#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rlt n LYS 4 N 0.00 4.70 -3.74 5.55 4.76 -0.06 -4.85 118.16 124.53 1rlt n LYS 4 Ca 0.00 0.00 -0.12 0.00 -2.87 0.00 0.00 58.31 55.32 1rlt n LYS 4 Cb 0.00 -0.39 -0.13 0.00 -1.84 0.00 0.00 35.03 32.67 1rlt n LYS 4 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1rlt s VAL 5 N -0.76 -0.03 -0.20 -0.18 1.01 -0.65 -0.83 120.40 118.76 1rlt s VAL 5 Ca 0.00 0.11 -0.00 0.00 0.00 0.00 0.00 61.98 62.09 1rlt s VAL 5 Cb 0.00 -0.39 0.02 0.00 0.00 0.00 0.00 36.38 36.01 1rlt s VAL 5 CO 0.00 0.05 -0.14 -0.63 0.00 0.00 0.00 175.10 174.38 1rlt s ILE 6 N 1.03 2.46 -0.11 2.22 1.01 -0.33 0.05 121.20 127.53 1rlt s ILE 6 Ca -0.07 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.67 1rlt s ILE 6 Cb -0.08 -2.12 -0.02 0.00 0.01 0.00 0.00 42.46 40.24 1rlt s ILE 6 CO -0.07 0.42 -0.13 -0.69 0.00 0.00 0.00 174.94 174.47 1rlt s VAL 7 N 1.32 3.11 0.02 2.92 1.01 0.11 -1.13 120.40 127.77 1rlt s VAL 7 Ca 0.03 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.39 1rlt s VAL 7 Cb -0.14 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.93 1rlt s VAL 7 CO -0.09 0.54 -0.11 0.28 0.00 0.00 0.00 175.10 175.72 1rlt s THR 8 N 0.05 0.85 0.75 3.92 -1.32 0.67 -0.86 115.64 119.70 1rlt s THR 8 Ca -0.05 -0.80 -0.12 0.00 -1.21 0.00 0.00 61.69 59.52 1rlt s THR 8 Cb -0.14 -0.78 0.04 0.00 -1.51 0.00 0.00 72.50 70.11 1rlt s THR 8 CO 0.04 -0.01 1.13 -0.62 -2.21 0.00 0.00 174.62 172.95 1rlt s ASP 9 N -0.90 5.00 -0.00 8.08 2.15 -0.78 -1.05 116.67 129.16 1rlt s ASP 9 Ca -0.00 1.00 -0.00 0.00 0.43 0.00 0.00 52.55 53.97 1rlt s ASP 9 Cb -0.07 -1.67 -0.00 0.00 -0.30 0.00 0.00 42.92 40.88 1rlt s ASP 9 CO 0.01 -1.61 -0.01 0.23 -0.17 0.00 0.00 175.17 173.61 1rlt n MET 10 N -3.16 0.01 -1.83 4.34 2.81 -1.26 -2.89 117.12 115.14 1rlt n MET 10 Ca 0.07 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.55 1rlt n MET 10 Cb 0.59 -0.27 -0.03 0.00 -0.71 0.00 0.00 33.22 32.80 1rlt n MET 10 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1rlt s ASP 11 N -4.60 6.51 0.00 7.83 1.11 -1.26 -0.92 116.67 125.34 1rlt s ASP 11 Ca -0.01 2.64 0.00 0.00 0.18 0.00 0.00 52.55 55.36 1rlt s ASP 11 Cb 0.00 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.42 1rlt s ASP 11 CO 0.01 -0.94 0.00 0.61 1.18 0.00 0.00 175.17 176.03 1rlt n GLY 12 N 4.07 0.36 0.00 0.21 0.00 -1.23 -4.83 105.19 103.77 1rlt n GLY 12 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1rlt n GLY 12 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1rlt n THR 13 N -2.51 0.00 0.26 2.61 -1.04 -0.57 -4.44 114.28 108.58 1rlt n THR 13 Ca 0.00 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.14 1rlt n THR 13 Cb 0.16 0.00 0.73 0.00 -1.82 0.00 0.00 70.33 69.40 1rlt n THR 13 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 1rlt h PHE 14 N 0.00 0.00 -3.22 -1.42 3.57 -1.35 -3.39 116.94 111.13 1rlt h PHE 14 Ca 0.00 0.00 -0.66 0.00 3.53 0.00 0.00 57.97 60.84 1rlt h PHE 14 Cb 0.00 0.00 -0.15 0.00 2.79 0.00 0.00 35.95 38.59 1rlt h PHE 14 CO 0.00 0.12 -0.59 -0.51 -2.23 0.00 0.00 178.31 175.09 1rlt s LEU 15 N -7.16 3.71 1.02 0.59 1.02 -0.10 -4.63 118.68 113.14 1rlt s LEU 15 Ca -0.03 0.14 -0.17 0.00 0.02 0.00 0.00 54.13 54.10 1rlt s LEU 15 Cb 0.13 -1.88 0.23 0.00 0.02 0.00 0.00 46.19 44.68 1rlt s LEU 15 CO 0.58 0.31 1.29 0.54 0.02 0.00 0.00 176.35 179.09 1rlt s ASN 16 N -0.46 2.57 0.53 2.29 2.20 -0.67 -3.54 114.94 117.86 1rlt s ASN 16 Ca 0.09 0.29 0.22 0.00 -0.94 0.00 0.00 52.86 52.52 1rlt s ASN 16 Cb -0.12 -0.33 1.44 0.00 -2.00 0.00 0.00 41.25 40.25 1rlt s ASN 16 CO 0.02 -3.07 2.15 0.44 -2.94 0.00 0.00 177.10 173.70 1rlt h ASP 17 N -1.88 0.00 -0.13 3.54 3.32 -1.89 -0.19 116.42 119.19 1rlt h ASP 17 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 1rlt h ASP 17 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1rlt h ASP 17 CO 0.35 0.05 0.00 0.00 -1.72 0.00 0.00 179.24 177.91 1rlt n ALA 18 N -2.43 2.51 -2.41 3.45 0.00 -1.26 -4.90 120.51 115.47 1rlt n ALA 18 Ca -0.03 -0.29 -0.15 0.00 0.00 0.00 0.00 53.44 52.97 1rlt n ALA 18 Cb 0.13 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1rlt n ALA 18 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1rlt n LYS 19 N -0.12 -1.77 -4.51 0.00 4.76 -0.08 -5.03 118.16 111.41 1rlt n LYS 19 Ca 0.09 0.69 -0.24 0.00 -2.87 0.00 0.00 58.31 55.98 1rlt n LYS 19 Cb 0.16 -5.00 -0.10 0.00 -1.84 0.00 0.00 35.03 28.24 1rlt n LYS 19 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1rlt s THR 20 N -2.80 1.26 0.12 -0.18 -4.23 -1.26 -4.86 115.64 103.69 1rlt s THR 20 Ca 0.06 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.46 1rlt s THR 20 Cb -0.02 -2.73 0.01 0.00 1.34 0.00 0.00 72.50 71.09 1rlt s THR 20 CO 0.07 0.00 0.28 -0.72 -0.54 0.00 0.00 174.62 173.71 1rlt s TYR 21 N -3.15 0.12 -0.92 3.99 -0.85 -1.26 -1.66 117.35 113.62 1rlt s TYR 21 Ca 0.32 -0.51 -0.24 0.00 -0.52 0.00 0.00 57.07 56.13 1rlt s TYR 21 Cb 0.08 0.04 -0.02 0.00 0.38 0.00 0.00 41.96 42.44 1rlt s TYR 21 CO 0.15 -0.65 1.78 1.21 -1.52 0.00 0.00 175.55 176.52 1rlt s ASN 22 N -2.88 5.57 0.10 -0.18 3.84 -1.26 -4.85 114.94 115.28 1rlt s ASN 22 Ca 0.08 -0.84 -0.19 0.00 0.21 0.00 0.00 52.86 52.12 1rlt s ASN 22 Cb 0.03 -2.56 -0.06 0.00 -0.55 0.00 0.00 41.25 38.11 1rlt s ASN 22 CO -0.08 -2.34 1.63 1.56 -2.79 0.00 0.00 177.10 175.09 1rlt h GLN 23 N 11.03 0.40 -0.59 0.43 4.20 -1.98 -1.18 115.11 127.41 1rlt h GLN 23 Ca 0.10 -0.08 0.04 0.00 0.06 0.00 0.00 58.65 58.77 1rlt h GLN 23 Cb 1.02 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.69 1rlt h GLN 23 CO 1.28 0.44 0.34 -1.35 -0.67 0.00 0.00 178.83 178.87 1rlt h PRO 24 N 0.27 0.64 -0.13 1.46 0.11 -1.99 0.14 132.00 132.50 1rlt h PRO 24 Ca 0.09 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.14 1rlt h PRO 24 Cb 0.20 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.16 1rlt h PRO 24 CO -0.01 0.43 0.02 -0.09 -0.21 0.00 0.00 178.00 178.14 1rlt h ARG 25 N 0.66 0.21 -0.65 1.05 2.43 -1.93 -2.36 114.38 113.79 1rlt h ARG 25 Ca 0.25 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.30 1rlt h ARG 25 Cb 0.08 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 1rlt h ARG 25 CO -0.13 0.40 0.16 0.35 -1.51 0.00 0.00 179.97 179.24 1rlt h PHE 26 N -0.01 1.06 -0.79 2.20 3.57 -1.04 -1.82 116.94 120.11 1rlt h PHE 26 Ca 0.04 -0.12 0.01 0.00 3.53 0.00 0.00 57.97 61.43 1rlt h PHE 26 Cb 0.29 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.69 1rlt h PHE 26 CO 0.02 0.87 0.52 0.52 -2.23 0.00 0.00 178.31 178.01 1rlt h MET 27 N 0.97 1.03 -0.26 1.11 2.86 -0.63 0.43 114.93 120.44 1rlt h MET 27 Ca 0.21 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.75 1rlt h MET 27 Cb 0.34 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1rlt h MET 27 CO 0.00 0.68 0.03 0.00 1.06 0.00 0.00 176.91 178.68 1rlt h ALA 28 N 1.29 0.35 -0.12 6.32 0.00 -1.19 -2.07 119.26 123.84 1rlt h ALA 28 Ca 0.29 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 55.03 1rlt h ALA 28 Cb -0.11 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1rlt h ALA 28 CO -0.07 0.04 -0.00 1.96 0.00 0.00 0.00 179.25 181.18 1rlt h GLN 29 N 0.24 0.04 -0.99 0.00 4.20 -0.80 -1.98 115.11 115.81 1rlt h GLN 29 Ca 0.08 -0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.92 1rlt h GLN 29 Cb 0.35 -0.01 -0.09 0.00 0.30 0.00 0.00 27.48 28.04 1rlt h GLN 29 CO 0.01 0.02 0.62 -0.92 -0.67 0.00 0.00 178.83 177.90 1rlt h TYR 30 N 0.04 1.09 -0.95 2.96 3.20 -0.06 0.14 116.97 123.40 1rlt h TYR 30 Ca 0.06 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.97 1rlt h TYR 30 Cb 0.07 -0.34 -0.05 0.00 1.54 0.00 0.00 36.73 37.95 1rlt h TYR 30 CO -0.14 0.40 0.63 1.96 -1.64 0.00 0.00 178.16 179.36 1rlt h GLN 31 N 0.92 1.24 -0.03 1.82 1.08 -0.64 0.19 115.11 119.69 1rlt h GLN 31 Ca 0.51 -0.07 -0.15 0.00 -1.45 0.00 0.00 58.65 57.48 1rlt h GLN 31 Cb 0.59 -0.28 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 1rlt h GLN 31 CO -0.28 0.82 -0.69 0.93 -0.95 0.00 0.00 178.83 178.67 1rlt h GLU 32 N 1.28 0.14 -0.22 1.46 4.39 -0.38 -1.71 114.58 119.54 1rlt h GLU 32 Ca 0.35 -0.12 -0.07 0.00 0.34 0.00 0.00 59.36 59.87 1rlt h GLU 32 Cb -0.14 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 1rlt h GLU 32 CO -0.08 0.77 -0.12 -0.07 -1.16 0.00 0.00 179.01 178.35 1rlt h LEU 33 N 0.10 0.50 -0.10 1.33 3.38 -0.03 -1.94 115.31 118.56 1rlt h LEU 33 Ca -0.01 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1rlt h LEU 33 Cb 1.22 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1rlt h LEU 33 CO 0.10 0.81 0.05 0.50 0.09 0.00 0.00 178.44 179.99 1rlt h LYS 34 N 0.19 0.10 -0.83 1.13 3.64 -0.61 -0.53 116.57 119.66 1rlt h LYS 34 Ca 0.05 -0.01 0.15 0.00 -1.27 0.00 0.00 60.65 59.57 1rlt h LYS 34 Cb 0.63 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.37 1rlt h LYS 34 CO 0.04 0.07 0.54 -0.22 -2.27 0.00 0.00 179.45 177.61 1rlt h LYS 35 N 0.11 0.52 -0.06 1.90 3.64 -1.27 0.14 116.57 121.55 1rlt h LYS 35 Ca 0.04 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1rlt h LYS 35 Cb 0.00 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1rlt h LYS 35 CO -0.03 0.34 0.00 0.54 -2.27 0.00 0.00 179.45 178.04 1rlt n ARG 36 N -4.52 1.59 -0.99 1.90 1.74 -0.72 -4.92 116.66 110.75 1rlt n ARG 36 Ca 0.16 -0.87 0.00 0.00 -0.77 0.00 0.00 57.85 56.37 1rlt n ARG 36 Cb 0.52 -1.45 0.00 0.00 -1.02 0.00 0.00 32.46 30.51 1rlt n ARG 36 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rlt n GLY 37 N 1.13 0.47 3.73 -0.13 0.00 0.49 -5.01 105.19 105.86 1rlt n GLY 37 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1rlt n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rlt s ILE 38 N -2.03 4.73 0.32 -0.61 1.01 -0.30 -4.96 121.20 119.36 1rlt s ILE 38 Ca 0.00 1.78 -0.11 0.00 0.00 0.00 0.00 60.65 62.33 1rlt s ILE 38 Cb 0.00 -4.19 -0.07 0.00 0.01 0.00 0.00 42.46 38.21 1rlt s ILE 38 CO 0.00 0.31 0.68 -0.54 0.00 0.00 0.00 174.94 175.39 1rlt s LYS 39 N 0.21 3.82 -0.15 2.79 1.02 -0.01 -4.15 119.74 123.28 1rlt s LYS 39 Ca 0.42 0.41 0.02 0.00 0.02 0.00 0.00 55.97 56.84 1rlt s LYS 39 Cb -0.21 -2.50 0.01 0.00 -0.52 0.00 0.00 37.83 34.61 1rlt s LYS 39 CO 0.25 0.14 -0.21 0.12 -0.92 0.00 0.00 175.35 174.73 1rlt s PHE 40 N -2.09 2.70 -0.01 3.18 5.36 -1.26 -1.19 117.98 124.67 1rlt s PHE 40 Ca 0.50 -1.37 0.05 0.00 -0.96 0.00 0.00 56.93 55.15 1rlt s PHE 40 Cb -0.11 -1.84 -0.01 0.00 -0.34 0.00 0.00 43.02 40.72 1rlt s PHE 40 CO 0.25 -0.64 -0.17 0.08 -1.46 0.00 0.00 175.22 173.29 1rlt s VAL 41 N 0.91 1.31 -0.27 3.12 1.01 -0.28 -2.25 120.40 123.96 1rlt s VAL 41 Ca -0.05 -0.72 -0.05 0.00 0.00 0.00 0.00 61.98 61.16 1rlt s VAL 41 Cb -0.15 -1.09 0.00 0.00 0.00 0.00 0.00 36.38 35.14 1rlt s VAL 41 CO -0.04 0.37 0.03 -0.69 0.00 0.00 0.00 175.10 174.77 1rlt s VAL 42 N -0.40 3.72 -0.31 2.92 1.01 -0.81 -0.24 120.40 126.29 1rlt s VAL 42 Ca 0.06 -0.63 -0.04 0.00 0.00 0.00 0.00 61.98 61.37 1rlt s VAL 42 Cb -0.06 -2.85 0.04 0.00 0.00 0.00 0.00 36.38 33.51 1rlt s VAL 42 CO -0.01 0.20 0.05 0.00 0.00 0.00 0.00 175.10 175.35 1rlt s ALA 43 N 1.48 2.93 0.03 5.51 0.00 -0.22 -0.22 121.76 131.27 1rlt s ALA 43 Ca 0.03 -1.71 -0.12 0.00 0.00 0.00 0.00 51.96 50.17 1rlt s ALA 43 Cb -0.16 -2.08 0.01 0.00 0.00 0.00 0.00 23.12 20.89 1rlt s ALA 43 CO 0.00 -1.24 0.25 0.45 0.00 0.00 0.00 175.76 175.22 1rlt s SER 44 N 1.34 -0.06 0.20 0.00 0.15 0.80 -4.07 113.70 112.06 1rlt s SER 44 Ca -0.03 -0.20 0.24 0.00 0.70 0.00 0.00 55.95 56.67 1rlt s SER 44 Cb -0.19 0.31 0.91 0.00 -1.71 0.00 0.00 66.02 65.33 1rlt s SER 44 CO 0.01 -0.53 1.74 0.61 1.20 0.00 0.00 173.24 176.26 1rlt n GLY 45 N 0.86 -1.44 3.76 9.45 0.00 -1.26 -0.29 105.19 116.26 1rlt n GLY 45 Ca -0.20 0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 1rlt n GLY 45 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rlt s ASN 46 N -4.15 4.25 0.42 1.61 0.01 -1.26 -3.60 114.94 112.22 1rlt s ASN 46 Ca 0.08 1.65 -0.25 0.00 -0.71 0.00 0.00 52.86 53.63 1rlt s ASN 46 Cb 0.11 -2.37 -0.08 0.00 0.41 0.00 0.00 41.25 39.33 1rlt s ASN 46 CO 0.47 -2.17 1.28 -1.58 -1.51 0.00 0.00 177.10 173.59 1rlt s GLN 47 N -4.95 3.88 0.28 -0.60 0.74 -0.98 -0.96 119.66 117.07 1rlt s GLN 47 Ca 0.62 2.09 0.02 0.00 0.05 0.00 0.00 55.36 58.13 1rlt s GLN 47 Cb -0.17 -2.67 0.62 0.00 1.10 0.00 0.00 33.01 31.89 1rlt s GLN 47 CO 0.56 -0.54 1.76 -0.92 -0.55 0.00 0.00 175.29 175.60 1rlt h TYR 48 N 2.50 0.84 0.00 1.67 3.20 -1.94 -0.54 116.97 122.70 1rlt h TYR 48 Ca -0.50 0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.32 1rlt h TYR 48 Cb 1.25 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 39.27 1rlt h TYR 48 CO 0.53 0.17 -0.40 1.88 -1.64 0.00 0.00 178.16 178.69 1rlt h TYR 49 N 0.64 0.00 0.03 -3.82 -1.99 -1.94 -2.04 116.97 107.84 1rlt h TYR 49 Ca 0.51 0.00 -0.25 0.00 2.00 0.00 0.00 58.73 60.99 1rlt h TYR 49 Cb 0.78 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.48 1rlt h TYR 49 CO -0.07 0.40 -1.28 -0.56 -0.00 0.00 0.00 178.16 176.66 1rlt h GLN 50 N 0.00 0.06 -0.23 4.88 -0.00 -1.51 -3.26 115.11 115.04 1rlt h GLN 50 Ca -0.00 -0.10 -0.00 0.00 -0.00 0.00 0.00 58.65 58.55 1rlt h GLN 50 Cb 0.75 0.04 -0.01 0.00 -0.00 0.00 0.00 27.48 28.25 1rlt h GLN 50 CO 0.05 0.91 0.14 -0.07 -0.00 0.00 0.00 178.83 179.86 1rlt h LEU 51 N 0.02 0.28 -1.44 0.06 3.38 -0.84 -2.23 115.31 114.54 1rlt h LEU 51 Ca -0.12 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1rlt h LEU 51 Cb 1.88 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.56 1rlt h LEU 51 CO 0.13 0.25 0.00 0.16 0.09 0.00 0.00 178.44 179.07 1rlt h ILE 52 N 0.29 0.00 0.00 1.22 3.07 -1.50 -1.92 117.51 118.67 1rlt h ILE 52 Ca 0.08 -0.27 0.00 0.00 1.55 0.00 0.00 64.86 66.23 1rlt h ILE 52 Cb 0.02 1.10 0.00 0.00 -0.27 0.00 0.00 36.82 37.68 1rlt h ILE 52 CO -0.02 0.00 0.00 0.77 -1.05 0.00 0.00 178.15 177.85 1rlt h SER 53 N 0.00 0.00 0.75 2.16 4.64 -1.44 -2.13 113.55 117.53 1rlt h SER 53 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rlt h SER 53 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1rlt h SER 53 CO 0.00 0.00 -0.74 0.49 -0.87 0.00 0.00 176.83 175.71 1rlt n PHE 54 N -2.89 0.48 -2.78 4.77 3.72 -0.72 -4.28 117.46 115.76 1rlt n PHE 54 Ca 0.00 0.14 -0.19 0.00 -0.05 0.00 0.00 57.45 57.35 1rlt n PHE 54 Cb 0.25 -0.60 -0.00 0.00 -0.94 0.00 0.00 39.48 38.19 1rlt n PHE 54 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1rlt n PHE 55 N -2.08 2.09 -0.25 1.38 3.01 -0.82 -4.93 117.46 115.85 1rlt n PHE 55 Ca 0.03 -3.33 0.19 0.00 1.01 0.00 0.00 57.45 55.35 1rlt n PHE 55 Cb 0.44 -0.33 0.50 0.00 -0.01 0.00 0.00 39.48 40.09 1rlt n PHE 55 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1rlt h PRO 56 N 2.88 0.41 0.00 -1.08 0.11 -1.68 0.21 132.00 132.85 1rlt h PRO 56 Ca 0.09 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1rlt h PRO 56 Cb 0.94 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.96 1rlt h PRO 56 CO 0.65 0.27 -0.46 0.39 -0.21 0.00 0.00 178.00 178.65 1rlt n GLU 57 N -4.52 0.08 0.00 1.05 1.02 -1.26 -4.24 120.64 112.76 1rlt n GLU 57 Ca 0.20 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 1rlt n GLU 57 Cb 0.70 -1.55 0.00 0.00 -0.02 0.00 0.00 31.44 30.57 1rlt n GLU 57 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1rlt n LEU 58 N -1.66 0.69 -0.41 -4.62 4.77 -0.59 -4.87 117.00 110.31 1rlt n LEU 58 Ca 0.05 -0.70 0.34 0.00 -0.03 0.00 0.00 56.01 55.67 1rlt n LEU 58 Cb 0.36 0.00 0.61 0.00 -2.33 0.00 0.00 43.42 42.06 1rlt n LEU 58 CO 0.34 0.17 1.20 0.50 -1.33 0.00 0.00 177.39 178.27 1rlt h LYS 59 N 0.00 0.12 -0.01 3.23 3.11 -0.80 0.19 116.57 122.41 1rlt h LYS 59 Ca 0.00 -0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.83 1rlt h LYS 59 Cb 0.14 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.34 1rlt h LYS 59 CO 0.00 0.08 -0.33 -0.25 -2.81 0.00 0.00 179.45 176.14 1rlt n ASP 60 N -4.81 1.08 -0.12 4.20 8.00 -1.26 -4.33 116.55 119.30 1rlt n ASP 60 Ca 0.36 -0.89 -0.25 0.00 0.71 0.00 0.00 54.79 54.72 1rlt n ASP 60 Cb 1.33 0.21 -0.10 0.00 -0.02 0.00 0.00 41.12 42.54 1rlt n ASP 60 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1rlt n GLU 61 N -0.70 0.57 -1.83 -1.24 1.02 0.02 -3.35 120.64 115.14 1rlt n GLU 61 Ca 0.11 0.37 -0.29 0.00 -0.02 0.00 0.00 57.16 57.33 1rlt n GLU 61 Cb 0.36 -1.58 0.11 0.00 -0.02 0.00 0.00 31.44 30.31 1rlt n GLU 61 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1rlt s ILE 62 N -2.48 2.00 0.23 -3.67 -4.36 -1.00 -4.36 121.20 107.56 1rlt s ILE 62 Ca -0.34 0.00 0.09 0.00 -0.26 0.00 0.00 60.65 60.14 1rlt s ILE 62 Cb 0.11 -2.95 -0.04 0.00 1.25 0.00 0.00 42.46 40.82 1rlt s ILE 62 CO 0.51 0.00 -0.04 -0.44 0.24 0.00 0.00 174.94 175.21 1rlt s SER 63 N -4.50 4.42 -0.02 4.36 0.01 -0.95 -3.74 113.70 113.27 1rlt s SER 63 Ca 0.63 -0.62 0.03 0.00 1.31 0.00 0.00 55.95 57.30 1rlt s SER 63 Cb -0.11 -0.79 -0.00 0.00 0.21 0.00 0.00 66.02 65.33 1rlt s SER 63 CO 0.50 0.05 -0.09 -0.36 0.41 0.00 0.00 173.24 173.74 1rlt s PHE 64 N -2.07 0.90 -0.54 2.43 0.40 -0.44 -1.93 117.98 116.73 1rlt s PHE 64 Ca 0.29 -0.20 -0.00 0.00 -0.60 0.00 0.00 56.93 56.42 1rlt s PHE 64 Cb -0.07 -0.61 0.14 0.00 0.51 0.00 0.00 43.02 42.99 1rlt s PHE 64 CO 0.18 -0.06 0.32 0.08 0.70 0.00 0.00 175.22 176.44 1rlt s VAL 65 N -0.02 3.18 0.59 -0.44 1.01 0.69 -0.90 120.40 124.51 1rlt s VAL 65 Ca 0.00 -2.91 0.05 0.00 0.00 0.00 0.00 61.98 59.12 1rlt s VAL 65 Cb -0.06 -3.14 0.08 0.00 0.00 0.00 0.00 36.38 33.26 1rlt s VAL 65 CO 0.00 -0.81 0.82 0.00 0.00 0.00 0.00 175.10 175.11 1rlt s ALA 66 N 0.09 4.26 -1.57 5.51 0.00 0.10 -0.14 121.76 130.01 1rlt s ALA 66 Ca 0.15 -1.83 -0.11 0.00 0.00 0.00 0.00 51.96 50.17 1rlt s ALA 66 Cb -0.22 -1.74 0.09 0.00 0.00 0.00 0.00 23.12 21.24 1rlt s ALA 66 CO -0.03 -0.95 0.66 0.39 0.00 0.00 0.00 175.76 175.83 1rlt n GLU 67 N -2.38 -3.46 -1.38 0.00 -0.58 -0.13 -0.64 120.64 112.06 1rlt n GLU 67 Ca 0.13 0.41 -0.14 0.00 -0.42 0.00 0.00 57.16 57.14 1rlt n GLU 67 Cb 0.61 -4.91 -0.06 0.00 -0.57 0.00 0.00 31.44 26.51 1rlt n GLU 67 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1rlt n ASN 68 N -2.81 -4.95 0.00 1.62 3.02 0.60 -1.74 115.26 111.00 1rlt n ASN 68 Ca -0.08 0.35 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 1rlt n ASN 68 Cb 0.57 -4.05 0.00 0.00 -0.61 0.00 0.00 39.78 35.70 1rlt n ASN 68 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rlt n GLY 69 N -0.05 1.18 0.22 7.41 0.00 0.18 -2.63 105.19 111.51 1rlt n GLY 69 Ca -0.14 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.00 1rlt n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rlt h ALA 70 N 0.00 0.97 -3.58 4.61 0.00 -0.79 -3.42 119.26 117.05 1rlt h ALA 70 Ca 0.00 -0.05 -0.37 0.00 0.00 0.00 0.00 54.91 54.49 1rlt h ALA 70 Cb 0.00 -0.01 -0.33 0.00 0.00 0.00 0.00 17.79 17.46 1rlt h ALA 70 CO 0.00 0.07 -0.76 -1.17 0.00 0.00 0.00 179.25 177.39 1rlt s LEU 71 N -6.24 1.45 -0.07 0.00 0.20 -1.10 -0.97 118.68 111.96 1rlt s LEU 71 Ca 0.06 -0.09 0.01 0.00 0.69 0.00 0.00 54.13 54.80 1rlt s LEU 71 Cb 0.06 -0.33 0.02 0.00 -0.43 0.00 0.00 46.19 45.51 1rlt s LEU 71 CO 0.66 -0.04 -0.06 -0.69 -0.29 0.00 0.00 176.35 175.93 1rlt s VAL 72 N 0.68 0.76 -0.09 1.68 1.01 -0.27 0.01 120.40 124.18 1rlt s VAL 72 Ca -0.08 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 61.70 1rlt s VAL 72 Cb -0.11 -0.77 -0.02 0.00 0.00 0.00 0.00 36.38 35.48 1rlt s VAL 72 CO -0.00 0.29 -0.14 -0.31 0.00 0.00 0.00 175.10 174.94 1rlt s TYR 73 N 1.12 2.76 -0.24 5.22 1.51 -0.08 0.73 117.35 128.38 1rlt s TYR 73 Ca -0.07 -0.41 0.01 0.00 -1.01 0.00 0.00 57.07 55.59 1rlt s TYR 73 Cb -0.14 -1.74 0.04 0.00 -0.11 0.00 0.00 41.96 40.01 1rlt s TYR 73 CO -0.01 -0.02 -0.11 -2.00 -1.11 0.00 0.00 175.55 172.29 1rlt s GLU 74 N -0.17 2.58 -1.46 -0.62 -6.30 0.36 -1.32 118.70 111.78 1rlt s GLU 74 Ca -0.00 -1.13 -0.03 0.00 -2.50 0.00 0.00 54.97 51.31 1rlt s GLU 74 Cb -0.13 -2.85 0.02 0.00 0.00 0.00 0.00 34.13 31.17 1rlt s GLU 74 CO 0.03 -0.44 0.46 1.58 0.02 0.00 0.00 175.26 176.91 1rlt n HIS 75 N 4.55 -1.66 0.00 5.30 -0.00 -1.25 -1.52 115.22 120.64 1rlt n HIS 75 Ca -0.16 0.75 0.00 0.00 -0.00 0.00 0.00 57.72 58.31 1rlt n HIS 75 Cb 0.45 -3.60 0.00 0.00 -0.00 0.00 0.00 29.99 26.84 1rlt n HIS 75 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1rlt n GLY 76 N -1.93 2.47 3.58 1.57 0.00 -1.21 -4.77 105.19 104.90 1rlt n GLY 76 Ca -0.25 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 1rlt n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rlt s LYS 77 N -0.52 3.27 0.08 1.61 1.02 -0.58 -5.04 119.74 119.58 1rlt s LYS 77 Ca 0.00 -0.48 -0.31 0.00 0.02 0.00 0.00 55.97 55.20 1rlt s LYS 77 Cb 0.00 -2.82 -0.09 0.00 -0.52 0.00 0.00 37.83 34.41 1rlt s LYS 77 CO 0.00 0.48 1.69 -1.14 -0.92 0.00 0.00 175.35 175.46 1rlt s GLN 78 N -0.28 4.18 -0.22 1.68 0.74 -1.26 -0.48 119.66 124.02 1rlt s GLN 78 Ca 0.05 2.38 0.00 0.00 0.05 0.00 0.00 55.36 57.85 1rlt s GLN 78 Cb -0.12 -3.60 -0.14 0.00 1.10 0.00 0.00 33.01 30.24 1rlt s GLN 78 CO 0.02 -0.76 -0.21 -0.11 -0.55 0.00 0.00 175.29 173.69 1rlt n LEU 79 N 5.63 2.83 -3.60 3.68 7.94 0.22 -4.89 117.00 128.81 1rlt n LEU 79 Ca 0.16 -0.07 -0.13 0.00 -1.11 0.00 0.00 56.01 54.86 1rlt n LEU 79 Cb 0.40 -0.77 -0.05 0.00 0.53 0.00 0.00 43.42 43.53 1rlt n LEU 79 CO 0.63 0.83 0.23 0.12 -1.11 0.00 0.00 177.39 178.10 1rlt s PHE 80 N -2.44 -0.36 -0.25 1.96 5.36 -1.00 -4.99 117.98 116.26 1rlt s PHE 80 Ca -0.30 0.31 -0.16 0.00 -0.96 0.00 0.00 56.93 55.82 1rlt s PHE 80 Cb 0.08 0.31 0.07 0.00 -0.34 0.00 0.00 43.02 43.14 1rlt s PHE 80 CO 0.50 -0.65 0.62 -3.38 -1.46 0.00 0.00 175.22 170.85 1rlt s HIS 81 N -2.74 -0.88 0.30 10.12 -3.43 -1.25 -1.12 115.29 116.29 1rlt s HIS 81 Ca -0.04 1.86 -0.04 0.00 -0.80 0.00 0.00 55.06 56.04 1rlt s HIS 81 Cb -0.00 0.47 0.07 0.00 -1.43 0.00 0.00 32.58 31.68 1rlt s HIS 81 CO -0.04 -0.45 0.41 0.41 -2.00 0.00 0.00 174.74 173.08 1rlt n GLY 82 N 3.94 -0.84 3.64 -1.38 0.00 -0.14 -5.01 105.19 105.39 1rlt n GLY 82 Ca -0.19 -1.74 -0.05 0.00 0.00 0.00 0.00 46.02 44.04 1rlt n GLY 82 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1rlt s GLU 83 N -3.81 0.20 0.25 1.61 -1.05 -1.26 -4.71 118.70 109.93 1rlt s GLU 83 Ca 0.24 0.16 -0.14 0.00 -0.15 0.00 0.00 54.97 55.08 1rlt s GLU 83 Cb -0.01 0.10 -0.08 0.00 -0.44 0.00 0.00 34.13 33.70 1rlt s GLU 83 CO 0.17 -0.04 0.66 -0.51 0.95 0.00 0.00 175.26 176.48 1rlt s LEU 84 N -0.33 4.18 0.84 1.83 1.43 -0.07 -4.98 118.68 121.58 1rlt s LEU 84 Ca 0.06 1.18 -0.11 0.00 -1.03 0.00 0.00 54.13 54.22 1rlt s LEU 84 Cb -0.03 -3.77 0.09 0.00 0.03 0.00 0.00 46.19 42.51 1rlt s LEU 84 CO -0.10 -0.08 1.10 0.42 0.23 0.00 0.00 176.35 177.91 1rlt s THR 85 N -1.78 2.89 0.30 5.49 -4.23 -1.26 -4.71 115.64 112.34 1rlt s THR 85 Ca 0.48 0.29 0.02 0.00 -1.18 0.00 0.00 61.69 61.30 1rlt s THR 85 Cb -0.12 -2.92 0.29 0.00 1.34 0.00 0.00 72.50 71.09 1rlt s THR 85 CO 0.19 -0.38 1.87 0.03 -0.54 0.00 0.00 174.62 175.79 1rlt h ARG 86 N -1.29 0.94 -0.23 3.99 2.47 -1.99 -1.90 114.38 116.37 1rlt h ARG 86 Ca -0.48 -0.06 -0.17 0.00 -1.26 0.00 0.00 59.98 58.01 1rlt h ARG 86 Cb 1.27 -0.21 0.00 0.00 -1.65 0.00 0.00 29.97 29.39 1rlt h ARG 86 CO 0.57 0.62 -0.53 0.45 0.56 0.00 0.00 179.97 181.65 1rlt h HIS 87 N 0.97 0.97 -0.37 3.04 3.86 -1.99 -2.34 115.15 119.29 1rlt h HIS 87 Ca 0.45 -0.37 0.01 0.00 -1.16 0.00 0.00 60.37 59.31 1rlt h HIS 87 Cb 0.42 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.69 1rlt h HIS 87 CO -0.00 1.17 0.23 0.93 0.86 0.00 0.00 177.93 181.11 1rlt h GLU 88 N 0.49 0.45 -0.59 2.45 5.08 -1.79 -0.60 114.58 120.06 1rlt h GLU 88 Ca -0.00 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 1rlt h GLU 88 Cb 1.14 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 1rlt h GLU 88 CO 0.12 0.30 0.09 0.66 -1.00 0.00 0.00 179.01 179.17 1rlt h SER 89 N 0.46 0.94 -0.43 1.42 4.64 -1.39 -0.65 113.55 118.54 1rlt h SER 89 Ca 0.14 -0.26 0.05 0.00 -0.47 0.00 0.00 61.79 61.25 1rlt h SER 89 Cb -0.02 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 61.78 1rlt h SER 89 CO -0.05 0.97 0.18 -0.09 -0.87 0.00 0.00 176.83 176.96 1rlt h ARG 90 N 0.88 0.36 0.62 4.77 2.43 -1.06 0.85 114.38 123.23 1rlt h ARG 90 Ca 0.18 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.30 1rlt h ARG 90 Cb 0.43 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1rlt h ARG 90 CO 0.01 0.23 -0.32 0.82 -1.51 0.00 0.00 179.97 179.21 1rlt h ILE 91 N 0.37 0.35 -0.14 1.20 2.04 -0.65 0.28 117.51 120.95 1rlt h ILE 91 Ca 0.20 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.10 1rlt h ILE 91 Cb 0.16 0.35 -0.05 0.00 -0.74 0.00 0.00 36.82 36.54 1rlt h ILE 91 CO -0.18 0.00 -0.14 0.58 0.00 0.00 0.00 178.15 178.42 1rlt h VAL 92 N -0.86 0.62 -0.60 1.67 2.07 -0.94 0.58 116.25 118.80 1rlt h VAL 92 Ca -0.08 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.46 1rlt h VAL 92 Cb 0.67 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1rlt h VAL 92 CO 0.13 0.00 0.38 0.40 0.02 0.00 0.00 177.57 178.49 1rlt h ILE 93 N -0.16 1.11 -1.00 4.57 2.04 -0.76 0.15 117.51 123.45 1rlt h ILE 93 Ca 0.10 -0.26 0.04 0.00 1.00 0.00 0.00 64.86 65.73 1rlt h ILE 93 Cb 0.30 0.28 -0.06 0.00 -0.74 0.00 0.00 36.82 36.60 1rlt h ILE 93 CO -0.24 0.14 0.65 1.23 0.00 0.00 0.00 178.15 179.93 1rlt h GLY 94 N 0.76 1.46 0.81 5.37 0.00 0.27 -0.13 103.07 111.61 1rlt h GLY 94 Ca 0.23 -0.50 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 1rlt h GLY 94 CO -0.08 0.43 -0.02 -2.09 0.00 0.00 0.00 176.54 174.78 1rlt h GLU 95 N 1.27 0.36 -0.50 4.80 4.57 0.04 -3.00 114.58 122.11 1rlt h GLU 95 Ca 0.40 -0.12 -0.00 0.00 -1.18 0.00 0.00 59.36 58.45 1rlt h GLU 95 Cb -0.00 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.54 1rlt h GLU 95 CO -0.12 0.58 0.31 -0.07 -1.18 0.00 0.00 179.01 178.52 1rlt h LEU 96 N 0.10 0.60 -0.72 1.64 3.38 -0.59 -2.16 115.31 117.56 1rlt h LEU 96 Ca 0.05 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rlt h LEU 96 Cb 0.43 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1rlt h LEU 96 CO 0.01 0.48 0.00 0.18 0.09 0.00 0.00 178.44 179.20 1rlt n LEU 97 N -4.70 0.35 0.24 1.67 4.32 -0.10 -1.70 117.00 117.09 1rlt n LEU 97 Ca 0.02 0.64 0.11 0.00 -0.02 0.00 0.00 56.01 56.77 1rlt n LEU 97 Cb 0.05 -0.65 0.60 0.00 -1.62 0.00 0.00 43.42 41.79 1rlt n LEU 97 CO 0.36 -0.67 0.89 0.11 -1.22 0.00 0.00 177.39 176.85 1rlt h LYS 98 N 0.00 0.00 -4.25 3.23 1.57 -1.24 -3.33 116.57 112.55 1rlt h LYS 98 Ca 0.00 0.00 -0.76 0.00 -1.87 0.00 0.00 60.65 58.02 1rlt h LYS 98 Cb 0.09 0.00 -0.23 0.00 0.08 0.00 0.00 32.23 32.17 1rlt h LYS 98 CO 0.00 0.17 0.57 0.34 -0.57 0.00 0.00 179.45 179.96 1rlt s ASP 99 N -6.15 6.89 0.00 0.86 -1.08 -0.69 -4.87 116.67 111.63 1rlt s ASP 99 Ca -0.01 -2.75 0.00 0.00 -0.52 0.00 0.00 52.55 49.27 1rlt s ASP 99 Cb 0.12 -2.29 0.00 0.00 -1.46 0.00 0.00 42.92 39.28 1rlt s ASP 99 CO 0.61 -0.67 0.15 0.29 0.52 0.00 0.00 175.17 176.07 1rlt n LYS 100 N 4.67 0.23 0.00 4.34 5.02 -1.25 -0.63 118.16 130.54 1rlt n LYS 100 Ca 0.22 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 1rlt n LYS 100 Cb 0.45 -1.08 0.00 0.00 -0.02 0.00 0.00 35.03 34.39 1rlt n LYS 100 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1rlt n GLN 101 N 0.09 5.47 -3.05 1.97 -0.06 -1.26 -5.04 117.38 115.50 1rlt n GLN 101 Ca 0.00 0.00 -0.39 0.00 -2.00 0.00 0.00 57.00 54.61 1rlt n GLN 101 Cb 0.04 -0.51 -0.06 0.00 -4.06 0.00 0.00 30.24 25.65 1rlt n GLN 101 CO 0.00 0.00 0.00 -1.17 -0.20 0.00 0.00 177.06 175.69 1rlt s LEU 102 N -1.89 4.51 -0.06 1.69 2.96 0.20 -5.07 118.68 121.02 1rlt s LEU 102 Ca 0.00 1.46 0.02 0.00 -0.22 0.00 0.00 54.13 55.40 1rlt s LEU 102 Cb 0.00 -3.17 -0.03 0.00 0.50 0.00 0.00 46.19 43.49 1rlt s LEU 102 CO 0.00 0.13 -0.11 0.20 -1.32 0.00 0.00 176.35 175.25 1rlt s ASN 103 N -0.60 4.27 0.22 3.68 0.01 -1.26 -5.02 114.94 116.23 1rlt s ASN 103 Ca 0.35 -0.13 -0.19 0.00 -0.71 0.00 0.00 52.86 52.19 1rlt s ASN 103 Cb -0.21 -0.98 0.03 0.00 0.41 0.00 0.00 41.25 40.50 1rlt s ASN 103 CO 0.23 0.35 0.59 0.72 -1.51 0.00 0.00 177.10 177.48 1rlt s PHE 104 N -0.75 -0.16 -0.04 2.20 -0.12 -1.26 -1.03 117.98 116.82 1rlt s PHE 104 Ca 0.12 -0.20 0.07 0.00 -0.05 0.00 0.00 56.93 56.86 1rlt s PHE 104 Cb -0.11 0.50 -0.01 0.00 -0.63 0.00 0.00 43.02 42.77 1rlt s PHE 104 CO 0.01 -1.01 -0.25 0.08 -0.05 0.00 0.00 175.22 174.00 1rlt s VAL 105 N -3.88 2.01 -0.26 -2.49 1.01 -0.04 -4.48 120.40 112.27 1rlt s VAL 105 Ca 0.10 -1.06 -0.13 0.00 0.00 0.00 0.00 61.98 60.89 1rlt s VAL 105 Cb -0.03 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 1rlt s VAL 105 CO -0.00 0.56 0.28 0.00 0.00 0.00 0.00 175.10 175.94 1rlt s ALA 106 N -0.31 3.56 -0.31 5.51 0.00 0.57 -1.31 121.76 129.47 1rlt s ALA 106 Ca 0.01 -0.89 -0.12 0.00 0.00 0.00 0.00 51.96 50.96 1rlt s ALA 106 Cb -0.12 -2.56 -0.04 0.00 0.00 0.00 0.00 23.12 20.40 1rlt s ALA 106 CO 0.02 -0.51 0.21 0.00 0.00 0.00 0.00 175.76 175.48 1rlt s GLY 108 N 1.74 2.39 0.22 0.00 0.00 0.43 -1.91 107.32 110.20 1rlt s GLY 108 Ca 0.07 -2.21 -0.08 0.00 0.00 0.00 0.00 44.72 42.50 1rlt s GLY 108 CO 0.11 -2.04 1.84 -2.00 0.00 0.00 0.00 173.10 171.01 1rlt h LEU 109 N 1.75 0.73 0.00 0.66 6.46 -1.75 -3.07 115.31 120.09 1rlt h LEU 109 Ca -0.43 0.01 -0.25 0.00 -0.12 0.00 0.00 57.88 57.09 1rlt h LEU 109 Cb 1.24 -0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 40.99 1rlt h LEU 109 CO 0.76 0.48 -1.50 1.56 -0.62 0.00 0.00 178.44 179.13 1rlt h GLN 110 N 0.87 0.00 -2.08 1.25 1.08 -1.97 -3.49 115.11 110.76 1rlt h GLN 110 Ca 0.33 0.00 0.22 0.00 -1.45 0.00 0.00 58.65 57.75 1rlt h GLN 110 Cb 0.12 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 27.46 1rlt h GLN 110 CO -0.15 0.56 0.59 0.45 -0.95 0.00 0.00 178.83 179.33 1rlt s SER 111 N -6.18 -0.13 0.27 1.46 0.15 -1.16 -5.01 113.70 103.09 1rlt s SER 111 Ca -0.03 -0.34 0.06 0.00 0.70 0.00 0.00 55.95 56.34 1rlt s SER 111 Cb 0.08 0.39 -0.03 0.00 -1.71 0.00 0.00 66.02 64.76 1rlt s SER 111 CO 0.82 -0.72 0.31 0.00 1.20 0.00 0.00 173.24 174.85 1rlt s ALA 112 N -2.98 3.85 0.03 5.45 0.00 0.48 -0.43 121.76 128.16 1rlt s ALA 112 Ca 0.13 -1.37 0.02 0.00 0.00 0.00 0.00 51.96 50.74 1rlt s ALA 112 Cb 0.00 -1.52 -0.02 0.00 0.00 0.00 0.00 23.12 21.58 1rlt s ALA 112 CO 0.01 0.18 -0.06 0.71 0.00 0.00 0.00 175.76 176.59 1rlt s TYR 113 N -2.09 0.54 -0.02 0.00 1.51 0.24 -1.16 117.35 116.36 1rlt s TYR 113 Ca 0.36 -0.42 -0.08 0.00 -1.01 0.00 0.00 57.07 55.91 1rlt s TYR 113 Cb -0.08 -0.33 0.01 0.00 -0.11 0.00 0.00 41.96 41.44 1rlt s TYR 113 CO 0.28 -0.09 0.17 0.54 -1.11 0.00 0.00 175.55 175.34 1rlt s VAL 114 N -1.15 0.06 0.34 0.71 0.11 -0.61 -0.32 120.40 119.54 1rlt s VAL 114 Ca -0.09 -0.49 -0.29 0.00 -2.93 0.00 0.00 61.98 58.18 1rlt s VAL 114 Cb -0.08 -0.41 -0.12 0.00 -1.53 0.00 0.00 36.38 34.23 1rlt s VAL 114 CO 0.00 -0.27 1.42 -0.24 -3.33 0.00 0.00 175.10 172.68 1rlt n SER 115 N 1.81 3.31 0.00 3.54 2.88 -1.26 -0.90 113.62 123.00 1rlt n SER 115 Ca -0.20 1.20 0.10 0.00 -1.33 0.00 0.00 58.87 58.64 1rlt n SER 115 Cb 0.56 -1.55 0.58 0.00 -0.75 0.00 0.00 64.21 63.06 1rlt n SER 115 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1rlt n GLU 116 N 0.85 0.60 -1.43 -1.46 0.28 -0.69 -2.68 120.64 116.11 1rlt n GLU 116 Ca 0.04 0.01 -0.21 0.00 -0.16 0.00 0.00 57.16 56.84 1rlt n GLU 116 Cb 0.37 -1.50 0.10 0.00 1.43 0.00 0.00 31.44 31.84 1rlt n GLU 116 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1rlt n ASN 117 N -1.02 4.91 -4.78 -1.84 3.02 -1.26 -5.01 115.26 109.28 1rlt n ASN 117 Ca 0.14 -3.77 -0.32 0.00 -0.03 0.00 0.00 54.58 50.60 1rlt n ASN 117 Cb 0.07 -0.63 -0.07 0.00 -0.61 0.00 0.00 39.78 38.55 1rlt n ASN 117 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rlt s ALA 118 N -3.55 3.57 0.19 5.41 0.00 -1.09 -5.06 121.76 121.23 1rlt s ALA 118 Ca 0.53 -0.91 -0.33 0.00 0.00 0.00 0.00 51.96 51.25 1rlt s ALA 118 Cb 0.44 -1.53 -0.14 0.00 0.00 0.00 0.00 23.12 21.89 1rlt s ALA 118 CO 0.01 0.71 1.39 -2.30 0.00 0.00 0.00 175.76 175.57 1rlt n PRO 119 N 0.99 1.77 -0.35 0.00 -0.02 -1.26 -4.82 135.00 131.32 1rlt n PRO 119 Ca -0.12 0.63 0.15 0.00 -2.02 0.00 0.00 63.50 62.14 1rlt n PRO 119 Cb 0.52 -2.28 0.35 0.00 -0.02 0.00 0.00 33.50 32.07 1rlt n PRO 119 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1rlt h GLU 120 N 4.45 0.67 -0.10 -0.52 4.81 -2.00 0.15 114.58 122.06 1rlt h GLU 120 Ca -0.45 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.69 1rlt h GLU 120 Cb 1.29 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 1rlt h GLU 120 CO 0.78 0.44 -0.19 0.00 -0.73 0.00 0.00 179.01 179.31 1rlt h ALA 121 N 1.68 1.51 -0.13 2.92 0.00 -2.00 -1.88 119.26 121.36 1rlt h ALA 121 Ca 0.61 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 55.11 1rlt h ALA 121 Cb 1.03 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.76 1rlt h ALA 121 CO -0.42 0.35 -0.60 0.35 0.00 0.00 0.00 179.25 178.93 1rlt h PHE 122 N 0.15 0.86 -0.71 0.00 3.57 -1.07 -2.82 116.94 116.91 1rlt h PHE 122 Ca 0.03 -0.37 -0.03 0.00 3.53 0.00 0.00 57.97 61.13 1rlt h PHE 122 Cb 0.43 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 1rlt h PHE 122 CO 0.00 1.17 0.34 0.28 -2.23 0.00 0.00 178.31 177.88 1rlt h VAL 123 N 0.30 1.24 -0.62 1.41 2.07 -1.10 -1.08 116.25 118.46 1rlt h VAL 123 Ca -0.04 -0.67 -0.03 0.00 0.82 0.00 0.00 66.70 66.79 1rlt h VAL 123 Cb 1.24 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1rlt h VAL 123 CO 0.13 0.28 0.28 0.00 0.02 0.00 0.00 177.57 178.27 1rlt h ALA 124 N 1.16 0.81 0.11 1.67 0.00 -1.38 0.33 119.26 121.97 1rlt h ALA 124 Ca 0.24 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1rlt h ALA 124 Cb 0.13 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1rlt h ALA 124 CO -0.03 0.39 -0.05 1.25 0.00 0.00 0.00 179.25 180.81 1rlt h LEU 125 N 0.86 -0.13 -1.66 0.00 5.85 -1.24 -2.76 115.31 116.22 1rlt h LEU 125 Ca 0.21 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 1rlt h LEU 125 Cb 0.15 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1rlt h LEU 125 CO -0.02 0.05 -0.17 0.24 -0.34 0.00 0.00 178.44 178.20 1rlt h MET 126 N -0.31 0.00 0.00 1.25 2.86 -0.95 -1.05 114.93 116.73 1rlt h MET 126 Ca -0.02 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1rlt h MET 126 Cb 0.25 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.91 1rlt h MET 126 CO 0.03 0.17 -0.03 0.00 1.06 0.00 0.00 176.91 178.14 1rlt h ALA 127 N 1.83 1.12 -0.00 6.32 0.00 -0.05 -0.05 119.26 128.43 1rlt h ALA 127 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1rlt h ALA 127 Cb 0.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1rlt h ALA 127 CO 0.02 0.03 -0.15 1.63 0.00 0.00 0.00 179.25 180.79 1rlt n LYS 128 N -3.29 0.54 -0.00 0.00 5.02 -0.40 -3.79 118.16 116.24 1rlt n LYS 128 Ca -0.02 -0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.08 1rlt n LYS 128 Cb 0.16 -1.50 -0.00 0.00 -0.02 0.00 0.00 35.03 33.67 1rlt n LYS 128 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1rlt n HIS 129 N -1.06 0.00 -3.61 2.13 8.25 -0.47 -4.93 115.22 115.53 1rlt n HIS 129 Ca 0.12 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.30 1rlt n HIS 129 Cb 0.29 -0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.25 1rlt n HIS 129 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1rlt s TYR 130 N -1.44 0.67 -0.42 4.41 1.51 -0.15 -2.32 117.35 119.60 1rlt s TYR 130 Ca 0.00 -1.00 0.26 0.00 -1.01 0.00 0.00 57.07 55.33 1rlt s TYR 130 Cb 0.00 -1.06 0.96 0.00 -0.11 0.00 0.00 41.96 41.75 1rlt s TYR 130 CO 0.01 -0.78 1.78 0.45 -1.11 0.00 0.00 175.55 175.89 1rlt h HIS 131 N 8.33 0.00 -3.51 2.71 3.86 -1.85 -3.35 115.15 121.33 1rlt h HIS 131 Ca -0.18 0.00 -0.69 0.00 -1.16 0.00 0.00 60.37 58.35 1rlt h HIS 131 Cb 1.04 0.00 -0.36 0.00 1.06 0.00 0.00 27.41 29.15 1rlt h HIS 131 CO 0.29 0.00 -0.50 1.03 0.86 0.00 0.00 177.93 179.60 1rlt s ARG 132 N -3.33 2.16 -0.24 2.45 0.52 -1.26 -5.02 118.95 114.23 1rlt s ARG 132 Ca 0.05 -2.16 -0.01 0.00 -0.52 0.00 0.00 55.73 53.09 1rlt s ARG 132 Cb 0.10 -3.58 0.07 0.00 0.52 0.00 0.00 34.95 32.05 1rlt s ARG 132 CO 0.50 -1.10 0.01 -1.17 0.02 0.00 0.00 175.30 173.56 1rlt s LEU 133 N 0.54 2.03 -0.13 2.53 2.96 -1.26 -0.39 118.68 124.96 1rlt s LEU 133 Ca 0.12 -1.16 -0.03 0.00 -0.22 0.00 0.00 54.13 52.85 1rlt s LEU 133 Cb -0.22 -0.90 -0.03 0.00 0.50 0.00 0.00 46.19 45.54 1rlt s LEU 133 CO -0.04 -0.30 -0.03 -0.75 -1.32 0.00 0.00 176.35 173.91 1rlt s LYS 134 N 1.60 3.47 0.35 1.98 2.20 -0.31 -4.94 119.74 124.09 1rlt s LYS 134 Ca -0.00 -0.49 -0.27 0.00 -0.36 0.00 0.00 55.97 54.85 1rlt s LYS 134 Cb -0.18 -2.88 -0.09 0.00 -1.51 0.00 0.00 37.83 33.17 1rlt s LYS 134 CO -0.11 0.38 1.14 -2.14 -0.36 0.00 0.00 175.35 174.26 1rlt s PRO 135 N -0.01 4.31 0.12 4.03 0.02 -1.26 -1.57 135.00 140.64 1rlt s PRO 135 Ca 0.02 1.81 0.02 0.00 0.02 0.00 0.00 61.00 62.86 1rlt s PRO 135 Cb -0.13 -2.87 -0.04 0.00 0.02 0.00 0.00 34.50 31.47 1rlt s PRO 135 CO 0.02 -0.08 -0.04 0.14 -0.33 0.00 0.00 177.00 176.71 1rlt s VAL 136 N -1.34 0.65 -0.08 3.83 -7.23 -0.08 -4.86 120.40 111.28 1rlt s VAL 136 Ca 0.52 -1.94 0.12 0.00 -1.81 0.00 0.00 61.98 58.87 1rlt s VAL 136 Cb -0.30 -1.80 -0.24 0.00 0.56 0.00 0.00 36.38 34.60 1rlt s VAL 136 CO 0.39 -0.76 0.51 0.29 -0.31 0.00 0.00 175.10 175.22 1rlt n LYS 137 N -0.09 0.65 -3.63 4.82 5.02 -1.26 -1.71 118.16 121.96 1rlt n LYS 137 Ca -0.10 0.23 -0.22 0.00 -2.02 0.00 0.00 58.31 56.20 1rlt n LYS 137 Cb 0.62 -1.73 -0.17 0.00 -0.02 0.00 0.00 35.03 33.73 1rlt n LYS 137 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1rlt s ASP 138 N -6.03 1.62 0.53 4.39 -1.08 -1.26 -4.92 116.67 109.93 1rlt s ASP 138 Ca -0.07 -0.21 0.20 0.00 -0.52 0.00 0.00 52.55 51.95 1rlt s ASP 138 Cb 0.07 -0.08 1.38 0.00 -1.46 0.00 0.00 42.92 42.84 1rlt s ASP 138 CO 0.82 -0.30 2.13 1.88 0.52 0.00 0.00 175.17 180.22 1rlt h TYR 139 N 8.41 0.00 0.00 -5.34 -1.99 -1.98 -0.98 116.97 115.09 1rlt h TYR 139 Ca -0.14 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.59 1rlt h TYR 139 Cb 1.14 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.87 1rlt h TYR 139 CO 0.30 0.00 0.00 1.96 -0.00 0.00 0.00 178.16 180.42 1rlt h GLN 140 N 0.00 0.00 -0.63 4.88 1.08 -1.97 -3.19 115.11 115.28 1rlt h GLN 140 Ca 0.05 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.11 1rlt h GLN 140 Cb 0.23 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 27.57 1rlt h GLN 140 CO -0.00 0.00 0.17 0.39 -0.95 0.00 0.00 178.83 178.44 1rlt n GLU 141 N -2.68 3.76 -2.66 1.46 -0.58 -0.37 -4.97 120.64 114.60 1rlt n GLU 141 Ca 0.02 -3.09 -0.43 0.00 -0.42 0.00 0.00 57.16 53.25 1rlt n GLU 141 Cb 0.32 -2.16 -0.02 0.00 -0.57 0.00 0.00 31.44 29.01 1rlt n GLU 141 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1rlt s ILE 142 N -2.95 4.71 -1.05 -3.67 1.01 -1.21 -4.97 121.20 113.07 1rlt s ILE 142 Ca 0.53 1.99 -0.12 0.00 0.00 0.00 0.00 60.65 63.05 1rlt s ILE 142 Cb 0.42 -4.28 0.23 0.00 0.01 0.00 0.00 42.46 38.84 1rlt s ILE 142 CO 0.13 -0.02 1.10 -0.62 0.00 0.00 0.00 174.94 175.52 1rlt s ASP 143 N 1.16 7.09 -0.05 3.58 2.15 -1.26 -4.90 116.67 124.44 1rlt s ASP 143 Ca 0.49 -3.14 -0.31 0.00 0.43 0.00 0.00 52.55 50.01 1rlt s ASP 143 Cb -0.18 -2.26 0.11 0.00 -0.30 0.00 0.00 42.92 40.29 1rlt s ASP 143 CO 0.17 -0.51 1.12 -0.62 -0.17 0.00 0.00 175.17 175.16 1rlt s ASP 144 N 2.00 -0.17 -0.06 -0.34 3.68 -1.26 -5.06 116.67 115.46 1rlt s ASP 144 Ca 0.30 -0.10 -0.21 0.00 2.13 0.00 0.00 52.55 54.68 1rlt s ASP 144 Cb -0.08 0.25 -0.04 0.00 -1.45 0.00 0.00 42.92 41.60 1rlt s ASP 144 CO -0.07 -0.44 0.59 0.54 0.13 0.00 0.00 175.17 175.93 1rlt s VAL 145 N -2.71 5.04 0.01 1.11 0.11 -1.26 -4.99 120.40 117.71 1rlt s VAL 145 Ca 0.10 1.22 0.01 0.00 -2.93 0.00 0.00 61.98 60.38 1rlt s VAL 145 Cb 0.00 -3.93 -0.04 0.00 -1.53 0.00 0.00 36.38 30.89 1rlt s VAL 145 CO -0.04 0.34 0.06 -0.76 -3.33 0.00 0.00 175.10 171.37 1rlt s LEU 146 N 0.35 3.78 0.00 2.54 1.43 -1.26 -1.85 118.68 123.67 1rlt s LEU 146 Ca 0.32 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.49 1rlt s LEU 146 Cb -0.17 -2.25 0.00 0.00 0.03 0.00 0.00 46.19 43.80 1rlt s LEU 146 CO 0.15 0.25 0.29 2.22 0.23 0.00 0.00 176.35 179.50 1rlt n PHE 147 N 1.09 0.00 -3.59 0.29 1.16 -0.80 -0.89 117.46 114.72 1rlt n PHE 147 Ca -0.13 0.00 -0.05 0.00 -1.87 0.00 0.00 57.45 55.40 1rlt n PHE 147 Cb 0.52 0.05 -0.03 0.00 -1.61 0.00 0.00 39.48 38.41 1rlt n PHE 147 CO 0.00 0.00 0.00 0.21 -1.87 0.00 0.00 176.76 175.10 1rlt s LYS 148 N 0.00 0.37 0.08 3.97 2.20 -1.21 -4.38 119.74 120.77 1rlt s LYS 148 Ca 0.00 -0.07 0.04 0.00 -0.36 0.00 0.00 55.97 55.58 1rlt s LYS 148 Cb 0.00 0.17 -0.03 0.00 -1.51 0.00 0.00 37.83 36.46 1rlt s LYS 148 CO 0.00 -0.15 -0.11 -0.06 -0.36 0.00 0.00 175.35 174.68 1rlt s PHE 149 N -2.02 1.00 -0.15 4.03 0.40 -0.84 -0.24 117.98 120.16 1rlt s PHE 149 Ca 0.07 -0.57 0.01 0.00 -0.60 0.00 0.00 56.93 55.84 1rlt s PHE 149 Cb -0.01 -0.56 0.02 0.00 0.51 0.00 0.00 43.02 42.98 1rlt s PHE 149 CO -0.05 -0.01 -0.16 0.45 0.70 0.00 0.00 175.22 176.15 1rlt s SER 150 N -2.06 2.78 -0.12 1.36 0.15 -0.43 0.15 113.70 115.53 1rlt s SER 150 Ca -0.00 -0.52 -0.07 0.00 0.70 0.00 0.00 55.95 56.05 1rlt s SER 150 Cb -0.06 -1.25 -0.04 0.00 -1.71 0.00 0.00 66.02 62.95 1rlt s SER 150 CO 0.01 -0.03 0.13 -0.76 1.20 0.00 0.00 173.24 173.79 1rlt s LEU 151 N 1.35 4.34 -1.47 3.45 1.02 0.34 -0.86 118.68 126.85 1rlt s LEU 151 Ca 0.03 0.44 -0.13 0.00 0.02 0.00 0.00 54.13 54.49 1rlt s LEU 151 Cb -0.13 -2.06 0.03 0.00 0.02 0.00 0.00 46.19 44.05 1rlt s LEU 151 CO -0.10 0.40 2.33 -3.20 0.02 0.00 0.00 176.35 175.80 1rlt n ASN 152 N 2.07 4.80 -3.72 2.29 5.15 -0.19 -3.33 115.26 122.32 1rlt n ASN 152 Ca -0.20 -2.82 -0.12 0.00 -0.60 0.00 0.00 54.58 50.85 1rlt n ASN 152 Cb 0.55 -1.63 -0.12 0.00 -0.53 0.00 0.00 39.78 38.05 1rlt n ASN 152 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1rlt s LEU 153 N 1.67 0.32 0.35 1.20 1.43 -1.26 -4.68 118.68 117.70 1rlt s LEU 153 Ca 0.50 0.70 -0.28 0.00 -1.03 0.00 0.00 54.13 54.02 1rlt s LEU 153 Cb 0.14 1.07 -0.12 0.00 0.03 0.00 0.00 46.19 47.32 1rlt s LEU 153 CO -0.08 -0.16 1.36 -2.65 0.23 0.00 0.00 176.35 175.05 1rlt n PRO 154 N 3.87 2.31 0.11 1.29 -0.02 -1.26 -2.71 135.00 138.59 1rlt n PRO 154 Ca -0.21 0.81 0.08 0.00 -2.02 0.00 0.00 63.50 62.16 1rlt n PRO 154 Cb 0.55 -2.44 0.41 0.00 -0.02 0.00 0.00 33.50 31.99 1rlt n PRO 154 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1rlt n ASP 155 N 0.77 0.39 0.21 2.55 5.68 0.51 -1.01 116.55 125.66 1rlt n ASP 155 Ca 0.04 0.67 0.07 0.00 -0.50 0.00 0.00 54.79 55.07 1rlt n ASP 155 Cb 0.37 -0.73 0.60 0.00 -1.14 0.00 0.00 41.12 40.22 1rlt n ASP 155 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1rlt h GLU 156 N 0.00 0.10 -0.30 0.11 4.81 -1.88 -1.35 114.58 116.07 1rlt h GLU 156 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1rlt h GLU 156 Cb 0.04 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1rlt h GLU 156 CO 0.00 0.07 0.00 1.04 -0.73 0.00 0.00 179.01 179.39 1rlt n GLN 157 N -4.52 1.65 -0.18 1.92 6.02 -0.18 -4.40 117.38 117.70 1rlt n GLN 157 Ca -0.02 -0.94 -0.02 0.00 -0.01 0.00 0.00 57.00 56.02 1rlt n GLN 157 Cb 0.09 -1.24 0.08 0.00 1.02 0.00 0.00 30.24 30.19 1rlt n GLN 157 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1rlt h ILE 158 N 1.50 0.77 -0.75 5.09 1.08 -1.41 -0.42 117.51 123.37 1rlt h ILE 158 Ca 0.00 -0.11 0.10 0.00 -0.39 0.00 0.00 64.86 64.46 1rlt h ILE 158 Cb 0.39 0.41 -0.05 0.00 -3.07 0.00 0.00 36.82 34.50 1rlt h ILE 158 CO 0.01 0.06 0.49 1.55 -0.69 0.00 0.00 178.15 179.57 1rlt h PRO 159 N 0.33 0.60 -0.18 2.37 0.13 -1.84 0.73 132.00 134.15 1rlt h PRO 159 Ca 0.27 -0.04 -0.13 0.00 -0.87 0.00 0.00 66.00 65.23 1rlt h PRO 159 Cb 0.33 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.32 1rlt h PRO 159 CO -0.29 0.40 -0.40 1.25 -0.23 0.00 0.00 178.00 178.73 1rlt h LEU 160 N 0.62 0.66 -1.11 1.56 7.12 -1.60 -3.03 115.31 119.55 1rlt h LEU 160 Ca 0.35 -0.56 -0.04 0.00 0.13 0.00 0.00 57.88 57.76 1rlt h LEU 160 Cb 0.52 -0.19 -0.03 0.00 -0.53 0.00 0.00 40.66 40.44 1rlt h LEU 160 CO -0.13 1.10 0.18 0.58 -0.13 0.00 0.00 178.44 180.05 1rlt h VAL 161 N 0.25 1.21 -0.04 1.05 2.07 0.09 -1.32 116.25 119.57 1rlt h VAL 161 Ca 0.00 -0.71 0.01 0.00 0.82 0.00 0.00 66.70 66.82 1rlt h VAL 161 Cb 1.00 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 1rlt h VAL 161 CO 0.09 0.27 -0.02 0.40 0.02 0.00 0.00 177.57 178.33 1rlt h ILE 162 N 0.80 0.92 -0.38 4.57 2.04 -0.89 -0.38 117.51 124.19 1rlt h ILE 162 Ca 0.19 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.02 1rlt h ILE 162 Cb 0.22 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 1rlt h ILE 162 CO -0.01 0.00 0.16 0.44 0.00 0.00 0.00 178.15 178.74 1rlt h ASP 163 N -0.03 0.53 -0.46 1.72 3.32 -1.35 0.30 116.42 120.45 1rlt h ASP 163 Ca 0.03 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 1rlt h ASP 163 Cb 0.06 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1rlt h ASP 163 CO -0.06 0.55 0.22 0.11 -1.72 0.00 0.00 179.24 178.34 1rlt h LYS 164 N 0.48 0.67 0.00 3.56 1.57 -1.08 -3.06 116.57 118.70 1rlt h LYS 164 Ca 0.13 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1rlt h LYS 164 Cb 0.18 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1rlt h LYS 164 CO -0.01 0.57 -0.33 -0.07 -0.57 0.00 0.00 179.45 179.03 1rlt h LEU 165 N 0.60 0.00 -0.59 2.94 3.38 -1.00 -3.16 115.31 117.49 1rlt h LEU 165 Ca 0.16 -0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.17 1rlt h LEU 165 Cb 0.12 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.80 1rlt h LEU 165 CO -0.02 0.03 0.19 -0.74 0.09 0.00 0.00 178.44 177.98 1rlt h HIS 166 N 0.00 0.32 0.13 1.13 2.76 -0.29 0.12 115.15 119.32 1rlt h HIS 166 Ca 0.00 0.03 -0.30 0.00 -2.20 0.00 0.00 60.37 57.90 1rlt h HIS 166 Cb 0.86 -0.05 -0.00 0.00 1.55 0.00 0.00 27.41 29.77 1rlt h HIS 166 CO 0.00 0.06 -1.55 -0.24 -1.30 0.00 0.00 177.93 174.90 1rlt h VAL 167 N 0.35 0.97 -0.25 5.26 3.04 -1.68 -1.93 116.25 122.00 1rlt h VAL 167 Ca 0.30 -2.42 -0.08 0.00 -1.01 0.00 0.00 66.70 63.48 1rlt h VAL 167 Cb 0.39 2.70 -0.01 0.00 -2.01 0.00 0.00 31.29 32.36 1rlt h VAL 167 CO -0.33 0.75 -0.20 0.00 -1.01 0.00 0.00 177.57 176.79 1rlt h ALA 168 N -0.00 1.18 -0.00 3.17 0.00 -1.49 -3.25 119.26 118.86 1rlt h ALA 168 Ca -0.32 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1rlt h ALA 168 Cb 1.86 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.53 1rlt h ALA 168 CO 0.09 0.52 -0.18 1.28 0.00 0.00 0.00 179.25 180.96 1rlt n LEU 169 N -4.16 0.68 -3.34 0.00 4.77 0.42 -4.99 117.00 110.37 1rlt n LEU 169 Ca -0.00 -0.66 -0.22 0.00 -0.03 0.00 0.00 56.01 55.10 1rlt n LEU 169 Cb 0.37 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.45 1rlt n LEU 169 CO 0.41 0.15 -0.05 -0.67 -1.33 0.00 0.00 177.39 175.90 1rlt n ASP 170 N -0.65 -3.25 -0.14 -1.43 4.64 -0.73 -0.20 116.55 114.79 1rlt n ASP 170 Ca 0.02 -0.35 -0.02 0.00 -1.38 0.00 0.00 54.79 53.06 1rlt n ASP 170 Cb 0.11 -2.72 -0.00 0.00 -1.04 0.00 0.00 41.12 37.46 1rlt n ASP 170 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1rlt n GLY 171 N -1.07 0.44 0.28 0.27 0.00 -1.25 -4.90 105.19 98.96 1rlt n GLY 171 Ca -0.01 -0.96 0.02 0.00 0.00 0.00 0.00 46.02 45.07 1rlt n GLY 171 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1rlt h ILE 172 N 0.00 1.16 -3.46 -0.61 1.08 -0.93 -3.43 117.51 111.32 1rlt h ILE 172 Ca -0.03 -0.59 -0.15 0.00 -0.39 0.00 0.00 64.86 63.70 1rlt h ILE 172 Cb 0.38 0.84 -0.21 0.00 -3.07 0.00 0.00 36.82 34.75 1rlt h ILE 172 CO 0.05 0.21 -0.48 -0.04 -0.69 0.00 0.00 178.15 177.20 1rlt s MET 173 N -5.11 0.46 -0.02 2.37 -1.94 -1.26 -4.35 119.30 109.45 1rlt s MET 173 Ca -0.07 -0.31 0.05 0.00 -1.71 0.00 0.00 55.69 53.64 1rlt s MET 173 Cb 0.16 0.19 -0.03 0.00 2.01 0.00 0.00 34.83 37.17 1rlt s MET 173 CO 0.75 -0.11 -0.15 0.21 -0.01 0.00 0.00 175.02 175.71 1rlt s LYS 174 N -1.21 2.36 -0.06 2.03 2.20 0.21 -4.88 119.74 120.39 1rlt s LYS 174 Ca -0.13 -0.79 -0.24 0.00 -0.36 0.00 0.00 55.97 54.45 1rlt s LYS 174 Cb -0.07 -2.31 -0.04 0.00 -1.51 0.00 0.00 37.83 33.90 1rlt s LYS 174 CO 0.02 0.59 0.72 -2.14 -0.36 0.00 0.00 175.35 174.18 1rlt s PRO 175 N -0.97 4.45 0.12 4.03 0.02 -1.26 -1.09 135.00 140.29 1rlt s PRO 175 Ca 0.13 0.92 -0.00 0.00 0.02 0.00 0.00 61.00 62.06 1rlt s PRO 175 Cb -0.11 -3.45 -0.04 0.00 0.02 0.00 0.00 34.50 30.93 1rlt s PRO 175 CO 0.02 0.06 0.03 0.14 -0.33 0.00 0.00 177.00 176.92 1rlt s VAL 176 N 0.79 0.25 0.44 3.83 -7.23 -0.37 -4.99 120.40 113.13 1rlt s VAL 176 Ca 0.38 -1.91 -0.23 0.00 -1.81 0.00 0.00 61.98 58.42 1rlt s VAL 176 Cb -0.18 -1.95 -0.08 0.00 0.56 0.00 0.00 36.38 34.73 1rlt s VAL 176 CO 0.19 -0.58 1.08 0.28 -0.31 0.00 0.00 175.10 175.76 1rlt s THR 177 N -3.94 3.54 -0.28 5.32 -1.32 -1.26 -0.39 115.64 117.31 1rlt s THR 177 Ca 0.20 1.11 0.24 0.00 -1.21 0.00 0.00 61.69 62.04 1rlt s THR 177 Cb 0.07 -3.54 0.32 0.00 -1.51 0.00 0.00 72.50 67.85 1rlt s THR 177 CO -0.00 -0.06 1.68 0.77 -2.21 0.00 0.00 174.62 174.79 1rlt h SER 178 N 2.09 0.00 0.00 8.08 4.64 -1.02 -3.40 113.55 123.94 1rlt h SER 178 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1rlt h SER 178 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1rlt h SER 178 CO 0.61 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 177.23 1rlt n GLY 179 N 0.86 1.73 1.58 -0.77 0.00 -1.26 -4.60 105.19 102.74 1rlt n GLY 179 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 1rlt n GLY 179 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1rlt n PHE 180 N -2.00 1.68 -0.13 1.61 1.16 -1.26 -4.71 117.46 113.80 1rlt n PHE 180 Ca 0.00 -1.93 0.00 0.00 -1.87 0.00 0.00 57.45 53.65 1rlt n PHE 180 Cb 0.00 -0.30 0.00 0.00 -1.61 0.00 0.00 39.48 37.57 1rlt n PHE 180 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1rlt n GLY 181 N -0.80 1.04 0.00 4.97 0.00 -1.26 -5.05 105.19 104.09 1rlt n GLY 181 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1rlt n GLY 181 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1rlt n PHE 182 N -2.00 -0.26 -5.05 1.61 3.72 -1.26 -0.36 117.46 113.86 1rlt n PHE 182 Ca 0.00 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.08 1rlt n PHE 182 Cb 0.00 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.39 1rlt n PHE 182 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1rlt s ILE 183 N -0.47 2.52 -0.08 4.37 1.01 -1.10 -0.38 121.20 127.07 1rlt s ILE 183 Ca 0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 60.65 59.76 1rlt s ILE 183 Cb 0.00 -1.98 -0.03 0.00 0.01 0.00 0.00 42.46 40.45 1rlt s ILE 183 CO 0.00 0.56 -0.03 -1.81 0.00 0.00 0.00 174.94 173.65 1rlt s ASP 184 N 0.00 4.94 -0.28 3.58 1.11 0.47 0.13 116.67 126.63 1rlt s ASP 184 Ca -0.07 0.06 -0.10 0.00 0.18 0.00 0.00 52.55 52.63 1rlt s ASP 184 Cb -0.15 -1.34 -0.03 0.00 1.07 0.00 0.00 42.92 42.47 1rlt s ASP 184 CO 0.05 0.36 0.15 -0.76 1.18 0.00 0.00 175.17 176.15 1rlt s LEU 185 N -0.81 3.88 0.30 1.23 1.43 0.12 -1.24 118.68 123.61 1rlt s LEU 185 Ca 0.12 -0.22 0.10 0.00 -1.03 0.00 0.00 54.13 53.11 1rlt s LEU 185 Cb -0.11 -2.03 -0.05 0.00 0.03 0.00 0.00 46.19 44.03 1rlt s LEU 185 CO 0.02 -0.09 -0.06 0.27 0.23 0.00 0.00 176.35 176.72 1rlt s ILE 186 N 1.68 2.75 -0.08 -0.59 -0.00 -0.25 -1.98 121.20 122.72 1rlt s ILE 186 Ca 0.06 -2.11 -0.30 0.00 -0.00 0.00 0.00 60.65 58.31 1rlt s ILE 186 Cb -0.16 -2.65 -0.03 0.00 -0.00 0.00 0.00 42.46 39.62 1rlt s ILE 186 CO 0.07 -0.30 1.26 -0.63 -0.00 0.00 0.00 174.94 175.35 1rlt s ILE 187 N -2.48 4.16 0.18 8.37 -1.09 -1.26 -0.62 121.20 128.47 1rlt s ILE 187 Ca 0.32 1.47 -0.32 0.00 -2.23 0.00 0.00 60.65 59.89 1rlt s ILE 187 Cb -0.03 -3.95 -0.16 0.00 -1.58 0.00 0.00 42.46 36.75 1rlt s ILE 187 CO 0.18 -0.05 1.16 -2.65 -1.23 0.00 0.00 174.94 172.35 1rlt n PRO 188 N 5.73 1.19 0.00 2.79 -0.02 -1.26 -0.90 135.00 142.53 1rlt n PRO 188 Ca 0.12 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1rlt n PRO 188 Cb 0.45 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 1rlt n PRO 188 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rlt n GLY 189 N 1.98 3.28 2.55 -1.23 0.00 -1.26 -4.93 105.19 105.59 1rlt n GLY 189 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 1rlt n GLY 189 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1rlt n LEU 190 N 0.00 7.09 -5.01 0.99 4.77 -0.08 -4.62 117.00 120.14 1rlt n LEU 190 Ca 0.00 -4.48 -0.22 0.00 -0.03 0.00 0.00 56.01 51.28 1rlt n LEU 190 Cb 0.00 -1.24 0.09 0.00 -2.33 0.00 0.00 43.42 39.93 1rlt n LEU 190 CO 0.00 1.85 0.45 -1.38 -1.33 0.00 0.00 177.39 176.98 1rlt s HIS 191 N -2.05 1.56 0.24 -1.77 -3.43 -1.25 -3.82 115.29 104.77 1rlt s HIS 191 Ca 0.55 -0.46 -0.05 0.00 -0.80 0.00 0.00 55.06 54.31 1rlt s HIS 191 Cb 0.32 -2.65 0.38 0.00 -1.43 0.00 0.00 32.58 29.20 1rlt s HIS 191 CO -0.21 -1.44 1.82 0.87 -2.00 0.00 0.00 174.74 173.79 1rlt h LYS 192 N -0.20 0.81 -0.41 -0.38 1.57 -1.75 -0.90 116.57 115.31 1rlt h LYS 192 Ca -0.34 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 1rlt h LYS 192 Cb 1.28 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 33.38 1rlt h LYS 192 CO 0.41 0.54 0.27 0.00 -0.57 0.00 0.00 179.45 180.10 1rlt h ALA 193 N 1.44 0.52 -0.89 3.86 0.00 -1.91 0.21 119.26 122.49 1rlt h ALA 193 Ca 0.39 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1rlt h ALA 193 Cb 0.31 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1rlt h ALA 193 CO -0.23 -0.02 0.57 -0.97 0.00 0.00 0.00 179.25 178.60 1rlt h ASN 194 N 0.56 1.05 -0.13 0.00 -0.73 -1.59 0.11 115.58 114.85 1rlt h ASN 194 Ca 0.15 -0.04 -0.03 0.00 1.87 0.00 0.00 56.30 58.25 1rlt h ASN 194 Cb -0.06 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 38.26 1rlt h ASN 194 CO -0.03 0.78 -0.02 1.23 -0.37 0.00 0.00 177.43 179.02 1rlt h GLY 195 N 1.23 0.26 1.23 1.57 0.00 -0.39 -2.90 103.07 104.06 1rlt h GLY 195 Ca 0.32 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1rlt h GLY 195 CO -0.07 0.19 0.50 -2.22 0.00 0.00 0.00 176.54 174.95 1rlt h ILE 196 N -0.05 1.21 -0.76 2.60 2.04 -0.26 -1.99 117.51 120.29 1rlt h ILE 196 Ca 0.03 -0.40 0.07 0.00 1.00 0.00 0.00 64.86 65.57 1rlt h ILE 196 Cb 0.42 0.07 -0.05 0.00 -0.74 0.00 0.00 36.82 36.52 1rlt h ILE 196 CO 0.01 0.20 0.50 0.28 0.00 0.00 0.00 178.15 179.14 1rlt h SER 197 N 1.06 0.68 -0.52 1.72 0.02 -0.59 -0.93 113.55 114.99 1rlt h SER 197 Ca 0.28 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.22 1rlt h SER 197 Cb -0.10 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.27 1rlt h SER 197 CO -0.06 0.43 0.27 0.03 -1.14 0.00 0.00 176.83 176.36 1rlt h ARG 198 N 0.77 0.78 -0.09 3.45 3.08 -1.19 -0.93 114.38 120.25 1rlt h ARG 198 Ca 0.33 -0.09 -0.24 0.00 0.07 0.00 0.00 59.98 60.05 1rlt h ARG 198 Cb 0.30 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 30.21 1rlt h ARG 198 CO -0.12 0.60 -0.88 -0.07 -1.07 0.00 0.00 179.97 178.44 1rlt h LEU 199 N 0.78 0.92 -0.50 3.04 3.38 -1.21 -2.46 115.31 119.26 1rlt h LEU 199 Ca 0.20 -0.65 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 1rlt h LEU 199 Cb 0.08 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1rlt h LEU 199 CO -0.03 1.45 0.28 -0.07 0.09 0.00 0.00 178.44 180.16 1rlt h LEU 200 N 0.48 0.62 -0.07 1.67 3.38 -1.03 0.91 115.31 121.26 1rlt h LEU 200 Ca -0.08 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 57.82 1rlt h LEU 200 Cb 1.52 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 42.09 1rlt h LEU 200 CO 0.18 0.53 -0.04 0.50 0.09 0.00 0.00 178.44 179.70 1rlt h LYS 201 N 0.67 -0.03 -0.99 1.13 3.64 -1.18 0.72 116.57 120.52 1rlt h LYS 201 Ca 0.18 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.68 1rlt h LYS 201 Cb 0.04 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 31.79 1rlt h LYS 201 CO -0.03 -0.02 0.62 0.00 -2.27 0.00 0.00 179.45 177.75 1rlt h ARG 202 N -0.03 0.92 -0.00 1.90 2.47 -0.92 -1.78 114.38 116.94 1rlt h ARG 202 Ca 0.04 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 1rlt h ARG 202 Cb 0.10 -0.21 0.00 0.00 -1.65 0.00 0.00 29.97 28.21 1rlt h ARG 202 CO -0.09 0.61 -0.47 0.91 0.56 0.00 0.00 179.97 181.48 1rlt n TRP 203 N -4.61 0.00 -3.24 3.04 8.01 0.26 -4.97 117.44 115.93 1rlt n TRP 203 Ca 0.19 0.00 -0.15 0.00 -1.31 0.00 0.00 57.50 56.23 1rlt n TRP 203 Cb 0.38 -0.19 0.08 0.00 -2.01 0.00 0.00 31.31 29.56 1rlt n TRP 203 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1rlt n ASP 204 N -1.23 -2.78 -4.31 -0.99 -0.08 0.24 -5.03 116.55 102.37 1rlt n ASP 204 Ca 0.07 -0.57 -0.16 0.00 -1.51 0.00 0.00 54.79 52.62 1rlt n ASP 204 Cb 0.34 -4.64 -0.10 0.00 2.34 0.00 0.00 41.12 39.06 1rlt n ASP 204 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1rlt s LEU 205 N -5.75 2.43 0.34 -2.67 1.43 -0.47 -5.04 118.68 108.94 1rlt s LEU 205 Ca 0.07 -1.09 0.08 0.00 -1.03 0.00 0.00 54.13 52.16 1rlt s LEU 205 Cb -0.01 -0.41 -0.07 0.00 0.03 0.00 0.00 46.19 45.74 1rlt s LEU 205 CO 0.65 -0.36 -0.05 -0.94 0.23 0.00 0.00 176.35 175.89 1rlt s SER 206 N -3.26 3.35 0.51 2.29 1.04 -1.26 -4.40 113.70 111.96 1rlt s SER 206 Ca 0.22 -1.25 0.24 0.00 0.48 0.00 0.00 55.95 55.64 1rlt s SER 206 Cb 0.03 -0.28 1.33 0.00 0.10 0.00 0.00 66.02 67.20 1rlt s SER 206 CO 0.05 -0.34 1.97 -0.65 0.98 0.00 0.00 173.24 175.25 1rlt h PRO 207 N 2.05 0.09 -0.04 4.02 0.11 -1.96 0.84 132.00 137.10 1rlt h PRO 207 Ca -0.42 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.70 1rlt h PRO 207 Cb 1.24 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1rlt h PRO 207 CO 0.72 0.06 0.25 1.96 -0.21 0.00 0.00 178.00 180.78 1rlt h GLN 208 N 0.09 0.00 -0.52 1.05 1.08 -1.95 0.41 115.11 115.27 1rlt h GLN 208 Ca 0.30 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.50 1rlt h GLN 208 Cb 1.07 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.50 1rlt h GLN 208 CO -0.03 0.00 0.00 0.09 -0.95 0.00 0.00 178.83 177.94 1rlt n ASN 209 N -3.06 3.81 -4.59 1.46 3.02 0.29 -4.73 115.26 111.45 1rlt n ASN 209 Ca -0.01 -2.24 -0.34 0.00 -0.03 0.00 0.00 54.58 51.96 1rlt n ASN 209 Cb 0.32 -0.43 -0.10 0.00 -0.61 0.00 0.00 39.78 38.96 1rlt n ASN 209 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1rlt s VAL 210 N -1.44 4.52 -0.17 2.41 1.01 0.14 -0.88 120.40 126.00 1rlt s VAL 210 Ca 0.40 -0.13 -0.07 0.00 0.00 0.00 0.00 61.98 62.18 1rlt s VAL 210 Cb 0.24 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 1rlt s VAL 210 CO 0.22 0.47 0.06 -0.69 0.00 0.00 0.00 175.10 175.16 1rlt s VAL 211 N 0.36 4.76 -0.01 2.92 1.01 0.11 -1.41 120.40 128.14 1rlt s VAL 211 Ca 0.01 -0.05 0.03 0.00 0.00 0.00 0.00 61.98 61.97 1rlt s VAL 211 Cb -0.13 -3.12 -0.00 0.00 0.00 0.00 0.00 36.38 33.12 1rlt s VAL 211 CO 0.01 0.49 -0.09 0.00 0.00 0.00 0.00 175.10 175.51 1rlt s ALA 212 N 0.13 0.73 -0.08 5.51 0.00 0.61 0.08 121.76 128.74 1rlt s ALA 212 Ca 0.05 -0.36 0.02 0.00 0.00 0.00 0.00 51.96 51.67 1rlt s ALA 212 Cb -0.12 -0.20 0.01 0.00 0.00 0.00 0.00 23.12 22.81 1rlt s ALA 212 CO 0.01 0.17 -0.14 0.42 0.00 0.00 0.00 175.76 176.22 1rlt s ILE 213 N -0.13 1.31 0.36 0.00 -1.09 -0.04 -0.09 121.20 121.51 1rlt s ILE 213 Ca 0.02 -0.56 -0.07 0.00 -2.23 0.00 0.00 60.65 57.81 1rlt s ILE 213 Cb -0.04 -1.20 0.02 0.00 -1.58 0.00 0.00 42.46 39.66 1rlt s ILE 213 CO -0.00 0.40 0.57 -0.83 -1.23 0.00 0.00 174.94 173.85 1rlt s GLY 214 N 0.77 1.14 0.00 6.18 0.00 -0.63 -1.86 107.32 112.91 1rlt s GLY 214 Ca -0.12 -1.27 0.00 0.00 0.00 0.00 0.00 44.72 43.33 1rlt s GLY 214 CO 0.02 -0.78 0.00 2.09 0.00 0.00 0.00 173.10 174.43 1rlt n ASP 215 N -1.40 0.00 -4.33 1.64 5.75 -1.26 -1.67 116.55 115.29 1rlt n ASP 215 Ca -0.02 0.00 -0.25 0.00 -0.01 0.00 0.00 54.79 54.51 1rlt n ASP 215 Cb 0.61 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.61 1rlt n ASP 215 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1rlt s SER 216 N 0.00 2.76 0.37 -1.12 1.04 -1.26 -1.23 113.70 114.27 1rlt s SER 216 Ca 0.00 -1.55 0.16 0.00 0.48 0.00 0.00 55.95 55.04 1rlt s SER 216 Cb 0.00 0.25 1.04 0.00 0.10 0.00 0.00 66.02 67.42 1rlt s SER 216 CO 0.00 -0.78 1.75 1.23 0.98 0.00 0.00 173.24 176.42 1rlt h GLY 217 N 1.88 1.45 0.76 7.32 0.00 -1.97 0.40 103.07 112.90 1rlt h GLY 217 Ca -0.39 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.71 1rlt h GLY 217 CO 0.64 -0.18 0.00 1.16 0.00 0.00 0.00 176.54 178.16 1rlt n ASN 218 N -4.72 0.00 -0.66 0.19 0.23 -1.26 -1.73 115.26 107.31 1rlt n ASN 218 Ca 0.26 -0.74 0.10 0.00 -0.53 0.00 0.00 54.58 53.68 1rlt n ASN 218 Cb 0.86 0.00 0.04 0.00 -2.08 0.00 0.00 39.78 38.60 1rlt n ASN 218 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1rlt n ASP 219 N -0.88 2.36 -0.07 0.53 8.00 0.13 -4.58 116.55 122.04 1rlt n ASP 219 Ca 0.11 -1.68 -0.08 0.00 0.71 0.00 0.00 54.79 53.84 1rlt n ASP 219 Cb 0.05 0.23 -0.06 0.00 -0.02 0.00 0.00 41.12 41.32 1rlt n ASP 219 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rlt h ALA 220 N 3.87 -0.61 0.00 2.24 0.00 -1.46 -0.32 119.26 122.98 1rlt h ALA 220 Ca 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1rlt h ALA 220 Cb 0.79 0.93 -0.01 0.00 0.00 0.00 0.00 17.79 19.51 1rlt h ALA 220 CO 0.00 -0.76 -0.23 1.05 0.00 0.00 0.00 179.25 179.31 1rlt h GLU 221 N -0.26 0.00 -0.39 0.00 9.09 -1.84 -1.40 114.58 119.78 1rlt h GLU 221 Ca 0.04 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 59.38 1rlt h GLU 221 Cb 0.36 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.45 1rlt h GLU 221 CO -0.34 0.23 -0.03 1.98 0.05 0.00 0.00 179.01 180.91 1rlt h MET 222 N 0.00 0.71 -0.26 1.06 4.05 -1.70 -1.36 114.93 117.42 1rlt h MET 222 Ca -0.00 -0.24 -0.20 0.00 -0.28 0.00 0.00 59.70 58.98 1rlt h MET 222 Cb 0.58 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.33 1rlt h MET 222 CO 0.03 0.82 -0.60 -0.07 0.23 0.00 0.00 176.91 177.32 1rlt h LEU 223 N 0.52 0.98 -1.29 3.39 3.38 -0.82 -2.64 115.31 118.82 1rlt h LEU 223 Ca 0.11 -0.55 -0.06 0.00 0.09 0.00 0.00 57.88 57.47 1rlt h LEU 223 Cb 0.52 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1rlt h LEU 223 CO 0.03 1.35 -0.12 0.50 0.09 0.00 0.00 178.44 180.29 1rlt h LYS 224 N 0.64 0.33 -0.22 1.13 1.63 -1.24 -3.11 116.57 115.74 1rlt h LYS 224 Ca -0.00 -0.08 -0.20 0.00 -0.85 0.00 0.00 60.65 59.52 1rlt h LYS 224 Cb 1.22 -0.04 0.01 0.00 -0.60 0.00 0.00 32.23 32.81 1rlt h LYS 224 CO 0.13 0.46 -0.64 1.98 -3.45 0.00 0.00 179.45 177.93 1rlt h MET 225 N 0.31 0.82 -6.84 1.90 4.05 -1.15 -3.46 114.93 110.57 1rlt h MET 225 Ca 0.06 -0.59 -0.50 0.00 -0.28 0.00 0.00 59.70 58.39 1rlt h MET 225 Cb 0.41 0.10 0.02 0.00 -0.80 0.00 0.00 31.60 31.33 1rlt h MET 225 CO 0.02 1.21 0.46 0.00 0.23 0.00 0.00 176.91 178.83 1rlt s ALA 226 N -3.94 3.34 0.13 0.39 0.00 -1.01 -4.79 121.76 115.89 1rlt s ALA 226 Ca -0.11 0.85 -0.17 0.00 0.00 0.00 0.00 51.96 52.54 1rlt s ALA 226 Cb 0.09 -3.31 -0.01 0.00 0.00 0.00 0.00 23.12 19.88 1rlt s ALA 226 CO 0.89 -0.16 1.71 -0.09 0.00 0.00 0.00 175.76 178.11 1rlt h ARG 227 N 3.56 0.53 -3.71 0.00 9.65 -1.36 -3.34 114.38 119.71 1rlt h ARG 227 Ca -0.47 -0.08 -0.73 0.00 -1.10 0.00 0.00 59.98 57.60 1rlt h ARG 227 Cb 1.21 -0.10 -0.31 0.00 -1.39 0.00 0.00 29.97 29.38 1rlt h ARG 227 CO 0.66 0.47 -0.18 0.71 2.80 0.00 0.00 179.97 184.43 1rlt s TYR 228 N -5.72 3.55 -0.21 2.20 1.51 -0.50 -4.96 117.35 113.22 1rlt s TYR 228 Ca -0.13 -2.39 -0.10 0.00 -1.01 0.00 0.00 57.07 53.44 1rlt s TYR 228 Cb 0.10 -3.46 -0.05 0.00 -0.11 0.00 0.00 41.96 38.44 1rlt s TYR 228 CO 0.74 -0.91 0.14 -1.54 -1.11 0.00 0.00 175.55 172.87 1rlt s SER 229 N 1.36 6.16 -0.10 2.29 1.04 -1.25 -0.29 113.70 122.90 1rlt s SER 229 Ca 0.17 0.19 0.04 0.00 0.48 0.00 0.00 55.95 56.82 1rlt s SER 229 Cb -0.16 -2.09 0.00 0.00 0.10 0.00 0.00 66.02 63.87 1rlt s SER 229 CO -0.05 0.14 -0.23 -0.36 0.98 0.00 0.00 173.24 173.72 1rlt s PHE 230 N 0.57 2.50 -0.19 5.02 0.40 0.87 -1.07 117.98 126.08 1rlt s PHE 230 Ca 0.08 -1.05 -0.09 0.00 -0.60 0.00 0.00 56.93 55.27 1rlt s PHE 230 Cb -0.12 -1.68 -0.05 0.00 0.51 0.00 0.00 43.02 41.69 1rlt s PHE 230 CO 0.00 -0.43 0.12 0.00 0.70 0.00 0.00 175.22 175.60 1rlt s ALA 231 N 0.42 3.65 0.62 5.36 0.00 -0.54 -1.60 121.76 129.67 1rlt s ALA 231 Ca -0.17 -0.70 -0.17 0.00 0.00 0.00 0.00 51.96 50.92 1rlt s ALA 231 Cb -0.18 -2.10 -0.02 0.00 0.00 0.00 0.00 23.12 20.82 1rlt s ALA 231 CO 0.07 0.20 1.17 -1.64 0.00 0.00 0.00 175.76 175.57 1rlt s MET 232 N 0.25 2.85 0.46 0.00 -1.94 -0.67 -2.30 119.30 117.96 1rlt s MET 232 Ca 0.08 1.68 0.17 0.00 -1.71 0.00 0.00 55.69 55.91 1rlt s MET 232 Cb -0.11 -1.93 1.14 0.00 2.01 0.00 0.00 34.83 35.93 1rlt s MET 232 CO -0.01 -1.27 1.99 0.78 -0.01 0.00 0.00 175.02 176.50 1rlt h GLY 233 N 0.54 0.41 -1.20 -0.03 0.00 -0.76 0.20 103.07 102.23 1rlt h GLY 233 Ca -0.49 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1rlt h GLY 233 CO 0.54 0.07 0.00 1.16 0.00 0.00 0.00 176.54 178.31 1rlt n ASN 234 N -4.45 1.95 -4.71 0.19 6.94 -1.26 -4.85 115.26 109.06 1rlt n ASN 234 Ca 0.09 -1.88 -0.31 0.00 -0.02 0.00 0.00 54.58 52.46 1rlt n ASN 234 Cb 0.42 -0.19 0.13 0.00 -2.36 0.00 0.00 39.78 37.78 1rlt n ASN 234 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rlt s ALA 235 N -1.61 1.80 0.69 -2.53 0.00 0.69 -4.99 121.76 115.81 1rlt s ALA 235 Ca 0.29 0.50 -0.12 0.00 0.00 0.00 0.00 51.96 52.63 1rlt s ALA 235 Cb 0.15 -3.39 0.01 0.00 0.00 0.00 0.00 23.12 19.90 1rlt s ALA 235 CO 0.22 -2.34 1.08 0.00 0.00 0.00 0.00 175.76 174.71 1rlt s ALA 236 N -2.69 2.53 0.16 0.00 0.00 -0.36 -4.81 121.76 116.59 1rlt s ALA 236 Ca 0.65 0.28 -0.19 0.00 0.00 0.00 0.00 51.96 52.70 1rlt s ALA 236 Cb -0.21 -3.24 0.07 0.00 0.00 0.00 0.00 23.12 19.74 1rlt s ALA 236 CO 0.56 -1.31 1.65 0.93 0.00 0.00 0.00 175.76 177.59 1rlt h GLU 237 N -0.48 -0.09 0.00 0.00 4.39 -1.94 -1.05 114.58 115.41 1rlt h GLU 237 Ca -0.45 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.24 1rlt h GLU 237 Cb 1.22 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1rlt h GLU 237 CO 0.55 -0.06 -0.07 -2.95 -1.16 0.00 0.00 179.01 175.31 1rlt h ASN 238 N -0.10 0.00 0.16 1.42 -1.07 -1.98 -1.86 115.58 112.15 1rlt h ASN 238 Ca 0.17 0.00 -0.30 0.00 0.07 0.00 0.00 56.30 56.24 1rlt h ASN 238 Cb 0.36 0.00 0.03 0.00 -2.07 0.00 0.00 38.32 36.64 1rlt h ASN 238 CO -0.40 0.07 -1.27 0.40 0.07 0.00 0.00 177.43 176.30 1rlt h ILE 239 N 0.00 1.30 -0.72 6.14 5.03 -1.62 -2.35 117.51 125.29 1rlt h ILE 239 Ca -0.00 -2.52 -0.00 0.00 -0.12 0.00 0.00 64.86 62.22 1rlt h ILE 239 Cb 0.35 2.83 -0.04 0.00 -3.03 0.00 0.00 36.82 36.94 1rlt h ILE 239 CO 0.01 0.76 0.44 0.11 -0.68 0.00 0.00 178.15 178.79 1rlt h LYS 240 N 0.19 0.97 -0.17 2.37 1.57 -0.69 -1.48 116.57 119.33 1rlt h LYS 240 Ca -0.20 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.45 1rlt h LYS 240 Cb 1.96 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 34.06 1rlt h LYS 240 CO 0.24 0.68 -0.07 1.96 -0.57 0.00 0.00 179.45 181.69 1rlt h GLN 241 N 0.99 0.35 -0.44 3.15 4.20 -1.38 -3.28 115.11 118.70 1rlt h GLN 241 Ca 0.26 -0.15 -0.02 0.00 0.06 0.00 0.00 58.65 58.81 1rlt h GLN 241 Cb -0.05 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1rlt h GLN 241 CO -0.05 0.64 0.20 0.82 -0.67 0.00 0.00 178.83 179.77 1rlt h ILE 242 N 0.04 1.19 -3.90 2.54 5.03 -1.09 -3.44 117.51 117.88 1rlt h ILE 242 Ca 0.04 -0.56 -0.51 0.00 -0.12 0.00 0.00 64.86 63.71 1rlt h ILE 242 Cb 0.53 0.75 0.04 0.00 -3.03 0.00 0.00 36.82 35.11 1rlt h ILE 242 CO 0.02 0.21 0.52 0.00 -0.68 0.00 0.00 178.15 178.22 1rlt s ALA 243 N -5.64 3.29 0.19 1.87 0.00 -0.59 -4.78 121.76 116.09 1rlt s ALA 243 Ca -0.13 1.00 0.06 0.00 0.00 0.00 0.00 51.96 52.88 1rlt s ALA 243 Cb 0.11 -3.38 0.07 0.00 0.00 0.00 0.00 23.12 19.91 1rlt s ALA 243 CO 0.75 -0.44 1.43 0.00 0.00 0.00 0.00 175.76 177.51 1rlt h ARG 244 N 3.09 0.11 -5.38 0.00 3.08 -1.81 -3.47 114.38 110.00 1rlt h ARG 244 Ca -0.48 -0.11 -0.61 0.00 0.07 0.00 0.00 59.98 58.85 1rlt h ARG 244 Cb 1.23 0.03 -0.13 0.00 0.08 0.00 0.00 29.97 31.17 1rlt h ARG 244 CO 0.64 0.86 -0.57 0.71 -1.07 0.00 0.00 179.97 180.54 1rlt s TYR 245 N -3.26 2.15 0.16 3.04 1.51 -0.23 -5.04 117.35 115.68 1rlt s TYR 245 Ca -0.02 -0.87 0.01 0.00 -1.01 0.00 0.00 57.07 55.18 1rlt s TYR 245 Cb 0.11 -1.58 -0.04 0.00 -0.11 0.00 0.00 41.96 40.34 1rlt s TYR 245 CO 0.81 0.23 0.02 0.00 -1.11 0.00 0.00 175.55 175.50 1rlt s ALA 246 N -2.92 1.22 0.26 3.71 0.00 -1.26 -1.47 121.76 121.30 1rlt s ALA 246 Ca 0.25 -1.57 -0.15 0.00 0.00 0.00 0.00 51.96 50.49 1rlt s ALA 246 Cb 0.06 0.67 0.00 0.00 0.00 0.00 0.00 23.12 23.86 1rlt s ALA 246 CO 0.13 -0.38 0.55 -0.08 0.00 0.00 0.00 175.76 175.98 1rlt s THR 247 N -3.78 0.00 1.16 0.00 -1.32 -0.97 -4.85 115.64 105.88 1rlt s THR 247 Ca 0.25 -1.29 -0.13 0.00 -1.21 0.00 0.00 61.69 59.31 1rlt s THR 247 Cb 0.07 -2.16 0.27 0.00 -1.51 0.00 0.00 72.50 69.17 1rlt s THR 247 CO 0.04 0.00 0.94 0.47 -2.21 0.00 0.00 174.62 173.86 1rlt n ASP 248 N -0.43 -1.69 -4.36 8.08 10.43 -1.26 -1.01 116.55 126.30 1rlt n ASP 248 Ca -0.02 -0.13 -0.29 0.00 2.57 0.00 0.00 54.79 56.91 1rlt n ASP 248 Cb 0.61 -1.25 0.17 0.00 1.84 0.00 0.00 41.12 42.49 1rlt n ASP 248 CO 0.00 0.00 0.00 1.51 -1.07 0.00 0.00 177.20 177.64 1rlt s ASP 249 N -2.37 2.90 0.14 -2.24 3.84 -1.26 -2.49 116.67 115.19 1rlt s ASP 249 Ca 0.68 0.63 0.18 0.00 -0.00 0.00 0.00 52.55 54.04 1rlt s ASP 249 Cb -0.24 -0.94 0.78 0.00 -1.38 0.00 0.00 42.92 41.14 1rlt s ASP 249 CO 0.65 -2.90 1.56 -0.46 -0.00 0.00 0.00 175.17 174.02 1rlt n ASN 250 N -3.94 0.35 -0.43 2.11 6.94 -1.26 -1.70 115.26 117.32 1rlt n ASN 250 Ca 0.11 0.59 0.13 0.00 -0.02 0.00 0.00 54.58 55.40 1rlt n ASN 250 Cb 0.60 -0.66 0.37 0.00 -2.36 0.00 0.00 39.78 37.72 1rlt n ASN 250 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1rlt n ASN 251 N -1.89 1.50 -1.78 0.53 3.02 -1.26 -3.43 115.26 111.94 1rlt n ASN 251 Ca 0.02 -1.30 -0.09 0.00 -0.03 0.00 0.00 54.58 53.19 1rlt n ASN 251 Cb 0.18 0.10 0.07 0.00 -0.61 0.00 0.00 39.78 39.52 1rlt n ASN 251 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1rlt n HIS 252 N -0.07 1.46 -3.54 3.10 8.25 -0.69 -4.99 115.22 118.75 1rlt n HIS 252 Ca 0.15 -1.83 -0.26 0.00 -0.26 0.00 0.00 57.72 55.51 1rlt n HIS 252 Cb 0.39 -0.27 0.03 0.00 1.12 0.00 0.00 29.99 31.25 1rlt n HIS 252 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1rlt n GLU 253 N -0.65 -5.13 -0.17 -0.41 1.02 -1.23 -4.78 120.64 109.29 1rlt n GLU 253 Ca 0.26 0.67 -0.01 0.00 -0.02 0.00 0.00 57.16 58.05 1rlt n GLU 253 Cb 0.89 -5.53 0.07 0.00 -0.02 0.00 0.00 31.44 26.85 1rlt n GLU 253 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1rlt h GLY 254 N -1.72 0.56 0.95 0.62 0.00 -1.56 -0.84 103.07 101.08 1rlt h GLY 254 Ca -0.53 0.06 0.01 0.00 0.00 0.00 0.00 47.33 46.87 1rlt h GLY 254 CO 0.60 -0.15 0.27 0.00 0.00 0.00 0.00 176.54 177.27 1rlt h ALA 255 N 1.47 0.55 0.00 3.60 0.00 -1.82 -2.17 119.26 120.89 1rlt h ALA 255 Ca 0.27 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1rlt h ALA 255 Cb 0.41 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1rlt h ALA 255 CO -0.44 -0.03 -0.24 -0.07 0.00 0.00 0.00 179.25 178.47 1rlt h LEU 256 N 0.55 0.00 -0.82 0.00 3.38 -1.72 -2.12 115.31 114.58 1rlt h LEU 256 Ca 0.17 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.01 1rlt h LEU 256 Cb -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1rlt h LEU 256 CO -0.06 0.24 -0.53 0.78 0.09 0.00 0.00 178.44 178.96 1rlt h ASN 257 N 0.00 0.18 -0.23 -0.43 2.35 -0.56 0.10 115.58 116.99 1rlt h ASN 257 Ca -0.00 -0.09 -0.04 0.00 -0.55 0.00 0.00 56.30 55.62 1rlt h ASN 257 Cb 0.50 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.81 1rlt h ASN 257 CO 0.03 0.67 -0.02 0.58 -1.65 0.00 0.00 177.43 177.05 1rlt h VAL 258 N 0.13 1.27 -0.52 2.81 2.07 -0.95 -0.27 116.25 120.78 1rlt h VAL 258 Ca 0.00 -0.95 0.03 0.00 0.82 0.00 0.00 66.70 66.61 1rlt h VAL 258 Cb 0.97 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 32.13 1rlt h VAL 258 CO 0.08 0.29 0.30 0.40 0.02 0.00 0.00 177.57 178.66 1rlt h ILE 259 N 0.18 1.02 -0.30 4.57 5.03 -1.10 -1.58 117.51 125.33 1rlt h ILE 259 Ca 0.06 -0.20 0.03 0.00 -0.12 0.00 0.00 64.86 64.63 1rlt h ILE 259 Cb 0.44 0.38 -0.03 0.00 -3.03 0.00 0.00 36.82 34.59 1rlt h ILE 259 CO 0.02 0.11 0.12 -0.61 -0.68 0.00 0.00 178.15 177.10 1rlt h GLN 260 N 0.59 0.25 -0.59 2.37 5.75 -0.55 -0.44 115.11 122.49 1rlt h GLN 260 Ca 0.22 -0.01 0.10 0.00 -0.15 0.00 0.00 58.65 58.80 1rlt h GLN 260 Cb 0.06 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 28.52 1rlt h GLN 260 CO -0.11 0.16 0.40 0.00 -2.65 0.00 0.00 178.83 176.63 1rlt h ALA 261 N 1.18 2.04 -0.27 3.38 0.00 -0.39 0.38 119.26 125.59 1rlt h ALA 261 Ca 0.13 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1rlt h ALA 261 Cb 0.09 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1rlt h ALA 261 CO -0.13 -0.18 -0.18 0.28 0.00 0.00 0.00 179.25 179.05 1rlt h VAL 262 N 0.39 1.30 -0.24 0.00 2.07 -0.16 0.96 116.25 120.57 1rlt h VAL 262 Ca 0.28 -1.31 -0.13 0.00 0.82 0.00 0.00 66.70 66.36 1rlt h VAL 262 Cb 0.57 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 1rlt h VAL 262 CO -0.07 0.41 -0.38 -0.07 0.02 0.00 0.00 177.57 177.48 1rlt h LEU 263 N 0.33 0.57 -1.66 2.57 3.38 -0.32 -3.09 115.31 117.09 1rlt h LEU 263 Ca 0.05 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1rlt h LEU 263 Cb 0.72 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1rlt h LEU 263 CO 0.05 0.90 0.00 0.47 0.09 0.00 0.00 178.44 179.95 1rlt n ASP 264 N -4.04 2.57 -3.50 -0.43 8.00 -0.01 -4.98 116.55 114.16 1rlt n ASP 264 Ca -0.01 -1.85 -0.19 0.00 0.71 0.00 0.00 54.79 53.44 1rlt n ASP 264 Cb 0.50 -0.01 0.06 0.00 -0.02 0.00 0.00 41.12 41.65 1rlt n ASP 264 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1rlt n ASN 265 N 1.00 -2.89 -4.87 -2.24 3.02 0.18 -5.02 115.26 104.44 1rlt n ASN 265 Ca 0.16 -0.74 -0.21 0.00 -0.03 0.00 0.00 54.58 53.76 1rlt n ASN 265 Cb 0.53 -4.65 0.08 0.00 -0.61 0.00 0.00 39.78 35.12 1rlt n ASN 265 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1rlt s THR 266 N -3.48 2.16 0.25 3.41 -4.23 -0.30 -4.44 115.64 109.02 1rlt s THR 266 Ca 0.13 -0.82 -0.31 0.00 -1.18 0.00 0.00 61.69 59.51 1rlt s THR 266 Cb -0.02 -2.34 -0.14 0.00 1.34 0.00 0.00 72.50 71.34 1rlt s THR 266 CO 0.77 0.00 1.28 0.00 -0.54 0.00 0.00 174.62 176.13 1rlt n TYR 267 N -2.49 1.88 0.14 3.99 9.36 -1.26 -0.17 117.16 128.60 1rlt n TYR 267 Ca 0.15 0.54 -0.01 0.00 3.32 0.00 0.00 57.90 61.90 1rlt n TYR 267 Cb 0.61 -2.39 0.17 0.00 -0.63 0.00 0.00 39.34 37.10 1rlt n TYR 267 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1rlt h PRO 268 N 3.46 0.00 -4.67 2.98 0.13 -1.95 -3.48 132.00 128.47 1rlt h PRO 268 Ca -0.44 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.03 1rlt h PRO 268 Cb 1.30 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.40 1rlt h PRO 268 CO 0.70 0.62 2.56 1.19 -0.23 0.00 0.00 178.00 182.84 1rlt n PHE 269 N -3.76 3.40 0.00 1.56 3.01 0.76 -5.15 117.46 117.28 1rlt n PHE 269 Ca -0.01 -2.57 0.00 0.00 1.01 0.00 0.00 57.45 55.88 1rlt n PHE 269 Cb 0.62 -2.41 0.00 0.00 -0.01 0.00 0.00 39.48 37.68 1rlt n PHE 269 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04