#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dau s ILE 2 N 0.00 3.95 0.09 3.17 1.01 -1.26 -0.83 121.20 127.33 3dau s ILE 2 Ca 0.00 -0.35 0.10 0.00 0.00 0.00 0.00 60.65 60.40 3dau s ILE 2 Cb 0.00 -2.71 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 3dau s ILE 2 CO 0.00 0.52 -0.25 -0.44 0.00 0.00 0.00 174.94 174.77 3dau s SER 3 N 0.03 3.06 -0.06 3.58 0.01 0.34 -0.49 113.70 120.17 3dau s SER 3 Ca 0.01 -0.67 -0.01 0.00 1.31 0.00 0.00 55.95 56.59 3dau s SER 3 Cb -0.13 -0.23 -0.03 0.00 0.21 0.00 0.00 66.02 65.84 3dau s SER 3 CO 0.03 0.18 0.02 -0.76 0.41 0.00 0.00 173.24 173.12 3dau s LEU 4 N -1.68 3.63 -0.06 2.44 1.02 -0.53 -0.31 118.68 123.18 3dau s LEU 4 Ca 0.11 0.13 0.03 0.00 0.02 0.00 0.00 54.13 54.43 3dau s LEU 4 Cb -0.10 -1.92 0.00 0.00 0.02 0.00 0.00 46.19 44.20 3dau s LEU 4 CO 0.04 0.35 -0.17 -0.51 0.02 0.00 0.00 176.35 176.08 3dau s ILE 5 N -0.97 1.44 0.07 -0.59 2.07 -0.49 -0.58 121.20 122.15 3dau s ILE 5 Ca 0.16 -0.68 -0.21 0.00 -1.41 0.00 0.00 60.65 58.50 3dau s ILE 5 Cb -0.11 -1.26 0.05 0.00 0.13 0.00 0.00 42.46 41.26 3dau s ILE 5 CO 0.05 0.42 0.50 0.00 -1.91 0.00 0.00 174.94 174.00 3dau s ALA 6 N 0.33 -1.25 -0.16 1.50 0.00 -0.24 -4.50 121.76 117.44 3dau s ALA 6 Ca -0.11 0.44 -0.01 0.00 0.00 0.00 0.00 51.96 52.29 3dau s ALA 6 Cb -0.14 0.49 -0.01 0.00 0.00 0.00 0.00 23.12 23.45 3dau s ALA 6 CO 0.04 -0.55 -0.12 0.00 0.00 0.00 0.00 175.76 175.13 3dau s ALA 7 N -2.82 2.61 -0.14 0.00 0.00 -1.26 -1.16 121.76 118.99 3dau s ALA 7 Ca -0.03 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 50.92 3dau s ALA 7 Cb -0.00 -1.34 0.01 0.00 0.00 0.00 0.00 23.12 21.79 3dau s ALA 7 CO -0.05 -0.04 -0.20 -0.51 0.00 0.00 0.00 175.76 174.96 3dau s LEU 8 N 0.83 1.99 0.00 0.00 1.02 0.41 -4.58 118.68 118.36 3dau s LEU 8 Ca -0.04 -0.56 -0.05 0.00 0.02 0.00 0.00 54.13 53.50 3dau s LEU 8 Cb -0.15 -1.35 0.07 0.00 0.02 0.00 0.00 46.19 44.78 3dau s LEU 8 CO 0.00 0.05 0.41 0.00 0.02 0.00 0.00 176.35 176.83 3dau n ALA 9 N 4.20 -0.51 -1.67 4.21 0.00 0.34 -0.48 120.51 126.60 3dau n ALA 9 Ca -0.20 -0.54 -0.40 0.00 0.00 0.00 0.00 53.44 52.30 3dau n ALA 9 Cb 0.51 -0.03 0.02 0.00 0.00 0.00 0.00 19.45 19.95 3dau n ALA 9 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3dau n VAL 10 N -2.61 2.84 -2.55 0.00 0.31 -0.59 -2.43 118.33 113.30 3dau n VAL 10 Ca 0.05 -0.50 -0.17 0.00 -0.01 0.00 0.00 64.34 63.71 3dau n VAL 10 Cb 0.18 -1.41 0.01 0.00 -0.91 0.00 0.00 33.84 31.71 3dau n VAL 10 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3dau n ASP 11 N 0.01 -4.96 -0.53 4.52 2.03 -1.26 -2.55 116.55 113.81 3dau n ASP 11 Ca 0.09 -0.11 -0.07 0.00 0.52 0.00 0.00 54.79 55.22 3dau n ASP 11 Cb 0.41 -3.96 -0.03 0.00 -0.72 0.00 0.00 41.12 36.82 3dau n ASP 11 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3dau n ARG 12 N -2.88 -1.00 -2.05 -0.67 1.74 -1.02 -4.89 116.66 105.89 3dau n ARG 12 Ca -0.15 0.65 -0.42 0.00 -0.77 0.00 0.00 57.85 57.16 3dau n ARG 12 Cb 0.62 -4.61 -0.03 0.00 -1.02 0.00 0.00 32.46 27.43 3dau n ARG 12 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3dau s VAL 13 N -1.99 3.01 0.00 1.55 1.01 -1.06 -0.28 120.40 122.64 3dau s VAL 13 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 61.98 62.68 3dau s VAL 13 Cb 0.00 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.93 3dau s VAL 13 CO 0.00 0.05 0.00 2.30 0.00 0.00 0.00 175.10 177.45 3dau n ILE 14 N 4.07 0.00 -3.46 2.22 -5.35 -0.45 -0.50 119.36 115.89 3dau n ILE 14 Ca 0.13 -0.15 -0.11 0.00 -0.27 0.00 0.00 62.75 62.35 3dau n ILE 14 Cb 0.41 0.63 -0.02 0.00 -1.74 0.00 0.00 39.64 38.92 3dau n ILE 14 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3dau s GLY 15 N -1.53 -0.56 -0.20 3.28 0.00 -1.07 -4.70 107.32 102.54 3dau s GLY 15 Ca 0.00 0.73 -0.08 0.00 0.00 0.00 0.00 44.72 45.36 3dau s GLY 15 CO 0.00 0.26 0.44 -0.29 0.00 0.00 0.00 173.10 173.51 3dau s MET 16 N -3.41 0.38 -1.34 2.90 1.75 -0.07 -0.61 119.30 118.91 3dau s MET 16 Ca 0.02 0.98 -0.04 0.00 -1.25 0.00 0.00 55.69 55.41 3dau s MET 16 Cb -0.01 0.22 0.02 0.00 2.84 0.00 0.00 34.83 37.90 3dau s MET 16 CO -0.11 -0.21 0.86 0.39 -0.65 0.00 0.00 175.02 175.30 3dau n GLU 17 N 4.93 -5.66 -2.41 4.11 1.02 -1.26 -1.77 120.64 119.60 3dau n GLU 17 Ca -0.15 0.68 -0.18 0.00 -0.02 0.00 0.00 57.16 57.49 3dau n GLU 17 Cb 0.52 -5.44 -0.01 0.00 -0.02 0.00 0.00 31.44 26.49 3dau n GLU 17 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3dau n ASN 18 N -3.02 -5.26 -3.57 1.62 3.02 -1.26 -4.97 115.26 101.82 3dau n ASN 18 Ca -0.20 0.05 -0.14 0.00 -0.03 0.00 0.00 54.58 54.26 3dau n ASN 18 Cb 0.63 -4.41 -0.06 0.00 -0.61 0.00 0.00 39.78 35.33 3dau n ASN 18 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dau s ALA 19 N -2.90 0.97 -0.15 5.41 0.00 -0.73 -4.83 121.76 119.52 3dau s ALA 19 Ca 0.00 -1.60 -0.04 0.00 0.00 0.00 0.00 51.96 50.32 3dau s ALA 19 Cb 0.00 1.27 -0.03 0.00 0.00 0.00 0.00 23.12 24.36 3dau s ALA 19 CO 0.00 -0.73 -0.00 -1.64 0.00 0.00 0.00 175.76 173.39 3dau s MET 20 N -3.50 3.65 -0.08 0.00 -1.94 -1.26 -0.89 119.30 115.28 3dau s MET 20 Ca 0.34 -0.45 -0.06 0.00 -1.71 0.00 0.00 55.69 53.80 3dau s MET 20 Cb 0.02 -2.98 -0.24 0.00 2.01 0.00 0.00 34.83 33.63 3dau s MET 20 CO 0.19 0.32 3.41 -0.35 -0.01 0.00 0.00 175.02 178.58 3dau n PRO 21 N 3.31 1.96 -3.77 2.03 -0.04 -1.26 -4.72 135.00 132.51 3dau n PRO 21 Ca -0.17 -1.00 -0.03 0.00 -0.04 0.00 0.00 63.50 62.25 3dau n PRO 21 Cb 0.53 -2.01 -0.01 0.00 -0.04 0.00 0.00 33.50 31.97 3dau n PRO 21 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 3dau s TRP 22 N 1.19 -0.11 -0.28 0.54 -2.14 -1.26 -4.97 118.94 111.91 3dau s TRP 22 Ca 0.63 -0.21 -0.03 0.00 2.66 0.00 0.00 56.10 59.15 3dau s TRP 22 Cb 0.29 0.65 0.11 0.00 -3.10 0.00 0.00 33.47 31.42 3dau s TRP 22 CO -0.00 -0.84 0.17 1.21 -2.66 0.00 0.00 176.95 174.83 3dau s ASN 23 N -2.99 3.04 -0.46 -2.66 2.47 -1.26 -5.09 114.94 107.99 3dau s ASN 23 Ca 0.13 -1.13 0.03 0.00 0.42 0.00 0.00 52.86 52.31 3dau s ASN 23 Cb -0.01 -0.14 0.14 0.00 -1.45 0.00 0.00 41.25 39.79 3dau s ASN 23 CO 0.03 -0.42 0.28 -0.76 -3.72 0.00 0.00 177.10 172.51 3dau s LEU 24 N 2.16 2.71 0.50 3.21 1.43 -1.26 -4.34 118.68 123.09 3dau s LEU 24 Ca 0.09 -2.82 0.20 0.00 -1.03 0.00 0.00 54.13 50.57 3dau s LEU 24 Cb -0.16 -1.00 1.26 0.00 0.03 0.00 0.00 46.19 46.32 3dau s LEU 24 CO -0.35 -0.23 2.02 -0.65 0.23 0.00 0.00 176.35 177.37 3dau h PRO 25 N 6.43 0.13 -0.29 1.29 0.11 -1.99 0.03 132.00 137.71 3dau h PRO 25 Ca 0.05 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.11 3dau h PRO 25 Cb 0.91 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.97 3dau h PRO 25 CO 0.49 0.08 0.01 0.00 -0.21 0.00 0.00 178.00 178.37 3dau h ALA 26 N 1.77 1.48 -0.22 -0.75 0.00 -1.93 -1.04 119.26 118.57 3dau h ALA 26 Ca 0.21 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 3dau h ALA 26 Cb 0.67 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 3dau h ALA 26 CO -0.03 0.37 -0.56 0.22 0.00 0.00 0.00 179.25 179.26 3dau h ASP 27 N 0.42 0.76 -0.08 0.00 3.58 -1.42 -2.21 116.42 117.46 3dau h ASP 27 Ca 0.09 -0.41 -0.04 0.00 0.42 0.00 0.00 57.03 57.09 3dau h ASP 27 Cb 0.27 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.09 3dau h ASP 27 CO 0.01 1.16 -0.04 -0.07 -2.88 0.00 0.00 179.24 177.41 3dau h LEU 28 N 0.52 0.29 -0.37 2.28 3.38 -0.93 0.12 115.31 120.60 3dau h LEU 28 Ca 0.01 -0.05 -0.18 0.00 0.09 0.00 0.00 57.88 57.75 3dau h LEU 28 Cb 1.13 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 3dau h LEU 28 CO 0.11 0.38 -0.59 0.00 0.09 0.00 0.00 178.44 178.44 3dau h ALA 29 N 1.66 0.54 -0.71 1.53 0.00 -1.03 0.06 119.26 121.31 3dau h ALA 29 Ca 0.07 -0.53 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 3dau h ALA 29 Cb 0.28 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3dau h ALA 29 CO 0.01 0.69 0.17 2.35 0.00 0.00 0.00 179.25 182.47 3dau h TRP 30 N 0.55 1.20 -0.31 0.00 2.91 -0.90 -0.10 115.95 119.29 3dau h TRP 30 Ca 0.00 -0.14 0.00 0.00 1.13 0.00 0.00 58.89 59.88 3dau h TRP 30 Cb 1.17 -0.34 -0.02 0.00 -0.51 0.00 0.00 29.16 29.47 3dau h TRP 30 CO 0.06 0.97 0.20 0.35 -1.03 0.00 0.00 178.44 178.99 3dau h PHE 31 N 1.08 0.40 -0.10 2.65 3.57 -0.43 -1.24 116.94 122.87 3dau h PHE 31 Ca 0.22 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.73 3dau h PHE 31 Cb 0.38 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.98 3dau h PHE 31 CO 0.03 0.27 0.05 -0.22 -2.23 0.00 0.00 178.31 176.21 3dau h LYS 32 N 0.41 0.14 -0.64 1.11 3.64 -0.63 -1.22 116.57 119.38 3dau h LYS 32 Ca 0.11 -0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.59 3dau h LYS 32 Cb -0.02 -0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 31.69 3dau h LYS 32 CO -0.02 0.18 0.21 0.00 -2.27 0.00 0.00 179.45 177.54 3dau h ARG 33 N 0.07 0.35 -0.01 1.90 3.08 -0.76 -0.49 114.38 118.52 3dau h ARG 33 Ca 0.03 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3dau h ARG 33 Cb 0.08 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3dau h ARG 33 CO -0.01 0.23 -0.28 0.09 -1.07 0.00 0.00 179.97 178.94 3dau n ASN 34 N -5.05 0.98 -0.00 7.04 3.02 -0.49 -3.97 115.26 116.79 3dau n ASN 34 Ca 0.10 -0.83 0.06 0.00 -0.03 0.00 0.00 54.58 53.87 3dau n ASN 34 Cb 0.32 0.15 -0.08 0.00 -0.61 0.00 0.00 39.78 39.56 3dau n ASN 34 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3dau n THR 35 N -0.72 0.00 -1.66 3.41 -2.24 -0.49 -4.98 114.28 107.59 3dau n THR 35 Ca 0.12 -0.25 -0.43 0.00 -2.27 0.00 0.00 64.05 61.21 3dau n THR 35 Cb 0.35 0.34 -0.01 0.00 -2.10 0.00 0.00 70.33 68.91 3dau n THR 35 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3dau n LEU 36 N -1.81 2.97 -1.93 3.22 7.94 -0.24 -1.78 117.00 125.37 3dau n LEU 36 Ca -0.02 1.20 -0.19 0.00 -1.11 0.00 0.00 56.01 55.89 3dau n LEU 36 Cb 0.27 -1.42 -0.03 0.00 0.53 0.00 0.00 43.42 42.77 3dau n LEU 36 CO 0.23 -0.78 -0.22 0.59 -1.11 0.00 0.00 177.39 176.09 3dau n ASN 37 N 0.92 -5.40 -4.14 1.96 3.02 0.92 -5.00 115.26 107.54 3dau n ASN 37 Ca 0.06 0.13 -0.15 0.00 -0.03 0.00 0.00 54.58 54.60 3dau n ASN 37 Cb 0.35 -4.48 -0.11 0.00 -0.61 0.00 0.00 39.78 34.92 3dau n ASN 37 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3dau s LYS 38 N -4.52 0.73 0.38 3.52 1.02 -0.74 -5.03 119.74 115.10 3dau s LYS 38 Ca 0.00 -0.97 -0.26 0.00 0.02 0.00 0.00 55.97 54.76 3dau s LYS 38 Cb 0.00 -0.53 -0.09 0.00 -0.52 0.00 0.00 37.83 36.69 3dau s LYS 38 CO 0.00 0.10 1.11 -1.25 -0.92 0.00 0.00 175.35 174.39 3dau s PRO 39 N -2.12 4.20 -0.11 -1.68 0.04 -1.26 -3.80 135.00 130.27 3dau s PRO 39 Ca -0.02 1.71 0.03 0.00 0.04 0.00 0.00 61.00 62.76 3dau s PRO 39 Cb -0.07 -2.72 -0.00 0.00 0.04 0.00 0.00 34.50 31.75 3dau s PRO 39 CO 0.01 -0.15 -0.21 0.14 0.04 0.00 0.00 177.00 176.83 3dau s VAL 40 N -1.46 2.36 -0.18 -0.36 -7.23 -0.02 -1.51 120.40 112.00 3dau s VAL 40 Ca 0.55 -0.91 -0.07 0.00 -1.81 0.00 0.00 61.98 59.74 3dau s VAL 40 Cb -0.28 -1.93 -0.04 0.00 0.56 0.00 0.00 36.38 34.70 3dau s VAL 40 CO 0.35 0.55 0.04 -0.63 -0.31 0.00 0.00 175.10 175.10 3dau s ILE 41 N 0.32 4.57 0.05 -0.62 1.01 0.01 -0.43 121.20 126.11 3dau s ILE 41 Ca -0.16 -0.11 -0.03 0.00 0.00 0.00 0.00 60.65 60.35 3dau s ILE 41 Cb -0.17 -3.06 -0.02 0.00 0.01 0.00 0.00 42.46 39.22 3dau s ILE 41 CO 0.08 0.45 0.04 0.00 0.00 0.00 0.00 174.94 175.51 3dau s MET 42 N 0.51 0.61 0.66 2.79 0.23 -0.24 -1.14 119.30 122.73 3dau s MET 42 Ca 0.02 -1.00 -0.11 0.00 -1.03 0.00 0.00 55.69 53.56 3dau s MET 42 Cb -0.13 0.23 -0.02 0.00 -1.53 0.00 0.00 34.83 33.38 3dau s MET 42 CO 0.01 -0.14 1.06 0.20 -2.03 0.00 0.00 175.02 174.12 3dau s GLY 43 N -2.58 1.65 0.29 3.16 0.00 0.04 -0.69 107.32 109.19 3dau s GLY 43 Ca 0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 44.72 44.51 3dau s GLY 43 CO -0.08 0.11 1.96 -0.09 0.00 0.00 0.00 173.10 175.00 3dau h ARG 44 N -0.46 1.14 -0.35 2.90 2.43 -1.82 -0.53 114.38 117.67 3dau h ARG 44 Ca -0.44 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 58.63 3dau h ARG 44 Cb 1.22 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 30.50 3dau h ARG 44 CO 0.63 0.75 0.10 0.45 -1.51 0.00 0.00 179.97 180.39 3dau h HIS 45 N 1.17 0.58 -0.45 2.20 3.86 -1.94 -0.90 115.15 119.67 3dau h HIS 45 Ca 0.32 -0.06 0.04 0.00 -1.16 0.00 0.00 60.37 59.51 3dau h HIS 45 Cb -0.12 -0.17 -0.04 0.00 1.06 0.00 0.00 27.41 28.15 3dau h HIS 45 CO -0.00 0.57 0.23 1.15 0.86 0.00 0.00 177.93 180.73 3dau h THR 46 N 0.42 0.97 -0.71 2.45 2.02 -1.78 -1.41 112.91 114.87 3dau h THR 46 Ca 0.11 -0.16 0.06 0.00 0.77 0.00 0.00 66.41 67.19 3dau h THR 46 Cb 0.27 0.48 -0.05 0.00 -1.74 0.00 0.00 68.15 67.10 3dau h THR 46 CO -0.00 0.08 0.41 -0.25 0.37 0.00 0.00 175.52 176.13 3dau h TRP 47 N 0.45 0.76 -0.13 3.16 2.91 -0.83 -0.98 115.95 121.29 3dau h TRP 47 Ca 0.20 0.03 -0.07 0.00 1.13 0.00 0.00 58.89 60.17 3dau h TRP 47 Cb 0.10 -0.24 -0.01 0.00 -0.51 0.00 0.00 29.16 28.50 3dau h TRP 47 CO -0.10 0.38 -0.22 0.93 -1.03 0.00 0.00 178.44 178.40 3dau h GLU 48 N 0.76 0.22 -0.27 2.65 5.08 -0.65 -0.55 114.58 121.83 3dau h GLU 48 Ca 0.31 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.49 3dau h GLU 48 Cb 0.16 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 3dau h GLU 48 CO -0.17 0.44 -0.31 0.77 -1.00 0.00 0.00 179.01 178.73 3dau h SER 49 N 0.20 0.59 -0.03 1.42 0.02 -0.24 -3.24 113.55 112.27 3dau h SER 49 Ca 0.04 -0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 60.71 3dau h SER 49 Cb 0.50 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.88 3dau h SER 49 CO 0.03 0.87 -0.16 0.40 -1.14 0.00 0.00 176.83 176.83 3dau h ILE 50 N 0.49 1.49 0.00 3.27 2.04 -0.45 -3.48 117.51 120.87 3dau h ILE 50 Ca 0.06 -1.66 0.00 0.00 1.00 0.00 0.00 64.86 64.26 3dau h ILE 50 Cb 0.78 2.49 0.00 0.00 -0.74 0.00 0.00 36.82 39.35 3dau h ILE 50 CO 0.06 0.45 0.00 0.61 0.00 0.00 0.00 178.15 179.28 3dau n GLY 51 N 0.73 2.20 3.48 5.37 0.00 -0.29 -4.96 105.19 111.72 3dau n GLY 51 Ca -0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.83 3dau n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3dau s ARG 52 N -0.55 1.32 0.34 1.61 1.04 -1.26 -5.08 118.95 116.37 3dau s ARG 52 Ca 0.00 -0.82 -0.29 0.00 -1.04 0.00 0.00 55.73 53.58 3dau s ARG 52 Cb 0.00 0.51 -0.11 0.00 -2.04 0.00 0.00 34.95 33.31 3dau s ARG 52 CO 0.00 -0.56 1.52 -2.14 -0.04 0.00 0.00 175.30 174.08 3dau s PRO 53 N -3.86 4.12 -0.14 3.89 0.02 -1.26 -4.95 135.00 132.83 3dau s PRO 53 Ca 0.08 2.56 -0.29 0.00 0.02 0.00 0.00 61.00 63.36 3dau s PRO 53 Cb -0.00 -2.99 -0.01 0.00 0.02 0.00 0.00 34.50 31.51 3dau s PRO 53 CO -0.05 -0.56 1.11 -0.51 -0.33 0.00 0.00 177.00 176.67 3dau s LEU 54 N -1.52 4.20 0.50 -5.54 1.43 -1.26 -4.99 118.68 111.50 3dau s LEU 54 Ca 0.56 1.59 -0.21 0.00 -1.03 0.00 0.00 54.13 55.05 3dau s LEU 54 Cb -0.47 -3.55 -0.07 0.00 0.03 0.00 0.00 46.19 42.14 3dau s LEU 54 CO 0.57 -0.60 1.15 -2.16 0.23 0.00 0.00 176.35 175.55 3dau s PRO 55 N 2.65 3.54 -0.01 1.29 0.04 -1.26 -3.37 135.00 137.88 3dau s PRO 55 Ca 0.50 1.70 0.00 0.00 0.04 0.00 0.00 61.00 63.25 3dau s PRO 55 Cb -0.20 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.14 3dau s PRO 55 CO 0.15 -0.72 0.00 0.41 0.04 0.00 0.00 177.00 176.88 3dau n GLY 56 N 0.31 0.48 2.92 0.56 0.00 -1.26 -4.84 105.19 103.37 3dau n GLY 56 Ca 0.10 -0.14 -0.12 0.00 0.00 0.00 0.00 46.02 45.86 3dau n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dau s ARG 57 N -0.34 0.10 -0.13 1.61 0.52 -1.22 -0.06 118.95 119.44 3dau s ARG 57 Ca 0.00 -0.08 -0.29 0.00 -0.52 0.00 0.00 55.73 54.84 3dau s ARG 57 Cb 0.00 0.04 -0.02 0.00 0.52 0.00 0.00 34.95 35.49 3dau s ARG 57 CO 0.00 -0.02 1.27 0.21 0.02 0.00 0.00 175.30 176.78 3dau s LYS 58 N -0.27 4.26 -0.26 3.54 2.20 -1.25 -4.79 119.74 123.17 3dau s LYS 58 Ca -0.03 1.70 -0.12 0.00 -0.36 0.00 0.00 55.97 57.15 3dau s LYS 58 Cb -0.02 -3.72 -0.05 0.00 -1.51 0.00 0.00 37.83 32.53 3dau s LYS 58 CO -0.00 -0.65 0.24 -0.80 -0.36 0.00 0.00 175.35 173.78 3dau s ASN 59 N 1.92 6.13 -0.19 1.43 0.02 -1.26 -0.84 114.94 122.15 3dau s ASN 59 Ca 0.56 0.13 0.00 0.00 -1.02 0.00 0.00 52.86 52.54 3dau s ASN 59 Cb -0.23 -2.15 0.02 0.00 0.02 0.00 0.00 41.25 38.91 3dau s ASN 59 CO 0.17 -0.05 -0.17 -0.63 0.02 0.00 0.00 177.10 176.44 3dau s ILE 60 N 1.60 2.25 -0.15 0.60 1.01 0.42 -1.32 121.20 125.61 3dau s ILE 60 Ca 0.10 -0.93 -0.01 0.00 0.00 0.00 0.00 60.65 59.81 3dau s ILE 60 Cb -0.15 -1.98 -0.01 0.00 0.01 0.00 0.00 42.46 40.32 3dau s ILE 60 CO 0.09 0.48 -0.11 -0.63 0.00 0.00 0.00 174.94 174.77 3dau s ILE 61 N 1.30 3.17 -0.03 2.92 -1.09 0.52 -1.08 121.20 126.92 3dau s ILE 61 Ca 0.04 -0.60 -0.28 0.00 -2.23 0.00 0.00 60.65 57.58 3dau s ILE 61 Cb -0.14 -2.36 -0.03 0.00 -1.58 0.00 0.00 42.46 38.35 3dau s ILE 61 CO -0.11 0.50 0.88 -0.76 -1.23 0.00 0.00 174.94 174.22 3dau s LEU 62 N 0.59 4.34 -0.20 2.97 1.43 0.13 -0.77 118.68 127.18 3dau s LEU 62 Ca -0.06 1.48 -0.27 0.00 -1.03 0.00 0.00 54.13 54.24 3dau s LEU 62 Cb -0.15 -3.39 0.07 0.00 0.03 0.00 0.00 46.19 42.75 3dau s LEU 62 CO 0.03 -0.22 0.73 -0.55 0.23 0.00 0.00 176.35 176.56 3dau s SER 63 N 0.94 -0.70 0.21 2.29 0.15 -0.20 -2.35 113.70 114.04 3dau s SER 63 Ca 0.46 1.17 0.23 0.00 0.70 0.00 0.00 55.95 58.51 3dau s SER 63 Cb -0.20 1.12 0.91 0.00 -1.71 0.00 0.00 66.02 66.15 3dau s SER 63 CO 0.24 -0.37 1.70 -1.54 1.20 0.00 0.00 173.24 174.47 3dau n SER 64 N 2.05 0.58 -4.83 5.45 3.41 -1.26 -4.07 113.62 114.95 3dau n SER 64 Ca -0.15 0.62 -0.22 0.00 -0.26 0.00 0.00 58.87 58.86 3dau n SER 64 Cb 0.56 -0.75 -0.04 0.00 -0.26 0.00 0.00 64.21 63.71 3dau n SER 64 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3dau s GLN 65 N -3.23 2.89 0.66 4.33 1.11 -1.26 -5.04 119.66 119.12 3dau s GLN 65 Ca 0.06 -1.10 -0.18 0.00 0.01 0.00 0.00 55.36 54.16 3dau s GLN 65 Cb 0.10 -2.54 -0.01 0.00 -1.01 0.00 0.00 33.01 29.55 3dau s GLN 65 CO 0.41 0.35 1.25 -2.30 0.01 0.00 0.00 175.29 175.02 3dau n PRO 66 N -1.20 1.00 -1.29 2.91 -0.02 -1.26 -4.94 135.00 130.21 3dau n PRO 66 Ca -0.07 0.40 -0.33 0.00 -2.02 0.00 0.00 63.50 61.48 3dau n PRO 66 Cb 0.58 -2.48 0.10 0.00 -0.02 0.00 0.00 33.50 31.68 3dau n PRO 66 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3dau s GLY 67 N -1.43 2.04 -0.07 -1.23 0.00 -1.26 -4.97 107.32 100.40 3dau s GLY 67 Ca 0.81 0.65 0.11 0.00 0.00 0.00 0.00 44.72 46.29 3dau s GLY 67 CO 0.42 1.04 1.10 -1.30 0.00 0.00 0.00 173.10 174.35 3dau n THR 68 N -3.16 0.92 -3.44 0.90 -2.24 -1.26 -4.97 114.28 101.04 3dau n THR 68 Ca 0.12 -1.27 -0.09 0.00 -2.27 0.00 0.00 64.05 60.54 3dau n THR 68 Cb 0.51 0.20 -0.08 0.00 -2.10 0.00 0.00 70.33 68.86 3dau n THR 68 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dau s ASP 69 N -2.03 0.05 0.00 3.42 -1.08 -1.26 -5.02 116.67 110.75 3dau s ASP 69 Ca 0.19 0.47 0.19 0.00 -0.52 0.00 0.00 52.55 52.88 3dau s ASP 69 Cb 0.18 1.21 0.92 0.00 -1.46 0.00 0.00 42.92 43.77 3dau s ASP 69 CO -0.01 -0.28 1.59 0.47 0.52 0.00 0.00 175.17 177.45 3dau n ASP 70 N 5.37 0.00 0.05 -0.34 8.00 -1.26 -2.78 116.55 125.59 3dau n ASP 70 Ca -0.05 0.11 0.13 0.00 0.71 0.00 0.00 54.79 55.69 3dau n ASP 70 Cb 0.50 -0.33 0.43 0.00 -0.02 0.00 0.00 41.12 41.70 3dau n ASP 70 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3dau n ARG 71 N -1.33 0.13 -4.44 -1.24 1.74 -1.26 -4.89 116.66 105.37 3dau n ARG 71 Ca 0.08 0.09 -0.21 0.00 -0.77 0.00 0.00 57.85 57.03 3dau n ARG 71 Cb 0.16 -1.63 -0.11 0.00 -1.02 0.00 0.00 32.46 29.87 3dau n ARG 71 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3dau s VAL 72 N -3.06 1.37 -0.22 1.55 -7.23 -1.12 -4.93 120.40 106.77 3dau s VAL 72 Ca 0.11 -2.04 -0.15 0.00 -1.81 0.00 0.00 61.98 58.10 3dau s VAL 72 Cb 0.16 -2.66 -0.04 0.00 0.56 0.00 0.00 36.38 34.39 3dau s VAL 72 CO 0.60 -0.12 0.35 -0.89 -0.31 0.00 0.00 175.10 174.73 3dau s THR 73 N -3.18 5.22 -0.11 5.32 2.01 -0.43 -4.93 115.64 119.54 3dau s THR 73 Ca 0.33 0.59 -0.04 0.00 0.31 0.00 0.00 61.69 62.89 3dau s THR 73 Cb 0.07 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 3dau s THR 73 CO 0.14 0.25 0.05 0.26 -0.69 0.00 0.00 174.62 174.63 3dau s TRP 74 N 1.41 3.32 0.03 4.92 0.52 -1.26 -0.35 118.94 127.52 3dau s TRP 74 Ca 0.16 0.30 -0.03 0.00 0.02 0.00 0.00 56.10 56.55 3dau s TRP 74 Cb -0.15 -1.86 -0.02 0.00 -1.15 0.00 0.00 33.47 30.29 3dau s TRP 74 CO 0.08 0.54 0.03 0.14 0.02 0.00 0.00 176.95 177.75 3dau s VAL 75 N -0.83 0.13 -1.36 4.03 -7.23 0.05 -4.93 120.40 110.25 3dau s VAL 75 Ca 0.13 -1.05 0.12 0.00 -1.81 0.00 0.00 61.98 59.36 3dau s VAL 75 Cb -0.12 -0.64 0.15 0.00 0.56 0.00 0.00 36.38 36.34 3dau s VAL 75 CO 0.03 -0.58 0.97 0.29 -0.31 0.00 0.00 175.10 175.50 3dau n LYS 76 N 1.14 1.20 -3.63 4.82 5.02 -1.26 -1.03 118.16 124.42 3dau n LYS 76 Ca -0.21 -1.43 -0.10 0.00 -2.02 0.00 0.00 58.31 54.56 3dau n LYS 76 Cb 0.57 -1.24 -0.02 0.00 -0.02 0.00 0.00 35.03 34.32 3dau n LYS 76 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3dau s SER 77 N -0.99 -0.42 0.17 4.39 1.04 -1.26 -4.76 113.70 111.86 3dau s SER 77 Ca 0.17 -0.29 -0.14 0.00 0.48 0.00 0.00 55.95 56.16 3dau s SER 77 Cb 0.11 0.66 0.09 0.00 0.10 0.00 0.00 66.02 66.98 3dau s SER 77 CO 0.15 -1.15 1.79 0.58 0.98 0.00 0.00 173.24 175.59 3dau h VAL 78 N 2.00 0.98 -0.41 5.02 2.07 -1.99 -0.13 116.25 123.79 3dau h VAL 78 Ca -0.27 -0.16 -0.09 0.00 0.82 0.00 0.00 66.70 67.00 3dau h VAL 78 Cb 1.28 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 3dau h VAL 78 CO 0.31 0.09 -0.11 0.44 0.02 0.00 0.00 177.57 178.31 3dau h ASP 79 N 0.47 0.72 -0.53 0.57 3.32 -2.00 -1.62 116.42 117.36 3dau h ASP 79 Ca 0.19 -0.21 -0.09 0.00 0.02 0.00 0.00 57.03 56.94 3dau h ASP 79 Cb 0.08 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 3dau h ASP 79 CO -0.13 0.86 -0.02 -0.33 -1.72 0.00 0.00 179.24 177.91 3dau h GLU 80 N 0.67 0.99 -0.51 3.56 5.08 -1.88 -0.51 114.58 121.98 3dau h GLU 80 Ca 0.11 -0.31 -0.00 0.00 -1.00 0.00 0.00 59.36 58.16 3dau h GLU 80 Cb 0.58 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 3dau h GLU 80 CO 0.04 0.98 0.30 0.00 -1.00 0.00 0.00 179.01 179.33 3dau h ALA 81 N 1.06 0.65 -0.44 3.43 0.00 -0.41 -1.22 119.26 122.33 3dau h ALA 81 Ca 0.16 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 3dau h ALA 81 Cb 0.55 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3dau h ALA 81 CO 0.03 0.14 -0.11 0.82 0.00 0.00 0.00 179.25 180.13 3dau h ILE 82 N 0.68 1.27 -0.50 0.00 2.04 -1.13 -2.71 117.51 117.16 3dau h ILE 82 Ca 0.18 -1.23 -0.03 0.00 1.00 0.00 0.00 64.86 64.79 3dau h ILE 82 Cb 0.00 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 3dau h ILE 82 CO -0.03 0.42 0.21 0.00 0.00 0.00 0.00 178.15 178.74 3dau h ALA 83 N 0.86 1.41 0.00 1.87 0.00 -0.93 -1.54 119.26 120.94 3dau h ALA 83 Ca 0.11 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3dau h ALA 83 Cb 0.65 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3dau h ALA 83 CO 0.04 0.45 0.00 0.00 0.00 0.00 0.00 179.25 179.74 3dau n ALA 84 N -2.46 1.50 0.42 0.00 0.00 -0.48 -1.68 120.51 117.81 3dau n ALA 84 Ca 0.04 0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.71 3dau n ALA 84 Cb 0.15 -1.35 0.24 0.00 0.00 0.00 0.00 19.45 18.49 3dau n ALA 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dau n GLY 86 N 1.23 0.69 3.32 0.00 0.00 -0.68 -4.33 105.19 105.42 3dau n GLY 86 Ca 0.04 -0.79 -0.46 0.00 0.00 0.00 0.00 46.02 44.81 3dau n GLY 86 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3dau s ASP 87 N -4.00 6.28 0.12 1.61 -4.77 -1.26 -4.97 116.67 109.68 3dau s ASP 87 Ca 0.00 -1.89 0.06 0.00 -3.30 0.00 0.00 52.55 47.42 3dau s ASP 87 Cb 0.00 -2.22 -0.04 0.00 -1.09 0.00 0.00 42.92 39.57 3dau s ASP 87 CO 0.00 -0.84 -0.15 0.68 0.70 0.00 0.00 175.17 175.56 3dau s VAL 88 N 1.49 1.38 0.49 2.11 -7.23 -1.26 -5.05 120.40 112.33 3dau s VAL 88 Ca 0.06 -1.72 0.20 0.00 -1.81 0.00 0.00 61.98 58.71 3dau s VAL 88 Cb -0.26 -1.55 0.26 0.00 0.56 0.00 0.00 36.38 35.38 3dau s VAL 88 CO 0.01 -0.39 2.09 -0.65 -0.31 0.00 0.00 175.10 175.86 3dau h PRO 89 N 3.53 0.00 -2.35 4.82 0.11 -1.95 -3.40 132.00 132.76 3dau h PRO 89 Ca -0.40 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.66 3dau h PRO 89 Cb 1.20 0.00 -0.24 0.00 0.11 0.00 0.00 31.00 32.06 3dau h PRO 89 CO 0.50 0.09 -0.23 -2.00 -0.21 0.00 0.00 178.00 176.16 3dau s GLU 90 N -4.66 0.47 -0.16 1.05 2.12 -1.26 -2.40 118.70 113.85 3dau s GLU 90 Ca -0.04 1.09 -0.08 0.00 0.36 0.00 0.00 54.97 56.30 3dau s GLU 90 Cb 0.15 0.30 -0.04 0.00 0.26 0.00 0.00 34.13 34.80 3dau s GLU 90 CO 0.64 -0.20 0.11 0.42 -0.54 0.00 0.00 175.26 175.69 3dau s ILE 91 N 2.15 5.20 -0.20 -3.70 1.01 -0.01 -4.33 121.20 121.31 3dau s ILE 91 Ca -0.06 0.11 -0.07 0.00 0.00 0.00 0.00 60.65 60.63 3dau s ILE 91 Cb -0.10 -3.32 -0.03 0.00 0.01 0.00 0.00 42.46 39.02 3dau s ILE 91 CO -0.15 0.51 0.05 -0.04 0.00 0.00 0.00 174.94 175.30 3dau s MET 92 N -0.15 3.79 -0.25 2.79 -1.94 -0.57 -0.50 119.30 122.48 3dau s MET 92 Ca 0.09 -0.43 -0.09 0.00 -1.71 0.00 0.00 55.69 53.55 3dau s MET 92 Cb -0.12 -3.20 -0.04 0.00 2.01 0.00 0.00 34.83 33.49 3dau s MET 92 CO 0.01 0.08 0.11 0.08 -0.01 0.00 0.00 175.02 175.29 3dau s VAL 93 N 0.86 4.74 -0.51 -6.03 1.01 0.57 -0.81 120.40 120.23 3dau s VAL 93 Ca 0.03 -0.03 0.12 0.00 0.00 0.00 0.00 61.98 62.09 3dau s VAL 93 Cb -0.14 -3.22 0.33 0.00 0.00 0.00 0.00 36.38 33.35 3dau s VAL 93 CO 0.02 0.33 1.26 2.30 0.00 0.00 0.00 175.10 179.01 3dau n ILE 94 N 4.73 1.45 0.00 2.22 -5.35 -0.29 -1.39 119.36 120.73 3dau n ILE 94 Ca -0.15 -1.36 0.00 0.00 -0.27 0.00 0.00 62.75 60.97 3dau n ILE 94 Cb 0.52 0.22 0.00 0.00 -1.74 0.00 0.00 39.64 38.64 3dau n ILE 94 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dau n GLY 95 N -0.08 1.39 0.00 3.28 0.00 -1.26 -4.95 105.19 103.57 3dau n GLY 95 Ca 0.13 -2.23 0.00 0.00 0.00 0.00 0.00 46.02 43.92 3dau n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dau n GLY 96 N -0.69 1.64 0.28 -0.02 0.00 -1.26 -0.78 105.19 104.35 3dau n GLY 96 Ca 0.00 -1.78 -0.05 0.00 0.00 0.00 0.00 46.02 44.19 3dau n GLY 96 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dau h GLY 97 N 0.00 1.00 0.90 -0.02 0.00 -1.97 0.17 103.07 103.15 3dau h GLY 97 Ca 0.00 -0.37 0.03 0.00 0.00 0.00 0.00 47.33 46.99 3dau h GLY 97 CO 0.00 0.35 0.55 -0.09 0.00 0.00 0.00 176.54 177.35 3dau h ARG 98 N 0.94 1.05 -0.31 4.80 9.65 -1.94 -1.75 114.38 126.82 3dau h ARG 98 Ca 0.26 -0.06 -0.12 0.00 -1.10 0.00 0.00 59.98 58.96 3dau h ARG 98 Cb -0.09 -0.24 -0.01 0.00 -1.39 0.00 0.00 29.97 28.25 3dau h ARG 98 CO -0.06 0.69 -0.27 0.28 2.80 0.00 0.00 179.97 183.41 3dau h VAL 99 N 1.08 1.29 -0.95 0.20 2.07 -1.69 -2.94 116.25 115.31 3dau h VAL 99 Ca 0.33 -1.43 0.06 0.00 0.82 0.00 0.00 66.70 66.48 3dau h VAL 99 Cb -0.02 1.51 -0.06 0.00 -1.52 0.00 0.00 31.29 31.19 3dau h VAL 99 CO -0.11 0.46 0.61 1.88 0.02 0.00 0.00 177.57 180.44 3dau h TYR 100 N 0.50 1.14 -0.94 1.57 0.05 -0.38 -1.72 116.97 117.19 3dau h TYR 100 Ca 0.06 0.03 0.07 0.00 0.05 0.00 0.00 58.73 58.93 3dau h TYR 100 Cb 0.84 -0.37 -0.07 0.00 1.01 0.00 0.00 36.73 38.14 3dau h TYR 100 CO 0.07 0.60 0.60 0.93 -1.05 0.00 0.00 178.16 179.31 3dau h GLU 101 N 1.13 1.05 0.03 4.88 5.08 -1.23 0.14 114.58 125.65 3dau h GLU 101 Ca 0.41 -0.06 -0.22 0.00 -1.00 0.00 0.00 59.36 58.48 3dau h GLU 101 Cb 0.13 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.14 3dau h GLU 101 CO -0.16 0.69 -0.99 1.96 -1.00 0.00 0.00 179.01 179.51 3dau h GLN 102 N 1.08 0.26 0.00 2.33 4.20 -1.25 -3.35 115.11 118.38 3dau h GLN 102 Ca 0.41 -0.33 0.00 0.00 0.06 0.00 0.00 58.65 58.79 3dau h GLN 102 Cb 0.18 0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.07 3dau h GLN 102 CO -0.18 1.06 -1.33 1.19 -0.67 0.00 0.00 178.83 178.90 3dau n PHE 103 N -3.63 0.58 -0.24 2.96 3.72 -0.70 -4.35 117.46 115.80 3dau n PHE 103 Ca -0.05 0.17 0.04 0.00 -0.05 0.00 0.00 57.45 57.55 3dau n PHE 103 Cb 0.88 -0.76 0.16 0.00 -0.94 0.00 0.00 39.48 38.82 3dau n PHE 103 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 3dau h LEU 104 N 0.00 0.11 -2.24 4.37 5.85 -0.87 0.03 115.31 122.57 3dau h LEU 104 Ca 0.00 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 3dau h LEU 104 Cb 0.97 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.14 3dau h LEU 104 CO 0.00 0.03 -0.03 -0.65 -0.34 0.00 0.00 178.44 177.45 3dau h PRO 105 N 0.33 0.00 0.00 5.25 0.11 -1.79 -1.95 132.00 133.95 3dau h PRO 105 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 3dau h PRO 105 Cb 0.61 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.72 3dau h PRO 105 CO -0.44 0.03 -0.54 1.63 -0.21 0.00 0.00 178.00 178.47 3dau n LYS 106 N -3.24 0.02 -3.08 1.05 5.02 -0.06 -4.97 118.16 112.91 3dau n LYS 106 Ca -0.02 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.92 3dau n LYS 106 Cb 0.18 -1.51 -0.06 0.00 -0.02 0.00 0.00 35.03 33.62 3dau n LYS 106 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dau s ALA 107 N -3.01 3.38 -0.67 7.82 0.00 -0.74 -4.44 121.76 124.11 3dau s ALA 107 Ca 0.11 0.18 0.15 0.00 0.00 0.00 0.00 51.96 52.39 3dau s ALA 107 Cb 0.17 -2.85 -0.17 0.00 0.00 0.00 0.00 23.12 20.28 3dau s ALA 107 CO 0.71 0.31 0.62 1.04 0.00 0.00 0.00 175.76 178.45 3dau n GLN 108 N 0.55 1.96 -3.78 0.00 6.02 0.35 -4.87 117.38 117.61 3dau n GLN 108 Ca -0.01 -0.01 -0.13 0.00 -0.01 0.00 0.00 57.00 56.84 3dau n GLN 108 Cb 0.51 -1.22 -0.10 0.00 1.02 0.00 0.00 30.24 30.45 3dau n GLN 108 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3dau s LYS 109 N -2.45 0.47 -0.05 -1.09 2.20 -1.21 -0.96 119.74 116.64 3dau s LYS 109 Ca 0.05 0.13 0.05 0.00 -0.36 0.00 0.00 55.97 55.84 3dau s LYS 109 Cb 0.11 0.21 -0.01 0.00 -1.51 0.00 0.00 37.83 36.64 3dau s LYS 109 CO 0.62 -0.10 -0.21 -0.51 -0.36 0.00 0.00 175.35 174.80 3dau s LEU 110 N -0.49 1.98 -0.29 5.43 1.43 -0.17 -1.45 118.68 125.12 3dau s LEU 110 Ca -0.06 -0.43 -0.01 0.00 -1.03 0.00 0.00 54.13 52.60 3dau s LEU 110 Cb -0.04 -1.16 0.05 0.00 0.03 0.00 0.00 46.19 45.08 3dau s LEU 110 CO 0.02 0.19 -0.02 -0.31 0.23 0.00 0.00 176.35 176.45 3dau s TYR 111 N -0.02 3.26 -0.03 0.29 1.51 0.25 -0.92 117.35 121.69 3dau s TYR 111 Ca -0.05 -1.97 0.06 0.00 -1.01 0.00 0.00 57.07 54.10 3dau s TYR 111 Cb -0.13 -2.07 -0.02 0.00 -0.11 0.00 0.00 41.96 39.63 3dau s TYR 111 CO 0.03 -0.82 -0.19 -0.51 -1.11 0.00 0.00 175.55 172.95 3dau s LEU 112 N 1.22 2.46 -0.29 -1.29 1.43 0.38 -1.08 118.68 121.52 3dau s LEU 112 Ca -0.06 -0.32 -0.06 0.00 -1.03 0.00 0.00 54.13 52.67 3dau s LEU 112 Cb -0.20 -1.47 0.02 0.00 0.03 0.00 0.00 46.19 44.57 3dau s LEU 112 CO -0.02 0.33 0.05 -0.89 0.23 0.00 0.00 176.35 176.05 3dau s THR 113 N -0.70 3.70 -0.45 5.49 2.01 -0.31 -0.15 115.64 125.23 3dau s THR 113 Ca 0.11 -0.82 -0.21 0.00 0.31 0.00 0.00 61.69 61.09 3dau s THR 113 Cb -0.10 -2.92 0.03 0.00 0.01 0.00 0.00 72.50 69.51 3dau s THR 113 CO 0.00 0.08 0.66 -1.00 -0.69 0.00 0.00 174.62 173.67 3dau s HIS 114 N 1.45 3.05 -0.20 4.92 0.09 0.13 -0.44 115.29 124.28 3dau s HIS 114 Ca 0.01 -0.10 -0.13 0.00 -0.00 0.00 0.00 55.06 54.84 3dau s HIS 114 Cb -0.17 -3.40 -0.04 0.00 -0.00 0.00 0.00 32.58 28.96 3dau s HIS 114 CO 0.01 -0.91 0.28 0.42 -0.00 0.00 0.00 174.74 174.54 3dau s ILE 115 N 2.86 5.29 -1.37 0.60 1.01 0.37 -0.79 121.20 129.17 3dau s ILE 115 Ca 0.22 0.47 -0.13 0.00 0.00 0.00 0.00 60.65 61.22 3dau s ILE 115 Cb -0.14 -3.62 0.09 0.00 0.01 0.00 0.00 42.46 38.80 3dau s ILE 115 CO 0.18 0.32 2.01 0.47 0.00 0.00 0.00 174.94 177.93 3dau n ASP 116 N 4.14 4.48 -3.92 3.58 8.00 -0.14 -3.43 116.55 129.26 3dau n ASP 116 Ca -0.12 -2.95 -0.21 0.00 0.71 0.00 0.00 54.79 52.22 3dau n ASP 116 Cb 0.52 -1.60 -0.16 0.00 -0.02 0.00 0.00 41.12 39.85 3dau n ASP 116 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dau s ALA 117 N 2.24 0.83 -0.80 2.24 0.00 -1.26 -4.54 121.76 120.48 3dau s ALA 117 Ca 0.45 -0.16 -0.15 0.00 0.00 0.00 0.00 51.96 52.10 3dau s ALA 117 Cb 0.10 -0.48 0.19 0.00 0.00 0.00 0.00 23.12 22.93 3dau s ALA 117 CO -0.03 -0.01 0.79 -1.21 0.00 0.00 0.00 175.76 175.29 3dau s GLU 118 N 0.91 3.50 0.04 0.00 0.41 -1.26 -1.54 118.70 120.77 3dau s GLU 118 Ca -0.11 -2.20 0.03 0.00 -0.41 0.00 0.00 54.97 52.28 3dau s GLU 118 Cb -0.15 -4.48 -0.02 0.00 -1.78 0.00 0.00 34.13 27.70 3dau s GLU 118 CO 0.01 -1.38 -0.10 0.14 -0.49 0.00 0.00 175.26 173.43 3dau s VAL 119 N 0.86 0.76 0.27 2.63 -7.23 -1.26 -5.07 120.40 111.36 3dau s VAL 119 Ca 0.18 -1.05 -0.29 0.00 -1.81 0.00 0.00 61.98 59.01 3dau s VAL 119 Cb -0.12 -0.76 -0.09 0.00 0.56 0.00 0.00 36.38 35.96 3dau s VAL 119 CO -0.07 -0.24 1.00 -0.70 -0.31 0.00 0.00 175.10 174.78 3dau s GLU 120 N -1.42 4.73 0.16 4.82 2.12 -1.26 -4.89 118.70 122.96 3dau s GLU 120 Ca -0.05 1.57 0.10 0.00 0.36 0.00 0.00 54.97 56.96 3dau s GLU 120 Cb -0.09 -3.16 -0.04 0.00 0.26 0.00 0.00 34.13 31.09 3dau s GLU 120 CO 0.01 0.36 -0.23 0.20 -0.54 0.00 0.00 175.26 175.06 3dau s GLY 121 N -1.15 1.56 0.00 -1.50 0.00 -1.26 -4.73 107.32 100.24 3dau s GLY 121 Ca 0.44 -1.53 0.20 0.00 0.00 0.00 0.00 44.72 43.83 3dau s GLY 121 CO 0.34 -1.55 1.12 2.09 0.00 0.00 0.00 173.10 175.10 3dau n ASP 122 N 0.50 2.63 -3.79 1.64 5.68 0.22 -4.95 116.55 118.48 3dau n ASP 122 Ca -0.15 -1.82 -0.14 0.00 -0.50 0.00 0.00 54.79 52.18 3dau n ASP 122 Cb 0.55 -0.00 -0.16 0.00 -1.14 0.00 0.00 41.12 40.38 3dau n ASP 122 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3dau s THR 123 N -1.63 -0.04 0.03 2.12 2.01 -0.97 -5.00 115.64 112.16 3dau s THR 123 Ca 0.23 0.17 0.04 0.00 0.31 0.00 0.00 61.69 62.44 3dau s THR 123 Cb 0.16 -0.07 -0.02 0.00 0.01 0.00 0.00 72.50 72.59 3dau s THR 123 CO 0.24 0.07 -0.12 -1.00 -0.69 0.00 0.00 174.62 173.13 3dau s HIS 124 N 0.84 1.04 0.44 4.92 3.76 -1.26 -1.33 115.29 123.69 3dau s HIS 124 Ca -0.07 -0.34 -0.24 0.00 -0.15 0.00 0.00 55.06 54.26 3dau s HIS 124 Cb -0.10 -0.62 -0.08 0.00 1.11 0.00 0.00 32.58 32.89 3dau s HIS 124 CO -0.02 0.01 1.22 0.12 -0.85 0.00 0.00 174.74 175.22 3dau s PHE 125 N -0.84 2.85 0.58 1.40 5.36 0.61 -4.87 117.98 123.07 3dau s PHE 125 Ca -0.00 1.49 -0.20 0.00 -0.96 0.00 0.00 56.93 57.26 3dau s PHE 125 Cb -0.07 -3.50 -0.03 0.00 -0.34 0.00 0.00 43.02 39.07 3dau s PHE 125 CO 0.01 -1.76 1.32 -2.14 -1.46 0.00 0.00 175.22 171.19 3dau s PRO 126 N -2.50 2.93 0.59 10.12 0.02 -1.26 -4.95 135.00 139.96 3dau s PRO 126 Ca 0.61 2.14 -0.17 0.00 0.02 0.00 0.00 61.00 63.60 3dau s PRO 126 Cb -0.33 -2.09 -0.03 0.00 0.02 0.00 0.00 34.50 32.07 3dau s PRO 126 CO 0.41 -1.32 1.10 0.34 -0.33 0.00 0.00 177.00 177.19 3dau s ASP 127 N -1.16 5.56 0.12 2.53 3.68 -1.26 -5.06 116.67 121.08 3dau s ASP 127 Ca 0.76 2.01 -0.15 0.00 2.13 0.00 0.00 52.55 57.29 3dau s ASP 127 Cb -0.38 -2.56 0.03 0.00 -1.45 0.00 0.00 42.92 38.56 3dau s ASP 127 CO 0.44 -1.32 0.38 -0.72 0.13 0.00 0.00 175.17 174.07 3dau s TYR 128 N -2.15 -0.18 -0.26 -5.34 1.13 -1.26 -5.13 117.35 104.16 3dau s TYR 128 Ca 0.68 -0.14 -0.29 0.00 -1.41 0.00 0.00 57.07 55.91 3dau s TYR 128 Cb -0.20 0.23 -0.01 0.00 -1.10 0.00 0.00 41.96 40.88 3dau s TYR 128 CO 0.34 -0.68 1.45 -2.00 -2.51 0.00 0.00 175.55 172.15 3dau s GLU 129 N -3.75 3.85 0.51 -3.49 2.56 -1.26 -4.92 118.70 112.20 3dau s GLU 129 Ca 0.03 1.44 0.16 0.00 0.00 0.00 0.00 54.97 56.60 3dau s GLU 129 Cb 0.02 -3.96 1.24 0.00 2.00 0.00 0.00 34.13 33.44 3dau s GLU 129 CO -0.12 -1.21 2.13 -1.35 -0.56 0.00 0.00 175.26 174.15 3dau h PRO 130 N 10.00 0.00 0.00 4.30 0.11 -2.00 -1.43 132.00 142.98 3dau h PRO 130 Ca -0.30 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.81 3dau h PRO 130 Cb 1.12 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3dau h PRO 130 CO 1.02 0.03 -0.00 -0.44 -0.21 0.00 0.00 178.00 178.40 3dau h ASP 131 N 0.00 0.00 0.79 -2.05 3.32 -2.04 -2.23 116.42 114.21 3dau h ASP 131 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3dau h ASP 131 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3dau h ASP 131 CO 0.00 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 178.00 3dau n ASP 132 N -3.15 0.00 -4.15 6.45 8.00 -0.54 -4.84 116.55 118.32 3dau n ASP 132 Ca -0.02 0.44 -0.24 0.00 0.71 0.00 0.00 54.79 55.67 3dau n ASP 132 Cb 0.12 -0.48 -0.15 0.00 -0.02 0.00 0.00 41.12 40.59 3dau n ASP 132 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 3dau s TRP 133 N -2.95 1.52 -0.19 1.24 0.52 -0.84 -0.49 118.94 117.75 3dau s TRP 133 Ca 0.13 -0.30 -0.04 0.00 0.02 0.00 0.00 56.10 55.91 3dau s TRP 133 Cb 0.16 -0.98 -0.02 0.00 -1.15 0.00 0.00 33.47 31.48 3dau s TRP 133 CO 0.43 -0.03 -0.02 -2.00 0.02 0.00 0.00 176.95 175.35 3dau s GLU 134 N -0.36 3.60 -0.11 4.98 2.12 0.27 -4.87 118.70 124.32 3dau s GLU 134 Ca 0.06 -0.54 -0.30 0.00 0.36 0.00 0.00 54.97 54.55 3dau s GLU 134 Cb -0.07 -3.01 -0.02 0.00 0.26 0.00 0.00 34.13 31.29 3dau s GLU 134 CO -0.00 0.05 1.15 0.45 -0.54 0.00 0.00 175.26 176.37 3dau s SER 135 N 0.87 7.08 0.00 -1.70 0.15 -1.26 -0.93 113.70 117.90 3dau s SER 135 Ca 0.00 1.67 0.08 0.00 0.70 0.00 0.00 55.95 58.41 3dau s SER 135 Cb -0.14 -2.55 -0.05 0.00 -1.71 0.00 0.00 66.02 61.56 3dau s SER 135 CO 0.02 -0.60 0.43 1.33 1.20 0.00 0.00 173.24 175.61 3dau n VAL 136 N 4.84 0.00 -3.64 4.45 0.24 0.28 -4.98 118.33 119.51 3dau n VAL 136 Ca 0.11 -0.35 -0.13 0.00 -2.04 0.00 0.00 64.34 61.93 3dau n VAL 136 Cb 0.46 1.04 -0.07 0.00 -1.47 0.00 0.00 33.84 33.80 3dau n VAL 136 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 3dau s PHE 137 N -1.54 -0.77 0.02 6.34 2.19 -1.11 -4.95 117.98 118.16 3dau s PHE 137 Ca 0.04 1.84 0.01 0.00 0.33 0.00 0.00 56.93 59.15 3dau s PHE 137 Cb 0.06 0.29 -0.02 0.00 -1.31 0.00 0.00 43.02 42.05 3dau s PHE 137 CO 0.28 -0.37 -0.05 -1.12 1.83 0.00 0.00 175.22 175.79 3dau s SER 138 N 0.50 0.46 -0.25 6.13 0.01 -1.26 -1.28 113.70 118.02 3dau s SER 138 Ca -0.01 -0.41 -0.02 0.00 1.31 0.00 0.00 55.95 56.82 3dau s SER 138 Cb -0.05 0.05 0.13 0.00 0.21 0.00 0.00 66.02 66.36 3dau s SER 138 CO -0.01 -0.19 0.35 -0.70 0.41 0.00 0.00 173.24 173.10 3dau s GLU 139 N -1.19 0.34 0.21 12.44 2.12 0.01 -4.96 118.70 127.67 3dau s GLU 139 Ca -0.10 0.32 -0.20 0.00 0.36 0.00 0.00 54.97 55.34 3dau s GLU 139 Cb -0.08 -0.56 -0.08 0.00 0.26 0.00 0.00 34.13 33.67 3dau s GLU 139 CO -0.00 -0.77 0.73 0.12 -0.54 0.00 0.00 175.26 174.79 3dau s PHE 140 N 2.49 3.70 -0.02 5.30 2.19 -1.26 -1.15 117.98 129.23 3dau s PHE 140 Ca 0.11 1.42 0.01 0.00 0.33 0.00 0.00 56.93 58.80 3dau s PHE 140 Cb -0.15 -2.64 0.02 0.00 -1.31 0.00 0.00 43.02 38.94 3dau s PHE 140 CO -0.21 0.37 -0.01 -1.01 1.83 0.00 0.00 175.22 176.20 3dau s HIS 141 N -1.45 0.27 0.67 10.12 3.76 0.39 -5.00 115.29 124.07 3dau s HIS 141 Ca 0.41 -0.01 -0.12 0.00 -0.15 0.00 0.00 55.06 55.19 3dau s HIS 141 Cb -0.18 -0.31 -0.00 0.00 1.11 0.00 0.00 32.58 33.20 3dau s HIS 141 CO 0.22 -0.08 1.06 -0.51 -0.85 0.00 0.00 174.74 174.58 3dau s ASP 142 N 0.63 5.41 0.75 1.40 1.01 -1.26 -1.08 116.67 123.53 3dau s ASP 142 Ca -0.06 1.70 -0.15 0.00 0.71 0.00 0.00 52.55 54.75 3dau s ASP 142 Cb -0.09 -2.51 0.00 0.00 1.01 0.00 0.00 42.92 41.33 3dau s ASP 142 CO -0.01 -1.42 0.83 0.00 0.21 0.00 0.00 175.17 174.78 3dau n ALA 143 N -2.83 -0.74 -3.38 5.23 0.00 -1.25 -4.71 120.51 112.83 3dau n ALA 143 Ca 0.08 -0.25 -0.05 0.00 0.00 0.00 0.00 53.44 53.22 3dau n ALA 143 Cb 0.53 -2.03 -0.01 0.00 0.00 0.00 0.00 19.45 17.94 3dau n ALA 143 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3dau n ASP 144 N -1.43 -0.48 0.32 0.00 5.68 -0.07 -4.95 116.55 115.62 3dau n ASP 144 Ca 0.12 -1.70 0.20 0.00 -0.50 0.00 0.00 54.79 52.91 3dau n ASP 144 Cb 0.50 0.90 1.05 0.00 -1.14 0.00 0.00 41.12 42.43 3dau n ASP 144 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3dau h ALA 145 N 1.63 1.15 -0.01 2.12 0.00 -2.00 -2.09 119.26 120.07 3dau h ALA 145 Ca -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3dau h ALA 145 Cb 0.43 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3dau h ALA 145 CO 0.13 0.02 -0.55 1.04 0.00 0.00 0.00 179.25 179.89 3dau n GLN 146 N -3.32 1.35 -3.45 0.00 3.00 -1.26 -4.85 117.38 108.86 3dau n GLN 146 Ca -0.03 -0.58 -0.22 0.00 -0.01 0.00 0.00 57.00 56.16 3dau n GLN 146 Cb 0.11 -1.36 -0.12 0.00 0.00 0.00 0.00 30.24 28.88 3dau n GLN 146 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 3dau s ASN 147 N -2.34 2.39 0.00 1.08 0.01 -0.78 -4.27 114.94 111.03 3dau s ASN 147 Ca 0.12 -1.11 0.15 0.00 -0.71 0.00 0.00 52.86 51.32 3dau s ASN 147 Cb 0.15 0.14 0.70 0.00 0.41 0.00 0.00 41.25 42.65 3dau s ASN 147 CO 0.57 -0.39 1.48 -1.54 -1.51 0.00 0.00 177.10 175.70 3dau n SER 148 N 5.12 0.00 -4.32 -1.22 3.41 -1.26 -0.89 113.62 114.46 3dau n SER 148 Ca -0.01 0.35 -0.23 0.00 -0.26 0.00 0.00 58.87 58.71 3dau n SER 148 Cb 0.44 -0.43 -0.12 0.00 -0.26 0.00 0.00 64.21 63.84 3dau n SER 148 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3dau s HIS 149 N -2.85 1.85 0.72 7.33 3.76 -1.26 -4.87 115.29 119.96 3dau s HIS 149 Ca 0.10 -0.44 -0.12 0.00 -0.15 0.00 0.00 55.06 54.45 3dau s HIS 149 Cb 0.10 -0.97 0.03 0.00 1.11 0.00 0.00 32.58 32.85 3dau s HIS 149 CO 0.27 0.28 1.09 -1.54 -0.85 0.00 0.00 174.74 173.98 3dau s SER 150 N -2.27 4.90 0.08 1.40 1.04 -1.26 -3.79 113.70 113.79 3dau s SER 150 Ca 0.11 1.84 -0.20 0.00 0.48 0.00 0.00 55.95 58.18 3dau s SER 150 Cb -0.08 -2.53 0.05 0.00 0.10 0.00 0.00 66.02 63.56 3dau s SER 150 CO 0.06 -1.77 0.49 -0.72 0.98 0.00 0.00 173.24 172.27 3dau s TYR 151 N -2.73 -0.36 -0.05 5.02 1.13 -0.24 -0.97 117.35 119.15 3dau s TYR 151 Ca 0.62 0.27 -0.01 0.00 -1.41 0.00 0.00 57.07 56.54 3dau s TYR 151 Cb -0.18 0.33 0.03 0.00 -1.10 0.00 0.00 41.96 41.05 3dau s TYR 151 CO 0.50 -0.68 0.02 0.00 -2.51 0.00 0.00 175.55 172.88 3dau s PHE 153 N 1.86 3.30 -0.06 0.00 0.08 -0.30 -0.69 117.98 122.17 3dau s PHE 153 Ca 0.02 1.65 -0.07 0.00 0.12 0.00 0.00 56.93 58.65 3dau s PHE 153 Cb -0.12 -3.12 0.02 0.00 -0.57 0.00 0.00 43.02 39.22 3dau s PHE 153 CO -0.04 -0.58 0.19 -2.00 -0.10 0.00 0.00 175.22 172.69 3dau s GLU 154 N -2.42 0.30 -0.05 0.44 2.12 0.79 -0.81 118.70 119.06 3dau s GLU 154 Ca 0.57 0.13 0.05 0.00 0.36 0.00 0.00 54.97 56.08 3dau s GLU 154 Cb -0.22 0.14 -0.01 0.00 0.26 0.00 0.00 34.13 34.30 3dau s GLU 154 CO 0.28 -0.05 -0.22 0.42 -0.54 0.00 0.00 175.26 175.15 3dau s ILE 155 N -0.23 1.85 0.08 -3.70 1.01 -0.40 -0.47 121.20 119.33 3dau s ILE 155 Ca -0.03 -0.95 0.07 0.00 0.00 0.00 0.00 60.65 59.73 3dau s ILE 155 Cb -0.03 -1.57 -0.03 0.00 0.01 0.00 0.00 42.46 40.84 3dau s ILE 155 CO 0.01 0.52 -0.18 -0.76 0.00 0.00 0.00 174.94 174.53 3dau s LEU 156 N -0.08 2.26 0.01 2.97 1.02 -0.10 -0.56 118.68 124.21 3dau s LEU 156 Ca -0.04 -0.61 0.08 0.00 0.02 0.00 0.00 54.13 53.58 3dau s LEU 156 Cb -0.13 -0.74 -0.02 0.00 0.02 0.00 0.00 46.19 45.32 3dau s LEU 156 CO 0.03 0.02 -0.25 -1.61 0.02 0.00 0.00 176.35 174.57 3dau s GLU 157 N -1.67 1.87 0.06 1.70 2.02 -0.11 -1.00 118.70 121.59 3dau s GLU 157 Ca 0.03 -0.98 -0.31 0.00 0.02 0.00 0.00 54.97 53.74 3dau s GLU 157 Cb -0.10 -1.92 -0.07 0.00 0.10 0.00 0.00 34.13 32.15 3dau s GLU 157 CO 0.03 0.51 1.42 0.50 0.02 0.00 0.00 175.26 177.74 3dau s ARG 158 N -0.89 4.29 0.00 1.61 3.52 -0.14 -0.57 118.95 126.78 3dau s ARG 158 Ca 0.10 2.06 0.12 0.00 -0.13 0.00 0.00 55.73 57.88 3dau s ARG 158 Cb -0.10 -3.42 0.70 0.00 -1.56 0.00 0.00 34.95 30.58 3dau s ARG 158 CO 0.00 -0.52 1.13 0.54 -0.81 0.00 0.00 175.30 175.64