#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d8u n LEU 2 N 0.00 7.70 -0.00 0.00 7.94 -1.26 -2.71 117.00 128.67 1d8u n LEU 2 Ca 0.00 -4.53 0.01 0.00 -1.11 0.00 0.00 56.01 50.38 1d8u n LEU 2 Cb 0.00 -1.51 -0.02 0.00 0.53 0.00 0.00 43.42 42.42 1d8u n LEU 2 CO 0.00 1.71 -0.51 0.52 -1.11 0.00 0.00 177.39 178.00 1d8u n VAL 3 N 3.33 0.00 -2.29 1.96 0.31 -1.26 -4.70 118.33 115.68 1d8u n VAL 3 Ca 0.60 -0.07 -0.01 0.00 -0.01 0.00 0.00 64.34 64.85 1d8u n VAL 3 Cb 0.30 0.47 0.01 0.00 -0.91 0.00 0.00 33.84 33.71 1d8u n VAL 3 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 1d8u n GLU 4 N -1.56 0.19 -1.72 5.55 0.00 -1.25 -5.07 120.64 116.78 1d8u n GLU 4 Ca -0.00 -0.22 -0.42 0.00 0.00 0.00 0.00 57.16 56.52 1d8u n GLU 4 Cb 0.06 0.19 -0.03 0.00 0.00 0.00 0.00 31.44 31.66 1d8u n GLU 4 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 1d8u s ASP 5 N -0.20 6.37 0.37 -1.84 2.15 -1.10 -4.72 116.67 117.70 1d8u s ASP 5 Ca 0.01 2.87 0.00 0.00 0.43 0.00 0.00 52.55 55.86 1d8u s ASP 5 Cb 0.06 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 1d8u s ASP 5 CO -0.02 -0.99 0.00 -3.20 -0.17 0.00 0.00 175.17 170.80 1d8u n ASN 6 N 4.22 -2.37 0.00 -0.34 2.85 -1.26 -5.00 115.26 113.35 1d8u n ASN 6 Ca 0.16 0.69 0.00 0.00 -0.11 0.00 0.00 54.58 55.32 1d8u n ASN 6 Cb 0.35 2.31 0.00 0.00 1.24 0.00 0.00 39.78 43.69 1d8u n ASN 6 CO 0.00 0.00 0.00 -3.20 -2.11 0.00 0.00 177.26 171.95 1d8u n ASN 7 N -3.41 0.00 -3.56 1.20 4.05 -1.26 -5.08 115.26 107.21 1d8u n ASN 7 Ca 0.00 0.00 -0.23 0.00 0.45 0.00 0.00 54.58 54.80 1d8u n ASN 7 Cb 0.00 0.00 -0.15 0.00 1.23 0.00 0.00 39.78 40.86 1d8u n ASN 7 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1d8u s ALA 8 N 0.00 0.17 0.29 5.20 0.00 -1.26 -5.12 121.76 121.04 1d8u s ALA 8 Ca 0.00 -0.14 0.06 0.00 0.00 0.00 0.00 51.96 51.89 1d8u s ALA 8 Cb 0.00 -1.16 -0.03 0.00 0.00 0.00 0.00 23.12 21.93 1d8u s ALA 8 CO 0.00 -1.21 0.34 0.08 0.00 0.00 0.00 175.76 174.96 1d8u s VAL 9 N 2.21 4.41 -0.73 0.00 1.01 -1.26 -4.87 120.40 121.17 1d8u s VAL 9 Ca 0.04 -1.17 -0.27 0.00 0.00 0.00 0.00 61.98 60.59 1d8u s VAL 9 Cb -0.16 -3.50 0.03 0.00 0.00 0.00 0.00 36.38 32.76 1d8u s VAL 9 CO -0.12 -0.26 1.24 0.00 0.00 0.00 0.00 175.10 175.97 1d8u s ALA 10 N -2.13 2.80 -1.15 5.51 0.00 -1.26 -4.94 121.76 120.58 1d8u s ALA 10 Ca 0.38 -1.41 -0.08 0.00 0.00 0.00 0.00 51.96 50.84 1d8u s ALA 10 Cb -0.08 -4.21 0.25 0.00 0.00 0.00 0.00 23.12 19.08 1d8u s ALA 10 CO 0.28 -3.22 1.44 0.28 0.00 0.00 0.00 175.76 174.54 1d8u n VAL 11 N 6.33 4.74 -2.37 0.00 0.31 -1.26 -4.98 118.33 121.09 1d8u n VAL 11 Ca 0.02 -5.27 -0.43 0.00 -0.01 0.00 0.00 64.34 58.66 1d8u n VAL 11 Cb 0.49 -2.35 -0.02 0.00 -0.91 0.00 0.00 33.84 31.04 1d8u n VAL 11 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1d8u s SER 12 N 0.45 6.86 -0.19 4.52 1.04 -1.26 -4.66 113.70 120.46 1d8u s SER 12 Ca 0.35 1.67 -0.04 0.00 0.48 0.00 0.00 55.95 58.41 1d8u s SER 12 Cb -0.00 -2.54 0.09 0.00 0.10 0.00 0.00 66.02 63.67 1d8u s SER 12 CO 0.01 -0.84 0.22 0.12 0.98 0.00 0.00 173.24 173.73 1d8u s PHE 13 N 3.74 -0.28 0.79 5.02 5.36 -1.26 -5.10 117.98 126.25 1d8u s PHE 13 Ca 0.57 0.31 -0.12 0.00 -0.96 0.00 0.00 56.93 56.73 1d8u s PHE 13 Cb -0.22 -0.33 0.06 0.00 -0.34 0.00 0.00 43.02 42.19 1d8u s PHE 13 CO 0.18 -0.56 1.12 -1.54 -1.46 0.00 0.00 175.22 172.96 1d8u s SER 14 N 2.33 4.65 0.30 6.13 1.04 -1.26 -4.23 113.70 122.66 1d8u s SER 14 Ca 0.06 1.09 0.02 0.00 0.48 0.00 0.00 55.95 57.60 1d8u s SER 14 Cb -0.15 -1.77 0.49 0.00 0.10 0.00 0.00 66.02 64.69 1d8u s SER 14 CO -0.11 -1.84 1.82 -0.08 0.98 0.00 0.00 173.24 174.01 1d8u h GLU 15 N -1.00 0.63 -0.29 4.02 4.81 -1.99 -1.68 114.58 119.07 1d8u h GLU 15 Ca -0.47 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 58.61 1d8u h GLU 15 Cb 1.29 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 1d8u h GLU 15 CO 0.63 0.65 0.15 0.93 -0.73 0.00 0.00 179.01 180.64 1d8u h GLU 16 N 0.59 0.41 -0.65 1.92 3.07 -1.99 0.14 114.58 118.08 1d8u h GLU 16 Ca 0.12 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 1d8u h GLU 16 Cb 0.39 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.19 1d8u h GLU 16 CO 0.01 0.37 0.42 1.96 -1.40 0.00 0.00 179.01 180.37 1d8u h GLN 17 N 0.34 0.87 -0.68 2.33 4.20 -1.84 0.10 115.11 120.44 1d8u h GLN 17 Ca 0.10 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 1d8u h GLN 17 Cb 0.09 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.64 1d8u h GLN 17 CO -0.01 0.59 0.30 1.49 -0.67 0.00 0.00 178.83 180.52 1d8u h GLU 18 N 0.88 1.00 -0.59 1.46 4.81 -1.06 -1.46 114.58 119.63 1d8u h GLU 18 Ca 0.24 -0.17 0.04 0.00 -0.13 0.00 0.00 59.36 59.34 1d8u h GLU 18 Cb -0.08 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.09 1d8u h GLU 18 CO -0.05 0.81 0.34 0.00 -0.73 0.00 0.00 179.01 179.38 1d8u h ALA 19 N 1.14 0.76 -0.59 2.92 0.00 0.19 0.31 119.26 123.98 1d8u h ALA 19 Ca 0.23 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.18 1d8u h ALA 19 Cb 0.17 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 1d8u h ALA 19 CO -0.02 0.04 0.34 -0.07 0.00 0.00 0.00 179.25 179.53 1d8u h LEU 20 N 0.65 0.53 -0.28 0.00 3.38 -0.27 0.37 115.31 119.68 1d8u h LEU 20 Ca 0.25 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.16 1d8u h LEU 20 Cb 0.08 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1d8u h LEU 20 CO -0.13 0.36 -0.10 0.58 0.09 0.00 0.00 178.44 179.24 1d8u h VAL 21 N 0.65 1.29 -0.45 1.22 2.07 -0.44 -2.65 116.25 117.95 1d8u h VAL 21 Ca 0.25 -1.16 -0.02 0.00 0.82 0.00 0.00 66.70 66.59 1d8u h VAL 21 Cb 0.09 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1d8u h VAL 21 CO -0.13 0.37 0.19 -0.07 0.02 0.00 0.00 177.57 177.94 1d8u h LEU 22 N 0.32 0.61 -0.55 2.57 3.38 0.04 0.24 115.31 121.92 1d8u h LEU 22 Ca 0.07 -0.16 -0.16 0.00 0.09 0.00 0.00 57.88 57.72 1d8u h LEU 22 Cb 0.60 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1d8u h LEU 22 CO 0.03 0.60 -0.71 0.07 0.09 0.00 0.00 178.44 178.53 1d8u h LYS 23 N 0.58 0.11 -0.19 1.13 2.10 -0.98 0.51 116.57 119.83 1d8u h LYS 23 Ca 0.15 -0.09 -0.22 0.00 -2.00 0.00 0.00 60.65 58.49 1d8u h LYS 23 Cb 0.18 0.02 0.01 0.00 -0.90 0.00 0.00 32.23 31.54 1d8u h LYS 23 CO -0.01 0.77 -0.73 0.66 -2.00 0.00 0.00 179.45 178.14 1d8u h SER 24 N 0.07 0.96 -0.75 7.07 4.64 -1.38 -2.35 113.55 121.81 1d8u h SER 24 Ca -0.01 -0.60 -0.06 0.00 -0.47 0.00 0.00 61.79 60.64 1d8u h SER 24 Cb 1.25 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 63.03 1d8u h SER 24 CO 0.10 1.40 0.22 -0.25 -0.87 0.00 0.00 176.83 177.44 1d8u h TRP 25 N 0.58 1.21 -0.48 4.77 -0.00 -0.85 -1.09 115.95 120.09 1d8u h TRP 25 Ca -0.04 -0.13 0.08 0.00 -0.00 0.00 0.00 58.89 58.80 1d8u h TRP 25 Cb 1.35 -0.35 -0.06 0.00 -0.00 0.00 0.00 29.16 30.10 1d8u h TRP 25 CO 0.08 0.96 0.11 0.00 -0.00 0.00 0.00 178.44 179.59 1d8u h ALA 26 N 1.12 0.54 -0.44 2.65 0.00 -0.73 0.10 119.26 122.50 1d8u h ALA 26 Ca 0.24 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 55.13 1d8u h ALA 26 Cb 0.32 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1d8u h ALA 26 CO -0.01 -0.30 -0.16 0.82 0.00 0.00 0.00 179.25 179.60 1d8u h ILE 27 N 0.25 1.27 -0.24 0.00 2.04 -0.99 -3.13 117.51 116.70 1d8u h ILE 27 Ca 0.24 -1.28 -0.07 0.00 1.00 0.00 0.00 64.86 64.75 1d8u h ILE 27 Cb 0.30 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 1d8u h ILE 27 CO -0.30 0.44 -0.14 -0.07 0.00 0.00 0.00 178.15 178.07 1d8u h LEU 28 N 0.75 0.39 -0.83 1.44 3.38 -0.04 -2.70 115.31 117.70 1d8u h LEU 28 Ca 0.11 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1d8u h LEU 28 Cb 0.68 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.29 1d8u h LEU 28 CO 0.05 0.56 0.45 0.11 0.09 0.00 0.00 178.44 179.70 1d8u h LYS 29 N 0.38 1.17 0.00 1.13 1.79 -0.79 -1.81 116.57 118.43 1d8u h LYS 29 Ca 0.07 -0.14 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 1d8u h LYS 29 Cb 0.48 -0.23 0.00 0.00 -1.58 0.00 0.00 32.23 30.90 1d8u h LYS 29 CO 0.03 0.87 0.05 1.63 -1.08 0.00 0.00 179.45 180.95 1d8u n LYS 30 N -4.38 0.00 -2.70 3.15 4.76 -1.02 -1.67 118.16 116.31 1d8u n LYS 30 Ca 0.08 0.12 -0.04 0.00 -2.87 0.00 0.00 58.31 55.60 1d8u n LYS 30 Cb 0.10 -1.55 0.11 0.00 -1.84 0.00 0.00 35.03 31.85 1d8u n LYS 30 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1d8u n ASP 31 N -1.03 -1.18 -0.20 4.39 -0.08 -0.71 -5.04 116.55 112.70 1d8u n ASP 31 Ca 0.00 -2.33 -0.10 0.00 -1.51 0.00 0.00 54.79 50.85 1d8u n ASP 31 Cb 0.05 0.64 -0.05 0.00 2.34 0.00 0.00 41.12 44.10 1d8u n ASP 31 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1d8u h SER 32 N 1.66 -1.60 -0.74 1.67 0.02 -1.02 -2.36 113.55 111.18 1d8u h SER 32 Ca -0.33 0.25 0.14 0.00 -0.84 0.00 0.00 61.79 61.01 1d8u h SER 32 Cb 1.29 0.71 -0.10 0.00 0.14 0.00 0.00 62.40 64.44 1d8u h SER 32 CO -0.07 -0.35 0.28 0.00 -1.14 0.00 0.00 176.83 175.56 1d8u h ALA 33 N 0.48 1.02 -0.34 3.77 0.00 -1.90 -1.25 119.26 121.04 1d8u h ALA 33 Ca 0.16 0.12 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 1d8u h ALA 33 Cb 0.56 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1d8u h ALA 33 CO -0.68 -0.23 -0.41 -0.91 0.00 0.00 0.00 179.25 177.02 1d8u h ASN 34 N 0.41 0.90 0.34 0.00 2.35 -1.84 -2.50 115.58 115.24 1d8u h ASN 34 Ca 0.40 -0.42 -0.19 0.00 -0.55 0.00 0.00 56.30 55.55 1d8u h ASN 34 Cb 0.62 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 1d8u h ASN 34 CO -0.41 1.19 -0.78 0.16 -1.65 0.00 0.00 177.43 175.94 1d8u h ILE 35 N 0.68 1.40 -0.69 2.81 3.07 -1.00 -1.82 117.51 121.96 1d8u h ILE 35 Ca 0.05 -2.26 -0.02 0.00 1.55 0.00 0.00 64.86 64.18 1d8u h ILE 35 Cb 0.98 2.21 -0.03 0.00 -0.27 0.00 0.00 36.82 39.72 1d8u h ILE 35 CO 0.09 0.67 0.34 0.00 -1.05 0.00 0.00 178.15 178.21 1d8u h ALA 36 N 0.94 0.89 0.31 0.16 0.00 -1.25 0.13 119.26 120.43 1d8u h ALA 36 Ca -0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1d8u h ALA 36 Cb 1.37 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1d8u h ALA 36 CO 0.13 0.44 -0.15 1.25 0.00 0.00 0.00 179.25 180.92 1d8u h LEU 37 N 0.96 -0.35 -1.10 0.00 5.85 -1.30 -1.64 115.31 117.73 1d8u h LEU 37 Ca 0.24 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.95 1d8u h LEU 37 Cb 0.10 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.17 1d8u h LEU 37 CO -0.03 -0.17 0.61 -0.09 -0.34 0.00 0.00 178.44 178.42 1d8u h ARG 38 N -0.51 1.11 -0.09 1.25 2.43 -1.11 -0.17 114.38 117.29 1d8u h ARG 38 Ca -0.04 -0.07 0.01 0.00 -0.81 0.00 0.00 59.98 59.07 1d8u h ARG 38 Cb 0.38 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1d8u h ARG 38 CO 0.07 0.74 0.03 0.35 -1.51 0.00 0.00 179.97 179.64 1d8u h PHE 39 N 1.15 0.05 -0.00 2.20 3.57 -0.50 -1.27 116.94 122.14 1d8u h PHE 39 Ca 0.38 0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.73 1d8u h PHE 39 Cb 0.06 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 1d8u h PHE 39 CO -0.00 0.03 -0.74 0.74 -2.23 0.00 0.00 178.31 176.11 1d8u h PHE 40 N 0.07 0.03 0.00 0.41 -1.00 -0.73 -2.32 116.94 113.39 1d8u h PHE 40 Ca 0.04 -0.01 -0.04 0.00 2.81 0.00 0.00 57.97 60.76 1d8u h PHE 40 Cb 0.02 -0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.57 1d8u h PHE 40 CO -0.10 0.75 -0.21 -0.07 -1.61 0.00 0.00 178.31 177.07 1d8u h LEU 41 N 0.01 0.00 -0.02 1.54 3.38 -0.85 -0.96 115.31 118.41 1d8u h LEU 41 Ca -0.01 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.70 1d8u h LEU 41 Cb 1.30 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.07 1d8u h LEU 41 CO 0.10 0.21 -1.06 0.50 0.09 0.00 0.00 178.44 178.28 1d8u h LYS 42 N 0.00 0.60 -0.19 1.13 1.63 -0.94 -1.96 116.57 116.84 1d8u h LYS 42 Ca -0.00 -0.68 -0.01 0.00 -0.85 0.00 0.00 60.65 59.11 1d8u h LYS 42 Cb 0.41 0.20 -0.01 0.00 -0.60 0.00 0.00 32.23 32.24 1d8u h LYS 42 CO 0.03 1.28 0.09 0.82 -3.45 0.00 0.00 179.45 178.21 1d8u h ILE 43 N 0.32 1.13 -0.35 2.00 2.04 -0.90 -1.43 117.51 120.32 1d8u h ILE 43 Ca -0.13 -0.38 -0.02 0.00 1.00 0.00 0.00 64.86 65.34 1d8u h ILE 43 Cb 1.72 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 38.82 1d8u h ILE 43 CO 0.20 0.13 0.15 0.15 0.00 0.00 0.00 178.15 178.77 1d8u h PHE 44 N 0.17 0.48 -0.27 1.37 3.04 -1.22 0.34 116.94 120.86 1d8u h PHE 44 Ca 0.06 -0.01 -0.09 0.00 3.98 0.00 0.00 57.97 61.91 1d8u h PHE 44 Cb 0.12 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 38.47 1d8u h PHE 44 CO -0.03 0.38 -0.20 1.49 -2.02 0.00 0.00 178.31 177.94 1d8u h GLU 45 N 0.49 0.61 0.03 1.11 4.81 -1.04 -2.59 114.58 118.00 1d8u h GLU 45 Ca 0.12 -0.29 -0.19 0.00 -0.13 0.00 0.00 59.36 58.87 1d8u h GLU 45 Cb 0.09 -0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.49 1d8u h GLU 45 CO -0.01 0.88 -0.77 0.28 -0.73 0.00 0.00 179.01 178.66 1d8u h VAL 46 N 0.33 1.40 -2.35 0.32 2.07 -0.82 -3.42 116.25 113.78 1d8u h VAL 46 Ca 0.05 -2.21 -0.55 0.00 0.82 0.00 0.00 66.70 64.81 1d8u h VAL 46 Cb 0.74 2.65 -0.37 0.00 -1.52 0.00 0.00 31.29 32.79 1d8u h VAL 46 CO 0.05 0.65 -0.89 0.00 0.02 0.00 0.00 177.57 177.40 1d8u s ALA 47 N -3.10 0.93 0.31 1.67 0.00 0.12 -4.98 121.76 116.70 1d8u s ALA 47 Ca -0.12 -2.03 0.07 0.00 0.00 0.00 0.00 51.96 49.88 1d8u s ALA 47 Cb 0.04 -1.68 0.80 0.00 0.00 0.00 0.00 23.12 22.28 1d8u s ALA 47 CO 0.85 -2.05 1.76 -1.35 0.00 0.00 0.00 175.76 174.97 1d8u h PRO 48 N 6.23 0.67 -0.14 0.00 0.11 -1.63 0.46 132.00 137.69 1d8u h PRO 48 Ca 0.17 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 66.28 1d8u h PRO 48 Cb 0.95 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.91 1d8u h PRO 48 CO 0.30 0.44 0.17 0.66 -0.21 0.00 0.00 178.00 179.36 1d8u h SER 49 N 0.69 0.00 0.50 -2.05 4.64 -1.92 -2.41 113.55 112.99 1d8u h SER 49 Ca 0.61 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.90 1d8u h SER 49 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1d8u h SER 49 CO -0.42 0.00 -0.24 0.00 -0.87 0.00 0.00 176.83 175.29 1d8u h ALA 50 N 1.79 -0.68 0.00 5.18 0.00 -0.41 -2.93 119.26 122.22 1d8u h ALA 50 Ca 0.06 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1d8u h ALA 50 Cb 0.40 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1d8u h ALA 50 CO -0.00 -0.67 0.07 0.77 0.00 0.00 0.00 179.25 179.42 1d8u h SER 51 N -1.10 0.00 0.62 0.00 0.02 -1.49 0.16 113.55 111.76 1d8u h SER 51 Ca -0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1d8u h SER 51 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 1d8u h SER 51 CO 0.11 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.80 1d8u n GLN 52 N -2.36 0.17 0.08 3.45 6.02 -0.99 -2.59 117.38 121.16 1d8u n GLN 52 Ca -0.02 0.08 0.13 0.00 -0.01 0.00 0.00 57.00 57.19 1d8u n GLN 52 Cb 0.11 -1.50 0.45 0.00 1.02 0.00 0.00 30.24 30.32 1d8u n GLN 52 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 1d8u n MET 53 N -1.39 0.20 -0.05 -1.09 2.81 0.57 -3.57 117.12 114.61 1d8u n MET 53 Ca 0.09 0.17 -0.10 0.00 -1.81 0.00 0.00 57.70 56.04 1d8u n MET 53 Cb 0.23 -1.74 -0.15 0.00 -0.71 0.00 0.00 33.22 30.86 1d8u n MET 53 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1d8u n PHE 54 N -2.09 0.70 -3.56 2.03 3.01 -1.07 -5.06 117.46 111.42 1d8u n PHE 54 Ca 0.06 0.24 0.00 0.00 1.01 0.00 0.00 57.45 58.76 1d8u n PHE 54 Cb 0.41 -1.13 0.00 0.00 -0.01 0.00 0.00 39.48 38.76 1d8u n PHE 54 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1d8u n SER 55 N -2.99 0.00 0.00 4.37 7.64 -1.23 -4.84 113.62 116.57 1d8u n SER 55 Ca -0.23 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.65 1d8u n SER 55 Cb 1.08 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.28 1d8u n SER 55 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 1d8u n PHE 56 N 1.92 0.00 -0.11 1.43 1.16 -1.26 -5.00 117.46 115.60 1d8u n PHE 56 Ca 0.00 0.00 -0.23 0.00 -1.87 0.00 0.00 57.45 55.35 1d8u n PHE 56 Cb 0.00 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 37.76 1d8u n PHE 56 CO 0.00 0.00 0.00 -0.11 -1.87 0.00 0.00 176.76 174.78 1d8u n LEU 57 N 0.00 1.91 -0.27 5.98 7.94 -1.26 -1.52 117.00 129.79 1d8u n LEU 57 Ca 0.00 0.39 -0.01 0.00 -1.11 0.00 0.00 56.01 55.29 1d8u n LEU 57 Cb 0.00 -0.94 0.11 0.00 0.53 0.00 0.00 43.42 43.12 1d8u n LEU 57 CO 0.00 0.36 1.14 -0.09 -1.11 0.00 0.00 177.39 177.69 1d8u h ARG 58 N -0.96 0.81 0.00 1.96 2.43 -1.98 -1.60 114.38 115.04 1d8u h ARG 58 Ca -0.42 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 58.67 1d8u h ARG 58 Cb 1.39 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.76 1d8u h ARG 58 CO -0.24 0.53 -1.02 -0.91 -1.51 0.00 0.00 179.97 176.82 1d8u h ASN 59 N 0.83 0.00 0.00 -3.80 4.21 -2.00 -3.47 115.58 111.36 1d8u h ASN 59 Ca 0.33 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.84 1d8u h ASN 59 Cb 0.16 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.36 1d8u h ASN 59 CO -0.17 0.11 0.00 -1.20 -1.29 0.00 0.00 177.43 174.88 1d8u n SER 60 N -2.74 -0.64 -4.56 5.81 7.64 -0.57 -4.87 113.62 113.69 1d8u n SER 60 Ca -0.01 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.64 1d8u n SER 60 Cb 0.60 -2.20 -0.06 0.00 -1.01 0.00 0.00 64.21 61.54 1d8u n SER 60 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1d8u s ASP 61 N -2.14 4.63 0.06 6.43 1.01 -1.20 -4.84 116.67 120.62 1d8u s ASP 61 Ca 0.00 -0.60 -0.34 0.00 0.71 0.00 0.00 52.55 52.32 1d8u s ASP 61 Cb 0.00 -2.56 -0.18 0.00 1.01 0.00 0.00 42.92 41.18 1d8u s ASP 61 CO 0.00 -3.27 1.51 0.58 0.21 0.00 0.00 175.17 174.20 1d8u h VAL 62 N 7.23 0.00 -2.26 -1.27 2.07 -1.89 -3.39 116.25 116.74 1d8u h VAL 62 Ca 0.08 0.00 -0.61 0.00 0.82 0.00 0.00 66.70 66.99 1d8u h VAL 62 Cb 1.00 0.00 0.13 0.00 -1.52 0.00 0.00 31.29 30.90 1d8u h VAL 62 CO 1.14 0.00 -0.28 -2.65 0.02 0.00 0.00 177.57 175.80 1d8u n PRO 63 N -5.30 0.71 -0.24 1.57 -0.02 -1.26 -4.84 135.00 125.61 1d8u n PRO 63 Ca -0.15 0.25 -0.08 0.00 -2.02 0.00 0.00 63.50 61.51 1d8u n PRO 63 Cb 0.48 -1.55 0.04 0.00 -0.02 0.00 0.00 33.50 32.45 1d8u n PRO 63 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1d8u h LEU 64 N 1.10 1.08 -2.34 2.45 3.38 -1.97 -2.52 115.31 116.49 1d8u h LEU 64 Ca -0.39 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.34 1d8u h LEU 64 Cb 1.39 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 1d8u h LEU 64 CO 0.54 1.06 0.21 -0.33 0.09 0.00 0.00 178.44 180.01 1d8u h GLU 65 N 1.05 0.00 -0.14 1.13 3.07 -1.95 -1.53 114.58 116.22 1d8u h GLU 65 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 1d8u h GLU 65 Cb 0.43 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 1d8u h GLU 65 CO 0.01 0.00 0.00 1.63 -1.40 0.00 0.00 179.01 179.25 1d8u n LYS 66 N -3.22 2.70 -2.71 2.33 5.02 -0.97 -4.93 118.16 116.39 1d8u n LYS 66 Ca -0.01 -2.01 -0.42 0.00 -2.02 0.00 0.00 58.31 53.86 1d8u n LYS 66 Cb 0.29 -1.27 -0.03 0.00 -0.02 0.00 0.00 35.03 34.00 1d8u n LYS 66 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1d8u s ASN 67 N -1.39 6.22 0.25 4.39 3.84 -0.58 -4.77 114.94 122.91 1d8u s ASN 67 Ca 0.17 -0.86 -0.02 0.00 0.21 0.00 0.00 52.86 52.36 1d8u s ASN 67 Cb 0.12 -2.49 0.51 0.00 -0.55 0.00 0.00 41.25 38.84 1d8u s ASN 67 CO 0.07 -1.59 1.74 -0.65 -2.79 0.00 0.00 177.10 173.88 1d8u h PRO 68 N 9.73 0.50 -0.99 0.43 0.11 -1.91 0.46 132.00 140.34 1d8u h PRO 68 Ca -0.22 -0.03 0.19 0.00 0.11 0.00 0.00 66.00 66.05 1d8u h PRO 68 Cb 1.05 -0.11 -0.11 0.00 0.11 0.00 0.00 31.00 31.94 1d8u h PRO 68 CO 1.24 0.33 0.59 0.87 -0.21 0.00 0.00 178.00 180.82 1d8u h LYS 69 N 0.51 0.70 -0.40 1.05 1.57 -1.95 -0.41 116.57 117.66 1d8u h LYS 69 Ca 0.44 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.17 1d8u h LYS 69 Cb 0.67 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 1d8u h LYS 69 CO -0.39 0.47 0.22 -0.07 -0.57 0.00 0.00 179.45 179.10 1d8u h LEU 70 N 0.73 0.49 -0.10 2.94 3.38 -1.26 0.43 115.31 121.92 1d8u h LEU 70 Ca 0.58 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.44 1d8u h LEU 70 Cb 0.91 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 1d8u h LEU 70 CO -0.40 0.43 -0.02 0.11 0.09 0.00 0.00 178.44 178.66 1d8u h LYS 71 N 0.51 0.18 -0.39 1.13 1.57 -1.16 0.11 116.57 118.53 1d8u h LYS 71 Ca 0.14 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1d8u h LYS 71 Cb 0.05 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1d8u h LYS 71 CO -0.02 0.48 0.23 1.15 -0.57 0.00 0.00 179.45 180.72 1d8u h THR 72 N -0.14 1.13 -0.49 -0.16 2.02 -1.03 -1.65 112.91 112.59 1d8u h THR 72 Ca 0.02 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 66.88 1d8u h THR 72 Cb 0.41 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1d8u h THR 72 CO 0.01 0.13 0.17 -0.74 0.37 0.00 0.00 175.52 175.45 1d8u h HIS 73 N 0.51 0.77 -0.50 3.16 -0.00 -0.05 -1.16 115.15 117.87 1d8u h HIS 73 Ca 0.14 -0.07 0.06 0.00 -0.00 0.00 0.00 60.37 60.50 1d8u h HIS 73 Cb 0.00 -0.22 -0.05 0.00 -0.00 0.00 0.00 27.41 27.13 1d8u h HIS 73 CO -0.04 0.66 0.21 0.00 -0.00 0.00 0.00 177.93 178.77 1d8u h ALA 74 N 1.02 0.63 -0.55 5.26 0.00 -0.49 -1.72 119.26 123.42 1d8u h ALA 74 Ca 0.16 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1d8u h ALA 74 Cb 0.24 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1d8u h ALA 74 CO -0.01 -0.17 0.08 0.52 0.00 0.00 0.00 179.25 179.68 1d8u h MET 75 N 0.41 0.87 -0.71 0.00 2.86 -1.09 -2.55 114.93 114.72 1d8u h MET 75 Ca 0.23 -0.21 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 1d8u h MET 75 Cb 0.21 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.72 1d8u h MET 75 CO -0.21 0.82 0.21 0.77 1.06 0.00 0.00 176.91 179.55 1d8u h SER 76 N 0.83 1.03 -0.29 1.22 0.02 -0.45 0.14 113.55 116.05 1d8u h SER 76 Ca 0.17 -0.20 -0.03 0.00 -0.84 0.00 0.00 61.79 60.89 1d8u h SER 76 Cb 0.37 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 1d8u h SER 76 CO 0.01 0.97 0.05 0.58 -1.14 0.00 0.00 176.83 177.30 1d8u h VAL 77 N 1.05 1.23 0.84 2.27 2.07 -1.11 -0.20 116.25 122.40 1d8u h VAL 77 Ca 0.23 -0.77 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 1d8u h VAL 77 Cb 0.31 1.17 0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1d8u h VAL 77 CO -0.01 0.25 -0.40 -0.26 0.02 0.00 0.00 177.57 177.17 1d8u h PHE 78 N 0.30 -1.05 -0.47 1.57 0.04 -1.21 -0.36 116.94 115.76 1d8u h PHE 78 Ca 0.09 -0.02 0.08 0.00 2.80 0.00 0.00 57.97 60.91 1d8u h PHE 78 Cb 0.32 0.35 -0.07 0.00 2.20 0.00 0.00 35.95 38.75 1d8u h PHE 78 CO 0.02 -0.65 0.09 0.28 -0.60 0.00 0.00 178.31 177.45 1d8u h VAL 79 N -1.23 0.74 -0.00 -0.55 2.07 -0.76 0.32 116.25 116.84 1d8u h VAL 79 Ca -0.12 -0.08 -0.12 0.00 0.82 0.00 0.00 66.70 67.21 1d8u h VAL 79 Cb 0.87 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1d8u h VAL 79 CO 0.19 0.04 -0.55 0.24 0.02 0.00 0.00 177.57 177.51 1d8u h MET 80 N 0.23 0.01 -0.23 1.57 2.86 -1.08 0.50 114.93 118.80 1d8u h MET 80 Ca 0.24 -0.01 -0.19 0.00 -2.06 0.00 0.00 59.70 57.68 1d8u h MET 80 Cb 0.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.97 1d8u h MET 80 CO -0.31 0.56 -0.59 1.15 1.06 0.00 0.00 176.91 178.78 1d8u h THR 81 N 0.01 1.29 -0.29 2.22 2.02 -0.07 -0.51 112.91 117.58 1d8u h THR 81 Ca -0.01 -1.79 -0.06 0.00 0.77 0.00 0.00 66.41 65.32 1d8u h THR 81 Cb 0.98 1.80 -0.02 0.00 -1.74 0.00 0.00 68.15 69.17 1d8u h THR 81 CO 0.07 0.57 -0.08 0.00 0.37 0.00 0.00 175.52 176.46 1d8u h GLU 83 N 0.44 0.30 -0.36 0.00 5.08 -0.73 -2.93 114.58 116.39 1d8u h GLU 83 Ca 0.09 -0.28 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 1d8u h GLU 83 Cb 0.42 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1d8u h GLU 83 CO 0.02 0.95 0.02 0.00 -1.00 0.00 0.00 179.01 179.00 1d8u h ALA 84 N 0.96 1.36 -0.02 3.43 0.00 -0.51 0.14 119.26 124.62 1d8u h ALA 84 Ca -0.04 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1d8u h ALA 84 Cb 1.39 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1d8u h ALA 84 CO 0.13 0.45 0.01 0.00 0.00 0.00 0.00 179.25 179.83 1d8u h ALA 85 N 1.49 0.02 -0.99 0.00 0.00 -1.19 0.83 119.26 119.42 1d8u h ALA 85 Ca 0.12 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1d8u h ALA 85 Cb 0.32 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 1d8u h ALA 85 CO 0.01 -0.37 0.65 0.00 0.00 0.00 0.00 179.25 179.54 1d8u h ALA 86 N 0.80 1.29 -0.37 0.00 0.00 -1.25 -0.47 119.26 119.26 1d8u h ALA 86 Ca 0.01 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 1d8u h ALA 86 Cb 0.21 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1d8u h ALA 86 CO -0.00 0.58 -0.29 1.96 0.00 0.00 0.00 179.25 181.50 1d8u h GLN 87 N 1.29 0.80 -0.53 0.00 4.20 -0.53 -0.20 115.11 120.13 1d8u h GLN 87 Ca 0.38 -0.36 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 1d8u h GLN 87 Cb -0.06 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 1d8u h GLN 87 CO -0.11 0.98 0.00 -0.07 -0.67 0.00 0.00 178.83 178.97 1d8u h LEU 88 N 0.68 0.87 -0.34 1.46 3.38 -0.24 0.34 115.31 121.47 1d8u h LEU 88 Ca 0.08 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1d8u h LEU 88 Cb 0.82 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1d8u h LEU 88 CO 0.07 0.93 0.04 -0.09 0.09 0.00 0.00 178.44 179.48 1d8u h ARG 89 N 0.84 0.58 0.16 1.13 9.65 -0.86 -0.85 114.38 125.03 1d8u h ARG 89 Ca 0.16 -0.16 -0.35 0.00 -1.10 0.00 0.00 59.98 58.52 1d8u h ARG 89 Cb 0.49 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 29.01 1d8u h ARG 89 CO 0.02 0.67 -1.81 -0.22 2.80 0.00 0.00 179.97 181.44 1d8u h LYS 90 N 0.40 0.35 0.00 0.20 3.64 -0.90 -3.41 116.57 116.84 1d8u h LYS 90 Ca 0.10 -0.59 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1d8u h LYS 90 Cb 0.39 0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1d8u h LYS 90 CO 0.01 1.28 -1.27 0.00 -2.27 0.00 0.00 179.45 177.20 1d8u n ALA 91 N -2.92 2.80 -0.87 5.00 0.00 0.12 -5.00 120.51 119.64 1d8u n ALA 91 Ca -0.27 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 52.86 1d8u n ALA 91 Cb 1.06 -0.43 0.00 0.00 0.00 0.00 0.00 19.45 20.07 1d8u n ALA 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1d8u n GLY 92 N 1.64 0.51 3.55 0.00 0.00 -0.32 -4.99 105.19 105.58 1d8u n GLY 92 Ca -0.01 -0.47 -0.08 0.00 0.00 0.00 0.00 46.02 45.46 1d8u n GLY 92 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1d8u s LYS 93 N -0.92 0.63 0.24 1.61 -2.85 -1.25 -4.24 119.74 112.97 1d8u s LYS 93 Ca 0.00 -0.12 -0.30 0.00 -1.00 0.00 0.00 55.97 54.55 1d8u s LYS 93 Cb 0.00 0.29 -0.10 0.00 -2.06 0.00 0.00 37.83 35.97 1d8u s LYS 93 CO 0.00 -0.25 1.39 0.08 0.10 0.00 0.00 175.35 176.67 1d8u s VAL 94 N -2.30 2.83 -0.57 1.79 1.01 -1.26 -3.96 120.40 117.94 1d8u s VAL 94 Ca 0.04 0.70 0.06 0.00 0.00 0.00 0.00 61.98 62.78 1d8u s VAL 94 Cb -0.01 -3.45 0.29 0.00 0.00 0.00 0.00 36.38 33.21 1d8u s VAL 94 CO -0.05 0.11 0.78 0.35 0.00 0.00 0.00 175.10 176.30 1d8u n THR 95 N 2.30 2.01 -3.31 3.92 -2.24 -1.26 -5.05 114.28 110.65 1d8u n THR 95 Ca 0.06 -5.14 -0.38 0.00 -2.27 0.00 0.00 64.05 56.32 1d8u n THR 95 Cb 0.41 -1.71 -0.06 0.00 -2.10 0.00 0.00 70.33 66.87 1d8u n THR 95 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1d8u s VAL 96 N -2.95 5.10 0.06 2.28 1.01 -1.26 -4.99 120.40 119.65 1d8u s VAL 96 Ca 0.42 1.02 -0.38 0.00 0.00 0.00 0.00 61.98 63.04 1d8u s VAL 96 Cb 0.21 -3.83 -0.18 0.00 0.00 0.00 0.00 36.38 32.57 1d8u s VAL 96 CO -0.07 0.38 1.16 0.54 0.00 0.00 0.00 175.10 177.12 1d8u n ARG 97 N 3.18 0.55 -0.32 2.72 1.74 -1.26 -4.63 116.66 118.64 1d8u n ARG 97 Ca -0.08 0.20 0.10 0.00 -0.77 0.00 0.00 57.85 57.30 1d8u n ARG 97 Cb 0.52 -1.73 0.22 0.00 -1.02 0.00 0.00 32.46 30.45 1d8u n ARG 97 CO 0.00 0.00 0.00 0.22 -1.52 0.00 0.00 177.63 176.33 1d8u h ASP 98 N 3.57 -0.50 -0.68 0.55 -0.00 -2.00 0.33 116.42 117.68 1d8u h ASP 98 Ca -0.48 0.25 -0.07 0.00 -0.00 0.00 0.00 57.03 56.73 1d8u h ASP 98 Cb 1.39 0.46 -0.03 0.00 -0.00 0.00 0.00 39.33 41.14 1d8u h ASP 98 CO 0.70 -0.29 0.17 0.71 -0.00 0.00 0.00 179.24 180.53 1d8u h THR 99 N 0.04 1.26 -0.52 2.25 1.35 -2.00 -1.89 112.91 113.41 1d8u h THR 99 Ca 0.52 -0.96 -0.08 0.00 -0.55 0.00 0.00 66.41 65.34 1d8u h THR 99 Cb 0.99 0.55 -0.02 0.00 -1.73 0.00 0.00 68.15 67.93 1d8u h THR 99 CO -0.85 0.37 0.02 0.74 -0.25 0.00 0.00 175.52 175.55 1d8u h THR 100 N 1.05 1.25 -0.29 6.82 2.02 -0.75 -1.47 112.91 121.53 1d8u h THR 100 Ca 0.22 -1.01 -0.14 0.00 0.77 0.00 0.00 66.41 66.25 1d8u h THR 100 Cb 0.37 0.83 -0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1d8u h THR 100 CO 0.00 0.36 -0.35 -0.07 0.37 0.00 0.00 175.52 175.83 1d8u h LEU 101 N 0.80 0.82 -1.05 2.58 3.38 -0.91 -1.57 115.31 119.37 1d8u h LEU 101 Ca 0.16 -0.49 0.01 0.00 0.09 0.00 0.00 57.88 57.65 1d8u h LEU 101 Cb 0.45 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 1d8u h LEU 101 CO 0.02 1.14 0.64 0.11 0.09 0.00 0.00 178.44 180.45 1d8u h LYS 102 N 0.51 1.28 -0.20 1.13 1.79 -1.20 0.22 116.57 120.10 1d8u h LYS 102 Ca 0.04 -0.08 -0.12 0.00 -2.18 0.00 0.00 60.65 58.32 1d8u h LYS 102 Cb 0.93 -0.29 -0.01 0.00 -1.58 0.00 0.00 32.23 31.28 1d8u h LYS 102 CO 0.08 0.85 -0.37 -0.09 -1.08 0.00 0.00 179.45 178.84 1d8u h ARG 103 N 1.32 0.45 -0.10 3.15 2.43 -1.11 -1.78 114.38 118.74 1d8u h ARG 103 Ca 0.36 -0.21 -0.20 0.00 -0.81 0.00 0.00 59.98 59.12 1d8u h ARG 103 Cb -0.15 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 1d8u h ARG 103 CO -0.08 0.75 -0.77 -0.07 -1.51 0.00 0.00 179.97 178.29 1d8u h LEU 104 N 0.38 0.66 0.05 3.80 3.38 -0.21 -1.84 115.31 121.53 1d8u h LEU 104 Ca 0.04 -0.44 -0.00 0.00 0.09 0.00 0.00 57.88 57.56 1d8u h LEU 104 Cb 0.82 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1d8u h LEU 104 CO 0.07 1.21 -0.02 1.23 0.09 0.00 0.00 178.44 181.01 1d8u h GLY 105 N 1.00 -0.07 0.75 0.83 0.00 -0.48 -1.77 103.07 103.33 1d8u h GLY 105 Ca -0.04 0.03 0.03 0.00 0.00 0.00 0.00 47.33 47.34 1d8u h GLY 105 CO 0.14 -0.03 0.08 0.00 0.00 0.00 0.00 176.54 176.73 1d8u h ALA 106 N 0.67 0.29 -0.22 3.60 0.00 -1.35 -1.12 119.26 121.13 1d8u h ALA 106 Ca -0.01 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1d8u h ALA 106 Cb 0.24 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1d8u h ALA 106 CO 0.01 -0.33 0.14 1.15 0.00 0.00 0.00 179.25 180.22 1d8u h THR 107 N 0.19 1.06 -0.09 0.00 2.02 -1.25 0.85 112.91 115.70 1d8u h THR 107 Ca 0.12 -0.13 -0.14 0.00 0.77 0.00 0.00 66.41 67.04 1d8u h THR 107 Cb 0.10 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1d8u h THR 107 CO -0.13 0.06 -0.54 0.45 0.37 0.00 0.00 175.52 175.72 1d8u h HIS 108 N 0.29 0.32 -0.44 3.16 3.86 -1.20 -2.42 115.15 118.72 1d8u h HIS 108 Ca 0.08 -0.11 -0.12 0.00 -1.16 0.00 0.00 60.37 59.06 1d8u h HIS 108 Cb -0.02 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.38 1d8u h HIS 108 CO -0.06 0.74 -0.19 1.25 0.86 0.00 0.00 177.93 180.54 1d8u h LEU 109 N 0.20 0.93 -2.53 2.43 5.85 -1.01 -1.20 115.31 119.98 1d8u h LEU 109 Ca 0.00 -0.39 -0.00 0.00 0.84 0.00 0.00 57.88 58.33 1d8u h LEU 109 Cb 1.02 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.80 1d8u h LEU 109 CO 0.09 1.11 -0.01 0.50 -0.34 0.00 0.00 178.44 179.79 1d8u h LYS 110 N 0.74 0.00 -0.61 1.25 3.64 -0.61 -1.82 116.57 119.16 1d8u h LYS 110 Ca 0.10 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1d8u h LYS 110 Cb 0.75 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1d8u h LYS 110 CO 0.06 0.01 0.00 0.66 -2.27 0.00 0.00 179.45 177.91 1d8u n TYR 111 N -3.71 0.81 -2.06 1.91 4.02 -0.93 -4.96 117.16 112.24 1d8u n TYR 111 Ca -0.03 -0.47 -0.14 0.00 -0.01 0.00 0.00 57.90 57.25 1d8u n TYR 111 Cb 0.09 -0.01 -0.02 0.00 -0.02 0.00 0.00 39.34 39.38 1d8u n TYR 111 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1d8u n GLY 112 N 1.38 0.19 3.66 2.72 0.00 -0.68 -4.95 105.19 107.50 1d8u n GLY 112 Ca 0.21 -0.32 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 1d8u n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d8u s VAL 113 N -2.65 4.13 0.00 1.61 1.01 -0.49 -5.00 120.40 119.01 1d8u s VAL 113 Ca 0.00 1.37 0.00 0.00 0.00 0.00 0.00 61.98 63.35 1d8u s VAL 113 Cb 0.00 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1d8u s VAL 113 CO 0.00 -0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.59 1d8u n GLY 114 N 3.72 3.63 0.18 4.51 0.00 -1.26 -4.73 105.19 111.24 1d8u n GLY 114 Ca 0.15 -2.19 -0.06 0.00 0.00 0.00 0.00 46.02 43.92 1d8u n GLY 114 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1d8u h ASP 115 N 0.00 0.36 -0.77 1.61 3.45 -2.00 -2.10 116.42 116.97 1d8u h ASP 115 Ca 0.00 0.01 0.01 0.00 0.43 0.00 0.00 57.03 57.49 1d8u h ASP 115 Cb 0.00 -0.06 -0.04 0.00 -0.56 0.00 0.00 39.33 38.67 1d8u h ASP 115 CO 0.00 0.26 0.51 0.00 -1.57 0.00 0.00 179.24 178.44 1d8u h ALA 116 N 1.21 1.47 -0.08 3.45 0.00 -1.98 -0.67 119.26 122.65 1d8u h ALA 116 Ca 0.18 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1d8u h ALA 116 Cb 0.05 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 1d8u h ALA 116 CO -0.10 0.48 0.02 0.45 0.00 0.00 0.00 179.25 180.10 1d8u h HIS 117 N 1.02 0.13 -0.93 0.00 3.86 -1.84 0.47 115.15 117.86 1d8u h HIS 117 Ca 0.29 -0.01 0.04 0.00 -1.16 0.00 0.00 60.37 59.52 1d8u h HIS 117 Cb -0.08 -0.04 -0.05 0.00 1.06 0.00 0.00 27.41 28.30 1d8u h HIS 117 CO -0.00 0.29 0.61 0.74 0.86 0.00 0.00 177.93 180.43 1d8u h PHE 118 N -0.07 1.13 -0.36 2.45 -1.00 -0.99 -0.67 116.94 117.43 1d8u h PHE 118 Ca 0.03 0.03 -0.12 0.00 2.81 0.00 0.00 57.97 60.71 1d8u h PHE 118 Cb 0.22 -0.38 -0.01 0.00 3.61 0.00 0.00 35.95 39.40 1d8u h PHE 118 CO -0.00 0.65 -0.24 0.93 -1.61 0.00 0.00 178.31 178.04 1d8u h GLU 119 N 1.17 0.80 -0.64 1.51 5.08 -0.88 -1.44 114.58 120.18 1d8u h GLU 119 Ca 0.37 -0.38 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 1d8u h GLU 119 Cb 0.03 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1d8u h GLU 119 CO -0.12 1.01 0.23 0.28 -1.00 0.00 0.00 179.01 179.41 1d8u h VAL 120 N 0.58 1.24 -0.85 3.13 2.07 -0.48 0.14 116.25 122.08 1d8u h VAL 120 Ca 0.07 -0.79 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 1d8u h VAL 120 Cb 0.80 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1d8u h VAL 120 CO 0.07 0.31 0.43 0.58 0.02 0.00 0.00 177.57 178.97 1d8u h VAL 121 N 0.90 1.26 -0.20 2.57 2.07 -1.01 0.11 116.25 121.95 1d8u h VAL 121 Ca 0.21 -0.69 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1d8u h VAL 121 Cb 0.25 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 1d8u h VAL 121 CO -0.01 0.30 0.06 0.50 0.02 0.00 0.00 177.57 178.44 1d8u h LYS 122 N 1.21 0.31 -0.84 1.57 3.64 -0.81 0.15 116.57 121.79 1d8u h LYS 122 Ca 0.29 -0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.67 1d8u h LYS 122 Cb 0.09 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 31.80 1d8u h LYS 122 CO -0.04 0.41 0.52 0.35 -2.27 0.00 0.00 179.45 178.42 1d8u h PHE 123 N 0.15 0.96 -0.19 1.91 3.57 -0.36 -0.53 116.94 122.46 1d8u h PHE 123 Ca 0.06 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.46 1d8u h PHE 123 Cb 0.22 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.64 1d8u h PHE 123 CO -0.00 0.49 -0.45 0.00 -2.23 0.00 0.00 178.31 176.12 1d8u h ALA 124 N 1.40 0.86 0.31 2.41 0.00 -0.26 -1.28 119.26 122.70 1d8u h ALA 124 Ca 0.37 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1d8u h ALA 124 Cb 0.17 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1d8u h ALA 124 CO -0.17 0.65 -0.15 1.25 0.00 0.00 0.00 179.25 180.83 1d8u h LEU 125 N 0.39 -0.35 -0.83 0.00 5.85 0.06 -0.70 115.31 119.74 1d8u h LEU 125 Ca 0.03 -0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.66 1d8u h LEU 125 Cb 0.94 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.02 1d8u h LEU 125 CO 0.08 -0.10 0.54 -0.07 -0.34 0.00 0.00 178.44 178.55 1d8u h LEU 126 N -0.60 0.92 -0.66 2.25 3.38 -1.10 -0.85 115.31 118.66 1d8u h LEU 126 Ca -0.04 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1d8u h LEU 126 Cb 0.43 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1d8u h LEU 126 CO 0.07 0.65 0.20 -0.78 0.09 0.00 0.00 178.44 178.67 1d8u h ASP 127 N 1.08 0.96 -0.59 -0.43 3.58 -1.18 -1.70 116.42 118.14 1d8u h ASP 127 Ca 0.32 -0.21 -0.08 0.00 0.42 0.00 0.00 57.03 57.48 1d8u h ASP 127 Cb -0.07 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 40.71 1d8u h ASP 127 CO -0.09 0.92 0.07 0.74 -2.88 0.00 0.00 179.24 178.00 1d8u h THR 128 N 0.95 1.26 -0.29 2.25 2.02 -0.46 -1.13 112.91 117.51 1d8u h THR 128 Ca 0.21 -1.03 -0.05 0.00 0.77 0.00 0.00 66.41 66.30 1d8u h THR 128 Cb 0.30 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1d8u h THR 128 CO -0.01 0.38 -0.02 0.40 0.37 0.00 0.00 175.52 176.64 1d8u h ILE 129 N 0.89 1.27 -0.67 3.11 2.04 -1.02 -1.09 117.51 122.03 1d8u h ILE 129 Ca 0.17 -0.99 0.01 0.00 1.00 0.00 0.00 64.86 65.06 1d8u h ILE 129 Cb 0.46 1.33 -0.04 0.00 -0.74 0.00 0.00 36.82 37.83 1d8u h ILE 129 CO 0.02 0.32 0.44 0.50 0.00 0.00 0.00 178.15 179.42 1d8u h LYS 130 N 0.31 0.86 0.00 2.37 3.64 -1.24 -0.69 116.57 121.81 1d8u h LYS 130 Ca 0.08 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.34 1d8u h LYS 130 Cb 0.47 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 1d8u h LYS 130 CO 0.02 0.57 -0.32 1.49 -2.27 0.00 0.00 179.45 178.93 1d8u h GLU 131 N 0.88 0.00 0.00 1.90 4.57 -1.08 -3.34 114.58 117.52 1d8u h GLU 131 Ca 0.25 0.00 -0.32 0.00 -1.18 0.00 0.00 59.36 58.11 1d8u h GLU 131 Cb -0.07 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 28.46 1d8u h GLU 131 CO -0.07 0.32 -2.00 0.39 -1.18 0.00 0.00 179.01 176.47 1d8u n GLU 132 N -3.92 0.66 -3.21 1.92 -0.58 -0.42 -4.95 120.64 110.13 1d8u n GLU 132 Ca -0.02 0.15 -0.31 0.00 -0.42 0.00 0.00 57.16 56.57 1d8u n GLU 132 Cb 0.39 -1.67 -0.04 0.00 -0.57 0.00 0.00 31.44 29.55 1d8u n GLU 132 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 1d8u s VAL 133 N -2.57 4.89 0.45 2.62 -7.23 -0.34 -4.97 120.40 113.25 1d8u s VAL 133 Ca -0.07 0.44 -0.25 0.00 -1.81 0.00 0.00 61.98 60.29 1d8u s VAL 133 Cb 0.07 -3.68 -0.08 0.00 0.56 0.00 0.00 36.38 33.25 1d8u s VAL 133 CO 0.83 -0.28 1.39 -0.81 -0.31 0.00 0.00 175.10 175.92 1d8u n PRO 134 N -0.71 2.13 -0.01 4.82 -0.04 -1.26 -4.78 135.00 135.15 1d8u n PRO 134 Ca 0.01 0.76 0.23 0.00 -0.04 0.00 0.00 63.50 64.46 1d8u n PRO 134 Cb 0.53 -2.57 0.72 0.00 -0.04 0.00 0.00 33.50 32.15 1d8u n PRO 134 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1d8u h ALA 135 N 2.18 2.44 0.00 0.55 0.00 -1.93 0.15 119.26 122.64 1d8u h ALA 135 Ca -0.50 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1d8u h ALA 135 Cb 1.28 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1d8u h ALA 135 CO 0.60 -0.80 0.00 0.38 0.00 0.00 0.00 179.25 179.43 1d8u h ASP 136 N 0.00 0.00 0.00 0.00 3.04 -2.02 -3.23 116.42 114.22 1d8u h ASP 136 Ca 0.28 0.00 -0.04 0.00 -3.24 0.00 0.00 57.03 54.03 1d8u h ASP 136 Cb 1.27 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.55 1d8u h ASP 136 CO -0.00 0.00 -1.58 1.15 -2.04 0.00 0.00 179.24 176.77 1d8u n MET 137 N -2.59 0.72 -2.22 4.15 0.00 0.49 -4.98 117.12 112.70 1d8u n MET 137 Ca 0.01 -0.09 -0.37 0.00 0.00 0.00 0.00 57.70 57.26 1d8u n MET 137 Cb 0.26 -1.28 -0.00 0.00 0.00 0.00 0.00 33.22 32.20 1d8u n MET 137 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 175.97 175.51 1d8u s TRP 138 N -2.71 2.77 0.01 3.17 -0.11 -1.03 -4.85 118.94 116.20 1d8u s TRP 138 Ca -0.04 1.53 -0.29 0.00 1.22 0.00 0.00 56.10 58.52 1d8u s TRP 138 Cb 0.07 -3.38 0.10 0.00 -1.50 0.00 0.00 33.47 28.76 1d8u s TRP 138 CO 0.48 -1.62 0.98 -1.54 -4.62 0.00 0.00 176.95 170.63 1d8u s SER 139 N -1.46 -0.26 0.39 5.86 1.04 -1.26 -4.97 113.70 113.04 1d8u s SER 139 Ca 0.67 -0.11 0.07 0.00 0.48 0.00 0.00 55.95 57.07 1d8u s SER 139 Cb -0.28 0.36 0.82 0.00 0.10 0.00 0.00 66.02 67.02 1d8u s SER 139 CO 0.33 -0.61 2.00 -0.65 0.98 0.00 0.00 173.24 175.30 1d8u h PRO 140 N 2.00 0.62 -0.69 4.02 0.11 -1.99 -1.37 132.00 134.69 1d8u h PRO 140 Ca -0.21 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 1d8u h PRO 140 Cb 1.23 -0.14 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 1d8u h PRO 140 CO 0.28 0.41 0.40 0.00 -0.21 0.00 0.00 178.00 178.88 1d8u h ALA 141 N 1.67 0.89 -0.53 -0.75 0.00 -1.97 0.35 119.26 118.92 1d8u h ALA 141 Ca 0.24 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 1d8u h ALA 141 Cb 0.17 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1d8u h ALA 141 CO -0.07 0.38 -0.12 1.98 0.00 0.00 0.00 179.25 181.42 1d8u h MET 142 N 0.95 1.03 -0.35 0.00 1.85 -1.67 -0.86 114.93 115.87 1d8u h MET 142 Ca 0.25 -0.39 0.01 0.00 -0.61 0.00 0.00 59.70 58.96 1d8u h MET 142 Cb 0.00 -0.06 -0.02 0.00 0.43 0.00 0.00 31.60 31.95 1d8u h MET 142 CO -0.04 1.08 0.22 -0.22 -0.40 0.00 0.00 176.91 177.55 1d8u h LYS 143 N 0.90 0.44 -0.25 0.39 3.64 -0.76 -2.49 116.57 118.44 1d8u h LYS 143 Ca 0.14 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 1d8u h LYS 143 Cb 0.69 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 1d8u h LYS 143 CO 0.05 0.29 -0.19 0.77 -2.27 0.00 0.00 179.45 178.11 1d8u h SER 144 N 0.45 0.44 -0.29 4.20 0.02 -0.78 -1.37 113.55 116.22 1d8u h SER 144 Ca 0.13 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1d8u h SER 144 Cb -0.03 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 1d8u h SER 144 CO -0.05 0.64 0.10 0.00 -1.14 0.00 0.00 176.83 176.39 1d8u h ALA 145 N 1.40 0.38 -0.66 3.77 0.00 -0.79 -0.28 119.26 123.09 1d8u h ALA 145 Ca 0.07 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1d8u h ALA 145 Cb 0.56 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1d8u h ALA 145 CO 0.04 0.01 0.19 -1.49 0.00 0.00 0.00 179.25 177.99 1d8u h TRP 146 N 0.32 1.08 -0.55 0.00 4.06 -1.33 -2.13 115.95 117.40 1d8u h TRP 146 Ca 0.10 -0.12 -0.03 0.00 2.06 0.00 0.00 58.89 60.90 1d8u h TRP 146 Cb 0.22 -0.31 -0.02 0.00 -1.00 0.00 0.00 29.16 28.05 1d8u h TRP 146 CO 0.00 0.88 0.22 0.77 -3.56 0.00 0.00 178.44 176.75 1d8u h SER 147 N 0.96 0.75 -0.32 -3.49 0.02 -0.94 0.09 113.55 110.62 1d8u h SER 147 Ca 0.21 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1d8u h SER 147 Cb 0.32 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1d8u h SER 147 CO -0.00 0.72 0.13 -0.33 -1.14 0.00 0.00 176.83 176.20 1d8u h GLU 148 N 0.75 0.47 0.26 3.45 4.39 -0.90 0.35 114.58 123.34 1d8u h GLU 148 Ca 0.18 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 1d8u h GLU 148 Cb 0.19 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1d8u h GLU 148 CO -0.02 0.48 -0.13 0.00 -1.16 0.00 0.00 179.01 178.19 1d8u h ALA 149 N 0.97 -0.35 -0.10 3.43 0.00 -1.18 -1.98 119.26 120.06 1d8u h ALA 149 Ca 0.11 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1d8u h ALA 149 Cb 0.18 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1d8u h ALA 149 CO -0.01 -0.68 -0.06 -0.92 0.00 0.00 0.00 179.25 177.58 1d8u h TYR 150 N -0.38 -0.15 -0.72 0.00 3.20 -0.86 -2.02 116.97 116.04 1d8u h TYR 150 Ca -0.04 0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.92 1d8u h TYR 150 Cb 0.29 0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.58 1d8u h TYR 150 CO -0.05 -0.10 0.39 -0.44 -1.64 0.00 0.00 178.16 176.32 1d8u h ASP 151 N -0.06 0.56 -0.17 -2.11 3.32 -0.18 -0.88 116.42 116.90 1d8u h ASP 151 Ca 0.06 0.04 -0.12 0.00 0.02 0.00 0.00 57.03 57.04 1d8u h ASP 151 Cb 0.15 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1d8u h ASP 151 CO -0.14 0.34 -0.30 0.45 -1.72 0.00 0.00 179.24 177.87 1d8u h HIS 152 N 0.69 0.76 -0.39 4.55 3.86 -1.16 -1.31 115.15 122.14 1d8u h HIS 152 Ca 0.34 -0.19 -0.02 0.00 -1.16 0.00 0.00 60.37 59.34 1d8u h HIS 152 Cb 0.29 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 1d8u h HIS 152 CO -0.08 0.88 0.15 1.25 0.86 0.00 0.00 177.93 180.99 1d8u h LEU 153 N 0.56 0.54 -0.61 2.43 5.85 -0.79 -1.91 115.31 121.39 1d8u h LEU 153 Ca 0.07 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 1d8u h LEU 153 Cb 0.79 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 1d8u h LEU 153 CO 0.07 0.57 0.37 0.58 -0.34 0.00 0.00 178.44 179.69 1d8u h VAL 154 N 0.49 1.17 -0.81 1.05 2.07 -1.01 -1.27 116.25 117.94 1d8u h VAL 154 Ca 0.13 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 1d8u h VAL 154 Cb 0.20 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 1d8u h VAL 154 CO -0.01 0.18 0.47 0.00 0.02 0.00 0.00 177.57 178.23 1d8u h ALA 155 N 1.19 1.31 -0.33 1.67 0.00 -1.07 0.24 119.26 122.27 1d8u h ALA 155 Ca 0.22 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1d8u h ALA 155 Cb -0.03 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1d8u h ALA 155 CO -0.04 0.58 0.08 0.00 0.00 0.00 0.00 179.25 179.87 1d8u h ALA 156 N 1.40 0.43 -0.20 0.00 0.00 -0.67 -2.30 119.26 117.92 1d8u h ALA 156 Ca 0.29 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1d8u h ALA 156 Cb -0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1d8u h ALA 156 CO -0.05 0.10 0.08 0.82 0.00 0.00 0.00 179.25 180.20 1d8u h ILE 157 N 0.37 1.16 -0.14 0.00 2.04 -0.75 -2.75 117.51 117.44 1d8u h ILE 157 Ca 0.10 -0.48 0.04 0.00 1.00 0.00 0.00 64.86 65.52 1d8u h ILE 157 Cb 0.30 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1d8u h ILE 157 CO 0.00 0.16 0.13 0.11 0.00 0.00 0.00 178.15 178.55 1d8u h LYS 158 N 0.17 0.00 -0.14 2.37 1.57 -0.44 -0.32 116.57 119.78 1d8u h LYS 158 Ca 0.07 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.79 1d8u h LYS 158 Cb 0.17 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1d8u h LYS 158 CO -0.01 0.00 -0.19 0.37 -0.57 0.00 0.00 179.45 179.06 1d8u h GLN 159 N 0.00 0.23 -0.71 3.15 4.15 -1.10 -1.11 115.11 119.73 1d8u h GLN 159 Ca 0.07 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1d8u h GLN 159 Cb 0.33 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.99 1d8u h GLN 159 CO -0.00 0.42 0.00 0.39 -1.93 0.00 0.00 178.83 177.71 1d8u n GLU 160 N -4.22 3.69 -0.04 1.69 -0.58 -0.14 -3.78 120.64 117.26 1d8u n GLU 160 Ca -0.01 -2.18 0.02 0.00 -0.42 0.00 0.00 57.16 54.57 1d8u n GLU 160 Cb 0.31 -2.03 0.04 0.00 -0.57 0.00 0.00 31.44 29.19 1d8u n GLU 160 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 1d8u n MET 161 N 0.44 2.02 -4.04 3.49 2.81 -0.42 -3.93 117.12 117.49 1d8u n MET 161 Ca 0.19 -1.41 -0.10 0.00 -1.81 0.00 0.00 57.70 54.57 1d8u n MET 161 Cb 0.90 -1.08 -0.06 0.00 -0.71 0.00 0.00 33.22 32.27 1d8u n MET 161 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1d8u s LYS 162 N -0.81 1.48 0.35 0.03 1.02 -1.22 -4.99 119.74 115.60 1d8u s LYS 162 Ca 0.06 -1.33 -0.28 0.00 0.02 0.00 0.00 55.97 54.45 1d8u s LYS 162 Cb 0.04 0.43 -0.09 0.00 -0.52 0.00 0.00 37.83 37.68 1d8u s LYS 162 CO 0.05 -0.59 1.23 -2.14 -0.92 0.00 0.00 175.35 172.98 1d8u s PRO 163 N -4.04 4.27 -0.34 -1.68 0.02 -1.26 -4.89 135.00 127.09 1d8u s PRO 163 Ca 0.26 2.04 -0.02 0.00 0.02 0.00 0.00 61.00 63.30 1d8u s PRO 163 Cb 0.01 -2.95 0.17 0.00 0.02 0.00 0.00 34.50 31.75 1d8u s PRO 163 CO 0.10 -0.19 2.21 0.00 -0.33 0.00 0.00 177.00 178.78 1d8u n ALA 164 N 0.59 5.41 0.00 -1.55 0.00 -1.26 -5.10 120.51 118.60 1d8u n ALA 164 Ca 0.01 -1.93 0.00 0.00 0.00 0.00 0.00 53.44 51.52 1d8u n ALA 164 Cb 0.44 -1.55 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1d8u n ALA 164 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89