 241l n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 241l n PHE 114 N -1.99 1.91 -0.22 1.61 3.01 -0.16 -4.74 117.46 116.88 241l n PHE 114 Ca 0.04 -2.51 -0.09 0.00 1.01 0.00 0.00 57.45 55.91 241l n PHE 114 Cb 0.31 -1.90 -0.05 0.00 -0.01 0.00 0.00 39.48 37.83 241l n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 241l h THR 115 N 2.49 0.06 -0.59 4.37 2.02 -1.82 -0.39 112.91 119.05 241l h THR 115 Ca 0.61 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.77 241l h THR 115 Cb 0.58 0.06 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 241l h THR 115 CO 1.24 0.00 0.32 0.78 0.37 0.00 0.00 175.52 178.22 241l h ASN 116 N -0.23 0.75 -0.78 4.18 2.35 -1.95 -1.88 115.58 118.03 241l h ASN 116 Ca 0.17 -0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.79 241l h ASN 116 Cb 0.56 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.70 241l h ASN 116 CO -0.71 0.64 0.40 0.28 -1.65 0.00 0.00 177.43 176.39 241l h SER 117 N 0.80 1.00 -0.65 5.81 0.02 -1.77 -1.71 113.55 117.06 241l h SER 117 Ca 0.21 -0.10 -0.06 0.00 -0.84 0.00 0.00 61.79 60.99 241l h SER 117 Cb 0.06 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.32 241l h SER 117 CO -0.03 0.83 0.17 -0.07 -1.14 0.00 0.00 176.83 176.59 241l h LEU 118 N 1.11 0.98 -0.73 5.07 3.38 -0.78 0.10 115.31 124.44 241l h LEU 118 Ca 0.27 -0.23 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 241l h LEU 118 Cb 0.08 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 241l h LEU 118 CO -0.04 0.95 0.04 -0.09 0.09 0.00 0.00 178.44 179.40 241l h ARG 119 N 0.96 1.01 -0.49 1.13 2.43 -1.04 0.26 114.38 118.64 241l h ARG 119 Ca 0.20 -0.29 -0.12 0.00 -0.81 0.00 0.00 59.98 58.97 241l h ARG 119 Cb 0.35 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 241l h ARG 119 CO 0.00 0.97 -0.17 0.52 -1.51 0.00 0.00 179.97 179.78 241l h MET 120 N 0.94 0.97 -0.52 0.20 2.86 -0.94 -0.91 114.93 117.53 241l h MET 120 Ca 0.18 -0.39 -0.05 0.00 -2.06 0.00 0.00 59.70 57.37 241l h MET 120 Cb 0.49 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.08 241l h MET 120 CO 0.02 1.07 0.13 -0.07 1.06 0.00 0.00 176.91 179.12 241l h LEU 121 N 0.83 0.79 -1.23 1.22 3.38 -0.30 -1.81 115.31 118.19 241l h LEU 121 Ca 0.12 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.90 241l h LEU 121 Cb 0.74 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.23 241l h LEU 121 CO 0.06 0.81 0.54 -0.61 0.09 0.00 0.00 178.44 179.33 241l h GLN 122 N 0.73 0.95 0.00 1.13 4.15 -0.67 -0.19 115.11 121.21 241l h GLN 122 Ca 0.17 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.53 241l h GLN 122 Cb 0.33 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.80 241l h GLN 122 CO 0.00 0.63 0.00 1.04 -1.93 0.00 0.00 178.83 178.57 241l n GLN 123 N -4.46 0.83 -2.79 1.69 6.02 -0.37 -4.91 117.38 113.40 241l n GLN 123 Ca 0.11 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.91 241l n GLN 123 Cb 0.14 -1.50 0.02 0.00 1.02 0.00 0.00 30.24 29.93 241l n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 241l n LYS 124 N -1.08 -3.64 -3.18 -1.09 5.02 -0.08 -4.93 118.16 109.17 241l n LYS 124 Ca 0.21 0.82 -0.45 0.00 -2.02 0.00 0.00 58.31 56.87 241l n LYS 124 Cb 0.15 -5.41 0.00 0.00 -0.02 0.00 0.00 35.03 29.75 241l n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 241l n ARG 125 N -3.41 3.56 0.22 1.97 1.74 -0.81 -4.91 116.66 115.03 241l n ARG 125 Ca -0.13 -4.28 -0.15 0.00 -0.77 0.00 0.00 57.85 52.53 241l n ARG 125 Cb 0.62 -2.69 -0.07 0.00 -1.02 0.00 0.00 32.46 29.29 241l n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 241l h TRP 126 N 6.67 -0.84 -0.48 -1.55 -0.00 -1.90 -1.38 115.95 116.47 241l h TRP 126 Ca 0.23 0.00 -0.03 0.00 -0.00 0.00 0.00 58.89 59.08 241l h TRP 126 Cb 0.85 0.32 -0.02 0.00 -0.00 0.00 0.00 29.16 30.31 241l h TRP 126 CO 0.88 -0.46 0.16 -0.44 -0.00 0.00 0.00 178.44 178.58 241l h ASP 127 N -0.68 0.63 -0.33 -3.49 5.19 -1.91 -1.73 116.42 114.11 241l h ASP 127 Ca -0.03 -0.08 -0.03 0.00 -0.62 0.00 0.00 57.03 56.27 241l h ASP 127 Cb 0.61 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.94 241l h ASP 127 CO -0.04 0.60 0.07 -0.33 -3.12 0.00 0.00 179.24 176.43 241l h GLU 128 N 0.68 0.54 -0.87 3.56 5.08 -1.93 -2.42 114.58 119.21 241l h GLU 128 Ca 0.16 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 241l h GLU 128 Cb 0.19 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.33 241l h GLU 128 CO -0.01 0.60 0.51 0.00 -1.00 0.00 0.00 179.01 179.11 241l h ALA 129 N 0.91 1.11 -0.94 3.43 0.00 -0.99 -1.97 119.26 120.82 241l h ALA 129 Ca 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 241l h ALA 129 Cb 0.31 -0.35 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 241l h ALA 129 CO 0.00 0.58 0.56 0.00 0.00 0.00 0.00 179.25 180.40 241l h ALA 130 N 1.28 1.19 -0.38 0.00 0.00 -1.12 0.31 119.26 120.54 241l h ALA 130 Ca 0.31 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 241l h ALA 130 Cb -0.03 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 241l h ALA 130 CO -0.06 0.66 -0.07 0.28 0.00 0.00 0.00 179.25 180.06 241l h VAL 131 N 1.29 1.27 -0.61 0.00 2.07 -1.15 -2.72 116.25 116.40 241l h VAL 131 Ca 0.34 -1.14 -0.10 0.00 0.82 0.00 0.00 66.70 66.62 241l h VAL 131 Cb -0.05 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 241l h VAL 131 CO -0.06 0.38 0.01 -1.13 0.02 0.00 0.00 177.57 176.78 241l h ASN 132 N 0.52 1.05 -0.57 0.57 -0.73 -0.85 -2.77 115.58 112.80 241l h ASN 132 Ca 0.10 -0.30 0.02 0.00 1.87 0.00 0.00 56.30 57.99 241l h ASN 132 Cb 0.58 -0.28 -0.03 0.00 0.27 0.00 0.00 38.32 38.86 241l h ASN 132 CO 0.03 1.10 0.37 -0.07 -0.37 0.00 0.00 177.43 178.50 241l h LEU 133 N 0.98 0.59 -1.21 0.34 3.38 -0.33 -1.80 115.31 117.26 241l h LEU 133 Ca 0.17 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.13 241l h LEU 133 Cb 0.55 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.16 241l h LEU 133 CO 0.03 0.42 0.00 0.00 0.09 0.00 0.00 178.44 178.98 241l h ALA 134 N 1.66 1.00 -0.49 1.53 0.00 -1.19 -3.34 119.26 118.43 241l h ALA 134 Ca 0.22 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 54.40 241l h ALA 134 Cb 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 17.72 241l h ALA 134 CO -0.06 0.00 2.54 1.63 0.00 0.00 0.00 179.25 183.37 241l n LYS 135 N -2.84 3.25 -3.53 0.00 5.02 -0.68 -4.67 118.16 114.72 241l n LYS 135 Ca 0.01 -3.09 -0.11 0.00 -2.02 0.00 0.00 58.31 53.09 241l n LYS 135 Cb 0.29 -3.10 -0.03 0.00 -0.02 0.00 0.00 35.03 32.16 241l n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 241l s SER 136 N 2.01 -0.40 0.24 4.39 1.04 -1.25 -5.00 113.70 114.73 241l s SER 136 Ca 0.43 -0.14 -0.06 0.00 0.48 0.00 0.00 55.95 56.66 241l s SER 136 Cb 0.11 0.53 0.29 0.00 0.10 0.00 0.00 66.02 67.06 241l s SER 136 CO -0.04 -0.90 1.89 -0.09 0.98 0.00 0.00 173.24 175.08 241l h ARG 137 N 2.22 1.13 -0.43 4.02 2.43 -1.92 -2.45 114.38 119.39 241l h ARG 137 Ca -0.34 -0.07 0.09 0.00 -0.81 0.00 0.00 59.98 58.85 241l h ARG 137 Cb 1.28 -0.26 -0.09 0.00 -0.42 0.00 0.00 29.97 30.48 241l h ARG 137 CO 0.42 0.75 -0.22 2.35 -1.51 0.00 0.00 179.97 181.76 241l h TRP 138 N 1.17 -0.57 -0.56 2.20 7.01 -1.94 0.26 115.95 123.52 241l h TRP 138 Ca 0.37 0.05 -0.05 0.00 2.11 0.00 0.00 58.89 61.36 241l h TRP 138 Cb -0.01 0.32 -0.02 0.00 -2.10 0.00 0.00 29.16 27.35 241l h TRP 138 CO -0.01 -0.30 0.14 -0.92 -2.79 0.00 0.00 178.44 174.56 241l h TYR 139 N -0.14 0.94 -0.29 2.65 3.20 -1.75 -1.12 116.97 120.47 241l h TYR 139 Ca 0.20 -0.11 -0.10 0.00 3.14 0.00 0.00 58.73 61.86 241l h TYR 139 Cb 0.46 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 241l h TYR 139 CO -0.47 0.81 -0.25 -0.91 -1.64 0.00 0.00 178.16 175.70 241l h ASN 140 N 0.80 0.57 0.25 -2.11 4.21 -0.85 -2.33 115.58 116.12 241l h ASN 140 Ca 0.18 -0.20 -0.34 0.00 1.21 0.00 0.00 56.30 57.15 241l h ASN 140 Cb 0.34 -0.16 0.04 0.00 -1.12 0.00 0.00 38.32 37.42 241l h ASN 140 CO 0.00 0.81 -1.52 1.56 -1.29 0.00 0.00 177.43 177.00 241l h GLN 141 N 0.50 0.52 -2.10 0.81 1.08 -0.41 -3.39 115.11 112.11 241l h GLN 141 Ca 0.07 -0.89 -0.58 0.00 -1.45 0.00 0.00 58.65 55.80 241l h GLN 141 Cb 0.70 0.33 -0.41 0.00 -0.05 0.00 0.00 27.48 28.06 241l h GLN 141 CO 0.05 1.43 -0.84 0.25 -0.95 0.00 0.00 178.83 178.78 241l n THR 142 N -3.71 0.98 -0.20 -0.54 -2.24 -0.43 -4.97 114.28 103.16 241l n THR 142 Ca -0.18 -4.68 -0.05 0.00 -2.27 0.00 0.00 64.05 56.86 241l n THR 142 Cb 1.10 -1.98 0.04 0.00 -2.10 0.00 0.00 70.33 67.39 241l n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 241l h PRO 143 N 4.04 0.73 -0.49 -0.78 0.13 -1.62 -0.41 132.00 133.60 241l h PRO 143 Ca 0.14 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 65.15 241l h PRO 143 Cb 0.76 -0.16 -0.02 0.00 0.13 0.00 0.00 31.00 31.71 241l h PRO 143 CO 0.66 0.48 0.01 -0.91 -0.23 0.00 0.00 178.00 178.01 241l h ASN 144 N 0.75 0.84 -0.16 1.44 2.35 -1.93 0.13 115.58 118.99 241l h ASN 144 Ca 0.23 -0.30 -0.03 0.00 -0.55 0.00 0.00 56.30 55.64 241l h ASN 144 Cb -0.03 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.11 241l h ASN 144 CO -0.07 0.94 -0.01 -0.09 -1.65 0.00 0.00 177.43 176.54 241l h ARG 145 N 0.72 0.29 -0.82 0.81 2.43 -1.94 -2.34 114.38 113.53 241l h ARG 145 Ca 0.14 -0.10 0.09 0.00 -0.81 0.00 0.00 59.98 59.30 241l h ARG 145 Cb 0.50 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.96 241l h ARG 145 CO 0.02 0.53 0.48 0.00 -1.51 0.00 0.00 179.97 179.49 241l h ALA 146 N 0.75 1.16 -1.00 2.80 0.00 -0.87 -1.42 119.26 120.68 241l h ALA 146 Ca 0.04 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.99 241l h ALA 146 Cb 0.40 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 241l h ALA 146 CO 0.01 0.13 0.66 0.87 0.00 0.00 0.00 179.25 180.91 241l h LYS 147 N 0.82 1.32 -0.40 0.00 1.57 -0.60 0.29 116.57 119.57 241l h LYS 147 Ca 0.39 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 59.06 241l h LYS 147 Cb 0.31 -0.30 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 241l h LYS 147 CO -0.23 0.88 0.18 0.00 -0.57 0.00 0.00 179.45 179.71 241l h ARG 148 N 1.36 0.59 -0.44 3.15 3.08 -0.73 -1.36 114.38 120.02 241l h ARG 148 Ca 0.36 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 60.25 241l h ARG 148 Cb -0.15 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.79 241l h ARG 148 CO -0.08 0.54 -0.00 0.28 -1.07 0.00 0.00 179.97 179.63 241l h VAL 149 N 0.50 1.26 -0.63 2.04 2.07 -0.91 -2.02 116.25 118.57 241l h VAL 149 Ca 0.14 -1.05 -0.01 0.00 0.82 0.00 0.00 66.70 66.60 241l h VAL 149 Cb 0.16 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 241l h VAL 149 CO -0.01 0.36 0.35 0.40 0.02 0.00 0.00 177.57 178.69 241l h ILE 150 N 0.62 1.19 -0.49 4.57 2.04 -0.90 -1.06 117.51 123.49 241l h ILE 150 Ca 0.12 -0.47 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 241l h ILE 150 Cb 0.50 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 241l h ILE 150 CO 0.02 0.21 0.21 0.74 0.00 0.00 0.00 178.15 179.34 241l h THR 151 N 0.85 1.18 -0.38 -0.27 2.02 -1.18 0.31 112.91 115.44 241l h THR 151 Ca 0.22 -0.53 -0.04 0.00 0.77 0.00 0.00 66.41 66.83 241l h THR 151 Cb 0.02 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 241l h THR 151 CO -0.04 0.21 0.06 0.74 0.37 0.00 0.00 175.52 176.87 241l h THR 152 N 0.69 1.24 -0.43 3.16 2.02 -0.64 -0.42 112.91 118.54 241l h THR 152 Ca 0.17 -0.85 -0.11 0.00 0.77 0.00 0.00 66.41 66.39 241l h THR 152 Cb 0.11 1.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 241l h THR 152 CO -0.02 0.29 -0.16 -0.26 0.37 0.00 0.00 175.52 175.74 241l h PHE 153 N 0.47 0.90 -0.33 3.16 0.04 -0.36 -0.02 116.94 120.80 241l h PHE 153 Ca 0.12 -0.18 -0.03 0.00 2.80 0.00 0.00 57.97 60.67 241l h PHE 153 Cb 0.36 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.27 241l h PHE 153 CO 0.02 0.91 0.10 -0.09 -0.60 0.00 0.00 178.31 178.65 241l h ARG 154 N 0.72 0.52 0.00 1.51 2.43 -0.17 -3.36 114.38 116.03 241l h ARG 154 Ca 0.11 -0.11 -0.21 0.00 -0.81 0.00 0.00 59.98 58.96 241l h ARG 154 Cb 0.66 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.10 241l h ARG 154 CO 0.05 0.56 -2.04 0.25 -1.51 0.00 0.00 179.97 177.28 241l n THR 155 N -4.66 0.90 -1.21 0.20 -2.24 -0.19 -4.79 114.28 102.30 241l n THR 155 Ca -0.02 -0.71 -0.07 0.00 -2.27 0.00 0.00 64.05 60.99 241l n THR 155 Cb 0.17 -0.38 -0.03 0.00 -2.10 0.00 0.00 70.33 67.99 241l n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 241l n GLY 156 N 1.51 0.94 3.52 3.38 0.00 -0.03 -5.01 105.19 109.51 241l n GLY 156 Ca -0.18 -0.69 -0.25 0.00 0.00 0.00 0.00 46.02 44.90 241l n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 241l s THR 157 N -2.26 0.93 -1.47 2.61 -4.23 -1.26 -4.79 115.64 105.17 241l s THR 157 Ca 0.00 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 58.71 241l s THR 157 Cb 0.00 -2.51 0.69 0.00 1.34 0.00 0.00 72.50 72.02 241l s THR 157 CO 0.00 0.00 1.59 0.79 -0.54 0.00 0.00 174.62 176.46 241l n TRP 158 N -0.87 1.30 -0.28 3.99 7.02 -1.26 -4.59 117.44 122.75 241l n TRP 158 Ca -0.06 -0.56 0.22 0.00 -1.02 0.00 0.00 57.50 56.08 241l n TRP 158 Cb 0.66 -0.15 0.53 0.00 -2.42 0.00 0.00 31.31 29.93 241l n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 241l h ASP 159 N 4.16 0.38 0.70 -0.99 3.32 -1.96 0.11 116.42 122.14 241l h ASP 159 Ca 0.00 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.10 241l h ASP 159 Cb 1.27 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.81 241l h ASP 159 CO 0.15 0.12 0.00 0.00 -1.72 0.00 0.00 179.24 177.79 241l n ALA 160 N -2.52 1.67 0.58 3.45 0.00 -1.26 -2.46 120.51 119.96 241l n ALA 160 Ca 0.22 0.06 0.07 0.00 0.00 0.00 0.00 53.44 53.80 241l n ALA 160 Cb 0.81 -1.37 0.06 0.00 0.00 0.00 0.00 19.45 18.95 241l n ALA 160 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 241l n TYR 161 N -2.13 0.00 1.03 0.00 4.01 0.36 -4.96 117.16 115.47 241l n TYR 161 Ca 0.02 -0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.88 241l n TYR 161 Cb 0.22 -0.00 0.13 0.00 -0.31 0.00 0.00 39.34 39.38 241l n TYR 161 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03