#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h7y s LEU 2 N 0.00 3.65 -0.07 3.17 1.43 -1.26 -3.62 118.68 121.97 1h7y s LEU 2 Ca 0.00 -0.46 0.02 0.00 -1.03 0.00 0.00 54.13 52.67 1h7y s LEU 2 Cb 0.00 -2.28 0.01 0.00 0.03 0.00 0.00 46.19 43.95 1h7y s LEU 2 CO 0.00 -0.36 -0.14 -0.76 0.23 0.00 0.00 176.35 175.32 1h7y s LEU 3 N -4.02 1.71 -0.34 1.79 1.43 -0.95 -2.33 118.68 115.98 1h7y s LEU 3 Ca 0.41 -0.34 -0.05 0.00 -1.03 0.00 0.00 54.13 53.12 1h7y s LEU 3 Cb -0.06 -0.93 0.05 0.00 0.03 0.00 0.00 46.19 45.28 1h7y s LEU 3 CO 0.27 0.05 0.08 -0.31 0.23 0.00 0.00 176.35 176.67 1h7y s TYR 4 N 0.65 3.29 0.33 0.29 1.51 0.20 -1.45 117.35 122.17 1h7y s TYR 4 Ca -0.15 -1.68 0.10 0.00 -1.01 0.00 0.00 57.07 54.33 1h7y s TYR 4 Cb -0.16 -2.34 -0.06 0.00 -0.11 0.00 0.00 41.96 39.30 1h7y s TYR 4 CO 0.04 -0.78 -0.04 0.15 -1.11 0.00 0.00 175.55 173.81 1h7y s LYS 5 N 1.33 1.98 0.52 -0.62 1.02 -1.21 -1.68 119.74 121.08 1h7y s LYS 5 Ca -0.02 -1.77 -0.18 0.00 0.02 0.00 0.00 55.97 54.02 1h7y s LYS 5 Cb -0.20 -1.87 -0.07 0.00 -0.52 0.00 0.00 37.83 35.17 1h7y s LYS 5 CO 0.01 0.18 1.02 0.34 -0.92 0.00 0.00 175.35 175.98 1h7y s ASP 6 N -3.66 6.28 0.00 2.83 -1.08 -1.26 -2.29 116.67 117.49 1h7y s ASP 6 Ca 0.33 1.80 0.20 0.00 -0.52 0.00 0.00 52.55 54.36 1h7y s ASP 6 Cb -0.01 -2.54 -0.05 0.00 -1.46 0.00 0.00 42.92 38.86 1h7y s ASP 6 CO 0.18 -0.83 0.95 0.52 0.52 0.00 0.00 175.17 176.51 1h7y n VAL 7 N -1.40 0.00 0.00 1.11 0.31 -1.26 -4.06 118.33 113.03 1h7y n VAL 7 Ca 0.08 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1h7y n VAL 7 Cb 0.53 1.18 0.00 0.00 -0.91 0.00 0.00 33.84 34.64 1h7y n VAL 7 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1h7y n ILE 8 N -0.38 0.00 -3.09 2.52 5.41 -1.26 -4.95 119.36 117.61 1h7y n ILE 8 Ca 0.07 0.04 -0.19 0.00 1.00 0.00 0.00 62.75 63.67 1h7y n ILE 8 Cb 0.39 -0.93 -0.03 0.00 -0.71 0.00 0.00 39.64 38.36 1h7y n ILE 8 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 1h7y n SER 9 N -1.46 -0.35 0.04 4.38 7.64 -1.26 -4.97 113.62 117.64 1h7y n SER 9 Ca 0.00 -2.92 0.00 0.00 1.01 0.00 0.00 58.87 56.96 1h7y n SER 9 Cb 0.00 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 1h7y n SER 9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1h7y n GLY 10 N 1.16 -0.12 2.28 0.23 0.00 -1.26 -4.67 105.19 102.81 1h7y n GLY 10 Ca 0.19 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.19 1h7y n GLY 10 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1h7y n ASP 11 N -2.92 -3.92 0.00 1.61 -0.08 -1.26 -4.88 116.55 105.10 1h7y n ASP 11 Ca 0.00 0.05 0.00 0.00 -1.51 0.00 0.00 54.79 53.33 1h7y n ASP 11 Cb 0.00 -1.62 0.00 0.00 2.34 0.00 0.00 41.12 41.84 1h7y n ASP 11 CO 0.00 0.00 0.00 -1.84 0.12 0.00 0.00 177.20 175.48 1h7y n GLU 12 N -2.05 0.00 0.05 -0.67 0.28 -1.26 -4.89 120.64 112.09 1h7y n GLU 12 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.98 1h7y n GLU 12 Cb 0.18 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.05 1h7y n GLU 12 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1h7y n LEU 13 N 0.00 0.25 -3.90 -1.84 4.77 -1.21 -4.79 117.00 110.28 1h7y n LEU 13 Ca 0.00 0.16 -0.08 0.00 -0.03 0.00 0.00 56.01 56.06 1h7y n LEU 13 Cb 0.00 0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 1h7y n LEU 13 CO 0.00 -0.64 0.38 0.54 -1.33 0.00 0.00 177.39 176.34 1h7y s VAL 14 N -1.50 0.00 0.24 4.08 0.11 -0.67 -4.94 120.40 117.72 1h7y s VAL 14 Ca 0.00 -1.13 -0.06 0.00 -2.93 0.00 0.00 61.98 57.86 1h7y s VAL 14 Cb 0.00 -2.13 0.02 0.00 -1.53 0.00 0.00 36.38 32.74 1h7y s VAL 14 CO 0.00 0.00 0.42 -1.54 -3.33 0.00 0.00 175.10 170.65 1h7y n SER 15 N -0.52 -1.21 -0.19 3.54 3.41 -1.26 -0.63 113.62 116.77 1h7y n SER 15 Ca -0.03 -2.10 0.01 0.00 -0.26 0.00 0.00 58.87 56.49 1h7y n SER 15 Cb 0.60 2.09 0.04 0.00 -0.26 0.00 0.00 64.21 66.67 1h7y n SER 15 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1h7y n ASP 16 N -1.54 0.52 0.01 4.04 -0.08 -0.98 -3.78 116.55 114.74 1h7y n ASP 16 Ca -0.03 -2.01 0.05 0.00 -1.51 0.00 0.00 54.79 51.29 1h7y n ASP 16 Cb 0.38 -0.09 0.21 0.00 2.34 0.00 0.00 41.12 43.95 1h7y n ASP 16 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1h7y n ALA 17 N -0.23 1.40 -1.50 -1.67 0.00 -1.26 -1.75 120.51 115.50 1h7y n ALA 17 Ca 0.03 -0.02 0.06 0.00 0.00 0.00 0.00 53.44 53.51 1h7y n ALA 17 Cb 0.09 -1.15 0.10 0.00 0.00 0.00 0.00 19.45 18.48 1h7y n ALA 17 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1h7y n TYR 18 N -1.54 0.00 -1.34 0.00 4.02 -1.25 -5.09 117.16 111.96 1h7y n TYR 18 Ca 0.02 -0.71 0.00 0.00 -0.01 0.00 0.00 57.90 57.20 1h7y n TYR 18 Cb 0.11 -0.13 0.00 0.00 -0.02 0.00 0.00 39.34 39.30 1h7y n TYR 18 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1h7y n ASP 19 N -0.84 -7.37 -4.24 7.72 -0.08 -0.72 -3.35 116.55 107.68 1h7y n ASP 19 Ca 0.11 0.97 -0.23 0.00 -1.51 0.00 0.00 54.79 54.13 1h7y n ASP 19 Cb 0.70 -3.37 -0.13 0.00 2.34 0.00 0.00 41.12 40.65 1h7y n ASP 19 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1h7y s LEU 20 N -1.80 2.25 -0.06 -2.67 1.43 -1.26 -3.30 118.68 113.27 1h7y s LEU 20 Ca 0.00 -0.61 0.04 0.00 -1.03 0.00 0.00 54.13 52.53 1h7y s LEU 20 Cb 0.00 -0.78 -0.00 0.00 0.03 0.00 0.00 46.19 45.43 1h7y s LEU 20 CO 0.00 0.05 -0.19 -0.54 0.23 0.00 0.00 176.35 175.89 1h7y s LYS 21 N -1.63 2.20 -0.24 1.70 -0.14 -0.78 -4.90 119.74 115.95 1h7y s LYS 21 Ca 0.04 -0.69 -0.15 0.00 -1.36 0.00 0.00 55.97 53.81 1h7y s LYS 21 Cb -0.09 -1.81 -0.04 0.00 -1.68 0.00 0.00 37.83 34.20 1h7y s LYS 21 CO 0.03 0.22 0.36 -2.00 -0.76 0.00 0.00 175.35 173.19 1h7y s GLU 22 N 0.18 4.08 0.27 1.68 2.12 -1.26 -1.46 118.70 124.31 1h7y s GLU 22 Ca -0.09 0.06 0.01 0.00 0.36 0.00 0.00 54.97 55.31 1h7y s GLU 22 Cb -0.14 -3.60 -0.04 0.00 0.26 0.00 0.00 34.13 30.61 1h7y s GLU 22 CO 0.04 -0.15 0.46 0.08 -0.54 0.00 0.00 175.26 175.15 1h7y s VAL 23 N 1.68 5.17 -0.92 3.70 1.01 -0.73 -4.95 120.40 125.36 1h7y s VAL 23 Ca 0.16 -0.54 0.08 0.00 0.00 0.00 0.00 61.98 61.68 1h7y s VAL 23 Cb -0.15 -3.82 0.07 0.00 0.00 0.00 0.00 36.38 32.48 1h7y s VAL 23 CO 0.09 -0.38 1.25 -0.67 0.00 0.00 0.00 175.10 175.38 1h7y n ASP 24 N -1.32 0.07 0.00 3.32 -0.08 -1.26 -1.46 116.55 115.82 1h7y n ASP 24 Ca -0.06 0.53 0.12 0.00 -1.51 0.00 0.00 54.79 53.86 1h7y n ASP 24 Cb 0.56 -0.54 0.69 0.00 2.34 0.00 0.00 41.12 44.16 1h7y n ASP 24 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1h7y n ASP 25 N -1.58 0.00 -0.49 1.67 8.00 -1.26 -4.82 116.55 118.06 1h7y n ASP 25 Ca 0.01 -0.97 -0.05 0.00 0.71 0.00 0.00 54.79 54.50 1h7y n ASP 25 Cb 0.07 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.16 1h7y n ASP 25 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 1h7y n ILE 26 N -0.93 -0.14 -4.43 0.53 -5.35 -0.54 -4.93 119.36 103.59 1h7y n ILE 26 Ca 0.17 0.00 -0.26 0.00 -0.27 0.00 0.00 62.75 62.40 1h7y n ILE 26 Cb 0.08 -0.99 -0.11 0.00 -1.74 0.00 0.00 39.64 36.88 1h7y n ILE 26 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1h7y s VAL 27 N -2.22 2.51 0.20 7.28 -7.23 -1.24 -2.34 120.40 117.35 1h7y s VAL 27 Ca 0.00 -2.14 0.07 0.00 -1.81 0.00 0.00 61.98 58.10 1h7y s VAL 27 Cb 0.00 -2.25 -0.04 0.00 0.56 0.00 0.00 36.38 34.65 1h7y s VAL 27 CO 0.00 -0.23 0.11 -0.31 -0.31 0.00 0.00 175.10 174.36 1h7y s TYR 28 N -2.01 3.02 -0.13 2.82 2.02 -0.62 -1.78 117.35 120.68 1h7y s TYR 28 Ca 0.25 -0.09 -0.01 0.00 -0.37 0.00 0.00 57.07 56.85 1h7y s TYR 28 Cb -0.07 -1.41 0.03 0.00 -0.40 0.00 0.00 41.96 40.11 1h7y s TYR 28 CO 0.12 0.53 -0.05 -1.21 -1.57 0.00 0.00 175.55 173.38 1h7y s GLU 29 N -3.36 1.32 -0.29 -0.62 2.02 -0.54 -1.23 118.70 115.99 1h7y s GLU 29 Ca 0.31 -0.31 -0.05 0.00 0.02 0.00 0.00 54.97 54.93 1h7y s GLU 29 Cb -0.09 -1.69 0.02 0.00 0.10 0.00 0.00 34.13 32.47 1h7y s GLU 29 CO 0.22 -0.36 0.05 0.00 0.02 0.00 0.00 175.26 175.20 1h7y s ALA 30 N 1.73 2.97 0.44 5.21 0.00 -0.97 -1.87 121.76 129.27 1h7y s ALA 30 Ca 0.03 -1.50 -0.25 0.00 0.00 0.00 0.00 51.96 50.24 1h7y s ALA 30 Cb -0.14 -2.05 -0.09 0.00 0.00 0.00 0.00 23.12 20.84 1h7y s ALA 30 CO -0.08 -0.96 1.30 -3.47 0.00 0.00 0.00 175.76 172.55 1h7y n ASP 31 N 4.81 2.63 -4.98 0.00 2.03 -1.21 -3.22 116.55 116.62 1h7y n ASP 31 Ca -0.15 1.09 -0.20 0.00 0.52 0.00 0.00 54.79 56.05 1h7y n ASP 31 Cb 0.47 -1.52 0.02 0.00 -0.72 0.00 0.00 41.12 39.37 1h7y n ASP 31 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1h7y s GLN 33 N -4.40 0.42 -0.12 0.00 0.74 -1.26 -4.74 119.66 110.29 1h7y s GLN 33 Ca 0.53 -0.72 0.00 0.00 0.05 0.00 0.00 55.36 55.23 1h7y s GLN 33 Cb -0.06 -0.03 -0.01 0.00 1.10 0.00 0.00 33.01 34.00 1h7y s GLN 33 CO 0.32 -0.02 -0.14 -1.64 -0.55 0.00 0.00 175.29 173.27 1h7y s MET 34 N -1.71 3.28 -0.03 1.67 -1.94 -1.26 -0.73 119.30 118.59 1h7y s MET 34 Ca -0.12 -0.70 0.01 0.00 -1.71 0.00 0.00 55.69 53.17 1h7y s MET 34 Cb -0.09 -2.58 0.02 0.00 2.01 0.00 0.00 34.83 34.19 1h7y s MET 34 CO -0.01 0.25 -0.01 0.14 -0.01 0.00 0.00 175.02 175.37 1h7y s VAL 35 N 0.25 0.27 -0.39 -6.03 -7.23 -0.89 -4.93 120.40 101.45 1h7y s VAL 35 Ca -0.10 0.02 -0.29 0.00 -1.81 0.00 0.00 61.98 59.80 1h7y s VAL 35 Cb -0.16 -0.34 0.01 0.00 0.56 0.00 0.00 36.38 36.46 1h7y s VAL 35 CO 0.05 0.16 1.29 -0.89 -0.31 0.00 0.00 175.10 175.40 1h7y s THR 36 N 0.92 4.09 0.24 5.32 2.01 -1.26 -1.99 115.64 124.97 1h7y s THR 36 Ca -0.10 1.17 0.06 0.00 0.31 0.00 0.00 61.69 63.13 1h7y s THR 36 Cb -0.13 -4.31 -0.05 0.00 0.01 0.00 0.00 72.50 68.02 1h7y s THR 36 CO -0.01 -0.72 -0.08 0.68 -0.69 0.00 0.00 174.62 173.80 1h7y s VAL 37 N 4.75 1.56 -0.91 3.82 -7.23 -1.25 -5.01 120.40 116.12 1h7y s VAL 37 Ca 0.55 -2.14 -0.22 0.00 -1.81 0.00 0.00 61.98 58.36 1h7y s VAL 37 Cb -0.13 -2.26 0.07 0.00 0.56 0.00 0.00 36.38 34.62 1h7y s VAL 37 CO 0.28 -0.43 1.28 -1.59 -0.31 0.00 0.00 175.10 174.33 1h7y s LYS 38 N -3.72 3.47 0.17 4.82 -2.85 -1.26 -3.01 119.74 117.36 1h7y s LYS 38 Ca 0.26 -1.12 0.09 0.00 -1.00 0.00 0.00 55.97 54.21 1h7y s LYS 38 Cb 0.02 -4.92 -0.04 0.00 -2.06 0.00 0.00 37.83 30.83 1h7y s LYS 38 CO 0.09 -2.04 -0.20 -0.65 0.10 0.00 0.00 175.35 172.65 1h7y s GLN 39 N 4.37 1.35 0.00 1.78 -0.21 -1.26 -4.94 119.66 120.75 1h7y s GLN 39 Ca 0.38 -1.44 0.00 0.00 0.02 0.00 0.00 55.36 54.32 1h7y s GLN 39 Cb -0.05 -1.51 0.00 0.00 1.00 0.00 0.00 33.01 32.46 1h7y s GLN 39 CO -0.04 0.31 0.00 0.41 -2.12 0.00 0.00 175.29 173.86 1h7y n GLY 40 N 0.30 -1.94 0.00 3.09 0.00 -1.26 -3.38 105.19 101.99 1h7y n GLY 40 Ca -0.13 0.93 0.00 0.00 0.00 0.00 0.00 46.02 46.82 1h7y n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h7y n GLY 41 N 0.00 0.00 0.62 -0.02 0.00 -1.26 -4.74 105.19 99.79 1h7y n GLY 41 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1h7y n GLY 41 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1h7y n ASP 42 N -1.35 1.67 0.04 1.61 2.03 -1.26 -3.50 116.55 115.79 1h7y n ASP 42 Ca 0.00 -2.12 0.11 0.00 0.52 0.00 0.00 54.79 53.30 1h7y n ASP 42 Cb 0.20 -0.33 -0.03 0.00 -0.72 0.00 0.00 41.12 40.23 1h7y n ASP 42 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1h7y n VAL 43 N 0.13 0.28 -3.40 5.18 0.31 -1.26 -5.02 118.33 114.56 1h7y n VAL 43 Ca 0.07 -0.41 -0.33 0.00 -0.01 0.00 0.00 64.34 63.66 1h7y n VAL 43 Cb 0.33 -0.03 0.03 0.00 -0.91 0.00 0.00 33.84 33.27 1h7y n VAL 43 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1h7y n ASP 44 N -2.28 -5.94 -2.68 4.52 2.03 -1.23 -4.95 116.55 106.02 1h7y n ASP 44 Ca -0.00 -0.05 -0.05 0.00 0.52 0.00 0.00 54.79 55.21 1h7y n ASP 44 Cb 0.51 -2.33 0.08 0.00 -0.72 0.00 0.00 41.12 38.66 1h7y n ASP 44 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1h7y n ILE 45 N -0.25 0.00 -1.57 5.18 0.13 -1.26 -5.12 119.36 116.47 1h7y n ILE 45 Ca -0.05 -0.85 -0.53 0.00 -1.10 0.00 0.00 62.75 60.21 1h7y n ILE 45 Cb 0.65 1.18 -0.06 0.00 -0.84 0.00 0.00 39.64 40.56 1h7y n ILE 45 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1h7y n GLY 46 N 1.16 0.24 0.04 4.50 0.00 -1.26 -4.84 105.19 105.03 1h7y n GLY 46 Ca 0.01 0.70 0.11 0.00 0.00 0.00 0.00 46.02 46.84 1h7y n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h7y n ALA 47 N 2.18 2.96 -3.50 4.61 0.00 -1.26 -4.73 120.51 120.77 1h7y n ALA 47 Ca 0.18 -0.43 -0.29 0.00 0.00 0.00 0.00 53.44 52.90 1h7y n ALA 47 Cb 0.17 -0.88 -0.13 0.00 0.00 0.00 0.00 19.45 18.61 1h7y n ALA 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1h7y s ASN 48 N -4.54 3.16 0.54 0.00 2.20 -1.26 -5.09 114.94 109.94 1h7y s ASN 48 Ca -0.03 -1.99 -0.17 0.00 -0.94 0.00 0.00 52.86 49.74 1h7y s ASN 48 Cb 0.13 -0.43 -0.06 0.00 -2.00 0.00 0.00 41.25 38.89 1h7y s ASN 48 CO 0.86 -0.34 1.02 -2.16 -2.94 0.00 0.00 177.10 173.54 1h7y s PRO 49 N 1.29 3.70 -1.59 3.55 0.04 -1.26 -3.60 135.00 137.12 1h7y s PRO 49 Ca 0.16 1.10 -0.02 0.00 0.04 0.00 0.00 61.00 62.28 1h7y s PRO 49 Cb -0.21 -2.09 0.01 0.00 0.04 0.00 0.00 34.50 32.24 1h7y s PRO 49 CO -0.08 -0.48 0.19 0.45 0.04 0.00 0.00 177.00 177.11 1h7y n SER 50 N -1.66 -5.58 -2.72 6.66 2.88 -1.26 -4.85 113.62 107.10 1h7y n SER 50 Ca 0.08 -0.08 -0.08 0.00 -1.33 0.00 0.00 58.87 57.46 1h7y n SER 50 Cb 0.53 -4.61 0.09 0.00 -0.75 0.00 0.00 64.21 59.47 1h7y n SER 50 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h7y n ALA 51 N -2.55 -1.19 -2.52 -1.46 0.00 -1.24 -5.14 120.51 106.42 1h7y n ALA 51 Ca -0.19 -1.32 -0.09 0.00 0.00 0.00 0.00 53.44 51.85 1h7y n ALA 51 Cb 0.65 -1.44 -0.09 0.00 0.00 0.00 0.00 19.45 18.58 1h7y n ALA 51 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1h7y s GLU 52 N 0.30 0.67 -0.36 0.00 -1.05 -1.26 -4.91 118.70 112.09 1h7y s GLU 52 Ca 0.23 -0.92 0.03 0.00 -0.15 0.00 0.00 54.97 54.16 1h7y s GLU 52 Cb 0.28 0.26 0.16 0.00 -0.44 0.00 0.00 34.13 34.38 1h7y s GLU 52 CO -0.10 -0.17 0.39 0.34 0.95 0.00 0.00 175.26 176.67 1h7y s ASP 53 N -2.53 0.96 0.49 0.83 2.15 -1.26 -5.12 116.67 112.19 1h7y s ASP 53 Ca 0.01 -1.34 0.00 0.00 0.43 0.00 0.00 52.55 51.65 1h7y s ASP 53 Cb 0.03 0.70 0.00 0.00 -0.30 0.00 0.00 42.92 43.35 1h7y s ASP 53 CO -0.08 -0.27 0.00 0.00 -0.17 0.00 0.00 175.17 174.65 1h7y n ALA 54 N 4.45 0.00 -0.91 3.66 0.00 -1.26 -4.99 120.51 121.47 1h7y n ALA 54 Ca 0.09 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.61 1h7y n ALA 54 Cb 0.46 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.90 1h7y n ALA 54 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1h7y n GLU 55 N -0.84 -1.14 -0.09 0.00 1.02 -1.26 -4.03 120.64 114.30 1h7y n GLU 55 Ca 0.00 0.75 0.12 0.00 -0.02 0.00 0.00 57.16 58.01 1h7y n GLU 55 Cb 0.00 -1.39 0.26 0.00 -0.02 0.00 0.00 31.44 30.28 1h7y n GLU 55 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1h7y n GLU 56 N -2.41 2.19 -0.06 3.49 -0.58 -1.26 -5.06 120.64 116.95 1h7y n GLU 56 Ca 0.00 -1.77 0.01 0.00 -0.42 0.00 0.00 57.16 54.99 1h7y n GLU 56 Cb 0.26 -1.47 -0.00 0.00 -0.57 0.00 0.00 31.44 29.66 1h7y n GLU 56 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1h7y n ASN 57 N 1.04 -6.06 -2.15 1.62 3.02 -1.26 -4.97 115.26 106.51 1h7y n ASN 57 Ca 0.17 0.06 -0.00 0.00 -0.03 0.00 0.00 54.58 54.78 1h7y n ASN 57 Cb 0.51 -0.18 -0.00 0.00 -0.61 0.00 0.00 39.78 39.50 1h7y n ASN 57 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1h7y n ALA 58 N -0.09 -2.32 -3.19 5.41 0.00 -1.26 -4.92 120.51 114.13 1h7y n ALA 58 Ca 0.00 0.57 -0.21 0.00 0.00 0.00 0.00 53.44 53.80 1h7y n ALA 58 Cb 0.03 -1.50 -0.05 0.00 0.00 0.00 0.00 19.45 17.93 1h7y n ALA 58 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1h7y n GLU 59 N 1.51 0.97 -2.77 0.00 0.28 -1.26 -4.84 120.64 114.52 1h7y n GLU 59 Ca -0.04 -3.39 -0.10 0.00 -0.16 0.00 0.00 57.16 53.48 1h7y n GLU 59 Cb 0.05 -1.53 0.08 0.00 1.43 0.00 0.00 31.44 31.48 1h7y n GLU 59 CO 0.00 0.00 0.00 -0.85 -0.16 0.00 0.00 177.13 176.12 1h7y n GLU 60 N 0.76 1.03 0.01 3.44 0.00 -1.26 -5.01 120.64 119.61 1h7y n GLU 60 Ca 0.24 -2.06 0.00 0.00 0.00 0.00 0.00 57.16 55.33 1h7y n GLU 60 Cb 0.59 -1.01 0.00 0.00 0.00 0.00 0.00 31.44 31.02 1h7y n GLU 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1h7y n GLY 61 N 0.27 -1.95 1.68 -1.84 0.00 -1.26 -5.16 105.19 96.93 1h7y n GLY 61 Ca 0.07 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.65 1h7y n GLY 61 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h7y n THR 62 N -2.17 -4.30 -3.80 2.61 -2.24 -1.22 -4.97 114.28 98.18 1h7y n THR 62 Ca 0.00 2.04 -0.12 0.00 -2.27 0.00 0.00 64.05 63.70 1h7y n THR 62 Cb 0.00 -3.03 -0.10 0.00 -2.10 0.00 0.00 70.33 65.10 1h7y n THR 62 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1h7y s GLU 63 N -4.53 0.43 0.29 -0.78 -1.05 -1.17 -4.86 118.70 107.03 1h7y s GLU 63 Ca 0.00 0.01 -0.30 0.00 -0.15 0.00 0.00 54.97 54.53 1h7y s GLU 63 Cb 0.00 0.20 -0.12 0.00 -0.44 0.00 0.00 34.13 33.76 1h7y s GLU 63 CO 0.00 -0.09 1.46 0.25 0.95 0.00 0.00 175.26 177.83 1h7y n THR 64 N 2.13 1.28 -4.40 1.83 -2.24 -1.26 -3.93 114.28 107.69 1h7y n THR 64 Ca -0.18 -0.32 -0.24 0.00 -2.27 0.00 0.00 64.05 61.05 1h7y n THR 64 Cb 0.57 -1.73 -0.13 0.00 -2.10 0.00 0.00 70.33 66.94 1h7y n THR 64 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1h7y s VAL 65 N -0.34 1.61 0.61 2.28 -7.23 -0.84 -4.91 120.40 111.58 1h7y s VAL 65 Ca 0.63 -1.37 -0.17 0.00 -1.81 0.00 0.00 61.98 59.26 1h7y s VAL 65 Cb -0.56 -1.45 -0.03 0.00 0.56 0.00 0.00 36.38 34.91 1h7y s VAL 65 CO 0.53 0.02 1.12 0.20 -0.31 0.00 0.00 175.10 176.66 1h7y s ASN 66 N -1.60 5.38 0.02 4.85 -0.87 -1.26 -2.10 114.94 119.37 1h7y s ASN 66 Ca 0.06 2.07 0.16 0.00 -1.57 0.00 0.00 52.86 53.58 1h7y s ASN 66 Cb -0.09 -2.56 -0.16 0.00 -0.02 0.00 0.00 41.25 38.41 1h7y s ASN 66 CO 0.03 -1.45 0.74 -3.20 -2.57 0.00 0.00 177.10 170.66 1h7y n ASN 67 N -1.94 0.79 0.05 -1.22 5.15 0.09 -2.44 115.26 115.74 1h7y n ASN 67 Ca 0.11 0.35 -0.20 0.00 -0.60 0.00 0.00 54.58 54.24 1h7y n ASN 67 Cb 0.52 0.21 -0.12 0.00 -0.53 0.00 0.00 39.78 39.86 1h7y n ASN 67 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1h7y h LEU 68 N 0.00 0.68 -0.44 1.20 4.07 -1.90 -2.66 115.31 116.25 1h7y h LEU 68 Ca -0.20 -0.82 -0.18 0.00 0.08 0.00 0.00 57.88 56.76 1h7y h LEU 68 Cb 1.68 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 43.21 1h7y h LEU 68 CO 0.05 1.42 -0.70 0.58 -1.08 0.00 0.00 178.44 178.70 1h7y h VAL 69 N 0.02 1.38 -0.10 1.22 2.07 -1.94 -1.36 116.25 117.54 1h7y h VAL 69 Ca -0.13 -2.11 -0.01 0.00 0.82 0.00 0.00 66.70 65.27 1h7y h VAL 69 Cb 1.62 2.08 -0.00 0.00 -1.52 0.00 0.00 31.29 33.47 1h7y h VAL 69 CO 0.17 0.63 0.04 0.22 0.02 0.00 0.00 177.57 178.65 1h7y h TYR 70 N 0.27 0.15 -0.08 1.57 5.03 -1.52 0.63 116.97 123.01 1h7y h TYR 70 Ca -0.03 -0.01 -0.23 0.00 2.58 0.00 0.00 58.73 61.04 1h7y h TYR 70 Cb 1.27 -0.04 0.01 0.00 1.55 0.00 0.00 36.73 39.52 1h7y h TYR 70 CO 0.04 0.26 -0.87 0.77 -1.32 0.00 0.00 178.16 177.04 1h7y h SER 71 N -0.01 0.90 -0.11 -2.11 0.02 -1.51 -3.09 113.55 107.65 1h7y h SER 71 Ca 0.03 -0.68 0.00 0.00 -0.84 0.00 0.00 61.79 60.30 1h7y h SER 71 Cb 0.17 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.44 1h7y h SER 71 CO -0.00 1.45 0.00 0.49 -1.14 0.00 0.00 176.83 177.63 1h7y n PHE 72 N -3.93 0.13 -3.29 3.45 3.72 -0.51 -4.90 117.46 112.13 1h7y n PHE 72 Ca -0.09 -0.07 -0.23 0.00 -0.05 0.00 0.00 57.45 57.01 1h7y n PHE 72 Cb 0.79 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.34 1h7y n PHE 72 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1h7y n ARG 73 N -0.08 -3.99 -0.56 -1.08 1.74 0.20 -4.61 116.66 108.29 1h7y n ARG 73 Ca 0.15 0.61 -0.30 0.00 -0.77 0.00 0.00 57.85 57.55 1h7y n ARG 73 Cb 0.23 -5.38 0.22 0.00 -1.02 0.00 0.00 32.46 26.51 1h7y n ARG 73 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1h7y n LEU 74 N -3.88 -1.05 -3.87 0.55 7.99 0.02 -3.91 117.00 112.85 1h7y n LEU 74 Ca -0.04 -0.06 -0.27 0.00 -0.01 0.00 0.00 56.01 55.63 1h7y n LEU 74 Cb 0.56 -1.21 -0.17 0.00 -0.11 0.00 0.00 43.42 42.50 1h7y n LEU 74 CO 0.51 -3.14 -0.42 -0.55 -1.51 0.00 0.00 177.39 172.28 1h7y s SER 75 N -2.27 2.49 -0.14 -1.43 0.15 0.42 -4.87 113.70 108.05 1h7y s SER 75 Ca 0.65 -0.49 -0.29 0.00 0.70 0.00 0.00 55.95 56.51 1h7y s SER 75 Cb -0.22 -0.82 -0.01 0.00 -1.71 0.00 0.00 66.02 63.26 1h7y s SER 75 CO 0.65 -0.17 1.07 -2.16 1.20 0.00 0.00 173.24 173.83 1h7y s PRO 76 N 1.71 4.35 -0.18 5.44 0.04 -1.26 -1.44 135.00 143.65 1h7y s PRO 76 Ca 0.03 1.45 -0.06 0.00 0.04 0.00 0.00 61.00 62.45 1h7y s PRO 76 Cb -0.14 -3.59 -0.03 0.00 0.04 0.00 0.00 34.50 30.77 1h7y s PRO 76 CO -0.08 -0.47 0.03 -0.08 0.04 0.00 0.00 177.00 176.45 1h7y s THR 77 N 2.53 4.41 -2.73 1.26 -1.32 -1.02 -4.96 115.64 113.81 1h7y s THR 77 Ca 0.49 -0.17 0.23 0.00 -1.21 0.00 0.00 61.69 61.03 1h7y s THR 77 Cb -0.19 -2.98 0.28 0.00 -1.51 0.00 0.00 72.50 68.10 1h7y s THR 77 CO 0.15 0.45 1.30 -1.20 -2.21 0.00 0.00 174.62 173.11 1h7y n SER 78 N 3.75 3.16 -4.15 8.08 7.64 -1.26 -4.31 113.62 126.53 1h7y n SER 78 Ca -0.17 -1.98 -0.32 0.00 1.01 0.00 0.00 58.87 57.41 1h7y n SER 78 Cb 0.52 -0.10 -0.17 0.00 -1.01 0.00 0.00 64.21 63.45 1h7y n SER 78 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1h7y s PHE 79 N -1.76 2.56 0.00 1.43 2.19 -1.26 -4.91 117.98 116.23 1h7y s PHE 79 Ca 0.32 -1.30 0.00 0.00 0.33 0.00 0.00 56.93 56.28 1h7y s PHE 79 Cb 0.21 -1.76 0.00 0.00 -1.31 0.00 0.00 43.02 40.16 1h7y s PHE 79 CO 0.30 -0.60 0.00 -0.25 1.83 0.00 0.00 175.22 176.50 1h7y n ASP 80 N 4.13 0.00 -0.08 6.13 8.00 -1.26 -4.84 116.55 128.62 1h7y n ASP 80 Ca -0.20 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.20 1h7y n ASP 80 Cb 0.51 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.58 1h7y n ASP 80 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1h7y h LYS 81 N 0.00 0.40 0.00 -1.24 1.57 -2.00 -2.70 116.57 112.59 1h7y h LYS 81 Ca 0.00 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1h7y h LYS 81 Cb 0.00 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1h7y h LYS 81 CO 0.00 0.40 -1.33 1.17 -0.57 0.00 0.00 179.45 179.12 1h7y n LYS 82 N -4.79 1.07 0.09 3.15 4.81 -1.26 -4.57 118.16 116.66 1h7y n LYS 82 Ca -0.02 -0.04 -0.05 0.00 -0.87 0.00 0.00 58.31 57.33 1h7y n LYS 82 Cb 0.11 -1.15 0.12 0.00 0.02 0.00 0.00 35.03 34.13 1h7y n LYS 82 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 1h7y h SER 83 N 0.00 0.26 -0.61 3.14 0.02 -1.92 -3.14 113.55 111.30 1h7y h SER 83 Ca -0.05 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 1h7y h SER 83 Cb 0.63 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 63.06 1h7y h SER 83 CO 0.00 0.80 0.40 0.22 -1.14 0.00 0.00 176.83 177.11 1h7y h TYR 84 N 0.17 0.77 0.08 3.45 3.20 -1.72 -1.48 116.97 121.43 1h7y h TYR 84 Ca -0.01 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1h7y h TYR 84 Cb 1.11 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.12 1h7y h TYR 84 CO 0.02 0.49 -0.04 0.52 -1.64 0.00 0.00 178.16 177.51 1h7y h MET 85 N 0.83 -0.10 -0.66 1.82 2.86 -1.78 0.49 114.93 118.39 1h7y h MET 85 Ca 0.22 0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.88 1h7y h MET 85 Cb -0.08 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 1h7y h MET 85 CO -0.05 -0.06 0.44 1.03 1.06 0.00 0.00 176.91 179.33 1h7y h SER 86 N -0.12 0.76 1.21 1.22 0.87 -1.51 -0.95 113.55 115.03 1h7y h SER 86 Ca -0.01 -0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.47 1h7y h SER 86 Cb 0.09 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 1h7y h SER 86 CO 0.02 0.55 -0.29 1.88 -0.53 0.00 0.00 176.83 178.46 1h7y h TYR 87 N 0.89 0.00 0.00 2.24 0.05 -0.84 -2.30 116.97 117.01 1h7y h TYR 87 Ca 0.24 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.88 1h7y h TYR 87 Cb -0.10 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.62 1h7y h TYR 87 CO 0.00 0.29 -0.69 0.97 -1.05 0.00 0.00 178.16 177.68 1h7y h ILE 88 N 0.00 1.40 0.16 -2.88 -0.00 0.45 -2.45 117.51 114.19 1h7y h ILE 88 Ca -0.00 -2.44 -0.31 0.00 -0.00 0.00 0.00 64.86 62.10 1h7y h ILE 88 Cb 0.97 2.35 0.01 0.00 -0.00 0.00 0.00 36.82 40.15 1h7y h ILE 88 CO 0.04 0.68 -1.48 0.11 -0.00 0.00 0.00 178.15 177.49 1h7y h LYS 89 N 0.00 0.33 -0.06 2.19 1.79 -1.26 -2.45 116.57 117.12 1h7y h LYS 89 Ca -0.01 -0.57 -0.09 0.00 -2.18 0.00 0.00 60.65 57.81 1h7y h LYS 89 Cb 1.30 0.21 -0.01 0.00 -1.58 0.00 0.00 32.23 32.15 1h7y h LYS 89 CO 0.09 1.23 -0.37 0.78 -1.08 0.00 0.00 179.45 180.10 1h7y h GLY 90 N 1.23 0.13 1.23 3.86 0.00 -1.42 -1.70 103.07 106.40 1h7y h GLY 90 Ca -0.23 -0.11 -0.33 0.00 0.00 0.00 0.00 47.33 46.65 1h7y h GLY 90 CO 0.20 0.10 -1.52 -1.82 0.00 0.00 0.00 176.54 173.50 1h7y h TYR 91 N 0.11 0.88 -0.22 5.60 3.20 -1.51 -2.54 116.97 122.48 1h7y h TYR 91 Ca 0.01 -0.64 -0.01 0.00 3.14 0.00 0.00 58.73 61.23 1h7y h TYR 91 Cb 0.71 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 1h7y h TYR 91 CO 0.01 1.55 0.11 0.52 -1.64 0.00 0.00 178.16 178.71 1h7y h MET 92 N 0.13 0.32 -0.71 1.82 2.86 -1.31 -2.22 114.93 115.81 1h7y h MET 92 Ca -0.26 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.28 1h7y h MET 92 Cb 2.14 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 33.71 1h7y h MET 92 CO 0.25 0.32 0.22 -0.22 1.06 0.00 0.00 176.91 178.54 1h7y h LYS 93 N 0.23 1.10 -0.47 1.72 3.64 -1.41 -2.07 116.57 119.30 1h7y h LYS 93 Ca 0.08 -0.23 0.07 0.00 -1.27 0.00 0.00 60.65 59.30 1h7y h LYS 93 Cb 0.11 -0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 31.70 1h7y h LYS 93 CO -0.01 0.94 0.12 0.00 -2.27 0.00 0.00 179.45 178.23 1h7y h ALA 94 N 1.18 0.54 -0.13 5.00 0.00 -1.04 0.19 119.26 125.00 1h7y h ALA 94 Ca 0.23 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.15 1h7y h ALA 94 Cb 0.29 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1h7y h ALA 94 CO -0.01 -0.28 -0.25 0.82 0.00 0.00 0.00 179.25 179.53 1h7y h ILE 95 N 0.27 1.24 -0.70 0.00 1.08 -1.08 -2.07 117.51 116.25 1h7y h ILE 95 Ca 0.23 -1.10 0.06 0.00 -0.39 0.00 0.00 64.86 63.65 1h7y h ILE 95 Cb 0.28 1.42 -0.04 0.00 -3.07 0.00 0.00 36.82 35.41 1h7y h ILE 95 CO -0.28 0.33 0.46 0.50 -0.69 0.00 0.00 178.15 178.48 1h7y h LYS 96 N 0.20 0.72 -0.00 2.37 1.63 -0.28 -1.35 116.57 119.86 1h7y h LYS 96 Ca 0.03 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1h7y h LYS 96 Cb 0.56 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.03 1h7y h LYS 96 CO 0.04 0.47 -0.02 0.00 -3.45 0.00 0.00 179.45 176.50 1h7y h ALA 97 N 1.62 0.01 -0.78 5.00 0.00 -0.84 -2.31 119.26 121.96 1h7y h ALA 97 Ca 0.30 -0.35 0.15 0.00 0.00 0.00 0.00 54.91 55.01 1h7y h ALA 97 Cb 0.23 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1h7y h ALA 97 CO -0.10 -0.14 0.52 0.07 0.00 0.00 0.00 179.25 179.60 1h7y h ARG 98 N -0.66 0.44 -0.07 0.00 -0.00 -1.06 0.15 114.38 113.19 1h7y h ARG 98 Ca -0.00 -0.03 -0.19 0.00 -0.00 0.00 0.00 59.98 59.76 1h7y h ARG 98 Cb 0.70 -0.10 -0.00 0.00 -0.00 0.00 0.00 29.97 30.57 1h7y h ARG 98 CO 0.00 0.29 -0.77 -0.07 -0.00 0.00 0.00 179.97 179.42 1h7y h LEU 99 N 0.46 0.53 -1.67 0.08 3.38 -1.25 -2.29 115.31 114.53 1h7y h LEU 99 Ca 0.39 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1h7y h LEU 99 Cb 0.84 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 1h7y h LEU 99 CO -0.13 1.11 -0.09 1.56 0.09 0.00 0.00 178.44 180.98 1h7y h GLN 100 N 0.29 0.00 0.16 1.13 1.08 -0.17 1.01 115.11 118.61 1h7y h GLN 100 Ca -0.04 0.00 -0.32 0.00 -1.45 0.00 0.00 58.65 56.83 1h7y h GLN 100 Cb 1.36 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.80 1h7y h GLN 100 CO 0.13 0.09 -1.64 0.93 -0.95 0.00 0.00 178.83 177.39 1h7y h GLU 101 N 0.00 0.33 -0.62 1.46 5.08 -0.96 -3.42 114.58 116.45 1h7y h GLU 101 Ca -0.00 -0.56 -0.30 0.00 -1.00 0.00 0.00 59.36 57.50 1h7y h GLU 101 Cb 0.47 0.21 -0.33 0.00 0.50 0.00 0.00 28.75 29.59 1h7y h GLU 101 CO 0.01 1.27 -0.95 0.45 -1.00 0.00 0.00 179.01 178.79 1h7y n SER 102 N -3.71 0.59 0.00 1.42 2.88 -0.88 -4.97 113.62 108.95 1h7y n SER 102 Ca -0.25 -2.49 0.00 0.00 -1.33 0.00 0.00 58.87 54.79 1h7y n SER 102 Cb 1.01 -0.13 0.00 0.00 -0.75 0.00 0.00 64.21 64.34 1h7y n SER 102 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1h7y n ASN 103 N -0.38 0.00 -0.01 -3.46 3.02 0.35 -4.88 115.26 109.90 1h7y n ASN 103 Ca 0.04 0.00 -0.17 0.00 -0.03 0.00 0.00 54.58 54.42 1h7y n ASN 103 Cb 0.83 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.90 1h7y n ASN 103 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1h7y h PRO 104 N 0.00 0.51 0.00 3.52 0.13 -1.75 -3.12 132.00 131.28 1h7y h PRO 104 Ca 0.00 -0.47 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1h7y h PRO 104 Cb 0.00 0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.25 1h7y h PRO 104 CO 0.00 1.11 0.00 0.39 -0.23 0.00 0.00 178.00 179.27 1h7y n GLU 105 N -4.18 0.13 0.00 0.86 1.02 -1.26 -2.23 120.64 114.98 1h7y n GLU 105 Ca -0.09 0.31 0.12 0.00 -0.02 0.00 0.00 57.16 57.47 1h7y n GLU 105 Cb 0.66 -1.72 0.19 0.00 -0.02 0.00 0.00 31.44 30.55 1h7y n GLU 105 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1h7y n ARG 106 N -1.96 0.46 -0.11 3.49 0.00 -1.19 -4.08 116.66 113.27 1h7y n ARG 106 Ca 0.03 -0.31 -0.11 0.00 -0.00 0.00 0.00 57.85 57.46 1h7y n ARG 106 Cb 0.25 -1.49 -0.03 0.00 0.00 0.00 0.00 32.46 31.19 1h7y n ARG 106 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1h7y h VAL 107 N 0.76 1.28 0.09 5.15 2.07 -1.40 -1.03 116.25 123.16 1h7y h VAL 107 Ca 0.00 -1.09 -0.00 0.00 0.82 0.00 0.00 66.70 66.42 1h7y h VAL 107 Cb 0.54 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 1h7y h VAL 107 CO 0.00 0.35 -0.04 1.55 0.02 0.00 0.00 177.57 179.45 1h7y h PRO 108 N 0.40 -0.11 -0.44 1.57 0.13 -1.75 -2.61 132.00 129.20 1h7y h PRO 108 Ca 0.08 0.01 0.01 0.00 -0.87 0.00 0.00 66.00 65.23 1h7y h PRO 108 Cb 0.55 0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.68 1h7y h PRO 108 CO 0.03 0.35 0.29 -0.39 -0.23 0.00 0.00 178.00 178.05 1h7y h VAL 109 N -0.94 1.10 -0.29 1.56 -1.51 -1.71 -1.28 116.25 113.18 1h7y h VAL 109 Ca -0.01 -0.20 -0.10 0.00 -1.23 0.00 0.00 66.70 65.17 1h7y h VAL 109 Cb 0.51 0.48 -0.01 0.00 -2.13 0.00 0.00 31.29 30.14 1h7y h VAL 109 CO 0.02 0.10 -0.19 0.15 -1.23 0.00 0.00 177.57 176.42 1h7y h PHE 110 N 0.57 0.75 -0.06 5.19 3.57 -1.26 -2.06 116.94 123.64 1h7y h PHE 110 Ca 0.16 -0.20 -0.08 0.00 3.53 0.00 0.00 57.97 61.38 1h7y h PHE 110 Cb -0.03 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 1h7y h PHE 110 CO -0.00 0.90 -0.35 0.93 -2.23 0.00 0.00 178.31 177.57 1h7y h GLU 111 N 0.39 0.12 -0.02 1.11 4.39 -1.00 -1.39 114.58 118.18 1h7y h GLU 111 Ca 0.06 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 1h7y h GLU 111 Cb 0.74 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 1h7y h GLU 111 CO 0.05 0.46 -0.04 0.87 -1.16 0.00 0.00 179.01 179.19 1h7y h LYS 112 N 0.11 0.05 0.08 2.33 1.79 -1.11 -2.82 116.57 117.00 1h7y h LYS 112 Ca 0.01 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1h7y h LYS 112 Cb 0.67 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.33 1h7y h LYS 112 CO 0.05 0.63 -0.04 -0.91 -1.08 0.00 0.00 179.45 178.10 1h7y h ASN 113 N -0.51 -0.09 -0.39 0.86 4.21 -1.34 -2.94 115.58 115.37 1h7y h ASN 113 Ca -0.00 -0.38 0.11 0.00 1.21 0.00 0.00 56.30 57.24 1h7y h ASN 113 Cb 0.63 0.02 -0.02 0.00 -1.12 0.00 0.00 38.32 37.84 1h7y h ASN 113 CO 0.01 0.35 0.37 0.00 -1.29 0.00 0.00 177.43 176.87 1h7y h ALA 114 N 0.32 2.15 -0.39 -0.83 0.00 -1.38 0.47 119.26 119.60 1h7y h ALA 114 Ca -0.01 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1h7y h ALA 114 Cb 0.46 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1h7y h ALA 114 CO 0.02 -0.57 -0.33 0.97 0.00 0.00 0.00 179.25 179.34 1h7y h ILE 115 N 0.00 1.28 -0.00 0.00 -0.00 -1.31 -1.96 117.51 115.50 1h7y h ILE 115 Ca 0.18 -1.49 -0.00 0.00 -0.00 0.00 0.00 64.86 63.55 1h7y h ILE 115 Cb 0.91 1.32 -0.00 0.00 -0.00 0.00 0.00 36.82 39.06 1h7y h ILE 115 CO -0.00 0.50 -0.00 1.23 -0.00 0.00 0.00 178.15 179.88 1h7y h GLY 116 N 0.87 0.00 1.82 8.18 0.00 -0.87 -2.77 103.07 110.31 1h7y h GLY 116 Ca 0.07 -0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.42 1h7y h GLY 116 CO 0.08 0.00 0.08 -2.75 0.00 0.00 0.00 176.54 173.96 1h7y h PHE 117 N -0.33 0.08 -0.69 5.60 3.57 -1.48 -1.57 116.94 122.12 1h7y h PHE 117 Ca 0.00 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.45 1h7y h PHE 117 Cb 0.34 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 1h7y h PHE 117 CO 0.04 0.05 0.24 0.28 -2.23 0.00 0.00 178.31 176.69 1h7y h VAL 118 N 0.09 1.25 -0.32 1.41 2.07 -1.08 -2.22 116.25 117.45 1h7y h VAL 118 Ca 0.05 -0.83 -0.13 0.00 0.82 0.00 0.00 66.70 66.61 1h7y h VAL 118 Cb 0.09 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1h7y h VAL 118 CO -0.01 0.33 -0.33 0.50 0.02 0.00 0.00 177.57 178.08 1h7y h LYS 119 N 1.00 0.71 0.92 1.57 3.64 -1.09 -1.73 116.57 121.59 1h7y h LYS 119 Ca 0.23 -0.33 -0.04 0.00 -1.27 0.00 0.00 60.65 59.23 1h7y h LYS 119 Cb 0.26 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1h7y h LYS 119 CO -0.01 0.94 -0.44 0.87 -2.27 0.00 0.00 179.45 178.54 1h7y h LYS 120 N 0.60 -1.19 -0.32 1.90 1.57 -1.13 -2.61 116.57 115.40 1h7y h LYS 120 Ca 0.07 0.08 0.04 0.00 -1.87 0.00 0.00 60.65 58.97 1h7y h LYS 120 Cb 0.85 0.27 -0.04 0.00 0.08 0.00 0.00 32.23 33.39 1h7y h LYS 120 CO 0.07 -0.79 0.07 0.82 -0.57 0.00 0.00 179.45 179.05 1h7y h ILE 121 N -1.32 0.85 -1.15 1.86 5.03 -1.46 -0.96 117.51 120.37 1h7y h ILE 121 Ca -0.13 -0.06 0.33 0.00 -0.12 0.00 0.00 64.86 64.88 1h7y h ILE 121 Cb 0.94 0.65 -0.10 0.00 -3.03 0.00 0.00 36.82 35.29 1h7y h ILE 121 CO 0.21 0.03 0.76 -0.07 -0.68 0.00 0.00 178.15 178.40 1h7y h LEU 122 N 0.19 0.32 -0.74 1.44 3.38 -1.26 0.83 115.31 119.45 1h7y h LEU 122 Ca 0.15 0.08 0.16 0.00 0.09 0.00 0.00 57.88 58.36 1h7y h LEU 122 Cb 0.16 0.04 -0.14 0.00 0.09 0.00 0.00 40.66 40.81 1h7y h LEU 122 CO -0.19 0.00 -0.10 0.00 0.09 0.00 0.00 178.44 178.24 1h7y h ALA 123 N 1.57 0.62 -1.68 1.53 0.00 -0.77 -3.18 119.26 117.35 1h7y h ALA 123 Ca 0.65 0.27 -0.44 0.00 0.00 0.00 0.00 54.91 55.39 1h7y h ALA 123 Cb 1.94 0.50 -0.39 0.00 0.00 0.00 0.00 17.79 19.83 1h7y h ALA 123 CO -0.28 -0.42 -1.18 -1.71 0.00 0.00 0.00 179.25 175.66 1h7y n ASN 124 N -5.43 0.89 0.32 0.00 2.85 0.14 -4.91 115.26 109.13 1h7y n ASN 124 Ca 0.12 -2.94 0.18 0.00 -0.11 0.00 0.00 54.58 51.82 1h7y n ASN 124 Cb 0.42 -0.53 0.95 0.00 1.24 0.00 0.00 39.78 41.86 1h7y n ASN 124 CO 0.00 0.00 0.00 2.19 -2.11 0.00 0.00 177.26 177.34 1h7y h PHE 125 N 2.99 0.00 -0.13 1.20 -5.15 -1.15 -0.85 116.94 113.86 1h7y h PHE 125 Ca 0.04 0.00 -0.08 0.00 -0.20 0.00 0.00 57.97 57.73 1h7y h PHE 125 Cb 1.03 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.20 1h7y h PHE 125 CO 0.46 0.00 -0.24 0.87 -2.00 0.00 0.00 178.31 177.40 1h7y h LYS 126 N 0.00 0.39 0.00 6.09 1.79 -1.90 -1.77 116.57 121.18 1h7y h LYS 126 Ca 0.01 -0.25 -0.09 0.00 -2.18 0.00 0.00 60.65 58.14 1h7y h LYS 126 Cb 0.46 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.13 1h7y h LYS 126 CO -0.00 0.85 -0.43 0.22 -1.08 0.00 0.00 179.45 179.01 1h7y h ASP 127 N -0.02 0.00 1.34 0.86 3.58 -1.58 -2.93 116.42 117.67 1h7y h ASP 127 Ca 0.01 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.36 1h7y h ASP 127 Cb 0.83 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.87 1h7y h ASP 127 CO 0.05 0.43 -0.46 1.88 -2.88 0.00 0.00 179.24 178.26 1h7y h TYR 128 N 0.00 0.00 -3.43 0.28 -1.99 -1.34 -3.43 116.97 107.06 1h7y h TYR 128 Ca -0.00 0.00 0.38 0.00 2.00 0.00 0.00 58.73 61.11 1h7y h TYR 128 Cb 1.00 0.00 -0.15 0.00 2.00 0.00 0.00 36.73 39.58 1h7y h TYR 128 CO 0.00 0.46 -0.91 -0.25 -0.00 0.00 0.00 178.16 177.47 1h7y n ASP 129 N -3.29 -8.87 -3.84 3.88 8.00 -0.67 -2.07 116.55 109.69 1h7y n ASP 129 Ca 0.01 1.03 -0.24 0.00 0.71 0.00 0.00 54.79 56.31 1h7y n ASP 129 Cb 0.68 -4.76 -0.17 0.00 -0.02 0.00 0.00 41.12 36.84 1h7y n ASP 129 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1h7y s PHE 130 N -3.24 0.97 0.36 1.24 0.08 -1.26 -4.45 117.98 111.69 1h7y s PHE 130 Ca 0.00 -0.37 0.07 0.00 0.12 0.00 0.00 56.93 56.75 1h7y s PHE 130 Cb 0.00 -0.93 -0.01 0.00 -0.57 0.00 0.00 43.02 41.52 1h7y s PHE 130 CO 0.00 -0.36 0.47 0.71 -0.10 0.00 0.00 175.22 175.94 1h7y s TYR 131 N 1.66 2.97 -0.17 0.36 1.51 -0.47 -2.44 117.35 120.77 1h7y s TYR 131 Ca 0.01 -0.30 -0.12 0.00 -1.01 0.00 0.00 57.07 55.65 1h7y s TYR 131 Cb -0.13 -2.09 0.05 0.00 -0.11 0.00 0.00 41.96 39.68 1h7y s TYR 131 CO -0.05 -0.11 0.43 -1.50 -1.11 0.00 0.00 175.55 173.21 1h7y s ILE 132 N -2.26 -0.01 1.14 2.71 2.07 -0.52 -3.37 121.20 120.96 1h7y s ILE 132 Ca 0.48 0.04 -0.18 0.00 -1.41 0.00 0.00 60.65 59.58 1h7y s ILE 132 Cb -0.09 -0.62 0.18 0.00 0.13 0.00 0.00 42.46 42.06 1h7y s ILE 132 CO 0.31 0.02 0.28 0.61 -1.91 0.00 0.00 174.94 174.25 1h7y n GLY 133 N 3.54 -2.65 0.26 1.50 0.00 -1.26 -0.44 105.19 106.15 1h7y n GLY 133 Ca -0.18 -0.95 0.13 0.00 0.00 0.00 0.00 46.02 45.02 1h7y n GLY 133 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1h7y h GLU 134 N -2.51 0.00 -0.56 1.61 4.81 -1.82 -2.35 114.58 113.76 1h7y h GLU 134 Ca -0.45 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 58.80 1h7y h GLU 134 Cb 1.19 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 1h7y h GLU 134 CO 0.31 0.12 0.37 0.66 -0.73 0.00 0.00 179.01 179.75 1h7y h SER 135 N 0.00 0.59 -3.67 1.04 4.64 -1.90 -3.47 113.55 110.78 1h7y h SER 135 Ca -0.00 -0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.18 1h7y h SER 135 Cb 0.40 -0.14 0.07 0.00 -0.31 0.00 0.00 62.40 62.43 1h7y h SER 135 CO 0.02 0.41 -0.33 0.80 -0.87 0.00 0.00 176.83 176.86 1h7y n MET 136 N -4.46 -2.20 -4.49 4.77 1.56 -0.88 -5.05 117.12 106.36 1h7y n MET 136 Ca 0.06 0.36 -0.22 0.00 -0.27 0.00 0.00 57.70 57.63 1h7y n MET 136 Cb 0.11 -3.72 -0.16 0.00 2.15 0.00 0.00 33.22 31.60 1h7y n MET 136 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 1h7y s ASP 137 N -3.44 1.47 0.00 6.12 -1.08 -1.26 -5.00 116.67 113.48 1h7y s ASP 137 Ca 0.06 -0.23 0.24 0.00 -0.52 0.00 0.00 52.55 52.10 1h7y s ASP 137 Cb -0.01 -0.48 1.43 0.00 -1.46 0.00 0.00 42.92 42.40 1h7y s ASP 137 CO 0.30 0.06 1.80 -0.81 0.52 0.00 0.00 175.17 177.05 1h7y n PRO 138 N 3.44 0.74 -0.25 4.34 -0.04 -1.26 -2.41 135.00 139.56 1h7y n PRO 138 Ca -0.20 0.00 0.10 0.00 -0.04 0.00 0.00 63.50 63.37 1h7y n PRO 138 Cb 0.53 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.73 1h7y n PRO 138 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1h7y n ASP 139 N -1.01 3.47 -1.26 3.54 -0.08 -1.26 -4.24 116.55 115.72 1h7y n ASP 139 Ca 0.18 -1.97 0.08 0.00 -1.51 0.00 0.00 54.79 51.57 1h7y n ASP 139 Cb 0.09 -0.33 0.30 0.00 2.34 0.00 0.00 41.12 43.52 1h7y n ASP 139 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1h7y n ALA 140 N 1.30 3.15 -0.46 -1.67 0.00 -1.01 -4.43 120.51 117.39 1h7y n ALA 140 Ca 0.19 -1.93 0.00 0.00 0.00 0.00 0.00 53.44 51.70 1h7y n ALA 140 Cb 0.56 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 19.16 1h7y n ALA 140 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1h7y n MET 141 N 0.23 -1.22 -4.90 0.00 1.56 -1.26 -4.87 117.12 106.65 1h7y n MET 141 Ca 0.23 0.94 -0.33 0.00 -0.27 0.00 0.00 57.70 58.27 1h7y n MET 141 Cb 0.92 -1.15 -0.13 0.00 2.15 0.00 0.00 33.22 35.00 1h7y n MET 141 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 1h7y s VAL 142 N -4.07 3.02 -0.20 1.12 1.01 -1.26 -4.73 120.40 115.29 1h7y s VAL 142 Ca 0.00 -0.73 -0.07 0.00 0.00 0.00 0.00 61.98 61.18 1h7y s VAL 142 Cb 0.00 -2.18 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 1h7y s VAL 142 CO 0.00 0.59 0.05 -0.69 0.00 0.00 0.00 175.10 175.04 1h7y s VAL 143 N -0.65 4.42 0.07 2.92 1.01 -1.22 -4.89 120.40 122.06 1h7y s VAL 143 Ca 0.10 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 61.96 1h7y s VAL 143 Cb -0.11 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 1h7y s VAL 143 CO 0.01 0.42 0.06 -0.76 0.00 0.00 0.00 175.10 174.82 1h7y s LEU 144 N 0.88 3.72 -0.02 3.92 1.02 -1.26 -1.37 118.68 125.57 1h7y s LEU 144 Ca 0.03 -0.03 -0.09 0.00 0.02 0.00 0.00 54.13 54.05 1h7y s LEU 144 Cb -0.14 -2.39 0.01 0.00 0.02 0.00 0.00 46.19 43.70 1h7y s LEU 144 CO 0.02 0.19 0.20 0.00 0.02 0.00 0.00 176.35 176.77 1h7y s MET 145 N -2.28 0.46 0.16 1.70 0.23 -0.88 -1.64 119.30 117.06 1h7y s MET 145 Ca 0.28 -0.17 -0.19 0.00 -1.03 0.00 0.00 55.69 54.58 1h7y s MET 145 Cb -0.12 0.20 0.04 0.00 -1.53 0.00 0.00 34.83 33.42 1h7y s MET 145 CO 0.20 -0.11 0.50 0.54 -2.03 0.00 0.00 175.02 174.12 1h7y s ASN 146 N -0.98 -0.34 0.34 -1.18 4.22 -1.00 -4.42 114.94 111.58 1h7y s ASN 146 Ca -0.11 -0.28 -0.29 0.00 -2.14 0.00 0.00 52.86 50.04 1h7y s ASN 146 Cb -0.06 0.55 -0.11 0.00 1.28 0.00 0.00 41.25 42.92 1h7y s ASN 146 CO 0.02 -0.96 1.39 -0.31 -2.04 0.00 0.00 177.10 175.20 1h7y s TYR 147 N -3.81 2.88 0.04 1.54 2.02 -1.26 -2.08 117.35 116.67 1h7y s TYR 147 Ca 0.04 1.27 -0.01 0.00 -0.37 0.00 0.00 57.07 58.01 1h7y s TYR 147 Cb 0.00 -3.82 0.01 0.00 -0.40 0.00 0.00 41.96 37.75 1h7y s TYR 147 CO -0.09 -2.38 0.03 2.89 -1.57 0.00 0.00 175.55 174.43 1h7y n ARG 148 N 0.90 -1.02 0.22 -0.62 1.85 -0.98 -4.74 116.66 112.26 1h7y n ARG 148 Ca 0.01 -0.05 0.07 0.00 -1.00 0.00 0.00 57.85 56.88 1h7y n ARG 148 Cb 0.41 -0.05 0.52 0.00 -1.05 0.00 0.00 32.46 32.29 1h7y n ARG 148 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 177.63 179.11 1h7y h GLU 149 N 0.00 0.00 0.00 2.89 4.81 -1.94 -1.49 114.58 118.85 1h7y h GLU 149 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1h7y h GLU 149 Cb 0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1h7y h GLU 149 CO 0.01 0.23 0.00 -0.25 -0.73 0.00 0.00 179.01 178.27 1h7y n ASP 150 N -3.95 0.78 -1.74 1.04 9.92 -1.26 -4.86 116.55 116.48 1h7y n ASP 150 Ca -0.02 0.62 -0.17 0.00 -0.53 0.00 0.00 54.79 54.69 1h7y n ASP 150 Cb 0.31 -0.81 -0.06 0.00 -0.64 0.00 0.00 41.12 39.92 1h7y n ASP 150 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1h7y n GLY 151 N 0.76 1.06 0.05 0.44 0.00 -0.56 -4.76 105.19 102.17 1h7y n GLY 151 Ca 0.04 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 1h7y n GLY 151 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1h7y n ILE 152 N -2.57 0.64 -3.95 -0.61 -6.64 -1.26 -4.95 119.36 100.03 1h7y n ILE 152 Ca -0.18 -0.42 -0.15 0.00 -1.77 0.00 0.00 62.75 60.23 1h7y n ILE 152 Cb 0.59 -0.66 -0.15 0.00 -1.44 0.00 0.00 39.64 37.98 1h7y n ILE 152 CO 0.00 0.00 0.00 0.28 -1.77 0.00 0.00 176.55 175.06 1h7y s THR 153 N -2.28 0.15 0.45 7.28 -1.32 -1.26 -5.05 115.64 113.61 1h7y s THR 153 Ca -0.05 0.01 -0.18 0.00 -1.21 0.00 0.00 61.69 60.26 1h7y s THR 153 Cb 0.03 -0.20 -0.09 0.00 -1.51 0.00 0.00 72.50 70.73 1h7y s THR 153 CO 0.42 0.09 0.93 -2.16 -2.21 0.00 0.00 174.62 171.69 1h7y s PRO 154 N 0.51 4.07 -0.08 7.08 0.04 -1.26 -2.32 135.00 143.04 1h7y s PRO 154 Ca -0.05 0.97 -0.05 0.00 0.04 0.00 0.00 61.00 61.91 1h7y s PRO 154 Cb -0.08 -2.21 0.03 0.00 0.04 0.00 0.00 34.50 32.29 1h7y s PRO 154 CO -0.01 -0.09 0.20 1.52 0.04 0.00 0.00 177.00 178.65 1h7y s TYR 155 N -2.33 -0.24 0.17 0.56 1.13 -0.88 -2.29 117.35 113.48 1h7y s TYR 155 Ca 0.59 0.59 0.05 0.00 -1.41 0.00 0.00 57.07 56.90 1h7y s TYR 155 Cb -0.10 0.02 -0.04 0.00 -1.10 0.00 0.00 41.96 40.74 1h7y s TYR 155 CO 0.21 -0.17 0.14 0.00 -2.51 0.00 0.00 175.55 173.23 1h7y s MET 156 N 0.81 2.89 0.20 -3.49 0.23 -1.20 -2.37 119.30 116.37 1h7y s MET 156 Ca -0.06 -0.89 0.11 0.00 -1.03 0.00 0.00 55.69 53.82 1h7y s MET 156 Cb -0.07 -2.63 -0.04 0.00 -1.53 0.00 0.00 34.83 30.55 1h7y s MET 156 CO -0.05 0.48 -0.19 0.42 -2.03 0.00 0.00 175.02 173.65 1h7y s ILE 157 N -1.79 2.64 0.19 3.16 1.01 -0.65 -2.29 121.20 123.47 1h7y s ILE 157 Ca 0.31 -1.95 0.03 0.00 0.00 0.00 0.00 60.65 59.04 1h7y s ILE 157 Cb -0.10 -2.29 -0.05 0.00 0.01 0.00 0.00 42.46 40.03 1h7y s ILE 157 CO 0.23 -0.14 -0.01 -0.36 0.00 0.00 0.00 174.94 174.66 1h7y s PHE 158 N -1.76 1.34 -0.23 3.97 0.40 -0.37 -4.00 117.98 117.32 1h7y s PHE 158 Ca 0.23 -0.95 -0.06 0.00 -0.60 0.00 0.00 56.93 55.55 1h7y s PHE 158 Cb -0.08 -0.76 -0.02 0.00 0.51 0.00 0.00 43.02 42.67 1h7y s PHE 158 CO 0.12 -0.11 0.03 -0.06 0.70 0.00 0.00 175.22 175.90 1h7y s PHE 159 N -3.53 3.05 0.45 0.36 0.08 -1.26 -1.58 117.98 115.55 1h7y s PHE 159 Ca 0.24 -0.54 0.11 0.00 0.12 0.00 0.00 56.93 56.87 1h7y s PHE 159 Cb 0.05 -2.17 1.02 0.00 -0.57 0.00 0.00 43.02 41.35 1h7y s PHE 159 CO 0.05 -0.37 2.07 -0.22 -0.10 0.00 0.00 175.22 176.65 1h7y h LYS 160 N 8.03 0.35 -1.29 0.44 3.64 -1.82 -1.80 116.57 124.13 1h7y h LYS 160 Ca -0.39 -0.02 0.37 0.00 -1.27 0.00 0.00 60.65 59.35 1h7y h LYS 160 Cb 1.17 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 32.86 1h7y h LYS 160 CO 0.59 0.23 1.06 0.38 -2.27 0.00 0.00 179.45 179.45 1h7y h ASP 161 N 0.36 0.00 -1.97 4.20 3.04 -1.94 -0.91 116.42 119.21 1h7y h ASP 161 Ca 0.14 0.00 -0.52 0.00 -3.24 0.00 0.00 57.03 53.41 1h7y h ASP 161 Cb 0.09 0.00 -0.41 0.00 -1.04 0.00 0.00 39.33 37.97 1h7y h ASP 161 CO -0.03 0.00 -0.95 0.61 -2.04 0.00 0.00 179.24 176.83 1h7y n GLY 162 N -1.77 4.35 3.39 7.15 0.00 -0.67 -5.02 105.19 112.62 1h7y n GLY 162 Ca 0.28 -2.15 -0.13 0.00 0.00 0.00 0.00 46.02 44.03 1h7y n GLY 162 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h7y s LEU 163 N -2.98 0.01 -0.10 0.99 1.43 -0.35 -4.08 118.68 113.60 1h7y s LEU 163 Ca 0.43 1.02 0.04 0.00 -1.03 0.00 0.00 54.13 54.58 1h7y s LEU 163 Cb 0.34 1.71 -0.00 0.00 0.03 0.00 0.00 46.19 48.26 1h7y s LEU 163 CO -0.10 -0.18 -0.22 0.68 0.23 0.00 0.00 176.35 176.76 1h7y s VAL 164 N 0.49 2.22 -0.14 -1.59 -7.23 -0.97 -4.94 120.40 108.25 1h7y s VAL 164 Ca -0.02 -0.97 -0.24 0.00 -1.81 0.00 0.00 61.98 58.94 1h7y s VAL 164 Cb -0.04 -1.85 -0.02 0.00 0.56 0.00 0.00 36.38 35.02 1h7y s VAL 164 CO -0.02 0.56 0.76 -0.94 -0.31 0.00 0.00 175.10 175.15 1h7y s SER 165 N 0.25 6.93 -0.02 4.85 1.04 -1.26 -3.35 113.70 122.14 1h7y s SER 165 Ca -0.15 1.14 0.04 0.00 0.48 0.00 0.00 55.95 57.45 1h7y s SER 165 Cb -0.17 -2.43 -0.03 0.00 0.10 0.00 0.00 66.02 63.49 1h7y s SER 165 CO 0.08 -0.28 -0.11 -1.61 0.98 0.00 0.00 173.24 172.29 1h7y s GLU 166 N 1.64 2.49 -0.22 4.02 8.01 -0.53 -4.93 118.70 129.19 1h7y s GLU 166 Ca 0.37 -0.72 -0.09 0.00 0.01 0.00 0.00 54.97 54.54 1h7y s GLU 166 Cb -0.17 -2.43 -0.04 0.00 -4.31 0.00 0.00 34.13 27.18 1h7y s GLU 166 CO 0.14 0.61 0.11 0.21 0.01 0.00 0.00 175.26 176.34 1h7y s LYS 167 N -1.07 3.98 0.00 1.61 2.47 -1.26 -2.24 119.74 123.22 1h7y s LYS 167 Ca 0.14 -0.33 0.00 0.00 -1.56 0.00 0.00 55.97 54.22 1h7y s LYS 167 Cb -0.11 -3.37 0.00 0.00 -1.46 0.00 0.00 37.83 32.89 1h7y s LYS 167 CO 0.04 0.12 0.09 1.97 0.16 0.00 0.00 175.35 177.72