#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hi6 s GLN 3 N 0.00 4.22 -0.25 0.38 -0.21 -1.26 -4.84 119.66 117.71 3hi6 s GLN 3 Ca 0.00 0.08 -0.06 0.00 0.02 0.00 0.00 55.36 55.41 3hi6 s GLN 3 Cb 0.00 -3.41 -0.01 0.00 1.00 0.00 0.00 33.01 30.59 3hi6 s GLN 3 CO 0.00 0.27 0.02 -1.64 -2.12 0.00 0.00 175.29 171.82 3hi6 s MET 4 N 0.38 3.42 -0.36 2.91 -1.94 -1.26 -1.44 119.30 121.00 3hi6 s MET 4 Ca 0.16 -0.62 -0.09 0.00 -1.71 0.00 0.00 55.69 53.43 3hi6 s MET 4 Cb -0.13 -3.20 0.03 0.00 2.01 0.00 0.00 34.83 33.54 3hi6 s MET 4 CO 0.04 -0.25 0.17 0.99 -0.01 0.00 0.00 175.02 175.96 3hi6 s THR 5 N 1.53 4.30 0.20 2.05 2.01 0.22 -4.22 115.64 121.74 3hi6 s THR 5 Ca 0.05 -0.96 -0.02 0.00 0.31 0.00 0.00 61.69 61.07 3hi6 s THR 5 Cb -0.15 -3.41 -0.05 0.00 0.01 0.00 0.00 72.50 68.90 3hi6 s THR 5 CO 0.00 -0.22 0.42 -1.58 -0.69 0.00 0.00 174.62 172.55 3hi6 s GLN 6 N 1.50 3.56 -0.28 4.92 0.74 -1.26 0.17 119.66 129.01 3hi6 s GLN 6 Ca 0.01 -0.22 -0.21 0.00 0.05 0.00 0.00 55.36 54.98 3hi6 s GLN 6 Cb -0.19 -2.81 0.08 0.00 1.10 0.00 0.00 33.01 31.19 3hi6 s GLN 6 CO 0.05 0.38 0.72 0.45 -0.55 0.00 0.00 175.29 176.34 3hi6 s SER 7 N -3.00 -0.83 0.94 6.67 0.15 0.58 -4.64 113.70 113.57 3hi6 s SER 7 Ca 0.40 1.46 -0.15 0.00 0.70 0.00 0.00 55.95 58.36 3hi6 s SER 7 Cb -0.11 1.42 0.17 0.00 -1.71 0.00 0.00 66.02 65.79 3hi6 s SER 7 CO 0.28 -0.24 1.27 -2.16 1.20 0.00 0.00 173.24 173.59 3hi6 s PRO 8 N 0.95 0.87 0.21 5.44 0.04 -1.26 0.10 135.00 141.35 3hi6 s PRO 8 Ca -0.05 -0.24 -0.04 0.00 0.04 0.00 0.00 61.00 60.72 3hi6 s PRO 8 Cb -0.05 -1.86 0.17 0.00 0.04 0.00 0.00 34.50 32.80 3hi6 s PRO 8 CO -0.09 -2.29 1.58 0.77 0.04 0.00 0.00 177.00 177.02 3hi6 h SER 9 N -1.55 0.71 -5.07 6.66 0.02 -1.82 -3.39 113.55 109.11 3hi6 h SER 9 Ca -0.45 -0.30 -0.08 0.00 -0.84 0.00 0.00 61.79 60.12 3hi6 h SER 9 Cb 1.26 -0.20 -0.15 0.00 0.14 0.00 0.00 62.40 63.45 3hi6 h SER 9 CO 0.45 1.00 -0.18 -0.94 -1.14 0.00 0.00 176.83 176.03 3hi6 s SER 10 N -6.83 -0.17 0.00 3.07 1.04 -1.26 -0.77 113.70 108.78 3hi6 s SER 10 Ca -0.08 -0.22 -0.20 0.00 0.48 0.00 0.00 55.95 55.93 3hi6 s SER 10 Cb 0.12 0.40 0.04 0.00 0.10 0.00 0.00 66.02 66.68 3hi6 s SER 10 CO 0.84 -0.70 0.43 -1.48 0.98 0.00 0.00 173.24 173.31 3hi6 s LEU 11 N -2.31 0.34 -0.11 2.42 0.05 -0.49 -4.90 118.68 113.66 3hi6 s LEU 11 Ca -0.02 0.18 0.02 0.00 0.05 0.00 0.00 54.13 54.37 3hi6 s LEU 11 Cb 0.00 1.74 0.01 0.00 -2.05 0.00 0.00 46.19 45.89 3hi6 s LEU 11 CO -0.06 -0.57 -0.19 -0.55 -0.55 0.00 0.00 176.35 174.43 3hi6 s SER 12 N -1.58 2.72 -0.04 1.48 0.15 -1.26 -0.64 113.70 114.54 3hi6 s SER 12 Ca -0.10 -0.50 -0.11 0.00 0.70 0.00 0.00 55.95 55.94 3hi6 s SER 12 Cb -0.02 -1.24 0.02 0.00 -1.71 0.00 0.00 66.02 63.06 3hi6 s SER 12 CO 0.03 0.06 0.26 0.00 1.20 0.00 0.00 173.24 174.79 3hi6 s ALA 13 N 0.80 -0.64 0.45 5.45 0.00 -0.89 -4.78 121.76 122.15 3hi6 s ALA 13 Ca -0.09 0.36 -0.21 0.00 0.00 0.00 0.00 51.96 52.02 3hi6 s ALA 13 Cb -0.16 -0.09 -0.10 0.00 0.00 0.00 0.00 23.12 22.78 3hi6 s ALA 13 CO 0.00 -0.21 1.00 -1.12 0.00 0.00 0.00 175.76 175.44 3hi6 s SER 14 N -0.87 6.68 0.19 0.00 0.01 -1.26 -0.84 113.70 117.61 3hi6 s SER 14 Ca -0.09 1.84 -0.32 0.00 1.31 0.00 0.00 55.95 58.69 3hi6 s SER 14 Cb -0.05 -2.56 -0.16 0.00 0.21 0.00 0.00 66.02 63.47 3hi6 s SER 14 CO 0.02 -0.54 1.05 0.52 0.41 0.00 0.00 173.24 174.70 3hi6 n VAL 15 N -0.66 1.21 0.00 3.43 0.31 -1.26 -0.63 118.33 120.72 3hi6 n VAL 15 Ca 0.08 -0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.10 3hi6 n VAL 15 Cb 0.53 -0.74 0.00 0.00 -0.91 0.00 0.00 33.84 32.72 3hi6 n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hi6 n GLY 16 N 1.82 2.44 3.81 2.92 0.00 0.15 -4.89 105.19 111.44 3hi6 n GLY 16 Ca 0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 3hi6 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hi6 s ASP 17 N -2.69 6.32 -0.02 1.61 1.01 0.20 -4.38 116.67 118.72 3hi6 s ASP 17 Ca 0.00 1.78 -0.26 0.00 0.71 0.00 0.00 52.55 54.78 3hi6 s ASP 17 Cb 0.00 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.35 3hi6 s ASP 17 CO 0.00 -0.79 0.79 -0.60 0.21 0.00 0.00 175.17 174.78 3hi6 s ARG 18 N -3.67 4.49 -0.03 8.23 3.52 -1.25 -0.50 118.95 129.74 3hi6 s ARG 18 Ca 0.64 1.07 0.06 0.00 -0.13 0.00 0.00 55.73 57.37 3hi6 s ARG 18 Cb -0.14 -3.43 -0.01 0.00 -1.56 0.00 0.00 34.95 29.81 3hi6 s ARG 18 CO 0.27 0.09 -0.22 0.08 -0.81 0.00 0.00 175.30 174.71 3hi6 s VAL 19 N 0.62 1.73 -0.06 7.11 1.01 -0.08 -5.00 120.40 125.72 3hi6 s VAL 19 Ca 0.42 -0.92 -0.00 0.00 0.00 0.00 0.00 61.98 61.47 3hi6 s VAL 19 Cb -0.19 -1.44 0.03 0.00 0.00 0.00 0.00 36.38 34.77 3hi6 s VAL 19 CO 0.22 0.49 -0.02 -0.89 0.00 0.00 0.00 175.10 174.90 3hi6 s THR 20 N -0.40 0.48 -0.06 3.92 2.01 -1.26 -1.05 115.64 119.28 3hi6 s THR 20 Ca 0.05 -0.00 0.05 0.00 0.31 0.00 0.00 61.69 62.10 3hi6 s THR 20 Cb -0.09 -0.58 -0.00 0.00 0.01 0.00 0.00 72.50 71.84 3hi6 s THR 20 CO 0.00 0.25 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.35 3hi6 s ILE 21 N 1.52 1.72 0.26 1.82 1.01 -0.50 -4.80 121.20 122.24 3hi6 s ILE 21 Ca -0.02 -0.86 0.10 0.00 0.00 0.00 0.00 60.65 59.87 3hi6 s ILE 21 Cb -0.13 -1.48 -0.04 0.00 0.01 0.00 0.00 42.46 40.82 3hi6 s ILE 21 CO -0.03 0.49 -0.04 0.42 0.00 0.00 0.00 174.94 175.78 3hi6 s THR 22 N 0.09 3.32 -0.14 2.92 -4.23 0.11 -0.89 115.64 116.83 3hi6 s THR 22 Ca -0.08 -1.94 -0.06 0.00 -1.18 0.00 0.00 61.69 58.44 3hi6 s THR 22 Cb -0.14 -2.75 0.06 0.00 1.34 0.00 0.00 72.50 71.01 3hi6 s THR 22 CO 0.04 -0.35 0.30 0.00 -0.54 0.00 0.00 174.62 174.08 3hi6 s ARG 24 N 1.93 2.64 0.04 0.00 3.52 0.13 -1.00 118.95 126.21 3hi6 s ARG 24 Ca -0.04 -0.86 0.01 0.00 -0.13 0.00 0.00 55.73 54.71 3hi6 s ARG 24 Cb -0.11 -2.24 -0.04 0.00 -1.56 0.00 0.00 34.95 31.00 3hi6 s ARG 24 CO -0.10 0.39 0.12 0.00 -0.81 0.00 0.00 175.30 174.90 3hi6 s ALA 25 N -0.17 3.71 -0.99 6.12 0.00 0.33 0.73 121.76 131.49 3hi6 s ALA 25 Ca -0.03 -0.91 0.21 0.00 0.00 0.00 0.00 51.96 51.23 3hi6 s ALA 25 Cb -0.14 -1.61 0.89 0.00 0.00 0.00 0.00 23.12 22.26 3hi6 s ALA 25 CO 0.04 0.75 1.67 -1.13 0.00 0.00 0.00 175.76 177.09 3hi6 n SER 26 N 0.67 0.01 -4.04 0.00 3.41 -0.52 -4.77 113.62 108.38 3hi6 n SER 26 Ca -0.09 0.50 -0.10 0.00 -0.26 0.00 0.00 58.87 58.92 3hi6 n SER 26 Cb 0.52 -0.51 -0.07 0.00 -0.26 0.00 0.00 64.21 63.90 3hi6 n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hi6 s GLN 27 N -3.00 1.37 0.17 4.33 -2.07 -1.26 -5.00 119.66 114.20 3hi6 s GLN 27 Ca 0.10 -1.32 -0.31 0.00 -1.82 0.00 0.00 55.36 52.01 3hi6 s GLN 27 Cb 0.14 0.40 -0.09 0.00 -1.09 0.00 0.00 33.01 32.37 3hi6 s GLN 27 CO 0.38 -0.53 1.40 0.45 -1.32 0.00 0.00 175.29 175.67 3hi6 s SER 28 N -3.04 6.78 -0.12 12.60 0.15 -1.26 -4.54 113.70 124.27 3hi6 s SER 28 Ca 0.25 2.46 0.15 0.00 0.70 0.00 0.00 55.95 59.50 3hi6 s SER 28 Cb 0.02 -2.60 0.29 0.00 -1.71 0.00 0.00 66.02 62.02 3hi6 s SER 28 CO 0.08 -0.65 1.15 2.30 1.20 0.00 0.00 173.24 177.32 3hi6 n ILE 29 N 3.24 1.57 0.00 6.45 -5.35 0.32 -4.98 119.36 120.61 3hi6 n ILE 29 Ca 0.09 -2.11 0.00 0.00 -0.27 0.00 0.00 62.75 60.46 3hi6 n ILE 29 Cb 0.41 -0.05 0.00 0.00 -1.74 0.00 0.00 39.64 38.27 3hi6 n ILE 29 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hi6 n GLY 30 N -1.01 1.92 0.04 3.28 0.00 -1.25 -1.22 105.19 106.94 3hi6 n GLY 30 Ca 0.14 0.48 0.03 0.00 0.00 0.00 0.00 46.02 46.66 3hi6 n GLY 30 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3hi6 n SER 31 N 6.46 1.84 -3.16 1.61 7.64 -1.26 -0.54 113.62 126.21 3hi6 n SER 31 Ca 0.00 -2.19 -0.32 0.00 1.01 0.00 0.00 58.87 57.37 3hi6 n SER 31 Cb 0.00 -0.12 -0.04 0.00 -1.01 0.00 0.00 64.21 63.05 3hi6 n SER 31 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3hi6 n TYR 32 N -0.68 1.95 -3.93 1.43 4.01 -0.36 -3.27 117.16 116.31 3hi6 n TYR 32 Ca 0.04 -2.67 -0.20 0.00 -0.16 0.00 0.00 57.90 54.91 3hi6 n TYR 32 Cb 0.39 -2.21 -0.17 0.00 -0.31 0.00 0.00 39.34 37.04 3hi6 n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 3hi6 s LEU 33 N 0.14 0.96 0.16 7.72 1.98 -1.26 -0.59 118.68 127.78 3hi6 s LEU 33 Ca 0.62 -0.08 0.07 0.00 -2.89 0.00 0.00 54.13 51.85 3hi6 s LEU 33 Cb 0.17 -0.39 -0.04 0.00 0.66 0.00 0.00 46.19 46.59 3hi6 s LEU 33 CO -0.05 -0.13 -0.16 0.20 -1.89 0.00 0.00 176.35 174.33 3hi6 s ASN 34 N 1.41 2.40 -0.06 3.68 0.01 0.12 0.13 114.94 122.63 3hi6 s ASN 34 Ca -0.04 -0.88 0.04 0.00 -0.71 0.00 0.00 52.86 51.27 3hi6 s ASN 34 Cb -0.13 -0.12 0.00 0.00 0.41 0.00 0.00 41.25 41.41 3hi6 s ASN 34 CO -0.03 -0.11 -0.17 0.26 -1.51 0.00 0.00 177.10 175.55 3hi6 s TRP 35 N -2.32 1.74 0.14 2.20 0.52 -0.42 -0.26 118.94 120.54 3hi6 s TRP 35 Ca 0.15 -0.57 0.10 0.00 0.02 0.00 0.00 56.10 55.80 3hi6 s TRP 35 Cb -0.04 -1.20 -0.04 0.00 -1.15 0.00 0.00 33.47 31.04 3hi6 s TRP 35 CO 0.05 -0.23 -0.23 0.71 0.02 0.00 0.00 176.95 177.27 3hi6 s TYR 36 N 0.25 2.09 -0.10 -1.98 2.02 -0.08 -0.56 117.35 118.99 3hi6 s TYR 36 Ca -0.09 -0.40 -0.00 0.00 -0.37 0.00 0.00 57.07 56.21 3hi6 s TYR 36 Cb -0.13 -1.10 -0.03 0.00 -0.40 0.00 0.00 41.96 40.30 3hi6 s TYR 36 CO 0.03 0.33 -0.08 -1.14 -1.57 0.00 0.00 175.55 173.13 3hi6 s GLN 37 N -2.25 3.11 -0.18 -0.62 0.74 0.18 -1.34 119.66 119.30 3hi6 s GLN 37 Ca 0.14 -0.59 -0.01 0.00 0.05 0.00 0.00 55.36 54.95 3hi6 s GLN 37 Cb -0.09 -2.66 0.05 0.00 1.10 0.00 0.00 33.01 31.41 3hi6 s GLN 37 CO 0.06 0.45 -0.01 -1.14 -0.55 0.00 0.00 175.29 174.10 3hi6 s GLN 38 N -0.23 1.10 0.56 1.67 0.74 0.11 -0.67 119.66 122.93 3hi6 s GLN 38 Ca 0.03 -0.52 -0.07 0.00 0.05 0.00 0.00 55.36 54.85 3hi6 s GLN 38 Cb -0.13 -2.08 -0.02 0.00 1.10 0.00 0.00 33.01 31.89 3hi6 s GLN 38 CO 0.03 -0.54 0.88 0.15 -0.55 0.00 0.00 175.29 175.26 3hi6 s LYS 39 N 1.70 3.28 0.28 1.67 1.02 -1.26 -1.42 119.74 125.01 3hi6 s LYS 39 Ca -0.01 0.22 -0.30 0.00 0.02 0.00 0.00 55.97 55.90 3hi6 s LYS 39 Cb -0.16 -2.27 -0.12 0.00 -0.52 0.00 0.00 37.83 34.75 3hi6 s LYS 39 CO -0.07 -0.49 1.58 2.41 -0.92 0.00 0.00 175.35 177.86 3hi6 n THR 40 N -2.50 0.97 -2.27 2.17 -1.04 -1.26 -2.18 114.28 108.17 3hi6 n THR 40 Ca 0.03 -0.24 -0.21 0.00 -2.04 0.00 0.00 64.05 61.59 3hi6 n THR 40 Cb 0.56 -1.90 -0.02 0.00 -1.82 0.00 0.00 70.33 67.15 3hi6 n THR 40 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3hi6 n GLY 41 N 2.24 -0.11 3.20 3.41 0.00 -1.26 -4.98 105.19 107.69 3hi6 n GLY 41 Ca 0.09 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 3hi6 n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hi6 s LYS 42 N -4.84 0.94 0.69 1.61 -0.14 -0.93 -5.15 119.74 111.92 3hi6 s LYS 42 Ca 0.00 -1.39 -0.11 0.00 -1.36 0.00 0.00 55.97 53.11 3hi6 s LYS 42 Cb 0.00 -0.35 0.00 0.00 -1.68 0.00 0.00 37.83 35.81 3hi6 s LYS 42 CO 0.00 0.00 1.06 0.00 -0.76 0.00 0.00 175.35 175.65 3hi6 s ALA 43 N -3.53 2.73 0.81 5.17 0.00 -1.26 -4.64 121.76 121.03 3hi6 s ALA 43 Ca 0.15 0.05 -0.12 0.00 0.00 0.00 0.00 51.96 52.04 3hi6 s ALA 43 Cb 0.04 -3.16 0.08 0.00 0.00 0.00 0.00 23.12 20.09 3hi6 s ALA 43 CO -0.02 -1.16 1.15 -2.14 0.00 0.00 0.00 175.76 173.58 3hi6 s PRO 44 N -5.07 1.79 -0.02 0.00 0.02 -1.26 -4.53 135.00 125.93 3hi6 s PRO 44 Ca 0.58 1.49 0.00 0.00 0.02 0.00 0.00 61.00 63.09 3hi6 s PRO 44 Cb -0.14 -1.82 0.02 0.00 0.02 0.00 0.00 34.50 32.59 3hi6 s PRO 44 CO 0.55 -2.05 0.02 0.21 -0.33 0.00 0.00 177.00 175.40 3hi6 s LYS 45 N -4.47 0.09 0.10 5.54 2.20 0.16 -4.95 119.74 118.41 3hi6 s LYS 45 Ca 0.67 0.12 -0.31 0.00 -0.36 0.00 0.00 55.97 56.10 3hi6 s LYS 45 Cb -0.23 -0.30 -0.08 0.00 -1.51 0.00 0.00 37.83 35.72 3hi6 s LYS 45 CO 0.53 -0.13 1.40 0.00 -0.36 0.00 0.00 175.35 176.78 3hi6 s ALA 46 N 0.90 3.59 -0.25 3.13 0.00 -1.26 -0.65 121.76 127.22 3hi6 s ALA 46 Ca -0.08 1.09 -0.11 0.00 0.00 0.00 0.00 51.96 52.85 3hi6 s ALA 46 Cb -0.11 -3.55 -0.11 0.00 0.00 0.00 0.00 23.12 19.34 3hi6 s ALA 46 CO -0.02 -0.66 -0.32 1.28 0.00 0.00 0.00 175.76 176.04 3hi6 n LEU 47 N 4.19 1.91 -3.89 0.00 4.77 0.27 -4.83 117.00 119.42 3hi6 n LEU 47 Ca 0.12 0.27 -0.18 0.00 -0.03 0.00 0.00 56.01 56.19 3hi6 n LEU 47 Cb 0.42 -0.76 -0.16 0.00 -2.33 0.00 0.00 43.42 40.60 3hi6 n LEU 47 CO 0.59 0.57 -0.40 -0.63 -1.33 0.00 0.00 177.39 176.19 3hi6 s ILE 48 N -2.47 0.39 0.16 -0.08 1.01 -1.08 -1.67 121.20 117.46 3hi6 s ILE 48 Ca -0.35 -0.09 0.07 0.00 0.00 0.00 0.00 60.65 60.28 3hi6 s ILE 48 Cb 0.13 -0.41 -0.04 0.00 0.01 0.00 0.00 42.46 42.15 3hi6 s ILE 48 CO 0.46 0.17 -0.01 -0.31 0.00 0.00 0.00 174.94 175.25 3hi6 s TYR 49 N 0.65 2.85 -1.31 3.97 2.02 -0.46 -1.30 117.35 123.78 3hi6 s TYR 49 Ca -0.08 -0.13 -0.04 0.00 -0.37 0.00 0.00 57.07 56.46 3hi6 s TYR 49 Cb -0.11 -1.40 0.00 0.00 -0.40 0.00 0.00 41.96 40.06 3hi6 s TYR 49 CO -0.00 0.51 0.55 0.00 -1.57 0.00 0.00 175.55 175.04 3hi6 n ALA 50 N 0.01 -0.84 0.00 3.71 0.00 -1.15 -1.38 120.51 120.86 3hi6 n ALA 50 Ca -0.10 0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.59 3hi6 n ALA 50 Cb 0.55 -3.49 0.00 0.00 0.00 0.00 0.00 19.45 16.51 3hi6 n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hi6 n ALA 51 N -3.38 0.00 -0.53 0.00 0.00 0.12 -4.21 120.51 112.50 3hi6 n ALA 51 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3hi6 n ALA 51 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 3hi6 n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3hi6 n SER 52 N 2.60 0.43 -4.43 0.00 3.41 -1.23 -2.79 113.62 111.62 3hi6 n SER 52 Ca 0.00 -0.97 -0.44 0.00 -0.26 0.00 0.00 58.87 57.20 3hi6 n SER 52 Cb 0.00 0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 63.91 3hi6 n SER 52 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3hi6 s SER 53 N -0.02 6.22 0.17 4.04 0.15 -0.48 -4.52 113.70 119.26 3hi6 s SER 53 Ca 0.00 -1.03 -0.30 0.00 0.70 0.00 0.00 55.95 55.31 3hi6 s SER 53 Cb 0.00 -2.31 -0.09 0.00 -1.71 0.00 0.00 66.02 61.91 3hi6 s SER 53 CO 0.00 -1.03 1.35 -0.22 1.20 0.00 0.00 173.24 174.54 3hi6 s LEU 54 N 2.85 4.40 0.32 3.45 2.96 -1.26 -1.35 118.68 130.05 3hi6 s LEU 54 Ca 0.16 2.40 -0.16 0.00 -0.22 0.00 0.00 54.13 56.31 3hi6 s LEU 54 Cb -0.20 -3.60 -0.09 0.00 0.50 0.00 0.00 46.19 42.80 3hi6 s LEU 54 CO 0.11 -0.59 0.75 -1.10 -1.32 0.00 0.00 176.35 174.19 3hi6 s GLN 55 N 0.31 4.03 0.51 1.98 -1.52 -0.67 -4.95 119.66 119.35 3hi6 s GLN 55 Ca 0.60 0.71 -0.23 0.00 -1.95 0.00 0.00 55.36 54.48 3hi6 s GLN 55 Cb -0.37 -2.45 -0.06 0.00 -0.22 0.00 0.00 33.01 29.91 3hi6 s GLN 55 CO 0.36 0.16 1.40 -1.13 -0.25 0.00 0.00 175.29 175.83 3hi6 n SER 56 N -0.30 2.98 0.00 5.90 3.41 -1.26 -1.56 113.62 122.78 3hi6 n SER 56 Ca 0.03 1.03 0.00 0.00 -0.26 0.00 0.00 58.87 59.67 3hi6 n SER 56 Cb 0.53 -1.59 0.00 0.00 -0.26 0.00 0.00 64.21 62.89 3hi6 n SER 56 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hi6 n GLY 57 N 0.68 2.65 3.71 5.00 0.00 -1.26 -5.02 105.19 110.94 3hi6 n GLY 57 Ca 0.08 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3hi6 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hi6 s VAL 58 N -1.28 3.97 0.48 1.61 1.01 -0.60 -4.96 120.40 120.62 3hi6 s VAL 58 Ca 0.00 1.41 -0.24 0.00 0.00 0.00 0.00 61.98 63.16 3hi6 s VAL 58 Cb 0.00 -3.91 -0.08 0.00 0.00 0.00 0.00 36.38 32.40 3hi6 s VAL 58 CO 0.00 0.11 1.24 -2.65 0.00 0.00 0.00 175.10 173.79 3hi6 n PRO 59 N 3.97 1.70 0.00 2.72 -0.02 -1.26 -4.87 135.00 137.24 3hi6 n PRO 59 Ca 0.09 0.61 0.09 0.00 -2.02 0.00 0.00 63.50 62.27 3hi6 n PRO 59 Cb 0.46 -2.38 0.43 0.00 -0.02 0.00 0.00 33.50 31.98 3hi6 n PRO 59 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3hi6 n SER 60 N -0.21 0.00 0.22 2.55 3.41 -1.26 -2.35 113.62 115.98 3hi6 n SER 60 Ca 0.09 0.13 0.15 0.00 -0.26 0.00 0.00 58.87 58.98 3hi6 n SER 60 Cb 0.42 -0.33 0.62 0.00 -0.26 0.00 0.00 64.21 64.66 3hi6 n SER 60 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 3hi6 h ARG 61 N 0.00 0.00 -6.24 4.33 0.11 -1.94 -3.43 114.38 107.21 3hi6 h ARG 61 Ca 0.00 0.00 -0.56 0.00 0.10 0.00 0.00 59.98 59.52 3hi6 h ARG 61 Cb 0.19 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.23 3hi6 h ARG 61 CO 0.00 0.00 0.07 -0.06 0.10 0.00 0.00 179.97 180.08 3hi6 s PHE 62 N -3.53 3.75 0.03 4.08 0.08 -0.99 -0.66 117.98 120.74 3hi6 s PHE 62 Ca 0.02 1.36 -0.14 0.00 0.12 0.00 0.00 56.93 58.29 3hi6 s PHE 62 Cb 0.09 -2.68 0.02 0.00 -0.57 0.00 0.00 43.02 39.88 3hi6 s PHE 62 CO 0.47 0.39 0.30 -1.54 -0.10 0.00 0.00 175.22 174.73 3hi6 s SER 63 N -0.42 -0.13 0.05 1.36 1.04 -0.10 -4.95 113.70 110.55 3hi6 s SER 63 Ca 0.34 -0.15 0.05 0.00 0.48 0.00 0.00 55.95 56.67 3hi6 s SER 63 Cb -0.20 0.34 -0.02 0.00 0.10 0.00 0.00 66.02 66.24 3hi6 s SER 63 CO 0.21 -0.58 -0.14 -0.83 0.98 0.00 0.00 173.24 172.87 3hi6 s GLY 64 N -1.92 0.82 0.18 7.32 0.00 -1.26 0.05 107.32 112.51 3hi6 s GLY 64 Ca -0.07 -0.87 -0.05 0.00 0.00 0.00 0.00 44.72 43.73 3hi6 s GLY 64 CO -0.02 -0.86 0.21 -1.35 0.00 0.00 0.00 173.10 171.08 3hi6 s SER 65 N -1.26 0.12 0.00 1.64 1.04 0.06 -4.08 113.70 111.22 3hi6 s SER 65 Ca 0.01 -1.15 0.00 0.00 0.48 0.00 0.00 55.95 55.29 3hi6 s SER 65 Cb -0.08 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.44 3hi6 s SER 65 CO 0.01 -0.88 0.00 0.61 0.98 0.00 0.00 173.24 173.97 3hi6 n GLY 66 N -0.23 3.14 3.41 7.32 0.00 -1.26 -1.22 105.19 116.35 3hi6 n GLY 66 Ca -0.03 -1.99 -0.12 0.00 0.00 0.00 0.00 46.02 43.88 3hi6 n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hi6 s SER 67 N 0.00 -0.52 0.00 1.61 1.04 -1.21 -4.86 113.70 109.75 3hi6 s SER 67 Ca 0.00 -0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.41 3hi6 s SER 67 Cb 0.00 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.70 3hi6 s SER 67 CO 0.00 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 173.90 3hi6 n GLY 68 N -0.29 1.73 0.04 7.32 0.00 0.30 -4.00 105.19 110.30 3hi6 n GLY 68 Ca -0.17 -0.31 -0.04 0.00 0.00 0.00 0.00 46.02 45.51 3hi6 n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3hi6 n THR 69 N 0.00 0.52 -5.12 2.61 -1.04 -1.26 -0.52 114.28 109.47 3hi6 n THR 69 Ca 0.00 -0.31 -0.32 0.00 -2.04 0.00 0.00 64.05 61.37 3hi6 n THR 69 Cb 0.00 -0.80 -0.17 0.00 -1.82 0.00 0.00 70.33 67.54 3hi6 n THR 69 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 3hi6 s ASP 70 N -3.98 3.16 0.08 8.00 1.01 -1.26 -0.52 116.67 123.17 3hi6 s ASP 70 Ca -0.04 -0.55 0.02 0.00 0.71 0.00 0.00 52.55 52.69 3hi6 s ASP 70 Cb 0.02 -1.43 -0.04 0.00 1.01 0.00 0.00 42.92 42.49 3hi6 s ASP 70 CO 0.30 0.15 -0.07 -0.36 0.21 0.00 0.00 175.17 175.41 3hi6 s PHE 71 N 0.40 0.82 -0.05 4.23 0.08 -0.17 -3.36 117.98 119.93 3hi6 s PHE 71 Ca -0.17 -0.83 -0.02 0.00 0.12 0.00 0.00 56.93 56.03 3hi6 s PHE 71 Cb -0.18 -0.48 0.03 0.00 -0.57 0.00 0.00 43.02 41.82 3hi6 s PHE 71 CO 0.07 -0.15 0.12 0.99 -0.10 0.00 0.00 175.22 176.16 3hi6 s THR 72 N -3.12 -0.04 -0.22 0.64 2.01 -0.36 -1.44 115.64 113.11 3hi6 s THR 72 Ca 0.07 0.16 -0.09 0.00 0.31 0.00 0.00 61.69 62.14 3hi6 s THR 72 Cb 0.02 -0.20 -0.04 0.00 0.01 0.00 0.00 72.50 72.29 3hi6 s THR 72 CO -0.04 0.07 0.11 -0.22 -0.69 0.00 0.00 174.62 173.85 3hi6 s LEU 73 N 1.00 3.95 -0.05 4.42 2.96 -0.07 -0.76 118.68 130.13 3hi6 s LEU 73 Ca -0.08 0.08 0.05 0.00 -0.22 0.00 0.00 54.13 53.96 3hi6 s LEU 73 Cb -0.10 -2.04 -0.02 0.00 0.50 0.00 0.00 46.19 44.53 3hi6 s LEU 73 CO -0.05 0.10 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.00 3hi6 s THR 74 N 0.82 2.56 -0.32 3.68 2.01 0.11 -1.41 115.64 123.10 3hi6 s THR 74 Ca 0.06 -0.90 -0.05 0.00 0.31 0.00 0.00 61.69 61.11 3hi6 s THR 74 Cb -0.13 -1.97 0.04 0.00 0.01 0.00 0.00 72.50 70.45 3hi6 s THR 74 CO 0.02 0.58 0.06 -0.63 -0.69 0.00 0.00 174.62 173.96 3hi6 s ILE 75 N -0.47 3.49 0.30 1.82 1.01 -0.21 -0.92 121.20 126.22 3hi6 s ILE 75 Ca 0.06 -1.19 0.07 0.00 0.00 0.00 0.00 60.65 59.58 3hi6 s ILE 75 Cb -0.12 -2.97 0.04 0.00 0.01 0.00 0.00 42.46 39.43 3hi6 s ILE 75 CO 0.01 -0.13 1.71 0.77 0.00 0.00 0.00 174.94 177.31 3hi6 h SER 76 N 8.14 0.25 -2.15 3.58 4.64 -1.17 -0.17 113.55 126.67 3hi6 h SER 76 Ca -0.23 -0.10 -0.30 0.00 -0.47 0.00 0.00 61.79 60.68 3hi6 h SER 76 Cb 1.08 -0.07 -0.33 0.00 -0.31 0.00 0.00 62.40 62.77 3hi6 h SER 76 CO 0.58 0.63 -0.61 -0.55 -0.87 0.00 0.00 176.83 176.00 3hi6 s SER 77 N -6.88 1.41 0.22 4.97 0.15 -1.26 -3.90 113.70 108.41 3hi6 s SER 77 Ca -0.05 -0.56 -0.31 0.00 0.70 0.00 0.00 55.95 55.74 3hi6 s SER 77 Cb 0.13 0.59 -0.10 0.00 -1.71 0.00 0.00 66.02 64.93 3hi6 s SER 77 CO 0.77 -0.37 1.55 -0.22 1.20 0.00 0.00 173.24 176.17 3hi6 s LEU 78 N 2.39 4.37 0.30 3.45 2.96 0.34 -4.62 118.68 127.86 3hi6 s LEU 78 Ca 0.09 2.71 0.10 0.00 -0.22 0.00 0.00 54.13 56.82 3hi6 s LEU 78 Cb -0.14 -3.61 -0.05 0.00 0.50 0.00 0.00 46.19 42.89 3hi6 s LEU 78 CO -0.28 -0.82 -0.07 -1.10 -1.32 0.00 0.00 176.35 172.76 3hi6 s GLN 79 N 0.39 1.98 0.26 1.98 -1.52 -1.26 0.29 119.66 121.79 3hi6 s GLN 79 Ca 0.66 -1.68 -0.03 0.00 -1.95 0.00 0.00 55.36 52.37 3hi6 s GLN 79 Cb -0.44 -1.92 0.52 0.00 -0.22 0.00 0.00 33.01 30.95 3hi6 s GLN 79 CO 0.38 0.27 1.70 -0.07 -0.25 0.00 0.00 175.29 177.32 3hi6 h LEU 80 N 2.00 0.18 -1.94 2.90 3.38 -1.95 0.21 115.31 120.10 3hi6 h LEU 80 Ca -0.42 0.14 0.09 0.00 0.09 0.00 0.00 57.88 57.77 3hi6 h LEU 80 Cb 1.25 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.13 3hi6 h LEU 80 CO 0.63 0.02 0.44 -0.33 0.09 0.00 0.00 178.44 179.29 3hi6 h GLU 81 N 0.36 0.00 -0.00 1.13 5.08 -1.96 -2.93 114.58 116.26 3hi6 h GLU 81 Ca 0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.81 3hi6 h GLU 81 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 3hi6 h GLU 81 CO -0.48 0.00 -0.04 -0.25 -1.00 0.00 0.00 179.01 177.24 3hi6 n ASP 82 N -3.48 0.35 -4.61 1.42 8.00 0.06 -4.80 116.55 113.49 3hi6 n ASP 82 Ca 0.05 -0.72 -0.43 0.00 0.71 0.00 0.00 54.79 54.40 3hi6 n ASP 82 Cb 0.58 -0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.56 3hi6 n ASP 82 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3hi6 n PHE 83 N -0.91 2.11 0.00 1.24 7.35 -1.11 -4.84 117.46 121.31 3hi6 n PHE 83 Ca 0.18 -0.19 0.00 0.00 -0.76 0.00 0.00 57.45 56.68 3hi6 n PHE 83 Cb 0.23 -2.75 0.00 0.00 0.35 0.00 0.00 39.48 37.31 3hi6 n PHE 83 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3hi6 n ALA 84 N 10.45 0.00 -2.82 3.13 0.00 -1.19 -4.83 120.51 125.25 3hi6 n ALA 84 Ca 0.27 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.35 3hi6 n ALA 84 Cb 0.43 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.81 3hi6 n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3hi6 s THR 85 N -2.00 5.41 -0.09 0.00 2.01 -0.51 -1.15 115.64 119.32 3hi6 s THR 85 Ca 0.00 0.18 0.03 0.00 0.31 0.00 0.00 61.69 62.21 3hi6 s THR 85 Cb 0.00 -3.39 -0.01 0.00 0.01 0.00 0.00 72.50 69.10 3hi6 s THR 85 CO 0.00 0.56 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.98 3hi6 s TYR 86 N -0.52 2.62 -0.06 4.92 2.02 -0.21 0.04 117.35 126.16 3hi6 s TYR 86 Ca 0.12 -0.67 0.05 0.00 -0.37 0.00 0.00 57.07 56.20 3hi6 s TYR 86 Cb -0.12 -1.70 -0.00 0.00 -0.40 0.00 0.00 41.96 39.74 3hi6 s TYR 86 CO 0.02 -0.19 -0.20 0.71 -1.57 0.00 0.00 175.55 174.31 3hi6 s TYR 87 N -0.00 2.04 0.42 2.71 2.02 -0.45 -0.77 117.35 123.32 3hi6 s TYR 87 Ca -0.06 -0.64 -0.08 0.00 -0.37 0.00 0.00 57.07 55.91 3hi6 s TYR 87 Cb -0.15 -1.37 -0.05 0.00 -0.40 0.00 0.00 41.96 39.99 3hi6 s TYR 87 CO 0.05 -0.22 0.74 0.00 -1.57 0.00 0.00 175.55 174.55 3hi6 s GLN 89 N -4.13 0.31 0.04 0.00 -0.44 0.64 -1.54 119.66 114.53 3hi6 s GLN 89 Ca 0.49 0.89 -0.28 0.00 -2.50 0.00 0.00 55.36 53.96 3hi6 s GLN 89 Cb -0.10 0.11 -0.05 0.00 -1.64 0.00 0.00 33.01 31.34 3hi6 s GLN 89 CO 0.36 -0.34 0.89 1.14 0.50 0.00 0.00 175.29 177.84 3hi6 s GLN 90 N 2.58 4.57 -0.22 1.67 1.03 -0.55 -0.70 119.66 128.04 3hi6 s GLN 90 Ca 0.02 1.27 0.14 0.00 0.04 0.00 0.00 55.36 56.84 3hi6 s GLN 90 Cb -0.13 -3.41 0.58 0.00 0.03 0.00 0.00 33.01 30.08 3hi6 s GLN 90 CO -0.13 0.12 1.51 -1.13 -2.54 0.00 0.00 175.29 173.12 3hi6 n SER 91 N 3.29 3.96 -0.01 12.60 3.41 0.25 -3.11 113.62 134.00 3hi6 n SER 91 Ca 0.02 -3.15 -0.13 0.00 -0.26 0.00 0.00 58.87 55.35 3hi6 n SER 91 Cb 0.50 -0.60 -0.10 0.00 -0.26 0.00 0.00 64.21 63.76 3hi6 n SER 91 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 3hi6 h TYR 92 N 1.97 -0.00 -2.89 7.33 3.20 -1.89 -3.46 116.97 121.22 3hi6 h TYR 92 Ca 0.07 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.94 3hi6 h TYR 92 Cb 1.64 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.92 3hi6 h TYR 92 CO 0.73 0.49 0.00 -1.13 -1.64 0.00 0.00 178.16 176.61 3hi6 n SER 93 N -4.86 1.89 -4.66 -2.11 3.41 -1.26 -5.09 113.62 100.94 3hi6 n SER 93 Ca -0.08 0.00 -0.44 0.00 -0.26 0.00 0.00 58.87 58.09 3hi6 n SER 93 Cb 0.25 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.19 3hi6 n SER 93 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3hi6 n THR 94 N 0.00 1.73 -1.66 6.66 -2.24 -1.26 -4.77 114.28 112.74 3hi6 n THR 94 Ca 0.00 -0.43 -0.44 0.00 -2.27 0.00 0.00 64.05 60.90 3hi6 n THR 94 Cb 0.00 -1.40 -0.02 0.00 -2.10 0.00 0.00 70.33 66.81 3hi6 n THR 94 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3hi6 n PRO 95 N 0.96 1.86 -4.05 -0.78 -0.02 -1.26 -4.96 135.00 126.75 3hi6 n PRO 95 Ca 0.08 0.66 -0.13 0.00 -2.02 0.00 0.00 63.50 62.09 3hi6 n PRO 95 Cb 0.34 -2.23 -0.12 0.00 -0.02 0.00 0.00 33.50 31.47 3hi6 n PRO 95 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3hi6 s SER 96 N -0.05 0.65 0.12 2.55 1.04 -1.18 -5.02 113.70 111.81 3hi6 s SER 96 Ca 0.63 -0.45 0.08 0.00 0.48 0.00 0.00 55.95 56.69 3hi6 s SER 96 Cb -0.65 0.03 -0.04 0.00 0.10 0.00 0.00 66.02 65.46 3hi6 s SER 96 CO 0.55 -0.18 -0.11 -0.36 0.98 0.00 0.00 173.24 174.12 3hi6 s PHE 97 N -1.15 2.69 0.87 5.02 0.08 -1.26 -1.48 117.98 122.75 3hi6 s PHE 97 Ca -0.09 -0.18 -0.11 0.00 0.12 0.00 0.00 56.93 56.66 3hi6 s PHE 97 Cb -0.08 -1.40 0.11 0.00 -0.57 0.00 0.00 43.02 41.08 3hi6 s PHE 97 CO 0.00 0.43 1.09 0.20 -0.10 0.00 0.00 175.22 176.84 3hi6 s GLY 98 N -2.28 1.62 0.54 4.36 0.00 -0.59 -4.51 107.32 106.46 3hi6 s GLY 98 Ca 0.21 -0.07 0.36 0.00 0.00 0.00 0.00 44.72 45.22 3hi6 s GLY 98 CO 0.13 0.40 2.09 0.06 0.00 0.00 0.00 173.10 175.78 3hi6 h GLN 99 N -1.44 0.00 0.00 2.90 -0.00 -1.90 -3.44 115.11 111.23 3hi6 h GLN 99 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.16 3hi6 h GLN 99 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.76 3hi6 h GLN 99 CO 0.55 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.79 3hi6 n GLY 100 N -0.64 2.08 3.00 0.06 0.00 -1.26 -5.04 105.19 103.38 3hi6 n GLY 100 Ca -0.01 -1.75 -0.28 0.00 0.00 0.00 0.00 46.02 43.98 3hi6 n GLY 100 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hi6 s THR 101 N -2.17 1.37 -0.35 2.61 2.01 0.05 -4.49 115.64 114.68 3hi6 s THR 101 Ca 0.00 -0.53 -0.20 0.00 0.31 0.00 0.00 61.69 61.27 3hi6 s THR 101 Cb 0.00 -1.30 -0.00 0.00 0.01 0.00 0.00 72.50 71.21 3hi6 s THR 101 CO 0.00 0.42 0.61 -0.75 -0.69 0.00 0.00 174.62 174.21 3hi6 s LYS 102 N 1.38 3.69 -0.25 4.92 2.20 0.05 -1.04 119.74 130.69 3hi6 s LYS 102 Ca 0.01 0.03 -0.15 0.00 -0.36 0.00 0.00 55.97 55.50 3hi6 s LYS 102 Cb -0.13 -3.80 -0.04 0.00 -1.51 0.00 0.00 37.83 32.35 3hi6 s LYS 102 CO -0.07 -0.69 0.38 0.08 -0.36 0.00 0.00 175.35 174.69 3hi6 s VAL 103 N 2.62 5.18 0.15 4.02 1.01 -0.30 -1.40 120.40 131.68 3hi6 s VAL 103 Ca 0.23 0.61 0.06 0.00 0.00 0.00 0.00 61.98 62.88 3hi6 s VAL 103 Cb -0.15 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 3hi6 s VAL 103 CO 0.14 0.18 0.05 -1.83 0.00 0.00 0.00 175.10 173.64 3hi6 s GLU 104 N 1.88 2.60 -0.27 2.72 -1.05 0.19 -3.18 118.70 121.59 3hi6 s GLU 104 Ca 0.16 -0.97 -0.20 0.00 -0.15 0.00 0.00 54.97 53.81 3hi6 s GLU 104 Cb -0.15 -2.49 -0.02 0.00 -0.44 0.00 0.00 34.13 31.03 3hi6 s GLU 104 CO 0.09 0.48 0.62 0.42 0.95 0.00 0.00 175.26 177.83 3hi6 s ILE 105 N -1.65 4.97 0.03 1.83 -1.09 -1.26 -2.09 121.20 121.93 3hi6 s ILE 105 Ca 0.28 1.02 -0.30 0.00 -2.23 0.00 0.00 60.65 59.42 3hi6 s ILE 105 Cb -0.10 -3.95 -0.04 0.00 -1.58 0.00 0.00 42.46 36.79 3hi6 s ILE 105 CO 0.20 -0.03 1.01 -0.75 -1.23 0.00 0.00 174.94 174.14 3hi6 s LYS 106 N 2.53 4.56 0.38 2.79 2.20 -0.02 -4.82 119.74 127.35 3hi6 s LYS 106 Ca 0.25 1.48 0.05 0.00 -0.36 0.00 0.00 55.97 57.39 3hi6 s LYS 106 Cb -0.15 -3.43 -0.03 0.00 -1.51 0.00 0.00 37.83 32.71 3hi6 s LYS 106 CO 0.10 -0.04 0.18 -0.98 -0.36 0.00 0.00 175.35 174.25 3hi6 s ARG 107 N 0.85 1.86 0.66 4.03 1.70 -1.26 -4.00 118.95 122.78 3hi6 s ARG 107 Ca 0.52 -2.12 -0.16 0.00 -0.47 0.00 0.00 55.73 53.51 3hi6 s ARG 107 Cb -0.23 -0.26 -0.00 0.00 -0.57 0.00 0.00 34.95 33.89 3hi6 s ARG 107 CO 0.29 -0.54 1.14 -0.08 -1.08 0.00 0.00 175.30 175.02 3hi6 s THR 108 N -3.31 3.02 0.33 4.99 -1.32 -1.26 -4.96 115.64 113.12 3hi6 s THR 108 Ca 0.30 0.50 -0.29 0.00 -1.21 0.00 0.00 61.69 60.99 3hi6 s THR 108 Cb 0.02 -3.05 -0.10 0.00 -1.51 0.00 0.00 72.50 67.86 3hi6 s THR 108 CO 0.19 -0.26 1.38 -0.69 -2.21 0.00 0.00 174.62 173.03 3hi6 s VAL 109 N -2.17 2.53 -0.05 5.08 1.01 -1.26 -4.77 120.40 120.76 3hi6 s VAL 109 Ca 0.70 0.51 -0.01 0.00 0.00 0.00 0.00 61.98 63.17 3hi6 s VAL 109 Cb -0.23 -3.32 0.03 0.00 0.00 0.00 0.00 36.38 32.85 3hi6 s VAL 109 CO 0.40 0.11 0.02 0.00 0.00 0.00 0.00 175.10 175.64 3hi6 s ALA 110 N -0.89 0.47 0.43 5.51 0.00 0.26 -4.90 121.76 122.65 3hi6 s ALA 110 Ca 0.52 0.03 -0.24 0.00 0.00 0.00 0.00 51.96 52.27 3hi6 s ALA 110 Cb -0.42 -0.63 -0.08 0.00 0.00 0.00 0.00 23.12 21.99 3hi6 s ALA 110 CO 0.53 -0.41 1.20 0.00 0.00 0.00 0.00 175.76 177.09 3hi6 s ALA 111 N 1.89 3.09 0.52 0.00 0.00 -1.26 -0.56 121.76 125.43 3hi6 s ALA 111 Ca 0.03 1.02 -0.19 0.00 0.00 0.00 0.00 51.96 52.82 3hi6 s ALA 111 Cb -0.12 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 19.52 3hi6 s ALA 111 CO -0.04 -0.67 1.03 -1.25 0.00 0.00 0.00 175.76 174.83 3hi6 s PRO 112 N -2.46 3.71 -0.05 0.00 0.04 -1.26 -4.53 135.00 130.44 3hi6 s PRO 112 Ca 0.60 1.25 -0.16 0.00 0.04 0.00 0.00 61.00 62.73 3hi6 s PRO 112 Cb -0.32 -2.09 -0.05 0.00 0.04 0.00 0.00 34.50 32.09 3hi6 s PRO 112 CO 0.39 -0.50 0.43 -1.12 0.04 0.00 0.00 177.00 176.25 3hi6 s SER 113 N -2.36 6.74 -0.04 6.66 0.01 -0.93 -4.86 113.70 118.92 3hi6 s SER 113 Ca 0.65 0.88 0.03 0.00 1.31 0.00 0.00 55.95 58.82 3hi6 s SER 113 Cb -0.15 -2.26 -0.03 0.00 0.21 0.00 0.00 66.02 63.79 3hi6 s SER 113 CO 0.26 0.18 -0.12 -0.69 0.41 0.00 0.00 173.24 173.27 3hi6 s VAL 114 N -0.30 3.24 0.01 3.43 1.01 -1.26 -0.37 120.40 126.16 3hi6 s VAL 114 Ca 0.24 -0.71 -0.00 0.00 0.00 0.00 0.00 61.98 61.51 3hi6 s VAL 114 Cb -0.16 -2.30 -0.01 0.00 0.00 0.00 0.00 36.38 33.91 3hi6 s VAL 114 CO 0.12 0.56 -0.01 -0.36 0.00 0.00 0.00 175.10 175.41 3hi6 s PHE 115 N -0.79 0.09 0.09 5.22 0.08 -0.46 -4.99 117.98 117.23 3hi6 s PHE 115 Ca 0.12 -0.19 0.08 0.00 0.12 0.00 0.00 56.93 57.07 3hi6 s PHE 115 Cb -0.11 -0.07 -0.04 0.00 -0.57 0.00 0.00 43.02 42.24 3hi6 s PHE 115 CO 0.02 -0.08 -0.19 -1.50 -0.10 0.00 0.00 175.22 173.37 3hi6 s ILE 116 N -0.56 2.76 -0.13 0.64 2.07 -1.26 -0.42 121.20 124.30 3hi6 s ILE 116 Ca -0.06 -1.40 -0.01 0.00 -1.41 0.00 0.00 60.65 57.76 3hi6 s ILE 116 Cb -0.04 -2.22 0.04 0.00 0.13 0.00 0.00 42.46 40.37 3hi6 s ILE 116 CO -0.00 0.20 -0.01 -0.36 -1.91 0.00 0.00 174.94 172.85 3hi6 s PHE 117 N -1.04 1.10 0.78 3.50 0.08 0.77 -5.00 117.98 118.18 3hi6 s PHE 117 Ca 0.16 -0.63 -0.11 0.00 0.12 0.00 0.00 56.93 56.48 3hi6 s PHE 117 Cb -0.10 -1.03 0.06 0.00 -0.57 0.00 0.00 43.02 41.37 3hi6 s PHE 117 CO 0.08 -0.49 1.10 -1.25 -0.10 0.00 0.00 175.22 174.55 3hi6 s PRO 118 N 1.83 2.15 0.50 0.24 0.04 -1.26 -1.95 135.00 136.56 3hi6 s PRO 118 Ca 0.03 1.21 -0.22 0.00 0.04 0.00 0.00 61.00 62.05 3hi6 s PRO 118 Cb -0.14 -1.88 -0.06 0.00 0.04 0.00 0.00 34.50 32.46 3hi6 s PRO 118 CO -0.07 -1.73 1.26 -1.25 0.04 0.00 0.00 177.00 175.26 3hi6 s PRO 119 N -4.87 3.44 0.61 0.56 0.04 -1.19 -4.84 135.00 128.75 3hi6 s PRO 119 Ca 0.62 2.01 -0.14 0.00 0.04 0.00 0.00 61.00 63.53 3hi6 s PRO 119 Cb -0.18 -2.33 -0.03 0.00 0.04 0.00 0.00 34.50 32.00 3hi6 s PRO 119 CO 0.56 -0.88 1.04 -1.54 0.04 0.00 0.00 177.00 176.22 3hi6 s SER 120 N -1.15 5.90 0.39 6.66 1.04 -1.26 -4.95 113.70 120.33 3hi6 s SER 120 Ca 0.68 1.67 0.08 0.00 0.48 0.00 0.00 55.95 58.85 3hi6 s SER 120 Cb -0.35 -2.51 0.80 0.00 0.10 0.00 0.00 66.02 64.07 3hi6 s SER 120 CO 0.41 -1.09 1.98 0.44 0.98 0.00 0.00 173.24 175.97 3hi6 h ASP 121 N 0.14 0.39 -0.18 7.02 3.32 -1.98 -2.25 116.42 122.87 3hi6 h ASP 121 Ca -0.46 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 56.54 3hi6 h ASP 121 Cb 1.21 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.65 3hi6 h ASP 121 CO 0.59 0.39 0.08 -0.33 -1.72 0.00 0.00 179.24 178.24 3hi6 h GLU 122 N 0.42 0.27 -0.47 3.56 3.07 -2.00 -2.35 114.58 117.09 3hi6 h GLU 122 Ca 0.10 -0.04 -0.05 0.00 -0.50 0.00 0.00 59.36 58.87 3hi6 h GLU 122 Cb 0.15 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 27.99 3hi6 h GLU 122 CO -0.01 0.31 0.06 0.37 -1.40 0.00 0.00 179.01 178.35 3hi6 h GLN 123 N 0.16 0.73 0.00 2.33 4.15 -1.84 -2.22 115.11 118.41 3hi6 h GLN 123 Ca 0.06 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.32 3hi6 h GLN 123 Cb 0.13 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 27.72 3hi6 h GLN 123 CO -0.01 0.70 0.00 -0.07 -1.93 0.00 0.00 178.83 177.52 3hi6 h LEU 124 N 0.69 0.00 -0.84 -2.39 3.38 -1.10 -2.47 115.31 112.59 3hi6 h LEU 124 Ca 0.15 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.17 3hi6 h LEU 124 Cb 0.34 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.03 3hi6 h LEU 124 CO 0.01 0.00 0.53 0.11 0.09 0.00 0.00 178.44 179.17 3hi6 h LYS 125 N 0.00 0.96 -7.39 1.13 6.56 -0.87 -3.42 116.57 113.55 3hi6 h LYS 125 Ca 0.00 -0.06 -0.46 0.00 -1.06 0.00 0.00 60.65 59.07 3hi6 h LYS 125 Cb 0.26 -0.22 0.09 0.00 -0.57 0.00 0.00 32.23 31.79 3hi6 h LYS 125 CO 0.00 0.64 0.27 -1.12 -2.06 0.00 0.00 179.45 177.18 3hi6 s SER 126 N -5.81 4.66 -0.31 0.86 0.01 -0.93 -4.96 113.70 107.22 3hi6 s SER 126 Ca -0.13 0.49 -0.07 0.00 1.31 0.00 0.00 55.95 57.56 3hi6 s SER 126 Cb 0.17 -1.07 -0.23 0.00 0.21 0.00 0.00 66.02 65.10 3hi6 s SER 126 CO 0.79 -1.72 3.50 0.61 0.41 0.00 0.00 173.24 176.82 3hi6 n GLY 127 N -3.04 3.25 3.07 3.44 0.00 -1.26 -4.79 105.19 105.85 3hi6 n GLY 127 Ca 0.09 -1.27 -0.12 0.00 0.00 0.00 0.00 46.02 44.71 3hi6 n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hi6 s THR 128 N 1.18 -0.03 -0.06 2.61 -4.23 -1.26 -3.01 115.64 110.85 3hi6 s THR 128 Ca 0.67 0.11 -0.02 0.00 -1.18 0.00 0.00 61.69 61.27 3hi6 s THR 128 Cb 0.29 -0.36 0.03 0.00 1.34 0.00 0.00 72.50 73.81 3hi6 s THR 128 CO -0.01 0.04 0.06 0.00 -0.54 0.00 0.00 174.62 174.17 3hi6 s ALA 129 N 0.93 0.32 -0.12 3.99 0.00 -0.39 -3.67 121.76 122.82 3hi6 s ALA 129 Ca -0.07 0.08 0.01 0.00 0.00 0.00 0.00 51.96 51.98 3hi6 s ALA 129 Cb -0.08 -0.69 -0.01 0.00 0.00 0.00 0.00 23.12 22.34 3hi6 s ALA 129 CO -0.06 -0.58 -0.15 -1.12 0.00 0.00 0.00 175.76 173.85 3hi6 s SER 130 N 2.14 3.86 -0.16 0.00 0.01 -1.26 -0.85 113.70 117.45 3hi6 s SER 130 Ca 0.05 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 56.95 3hi6 s SER 130 Cb -0.13 -1.54 0.00 0.00 0.21 0.00 0.00 66.02 64.57 3hi6 s SER 130 CO -0.04 0.17 -0.16 -0.69 0.41 0.00 0.00 173.24 172.93 3hi6 s VAL 131 N 0.29 2.55 -0.15 3.43 1.01 -0.01 -3.17 120.40 124.35 3hi6 s VAL 131 Ca -0.11 -0.81 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 3hi6 s VAL 131 Cb -0.16 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.13 3hi6 s VAL 131 CO 0.06 0.52 -0.07 -0.69 0.00 0.00 0.00 175.10 174.92 3hi6 s VAL 132 N 0.88 3.55 -0.13 2.92 1.01 -0.82 -0.57 120.40 127.24 3hi6 s VAL 132 Ca -0.04 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 3hi6 s VAL 132 Cb -0.15 -2.54 -0.03 0.00 0.00 0.00 0.00 36.38 33.66 3hi6 s VAL 132 CO -0.02 0.50 -0.03 0.00 0.00 0.00 0.00 175.10 175.55 3hi6 s LEU 134 N 0.03 2.22 -0.24 0.00 2.96 0.45 -0.49 118.68 123.60 3hi6 s LEU 134 Ca 0.01 -0.55 -0.06 0.00 -0.22 0.00 0.00 54.13 53.31 3hi6 s LEU 134 Cb -0.13 -1.47 -0.02 0.00 0.50 0.00 0.00 46.19 45.07 3hi6 s LEU 134 CO 0.03 0.11 0.04 -0.76 -1.32 0.00 0.00 176.35 174.44 3hi6 s LEU 135 N 0.64 3.29 -0.15 -0.68 1.02 0.35 -1.35 118.68 121.81 3hi6 s LEU 135 Ca -0.10 -0.25 -0.03 0.00 0.02 0.00 0.00 54.13 53.76 3hi6 s LEU 135 Cb -0.16 -1.87 -0.02 0.00 0.02 0.00 0.00 46.19 44.15 3hi6 s LEU 135 CO 0.02 -0.03 -0.07 0.21 0.02 0.00 0.00 176.35 176.51 3hi6 s ASN 136 N 1.55 4.55 -0.98 2.29 2.47 0.50 -0.85 114.94 124.46 3hi6 s ASN 136 Ca 0.06 -0.19 -0.06 0.00 0.42 0.00 0.00 52.86 53.09 3hi6 s ASN 136 Cb -0.15 -1.73 -0.05 0.00 -1.45 0.00 0.00 41.25 37.87 3hi6 s ASN 136 CO 0.02 0.17 0.86 0.59 -3.72 0.00 0.00 177.10 175.01 3hi6 n ASN 137 N 3.54 -6.82 -4.49 -4.21 3.02 -0.65 -2.19 115.26 103.46 3hi6 n ASN 137 Ca -0.18 -0.59 -0.24 0.00 -0.03 0.00 0.00 54.58 53.55 3hi6 n ASN 137 Cb 0.53 -5.10 -0.10 0.00 -0.61 0.00 0.00 39.78 34.49 3hi6 n ASN 137 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 3hi6 s PHE 138 N -3.30 2.20 -0.18 3.10 -0.12 0.23 -4.62 117.98 115.29 3hi6 s PHE 138 Ca 0.36 -0.56 -0.14 0.00 -0.05 0.00 0.00 56.93 56.54 3hi6 s PHE 138 Cb -0.05 -1.22 0.05 0.00 -0.63 0.00 0.00 43.02 41.17 3hi6 s PHE 138 CO 0.75 0.48 0.46 -0.47 -0.05 0.00 0.00 175.22 176.39 3hi6 s TYR 139 N -2.76 -0.57 0.95 3.49 5.04 0.27 -0.83 117.35 122.94 3hi6 s TYR 139 Ca 0.31 1.31 -0.15 0.00 -2.44 0.00 0.00 57.07 56.10 3hi6 s TYR 139 Cb 0.02 0.23 0.20 0.00 0.35 0.00 0.00 41.96 42.76 3hi6 s TYR 139 CO 0.14 -0.29 1.30 -1.25 -1.34 0.00 0.00 175.55 174.11 3hi6 s PRO 140 N 0.68 0.66 0.46 4.97 0.04 -1.26 -0.57 135.00 139.98 3hi6 s PRO 140 Ca -0.04 -0.53 0.15 0.00 0.04 0.00 0.00 61.00 60.63 3hi6 s PRO 140 Cb -0.05 -1.89 1.11 0.00 0.04 0.00 0.00 34.50 33.70 3hi6 s PRO 140 CO -0.05 -2.37 2.02 -0.09 0.04 0.00 0.00 177.00 176.56 3hi6 h ARG 141 N -1.56 0.28 -6.26 4.56 2.43 -1.98 -3.42 114.38 108.43 3hi6 h ARG 141 Ca -0.43 -0.02 -0.55 0.00 -0.81 0.00 0.00 59.98 58.17 3hi6 h ARG 141 Cb 1.23 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.71 3hi6 h ARG 141 CO 0.36 0.19 1.13 -1.21 -1.51 0.00 0.00 179.97 178.93 3hi6 s GLU 142 N -5.29 4.00 -0.12 0.20 8.01 -1.26 -4.97 118.70 119.28 3hi6 s GLU 142 Ca -0.07 2.03 -0.18 0.00 0.01 0.00 0.00 54.97 56.77 3hi6 s GLU 142 Cb 0.19 -4.03 0.04 0.00 -4.31 0.00 0.00 34.13 26.02 3hi6 s GLU 142 CO 0.73 -1.06 0.45 0.00 0.01 0.00 0.00 175.26 175.39 3hi6 s ALA 143 N 4.66 -1.13 -0.14 5.21 0.00 -1.26 -4.61 121.76 124.49 3hi6 s ALA 143 Ca 0.75 1.05 -0.02 0.00 0.00 0.00 0.00 51.96 53.75 3hi6 s ALA 143 Cb -0.31 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.35 3hi6 s ALA 143 CO 0.30 -0.25 -0.09 0.21 0.00 0.00 0.00 175.76 175.93 3hi6 s LYS 144 N -0.35 3.48 -0.13 0.00 2.20 -0.24 -5.00 119.74 119.70 3hi6 s LYS 144 Ca -0.05 -0.63 0.00 0.00 -0.36 0.00 0.00 55.97 54.94 3hi6 s LYS 144 Cb -0.03 -2.75 0.02 0.00 -1.51 0.00 0.00 37.83 33.56 3hi6 s LYS 144 CO 0.03 0.20 -0.13 0.08 -0.36 0.00 0.00 175.35 175.17 3hi6 s VAL 145 N 0.42 1.40 -0.12 4.02 1.01 -1.26 -0.98 120.40 124.89 3hi6 s VAL 145 Ca -0.08 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.37 3hi6 s VAL 145 Cb -0.15 -1.33 -0.02 0.00 0.00 0.00 0.00 36.38 34.88 3hi6 s VAL 145 CO 0.04 0.43 -0.13 -1.10 0.00 0.00 0.00 175.10 174.34 3hi6 s GLN 146 N 1.43 3.25 -0.19 2.72 -0.21 -0.60 -4.94 119.66 121.11 3hi6 s GLN 146 Ca 0.02 -0.67 -0.12 0.00 0.02 0.00 0.00 55.36 54.61 3hi6 s GLN 146 Cb -0.13 -2.61 -0.05 0.00 1.00 0.00 0.00 33.01 31.22 3hi6 s GLN 146 CO -0.08 0.29 0.20 -1.58 -2.12 0.00 0.00 175.29 172.00 3hi6 s TRP 147 N 0.15 3.41 -0.08 0.91 0.52 -1.26 -0.47 118.94 122.12 3hi6 s TRP 147 Ca -0.07 0.42 0.03 0.00 0.02 0.00 0.00 56.10 56.49 3hi6 s TRP 147 Cb -0.15 -2.26 0.01 0.00 -1.15 0.00 0.00 33.47 29.93 3hi6 s TRP 147 CO 0.05 0.22 -0.15 0.15 0.02 0.00 0.00 176.95 177.24 3hi6 s LYS 148 N 0.56 2.07 -0.28 4.98 1.02 -0.18 -0.83 119.74 127.07 3hi6 s LYS 148 Ca 0.11 -0.53 0.02 0.00 0.02 0.00 0.00 55.97 55.59 3hi6 s LYS 148 Cb -0.12 -1.67 0.07 0.00 -0.52 0.00 0.00 37.83 35.59 3hi6 s LYS 148 CO 0.01 0.05 -0.05 0.08 -0.92 0.00 0.00 175.35 174.52 3hi6 s VAL 149 N 0.64 2.38 -1.56 3.17 1.01 -0.38 -1.57 120.40 124.09 3hi6 s VAL 149 Ca -0.14 -1.71 -0.12 0.00 0.00 0.00 0.00 61.98 60.00 3hi6 s VAL 149 Cb -0.16 -2.46 0.09 0.00 0.00 0.00 0.00 36.38 33.85 3hi6 s VAL 149 CO 0.04 -0.15 0.80 0.47 0.00 0.00 0.00 175.10 176.26 3hi6 n ASP 150 N 4.45 -3.29 0.00 3.32 8.00 -0.35 -1.60 116.55 127.08 3hi6 n ASP 150 Ca -0.11 -0.90 0.00 0.00 0.71 0.00 0.00 54.79 54.49 3hi6 n ASP 150 Cb 0.42 -3.35 0.00 0.00 -0.02 0.00 0.00 41.12 38.17 3hi6 n ASP 150 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3hi6 n ASN 151 N -2.81 -2.13 -4.65 -2.24 3.02 -1.26 -5.01 115.26 100.19 3hi6 n ASN 151 Ca -0.03 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.11 3hi6 n ASN 151 Cb 0.55 -1.50 -0.05 0.00 -0.61 0.00 0.00 39.78 38.18 3hi6 n ASN 151 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hi6 s ALA 152 N -2.10 3.62 0.17 5.41 0.00 -0.63 -5.00 121.76 123.23 3hi6 s ALA 152 Ca 0.00 -0.15 -0.31 0.00 0.00 0.00 0.00 51.96 51.51 3hi6 s ALA 152 Cb 0.00 -3.23 -0.09 0.00 0.00 0.00 0.00 23.12 19.80 3hi6 s ALA 152 CO 0.00 -0.85 1.39 -1.17 0.00 0.00 0.00 175.76 175.13 3hi6 s LEU 153 N 2.66 4.39 0.37 0.00 0.20 -1.26 -1.25 118.68 123.77 3hi6 s LEU 153 Ca 0.34 2.44 -0.06 0.00 0.69 0.00 0.00 54.13 57.54 3hi6 s LEU 153 Cb -0.15 -3.60 -0.05 0.00 -0.43 0.00 0.00 46.19 41.96 3hi6 s LEU 153 CO 0.08 -0.64 0.66 -1.10 -0.29 0.00 0.00 176.35 175.06 3hi6 s GLN 154 N 0.49 3.63 -0.16 1.98 -1.52 -0.01 -4.97 119.66 119.10 3hi6 s GLN 154 Ca 0.62 0.12 -0.09 0.00 -1.95 0.00 0.00 55.36 54.06 3hi6 s GLN 154 Cb -0.38 -2.53 0.06 0.00 -0.22 0.00 0.00 33.01 29.94 3hi6 s GLN 154 CO 0.35 0.05 0.38 -1.12 -0.25 0.00 0.00 175.29 174.71 3hi6 s SER 155 N -3.47 -0.48 -0.60 5.90 0.01 -1.26 -4.80 113.70 109.00 3hi6 s SER 155 Ca 0.46 0.83 0.00 0.00 1.31 0.00 0.00 55.95 58.55 3hi6 s SER 155 Cb -0.10 0.72 0.00 0.00 0.21 0.00 0.00 66.02 66.84 3hi6 s SER 155 CO 0.34 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.41 3hi6 n GLY 156 N 4.23 0.70 0.21 3.44 0.00 -1.26 -4.80 105.19 107.70 3hi6 n GLY 156 Ca -0.23 -0.16 0.04 0.00 0.00 0.00 0.00 46.02 45.66 3hi6 n GLY 156 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3hi6 n ASN 157 N -0.45 1.17 -4.71 1.61 6.94 -1.26 -5.05 115.26 113.51 3hi6 n ASN 157 Ca -0.06 -2.29 -0.25 0.00 -0.02 0.00 0.00 54.58 51.96 3hi6 n ASN 157 Cb 0.37 -0.24 -0.08 0.00 -2.36 0.00 0.00 39.78 37.48 3hi6 n ASN 157 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3hi6 s SER 158 N -1.60 4.34 -0.27 0.53 1.04 -1.26 -1.46 113.70 115.03 3hi6 s SER 158 Ca 0.12 -1.07 -0.14 0.00 0.48 0.00 0.00 55.95 55.34 3hi6 s SER 158 Cb 0.11 -0.50 0.08 0.00 0.10 0.00 0.00 66.02 65.81 3hi6 s SER 158 CO 0.01 -0.46 0.65 -1.58 0.98 0.00 0.00 173.24 172.84 3hi6 s GLN 159 N -3.85 0.65 -0.05 4.02 0.74 -0.51 -4.96 119.66 115.70 3hi6 s GLN 159 Ca 0.39 1.19 -0.01 0.00 0.05 0.00 0.00 55.36 56.98 3hi6 s GLN 159 Cb 0.03 0.19 -0.04 0.00 1.10 0.00 0.00 33.01 34.29 3hi6 s GLN 159 CO 0.22 -0.16 0.04 -1.21 -0.55 0.00 0.00 175.29 173.63 3hi6 s GLU 160 N 1.74 3.03 -0.00 1.67 2.02 -1.26 -0.66 118.70 125.24 3hi6 s GLU 160 Ca -0.09 -0.43 0.03 0.00 0.02 0.00 0.00 54.97 54.49 3hi6 s GLU 160 Cb -0.06 -2.84 -0.01 0.00 0.10 0.00 0.00 34.13 31.32 3hi6 s GLU 160 CO -0.19 0.68 -0.09 0.45 0.02 0.00 0.00 175.26 176.13 3hi6 s SER 161 N -1.29 1.08 -0.04 -0.19 0.15 -0.10 -4.99 113.70 108.31 3hi6 s SER 161 Ca 0.18 -0.19 0.05 0.00 0.70 0.00 0.00 55.95 56.68 3hi6 s SER 161 Cb -0.12 -0.11 -0.01 0.00 -1.71 0.00 0.00 66.02 64.08 3hi6 s SER 161 CO 0.08 0.09 -0.19 -0.69 1.20 0.00 0.00 173.24 173.73 3hi6 s VAL 162 N -0.29 1.59 0.76 4.45 1.01 -1.26 -0.63 120.40 126.03 3hi6 s VAL 162 Ca 0.03 -0.82 -0.11 0.00 0.00 0.00 0.00 61.98 61.08 3hi6 s VAL 162 Cb -0.04 -1.35 0.05 0.00 0.00 0.00 0.00 36.38 35.04 3hi6 s VAL 162 CO -0.00 0.45 1.09 0.42 0.00 0.00 0.00 175.10 177.06 3hi6 s THR 163 N -0.10 3.34 0.64 3.92 -4.23 -0.52 -5.00 115.64 113.70 3hi6 s THR 163 Ca -0.02 0.45 -0.11 0.00 -1.18 0.00 0.00 61.69 60.83 3hi6 s THR 163 Cb -0.11 -2.94 -0.02 0.00 1.34 0.00 0.00 72.50 70.77 3hi6 s THR 163 CO 0.02 -0.55 1.04 -1.83 -0.54 0.00 0.00 174.62 172.76 3hi6 s GLU 164 N -4.85 3.35 0.16 3.99 -1.05 -1.26 -4.59 118.70 114.44 3hi6 s GLU 164 Ca 0.61 0.85 -0.34 0.00 -0.15 0.00 0.00 54.97 55.94 3hi6 s GLU 164 Cb -0.17 -2.05 -0.15 0.00 -0.44 0.00 0.00 34.13 31.32 3hi6 s GLU 164 CO 0.55 -0.77 1.36 0.94 0.95 0.00 0.00 175.26 178.29 3hi6 n GLN 165 N -2.84 1.55 -1.95 -4.83 7.27 -1.26 -4.83 117.38 110.48 3hi6 n GLN 165 Ca 0.07 0.56 -0.41 0.00 0.07 0.00 0.00 57.00 57.28 3hi6 n GLN 165 Cb 0.54 -2.19 -0.02 0.00 2.41 0.00 0.00 30.24 30.98 3hi6 n GLN 165 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 3hi6 s ASP 166 N 0.40 6.59 0.32 1.69 -1.08 0.42 -4.89 116.67 120.12 3hi6 s ASP 166 Ca 0.77 2.71 0.26 0.00 -0.52 0.00 0.00 52.55 55.77 3hi6 s ASP 166 Cb -0.80 -2.62 0.99 0.00 -1.46 0.00 0.00 42.92 39.02 3hi6 s ASP 166 CO 0.47 -0.76 1.77 0.77 0.52 0.00 0.00 175.17 177.94 3hi6 h SER 167 N 5.31 0.00 0.01 -0.34 4.64 -1.91 -0.35 113.55 120.91 3hi6 h SER 167 Ca -0.46 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.47 3hi6 h SER 167 Cb 1.22 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.25 3hi6 h SER 167 CO 0.80 0.00 -2.21 0.29 -0.87 0.00 0.00 176.83 174.84 3hi6 n LYS 168 N -2.47 0.60 -0.02 4.77 4.01 -1.26 -4.76 118.16 119.04 3hi6 n LYS 168 Ca 0.03 0.32 0.02 0.00 -0.51 0.00 0.00 58.31 58.17 3hi6 n LYS 168 Cb 0.30 -1.57 0.03 0.00 -0.51 0.00 0.00 35.03 33.29 3hi6 n LYS 168 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 3hi6 n ASP 169 N -4.13 1.62 -1.00 4.39 5.68 -1.23 -5.01 116.55 116.87 3hi6 n ASP 169 Ca -0.47 -1.37 -0.13 0.00 -0.50 0.00 0.00 54.79 52.31 3hi6 n ASP 169 Cb 0.86 -0.02 -0.06 0.00 -1.14 0.00 0.00 41.12 40.76 3hi6 n ASP 169 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3hi6 n SER 170 N 0.21 -5.20 -4.92 -1.12 7.64 -0.14 -4.95 113.62 105.13 3hi6 n SER 170 Ca 0.03 0.32 -0.26 0.00 1.01 0.00 0.00 58.87 59.98 3hi6 n SER 170 Cb 0.17 -3.85 0.05 0.00 -1.01 0.00 0.00 64.21 59.56 3hi6 n SER 170 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3hi6 s THR 171 N -2.27 3.04 0.28 0.44 -4.23 -1.26 -4.51 115.64 107.13 3hi6 s THR 171 Ca 0.00 -0.14 0.10 0.00 -1.18 0.00 0.00 61.69 60.47 3hi6 s THR 171 Cb 0.00 -3.25 -0.04 0.00 1.34 0.00 0.00 72.50 70.55 3hi6 s THR 171 CO 0.00 -0.25 0.00 -0.31 -0.54 0.00 0.00 174.62 173.52 3hi6 s TYR 172 N -3.09 2.65 0.18 3.99 2.02 -0.01 -0.43 117.35 122.65 3hi6 s TYR 172 Ca 0.57 -0.27 0.07 0.00 -0.37 0.00 0.00 57.07 57.06 3hi6 s TYR 172 Cb -0.11 -1.26 -0.04 0.00 -0.40 0.00 0.00 41.96 40.15 3hi6 s TYR 172 CO 0.45 0.58 -0.14 -1.12 -1.57 0.00 0.00 175.55 173.75 3hi6 s SER 173 N -3.69 2.31 -0.08 2.29 0.01 -1.26 -0.60 113.70 112.68 3hi6 s SER 173 Ca 0.32 -0.98 -0.06 0.00 1.31 0.00 0.00 55.95 56.54 3hi6 s SER 173 Cb -0.05 -0.10 0.02 0.00 0.21 0.00 0.00 66.02 66.11 3hi6 s SER 173 CO 0.20 -0.20 0.20 -0.22 0.41 0.00 0.00 173.24 173.63 3hi6 s LEU 174 N -3.12 1.10 -0.06 2.44 0.20 -0.03 -1.43 118.68 117.78 3hi6 s LEU 174 Ca 0.19 0.41 0.03 0.00 0.69 0.00 0.00 54.13 55.44 3hi6 s LEU 174 Cb -0.01 0.67 -0.02 0.00 -0.43 0.00 0.00 46.19 46.39 3hi6 s LEU 174 CO 0.05 -0.09 -0.13 -0.94 -0.29 0.00 0.00 176.35 174.95 3hi6 s SER 175 N 0.33 4.10 -0.19 3.68 1.04 0.20 -0.49 113.70 122.36 3hi6 s SER 175 Ca -0.02 -0.19 0.01 0.00 0.48 0.00 0.00 55.95 56.23 3hi6 s SER 175 Cb -0.03 -0.99 0.03 0.00 0.10 0.00 0.00 66.02 65.13 3hi6 s SER 175 CO -0.01 0.32 -0.17 -0.55 0.98 0.00 0.00 173.24 173.81 3hi6 s SER 176 N -0.59 3.36 -0.23 7.02 0.15 0.35 -0.93 113.70 122.84 3hi6 s SER 176 Ca 0.08 -0.80 -0.07 0.00 0.70 0.00 0.00 55.95 55.87 3hi6 s SER 176 Cb -0.11 -1.45 -0.03 0.00 -1.71 0.00 0.00 66.02 62.72 3hi6 s SER 176 CO 0.01 -0.05 0.05 -0.89 1.20 0.00 0.00 173.24 173.56 3hi6 s THR 177 N 1.28 4.26 -0.25 6.45 2.01 0.17 -0.82 115.64 128.74 3hi6 s THR 177 Ca 0.02 -0.20 -0.14 0.00 0.31 0.00 0.00 61.69 61.68 3hi6 s THR 177 Cb -0.15 -2.97 -0.04 0.00 0.01 0.00 0.00 72.50 69.35 3hi6 s THR 177 CO -0.11 0.37 0.31 -0.22 -0.69 0.00 0.00 174.62 174.29 3hi6 s LEU 178 N 1.33 4.08 -0.23 4.42 2.96 0.27 -1.43 118.68 130.09 3hi6 s LEU 178 Ca 0.05 0.28 -0.05 0.00 -0.22 0.00 0.00 54.13 54.19 3hi6 s LEU 178 Cb -0.15 -2.35 -0.02 0.00 0.50 0.00 0.00 46.19 44.18 3hi6 s LEU 178 CO 0.03 -0.08 -0.00 -0.89 -1.32 0.00 0.00 176.35 174.08 3hi6 s THR 179 N 1.61 3.70 0.07 3.68 2.01 -0.54 -0.83 115.64 125.34 3hi6 s THR 179 Ca 0.14 -0.38 0.03 0.00 0.31 0.00 0.00 61.69 61.78 3hi6 s THR 179 Cb -0.15 -2.70 -0.03 0.00 0.01 0.00 0.00 72.50 69.63 3hi6 s THR 179 CO 0.08 0.40 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.56 3hi6 s LEU 180 N 1.50 2.34 0.54 4.42 1.43 -0.03 -4.88 118.68 124.01 3hi6 s LEU 180 Ca 0.06 -0.71 -0.20 0.00 -1.03 0.00 0.00 54.13 52.25 3hi6 s LEU 180 Cb -0.15 -0.21 -0.05 0.00 0.03 0.00 0.00 46.19 45.82 3hi6 s LEU 180 CO -0.01 -0.26 1.20 -0.94 0.23 0.00 0.00 176.35 176.57 3hi6 s SER 181 N -2.08 5.57 0.28 2.29 1.04 -1.26 -1.26 113.70 118.28 3hi6 s SER 181 Ca -0.01 2.37 -0.02 0.00 0.48 0.00 0.00 55.95 58.76 3hi6 s SER 181 Cb -0.05 -2.60 0.59 0.00 0.10 0.00 0.00 66.02 64.06 3hi6 s SER 181 CO -0.01 -1.33 1.47 1.17 0.98 0.00 0.00 173.24 175.53 3hi6 n LYS 182 N -1.16 -0.08 0.14 4.02 3.00 -1.16 -0.97 118.16 121.94 3hi6 n LYS 182 Ca 0.11 1.44 -0.14 0.00 -0.00 0.00 0.00 58.31 59.72 3hi6 n LYS 182 Cb 0.49 -2.22 -0.08 0.00 0.00 0.00 0.00 35.03 33.22 3hi6 n LYS 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3hi6 h ALA 183 N 1.88 -0.28 -0.25 3.14 0.00 -1.91 -2.61 119.26 119.24 3hi6 h ALA 183 Ca 0.52 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.33 3hi6 h ALA 183 Cb 0.96 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 3hi6 h ALA 183 CO -0.92 -0.63 0.07 -0.44 0.00 0.00 0.00 179.25 177.33 3hi6 h ASP 184 N -0.33 0.31 -0.33 0.00 3.32 -1.60 -2.56 116.42 115.23 3hi6 h ASP 184 Ca -0.03 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 3hi6 h ASP 184 Cb 0.25 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 3hi6 h ASP 184 CO 0.05 0.32 0.00 0.22 -1.72 0.00 0.00 179.24 178.11 3hi6 h TYR 185 N 0.35 0.63 0.00 4.55 3.20 -0.88 -3.01 116.97 121.81 3hi6 h TYR 185 Ca 0.09 -0.11 0.00 0.00 3.14 0.00 0.00 58.73 61.85 3hi6 h TYR 185 Cb 0.13 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.23 3hi6 h TYR 185 CO 0.00 0.70 0.00 0.93 -1.64 0.00 0.00 178.16 178.15 3hi6 h GLU 186 N 0.39 0.00 0.00 1.82 5.08 -1.09 -3.02 114.58 117.76 3hi6 h GLU 186 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3hi6 h GLU 186 Cb 0.44 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3hi6 h GLU 186 CO 0.02 0.00 0.00 0.87 -1.00 0.00 0.00 179.01 178.90 3hi6 h LYS 187 N 0.00 0.00 -5.05 2.33 1.57 -1.34 -3.46 116.57 110.62 3hi6 h LYS 187 Ca 0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.45 3hi6 h LYS 187 Cb 0.44 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 32.59 3hi6 h LYS 187 CO 0.00 0.00 -0.73 -1.01 -0.57 0.00 0.00 179.45 177.14 3hi6 s HIS 188 N -3.27 1.17 -0.17 -1.35 3.76 -1.14 -5.09 115.29 109.20 3hi6 s HIS 188 Ca 0.06 -0.69 -0.17 0.00 -0.15 0.00 0.00 55.06 54.12 3hi6 s HIS 188 Cb 0.10 -0.62 -0.06 0.00 1.11 0.00 0.00 32.58 33.11 3hi6 s HIS 188 CO 0.49 0.04 -0.34 1.17 -0.85 0.00 0.00 174.74 175.26 3hi6 n LYS 189 N 0.28 0.51 -3.10 1.40 4.81 -1.26 -4.73 118.16 116.07 3hi6 n LYS 189 Ca -0.14 0.20 -0.41 0.00 -0.87 0.00 0.00 58.31 57.10 3hi6 n LYS 189 Cb 0.59 -1.40 -0.06 0.00 0.02 0.00 0.00 35.03 34.18 3hi6 n LYS 189 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3hi6 s VAL 190 N -2.87 4.96 -0.18 3.15 1.01 -1.26 -0.85 120.40 124.36 3hi6 s VAL 190 Ca -0.28 1.09 -0.00 0.00 0.00 0.00 0.00 61.98 62.78 3hi6 s VAL 190 Cb 0.04 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.46 3hi6 s VAL 190 CO 0.41 -0.02 -0.14 -0.31 0.00 0.00 0.00 175.10 175.04 3hi6 s TYR 191 N 2.56 2.82 0.00 5.22 2.02 -0.35 -1.21 117.35 128.41 3hi6 s TYR 191 Ca 0.26 -1.20 0.01 0.00 -0.37 0.00 0.00 57.07 55.78 3hi6 s TYR 191 Cb -0.15 -1.94 -0.01 0.00 -0.40 0.00 0.00 41.96 39.46 3hi6 s TYR 191 CO 0.09 -0.59 -0.05 0.00 -1.57 0.00 0.00 175.55 173.44 3hi6 s ALA 192 N 1.09 0.38 -0.09 3.71 0.00 -0.61 -1.28 121.76 124.97 3hi6 s ALA 192 Ca 0.00 -0.24 0.04 0.00 0.00 0.00 0.00 51.96 51.76 3hi6 s ALA 192 Cb -0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 3hi6 s ALA 192 CO -0.05 0.08 -0.21 0.00 0.00 0.00 0.00 175.76 175.58 3hi6 s GLU 194 N 0.17 3.41 -0.20 0.00 2.12 0.38 -1.91 118.70 122.67 3hi6 s GLU 194 Ca -0.12 -0.61 -0.07 0.00 0.36 0.00 0.00 54.97 54.52 3hi6 s GLU 194 Cb -0.16 -3.00 -0.04 0.00 0.26 0.00 0.00 34.13 31.19 3hi6 s GLU 194 CO 0.07 -0.15 0.07 0.08 -0.54 0.00 0.00 175.26 174.78 3hi6 s VAL 195 N 1.37 4.65 -0.14 3.70 1.01 0.11 -1.56 120.40 129.55 3hi6 s VAL 195 Ca 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 61.95 3hi6 s VAL 195 Cb -0.14 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.11 3hi6 s VAL 195 CO -0.02 0.42 -0.15 -0.89 0.00 0.00 0.00 175.10 174.45 3hi6 s THR 196 N 0.79 2.75 -0.08 3.92 2.01 -0.16 -1.60 115.64 123.27 3hi6 s THR 196 Ca 0.04 -0.75 -0.17 0.00 0.31 0.00 0.00 61.69 61.12 3hi6 s THR 196 Cb -0.13 -2.15 0.04 0.00 0.01 0.00 0.00 72.50 70.26 3hi6 s THR 196 CO 0.02 0.52 0.40 -2.28 -0.69 0.00 0.00 174.62 172.59 3hi6 s HIS 197 N 0.65 -0.35 0.41 4.92 2.46 -1.26 -1.08 115.29 121.03 3hi6 s HIS 197 Ca -0.08 0.72 0.22 0.00 0.47 0.00 0.00 55.06 56.39 3hi6 s HIS 197 Cb -0.16 0.16 1.22 0.00 -0.13 0.00 0.00 32.58 33.67 3hi6 s HIS 197 CO 0.02 -0.35 1.71 0.37 -2.47 0.00 0.00 174.74 174.03 3hi6 h GLN 198 N 4.41 0.27 -0.01 2.88 4.15 -1.92 -0.31 115.11 124.58 3hi6 h GLN 198 Ca -0.28 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.12 3hi6 h GLN 198 Cb 1.17 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.80 3hi6 h GLN 198 CO 0.34 0.18 0.00 0.41 -1.93 0.00 0.00 178.83 177.82 3hi6 n GLY 199 N -1.48 -0.69 3.45 2.39 0.00 -1.26 -4.77 105.19 102.84 3hi6 n GLY 199 Ca 0.30 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 3hi6 n GLY 199 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hi6 s LEU 200 N -1.93 2.97 0.45 0.99 1.43 -0.13 -4.41 118.68 118.06 3hi6 s LEU 200 Ca 0.42 -0.20 0.25 0.00 -1.03 0.00 0.00 54.13 53.57 3hi6 s LEU 200 Cb 0.20 -1.68 0.69 0.00 0.03 0.00 0.00 46.19 45.43 3hi6 s LEU 200 CO 0.34 0.21 1.73 0.77 0.23 0.00 0.00 176.35 179.62 3hi6 h SER 201 N 6.41 0.00 -5.17 2.29 4.64 -1.86 -3.44 113.55 116.42 3hi6 h SER 201 Ca -0.32 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.93 3hi6 h SER 201 Cb 1.20 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.16 3hi6 h SER 201 CO 0.57 0.10 -0.20 -0.94 -0.87 0.00 0.00 176.83 175.49 3hi6 s SER 202 N -6.09 -0.07 0.36 4.97 1.04 -1.26 -5.15 113.70 107.50 3hi6 s SER 202 Ca 0.04 -0.64 -0.28 0.00 0.48 0.00 0.00 55.95 55.55 3hi6 s SER 202 Cb 0.07 0.46 -0.10 0.00 0.10 0.00 0.00 66.02 66.56 3hi6 s SER 202 CO 0.64 -0.90 1.30 -2.84 0.98 0.00 0.00 173.24 172.42 3hi6 s PRO 203 N -3.90 4.22 -0.16 4.02 0.02 -1.26 -4.94 135.00 133.01 3hi6 s PRO 203 Ca 0.11 2.19 -0.15 0.00 0.02 0.00 0.00 61.00 63.17 3hi6 s PRO 203 Cb 0.02 -2.96 -0.04 0.00 0.02 0.00 0.00 34.50 31.54 3hi6 s PRO 203 CO -0.05 -0.29 0.35 0.08 -0.33 0.00 0.00 177.00 176.76 3hi6 s VAL 204 N -1.19 5.27 -0.16 3.83 1.01 -0.63 -4.88 120.40 123.64 3hi6 s VAL 204 Ca 0.52 0.66 -0.02 0.00 0.00 0.00 0.00 61.98 63.14 3hi6 s VAL 204 Cb -0.39 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.29 3hi6 s VAL 204 CO 0.51 0.36 -0.10 -0.89 0.00 0.00 0.00 175.10 174.99 3hi6 s THR 205 N 0.60 3.19 -0.09 3.92 2.01 -1.26 0.10 115.64 124.11 3hi6 s THR 205 Ca 0.19 -0.59 0.02 0.00 0.31 0.00 0.00 61.69 61.62 3hi6 s THR 205 Cb -0.14 -2.38 -0.02 0.00 0.01 0.00 0.00 72.50 69.97 3hi6 s THR 205 CO 0.06 0.49 -0.15 -0.54 -0.69 0.00 0.00 174.62 173.78 3hi6 s LYS 206 N 0.77 2.97 0.09 4.92 -0.14 -0.80 -4.99 119.74 122.56 3hi6 s LYS 206 Ca -0.04 -0.72 -0.10 0.00 -1.36 0.00 0.00 55.97 53.75 3hi6 s LYS 206 Cb -0.15 -2.48 0.00 0.00 -1.68 0.00 0.00 37.83 33.53 3hi6 s LYS 206 CO 0.01 0.37 0.23 -1.54 -0.76 0.00 0.00 175.35 173.66 3hi6 s SER 207 N -0.08 0.05 0.04 2.83 1.04 -1.26 -1.44 113.70 114.88 3hi6 s SER 207 Ca -0.03 -0.57 -0.06 0.00 0.48 0.00 0.00 55.95 55.77 3hi6 s SER 207 Cb -0.14 0.36 -0.01 0.00 0.10 0.00 0.00 66.02 66.33 3hi6 s SER 207 CO 0.04 -0.74 0.12 0.72 0.98 0.00 0.00 173.24 174.36 3hi6 s PHE 208 N -3.74 0.18 -0.20 5.02 -0.12 -0.40 -5.01 117.98 113.71 3hi6 s PHE 208 Ca 0.04 -0.49 -0.13 0.00 -0.05 0.00 0.00 56.93 56.30 3hi6 s PHE 208 Cb 0.04 -0.13 -0.05 0.00 -0.63 0.00 0.00 43.02 42.26 3hi6 s PHE 208 CO -0.11 -0.39 0.25 -0.80 -0.05 0.00 0.00 175.22 174.12 3hi6 s ASN 209 N -2.20 6.30 0.00 1.98 0.01 -1.26 -1.21 114.94 118.57 3hi6 s ASN 209 Ca -0.04 0.35 0.00 0.00 -0.71 0.00 0.00 52.86 52.46 3hi6 s ASN 209 Cb -0.00 -2.15 0.00 0.00 0.41 0.00 0.00 41.25 39.50 3hi6 s ASN 209 CO -0.05 0.07 0.48 -1.14 -1.51 0.00 0.00 177.10 174.95