#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oaz s VAL 2 N 0.00 2.98 -0.07 6.31 1.01 -1.26 -4.31 120.40 125.05 1oaz s VAL 2 Ca 0.00 0.69 -0.09 0.00 0.00 0.00 0.00 61.98 62.58 1oaz s VAL 2 Cb 0.00 -3.44 0.02 0.00 0.00 0.00 0.00 36.38 32.96 1oaz s VAL 2 CO 0.00 0.05 0.23 -1.10 0.00 0.00 0.00 175.10 174.28 1oaz s GLN 3 N 1.21 0.33 -0.23 2.72 -0.21 -1.07 -5.03 119.66 117.38 1oaz s GLN 3 Ca 0.67 0.21 0.01 0.00 0.02 0.00 0.00 55.36 56.27 1oaz s GLN 3 Cb -0.40 0.15 0.06 0.00 1.00 0.00 0.00 33.01 33.82 1oaz s GLN 3 CO 0.31 -0.05 -0.05 -0.51 -2.12 0.00 0.00 175.29 172.86 1oaz s LEU 4 N -0.14 2.46 -0.13 2.90 1.43 -1.26 -2.88 118.68 121.06 1oaz s LEU 4 Ca -0.03 -1.13 0.02 0.00 -1.03 0.00 0.00 54.13 51.97 1oaz s LEU 4 Cb -0.03 -1.14 0.00 0.00 0.03 0.00 0.00 46.19 45.05 1oaz s LEU 4 CO 0.01 -0.23 -0.21 -1.10 0.23 0.00 0.00 176.35 175.05 1oaz s GLN 5 N 1.43 3.09 0.47 1.70 -1.52 -1.02 -3.84 119.66 119.97 1oaz s GLN 5 Ca -0.05 -0.83 0.07 0.00 -1.95 0.00 0.00 55.36 52.60 1oaz s GLN 5 Cb -0.19 -2.44 0.01 0.00 -0.22 0.00 0.00 33.01 30.17 1oaz s GLN 5 CO -0.06 0.08 0.41 -0.65 -0.25 0.00 0.00 175.29 174.81 1oaz s GLN 6 N 0.61 2.40 1.05 2.91 -0.21 -1.26 -1.26 119.66 123.89 1oaz s GLN 6 Ca -0.11 -1.73 -0.12 0.00 0.02 0.00 0.00 55.36 53.41 1oaz s GLN 6 Cb -0.16 -2.28 0.22 0.00 1.00 0.00 0.00 33.01 31.79 1oaz s GLN 6 CO 0.03 -0.38 1.07 -1.54 -2.12 0.00 0.00 175.29 172.35 1oaz s SER 7 N -4.21 2.15 1.11 5.90 1.04 -1.22 -4.99 113.70 113.48 1oaz s SER 7 Ca 0.44 1.30 -0.18 0.00 0.48 0.00 0.00 55.95 57.99 1oaz s SER 7 Cb -0.02 -2.00 0.25 0.00 0.10 0.00 0.00 66.02 64.35 1oaz s SER 7 CO 0.26 -3.45 1.20 -0.83 0.98 0.00 0.00 173.24 171.41 1oaz s GLY 8 N -3.18 1.67 -0.33 7.32 0.00 -1.26 -4.65 107.32 106.89 1oaz s GLY 8 Ca 0.66 -1.07 -0.28 0.00 0.00 0.00 0.00 44.72 44.03 1oaz s GLY 8 CO 0.60 -0.22 1.82 0.00 0.00 0.00 0.00 173.10 175.29 1oaz s ALA 9 N -3.37 2.85 0.51 3.20 0.00 -1.26 -4.71 121.76 118.97 1oaz s ALA 9 Ca 0.72 0.27 -0.06 0.00 0.00 0.00 0.00 51.96 52.89 1oaz s ALA 9 Cb -0.07 -4.02 -0.03 0.00 0.00 0.00 0.00 23.12 19.00 1oaz s ALA 9 CO 0.55 -2.66 0.82 -1.21 0.00 0.00 0.00 175.76 173.26 1oaz s GLU 10 N 5.72 3.43 -0.09 0.00 0.41 -0.98 -5.02 118.70 122.16 1oaz s GLU 10 Ca 0.80 0.20 -0.03 0.00 -0.41 0.00 0.00 54.97 55.53 1oaz s GLU 10 Cb -0.23 -2.34 0.05 0.00 -1.78 0.00 0.00 34.13 29.83 1oaz s GLU 10 CO 0.33 -0.32 0.11 -1.17 -0.49 0.00 0.00 175.26 173.72 1oaz s LEU 11 N -4.82 0.11 0.06 1.80 0.20 -1.26 -3.49 118.68 111.29 1oaz s LEU 11 Ca 0.49 -0.03 0.03 0.00 0.69 0.00 0.00 54.13 55.31 1oaz s LEU 11 Cb -0.10 -0.01 -0.03 0.00 -0.43 0.00 0.00 46.19 45.62 1oaz s LEU 11 CO 0.46 -0.28 -0.09 0.68 -0.29 0.00 0.00 176.35 176.83 1oaz s VAL 12 N 2.21 0.72 0.40 1.68 -7.23 -1.12 -5.02 120.40 112.05 1oaz s VAL 12 Ca 0.04 -1.32 -0.14 0.00 -1.81 0.00 0.00 61.98 58.74 1oaz s VAL 12 Cb -0.13 -0.95 -0.08 0.00 0.56 0.00 0.00 36.38 35.78 1oaz s VAL 12 CO -0.06 -0.45 0.82 -0.54 -0.31 0.00 0.00 175.10 174.56 1oaz s LYS 13 N -2.10 3.94 0.27 4.82 1.02 -1.26 -1.91 119.74 124.52 1oaz s LYS 13 Ca -0.03 0.70 -0.29 0.00 0.02 0.00 0.00 55.97 56.36 1oaz s LYS 13 Cb -0.07 -2.34 -0.10 0.00 -0.52 0.00 0.00 37.83 34.81 1oaz s LYS 13 CO -0.00 -0.01 1.35 -2.14 -0.92 0.00 0.00 175.35 173.63 1oaz s PRO 14 N -3.51 4.33 0.00 -1.68 0.02 -1.26 -3.10 135.00 129.81 1oaz s PRO 14 Ca 0.55 2.21 0.00 0.00 0.02 0.00 0.00 61.00 63.77 1oaz s PRO 14 Cb -0.10 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 31.31 1oaz s PRO 14 CO 0.24 -0.28 0.00 0.41 -0.33 0.00 0.00 177.00 177.04 1oaz n GLY 15 N 1.66 2.70 2.78 0.52 0.00 -0.94 -4.93 105.19 106.98 1oaz n GLY 15 Ca 0.04 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.88 1oaz n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oaz n ALA 16 N -1.83 -0.11 -2.51 4.61 0.00 -1.18 -4.48 120.51 115.02 1oaz n ALA 16 Ca 0.00 -1.37 -0.25 0.00 0.00 0.00 0.00 53.44 51.82 1oaz n ALA 16 Cb 0.00 0.17 -0.10 0.00 0.00 0.00 0.00 19.45 19.52 1oaz n ALA 16 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1oaz s SER 17 N -4.04 3.63 -0.11 0.00 0.01 -1.26 -2.96 113.70 108.97 1oaz s SER 17 Ca 0.49 -1.12 -0.11 0.00 1.31 0.00 0.00 55.95 56.52 1oaz s SER 17 Cb -0.02 -0.32 0.03 0.00 0.21 0.00 0.00 66.02 65.92 1oaz s SER 17 CO 0.33 -0.10 0.31 0.54 0.41 0.00 0.00 173.24 174.74 1oaz s VAL 18 N -2.58 0.01 -0.24 3.43 0.11 -1.07 -5.02 120.40 115.04 1oaz s VAL 18 Ca 0.31 -0.04 -0.01 0.00 -2.93 0.00 0.00 61.98 59.30 1oaz s VAL 18 Cb -0.01 -0.46 0.02 0.00 -1.53 0.00 0.00 36.38 34.41 1oaz s VAL 18 CO 0.16 -0.02 -0.08 -0.75 -3.33 0.00 0.00 175.10 171.07 1oaz s LYS 19 N 0.04 2.89 -0.20 1.54 2.20 -1.26 -2.46 119.74 122.49 1oaz s LYS 19 Ca -0.01 -0.94 -0.09 0.00 -0.36 0.00 0.00 55.97 54.57 1oaz s LYS 19 Cb -0.02 -2.93 -0.05 0.00 -1.51 0.00 0.00 37.83 33.32 1oaz s LYS 19 CO 0.01 -0.36 0.10 -0.51 -0.36 0.00 0.00 175.35 174.23 1oaz s LEU 20 N 1.33 4.02 0.42 5.43 1.43 -1.15 -4.99 118.68 125.17 1oaz s LEU 20 Ca 0.01 0.15 0.07 0.00 -1.03 0.00 0.00 54.13 53.33 1oaz s LEU 20 Cb -0.16 -2.04 0.01 0.00 0.03 0.00 0.00 46.19 44.03 1oaz s LEU 20 CO -0.05 0.16 0.58 -0.94 0.23 0.00 0.00 176.35 176.32 1oaz s SER 21 N 0.47 5.68 -0.47 2.29 1.04 -1.26 -2.73 113.70 118.72 1oaz s SER 21 Ca 0.06 -0.31 0.06 0.00 0.48 0.00 0.00 55.95 56.24 1oaz s SER 21 Cb -0.12 -0.81 0.18 0.00 0.10 0.00 0.00 66.02 65.37 1oaz s SER 21 CO -0.00 -0.74 0.60 0.00 0.98 0.00 0.00 173.24 174.07 1oaz n LYS 23 N 3.29 2.49 -4.72 0.00 3.00 -0.39 -2.56 118.16 119.26 1oaz n LYS 23 Ca 0.19 0.90 -0.33 0.00 -0.00 0.00 0.00 58.31 59.07 1oaz n LYS 23 Cb 0.53 -2.75 -0.14 0.00 0.00 0.00 0.00 35.03 32.67 1oaz n LYS 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1oaz s ALA 24 N 2.50 2.70 0.13 3.14 0.00 -0.98 -2.43 121.76 126.82 1oaz s ALA 24 Ca 0.83 -0.89 -0.09 0.00 0.00 0.00 0.00 51.96 51.82 1oaz s ALA 24 Cb -0.58 -1.24 -0.00 0.00 0.00 0.00 0.00 23.12 21.29 1oaz s ALA 24 CO 0.40 0.29 0.24 -1.54 0.00 0.00 0.00 175.76 175.16 1oaz s SER 25 N 0.20 0.07 0.00 0.00 1.04 -1.14 -4.78 113.70 109.09 1oaz s SER 25 Ca -0.07 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1oaz s SER 25 Cb -0.15 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.36 1oaz s SER 25 CO 0.05 -0.82 0.00 0.61 0.98 0.00 0.00 173.24 174.06 1oaz n GLY 26 N -0.14 0.75 3.63 7.32 0.00 -1.26 -2.61 105.19 112.87 1oaz n GLY 26 Ca -0.11 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 1oaz n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1oaz s TYR 27 N -2.82 -0.34 -0.21 1.61 1.13 -1.26 -4.54 117.35 110.92 1oaz s TYR 27 Ca 0.00 0.04 -0.29 0.00 -1.41 0.00 0.00 57.07 55.41 1oaz s TYR 27 Cb 0.00 0.62 -0.03 0.00 -1.10 0.00 0.00 41.96 41.45 1oaz s TYR 27 CO 0.00 -0.94 1.67 0.99 -2.51 0.00 0.00 175.55 174.76 1oaz s THR 28 N -3.67 3.62 0.39 -3.49 2.01 -1.26 -4.89 115.64 108.35 1oaz s THR 28 Ca 0.06 0.69 0.07 0.00 0.31 0.00 0.00 61.69 62.83 1oaz s THR 28 Cb -0.03 -3.63 0.28 0.00 0.01 0.00 0.00 72.50 69.13 1oaz s THR 28 CO -0.04 -0.26 2.03 0.15 -0.69 0.00 0.00 174.62 175.81 1oaz h PHE 29 N 10.99 0.60 -0.31 4.92 3.57 -1.94 -2.81 116.94 131.95 1oaz h PHE 29 Ca -0.35 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.16 1oaz h PHE 29 Cb 1.16 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.70 1oaz h PHE 29 CO 0.91 0.36 0.00 0.25 -2.23 0.00 0.00 178.31 177.60 1oaz n THR 30 N -4.47 1.48 0.29 4.41 -2.24 -1.26 -3.82 114.28 108.67 1oaz n THR 30 Ca 0.06 -0.75 0.04 0.00 -2.27 0.00 0.00 64.05 61.13 1oaz n THR 30 Cb 0.12 -0.39 0.03 0.00 -2.10 0.00 0.00 70.33 67.99 1oaz n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1oaz n SER 31 N 0.33 1.61 -3.85 3.42 7.64 -1.06 -4.39 113.62 117.33 1oaz n SER 31 Ca 0.15 -1.31 -0.12 0.00 1.01 0.00 0.00 58.87 58.60 1oaz n SER 31 Cb 0.76 -0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.83 1oaz n SER 31 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1oaz s TYR 32 N -0.60 -0.08 1.07 1.43 1.51 -1.25 -4.92 117.35 114.52 1oaz s TYR 32 Ca 0.08 0.19 -0.12 0.00 -1.01 0.00 0.00 57.07 56.21 1oaz s TYR 32 Cb 0.06 0.02 0.23 0.00 -0.11 0.00 0.00 41.96 42.16 1oaz s TYR 32 CO 0.09 -0.06 1.06 -1.58 -1.11 0.00 0.00 175.55 173.95 1oaz s TRP 33 N -0.08 1.74 -0.31 2.71 0.51 -1.08 -4.39 118.94 118.06 1oaz s TRP 33 Ca -0.01 1.11 -0.00 0.00 -2.12 0.00 0.00 56.10 55.07 1oaz s TRP 33 Cb -0.01 -3.18 0.14 0.00 -0.81 0.00 0.00 33.47 29.60 1oaz s TRP 33 CO 0.00 -3.35 0.29 1.41 -0.51 0.00 0.00 176.95 174.79 1oaz s MET 34 N -4.72 0.38 0.84 4.98 1.75 -0.68 -2.88 119.30 118.96 1oaz s MET 34 Ca 0.67 -0.37 -0.12 0.00 -1.25 0.00 0.00 55.69 54.61 1oaz s MET 34 Cb -0.22 -0.75 0.10 0.00 2.84 0.00 0.00 34.83 36.80 1oaz s MET 34 CO 0.61 -1.07 1.19 -1.01 -0.65 0.00 0.00 175.02 174.09 1oaz s HIS 35 N 2.10 2.76 -0.02 4.11 3.76 -0.64 -2.68 115.29 124.68 1oaz s HIS 35 Ca 0.11 0.72 0.00 0.00 -0.15 0.00 0.00 55.06 55.74 1oaz s HIS 35 Cb -0.15 -3.55 0.02 0.00 1.11 0.00 0.00 32.58 30.02 1oaz s HIS 35 CO -0.26 -1.93 0.02 -1.58 -0.85 0.00 0.00 174.74 170.13 1oaz s TRP 36 N -3.58 0.05 0.17 1.40 0.52 -0.62 -2.58 118.94 114.31 1oaz s TRP 36 Ca 0.63 0.09 0.09 0.00 0.02 0.00 0.00 56.10 56.94 1oaz s TRP 36 Cb -0.11 -0.20 -0.04 0.00 -1.15 0.00 0.00 33.47 31.97 1oaz s TRP 36 CO 0.50 -0.07 -0.19 0.08 0.02 0.00 0.00 176.95 177.28 1oaz s VAL 37 N 0.86 1.91 -0.15 4.03 1.01 -1.07 -2.00 120.40 124.97 1oaz s VAL 37 Ca -0.07 -1.95 0.02 0.00 0.00 0.00 0.00 61.98 59.97 1oaz s VAL 37 Cb -0.10 -1.90 0.01 0.00 0.00 0.00 0.00 36.38 34.39 1oaz s VAL 37 CO -0.02 -0.30 -0.21 -0.75 0.00 0.00 0.00 175.10 173.82 1oaz s LYS 38 N -2.82 3.00 -0.30 2.72 2.20 -0.61 -2.34 119.74 121.59 1oaz s LYS 38 Ca 0.17 -0.84 0.02 0.00 -0.36 0.00 0.00 55.97 54.95 1oaz s LYS 38 Cb -0.06 -2.48 0.07 0.00 -1.51 0.00 0.00 37.83 33.85 1oaz s LYS 38 CO 0.07 -0.09 -0.03 -1.14 -0.36 0.00 0.00 175.35 173.81 1oaz s GLN 39 N 0.99 2.09 0.10 4.03 0.74 -1.08 -1.68 119.66 124.86 1oaz s GLN 39 Ca -0.03 -1.49 0.04 0.00 0.05 0.00 0.00 55.36 53.94 1oaz s GLN 39 Cb -0.15 -3.08 -0.04 0.00 1.10 0.00 0.00 33.01 30.84 1oaz s GLN 39 CO -0.06 -0.70 0.04 1.03 -0.55 0.00 0.00 175.29 175.05 1oaz s ARG 40 N 1.09 2.70 0.00 1.67 0.52 -1.26 -2.57 118.95 121.11 1oaz s ARG 40 Ca -0.02 -0.80 -0.33 0.00 -0.52 0.00 0.00 55.73 54.05 1oaz s ARG 40 Cb -0.20 -2.61 -0.12 0.00 0.52 0.00 0.00 34.95 32.54 1oaz s ARG 40 CO -0.05 0.54 1.82 -2.30 0.02 0.00 0.00 175.30 175.33 1oaz n PRO 41 N 0.40 2.31 -1.04 3.54 -0.02 -1.26 -2.21 135.00 136.72 1oaz n PRO 41 Ca -0.10 0.84 -0.02 0.00 -2.02 0.00 0.00 63.50 62.21 1oaz n PRO 41 Cb 0.52 -2.69 -0.01 0.00 -0.02 0.00 0.00 33.50 31.31 1oaz n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oaz n GLY 42 N 4.18 0.52 0.00 -1.23 0.00 -1.26 -4.87 105.19 102.53 1oaz n GLY 42 Ca 0.21 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1oaz n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oaz n ARG 43 N -2.59 0.84 0.00 1.61 3.00 -0.94 -5.11 116.66 113.47 1oaz n ARG 43 Ca -0.02 -0.31 0.00 0.00 -0.01 0.00 0.00 57.85 57.51 1oaz n ARG 43 Cb 0.10 -0.79 0.00 0.00 0.00 0.00 0.00 32.46 31.76 1oaz n ARG 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1oaz n GLY 44 N 0.21 2.99 3.39 -0.13 0.00 -1.24 -4.75 105.19 105.66 1oaz n GLY 44 Ca 0.00 -0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 1oaz n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oaz s LEU 45 N 0.00 2.51 -0.19 0.99 1.43 -1.26 -4.03 118.68 118.13 1oaz s LEU 45 Ca 0.00 -0.95 -0.04 0.00 -1.03 0.00 0.00 54.13 52.11 1oaz s LEU 45 Cb 0.00 -0.93 0.09 0.00 0.03 0.00 0.00 46.19 45.38 1oaz s LEU 45 CO 0.00 -0.01 0.27 -1.61 0.23 0.00 0.00 176.35 175.23 1oaz s GLU 46 N -3.17 0.21 0.14 1.70 2.02 -0.67 -4.96 118.70 113.98 1oaz s GLU 46 Ca 0.22 0.46 -0.31 0.00 0.02 0.00 0.00 54.97 55.37 1oaz s GLU 46 Cb -0.05 -0.65 -0.09 0.00 0.10 0.00 0.00 34.13 33.44 1oaz s GLU 46 CO 0.10 -0.53 1.43 -0.46 0.02 0.00 0.00 175.26 175.82 1oaz s TRP 47 N 2.41 3.19 -0.27 1.61 -0.00 -1.26 -1.58 118.94 123.04 1oaz s TRP 47 Ca 0.06 0.90 -0.08 0.00 -0.00 0.00 0.00 56.10 56.98 1oaz s TRP 47 Cb -0.14 -3.75 -0.13 0.00 -0.00 0.00 0.00 33.47 29.45 1oaz s TRP 47 CO -0.12 -2.61 -0.31 -0.89 -0.00 0.00 0.00 176.95 173.02 1oaz n ILE 48 N 3.72 1.48 0.00 5.86 5.41 -0.85 -4.61 119.36 130.37 1oaz n ILE 48 Ca 0.11 -0.44 0.00 0.00 1.00 0.00 0.00 62.75 63.42 1oaz n ILE 48 Cb 0.41 -1.71 0.00 0.00 -0.71 0.00 0.00 39.64 37.63 1oaz n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1oaz n GLY 49 N 1.63 0.66 3.32 7.39 0.00 -1.24 -2.45 105.19 114.50 1oaz n GLY 49 Ca -0.51 -1.02 -0.17 0.00 0.00 0.00 0.00 46.02 44.33 1oaz n GLY 49 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1oaz s ARG 50 N -2.00 1.28 -0.09 1.61 1.70 -0.71 -1.58 118.95 119.16 1oaz s ARG 50 Ca 0.00 -1.62 -0.05 0.00 -0.47 0.00 0.00 55.73 53.59 1oaz s ARG 50 Cb 0.00 -0.67 0.04 0.00 -0.57 0.00 0.00 34.95 33.75 1oaz s ARG 50 CO 0.00 -0.03 0.21 -1.50 -1.08 0.00 0.00 175.30 172.90 1oaz s ILE 51 N -3.35 -0.03 -0.39 4.99 2.07 -1.09 -2.84 121.20 120.56 1oaz s ILE 51 Ca 0.25 0.13 -0.23 0.00 -1.41 0.00 0.00 60.65 59.39 1oaz s ILE 51 Cb 0.04 -0.32 0.01 0.00 0.13 0.00 0.00 42.46 42.33 1oaz s ILE 51 CO 0.07 0.05 0.78 -0.62 -1.91 0.00 0.00 174.94 173.31 1oaz s ASP 52 N 1.00 6.51 0.44 4.50 2.15 -0.82 -1.68 116.67 128.76 1oaz s ASP 52 Ca -0.07 0.22 0.31 0.00 0.43 0.00 0.00 52.55 53.43 1oaz s ASP 52 Cb -0.09 -2.39 1.47 0.00 -0.30 0.00 0.00 42.92 41.61 1oaz s ASP 52 CO -0.06 -0.78 1.92 -0.65 -0.17 0.00 0.00 175.17 175.43 1oaz h PRO 53 N 8.63 0.00 -4.99 4.34 0.11 -1.86 -2.07 132.00 136.16 1oaz h PRO 53 Ca -0.25 0.00 -0.68 0.00 0.11 0.00 0.00 66.00 65.18 1oaz h PRO 53 Cb 1.09 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.02 1oaz h PRO 53 CO 0.92 0.00 0.59 1.21 -0.21 0.00 0.00 178.00 180.52 1oaz s ASN 54 N -4.75 6.45 0.00 -2.05 2.47 -1.26 -4.19 114.94 111.61 1oaz s ASN 54 Ca -0.00 -1.73 0.00 0.00 0.42 0.00 0.00 52.86 51.54 1oaz s ASN 54 Cb 0.09 -2.37 0.00 0.00 -1.45 0.00 0.00 41.25 37.52 1oaz s ASN 54 CO 0.38 -1.13 0.00 0.61 -3.72 0.00 0.00 177.10 173.24 1oaz n GLY 55 N 5.31 2.34 2.17 1.21 0.00 -1.26 -4.65 105.19 110.31 1oaz n GLY 55 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.05 1oaz n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oaz n GLY 56 N -0.56 0.14 3.75 -0.02 0.00 -0.78 -5.02 105.19 102.69 1oaz n GLY 56 Ca 0.00 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 45.10 1oaz n GLY 56 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1oaz s GLY 57 N -2.76 3.01 0.04 -0.02 0.00 -1.21 -4.89 107.32 101.49 1oaz s GLY 57 Ca 0.05 0.75 0.05 0.00 0.00 0.00 0.00 44.72 45.57 1oaz s GLY 57 CO 0.06 1.45 -0.15 -0.51 0.00 0.00 0.00 173.10 173.95 1oaz s THR 58 N -0.78 1.18 -0.01 0.90 -4.23 -1.26 -1.95 115.64 109.48 1oaz s THR 58 Ca 0.45 -1.02 0.03 0.00 -1.18 0.00 0.00 61.69 59.96 1oaz s THR 58 Cb -0.28 -1.06 -0.00 0.00 1.34 0.00 0.00 72.50 72.49 1oaz s THR 58 CO 0.35 0.03 -0.09 -0.54 -0.54 0.00 0.00 174.62 173.83 1oaz s LYS 59 N -1.15 0.81 0.14 3.99 -0.14 -1.13 -5.03 119.74 117.23 1oaz s LYS 59 Ca 0.02 -0.33 0.07 0.00 -1.36 0.00 0.00 55.97 54.38 1oaz s LYS 59 Cb -0.08 -0.78 -0.04 0.00 -1.68 0.00 0.00 37.83 35.25 1oaz s LYS 59 CO 0.01 0.18 -0.16 0.71 -0.76 0.00 0.00 175.35 175.33 1oaz s TYR 60 N -0.10 1.59 0.46 3.18 1.51 -1.26 -1.74 117.35 120.98 1oaz s TYR 60 Ca 0.02 -0.51 -0.24 0.00 -1.01 0.00 0.00 57.07 55.33 1oaz s TYR 60 Cb -0.05 -0.82 -0.07 0.00 -0.11 0.00 0.00 41.96 40.91 1oaz s TYR 60 CO -0.00 0.23 1.24 1.21 -1.11 0.00 0.00 175.55 177.12 1oaz s ASN 61 N -2.53 6.05 0.45 2.29 3.84 -1.02 -4.95 114.94 119.07 1oaz s ASN 61 Ca 0.12 2.50 0.12 0.00 0.21 0.00 0.00 52.86 55.81 1oaz s ASN 61 Cb -0.05 -2.62 1.01 0.00 -0.55 0.00 0.00 41.25 39.04 1oaz s ASN 61 CO 0.05 -1.01 2.04 -0.08 -2.79 0.00 0.00 177.10 175.30 1oaz h GLU 62 N 2.15 0.15 0.00 0.43 4.81 -1.93 -2.14 114.58 118.06 1oaz h GLU 62 Ca -0.50 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 58.62 1oaz h GLU 62 Cb 1.26 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.60 1oaz h GLU 62 CO 0.60 0.20 -0.42 -0.22 -0.73 0.00 0.00 179.01 178.44 1oaz h LYS 63 N 0.15 0.00 -0.27 1.92 3.64 -1.94 -3.31 116.57 116.77 1oaz h LYS 63 Ca 0.04 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.29 1oaz h LYS 63 Cb 0.16 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.91 1oaz h LYS 63 CO 0.01 0.42 -0.15 1.19 -2.27 0.00 0.00 179.45 178.65 1oaz n PHE 64 N -3.69 0.83 0.13 1.91 3.72 -0.83 -4.67 117.46 114.86 1oaz n PHE 64 Ca -0.01 -1.50 -0.24 0.00 -0.05 0.00 0.00 57.45 55.65 1oaz n PHE 64 Cb 0.51 -0.42 -0.16 0.00 -0.94 0.00 0.00 39.48 38.47 1oaz n PHE 64 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1oaz h LYS 65 N 1.02 0.50 0.00 -1.08 2.10 -1.58 -2.89 116.57 114.64 1oaz h LYS 65 Ca 0.15 -0.86 0.00 0.00 -2.00 0.00 0.00 60.65 57.94 1oaz h LYS 65 Cb 1.50 0.32 0.00 0.00 -0.90 0.00 0.00 32.23 33.15 1oaz h LYS 65 CO 0.29 1.41 -0.31 0.43 -2.00 0.00 0.00 179.45 179.27 1oaz n SER 66 N -3.75 0.50 -0.09 7.07 7.64 -1.26 -4.32 113.62 119.40 1oaz n SER 66 Ca -0.18 0.21 -0.17 0.00 1.01 0.00 0.00 58.87 59.74 1oaz n SER 66 Cb 1.07 -0.17 -0.08 0.00 -1.01 0.00 0.00 64.21 64.02 1oaz n SER 66 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1oaz n LYS 67 N -1.83 0.53 -3.95 1.43 3.00 -1.25 -4.82 118.16 111.28 1oaz n LYS 67 Ca 0.05 0.55 -0.23 0.00 -0.00 0.00 0.00 58.31 58.69 1oaz n LYS 67 Cb 0.39 -1.72 -0.02 0.00 0.00 0.00 0.00 35.03 33.67 1oaz n LYS 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1oaz s ALA 68 N -2.49 3.93 -0.32 3.14 0.00 -1.09 -2.36 121.76 122.58 1oaz s ALA 68 Ca -0.25 -1.16 0.01 0.00 0.00 0.00 0.00 51.96 50.56 1oaz s ALA 68 Cb 0.05 -1.76 0.14 0.00 0.00 0.00 0.00 23.12 21.56 1oaz s ALA 68 CO 0.47 0.32 0.33 0.99 0.00 0.00 0.00 175.76 177.87 1oaz s THR 69 N -1.92 -0.36 -0.14 0.00 2.01 -1.11 -4.83 115.64 109.29 1oaz s THR 69 Ca 0.34 -0.72 -0.27 0.00 0.31 0.00 0.00 61.69 61.35 1oaz s THR 69 Cb -0.10 -0.87 -0.01 0.00 0.01 0.00 0.00 72.50 71.53 1oaz s THR 69 CO 0.29 -0.53 0.92 -0.76 -0.69 0.00 0.00 174.62 173.85 1oaz s LEU 70 N 1.96 4.21 0.21 4.42 1.43 -1.26 -2.85 118.68 126.80 1oaz s LEU 70 Ca 0.13 1.35 0.01 0.00 -1.03 0.00 0.00 54.13 54.58 1oaz s LEU 70 Cb -0.15 -3.39 -0.05 0.00 0.03 0.00 0.00 46.19 42.63 1oaz s LEU 70 CO -0.20 -0.43 0.06 0.42 0.23 0.00 0.00 176.35 176.42 1oaz s THR 71 N 2.12 0.55 0.23 5.49 -4.23 -1.22 -4.96 115.64 113.61 1oaz s THR 71 Ca 0.43 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 58.98 1oaz s THR 71 Cb -0.17 -2.38 -0.05 0.00 1.34 0.00 0.00 72.50 71.24 1oaz s THR 71 CO 0.14 -0.23 0.03 0.68 -0.54 0.00 0.00 174.62 174.71 1oaz s VAL 72 N -3.76 0.82 -0.28 2.29 -7.23 -1.26 -1.36 120.40 109.62 1oaz s VAL 72 Ca 0.31 -2.01 -0.03 0.00 -1.81 0.00 0.00 61.98 58.45 1oaz s VAL 72 Cb 0.07 -2.37 0.09 0.00 0.56 0.00 0.00 36.38 34.73 1oaz s VAL 72 CO 0.09 -0.27 0.10 -0.62 -0.31 0.00 0.00 175.10 174.08 1oaz s ASP 73 N -3.28 3.57 0.20 4.85 2.15 -0.93 -5.01 116.67 118.23 1oaz s ASP 73 Ca 0.30 -1.32 -0.10 0.00 0.43 0.00 0.00 52.55 51.86 1oaz s ASP 73 Cb 0.06 -0.60 0.14 0.00 -0.30 0.00 0.00 42.92 42.23 1oaz s ASP 73 CO 0.09 -0.40 1.82 0.11 -0.17 0.00 0.00 175.17 176.62 1oaz h LYS 74 N 8.25 1.04 -0.13 4.34 1.57 -1.92 -0.88 116.57 128.85 1oaz h LYS 74 Ca -0.16 -0.12 0.04 0.00 -1.87 0.00 0.00 60.65 58.53 1oaz h LYS 74 Cb 1.04 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 33.11 1oaz h LYS 74 CO 0.43 0.78 -0.10 -1.35 -0.57 0.00 0.00 179.45 178.64 1oaz h PRO 75 N 1.03 -0.10 -0.01 3.15 0.11 -1.98 -3.01 132.00 131.18 1oaz h PRO 75 Ca 0.26 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.38 1oaz h PRO 75 Cb 0.04 0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.17 1oaz h PRO 75 CO -0.04 -0.07 -0.07 -1.13 -0.21 0.00 0.00 178.00 176.48 1oaz n SER 76 N -5.24 1.34 -1.95 -2.05 3.41 -1.17 -4.94 113.62 103.01 1oaz n SER 76 Ca -0.03 -1.31 -0.19 0.00 -0.26 0.00 0.00 58.87 57.07 1oaz n SER 76 Cb 0.16 0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.10 1oaz n SER 76 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1oaz n SER 77 N -0.08 -5.20 -4.55 4.04 7.64 -0.35 -4.69 113.62 110.44 1oaz n SER 77 Ca 0.17 0.26 -0.40 0.00 1.01 0.00 0.00 58.87 59.92 1oaz n SER 77 Cb 0.35 -4.49 -0.11 0.00 -1.01 0.00 0.00 64.21 58.95 1oaz n SER 77 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1oaz s THR 78 N -2.76 5.28 0.58 0.44 2.01 -1.08 -2.32 115.64 117.79 1oaz s THR 78 Ca 0.00 -0.08 -0.13 0.00 0.31 0.00 0.00 61.69 61.79 1oaz s THR 78 Cb 0.00 -3.67 -0.05 0.00 0.01 0.00 0.00 72.50 68.78 1oaz s THR 78 CO 0.00 0.06 1.01 0.00 -0.69 0.00 0.00 174.62 174.99 1oaz s ALA 79 N 1.76 3.10 0.08 7.40 0.00 -1.06 -2.19 121.76 130.85 1oaz s ALA 79 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 51.96 52.01 1oaz s ALA 79 Cb -0.17 -3.08 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 1oaz s ALA 79 CO 0.11 -0.51 0.01 0.71 0.00 0.00 0.00 175.76 176.08 1oaz s TYR 80 N -2.97 0.63 -0.30 0.00 2.02 -0.47 -1.73 117.35 114.55 1oaz s TYR 80 Ca 0.56 -1.11 -0.03 0.00 -0.37 0.00 0.00 57.07 56.12 1oaz s TYR 80 Cb -0.11 -0.41 0.18 0.00 -0.40 0.00 0.00 41.96 41.23 1oaz s TYR 80 CO 0.45 -0.44 0.63 1.41 -1.57 0.00 0.00 175.55 176.03 1oaz s MET 81 N -3.97 0.56 -0.41 -0.62 -2.45 -1.10 -3.42 119.30 107.88 1oaz s MET 81 Ca 0.14 1.06 -0.14 0.00 -1.25 0.00 0.00 55.69 55.50 1oaz s MET 81 Cb 0.08 0.60 0.03 0.00 1.25 0.00 0.00 34.83 36.79 1oaz s MET 81 CO -0.05 -0.53 0.29 -1.14 1.05 0.00 0.00 175.02 174.64 1oaz s GLN 82 N 2.87 2.94 -0.21 4.11 0.74 -1.13 -2.92 119.66 126.05 1oaz s GLN 82 Ca 0.15 -1.07 -0.21 0.00 0.05 0.00 0.00 55.36 54.28 1oaz s GLN 82 Cb -0.14 -3.95 -0.02 0.00 1.10 0.00 0.00 33.01 29.99 1oaz s GLN 82 CO -0.20 -0.78 0.66 -0.51 -0.55 0.00 0.00 175.29 173.91 1oaz s LEU 83 N 1.65 4.12 0.20 3.68 1.43 -1.03 -2.73 118.68 126.00 1oaz s LEU 83 Ca 0.04 0.85 0.09 0.00 -1.03 0.00 0.00 54.13 54.08 1oaz s LEU 83 Cb -0.20 -2.93 -0.04 0.00 0.03 0.00 0.00 46.19 43.05 1oaz s LEU 83 CO 0.09 -0.32 -0.09 -0.94 0.23 0.00 0.00 176.35 175.32 1oaz s SER 84 N 1.27 4.24 -1.01 2.29 1.04 -0.99 -2.60 113.70 117.93 1oaz s SER 84 Ca 0.29 -0.63 -0.11 0.00 0.48 0.00 0.00 55.95 55.98 1oaz s SER 84 Cb -0.16 -0.70 -0.02 0.00 0.10 0.00 0.00 66.02 65.24 1oaz s SER 84 CO 0.10 0.08 0.79 -1.20 0.98 0.00 0.00 173.24 173.99 1oaz n SER 85 N -0.15 -6.09 -4.75 7.02 7.64 -1.20 -4.86 113.62 111.22 1oaz n SER 85 Ca -0.10 -0.76 -0.41 0.00 1.01 0.00 0.00 58.87 58.62 1oaz n SER 85 Cb 0.56 -4.01 -0.03 0.00 -1.01 0.00 0.00 64.21 59.72 1oaz n SER 85 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1oaz s LEU 86 N -5.58 4.45 0.00 -3.43 1.43 -1.16 -4.77 118.68 109.62 1oaz s LEU 86 Ca 0.33 2.48 0.02 0.00 -1.03 0.00 0.00 54.13 55.92 1oaz s LEU 86 Cb -0.09 -3.63 -0.01 0.00 0.03 0.00 0.00 46.19 42.49 1oaz s LEU 86 CO 0.81 -0.45 0.06 0.35 0.23 0.00 0.00 176.35 177.35 1oaz n THR 87 N 1.67 0.00 0.26 5.49 -2.24 -1.26 -2.22 114.28 115.99 1oaz n THR 87 Ca 0.02 -1.55 0.15 0.00 -2.27 0.00 0.00 64.05 60.40 1oaz n THR 87 Cb 0.43 0.46 0.61 0.00 -2.10 0.00 0.00 70.33 69.73 1oaz n THR 87 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1oaz h SER 88 N 0.95 0.00 0.95 3.42 4.64 -1.97 -2.95 113.55 118.59 1oaz h SER 88 Ca -0.23 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.03 1oaz h SER 88 Cb 0.81 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 1oaz h SER 88 CO 0.38 0.05 -0.27 -0.33 -0.87 0.00 0.00 176.83 175.79 1oaz h GLU 89 N 0.00 0.00 -0.00 4.77 5.08 -1.96 -3.10 114.58 119.37 1oaz h GLU 89 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1oaz h GLU 89 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1oaz h GLU 89 CO 0.01 0.27 -0.00 -0.25 -1.00 0.00 0.00 179.01 178.04 1oaz n ASP 90 N -3.41 0.02 -4.55 1.42 8.00 -1.11 -4.75 116.55 112.16 1oaz n ASP 90 Ca 0.00 -0.55 -0.37 0.00 0.71 0.00 0.00 54.79 54.58 1oaz n ASP 90 Cb 0.47 -0.15 -0.03 0.00 -0.02 0.00 0.00 41.12 41.38 1oaz n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1oaz s SER 91 N -2.30 5.20 0.06 -2.24 0.01 -1.17 -4.89 113.70 108.36 1oaz s SER 91 Ca 0.38 0.27 -0.26 0.00 1.31 0.00 0.00 55.95 57.64 1oaz s SER 91 Cb 0.21 -2.53 0.08 0.00 0.21 0.00 0.00 66.02 63.99 1oaz s SER 91 CO 0.42 -2.46 0.70 0.00 0.41 0.00 0.00 173.24 172.31 1oaz s ALA 92 N 9.40 -1.70 -0.53 1.44 0.00 -1.05 -4.86 121.76 124.46 1oaz s ALA 92 Ca 0.69 0.84 -0.26 0.00 0.00 0.00 0.00 51.96 53.23 1oaz s ALA 92 Cb -0.12 0.51 0.03 0.00 0.00 0.00 0.00 23.12 23.54 1oaz s ALA 92 CO 0.19 -0.64 1.05 0.08 0.00 0.00 0.00 175.76 176.43 1oaz s VAL 93 N -2.92 4.26 -0.20 0.00 1.01 -1.06 -2.81 120.40 118.68 1oaz s VAL 93 Ca -0.01 0.72 -0.17 0.00 0.00 0.00 0.00 61.98 62.52 1oaz s VAL 93 Cb -0.01 -4.59 -0.04 0.00 0.00 0.00 0.00 36.38 31.75 1oaz s VAL 93 CO -0.06 -1.11 0.46 -0.31 0.00 0.00 0.00 175.10 174.08 1oaz s TYR 94 N 4.30 3.37 0.41 5.22 2.02 -1.06 -2.63 117.35 128.98 1oaz s TYR 94 Ca 0.38 0.70 0.08 0.00 -0.37 0.00 0.00 57.07 57.86 1oaz s TYR 94 Cb -0.10 -2.60 -0.01 0.00 -0.40 0.00 0.00 41.96 38.85 1oaz s TYR 94 CO 0.25 -0.06 0.47 0.71 -1.57 0.00 0.00 175.55 175.34 1oaz s TYR 95 N 1.50 2.80 -0.15 2.71 2.02 -0.99 -2.23 117.35 123.00 1oaz s TYR 95 Ca 0.22 -0.42 -0.01 0.00 -0.37 0.00 0.00 57.07 56.48 1oaz s TYR 95 Cb -0.15 -2.23 0.04 0.00 -0.40 0.00 0.00 41.96 39.22 1oaz s TYR 95 CO 0.09 -0.23 -0.01 0.00 -1.57 0.00 0.00 175.55 173.83 1oaz s ALA 97 N 1.78 3.96 0.02 0.00 0.00 -1.06 -2.83 121.76 123.63 1oaz s ALA 97 Ca 0.01 -1.23 0.04 0.00 0.00 0.00 0.00 51.96 50.78 1oaz s ALA 97 Cb -0.15 -1.81 -0.04 0.00 0.00 0.00 0.00 23.12 21.13 1oaz s ALA 97 CO -0.07 0.08 -0.06 0.50 0.00 0.00 0.00 175.76 176.20 1oaz s ARG 98 N -4.13 2.51 -0.04 0.00 3.52 -0.66 -1.62 118.95 118.54 1oaz s ARG 98 Ca 0.39 -0.76 0.02 0.00 -0.13 0.00 0.00 55.73 55.25 1oaz s ARG 98 Cb -0.09 -2.49 0.01 0.00 -1.56 0.00 0.00 34.95 30.81 1oaz s ARG 98 CO 0.31 0.59 -0.09 1.41 -0.81 0.00 0.00 175.30 176.71 1oaz s MET 99 N -1.60 1.07 -0.27 5.12 -2.45 -1.14 -3.04 119.30 116.98 1oaz s MET 99 Ca 0.19 -0.29 -0.21 0.00 -1.25 0.00 0.00 55.69 54.12 1oaz s MET 99 Cb -0.11 -0.98 -0.01 0.00 1.25 0.00 0.00 34.83 34.98 1oaz s MET 99 CO 0.09 0.06 0.68 -0.46 1.05 0.00 0.00 175.02 176.45 1oaz s TRP 100 N 0.40 3.26 -0.42 4.11 -0.11 -0.89 -2.62 118.94 122.67 1oaz s TRP 100 Ca -0.07 0.80 0.14 0.00 1.22 0.00 0.00 56.10 58.19 1oaz s TRP 100 Cb -0.11 -2.95 -0.17 0.00 -1.50 0.00 0.00 33.47 28.74 1oaz s TRP 100 CO 0.01 -0.40 0.48 2.48 -4.62 0.00 0.00 176.95 174.90 1oaz n TYR 101 N 5.86 0.00 -2.15 5.86 0.18 -1.23 -2.72 117.16 122.96 1oaz n TYR 101 Ca 0.01 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.40 1oaz n TYR 101 Cb 0.49 -0.11 -0.03 0.00 -0.38 0.00 0.00 39.34 39.30 1oaz n TYR 101 CO 0.00 0.00 0.00 0.71 -2.08 0.00 0.00 176.86 175.49 1oaz s TYR 102 N -2.52 1.81 0.00 -3.48 2.02 -1.26 -3.23 117.35 110.68 1oaz s TYR 102 Ca 0.01 0.58 0.00 0.00 -0.37 0.00 0.00 57.07 57.30 1oaz s TYR 102 Cb 0.10 -4.20 0.00 0.00 -0.40 0.00 0.00 41.96 37.45 1oaz s TYR 102 CO 0.56 -2.22 0.00 0.41 -1.57 0.00 0.00 175.55 172.73 1oaz n GLY 103 N 5.74 2.62 3.60 0.71 0.00 -1.26 -4.96 105.19 111.65 1oaz n GLY 103 Ca 0.18 -0.26 -0.09 0.00 0.00 0.00 0.00 46.02 45.86 1oaz n GLY 103 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1oaz s THR 104 N -1.36 0.01 -0.31 2.61 -1.32 -1.20 -5.15 115.64 108.92 1oaz s THR 104 Ca 0.00 -0.95 -0.02 0.00 -1.21 0.00 0.00 61.69 59.50 1oaz s THR 104 Cb 0.00 -1.79 0.05 0.00 -1.51 0.00 0.00 72.50 69.25 1oaz s THR 104 CO 0.00 -0.07 0.03 -0.31 -2.21 0.00 0.00 174.62 172.06 1oaz s TYR 105 N -3.91 3.30 -0.00 9.09 1.51 -1.25 -3.53 117.35 122.55 1oaz s TYR 105 Ca 0.12 -1.87 -0.01 0.00 -1.01 0.00 0.00 57.07 54.30 1oaz s TYR 105 Cb -0.02 -2.24 -0.00 0.00 -0.11 0.00 0.00 41.96 39.59 1oaz s TYR 105 CO 0.02 -0.81 0.02 1.52 -1.11 0.00 0.00 175.55 175.18 1oaz s TYR 106 N 1.26 0.06 0.66 2.71 -0.85 -1.10 -5.03 117.35 115.05 1oaz s TYR 106 Ca -0.03 -0.11 -0.09 0.00 -0.52 0.00 0.00 57.07 56.32 1oaz s TYR 106 Cb -0.20 -0.05 0.01 0.00 0.38 0.00 0.00 41.96 42.10 1oaz s TYR 106 CO -0.01 -0.08 1.01 -0.06 -1.52 0.00 0.00 175.55 174.89 1oaz s PHE 107 N -0.48 3.27 0.41 -3.49 0.08 -1.26 -2.10 117.98 114.41 1oaz s PHE 107 Ca -0.05 0.85 0.00 0.00 0.12 0.00 0.00 56.93 57.84 1oaz s PHE 107 Cb -0.03 -2.94 0.00 0.00 -0.57 0.00 0.00 43.02 39.48 1oaz s PHE 107 CO -0.00 -1.04 0.00 -0.40 -0.10 0.00 0.00 175.22 173.68 1oaz n ASP 108 N -2.82 -2.70 -4.37 1.36 5.68 -1.17 -4.94 116.55 107.58 1oaz n ASP 108 Ca 0.06 0.77 -0.34 0.00 -0.50 0.00 0.00 54.79 54.77 1oaz n ASP 108 Cb 0.58 2.60 -0.14 0.00 -1.14 0.00 0.00 41.12 43.02 1oaz n ASP 108 CO 0.00 0.00 0.00 -0.31 -1.33 0.00 0.00 177.20 175.56 1oaz s TYR 109 N -1.99 2.93 0.30 2.11 2.02 -1.26 -5.00 117.35 116.46 1oaz s TYR 109 Ca 0.00 -0.69 0.09 0.00 -0.37 0.00 0.00 57.07 56.10 1oaz s TYR 109 Cb 0.00 -1.99 -0.05 0.00 -0.40 0.00 0.00 41.96 39.52 1oaz s TYR 109 CO 0.00 -0.32 0.00 -1.58 -1.57 0.00 0.00 175.55 172.08 1oaz s TRP 110 N 0.87 2.61 0.58 2.71 0.52 -1.26 -1.65 118.94 123.31 1oaz s TRP 110 Ca -0.02 -0.33 -0.00 0.00 0.02 0.00 0.00 56.10 55.77 1oaz s TRP 110 Cb -0.15 -1.33 0.04 0.00 -1.15 0.00 0.00 33.47 30.88 1oaz s TRP 110 CO 0.01 0.54 0.83 0.20 0.02 0.00 0.00 176.95 178.55 1oaz s GLY 111 N -3.70 1.80 0.45 0.98 0.00 -1.13 -4.55 107.32 101.17 1oaz s GLY 111 Ca 0.33 -1.24 0.28 0.00 0.00 0.00 0.00 44.72 44.09 1oaz s GLY 111 CO 0.20 -0.93 1.79 0.06 0.00 0.00 0.00 173.10 174.21 1oaz h GLN 112 N -0.07 0.00 0.00 2.90 -0.00 -1.94 -3.45 115.11 112.54 1oaz h GLN 112 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.22 1oaz h GLN 112 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.78 1oaz h GLN 112 CO 0.54 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.78 1oaz n GLY 113 N 0.60 1.22 2.67 0.06 0.00 -1.26 -5.02 105.19 103.45 1oaz n GLY 113 Ca 0.03 -1.90 -0.27 0.00 0.00 0.00 0.00 46.02 43.88 1oaz n GLY 113 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1oaz s THR 114 N -2.38 0.18 -0.30 2.61 2.01 -0.95 -4.80 115.64 112.01 1oaz s THR 114 Ca 0.00 -0.34 -0.29 0.00 0.31 0.00 0.00 61.69 61.38 1oaz s THR 114 Cb 0.00 -0.77 -0.01 0.00 0.01 0.00 0.00 72.50 71.73 1oaz s THR 114 CO 0.00 -0.25 1.51 -0.89 -0.69 0.00 0.00 174.62 174.30 1oaz s THR 115 N 2.01 3.84 -0.17 -0.82 2.01 -1.26 -2.58 115.64 118.67 1oaz s THR 115 Ca 0.01 0.91 -0.06 0.00 0.31 0.00 0.00 61.69 62.86 1oaz s THR 115 Cb -0.16 -3.94 -0.03 0.00 0.01 0.00 0.00 72.50 68.37 1oaz s THR 115 CO -0.08 -0.47 0.01 -0.22 -0.69 0.00 0.00 174.62 173.17 1oaz s LEU 116 N 5.26 3.55 -0.22 4.42 2.96 -1.12 -2.33 118.68 131.20 1oaz s LEU 116 Ca 0.66 -0.02 0.01 0.00 -0.22 0.00 0.00 54.13 54.56 1oaz s LEU 116 Cb -0.20 -1.88 0.05 0.00 0.50 0.00 0.00 46.19 44.67 1oaz s LEU 116 CO 0.29 0.17 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.54 1oaz s THR 117 N 0.35 1.49 -0.95 3.68 2.01 -1.23 -2.54 115.64 118.46 1oaz s THR 117 Ca -0.00 -1.11 -0.20 0.00 0.31 0.00 0.00 61.69 60.68 1oaz s THR 117 Cb -0.13 -1.72 0.11 0.00 0.01 0.00 0.00 72.50 70.77 1oaz s THR 117 CO 0.01 -0.03 1.22 -0.69 -0.69 0.00 0.00 174.62 174.45 1oaz s VAL 118 N 1.43 4.48 -0.08 3.82 1.01 -1.26 -2.78 120.40 127.01 1oaz s VAL 118 Ca -0.04 -1.32 0.02 0.00 0.00 0.00 0.00 61.98 60.64 1oaz s VAL 118 Cb -0.18 -4.86 -0.02 0.00 0.00 0.00 0.00 36.38 31.31 1oaz s VAL 118 CO -0.07 -1.64 -0.12 -0.55 0.00 0.00 0.00 175.10 172.72 1oaz s SER 119 N 4.04 4.19 0.25 3.32 0.15 -0.80 -4.68 113.70 120.17 1oaz s SER 119 Ca 0.37 -0.19 -0.22 0.00 0.70 0.00 0.00 55.95 56.61 1oaz s SER 119 Cb -0.03 -1.14 -0.09 0.00 -1.71 0.00 0.00 66.02 63.05 1oaz s SER 119 CO -0.09 0.30 0.80 -0.94 1.20 0.00 0.00 173.24 174.50 1oaz s SER 120 N -0.44 7.16 -0.32 5.45 1.04 -1.26 -4.02 113.70 121.31 1oaz s SER 120 Ca 0.06 1.57 -0.29 0.00 0.48 0.00 0.00 55.95 57.76 1oaz s SER 120 Cb -0.12 -2.48 -0.00 0.00 0.10 0.00 0.00 66.02 63.52 1oaz s SER 120 CO 0.02 0.00 1.38 0.00 0.98 0.00 0.00 173.24 175.62 1oaz s ALA 121 N -1.54 3.26 -2.00 5.32 0.00 -1.26 -5.07 121.76 120.47 1oaz s ALA 121 Ca 0.45 0.08 0.21 0.00 0.00 0.00 0.00 51.96 52.70 1oaz s ALA 121 Cb -0.17 -3.83 1.23 0.00 0.00 0.00 0.00 23.12 20.35 1oaz s ALA 121 CO 0.22 -1.97 1.62 0.00 0.00 0.00 0.00 175.76 175.62