#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d5d s ARG 4 N 0.00 1.81 -0.30 -0.72 0.52 -1.26 -1.39 118.95 117.61 3d5d s ARG 4 Ca 0.00 -2.00 -0.16 0.00 -0.52 0.00 0.00 55.73 53.05 3d5d s ARG 4 Cb 0.00 -1.34 0.18 0.00 0.52 0.00 0.00 34.95 34.31 3d5d s ARG 4 CO 0.00 -0.08 1.10 -1.17 0.02 0.00 0.00 175.30 175.18 3d5d s LEU 5 N -3.60 -0.38 -0.82 2.53 0.20 -1.13 -4.92 118.68 110.56 3d5d s LEU 5 Ca 0.35 0.42 -0.25 0.00 0.69 0.00 0.00 54.13 55.34 3d5d s LEU 5 Cb 0.08 1.39 -0.04 0.00 -0.43 0.00 0.00 46.19 47.20 3d5d s LEU 5 CO 0.17 -0.07 1.91 -0.75 -0.29 0.00 0.00 176.35 177.31 3d5d s LYS 6 N 2.48 2.60 0.08 1.98 2.47 -1.26 -2.00 119.74 126.08 3d5d s LYS 6 Ca -0.01 -0.05 -0.22 0.00 -1.56 0.00 0.00 55.97 54.13 3d5d s LYS 6 Cb -0.06 -4.87 -0.07 0.00 -1.46 0.00 0.00 37.83 31.38 3d5d s LYS 6 CO -0.15 -3.16 0.66 0.00 0.16 0.00 0.00 175.35 172.86 3d5d s ALA 7 N 9.68 3.49 0.24 3.13 0.00 -1.08 -4.71 121.76 132.50 3d5d s ALA 7 Ca 0.69 0.16 0.09 0.00 0.00 0.00 0.00 51.96 52.90 3d5d s ALA 7 Cb -0.08 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 3d5d s ALA 7 CO 0.05 0.27 -0.01 0.71 0.00 0.00 0.00 175.76 176.78 3d5d s TYR 8 N -0.74 2.73 0.09 0.00 1.51 -0.94 -3.75 117.35 116.25 3d5d s TYR 8 Ca 0.33 -0.20 -0.23 0.00 -1.01 0.00 0.00 57.07 55.96 3d5d s TYR 8 Cb -0.20 -1.25 -0.07 0.00 -0.11 0.00 0.00 41.96 40.33 3d5d s TYR 8 CO 0.21 0.58 0.69 0.71 -1.11 0.00 0.00 175.55 176.64 3d5d s TYR 9 N -2.12 3.81 0.56 2.71 1.51 -1.26 -2.38 117.35 120.18 3d5d s TYR 9 Ca 0.30 1.44 0.09 0.00 -1.01 0.00 0.00 57.07 57.89 3d5d s TYR 9 Cb -0.07 -2.69 0.08 0.00 -0.11 0.00 0.00 41.96 39.16 3d5d s TYR 9 CO 0.19 0.45 0.74 0.50 -1.11 0.00 0.00 175.55 176.33 3d5d s ARG 10 N -0.73 2.36 0.00 -0.62 3.52 -0.21 -4.90 118.95 118.36 3d5d s ARG 10 Ca 0.34 -1.63 0.00 0.00 -0.13 0.00 0.00 55.73 54.31 3d5d s ARG 10 Cb -0.21 -2.62 0.00 0.00 -1.56 0.00 0.00 34.95 30.56 3d5d s ARG 10 CO 0.22 -0.78 0.00 -1.91 -0.81 0.00 0.00 175.30 172.02 3d5d n GLU 11 N -2.17 0.00 -1.54 5.12 4.07 -1.26 -4.77 120.64 120.09 3d5d n GLU 11 Ca 0.14 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 57.13 3d5d n GLU 11 Cb 0.62 0.00 0.09 0.00 -0.06 0.00 0.00 31.44 32.08 3d5d n GLU 11 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3d5d n GLY 12 N -0.78 5.53 3.85 8.31 0.00 -1.26 -5.05 105.19 115.79 3d5d n GLY 12 Ca 0.00 -2.04 -0.34 0.00 0.00 0.00 0.00 46.02 43.64 3d5d n GLY 12 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d5d s GLU 13 N -3.36 3.95 -0.36 1.61 8.01 -1.26 -5.02 118.70 122.26 3d5d s GLU 13 Ca 0.45 0.48 -0.29 0.00 0.01 0.00 0.00 54.97 55.61 3d5d s GLU 13 Cb 0.39 -2.77 0.00 0.00 -4.31 0.00 0.00 34.13 27.44 3d5d s GLU 13 CO -0.01 0.37 1.46 0.15 0.01 0.00 0.00 175.26 177.25 3d5d s LYS 14 N -2.38 3.63 0.47 1.61 1.02 -1.26 -4.89 119.74 117.94 3d5d s LYS 14 Ca 0.44 1.13 0.20 0.00 0.02 0.00 0.00 55.97 57.76 3d5d s LYS 14 Cb -0.13 -4.02 1.20 0.00 -0.52 0.00 0.00 37.83 34.35 3d5d s LYS 14 CO 0.20 -1.49 1.94 -1.35 -0.92 0.00 0.00 175.35 173.72 3d5d h PRO 15 N 10.73 0.24 0.01 -1.68 0.11 -1.98 0.36 132.00 139.77 3d5d h PRO 15 Ca -0.29 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.81 3d5d h PRO 15 Cb 1.12 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3d5d h PRO 15 CO 1.06 0.16 -0.00 0.66 -0.21 0.00 0.00 178.00 179.67 3d5d h SER 16 N 0.25 -0.01 0.59 -2.05 4.64 -2.01 -3.27 113.55 111.68 3d5d h SER 16 Ca 0.34 -0.80 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3d5d h SER 16 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 3d5d h SER 16 CO -0.07 0.87 0.00 0.00 -0.87 0.00 0.00 176.83 176.76 3d5d h ALA 17 N -0.12 1.00 -0.34 5.18 0.00 -1.88 -2.93 119.26 120.18 3d5d h ALA 17 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3d5d h ALA 17 Cb 0.81 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 3d5d h ALA 17 CO 0.00 0.00 -0.10 1.25 0.00 0.00 0.00 179.25 180.40 3d5d h LEU 18 N 0.00 0.67 -1.00 0.00 5.85 -0.36 -2.90 115.31 117.57 3d5d h LEU 18 Ca 0.00 -0.37 -0.01 0.00 0.84 0.00 0.00 57.88 58.34 3d5d h LEU 18 Cb 0.29 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 3d5d h LEU 18 CO 0.00 0.89 0.52 0.03 -0.34 0.00 0.00 178.44 179.54 3d5d h ARG 19 N 0.44 1.21 -0.99 1.25 3.08 -1.57 -2.02 114.38 115.79 3d5d h ARG 19 Ca 0.08 -0.12 0.12 0.00 0.07 0.00 0.00 59.98 60.14 3d5d h ARG 19 Cb 0.60 -0.25 -0.08 0.00 0.08 0.00 0.00 29.97 30.32 3d5d h ARG 19 CO 0.04 0.86 0.63 0.00 -1.07 0.00 0.00 179.97 180.42 3d5d h ARG 20 N 1.23 0.94 0.70 0.04 3.08 -1.55 -2.46 114.38 116.35 3d5d h ARG 20 Ca 0.32 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.28 3d5d h ARG 20 Cb -0.03 -0.21 0.01 0.00 0.08 0.00 0.00 29.97 29.82 3d5d h ARG 20 CO -0.06 0.62 -0.34 0.00 -1.07 0.00 0.00 179.97 179.13 3d5d h ALA 21 N 1.55 -0.94 0.00 0.04 0.00 -1.20 -3.47 119.26 115.24 3d5d h ALA 21 Ca 0.49 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3d5d h ALA 21 Cb 0.51 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3d5d h ALA 21 CO -0.26 -0.97 0.00 0.41 0.00 0.00 0.00 179.25 178.43 3d5d n GLY 22 N -1.20 -0.35 3.64 0.00 0.00 -0.93 -5.12 105.19 101.25 3d5d n GLY 22 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 3d5d n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d5d s LYS 23 N 0.00 2.69 -0.40 1.61 -0.14 -1.17 -1.29 119.74 121.04 3d5d s LYS 23 Ca 0.00 -0.65 -0.16 0.00 -1.36 0.00 0.00 55.97 53.79 3d5d s LYS 23 Cb 0.00 -2.60 0.01 0.00 -1.68 0.00 0.00 37.83 33.56 3d5d s LYS 23 CO 0.00 0.62 0.40 -1.17 -0.76 0.00 0.00 175.35 174.44 3d5d s LEU 24 N -1.46 4.78 0.95 3.17 2.96 0.27 -3.75 118.68 125.60 3d5d s LEU 24 Ca 0.18 -0.58 -0.11 0.00 -0.22 0.00 0.00 54.13 53.40 3d5d s LEU 24 Cb -0.11 -2.35 0.13 0.00 0.50 0.00 0.00 46.19 44.36 3d5d s LEU 24 CO 0.09 -0.50 0.93 -0.81 -1.32 0.00 0.00 176.35 174.73 3d5d n PRO 25 N 5.49 -0.57 0.00 0.98 -0.04 -1.26 -1.24 135.00 138.36 3d5d n PRO 25 Ca -0.08 -0.11 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 3d5d n PRO 25 Cb 0.48 -2.22 0.00 0.00 -0.04 0.00 0.00 33.50 31.72 3d5d n PRO 25 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3d5d n GLY 26 N 0.67 -0.79 3.04 0.55 0.00 -1.16 -2.90 105.19 104.60 3d5d n GLY 26 Ca 0.10 -1.28 -0.13 0.00 0.00 0.00 0.00 46.02 44.71 3d5d n GLY 26 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d5d s VAL 27 N -2.00 -0.01 -0.04 1.61 1.01 -0.10 -1.98 120.40 118.89 3d5d s VAL 27 Ca 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 61.98 62.00 3d5d s VAL 27 Cb 0.00 -0.26 -0.04 0.00 0.00 0.00 0.00 36.38 36.08 3d5d s VAL 27 CO 0.00 0.02 0.07 0.00 0.00 0.00 0.00 175.10 175.19 3d5d s MET 28 N 0.34 3.10 -0.20 2.72 0.23 -1.15 -0.58 119.30 123.75 3d5d s MET 28 Ca -0.02 -0.42 -0.30 0.00 -1.03 0.00 0.00 55.69 53.92 3d5d s MET 28 Cb -0.03 -2.89 0.15 0.00 -1.53 0.00 0.00 34.83 30.53 3d5d s MET 28 CO -0.01 0.68 1.13 1.52 -2.03 0.00 0.00 175.02 176.31 3d5d s TYR 29 N -1.10 -0.24 0.00 3.16 -0.85 -0.19 -2.11 117.35 116.02 3d5d s TYR 29 Ca 0.20 0.40 0.00 0.00 -0.52 0.00 0.00 57.07 57.15 3d5d s TYR 29 Cb -0.12 0.47 0.00 0.00 0.38 0.00 0.00 41.96 42.69 3d5d s TYR 29 CO 0.10 -0.23 0.00 0.27 -1.52 0.00 0.00 175.55 174.17 3d5d n ASN 30 N 0.62 0.87 0.17 -0.18 6.94 -1.21 -2.43 115.26 120.03 3d5d n ASN 30 Ca -0.06 -0.27 0.10 0.00 -0.02 0.00 0.00 54.58 54.32 3d5d n ASN 30 Cb 0.58 0.00 0.52 0.00 -2.36 0.00 0.00 39.78 38.52 3d5d n ASN 30 CO 0.00 0.00 0.00 -2.11 -1.03 0.00 0.00 177.26 174.12 3d5d n ARG 31 N 0.00 0.12 0.00 -3.83 1.85 -1.26 -1.65 116.66 111.89 3d5d n ARG 31 Ca 0.00 0.62 0.00 0.00 -1.00 0.00 0.00 57.85 57.47 3d5d n ARG 31 Cb 0.00 -2.02 0.00 0.00 -1.05 0.00 0.00 32.46 29.39 3d5d n ARG 31 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 3d5d n HIS 32 N -2.20 0.00 -4.39 2.89 8.25 -1.26 -5.10 115.22 113.41 3d5d n HIS 32 Ca -0.01 -0.02 -0.24 0.00 -0.26 0.00 0.00 57.72 57.19 3d5d n HIS 32 Cb 0.13 -0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.15 3d5d n HIS 32 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3d5d s LEU 33 N -0.03 2.84 -0.35 2.41 2.96 -0.66 -5.10 118.68 120.75 3d5d s LEU 33 Ca 0.00 -0.86 -0.05 0.00 -0.22 0.00 0.00 54.13 53.00 3d5d s LEU 33 Cb 0.00 -1.36 0.19 0.00 0.50 0.00 0.00 46.19 45.51 3d5d s LEU 33 CO 0.00 0.03 0.95 0.21 -1.32 0.00 0.00 176.35 176.22 3d5d s ASN 34 N -3.54 -0.62 -0.07 3.68 3.84 -1.26 -3.36 114.94 113.61 3d5d s ASN 34 Ca 0.30 -0.35 0.02 0.00 0.21 0.00 0.00 52.86 53.05 3d5d s ASN 34 Cb -0.06 0.79 0.01 0.00 -0.55 0.00 0.00 41.25 41.45 3d5d s ASN 34 CO 0.17 -0.06 -0.12 -0.13 -2.79 0.00 0.00 177.10 174.16 3d5d s ARG 35 N 1.86 1.74 0.12 0.43 1.81 -0.90 -5.05 118.95 118.96 3d5d s ARG 35 Ca 0.16 -0.42 -0.31 0.00 -1.72 0.00 0.00 55.73 53.44 3d5d s ARG 35 Cb 0.02 -1.46 -0.09 0.00 -0.45 0.00 0.00 34.95 32.97 3d5d s ARG 35 CO -0.13 0.00 1.65 0.15 -0.68 0.00 0.00 175.30 176.30 3d5d s LYS 36 N 0.75 4.19 0.11 3.54 1.02 -1.26 -2.95 119.74 125.15 3d5d s LYS 36 Ca -0.13 2.39 0.02 0.00 0.02 0.00 0.00 55.97 58.26 3d5d s LYS 36 Cb -0.16 -3.42 -0.01 0.00 -0.52 0.00 0.00 37.83 33.73 3d5d s LYS 36 CO 0.03 -0.70 0.12 1.33 -0.92 0.00 0.00 175.35 175.20 3d5d n VAL 37 N 4.43 0.00 -3.61 3.17 0.24 -0.84 -1.04 118.33 120.68 3d5d n VAL 37 Ca 0.15 -0.74 -0.05 0.00 -2.04 0.00 0.00 64.34 61.66 3d5d n VAL 37 Cb 0.39 0.39 -0.04 0.00 -1.47 0.00 0.00 33.84 33.12 3d5d n VAL 37 CO 0.00 0.00 0.00 -0.72 -2.14 0.00 0.00 176.83 173.97 3d5d s TYR 38 N -3.05 -0.16 0.20 6.34 -0.85 -1.00 -3.01 117.35 115.81 3d5d s TYR 38 Ca 0.12 0.23 0.01 0.00 -0.52 0.00 0.00 57.07 56.92 3d5d s TYR 38 Cb 0.00 0.49 -0.00 0.00 0.38 0.00 0.00 41.96 42.83 3d5d s TYR 38 CO 0.09 -0.17 0.04 1.33 -1.52 0.00 0.00 175.55 175.32 3d5d n VAL 39 N 0.42 0.00 -3.56 -3.49 0.24 -0.38 -2.22 118.33 109.35 3d5d n VAL 39 Ca -0.03 -1.07 -0.38 0.00 -2.04 0.00 0.00 64.34 60.82 3d5d n VAL 39 Cb 0.58 0.33 -0.06 0.00 -1.47 0.00 0.00 33.84 33.22 3d5d n VAL 39 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3d5d s ASP 40 N -2.17 6.69 0.08 -1.34 -1.08 -1.26 0.95 116.67 118.55 3d5d s ASP 40 Ca 0.06 0.83 -0.35 0.00 -0.52 0.00 0.00 52.55 52.57 3d5d s ASP 40 Cb 0.00 -2.21 -0.17 0.00 -1.46 0.00 0.00 42.92 39.08 3d5d s ASP 40 CO 0.04 0.30 1.59 -0.07 0.52 0.00 0.00 175.17 177.55 3d5d h LEU 41 N 5.06 -1.13 -0.65 -1.34 3.38 -1.50 -0.87 115.31 118.26 3d5d h LEU 41 Ca -0.51 0.08 0.04 0.00 0.09 0.00 0.00 57.88 57.58 3d5d h LEU 41 Cb 1.21 0.35 -0.04 0.00 0.09 0.00 0.00 40.66 42.27 3d5d h LEU 41 CO 0.63 -0.65 0.39 1.62 0.09 0.00 0.00 178.44 180.52 3d5d h VAL 42 N -1.01 1.05 0.50 1.22 3.04 -1.96 0.13 116.25 119.22 3d5d h VAL 42 Ca -0.07 -0.26 -0.02 0.00 -1.01 0.00 0.00 66.70 65.33 3d5d h VAL 42 Cb 0.84 0.23 0.00 0.00 -2.01 0.00 0.00 31.29 30.35 3d5d h VAL 42 CO 0.04 0.14 -0.24 -0.33 -1.01 0.00 0.00 177.57 176.16 3d5d h GLU 43 N 0.75 -0.65 -0.97 4.17 5.08 -1.94 -2.64 114.58 118.39 3d5d h GLU 43 Ca 0.27 0.04 0.25 0.00 -1.00 0.00 0.00 59.36 58.92 3d5d h GLU 43 Cb 0.07 0.15 -0.07 0.00 0.50 0.00 0.00 28.75 29.40 3d5d h GLU 43 CO -0.13 -0.43 0.65 0.35 -1.00 0.00 0.00 179.01 178.45 3d5d h PHE 44 N -0.73 0.41 0.64 4.33 3.04 -1.10 -0.09 116.94 123.45 3d5d h PHE 44 Ca -0.07 0.01 -0.03 0.00 3.98 0.00 0.00 57.97 61.87 3d5d h PHE 44 Cb 0.51 -0.12 -0.00 0.00 2.56 0.00 0.00 35.95 38.90 3d5d h PHE 44 CO 0.09 0.08 -0.41 0.22 -2.02 0.00 0.00 178.31 176.27 3d5d h ASP 45 N 0.28 -1.04 0.68 0.41 -0.00 -0.57 0.24 116.42 116.42 3d5d h ASP 45 Ca 0.50 0.06 -0.08 0.00 -0.00 0.00 0.00 57.03 57.51 3d5d h ASP 45 Cb 1.48 0.30 -0.01 0.00 -0.00 0.00 0.00 39.33 41.10 3d5d h ASP 45 CO -0.16 -0.62 -0.39 0.11 -0.00 0.00 0.00 179.24 178.19 3d5d h LYS 46 N -0.98 0.00 -0.07 0.28 1.57 -1.03 -2.26 116.57 114.08 3d5d h LYS 46 Ca -0.09 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.52 3d5d h LYS 46 Cb 0.79 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.11 3d5d h LYS 46 CO 0.08 0.39 -0.63 0.28 -0.57 0.00 0.00 179.45 179.00 3d5d h VAL 47 N 0.00 1.36 0.00 0.50 2.07 -0.93 -3.27 116.25 115.98 3d5d h VAL 47 Ca -0.00 -1.96 -0.05 0.00 0.82 0.00 0.00 66.70 65.51 3d5d h VAL 47 Cb 0.83 2.30 -0.01 0.00 -1.52 0.00 0.00 31.29 32.89 3d5d h VAL 47 CO 0.05 0.59 -0.23 0.15 0.02 0.00 0.00 177.57 178.15 3d5d h PHE 48 N 0.14 0.00 0.03 1.57 3.04 -0.44 -1.07 116.94 120.21 3d5d h PHE 48 Ca -0.06 0.00 0.03 0.00 3.98 0.00 0.00 57.97 61.92 3d5d h PHE 48 Cb 1.29 0.00 -0.04 0.00 2.56 0.00 0.00 35.95 39.76 3d5d h PHE 48 CO 0.12 0.23 -0.24 0.00 -2.02 0.00 0.00 178.31 176.40 3d5d h ARG 49 N 0.00 -0.38 0.10 1.11 2.47 -1.46 0.37 114.38 116.60 3d5d h ARG 49 Ca -0.00 0.03 -0.00 0.00 -1.26 0.00 0.00 59.98 58.74 3d5d h ARG 49 Cb 0.93 0.09 0.00 0.00 -1.65 0.00 0.00 29.97 29.34 3d5d h ARG 49 CO 0.03 -0.25 -0.05 1.96 0.56 0.00 0.00 179.97 182.22 3d5d h GLN 50 N -0.39 -0.13 -0.70 0.04 7.50 -1.66 -3.37 115.11 116.40 3d5d h GLN 50 Ca 0.05 0.01 0.15 0.00 0.50 0.00 0.00 58.65 59.36 3d5d h GLN 50 Cb 0.46 0.03 -0.13 0.00 0.05 0.00 0.00 27.48 27.89 3d5d h GLN 50 CO -0.19 -0.09 -0.09 0.00 -1.50 0.00 0.00 178.83 176.96 3d5d h ALA 51 N -1.61 0.59 -0.53 3.87 0.00 -1.27 -3.46 119.26 116.85 3d5d h ALA 51 Ca -0.01 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3d5d h ALA 51 Cb 0.10 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3d5d h ALA 51 CO 0.02 -0.42 0.00 -1.13 0.00 0.00 0.00 179.25 177.72 3d5d n SER 52 N -5.40 0.00 -2.68 0.00 3.41 0.13 -3.58 113.62 105.50 3d5d n SER 52 Ca 0.11 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.45 3d5d n SER 52 Cb 0.40 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.33 3d5d n SER 52 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3d5d n ILE 53 N 0.00 2.55 0.00 -1.33 -6.64 -1.26 -4.63 119.36 108.06 3d5d n ILE 53 Ca 0.00 -5.13 0.00 0.00 -1.77 0.00 0.00 62.75 55.85 3d5d n ILE 53 Cb 0.00 -1.24 0.00 0.00 -1.44 0.00 0.00 39.64 36.96 3d5d n ILE 53 CO 0.00 0.00 0.00 1.41 -1.77 0.00 0.00 176.55 176.19 3d5d n HIS 54 N -0.36 0.00 -3.44 4.28 8.25 -1.23 -4.55 115.22 118.16 3d5d n HIS 54 Ca 0.35 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.62 3d5d n HIS 54 Cb 0.56 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.70 3d5d n HIS 54 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3d5d n HIS 55 N -0.81 -1.55 -4.45 4.41 8.25 -1.25 -4.92 115.22 114.91 3d5d n HIS 55 Ca 0.00 -1.79 -0.34 0.00 -0.26 0.00 0.00 57.72 55.33 3d5d n HIS 55 Cb 0.11 -0.40 -0.12 0.00 1.12 0.00 0.00 29.99 30.70 3d5d n HIS 55 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3d5d s VAL 56 N -2.05 3.84 -0.37 1.59 1.01 -1.26 -4.79 120.40 118.37 3d5d s VAL 56 Ca 0.36 -0.38 -0.02 0.00 0.00 0.00 0.00 61.98 61.93 3d5d s VAL 56 Cb -0.03 -2.66 0.09 0.00 0.00 0.00 0.00 36.38 33.78 3d5d s VAL 56 CO 0.23 0.52 0.14 -0.63 0.00 0.00 0.00 175.10 175.36 3d5d s ILE 57 N 0.13 3.19 0.23 2.22 1.09 0.12 -2.83 121.20 125.35 3d5d s ILE 57 Ca -0.01 -1.85 -0.31 0.00 -1.10 0.00 0.00 60.65 57.38 3d5d s ILE 57 Cb -0.14 -3.09 -0.10 0.00 -1.06 0.00 0.00 42.46 38.07 3d5d s ILE 57 CO 0.03 -0.51 1.53 -0.69 -0.10 0.00 0.00 174.94 175.20 3d5d s VAL 58 N 1.17 2.50 -0.35 2.92 1.01 -0.48 -3.34 120.40 123.83 3d5d s VAL 58 Ca 0.04 0.39 -0.09 0.00 0.00 0.00 0.00 61.98 62.32 3d5d s VAL 58 Cb -0.22 -3.25 0.02 0.00 0.00 0.00 0.00 36.38 32.94 3d5d s VAL 58 CO -0.03 0.05 0.16 -0.76 0.00 0.00 0.00 175.10 174.52 3d5d s LEU 59 N 0.18 4.47 -0.97 3.92 1.43 -0.75 -2.84 118.68 124.12 3d5d s LEU 59 Ca 0.64 -0.95 -0.22 0.00 -1.03 0.00 0.00 54.13 52.58 3d5d s LEU 59 Cb -0.44 -1.97 0.08 0.00 0.03 0.00 0.00 46.19 43.89 3d5d s LEU 59 CO 0.40 -0.33 1.32 -1.61 0.23 0.00 0.00 176.35 176.35 3d5d s GLU 60 N 1.52 3.57 0.69 1.70 0.41 -0.85 -3.30 118.70 122.45 3d5d s GLU 60 Ca 0.01 -1.31 -0.13 0.00 -0.41 0.00 0.00 54.97 53.13 3d5d s GLU 60 Cb -0.19 -5.14 0.02 0.00 -1.78 0.00 0.00 34.13 27.04 3d5d s GLU 60 CO 0.05 -2.04 1.09 -0.51 -0.49 0.00 0.00 175.26 173.36 3d5d s LEU 61 N 4.17 3.26 0.60 1.80 1.43 -1.18 -2.65 118.68 126.10 3d5d s LEU 61 Ca 0.40 1.88 0.29 0.00 -1.03 0.00 0.00 54.13 55.67 3d5d s LEU 61 Cb -0.02 -4.53 1.57 0.00 0.03 0.00 0.00 46.19 43.23 3d5d s LEU 61 CO -0.09 -1.69 1.99 -0.65 0.23 0.00 0.00 176.35 176.14 3d5d h PRO 62 N -0.39 0.00 0.00 1.29 0.11 -1.93 0.29 132.00 131.37 3d5d h PRO 62 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3d5d h PRO 62 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3d5d h PRO 62 CO 0.54 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.08 3d5d n ASP 63 N -3.68 0.00 0.00 -2.05 8.00 -1.26 -4.78 116.55 112.78 3d5d n ASP 63 Ca 0.05 0.22 0.00 0.00 0.71 0.00 0.00 54.79 55.76 3d5d n ASP 63 Cb 0.50 -0.29 0.00 0.00 -0.02 0.00 0.00 41.12 41.30 3d5d n ASP 63 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d5d n GLY 64 N -0.81 0.48 3.64 0.44 0.00 0.10 -4.98 105.19 104.06 3d5d n GLY 64 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 3d5d n GLY 64 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d5d s GLN 65 N -0.41 4.06 -0.72 1.61 -0.21 -1.25 -4.89 119.66 117.85 3d5d s GLN 65 Ca 0.00 1.16 -0.20 0.00 0.02 0.00 0.00 55.36 56.35 3d5d s GLN 65 Cb 0.00 -3.76 0.11 0.00 1.00 0.00 0.00 33.01 30.35 3d5d s GLN 65 CO 0.00 -0.92 0.91 -1.54 -2.12 0.00 0.00 175.29 171.62 3d5d s SER 66 N 1.87 6.33 -0.21 5.90 1.04 -1.26 -3.13 113.70 124.23 3d5d s SER 66 Ca 0.48 -1.51 -0.11 0.00 0.48 0.00 0.00 55.95 55.29 3d5d s SER 66 Cb -0.14 -2.36 -0.05 0.00 0.10 0.00 0.00 66.02 63.57 3d5d s SER 66 CO 0.16 -1.19 0.19 -0.76 0.98 0.00 0.00 173.24 172.63 3d5d s LEU 67 N 3.03 4.16 -1.16 2.42 1.02 -1.21 -4.89 118.68 122.06 3d5d s LEU 67 Ca 0.21 0.24 -0.23 0.00 0.02 0.00 0.00 54.13 54.37 3d5d s LEU 67 Cb -0.16 -2.18 -0.08 0.00 0.02 0.00 0.00 46.19 43.79 3d5d s LEU 67 CO 0.03 0.09 1.93 -2.16 0.02 0.00 0.00 176.35 176.26 3d5d s PRO 68 N 0.80 2.53 0.17 1.29 0.04 -1.26 -1.80 135.00 136.77 3d5d s PRO 68 Ca 0.10 -1.10 0.07 0.00 0.04 0.00 0.00 61.00 60.11 3d5d s PRO 68 Cb -0.13 -5.23 -0.04 0.00 0.04 0.00 0.00 34.50 29.14 3d5d s PRO 68 CO 0.03 -3.88 0.01 0.95 0.04 0.00 0.00 177.00 174.14 3d5d s THR 69 N 10.77 3.78 -0.11 1.26 -4.23 -1.21 -0.65 115.64 125.26 3d5d s THR 69 Ca 0.68 -1.38 -0.06 0.00 -1.18 0.00 0.00 61.69 59.75 3d5d s THR 69 Cb -0.01 -2.90 0.04 0.00 1.34 0.00 0.00 72.50 70.97 3d5d s THR 69 CO 0.12 -0.10 0.26 -1.48 -0.54 0.00 0.00 174.62 172.88 3d5d s LEU 70 N -2.92 0.45 -0.52 4.79 2.34 -0.62 0.16 118.68 122.36 3d5d s LEU 70 Ca 0.28 0.56 -0.28 0.00 0.06 0.00 0.00 54.13 54.74 3d5d s LEU 70 Cb -0.09 0.82 -0.10 0.00 -0.56 0.00 0.00 46.19 46.25 3d5d s LEU 70 CO 0.19 -0.16 2.41 0.52 -1.06 0.00 0.00 176.35 178.25 3d5d n VAL 71 N 4.04 0.02 0.36 1.48 0.31 -1.26 -2.12 118.33 121.17 3d5d n VAL 71 Ca -0.23 -0.55 0.14 0.00 -0.01 0.00 0.00 64.34 63.68 3d5d n VAL 71 Cb 0.54 -2.23 0.54 0.00 -0.91 0.00 0.00 33.84 31.78 3d5d n VAL 71 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3d5d h ARG 72 N 16.82 0.00 -1.36 5.55 1.12 -1.90 -3.45 114.38 131.16 3d5d h ARG 72 Ca -0.23 0.00 0.13 0.00 -1.11 0.00 0.00 59.98 58.76 3d5d h ARG 72 Cb 1.28 0.00 -0.28 0.00 -0.01 0.00 0.00 29.97 30.96 3d5d h ARG 72 CO 1.15 0.00 0.67 -1.14 -3.11 0.00 0.00 179.97 177.54 3d5d s GLN 73 N -3.42 0.32 -0.08 0.20 0.74 -1.26 -5.02 119.66 111.14 3d5d s GLN 73 Ca 0.04 0.29 0.02 0.00 0.05 0.00 0.00 55.36 55.76 3d5d s GLN 73 Cb 0.09 0.16 0.01 0.00 1.10 0.00 0.00 33.01 34.37 3d5d s GLN 73 CO 0.48 -0.06 -0.14 0.08 -0.55 0.00 0.00 175.29 175.10 3d5d s VAL 74 N -0.19 1.33 -0.50 1.34 1.01 -1.26 -1.07 120.40 121.06 3d5d s VAL 74 Ca 0.04 -0.58 -0.21 0.00 0.00 0.00 0.00 61.98 61.24 3d5d s VAL 74 Cb -0.04 -1.20 0.05 0.00 0.00 0.00 0.00 36.38 35.18 3d5d s VAL 74 CO -0.08 0.40 0.69 0.20 0.00 0.00 0.00 175.10 176.31 3d5d s ASN 75 N 0.72 6.27 -0.20 3.32 0.01 -0.70 -4.99 114.94 119.37 3d5d s ASN 75 Ca -0.13 -0.66 -0.23 0.00 -0.71 0.00 0.00 52.86 51.12 3d5d s ASN 75 Cb -0.16 -2.33 -0.02 0.00 0.41 0.00 0.00 41.25 39.16 3d5d s ASN 75 CO 0.03 -0.93 0.75 -0.76 -1.51 0.00 0.00 177.10 174.68 3d5d s LEU 76 N 2.95 4.13 -0.03 0.60 1.02 -1.26 -0.33 118.68 125.76 3d5d s LEU 76 Ca 0.20 0.99 -0.30 0.00 0.02 0.00 0.00 54.13 55.05 3d5d s LEU 76 Cb -0.17 -3.09 -0.06 0.00 0.02 0.00 0.00 46.19 42.90 3d5d s LEU 76 CO 0.15 -0.39 1.65 -0.62 0.02 0.00 0.00 176.35 177.16 3d5d s ASP 77 N 1.25 6.66 0.89 2.29 2.15 0.33 -4.85 116.67 125.39 3d5d s ASP 77 Ca 0.33 2.29 0.00 0.00 0.43 0.00 0.00 52.55 55.60 3d5d s ASP 77 Cb -0.16 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 3d5d s ASP 77 CO 0.10 -0.91 0.00 0.29 -0.17 0.00 0.00 175.17 174.48 3d5d n LYS 78 N 6.78 -1.26 -3.08 4.34 4.76 -1.26 -2.72 118.16 125.72 3d5d n LYS 78 Ca 0.17 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.48 3d5d n LYS 78 Cb 0.42 0.00 0.01 0.00 -1.84 0.00 0.00 35.03 33.63 3d5d n LYS 78 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 3d5d n ARG 79 N -1.58 -2.02 -2.37 1.97 0.63 -1.26 -4.53 116.66 107.50 3d5d n ARG 79 Ca 0.00 1.78 -0.04 0.00 -0.92 0.00 0.00 57.85 58.67 3d5d n ARG 79 Cb 0.00 -4.83 -0.03 0.00 0.45 0.00 0.00 32.46 28.05 3d5d n ARG 79 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 3d5d n ARG 80 N -0.76 -3.43 -1.45 -0.14 0.63 -1.26 -4.88 116.66 105.37 3d5d n ARG 80 Ca 0.03 2.71 -0.51 0.00 -0.92 0.00 0.00 57.85 59.16 3d5d n ARG 80 Cb 0.52 -4.24 -0.04 0.00 0.45 0.00 0.00 32.46 29.15 3d5d n ARG 80 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 3d5d n ARG 81 N 1.16 0.15 -3.65 -0.14 1.85 -1.26 -4.93 116.66 109.86 3d5d n ARG 81 Ca -0.27 0.05 -0.00 0.00 -1.00 0.00 0.00 57.85 56.64 3d5d n ARG 81 Cb 0.41 -1.25 -0.06 0.00 -1.05 0.00 0.00 32.46 30.51 3d5d n ARG 81 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 3d5d s ARG 82 N -0.70 0.11 0.09 2.89 3.52 -1.10 -4.98 118.95 118.77 3d5d s ARG 82 Ca 0.72 0.16 -0.31 0.00 -0.13 0.00 0.00 55.73 56.17 3d5d s ARG 82 Cb -1.01 0.03 -0.09 0.00 -1.56 0.00 0.00 34.95 32.32 3d5d s ARG 82 CO 0.56 -0.02 1.77 -1.25 -0.81 0.00 0.00 175.30 175.55 3d5d s PRO 83 N 0.71 4.16 -0.20 5.12 0.04 -1.26 0.12 135.00 143.70 3d5d s PRO 83 Ca -0.03 2.48 -0.16 0.00 0.04 0.00 0.00 61.00 63.34 3d5d s PRO 83 Cb -0.03 -3.66 -0.08 0.00 0.04 0.00 0.00 34.50 30.77 3d5d s PRO 83 CO -0.12 -0.81 -0.26 0.39 0.04 0.00 0.00 177.00 176.23 3d5d n GLU 84 N 5.85 0.53 -4.39 4.56 1.02 0.55 -4.78 120.64 123.99 3d5d n GLU 84 Ca 0.17 0.32 -0.23 0.00 -0.02 0.00 0.00 57.16 57.41 3d5d n GLU 84 Cb 0.39 -1.53 -0.11 0.00 -0.02 0.00 0.00 31.44 30.18 3d5d n GLU 84 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3d5d s HIS 85 N -2.63 2.01 -0.01 -0.32 5.04 -1.09 -4.16 115.29 114.13 3d5d s HIS 85 Ca -0.28 -0.43 0.00 0.00 -1.54 0.00 0.00 55.06 52.81 3d5d s HIS 85 Cb 0.06 -0.96 0.01 0.00 0.04 0.00 0.00 32.58 31.74 3d5d s HIS 85 CO 0.41 0.46 0.01 0.08 -2.34 0.00 0.00 174.74 173.36 3d5d s VAL 86 N -2.23 0.01 0.25 0.89 1.01 -1.14 -1.72 120.40 117.47 3d5d s VAL 86 Ca 0.21 0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.28 3d5d s VAL 86 Cb -0.05 -0.07 -0.04 0.00 0.00 0.00 0.00 36.38 36.22 3d5d s VAL 86 CO 0.09 0.05 0.43 -1.81 0.00 0.00 0.00 175.10 173.86 3d5d s ASP 87 N 0.48 6.34 -0.38 3.32 1.01 -0.23 -0.93 116.67 126.28 3d5d s ASP 87 Ca -0.04 0.33 0.02 0.00 0.71 0.00 0.00 52.55 53.57 3d5d s ASP 87 Cb -0.06 -1.98 0.16 0.00 1.01 0.00 0.00 42.92 42.05 3d5d s ASP 87 CO -0.01 -0.12 0.30 -0.36 0.21 0.00 0.00 175.17 175.19 3d5d s PHE 88 N -2.03 0.66 -0.19 4.23 0.40 0.25 -3.65 117.98 117.66 3d5d s PHE 88 Ca 0.38 -1.79 -0.29 0.00 -0.60 0.00 0.00 56.93 54.62 3d5d s PHE 88 Cb -0.10 -0.80 -0.01 0.00 0.51 0.00 0.00 43.02 42.62 3d5d s PHE 88 CO 0.31 -0.86 1.25 0.12 0.70 0.00 0.00 175.22 176.73 3d5d s PHE 89 N 0.67 2.87 0.22 0.36 2.19 -0.90 -1.02 117.98 122.38 3d5d s PHE 89 Ca 0.25 1.03 -0.20 0.00 0.33 0.00 0.00 56.93 58.34 3d5d s PHE 89 Cb -0.10 -3.54 -0.08 0.00 -1.31 0.00 0.00 43.02 37.99 3d5d s PHE 89 CO -0.09 -1.58 0.73 0.08 1.83 0.00 0.00 175.22 176.19 3d5d s VAL 90 N 3.60 4.56 0.49 3.12 1.01 -1.02 -1.58 120.40 130.59 3d5d s VAL 90 Ca 0.54 1.29 0.08 0.00 0.00 0.00 0.00 61.98 63.89 3d5d s VAL 90 Cb -0.20 -3.86 0.04 0.00 0.00 0.00 0.00 36.38 32.35 3d5d s VAL 90 CO 0.15 0.21 0.58 -0.76 0.00 0.00 0.00 175.10 175.28 3d5d s LEU 91 N -1.96 3.24 0.00 3.92 1.43 0.18 -4.70 118.68 120.80 3d5d s LEU 91 Ca 0.43 -0.78 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 3d5d s LEU 91 Cb -0.17 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.14 3d5d s LEU 91 CO 0.21 -1.00 0.00 -1.20 0.23 0.00 0.00 176.35 174.59 3d5d n SER 92 N -1.91 0.00 0.00 2.29 7.64 -1.26 -4.74 113.62 115.64 3d5d n SER 92 Ca 0.08 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.96 3d5d n SER 92 Cb 0.61 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.81 3d5d n SER 92 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3d5d n ASP 93 N 0.00 0.42 -4.77 6.43 5.68 -1.26 -4.83 116.55 118.22 3d5d n ASP 93 Ca 0.00 -0.80 -0.39 0.00 -0.50 0.00 0.00 54.79 53.10 3d5d n ASP 93 Cb 0.00 0.17 -0.06 0.00 -1.14 0.00 0.00 41.12 40.09 3d5d n ASP 93 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 3d5d s GLU 94 N -0.17 4.43 0.06 0.11 1.03 -1.26 -4.78 118.70 118.12 3d5d s GLU 94 Ca 0.00 0.97 -0.34 0.00 0.03 0.00 0.00 54.97 55.63 3d5d s GLU 94 Cb 0.00 -3.30 -0.13 0.00 -0.80 0.00 0.00 34.13 29.90 3d5d s GLU 94 CO 0.00 0.47 1.67 -0.35 -1.33 0.00 0.00 175.26 175.72 3d5d n PRO 95 N 2.17 2.08 -4.44 -4.83 -0.04 -1.26 -4.38 135.00 124.30 3d5d n PRO 95 Ca -0.06 0.75 -0.28 0.00 -0.04 0.00 0.00 63.50 63.88 3d5d n PRO 95 Cb 0.50 -2.54 -0.13 0.00 -0.04 0.00 0.00 33.50 31.29 3d5d n PRO 95 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3d5d s VAL 96 N 2.06 2.07 0.48 0.52 0.11 0.82 -4.82 120.40 121.65 3d5d s VAL 96 Ca 0.84 -1.63 -0.07 0.00 -2.93 0.00 0.00 61.98 58.20 3d5d s VAL 96 Cb -0.71 -1.84 -0.04 0.00 -1.53 0.00 0.00 36.38 32.26 3d5d s VAL 96 CO 0.44 0.09 0.81 -1.61 -3.33 0.00 0.00 175.10 171.50 3d5d s GLU 97 N -1.87 3.59 0.00 1.54 8.01 -1.26 -1.40 118.70 127.31 3d5d s GLU 97 Ca 0.11 0.31 0.00 0.00 0.01 0.00 0.00 54.97 55.40 3d5d s GLU 97 Cb -0.10 -2.35 0.00 0.00 -4.31 0.00 0.00 34.13 27.37 3d5d s GLU 97 CO 0.05 -0.21 0.00 0.00 0.01 0.00 0.00 175.26 175.11 3d5d n MET 98 N -2.13 0.00 -2.87 1.61 0.00 -0.92 -4.96 117.12 107.86 3d5d n MET 98 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 57.70 57.29 3d5d n MET 98 Cb 0.55 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.73 3d5d n MET 98 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 175.97 176.68 3d5d s TYR 99 N -2.00 3.23 -0.13 3.17 4.12 -1.26 -1.04 117.35 123.44 3d5d s TYR 99 Ca 0.00 1.00 -0.06 0.00 0.02 0.00 0.00 57.07 58.04 3d5d s TYR 99 Cb 0.00 -3.24 -0.04 0.00 -1.52 0.00 0.00 41.96 37.16 3d5d s TYR 99 CO 0.00 -0.54 0.08 0.14 0.02 0.00 0.00 175.55 175.24 3d5d s VAL 100 N 3.04 4.94 0.75 0.71 -7.23 0.03 -4.43 120.40 118.21 3d5d s VAL 100 Ca 0.36 0.00 -0.15 0.00 -1.81 0.00 0.00 61.98 60.38 3d5d s VAL 100 Cb -0.14 -3.15 0.05 0.00 0.56 0.00 0.00 36.38 33.70 3d5d s VAL 100 CO 0.11 0.57 1.22 -2.84 -0.31 0.00 0.00 175.10 173.85 3d5d s PRO 101 N -0.59 1.98 -0.08 4.82 0.02 -1.26 -2.09 135.00 137.80 3d5d s PRO 101 Ca 0.11 1.80 -0.01 0.00 0.02 0.00 0.00 61.00 62.92 3d5d s PRO 101 Cb -0.12 -1.81 0.03 0.00 0.02 0.00 0.00 34.50 32.62 3d5d s PRO 101 CO 0.02 -1.97 -0.03 -0.51 -0.33 0.00 0.00 177.00 174.19 3d5d s LEU 102 N -5.29 0.89 -0.52 -5.54 1.43 -1.08 -2.68 118.68 105.90 3d5d s LEU 102 Ca 0.75 -0.15 -0.17 0.00 -1.03 0.00 0.00 54.13 53.52 3d5d s LEU 102 Cb -0.30 -0.55 0.09 0.00 0.03 0.00 0.00 46.19 45.46 3d5d s LEU 102 CO 0.47 -0.15 0.54 -0.13 0.23 0.00 0.00 176.35 177.31 3d5d s ARG 103 N 1.69 3.03 -0.96 1.70 0.52 -1.01 -4.87 118.95 119.06 3d5d s ARG 103 Ca 0.02 -1.29 -0.24 0.00 -0.52 0.00 0.00 55.73 53.70 3d5d s ARG 103 Cb -0.13 -4.18 -0.00 0.00 0.52 0.00 0.00 34.95 31.16 3d5d s ARG 103 CO -0.05 -1.24 1.72 -0.06 0.02 0.00 0.00 175.30 175.69 3d5d s PHE 104 N 2.12 2.14 -0.11 -0.53 0.08 -1.26 -1.74 117.98 118.68 3d5d s PHE 104 Ca 0.08 -0.05 -0.01 0.00 0.12 0.00 0.00 56.93 57.07 3d5d s PHE 104 Cb -0.24 -4.35 -0.03 0.00 -0.57 0.00 0.00 43.02 37.84 3d5d s PHE 104 CO 0.07 -1.83 -0.07 0.54 -0.10 0.00 0.00 175.22 173.83 3d5d s VAL 105 N 7.73 3.61 0.00 -0.44 0.11 -1.08 -4.99 120.40 125.34 3d5d s VAL 105 Ca 0.59 -0.48 0.00 0.00 -2.93 0.00 0.00 61.98 59.16 3d5d s VAL 105 Cb -0.04 -2.52 0.00 0.00 -1.53 0.00 0.00 36.38 32.29 3d5d s VAL 105 CO -0.05 0.55 0.00 0.61 -3.33 0.00 0.00 175.10 172.88 3d5d n GLY 106 N 2.96 1.97 3.07 6.54 0.00 -1.25 -3.77 105.19 114.72 3d5d n GLY 106 Ca -0.18 -1.87 -0.35 0.00 0.00 0.00 0.00 46.02 43.62 3d5d n GLY 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3d5d s THR 107 N -1.44 3.46 0.51 2.61 -4.23 -1.25 -4.89 115.64 110.42 3d5d s THR 107 Ca 0.00 -2.91 -0.22 0.00 -1.18 0.00 0.00 61.69 57.38 3d5d s THR 107 Cb 0.00 -3.29 -0.07 0.00 1.34 0.00 0.00 72.50 70.48 3d5d s THR 107 CO 0.00 -0.84 1.20 -2.65 -0.54 0.00 0.00 174.62 171.79 3d5d n PRO 108 N 3.56 1.52 0.22 3.99 -0.02 -1.24 -4.66 135.00 138.37 3d5d n PRO 108 Ca 0.06 0.56 0.16 0.00 -2.02 0.00 0.00 63.50 62.26 3d5d n PRO 108 Cb 0.37 -2.36 0.74 0.00 -0.02 0.00 0.00 33.50 32.22 3d5d n PRO 108 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d5d h ALA 109 N 1.39 1.00 0.00 3.55 0.00 -1.01 -2.86 119.26 121.33 3d5d h ALA 109 Ca -0.49 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 3d5d h ALA 109 Cb 1.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3d5d h ALA 109 CO 0.56 0.00 -0.00 0.78 0.00 0.00 0.00 179.25 180.59 3d5d h GLY 110 N 1.14 -0.00 -0.20 0.00 0.00 -1.85 -2.82 103.07 99.33 3d5d h GLY 110 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.50 3d5d h GLY 110 CO 0.00 -0.00 0.11 -2.08 0.00 0.00 0.00 176.54 174.57 3d5d h VAL 111 N -0.28 0.44 -0.42 4.60 2.07 -1.77 0.88 116.25 121.77 3d5d h VAL 111 Ca -0.00 -0.07 0.04 0.00 0.82 0.00 0.00 66.70 67.49 3d5d h VAL 111 Cb 0.28 0.23 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 3d5d h VAL 111 CO 0.00 0.04 0.20 0.03 0.02 0.00 0.00 177.57 177.85 3d5d h ARG 112 N 0.19 0.38 -0.72 1.57 3.08 -1.64 -1.27 114.38 115.98 3d5d h ARG 112 Ca 0.42 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.44 3d5d h ARG 112 Cb 0.73 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.70 3d5d h ARG 112 CO -0.57 0.25 0.00 0.00 -1.07 0.00 0.00 179.97 178.58 3d5d n ALA 113 N -2.31 2.94 -2.77 0.04 0.00 -0.19 -4.90 120.51 113.32 3d5d n ALA 113 Ca 0.02 -0.72 -0.08 0.00 0.00 0.00 0.00 53.44 52.67 3d5d n ALA 113 Cb 0.12 -1.04 0.04 0.00 0.00 0.00 0.00 19.45 18.57 3d5d n ALA 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d5d n GLY 114 N 0.40 -0.77 0.00 0.00 0.00 0.27 -5.03 105.19 100.07 3d5d n GLY 114 Ca 0.11 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.48 3d5d n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d5d n GLY 115 N -1.39 3.11 3.15 -0.02 0.00 0.28 -4.63 105.19 105.69 3d5d n GLY 115 Ca -0.04 -2.11 -0.30 0.00 0.00 0.00 0.00 46.02 43.57 3d5d n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d5d s VAL 116 N 0.85 1.80 -0.74 1.61 1.01 -0.83 -4.67 120.40 119.42 3d5d s VAL 116 Ca 0.00 -0.85 -0.26 0.00 0.00 0.00 0.00 61.98 60.87 3d5d s VAL 116 Cb 0.00 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.76 3d5d s VAL 116 CO 0.00 0.50 1.92 -0.22 0.00 0.00 0.00 175.10 177.30 3d5d s LEU 117 N 0.59 3.23 -0.04 3.92 2.96 -1.26 -3.67 118.68 124.40 3d5d s LEU 117 Ca -0.14 -0.10 -0.07 0.00 -0.22 0.00 0.00 54.13 53.60 3d5d s LEU 117 Cb -0.17 -2.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.94 3d5d s LEU 117 CO 0.04 -2.57 0.22 -1.10 -1.32 0.00 0.00 176.35 171.62 3d5d s GLN 118 N 7.08 3.53 0.02 1.98 -1.52 -0.96 -5.02 119.66 124.78 3d5d s GLN 118 Ca 0.69 -0.09 -0.08 0.00 -1.95 0.00 0.00 55.36 53.93 3d5d s GLN 118 Cb -0.10 -3.14 -0.00 0.00 -0.22 0.00 0.00 33.01 29.55 3d5d s GLN 118 CO 0.11 0.71 0.15 -1.83 -0.25 0.00 0.00 175.29 174.17 3d5d s GLU 119 N -1.45 0.58 0.14 2.91 -1.05 -1.26 -2.89 118.70 115.67 3d5d s GLU 119 Ca 0.22 -0.57 0.00 0.00 -0.15 0.00 0.00 54.97 54.47 3d5d s GLU 119 Cb -0.13 0.24 0.00 0.00 -0.44 0.00 0.00 34.13 33.80 3d5d s GLU 119 CO 0.12 -0.15 0.00 -0.89 0.95 0.00 0.00 175.26 175.29 3d5d n ILE 120 N 1.00 0.88 -3.50 1.83 2.08 -0.40 -4.88 119.36 116.37 3d5d n ILE 120 Ca -0.20 0.29 -0.42 0.00 0.56 0.00 0.00 62.75 62.98 3d5d n ILE 120 Cb 0.57 -1.29 -0.05 0.00 -0.75 0.00 0.00 39.64 38.12 3d5d n ILE 120 CO 0.00 0.00 0.00 -1.00 0.56 0.00 0.00 176.55 176.11 3d5d s HIS 121 N -1.93 3.70 -2.00 1.39 3.76 -1.14 -4.86 115.29 114.21 3d5d s HIS 121 Ca 0.00 -2.45 0.14 0.00 -0.15 0.00 0.00 55.06 52.60 3d5d s HIS 121 Cb 0.00 -3.53 0.81 0.00 1.11 0.00 0.00 32.58 30.97 3d5d s HIS 121 CO 0.00 -0.90 1.25 0.54 -0.85 0.00 0.00 174.74 174.77 3d5d n ARG 122 N 3.46 0.55 -3.18 1.40 1.74 -1.26 -4.46 116.66 114.92 3d5d n ARG 122 Ca 0.14 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.26 3d5d n ARG 122 Cb 0.42 -1.38 -0.02 0.00 -1.02 0.00 0.00 32.46 30.46 3d5d n ARG 122 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 3d5d s ASP 123 N -1.87 -0.58 0.14 0.55 1.47 -1.26 -2.62 116.67 112.51 3d5d s ASP 123 Ca 0.20 0.41 -0.12 0.00 1.18 0.00 0.00 52.55 54.23 3d5d s ASP 123 Cb 0.09 1.51 -0.07 0.00 -0.34 0.00 0.00 42.92 44.11 3d5d s ASP 123 CO 0.16 -0.11 0.51 0.27 0.68 0.00 0.00 175.17 176.68 3d5d s ILE 124 N 2.87 4.94 -0.22 2.11 -4.36 -0.89 -4.68 121.20 120.96 3d5d s ILE 124 Ca 0.02 0.66 -0.25 0.00 -0.26 0.00 0.00 60.65 60.81 3d5d s ILE 124 Cb -0.10 -3.69 -0.00 0.00 1.25 0.00 0.00 42.46 39.91 3d5d s ILE 124 CO -0.13 0.20 0.86 -0.22 0.24 0.00 0.00 174.94 175.89 3d5d s LEU 125 N -2.10 4.10 0.02 0.37 0.20 -1.26 -0.79 118.68 119.22 3d5d s LEU 125 Ca 0.38 1.12 0.01 0.00 0.69 0.00 0.00 54.13 56.33 3d5d s LEU 125 Cb -0.14 -3.26 -0.02 0.00 -0.43 0.00 0.00 46.19 42.35 3d5d s LEU 125 CO 0.19 -0.52 -0.03 0.68 -0.29 0.00 0.00 176.35 176.38 3d5d s VAL 126 N 2.75 0.19 0.14 1.68 -7.23 -0.21 -3.22 120.40 114.51 3d5d s VAL 126 Ca 0.37 -0.71 -0.30 0.00 -1.81 0.00 0.00 61.98 59.53 3d5d s VAL 126 Cb -0.15 -0.28 -0.07 0.00 0.56 0.00 0.00 36.38 36.44 3d5d s VAL 126 CO 0.08 -0.33 0.97 -0.75 -0.31 0.00 0.00 175.10 174.76 3d5d s LYS 127 N -1.09 4.71 -0.13 4.82 2.47 -1.20 -2.15 119.74 127.16 3d5d s LYS 127 Ca -0.10 1.49 -0.30 0.00 -1.56 0.00 0.00 55.97 55.50 3d5d s LYS 127 Cb -0.07 -3.35 0.11 0.00 -1.46 0.00 0.00 37.83 33.06 3d5d s LYS 127 CO -0.00 0.25 0.89 0.54 0.16 0.00 0.00 175.35 177.19 3d5d s VAL 128 N -0.25 0.00 0.59 4.02 0.11 -0.49 -3.36 120.40 121.03 3d5d s VAL 128 Ca 0.46 0.00 -0.19 0.00 -2.93 0.00 0.00 61.98 59.32 3d5d s VAL 128 Cb -0.25 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.57 3d5d s VAL 128 CO 0.31 0.00 1.21 -0.55 -3.33 0.00 0.00 175.10 172.74 3d5d s SER 129 N -1.04 5.19 0.55 3.54 0.15 -1.26 -0.12 113.70 120.71 3d5d s SER 129 Ca -0.04 2.40 0.25 0.00 0.70 0.00 0.00 55.95 59.25 3d5d s SER 129 Cb -0.01 -2.60 1.47 0.00 -1.71 0.00 0.00 66.02 63.18 3d5d s SER 129 CO 0.04 -1.59 2.06 -0.65 1.20 0.00 0.00 173.24 174.30 3d5d h PRO 130 N 0.91 0.00 -0.44 5.44 0.11 -1.86 -2.46 132.00 133.68 3d5d h PRO 130 Ca -0.50 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.48 3d5d h PRO 130 Cb 1.30 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.40 3d5d h PRO 130 CO 0.55 0.00 -0.22 0.00 -0.21 0.00 0.00 178.00 178.12 3d5d h ARG 131 N 0.00 0.93 -6.45 1.05 -0.00 -1.91 -3.41 114.38 104.59 3d5d h ARG 131 Ca 0.14 -0.41 -0.57 0.00 -0.50 0.00 0.00 59.98 58.64 3d5d h ARG 131 Cb 0.63 -0.02 -0.05 0.00 0.00 0.00 0.00 29.97 30.53 3d5d h ARG 131 CO -0.00 1.07 1.11 -0.80 0.00 0.00 0.00 179.97 181.35 3d5d s ASN 132 N -6.67 6.26 -0.52 7.04 0.01 -0.93 -4.92 114.94 115.22 3d5d s ASN 132 Ca -0.12 1.00 0.07 0.00 -0.71 0.00 0.00 52.86 53.10 3d5d s ASN 132 Cb 0.11 -2.54 0.35 0.00 0.41 0.00 0.00 41.25 39.58 3d5d s ASN 132 CO 0.86 -1.46 0.90 -0.38 -1.51 0.00 0.00 177.10 175.51 3d5d n ILE 133 N 7.07 2.24 -1.59 0.60 5.41 -1.26 -4.79 119.36 127.04 3d5d n ILE 133 Ca 0.18 -5.30 -0.45 0.00 1.00 0.00 0.00 62.75 58.18 3d5d n ILE 133 Cb 0.47 -1.09 -0.04 0.00 -0.71 0.00 0.00 39.64 38.27 3d5d n ILE 133 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 3d5d n PRO 134 N -0.12 1.93 -0.28 0.38 -0.04 -1.26 -4.82 135.00 130.79 3d5d n PRO 134 Ca 0.30 0.58 0.24 0.00 -0.04 0.00 0.00 63.50 64.57 3d5d n PRO 134 Cb 0.47 -3.00 0.56 0.00 -0.04 0.00 0.00 33.50 31.49 3d5d n PRO 134 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3d5d h GLU 135 N 13.43 0.30 -2.15 0.54 5.08 -1.96 -3.44 114.58 126.38 3d5d h GLU 135 Ca -0.40 -0.02 0.25 0.00 -1.00 0.00 0.00 59.36 58.19 3d5d h GLU 135 Cb 1.26 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 30.37 3d5d h GLU 135 CO 0.97 0.20 0.70 -0.59 -1.00 0.00 0.00 179.01 179.29 3d5d s PHE 136 N -5.34 0.00 -0.12 4.33 -0.12 -1.26 -4.46 117.98 111.01 3d5d s PHE 136 Ca -0.08 -0.25 0.03 0.00 -0.05 0.00 0.00 56.93 56.59 3d5d s PHE 136 Cb 0.24 0.62 0.00 0.00 -0.63 0.00 0.00 43.02 43.25 3d5d s PHE 136 CO 0.79 -0.60 -0.23 0.42 -0.05 0.00 0.00 175.22 175.55 3d5d s ILE 137 N -2.38 2.09 -0.07 -4.49 1.09 -1.09 -4.97 121.20 111.37 3d5d s ILE 137 Ca 0.20 -0.99 -0.29 0.00 -1.10 0.00 0.00 60.65 58.47 3d5d s ILE 137 Cb -0.00 -1.81 -0.07 0.00 -1.06 0.00 0.00 42.46 39.52 3d5d s ILE 137 CO 0.01 0.55 2.02 -1.61 -0.10 0.00 0.00 174.94 175.82 3d5d s GLU 138 N 0.54 3.76 -0.34 2.79 2.02 -1.26 -2.41 118.70 123.80 3d5d s GLU 138 Ca -0.14 2.33 -0.14 0.00 0.02 0.00 0.00 54.97 57.04 3d5d s GLU 138 Cb -0.17 -4.22 -0.01 0.00 0.10 0.00 0.00 34.13 29.82 3d5d s GLU 138 CO 0.04 -1.38 0.32 0.08 0.02 0.00 0.00 175.26 174.34 3d5d s VAL 139 N 5.86 5.21 -0.18 2.63 1.01 -0.71 -4.76 120.40 129.46 3d5d s VAL 139 Ca 0.91 -0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.83 3d5d s VAL 139 Cb -0.38 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.22 3d5d s VAL 139 CO 0.38 -0.07 0.91 -0.90 0.00 0.00 0.00 175.10 175.42 3d5d n ASP 140 N 5.28 2.63 -4.56 3.32 3.85 -1.26 -2.64 116.55 123.16 3d5d n ASP 140 Ca -0.10 -1.99 -0.38 0.00 -0.71 0.00 0.00 54.79 51.61 3d5d n ASP 140 Cb 0.49 -0.50 -0.03 0.00 -1.35 0.00 0.00 41.12 39.74 3d5d n ASP 140 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3d5d s VAL 141 N -0.18 3.02 0.27 2.12 0.11 -1.25 -4.33 120.40 120.17 3d5d s VAL 141 Ca 0.00 0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.07 3d5d s VAL 141 Cb 0.00 -3.06 0.00 0.00 -1.53 0.00 0.00 36.38 31.79 3d5d s VAL 141 CO 0.00 -0.05 0.00 -1.20 -3.33 0.00 0.00 175.10 170.52 3d5d n SER 142 N 14.90 -1.74 -1.02 3.54 7.64 -1.26 -3.78 113.62 131.90 3d5d n SER 142 Ca 0.35 0.50 0.00 0.00 1.01 0.00 0.00 58.87 60.73 3d5d n SER 142 Cb 0.53 1.78 0.00 0.00 -1.01 0.00 0.00 64.21 65.51 3d5d n SER 142 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d5d n GLY 143 N -0.24 1.97 3.44 0.23 0.00 -1.26 -2.44 105.19 106.89 3d5d n GLY 143 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3d5d n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d5d s LEU 144 N 0.00 5.13 0.58 0.99 2.01 -1.26 -4.87 118.68 121.26 3d5d s LEU 144 Ca 0.00 -0.96 -0.04 0.00 0.01 0.00 0.00 54.13 53.14 3d5d s LEU 144 Cb 0.00 -2.15 0.02 0.00 0.01 0.00 0.00 46.19 44.07 3d5d s LEU 144 CO 0.00 -0.47 0.86 -0.70 1.01 0.00 0.00 176.35 177.06 3d5d s GLU 145 N 1.66 2.80 0.03 1.70 2.56 -1.26 -1.82 118.70 124.37 3d5d s GLU 145 Ca 0.05 -0.22 -0.33 0.00 0.00 0.00 0.00 54.97 54.47 3d5d s GLU 145 Cb -0.20 -2.33 -0.11 0.00 2.00 0.00 0.00 34.13 33.49 3d5d s GLU 145 CO 0.09 -0.70 1.83 0.44 -0.56 0.00 0.00 175.26 176.36 3d5d n ILE 146 N -2.51 0.45 0.00 -3.70 -5.35 -1.26 -1.22 119.36 105.76 3d5d n ILE 146 Ca 0.05 -0.08 0.00 0.00 -0.27 0.00 0.00 62.75 62.45 3d5d n ILE 146 Cb 0.58 -1.94 0.00 0.00 -1.74 0.00 0.00 39.64 36.54 3d5d n ILE 146 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3d5d n GLY 147 N 4.20 0.92 3.92 3.28 0.00 -0.65 -5.01 105.19 111.84 3d5d n GLY 147 Ca 0.20 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 3d5d n GLY 147 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3d5d s ASP 148 N -1.80 6.27 -0.04 1.61 1.11 -0.36 -4.92 116.67 118.55 3d5d s ASP 148 Ca 0.00 0.78 -0.03 0.00 0.18 0.00 0.00 52.55 53.48 3d5d s ASP 148 Cb 0.00 -2.18 0.01 0.00 1.07 0.00 0.00 42.92 41.82 3d5d s ASP 148 CO 0.00 -0.49 0.10 -0.44 1.18 0.00 0.00 175.17 175.52 3d5d s SER 149 N -4.09 -0.10 -0.18 0.27 0.01 -1.26 -3.66 113.70 104.69 3d5d s SER 149 Ca 0.45 0.20 -0.12 0.00 1.31 0.00 0.00 55.95 57.80 3d5d s SER 149 Cb -0.10 0.19 -0.05 0.00 0.21 0.00 0.00 66.02 66.27 3d5d s SER 149 CO 0.42 -0.05 0.20 -0.22 0.41 0.00 0.00 173.24 174.00 3d5d s LEU 150 N 0.19 4.23 0.39 2.44 0.20 -1.16 -5.00 118.68 119.96 3d5d s LEU 150 Ca -0.01 0.35 0.08 0.00 0.69 0.00 0.00 54.13 55.24 3d5d s LEU 150 Cb -0.02 -2.21 -0.03 0.00 -0.43 0.00 0.00 46.19 43.50 3d5d s LEU 150 CO -0.01 0.15 0.31 -1.00 -0.29 0.00 0.00 176.35 175.52 3d5d s HIS 151 N 0.38 2.75 0.44 5.38 3.76 -1.26 -0.52 115.29 126.20 3d5d s HIS 151 Ca 0.12 -0.44 0.11 0.00 -0.15 0.00 0.00 55.06 54.69 3d5d s HIS 151 Cb -0.12 -2.00 0.96 0.00 1.11 0.00 0.00 32.58 32.54 3d5d s HIS 151 CO 0.01 0.04 2.04 0.00 -0.85 0.00 0.00 174.74 175.97 3d5d h ALA 152 N 1.18 1.73 0.00 -1.40 0.00 0.04 0.97 119.26 121.78 3d5d h ALA 152 Ca -0.43 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3d5d h ALA 152 Cb 1.26 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3d5d h ALA 152 CO 0.59 0.22 0.00 -1.13 0.00 0.00 0.00 179.25 178.93 3d5d n SER 153 N -4.42 0.00 -1.89 0.00 3.41 -1.26 -2.81 113.62 106.65 3d5d n SER 153 Ca -0.00 -0.11 -0.22 0.00 -0.26 0.00 0.00 58.87 58.29 3d5d n SER 153 Cb 0.14 -0.24 0.11 0.00 -0.26 0.00 0.00 64.21 63.96 3d5d n SER 153 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3d5d n ASP 154 N -1.24 4.94 -4.85 4.04 10.43 0.34 -5.02 116.55 125.19 3d5d n ASP 154 Ca 0.10 -3.76 -0.31 0.00 2.57 0.00 0.00 54.79 53.39 3d5d n ASP 154 Cb 0.14 -0.68 -0.05 0.00 1.84 0.00 0.00 41.12 42.37 3d5d n ASP 154 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3d5d s LEU 155 N -3.54 4.08 -0.50 0.64 1.43 -1.12 -4.82 118.68 114.84 3d5d s LEU 155 Ca 0.54 0.14 -0.16 0.00 -1.03 0.00 0.00 54.13 53.62 3d5d s LEU 155 Cb 0.45 -2.70 0.10 0.00 0.03 0.00 0.00 46.19 44.07 3d5d s LEU 155 CO 0.02 0.18 0.46 -0.75 0.23 0.00 0.00 176.35 176.49 3d5d s LYS 156 N -2.40 2.99 -0.24 1.70 2.20 -1.26 -5.06 119.74 117.68 3d5d s LYS 156 Ca 0.32 -1.47 -0.16 0.00 -0.36 0.00 0.00 55.97 54.30 3d5d s LYS 156 Cb -0.13 -4.20 -0.04 0.00 -1.51 0.00 0.00 37.83 31.96 3d5d s LYS 156 CO 0.24 -1.17 0.40 -0.51 -0.36 0.00 0.00 175.35 173.95 3d5d s LEU 157 N 1.71 4.09 0.48 5.43 1.02 -1.26 -4.82 118.68 125.34 3d5d s LEU 157 Ca 0.04 0.42 -0.24 0.00 0.02 0.00 0.00 54.13 54.38 3d5d s LEU 157 Cb -0.26 -2.49 -0.07 0.00 0.02 0.00 0.00 46.19 43.38 3d5d s LEU 157 CO 0.05 -0.15 1.42 -0.81 0.02 0.00 0.00 176.35 176.89 3d5d n PRO 158 N 4.95 2.09 -1.29 1.29 -0.04 -1.26 -4.93 135.00 135.82 3d5d n PRO 158 Ca -0.08 0.75 -0.37 0.00 -0.04 0.00 0.00 63.50 63.77 3d5d n PRO 158 Cb 0.51 -2.63 0.06 0.00 -0.04 0.00 0.00 33.50 31.40 3d5d n PRO 158 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3d5d n PRO 159 N -0.47 0.31 -1.01 0.54 -0.02 -1.26 -2.90 135.00 130.18 3d5d n PRO 159 Ca 0.07 0.14 -0.00 0.00 -2.02 0.00 0.00 63.50 61.68 3d5d n PRO 159 Cb 0.42 -1.72 -0.00 0.00 -0.02 0.00 0.00 33.50 32.18 3d5d n PRO 159 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d5d n GLY 160 N 1.80 0.42 3.14 -1.23 0.00 -1.26 -5.00 105.19 103.06 3d5d n GLY 160 Ca 0.10 -0.06 -0.17 0.00 0.00 0.00 0.00 46.02 45.89 3d5d n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d5d s VAL 161 N -1.83 0.94 0.08 1.61 1.01 -1.14 -4.47 120.40 116.60 3d5d s VAL 161 Ca 0.00 -1.26 0.03 0.00 0.00 0.00 0.00 61.98 60.75 3d5d s VAL 161 Cb 0.00 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.39 3d5d s VAL 161 CO 0.00 -0.29 -0.10 -1.83 0.00 0.00 0.00 175.10 172.88 3d5d s GLU 162 N -1.75 0.77 -0.93 2.72 -1.05 -1.21 -4.87 118.70 112.37 3d5d s GLU 162 Ca -0.04 -1.06 -0.24 0.00 -0.15 0.00 0.00 54.97 53.48 3d5d s GLU 162 Cb -0.10 -0.49 0.04 0.00 -0.44 0.00 0.00 34.13 33.14 3d5d s GLU 162 CO 0.02 0.08 1.43 -0.48 0.95 0.00 0.00 175.26 177.26 3d5d s LEU 163 N -2.21 3.39 -1.30 1.83 2.34 -1.26 -3.26 118.68 118.21 3d5d s LEU 163 Ca 0.02 -1.11 -0.10 0.00 0.06 0.00 0.00 54.13 53.00 3d5d s LEU 163 Cb -0.05 -2.57 -0.07 0.00 -0.56 0.00 0.00 46.19 42.95 3d5d s LEU 163 CO 0.00 -1.67 2.51 0.00 -1.06 0.00 0.00 176.35 176.12 3d5d n ALA 164 N 9.32 6.03 -2.89 1.48 0.00 -1.20 -4.71 120.51 128.54 3d5d n ALA 164 Ca 0.25 -3.03 0.00 0.00 0.00 0.00 0.00 53.44 50.66 3d5d n ALA 164 Cb 0.50 -3.29 0.00 0.00 0.00 0.00 0.00 19.45 16.67 3d5d n ALA 164 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3d5d n VAL 165 N 4.16 0.00 -3.80 0.00 0.24 -1.26 -4.53 118.33 113.14 3d5d n VAL 165 Ca 0.62 0.00 -0.35 0.00 -2.04 0.00 0.00 64.34 62.57 3d5d n VAL 165 Cb 0.23 0.00 -0.12 0.00 -1.47 0.00 0.00 33.84 32.48 3d5d n VAL 165 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3d5d s SER 166 N 1.26 5.08 -0.09 -1.34 1.04 -1.26 -5.01 113.70 113.37 3d5d s SER 166 Ca 0.00 -2.47 -0.10 0.00 0.48 0.00 0.00 55.95 53.85 3d5d s SER 166 Cb 0.00 -1.79 -0.12 0.00 0.10 0.00 0.00 66.02 64.21 3d5d s SER 166 CO 0.00 -0.42 1.00 -0.81 0.98 0.00 0.00 173.24 173.98 3d5d n PRO 167 N 3.96 0.01 0.00 4.02 -0.04 -1.26 -0.79 135.00 140.90 3d5d n PRO 167 Ca 0.03 -0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.09 3d5d n PRO 167 Cb 0.39 -1.63 0.00 0.00 -0.04 0.00 0.00 33.50 32.21 3d5d n PRO 167 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3d5d n GLU 168 N 5.21 0.00 -2.96 0.54 4.07 -1.26 -4.46 120.64 121.78 3d5d n GLU 168 Ca 0.16 0.00 -0.40 0.00 -0.06 0.00 0.00 57.16 56.85 3d5d n GLU 168 Cb 0.35 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.69 3d5d n GLU 168 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 3d5d s GLU 169 N 0.00 4.41 0.33 5.31 2.56 0.03 -4.63 118.70 126.72 3d5d s GLU 169 Ca 0.00 0.98 -0.27 0.00 0.00 0.00 0.00 54.97 55.68 3d5d s GLU 169 Cb 0.00 -3.48 -0.13 0.00 2.00 0.00 0.00 34.13 32.52 3d5d s GLU 169 CO 0.00 -0.06 1.08 0.25 -0.56 0.00 0.00 175.26 175.97 3d5d n THR 170 N 4.05 2.09 -0.04 -1.70 -2.24 -1.26 0.72 114.28 115.90 3d5d n THR 170 Ca 0.01 -0.50 -0.07 0.00 -2.27 0.00 0.00 64.05 61.22 3d5d n THR 170 Cb 0.51 -1.18 -0.04 0.00 -2.10 0.00 0.00 70.33 67.52 3d5d n THR 170 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 3d5d n ILE 171 N 0.08 0.49 -3.85 2.28 2.08 0.32 -4.49 119.36 116.27 3d5d n ILE 171 Ca 0.08 -0.17 -0.07 0.00 0.56 0.00 0.00 62.75 63.15 3d5d n ILE 171 Cb 0.35 -1.01 -0.02 0.00 -0.75 0.00 0.00 39.64 38.20 3d5d n ILE 171 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3d5d s ALA 172 N -2.17 -1.26 0.20 -1.39 0.00 -1.16 -1.28 121.76 114.70 3d5d s ALA 172 Ca -0.12 -0.27 -0.03 0.00 0.00 0.00 0.00 51.96 51.54 3d5d s ALA 172 Cb 0.03 0.83 0.01 0.00 0.00 0.00 0.00 23.12 24.00 3d5d s ALA 172 CO 0.19 -1.04 0.32 0.00 0.00 0.00 0.00 175.76 175.23 3d5d n ALA 173 N -0.46 -0.44 -3.24 0.00 0.00 -1.14 -2.98 120.51 112.25 3d5d n ALA 173 Ca -0.04 -0.82 -0.21 0.00 0.00 0.00 0.00 53.44 52.37 3d5d n ALA 173 Cb 0.59 0.66 -0.07 0.00 0.00 0.00 0.00 19.45 20.63 3d5d n ALA 173 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3d5d s VAL 174 N -2.60 -0.05 0.78 0.00 1.01 -1.24 -2.25 120.40 116.05 3d5d s VAL 174 Ca 0.14 -2.07 -0.12 0.00 0.00 0.00 0.00 61.98 59.93 3d5d s VAL 174 Cb -0.01 -0.90 0.06 0.00 0.00 0.00 0.00 36.38 35.53 3d5d s VAL 174 CO 0.10 -0.88 1.11 0.68 0.00 0.00 0.00 175.10 176.11 3d5d s VAL 175 N 0.42 3.01 0.66 2.92 -7.23 -1.24 -1.64 120.40 117.30 3d5d s VAL 175 Ca 0.30 0.33 -0.11 0.00 -1.81 0.00 0.00 61.98 60.69 3d5d s VAL 175 Cb 0.00 -3.18 -0.01 0.00 0.56 0.00 0.00 36.38 33.75 3d5d s VAL 175 CO -0.14 -0.43 1.06 -2.84 -0.31 0.00 0.00 175.10 172.44 3d5d s PRO 176 N -5.27 3.21 0.00 4.82 0.02 -1.26 -1.97 135.00 134.55 3d5d s PRO 176 Ca 0.60 0.59 0.00 0.00 0.02 0.00 0.00 61.00 62.21 3d5d s PRO 176 Cb -0.13 -2.06 0.00 0.00 0.02 0.00 0.00 34.50 32.33 3d5d s PRO 176 CO 0.53 -0.80 0.00 -0.35 -0.33 0.00 0.00 177.00 176.04 3d5d n PRO 177 N -2.87 1.41 0.00 5.54 -0.04 -1.26 -4.80 135.00 132.97 3d5d n PRO 177 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 3d5d n PRO 177 Cb 0.56 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 3d5d n PRO 177 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3d5d n GLU 178 N 0.00 0.69 0.00 0.54 0.28 -1.26 -5.08 120.64 115.81 3d5d n GLU 178 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 3d5d n GLU 178 Cb 0.00 -0.09 0.00 0.00 1.43 0.00 0.00 31.44 32.78 3d5d n GLU 178 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 3d5d n ASP 179 N -0.18 0.00 0.00 -1.84 -0.08 -1.26 -3.65 116.55 109.54 3d5d n ASP 179 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 3d5d n ASP 179 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 3d5d n ASP 179 CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 3d5d n VAL 180 N 0.00 0.00 -0.28 5.18 0.24 -1.26 -2.61 118.33 119.60 3d5d n VAL 180 Ca 0.00 1.42 -0.04 0.00 -2.04 0.00 0.00 64.34 63.68 3d5d n VAL 180 Cb 0.00 -1.93 0.01 0.00 -1.47 0.00 0.00 33.84 30.45 3d5d n VAL 180 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 3d5d h GLU 181 N 0.00 -0.10 0.23 7.34 4.39 -2.00 -2.33 114.58 122.10 3d5d h GLU 181 Ca 0.00 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 3d5d h GLU 181 Cb 0.00 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.67 3d5d h GLU 181 CO 0.00 -0.07 -0.15 0.87 -1.16 0.00 0.00 179.01 178.50 3d5d h LYS 182 N -0.11 -0.34 -0.15 2.33 1.57 -1.57 -2.01 116.57 116.29 3d5d h LYS 182 Ca 0.26 0.02 0.02 0.00 -1.87 0.00 0.00 60.65 59.08 3d5d h LYS 182 Cb 0.57 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.93 3d5d h LYS 182 CO -0.81 -0.23 -0.14 -0.07 -0.57 0.00 0.00 179.45 177.64 3d5d h LEU 183 N -0.35 -0.49 -1.12 2.94 3.38 -1.32 1.42 115.31 119.77 3d5d h LEU 183 Ca -0.03 0.07 0.21 0.00 0.09 0.00 0.00 57.88 58.22 3d5d h LEU 183 Cb 0.29 0.21 -0.10 0.00 0.09 0.00 0.00 40.66 41.14 3d5d h LEU 183 CO 0.03 -0.08 0.62 0.00 0.09 0.00 0.00 178.44 179.09 3d5d h ALA 184 N -0.86 1.84 0.00 1.53 0.00 -1.53 0.19 119.26 120.44 3d5d h ALA 184 Ca 0.03 0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.83 3d5d h ALA 184 Cb 0.13 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3d5d h ALA 184 CO -0.18 -0.23 -0.93 1.49 0.00 0.00 0.00 179.25 179.40 3d5d h GLU 185 N 0.63 0.00 -0.01 0.00 4.57 -0.43 -3.33 114.58 116.01 3d5d h GLU 185 Ca 0.58 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.76 3d5d h GLU 185 Cb 1.09 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.68 3d5d h GLU 185 CO -0.36 0.79 -0.02 0.93 -1.18 0.00 0.00 179.01 179.17 3d5d h GLU 186 N 0.00 0.03 -0.53 1.92 5.08 0.39 0.11 114.58 121.58 3d5d h GLU 186 Ca -0.04 -0.02 0.14 0.00 -1.00 0.00 0.00 59.36 58.44 3d5d h GLU 186 Cb 1.67 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.90 3d5d h GLU 186 CO 0.10 0.57 0.37 0.00 -1.00 0.00 0.00 179.01 179.06 3d5d h ALA 187 N 0.46 2.38 0.00 3.43 0.00 -1.42 0.17 119.26 124.27 3d5d h ALA 187 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3d5d h ALA 187 Cb 0.57 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3d5d h ALA 187 CO 0.00 -0.52 -1.36 0.00 0.00 0.00 0.00 179.25 177.37 3d5d n ALA 188 N -2.61 2.63 -1.60 0.00 0.00 -1.21 -4.16 120.51 113.56 3d5d n ALA 188 Ca 0.09 -0.34 -0.12 0.00 0.00 0.00 0.00 53.44 53.08 3d5d n ALA 188 Cb 0.54 -0.98 0.14 0.00 0.00 0.00 0.00 19.45 19.15 3d5d n ALA 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d5d n ALA 189 N -2.21 4.69 -0.94 0.00 0.00 0.02 -5.11 120.51 116.96 3d5d n ALA 189 Ca -0.01 -3.37 0.00 0.00 0.00 0.00 0.00 53.44 50.06 3d5d n ALA 189 Cb 0.56 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.29 3d5d n ALA 189 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89