#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hi5 s GLN 3 N 0.00 0.54 -0.34 5.55 0.74 0.18 -4.96 119.66 121.37 3hi5 s GLN 3 Ca 0.00 1.14 -0.08 0.00 0.05 0.00 0.00 55.36 56.47 3hi5 s GLN 3 Cb 0.00 0.29 0.03 0.00 1.10 0.00 0.00 33.01 34.43 3hi5 s GLN 3 CO 0.00 -0.18 0.13 -0.51 -0.55 0.00 0.00 175.29 174.18 3hi5 s LEU 4 N 2.02 4.33 -0.20 3.68 1.43 -1.26 -1.12 118.68 127.56 3hi5 s LEU 4 Ca -0.08 -0.99 -0.02 0.00 -1.03 0.00 0.00 54.13 52.01 3hi5 s LEU 4 Cb -0.09 -1.92 -0.00 0.00 0.03 0.00 0.00 46.19 44.21 3hi5 s LEU 4 CO -0.17 -0.31 -0.09 -0.22 0.23 0.00 0.00 176.35 175.79 3hi5 s LEU 5 N 1.47 2.68 0.24 1.79 2.96 -0.35 -3.39 118.68 124.09 3hi5 s LEU 5 Ca 0.00 -0.45 0.08 0.00 -0.22 0.00 0.00 54.13 53.54 3hi5 s LEU 5 Cb -0.19 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.80 3hi5 s LEU 5 CO 0.04 0.00 0.07 -1.61 -1.32 0.00 0.00 176.35 173.53 3hi5 s GLU 6 N 1.32 2.54 0.30 1.98 2.02 -1.26 -0.05 118.70 125.54 3hi5 s GLU 6 Ca 0.04 -1.23 -0.20 0.00 0.02 0.00 0.00 54.97 53.60 3hi5 s GLU 6 Cb -0.14 -2.34 0.03 0.00 0.10 0.00 0.00 34.13 31.78 3hi5 s GLU 6 CO -0.05 0.39 0.73 -1.54 0.02 0.00 0.00 175.26 174.81 3hi5 s SER 7 N -3.60 -0.19 0.00 -0.19 1.04 -0.74 -4.95 113.70 105.07 3hi5 s SER 7 Ca 0.31 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 56.00 3hi5 s SER 7 Cb -0.07 0.75 0.00 0.00 0.10 0.00 0.00 66.02 66.80 3hi5 s SER 7 CO 0.21 -1.42 0.00 0.61 0.98 0.00 0.00 173.24 173.63 3hi5 n GLY 8 N -0.47 3.06 3.73 7.32 0.00 -1.26 -1.12 105.19 116.44 3hi5 n GLY 8 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 3hi5 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hi5 s GLY 9 N -2.73 1.68 0.00 -0.02 0.00 -1.26 -4.48 107.32 100.50 3hi5 s GLY 9 Ca 0.00 0.36 0.00 0.00 0.00 0.00 0.00 44.72 45.08 3hi5 s GLY 9 CO 0.00 0.74 0.00 0.61 0.00 0.00 0.00 173.10 174.45 3hi5 n GLY 10 N -0.71 -0.87 3.77 0.20 0.00 -0.18 -4.89 105.19 102.52 3hi5 n GLY 10 Ca 0.10 -0.99 -0.39 0.00 0.00 0.00 0.00 46.02 44.74 3hi5 n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3hi5 s LEU 11 N 0.00 4.42 -0.06 0.99 2.96 -1.26 -0.86 118.68 124.87 3hi5 s LEU 11 Ca 0.00 1.12 -0.10 0.00 -0.22 0.00 0.00 54.13 54.93 3hi5 s LEU 11 Cb 0.00 -2.86 0.02 0.00 0.50 0.00 0.00 46.19 43.85 3hi5 s LEU 11 CO 0.00 0.14 0.25 -0.69 -1.32 0.00 0.00 176.35 174.73 3hi5 s VAL 12 N -0.32 0.03 0.43 1.68 1.01 0.74 -4.96 120.40 119.01 3hi5 s VAL 12 Ca 0.30 -0.26 -0.22 0.00 0.00 0.00 0.00 61.98 61.80 3hi5 s VAL 12 Cb -0.18 -0.45 -0.10 0.00 0.00 0.00 0.00 36.38 35.66 3hi5 s VAL 12 CO 0.16 -0.14 1.00 -1.58 0.00 0.00 0.00 175.10 174.54 3hi5 s GLN 13 N -0.53 4.12 0.30 2.72 2.00 -1.25 -0.42 119.66 126.59 3hi5 s GLN 13 Ca -0.06 1.31 -0.30 0.00 -2.00 0.00 0.00 55.36 54.31 3hi5 s GLN 13 Cb -0.04 -2.31 -0.12 0.00 0.80 0.00 0.00 33.01 31.35 3hi5 s GLN 13 CO 0.02 -0.15 1.50 -2.30 -0.50 0.00 0.00 175.29 173.86 3hi5 n PRO 14 N -0.48 2.47 0.00 1.67 -0.02 -1.26 -0.93 135.00 136.45 3hi5 n PRO 14 Ca 0.07 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 3hi5 n PRO 14 Cb 0.52 -2.60 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 3hi5 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hi5 n GLY 15 N 1.78 2.69 1.64 -1.23 0.00 0.17 -4.94 105.19 105.29 3hi5 n GLY 15 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 3hi5 n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hi5 n GLY 16 N -2.00 -2.13 3.15 -0.02 0.00 -0.11 -3.90 105.19 100.19 3hi5 n GLY 16 Ca 0.00 -1.55 -0.15 0.00 0.00 0.00 0.00 46.02 44.33 3hi5 n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hi5 s SER 17 N -2.96 1.36 0.03 1.61 0.01 -1.26 -2.08 113.70 110.41 3hi5 s SER 17 Ca 0.33 -0.73 -0.05 0.00 1.31 0.00 0.00 55.95 56.81 3hi5 s SER 17 Cb -0.02 0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.20 3hi5 s SER 17 CO 0.24 -0.22 0.08 -0.76 0.41 0.00 0.00 173.24 172.99 3hi5 s LEU 18 N -2.15 1.86 -0.17 2.44 1.43 -0.49 -5.01 118.68 116.59 3hi5 s LEU 18 Ca 0.01 -0.53 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 3hi5 s LEU 18 Cb -0.05 0.54 0.04 0.00 0.03 0.00 0.00 46.19 46.75 3hi5 s LEU 18 CO 0.00 -0.49 -0.08 -0.60 0.23 0.00 0.00 176.35 175.42 3hi5 s ARG 19 N -2.50 1.73 0.22 1.70 3.52 -1.26 0.16 118.95 122.52 3hi5 s ARG 19 Ca -0.06 -0.59 -0.15 0.00 -0.13 0.00 0.00 55.73 54.80 3hi5 s ARG 19 Cb -0.02 -2.10 -0.08 0.00 -1.56 0.00 0.00 34.95 31.20 3hi5 s ARG 19 CO -0.04 -0.39 0.63 -0.51 -0.81 0.00 0.00 175.30 174.18 3hi5 s LEU 20 N 1.55 4.25 0.17 -0.88 1.43 -0.68 -4.43 118.68 120.10 3hi5 s LEU 20 Ca 0.01 1.17 0.09 0.00 -1.03 0.00 0.00 54.13 54.37 3hi5 s LEU 20 Cb -0.15 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.43 3hi5 s LEU 20 CO -0.08 -0.01 -0.19 -0.44 0.23 0.00 0.00 176.35 175.85 3hi5 s SER 21 N -1.94 2.81 -0.31 2.29 0.01 -0.28 -1.84 113.70 114.44 3hi5 s SER 21 Ca 0.44 -0.86 -0.01 0.00 1.31 0.00 0.00 55.95 56.83 3hi5 s SER 21 Cb -0.14 -0.17 0.13 0.00 0.21 0.00 0.00 66.02 66.05 3hi5 s SER 21 CO 0.20 -0.01 0.25 0.00 0.41 0.00 0.00 173.24 174.09 3hi5 s ALA 23 N 1.99 3.20 0.26 0.00 0.00 0.93 -1.20 121.76 126.93 3hi5 s ALA 23 Ca 0.11 -0.44 -0.13 0.00 0.00 0.00 0.00 51.96 51.51 3hi5 s ALA 23 Cb -0.16 -3.86 -0.08 0.00 0.00 0.00 0.00 23.12 19.02 3hi5 s ALA 23 CO -0.26 -2.16 0.63 0.00 0.00 0.00 0.00 175.76 173.98 3hi5 s ALA 24 N 4.34 3.46 0.14 0.00 0.00 -0.38 -1.21 121.76 128.11 3hi5 s ALA 24 Ca 0.47 -0.10 -0.22 0.00 0.00 0.00 0.00 51.96 52.11 3hi5 s ALA 24 Cb -0.08 -2.60 0.06 0.00 0.00 0.00 0.00 23.12 20.50 3hi5 s ALA 24 CO 0.30 0.42 0.55 -1.54 0.00 0.00 0.00 175.76 175.49 3hi5 s SER 25 N -2.20 -0.49 0.00 0.00 1.04 -0.27 -4.86 113.70 106.92 3hi5 s SER 25 Ca 0.49 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.88 3hi5 s SER 25 Cb -0.12 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.57 3hi5 s SER 25 CO 0.19 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 174.11 3hi5 n GLY 26 N -0.26 1.04 3.33 7.32 0.00 -1.26 -0.65 105.19 114.71 3hi5 n GLY 26 Ca -0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.75 3hi5 n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3hi5 s PHE 27 N -2.46 -0.09 -1.07 1.61 -0.12 -1.26 -4.51 117.98 110.08 3hi5 s PHE 27 Ca 0.00 -0.25 -0.22 0.00 -0.05 0.00 0.00 56.93 56.40 3hi5 s PHE 27 Cb 0.00 0.20 0.00 0.00 -0.63 0.00 0.00 43.02 42.59 3hi5 s PHE 27 CO 0.00 -0.71 1.74 0.99 -0.05 0.00 0.00 175.22 177.19 3hi5 s THR 28 N -3.84 3.75 0.30 -4.49 2.01 -1.26 -4.82 115.64 107.30 3hi5 s THR 28 Ca 0.05 -0.90 0.06 0.00 0.31 0.00 0.00 61.69 61.21 3hi5 s THR 28 Cb 0.02 -4.69 0.31 0.00 0.01 0.00 0.00 72.50 68.15 3hi5 s THR 28 CO -0.10 -1.49 1.67 0.15 -0.69 0.00 0.00 174.62 174.16 3hi5 h PHE 29 N 9.79 0.63 -0.13 4.92 3.57 -1.95 -2.06 116.94 131.71 3hi5 h PHE 29 Ca 0.22 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.80 3hi5 h PHE 29 Cb 0.97 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 3hi5 h PHE 29 CO 1.28 -0.14 0.28 0.77 -2.23 0.00 0.00 178.31 178.27 3hi5 h SER 30 N 0.31 0.00 0.24 0.41 0.02 -1.87 -2.27 113.55 110.38 3hi5 h SER 30 Ca 0.61 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.56 3hi5 h SER 30 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 3hi5 h SER 30 CO -0.60 0.00 -0.21 0.54 -1.14 0.00 0.00 176.83 175.42 3hi5 n ARG 31 N -3.31 0.88 -4.62 3.45 1.74 -0.77 -4.36 116.66 109.67 3hi5 n ARG 31 Ca 0.01 -0.49 -0.31 0.00 -0.77 0.00 0.00 57.85 56.28 3hi5 n ARG 31 Cb 0.38 -1.49 -0.12 0.00 -1.02 0.00 0.00 32.46 30.21 3hi5 n ARG 31 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3hi5 s TYR 32 N -2.46 2.68 -0.00 -1.55 2.02 -0.86 -4.77 117.35 112.42 3hi5 s TYR 32 Ca 0.26 -0.18 -0.30 0.00 -0.37 0.00 0.00 57.07 56.48 3hi5 s TYR 32 Cb 0.19 -1.53 -0.06 0.00 -0.40 0.00 0.00 41.96 40.17 3hi5 s TYR 32 CO 0.50 0.28 1.50 0.08 -1.57 0.00 0.00 175.55 176.34 3hi5 s VAL 33 N -0.93 3.55 0.05 0.71 1.01 -1.26 -3.70 120.40 119.84 3hi5 s VAL 33 Ca 0.15 0.90 0.02 0.00 0.00 0.00 0.00 61.98 63.06 3hi5 s VAL 33 Cb -0.11 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 3hi5 s VAL 33 CO 0.06 -0.02 0.05 -0.04 0.00 0.00 0.00 175.10 175.14 3hi5 s MET 34 N 2.79 2.83 0.15 2.72 -1.94 -0.87 -4.31 119.30 120.68 3hi5 s MET 34 Ca 0.67 -0.67 0.08 0.00 -1.71 0.00 0.00 55.69 54.06 3hi5 s MET 34 Cb -0.33 -2.70 -0.04 0.00 2.01 0.00 0.00 34.83 33.77 3hi5 s MET 34 CO 0.28 0.59 -0.17 -1.58 -0.01 0.00 0.00 175.02 174.13 3hi5 s TRP 35 N -1.28 1.69 -0.15 -0.03 0.52 -0.31 -1.54 118.94 117.84 3hi5 s TRP 35 Ca 0.25 -0.50 0.01 0.00 0.02 0.00 0.00 56.10 55.88 3hi5 s TRP 35 Cb -0.12 -0.85 0.00 0.00 -1.15 0.00 0.00 33.47 31.35 3hi5 s TRP 35 CO 0.17 0.28 -0.17 -1.58 0.02 0.00 0.00 176.95 175.67 3hi5 s TRP 36 N -2.13 2.75 -0.05 -1.98 0.52 -0.13 -2.23 118.94 115.68 3hi5 s TRP 36 Ca 0.14 -1.17 0.05 0.00 0.02 0.00 0.00 56.10 55.14 3hi5 s TRP 36 Cb -0.05 -1.87 -0.01 0.00 -1.15 0.00 0.00 33.47 30.39 3hi5 s TRP 36 CO 0.06 -0.54 -0.21 0.08 0.02 0.00 0.00 176.95 176.36 3hi5 s VAL 37 N 0.86 1.71 0.23 4.03 1.01 0.26 -0.57 120.40 127.93 3hi5 s VAL 37 Ca -0.05 -0.87 0.11 0.00 0.00 0.00 0.00 61.98 61.18 3hi5 s VAL 37 Cb -0.15 -1.46 -0.05 0.00 0.00 0.00 0.00 36.38 34.72 3hi5 s VAL 37 CO -0.01 0.48 -0.21 0.00 0.00 0.00 0.00 175.10 175.36 3hi5 s ARG 38 N -0.01 1.64 -0.18 2.72 1.70 -0.07 0.12 118.95 124.87 3hi5 s ARG 38 Ca -0.05 -1.62 -0.05 0.00 -0.47 0.00 0.00 55.73 53.55 3hi5 s ARG 38 Cb -0.13 -1.84 0.06 0.00 -0.57 0.00 0.00 34.95 32.48 3hi5 s ARG 38 CO 0.03 0.37 0.09 -1.14 -1.08 0.00 0.00 175.30 173.57 3hi5 s GLN 39 N -3.08 0.07 0.47 3.89 0.74 -0.46 -1.02 119.66 120.27 3hi5 s GLN 39 Ca 0.25 -0.10 -0.23 0.00 0.05 0.00 0.00 55.36 55.33 3hi5 s GLN 39 Cb -0.07 -1.81 -0.07 0.00 1.10 0.00 0.00 33.01 32.16 3hi5 s GLN 39 CO 0.13 -0.68 1.16 0.00 -0.55 0.00 0.00 175.29 175.35 3hi5 s ALA 40 N 2.13 2.95 -0.01 1.58 0.00 -1.26 -1.27 121.76 125.89 3hi5 s ALA 40 Ca 0.02 0.93 -0.36 0.00 0.00 0.00 0.00 51.96 52.55 3hi5 s ALA 40 Cb -0.16 -3.38 -0.14 0.00 0.00 0.00 0.00 23.12 19.43 3hi5 s ALA 40 CO -0.10 -0.67 1.62 -2.30 0.00 0.00 0.00 175.76 174.31 3hi5 n PRO 41 N -0.56 1.69 -2.82 0.00 -0.02 -1.26 -0.83 135.00 131.20 3hi5 n PRO 41 Ca 0.08 0.61 -0.18 0.00 -2.02 0.00 0.00 63.50 61.99 3hi5 n PRO 41 Cb 0.48 -2.35 0.03 0.00 -0.02 0.00 0.00 33.50 31.64 3hi5 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hi5 n GLY 42 N 3.58 -0.30 3.35 -1.23 0.00 -1.26 -5.01 105.19 104.32 3hi5 n GLY 42 Ca 0.21 -0.06 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 3hi5 n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hi5 s LYS 43 N -5.41 1.79 0.00 1.61 1.02 -0.01 -5.18 119.74 113.55 3hi5 s LYS 43 Ca 0.22 -2.05 0.00 0.00 0.02 0.00 0.00 55.97 54.16 3hi5 s LYS 43 Cb -0.10 0.06 0.00 0.00 -0.52 0.00 0.00 37.83 37.28 3hi5 s LYS 43 CO 0.27 -0.60 0.00 0.41 -0.92 0.00 0.00 175.35 174.52 3hi5 n GLY 44 N -0.70 -0.79 3.67 -3.33 0.00 -1.26 -4.66 105.19 98.12 3hi5 n GLY 44 Ca 0.03 -1.69 -0.35 0.00 0.00 0.00 0.00 46.02 44.01 3hi5 n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hi5 s LEU 45 N 0.00 3.61 -0.02 0.99 1.43 -1.26 -4.09 118.68 119.34 3hi5 s LEU 45 Ca 0.00 0.12 -0.01 0.00 -1.03 0.00 0.00 54.13 53.21 3hi5 s LEU 45 Cb 0.00 -1.84 0.01 0.00 0.03 0.00 0.00 46.19 44.39 3hi5 s LEU 45 CO 0.00 0.33 0.05 -1.83 0.23 0.00 0.00 176.35 175.13 3hi5 s GLU 46 N -0.60 0.03 0.43 1.70 -1.05 -0.19 -5.00 118.70 114.02 3hi5 s GLU 46 Ca 0.10 0.12 -0.24 0.00 -0.15 0.00 0.00 54.97 54.80 3hi5 s GLU 46 Cb -0.12 -0.06 -0.08 0.00 -0.44 0.00 0.00 34.13 33.43 3hi5 s GLU 46 CO 0.02 -0.06 1.16 1.67 0.95 0.00 0.00 175.26 179.01 3hi5 s TRP 47 N 0.39 2.96 -0.10 4.83 1.48 -1.26 -0.89 118.94 126.35 3hi5 s TRP 47 Ca -0.03 1.54 -0.06 0.00 -1.06 0.00 0.00 56.10 56.49 3hi5 s TRP 47 Cb -0.04 -3.38 -0.04 0.00 -1.16 0.00 0.00 33.47 28.84 3hi5 s TRP 47 CO -0.01 -1.41 -0.14 0.28 -4.06 0.00 0.00 176.95 171.60 3hi5 n VAL 48 N -0.26 0.72 -3.51 -0.66 0.31 0.27 -4.69 118.33 110.51 3hi5 n VAL 48 Ca 0.06 -0.09 -0.15 0.00 -0.01 0.00 0.00 64.34 64.15 3hi5 n VAL 48 Cb 0.47 -1.69 -0.05 0.00 -0.91 0.00 0.00 33.84 31.67 3hi5 n VAL 48 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3hi5 s SER 49 N -6.00 -0.57 0.20 4.52 0.15 -1.18 -0.50 113.70 110.32 3hi5 s SER 49 Ca -0.15 0.38 -0.03 0.00 0.70 0.00 0.00 55.95 56.86 3hi5 s SER 49 Cb 0.05 0.54 -0.03 0.00 -1.71 0.00 0.00 66.02 64.87 3hi5 s SER 49 CO 0.19 -0.73 0.17 -0.72 1.20 0.00 0.00 173.24 173.35 3hi5 s TYR 50 N -2.18 1.01 -0.08 3.44 -0.85 -0.66 -0.96 117.35 117.07 3hi5 s TYR 50 Ca -0.06 -1.27 -0.07 0.00 -0.52 0.00 0.00 57.07 55.15 3hi5 s TYR 50 Cb -0.01 -0.45 0.03 0.00 0.38 0.00 0.00 41.96 41.91 3hi5 s TYR 50 CO 0.01 -0.67 0.21 -1.50 -1.52 0.00 0.00 175.55 172.08 3hi5 s ILE 51 N -4.12 -0.01 0.68 -3.49 2.07 -0.59 -1.53 121.20 114.21 3hi5 s ILE 51 Ca 0.35 0.03 -0.14 0.00 -1.41 0.00 0.00 60.65 59.48 3hi5 s ILE 51 Cb 0.06 -0.31 0.01 0.00 0.13 0.00 0.00 42.46 42.35 3hi5 s ILE 51 CO 0.10 0.01 1.10 0.26 -1.91 0.00 0.00 174.94 174.51 3hi5 s TRP 52 N 0.32 2.63 0.27 3.50 0.52 -0.67 -2.05 118.94 123.46 3hi5 s TRP 52 Ca -0.02 1.55 -0.01 0.00 0.02 0.00 0.00 56.10 57.65 3hi5 s TRP 52 Cb -0.03 -3.14 0.61 0.00 -1.15 0.00 0.00 33.47 29.77 3hi5 s TRP 52 CO -0.01 -1.69 1.66 -1.35 0.02 0.00 0.00 176.95 175.57 3hi5 h PRO 53 N -0.22 0.23 0.00 4.98 0.11 -1.82 0.20 132.00 135.48 3hi5 h PRO 53 Ca -0.46 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 3hi5 h PRO 53 Cb 1.24 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 3hi5 h PRO 53 CO 0.54 0.15 -0.01 0.66 -0.21 0.00 0.00 178.00 179.12 3hi5 h SER 54 N 0.24 0.00 0.00 -2.05 4.64 -1.89 -3.44 113.55 111.04 3hi5 h SER 54 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 3hi5 h SER 54 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 3hi5 h SER 54 CO -0.60 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 175.98 3hi5 n GLY 55 N 0.00 0.68 0.13 -0.77 0.00 0.71 -4.94 105.19 100.99 3hi5 n GLY 55 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 3hi5 n GLY 55 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3hi5 h GLY 56 N 0.00 0.00 -6.03 -0.02 0.00 -1.90 -3.44 103.07 91.68 3hi5 h GLY 56 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.02 3hi5 h GLY 56 CO 0.00 0.00 -0.74 -1.31 0.00 0.00 0.00 176.54 174.49 3hi5 s ASN 57 N -4.93 0.35 0.03 0.19 0.01 -1.26 -5.05 114.94 104.28 3hi5 s ASN 57 Ca 0.08 -0.03 0.05 0.00 -0.71 0.00 0.00 52.86 52.25 3hi5 s ASN 57 Cb 0.11 -0.14 -0.02 0.00 0.41 0.00 0.00 41.25 41.61 3hi5 s ASN 57 CO 0.65 -0.05 -0.14 0.42 -1.51 0.00 0.00 177.10 176.47 3hi5 s THR 58 N 0.58 1.11 0.05 1.60 -4.23 -1.26 -1.67 115.64 111.82 3hi5 s THR 58 Ca -0.06 -0.96 0.02 0.00 -1.18 0.00 0.00 61.69 59.51 3hi5 s THR 58 Cb -0.09 -1.00 -0.03 0.00 1.34 0.00 0.00 72.50 72.73 3hi5 s THR 58 CO -0.01 0.03 -0.07 -0.31 -0.54 0.00 0.00 174.62 173.72 3hi5 s TYR 59 N -0.81 0.68 -0.03 3.99 2.02 -0.58 -5.02 117.35 117.60 3hi5 s TYR 59 Ca 0.02 -0.62 -0.03 0.00 -0.37 0.00 0.00 57.07 56.07 3hi5 s TYR 59 Cb -0.08 -0.41 0.01 0.00 -0.40 0.00 0.00 41.96 41.08 3hi5 s TYR 59 CO 0.01 -0.12 0.08 0.71 -1.57 0.00 0.00 175.55 174.66 3hi5 s TYR 60 N -2.01 -0.07 0.50 2.71 2.02 -1.26 -1.66 117.35 117.58 3hi5 s TYR 60 Ca -0.05 0.16 -0.23 0.00 -0.37 0.00 0.00 57.07 56.59 3hi5 s TYR 60 Cb -0.06 0.02 -0.06 0.00 -0.40 0.00 0.00 41.96 41.46 3hi5 s TYR 60 CO -0.01 -0.06 1.31 0.00 -1.57 0.00 0.00 175.55 175.21 3hi5 s ALA 61 N -0.11 2.95 0.49 3.71 0.00 0.34 -4.83 121.76 124.32 3hi5 s ALA 61 Ca -0.02 1.23 0.20 0.00 0.00 0.00 0.00 51.96 53.37 3hi5 s ALA 61 Cb -0.01 -3.51 1.30 0.00 0.00 0.00 0.00 23.12 20.89 3hi5 s ALA 61 CO 0.00 -1.11 2.10 -0.44 0.00 0.00 0.00 175.76 176.31 3hi5 h ASP 62 N 1.84 0.00 0.36 0.00 3.45 -1.94 -0.64 116.42 119.49 3hi5 h ASP 62 Ca -0.50 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 56.94 3hi5 h ASP 62 Cb 1.28 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.05 3hi5 h ASP 62 CO 0.59 0.08 -0.18 0.77 -1.57 0.00 0.00 179.24 178.94 3hi5 h SER 63 N 0.00 -0.42 1.20 6.45 4.64 -1.95 -3.23 113.55 120.24 3hi5 h SER 63 Ca -0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3hi5 h SER 63 Cb 0.16 0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3hi5 h SER 63 CO 0.01 -0.26 -0.17 1.33 -0.87 0.00 0.00 176.83 176.87 3hi5 n VAL 64 N -5.28 0.41 -1.65 0.95 0.24 -0.95 -4.90 118.33 107.15 3hi5 n VAL 64 Ca -0.11 -0.22 -0.45 0.00 -2.04 0.00 0.00 64.34 61.52 3hi5 n VAL 64 Cb 0.22 -0.42 -0.03 0.00 -1.47 0.00 0.00 33.84 32.15 3hi5 n VAL 64 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 3hi5 n LYS 65 N -2.06 1.81 0.00 7.34 4.81 -0.29 -1.40 118.16 128.37 3hi5 n LYS 65 Ca 0.05 0.64 0.00 0.00 -0.87 0.00 0.00 58.31 58.14 3hi5 n LYS 65 Cb 0.41 -2.23 0.00 0.00 0.02 0.00 0.00 35.03 33.23 3hi5 n LYS 65 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hi5 n GLY 66 N 1.85 2.58 0.08 3.14 0.00 -1.26 -4.74 105.19 106.85 3hi5 n GLY 66 Ca 0.11 -0.03 -0.07 0.00 0.00 0.00 0.00 46.02 46.03 3hi5 n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hi5 n ARG 67 N 0.00 0.93 -4.14 1.61 1.74 -0.50 -4.98 116.66 111.32 3hi5 n ARG 67 Ca 0.00 -0.03 -0.32 0.00 -0.77 0.00 0.00 57.85 56.73 3hi5 n ARG 67 Cb 0.00 -1.48 -0.07 0.00 -1.02 0.00 0.00 32.46 29.89 3hi5 n ARG 67 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3hi5 s PHE 68 N -2.56 3.18 -0.21 -1.55 0.40 -0.74 -1.41 117.98 115.09 3hi5 s PHE 68 Ca -0.09 0.12 -0.01 0.00 -0.60 0.00 0.00 56.93 56.35 3hi5 s PHE 68 Cb 0.06 -1.67 0.06 0.00 0.51 0.00 0.00 43.02 41.98 3hi5 s PHE 68 CO 0.77 0.51 -0.02 0.99 0.70 0.00 0.00 175.22 178.17 3hi5 s THR 69 N -1.23 1.10 0.19 0.64 2.01 0.20 -4.91 115.64 113.64 3hi5 s THR 69 Ca 0.24 -0.90 -0.21 0.00 0.31 0.00 0.00 61.69 61.13 3hi5 s THR 69 Cb -0.12 -1.45 -0.08 0.00 0.01 0.00 0.00 72.50 70.86 3hi5 s THR 69 CO 0.16 -0.11 0.71 -0.51 -0.69 0.00 0.00 174.62 174.17 3hi5 s ILE 70 N 1.60 4.55 0.30 1.82 2.07 -1.26 -0.98 121.20 129.30 3hi5 s ILE 70 Ca -0.03 1.36 -0.18 0.00 -1.41 0.00 0.00 60.65 60.38 3hi5 s ILE 70 Cb -0.18 -3.92 0.03 0.00 0.13 0.00 0.00 42.46 38.51 3hi5 s ILE 70 CO -0.07 0.33 0.70 -0.94 -1.91 0.00 0.00 174.94 173.05 3hi5 s SER 71 N -1.46 -0.15 0.06 4.50 1.04 -0.72 -5.00 113.70 111.97 3hi5 s SER 71 Ca 0.39 -0.80 -0.14 0.00 0.48 0.00 0.00 55.95 55.88 3hi5 s SER 71 Cb -0.18 0.74 0.02 0.00 0.10 0.00 0.00 66.02 66.70 3hi5 s SER 71 CO 0.22 -1.41 0.33 0.00 0.98 0.00 0.00 173.24 173.36 3hi5 s ARG 72 N -3.52 0.87 -0.38 4.02 1.70 -1.26 -0.13 118.95 120.25 3hi5 s ARG 72 Ca 0.14 -0.54 0.03 0.00 -0.47 0.00 0.00 55.73 54.88 3hi5 s ARG 72 Cb -0.05 0.38 0.11 0.00 -0.57 0.00 0.00 34.95 34.82 3hi5 s ARG 72 CO 0.09 -0.29 0.12 0.34 -1.08 0.00 0.00 175.30 174.48 3hi5 s ASP 73 N -2.21 4.36 0.34 -2.89 -1.08 -0.13 -4.99 116.67 110.06 3hi5 s ASP 73 Ca -0.03 -2.24 0.26 0.00 -0.52 0.00 0.00 52.55 50.02 3hi5 s ASP 73 Cb -0.00 -1.36 1.16 0.00 -1.46 0.00 0.00 42.92 41.26 3hi5 s ASP 73 CO -0.05 -0.35 1.78 0.78 0.52 0.00 0.00 175.17 177.86 3hi5 h ASN 74 N 7.42 0.00 0.83 -0.34 2.35 -1.95 0.15 115.58 124.04 3hi5 h ASN 74 Ca -0.07 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.52 3hi5 h ASN 74 Cb 0.98 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.33 3hi5 h ASN 74 CO 0.53 0.00 -0.80 0.77 -1.65 0.00 0.00 177.43 176.28 3hi5 h SER 75 N 0.00 0.00 -0.01 5.81 4.64 -1.95 -3.28 113.55 118.76 3hi5 h SER 75 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hi5 h SER 75 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 3hi5 h SER 75 CO 0.00 0.80 -0.14 0.29 -0.87 0.00 0.00 176.83 176.91 3hi5 n LYS 76 N -3.57 1.84 -1.81 4.77 5.02 -0.21 -4.97 118.16 119.24 3hi5 n LYS 76 Ca -0.01 -1.45 -0.16 0.00 -2.02 0.00 0.00 58.31 54.68 3hi5 n LYS 76 Cb 0.77 -1.47 -0.04 0.00 -0.02 0.00 0.00 35.03 34.27 3hi5 n LYS 76 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3hi5 n ASN 77 N 0.68 -4.30 -4.65 4.39 3.02 -0.13 -4.82 115.26 109.46 3hi5 n ASN 77 Ca 0.13 0.29 -0.32 0.00 -0.03 0.00 0.00 54.58 54.65 3hi5 n ASN 77 Cb 0.51 -3.81 -0.09 0.00 -0.61 0.00 0.00 39.78 35.78 3hi5 n ASN 77 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3hi5 s THR 78 N -2.48 3.95 -0.00 3.41 2.01 -0.99 -1.25 115.64 120.28 3hi5 s THR 78 Ca 0.00 -0.66 0.04 0.00 0.31 0.00 0.00 61.69 61.38 3hi5 s THR 78 Cb 0.00 -2.74 -0.03 0.00 0.01 0.00 0.00 72.50 69.74 3hi5 s THR 78 CO 0.00 0.39 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.98 3hi5 s LEU 79 N -1.48 2.90 0.10 4.42 2.96 -0.34 -0.96 118.68 126.28 3hi5 s LEU 79 Ca 0.18 -0.23 0.06 0.00 -0.22 0.00 0.00 54.13 53.93 3hi5 s LEU 79 Cb -0.11 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 44.88 3hi5 s LEU 79 CO 0.09 0.30 -0.16 -0.31 -1.32 0.00 0.00 176.35 174.95 3hi5 s TYR 80 N -0.90 1.43 -0.27 5.38 2.02 0.81 -0.42 117.35 125.40 3hi5 s TYR 80 Ca 0.15 -0.48 -0.02 0.00 -0.37 0.00 0.00 57.07 56.34 3hi5 s TYR 80 Cb -0.11 -0.77 0.09 0.00 -0.40 0.00 0.00 41.96 40.77 3hi5 s TYR 80 CO 0.05 0.13 0.09 -1.17 -1.57 0.00 0.00 175.55 173.07 3hi5 s LEU 81 N -2.05 1.55 -0.17 -1.29 2.96 -0.77 -1.76 118.68 117.16 3hi5 s LEU 81 Ca 0.04 -1.32 -0.29 0.00 -0.22 0.00 0.00 54.13 52.33 3hi5 s LEU 81 Cb -0.08 -0.67 -0.01 0.00 0.50 0.00 0.00 46.19 45.93 3hi5 s LEU 81 CO 0.03 -0.39 1.16 -1.58 -1.32 0.00 0.00 176.35 174.25 3hi5 s GLN 82 N 1.80 4.27 -0.34 1.98 2.00 -0.16 -1.68 119.66 127.54 3hi5 s GLN 82 Ca 0.06 1.54 -0.03 0.00 -2.00 0.00 0.00 55.36 54.93 3hi5 s GLN 82 Cb -0.17 -3.68 0.06 0.00 0.80 0.00 0.00 33.01 30.02 3hi5 s GLN 82 CO -0.23 -0.62 0.08 -1.64 -0.50 0.00 0.00 175.29 172.38 3hi5 s MET 83 N 3.11 2.39 0.36 1.67 -1.94 0.12 -0.62 119.30 124.38 3hi5 s MET 83 Ca 0.51 -1.37 0.08 0.00 -1.71 0.00 0.00 55.69 53.19 3hi5 s MET 83 Cb -0.19 -3.35 -0.03 0.00 2.01 0.00 0.00 34.83 33.26 3hi5 s MET 83 CO 0.13 -0.74 0.28 -0.80 -0.01 0.00 0.00 175.02 173.87 3hi5 s ASN 84 N 1.44 5.08 -1.57 3.03 0.01 -0.50 -1.40 114.94 121.04 3hi5 s ASN 84 Ca -0.01 -0.62 -0.09 0.00 -0.71 0.00 0.00 52.86 51.43 3hi5 s ASN 84 Cb -0.20 -0.82 0.08 0.00 0.41 0.00 0.00 41.25 40.71 3hi5 s ASN 84 CO -0.01 -0.41 0.54 -1.20 -1.51 0.00 0.00 177.10 174.51 3hi5 n SER 85 N -1.36 -1.53 -4.76 -1.22 7.64 -1.17 -4.68 113.62 106.54 3hi5 n SER 85 Ca -0.01 -1.05 -0.41 0.00 1.01 0.00 0.00 58.87 58.41 3hi5 n SER 85 Cb 0.61 -2.71 -0.01 0.00 -1.01 0.00 0.00 64.21 61.08 3hi5 n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3hi5 s LEU 86 N -7.16 4.35 0.33 -3.43 1.43 -0.89 -4.59 118.68 108.72 3hi5 s LEU 86 Ca 0.35 2.91 0.09 0.00 -1.03 0.00 0.00 54.13 56.45 3hi5 s LEU 86 Cb -0.19 -3.65 -0.05 0.00 0.03 0.00 0.00 46.19 42.33 3hi5 s LEU 86 CO 0.92 -0.83 0.06 -0.13 0.23 0.00 0.00 176.35 176.60 3hi5 s ARG 87 N -1.15 2.22 0.25 1.70 0.52 -1.26 0.41 118.95 121.64 3hi5 s ARG 87 Ca 0.58 -1.61 -0.04 0.00 -0.52 0.00 0.00 55.73 54.13 3hi5 s ARG 87 Cb -0.46 -2.06 0.40 0.00 0.52 0.00 0.00 34.95 33.35 3hi5 s ARG 87 CO 0.53 0.17 1.81 0.00 0.02 0.00 0.00 175.30 177.83 3hi5 h ALA 88 N 1.73 1.18 0.00 2.13 0.00 -1.96 -2.17 119.26 120.16 3hi5 h ALA 88 Ca -0.43 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3hi5 h ALA 88 Cb 1.25 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3hi5 h ALA 88 CO 0.64 0.09 0.00 -0.85 0.00 0.00 0.00 179.25 179.14 3hi5 n GLU 89 N -4.75 0.48 -0.15 0.00 0.00 -1.26 -1.70 120.64 113.27 3hi5 n GLU 89 Ca 0.14 0.03 0.09 0.00 0.00 0.00 0.00 57.16 57.42 3hi5 n GLU 89 Cb 0.28 -1.50 0.28 0.00 0.00 0.00 0.00 31.44 30.50 3hi5 n GLU 89 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3hi5 n ASP 90 N -1.06 2.12 -4.67 -1.84 8.00 -0.82 -4.90 116.55 113.39 3hi5 n ASP 90 Ca 0.12 -1.86 -0.42 0.00 0.71 0.00 0.00 54.79 53.34 3hi5 n ASP 90 Cb 0.08 -0.19 -0.03 0.00 -0.02 0.00 0.00 41.12 40.96 3hi5 n ASP 90 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3hi5 s THR 91 N -1.62 3.62 -0.05 -3.53 2.01 -0.69 -4.86 115.64 110.52 3hi5 s THR 91 Ca 0.32 0.86 -0.31 0.00 0.31 0.00 0.00 61.69 62.86 3hi5 s THR 91 Cb 0.17 -3.55 0.12 0.00 0.01 0.00 0.00 72.50 69.25 3hi5 s THR 91 CO 0.24 -0.05 1.27 0.00 -0.69 0.00 0.00 174.62 175.40 3hi5 s ALA 92 N 3.43 -2.20 0.08 7.40 0.00 -0.76 -4.51 121.76 125.19 3hi5 s ALA 92 Ca 0.69 0.88 -0.30 0.00 0.00 0.00 0.00 51.96 53.23 3hi5 s ALA 92 Cb -0.32 0.26 -0.05 0.00 0.00 0.00 0.00 23.12 23.01 3hi5 s ALA 92 CO 0.27 -0.96 0.97 0.08 0.00 0.00 0.00 175.76 176.12 3hi5 s VAL 93 N -2.42 4.62 -0.24 0.00 1.01 -0.40 -0.89 120.40 122.08 3hi5 s VAL 93 Ca 0.13 2.07 -0.05 0.00 0.00 0.00 0.00 61.98 64.13 3hi5 s VAL 93 Cb 0.04 -4.32 -0.01 0.00 0.00 0.00 0.00 36.38 32.09 3hi5 s VAL 93 CO -0.04 0.27 -0.01 -0.31 0.00 0.00 0.00 175.10 175.01 3hi5 s TYR 94 N 0.31 3.01 -0.10 5.22 2.02 0.45 -1.36 117.35 126.90 3hi5 s TYR 94 Ca 0.48 -0.89 -0.03 0.00 -0.37 0.00 0.00 57.07 56.26 3hi5 s TYR 94 Cb -0.23 -2.14 -0.03 0.00 -0.40 0.00 0.00 41.96 39.16 3hi5 s TYR 94 CO 0.29 -0.53 0.04 0.71 -1.57 0.00 0.00 175.55 174.49 3hi5 s TYR 95 N 1.50 3.26 0.06 2.71 2.02 0.12 -1.80 117.35 125.21 3hi5 s TYR 95 Ca 0.05 0.26 -0.10 0.00 -0.37 0.00 0.00 57.07 56.92 3hi5 s TYR 95 Cb -0.15 -1.83 -0.06 0.00 -0.40 0.00 0.00 41.96 39.52 3hi5 s TYR 95 CO -0.01 0.52 0.38 0.00 -1.57 0.00 0.00 175.55 174.86 3hi5 s ALA 97 N -1.34 -0.56 0.11 0.00 0.00 -0.95 -0.31 121.76 118.71 3hi5 s ALA 97 Ca 0.31 -0.37 -0.21 0.00 0.00 0.00 0.00 51.96 51.69 3hi5 s ALA 97 Cb -0.14 0.65 0.05 0.00 0.00 0.00 0.00 23.12 23.68 3hi5 s ALA 97 CO 0.17 -0.61 0.51 0.45 0.00 0.00 0.00 175.76 176.29 3hi5 s SER 98 N -2.85 -0.42 -0.93 0.00 0.15 -0.88 -1.16 113.70 107.61 3hi5 s SER 98 Ca 0.06 -0.04 -0.16 0.00 0.70 0.00 0.00 55.95 56.51 3hi5 s SER 98 Cb 0.03 0.52 0.18 0.00 -1.71 0.00 0.00 66.02 65.04 3hi5 s SER 98 CO -0.10 -0.85 1.02 -0.55 1.20 0.00 0.00 173.24 173.96 3hi5 s SER 99 N -2.51 6.78 0.27 5.45 0.15 -1.25 -1.35 113.70 121.24 3hi5 s SER 99 Ca -0.00 -2.51 -0.02 0.00 0.70 0.00 0.00 55.95 54.12 3hi5 s SER 99 Cb 0.00 -2.31 0.41 0.00 -1.71 0.00 0.00 66.02 62.41 3hi5 s SER 99 CO -0.09 -0.78 1.90 0.22 1.20 0.00 0.00 173.24 175.69 3hi5 h TYR 100 N 8.10 1.17 -0.56 3.44 3.20 -1.93 -2.54 116.97 127.86 3hi5 h TYR 100 Ca 0.16 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.96 3hi5 h TYR 100 Cb 1.00 -0.39 -0.02 0.00 1.54 0.00 0.00 36.73 38.87 3hi5 h TYR 100 CO 1.08 0.64 -0.03 -0.44 -1.64 0.00 0.00 178.16 177.76 3hi5 h ASP 101 N 1.17 0.98 0.00 -2.11 3.45 -1.90 -3.48 116.42 114.53 3hi5 h ASP 101 Ca 0.41 -0.28 0.00 0.00 0.43 0.00 0.00 57.03 57.58 3hi5 h ASP 101 Cb 0.11 -0.26 0.00 0.00 -0.56 0.00 0.00 39.33 38.62 3hi5 h ASP 101 CO -0.15 1.05 0.00 0.49 -1.57 0.00 0.00 179.24 179.06 3hi5 n PHE 102 N -4.17 0.00 0.28 4.55 3.72 -0.96 -4.70 117.46 116.18 3hi5 n PHE 102 Ca 0.02 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.59 3hi5 n PHE 102 Cb 0.36 0.00 0.75 0.00 -0.94 0.00 0.00 39.48 39.65 3hi5 n PHE 102 CO 0.00 0.00 0.00 0.11 -0.05 0.00 0.00 176.76 176.82 3hi5 h TRP 103 N 0.00 0.00 -0.04 1.38 0.09 -1.92 -3.26 115.95 112.20 3hi5 h TRP 103 Ca 0.00 0.00 -0.10 0.00 0.09 0.00 0.00 58.89 58.88 3hi5 h TRP 103 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 29.23 3hi5 h TRP 103 CO 0.00 0.06 -0.44 0.66 0.09 0.00 0.00 178.44 178.81 3hi5 h SER 104 N 0.00 0.09 -1.27 0.11 4.64 -1.95 -3.47 113.55 111.71 3hi5 h SER 104 Ca -0.00 -0.04 -0.42 0.00 -0.47 0.00 0.00 61.79 60.86 3hi5 h SER 104 Cb 0.43 -0.03 -0.15 0.00 -0.31 0.00 0.00 62.40 62.34 3hi5 h SER 104 CO 0.01 0.52 -0.41 0.59 -0.87 0.00 0.00 176.83 176.67 3hi5 n ASN 105 N -4.01 -5.55 -4.60 4.97 3.02 -1.23 -5.00 115.26 102.86 3hi5 n ASN 105 Ca -0.02 0.44 -0.23 0.00 -0.03 0.00 0.00 54.58 54.74 3hi5 n ASN 105 Cb 0.48 -4.83 -0.08 0.00 -0.61 0.00 0.00 39.78 34.74 3hi5 n ASN 105 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hi5 s ALA 106 N -2.81 3.05 -0.91 5.41 0.00 -1.26 -5.07 121.76 120.17 3hi5 s ALA 106 Ca 0.00 -1.70 -0.24 0.00 0.00 0.00 0.00 51.96 50.01 3hi5 s ALA 106 Cb 0.00 -0.64 0.05 0.00 0.00 0.00 0.00 23.12 22.52 3hi5 s ALA 106 CO 0.00 0.28 1.37 -0.06 0.00 0.00 0.00 175.76 177.34 3hi5 s PHE 107 N -2.35 2.48 0.03 0.00 0.08 -1.26 -3.97 117.98 112.99 3hi5 s PHE 107 Ca 0.31 -0.59 -0.18 0.00 0.12 0.00 0.00 56.93 56.58 3hi5 s PHE 107 Cb -0.06 -4.65 -0.20 0.00 -0.57 0.00 0.00 43.02 37.55 3hi5 s PHE 107 CO 0.19 -1.96 1.20 -0.44 -0.10 0.00 0.00 175.22 174.10 3hi5 h ASP 108 N 9.83 0.60 -3.68 1.36 3.32 -1.57 -3.45 116.42 122.83 3hi5 h ASP 108 Ca 0.02 -0.67 -0.68 0.00 0.02 0.00 0.00 57.03 55.72 3hi5 h ASP 108 Cb 1.03 -0.18 -0.19 0.00 0.22 0.00 0.00 39.33 40.21 3hi5 h ASP 108 CO 1.36 1.18 -0.70 0.27 -1.72 0.00 0.00 179.24 179.63 3hi5 s ILE 109 N -3.55 3.67 0.08 0.35 -0.00 -1.09 -4.96 121.20 115.70 3hi5 s ILE 109 Ca -0.13 -0.51 0.05 0.00 -0.00 0.00 0.00 60.65 60.06 3hi5 s ILE 109 Cb 0.05 -2.51 -0.03 0.00 -0.00 0.00 0.00 42.46 39.97 3hi5 s ILE 109 CO 0.83 0.58 -0.15 0.26 -0.00 0.00 0.00 174.94 176.46 3hi5 s TRP 110 N -0.82 1.26 0.98 1.37 0.52 -1.26 -2.07 118.94 118.93 3hi5 s TRP 110 Ca 0.13 -0.46 -0.14 0.00 0.02 0.00 0.00 56.10 55.64 3hi5 s TRP 110 Cb -0.11 -0.71 0.18 0.00 -1.15 0.00 0.00 33.47 31.69 3hi5 s TRP 110 CO 0.02 0.07 1.17 0.20 0.02 0.00 0.00 176.95 178.43 3hi5 s GLY 111 N -1.79 1.62 0.46 0.98 0.00 0.57 -4.46 107.32 104.70 3hi5 s GLY 111 Ca -0.01 -0.75 0.29 0.00 0.00 0.00 0.00 44.72 44.25 3hi5 s GLY 111 CO 0.02 -0.08 1.85 0.06 0.00 0.00 0.00 173.10 174.95 3hi5 h GLN 112 N -1.76 0.00 0.00 2.90 -0.00 -1.90 -3.46 115.11 110.89 3hi5 h GLN 112 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.17 3hi5 h GLN 112 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.78 3hi5 h GLN 112 CO 0.51 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.75 3hi5 n GLY 113 N 0.33 2.63 3.27 0.06 0.00 -1.26 -5.08 105.19 105.14 3hi5 n GLY 113 Ca 0.02 -1.88 -0.10 0.00 0.00 0.00 0.00 46.02 44.06 3hi5 n GLY 113 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3hi5 s THR 114 N -2.73 -0.23 -0.09 2.61 -1.32 -0.75 -4.78 115.64 108.35 3hi5 s THR 114 Ca 0.00 0.12 -0.26 0.00 -1.21 0.00 0.00 61.69 60.34 3hi5 s THR 114 Cb 0.00 -0.63 -0.02 0.00 -1.51 0.00 0.00 72.50 70.33 3hi5 s THR 114 CO 0.00 0.05 0.84 -0.32 -2.21 0.00 0.00 174.62 172.98 3hi5 s MET 115 N 1.80 4.41 -0.25 7.08 1.75 -1.26 -0.41 119.30 132.42 3hi5 s MET 115 Ca -0.07 1.10 -0.01 0.00 -1.25 0.00 0.00 55.69 55.46 3hi5 s MET 115 Cb -0.10 -3.51 0.03 0.00 2.84 0.00 0.00 34.83 34.10 3hi5 s MET 115 CO -0.13 -0.14 -0.06 0.08 -0.65 0.00 0.00 175.02 174.12 3hi5 s VAL 116 N 1.46 2.80 -0.24 10.11 1.01 -0.07 -1.01 120.40 134.46 3hi5 s VAL 116 Ca 0.42 -1.12 -0.05 0.00 0.00 0.00 0.00 61.98 61.23 3hi5 s VAL 116 Cb -0.18 -2.46 -0.00 0.00 0.00 0.00 0.00 36.38 33.74 3hi5 s VAL 116 CO 0.18 0.15 -0.00 -0.89 0.00 0.00 0.00 175.10 174.54 3hi5 s THR 117 N 1.29 3.59 -0.45 3.92 2.01 -0.04 -1.83 115.64 124.13 3hi5 s THR 117 Ca -0.01 -0.53 -0.08 0.00 0.31 0.00 0.00 61.69 61.38 3hi5 s THR 117 Cb -0.17 -2.70 0.11 0.00 0.01 0.00 0.00 72.50 69.75 3hi5 s THR 117 CO -0.04 0.32 0.30 -0.69 -0.69 0.00 0.00 174.62 173.82 3hi5 s VAL 118 N 1.49 4.02 -0.03 3.82 1.01 -1.26 -0.19 120.40 129.27 3hi5 s VAL 118 Ca 0.05 -1.77 -0.03 0.00 0.00 0.00 0.00 61.98 60.23 3hi5 s VAL 118 Cb -0.15 -3.63 0.01 0.00 0.00 0.00 0.00 36.38 32.61 3hi5 s VAL 118 CO -0.01 -0.70 0.08 -0.55 0.00 0.00 0.00 175.10 173.91 3hi5 s SER 119 N 2.40 -0.07 0.09 3.32 0.15 0.44 -4.26 113.70 115.76 3hi5 s SER 119 Ca 0.06 0.14 0.27 0.00 0.70 0.00 0.00 55.95 57.11 3hi5 s SER 119 Cb -0.25 0.16 0.86 0.00 -1.71 0.00 0.00 66.02 65.08 3hi5 s SER 119 CO -0.01 -0.04 1.71 -1.54 1.20 0.00 0.00 173.24 174.56 3hi5 n SER 120 N 2.97 0.45 -4.77 5.45 3.41 -1.26 -3.93 113.62 115.94 3hi5 n SER 120 Ca -0.13 0.36 -0.33 0.00 -0.26 0.00 0.00 58.87 58.52 3hi5 n SER 120 Cb 0.59 -0.40 0.05 0.00 -0.26 0.00 0.00 64.21 64.20 3hi5 n SER 120 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hi5 s ALA 121 N -3.06 2.44 0.32 7.33 0.00 -1.26 -5.03 121.76 122.50 3hi5 s ALA 121 Ca 0.11 0.55 0.10 0.00 0.00 0.00 0.00 51.96 52.72 3hi5 s ALA 121 Cb 0.16 -3.32 -0.06 0.00 0.00 0.00 0.00 23.12 19.90 3hi5 s ALA 121 CO 0.60 -1.33 -0.07 -1.54 0.00 0.00 0.00 175.76 173.42 3hi5 s SER 122 N -2.59 3.94 -0.25 0.00 1.04 -1.26 -5.01 113.70 109.58 3hi5 s SER 122 Ca 0.67 -1.03 -0.28 0.00 0.48 0.00 0.00 55.95 55.79 3hi5 s SER 122 Cb -0.21 -0.45 -0.05 0.00 0.10 0.00 0.00 66.02 65.41 3hi5 s SER 122 CO 0.42 -0.15 2.22 -0.89 0.98 0.00 0.00 173.24 175.83 3hi5 s THR 123 N -2.53 3.03 0.05 2.02 2.01 -1.26 -4.66 115.64 114.30 3hi5 s THR 123 Ca 0.33 0.03 0.07 0.00 0.31 0.00 0.00 61.69 62.42 3hi5 s THR 123 Cb -0.01 -3.04 -0.03 0.00 0.01 0.00 0.00 72.50 69.44 3hi5 s THR 123 CO 0.18 -0.03 -0.19 -0.75 -0.69 0.00 0.00 174.62 173.14 3hi5 s LYS 124 N 6.50 1.26 0.43 4.92 2.20 0.14 -4.92 119.74 130.26 3hi5 s LYS 124 Ca 0.99 -0.93 -0.07 0.00 -0.36 0.00 0.00 55.97 55.61 3hi5 s LYS 124 Cb -0.31 -1.37 -0.05 0.00 -1.51 0.00 0.00 37.83 34.59 3hi5 s LYS 124 CO 0.34 0.34 0.74 0.20 -0.36 0.00 0.00 175.35 176.62 3hi5 s GLY 125 N -1.25 1.70 0.08 5.54 0.00 -1.26 -0.36 107.32 111.76 3hi5 s GLY 125 Ca 0.06 -0.42 -0.26 0.00 0.00 0.00 0.00 44.72 44.10 3hi5 s GLY 125 CO 0.02 -0.25 0.82 2.56 0.00 0.00 0.00 173.10 176.25 3hi5 s PRO 126 N -4.26 4.56 -0.26 2.90 0.04 -1.26 -4.46 135.00 132.26 3hi5 s PRO 126 Ca 0.48 1.18 -0.26 0.00 0.04 0.00 0.00 61.00 62.44 3hi5 s PRO 126 Cb -0.10 -3.35 0.00 0.00 0.04 0.00 0.00 34.50 31.09 3hi5 s PRO 126 CO 0.38 0.31 0.92 -1.12 0.04 0.00 0.00 177.00 177.52 3hi5 s SER 127 N -0.21 6.89 -0.29 6.66 0.01 -0.37 -4.84 113.70 121.54 3hi5 s SER 127 Ca 0.40 1.06 -0.12 0.00 1.31 0.00 0.00 55.95 58.60 3hi5 s SER 127 Cb -0.22 -2.48 -0.04 0.00 0.21 0.00 0.00 66.02 63.50 3hi5 s SER 127 CO 0.25 -0.64 0.25 -0.69 0.41 0.00 0.00 173.24 172.83 3hi5 s VAL 128 N 3.09 5.27 0.04 3.43 1.01 -1.26 -0.66 120.40 131.32 3hi5 s VAL 128 Ca 0.39 0.21 0.06 0.00 0.00 0.00 0.00 61.98 62.63 3hi5 s VAL 128 Cb -0.14 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 3hi5 s VAL 128 CO 0.09 0.17 -0.14 -0.36 0.00 0.00 0.00 175.10 174.87 3hi5 s PHE 129 N 1.84 2.67 0.24 5.22 0.08 -0.28 -4.94 117.98 122.82 3hi5 s PHE 129 Ca 0.09 -0.18 -0.26 0.00 0.12 0.00 0.00 56.93 56.70 3hi5 s PHE 129 Cb -0.16 -1.50 -0.09 0.00 -0.57 0.00 0.00 43.02 40.70 3hi5 s PHE 129 CO 0.11 0.31 0.86 -1.25 -0.10 0.00 0.00 175.22 175.15 3hi5 s PRO 130 N -1.54 4.59 -0.91 0.24 0.04 -1.26 0.40 135.00 136.56 3hi5 s PRO 130 Ca 0.16 1.25 -0.09 0.00 0.04 0.00 0.00 61.00 62.36 3hi5 s PRO 130 Cb -0.11 -3.05 0.23 0.00 0.04 0.00 0.00 34.50 31.61 3hi5 s PRO 130 CO 0.07 0.44 0.84 -0.51 0.04 0.00 0.00 177.00 177.88 3hi5 s LEU 131 N -1.59 6.23 0.36 -3.56 1.43 0.75 -4.81 118.68 117.48 3hi5 s LEU 131 Ca 0.43 -3.19 -0.28 0.00 -1.03 0.00 0.00 54.13 50.06 3hi5 s LEU 131 Cb -0.21 -2.11 -0.11 0.00 0.03 0.00 0.00 46.19 43.79 3hi5 s LEU 131 CO 0.26 -0.39 1.39 0.00 0.23 0.00 0.00 176.35 177.85 3hi5 s ALA 132 N -0.59 3.53 0.81 4.21 0.00 -1.26 -1.56 121.76 126.90 3hi5 s ALA 132 Ca 0.24 1.41 -0.12 0.00 0.00 0.00 0.00 51.96 53.49 3hi5 s ALA 132 Cb -0.11 -3.54 0.08 0.00 0.00 0.00 0.00 23.12 19.55 3hi5 s ALA 132 CO -0.08 -0.85 1.14 -1.25 0.00 0.00 0.00 175.76 174.72 3hi5 s PRO 133 N -1.95 1.77 0.12 0.00 0.04 -1.26 -4.90 135.00 128.81 3hi5 s PRO 133 Ca 0.51 1.47 -0.20 0.00 0.04 0.00 0.00 61.00 62.82 3hi5 s PRO 133 Cb -0.43 -1.82 0.07 0.00 0.04 0.00 0.00 34.50 32.36 3hi5 s PRO 133 CO 0.58 -2.06 0.94 0.00 0.04 0.00 0.00 177.00 176.50 3hi5 h SER 135 N 1.70 0.00 -0.03 0.00 4.64 -1.95 -2.62 113.55 115.30 3hi5 h SER 135 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 3hi5 h SER 135 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 3hi5 h SER 135 CO 0.30 0.50 0.00 0.54 -0.87 0.00 0.00 176.83 177.30 3hi5 n ARG 136 N -3.11 1.43 0.00 4.77 5.12 -1.26 -3.54 116.66 120.06 3hi5 n ARG 136 Ca -0.01 -0.62 0.03 0.00 -1.93 0.00 0.00 57.85 55.31 3hi5 n ARG 136 Cb 0.76 -1.46 -0.00 0.00 -1.16 0.00 0.00 32.46 30.59 3hi5 n ARG 136 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3hi5 n SER 137 N -0.23 0.90 -4.86 0.55 2.88 -1.19 -5.00 113.62 106.67 3hi5 n SER 137 Ca 0.20 -0.95 -0.34 0.00 -1.33 0.00 0.00 58.87 56.45 3hi5 n SER 137 Cb 0.26 0.46 -0.06 0.00 -0.75 0.00 0.00 64.21 64.12 3hi5 n SER 137 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3hi5 s THR 138 N -0.94 5.19 -0.18 2.46 -4.23 -0.99 -1.27 115.64 115.68 3hi5 s THR 138 Ca 0.04 -0.18 -0.08 0.00 -1.18 0.00 0.00 61.69 60.29 3hi5 s THR 138 Cb 0.04 -3.38 0.07 0.00 1.34 0.00 0.00 72.50 70.57 3hi5 s THR 138 CO 0.13 0.39 0.41 -0.94 -0.54 0.00 0.00 174.62 174.07 3hi5 s SER 139 N -1.70 -0.42 0.70 3.99 1.04 -0.67 -4.96 113.70 111.68 3hi5 s SER 139 Ca 0.23 0.91 0.00 0.00 0.48 0.00 0.00 55.95 57.57 3hi5 s SER 139 Cb -0.12 0.91 0.00 0.00 0.10 0.00 0.00 66.02 66.91 3hi5 s SER 139 CO 0.14 -0.20 0.00 -1.84 0.98 0.00 0.00 173.24 172.32 3hi5 n GLU 140 N 4.57 0.00 -0.14 4.02 0.28 -1.26 -3.06 120.64 125.05 3hi5 n GLU 140 Ca -0.19 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.71 3hi5 n GLU 140 Cb 0.54 0.00 0.03 0.00 1.43 0.00 0.00 31.44 33.44 3hi5 n GLU 140 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 3hi5 h SER 141 N 9.21 0.96 -3.87 -1.84 4.64 -1.97 -3.47 113.55 117.21 3hi5 h SER 141 Ca 0.00 -0.34 -0.53 0.00 -0.47 0.00 0.00 61.79 60.44 3hi5 h SER 141 Cb 0.00 -0.26 0.09 0.00 -0.31 0.00 0.00 62.40 61.92 3hi5 h SER 141 CO 0.00 1.12 0.75 0.28 -0.87 0.00 0.00 176.83 178.11 3hi5 s THR 142 N -4.70 2.23 -0.07 2.95 -1.32 -1.17 -0.05 115.64 113.50 3hi5 s THR 142 Ca -0.11 0.23 0.04 0.00 -1.21 0.00 0.00 61.69 60.64 3hi5 s THR 142 Cb 0.13 -3.14 -0.00 0.00 -1.51 0.00 0.00 72.50 67.97 3hi5 s THR 142 CO 0.86 0.05 -0.21 0.00 -2.21 0.00 0.00 174.62 173.11 3hi5 s ALA 143 N -1.02 1.85 0.06 11.08 0.00 0.96 -1.67 121.76 133.03 3hi5 s ALA 143 Ca 0.53 -0.83 -0.10 0.00 0.00 0.00 0.00 51.96 51.55 3hi5 s ALA 143 Cb -0.45 -0.65 -0.06 0.00 0.00 0.00 0.00 23.12 21.96 3hi5 s ALA 143 CO 0.59 0.29 0.39 0.00 0.00 0.00 0.00 175.76 177.04 3hi5 s ALA 144 N 0.17 3.73 0.09 0.00 0.00 -0.40 -0.96 121.76 124.40 3hi5 s ALA 144 Ca -0.10 -0.37 -0.08 0.00 0.00 0.00 0.00 51.96 51.41 3hi5 s ALA 144 Cb -0.15 -2.28 -0.01 0.00 0.00 0.00 0.00 23.12 20.69 3hi5 s ALA 144 CO 0.05 0.56 0.17 -0.48 0.00 0.00 0.00 175.76 176.06 3hi5 s LEU 145 N -1.79 1.49 0.00 0.00 0.05 -0.37 -4.18 118.68 113.89 3hi5 s LEU 145 Ca 0.31 -0.70 0.00 0.00 0.05 0.00 0.00 54.13 53.79 3hi5 s LEU 145 Cb -0.14 0.96 0.00 0.00 -2.05 0.00 0.00 46.19 44.96 3hi5 s LEU 145 CO 0.17 -0.73 0.00 0.61 -0.55 0.00 0.00 176.35 175.85 3hi5 n GLY 146 N -0.05 1.33 2.91 -3.48 0.00 -0.60 -0.04 105.19 105.26 3hi5 n GLY 146 Ca -0.14 -0.91 -0.20 0.00 0.00 0.00 0.00 46.02 44.77 3hi5 n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hi5 s LEU 148 N 0.78 6.16 -0.63 0.00 2.96 0.16 -1.41 118.68 126.71 3hi5 s LEU 148 Ca -0.11 -1.83 -0.24 0.00 -0.22 0.00 0.00 54.13 51.73 3hi5 s LEU 148 Cb -0.14 -2.22 0.05 0.00 0.50 0.00 0.00 46.19 44.38 3hi5 s LEU 148 CO 0.01 -0.86 1.02 -0.69 -1.32 0.00 0.00 176.35 174.51 3hi5 s VAL 149 N 1.58 4.23 0.10 1.68 1.01 0.21 -1.12 120.40 128.09 3hi5 s VAL 149 Ca 0.05 0.08 0.09 0.00 0.00 0.00 0.00 61.98 62.20 3hi5 s VAL 149 Cb -0.28 -4.67 -0.04 0.00 0.00 0.00 0.00 36.38 31.39 3hi5 s VAL 149 CO 0.02 -1.39 -0.20 -0.75 0.00 0.00 0.00 175.10 172.79 3hi5 s LYS 150 N 4.35 1.76 -1.21 2.72 2.20 0.17 -1.12 119.74 128.60 3hi5 s LYS 150 Ca 0.29 -1.17 -0.04 0.00 -0.36 0.00 0.00 55.97 54.68 3hi5 s LYS 150 Cb -0.13 -2.08 -0.02 0.00 -1.51 0.00 0.00 37.83 34.09 3hi5 s LYS 150 CO 0.15 0.49 0.83 -0.25 -0.36 0.00 0.00 175.35 176.20 3hi5 n ASP 151 N 0.99 -3.00 -4.63 1.43 8.00 -0.15 -1.24 116.55 117.94 3hi5 n ASP 151 Ca -0.16 -0.78 -0.24 0.00 0.71 0.00 0.00 54.79 54.32 3hi5 n ASP 151 Cb 0.53 -4.45 -0.08 0.00 -0.02 0.00 0.00 41.12 37.10 3hi5 n ASP 151 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3hi5 s TYR 152 N -3.52 2.68 -0.19 1.24 -0.85 -0.98 -4.53 117.35 111.21 3hi5 s TYR 152 Ca 0.15 -0.22 -0.25 0.00 -0.52 0.00 0.00 57.07 56.23 3hi5 s TYR 152 Cb -0.03 -1.21 0.07 0.00 0.38 0.00 0.00 41.96 41.17 3hi5 s TYR 152 CO 0.78 0.61 0.67 0.12 -1.52 0.00 0.00 175.55 176.21 3hi5 s PHE 153 N -2.23 -0.71 0.12 -3.49 5.36 0.51 0.28 117.98 117.84 3hi5 s PHE 153 Ca 0.30 1.58 -0.02 0.00 -0.96 0.00 0.00 56.93 57.84 3hi5 s PHE 153 Cb -0.07 0.29 0.03 0.00 -0.34 0.00 0.00 43.02 42.93 3hi5 s PHE 153 CO 0.19 -0.43 0.17 -0.35 -1.46 0.00 0.00 175.22 173.34 3hi5 n PRO 154 N 2.16 0.04 -1.55 10.12 -0.04 -1.26 0.24 135.00 144.71 3hi5 n PRO 154 Ca -0.16 -0.31 -0.31 0.00 -0.04 0.00 0.00 63.50 62.68 3hi5 n PRO 154 Cb 0.56 -0.16 0.05 0.00 -0.04 0.00 0.00 33.50 33.91 3hi5 n PRO 154 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3hi5 s GLU 155 N -3.20 2.88 0.33 0.54 2.02 -1.26 -4.75 118.70 115.25 3hi5 s GLU 155 Ca 0.10 0.98 0.08 0.00 0.02 0.00 0.00 54.97 56.15 3hi5 s GLU 155 Cb -0.00 -1.98 -0.03 0.00 0.10 0.00 0.00 34.13 32.22 3hi5 s GLU 155 CO 0.07 -1.14 0.26 -1.25 0.02 0.00 0.00 175.26 173.22 3hi5 s PRO 156 N -5.00 2.70 0.22 0.39 0.04 -1.26 -4.93 135.00 127.16 3hi5 s PRO 156 Ca 0.58 -1.31 0.07 0.00 0.04 0.00 0.00 61.00 60.39 3hi5 s PRO 156 Cb -0.14 -2.45 -0.04 0.00 0.04 0.00 0.00 34.50 31.91 3hi5 s PRO 156 CO 0.55 0.12 0.13 0.14 0.04 0.00 0.00 177.00 177.98 3hi5 s VAL 157 N -2.31 4.25 -0.04 -0.36 -7.23 -1.26 -4.13 120.40 109.33 3hi5 s VAL 157 Ca 0.40 -1.39 0.05 0.00 -1.81 0.00 0.00 61.98 59.22 3hi5 s VAL 157 Cb -0.06 -3.25 -0.01 0.00 0.56 0.00 0.00 36.38 33.63 3hi5 s VAL 157 CO 0.26 -0.27 -0.18 0.42 -0.31 0.00 0.00 175.10 175.02 3hi5 s THR 158 N -2.02 1.52 -0.05 5.32 -4.23 0.63 -4.97 115.64 111.84 3hi5 s THR 158 Ca 0.32 -0.77 0.03 0.00 -1.18 0.00 0.00 61.69 60.08 3hi5 s THR 158 Cb -0.08 -1.29 0.01 0.00 1.34 0.00 0.00 72.50 72.47 3hi5 s THR 158 CO 0.23 0.43 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.93 3hi5 s VAL 159 N -0.05 1.14 0.11 2.29 1.01 -1.26 -1.01 120.40 122.63 3hi5 s VAL 159 Ca -0.02 -0.52 -0.03 0.00 0.00 0.00 0.00 61.98 61.41 3hi5 s VAL 159 Cb -0.11 -1.01 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 3hi5 s VAL 159 CO 0.02 0.35 0.08 -0.94 0.00 0.00 0.00 175.10 174.61 3hi5 s SER 160 N 0.38 0.29 -0.05 3.32 1.04 -0.87 -4.96 113.70 112.85 3hi5 s SER 160 Ca -0.09 -1.06 0.06 0.00 0.48 0.00 0.00 55.95 55.34 3hi5 s SER 160 Cb -0.13 0.30 -0.01 0.00 0.10 0.00 0.00 66.02 66.28 3hi5 s SER 160 CO 0.03 -0.73 -0.23 0.26 0.98 0.00 0.00 173.24 173.55 3hi5 s TRP 161 N -3.99 2.27 -1.43 5.02 0.52 -1.25 0.99 118.94 121.08 3hi5 s TRP 161 Ca 0.17 -0.66 -0.13 0.00 0.02 0.00 0.00 56.10 55.51 3hi5 s TRP 161 Cb 0.07 -1.49 0.10 0.00 -1.15 0.00 0.00 33.47 31.00 3hi5 s TRP 161 CO -0.02 -0.20 0.63 0.09 0.02 0.00 0.00 176.95 177.47 3hi5 n ASN 162 N 2.96 -3.61 -3.26 2.95 3.02 -0.45 -1.43 115.26 115.43 3hi5 n ASN 162 Ca -0.17 -0.62 -0.23 0.00 -0.03 0.00 0.00 54.58 53.52 3hi5 n ASN 162 Cb 0.52 -2.97 0.04 0.00 -0.61 0.00 0.00 39.78 36.76 3hi5 n ASN 162 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3hi5 n SER 163 N -2.44 -5.95 0.00 6.41 7.64 -1.26 -1.93 113.62 116.09 3hi5 n SER 163 Ca 0.02 -0.40 0.00 0.00 1.01 0.00 0.00 58.87 59.51 3hi5 n SER 163 Cb 0.52 -4.77 0.00 0.00 -1.01 0.00 0.00 64.21 58.95 3hi5 n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hi5 n GLY 164 N -1.65 1.69 0.01 0.23 0.00 -0.51 -4.91 105.19 100.06 3hi5 n GLY 164 Ca -0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.03 3hi5 n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hi5 n ALA 165 N -1.41 1.64 -3.89 4.61 0.00 -0.81 -4.29 120.51 116.35 3hi5 n ALA 165 Ca 0.00 -0.04 -0.29 0.00 0.00 0.00 0.00 53.44 53.11 3hi5 n ALA 165 Cb 0.00 -1.24 -0.16 0.00 0.00 0.00 0.00 19.45 18.05 3hi5 n ALA 165 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3hi5 s LEU 166 N -3.10 2.13 0.00 0.00 2.96 -0.77 -4.95 118.68 114.94 3hi5 s LEU 166 Ca 0.07 -1.01 0.00 0.00 -0.22 0.00 0.00 54.13 52.96 3hi5 s LEU 166 Cb 0.09 -1.02 0.00 0.00 0.50 0.00 0.00 46.19 45.76 3hi5 s LEU 166 CO 0.27 -0.24 0.25 0.35 -1.32 0.00 0.00 176.35 175.66 3hi5 n THR 167 N 4.78 0.00 -3.38 3.68 -2.24 -1.26 -3.88 114.28 111.97 3hi5 n THR 167 Ca -0.12 -0.27 -0.40 0.00 -2.27 0.00 0.00 64.05 61.00 3hi5 n THR 167 Cb 0.45 1.42 -0.09 0.00 -2.10 0.00 0.00 70.33 70.01 3hi5 n THR 167 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3hi5 s SER 168 N -0.04 6.24 0.00 3.42 0.01 -1.26 -3.71 113.70 118.35 3hi5 s SER 168 Ca 0.00 0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.40 3hi5 s SER 168 Cb 0.00 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 64.02 3hi5 s SER 168 CO 0.00 -0.24 0.00 0.61 0.41 0.00 0.00 173.24 174.02 3hi5 n GLY 169 N 4.76 1.19 3.69 3.44 0.00 -1.26 -4.68 105.19 112.33 3hi5 n GLY 169 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 3hi5 n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hi5 s VAL 170 N -2.75 4.26 -0.27 1.61 1.01 -1.24 -2.88 120.40 120.12 3hi5 s VAL 170 Ca 0.00 1.59 0.01 0.00 0.00 0.00 0.00 61.98 63.59 3hi5 s VAL 170 Cb 0.00 -4.02 0.08 0.00 0.00 0.00 0.00 36.38 32.43 3hi5 s VAL 170 CO 0.00 0.03 -0.01 -1.00 0.00 0.00 0.00 175.10 174.13 3hi5 s HIS 171 N 1.89 2.69 -0.26 5.22 3.76 0.18 -4.99 115.29 123.77 3hi5 s HIS 171 Ca 0.56 -2.10 -0.13 0.00 -0.15 0.00 0.00 55.06 53.23 3hi5 s HIS 171 Cb -0.25 -1.96 -0.04 0.00 1.11 0.00 0.00 32.58 31.44 3hi5 s HIS 171 CO 0.24 -0.84 0.30 0.99 -0.85 0.00 0.00 174.74 174.58 3hi5 s THR 172 N 1.29 5.23 0.39 1.30 2.01 -1.26 -0.66 115.64 123.94 3hi5 s THR 172 Ca 0.01 0.44 -0.07 0.00 0.31 0.00 0.00 61.69 62.38 3hi5 s THR 172 Cb -0.19 -3.64 -0.05 0.00 0.01 0.00 0.00 72.50 68.64 3hi5 s THR 172 CO -0.10 0.21 0.70 -0.36 -0.69 0.00 0.00 174.62 174.39 3hi5 s PHE 173 N 1.80 3.50 0.49 4.92 0.08 -0.46 -5.01 117.98 123.31 3hi5 s PHE 173 Ca 0.12 0.82 -0.23 0.00 0.12 0.00 0.00 56.93 57.77 3hi5 s PHE 173 Cb -0.15 -2.27 -0.08 0.00 -0.57 0.00 0.00 43.02 39.95 3hi5 s PHE 173 CO 0.09 -0.07 1.22 -2.30 -0.10 0.00 0.00 175.22 174.06 3hi5 n PRO 174 N -1.52 1.63 -2.31 0.24 -0.02 -1.26 -4.65 135.00 127.10 3hi5 n PRO 174 Ca 0.00 0.59 -0.35 0.00 -2.02 0.00 0.00 63.50 61.72 3hi5 n PRO 174 Cb 0.54 -2.37 -0.01 0.00 -0.02 0.00 0.00 33.50 31.65 3hi5 n PRO 174 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hi5 s ALA 175 N -1.29 2.80 -0.14 3.55 0.00 -1.26 -4.77 121.76 120.65 3hi5 s ALA 175 Ca 0.67 0.82 -0.02 0.00 0.00 0.00 0.00 51.96 53.43 3hi5 s ALA 175 Cb -0.47 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.28 3hi5 s ALA 175 CO 0.53 -0.66 -0.08 0.14 0.00 0.00 0.00 175.76 175.70 3hi5 s VAL 176 N -1.74 3.51 -0.35 0.00 -7.23 -0.12 -4.92 120.40 109.55 3hi5 s VAL 176 Ca 0.69 -0.50 -0.29 0.00 -1.81 0.00 0.00 61.98 60.07 3hi5 s VAL 176 Cb -0.24 -2.51 0.01 0.00 0.56 0.00 0.00 36.38 34.20 3hi5 s VAL 176 CO 0.28 0.51 1.26 -0.22 -0.31 0.00 0.00 175.10 176.62 3hi5 s LEU 177 N 0.30 3.81 0.64 1.32 2.96 -1.26 -1.97 118.68 124.48 3hi5 s LEU 177 Ca -0.07 1.02 -0.11 0.00 -0.22 0.00 0.00 54.13 54.75 3hi5 s LEU 177 Cb -0.15 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.97 3hi5 s LEU 177 CO 0.04 -1.13 1.04 -1.10 -1.32 0.00 0.00 176.35 173.89 3hi5 s GLN 178 N 4.25 3.42 0.47 1.98 -0.21 -0.64 -4.94 119.66 123.98 3hi5 s GLN 178 Ca 0.54 0.70 0.31 0.00 0.02 0.00 0.00 55.36 56.92 3hi5 s GLN 178 Cb -0.14 -2.06 1.67 0.00 1.00 0.00 0.00 33.01 33.48 3hi5 s GLN 178 CO 0.25 -0.69 1.94 0.66 -2.12 0.00 0.00 175.29 175.33 3hi5 h SER 179 N -0.40 0.00 1.16 5.90 4.64 -1.95 0.17 113.55 123.06 3hi5 h SER 179 Ca -0.44 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.87 3hi5 h SER 179 Cb 1.20 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3hi5 h SER 179 CO 0.62 0.00 -0.05 0.77 -0.87 0.00 0.00 176.83 177.30 3hi5 h SER 180 N 0.00 0.00 0.00 4.97 4.64 -2.01 -3.47 113.55 117.68 3hi5 h SER 180 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hi5 h SER 180 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3hi5 h SER 180 CO 0.00 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 3hi5 n GLY 181 N 0.23 0.43 3.90 -0.77 0.00 0.05 -4.93 105.19 104.11 3hi5 n GLY 181 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 3hi5 n GLY 181 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hi5 s LEU 182 N 0.00 4.34 0.65 0.99 1.43 -1.26 -4.85 118.68 119.98 3hi5 s LEU 182 Ca 0.00 0.43 -0.04 0.00 -1.03 0.00 0.00 54.13 53.49 3hi5 s LEU 182 Cb 0.00 -2.93 0.06 0.00 0.03 0.00 0.00 46.19 43.34 3hi5 s LEU 182 CO 0.00 0.17 0.93 -0.31 0.23 0.00 0.00 176.35 177.37 3hi5 s TYR 183 N -1.47 2.82 -0.28 0.29 2.02 0.14 -1.63 117.35 119.25 3hi5 s TYR 183 Ca 0.34 0.24 -0.21 0.00 -0.37 0.00 0.00 57.07 57.07 3hi5 s TYR 183 Cb -0.13 -3.04 0.08 0.00 -0.40 0.00 0.00 41.96 38.47 3hi5 s TYR 183 CO 0.23 -1.24 0.73 0.45 -1.57 0.00 0.00 175.55 174.15 3hi5 s SER 184 N -4.50 -0.82 0.07 2.29 0.15 -0.83 -0.97 113.70 109.09 3hi5 s SER 184 Ca 0.60 1.43 -0.06 0.00 0.70 0.00 0.00 55.95 58.62 3hi5 s SER 184 Cb -0.10 1.40 -0.02 0.00 -1.71 0.00 0.00 66.02 65.59 3hi5 s SER 184 CO 0.42 -0.24 0.11 -1.48 1.20 0.00 0.00 173.24 173.26 3hi5 s LEU 185 N 0.95 1.81 0.07 3.45 0.05 -0.28 -0.95 118.68 123.77 3hi5 s LEU 185 Ca -0.04 -0.77 0.07 0.00 0.05 0.00 0.00 54.13 53.43 3hi5 s LEU 185 Cb -0.05 0.74 -0.04 0.00 -2.05 0.00 0.00 46.19 44.79 3hi5 s LEU 185 CO -0.09 -0.68 -0.16 -0.94 -0.55 0.00 0.00 176.35 173.93 3hi5 s SER 186 N -2.88 3.98 -0.13 1.48 1.04 -1.26 -0.62 113.70 115.30 3hi5 s SER 186 Ca 0.06 -0.43 0.01 0.00 0.48 0.00 0.00 55.95 56.07 3hi5 s SER 186 Cb 0.06 -0.66 0.02 0.00 0.10 0.00 0.00 66.02 65.53 3hi5 s SER 186 CO -0.11 0.23 -0.16 -0.55 0.98 0.00 0.00 173.24 173.63 3hi5 s SER 187 N -1.74 2.69 0.17 7.02 0.15 -0.50 -1.35 113.70 120.15 3hi5 s SER 187 Ca 0.17 -0.50 0.10 0.00 0.70 0.00 0.00 55.95 56.42 3hi5 s SER 187 Cb -0.11 -1.21 -0.04 0.00 -1.71 0.00 0.00 66.02 62.95 3hi5 s SER 187 CO 0.08 -0.00 -0.22 0.68 1.20 0.00 0.00 173.24 174.98 3hi5 s VAL 188 N 1.16 2.08 -0.01 4.45 -7.23 0.16 -0.70 120.40 120.32 3hi5 s VAL 188 Ca -0.02 -1.93 0.01 0.00 -1.81 0.00 0.00 61.98 58.24 3hi5 s VAL 188 Cb -0.14 -1.96 0.00 0.00 0.56 0.00 0.00 36.38 34.85 3hi5 s VAL 188 CO -0.06 -0.17 -0.04 0.54 -0.31 0.00 0.00 175.10 175.06 3hi5 s VAL 189 N -1.73 0.36 -0.24 1.32 0.11 0.94 0.47 120.40 121.62 3hi5 s VAL 189 Ca 0.17 -0.14 -0.13 0.00 -2.93 0.00 0.00 61.98 58.95 3hi5 s VAL 189 Cb -0.07 -0.34 -0.04 0.00 -1.53 0.00 0.00 36.38 34.39 3hi5 s VAL 189 CO 0.08 0.13 0.28 0.42 -3.33 0.00 0.00 175.10 172.68 3hi5 s THR 190 N 0.21 5.27 0.35 5.04 -4.23 -1.14 -1.24 115.64 119.90 3hi5 s THR 190 Ca -0.02 0.41 0.04 0.00 -1.18 0.00 0.00 61.69 60.95 3hi5 s THR 190 Cb -0.05 -3.61 -0.06 0.00 1.34 0.00 0.00 72.50 70.11 3hi5 s THR 190 CO -0.00 0.26 0.06 0.68 -0.54 0.00 0.00 174.62 175.07 3hi5 s VAL 191 N 1.47 1.26 0.24 2.29 -7.23 -0.13 -4.63 120.40 113.66 3hi5 s VAL 191 Ca 0.12 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.99 3hi5 s VAL 191 Cb -0.15 -2.77 -0.09 0.00 0.56 0.00 0.00 36.38 33.93 3hi5 s VAL 191 CO 0.08 0.00 0.95 -2.16 -0.31 0.00 0.00 175.10 173.66 3hi5 s PRO 192 N -3.85 4.84 -0.25 4.82 0.04 -1.26 -0.03 135.00 139.30 3hi5 s PRO 192 Ca 0.34 1.52 -0.29 0.00 0.04 0.00 0.00 61.00 62.61 3hi5 s PRO 192 Cb 0.08 -3.27 -0.02 0.00 0.04 0.00 0.00 34.50 31.33 3hi5 s PRO 192 CO 0.15 0.49 1.62 0.45 0.04 0.00 0.00 177.00 179.75 3hi5 s SER 193 N -1.12 6.31 0.00 6.66 0.15 0.93 -1.75 113.70 124.87 3hi5 s SER 193 Ca 0.41 1.51 0.00 0.00 0.70 0.00 0.00 55.95 58.57 3hi5 s SER 193 Cb -0.26 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.51 3hi5 s SER 193 CO 0.33 -1.34 0.00 -1.54 1.20 0.00 0.00 173.24 171.89 3hi5 n SER 194 N 8.74 0.00 -0.14 5.45 3.41 -1.26 -4.93 113.62 124.88 3hi5 n SER 194 Ca 0.19 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.94 3hi5 n SER 194 Cb 0.46 0.00 0.63 0.00 -0.26 0.00 0.00 64.21 65.03 3hi5 n SER 194 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3hi5 n SER 195 N 0.00 0.54 -4.25 4.04 2.88 -0.72 -4.56 113.62 111.55 3hi5 n SER 195 Ca 0.00 -0.71 -0.43 0.00 -1.33 0.00 0.00 58.87 56.39 3hi5 n SER 195 Cb 0.00 -0.05 -0.05 0.00 -0.75 0.00 0.00 64.21 63.36 3hi5 n SER 195 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3hi5 s LEU 196 N -2.38 6.20 0.00 2.46 1.43 -1.26 -1.58 118.68 123.55 3hi5 s LEU 196 Ca 0.31 -2.65 0.00 0.00 -1.03 0.00 0.00 54.13 50.76 3hi5 s LEU 196 Cb 0.20 -2.09 0.00 0.00 0.03 0.00 0.00 46.19 44.33 3hi5 s LEU 196 CO 0.45 -0.53 0.00 0.61 0.23 0.00 0.00 176.35 177.11 3hi5 n GLY 197 N 3.94 -0.47 5.14 -3.19 0.00 -1.26 -4.99 105.19 104.36 3hi5 n GLY 197 Ca 0.09 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.94 3hi5 n GLY 197 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3hi5 n THR 198 N 0.00 0.00 -4.47 2.61 -1.04 -1.26 -4.87 114.28 105.25 3hi5 n THR 198 Ca 0.00 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.80 3hi5 n THR 198 Cb 0.00 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.37 3hi5 n THR 198 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3hi5 s LYS 199 N 0.00 0.98 0.01 -2.82 2.20 -0.62 -5.08 119.74 114.42 3hi5 s LYS 199 Ca 0.00 -0.59 -0.25 0.00 -0.36 0.00 0.00 55.97 54.77 3hi5 s LYS 199 Cb 0.00 -0.97 -0.05 0.00 -1.51 0.00 0.00 37.83 35.31 3hi5 s LYS 199 CO 0.00 0.25 0.76 0.99 -0.36 0.00 0.00 175.35 176.99 3hi5 s THR 200 N -0.55 4.82 -0.27 3.43 2.01 -1.26 -4.74 115.64 119.08 3hi5 s THR 200 Ca 0.03 1.60 0.02 0.00 0.31 0.00 0.00 61.69 63.66 3hi5 s THR 200 Cb -0.06 -4.11 0.06 0.00 0.01 0.00 0.00 72.50 68.40 3hi5 s THR 200 CO 0.00 0.32 -0.08 -0.31 -0.69 0.00 0.00 174.62 173.86 3hi5 s TYR 201 N 0.22 3.28 -0.14 4.92 2.02 -1.26 -4.92 117.35 121.47 3hi5 s TYR 201 Ca 0.39 -2.26 0.02 0.00 -0.37 0.00 0.00 57.07 54.85 3hi5 s TYR 201 Cb -0.20 -1.99 0.01 0.00 -0.40 0.00 0.00 41.96 39.38 3hi5 s TYR 201 CO 0.22 -0.87 -0.20 0.99 -1.57 0.00 0.00 175.55 174.12 3hi5 s THR 202 N 1.12 1.90 0.06 -0.71 2.01 -1.26 -2.46 115.64 116.30 3hi5 s THR 202 Ca -0.08 -0.88 -0.18 0.00 0.31 0.00 0.00 61.69 60.86 3hi5 s THR 202 Cb -0.20 -1.70 -0.06 0.00 0.01 0.00 0.00 72.50 70.55 3hi5 s THR 202 CO -0.04 0.52 0.53 0.00 -0.69 0.00 0.00 174.62 174.94 3hi5 s ASN 204 N -1.15 5.46 -0.10 0.00 -0.87 0.28 -2.50 114.94 116.05 3hi5 s ASN 204 Ca 0.28 -1.95 -0.15 0.00 -1.57 0.00 0.00 52.86 49.48 3hi5 s ASN 204 Cb -0.18 -1.91 -0.05 0.00 -0.02 0.00 0.00 41.25 39.08 3hi5 s ASN 204 CO 0.18 -0.61 0.35 -0.69 -2.57 0.00 0.00 177.10 173.77 3hi5 s VAL 205 N 1.25 5.22 -0.08 1.60 1.01 -0.03 -2.04 120.40 127.33 3hi5 s VAL 205 Ca 0.07 0.69 -0.02 0.00 0.00 0.00 0.00 61.98 62.72 3hi5 s VAL 205 Cb -0.24 -3.68 0.03 0.00 0.00 0.00 0.00 36.38 32.49 3hi5 s VAL 205 CO -0.02 0.44 0.04 -0.62 0.00 0.00 0.00 175.10 174.94 3hi5 s ASP 206 N -0.04 1.57 -0.32 3.32 2.15 -0.18 -1.06 116.67 122.11 3hi5 s ASP 206 Ca 0.20 -0.12 0.01 0.00 0.43 0.00 0.00 52.55 53.07 3hi5 s ASP 206 Cb -0.14 -0.29 0.08 0.00 -0.30 0.00 0.00 42.92 42.26 3hi5 s ASP 206 CO 0.08 -0.25 0.01 -2.28 -0.17 0.00 0.00 175.17 172.57 3hi5 s HIS 207 N 2.07 3.45 -0.25 -5.34 5.65 -0.95 -0.27 115.29 119.66 3hi5 s HIS 207 Ca 0.04 -2.40 0.18 0.00 0.25 0.00 0.00 55.06 53.13 3hi5 s HIS 207 Cb -0.13 -2.45 0.15 0.00 -1.18 0.00 0.00 32.58 28.97 3hi5 s HIS 207 CO -0.05 -0.89 1.49 0.87 -0.65 0.00 0.00 174.74 175.51 3hi5 h LYS 208 N 7.83 0.00 -0.88 2.88 1.57 -1.83 -3.21 116.57 122.92 3hi5 h LYS 208 Ca -0.15 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 3hi5 h LYS 208 Cb 1.04 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.31 3hi5 h LYS 208 CO 0.53 0.34 0.50 -1.35 -0.57 0.00 0.00 179.45 178.90 3hi5 h PRO 209 N 0.00 1.22 -7.20 3.15 0.11 -1.90 -3.41 132.00 123.97 3hi5 h PRO 209 Ca -0.00 -0.13 -0.47 0.00 0.11 0.00 0.00 66.00 65.51 3hi5 h PRO 209 Cb 1.26 -0.25 0.06 0.00 0.11 0.00 0.00 31.00 32.19 3hi5 h PRO 209 CO 0.04 0.88 0.21 -1.12 -0.21 0.00 0.00 178.00 177.80 3hi5 s SER 210 N -6.25 5.31 -1.10 -2.05 0.01 -1.21 -5.00 113.70 103.39 3hi5 s SER 210 Ca -0.12 0.64 -0.03 0.00 1.31 0.00 0.00 55.95 57.75 3hi5 s SER 210 Cb 0.17 -1.50 0.28 0.00 0.21 0.00 0.00 66.02 65.17 3hi5 s SER 210 CO 0.82 -1.27 1.88 -3.20 0.41 0.00 0.00 173.24 171.88 3hi5 n ASN 211 N -2.73 7.24 -3.83 2.44 5.15 -1.26 -4.82 115.26 117.46 3hi5 n ASN 211 Ca 0.06 -3.52 -0.23 0.00 -0.60 0.00 0.00 54.58 50.29 3hi5 n ASN 211 Cb 0.59 -1.23 -0.17 0.00 -0.53 0.00 0.00 39.78 38.43 3hi5 n ASN 211 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 3hi5 s THR 212 N -3.30 0.57 -0.06 -0.44 -1.32 -1.24 -5.11 115.64 104.74 3hi5 s THR 212 Ca 0.40 -0.03 0.02 0.00 -1.21 0.00 0.00 61.69 60.87 3hi5 s THR 212 Cb 0.16 -0.66 0.01 0.00 -1.51 0.00 0.00 72.50 70.50 3hi5 s THR 212 CO -0.08 0.28 -0.11 -0.54 -2.21 0.00 0.00 174.62 171.96 3hi5 s LYS 213 N 1.66 1.53 -0.03 7.08 1.02 -1.26 -2.25 119.74 127.48 3hi5 s LYS 213 Ca 0.01 -0.37 0.05 0.00 0.02 0.00 0.00 55.97 55.68 3hi5 s LYS 213 Cb -0.13 -1.29 -0.01 0.00 -0.52 0.00 0.00 37.83 35.88 3hi5 s LYS 213 CO -0.05 0.02 -0.16 0.08 -0.92 0.00 0.00 175.35 174.33 3hi5 s VAL 214 N 0.65 1.32 -0.55 3.17 1.01 -0.22 -5.02 120.40 120.76 3hi5 s VAL 214 Ca -0.13 -0.68 0.04 0.00 0.00 0.00 0.00 61.98 61.20 3hi5 s VAL 214 Cb -0.15 -1.12 0.14 0.00 0.00 0.00 0.00 36.38 35.25 3hi5 s VAL 214 CO 0.03 0.38 0.30 -1.81 0.00 0.00 0.00 175.10 174.00 3hi5 s ASP 215 N -0.14 4.44 -0.17 3.32 1.01 -1.26 -0.85 116.67 123.02 3hi5 s ASP 215 Ca 0.01 -3.09 -0.26 0.00 0.71 0.00 0.00 52.55 49.92 3hi5 s ASP 215 Cb -0.09 -1.66 -0.01 0.00 1.01 0.00 0.00 42.92 42.17 3hi5 s ASP 215 CO 0.01 -0.23 0.85 -0.75 0.21 0.00 0.00 175.17 175.26 3hi5 s LYS 216 N -0.40 4.30 -0.52 8.23 2.47 -1.04 -4.91 119.74 127.86 3hi5 s LYS 216 Ca 0.18 1.05 -0.22 0.00 -1.56 0.00 0.00 55.97 55.42 3hi5 s LYS 216 Cb -0.23 -3.58 0.05 0.00 -1.46 0.00 0.00 37.83 32.60 3hi5 s LYS 216 CO -0.02 -0.35 0.82 0.50 0.16 0.00 0.00 175.35 176.46 3hi5 s ARG 217 N 2.20 3.27 -0.15 4.03 3.52 -1.26 -1.81 118.95 128.75 3hi5 s ARG 217 Ca 0.39 -0.46 -0.16 0.00 -0.13 0.00 0.00 55.73 55.37 3hi5 s ARG 217 Cb -0.17 -4.06 -0.04 0.00 -1.56 0.00 0.00 34.95 29.13 3hi5 s ARG 217 CO 0.12 -1.35 0.41 0.54 -0.81 0.00 0.00 175.30 174.21 3hi5 s VAL 218 N 3.43 5.23 0.21 7.11 0.11 -1.03 -4.99 120.40 130.46 3hi5 s VAL 218 Ca 0.25 0.79 -0.05 0.00 -2.93 0.00 0.00 61.98 60.03 3hi5 s VAL 218 Cb -0.15 -3.75 -0.03 0.00 -1.53 0.00 0.00 36.38 30.93 3hi5 s VAL 218 CO 0.17 0.33 0.25 -1.83 -3.33 0.00 0.00 175.10 170.69 3hi5 s GLU 219 N 0.72 1.30 0.00 1.54 -1.05 -1.26 -4.43 118.70 115.51 3hi5 s GLU 219 Ca 0.22 -1.47 0.13 0.00 -0.15 0.00 0.00 54.97 53.70 3hi5 s GLU 219 Cb -0.14 0.34 0.79 0.00 -0.44 0.00 0.00 34.13 34.67 3hi5 s GLU 219 CO 0.08 -0.47 1.21 0.45 0.95 0.00 0.00 175.26 177.48