#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 2.33 -4.66 0.00 4.77 -1.26 -4.80 117.00 113.38 1d8u n LEU 2 Ca 0.00 -1.15 -0.42 0.00 -0.03 0.00 0.00 56.01 54.41 1d8u n LEU 2 Cb 0.00 -0.40 -0.04 0.00 -2.33 0.00 0.00 43.42 40.65 1d8u n LEU 2 CO 0.00 0.39 0.67 0.68 -1.33 0.00 0.00 177.39 177.81 1d8u s VAL 3 N 0.26 4.83 0.00 4.08 -7.23 -1.26 -4.94 120.40 116.15 1d8u s VAL 3 Ca 0.00 1.66 0.00 0.00 -1.81 0.00 0.00 61.98 61.83 1d8u s VAL 3 Cb 0.00 -4.15 0.00 0.00 0.56 0.00 0.00 36.38 32.79 1d8u s VAL 3 CO 0.00 -0.05 0.00 1.21 -0.31 0.00 0.00 175.10 175.95 1d8u n GLU 4 N 5.73 0.00 -1.12 4.82 2.13 -1.26 -4.54 120.64 126.40 1d8u n GLU 4 Ca 0.06 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.88 1d8u n GLU 4 Cb 0.48 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.19 1d8u n GLU 4 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1d8u n ASP 5 N -2.44 1.24 -3.24 4.31 4.64 -1.26 -4.89 116.55 114.91 1d8u n ASP 5 Ca 0.00 -0.56 -0.16 0.00 -1.38 0.00 0.00 54.79 52.69 1d8u n ASP 5 Cb 0.00 0.00 -0.06 0.00 -1.04 0.00 0.00 41.12 40.02 1d8u n ASP 5 CO 0.00 0.00 0.00 0.20 -0.82 0.00 0.00 177.20 176.58 1d8u s ASN 6 N -0.12 0.52 0.35 1.67 -0.87 -1.26 -5.02 114.94 110.21 1d8u s ASN 6 Ca 0.00 -1.92 0.23 0.00 -1.57 0.00 0.00 52.86 49.60 1d8u s ASN 6 Cb 0.00 0.69 0.77 0.00 -0.02 0.00 0.00 41.25 42.69 1d8u s ASN 6 CO 0.00 -0.19 0.85 -3.20 -2.57 0.00 0.00 177.10 172.00 1d8u n ASN 7 N 3.66 0.00 0.00 -1.22 5.15 -1.26 -3.27 115.26 118.32 1d8u n ASN 7 Ca 0.17 0.52 0.00 0.00 -0.60 0.00 0.00 54.58 54.67 1d8u n ASN 7 Cb 0.49 -0.22 0.00 0.00 -0.53 0.00 0.00 39.78 39.52 1d8u n ASN 7 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1d8u n ALA 8 N -2.17 0.00 -1.00 5.20 0.00 -1.26 -4.85 120.51 116.43 1d8u n ALA 8 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1d8u n ALA 8 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.51 1d8u n ALA 8 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1d8u n VAL 9 N 0.00 0.00 -1.58 0.00 0.24 -1.20 -4.86 118.33 110.93 1d8u n VAL 9 Ca 0.00 0.00 -0.59 0.00 -2.04 0.00 0.00 64.34 61.71 1d8u n VAL 9 Cb 0.02 -1.71 -0.08 0.00 -1.47 0.00 0.00 33.84 30.60 1d8u n VAL 9 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1d8u n ALA 10 N -3.00 -2.39 -3.15 2.33 0.00 -1.26 -4.87 120.51 108.17 1d8u n ALA 10 Ca 0.00 0.55 0.05 0.00 0.00 0.00 0.00 53.44 54.04 1d8u n ALA 10 Cb 0.00 -1.90 -0.01 0.00 0.00 0.00 0.00 19.45 17.54 1d8u n ALA 10 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1d8u s VAL 11 N 0.84 -0.35 -1.03 0.00 1.01 -1.26 -4.89 120.40 114.72 1d8u s VAL 11 Ca 0.92 0.00 -0.11 0.00 0.00 0.00 0.00 61.98 62.79 1d8u s VAL 11 Cb -1.21 -0.92 0.25 0.00 0.00 0.00 0.00 36.38 34.50 1d8u s VAL 11 CO 0.59 0.00 1.02 -0.55 0.00 0.00 0.00 175.10 176.16 1d8u s SER 12 N 2.95 7.13 -0.41 3.32 0.15 -1.26 -4.79 113.70 120.79 1d8u s SER 12 Ca 0.03 -3.27 -0.17 0.00 0.70 0.00 0.00 55.95 53.24 1d8u s SER 12 Cb -0.10 -2.22 0.02 0.00 -1.71 0.00 0.00 66.02 62.01 1d8u s SER 12 CO -0.13 -0.41 0.45 0.12 1.20 0.00 0.00 173.24 174.47 1d8u s PHE 13 N -0.62 3.17 0.81 3.44 5.36 -1.26 -5.04 117.98 123.83 1d8u s PHE 13 Ca 0.27 -0.27 -0.12 0.00 -0.96 0.00 0.00 56.93 55.86 1d8u s PHE 13 Cb -0.10 -2.91 0.08 0.00 -0.34 0.00 0.00 43.02 39.75 1d8u s PHE 13 CO -0.08 -0.68 1.12 -1.54 -1.46 0.00 0.00 175.22 172.59 1d8u s SER 14 N 1.82 4.47 0.31 6.13 1.04 -1.26 -3.98 113.70 122.23 1d8u s SER 14 Ca 0.13 1.09 0.04 0.00 0.48 0.00 0.00 55.95 57.69 1d8u s SER 14 Cb -0.17 -1.75 0.53 0.00 0.10 0.00 0.00 66.02 64.73 1d8u s SER 14 CO 0.14 -1.96 1.81 -0.08 0.98 0.00 0.00 173.24 174.14 1d8u h GLU 15 N -1.08 0.51 -0.20 4.02 4.81 -1.96 -1.61 114.58 119.06 1d8u h GLU 15 Ca -0.47 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 58.61 1d8u h GLU 15 Cb 1.29 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 1d8u h GLU 15 CO 0.62 0.61 0.08 0.93 -0.73 0.00 0.00 179.01 180.52 1d8u h GLU 16 N 0.47 0.30 -0.60 1.92 3.07 -1.99 0.75 114.58 118.51 1d8u h GLU 16 Ca 0.09 -0.05 0.03 0.00 -0.50 0.00 0.00 59.36 58.92 1d8u h GLU 16 Cb 0.46 -0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 28.29 1d8u h GLU 16 CO 0.03 0.36 0.36 1.96 -1.40 0.00 0.00 179.01 180.32 1d8u h GLN 17 N 0.18 0.69 -0.81 2.33 4.20 -1.84 0.12 115.11 119.97 1d8u h GLN 17 Ca 0.07 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 1d8u h GLN 17 Cb 0.17 -0.16 -0.04 0.00 0.30 0.00 0.00 27.48 27.76 1d8u h GLN 17 CO -0.01 0.46 0.41 1.49 -0.67 0.00 0.00 178.83 180.51 1d8u h GLU 18 N 0.71 1.16 -0.64 1.46 4.81 -1.08 -1.49 114.58 119.51 1d8u h GLU 18 Ca 0.24 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1d8u h GLU 18 Cb 0.03 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.16 1d8u h GLU 18 CO -0.11 0.88 0.41 0.00 -0.73 0.00 0.00 179.01 179.47 1d8u h ALA 19 N 1.21 0.81 -0.57 2.92 0.00 0.14 0.24 119.26 124.02 1d8u h ALA 19 Ca 0.28 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.18 1d8u h ALA 19 Cb 0.09 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.58 1d8u h ALA 19 CO -0.04 0.25 0.32 -0.07 0.00 0.00 0.00 179.25 179.71 1d8u h LEU 20 N 0.87 0.48 -0.30 0.00 3.38 -0.08 0.60 115.31 120.26 1d8u h LEU 20 Ca 0.23 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.15 1d8u h LEU 20 Cb -0.08 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1d8u h LEU 20 CO -0.05 0.32 -0.08 0.58 0.09 0.00 0.00 178.44 179.30 1d8u h VAL 21 N 0.61 1.28 -0.28 1.22 2.07 -0.66 -2.68 116.25 117.82 1d8u h VAL 21 Ca 0.25 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.63 1d8u h VAL 21 Cb 0.12 1.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 1d8u h VAL 21 CO -0.15 0.36 0.14 -0.07 0.02 0.00 0.00 177.57 177.87 1d8u h LEU 22 N 0.36 0.36 -0.72 2.57 3.38 -0.04 0.27 115.31 121.49 1d8u h LEU 22 Ca 0.08 -0.11 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 1d8u h LEU 22 Cb 0.57 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1d8u h LEU 22 CO 0.03 0.37 -0.61 0.07 0.09 0.00 0.00 178.44 178.39 1d8u h LYS 23 N 0.32 0.09 -0.12 1.13 2.10 -0.96 0.83 116.57 119.96 1d8u h LYS 23 Ca 0.10 -0.06 -0.23 0.00 -2.00 0.00 0.00 60.65 58.45 1d8u h LYS 23 Cb 0.10 0.01 0.01 0.00 -0.90 0.00 0.00 32.23 31.45 1d8u h LYS 23 CO -0.01 0.68 -0.83 0.66 -2.00 0.00 0.00 179.45 177.94 1d8u h SER 24 N 0.07 0.90 -0.72 7.07 4.64 -1.39 -2.31 113.55 121.81 1d8u h SER 24 Ca -0.01 -0.62 -0.06 0.00 -0.47 0.00 0.00 61.79 60.63 1d8u h SER 24 Cb 1.10 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 62.89 1d8u h SER 24 CO 0.09 1.42 0.21 -0.25 -0.87 0.00 0.00 176.83 177.42 1d8u h TRP 25 N 0.49 1.17 -0.49 4.77 -0.00 -0.84 -1.17 115.95 119.88 1d8u h TRP 25 Ca -0.07 -0.12 0.09 0.00 -0.00 0.00 0.00 58.89 58.79 1d8u h TRP 25 Cb 1.46 -0.34 -0.07 0.00 -0.00 0.00 0.00 29.16 30.21 1d8u h TRP 25 CO 0.09 0.93 0.06 0.00 -0.00 0.00 0.00 178.44 179.52 1d8u h ALA 26 N 1.10 0.52 -0.53 2.65 0.00 -0.65 0.86 119.26 123.21 1d8u h ALA 26 Ca 0.23 0.12 -0.12 0.00 0.00 0.00 0.00 54.91 55.14 1d8u h ALA 26 Cb 0.33 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1d8u h ALA 26 CO -0.00 -0.34 -0.13 0.82 0.00 0.00 0.00 179.25 179.60 1d8u h ILE 27 N 0.19 1.27 -0.38 0.00 2.04 -1.03 -3.10 117.51 116.50 1d8u h ILE 27 Ca 0.25 -1.29 -0.04 0.00 1.00 0.00 0.00 64.86 64.78 1d8u h ILE 27 Cb 0.35 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1d8u h ILE 27 CO -0.35 0.46 0.07 -0.07 0.00 0.00 0.00 178.15 178.25 1d8u h LEU 28 N 0.91 0.52 -0.68 1.44 3.38 -0.12 -2.60 115.31 118.15 1d8u h LEU 28 Ca 0.14 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1d8u h LEU 28 Cb 0.70 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 1d8u h LEU 28 CO 0.05 0.54 0.43 0.11 0.09 0.00 0.00 178.44 179.66 1d8u h LYS 29 N 0.55 0.91 0.00 1.13 1.79 -0.80 -1.68 116.57 118.48 1d8u h LYS 29 Ca 0.13 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1d8u h LYS 29 Cb 0.24 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 30.70 1d8u h LYS 29 CO -0.00 0.63 0.07 1.63 -1.08 0.00 0.00 179.45 180.70 1d8u n LYS 30 N -4.58 0.00 -2.70 3.15 4.76 -0.98 -1.43 118.16 116.38 1d8u n LYS 30 Ca 0.06 0.10 -0.03 0.00 -2.87 0.00 0.00 58.31 55.57 1d8u n LYS 30 Cb 0.04 -1.57 0.11 0.00 -1.84 0.00 0.00 35.03 31.78 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 -0.97 -1.06 -0.28 4.39 -0.08 -0.66 -5.03 116.55 112.86 1d8u n ASP 31 Ca 0.00 -2.27 -0.07 0.00 -1.51 0.00 0.00 54.79 50.94 1d8u n ASP 31 Cb 0.07 0.56 -0.03 0.00 2.34 0.00 0.00 41.12 44.06 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 1.49 -1.60 -0.66 1.67 0.02 -0.91 -2.26 113.55 111.30 1d8u h SER 32 Ca -0.36 0.27 0.12 0.00 -0.84 0.00 0.00 61.79 60.98 1d8u h SER 32 Cb 1.29 0.74 -0.09 0.00 0.14 0.00 0.00 62.40 64.49 1d8u h SER 32 CO -0.09 -0.31 0.21 0.00 -1.14 0.00 0.00 176.83 175.50 1d8u h ALA 33 N 0.76 0.86 -0.42 3.77 0.00 -1.90 -1.05 119.26 121.28 1d8u h ALA 33 Ca 0.21 0.12 -0.13 0.00 0.00 0.00 0.00 54.91 55.11 1d8u h ALA 33 Cb 0.55 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1d8u h ALA 33 CO -0.79 -0.25 -0.25 -0.91 0.00 0.00 0.00 179.25 177.05 1d8u h ASN 34 N 0.36 0.95 0.26 0.00 2.35 -1.82 -2.53 115.58 115.16 1d8u h ASN 34 Ca 0.35 -0.42 -0.16 0.00 -0.55 0.00 0.00 56.30 55.52 1d8u h ASN 34 Cb 0.51 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 1d8u h ASN 34 CO -0.39 1.16 -0.64 0.16 -1.65 0.00 0.00 177.43 176.08 1d8u h ILE 35 N 0.74 1.37 -0.71 2.81 3.07 -1.04 -1.68 117.51 122.08 1d8u h ILE 35 Ca 0.09 -2.01 -0.03 0.00 1.55 0.00 0.00 64.86 64.46 1d8u h ILE 35 Cb 0.83 2.00 -0.03 0.00 -0.27 0.00 0.00 36.82 39.35 1d8u h ILE 35 CO 0.07 0.60 0.32 0.00 -1.05 0.00 0.00 178.15 178.10 1d8u h ALA 36 N 1.05 0.92 0.38 0.16 0.00 -1.21 0.12 119.26 120.69 1d8u h ALA 36 Ca -0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1d8u h ALA 36 Cb 1.18 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1d8u h ALA 36 CO 0.11 0.50 -0.18 1.25 0.00 0.00 0.00 179.25 180.93 1d8u h LEU 37 N 1.00 -0.43 -1.39 0.00 5.85 -1.26 -1.82 115.31 117.26 1d8u h LEU 37 Ca 0.24 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.96 1d8u h LEU 37 Cb 0.15 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 1d8u h LEU 37 CO -0.03 -0.21 0.46 -0.09 -0.34 0.00 0.00 178.44 178.23 1d8u h ARG 38 N -0.63 0.72 -0.23 1.25 2.43 -1.10 0.13 114.38 116.96 1d8u h ARG 38 Ca -0.05 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 1d8u h ARG 38 Cb 0.46 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 1d8u h ARG 38 CO 0.09 0.48 0.11 0.35 -1.51 0.00 0.00 179.97 179.48 1d8u h PHE 39 N 0.75 0.33 0.00 2.20 3.57 -0.52 -1.62 116.94 121.64 1d8u h PHE 39 Ca 0.30 -0.02 -0.17 0.00 3.53 0.00 0.00 57.97 61.61 1d8u h PHE 39 Cb 0.22 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 1d8u h PHE 39 CO -0.00 0.33 -0.82 0.74 -2.23 0.00 0.00 178.31 176.32 1d8u h PHE 40 N 0.23 0.00 0.00 0.41 -1.00 -0.70 -2.58 116.94 113.31 1d8u h PHE 40 Ca 0.08 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.81 1d8u h PHE 40 Cb 0.12 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.68 1d8u h PHE 40 CO -0.02 0.82 -0.21 -0.07 -1.61 0.00 0.00 178.31 177.22 1d8u h LEU 41 N 0.00 0.00 -0.06 1.54 3.38 -0.85 -0.64 115.31 118.68 1d8u h LEU 41 Ca -0.01 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.71 1d8u h LEU 41 Cb 1.49 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.26 1d8u h LEU 41 CO 0.11 0.21 -1.03 0.50 0.09 0.00 0.00 178.44 178.32 1d8u h LYS 42 N 0.00 0.55 -0.25 1.13 1.63 -1.09 -1.90 116.57 116.63 1d8u h LYS 42 Ca -0.00 -0.61 -0.02 0.00 -0.85 0.00 0.00 60.65 59.16 1d8u h LYS 42 Cb 0.41 0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.21 1d8u h LYS 42 CO 0.03 1.23 0.07 0.82 -3.45 0.00 0.00 179.45 178.14 1d8u h ILE 43 N 0.30 1.21 -0.54 2.00 2.04 -1.03 -1.63 117.51 119.85 1d8u h ILE 43 Ca -0.11 -0.66 -0.03 0.00 1.00 0.00 0.00 64.86 65.05 1d8u h ILE 43 Cb 1.68 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 38.90 1d8u h ILE 43 CO 0.19 0.21 0.22 0.15 0.00 0.00 0.00 178.15 178.92 1d8u h PHE 44 N 0.23 0.78 -0.41 1.37 3.04 -1.16 0.33 116.94 121.12 1d8u h PHE 44 Ca 0.08 -0.04 -0.08 0.00 3.98 0.00 0.00 57.97 61.91 1d8u h PHE 44 Cb 0.26 -0.24 -0.01 0.00 2.56 0.00 0.00 35.95 38.52 1d8u h PHE 44 CO 0.01 0.61 -0.05 1.49 -2.02 0.00 0.00 178.31 178.34 1d8u h GLU 45 N 0.77 0.75 0.06 1.11 4.81 -1.07 -2.29 114.58 118.73 1d8u h GLU 45 Ca 0.19 -0.27 -0.18 0.00 -0.13 0.00 0.00 59.36 58.97 1d8u h GLU 45 Cb 0.15 -0.05 0.02 0.00 0.63 0.00 0.00 28.75 29.49 1d8u h GLU 45 CO -0.02 0.87 -0.73 0.28 -0.73 0.00 0.00 179.01 178.68 1d8u h VAL 46 N 0.57 1.45 -2.49 0.32 2.07 -0.89 -3.42 116.25 113.87 1d8u h VAL 46 Ca 0.11 -2.28 -0.59 0.00 0.82 0.00 0.00 66.70 64.76 1d8u h VAL 46 Cb 0.56 2.83 -0.39 0.00 -1.52 0.00 0.00 31.29 32.78 1d8u h VAL 46 CO 0.03 0.66 -0.91 0.00 0.02 0.00 0.00 177.57 177.37 1d8u s ALA 47 N -2.90 1.29 0.31 1.67 0.00 0.11 -4.99 121.76 117.26 1d8u s ALA 47 Ca -0.13 -2.26 0.07 0.00 0.00 0.00 0.00 51.96 49.65 1d8u s ALA 47 Cb 0.03 -1.62 0.78 0.00 0.00 0.00 0.00 23.12 22.31 1d8u s ALA 47 CO 0.83 -2.03 1.78 -1.35 0.00 0.00 0.00 175.76 174.99 1d8u h PRO 48 N 6.21 0.70 -0.17 0.00 0.11 -1.58 0.32 132.00 137.59 1d8u h PRO 48 Ca 0.17 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 66.29 1d8u h PRO 48 Cb 0.93 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.87 1d8u h PRO 48 CO 0.34 0.47 0.19 0.66 -0.21 0.00 0.00 178.00 179.45 1d8u h SER 49 N 0.73 0.00 0.65 -2.05 4.64 -1.93 -2.58 113.55 113.01 1d8u h SER 49 Ca 0.57 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.86 1d8u h SER 49 Cb 0.95 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.04 1d8u h SER 49 CO -0.37 0.00 -0.31 0.00 -0.87 0.00 0.00 176.83 175.28 1d8u h ALA 50 N 1.78 -0.89 0.00 5.18 0.00 -0.68 -2.77 119.26 121.87 1d8u h ALA 50 Ca 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1d8u h ALA 50 Cb 0.46 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1d8u h ALA 50 CO -0.00 -0.83 0.11 0.43 0.00 0.00 0.00 179.25 178.96 1d8u n SER 51 N -5.27 0.44 0.00 0.00 7.64 -1.00 -0.13 113.62 115.31 1d8u n SER 51 Ca -0.11 0.66 0.13 0.00 1.01 0.00 0.00 58.87 60.57 1d8u n SER 51 Cb 0.34 -0.69 0.71 0.00 -1.01 0.00 0.00 64.21 63.56 1d8u n SER 51 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1d8u n GLN 52 N -2.12 0.47 0.10 1.43 6.02 -1.04 -2.91 117.38 119.33 1d8u n GLN 52 Ca -0.01 0.03 0.13 0.00 -0.01 0.00 0.00 57.00 57.13 1d8u n GLN 52 Cb 0.14 -1.50 0.30 0.00 1.02 0.00 0.00 30.24 30.20 1d8u n GLN 52 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 1d8u h MET 53 N 0.00 0.00 0.00 -1.09 2.86 -0.60 -3.44 114.93 112.66 1d8u h MET 53 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1d8u h MET 53 Cb 0.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.87 1d8u h MET 53 CO 0.00 0.00 0.00 1.19 1.06 0.00 0.00 176.91 179.16 1d8u n PHE 54 N -2.26 0.00 -3.95 -0.22 3.01 -1.14 -5.09 117.46 107.80 1d8u n PHE 54 Ca 0.05 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.41 1d8u n PHE 54 Cb 0.44 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.81 1d8u n PHE 54 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1d8u s SER 55 N -1.00 0.19 0.00 4.37 0.01 -1.26 -5.16 113.70 110.85 1d8u s SER 55 Ca 0.00 -0.49 0.00 0.00 1.31 0.00 0.00 55.95 56.77 1d8u s SER 55 Cb 0.00 0.18 0.00 0.00 0.21 0.00 0.00 66.02 66.41 1d8u s SER 55 CO 0.00 -0.42 0.00 0.33 0.41 0.00 0.00 173.24 173.56 1d8u n PHE 56 N 1.14 0.00 -3.68 2.43 -0.00 -1.26 -4.98 117.46 111.11 1d8u n PHE 56 Ca -0.21 0.00 -0.15 0.00 -0.00 0.00 0.00 57.45 57.09 1d8u n PHE 56 Cb 0.57 0.00 -0.15 0.00 -0.00 0.00 0.00 39.48 39.90 1d8u n PHE 56 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.76 175.59 1d8u s LEU 57 N 0.00 -0.05 -0.30 -2.13 0.20 -1.26 -5.03 118.68 110.11 1d8u s LEU 57 Ca 0.00 0.42 -0.17 0.00 0.69 0.00 0.00 54.13 55.07 1d8u s LEU 57 Cb 0.00 0.44 0.18 0.00 -0.43 0.00 0.00 46.19 46.38 1d8u s LEU 57 CO 0.00 -0.23 1.14 -0.13 -0.29 0.00 0.00 176.35 176.84 1d8u s ARG 58 N 2.17 0.17 0.00 1.98 0.52 -1.26 -5.12 118.95 117.41 1d8u s ARG 58 Ca 0.01 0.39 0.00 0.00 -0.52 0.00 0.00 55.73 55.61 1d8u s ARG 58 Cb -0.12 0.20 0.00 0.00 0.52 0.00 0.00 34.95 35.56 1d8u s ARG 58 CO -0.07 -0.05 0.00 -1.71 0.02 0.00 0.00 175.30 173.49 1d8u n ASN 59 N 4.49 0.00 -3.21 0.23 2.85 -1.26 -4.66 115.26 113.71 1d8u n ASN 59 Ca -0.10 0.00 -0.24 0.00 -0.11 0.00 0.00 54.58 54.13 1d8u n ASN 59 Cb 0.55 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 41.50 1d8u n ASN 59 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 1d8u n SER 60 N -0.80 0.44 -3.52 1.20 2.88 -1.26 -5.00 113.62 107.55 1d8u n SER 60 Ca 0.00 -2.75 -0.18 0.00 -1.33 0.00 0.00 58.87 54.61 1d8u n SER 60 Cb 0.00 -0.64 0.00 0.00 -0.75 0.00 0.00 64.21 62.82 1d8u n SER 60 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1d8u n ASP 61 N 1.34 -2.22 -3.63 -3.46 2.03 -1.26 -4.95 116.55 104.40 1d8u n ASP 61 Ca 0.22 -0.57 -0.12 0.00 0.52 0.00 0.00 54.79 54.83 1d8u n ASP 61 Cb 0.52 -0.79 -0.07 0.00 -0.72 0.00 0.00 41.12 40.06 1d8u n ASP 61 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1d8u s VAL 62 N -3.35 0.00 0.05 5.18 1.01 -1.26 -5.10 120.40 116.94 1d8u s VAL 62 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 61.98 61.78 1d8u s VAL 62 Cb -0.07 -1.00 -0.19 0.00 0.00 0.00 0.00 36.38 35.13 1d8u s VAL 62 CO 0.47 0.00 1.49 -0.65 0.00 0.00 0.00 175.10 176.40 1d8u h PRO 63 N 5.36 -0.95 -6.19 2.72 0.11 -2.01 -3.45 132.00 127.58 1d8u h PRO 63 Ca -0.29 0.07 -0.65 0.00 0.11 0.00 0.00 66.00 65.23 1d8u h PRO 63 Cb 1.17 0.22 0.10 0.00 0.11 0.00 0.00 31.00 32.61 1d8u h PRO 63 CO 0.08 -0.62 -0.20 -0.11 -0.21 0.00 0.00 178.00 176.94 1d8u n LEU 64 N -5.49 0.12 -4.54 2.35 7.94 -1.26 -4.67 117.00 111.46 1d8u n LEU 64 Ca -0.14 1.15 -0.23 0.00 -1.11 0.00 0.00 56.01 55.68 1d8u n LEU 64 Cb 0.40 -1.09 -0.09 0.00 0.53 0.00 0.00 43.42 43.17 1d8u n LEU 64 CO 0.37 -2.22 1.67 -0.62 -1.11 0.00 0.00 177.39 175.47 1d8u n GLU 65 N 1.01 0.55 0.00 1.96 -0.58 -1.26 -4.69 120.64 117.62 1d8u n GLU 65 Ca 0.15 -0.41 0.11 0.00 -0.42 0.00 0.00 57.16 56.59 1d8u n GLU 65 Cb 0.26 -2.99 0.04 0.00 -0.57 0.00 0.00 31.44 28.18 1d8u n GLU 65 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1d8u n LYS 66 N 8.30 1.69 -1.52 3.49 5.02 -1.26 -4.95 118.16 128.93 1d8u n LYS 66 Ca 0.50 -1.37 -0.46 0.00 -2.02 0.00 0.00 58.31 54.96 1d8u n LYS 66 Cb 0.38 -1.42 -0.05 0.00 -0.02 0.00 0.00 35.03 33.91 1d8u n LYS 66 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1d8u n ASN 67 N 0.57 2.61 0.27 4.39 2.85 -1.26 -4.84 115.26 119.85 1d8u n ASN 67 Ca 0.11 0.26 0.15 0.00 -0.11 0.00 0.00 54.58 54.98 1d8u n ASN 67 Cb 0.49 -1.41 0.78 0.00 1.24 0.00 0.00 39.78 40.88 1d8u n ASN 67 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1d8u h PRO 68 N 14.00 0.00 -0.20 1.20 0.11 -1.92 -1.76 132.00 143.42 1d8u h PRO 68 Ca -0.33 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.66 1d8u h PRO 68 Cb 1.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 1d8u h PRO 68 CO 1.01 0.00 -0.40 -0.22 -0.21 0.00 0.00 178.00 178.18 1d8u h LYS 69 N 0.00 0.47 0.44 1.05 3.64 -1.99 -2.38 116.57 117.79 1d8u h LYS 69 Ca 0.00 -0.23 -0.02 0.00 -1.27 0.00 0.00 60.65 59.13 1d8u h LYS 69 Cb 0.36 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1d8u h LYS 69 CO 0.00 0.79 -0.21 -0.07 -2.27 0.00 0.00 179.45 177.69 1d8u h LEU 70 N 0.39 -0.50 -1.42 5.20 3.38 -1.71 -1.59 115.31 119.07 1d8u h LEU 70 Ca 0.04 -0.08 0.25 0.00 0.09 0.00 0.00 57.88 58.17 1d8u h LEU 70 Cb 0.87 0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.66 1d8u h LEU 70 CO 0.07 -0.08 0.65 0.11 0.09 0.00 0.00 178.44 179.29 1d8u h LYS 71 N -1.05 0.39 -0.04 1.13 1.57 -1.63 0.48 116.57 117.42 1d8u h LYS 71 Ca -0.06 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1d8u h LYS 71 Cb 0.55 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 1d8u h LYS 71 CO 0.10 0.26 -0.01 1.15 -0.57 0.00 0.00 179.45 180.38 1d8u h THR 72 N 0.40 1.29 -0.39 -0.16 2.02 -1.31 -1.51 112.91 113.25 1d8u h THR 72 Ca 0.55 -0.90 -0.05 0.00 0.77 0.00 0.00 66.41 66.78 1d8u h THR 72 Cb 1.40 1.82 -0.02 0.00 -1.74 0.00 0.00 68.15 69.61 1d8u h THR 72 CO -0.25 0.24 0.05 -0.74 0.37 0.00 0.00 175.52 175.19 1d8u h HIS 73 N -0.27 0.71 -0.39 3.16 -0.00 0.14 -1.04 115.15 117.46 1d8u h HIS 73 Ca 0.01 -0.11 0.06 0.00 -0.00 0.00 0.00 60.37 60.34 1d8u h HIS 73 Cb 0.40 -0.19 -0.05 0.00 -0.00 0.00 0.00 27.41 27.56 1d8u h HIS 73 CO 0.05 0.71 0.07 0.00 -0.00 0.00 0.00 177.93 178.77 1d8u h ALA 74 N 0.91 0.42 -0.61 5.26 0.00 -0.16 -1.64 119.26 123.44 1d8u h ALA 74 Ca 0.12 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1d8u h ALA 74 Cb 0.40 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1d8u h ALA 74 CO 0.01 -0.33 0.21 0.52 0.00 0.00 0.00 179.25 179.66 1d8u h MET 75 N 0.20 0.91 -0.62 0.00 2.86 -1.09 -2.41 114.93 114.77 1d8u h MET 75 Ca 0.19 -0.16 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 1d8u h MET 75 Cb 0.23 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 1d8u h MET 75 CO -0.25 0.77 0.16 0.77 1.06 0.00 0.00 176.91 179.41 1d8u h SER 76 N 0.89 0.91 -0.33 1.22 0.02 -0.43 0.13 113.55 115.95 1d8u h SER 76 Ca 0.20 -0.17 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 1d8u h SER 76 Cb 0.22 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1d8u h SER 76 CO -0.01 0.87 -0.05 0.58 -1.14 0.00 0.00 176.83 177.08 1d8u h VAL 77 N 0.93 1.27 0.69 2.27 2.07 -0.94 -0.81 116.25 121.72 1d8u h VAL 77 Ca 0.20 -1.07 -0.03 0.00 0.82 0.00 0.00 66.70 66.62 1d8u h VAL 77 Cb 0.32 1.30 0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1d8u h VAL 77 CO -0.00 0.35 -0.33 -0.26 0.02 0.00 0.00 177.57 177.35 1d8u h PHE 78 N 0.41 -0.86 -0.48 1.57 0.04 -1.21 -0.81 116.94 115.61 1d8u h PHE 78 Ca 0.09 -0.02 0.09 0.00 2.80 0.00 0.00 57.97 60.93 1d8u h PHE 78 Cb 0.53 0.28 -0.08 0.00 2.20 0.00 0.00 35.95 38.89 1d8u h PHE 78 CO 0.05 -0.53 0.02 0.28 -0.60 0.00 0.00 178.31 177.52 1d8u h VAL 79 N -1.07 0.65 -0.06 -0.55 2.07 -0.82 0.40 116.25 116.87 1d8u h VAL 79 Ca -0.09 -0.04 -0.11 0.00 0.82 0.00 0.00 66.70 67.27 1d8u h VAL 79 Cb 0.71 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1d8u h VAL 79 CO 0.16 0.02 -0.47 0.24 0.02 0.00 0.00 177.57 177.54 1d8u h MET 80 N 0.13 0.14 -0.25 1.57 2.86 -1.21 0.55 114.93 118.72 1d8u h MET 80 Ca 0.24 -0.07 -0.19 0.00 -2.06 0.00 0.00 59.70 57.61 1d8u h MET 80 Cb 0.35 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.01 1d8u h MET 80 CO -0.38 0.58 -0.60 1.15 1.06 0.00 0.00 176.91 178.72 1d8u h THR 81 N 0.11 1.28 -0.32 2.22 2.02 -0.17 -0.09 112.91 117.96 1d8u h THR 81 Ca 0.01 -1.79 -0.06 0.00 0.77 0.00 0.00 66.41 65.33 1d8u h THR 81 Cb 0.88 1.72 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 1d8u h THR 81 CO 0.07 0.58 -0.07 0.00 0.37 0.00 0.00 175.52 176.47 1d8u h GLU 83 N 0.49 0.15 -0.17 0.00 5.08 -0.71 -2.86 114.58 116.56 1d8u h GLU 83 Ca 0.10 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1d8u h GLU 83 Cb 0.43 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1d8u h GLU 83 CO 0.02 0.88 -0.22 0.00 -1.00 0.00 0.00 179.01 178.69 1d8u h ALA 84 N 1.06 1.32 -0.02 3.43 0.00 -0.25 0.31 119.26 125.12 1d8u h ALA 84 Ca -0.03 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 1d8u h ALA 84 Cb 1.43 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1d8u h ALA 84 CO 0.12 0.46 -0.00 0.00 0.00 0.00 0.00 179.25 179.83 1d8u h ALA 85 N 1.51 0.02 -0.96 0.00 0.00 -1.13 0.61 119.26 119.32 1d8u h ALA 85 Ca 0.05 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 54.85 1d8u h ALA 85 Cb 0.55 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.27 1d8u h ALA 85 CO 0.04 -0.32 0.62 0.00 0.00 0.00 0.00 179.25 179.60 1d8u h ALA 86 N 0.69 1.43 -0.26 0.00 0.00 -1.25 0.28 119.26 120.14 1d8u h ALA 86 Ca 0.00 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1d8u h ALA 86 Cb 0.32 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1d8u h ALA 86 CO 0.00 0.45 -0.41 1.96 0.00 0.00 0.00 179.25 181.25 1d8u h GLN 87 N 1.14 0.64 -0.23 0.00 4.20 -0.75 -0.20 115.11 119.91 1d8u h GLN 87 Ca 0.40 -0.33 -0.12 0.00 0.06 0.00 0.00 58.65 58.65 1d8u h GLN 87 Cb 0.11 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1d8u h GLN 87 CO -0.14 0.93 -0.37 -0.07 -0.67 0.00 0.00 178.83 178.51 1d8u h LEU 88 N 0.52 0.54 -0.32 1.46 3.38 0.07 0.21 115.31 121.18 1d8u h LEU 88 Ca 0.04 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.72 1d8u h LEU 88 Cb 0.94 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1d8u h LEU 88 CO 0.08 0.86 -0.04 -0.09 0.09 0.00 0.00 178.44 179.34 1d8u h ARG 89 N 0.43 0.60 0.13 1.13 9.65 -0.70 -1.38 114.38 124.24 1d8u h ARG 89 Ca 0.04 -0.21 -0.30 0.00 -1.10 0.00 0.00 59.98 58.41 1d8u h ARG 89 Cb 0.85 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 29.38 1d8u h ARG 89 CO 0.07 0.76 -1.53 -0.22 2.80 0.00 0.00 179.97 181.85 1d8u h LYS 90 N 0.38 0.28 0.00 0.20 3.64 -0.94 -3.41 116.57 116.72 1d8u h LYS 90 Ca 0.09 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 1d8u h LYS 90 Cb 0.52 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1d8u h LYS 90 CO 0.02 1.23 -1.20 0.00 -2.27 0.00 0.00 179.45 177.23 1d8u n ALA 91 N -2.95 3.03 -0.98 5.00 0.00 0.72 -5.00 120.51 120.34 1d8u n ALA 91 Ca -0.25 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 52.84 1d8u n ALA 91 Cb 0.95 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 19.92 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 1.55 0.43 3.55 0.00 0.00 -0.52 -4.99 105.19 105.21 1d8u n GLY 92 Ca -0.00 -0.74 -0.08 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.36 0.60 0.25 1.61 -2.85 -1.24 -4.60 119.74 112.15 1d8u s LYS 93 Ca 0.00 -0.10 -0.30 0.00 -1.00 0.00 0.00 55.97 54.58 1d8u s LYS 93 Cb 0.00 0.28 -0.10 0.00 -2.06 0.00 0.00 37.83 35.95 1d8u s LYS 93 CO 0.00 -0.24 1.38 0.08 0.10 0.00 0.00 175.35 176.67 1d8u s VAL 94 N -2.20 2.82 -0.55 1.79 1.01 -1.26 -3.99 120.40 118.02 1d8u s VAL 94 Ca 0.04 0.71 0.06 0.00 0.00 0.00 0.00 61.98 62.79 1d8u s VAL 94 Cb -0.01 -3.45 0.32 0.00 0.00 0.00 0.00 36.38 33.24 1d8u s VAL 94 CO -0.04 0.12 0.85 0.35 0.00 0.00 0.00 175.10 176.38 1d8u n THR 95 N 2.12 2.28 -3.16 3.92 -2.24 -1.26 -5.04 114.28 110.89 1d8u n THR 95 Ca 0.05 -5.29 -0.39 0.00 -2.27 0.00 0.00 64.05 56.16 1d8u n THR 95 Cb 0.41 -1.44 -0.05 0.00 -2.10 0.00 0.00 70.33 67.15 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 -3.56 4.86 0.08 2.28 1.01 -1.26 -4.97 120.40 118.83 1d8u s VAL 96 Ca 0.45 1.33 -0.37 0.00 0.00 0.00 0.00 61.98 63.40 1d8u s VAL 96 Cb 0.25 -3.97 -0.17 0.00 0.00 0.00 0.00 36.38 32.49 1d8u s VAL 96 CO -0.10 0.41 1.23 0.54 0.00 0.00 0.00 175.10 177.18 1d8u n ARG 97 N 2.70 0.84 -0.32 2.72 1.74 -1.26 -4.66 116.66 118.43 1d8u n ARG 97 Ca -0.06 0.30 0.08 0.00 -0.77 0.00 0.00 57.85 57.40 1d8u n ARG 97 Cb 0.51 -1.87 0.18 0.00 -1.02 0.00 0.00 32.46 30.25 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 3.91 -0.69 -0.67 0.55 -0.00 -2.00 0.37 116.42 117.89 1d8u h ASP 98 Ca -0.47 0.27 -0.05 0.00 -0.00 0.00 0.00 57.03 56.78 1d8u h ASP 98 Cb 1.36 0.52 -0.03 0.00 -0.00 0.00 0.00 39.33 41.18 1d8u h ASP 98 CO 0.73 -0.30 0.25 0.71 -0.00 0.00 0.00 179.24 180.62 1d8u h THR 99 N 0.02 1.24 -0.41 2.25 1.35 -2.00 -1.88 112.91 113.48 1d8u h THR 99 Ca 0.48 -0.81 -0.09 0.00 -0.55 0.00 0.00 66.41 65.45 1d8u h THR 99 Cb 0.84 0.45 -0.02 0.00 -1.73 0.00 0.00 68.15 67.69 1d8u h THR 99 CO -0.91 0.32 -0.10 0.74 -0.25 0.00 0.00 175.52 175.32 1d8u h THR 100 N 1.01 1.25 -0.22 6.82 2.02 -0.65 -1.46 112.91 121.68 1d8u h THR 100 Ca 0.23 -1.12 -0.14 0.00 0.77 0.00 0.00 66.41 66.15 1d8u h THR 100 Cb 0.24 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.70 1d8u h THR 100 CO -0.01 0.38 -0.41 -0.07 0.37 0.00 0.00 175.52 175.78 1d8u h LEU 101 N 0.65 0.73 -0.98 2.58 3.38 -0.89 -1.74 115.31 119.04 1d8u h LEU 101 Ca 0.11 -0.54 0.03 0.00 0.09 0.00 0.00 57.88 57.58 1d8u h LEU 101 Cb 0.56 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 41.04 1d8u h LEU 101 CO 0.03 1.14 0.65 0.11 0.09 0.00 0.00 178.44 180.45 1d8u h LYS 102 N 0.36 1.23 -0.18 1.13 1.79 -1.22 0.26 116.57 119.93 1d8u h LYS 102 Ca 0.01 -0.07 -0.11 0.00 -2.18 0.00 0.00 60.65 58.30 1d8u h LYS 102 Cb 1.00 -0.28 -0.01 0.00 -1.58 0.00 0.00 32.23 31.36 1d8u h LYS 102 CO 0.09 0.81 -0.35 -0.09 -1.08 0.00 0.00 179.45 178.83 1d8u h ARG 103 N 1.26 0.38 -0.04 3.15 2.43 -1.15 -1.63 114.38 118.78 1d8u h ARG 103 Ca 0.39 -0.17 -0.21 0.00 -0.81 0.00 0.00 59.98 59.18 1d8u h ARG 103 Cb -0.03 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 1d8u h ARG 103 CO -0.11 0.68 -0.85 -0.07 -1.51 0.00 0.00 179.97 178.11 1d8u h LEU 104 N 0.32 0.57 0.27 3.80 3.38 -0.27 -1.99 115.31 121.40 1d8u h LEU 104 Ca 0.04 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 1d8u h LEU 104 Cb 0.78 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1d8u h LEU 104 CO 0.06 1.19 -0.13 1.23 0.09 0.00 0.00 178.44 180.89 1d8u h GLY 105 N 1.16 -0.38 0.59 0.83 0.00 -0.39 -1.92 103.07 102.96 1d8u h GLY 105 Ca -0.06 0.14 0.05 0.00 0.00 0.00 0.00 47.33 47.46 1d8u h GLY 105 CO 0.15 -0.14 0.06 0.00 0.00 0.00 0.00 176.54 176.61 1d8u h ALA 106 N 0.11 0.34 -0.12 3.60 0.00 -1.35 -0.92 119.26 120.93 1d8u h ALA 106 Ca -0.04 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1d8u h ALA 106 Cb 0.41 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1d8u h ALA 106 CO 0.06 -0.35 0.08 1.15 0.00 0.00 0.00 179.25 180.19 1d8u h THR 107 N 0.17 1.03 -0.10 0.00 2.02 -1.31 -0.05 112.91 114.67 1d8u h THR 107 Ca 0.16 -0.07 -0.13 0.00 0.77 0.00 0.00 66.41 67.14 1d8u h THR 107 Cb 0.18 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1d8u h THR 107 CO -0.21 0.03 -0.53 0.45 0.37 0.00 0.00 175.52 175.63 1d8u h HIS 108 N 0.15 0.36 -0.49 3.16 3.86 -1.17 -2.34 115.15 118.68 1d8u h HIS 108 Ca 0.04 -0.12 -0.09 0.00 -1.16 0.00 0.00 60.37 59.05 1d8u h HIS 108 Cb -0.01 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.37 1d8u h HIS 108 CO -0.07 0.76 -0.03 1.25 0.86 0.00 0.00 177.93 180.70 1d8u h LEU 109 N 0.22 0.87 -2.36 2.43 5.85 -1.03 -1.39 115.31 119.89 1d8u h LEU 109 Ca 0.01 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 1d8u h LEU 109 Cb 1.01 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.80 1d8u h LEU 109 CO 0.08 0.98 -0.03 0.50 -0.34 0.00 0.00 178.44 179.64 1d8u h LYS 110 N 0.74 0.00 -0.68 1.25 3.64 -0.70 -1.60 116.57 119.21 1d8u h LYS 110 Ca 0.13 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1d8u h LYS 110 Cb 0.55 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1d8u h LYS 110 CO 0.03 0.03 0.00 0.66 -2.27 0.00 0.00 179.45 177.90 1d8u n TYR 111 N -3.80 0.95 -2.23 1.91 4.02 -0.91 -4.96 117.16 112.15 1d8u n TYR 111 Ca -0.03 -0.51 -0.15 0.00 -0.01 0.00 0.00 57.90 57.20 1d8u n TYR 111 Cb 0.11 -0.03 -0.01 0.00 -0.02 0.00 0.00 39.34 39.40 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 1.45 -0.13 3.65 2.72 0.00 -0.60 -4.94 105.19 107.34 1d8u n GLY 112 Ca 0.23 -0.25 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.74 4.24 0.04 1.61 1.01 -0.56 -5.00 120.40 119.00 1d8u s VAL 113 Ca 0.00 1.48 0.00 0.00 0.00 0.00 0.00 61.98 63.46 1d8u s VAL 113 Cb 0.00 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.34 1d8u s VAL 113 CO 0.00 -0.23 0.02 0.61 0.00 0.00 0.00 175.10 175.50 1d8u n GLY 114 N 3.81 3.31 0.19 4.51 0.00 -1.26 -4.74 105.19 111.01 1d8u n GLY 114 Ca 0.14 -2.19 -0.05 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 0.06 0.28 -0.61 1.61 3.45 -2.00 -2.06 116.42 117.16 1d8u h ASP 115 Ca -0.03 0.03 0.02 0.00 0.43 0.00 0.00 57.03 57.49 1d8u h ASP 115 Cb 0.09 -0.02 -0.03 0.00 -0.56 0.00 0.00 39.33 38.81 1d8u h ASP 115 CO 0.04 0.20 0.40 0.00 -1.57 0.00 0.00 179.24 178.32 1d8u h ALA 116 N 1.25 1.64 -0.13 3.45 0.00 -1.99 -0.59 119.26 122.90 1d8u h ALA 116 Ca 0.20 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1d8u h ALA 116 Cb 0.13 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1d8u h ALA 116 CO -0.15 0.30 -0.01 0.45 0.00 0.00 0.00 179.25 179.84 1d8u h HIS 117 N 0.75 0.27 -0.78 0.00 3.86 -1.81 -0.16 115.15 117.28 1d8u h HIS 117 Ca 0.24 -0.05 0.01 0.00 -1.16 0.00 0.00 60.37 59.41 1d8u h HIS 117 Cb 0.03 -0.07 -0.04 0.00 1.06 0.00 0.00 27.41 28.39 1d8u h HIS 117 CO -0.00 0.50 0.52 0.74 0.86 0.00 0.00 177.93 180.55 1d8u h PHE 118 N -0.04 0.97 -0.35 2.45 -1.00 -0.94 -1.11 116.94 116.92 1d8u h PHE 118 Ca 0.04 0.02 -0.13 0.00 2.81 0.00 0.00 57.97 60.71 1d8u h PHE 118 Cb 0.40 -0.33 -0.01 0.00 3.61 0.00 0.00 35.95 39.63 1d8u h PHE 118 CO 0.04 0.61 -0.29 0.93 -1.61 0.00 0.00 178.31 177.98 1d8u h GLU 119 N 1.04 0.82 -0.58 1.51 5.08 -0.88 -1.44 114.58 120.14 1d8u h GLU 119 Ca 0.29 -0.41 -0.06 0.00 -1.00 0.00 0.00 59.36 58.18 1d8u h GLU 119 Cb -0.10 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1d8u h GLU 119 CO -0.07 1.05 0.13 0.28 -1.00 0.00 0.00 179.01 179.40 1d8u h VAL 120 N 0.61 1.25 -0.64 3.13 2.07 -0.65 0.26 116.25 122.29 1d8u h VAL 120 Ca 0.06 -0.92 -0.02 0.00 0.82 0.00 0.00 66.70 66.65 1d8u h VAL 120 Cb 0.87 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 1d8u h VAL 120 CO 0.08 0.34 0.34 0.58 0.02 0.00 0.00 177.57 178.93 1d8u h VAL 121 N 0.84 1.21 -0.36 2.57 2.07 -1.14 0.14 116.25 121.58 1d8u h VAL 121 Ca 0.18 -0.55 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 1d8u h VAL 121 Cb 0.37 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1d8u h VAL 121 CO 0.00 0.23 0.22 0.50 0.02 0.00 0.00 177.57 178.55 1d8u h LYS 122 N 0.88 0.49 -0.84 1.57 3.64 -0.82 0.21 116.57 121.69 1d8u h LYS 122 Ca 0.22 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.59 1d8u h LYS 122 Cb 0.07 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 31.73 1d8u h LYS 122 CO -0.03 0.36 0.54 0.35 -2.27 0.00 0.00 179.45 178.40 1d8u h PHE 123 N 0.47 1.02 -0.17 1.91 3.57 -0.39 -0.64 116.94 122.71 1d8u h PHE 123 Ca 0.13 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.53 1d8u h PHE 123 Cb -0.01 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.38 1d8u h PHE 123 CO -0.04 0.59 -0.44 0.00 -2.23 0.00 0.00 178.31 176.19 1d8u h ALA 124 N 1.35 0.93 0.42 2.41 0.00 -0.09 -1.31 119.26 122.96 1d8u h ALA 124 Ca 0.33 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1d8u h ALA 124 Cb -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1d8u h ALA 124 CO -0.11 0.64 -0.20 1.25 0.00 0.00 0.00 179.25 180.83 1d8u h LEU 125 N 0.34 -0.48 -0.82 0.00 5.85 0.01 -0.67 115.31 119.54 1d8u h LEU 125 Ca 0.02 -0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.72 1d8u h LEU 125 Cb 0.91 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 42.00 1d8u h LEU 125 CO 0.08 -0.17 0.49 -0.07 -0.34 0.00 0.00 178.44 178.43 1d8u h LEU 126 N -0.80 0.75 -0.69 2.25 3.38 -1.14 -0.91 115.31 118.15 1d8u h LEU 126 Ca -0.06 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1d8u h LEU 126 Cb 0.54 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1d8u h LEU 126 CO 0.09 0.47 0.20 -0.78 0.09 0.00 0.00 178.44 178.51 1d8u h ASP 127 N 0.88 1.02 -0.51 -0.43 3.58 -1.18 -1.93 116.42 117.85 1d8u h ASP 127 Ca 0.37 -0.22 -0.09 0.00 0.42 0.00 0.00 57.03 57.51 1d8u h ASP 127 Cb 0.23 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 40.99 1d8u h ASP 127 CO -0.19 0.97 -0.04 0.74 -2.88 0.00 0.00 179.24 177.84 1d8u h THR 128 N 1.02 1.27 -0.22 2.25 2.02 -0.40 -1.10 112.91 117.75 1d8u h THR 128 Ca 0.22 -1.15 -0.03 0.00 0.77 0.00 0.00 66.41 66.22 1d8u h THR 128 Cb 0.33 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.71 1d8u h THR 128 CO -0.00 0.41 0.04 0.40 0.37 0.00 0.00 175.52 176.73 1d8u h ILE 129 N 0.79 1.23 -0.71 3.11 2.04 -1.07 -0.68 117.51 122.22 1d8u h ILE 129 Ca 0.14 -0.75 0.03 0.00 1.00 0.00 0.00 64.86 65.27 1d8u h ILE 129 Cb 0.58 1.30 -0.04 0.00 -0.74 0.00 0.00 36.82 37.92 1d8u h ILE 129 CO 0.03 0.24 0.45 0.50 0.00 0.00 0.00 178.15 179.37 1d8u h LYS 130 N 0.17 0.86 0.00 2.37 3.64 -1.29 -0.45 116.57 121.87 1d8u h LYS 130 Ca 0.07 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 1d8u h LYS 130 Cb 0.32 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1d8u h LYS 130 CO 0.00 0.57 -0.38 1.49 -2.27 0.00 0.00 179.45 178.87 1d8u h GLU 131 N 0.89 0.00 0.00 1.90 4.57 -1.05 -3.34 114.58 117.55 1d8u h GLU 131 Ca 0.28 0.00 -0.28 0.00 -1.18 0.00 0.00 59.36 58.18 1d8u h GLU 131 Cb -0.01 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.53 1d8u h GLU 131 CO -0.10 0.38 -1.90 0.39 -1.18 0.00 0.00 179.01 176.61 1d8u n GLU 132 N -3.94 0.65 -3.18 1.92 -0.58 -0.28 -4.95 120.64 110.29 1d8u n GLU 132 Ca -0.02 0.16 -0.30 0.00 -0.42 0.00 0.00 57.16 56.59 1d8u n GLU 132 Cb 0.43 -1.69 -0.04 0.00 -0.57 0.00 0.00 31.44 29.57 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 -2.66 4.89 0.49 2.62 -7.23 -0.26 -4.98 120.40 113.29 1d8u s VAL 133 Ca -0.06 0.41 -0.24 0.00 -1.81 0.00 0.00 61.98 60.28 1d8u s VAL 133 Cb 0.08 -3.70 -0.07 0.00 0.56 0.00 0.00 36.38 33.25 1d8u s VAL 133 CO 0.83 -0.32 1.41 -2.16 -0.31 0.00 0.00 175.10 174.55 1d8u s PRO 134 N -3.44 3.44 0.56 4.82 0.04 -1.26 -4.79 135.00 134.38 1d8u s PRO 134 Ca 0.48 2.38 0.28 0.00 0.04 0.00 0.00 61.00 64.18 1d8u s PRO 134 Cb -0.11 -2.49 1.47 0.00 0.04 0.00 0.00 34.50 33.41 1d8u s PRO 134 CO 0.27 -1.00 1.96 0.00 0.04 0.00 0.00 177.00 178.28 1d8u h ALA 135 N 1.96 2.35 0.00 8.56 0.00 -1.93 0.14 119.26 130.33 1d8u h ALA 135 Ca -0.51 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.38 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 0.59 -0.69 0.00 0.38 0.00 0.00 0.00 179.25 179.54 1d8u h ASP 136 N 0.00 0.00 0.00 0.00 3.04 -2.02 -3.24 116.42 114.21 1d8u h ASP 136 Ca 0.24 0.00 -0.05 0.00 -3.24 0.00 0.00 57.03 53.98 1d8u h ASP 136 Cb 1.09 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.37 1d8u h ASP 136 CO -0.00 0.00 -1.61 1.15 -2.04 0.00 0.00 179.24 176.73 1d8u n MET 137 N -2.47 0.78 -2.22 4.15 0.00 0.45 -4.98 117.12 112.83 1d8u n MET 137 Ca 0.02 -0.09 -0.37 0.00 0.00 0.00 0.00 57.70 57.26 1d8u n MET 137 Cb 0.27 -1.29 -0.00 0.00 0.00 0.00 0.00 33.22 32.19 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 -2.72 2.79 0.07 3.17 -0.11 -1.06 -4.85 118.94 116.24 1d8u s TRP 138 Ca -0.05 1.53 -0.27 0.00 1.22 0.00 0.00 56.10 58.53 1d8u s TRP 138 Cb 0.07 -3.39 0.08 0.00 -1.50 0.00 0.00 33.47 28.73 1d8u s TRP 138 CO 0.50 -1.62 0.97 -1.54 -4.62 0.00 0.00 176.95 170.64 1d8u s SER 139 N -1.40 -0.23 0.39 5.86 1.04 -1.26 -4.97 113.70 113.12 1d8u s SER 139 Ca 0.66 -0.22 0.06 0.00 0.48 0.00 0.00 55.95 56.92 1d8u s SER 139 Cb -0.29 0.41 0.79 0.00 0.10 0.00 0.00 66.02 67.04 1d8u s SER 139 CO 0.34 -0.73 2.03 -0.65 0.98 0.00 0.00 173.24 175.21 1d8u h PRO 140 N 2.00 0.59 -0.70 4.02 0.11 -1.99 -1.68 132.00 134.35 1d8u h PRO 140 Ca -0.23 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.82 1d8u h PRO 140 Cb 1.23 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 1d8u h PRO 140 CO 0.28 0.42 0.38 0.00 -0.21 0.00 0.00 178.00 178.86 1d8u h ALA 141 N 1.69 0.90 -0.55 -0.75 0.00 -1.97 0.66 119.26 119.23 1d8u h ALA 141 Ca 0.16 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1d8u h ALA 141 Cb -0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1d8u h ALA 141 CO -0.03 0.42 -0.09 1.98 0.00 0.00 0.00 179.25 181.53 1d8u h MET 142 N 0.96 1.03 -0.35 0.00 1.85 -1.71 -0.79 114.93 115.92 1d8u h MET 142 Ca 0.25 -0.37 -0.00 0.00 -0.61 0.00 0.00 59.70 58.96 1d8u h MET 142 Cb 0.05 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 31.99 1d8u h MET 142 CO -0.04 1.06 0.22 -0.22 -0.40 0.00 0.00 176.91 177.53 1d8u h LYS 143 N 0.92 0.47 -0.20 0.39 3.64 -0.71 -2.44 116.57 118.64 1d8u h LYS 143 Ca 0.15 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.40 1d8u h LYS 143 Cb 0.66 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 1d8u h LYS 143 CO 0.05 0.34 -0.26 0.77 -2.27 0.00 0.00 179.45 178.09 1d8u h SER 144 N 0.47 0.37 -0.14 4.20 0.02 -0.70 -1.09 113.55 116.67 1d8u h SER 144 Ca 0.13 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1d8u h SER 144 Cb -0.01 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 1d8u h SER 144 CO -0.03 0.63 0.06 0.00 -1.14 0.00 0.00 176.83 176.35 1d8u h ALA 145 N 1.41 0.18 -0.58 3.77 0.00 -0.73 0.03 119.26 123.33 1d8u h ALA 145 Ca 0.05 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1d8u h ALA 145 Cb 0.63 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 1d8u h ALA 145 CO 0.05 -0.25 0.30 -1.49 0.00 0.00 0.00 179.25 177.86 1d8u h TRP 146 N 0.09 0.82 -0.52 0.00 4.06 -1.33 -2.20 115.95 116.87 1d8u h TRP 146 Ca 0.05 -0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.95 1d8u h TRP 146 Cb 0.14 -0.26 -0.02 0.00 -1.00 0.00 0.00 29.16 28.02 1d8u h TRP 146 CO -0.02 0.61 0.27 0.77 -3.56 0.00 0.00 178.44 176.51 1d8u h SER 147 N 0.79 0.67 -0.44 -3.49 0.02 -0.92 0.12 113.55 110.30 1d8u h SER 147 Ca 0.20 -0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 1d8u h SER 147 Cb 0.08 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 1d8u h SER 147 CO -0.03 0.59 0.21 -0.33 -1.14 0.00 0.00 176.83 176.13 1d8u h GLU 148 N 0.69 0.63 0.39 3.45 4.39 -0.88 0.25 114.58 123.50 1d8u h GLU 148 Ca 0.18 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.77 1d8u h GLU 148 Cb 0.09 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1d8u h GLU 148 CO -0.03 0.55 -0.19 0.00 -1.16 0.00 0.00 179.01 178.19 1d8u h ALA 149 N 1.05 -0.52 -0.12 3.43 0.00 -1.15 -2.13 119.26 119.82 1d8u h ALA 149 Ca 0.15 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1d8u h ALA 149 Cb 0.13 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1d8u h ALA 149 CO -0.02 -0.78 -0.05 -0.92 0.00 0.00 0.00 179.25 177.48 1d8u h TYR 150 N -0.54 -0.12 -0.80 0.00 3.20 -0.83 -2.00 116.97 115.88 1d8u h TYR 150 Ca -0.05 0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.91 1d8u h TYR 150 Cb 0.41 0.07 -0.07 0.00 1.54 0.00 0.00 36.73 38.69 1d8u h TYR 150 CO -0.04 -0.08 0.46 -0.44 -1.64 0.00 0.00 178.16 176.42 1d8u h ASP 151 N -0.04 0.69 -0.15 -2.11 3.32 -0.43 -1.14 116.42 116.56 1d8u h ASP 151 Ca 0.07 0.04 -0.14 0.00 0.02 0.00 0.00 57.03 57.01 1d8u h ASP 151 Cb 0.13 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1d8u h ASP 151 CO -0.14 0.41 -0.39 0.45 -1.72 0.00 0.00 179.24 177.85 1d8u h HIS 152 N 0.81 0.80 -0.34 4.55 3.86 -1.13 -1.13 115.15 122.58 1d8u h HIS 152 Ca 0.37 -0.23 -0.01 0.00 -1.16 0.00 0.00 60.37 59.34 1d8u h HIS 152 Cb 0.28 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 1d8u h HIS 152 CO -0.06 0.96 0.17 1.25 0.86 0.00 0.00 177.93 181.11 1d8u h LEU 153 N 0.56 0.43 -0.60 2.43 5.85 -0.86 -1.58 115.31 121.53 1d8u h LEU 153 Ca 0.05 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 1d8u h LEU 153 Cb 0.91 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 1d8u h LEU 153 CO 0.08 0.41 0.37 0.58 -0.34 0.00 0.00 178.44 179.55 1d8u h VAL 154 N 0.41 1.17 -0.46 1.05 2.07 -1.09 -1.11 116.25 118.29 1d8u h VAL 154 Ca 0.12 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 1d8u h VAL 154 Cb 0.09 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 1d8u h VAL 154 CO -0.02 0.17 0.14 0.00 0.02 0.00 0.00 177.57 177.88 1d8u h ALA 155 N 1.19 1.38 -0.34 1.67 0.00 -0.99 0.20 119.26 122.36 1d8u h ALA 155 Ca 0.22 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1d8u h ALA 155 Cb -0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1d8u h ALA 155 CO -0.04 0.46 -0.00 0.00 0.00 0.00 0.00 179.25 179.66 1d8u h ALA 156 N 1.49 0.46 -0.18 0.00 0.00 -0.55 -2.38 119.26 118.11 1d8u h ALA 156 Ca 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1d8u h ALA 156 Cb 0.21 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1d8u h ALA 156 CO -0.01 0.23 0.06 0.82 0.00 0.00 0.00 179.25 180.35 1d8u h ILE 157 N 0.42 1.18 -0.13 0.00 2.04 -0.76 -2.80 117.51 117.46 1d8u h ILE 157 Ca 0.10 -0.57 0.04 0.00 1.00 0.00 0.00 64.86 65.43 1d8u h ILE 157 Cb 0.46 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1d8u h ILE 157 CO 0.02 0.18 0.15 0.11 0.00 0.00 0.00 178.15 178.60 1d8u h LYS 158 N 0.11 0.00 -0.05 2.37 1.57 -0.53 -0.06 116.57 119.99 1d8u h LYS 158 Ca 0.06 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.76 1d8u h LYS 158 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1d8u h LYS 158 CO -0.00 0.00 -0.32 0.37 -0.57 0.00 0.00 179.45 178.92 1d8u h GLN 159 N 0.00 0.09 -0.71 3.15 4.15 -1.14 -1.40 115.11 119.25 1d8u h GLN 159 Ca 0.06 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.42 1d8u h GLN 159 Cb 0.36 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.02 1d8u h GLN 159 CO -0.00 0.41 0.04 0.39 -1.93 0.00 0.00 178.83 177.74 1d8u n GLU 160 N -4.13 3.83 -0.03 1.69 -0.58 -0.04 -3.82 120.64 117.57 1d8u n GLU 160 Ca -0.02 -2.41 0.01 0.00 -0.42 0.00 0.00 57.16 54.32 1d8u n GLU 160 Cb 0.38 -2.08 0.03 0.00 -0.57 0.00 0.00 31.44 29.20 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 0.37 1.98 -3.88 3.49 2.81 -0.53 -3.86 117.12 117.50 1d8u n MET 161 Ca 0.23 -1.36 -0.10 0.00 -1.81 0.00 0.00 57.70 54.67 1d8u n MET 161 Cb 1.02 -1.06 -0.09 0.00 -0.71 0.00 0.00 33.22 32.38 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 -0.78 0.66 0.59 0.03 1.02 -1.23 -4.98 119.74 115.04 1d8u s LYS 162 Ca 0.05 -0.71 -0.18 0.00 0.02 0.00 0.00 55.97 55.14 1d8u s LYS 162 Cb 0.03 0.27 -0.08 0.00 -0.52 0.00 0.00 37.83 37.52 1d8u s LYS 162 CO 0.03 -0.18 0.52 -2.30 -0.92 0.00 0.00 175.35 172.51 1d8u n PRO 163 N 0.66 0.49 -1.02 -1.68 -0.02 -1.26 -4.83 135.00 127.34 1d8u n PRO 163 Ca -0.19 0.20 -0.33 0.00 -2.02 0.00 0.00 63.50 61.16 1d8u n PRO 163 Cb 0.59 -1.71 0.02 0.00 -0.02 0.00 0.00 33.50 32.38 1d8u n PRO 163 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1d8u n ALA 164 N -1.76 -3.68 0.00 3.55 0.00 -1.26 -5.05 120.51 112.31 1d8u n ALA 164 Ca 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1d8u n ALA 164 Cb 0.48 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.77 1d8u n ALA 164 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89