#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bz4 s VAL 2 N 0.00 3.69 -0.06 2.62 1.01 -1.26 -4.04 120.40 122.36 3bz4 s VAL 2 Ca 0.00 1.14 0.02 0.00 0.00 0.00 0.00 61.98 63.14 3bz4 s VAL 2 Cb 0.00 -3.73 0.01 0.00 0.00 0.00 0.00 36.38 32.66 3bz4 s VAL 2 CO 0.00 0.04 -0.12 -0.54 0.00 0.00 0.00 175.10 174.48 3bz4 s LYS 3 N 1.82 1.62 -0.13 2.72 1.02 -0.19 -4.99 119.74 121.61 3bz4 s LYS 3 Ca 0.63 -0.40 0.00 0.00 0.02 0.00 0.00 55.97 56.22 3bz4 s LYS 3 Cb -0.32 -1.35 0.02 0.00 -0.52 0.00 0.00 37.83 35.66 3bz4 s LYS 3 CO 0.28 0.04 -0.12 0.08 -0.92 0.00 0.00 175.35 174.71 3bz4 s VAL 4 N 0.62 1.35 -0.20 3.17 1.01 -1.26 -0.46 120.40 124.64 3bz4 s VAL 4 Ca -0.13 -0.50 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 3bz4 s VAL 4 Cb -0.15 -1.30 0.06 0.00 0.00 0.00 0.00 36.38 34.98 3bz4 s VAL 4 CO 0.03 0.42 0.03 -0.70 0.00 0.00 0.00 175.10 174.88 3bz4 s GLU 5 N 1.57 0.76 0.42 2.72 2.12 -0.41 -3.66 118.70 122.21 3bz4 s GLU 5 Ca 0.05 -0.47 -0.05 0.00 0.36 0.00 0.00 54.97 54.85 3bz4 s GLU 5 Cb -0.13 -2.14 -0.04 0.00 0.26 0.00 0.00 34.13 32.08 3bz4 s GLU 5 CO -0.10 -0.63 0.71 -1.21 -0.54 0.00 0.00 175.26 173.50 3bz4 s GLU 6 N 1.81 3.59 0.24 4.30 8.01 -1.26 -1.56 118.70 133.83 3bz4 s GLU 6 Ca -0.01 0.14 -0.17 0.00 0.01 0.00 0.00 54.97 54.94 3bz4 s GLU 6 Cb -0.17 -2.46 0.02 0.00 -4.31 0.00 0.00 34.13 27.20 3bz4 s GLU 6 CO -0.08 -0.06 0.57 -1.54 0.01 0.00 0.00 175.26 174.17 3bz4 s SER 7 N -3.77 -0.21 0.00 -0.19 1.04 0.22 -4.85 113.70 105.93 3bz4 s SER 7 Ca 0.46 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 56.23 3bz4 s SER 7 Cb -0.10 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.65 3bz4 s SER 7 CO 0.39 -1.17 0.00 0.61 0.98 0.00 0.00 173.24 174.04 3bz4 n GLY 8 N -0.39 0.68 3.65 7.32 0.00 -1.26 -1.71 105.19 113.47 3bz4 n GLY 8 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 3bz4 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3bz4 s GLY 9 N -0.66 1.59 0.00 -0.02 0.00 -1.26 -4.65 107.32 102.32 3bz4 s GLY 9 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 43.97 3bz4 s GLY 9 CO 0.00 0.02 0.00 0.61 0.00 0.00 0.00 173.10 173.73 3bz4 n GLY 10 N -1.25 0.16 3.54 0.20 0.00 -0.34 -4.94 105.19 102.55 3bz4 n GLY 10 Ca 0.10 -1.33 -0.33 0.00 0.00 0.00 0.00 46.02 44.46 3bz4 n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3bz4 s LEU 11 N 0.00 3.01 0.11 0.99 0.20 -1.26 -0.94 118.68 120.80 3bz4 s LEU 11 Ca 0.00 -0.09 -0.04 0.00 0.69 0.00 0.00 54.13 54.69 3bz4 s LEU 11 Cb 0.00 -1.64 -0.03 0.00 -0.43 0.00 0.00 46.19 44.09 3bz4 s LEU 11 CO 0.00 0.35 0.10 0.54 -0.29 0.00 0.00 176.35 177.04 3bz4 s VAL 12 N -0.71 0.13 0.46 1.68 0.11 -0.18 -4.98 120.40 116.90 3bz4 s VAL 12 Ca 0.11 -1.69 -0.13 0.00 -2.93 0.00 0.00 61.98 57.34 3bz4 s VAL 12 Cb -0.11 -1.78 -0.07 0.00 -1.53 0.00 0.00 36.38 32.89 3bz4 s VAL 12 CO 0.01 -0.59 0.87 -1.10 -3.33 0.00 0.00 175.10 170.97 3bz4 s GLN 13 N -3.98 3.84 0.09 1.54 1.11 -1.25 -1.07 119.66 119.94 3bz4 s GLN 13 Ca 0.16 0.68 -0.35 0.00 0.01 0.00 0.00 55.36 55.86 3bz4 s GLN 13 Cb 0.06 -2.27 -0.15 0.00 -1.01 0.00 0.00 33.01 29.64 3bz4 s GLN 13 CO -0.03 -0.16 1.50 -2.30 0.01 0.00 0.00 175.29 174.30 3bz4 n PRO 14 N -1.51 1.66 0.00 2.91 -0.02 -1.26 -1.20 135.00 135.59 3bz4 n PRO 14 Ca 0.04 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 3bz4 n PRO 14 Cb 0.54 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 3bz4 n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3bz4 n GLY 15 N 3.12 1.54 2.83 -1.23 0.00 0.11 -4.93 105.19 106.63 3bz4 n GLY 15 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.02 3bz4 n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bz4 n GLY 16 N -1.93 0.14 3.35 -0.02 0.00 -0.34 -3.92 105.19 102.48 3bz4 n GLY 16 Ca 0.00 -1.93 -0.19 0.00 0.00 0.00 0.00 46.02 43.90 3bz4 n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3bz4 s SER 17 N -4.12 2.63 0.02 1.61 0.01 -1.26 -1.84 113.70 110.75 3bz4 s SER 17 Ca 0.50 -1.02 -0.08 0.00 1.31 0.00 0.00 55.95 56.65 3bz4 s SER 17 Cb -0.02 -0.15 0.00 0.00 0.21 0.00 0.00 66.02 66.06 3bz4 s SER 17 CO 0.34 -0.16 0.17 -0.32 0.41 0.00 0.00 173.24 173.67 3bz4 s MET 18 N -3.64 0.61 -0.10 12.44 1.75 -0.09 -4.93 119.30 125.34 3bz4 s MET 18 Ca 0.23 -0.55 -0.00 0.00 -1.25 0.00 0.00 55.69 54.11 3bz4 s MET 18 Cb -0.01 0.25 0.02 0.00 2.84 0.00 0.00 34.83 37.94 3bz4 s MET 18 CO 0.07 -0.16 -0.07 0.21 -0.65 0.00 0.00 175.02 174.42 3bz4 s LYS 19 N -2.13 1.38 0.26 4.11 2.20 -1.26 -0.75 119.74 123.54 3bz4 s LYS 19 Ca -0.09 -0.21 0.11 0.00 -0.36 0.00 0.00 55.97 55.43 3bz4 s LYS 19 Cb -0.03 -1.45 -0.05 0.00 -1.51 0.00 0.00 37.83 34.79 3bz4 s LYS 19 CO -0.02 -0.24 -0.15 0.96 -0.36 0.00 0.00 175.35 175.55 3bz4 s ILE 20 N 1.62 2.75 0.18 5.43 -4.36 -0.70 -4.69 121.20 121.43 3bz4 s ILE 20 Ca 0.03 -2.22 -0.12 0.00 -0.26 0.00 0.00 60.65 58.08 3bz4 s ILE 20 Cb -0.13 -2.44 0.00 0.00 1.25 0.00 0.00 42.46 41.15 3bz4 s ILE 20 CO -0.06 -0.36 0.38 -0.94 0.24 0.00 0.00 174.94 174.20 3bz4 s SER 21 N -3.45 -0.07 0.02 4.36 1.04 -0.70 -0.66 113.70 114.25 3bz4 s SER 21 Ca 0.29 -0.76 -0.02 0.00 0.48 0.00 0.00 55.95 55.95 3bz4 s SER 21 Cb -0.06 0.50 -0.02 0.00 0.10 0.00 0.00 66.02 66.54 3bz4 s SER 21 CO 0.16 -0.97 0.00 0.00 0.98 0.00 0.00 173.24 173.41 3bz4 s VAL 23 N -1.77 3.18 -0.15 0.00 0.11 -0.60 -1.17 120.40 120.00 3bz4 s VAL 23 Ca -0.13 -0.65 -0.03 0.00 -2.93 0.00 0.00 61.98 58.25 3bz4 s VAL 23 Cb -0.07 -2.30 -0.02 0.00 -1.53 0.00 0.00 36.38 32.45 3bz4 s VAL 23 CO -0.02 0.56 -0.06 -0.69 -3.33 0.00 0.00 175.10 171.55 3bz4 s VAL 24 N -0.18 3.65 0.23 2.04 1.01 -0.87 -1.29 120.40 124.99 3bz4 s VAL 24 Ca 0.00 -0.45 0.08 0.00 0.00 0.00 0.00 61.98 61.62 3bz4 s VAL 24 Cb -0.13 -2.58 -0.05 0.00 0.00 0.00 0.00 36.38 33.62 3bz4 s VAL 24 CO 0.03 0.50 -0.13 -0.94 0.00 0.00 0.00 175.10 174.56 3bz4 s SER 25 N 0.35 2.73 0.00 3.32 1.04 0.39 -4.83 113.70 116.70 3bz4 s SER 25 Ca -0.06 -1.05 0.00 0.00 0.48 0.00 0.00 55.95 55.31 3bz4 s SER 25 Cb -0.15 -0.16 0.00 0.00 0.10 0.00 0.00 66.02 65.81 3bz4 s SER 25 CO 0.04 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 174.69 3bz4 n GLY 26 N -0.45 0.71 3.36 7.32 0.00 -1.26 -1.02 105.19 113.86 3bz4 n GLY 26 Ca -0.07 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 3bz4 n GLY 26 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3bz4 s LEU 27 N 0.00 0.89 -1.02 0.99 0.05 -1.26 -4.61 118.68 113.72 3bz4 s LEU 27 Ca 0.00 -0.92 -0.23 0.00 0.05 0.00 0.00 54.13 53.03 3bz4 s LEU 27 Cb 0.00 1.20 0.02 0.00 -2.05 0.00 0.00 46.19 45.36 3bz4 s LEU 27 CO 0.00 -0.92 1.63 -0.89 -0.55 0.00 0.00 176.35 175.62 3bz4 s THR 28 N -3.99 3.80 0.28 5.48 2.01 -1.26 -4.88 115.64 117.08 3bz4 s THR 28 Ca 0.20 -0.78 -0.00 0.00 0.31 0.00 0.00 61.69 61.42 3bz4 s THR 28 Cb 0.03 -4.77 0.29 0.00 0.01 0.00 0.00 72.50 68.06 3bz4 s THR 28 CO 0.02 -1.64 1.66 0.15 -0.69 0.00 0.00 174.62 174.12 3bz4 h PHE 29 N 9.97 0.34 0.00 4.92 3.57 -1.93 -1.04 116.94 132.77 3bz4 h PHE 29 Ca 0.20 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.75 3bz4 h PHE 29 Cb 0.99 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.71 3bz4 h PHE 29 CO 1.28 -0.16 0.00 -1.13 -2.23 0.00 0.00 178.31 176.06 3bz4 n SER 30 N -5.20 0.62 -0.01 0.41 3.41 -1.26 -2.01 113.62 109.58 3bz4 n SER 30 Ca 0.19 0.73 0.13 0.00 -0.26 0.00 0.00 58.87 59.66 3bz4 n SER 30 Cb 0.61 -0.83 0.41 0.00 -0.26 0.00 0.00 64.21 64.14 3bz4 n SER 30 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3bz4 n ASN 31 N -2.27 0.33 -4.53 4.04 5.03 -0.39 -4.65 115.26 112.82 3bz4 n ASN 31 Ca -0.00 -0.01 -0.33 0.00 0.87 0.00 0.00 54.58 55.10 3bz4 n ASN 31 Cb 0.11 -0.04 -0.12 0.00 -1.02 0.00 0.00 39.78 38.71 3bz4 n ASN 31 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 3bz4 s TYR 32 N -2.96 2.88 0.53 3.10 2.02 -0.85 -5.03 117.35 117.04 3bz4 s TYR 32 Ca 0.13 -0.12 -0.21 0.00 -0.37 0.00 0.00 57.07 56.51 3bz4 s TYR 32 Cb 0.18 -1.73 -0.06 0.00 -0.40 0.00 0.00 41.96 39.96 3bz4 s TYR 32 CO 0.62 0.20 1.20 -1.58 -1.57 0.00 0.00 175.55 174.42 3bz4 s TRP 33 N -0.55 2.61 -0.01 2.71 0.51 -1.26 -4.83 118.94 118.11 3bz4 s TRP 33 Ca 0.08 1.51 0.04 0.00 -2.12 0.00 0.00 56.10 55.61 3bz4 s TRP 33 Cb -0.12 -3.45 -0.01 0.00 -0.81 0.00 0.00 33.47 29.08 3bz4 s TRP 33 CO 0.02 -1.92 -0.13 -1.64 -0.51 0.00 0.00 176.95 172.76 3bz4 s MET 34 N -3.04 1.06 0.13 4.98 -1.94 -0.81 -4.06 119.30 115.62 3bz4 s MET 34 Ca 0.71 -0.48 -0.08 0.00 -1.71 0.00 0.00 55.69 54.13 3bz4 s MET 34 Cb -0.30 -1.02 -0.01 0.00 2.01 0.00 0.00 34.83 35.51 3bz4 s MET 34 CO 0.34 0.28 0.22 -1.54 -0.01 0.00 0.00 175.02 174.31 3bz4 s SER 35 N -0.34 0.11 -0.08 3.03 1.04 -0.17 -0.41 113.70 116.88 3bz4 s SER 35 Ca 0.05 -0.82 0.03 0.00 0.48 0.00 0.00 55.95 55.69 3bz4 s SER 35 Cb -0.05 0.38 -0.02 0.00 0.10 0.00 0.00 66.02 66.43 3bz4 s SER 35 CO -0.00 -0.80 -0.18 0.26 0.98 0.00 0.00 173.24 173.49 3bz4 s TRP 36 N -3.93 2.64 -0.06 5.02 0.52 -0.17 -0.68 118.94 122.28 3bz4 s TRP 36 Ca 0.13 -0.53 0.01 0.00 0.02 0.00 0.00 56.10 55.73 3bz4 s TRP 36 Cb 0.04 -1.69 0.02 0.00 -1.15 0.00 0.00 33.47 30.70 3bz4 s TRP 36 CO -0.04 -0.09 -0.07 0.08 0.02 0.00 0.00 176.95 176.84 3bz4 s VAL 37 N -0.17 0.78 0.14 4.03 1.01 -0.25 -1.13 120.40 124.80 3bz4 s VAL 37 Ca -0.02 -0.24 0.05 0.00 0.00 0.00 0.00 61.98 61.77 3bz4 s VAL 37 Cb -0.14 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.43 3bz4 s VAL 37 CO 0.03 0.29 0.10 0.00 0.00 0.00 0.00 175.10 175.52 3bz4 s ARG 38 N 0.99 2.83 -0.06 2.72 1.70 0.02 -0.07 118.95 127.07 3bz4 s ARG 38 Ca -0.09 -0.84 0.03 0.00 -0.47 0.00 0.00 55.73 54.36 3bz4 s ARG 38 Cb -0.14 -2.64 0.01 0.00 -0.57 0.00 0.00 34.95 31.60 3bz4 s ARG 38 CO 0.00 0.51 -0.15 -1.14 -1.08 0.00 0.00 175.30 173.44 3bz4 s GLN 39 N -2.83 1.91 0.05 3.89 0.74 0.92 -0.51 119.66 123.82 3bz4 s GLN 39 Ca 0.30 -0.53 0.02 0.00 0.05 0.00 0.00 55.36 55.19 3bz4 s GLN 39 Cb -0.11 -1.56 -0.03 0.00 1.10 0.00 0.00 33.01 32.41 3bz4 s GLN 39 CO 0.22 0.11 -0.07 -1.54 -0.55 0.00 0.00 175.29 173.47 3bz4 s SER 40 N 0.43 0.80 0.31 6.67 1.04 -1.00 -1.40 113.70 120.55 3bz4 s SER 40 Ca -0.12 -0.65 0.04 0.00 0.48 0.00 0.00 55.95 55.70 3bz4 s SER 40 Cb -0.15 0.07 0.65 0.00 0.10 0.00 0.00 66.02 66.69 3bz4 s SER 40 CO 0.04 -0.29 1.85 -0.65 0.98 0.00 0.00 173.24 175.17 3bz4 h PRO 41 N 4.15 0.86 -0.27 4.02 0.11 -1.95 0.96 132.00 139.88 3bz4 h PRO 41 Ca -0.35 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 65.56 3bz4 h PRO 41 Cb 1.19 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 3bz4 h PRO 41 CO 0.47 0.57 -0.42 1.49 -0.21 0.00 0.00 178.00 179.90 3bz4 h GLU 42 N 0.88 0.76 -0.01 1.05 4.57 -1.99 -3.36 114.58 116.49 3bz4 h GLU 42 Ca 0.48 -0.46 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 3bz4 h GLU 42 Cb 0.58 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.21 3bz4 h GLU 42 CO -0.25 1.08 -0.04 1.63 -1.18 0.00 0.00 179.01 180.26 3bz4 n LYS 43 N -4.15 0.80 0.00 1.92 4.76 -1.20 -5.11 118.16 115.18 3bz4 n LYS 43 Ca -0.05 -0.67 0.00 0.00 -2.87 0.00 0.00 58.31 54.73 3bz4 n LYS 43 Cb 0.55 -1.03 0.00 0.00 -1.84 0.00 0.00 35.03 32.71 3bz4 n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3bz4 n GLY 44 N 0.45 1.02 3.69 0.72 0.00 0.33 -4.63 105.19 106.77 3bz4 n GLY 44 Ca 0.03 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 3bz4 n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3bz4 s LEU 45 N 0.00 4.28 -0.27 0.99 1.43 -1.26 -2.39 118.68 121.47 3bz4 s LEU 45 Ca 0.00 1.59 -0.02 0.00 -1.03 0.00 0.00 54.13 54.67 3bz4 s LEU 45 Cb 0.00 -3.56 0.09 0.00 0.03 0.00 0.00 46.19 42.75 3bz4 s LEU 45 CO 0.00 -0.41 0.09 -0.70 0.23 0.00 0.00 176.35 175.56 3bz4 s GLU 46 N 1.75 0.55 0.20 1.70 2.12 0.33 -4.98 118.70 120.36 3bz4 s GLU 46 Ca 0.50 -0.72 -0.32 0.00 0.36 0.00 0.00 54.97 54.79 3bz4 s GLU 46 Cb -0.20 -1.81 -0.12 0.00 0.26 0.00 0.00 34.13 32.26 3bz4 s GLU 46 CO 0.21 -0.88 1.73 1.87 -0.54 0.00 0.00 175.26 177.65 3bz4 n TRP 47 N 5.02 2.75 -0.00 5.30 -0.00 -1.26 -0.80 117.44 128.44 3bz4 n TRP 47 Ca -0.05 0.03 -0.00 0.00 -0.00 0.00 0.00 57.50 57.47 3bz4 n TRP 47 Cb 0.44 -2.68 -0.01 0.00 -0.00 0.00 0.00 31.31 29.06 3bz4 n TRP 47 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 177.69 179.02 3bz4 n VAL 48 N 4.01 0.05 -3.51 5.87 0.24 -0.29 -4.61 118.33 120.09 3bz4 n VAL 48 Ca 0.16 -0.03 -0.13 0.00 -2.04 0.00 0.00 64.34 62.30 3bz4 n VAL 48 Cb 0.35 -0.96 -0.04 0.00 -1.47 0.00 0.00 33.84 31.72 3bz4 n VAL 48 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3bz4 s ALA 49 N -2.02 -1.79 -0.08 2.33 0.00 -1.20 -1.03 121.76 117.97 3bz4 s ALA 49 Ca -0.00 1.19 -0.11 0.00 0.00 0.00 0.00 51.96 53.04 3bz4 s ALA 49 Cb 0.00 0.04 0.03 0.00 0.00 0.00 0.00 23.12 23.19 3bz4 s ALA 49 CO 0.03 -0.48 0.28 -2.00 0.00 0.00 0.00 175.76 173.59 3bz4 s GLU 50 N -1.95 0.42 -0.01 0.00 2.12 -0.31 -1.00 118.70 117.97 3bz4 s GLU 50 Ca -0.04 0.22 0.04 0.00 0.36 0.00 0.00 54.97 55.55 3bz4 s GLU 50 Cb -0.00 0.20 -0.01 0.00 0.26 0.00 0.00 34.13 34.57 3bz4 s GLU 50 CO 0.00 -0.08 -0.12 -1.50 -0.54 0.00 0.00 175.26 173.03 3bz4 s ILE 51 N -0.27 0.97 0.00 -3.70 2.07 0.45 -1.24 121.20 119.47 3bz4 s ILE 51 Ca -0.04 -0.56 0.00 0.00 -1.41 0.00 0.00 60.65 58.64 3bz4 s ILE 51 Cb -0.03 -0.81 0.00 0.00 0.13 0.00 0.00 42.46 41.75 3bz4 s ILE 51 CO 0.01 0.25 0.00 0.54 -1.91 0.00 0.00 174.94 173.83 3bz4 n ARG 52 N 2.70 2.44 -2.73 3.50 5.12 0.14 -1.92 116.66 125.91 3bz4 n ARG 52 Ca -0.14 0.00 -0.21 0.00 -1.93 0.00 0.00 57.85 55.57 3bz4 n ARG 52 Cb 0.56 0.00 0.03 0.00 -1.16 0.00 0.00 32.46 31.89 3bz4 n ARG 52 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 3bz4 s LEU 52 N 0.00 3.37 0.24 0.55 1.43 -1.26 -4.59 118.68 118.42 3bz4 s LEU 52 Ca 0.00 -0.01 -0.05 0.00 -1.03 0.00 0.00 54.13 53.03 3bz4 s LEU 52 Cb 0.00 -2.89 0.38 0.00 0.03 0.00 0.00 46.19 43.71 3bz4 s LEU 52 CO 0.00 -1.04 1.80 0.50 0.23 0.00 0.00 176.35 177.84 3bz4 h LYS 52 N 0.18 0.69 0.00 1.70 3.64 -1.95 0.15 116.57 120.99 3bz4 h LYS 52 Ca -0.42 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 3bz4 h LYS 52 Cb 1.29 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 3bz4 h LYS 52 CO 0.52 0.46 0.05 0.66 -2.27 0.00 0.00 179.45 178.88 3bz4 h SER 52 N 0.72 0.00 -0.49 4.20 4.64 -1.94 0.20 113.55 120.88 3bz4 h SER 52 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 3bz4 h SER 52 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 3bz4 h SER 52 CO -0.26 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.17 3bz4 n ASP 53 N -2.25 4.39 -2.73 4.97 8.00 0.42 -4.93 116.55 124.41 3bz4 n ASP 53 Ca -0.01 -2.60 -0.19 0.00 0.71 0.00 0.00 54.79 52.69 3bz4 n ASP 53 Cb 0.09 -0.53 0.00 0.00 -0.02 0.00 0.00 41.12 40.66 3bz4 n ASP 53 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3bz4 n ASN 54 N 0.52 -5.05 -3.94 -2.24 3.02 0.70 -2.75 115.26 105.52 3bz4 n ASN 54 Ca 0.23 -0.09 -0.29 0.00 -0.03 0.00 0.00 54.58 54.40 3bz4 n ASN 54 Cb 0.86 -4.18 0.01 0.00 -0.61 0.00 0.00 39.78 35.86 3bz4 n ASN 54 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3bz4 n TYR 55 N -3.96 -2.00 -1.72 3.10 4.01 -0.48 -4.88 117.16 111.23 3bz4 n TYR 55 Ca -0.15 0.84 -0.39 0.00 -0.16 0.00 0.00 57.90 58.05 3bz4 n TYR 55 Cb 0.62 -3.82 0.03 0.00 -0.31 0.00 0.00 39.34 35.87 3bz4 n TYR 55 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3bz4 n ALA 56 N -4.49 1.43 -2.58 -0.72 0.00 -1.11 -4.52 120.51 108.52 3bz4 n ALA 56 Ca -0.08 0.17 -0.21 0.00 0.00 0.00 0.00 53.44 53.31 3bz4 n ALA 56 Cb 0.58 -2.31 -0.12 0.00 0.00 0.00 0.00 19.45 17.59 3bz4 n ALA 56 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3bz4 s THR 57 N -1.27 1.49 0.00 0.00 -4.23 -1.26 -0.68 115.64 109.69 3bz4 s THR 57 Ca 0.68 -1.53 -0.03 0.00 -1.18 0.00 0.00 61.69 59.63 3bz4 s THR 57 Cb -0.44 -1.43 -0.01 0.00 1.34 0.00 0.00 72.50 71.95 3bz4 s THR 57 CO 0.52 -0.18 0.05 -0.31 -0.54 0.00 0.00 174.62 174.16 3bz4 s TYR 58 N -1.41 0.12 0.05 3.99 2.02 -0.38 -4.99 117.35 116.75 3bz4 s TYR 58 Ca 0.05 -0.24 0.01 0.00 -0.37 0.00 0.00 57.07 56.52 3bz4 s TYR 58 Cb -0.09 -0.10 -0.03 0.00 -0.40 0.00 0.00 41.96 41.35 3bz4 s TYR 58 CO 0.04 -0.19 -0.05 0.71 -1.57 0.00 0.00 175.55 174.48 3bz4 s TYR 59 N -1.11 0.57 0.29 2.71 2.02 -1.26 -1.16 117.35 119.41 3bz4 s TYR 59 Ca -0.12 -0.68 -0.29 0.00 -0.37 0.00 0.00 57.07 55.60 3bz4 s TYR 59 Cb -0.07 -0.36 -0.10 0.00 -0.40 0.00 0.00 41.96 41.03 3bz4 s TYR 59 CO 0.00 -0.18 1.32 0.00 -1.57 0.00 0.00 175.55 175.12 3bz4 s ALA 60 N -2.26 3.52 0.36 3.71 0.00 -0.20 -4.90 121.76 121.98 3bz4 s ALA 60 Ca -0.05 1.23 0.16 0.00 0.00 0.00 0.00 51.96 53.31 3bz4 s ALA 60 Cb -0.04 -3.48 1.12 0.00 0.00 0.00 0.00 23.12 20.72 3bz4 s ALA 60 CO -0.03 -0.62 1.67 1.49 0.00 0.00 0.00 175.76 178.27 3bz4 h GLU 61 N 4.00 0.30 0.00 0.00 4.81 -1.95 -1.10 114.58 120.65 3bz4 h GLU 61 Ca -0.48 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 3bz4 h GLU 61 Cb 1.22 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.53 3bz4 h GLU 61 CO 0.69 0.20 0.00 0.66 -0.73 0.00 0.00 179.01 179.83 3bz4 h SER 62 N 0.31 0.00 0.00 1.04 4.64 -1.96 -3.21 113.55 114.37 3bz4 h SER 62 Ca 0.73 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.05 3bz4 h SER 62 Cb 1.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.84 3bz4 h SER 62 CO -0.56 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 176.73 3bz4 n VAL 63 N -2.31 0.21 -1.76 0.95 0.24 -0.45 -5.01 118.33 110.21 3bz4 n VAL 63 Ca 0.01 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.34 61.40 3bz4 n VAL 63 Cb 0.20 1.05 -0.02 0.00 -1.47 0.00 0.00 33.84 33.61 3bz4 n VAL 63 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 3bz4 s LYS 64 N -0.21 4.12 0.00 7.34 1.02 -0.98 -1.46 119.74 129.57 3bz4 s LYS 64 Ca 0.00 2.60 0.00 0.00 0.02 0.00 0.00 55.97 58.59 3bz4 s LYS 64 Cb 0.00 -3.03 0.00 0.00 -0.52 0.00 0.00 37.83 34.28 3bz4 s LYS 64 CO 0.00 -0.67 0.00 0.41 -0.92 0.00 0.00 175.35 174.17 3bz4 n GLY 65 N 2.60 2.27 0.09 -3.33 0.00 -1.26 -4.80 105.19 100.76 3bz4 n GLY 65 Ca 0.10 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.00 3bz4 n GLY 65 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3bz4 n LYS 66 N -2.00 0.42 -4.14 1.61 5.02 -0.53 -5.03 118.16 113.50 3bz4 n LYS 66 Ca 0.00 0.10 -0.35 0.00 -2.02 0.00 0.00 58.31 56.04 3bz4 n LYS 66 Cb 0.00 -1.33 -0.08 0.00 -0.02 0.00 0.00 35.03 33.61 3bz4 n LYS 66 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3bz4 s PHE 67 N -2.33 3.32 -0.12 2.13 0.40 -0.87 -4.40 117.98 116.11 3bz4 s PHE 67 Ca -0.23 0.28 -0.00 0.00 -0.60 0.00 0.00 56.93 56.38 3bz4 s PHE 67 Cb 0.06 -1.81 0.03 0.00 0.51 0.00 0.00 43.02 41.81 3bz4 s PHE 67 CO 0.38 0.57 -0.07 0.99 0.70 0.00 0.00 175.22 177.79 3bz4 s THR 68 N -1.04 1.02 0.07 0.64 2.01 0.25 -4.91 115.64 113.68 3bz4 s THR 68 Ca 0.17 -0.33 -0.12 0.00 0.31 0.00 0.00 61.69 61.73 3bz4 s THR 68 Cb -0.12 -1.07 -0.06 0.00 0.01 0.00 0.00 72.50 71.27 3bz4 s THR 68 CO 0.07 0.33 0.43 -0.51 -0.69 0.00 0.00 174.62 174.25 3bz4 s ILE 69 N 1.71 5.04 0.18 1.82 2.07 -1.26 -0.93 121.20 129.82 3bz4 s ILE 69 Ca 0.04 0.60 -0.17 0.00 -1.41 0.00 0.00 60.65 59.72 3bz4 s ILE 69 Cb -0.13 -3.68 0.03 0.00 0.13 0.00 0.00 42.46 38.81 3bz4 s ILE 69 CO -0.08 0.34 0.49 -0.94 -1.91 0.00 0.00 174.94 172.84 3bz4 s SER 70 N -1.61 -0.25 0.04 4.50 1.04 -0.96 -5.01 113.70 111.46 3bz4 s SER 70 Ca 0.32 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.28 3bz4 s SER 70 Cb -0.15 0.55 -0.03 0.00 0.10 0.00 0.00 66.02 66.50 3bz4 s SER 70 CO 0.17 -1.01 -0.04 0.00 0.98 0.00 0.00 173.24 173.34 3bz4 s ARG 71 N -3.87 0.49 -0.42 4.02 1.70 -1.26 -0.72 118.95 118.90 3bz4 s ARG 71 Ca 0.09 -0.92 0.02 0.00 -0.47 0.00 0.00 55.73 54.45 3bz4 s ARG 71 Cb -0.00 0.07 0.13 0.00 -0.57 0.00 0.00 34.95 34.58 3bz4 s ARG 71 CO -0.04 -0.06 0.21 0.34 -1.08 0.00 0.00 175.30 174.67 3bz4 s ASP 72 N -2.15 3.81 0.43 -2.89 -1.08 0.31 -4.99 116.67 110.10 3bz4 s ASP 72 Ca -0.04 -2.47 0.12 0.00 -0.52 0.00 0.00 52.55 49.63 3bz4 s ASP 72 Cb -0.02 -1.08 0.99 0.00 -1.46 0.00 0.00 42.92 41.35 3bz4 s ASP 72 CO -0.04 -0.29 2.02 0.44 0.52 0.00 0.00 175.17 177.81 3bz4 h ASP 73 N 6.97 0.37 0.34 -0.34 3.32 -1.97 -0.55 116.42 124.57 3bz4 h ASP 73 Ca -0.04 -0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.95 3bz4 h ASP 73 Cb 0.94 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.40 3bz4 h ASP 73 CO 0.50 0.25 -0.32 0.77 -1.72 0.00 0.00 179.24 178.72 3bz4 h SER 74 N 0.43 0.00 -0.21 6.45 4.64 -1.95 -2.56 113.55 120.35 3bz4 h SER 74 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3bz4 h SER 74 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 3bz4 h SER 74 CO -0.05 0.32 0.00 0.29 -0.87 0.00 0.00 176.83 176.51 3bz4 n LYS 75 N -4.11 2.07 -3.79 4.77 5.02 -0.43 -4.98 118.16 116.71 3bz4 n LYS 75 Ca -0.02 -1.93 -0.25 0.00 -2.02 0.00 0.00 58.31 54.09 3bz4 n LYS 75 Cb 0.36 -1.41 0.03 0.00 -0.02 0.00 0.00 35.03 34.00 3bz4 n LYS 75 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3bz4 n SER 76 N 1.17 -3.09 -4.06 4.39 7.64 -0.35 -4.86 113.62 114.47 3bz4 n SER 76 Ca 0.14 -0.79 -0.24 0.00 1.01 0.00 0.00 58.87 59.00 3bz4 n SER 76 Cb 0.52 -4.04 -0.16 0.00 -1.01 0.00 0.00 64.21 59.52 3bz4 n SER 76 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 3bz4 s ARG 77 N -6.28 1.58 -0.00 1.43 3.52 -1.03 -2.06 118.95 116.11 3bz4 s ARG 77 Ca 0.33 -0.46 0.01 0.00 -0.13 0.00 0.00 55.73 55.48 3bz4 s ARG 77 Cb -0.16 -1.36 -0.04 0.00 -1.56 0.00 0.00 34.95 31.83 3bz4 s ARG 77 CO 0.82 0.13 0.03 -1.17 -0.81 0.00 0.00 175.30 174.29 3bz4 s LEU 78 N 0.33 3.63 0.11 -0.88 2.96 -0.31 -0.53 118.68 123.99 3bz4 s LEU 78 Ca -0.08 0.04 0.06 0.00 -0.22 0.00 0.00 54.13 53.92 3bz4 s LEU 78 Cb -0.13 -2.09 -0.04 0.00 0.50 0.00 0.00 46.19 44.44 3bz4 s LEU 78 CO 0.03 0.28 -0.14 -0.31 -1.32 0.00 0.00 176.35 174.88 3bz4 s TYR 79 N -1.12 1.35 -0.09 5.38 2.02 0.11 -0.70 117.35 124.31 3bz4 s TYR 79 Ca 0.20 -0.55 -0.02 0.00 -0.37 0.00 0.00 57.07 56.34 3bz4 s TYR 79 Cb -0.12 -0.72 0.03 0.00 -0.40 0.00 0.00 41.96 40.76 3bz4 s TYR 79 CO 0.11 0.12 0.02 -1.17 -1.57 0.00 0.00 175.55 173.07 3bz4 s LEU 80 N -2.34 0.57 -0.24 -1.29 2.96 0.16 -2.26 118.68 116.24 3bz4 s LEU 80 Ca 0.07 -0.19 -0.12 0.00 -0.22 0.00 0.00 54.13 53.67 3bz4 s LEU 80 Cb -0.06 -0.40 -0.05 0.00 0.50 0.00 0.00 46.19 46.19 3bz4 s LEU 80 CO 0.03 -0.23 0.23 -1.58 -1.32 0.00 0.00 176.35 173.48 3bz4 s GLN 81 N 2.00 4.06 0.12 1.98 2.00 -0.11 -1.72 119.66 128.00 3bz4 s GLN 81 Ca 0.04 -0.16 0.09 0.00 -2.00 0.00 0.00 55.36 53.33 3bz4 s GLN 81 Cb -0.13 -3.57 -0.04 0.00 0.80 0.00 0.00 33.01 30.07 3bz4 s GLN 81 CO -0.05 -0.03 -0.23 -1.64 -0.50 0.00 0.00 175.29 172.84 3bz4 s MET 82 N 1.32 1.23 0.00 1.67 -1.94 0.07 -0.58 119.30 121.07 3bz4 s MET 82 Ca 0.10 -1.25 0.00 0.00 -1.71 0.00 0.00 55.69 52.83 3bz4 s MET 82 Cb -0.14 -1.55 0.00 0.00 2.01 0.00 0.00 34.83 35.14 3bz4 s MET 82 CO 0.07 0.36 0.00 -1.71 -0.01 0.00 0.00 175.02 173.73 3bz4 n ASN 82 N 0.94 0.00 -4.79 3.03 5.15 -1.12 -0.91 115.26 117.55 3bz4 n ASN 82 Ca -0.18 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.45 3bz4 n ASN 82 Cb 0.54 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.75 3bz4 n ASN 82 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3bz4 s LEU 82 N -1.30 3.98 0.34 1.20 1.43 -0.77 -4.63 118.68 118.94 3bz4 s LEU 82 Ca 0.00 1.94 0.10 0.00 -1.03 0.00 0.00 54.13 55.14 3bz4 s LEU 82 Cb 0.00 -4.40 -0.06 0.00 0.03 0.00 0.00 46.19 41.75 3bz4 s LEU 82 CO 0.00 -0.61 -0.08 -0.13 0.23 0.00 0.00 176.35 175.76 3bz4 s ARG 83 N -2.92 1.86 0.31 1.70 3.00 -1.26 0.04 118.95 121.68 3bz4 s ARG 83 Ca 0.63 -1.90 0.04 0.00 0.00 0.00 0.00 55.73 54.50 3bz4 s ARG 83 Cb -0.18 -1.74 0.67 0.00 0.00 0.00 0.00 34.95 33.69 3bz4 s ARG 83 CO 0.22 0.15 1.85 1.15 0.00 0.00 0.00 175.30 178.67 3bz4 h THR 84 N 2.00 0.88 0.00 0.02 2.02 -1.98 -0.85 112.91 115.01 3bz4 h THR 84 Ca -0.42 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.46 3bz4 h THR 84 Cb 1.25 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 3bz4 h THR 84 CO 0.69 0.16 0.00 -1.84 0.37 0.00 0.00 175.52 174.90 3bz4 n GLU 85 N -4.60 0.05 0.00 6.66 0.00 -1.26 -1.58 120.64 119.91 3bz4 n GLU 85 Ca 0.18 0.37 0.15 0.00 0.00 0.00 0.00 57.16 57.86 3bz4 n GLU 85 Cb 0.41 -1.62 0.71 0.00 0.00 0.00 0.00 31.44 30.94 3bz4 n GLU 85 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 3bz4 n ASP 86 N -1.72 0.19 -4.74 -1.84 8.00 -0.32 -4.86 116.55 111.26 3bz4 n ASP 86 Ca 0.02 -0.39 -0.42 0.00 0.71 0.00 0.00 54.79 54.71 3bz4 n ASP 86 Cb 0.13 -0.17 -0.02 0.00 -0.02 0.00 0.00 41.12 41.04 3bz4 n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3bz4 s THR 87 N -2.48 2.05 -2.54 -3.53 2.01 -0.62 -4.89 115.64 105.64 3bz4 s THR 87 Ca 0.30 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.34 3bz4 s THR 87 Cb 0.20 -3.03 0.00 0.00 0.01 0.00 0.00 72.50 69.69 3bz4 s THR 87 CO 0.46 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 175.01 3bz4 n GLY 88 N 2.50 -1.79 3.58 4.40 0.00 -0.49 -4.80 105.19 108.59 3bz4 n GLY 88 Ca 0.10 -1.12 -0.40 0.00 0.00 0.00 0.00 46.02 44.59 3bz4 n GLY 88 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3bz4 s ILE 89 N -2.34 5.08 -0.32 -0.61 -1.09 -0.49 -1.00 121.20 120.44 3bz4 s ILE 89 Ca 0.00 0.47 -0.14 0.00 -2.23 0.00 0.00 60.65 58.75 3bz4 s ILE 89 Cb 0.00 -3.86 -0.02 0.00 -1.58 0.00 0.00 42.46 37.00 3bz4 s ILE 89 CO 0.00 -0.05 0.34 -0.31 -1.23 0.00 0.00 174.94 173.68 3bz4 s TYR 90 N 2.26 3.22 -0.14 3.97 1.51 -0.14 -0.06 117.35 127.97 3bz4 s TYR 90 Ca 0.18 0.10 -0.06 0.00 -1.01 0.00 0.00 57.07 56.27 3bz4 s TYR 90 Cb -0.16 -2.60 -0.04 0.00 -0.11 0.00 0.00 41.96 39.05 3bz4 s TYR 90 CO 0.11 -0.34 0.08 0.71 -1.11 0.00 0.00 175.55 175.00 3bz4 s TYR 91 N 1.99 3.35 0.03 2.71 2.02 0.90 -1.49 117.35 126.85 3bz4 s TYR 91 Ca 0.12 0.26 -0.30 0.00 -0.37 0.00 0.00 57.07 56.77 3bz4 s TYR 91 Cb -0.16 -1.98 -0.05 0.00 -0.40 0.00 0.00 41.96 39.36 3bz4 s TYR 91 CO 0.11 0.41 1.25 0.00 -1.57 0.00 0.00 175.55 175.75 3bz4 s PHE 93 N 1.56 1.82 -0.72 0.00 5.36 0.15 -0.97 117.98 125.17 3bz4 s PHE 93 Ca 0.59 -1.15 -0.21 0.00 -0.96 0.00 0.00 56.93 55.20 3bz4 s PHE 93 Cb -0.29 -1.37 0.09 0.00 -0.34 0.00 0.00 43.02 41.11 3bz4 s PHE 93 CO 0.27 -0.63 0.98 -0.51 -1.46 0.00 0.00 175.22 173.87 3bz4 s LEU 94 N 1.60 4.65 0.23 6.12 1.02 -0.20 -1.00 118.68 131.09 3bz4 s LEU 94 Ca 0.01 -1.30 -0.31 0.00 0.02 0.00 0.00 54.13 52.54 3bz4 s LEU 94 Cb -0.15 -2.40 -0.11 0.00 0.02 0.00 0.00 46.19 43.54 3bz4 s LEU 94 CO -0.08 -1.32 1.65 -2.84 0.02 0.00 0.00 176.35 173.78 3bz4 s PRO 95 N 3.59 4.15 0.00 1.29 0.02 -1.26 -1.37 135.00 141.42 3bz4 s PRO 95 Ca 0.24 2.54 0.15 0.00 0.02 0.00 0.00 61.00 63.95 3bz4 s PRO 95 Cb -0.15 -3.08 0.30 0.00 0.02 0.00 0.00 34.50 31.60 3bz4 s PRO 95 CO 0.05 -0.68 1.20 -1.33 -0.33 0.00 0.00 177.00 175.91 3bz4 n MET 96 N 3.40 2.14 -0.03 5.54 2.81 -1.26 -4.81 117.12 124.91 3bz4 n MET 96 Ca 0.13 -1.92 0.06 0.00 -1.81 0.00 0.00 57.70 54.16 3bz4 n MET 96 Cb 0.37 -1.34 -0.16 0.00 -0.71 0.00 0.00 33.22 31.37 3bz4 n MET 96 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3bz4 n ASP 101 N 0.88 0.16 -4.05 7.83 8.00 -0.47 -4.99 116.55 123.91 3bz4 n ASP 101 Ca 0.13 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.42 3bz4 n ASP 101 Cb 0.45 1.74 -0.15 0.00 -0.02 0.00 0.00 41.12 43.13 3bz4 n ASP 101 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3bz4 s TYR 102 N -3.24 1.09 0.07 1.24 2.02 -1.09 -5.03 117.35 112.42 3bz4 s TYR 102 Ca -0.08 -0.24 0.10 0.00 -0.37 0.00 0.00 57.07 56.47 3bz4 s TYR 102 Cb 0.12 -0.73 -0.03 0.00 -0.40 0.00 0.00 41.96 40.91 3bz4 s TYR 102 CO 0.86 -0.06 -0.26 -1.58 -1.57 0.00 0.00 175.55 172.94 3bz4 s TRP 103 N -0.07 2.33 0.00 2.71 0.52 -1.26 -1.03 118.94 122.13 3bz4 s TRP 103 Ca 0.01 -0.40 0.00 0.00 0.02 0.00 0.00 56.10 55.73 3bz4 s TRP 103 Cb -0.07 -1.35 0.00 0.00 -1.15 0.00 0.00 33.47 30.91 3bz4 s TRP 103 CO 0.00 0.20 0.00 0.41 0.02 0.00 0.00 176.95 177.58 3bz4 n GLY 104 N 1.47 -0.65 0.06 0.98 0.00 -0.15 -4.72 105.19 102.19 3bz4 n GLY 104 Ca -0.17 -1.60 0.08 0.00 0.00 0.00 0.00 46.02 44.33 3bz4 n GLY 104 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3bz4 n GLN 105 N 0.00 0.64 0.00 1.61 1.13 -1.24 -4.93 117.38 114.59 3bz4 n GLN 105 Ca 0.00 -0.05 0.00 0.00 -1.94 0.00 0.00 57.00 55.01 3bz4 n GLN 105 Cb 0.00 -1.63 0.00 0.00 0.11 0.00 0.00 30.24 28.72 3bz4 n GLN 105 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3bz4 n GLY 106 N 1.30 -0.82 3.03 1.08 0.00 -1.26 -5.02 105.19 103.51 3bz4 n GLY 106 Ca -0.06 -1.45 -0.20 0.00 0.00 0.00 0.00 46.02 44.31 3bz4 n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3bz4 s THR 107 N -2.92 0.79 -0.06 2.61 -1.32 -0.56 -4.78 115.64 109.40 3bz4 s THR 107 Ca 0.00 -0.42 -0.20 0.00 -1.21 0.00 0.00 61.69 59.86 3bz4 s THR 107 Cb 0.00 -0.67 -0.04 0.00 -1.51 0.00 0.00 72.50 70.28 3bz4 s THR 107 CO 0.00 0.23 0.57 -0.55 -2.21 0.00 0.00 174.62 172.66 3bz4 s SER 108 N -0.17 6.86 -0.18 8.08 0.15 -1.26 -0.97 113.70 126.22 3bz4 s SER 108 Ca 0.03 1.03 0.00 0.00 0.70 0.00 0.00 55.95 57.71 3bz4 s SER 108 Cb -0.05 -2.34 0.01 0.00 -1.71 0.00 0.00 66.02 61.93 3bz4 s SER 108 CO -0.00 0.01 -0.17 -0.69 1.20 0.00 0.00 173.24 173.59 3bz4 s VAL 109 N 0.36 2.39 -0.18 4.45 1.01 -0.17 -1.20 120.40 127.05 3bz4 s VAL 109 Ca 0.31 -0.84 -0.04 0.00 0.00 0.00 0.00 61.98 61.41 3bz4 s VAL 109 Cb -0.17 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.18 3bz4 s VAL 109 CO 0.15 0.52 -0.04 -0.89 0.00 0.00 0.00 175.10 174.83 3bz4 s THR 110 N 1.17 3.67 -0.29 3.92 2.01 -0.11 -1.39 115.64 124.61 3bz4 s THR 110 Ca 0.02 -0.42 -0.06 0.00 0.31 0.00 0.00 61.69 61.54 3bz4 s THR 110 Cb -0.14 -2.63 0.02 0.00 0.01 0.00 0.00 72.50 69.76 3bz4 s THR 110 CO -0.07 0.46 0.06 -0.69 -0.69 0.00 0.00 174.62 173.69 3bz4 s VAL 111 N 0.78 3.74 -0.11 3.82 1.01 -1.26 -1.01 120.40 127.37 3bz4 s VAL 111 Ca -0.02 -0.81 -0.30 0.00 0.00 0.00 0.00 61.98 60.85 3bz4 s VAL 111 Cb -0.15 -2.95 0.11 0.00 0.00 0.00 0.00 36.38 33.39 3bz4 s VAL 111 CO 0.02 0.07 0.88 -0.55 0.00 0.00 0.00 175.10 175.51 3bz4 s SER 112 N 1.45 -0.47 0.00 3.32 0.15 -0.23 -4.49 113.70 113.44 3bz4 s SER 112 Ca 0.02 0.48 0.26 0.00 0.70 0.00 0.00 55.95 57.40 3bz4 s SER 112 Cb -0.17 0.39 0.57 0.00 -1.71 0.00 0.00 66.02 65.10 3bz4 s SER 112 CO 0.01 -0.46 1.46 -1.54 1.20 0.00 0.00 173.24 173.92 3bz4 n SER 113 N 0.71 1.86 -4.77 5.45 3.41 -1.26 -3.82 113.62 115.20 3bz4 n SER 113 Ca -0.13 -1.48 -0.33 0.00 -0.26 0.00 0.00 58.87 56.67 3bz4 n SER 113 Cb 0.58 0.12 0.05 0.00 -0.26 0.00 0.00 64.21 64.70 3bz4 n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3bz4 s ALA 114 N -2.20 2.45 0.04 7.33 0.00 -1.26 -5.03 121.76 123.08 3bz4 s ALA 114 Ca 0.29 0.51 -0.07 0.00 0.00 0.00 0.00 51.96 52.68 3bz4 s ALA 114 Cb 0.20 -3.31 -0.05 0.00 0.00 0.00 0.00 23.12 19.96 3bz4 s ALA 114 CO 0.41 -1.33 0.31 0.15 0.00 0.00 0.00 175.76 175.30 3bz4 s LYS 115 N -4.20 3.63 0.24 0.00 3.01 -1.26 -5.04 119.74 116.12 3bz4 s LYS 115 Ca 0.66 -0.01 -0.30 0.00 -1.01 0.00 0.00 55.97 55.31 3bz4 s LYS 115 Cb -0.20 -3.04 -0.10 0.00 -1.01 0.00 0.00 37.83 33.49 3bz4 s LYS 115 CO 0.43 0.61 1.39 0.99 0.51 0.00 0.00 175.35 179.28 3bz4 s THR 116 N -1.36 2.82 -0.02 2.17 2.01 -1.26 -4.73 115.64 115.27 3bz4 s THR 116 Ca 0.30 0.70 -0.00 0.00 0.31 0.00 0.00 61.69 63.00 3bz4 s THR 116 Cb -0.13 -3.44 0.03 0.00 0.01 0.00 0.00 72.50 68.96 3bz4 s THR 116 CO 0.18 0.11 0.03 -0.89 -0.69 0.00 0.00 174.62 173.36 3bz4 s THR 117 N -0.06 -0.01 0.56 -0.82 2.01 -0.18 -4.94 115.64 112.20 3bz4 s THR 117 Ca 0.58 0.20 -0.16 0.00 0.31 0.00 0.00 61.69 62.62 3bz4 s THR 117 Cb -0.40 -0.12 -0.05 0.00 0.01 0.00 0.00 72.50 71.93 3bz4 s THR 117 CO 0.42 0.11 1.03 -2.16 -0.69 0.00 0.00 174.62 173.33 3bz4 s PRO 118 N 1.12 3.57 0.61 4.92 0.04 -1.26 -1.50 135.00 142.51 3bz4 s PRO 118 Ca -0.08 1.12 -0.17 0.00 0.04 0.00 0.00 61.00 61.90 3bz4 s PRO 118 Cb -0.13 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.31 3bz4 s PRO 118 CO -0.03 -0.59 1.15 -1.25 0.04 0.00 0.00 177.00 176.32 3bz4 s PRO 119 N -4.03 2.96 -0.23 0.56 0.04 -1.26 -4.48 135.00 128.56 3bz4 s PRO 119 Ca 0.62 1.61 -0.09 0.00 0.04 0.00 0.00 61.00 63.19 3bz4 s PRO 119 Cb -0.14 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.41 3bz4 s PRO 119 CO 0.34 -1.17 0.11 -1.12 0.04 0.00 0.00 177.00 175.20 3bz4 s SER 120 N -2.00 5.73 -0.26 6.66 0.01 0.34 -4.92 113.70 119.26 3bz4 s SER 120 Ca 0.72 0.02 -0.05 0.00 1.31 0.00 0.00 55.95 57.95 3bz4 s SER 120 Cb -0.25 -2.02 -0.00 0.00 0.21 0.00 0.00 66.02 63.96 3bz4 s SER 120 CO 0.35 0.07 0.02 -0.69 0.41 0.00 0.00 173.24 173.39 3bz4 s VAL 121 N 1.03 3.69 -0.08 3.43 1.01 -1.26 -0.84 120.40 127.38 3bz4 s VAL 121 Ca 0.06 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.47 3bz4 s VAL 121 Cb -0.14 -2.80 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 3bz4 s VAL 121 CO 0.04 0.25 -0.10 -0.31 0.00 0.00 0.00 175.10 174.98 3bz4 s TYR 122 N 1.49 2.84 0.36 5.22 2.02 0.05 -4.95 117.35 124.39 3bz4 s TYR 122 Ca 0.04 -0.20 -0.26 0.00 -0.37 0.00 0.00 57.07 56.28 3bz4 s TYR 122 Cb -0.16 -1.73 -0.09 0.00 -0.40 0.00 0.00 41.96 39.58 3bz4 s TYR 122 CO -0.00 0.14 1.07 -1.25 -1.57 0.00 0.00 175.55 173.94 3bz4 s PRO 123 N -0.43 4.30 -0.37 -1.71 0.04 -1.26 -0.70 135.00 134.87 3bz4 s PRO 123 Ca 0.06 1.62 -0.04 0.00 0.04 0.00 0.00 61.00 62.68 3bz4 s PRO 123 Cb -0.12 -2.76 0.08 0.00 0.04 0.00 0.00 34.50 31.74 3bz4 s PRO 123 CO 0.02 -0.04 0.14 -0.51 0.04 0.00 0.00 177.00 176.65 3bz4 s LEU 124 N -2.25 4.71 0.07 -3.56 1.43 0.77 -4.83 118.68 115.02 3bz4 s LEU 124 Ca 0.54 -1.62 0.08 0.00 -1.03 0.00 0.00 54.13 52.10 3bz4 s LEU 124 Cb -0.26 -1.82 -0.03 0.00 0.03 0.00 0.00 46.19 44.11 3bz4 s LEU 124 CO 0.32 -0.43 -0.22 0.00 0.23 0.00 0.00 176.35 176.25 3bz4 s ALA 125 N 1.24 1.93 0.45 4.21 0.00 -1.26 -1.49 121.76 126.84 3bz4 s ALA 125 Ca 0.02 -1.20 -0.25 0.00 0.00 0.00 0.00 51.96 50.53 3bz4 s ALA 125 Cb -0.21 -0.34 -0.08 0.00 0.00 0.00 0.00 23.12 22.49 3bz4 s ALA 125 CO -0.02 0.42 1.42 -2.14 0.00 0.00 0.00 175.76 175.45 3bz4 s PRO 126 N -1.54 3.67 0.19 0.00 0.02 -1.26 -4.96 135.00 131.13 3bz4 s PRO 126 Ca 0.09 2.41 0.15 0.00 0.02 0.00 0.00 61.00 63.67 3bz4 s PRO 126 Cb -0.10 -2.65 0.77 0.00 0.02 0.00 0.00 34.50 32.55 3bz4 s PRO 126 CO 0.03 -0.82 1.47 0.41 -0.33 0.00 0.00 177.00 177.75 3bz4 n GLY 127 N 0.58 -0.83 0.00 0.52 0.00 -1.26 -4.54 105.19 99.66 3bz4 n GLY 127 Ca 0.05 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.18 3bz4 n GLY 127 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3bz4 n SER 136 N -1.98 0.00 -4.57 1.61 2.88 -1.26 -5.06 113.62 105.24 3bz4 n SER 136 Ca -0.00 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.29 3bz4 n SER 136 Cb 0.06 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.43 3bz4 n SER 136 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 3bz4 s MET 137 N -1.33 1.91 -0.02 -1.46 1.00 -1.26 -0.73 119.30 117.41 3bz4 s MET 137 Ca 0.00 -1.82 -0.01 0.00 0.00 0.00 0.00 55.69 53.86 3bz4 s MET 137 Cb 0.00 -1.82 0.01 0.00 0.00 0.00 0.00 34.83 33.03 3bz4 s MET 137 CO 0.00 0.18 0.03 0.54 0.00 0.00 0.00 175.02 175.78 3bz4 s VAL 138 N -2.55 -0.02 -0.22 -6.03 0.11 0.16 -4.51 120.40 107.34 3bz4 s VAL 138 Ca 0.33 0.06 -0.07 0.00 -2.93 0.00 0.00 61.98 59.37 3bz4 s VAL 138 Cb -0.00 -0.07 -0.03 0.00 -1.53 0.00 0.00 36.38 34.75 3bz4 s VAL 138 CO 0.17 0.03 0.07 -0.89 -3.33 0.00 0.00 175.10 171.15 3bz4 s THR 139 N 0.33 4.48 0.51 5.04 2.01 -1.26 -0.58 115.64 126.17 3bz4 s THR 139 Ca -0.03 -0.13 0.02 0.00 0.31 0.00 0.00 61.69 61.87 3bz4 s THR 139 Cb -0.04 -3.07 -0.01 0.00 0.01 0.00 0.00 72.50 69.40 3bz4 s THR 139 CO -0.01 0.38 0.05 -0.76 -0.69 0.00 0.00 174.62 173.59 3bz4 s LEU 140 N 1.16 2.36 0.11 4.42 1.43 0.32 -4.65 118.68 123.83 3bz4 s LEU 140 Ca 0.04 -1.60 -0.25 0.00 -1.03 0.00 0.00 54.13 51.29 3bz4 s LEU 140 Cb -0.14 -0.79 0.08 0.00 0.03 0.00 0.00 46.19 45.37 3bz4 s LEU 140 CO 0.03 -0.87 1.10 -0.83 0.23 0.00 0.00 176.35 176.01 3bz4 s GLY 141 N -3.92 -0.13 -0.03 -3.19 0.00 -0.56 -1.09 107.32 98.40 3bz4 s GLY 141 Ca 0.10 0.06 0.05 0.00 0.00 0.00 0.00 44.72 44.92 3bz4 s GLY 141 CO 0.05 1.64 -0.18 0.00 0.00 0.00 0.00 173.10 174.62 3bz4 s LEU 143 N -0.18 3.52 -0.31 0.00 2.96 0.12 -1.39 118.68 123.40 3bz4 s LEU 143 Ca 0.01 -0.05 0.03 0.00 -0.22 0.00 0.00 54.13 53.90 3bz4 s LEU 143 Cb -0.09 -1.88 0.08 0.00 0.50 0.00 0.00 46.19 44.80 3bz4 s LEU 143 CO 0.01 0.14 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.47 3bz4 s VAL 144 N 0.58 2.26 0.06 1.68 1.01 0.11 -0.77 120.40 125.33 3bz4 s VAL 144 Ca 0.01 -2.04 0.07 0.00 0.00 0.00 0.00 61.98 60.02 3bz4 s VAL 144 Cb -0.14 -2.53 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 3bz4 s VAL 144 CO 0.02 -0.36 -0.19 -0.75 0.00 0.00 0.00 175.10 173.82 3bz4 s LYS 145 N 0.99 1.22 -0.17 2.72 2.20 -0.02 -0.61 119.74 126.06 3bz4 s LYS 145 Ca 0.02 -0.95 -0.00 0.00 -0.36 0.00 0.00 55.97 54.68 3bz4 s LYS 145 Cb -0.19 -1.34 0.00 0.00 -1.51 0.00 0.00 37.83 34.78 3bz4 s LYS 145 CO -0.07 0.33 0.05 0.41 -0.36 0.00 0.00 175.35 175.72 3bz4 n GLY 146 N 1.68 0.48 3.62 5.54 0.00 -0.43 -0.51 105.19 115.58 3bz4 n GLY 146 Ca -0.18 -0.71 -0.23 0.00 0.00 0.00 0.00 46.02 44.90 3bz4 n GLY 146 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3bz4 s TYR 147 N -2.47 2.63 -0.25 1.61 1.13 -1.09 -4.57 117.35 114.34 3bz4 s TYR 147 Ca 0.02 -0.25 -0.26 0.00 -1.41 0.00 0.00 57.07 55.18 3bz4 s TYR 147 Cb -0.01 -1.17 0.09 0.00 -1.10 0.00 0.00 41.96 39.76 3bz4 s TYR 147 CO 0.03 0.63 0.81 0.12 -2.51 0.00 0.00 175.55 174.63 3bz4 s PHE 148 N -2.36 -0.68 0.88 -3.49 5.36 -0.56 0.64 117.98 117.76 3bz4 s PHE 148 Ca 0.31 1.60 -0.13 0.00 -0.96 0.00 0.00 56.93 57.76 3bz4 s PHE 148 Cb -0.06 0.31 0.15 0.00 -0.34 0.00 0.00 43.02 43.08 3bz4 s PHE 148 CO 0.19 -0.36 1.23 -1.25 -1.46 0.00 0.00 175.22 173.57 3bz4 s PRO 149 N 0.12 1.23 0.69 10.12 0.04 -1.26 -1.01 135.00 144.94 3bz4 s PRO 149 Ca -0.00 -0.30 -0.16 0.00 0.04 0.00 0.00 61.00 60.58 3bz4 s PRO 149 Cb -0.04 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.58 3bz4 s PRO 149 CO 0.00 -2.01 1.22 -1.21 0.04 0.00 0.00 177.00 175.04 3bz4 s GLU 150 N -5.69 2.36 0.39 4.56 0.41 -1.26 -4.73 118.70 114.74 3bz4 s GLU 150 Ca 0.69 1.81 0.07 0.00 -0.41 0.00 0.00 54.97 57.13 3bz4 s GLU 150 Cb -0.07 -1.85 0.00 0.00 -1.78 0.00 0.00 34.13 30.43 3bz4 s GLU 150 CO 0.50 -1.68 0.54 -1.25 -0.49 0.00 0.00 175.26 172.89 3bz4 s PRO 151 N -3.74 2.93 0.23 0.39 0.04 -1.26 -4.92 135.00 128.67 3bz4 s PRO 151 Ca 0.76 -1.14 0.11 0.00 0.04 0.00 0.00 61.00 60.77 3bz4 s PRO 151 Cb -0.30 -2.78 -0.05 0.00 0.04 0.00 0.00 34.50 31.41 3bz4 s PRO 151 CO 0.42 -0.16 -0.20 0.14 0.04 0.00 0.00 177.00 177.24 3bz4 s VAL 152 N -2.30 2.29 -0.21 -0.36 -7.23 -1.26 -4.06 120.40 107.27 3bz4 s VAL 152 Ca 0.51 -2.23 0.01 0.00 -1.81 0.00 0.00 61.98 58.47 3bz4 s VAL 152 Cb -0.10 -2.17 0.03 0.00 0.56 0.00 0.00 36.38 34.70 3bz4 s VAL 152 CO 0.32 -0.33 -0.16 -0.89 -0.31 0.00 0.00 175.10 173.73 3bz4 s THR 153 N -2.28 2.19 -0.17 5.32 2.01 -0.37 -4.97 115.64 117.37 3bz4 s THR 153 Ca 0.25 -1.13 -0.07 0.00 0.31 0.00 0.00 61.69 61.05 3bz4 s THR 153 Cb -0.05 -2.04 -0.04 0.00 0.01 0.00 0.00 72.50 70.37 3bz4 s THR 153 CO 0.12 0.35 0.06 -0.69 -0.69 0.00 0.00 174.62 173.77 3bz4 s VAL 154 N 1.25 4.78 0.34 3.82 1.01 -1.26 -1.51 120.40 128.82 3bz4 s VAL 154 Ca 0.01 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 61.99 3bz4 s VAL 154 Cb -0.15 -3.14 -0.06 0.00 0.00 0.00 0.00 36.38 33.03 3bz4 s VAL 154 CO -0.10 0.48 0.06 0.42 0.00 0.00 0.00 175.10 175.96 3bz4 s THR 155 N 0.23 1.14 -0.05 3.92 -4.23 -0.26 -4.99 115.64 111.41 3bz4 s THR 155 Ca 0.04 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.58 3bz4 s THR 155 Cb -0.12 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 70.99 3bz4 s THR 155 CO 0.00 0.00 -0.15 0.26 -0.54 0.00 0.00 174.62 174.20 3bz4 s TRP 156 N -3.26 1.55 -1.65 3.99 0.52 -1.26 -0.62 118.94 118.21 3bz4 s TRP 156 Ca 0.34 -0.47 -0.14 0.00 0.02 0.00 0.00 56.10 55.86 3bz4 s TRP 156 Cb 0.08 -1.07 0.12 0.00 -1.15 0.00 0.00 33.47 31.45 3bz4 s TRP 156 CO 0.15 -0.18 0.63 0.09 0.02 0.00 0.00 176.95 177.65 3bz4 n ASN 157 N 3.32 -2.18 -3.61 2.95 3.02 0.63 -1.70 115.26 117.70 3bz4 n ASN 157 Ca -0.19 -1.05 -0.26 0.00 -0.03 0.00 0.00 54.58 53.05 3bz4 n ASN 157 Cb 0.53 -2.62 0.05 0.00 -0.61 0.00 0.00 39.78 37.13 3bz4 n ASN 157 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3bz4 n SER 158 N -2.73 -5.81 0.00 6.41 7.64 -1.26 -2.34 113.62 115.53 3bz4 n SER 158 Ca -0.04 -0.57 0.00 0.00 1.01 0.00 0.00 58.87 59.27 3bz4 n SER 158 Cb 0.55 -4.61 0.00 0.00 -1.01 0.00 0.00 64.21 59.14 3bz4 n SER 158 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3bz4 n GLY 159 N -1.82 3.27 0.32 0.23 0.00 -0.69 -4.92 105.19 101.58 3bz4 n GLY 159 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.07 3bz4 n GLY 159 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3bz4 h SER 160 N 0.00 0.55 -3.25 1.61 0.02 -1.39 -3.36 113.55 107.73 3bz4 h SER 160 Ca 0.00 -0.01 -0.74 0.00 -0.84 0.00 0.00 61.79 60.20 3bz4 h SER 160 Cb 0.00 -0.13 -0.22 0.00 0.14 0.00 0.00 62.40 62.18 3bz4 h SER 160 CO 0.00 0.39 -0.26 -0.76 -1.14 0.00 0.00 176.83 175.06 3bz4 s LEU 161 N -9.57 5.66 -0.07 5.07 1.43 -0.82 -4.89 118.68 115.49 3bz4 s LEU 161 Ca -0.09 -1.37 0.03 0.00 -1.03 0.00 0.00 54.13 51.67 3bz4 s LEU 161 Cb 0.18 -2.22 -0.07 0.00 0.03 0.00 0.00 46.19 44.12 3bz4 s LEU 161 CO 0.75 -0.72 -0.02 -1.54 0.23 0.00 0.00 176.35 175.04 3bz4 n SER 162 N 5.33 3.41 -4.93 2.29 3.41 -1.26 -4.13 113.62 117.74 3bz4 n SER 162 Ca -0.12 -0.02 -0.27 0.00 -0.26 0.00 0.00 58.87 58.20 3bz4 n SER 162 Cb 0.43 0.27 -0.03 0.00 -0.26 0.00 0.00 64.21 64.62 3bz4 n SER 162 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3bz4 s SER 163 N -4.27 6.36 -0.20 4.04 0.01 -1.26 -4.14 113.70 114.25 3bz4 s SER 163 Ca -0.07 0.28 0.00 0.00 1.31 0.00 0.00 55.95 57.47 3bz4 s SER 163 Cb 0.02 -1.96 0.00 0.00 0.21 0.00 0.00 66.02 64.30 3bz4 s SER 163 CO 0.22 0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.51 3bz4 n GLY 164 N -0.52 0.54 3.28 3.44 0.00 -1.26 -4.68 105.19 105.98 3bz4 n GLY 164 Ca -0.06 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 3bz4 n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3bz4 s VAL 165 N -2.05 2.97 -0.09 1.61 1.01 -1.26 -1.19 120.40 121.40 3bz4 s VAL 165 Ca 0.00 -0.65 0.02 0.00 0.00 0.00 0.00 61.98 61.35 3bz4 s VAL 165 Cb 0.00 -2.30 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 3bz4 s VAL 165 CO 0.00 0.48 -0.14 -1.00 0.00 0.00 0.00 175.10 174.44 3bz4 s HIS 166 N 1.12 2.74 -0.14 5.22 3.76 -0.84 -4.99 115.29 122.16 3bz4 s HIS 166 Ca 0.01 -0.43 0.02 0.00 -0.15 0.00 0.00 55.06 54.50 3bz4 s HIS 166 Cb -0.14 -1.73 0.00 0.00 1.11 0.00 0.00 32.58 31.81 3bz4 s HIS 166 CO -0.03 -0.03 -0.19 0.99 -0.85 0.00 0.00 174.74 174.63 3bz4 s THR 167 N -0.17 2.41 0.31 1.30 2.01 -1.26 -0.23 115.64 120.01 3bz4 s THR 167 Ca -0.01 -0.87 -0.13 0.00 0.31 0.00 0.00 61.69 60.99 3bz4 s THR 167 Cb -0.13 -1.98 -0.08 0.00 0.01 0.00 0.00 72.50 70.31 3bz4 s THR 167 CO 0.03 0.54 0.69 -0.36 -0.69 0.00 0.00 174.62 174.83 3bz4 s PHE 168 N 0.65 3.40 0.42 4.92 0.40 -0.40 -5.01 117.98 122.36 3bz4 s PHE 168 Ca -0.10 1.10 -0.26 0.00 -0.60 0.00 0.00 56.93 57.07 3bz4 s PHE 168 Cb -0.16 -2.45 -0.10 0.00 0.51 0.00 0.00 43.02 40.83 3bz4 s PHE 168 CO 0.02 0.11 1.46 -2.30 0.70 0.00 0.00 175.22 175.21 3bz4 n PRO 169 N -0.46 2.46 -2.10 0.24 -0.02 -1.26 -4.52 135.00 129.34 3bz4 n PRO 169 Ca 0.03 0.87 -0.36 0.00 -2.02 0.00 0.00 63.50 62.01 3bz4 n PRO 169 Cb 0.53 -2.66 0.02 0.00 -0.02 0.00 0.00 33.50 31.37 3bz4 n PRO 169 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3bz4 s ALA 170 N -1.16 2.68 -0.07 3.55 0.00 -1.26 -4.83 121.76 120.68 3bz4 s ALA 170 Ca 0.58 0.98 0.04 0.00 0.00 0.00 0.00 51.96 53.55 3bz4 s ALA 170 Cb -0.46 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.22 3bz4 s ALA 170 CO 0.60 -0.99 -0.19 0.08 0.00 0.00 0.00 175.76 175.27 3bz4 s VAL 171 N -1.60 2.63 -0.12 0.00 1.01 -0.54 -4.94 120.40 116.83 3bz4 s VAL 171 Ca 0.73 -0.86 -0.13 0.00 0.00 0.00 0.00 61.98 61.72 3bz4 s VAL 171 Cb -0.29 -2.02 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 3bz4 s VAL 171 CO 0.33 0.57 0.29 -0.22 0.00 0.00 0.00 175.10 176.07 3bz4 s LEU 172 N -0.28 4.31 -0.13 3.92 2.96 -1.26 -1.38 118.68 126.82 3bz4 s LEU 172 Ca 0.01 0.59 -0.05 0.00 -0.22 0.00 0.00 54.13 54.46 3bz4 s LEU 172 Cb -0.13 -2.37 0.06 0.00 0.50 0.00 0.00 46.19 44.26 3bz4 s LEU 172 CO 0.03 0.19 0.27 -1.58 -1.32 0.00 0.00 176.35 173.94 3bz4 s GLN 173 N -0.09 0.16 -1.31 1.98 0.74 0.69 -4.92 119.66 116.91 3bz4 s GLN 173 Ca 0.18 0.75 -0.06 0.00 0.05 0.00 0.00 55.36 56.28 3bz4 s GLN 173 Cb -0.14 -0.02 0.01 0.00 1.10 0.00 0.00 33.01 33.97 3bz4 s GLN 173 CO 0.06 -0.28 1.09 0.43 -0.55 0.00 0.00 175.29 176.04 3bz4 n SER 174 N 5.30 -4.55 -0.20 6.67 7.64 -1.26 -1.94 113.62 125.28 3bz4 n SER 174 Ca -0.07 -0.59 -0.03 0.00 1.01 0.00 0.00 58.87 59.19 3bz4 n SER 174 Cb 0.50 -4.97 -0.01 0.00 -1.01 0.00 0.00 64.21 58.71 3bz4 n SER 174 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3bz4 n ASP 175 N -3.05 -3.87 -3.94 6.43 -0.08 -1.26 -4.99 116.55 105.78 3bz4 n ASP 175 Ca -0.11 0.07 -0.10 0.00 -1.51 0.00 0.00 54.79 53.14 3bz4 n ASP 175 Cb 0.60 -1.61 -0.12 0.00 2.34 0.00 0.00 41.12 42.34 3bz4 n ASP 175 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3bz4 s LEU 176 N -0.60 2.08 0.13 -2.67 1.43 -0.82 -4.75 118.68 113.48 3bz4 s LEU 176 Ca 0.00 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 52.77 3bz4 s LEU 176 Cb 0.00 0.16 -0.04 0.00 0.03 0.00 0.00 46.19 46.34 3bz4 s LEU 176 CO 0.00 -0.24 0.29 -0.31 0.23 0.00 0.00 176.35 176.32 3bz4 s TYR 177 N -1.10 3.50 -0.01 0.29 2.02 0.21 -0.22 117.35 122.03 3bz4 s TYR 177 Ca -0.12 0.24 0.02 0.00 -0.37 0.00 0.00 57.07 56.83 3bz4 s TYR 177 Cb -0.07 -1.76 -0.00 0.00 -0.40 0.00 0.00 41.96 39.73 3bz4 s TYR 177 CO -0.00 0.51 -0.06 0.99 -1.57 0.00 0.00 175.55 175.41 3bz4 s THR 178 N -1.68 0.50 0.20 -0.71 2.01 -0.48 -1.31 115.64 114.17 3bz4 s THR 178 Ca 0.36 -0.25 -0.02 0.00 0.31 0.00 0.00 61.69 62.09 3bz4 s THR 178 Cb -0.12 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.93 3bz4 s THR 178 CO 0.28 0.15 0.16 -1.48 -0.69 0.00 0.00 174.62 173.04 3bz4 s LEU 179 N -0.04 1.10 0.10 4.42 0.05 0.22 -1.47 118.68 123.06 3bz4 s LEU 179 Ca 0.01 -1.33 0.04 0.00 0.05 0.00 0.00 54.13 52.90 3bz4 s LEU 179 Cb -0.04 0.52 -0.04 0.00 -2.05 0.00 0.00 46.19 44.59 3bz4 s LEU 179 CO -0.00 -0.86 -0.10 -0.94 -0.55 0.00 0.00 176.35 173.90 3bz4 s SER 180 N -3.14 1.47 -0.03 1.48 1.04 -1.26 0.06 113.70 113.32 3bz4 s SER 180 Ca 0.36 -0.85 0.03 0.00 0.48 0.00 0.00 55.95 55.98 3bz4 s SER 180 Cb 0.06 0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.20 3bz4 s SER 180 CO 0.11 -0.28 -0.12 -0.55 0.98 0.00 0.00 173.24 173.38 3bz4 s SER 181 N -2.56 1.54 0.10 7.02 0.15 -0.49 -1.28 113.70 118.18 3bz4 s SER 181 Ca 0.07 -0.25 0.06 0.00 0.70 0.00 0.00 55.95 56.54 3bz4 s SER 181 Cb -0.02 -0.45 -0.04 0.00 -1.71 0.00 0.00 66.02 63.81 3bz4 s SER 181 CO -0.00 0.09 -0.06 -0.94 1.20 0.00 0.00 173.24 173.53 3bz4 s SER 182 N 0.19 4.64 -0.02 5.45 1.04 0.68 -1.28 113.70 124.42 3bz4 s SER 182 Ca -0.04 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.08 3bz4 s SER 182 Cb -0.10 -0.98 0.02 0.00 0.10 0.00 0.00 66.02 65.06 3bz4 s SER 182 CO 0.01 0.17 -0.00 0.54 0.98 0.00 0.00 173.24 174.94 3bz4 s VAL 183 N -1.27 0.13 -0.15 5.02 0.11 -0.25 -1.99 120.40 122.00 3bz4 s VAL 183 Ca 0.23 0.04 -0.00 0.00 -2.93 0.00 0.00 61.98 59.32 3bz4 s VAL 183 Cb -0.11 -0.19 -0.01 0.00 -1.53 0.00 0.00 36.38 34.54 3bz4 s VAL 183 CO 0.16 0.10 -0.13 -0.89 -3.33 0.00 0.00 175.10 171.00 3bz4 s THR 184 N 0.60 2.90 0.27 5.04 2.01 -0.33 -0.52 115.64 125.61 3bz4 s THR 184 Ca -0.06 -0.70 0.05 0.00 0.31 0.00 0.00 61.69 61.30 3bz4 s THR 184 Cb -0.09 -2.23 -0.06 0.00 0.01 0.00 0.00 72.50 70.14 3bz4 s THR 184 CO -0.01 0.51 -0.03 0.68 -0.69 0.00 0.00 174.62 175.07 3bz4 s VAL 185 N 0.68 1.42 0.24 3.82 -7.23 0.25 -4.63 120.40 114.95 3bz4 s VAL 185 Ca -0.07 -2.09 -0.30 0.00 -1.81 0.00 0.00 61.98 57.72 3bz4 s VAL 185 Cb -0.15 -2.43 -0.10 0.00 0.56 0.00 0.00 36.38 34.26 3bz4 s VAL 185 CO 0.02 -0.30 1.46 -2.84 -0.31 0.00 0.00 175.10 173.13 3bz4 s PRO 186 N -3.78 4.25 0.45 4.82 0.02 -1.26 0.38 135.00 139.88 3bz4 s PRO 186 Ca 0.29 2.32 0.18 0.00 0.02 0.00 0.00 61.00 63.82 3bz4 s PRO 186 Cb 0.05 -3.11 1.15 0.00 0.02 0.00 0.00 34.50 32.60 3bz4 s PRO 186 CO 0.11 -0.45 1.94 0.77 -0.33 0.00 0.00 177.00 179.04 3bz4 h SER 187 N 5.16 0.29 0.29 2.53 0.02 -1.16 -0.66 113.55 120.02 3bz4 h SER 187 Ca -0.46 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.50 3bz4 h SER 187 Cb 1.22 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.71 3bz4 h SER 187 CO 0.79 0.15 -0.06 0.77 -1.14 0.00 0.00 176.83 177.33 3bz4 h SER 188 N 0.31 0.00 1.00 3.07 4.64 -1.91 -3.14 113.55 117.51 3bz4 h SER 188 Ca 0.34 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.55 3bz4 h SER 188 Cb 0.91 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.98 3bz4 h SER 188 CO -0.09 0.06 -1.06 0.71 -0.87 0.00 0.00 176.83 175.58 3bz4 h THR 189 N 0.00 0.47 -4.03 2.95 1.35 -1.50 -3.44 112.91 108.72 3bz4 h THR 189 Ca -0.00 -1.82 -0.69 0.00 -0.55 0.00 0.00 66.41 63.35 3bz4 h THR 189 Cb 0.23 2.02 -0.29 0.00 -1.73 0.00 0.00 68.15 68.38 3bz4 h THR 189 CO 0.01 0.27 -0.85 0.86 -0.25 0.00 0.00 175.52 175.56 3bz4 s TRP 190 N -3.03 2.53 -2.14 4.73 -0.00 -1.19 0.15 118.94 120.00 3bz4 s TRP 190 Ca -0.00 -0.54 0.25 0.00 -0.00 0.00 0.00 56.10 55.80 3bz4 s TRP 190 Cb 0.08 -1.62 1.29 0.00 -0.00 0.00 0.00 33.47 33.22 3bz4 s TRP 190 CO 0.79 -0.10 1.85 -0.35 -0.00 0.00 0.00 176.95 179.14 3bz4 n PRO 191 N 2.79 1.25 -0.27 5.86 -0.04 -1.26 -4.89 135.00 138.43 3bz4 n PRO 191 Ca -0.17 -0.37 0.03 0.00 -0.04 0.00 0.00 63.50 62.95 3bz4 n PRO 191 Cb 0.52 -1.41 0.16 0.00 -0.04 0.00 0.00 33.50 32.73 3bz4 n PRO 191 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3bz4 h SER 192 N 0.81 0.59 -3.27 3.54 4.64 -1.79 -3.37 113.55 114.69 3bz4 h SER 192 Ca 0.00 0.06 -0.62 0.00 -0.47 0.00 0.00 61.79 60.76 3bz4 h SER 192 Cb 0.18 -0.05 -0.16 0.00 -0.31 0.00 0.00 62.40 62.05 3bz4 h SER 192 CO 0.00 0.33 -0.57 -1.61 -0.87 0.00 0.00 176.83 174.11 3bz4 s GLU 193 N -6.04 3.93 0.48 4.77 2.02 0.41 -5.08 118.70 119.19 3bz4 s GLU 193 Ca -0.12 -0.35 -0.22 0.00 0.02 0.00 0.00 54.97 54.30 3bz4 s GLU 193 Cb 0.19 -3.19 -0.07 0.00 0.10 0.00 0.00 34.13 31.16 3bz4 s GLU 193 CO 0.77 0.29 1.17 0.95 0.02 0.00 0.00 175.26 178.47 3bz4 s THR 194 N 0.30 3.06 -0.09 3.63 -4.23 -1.26 -4.48 115.64 112.58 3bz4 s THR 194 Ca 0.03 0.77 0.00 0.00 -1.18 0.00 0.00 61.69 61.31 3bz4 s THR 194 Cb -0.12 -3.37 0.02 0.00 1.34 0.00 0.00 72.50 70.36 3bz4 s THR 194 CO 0.00 -0.04 -0.07 -0.69 -0.54 0.00 0.00 174.62 173.28 3bz4 s VAL 195 N -1.58 0.89 -0.03 2.29 1.01 -1.26 -4.98 120.40 116.74 3bz4 s VAL 195 Ca 0.66 -0.24 -0.00 0.00 0.00 0.00 0.00 61.98 62.39 3bz4 s VAL 195 Cb -0.28 -0.90 0.03 0.00 0.00 0.00 0.00 36.38 35.23 3bz4 s VAL 195 CO 0.34 0.33 0.02 -0.89 0.00 0.00 0.00 175.10 174.90 3bz4 s THR 196 N 1.42 0.01 0.05 3.92 2.01 -1.26 -0.94 115.64 120.85 3bz4 s THR 196 Ca -0.01 0.21 -0.12 0.00 0.31 0.00 0.00 61.69 62.08 3bz4 s THR 196 Cb -0.13 -0.15 -0.06 0.00 0.01 0.00 0.00 72.50 72.17 3bz4 s THR 196 CO -0.04 0.12 0.41 0.00 -0.69 0.00 0.00 174.62 174.42 3bz4 s ASN 198 N -1.52 3.62 -0.17 0.00 -0.87 0.21 -1.18 114.94 115.02 3bz4 s ASN 198 Ca 0.30 -0.45 0.01 0.00 -1.57 0.00 0.00 52.86 51.15 3bz4 s ASN 198 Cb -0.15 -1.54 0.03 0.00 -0.02 0.00 0.00 41.25 39.57 3bz4 s ASN 198 CO 0.16 0.13 -0.15 -0.69 -2.57 0.00 0.00 177.10 173.98 3bz4 s VAL 199 N 0.54 1.76 -0.12 1.60 1.01 0.10 -1.10 120.40 124.19 3bz4 s VAL 199 Ca -0.11 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.01 3bz4 s VAL 199 Cb -0.16 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 3bz4 s VAL 199 CO 0.04 0.40 -0.05 0.00 0.00 0.00 0.00 175.10 175.49 3bz4 s ALA 200 N 1.39 2.99 -0.40 5.51 0.00 -0.57 -1.26 121.76 129.42 3bz4 s ALA 200 Ca 0.03 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.18 3bz4 s ALA 200 Cb -0.14 -1.43 0.11 0.00 0.00 0.00 0.00 23.12 21.66 3bz4 s ALA 200 CO -0.11 0.35 0.15 -1.58 0.00 0.00 0.00 175.76 174.58 3bz4 s HIS 201 N -0.08 2.91 0.26 0.00 2.46 -0.31 -1.23 115.29 119.29 3bz4 s HIS 201 Ca 0.01 -2.72 -0.02 0.00 0.47 0.00 0.00 55.06 52.80 3bz4 s HIS 201 Cb -0.13 -2.49 0.55 0.00 -0.13 0.00 0.00 32.58 30.38 3bz4 s HIS 201 CO 0.03 -0.85 1.68 -1.35 -2.47 0.00 0.00 174.74 171.78 3bz4 h PRO 202 N 7.23 0.26 0.00 2.88 0.11 -1.83 -1.81 132.00 138.84 3bz4 h PRO 202 Ca -0.06 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 3bz4 h PRO 202 Cb 0.97 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.01 3bz4 h PRO 202 CO 0.55 0.18 -0.07 0.00 -0.21 0.00 0.00 178.00 178.45 3bz4 h ALA 203 N 1.66 1.74 -0.16 -0.75 0.00 -1.89 -1.06 119.26 118.81 3bz4 h ALA 203 Ca 0.46 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.31 3bz4 h ALA 203 Cb 0.84 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3bz4 h ALA 203 CO -0.55 0.09 0.00 -1.13 0.00 0.00 0.00 179.25 177.66 3bz4 n SER 204 N -4.24 2.81 -3.49 0.00 3.41 -0.92 -4.88 113.62 106.31 3bz4 n SER 204 Ca -0.03 -1.84 -0.25 0.00 -0.26 0.00 0.00 58.87 56.49 3bz4 n SER 204 Cb 0.15 -0.09 0.04 0.00 -0.26 0.00 0.00 64.21 64.05 3bz4 n SER 204 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3bz4 n SER 205 N 1.11 -5.37 -4.44 4.04 7.64 -0.40 -4.97 113.62 111.22 3bz4 n SER 205 Ca 0.13 -0.51 -0.29 0.00 1.01 0.00 0.00 58.87 59.21 3bz4 n SER 205 Cb 0.49 -4.30 -0.12 0.00 -1.01 0.00 0.00 64.21 59.27 3bz4 n SER 205 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3bz4 s THR 206 N -3.20 2.57 -0.07 0.44 -4.23 -1.16 -5.02 115.64 104.97 3bz4 s THR 206 Ca 0.50 -1.64 -0.03 0.00 -1.18 0.00 0.00 61.69 59.34 3bz4 s THR 206 Cb -0.24 -2.17 0.04 0.00 1.34 0.00 0.00 72.50 71.48 3bz4 s THR 206 CO 0.62 0.09 0.15 -0.75 -0.54 0.00 0.00 174.62 174.19 3bz4 s LYS 207 N -2.13 0.07 0.04 3.99 2.20 -1.26 -1.17 119.74 121.49 3bz4 s LYS 207 Ca 0.16 0.44 0.06 0.00 -0.36 0.00 0.00 55.97 56.28 3bz4 s LYS 207 Cb -0.10 -0.21 -0.02 0.00 -1.51 0.00 0.00 37.83 35.98 3bz4 s LYS 207 CO 0.08 -0.22 -0.18 0.08 -0.36 0.00 0.00 175.35 174.76 3bz4 s VAL 208 N 1.58 1.43 -0.02 4.02 1.01 -0.39 -4.95 120.40 123.08 3bz4 s VAL 208 Ca -0.05 -1.11 0.03 0.00 0.00 0.00 0.00 61.98 60.85 3bz4 s VAL 208 Cb -0.12 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 3bz4 s VAL 208 CO -0.06 0.13 -0.09 -1.81 0.00 0.00 0.00 175.10 173.27 3bz4 s ASP 209 N -1.15 4.45 -0.20 3.32 1.01 -1.26 -0.72 116.67 122.13 3bz4 s ASP 209 Ca 0.05 -0.16 -0.02 0.00 0.71 0.00 0.00 52.55 53.14 3bz4 s ASP 209 Cb -0.08 -1.01 0.06 0.00 1.01 0.00 0.00 42.92 42.89 3bz4 s ASP 209 CO 0.02 0.31 0.01 -0.75 0.21 0.00 0.00 175.17 174.96 3bz4 s LYS 210 N -1.18 0.94 0.22 8.23 2.47 -0.32 -4.99 119.74 125.11 3bz4 s LYS 210 Ca 0.15 -0.54 -0.30 0.00 -1.56 0.00 0.00 55.97 53.72 3bz4 s LYS 210 Cb -0.11 -2.17 -0.08 0.00 -1.46 0.00 0.00 37.83 34.01 3bz4 s LYS 210 CO 0.05 -0.60 1.12 0.21 0.16 0.00 0.00 175.35 176.28 3bz4 s LYS 211 N 1.74 4.60 -0.29 4.03 2.20 -1.26 -1.39 119.74 129.36 3bz4 s LYS 211 Ca -0.02 1.78 -0.15 0.00 -0.36 0.00 0.00 55.97 57.22 3bz4 s LYS 211 Cb -0.17 -3.24 -0.03 0.00 -1.51 0.00 0.00 37.83 32.88 3bz4 s LYS 211 CO -0.07 0.10 0.39 0.42 -0.36 0.00 0.00 175.35 175.83 3bz4 s ILE 212 N -0.58 5.15 0.16 5.43 -1.09 -0.12 -4.88 121.20 125.27 3bz4 s ILE 212 Ca 0.48 0.45 0.10 0.00 -2.23 0.00 0.00 60.65 59.45 3bz4 s ILE 212 Cb -0.31 -3.76 -0.04 0.00 -1.58 0.00 0.00 42.46 36.77 3bz4 s ILE 212 CO 0.38 0.06 -0.23 0.68 -1.23 0.00 0.00 174.94 174.60 3bz4 s VAL 213 N 2.11 2.08 0.43 2.92 -7.23 -1.26 -4.56 120.40 114.88 3bz4 s VAL 213 Ca 0.15 -1.85 -0.24 0.00 -1.81 0.00 0.00 61.98 58.22 3bz4 s VAL 213 Cb -0.16 -1.92 -0.10 0.00 0.56 0.00 0.00 36.38 34.77 3bz4 s VAL 213 CO 0.11 -0.11 1.11 -2.65 -0.31 0.00 0.00 175.10 173.24 3bz4 n PRO 214 N 0.56 1.53 0.00 4.82 -0.02 -1.26 -4.85 135.00 135.78 3bz4 n PRO 214 Ca -0.15 0.55 0.15 0.00 -2.02 0.00 0.00 63.50 62.02 3bz4 n PRO 214 Cb 0.55 -2.18 0.88 0.00 -0.02 0.00 0.00 33.50 32.74 3bz4 n PRO 214 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02