#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s5e n ASP 2 N 0.00 4.17 -4.63 0.53 5.75 -1.25 -4.33 116.55 116.79 1s5e n ASP 2 Ca 0.00 -2.62 -0.40 0.00 -0.01 0.00 0.00 54.79 51.75 1s5e n ASP 2 Cb 0.00 -0.63 0.02 0.00 -1.03 0.00 0.00 41.12 39.49 1s5e n ASP 2 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1s5e n ASP 3 N 0.42 1.47 -4.55 -1.12 8.00 -1.26 -4.93 116.55 114.58 1s5e n ASP 3 Ca 0.19 1.00 -0.28 0.00 0.71 0.00 0.00 54.79 56.40 1s5e n ASP 3 Cb 0.89 -1.40 -0.10 0.00 -0.02 0.00 0.00 41.12 40.49 1s5e n ASP 3 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1s5e s LYS 4 N -2.25 1.99 0.35 -1.24 -0.14 -1.26 -3.05 119.74 114.15 1s5e s LYS 4 Ca 0.66 -1.22 0.09 0.00 -1.36 0.00 0.00 55.97 54.13 1s5e s LYS 4 Cb -0.51 -2.16 -0.06 0.00 -1.68 0.00 0.00 37.83 33.42 1s5e s LYS 4 CO 0.55 0.45 -0.03 -0.51 -0.76 0.00 0.00 175.35 175.05 1s5e s LEU 5 N -2.59 2.86 -0.03 3.17 1.43 0.18 -4.75 118.68 118.95 1s5e s LEU 5 Ca 0.23 -1.14 -0.03 0.00 -1.03 0.00 0.00 54.13 52.16 1s5e s LEU 5 Cb -0.09 -1.14 0.01 0.00 0.03 0.00 0.00 46.19 45.00 1s5e s LEU 5 CO 0.14 -0.26 0.08 -0.31 0.23 0.00 0.00 176.35 176.23 1s5e s TYR 6 N -2.59 -0.09 -0.06 0.29 1.51 -0.16 0.07 117.35 116.33 1s5e s TYR 6 Ca 0.34 0.24 -0.02 0.00 -1.01 0.00 0.00 57.07 56.61 1s5e s TYR 6 Cb 0.03 -0.00 0.04 0.00 -0.11 0.00 0.00 41.96 41.91 1s5e s TYR 6 CO 0.18 -0.06 0.11 0.50 -1.11 0.00 0.00 175.55 175.17 1s5e s ARG 7 N 0.25 0.02 0.16 -0.62 3.52 -0.43 -0.32 118.95 121.52 1s5e s ARG 7 Ca -0.02 0.38 -0.30 0.00 -0.13 0.00 0.00 55.73 55.67 1s5e s ARG 7 Cb -0.03 -0.27 -0.07 0.00 -1.56 0.00 0.00 34.95 33.02 1s5e s ARG 7 CO -0.01 -0.23 1.03 0.00 -0.81 0.00 0.00 175.30 175.28 1s5e s ALA 8 N 1.61 3.32 -0.24 6.12 0.00 -1.26 -0.52 121.76 130.79 1s5e s ALA 8 Ca -0.04 0.70 -0.14 0.00 0.00 0.00 0.00 51.96 52.49 1s5e s ALA 8 Cb -0.12 -3.31 0.07 0.00 0.00 0.00 0.00 23.12 19.76 1s5e s ALA 8 CO -0.05 -0.10 0.58 0.34 0.00 0.00 0.00 175.76 176.54 1s5e s ASP 9 N -0.17 -0.78 0.48 0.00 -1.08 -0.12 -4.62 116.67 110.38 1s5e s ASP 9 Ca 0.48 1.27 0.27 0.00 -0.52 0.00 0.00 52.55 54.05 1s5e s ASP 9 Cb -0.27 1.15 1.11 0.00 -1.46 0.00 0.00 42.92 43.46 1s5e s ASP 9 CO 0.33 -0.22 1.90 0.77 0.52 0.00 0.00 175.17 178.47 1s5e h SER 10 N 7.00 0.00 -2.60 -0.34 4.64 -1.89 -1.47 113.55 118.89 1s5e h SER 10 Ca -0.33 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.46 1s5e h SER 10 Cb 1.21 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.32 1s5e h SER 10 CO 0.21 0.16 1.07 -0.13 -0.87 0.00 0.00 176.83 177.26 1s5e s ARG 11 N -3.74 4.17 0.69 4.77 0.52 -1.26 -4.81 118.95 119.29 1s5e s ARG 11 Ca 0.00 2.43 -0.11 0.00 -0.52 0.00 0.00 55.73 57.53 1s5e s ARG 11 Cb 0.10 -3.69 0.01 0.00 0.52 0.00 0.00 34.95 31.89 1s5e s ARG 11 CO 0.61 -0.80 1.08 -1.25 0.02 0.00 0.00 175.30 174.96 1s5e s PRO 12 N 2.98 2.95 0.27 3.54 0.04 -1.26 -4.81 135.00 138.71 1s5e s PRO 12 Ca 0.78 0.48 -0.01 0.00 0.04 0.00 0.00 61.00 62.29 1s5e s PRO 12 Cb -0.41 -2.04 0.51 0.00 0.04 0.00 0.00 34.50 32.60 1s5e s PRO 12 CO 0.34 -0.97 1.81 -1.35 0.04 0.00 0.00 177.00 176.87 1s5e h PRO 13 N -0.60 0.82 -1.01 0.56 0.11 -1.98 -1.19 132.00 128.71 1s5e h PRO 13 Ca -0.45 -0.05 0.04 0.00 0.11 0.00 0.00 66.00 65.65 1s5e h PRO 13 Cb 1.25 -0.18 -0.06 0.00 0.11 0.00 0.00 31.00 32.11 1s5e h PRO 13 CO 0.64 0.54 0.66 -0.44 -0.21 0.00 0.00 178.00 179.19 1s5e h ASP 14 N 0.84 1.11 -0.29 -2.05 3.32 -1.99 0.31 116.42 117.66 1s5e h ASP 14 Ca 0.46 -0.01 -0.15 0.00 0.02 0.00 0.00 57.03 57.35 1s5e h ASP 14 Cb 0.50 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 1s5e h ASP 14 CO -0.28 0.76 -0.42 -0.08 -1.72 0.00 0.00 179.24 177.50 1s5e h GLU 15 N 1.28 0.80 -0.48 3.56 4.81 -1.62 -2.13 114.58 120.80 1s5e h GLU 15 Ca 0.40 -0.47 0.06 0.00 -0.13 0.00 0.00 59.36 59.22 1s5e h GLU 15 Cb -0.01 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.36 1s5e h GLU 15 CO -0.12 1.10 0.19 0.82 -0.73 0.00 0.00 179.01 180.27 1s5e h ILE 16 N 0.56 0.87 -0.44 2.32 1.08 -0.86 0.88 117.51 121.93 1s5e h ILE 16 Ca 0.03 -0.13 -0.02 0.00 -0.39 0.00 0.00 64.86 64.35 1s5e h ILE 16 Cb 1.02 0.46 -0.02 0.00 -3.07 0.00 0.00 36.82 35.20 1s5e h ILE 16 CO 0.10 0.07 0.21 0.50 -0.69 0.00 0.00 178.15 178.34 1s5e h LYS 17 N 0.38 0.63 -0.12 2.37 1.63 -0.85 0.05 116.57 120.66 1s5e h LYS 17 Ca 0.23 -0.09 -0.05 0.00 -0.85 0.00 0.00 60.65 59.88 1s5e h LYS 17 Cb 0.21 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 31.71 1s5e h LYS 17 CO -0.21 0.54 -0.17 1.96 -3.45 0.00 0.00 179.45 178.12 1s5e h GLN 18 N 0.57 0.20 -0.00 1.90 7.50 -0.79 -2.30 115.11 122.20 1s5e h GLN 18 Ca 0.15 -0.05 0.00 0.00 0.50 0.00 0.00 58.65 59.25 1s5e h GLN 18 Cb 0.12 -0.03 0.00 0.00 0.05 0.00 0.00 27.48 27.62 1s5e h GLN 18 CO -0.02 0.38 -0.09 0.43 -1.50 0.00 0.00 178.83 178.03 1s5e n SER 19 N -4.25 0.15 0.00 1.46 7.64 0.25 -4.91 113.62 113.96 1s5e n SER 19 Ca -0.01 0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1s5e n SER 19 Cb 0.29 -0.28 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 1s5e n SER 19 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1s5e n GLY 20 N 1.41 0.42 0.00 0.23 0.00 -0.83 -1.61 105.19 104.82 1s5e n GLY 20 Ca 0.10 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1s5e n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s5e n GLY 21 N -3.00 0.93 3.49 -0.02 0.00 -0.06 -0.82 105.19 105.71 1s5e n GLY 21 Ca 0.00 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 1s5e n GLY 21 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s5e s LEU 22 N 0.00 4.62 0.16 0.99 1.43 0.36 -4.57 118.68 121.66 1s5e s LEU 22 Ca 0.00 -0.60 0.01 0.00 -1.03 0.00 0.00 54.13 52.50 1s5e s LEU 22 Cb 0.00 -2.63 -0.04 0.00 0.03 0.00 0.00 46.19 43.55 1s5e s LEU 22 CO 0.00 -0.94 0.32 -0.04 0.23 0.00 0.00 176.35 175.92 1s5e s MET 23 N 3.00 3.48 0.77 1.70 -1.94 -1.26 -0.95 119.30 124.10 1s5e s MET 23 Ca 0.21 -0.45 -0.11 0.00 -1.71 0.00 0.00 55.69 53.62 1s5e s MET 23 Cb -0.16 -2.92 0.06 0.00 2.01 0.00 0.00 34.83 33.82 1s5e s MET 23 CO 0.16 0.48 1.11 -2.14 -0.01 0.00 0.00 175.02 174.62 1s5e s PRO 24 N -3.14 2.13 0.16 2.03 0.02 -1.26 -4.93 135.00 130.01 1s5e s PRO 24 Ca 0.36 1.31 -0.34 0.00 0.02 0.00 0.00 61.00 62.35 1s5e s PRO 24 Cb -0.11 -1.87 -0.14 0.00 0.02 0.00 0.00 34.50 32.39 1s5e s PRO 24 CO 0.28 -1.75 1.56 -2.13 -0.33 0.00 0.00 177.00 174.63 1s5e n ARG 25 N -3.40 2.11 0.00 5.54 0.63 0.02 -2.15 116.66 119.41 1s5e n ARG 25 Ca 0.10 0.76 0.00 0.00 -0.92 0.00 0.00 57.85 57.79 1s5e n ARG 25 Cb 0.52 -2.52 0.00 0.00 0.45 0.00 0.00 32.46 30.91 1s5e n ARG 25 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1s5e n GLY 26 N 3.35 0.97 3.50 5.14 0.00 -1.26 -4.82 105.19 112.07 1s5e n GLY 26 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1s5e n GLY 26 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1s5e s GLN 27 N -0.74 3.75 0.03 1.61 2.00 -0.91 -4.99 119.66 120.41 1s5e s GLN 27 Ca 0.00 -0.43 0.23 0.00 -2.00 0.00 0.00 55.36 53.16 1s5e s GLN 27 Cb 0.00 -3.48 0.06 0.00 0.80 0.00 0.00 33.01 30.39 1s5e s GLN 27 CO 0.00 -0.20 1.05 -1.13 -0.50 0.00 0.00 175.29 174.51 1s5e n SER 28 N 4.98 0.64 -3.75 6.67 3.41 -1.26 -4.70 113.62 119.61 1s5e n SER 28 Ca -0.15 -0.33 -0.13 0.00 -0.26 0.00 0.00 58.87 58.00 1s5e n SER 28 Cb 0.51 0.77 -0.10 0.00 -0.26 0.00 0.00 64.21 65.14 1s5e n SER 28 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1s5e s GLU 29 N -3.15 0.48 0.04 4.33 2.02 -1.26 -4.43 118.70 116.73 1s5e s GLU 29 Ca 0.05 0.32 -0.28 0.00 0.02 0.00 0.00 54.97 55.08 1s5e s GLU 29 Cb 0.15 0.23 -0.17 0.00 0.10 0.00 0.00 34.13 34.44 1s5e s GLU 29 CO 0.80 -0.08 1.41 -0.92 0.02 0.00 0.00 175.26 176.48 1s5e h TYR 30 N 5.15 -0.63 0.00 1.61 3.20 -1.58 -3.30 116.97 121.42 1s5e h TYR 30 Ca -0.27 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.55 1s5e h TYR 30 Cb 1.18 0.21 -0.00 0.00 1.54 0.00 0.00 36.73 39.66 1s5e h TYR 30 CO 0.43 -0.32 -0.50 0.74 -1.64 0.00 0.00 178.16 176.87 1s5e h PHE 31 N -0.85 0.00 -0.87 -3.82 0.04 -1.93 -3.41 116.94 106.09 1s5e h PHE 31 Ca -0.07 0.00 -0.46 0.00 2.80 0.00 0.00 57.97 60.24 1s5e h PHE 31 Cb 0.59 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.67 1s5e h PHE 31 CO -0.01 0.13 1.23 0.16 -0.60 0.00 0.00 178.31 179.22 1s5e s ASP 32 N -5.96 5.86 -0.45 2.17 -4.77 -1.25 -4.83 116.67 107.45 1s5e s ASP 32 Ca 0.03 -1.26 -0.01 0.00 -3.30 0.00 0.00 52.55 48.01 1s5e s ASP 32 Cb 0.07 -2.57 0.35 0.00 -1.09 0.00 0.00 42.92 39.68 1s5e s ASP 32 CO 0.73 -2.11 1.96 -1.14 0.70 0.00 0.00 175.17 175.31 1s5e n ARG 33 N 8.77 2.14 0.04 2.11 3.00 -1.26 -4.60 116.66 126.86 1s5e n ARG 33 Ca 0.38 -2.30 -0.13 0.00 -0.00 0.00 0.00 57.85 55.81 1s5e n ARG 33 Cb 0.48 -1.90 -0.08 0.00 0.00 0.00 0.00 32.46 30.96 1s5e n ARG 33 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1s5e h GLY 34 N 2.21 -0.05 -7.46 5.14 0.00 -1.96 -3.39 103.07 97.56 1s5e h GLY 34 Ca 0.44 0.02 -0.68 0.00 0.00 0.00 0.00 47.33 47.11 1s5e h GLY 34 CO 1.07 -0.02 -0.60 -1.08 0.00 0.00 0.00 176.54 175.92 1s5e s THR 35 N -5.46 4.15 -0.49 4.70 -1.32 -1.26 -5.06 115.64 110.90 1s5e s THR 35 Ca -0.14 -0.66 -0.19 0.00 -1.21 0.00 0.00 61.69 59.50 1s5e s THR 35 Cb 0.04 -3.16 0.05 0.00 -1.51 0.00 0.00 72.50 67.93 1s5e s THR 35 CO 0.66 0.04 0.58 -1.58 -2.21 0.00 0.00 174.62 172.11 1s5e s GLN 36 N 1.53 3.12 0.77 7.08 2.00 -1.26 -5.03 119.66 127.86 1s5e s GLN 36 Ca 0.03 -0.88 -0.12 0.00 -2.00 0.00 0.00 55.36 52.39 1s5e s GLN 36 Cb -0.17 -4.07 0.06 0.00 0.80 0.00 0.00 33.01 29.62 1s5e s GLN 36 CO 0.04 -1.14 1.11 0.00 -0.50 0.00 0.00 175.29 174.80 1s5e s MET 37 N 2.48 2.17 0.21 1.67 0.23 -1.26 -4.99 119.30 119.81 1s5e s MET 37 Ca 0.14 1.30 -0.31 0.00 -1.03 0.00 0.00 55.69 55.79 1s5e s MET 37 Cb -0.19 -1.88 -0.11 0.00 -1.53 0.00 0.00 34.83 31.12 1s5e s MET 37 CO 0.12 -1.72 1.60 1.21 -2.03 0.00 0.00 175.02 174.20 1s5e s ASN 38 N -3.05 6.50 -0.27 -1.18 2.47 -1.26 -4.94 114.94 113.22 1s5e s ASN 38 Ca 0.64 2.75 0.02 0.00 0.42 0.00 0.00 52.86 56.70 1s5e s ASN 38 Cb -0.19 -2.61 0.06 0.00 -1.45 0.00 0.00 41.25 37.06 1s5e s ASN 38 CO 0.53 -0.87 -0.09 -0.63 -3.72 0.00 0.00 177.10 172.32 1s5e s ILE 39 N 0.81 2.28 -0.27 -5.21 1.01 -1.26 -2.03 121.20 116.53 1s5e s ILE 39 Ca 0.69 -1.63 -0.02 0.00 0.00 0.00 0.00 60.65 59.70 1s5e s ILE 39 Cb -0.46 -2.35 0.16 0.00 0.01 0.00 0.00 42.46 39.82 1s5e s ILE 39 CO 0.36 -0.06 0.48 0.21 0.00 0.00 0.00 174.94 175.93 1s5e s ASN 40 N 1.12 -0.50 0.11 3.58 3.84 -0.70 -4.45 114.94 117.94 1s5e s ASN 40 Ca -0.08 0.48 -0.17 0.00 0.21 0.00 0.00 52.86 53.29 1s5e s ASN 40 Cb -0.20 1.59 -0.04 0.00 -0.55 0.00 0.00 41.25 42.05 1s5e s ASN 40 CO -0.05 -0.29 1.64 0.25 -2.79 0.00 0.00 177.10 175.87 1s5e h LEU 41 N 8.10 0.47 -0.59 3.21 5.85 -1.70 -0.34 115.31 130.31 1s5e h LEU 41 Ca -0.20 -0.20 0.08 0.00 0.84 0.00 0.00 57.88 58.40 1s5e h LEU 41 Cb 1.16 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 42.00 1s5e h LEU 41 CO 0.26 0.54 0.24 0.22 -0.34 0.00 0.00 178.44 179.37 1s5e h TYR 42 N 0.37 0.43 -0.55 1.25 3.20 -1.36 0.91 116.97 121.23 1s5e h TYR 42 Ca 0.11 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.91 1s5e h TYR 42 Cb 0.24 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 1s5e h TYR 42 CO 0.00 0.15 -0.03 -0.44 -1.64 0.00 0.00 178.16 176.20 1s5e h ASP 43 N 0.45 0.98 0.04 -2.11 3.32 -1.74 -2.71 116.42 114.64 1s5e h ASP 43 Ca 0.29 -0.32 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1s5e h ASP 43 Cb 0.31 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1s5e h ASP 43 CO -0.26 1.06 -0.02 -0.74 -1.72 0.00 0.00 179.24 177.56 1s5e h HIS 44 N 0.87 -0.05 -0.07 4.55 -0.00 -0.45 -2.32 115.15 117.67 1s5e h HIS 44 Ca 0.15 -0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.48 1s5e h HIS 44 Cb 0.57 0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.99 1s5e h HIS 44 CO 0.04 0.05 -0.16 0.00 -0.00 0.00 0.00 177.93 177.86 1s5e h ALA 45 N 0.80 1.60 -0.00 5.26 0.00 -0.78 -1.85 119.26 124.29 1s5e h ALA 45 Ca -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1s5e h ALA 45 Cb 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1s5e h ALA 45 CO 0.01 0.30 -0.21 0.54 0.00 0.00 0.00 179.25 179.89 1s5e n ARG 46 N -4.29 0.20 -1.65 0.00 1.74 -1.03 -4.76 116.66 106.87 1s5e n ARG 46 Ca -0.02 -0.07 -0.38 0.00 -0.77 0.00 0.00 57.85 56.61 1s5e n ARG 46 Cb 0.26 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.25 1s5e n ARG 46 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1s5e n GLY 47 N 1.44 -0.01 3.75 -0.13 0.00 -0.70 -4.96 105.19 104.58 1s5e n GLY 47 Ca 0.09 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 1s5e n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1s5e s THR 48 N -1.43 3.99 -0.16 2.61 2.01 -1.26 -4.96 115.64 116.44 1s5e s THR 48 Ca 0.74 2.00 -0.08 0.00 0.31 0.00 0.00 61.69 64.67 1s5e s THR 48 Cb -0.43 -4.28 -0.04 0.00 0.01 0.00 0.00 72.50 67.76 1s5e s THR 48 CO 0.48 0.48 0.10 -1.10 -0.69 0.00 0.00 174.62 173.89 1s5e s GLN 49 N -1.21 3.79 -0.08 4.92 -0.21 -1.26 -4.85 119.66 120.75 1s5e s GLN 49 Ca 0.42 -0.25 0.01 0.00 0.02 0.00 0.00 55.36 55.56 1s5e s GLN 49 Cb -0.27 -3.23 0.14 0.00 1.00 0.00 0.00 33.01 30.65 1s5e s GLN 49 CO 0.33 0.47 1.13 0.41 -2.12 0.00 0.00 175.29 175.51 1s5e n GLY 51 N 2.95 2.41 2.94 3.09 0.00 -1.26 -4.97 105.19 110.35 1s5e n GLY 51 Ca -0.18 -0.21 -0.10 0.00 0.00 0.00 0.00 46.02 45.53 1s5e n GLY 51 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1s5e s PHE 52 N -0.73 0.14 0.26 1.61 0.40 -1.26 -4.74 117.98 113.66 1s5e s PHE 52 Ca 0.11 -0.28 -0.29 0.00 -0.60 0.00 0.00 56.93 55.86 1s5e s PHE 52 Cb 0.09 -0.10 -0.09 0.00 0.51 0.00 0.00 43.02 43.43 1s5e s PHE 52 CO 0.02 -0.11 1.18 0.08 0.70 0.00 0.00 175.22 177.08 1s5e s VAL 53 N -0.84 3.33 -0.36 -0.44 1.01 -1.26 -4.85 120.40 117.00 1s5e s VAL 53 Ca -0.09 1.27 -0.45 0.00 0.00 0.00 0.00 61.98 62.71 1s5e s VAL 53 Cb -0.06 -3.81 -0.20 0.00 0.00 0.00 0.00 36.38 32.32 1s5e s VAL 53 CO -0.00 0.27 1.49 0.54 0.00 0.00 0.00 175.10 177.40 1s5e n ARG 54 N 1.49 0.12 -0.49 2.72 1.74 -1.26 -4.81 116.66 116.16 1s5e n ARG 54 Ca 0.01 0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.13 1s5e n ARG 54 Cb 0.44 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 1s5e n ARG 54 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 1s5e n HIS 55 N 3.51 0.00 -2.78 -1.55 1.44 -1.26 -1.47 115.22 113.11 1s5e n HIS 55 Ca 0.28 0.00 -0.21 0.00 -2.01 0.00 0.00 57.72 55.78 1s5e n HIS 55 Cb -0.01 0.10 0.03 0.00 0.12 0.00 0.00 29.99 30.23 1s5e n HIS 55 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1s5e s ASP 56 N -0.49 5.47 -1.45 4.39 -1.08 -1.24 -0.80 116.67 121.47 1s5e s ASP 56 Ca 0.00 0.05 -0.10 0.00 -0.52 0.00 0.00 52.55 51.98 1s5e s ASP 56 Cb 0.00 -1.06 0.04 0.00 -1.46 0.00 0.00 42.92 40.44 1s5e s ASP 56 CO 0.00 -0.98 0.98 0.47 0.52 0.00 0.00 175.17 176.16 1s5e n ASP 57 N -2.22 -5.70 0.00 -0.34 8.00 -1.26 -3.37 116.55 111.65 1s5e n ASP 57 Ca 0.06 -0.56 0.00 0.00 0.71 0.00 0.00 54.79 55.00 1s5e n ASP 57 Cb 0.59 -4.53 0.00 0.00 -0.02 0.00 0.00 41.12 37.16 1s5e n ASP 57 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1s5e n GLY 58 N -1.77 0.70 3.27 0.44 0.00 -0.86 -1.72 105.19 105.23 1s5e n GLY 58 Ca -0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 1s5e n GLY 58 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1s5e s TYR 59 N -2.40 1.53 -0.09 1.61 1.51 -1.22 -0.45 117.35 117.85 1s5e s TYR 59 Ca 0.00 -0.52 0.03 0.00 -1.01 0.00 0.00 57.07 55.57 1s5e s TYR 59 Cb 0.00 -0.80 0.01 0.00 -0.11 0.00 0.00 41.96 41.06 1s5e s TYR 59 CO 0.00 0.19 -0.19 0.14 -1.11 0.00 0.00 175.55 174.58 1s5e s VAL 60 N -2.00 1.72 0.33 0.71 -7.23 -0.70 -3.68 120.40 109.54 1s5e s VAL 60 Ca 0.10 -0.81 -0.13 0.00 -1.81 0.00 0.00 61.98 59.33 1s5e s VAL 60 Cb -0.06 -1.51 -0.08 0.00 0.56 0.00 0.00 36.38 35.29 1s5e s VAL 60 CO 0.04 0.48 0.71 -0.55 -0.31 0.00 0.00 175.10 175.47 1s5e s SER 61 N 0.54 6.68 0.16 4.85 0.15 -0.54 -0.91 113.70 124.63 1s5e s SER 61 Ca -0.16 1.17 0.00 0.00 0.70 0.00 0.00 55.95 57.67 1s5e s SER 61 Cb -0.17 -2.33 -0.04 0.00 -1.71 0.00 0.00 66.02 61.77 1s5e s SER 61 CO 0.06 -0.23 0.05 0.42 1.20 0.00 0.00 173.24 174.73 1s5e s THR 62 N -2.05 0.31 0.27 6.45 -4.23 0.45 -4.84 115.64 112.00 1s5e s THR 62 Ca 0.52 -1.95 0.07 0.00 -1.18 0.00 0.00 61.69 59.16 1s5e s THR 62 Cb -0.10 -2.16 -0.04 0.00 1.34 0.00 0.00 72.50 71.54 1s5e s THR 62 CO 0.22 -0.39 0.19 -0.44 -0.54 0.00 0.00 174.62 173.66 1s5e s SER 63 N -3.12 5.33 0.00 3.99 0.01 0.56 -1.79 113.70 118.68 1s5e s SER 63 Ca 0.27 -0.37 0.28 0.00 1.31 0.00 0.00 55.95 57.44 1s5e s SER 63 Cb 0.07 -1.23 1.05 0.00 0.21 0.00 0.00 66.02 66.13 1s5e s SER 63 CO 0.04 -0.11 1.75 2.30 0.41 0.00 0.00 173.24 177.63 1s5e n ILE 64 N -1.18 0.00 -3.89 1.44 -5.35 -1.26 -0.99 119.36 108.13 1s5e n ILE 64 Ca -0.06 -0.16 -0.09 0.00 -0.27 0.00 0.00 62.75 62.17 1s5e n ILE 64 Cb 0.58 0.28 -0.08 0.00 -1.74 0.00 0.00 39.64 38.69 1s5e n ILE 64 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1s5e s SER 65 N -2.24 0.16 0.13 7.28 1.04 -1.26 -4.84 113.70 113.96 1s5e s SER 65 Ca 0.33 -0.70 -0.17 0.00 0.48 0.00 0.00 55.95 55.89 1s5e s SER 65 Cb 0.20 0.33 -0.02 0.00 0.10 0.00 0.00 66.02 66.63 1s5e s SER 65 CO 0.42 -0.72 1.70 0.25 0.98 0.00 0.00 173.24 175.87 1s5e h LEU 66 N 2.79 0.45 -0.26 2.42 5.85 -1.95 -1.11 115.31 123.50 1s5e h LEU 66 Ca -0.34 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.27 1s5e h LEU 66 Cb 1.19 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.08 1s5e h LEU 66 CO 0.57 0.46 0.10 -0.09 -0.34 0.00 0.00 178.44 179.14 1s5e h ARG 67 N 0.42 0.21 -0.63 1.25 9.65 -1.99 0.15 114.38 123.45 1s5e h ARG 67 Ca 0.12 -0.01 0.04 0.00 -1.10 0.00 0.00 59.98 59.02 1s5e h ARG 67 Cb 0.13 -0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 28.61 1s5e h ARG 67 CO -0.01 0.14 0.37 0.77 2.80 0.00 0.00 179.97 184.04 1s5e h SER 68 N 0.22 0.59 0.03 -3.80 0.02 -1.92 0.19 113.55 108.88 1s5e h SER 68 Ca 0.11 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 60.96 1s5e h SER 68 Cb 0.07 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 1s5e h SER 68 CO -0.11 0.40 -0.38 0.00 -1.14 0.00 0.00 176.83 175.60 1s5e h ALA 69 N 1.30 0.95 -0.05 3.77 0.00 -0.62 -1.18 119.26 123.43 1s5e h ALA 69 Ca 0.26 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1s5e h ALA 69 Cb 0.08 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1s5e h ALA 69 CO -0.13 0.62 0.02 1.25 0.00 0.00 0.00 179.25 181.00 1s5e h HIS 70 N 0.39 0.08 -0.91 0.00 2.76 -0.30 0.16 115.15 117.34 1s5e h HIS 70 Ca 0.04 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.25 1s5e h HIS 70 Cb 0.85 -0.02 -0.06 0.00 1.55 0.00 0.00 27.41 29.73 1s5e h HIS 70 CO 0.03 0.25 0.59 -0.07 -1.30 0.00 0.00 177.93 177.43 1s5e h LEU 71 N -0.11 0.95 -0.44 0.26 3.38 -0.79 0.29 115.31 118.85 1s5e h LEU 71 Ca 0.02 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 1s5e h LEU 71 Cb 0.20 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1s5e h LEU 71 CO -0.00 0.63 -0.22 0.58 0.09 0.00 0.00 178.44 179.52 1s5e h VAL 72 N 1.09 1.27 -0.99 1.22 2.07 -1.07 -2.18 116.25 117.66 1s5e h VAL 72 Ca 0.37 -1.38 0.04 0.00 0.82 0.00 0.00 66.70 66.56 1s5e h VAL 72 Cb 0.10 1.22 -0.06 0.00 -1.52 0.00 0.00 31.29 31.03 1s5e h VAL 72 CO -0.13 0.47 0.64 1.23 0.02 0.00 0.00 177.57 179.81 1s5e h GLY 73 N 0.76 1.46 2.00 2.17 0.00 0.14 -0.01 103.07 109.58 1s5e h GLY 73 Ca 0.10 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.86 1s5e h GLY 73 CO 0.07 0.40 -0.39 1.46 0.00 0.00 0.00 176.54 178.08 1s5e h GLN 74 N 1.23 0.00 0.09 4.80 1.08 -0.29 0.14 115.11 122.16 1s5e h GLN 74 Ca 0.40 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.40 1s5e h GLN 74 Cb 0.04 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.49 1s5e h GLN 74 CO -0.14 0.39 -0.83 1.15 -0.95 0.00 0.00 178.83 178.45 1s5e h THR 75 N 0.00 1.43 0.00 -0.54 2.02 -0.69 -3.34 112.91 111.79 1s5e h THR 75 Ca -0.00 -2.36 -0.37 0.00 0.77 0.00 0.00 66.41 64.44 1s5e h THR 75 Cb 0.85 2.88 -0.07 0.00 -1.74 0.00 0.00 68.15 70.07 1s5e h THR 75 CO 0.05 0.68 -2.42 -0.38 0.37 0.00 0.00 175.52 173.83 1s5e n ILE 76 N -4.09 1.43 -0.82 3.11 2.08 -0.10 -4.49 119.36 116.47 1s5e n ILE 76 Ca -0.13 -0.65 0.08 0.00 0.56 0.00 0.00 62.75 62.62 1s5e n ILE 76 Cb 0.81 -1.11 0.34 0.00 -0.75 0.00 0.00 39.64 38.93 1s5e n ILE 76 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1s5e n LEU 77 N -3.08 4.81 -4.73 1.39 4.77 0.50 -4.57 117.00 116.08 1s5e n LEU 77 Ca -0.41 -2.79 -0.42 0.00 -0.03 0.00 0.00 56.01 52.36 1s5e n LEU 77 Cb 1.03 -0.59 -0.02 0.00 -2.33 0.00 0.00 43.42 41.51 1s5e n LEU 77 CO 0.31 0.69 1.26 -1.20 -1.33 0.00 0.00 177.39 177.12 1s5e n SER 78 N 0.40 3.83 0.00 -1.43 7.64 -1.22 -1.67 113.62 121.17 1s5e n SER 78 Ca 0.24 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.25 1s5e n SER 78 Cb 0.99 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 1s5e n SER 78 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1s5e n GLY 79 N 2.60 0.68 3.31 0.23 0.00 -1.26 -5.02 105.19 105.72 1s5e n GLY 79 Ca 0.11 -0.34 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 1s5e n GLY 79 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1s5e s HIS 80 N -2.00 3.01 0.41 1.61 4.02 -0.67 -5.01 115.29 116.65 1s5e s HIS 80 Ca 0.00 -1.00 0.20 0.00 1.02 0.00 0.00 55.06 55.28 1s5e s HIS 80 Cb 0.00 -2.13 1.12 0.00 -1.02 0.00 0.00 32.58 30.55 1s5e s HIS 80 CO 0.00 -0.57 1.98 0.66 1.02 0.00 0.00 174.74 177.83 1s5e h SER 81 N 8.12 0.00 -3.39 1.40 4.64 -1.92 -3.41 113.55 119.00 1s5e h SER 81 Ca -0.39 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.47 1s5e h SER 81 Cb 1.15 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 62.89 1s5e h SER 81 CO 0.60 0.20 -0.79 -0.89 -0.87 0.00 0.00 176.83 175.08 1s5e s THR 82 N -4.32 0.78 0.32 2.95 2.01 -1.26 -0.74 115.64 115.39 1s5e s THR 82 Ca -0.03 -0.24 0.05 0.00 0.31 0.00 0.00 61.69 61.78 1s5e s THR 82 Cb 0.14 -0.78 -0.03 0.00 0.01 0.00 0.00 72.50 71.85 1s5e s THR 82 CO 0.66 0.29 0.30 -0.72 -0.69 0.00 0.00 174.62 174.46 1s5e s TYR 83 N 1.05 1.59 0.05 4.92 -0.85 -0.30 -4.87 117.35 118.92 1s5e s TYR 83 Ca -0.08 -1.58 0.08 0.00 -0.52 0.00 0.00 57.07 54.97 1s5e s TYR 83 Cb -0.14 -0.59 -0.03 0.00 0.38 0.00 0.00 41.96 41.58 1s5e s TYR 83 CO -0.00 -0.90 -0.21 0.71 -1.52 0.00 0.00 175.55 173.62 1s5e s TYR 84 N -3.43 1.86 -0.29 -3.49 1.51 -0.55 0.33 117.35 113.28 1s5e s TYR 84 Ca 0.39 -0.38 -0.04 0.00 -1.01 0.00 0.00 57.07 56.03 1s5e s TYR 84 Cb 0.02 -1.10 0.03 0.00 -0.11 0.00 0.00 41.96 40.80 1s5e s TYR 84 CO 0.25 0.10 0.02 0.42 -1.11 0.00 0.00 175.55 175.24 1s5e s ILE 85 N -0.82 3.33 0.07 2.71 1.01 0.18 -0.95 121.20 126.74 1s5e s ILE 85 Ca 0.08 -1.10 -0.27 0.00 0.00 0.00 0.00 60.65 59.36 1s5e s ILE 85 Cb -0.09 -2.82 -0.06 0.00 0.01 0.00 0.00 42.46 39.51 1s5e s ILE 85 CO 0.02 -0.01 0.85 -0.31 0.00 0.00 0.00 174.94 175.49 1s5e s TYR 86 N 1.35 3.77 -0.23 3.97 2.02 0.32 -1.26 117.35 127.29 1s5e s TYR 86 Ca -0.02 1.61 -0.09 0.00 -0.37 0.00 0.00 57.07 58.20 1s5e s TYR 86 Cb -0.18 -2.92 -0.04 0.00 -0.40 0.00 0.00 41.96 38.42 1s5e s TYR 86 CO -0.00 0.25 0.13 0.08 -1.57 0.00 0.00 175.55 174.44 1s5e s VAL 87 N -0.06 5.06 -0.06 0.71 1.01 -0.20 -1.32 120.40 125.54 1s5e s VAL 87 Ca 0.42 0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.50 1s5e s VAL 87 Cb -0.22 -3.35 0.01 0.00 0.00 0.00 0.00 36.38 32.83 1s5e s VAL 87 CO 0.26 0.36 -0.11 -0.63 0.00 0.00 0.00 175.10 174.98 1s5e s ILE 88 N 1.09 1.01 0.52 2.22 1.01 0.11 -0.46 121.20 126.70 1s5e s ILE 88 Ca 0.06 -0.42 -0.19 0.00 0.00 0.00 0.00 60.65 60.10 1s5e s ILE 88 Cb -0.14 -0.93 -0.07 0.00 0.01 0.00 0.00 42.46 41.33 1s5e s ILE 88 CO 0.04 0.32 1.07 0.00 0.00 0.00 0.00 174.94 176.37 1s5e s ALA 89 N 0.60 2.80 0.30 9.38 0.00 -0.07 0.52 121.76 135.29 1s5e s ALA 89 Ca -0.12 0.64 -0.27 0.00 0.00 0.00 0.00 51.96 52.21 1s5e s ALA 89 Cb -0.14 -3.28 -0.10 0.00 0.00 0.00 0.00 23.12 19.60 1s5e s ALA 89 CO 0.03 -0.52 0.96 0.95 0.00 0.00 0.00 175.76 177.18 1s5e s THR 90 N -1.99 4.08 0.08 0.00 -4.23 -1.17 -4.80 115.64 107.61 1s5e s THR 90 Ca 0.68 1.83 -0.26 0.00 -1.18 0.00 0.00 61.69 62.76 1s5e s THR 90 Cb -0.18 -4.06 0.08 0.00 1.34 0.00 0.00 72.50 69.68 1s5e s THR 90 CO 0.24 0.24 0.79 0.00 -0.54 0.00 0.00 174.62 175.36 1s5e s ALA 91 N -1.47 -1.70 -1.42 3.99 0.00 -1.17 -4.20 121.76 115.78 1s5e s ALA 91 Ca 0.48 0.67 0.00 0.00 0.00 0.00 0.00 51.96 53.11 1s5e s ALA 91 Cb -0.22 0.62 0.00 0.00 0.00 0.00 0.00 23.12 23.52 1s5e s ALA 91 CO 0.27 -0.77 0.48 -2.30 0.00 0.00 0.00 175.76 173.44 1s5e n PRO 92 N -0.33 0.68 -0.05 0.00 -0.02 -0.33 -1.50 135.00 133.45 1s5e n PRO 92 Ca -0.11 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 61.49 1s5e n PRO 92 Cb 0.63 -1.20 0.40 0.00 -0.02 0.00 0.00 33.50 33.31 1s5e n PRO 92 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1s5e n ASN 93 N -0.12 1.84 -4.54 2.55 6.94 -1.26 -4.23 115.26 116.45 1s5e n ASN 93 Ca 0.00 -1.67 -0.34 0.00 -0.02 0.00 0.00 54.58 52.55 1s5e n ASN 93 Cb 0.10 -0.07 -0.12 0.00 -2.36 0.00 0.00 39.78 37.33 1s5e n ASN 93 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1s5e s MET 94 N -1.86 3.43 -0.08 -3.83 -1.94 -0.56 -0.63 119.30 113.83 1s5e s MET 94 Ca 0.35 -0.50 0.05 0.00 -1.71 0.00 0.00 55.69 53.87 1s5e s MET 94 Cb 0.19 -2.85 -0.00 0.00 2.01 0.00 0.00 34.83 34.18 1s5e s MET 94 CO 0.30 0.38 -0.23 -0.06 -0.01 0.00 0.00 175.02 175.39 1s5e s PHE 95 N -0.02 2.40 -0.45 -0.03 0.08 0.16 -0.52 117.98 119.61 1s5e s PHE 95 Ca 0.01 -0.86 -0.28 0.00 0.12 0.00 0.00 56.93 55.92 1s5e s PHE 95 Cb -0.13 -1.60 -0.01 0.00 -0.57 0.00 0.00 43.02 40.72 1s5e s PHE 95 CO 0.03 -0.32 1.65 1.21 -0.10 0.00 0.00 175.22 177.69 1s5e s ASN 96 N 0.14 5.92 0.17 1.36 3.84 -1.26 -0.90 114.94 124.20 1s5e s ASN 96 Ca -0.12 0.81 -0.14 0.00 0.21 0.00 0.00 52.86 53.62 1s5e s ASN 96 Cb -0.16 -2.53 0.05 0.00 -0.55 0.00 0.00 41.25 38.06 1s5e s ASN 96 CO 0.06 -1.78 1.82 0.58 -2.79 0.00 0.00 177.10 175.00 1s5e h VAL 97 N 6.66 1.14 -0.90 -5.21 2.07 -1.79 -1.53 116.25 116.70 1s5e h VAL 97 Ca -0.29 -0.29 0.03 0.00 0.82 0.00 0.00 66.70 66.97 1s5e h VAL 97 Cb 1.14 0.42 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 1s5e h VAL 97 CO 1.11 0.14 0.59 0.78 0.02 0.00 0.00 177.57 180.21 1s5e h ASN 98 N 0.68 0.98 -0.22 0.57 -0.26 -1.90 0.12 115.58 115.55 1s5e h ASN 98 Ca 0.18 -0.01 -0.07 0.00 -0.56 0.00 0.00 56.30 55.84 1s5e h ASN 98 Cb -0.05 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 36.98 1s5e h ASN 98 CO -0.04 0.68 -0.14 0.44 -1.06 0.00 0.00 177.43 177.31 1s5e h ASP 99 N 1.14 0.51 0.25 5.81 3.32 -1.73 -0.60 116.42 125.12 1s5e h ASP 99 Ca 0.35 -0.43 -0.27 0.00 0.02 0.00 0.00 57.03 56.70 1s5e h ASP 99 Cb -0.01 -0.14 0.02 0.00 0.22 0.00 0.00 39.33 39.41 1s5e h ASP 99 CO -0.10 0.83 -1.11 0.58 -1.72 0.00 0.00 179.24 177.72 1s5e h VAL 100 N 0.19 1.35 -0.00 -1.35 2.07 -0.96 -3.21 116.25 114.34 1s5e h VAL 100 Ca 0.05 -2.51 0.00 0.00 0.82 0.00 0.00 66.70 65.06 1s5e h VAL 100 Cb 0.66 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 33.01 1s5e h VAL 100 CO 0.04 0.75 -0.52 0.18 0.02 0.00 0.00 177.57 178.05 1s5e n LEU 101 N -3.75 0.88 0.00 2.57 4.77 0.00 -4.75 117.00 116.72 1s5e n LEU 101 Ca -0.10 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 1s5e n LEU 101 Cb 0.92 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.87 1s5e n LEU 101 CO 0.55 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.41 1s5e n GLY 102 N 1.45 3.20 0.08 -0.72 0.00 -0.23 -1.11 105.19 107.86 1s5e n GLY 102 Ca 0.07 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.18 1s5e n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s5e n ALA 103 N 10.05 1.75 0.80 4.61 0.00 -1.26 -1.53 120.51 134.93 1s5e n ALA 103 Ca 0.00 0.03 0.10 0.00 0.00 0.00 0.00 53.44 53.56 1s5e n ALA 103 Cb 0.00 -1.36 0.28 0.00 0.00 0.00 0.00 19.45 18.37 1s5e n ALA 103 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1s5e n TYR 104 N -2.00 0.41 -1.80 0.00 4.01 -0.27 -4.87 117.16 112.64 1s5e n TYR 104 Ca 0.03 -0.20 -0.42 0.00 -0.16 0.00 0.00 57.90 57.14 1s5e n TYR 104 Cb 0.24 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.24 1s5e n TYR 104 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1s5e s SER 105 N -1.36 6.52 0.29 7.72 0.15 -0.58 -4.90 113.70 121.55 1s5e s SER 105 Ca 0.33 2.55 0.14 0.00 0.70 0.00 0.00 55.95 59.67 1s5e s SER 105 Cb 0.18 -2.54 0.38 0.00 -1.71 0.00 0.00 66.02 62.33 1s5e s SER 105 CO 0.26 -0.99 1.60 1.55 1.20 0.00 0.00 173.24 176.85 1s5e h PRO 106 N 9.69 0.00 -2.09 5.44 0.13 -1.89 -3.36 132.00 139.92 1s5e h PRO 106 Ca -0.45 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.12 1s5e h PRO 106 Cb 1.21 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.94 1s5e h PRO 106 CO 0.94 0.56 -0.93 0.72 -0.23 0.00 0.00 178.00 179.06 1s5e n HIS 107 N -3.57 1.35 0.22 1.56 8.25 -1.26 -4.97 115.22 116.81 1s5e n HIS 107 Ca -0.00 -3.82 0.08 0.00 -0.26 0.00 0.00 57.72 53.71 1s5e n HIS 107 Cb 0.63 -0.44 0.52 0.00 1.12 0.00 0.00 29.99 31.82 1s5e n HIS 107 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1s5e h PRO 108 N 3.73 0.00 0.00 -0.41 0.13 -1.98 -1.49 132.00 131.98 1s5e h PRO 108 Ca 0.12 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.24 1s5e h PRO 108 Cb 0.79 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.92 1s5e h PRO 108 CO 0.61 0.25 -0.04 -0.44 -0.23 0.00 0.00 178.00 178.15 1s5e h ASP 109 N 0.00 0.00 1.33 1.44 3.32 -1.95 -2.58 116.42 117.98 1s5e h ASP 109 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1s5e h ASP 109 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 1s5e h ASP 109 CO 0.03 0.04 0.00 -0.33 -1.72 0.00 0.00 179.24 177.27 1s5e h GLU 110 N 0.00 0.00 -6.57 3.56 4.39 -1.70 -3.48 114.58 110.79 1s5e h GLU 110 Ca -0.00 0.00 -0.51 0.00 0.34 0.00 0.00 59.36 59.19 1s5e h GLU 110 Cb 0.27 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 1s5e h GLU 110 CO 0.01 0.00 -0.94 1.04 -1.16 0.00 0.00 179.01 177.95 1s5e n GLN 111 N -2.92 -1.65 -3.01 2.33 6.02 -0.97 -4.83 117.38 112.34 1s5e n GLN 111 Ca 0.02 0.31 -0.35 0.00 -0.01 0.00 0.00 57.00 56.98 1s5e n GLN 111 Cb 0.38 -3.84 -0.06 0.00 1.02 0.00 0.00 30.24 27.73 1s5e n GLN 111 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1s5e s GLU 112 N -6.65 4.24 -0.12 -1.09 2.02 -1.26 -4.32 118.70 111.52 1s5e s GLU 112 Ca 0.27 0.93 0.02 0.00 0.02 0.00 0.00 54.97 56.22 1s5e s GLU 112 Cb -0.12 -2.63 0.01 0.00 0.10 0.00 0.00 34.13 31.49 1s5e s GLU 112 CO 0.91 0.24 -0.19 0.08 0.02 0.00 0.00 175.26 176.32 1s5e s VAL 113 N -1.77 1.79 -0.02 2.63 1.01 -0.74 -2.03 120.40 121.27 1s5e s VAL 113 Ca 0.50 -0.83 0.07 0.00 0.00 0.00 0.00 61.98 61.72 1s5e s VAL 113 Cb -0.14 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 1s5e s VAL 113 CO 0.19 0.50 -0.22 -0.44 0.00 0.00 0.00 175.10 175.13 1s5e s SER 114 N 0.78 2.64 -0.28 3.32 0.01 -0.08 -0.42 113.70 119.68 1s5e s SER 114 Ca -0.10 -0.41 -0.11 0.00 1.31 0.00 0.00 55.95 56.64 1s5e s SER 114 Cb -0.16 -0.34 -0.05 0.00 0.21 0.00 0.00 66.02 65.69 1s5e s SER 114 CO 0.01 0.27 0.21 0.00 0.41 0.00 0.00 173.24 174.13 1s5e s ALA 115 N -0.48 3.53 -0.23 1.44 0.00 -0.09 -0.66 121.76 125.26 1s5e s ALA 115 Ca 0.07 -1.10 -0.29 0.00 0.00 0.00 0.00 51.96 50.65 1s5e s ALA 115 Cb -0.09 -2.52 -0.01 0.00 0.00 0.00 0.00 23.12 20.50 1s5e s ALA 115 CO -0.00 -0.60 1.40 -1.17 0.00 0.00 0.00 175.76 175.39 1s5e s LEU 116 N 1.78 3.98 0.00 0.00 2.96 0.20 -1.73 118.68 125.87 1s5e s LEU 116 Ca 0.08 1.49 0.00 0.00 -0.22 0.00 0.00 54.13 55.47 1s5e s LEU 116 Cb -0.16 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 42.99 1s5e s LEU 116 CO 0.11 -1.05 0.00 0.61 -1.32 0.00 0.00 176.35 174.70 1s5e n GLY 117 N 4.25 0.75 0.00 7.98 0.00 0.41 -4.93 105.19 113.65 1s5e n GLY 117 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1s5e n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s5e n GLY 118 N -2.19 0.12 3.20 -0.02 0.00 -1.00 -4.68 105.19 100.62 1s5e n GLY 118 Ca 0.00 -1.99 -0.36 0.00 0.00 0.00 0.00 46.02 43.67 1s5e n GLY 118 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1s5e s ILE 119 N -1.08 3.34 0.65 -0.61 1.01 -0.13 -4.86 121.20 119.52 1s5e s ILE 119 Ca 0.00 -1.38 -0.18 0.00 0.00 0.00 0.00 60.65 59.10 1s5e s ILE 119 Cb 0.00 -2.96 -0.01 0.00 0.01 0.00 0.00 42.46 39.50 1s5e s ILE 119 CO 0.00 -0.21 1.27 -2.84 0.00 0.00 0.00 174.94 173.16 1s5e s PRO 120 N 1.30 2.55 0.31 2.79 0.02 -1.26 -0.49 135.00 140.21 1s5e s PRO 120 Ca -0.02 2.00 0.05 0.00 0.02 0.00 0.00 61.00 63.05 1s5e s PRO 120 Cb -0.20 -1.85 0.70 0.00 0.02 0.00 0.00 34.50 33.17 1s5e s PRO 120 CO 0.00 -1.59 1.81 -0.92 -0.33 0.00 0.00 177.00 175.97 1s5e h TYR 121 N 0.48 1.05 0.00 6.54 3.20 -1.32 -1.14 116.97 125.79 1s5e h TYR 121 Ca -0.50 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.38 1s5e h TYR 121 Cb 1.33 -0.32 -0.00 0.00 1.54 0.00 0.00 36.73 39.27 1s5e h TYR 121 CO 0.43 0.31 -0.07 0.66 -1.64 0.00 0.00 178.16 177.85 1s5e h SER 122 N 0.82 0.00 0.22 -2.11 4.64 -1.86 -1.94 113.55 113.33 1s5e h SER 122 Ca 0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 1s5e h SER 122 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 1s5e h SER 122 CO -0.32 0.07 -0.10 1.67 -0.87 0.00 0.00 176.83 177.28 1s5e n GLN 123 N -3.35 0.94 -3.12 4.77 7.27 -0.43 -3.20 117.38 120.27 1s5e n GLN 123 Ca -0.01 -0.39 -0.42 0.00 0.07 0.00 0.00 57.00 56.24 1s5e n GLN 123 Cb 0.23 -1.49 -0.07 0.00 2.41 0.00 0.00 30.24 31.32 1s5e n GLN 123 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 1s5e s ILE 124 N -2.33 4.89 0.14 1.69 1.01 -0.73 -0.89 121.20 124.98 1s5e s ILE 124 Ca 0.32 0.48 -0.11 0.00 0.00 0.00 0.00 60.65 61.34 1s5e s ILE 124 Cb 0.20 -4.09 -0.03 0.00 0.01 0.00 0.00 42.46 38.56 1s5e s ILE 124 CO 0.44 -0.36 1.51 0.22 0.00 0.00 0.00 174.94 176.75 1s5e h TYR 125 N 8.54 1.09 0.00 3.97 3.20 -1.06 -3.38 116.97 129.33 1s5e h TYR 125 Ca -0.26 -0.29 0.00 0.00 3.14 0.00 0.00 58.73 61.32 1s5e h TYR 125 Cb 1.11 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 39.14 1s5e h TYR 125 CO 0.74 1.10 0.00 0.41 -1.64 0.00 0.00 178.16 178.78 1s5e n GLY 126 N 0.00 -1.18 3.44 1.82 0.00 -1.15 -1.03 105.19 107.09 1s5e n GLY 126 Ca -0.01 -0.99 -0.14 0.00 0.00 0.00 0.00 46.02 44.88 1s5e n GLY 126 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1s5e s TRP 127 N -3.00 -0.56 0.03 1.61 -2.14 -0.19 -1.03 118.94 113.65 1s5e s TRP 127 Ca 0.00 1.26 -0.09 0.00 2.66 0.00 0.00 56.10 59.93 1s5e s TRP 127 Cb 0.00 0.23 -0.05 0.00 -3.10 0.00 0.00 33.47 30.55 1s5e s TRP 127 CO 0.00 -0.37 0.32 0.71 -2.66 0.00 0.00 176.95 174.96 1s5e s TYR 128 N -0.21 3.60 0.04 1.66 2.02 -0.39 -1.06 117.35 123.01 1s5e s TYR 128 Ca -0.04 0.69 -0.19 0.00 -0.37 0.00 0.00 57.07 57.16 1s5e s TYR 128 Cb -0.03 -2.08 -0.06 0.00 -0.40 0.00 0.00 41.96 39.39 1s5e s TYR 128 CO 0.03 0.59 0.55 0.50 -1.57 0.00 0.00 175.55 175.65 1s5e s ARG 129 N -1.71 4.20 -0.20 -0.62 3.52 -1.26 -0.65 118.95 122.23 1s5e s ARG 129 Ca 0.29 0.69 0.02 0.00 -0.13 0.00 0.00 55.73 56.59 1s5e s ARG 129 Cb -0.14 -3.27 0.03 0.00 -1.56 0.00 0.00 34.95 30.02 1s5e s ARG 129 CO 0.16 0.56 -0.16 0.08 -0.81 0.00 0.00 175.30 175.13 1s5e s VAL 130 N -0.82 2.04 -0.18 7.11 1.01 0.15 -1.19 120.40 128.52 1s5e s VAL 130 Ca 0.29 -1.13 -0.01 0.00 0.00 0.00 0.00 61.98 61.12 1s5e s VAL 130 Cb -0.19 -1.96 0.00 0.00 0.00 0.00 0.00 36.38 34.24 1s5e s VAL 130 CO 0.18 0.35 -0.14 -2.28 0.00 0.00 0.00 175.10 173.21 1s5e s HIS 131 N 1.25 2.83 -1.49 5.22 2.46 -0.62 -1.15 115.29 123.79 1s5e s HIS 131 Ca 0.01 -1.22 -0.07 0.00 0.47 0.00 0.00 55.06 54.25 1s5e s HIS 131 Cb -0.15 -1.96 0.01 0.00 -0.13 0.00 0.00 32.58 30.34 1s5e s HIS 131 CO -0.10 -0.61 0.13 1.19 -2.47 0.00 0.00 174.74 172.88 1s5e n PHE 132 N 4.47 -1.28 -0.30 3.88 3.72 0.08 -0.76 117.46 127.27 1s5e n PHE 132 Ca -0.19 0.50 0.00 0.00 -0.05 0.00 0.00 57.45 57.71 1s5e n PHE 132 Cb 0.51 -2.80 0.00 0.00 -0.94 0.00 0.00 39.48 36.25 1s5e n PHE 132 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1s5e n GLY 133 N -2.49 2.06 3.56 1.37 0.00 -1.26 -4.98 105.19 103.44 1s5e n GLY 133 Ca -0.29 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 1s5e n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s5e s VAL 134 N -3.02 5.04 -0.05 1.61 1.01 0.06 -5.03 120.40 120.02 1s5e s VAL 134 Ca 0.00 0.34 -0.29 0.00 0.00 0.00 0.00 61.98 62.03 1s5e s VAL 134 Cb 0.00 -3.93 -0.07 0.00 0.00 0.00 0.00 36.38 32.38 1s5e s VAL 134 CO 0.00 -0.17 1.93 -0.76 0.00 0.00 0.00 175.10 176.10 1s5e s LEU 135 N 2.33 4.17 0.32 3.92 1.43 -1.26 -1.60 118.68 127.99 1s5e s LEU 135 Ca 0.18 2.35 -0.29 0.00 -1.03 0.00 0.00 54.13 55.33 1s5e s LEU 135 Cb -0.16 -3.53 -0.12 0.00 0.03 0.00 0.00 46.19 42.42 1s5e s LEU 135 CO 0.13 -1.23 1.50 -0.67 0.23 0.00 0.00 176.35 176.31 1s5e n ASP 136 N 8.35 3.53 0.23 2.29 -0.08 -0.33 -4.91 116.55 125.63 1s5e n ASP 136 Ca 0.21 1.18 0.08 0.00 -1.51 0.00 0.00 54.79 54.75 1s5e n ASP 136 Cb 0.43 -1.56 0.55 0.00 2.34 0.00 0.00 41.12 42.88 1s5e n ASP 136 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1s5e h GLU 137 N 3.87 0.00 -5.72 -0.67 4.39 -1.93 -3.44 114.58 111.09 1s5e h GLU 137 Ca -0.48 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 58.63 1s5e h GLU 137 Cb 1.24 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.80 1s5e h GLU 137 CO 0.72 0.22 0.28 -0.65 -1.16 0.00 0.00 179.01 178.42 1s5e s GLN 138 N -4.16 4.20 -0.17 2.33 1.11 -1.26 -5.03 119.66 116.67 1s5e s GLN 138 Ca -0.02 0.77 -0.26 0.00 0.01 0.00 0.00 55.36 55.85 1s5e s GLN 138 Cb 0.13 -3.61 -0.01 0.00 -1.01 0.00 0.00 33.01 28.51 1s5e s GLN 138 CO 0.65 -0.37 0.88 -1.17 0.01 0.00 0.00 175.29 175.28 1s5e s LEU 139 N 2.35 4.17 -0.21 2.90 2.96 -1.26 -4.57 118.68 125.02 1s5e s LEU 139 Ca 0.32 1.24 -0.20 0.00 -0.22 0.00 0.00 54.13 55.26 1s5e s LEU 139 Cb -0.16 -3.31 -0.03 0.00 0.50 0.00 0.00 46.19 43.20 1s5e s LEU 139 CO 0.09 -0.44 0.60 -1.00 -1.32 0.00 0.00 176.35 174.29 1s5e s HIS 140 N 2.29 3.36 0.07 5.38 3.76 -0.22 -4.91 115.29 125.01 1s5e s HIS 140 Ca 0.40 0.88 -0.18 0.00 -0.15 0.00 0.00 55.06 56.01 1s5e s HIS 140 Cb -0.17 -2.77 -0.07 0.00 1.11 0.00 0.00 32.58 30.68 1s5e s HIS 140 CO 0.12 -0.18 0.54 1.03 -0.85 0.00 0.00 174.74 175.40 1s5e s ARG 141 N 1.93 4.13 -0.21 1.40 0.52 -1.26 -1.02 118.95 124.43 1s5e s ARG 141 Ca 0.27 0.66 -0.21 0.00 -0.52 0.00 0.00 55.73 55.94 1s5e s ARG 141 Cb -0.16 -3.21 -0.02 0.00 0.52 0.00 0.00 34.95 32.08 1s5e s ARG 141 CO 0.10 0.64 0.63 1.21 0.02 0.00 0.00 175.30 177.89 1s5e s ASN 142 N -1.15 6.65 0.49 0.23 2.47 -0.20 -4.92 114.94 118.51 1s5e s ASN 142 Ca 0.29 0.79 0.23 0.00 0.42 0.00 0.00 52.86 54.59 1s5e s ASN 142 Cb -0.19 -2.34 1.26 0.00 -1.45 0.00 0.00 41.25 38.53 1s5e s ASN 142 CO 0.18 -0.30 2.02 0.03 -3.72 0.00 0.00 177.10 175.31 1s5e h ARG 143 N 7.60 0.00 0.00 0.43 3.08 -1.91 -2.84 114.38 120.74 1s5e h ARG 143 Ca -0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.75 1s5e h ARG 143 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1s5e h ARG 143 CO 0.77 0.17 0.00 0.41 -1.07 0.00 0.00 179.97 180.25 1s5e n GLY 144 N -0.68 -1.29 3.78 0.04 0.00 -1.26 -4.86 105.19 100.92 1s5e n GLY 144 Ca -0.02 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1s5e n GLY 144 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1s5e s TYR 145 N -3.00 2.90 -0.30 1.61 5.04 -1.08 -4.20 117.35 118.32 1s5e s TYR 145 Ca 0.11 1.57 0.01 0.00 -2.44 0.00 0.00 57.07 56.32 1s5e s TYR 145 Cb 0.15 -3.20 0.09 0.00 0.35 0.00 0.00 41.96 39.35 1s5e s TYR 145 CO 0.42 -1.17 0.05 1.03 -1.34 0.00 0.00 175.55 174.54 1s5e s ARG 146 N -3.07 1.12 0.07 4.97 1.81 -1.19 -5.03 118.95 117.63 1s5e s ARG 146 Ca 0.67 -1.29 -0.17 0.00 -1.72 0.00 0.00 55.73 53.22 1s5e s ARG 146 Cb -0.22 -2.49 -0.12 0.00 -0.45 0.00 0.00 34.95 31.67 1s5e s ARG 146 CO 0.26 -0.89 1.36 0.22 -0.68 0.00 0.00 175.30 175.56 1s5e h ASP 147 N 7.92 0.63 -0.53 0.23 3.58 -1.96 -2.00 116.42 124.27 1s5e h ASP 147 Ca -0.11 -0.51 -0.09 0.00 0.42 0.00 0.00 57.03 56.74 1s5e h ASP 147 Cb 1.03 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.88 1s5e h ASP 147 CO 0.47 1.02 0.01 0.03 -2.88 0.00 0.00 179.24 177.89 1s5e h ARG 148 N 0.26 0.98 0.58 0.28 3.08 -1.97 0.16 114.38 117.74 1s5e h ARG 148 Ca 0.02 -0.29 -0.03 0.00 0.07 0.00 0.00 59.98 59.75 1s5e h ARG 148 Cb 0.88 -0.10 0.01 0.00 0.08 0.00 0.00 29.97 30.83 1s5e h ARG 148 CO 0.07 0.96 -0.28 -0.92 -1.07 0.00 0.00 179.97 178.73 1s5e h TYR 149 N 0.90 -0.72 0.00 3.04 3.20 -1.99 -3.12 116.97 118.28 1s5e h TYR 149 Ca 0.17 -0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.94 1s5e h TYR 149 Cb 0.51 0.24 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 1s5e h TYR 149 CO 0.03 -0.39 -0.36 1.88 -1.64 0.00 0.00 178.16 177.68 1s5e h TYR 150 N -0.97 0.00 0.00 -3.82 0.05 -1.27 -2.82 116.97 108.14 1s5e h TYR 150 Ca -0.08 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.70 1s5e h TYR 150 Cb 0.65 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.39 1s5e h TYR 150 CO -0.00 0.36 0.00 0.43 -1.05 0.00 0.00 178.16 177.89 1s5e n SER 151 N -3.37 0.00 -1.10 3.88 7.64 0.03 -2.30 113.62 118.41 1s5e n SER 151 Ca 0.01 0.09 0.12 0.00 1.01 0.00 0.00 58.87 60.10 1s5e n SER 151 Cb 0.56 -0.35 0.19 0.00 -1.01 0.00 0.00 64.21 63.60 1s5e n SER 151 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1s5e n ASN 152 N -1.35 3.35 -4.44 6.43 4.05 -1.06 -2.60 115.26 119.65 1s5e n ASN 152 Ca 0.10 -1.99 -0.22 0.00 0.45 0.00 0.00 54.58 52.92 1s5e n ASN 152 Cb 0.22 -0.19 -0.10 0.00 1.23 0.00 0.00 39.78 40.94 1s5e n ASN 152 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1s5e s LEU 153 N -1.59 2.58 0.00 1.20 1.43 -0.97 -4.61 118.68 116.72 1s5e s LEU 153 Ca 0.36 -1.03 0.04 0.00 -1.03 0.00 0.00 54.13 52.46 1s5e s LEU 153 Cb 0.22 -0.97 -0.01 0.00 0.03 0.00 0.00 46.19 45.46 1s5e s LEU 153 CO 0.31 -0.03 0.13 0.47 0.23 0.00 0.00 176.35 177.46 1s5e n ASP 154 N -0.56 1.24 -4.73 2.29 8.00 -1.26 -1.70 116.55 119.84 1s5e n ASP 154 Ca -0.06 -2.99 -0.30 0.00 0.71 0.00 0.00 54.79 52.16 1s5e n ASP 154 Cb 0.60 0.93 0.13 0.00 -0.02 0.00 0.00 41.12 42.77 1s5e n ASP 154 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1s5e s ILE 155 N -2.95 2.67 0.40 0.53 -4.36 -1.26 -1.19 121.20 115.05 1s5e s ILE 155 Ca 0.19 0.22 -0.26 0.00 -0.26 0.00 0.00 60.65 60.53 1s5e s ILE 155 Cb 0.01 -2.73 -0.09 0.00 1.25 0.00 0.00 42.46 40.90 1s5e s ILE 155 CO 0.13 -0.28 1.32 0.00 0.24 0.00 0.00 174.94 176.35 1s5e s ALA 156 N -2.96 3.29 0.50 2.27 0.00 0.32 -4.63 121.76 120.55 1s5e s ALA 156 Ca 0.63 1.26 -0.21 0.00 0.00 0.00 0.00 51.96 53.64 1s5e s ALA 156 Cb -0.18 -3.50 -0.07 0.00 0.00 0.00 0.00 23.12 19.38 1s5e s ALA 156 CO 0.57 -0.84 1.14 -1.25 0.00 0.00 0.00 175.76 175.38 1s5e s PRO 157 N -2.20 3.58 0.50 0.00 0.04 -1.26 -4.65 135.00 131.00 1s5e s PRO 157 Ca 0.56 1.67 0.21 0.00 0.04 0.00 0.00 61.00 63.49 1s5e s PRO 157 Cb -0.39 -2.21 1.28 0.00 0.04 0.00 0.00 34.50 33.23 1s5e s PRO 157 CO 0.50 -0.68 1.99 0.00 0.04 0.00 0.00 177.00 178.86 1s5e h ALA 158 N 1.64 2.34 -0.03 8.56 0.00 -1.95 -0.65 119.26 129.17 1s5e h ALA 158 Ca -0.50 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.41 1s5e h ALA 158 Cb 1.25 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1s5e h ALA 158 CO 0.59 -0.48 0.04 0.00 0.00 0.00 0.00 179.25 179.39 1s5e h ALA 159 N 1.73 1.64 0.00 0.00 0.00 -1.97 0.21 119.26 120.87 1s5e h ALA 159 Ca 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1s5e h ALA 159 Cb 0.85 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1s5e h ALA 159 CO -0.03 -0.05 -0.01 -0.25 0.00 0.00 0.00 179.25 178.91 1s5e n ASP 160 N -3.94 0.46 -0.02 0.00 8.00 -0.25 -4.11 116.55 116.69 1s5e n ASP 160 Ca -0.02 0.53 0.03 0.00 0.71 0.00 0.00 54.79 56.04 1s5e n ASP 160 Cb 0.13 -0.65 -0.10 0.00 -0.02 0.00 0.00 41.12 40.47 1s5e n ASP 160 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1s5e n GLY 161 N 1.39 -0.61 0.30 0.44 0.00 0.61 -4.65 105.19 102.68 1s5e n GLY 161 Ca 0.06 -0.29 0.06 0.00 0.00 0.00 0.00 46.02 45.86 1s5e n GLY 161 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1s5e h TYR 162 N 0.00 0.75 0.00 1.61 0.05 -1.36 0.41 116.97 118.43 1s5e h TYR 162 Ca -0.10 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.72 1s5e h TYR 162 Cb 0.94 -0.21 0.00 0.00 1.01 0.00 0.00 36.73 38.48 1s5e h TYR 162 CO 0.00 0.19 0.00 0.78 -1.05 0.00 0.00 178.16 178.08 1s5e h GLY 163 N 0.62 0.00 -2.26 3.88 0.00 -1.82 -2.37 103.07 101.11 1s5e h GLY 163 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.78 1s5e h GLY 163 CO -0.35 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.23 1s5e n LEU 164 N -2.49 3.92 -0.03 3.11 4.77 0.08 -4.60 117.00 121.77 1s5e n LEU 164 Ca 0.01 -2.28 0.02 0.00 -0.03 0.00 0.00 56.01 53.74 1s5e n LEU 164 Cb 0.24 -0.45 0.35 0.00 -2.33 0.00 0.00 43.42 41.23 1s5e n LEU 164 CO 0.21 0.81 1.08 0.00 -1.33 0.00 0.00 177.39 178.16 1s5e h ALA 165 N 3.24 1.54 0.00 -1.18 0.00 -0.85 -3.35 119.26 118.65 1s5e h ALA 165 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1s5e h ALA 165 Cb 1.13 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1s5e h ALA 165 CO 0.11 0.37 0.00 0.41 0.00 0.00 0.00 179.25 180.14 1s5e n GLY 166 N -1.22 0.56 3.75 0.00 0.00 -1.26 -1.09 105.19 105.93 1s5e n GLY 166 Ca 0.03 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.21 1s5e n GLY 166 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1s5e s PHE 167 N -2.00 2.30 0.69 1.61 0.08 -1.26 -4.59 117.98 114.81 1s5e s PHE 167 Ca 0.00 1.34 -0.17 0.00 0.12 0.00 0.00 56.93 58.23 1s5e s PHE 167 Cb 0.00 -3.84 -0.03 0.00 -0.57 0.00 0.00 43.02 38.58 1s5e s PHE 167 CO 0.00 -2.95 0.76 -2.30 -0.10 0.00 0.00 175.22 170.63 1s5e n PRO 168 N -0.86 0.48 -0.13 0.24 -0.02 -1.26 -4.89 135.00 128.56 1s5e n PRO 168 Ca 0.09 0.21 0.08 0.00 -2.02 0.00 0.00 63.50 61.86 1s5e n PRO 168 Cb 0.44 -2.01 0.41 0.00 -0.02 0.00 0.00 33.50 32.32 1s5e n PRO 168 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1s5e h PRO 169 N -0.14 0.61 -0.00 0.52 0.13 -1.92 -1.22 132.00 129.97 1s5e h PRO 169 Ca -0.47 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1s5e h PRO 169 Cb 1.35 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1s5e h PRO 169 CO 0.46 0.40 -0.06 -0.85 -0.23 0.00 0.00 178.00 177.72 1s5e n GLU 170 N -4.48 0.67 -2.10 0.86 0.00 -1.26 -1.59 120.64 112.74 1s5e n GLU 170 Ca 0.10 -0.14 -0.42 0.00 0.00 0.00 0.00 57.16 56.70 1s5e n GLU 170 Cb 0.26 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.18 1s5e n GLU 170 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 1s5e s HIS 171 N -2.43 3.15 0.61 -1.84 2.46 -0.46 -4.90 115.29 111.87 1s5e s HIS 171 Ca 0.32 1.02 0.41 0.00 0.47 0.00 0.00 55.06 57.27 1s5e s HIS 171 Cb 0.20 -3.73 2.22 0.00 -0.13 0.00 0.00 32.58 31.14 1s5e s HIS 171 CO 0.45 -2.45 2.32 0.07 -2.47 0.00 0.00 174.74 172.66 1s5e h ARG 172 N 5.75 0.00 -0.94 2.88 0.11 -1.90 -2.61 114.38 117.67 1s5e h ARG 172 Ca -0.44 0.00 0.19 0.00 0.10 0.00 0.00 59.98 59.83 1s5e h ARG 172 Cb 1.21 0.00 -0.11 0.00 1.11 0.00 0.00 29.97 32.18 1s5e h ARG 172 CO 0.81 0.01 0.51 0.00 0.10 0.00 0.00 179.97 181.40 1s5e h ALA 173 N 1.99 1.52 0.00 0.08 0.00 -1.93 0.48 119.26 121.41 1s5e h ALA 173 Ca -0.00 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1s5e h ALA 173 Cb 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1s5e h ALA 173 CO 0.00 -0.15 0.00 0.91 0.00 0.00 0.00 179.25 180.01 1s5e n TRP 174 N -4.87 0.27 -0.23 0.00 5.03 -0.98 -1.19 117.44 115.46 1s5e n TRP 174 Ca 0.22 0.12 0.07 0.00 3.03 0.00 0.00 57.50 60.94 1s5e n TRP 174 Cb 0.57 -0.69 0.20 0.00 -1.03 0.00 0.00 31.31 30.37 1s5e n TRP 174 CO 0.00 0.00 0.00 0.54 -0.03 0.00 0.00 177.69 178.20 1s5e n ARG 175 N -1.76 2.81 -4.39 -0.99 1.74 0.14 -3.87 116.66 110.35 1s5e n ARG 175 Ca 0.01 -2.23 -0.22 0.00 -0.77 0.00 0.00 57.85 54.64 1s5e n ARG 175 Cb 0.11 -1.36 -0.11 0.00 -1.02 0.00 0.00 32.46 30.09 1s5e n ARG 175 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1s5e s GLU 176 N -1.00 1.44 0.35 5.56 2.02 -0.33 -4.92 118.70 121.82 1s5e s GLU 176 Ca 0.31 -1.59 -0.26 0.00 0.02 0.00 0.00 54.97 53.45 1s5e s GLU 176 Cb 0.16 -1.46 -0.09 0.00 0.10 0.00 0.00 34.13 32.84 1s5e s GLU 176 CO 0.21 0.28 1.03 -1.21 0.02 0.00 0.00 175.26 175.59 1s5e s GLU 177 N -3.27 4.40 0.06 1.61 2.02 -1.26 -0.99 118.70 121.26 1s5e s GLU 177 Ca 0.23 1.53 0.25 0.00 0.02 0.00 0.00 54.97 57.00 1s5e s GLU 177 Cb -0.04 -2.78 0.53 0.00 0.10 0.00 0.00 34.13 31.94 1s5e s GLU 177 CO 0.10 0.07 1.45 -0.35 0.02 0.00 0.00 175.26 176.54 1s5e n PRO 178 N 0.43 0.13 0.26 0.39 -0.04 -1.26 -4.90 135.00 130.00 1s5e n PRO 178 Ca 0.03 0.04 0.11 0.00 -0.04 0.00 0.00 63.50 63.64 1s5e n PRO 178 Cb 0.49 -1.59 0.69 0.00 -0.04 0.00 0.00 33.50 33.05 1s5e n PRO 178 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1s5e h TRP 179 N 0.00 0.00 -0.03 0.54 6.55 -1.57 -2.34 115.95 119.10 1s5e h TRP 179 Ca 0.00 0.00 0.01 0.00 0.95 0.00 0.00 58.89 59.85 1s5e h TRP 179 Cb 0.61 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 28.91 1s5e h TRP 179 CO 0.00 0.13 0.02 0.97 -1.05 0.00 0.00 178.44 178.51 1s5e h ILE 180 N 0.00 0.99 0.00 1.49 2.10 -1.17 0.70 117.51 121.62 1s5e h ILE 180 Ca -0.00 -0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.93 1s5e h ILE 180 Cb 0.31 0.98 0.00 0.00 -1.09 0.00 0.00 36.82 37.02 1s5e h ILE 180 CO 0.02 0.00 -0.00 1.41 -1.08 0.00 0.00 178.15 178.50 1s5e n HIS 181 N -4.53 0.28 -0.17 2.19 8.25 -0.88 -3.86 115.22 116.50 1s5e n HIS 181 Ca -0.02 0.08 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1s5e n HIS 181 Cb 0.11 -0.63 0.00 0.00 1.12 0.00 0.00 29.99 30.59 1s5e n HIS 181 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1s5e n HIS 182 N -1.73 0.00 -1.83 4.41 8.25 0.08 -5.08 115.22 119.33 1s5e n HIS 182 Ca 0.07 -0.27 -0.42 0.00 -0.26 0.00 0.00 57.72 56.84 1s5e n HIS 182 Cb 0.37 -0.03 -0.02 0.00 1.12 0.00 0.00 29.99 31.43 1s5e n HIS 182 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1s5e s ALA 183 N -0.54 3.79 0.87 -1.41 0.00 -0.29 -4.23 121.76 119.94 1s5e s ALA 183 Ca 0.00 1.51 -0.10 0.00 0.00 0.00 0.00 51.96 53.36 1s5e s ALA 183 Cb 0.00 -3.64 0.12 0.00 0.00 0.00 0.00 23.12 19.59 1s5e s ALA 183 CO 0.00 -0.90 1.12 -2.14 0.00 0.00 0.00 175.76 173.84 1s5e s PRO 184 N 0.27 1.44 0.30 0.00 0.02 -1.26 -4.91 135.00 130.85 1s5e s PRO 184 Ca 0.67 1.33 -0.28 0.00 0.02 0.00 0.00 61.00 62.74 1s5e s PRO 184 Cb -0.47 -1.79 -0.14 0.00 0.02 0.00 0.00 34.50 32.12 1s5e s PRO 184 CO 0.40 -2.27 1.03 -2.30 -0.33 0.00 0.00 177.00 173.53 1s5e n PRO 185 N -3.96 1.41 -0.91 5.54 -0.02 -1.26 -2.16 135.00 133.63 1s5e n PRO 185 Ca 0.10 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1s5e n PRO 185 Cb 0.53 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 1s5e n PRO 185 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s5e n GLY 186 N 1.18 0.92 3.77 -1.23 0.00 -1.26 -3.33 105.19 105.25 1s5e n GLY 186 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 1s5e n GLY 186 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s5e n GLY 188 N 0.01 3.02 0.19 0.00 0.00 -0.62 -2.14 105.19 105.65 1s5e n GLY 188 Ca -0.09 -0.20 0.10 0.00 0.00 0.00 0.00 46.02 45.84 1s5e n GLY 188 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1s5e n ASN 189 N 7.82 0.59 -4.77 1.61 5.03 -1.26 -4.67 115.26 119.62 1s5e n ASN 189 Ca 0.00 -1.49 -0.39 0.00 0.87 0.00 0.00 54.58 53.58 1s5e n ASN 189 Cb 0.00 -0.03 -0.02 0.00 -1.02 0.00 0.00 39.78 38.70 1s5e n ASN 189 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1s5e s ALA 190 N -1.93 3.22 -0.24 5.41 0.00 -0.91 -4.90 121.76 122.40 1s5e s ALA 190 Ca 0.31 0.99 -0.42 0.00 0.00 0.00 0.00 51.96 52.84 1s5e s ALA 190 Cb 0.15 -3.38 -0.18 0.00 0.00 0.00 0.00 23.12 19.71 1s5e s ALA 190 CO 0.24 -0.50 1.52 -2.30 0.00 0.00 0.00 175.76 174.72 1s5e n PRO 191 N 0.27 0.58 -1.89 0.00 -0.02 -1.26 -2.66 135.00 130.02 1s5e n PRO 191 Ca 0.03 0.21 -0.19 0.00 -2.02 0.00 0.00 63.50 61.53 1s5e n PRO 191 Cb 0.46 -1.80 -0.05 0.00 -0.02 0.00 0.00 33.50 32.09 1s5e n PRO 191 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1s5e n ARG 192 N 3.80 -1.41 -1.36 -0.52 0.63 -1.26 -4.87 116.66 111.67 1s5e n ARG 192 Ca 0.25 1.07 -0.42 0.00 -0.92 0.00 0.00 57.85 57.83 1s5e n ARG 192 Cb 0.07 -5.48 -0.13 0.00 0.45 0.00 0.00 32.46 27.36 1s5e n ARG 192 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1s5e n SER 193 N -1.31 0.36 0.00 6.15 3.41 -1.09 -5.06 113.62 116.09 1s5e n SER 193 Ca -0.21 0.27 0.06 0.00 -0.26 0.00 0.00 58.87 58.73 1s5e n SER 193 Cb 0.65 -0.86 0.36 0.00 -0.26 0.00 0.00 64.21 64.10 1s5e n SER 193 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1s5e n ASN 197 N 9.27 0.00 -0.15 4.04 3.02 -1.26 -4.67 115.26 125.51 1s5e n ASN 197 Ca 0.60 -1.51 -0.08 0.00 -0.03 0.00 0.00 54.58 53.56 1s5e n ASN 197 Cb 0.01 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.19 1s5e n ASN 197 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1s5e h THR 198 N 0.00 1.16 -0.29 3.41 2.02 -1.89 -1.18 112.91 116.13 1s5e h THR 198 Ca 0.00 -0.39 0.06 0.00 0.77 0.00 0.00 66.41 66.84 1s5e h THR 198 Cb 0.00 0.59 -0.05 0.00 -1.74 0.00 0.00 68.15 66.95 1s5e h THR 198 CO 0.00 0.17 -0.04 0.00 0.37 0.00 0.00 175.52 176.02 1s5e h ASP 200 N 0.04 0.72 -0.39 0.00 3.32 -1.80 -0.88 116.42 117.43 1s5e h ASP 200 Ca 0.14 -0.33 -0.04 0.00 0.02 0.00 0.00 57.03 56.82 1s5e h ASP 200 Cb 0.20 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1s5e h ASP 200 CO -0.27 1.05 0.12 -0.33 -1.72 0.00 0.00 179.24 178.09 1s5e h GLU 201 N 0.54 0.68 0.18 3.56 5.08 -0.94 -1.08 114.58 122.61 1s5e h GLU 201 Ca 0.04 -0.12 -0.31 0.00 -1.00 0.00 0.00 59.36 57.97 1s5e h GLU 201 Cb 0.97 -0.11 0.02 0.00 0.50 0.00 0.00 28.75 30.12 1s5e h GLU 201 CO 0.09 0.62 -1.39 0.87 -1.00 0.00 0.00 179.01 178.19 1s5e h LYS 202 N 0.67 0.39 -0.35 2.33 1.79 -0.65 -1.08 116.57 119.68 1s5e h LYS 202 Ca 0.15 -0.67 0.06 0.00 -2.18 0.00 0.00 60.65 58.02 1s5e h LYS 202 Cb 0.24 0.25 -0.06 0.00 -1.58 0.00 0.00 32.23 31.08 1s5e h LYS 202 CO -0.00 1.31 -0.02 1.15 -1.08 0.00 0.00 179.45 180.80 1s5e h THR 203 N 0.11 0.72 -0.15 -0.16 2.02 -1.08 -0.23 112.91 114.14 1s5e h THR 203 Ca -0.20 -0.02 0.02 0.00 0.77 0.00 0.00 66.41 66.97 1s5e h THR 203 Cb 2.07 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 69.10 1s5e h THR 203 CO 0.23 0.01 0.01 -0.61 0.37 0.00 0.00 175.52 175.53 1s5e h GLN 204 N 0.07 0.06 -0.01 6.66 5.75 -1.10 -1.75 115.11 124.79 1s5e h GLN 204 Ca 0.17 -0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.57 1s5e h GLN 204 Cb 0.24 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 1s5e h GLN 204 CO -0.30 0.04 -0.47 0.66 -2.65 0.00 0.00 178.83 176.10 1s5e h SER 205 N 0.06 0.02 -0.22 -0.69 4.64 -0.95 -0.99 113.55 115.42 1s5e h SER 205 Ca 0.07 -0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.23 1s5e h SER 205 Cb 0.08 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 1s5e h SER 205 CO -0.11 0.49 -0.41 -0.07 -0.87 0.00 0.00 176.83 175.86 1s5e h LEU 206 N 0.02 0.82 -0.54 5.97 3.38 -0.87 -1.35 115.31 122.74 1s5e h LEU 206 Ca -0.00 -0.38 -0.11 0.00 0.09 0.00 0.00 57.88 57.48 1s5e h LEU 206 Cb 0.84 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1s5e h LEU 206 CO 0.06 1.12 -0.09 1.23 0.09 0.00 0.00 178.44 180.86 1s5e h GLY 207 N 0.91 1.10 0.99 0.83 0.00 -0.90 -1.24 103.07 104.76 1s5e h GLY 207 Ca 0.05 -0.88 -0.04 0.00 0.00 0.00 0.00 47.33 46.46 1s5e h GLY 207 CO 0.09 0.81 0.18 -2.08 0.00 0.00 0.00 176.54 175.53 1s5e h VAL 208 N 0.90 1.24 -0.43 4.60 2.07 -1.03 -0.83 116.25 122.77 1s5e h VAL 208 Ca 0.14 -0.79 -0.05 0.00 0.82 0.00 0.00 66.70 66.82 1s5e h VAL 208 Cb 0.65 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1s5e h VAL 208 CO 0.05 0.30 0.06 0.50 0.02 0.00 0.00 177.57 178.49 1s5e h LYS 209 N 0.77 0.72 -0.26 1.57 3.64 -1.19 0.41 116.57 122.22 1s5e h LYS 209 Ca 0.18 -0.20 0.05 0.00 -1.27 0.00 0.00 60.65 59.41 1s5e h LYS 209 Cb 0.27 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.97 1s5e h LYS 209 CO -0.01 0.76 -0.04 0.35 -2.27 0.00 0.00 179.45 178.24 1s5e h PHE 210 N 0.57 -0.09 -0.64 1.91 3.04 -1.00 -1.29 116.94 119.43 1s5e h PHE 210 Ca 0.13 0.02 -0.08 0.00 3.98 0.00 0.00 57.97 62.02 1s5e h PHE 210 Cb 0.40 0.08 -0.03 0.00 2.56 0.00 0.00 35.95 38.96 1s5e h PHE 210 CO 0.03 -0.09 0.10 1.25 -2.02 0.00 0.00 178.31 177.58 1s5e h LEU 211 N 0.03 1.02 -0.42 0.59 5.85 -0.93 -0.17 115.31 121.28 1s5e h LEU 211 Ca 0.13 -0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.62 1s5e h LEU 211 Cb 0.18 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.92 1s5e h LEU 211 CO -0.25 1.01 0.25 0.44 -0.34 0.00 0.00 178.44 179.56 1s5e h ASP 212 N 0.99 0.42 -0.42 1.25 3.32 -0.67 0.13 116.42 121.45 1s5e h ASP 212 Ca 0.20 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.16 1s5e h ASP 212 Cb 0.44 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1s5e h ASP 212 CO 0.01 0.30 -0.07 -0.33 -1.72 0.00 0.00 179.24 177.43 1s5e h GLU 213 N 0.51 0.78 -0.54 3.56 5.08 -0.98 -2.30 114.58 120.70 1s5e h GLU 213 Ca 0.17 -0.29 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 1s5e h GLU 213 Cb -0.00 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 1s5e h GLU 213 CO -0.07 0.90 0.16 -0.92 -1.00 0.00 0.00 179.01 178.08 1s5e h TYR 214 N 0.61 0.89 -0.34 4.33 3.20 -0.72 -2.89 116.97 122.04 1s5e h TYR 214 Ca 0.11 -0.10 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 1s5e h TYR 214 Cb 0.59 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 1s5e h TYR 214 CO 0.05 0.76 0.12 1.96 -1.64 0.00 0.00 178.16 179.41 1s5e h GLN 215 N 0.76 0.48 -0.58 1.82 4.20 -0.65 -0.55 115.11 120.60 1s5e h GLN 215 Ca 0.17 -0.06 0.02 0.00 0.06 0.00 0.00 58.65 58.84 1s5e h GLN 215 Cb 0.30 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.96 1s5e h GLN 215 CO -0.00 0.42 0.38 0.77 -0.67 0.00 0.00 178.83 179.73 1s5e h SER 216 N 0.48 0.64 -0.21 1.46 0.02 -1.20 -0.83 113.55 113.91 1s5e h SER 216 Ca 0.12 -0.01 -0.20 0.00 -0.84 0.00 0.00 61.79 60.86 1s5e h SER 216 Cb 0.13 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.51 1s5e h SER 216 CO -0.01 0.45 -0.63 0.11 -1.14 0.00 0.00 176.83 175.61 1s5e h LYS 217 N 0.75 0.82 -0.04 3.45 1.57 -1.05 -1.77 116.57 120.30 1s5e h LYS 217 Ca 0.22 -0.57 -0.00 0.00 -1.87 0.00 0.00 60.65 58.43 1s5e h LYS 217 Cb -0.03 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 1s5e h LYS 217 CO -0.05 1.19 0.01 0.28 -0.57 0.00 0.00 179.45 180.31 1s5e h VAL 218 N 0.61 1.17 -0.57 0.50 2.07 -1.12 -1.81 116.25 117.10 1s5e h VAL 218 Ca -0.01 -0.51 0.09 0.00 0.82 0.00 0.00 66.70 67.09 1s5e h VAL 218 Cb 1.24 1.44 -0.07 0.00 -1.52 0.00 0.00 31.29 32.38 1s5e h VAL 218 CO 0.13 0.14 0.20 0.11 0.02 0.00 0.00 177.57 178.17 1s5e h LYS 219 N -0.14 0.36 -0.61 1.57 1.57 -1.18 -0.02 116.57 118.12 1s5e h LYS 219 Ca 0.01 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1s5e h LYS 219 Cb 0.21 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.41 1s5e h LYS 219 CO -0.00 0.24 0.40 -0.09 -0.57 0.00 0.00 179.45 179.43 1s5e h ARG 220 N 0.37 0.80 0.09 3.15 2.43 -1.08 0.19 114.38 120.33 1s5e h ARG 220 Ca 0.28 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.40 1s5e h ARG 220 Cb 0.34 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1s5e h ARG 220 CO -0.30 0.53 -0.04 0.37 -1.51 0.00 0.00 179.97 179.02 1s5e h GLN 221 N 0.82 -0.12 -0.05 0.20 5.75 -0.69 -2.63 115.11 118.40 1s5e h GLN 221 Ca 0.22 0.01 -0.06 0.00 -0.15 0.00 0.00 58.65 58.67 1s5e h GLN 221 Cb -0.09 0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.49 1s5e h GLN 221 CO -0.05 0.39 -0.21 0.82 -2.65 0.00 0.00 178.83 177.13 1s5e h ILE 222 N -0.73 1.46 0.00 2.39 1.08 -0.97 -2.87 117.51 117.87 1s5e h ILE 222 Ca -0.01 -1.67 0.00 0.00 -0.39 0.00 0.00 64.86 62.79 1s5e h ILE 222 Cb 0.56 2.41 0.00 0.00 -3.07 0.00 0.00 36.82 36.72 1s5e h ILE 222 CO 0.02 0.46 0.00 -0.26 -0.69 0.00 0.00 178.15 177.68 1s5e h PHE 223 N -0.32 0.00 -0.17 1.37 0.04 -0.76 -2.14 116.94 114.95 1s5e h PHE 223 Ca -0.01 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.65 1s5e h PHE 223 Cb 0.87 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.02 1s5e h PHE 223 CO 0.14 0.00 -0.31 0.77 -0.60 0.00 0.00 178.31 178.31 1s5e h SER 224 N 0.00 0.58 -0.94 2.17 0.02 -1.51 -2.91 113.55 110.95 1s5e h SER 224 Ca 0.00 -0.54 0.09 0.00 -0.84 0.00 0.00 61.79 60.50 1s5e h SER 224 Cb 0.79 -0.16 -0.07 0.00 0.14 0.00 0.00 62.40 63.09 1s5e h SER 224 CO 0.00 1.01 0.59 1.23 -1.14 0.00 0.00 176.83 178.52 1s5e h GLY 225 N 0.16 1.48 2.00 -3.77 0.00 -1.26 -1.37 103.07 100.31 1s5e h GLY 225 Ca 0.01 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1s5e h GLY 225 CO 0.07 0.22 0.00 -0.97 0.00 0.00 0.00 176.54 175.86 1s5e h TYR 226 N 1.00 0.00 -0.30 5.60 -1.99 -1.31 -2.68 116.97 117.30 1s5e h TYR 226 Ca 0.44 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.17 1s5e h TYR 226 Cb 0.32 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.05 1s5e h TYR 226 CO -0.02 0.00 0.00 1.04 -0.00 0.00 0.00 178.16 179.18 1s5e n GLN 227 N -2.87 2.93 -0.11 4.88 6.02 -0.54 -4.57 117.38 123.11 1s5e n GLN 227 Ca -0.02 -2.53 0.06 0.00 -0.01 0.00 0.00 57.00 54.50 1s5e n GLN 227 Cb 0.12 -1.62 0.19 0.00 1.02 0.00 0.00 30.24 29.95 1s5e n GLN 227 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1s5e n SER 228 N -0.09 1.32 0.08 1.08 3.41 -1.01 -3.40 113.62 115.01 1s5e n SER 228 Ca 0.17 -1.91 0.11 0.00 -0.26 0.00 0.00 58.87 56.99 1s5e n SER 228 Cb 0.71 -0.15 -0.00 0.00 -0.26 0.00 0.00 64.21 64.51 1s5e n SER 228 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1s5e n ASP 229 N 0.19 0.72 -4.68 4.04 5.75 -1.26 -4.95 116.55 116.35 1s5e n ASP 229 Ca 0.10 0.22 -0.45 0.00 -0.01 0.00 0.00 54.79 54.66 1s5e n ASP 229 Cb 0.22 0.64 -0.04 0.00 -1.03 0.00 0.00 41.12 40.92 1s5e n ASP 229 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 1s5e n ILE 230 N -2.51 0.23 -3.95 2.12 5.41 -1.22 -4.96 119.36 114.48 1s5e n ILE 230 Ca -0.00 -0.04 -0.33 0.00 1.00 0.00 0.00 62.75 63.37 1s5e n ILE 230 Cb 0.53 -1.83 -0.14 0.00 -0.71 0.00 0.00 39.64 37.49 1s5e n ILE 230 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1s5e s ASP 231 N 2.16 4.83 0.15 4.38 2.15 -1.26 -5.02 116.67 124.06 1s5e s ASP 231 Ca 0.82 -1.69 -0.17 0.00 0.43 0.00 0.00 52.55 51.94 1s5e s ASP 231 Cb -0.60 -1.68 0.07 0.00 -0.30 0.00 0.00 42.92 40.41 1s5e s ASP 231 CO 0.40 -0.33 1.71 0.74 -0.17 0.00 0.00 175.17 177.52 1s5e h THR 232 N 6.56 0.78 -0.96 1.71 2.02 -2.01 -3.08 112.91 117.93 1s5e h THR 232 Ca -0.14 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.99 1s5e h THR 232 Cb 1.04 0.64 -0.05 0.00 -1.74 0.00 0.00 68.15 68.05 1s5e h THR 232 CO 0.55 0.02 0.59 -0.74 0.37 0.00 0.00 175.52 176.31 1s5e h HIS 233 N 0.13 1.25 -0.63 3.16 6.17 -1.96 -0.31 115.15 122.96 1s5e h HIS 233 Ca 0.16 0.00 0.17 0.00 0.71 0.00 0.00 60.37 61.42 1s5e h HIS 233 Cb 0.21 -0.41 -0.03 0.00 2.52 0.00 0.00 27.41 29.70 1s5e h HIS 233 CO -0.22 0.82 0.44 -0.97 0.71 0.00 0.00 177.93 178.71 1s5e h ASN 234 N 1.31 0.08 0.51 3.26 -0.73 -1.99 -1.83 115.58 116.20 1s5e h ASN 234 Ca 0.34 0.00 -0.21 0.00 1.87 0.00 0.00 56.30 58.31 1s5e h ASN 234 Cb -0.08 -0.01 -0.04 0.00 0.27 0.00 0.00 38.32 38.47 1s5e h ASN 234 CO -0.07 0.04 -1.65 0.54 -0.37 0.00 0.00 177.43 175.92 1s5e n ARG 235 N -4.38 0.64 0.00 6.67 3.00 -0.49 -5.16 116.66 116.93 1s5e n ARG 235 Ca 0.12 0.18 0.12 0.00 -0.01 0.00 0.00 57.85 58.26 1s5e n ARG 235 Cb 0.64 -1.75 0.71 0.00 0.00 0.00 0.00 32.46 32.07 1s5e n ARG 235 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.63 178.07