#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o3y s SER 17 N 0.00 3.74 -0.13 1.61 1.04 -1.26 -4.93 113.70 113.77 1o3y s SER 17 Ca 0.00 -1.28 -0.28 0.00 0.48 0.00 0.00 55.95 54.86 1o3y s SER 17 Cb 0.00 -0.36 -0.01 0.00 0.10 0.00 0.00 66.02 65.75 1o3y s SER 17 CO 0.00 -0.33 0.96 -0.04 0.98 0.00 0.00 173.24 174.80 1o3y s MET 18 N -3.67 4.39 -0.29 4.02 1.00 0.02 -4.85 119.30 119.92 1o3y s MET 18 Ca 0.34 1.29 -0.23 0.00 0.00 0.00 0.00 55.69 57.09 1o3y s MET 18 Cb 0.06 -3.55 -0.01 0.00 0.00 0.00 0.00 34.83 31.34 1o3y s MET 18 CO 0.17 -0.32 0.74 0.50 0.00 0.00 0.00 175.02 176.11 1o3y s ARG 19 N 2.06 4.01 -0.12 2.03 3.52 -1.26 -0.65 118.95 128.55 1o3y s ARG 19 Ca 0.45 0.59 0.02 0.00 -0.13 0.00 0.00 55.73 56.67 1o3y s ARG 19 Cb -0.18 -3.70 -0.00 0.00 -1.56 0.00 0.00 34.95 29.51 1o3y s ARG 19 CO 0.16 -0.59 -0.20 0.42 -0.81 0.00 0.00 175.30 174.28 1o3y s ILE 20 N 2.81 2.33 -0.26 4.11 -1.09 0.06 -0.94 121.20 128.23 1o3y s ILE 20 Ca 0.31 -0.91 -0.09 0.00 -2.23 0.00 0.00 60.65 57.73 1o3y s ILE 20 Cb -0.15 -1.93 -0.04 0.00 -1.58 0.00 0.00 42.46 38.77 1o3y s ILE 20 CO 0.11 0.55 0.11 -0.22 -1.23 0.00 0.00 174.94 174.25 1o3y s LEU 21 N 0.47 3.66 -0.34 2.97 2.96 -0.20 -0.67 118.68 127.53 1o3y s LEU 21 Ca -0.14 -0.12 -0.10 0.00 -0.22 0.00 0.00 54.13 53.55 1o3y s LEU 21 Cb -0.17 -1.99 0.01 0.00 0.50 0.00 0.00 46.19 44.54 1o3y s LEU 21 CO 0.06 -0.03 0.17 -0.32 -1.32 0.00 0.00 176.35 174.91 1o3y s MET 22 N 1.59 3.03 0.39 1.98 -2.45 0.10 -0.76 119.30 123.18 1o3y s MET 22 Ca 0.06 -0.93 0.05 0.00 -1.25 0.00 0.00 55.69 53.62 1o3y s MET 22 Cb -0.15 -3.62 -0.02 0.00 1.25 0.00 0.00 34.83 32.29 1o3y s MET 22 CO 0.06 -0.57 0.19 0.14 1.05 0.00 0.00 175.02 175.89 1o3y s VAL 23 N 1.56 0.36 0.00 10.11 -7.23 -0.34 -2.44 120.40 122.42 1o3y s VAL 23 Ca 0.03 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.20 1o3y s VAL 23 Cb -0.18 -2.36 0.00 0.00 0.56 0.00 0.00 36.38 34.39 1o3y s VAL 23 CO 0.06 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.46 1o3y n GLY 24 N -0.84 3.70 3.65 2.32 0.00 -1.26 -1.36 105.19 111.40 1o3y n GLY 24 Ca -0.02 -1.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.16 1o3y n GLY 24 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1o3y n LEU 25 N 0.00 3.47 -4.57 0.99 4.77 -1.26 -4.25 117.00 116.15 1o3y n LEU 25 Ca 0.00 0.52 -0.37 0.00 -0.03 0.00 0.00 56.01 56.12 1o3y n LEU 25 Cb 0.00 -1.45 0.06 0.00 -2.33 0.00 0.00 43.42 39.69 1o3y n LEU 25 CO 0.00 -2.09 0.41 -0.90 -1.33 0.00 0.00 177.39 173.48 1o3y n ASP 26 N -3.18 0.21 0.00 -1.43 5.75 -0.95 -2.58 116.55 114.37 1o3y n ASP 26 Ca 0.12 0.75 0.00 0.00 -0.01 0.00 0.00 54.79 55.66 1o3y n ASP 26 Cb 0.51 -1.34 0.00 0.00 -1.03 0.00 0.00 41.12 39.27 1o3y n ASP 26 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1o3y n ALA 27 N -1.89 0.00 0.16 2.12 0.00 -1.26 -4.89 120.51 114.74 1o3y n ALA 27 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1o3y n ALA 27 Cb 0.48 -0.39 0.25 0.00 0.00 0.00 0.00 19.45 19.78 1o3y n ALA 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o3y h ALA 28 N 0.00 1.13 0.00 0.00 0.00 -1.83 -3.46 119.26 115.10 1o3y h ALA 28 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1o3y h ALA 28 Cb 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1o3y h ALA 28 CO 0.00 0.65 0.00 0.41 0.00 0.00 0.00 179.25 180.31 1o3y n GLY 29 N -0.02 1.56 0.24 0.00 0.00 -1.26 -4.25 105.19 101.46 1o3y n GLY 29 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 1o3y n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1o3y h LYS 30 N 0.45 -0.35 -0.72 1.61 1.57 -1.91 -0.08 116.57 117.15 1o3y h LYS 30 Ca 0.00 0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 1o3y h LYS 30 Cb 0.00 0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.36 1o3y h LYS 30 CO 0.00 -0.23 0.24 1.15 -0.57 0.00 0.00 179.45 180.04 1o3y h THR 31 N -0.36 1.25 -0.49 -0.16 2.02 -1.97 -0.08 112.91 113.12 1o3y h THR 31 Ca 0.04 -0.85 0.03 0.00 0.77 0.00 0.00 66.41 66.40 1o3y h THR 31 Cb 0.40 0.44 -0.04 0.00 -1.74 0.00 0.00 68.15 67.21 1o3y h THR 31 CO -0.14 0.34 0.28 0.74 0.37 0.00 0.00 175.52 177.11 1o3y h THR 32 N 1.06 1.01 -0.41 3.16 2.02 -1.83 -2.39 112.91 115.53 1o3y h THR 32 Ca 0.24 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 67.20 1o3y h THR 32 Cb 0.27 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 1o3y h THR 32 CO -0.01 0.10 0.15 0.40 0.37 0.00 0.00 175.52 176.53 1o3y h ILE 33 N 0.55 1.20 -0.28 3.11 2.04 -0.53 -1.09 117.51 122.52 1o3y h ILE 33 Ca 0.21 -0.64 0.05 0.00 1.00 0.00 0.00 64.86 65.48 1o3y h ILE 33 Cb 0.06 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 1o3y h ILE 33 CO -0.11 0.23 -0.05 0.25 0.00 0.00 0.00 178.15 178.47 1o3y h LEU 34 N 0.52 -0.21 0.00 1.44 5.85 -0.70 0.41 115.31 122.62 1o3y h LEU 34 Ca 0.14 0.08 -0.10 0.00 0.84 0.00 0.00 57.88 58.83 1o3y h LEU 34 Cb 0.21 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1o3y h LEU 34 CO -0.01 -0.07 -0.48 1.88 -0.34 0.00 0.00 178.44 179.42 1o3y h TYR 35 N 0.02 0.00 -0.21 1.25 0.05 -1.40 -0.79 116.97 115.89 1o3y h TYR 35 Ca 0.13 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.87 1o3y h TYR 35 Cb 0.19 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.93 1o3y h TYR 35 CO -0.25 0.48 -0.02 -0.22 -1.05 0.00 0.00 178.16 177.10 1o3y h LYS 36 N 0.00 0.38 -0.43 4.88 1.63 -0.90 0.23 116.57 122.36 1o3y h LYS 36 Ca -0.00 -0.13 0.01 0.00 -0.85 0.00 0.00 60.65 59.68 1o3y h LYS 36 Cb 1.37 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.94 1o3y h LYS 36 CO 0.06 0.60 0.26 -0.07 -3.45 0.00 0.00 179.45 176.85 1o3y h LEU 37 N 0.13 0.44 0.16 5.20 3.38 -0.81 -1.30 115.31 122.50 1o3y h LEU 37 Ca 0.06 -0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.81 1o3y h LEU 37 Cb 0.44 -0.09 0.02 0.00 0.09 0.00 0.00 40.66 41.12 1o3y h LEU 37 CO 0.01 0.31 -0.92 0.50 0.09 0.00 0.00 178.44 178.44 1o3y h LYS 38 N 0.53 0.35 0.00 1.13 1.63 -1.10 -3.40 116.57 115.71 1o3y h LYS 38 Ca 0.17 -0.58 0.00 0.00 -0.85 0.00 0.00 60.65 59.38 1o3y h LYS 38 Cb -0.01 0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.83 1o3y h LYS 38 CO -0.07 1.28 -1.06 1.28 -3.45 0.00 0.00 179.45 177.43 1o3y n LEU 39 N -4.06 0.26 -0.89 5.20 4.77 0.78 -5.00 117.00 118.07 1o3y n LEU 39 Ca -0.14 -0.24 -0.09 0.00 -0.03 0.00 0.00 56.01 55.51 1o3y n LEU 39 Cb 0.87 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.94 1o3y n LEU 39 CO 0.51 0.06 -0.10 0.61 -1.33 0.00 0.00 177.39 177.14 1o3y n GLY 40 N 1.56 0.39 3.14 -0.72 0.00 -0.49 -5.00 105.19 104.07 1o3y n GLY 40 Ca -0.00 -0.56 -0.09 0.00 0.00 0.00 0.00 46.02 45.37 1o3y n GLY 40 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o3y s GLU 41 N -3.83 0.78 -0.37 1.61 0.41 -1.25 -5.02 118.70 111.03 1o3y s GLU 41 Ca 0.00 -1.32 -0.15 0.00 -0.41 0.00 0.00 54.97 53.09 1o3y s GLU 41 Cb 0.00 -0.01 0.00 0.00 -1.78 0.00 0.00 34.13 32.34 1o3y s GLU 41 CO 0.00 -0.09 0.33 0.42 -0.49 0.00 0.00 175.26 175.43 1o3y s ILE 42 N -3.78 5.21 0.08 -1.63 -1.09 -1.26 -3.26 121.20 115.46 1o3y s ILE 42 Ca 0.12 -0.29 -0.05 0.00 -2.23 0.00 0.00 60.65 58.20 1o3y s ILE 42 Cb 0.07 -3.86 -0.05 0.00 -1.58 0.00 0.00 42.46 37.03 1o3y s ILE 42 CO -0.05 -0.19 0.32 0.68 -1.23 0.00 0.00 174.94 174.47 1o3y s VAL 43 N 1.87 5.23 0.20 2.92 -7.23 -1.26 -5.07 120.40 117.06 1o3y s VAL 43 Ca 0.08 0.08 -0.30 0.00 -1.81 0.00 0.00 61.98 60.03 1o3y s VAL 43 Cb -0.18 -3.61 -0.08 0.00 0.56 0.00 0.00 36.38 33.08 1o3y s VAL 43 CO 0.11 0.20 1.18 -0.89 -0.31 0.00 0.00 175.10 175.39 1o3y s THR 44 N -1.48 3.56 0.30 5.32 2.01 -1.26 -4.87 115.64 119.22 1o3y s THR 44 Ca 0.34 1.35 0.08 0.00 0.31 0.00 0.00 61.69 63.77 1o3y s THR 44 Cb -0.13 -3.86 -0.06 0.00 0.01 0.00 0.00 72.50 68.46 1o3y s THR 44 CO 0.21 0.23 -0.07 0.42 -0.69 0.00 0.00 174.62 174.72 1o3y s THR 45 N -0.24 1.84 0.31 -0.82 -4.23 -1.26 -5.11 115.64 106.13 1o3y s THR 45 Ca 0.51 -2.15 0.09 0.00 -1.18 0.00 0.00 61.69 58.96 1o3y s THR 45 Cb -0.32 -2.51 -0.06 0.00 1.34 0.00 0.00 72.50 70.95 1o3y s THR 45 CO 0.37 -0.27 -0.11 0.27 -0.54 0.00 0.00 174.62 174.35 1o3y s ILE 46 N -2.88 2.13 0.07 2.99 -4.36 -1.26 -5.11 121.20 112.78 1o3y s ILE 46 Ca 0.30 -2.22 -0.35 0.00 -0.26 0.00 0.00 60.65 58.12 1o3y s ILE 46 Cb 0.03 -2.52 -0.15 0.00 1.25 0.00 0.00 42.46 41.08 1o3y s ILE 46 CO 0.13 -0.27 1.56 -2.65 0.24 0.00 0.00 174.94 173.95 1o3y n PRO 47 N -0.70 1.78 -2.63 0.37 -0.02 -1.26 -4.88 135.00 127.65 1o3y n PRO 47 Ca -0.05 0.64 -0.43 0.00 -2.02 0.00 0.00 63.50 61.64 1o3y n PRO 47 Cb 0.63 -2.38 -0.02 0.00 -0.02 0.00 0.00 33.50 31.71 1o3y n PRO 47 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1o3y s THR 48 N 1.44 4.58 0.08 3.45 2.01 -1.26 -4.93 115.64 121.01 1o3y s THR 48 Ca 0.84 1.87 -0.02 0.00 0.31 0.00 0.00 61.69 64.69 1o3y s THR 48 Cb -0.79 -4.33 -0.27 0.00 0.01 0.00 0.00 72.50 67.12 1o3y s THR 48 CO 0.45 -0.30 1.16 0.40 -0.69 0.00 0.00 174.62 175.63 1o3y h ILE 49 N 5.57 1.53 0.00 1.82 1.08 -1.97 -3.37 117.51 122.18 1o3y h ILE 49 Ca -0.20 -3.13 0.00 0.00 -0.39 0.00 0.00 64.86 61.14 1o3y h ILE 49 Cb 1.06 2.93 0.00 0.00 -3.07 0.00 0.00 36.82 37.74 1o3y h ILE 49 CO 1.00 0.91 0.00 0.61 -0.69 0.00 0.00 178.15 179.98 1o3y n GLY 50 N 1.50 0.71 3.36 5.37 0.00 -1.26 -4.83 105.19 110.05 1o3y n GLY 50 Ca -0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.84 1o3y n GLY 50 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1o3y s PHE 51 N 0.96 -0.24 0.16 1.61 -0.12 -1.26 -2.02 117.98 117.07 1o3y s PHE 51 Ca 0.00 -0.06 0.11 0.00 -0.05 0.00 0.00 56.93 56.93 1o3y s PHE 51 Cb 0.00 0.32 -0.04 0.00 -0.63 0.00 0.00 43.02 42.67 1o3y s PHE 51 CO 0.00 -0.75 -0.25 -0.80 -0.05 0.00 0.00 175.22 173.37 1o3y s ASN 52 N -2.80 3.32 -0.06 1.98 0.02 0.35 -4.99 114.94 112.75 1o3y s ASN 52 Ca 0.03 -0.81 -0.04 0.00 -1.02 0.00 0.00 52.86 51.02 1o3y s ASN 52 Cb 0.01 -0.23 0.03 0.00 0.02 0.00 0.00 41.25 41.07 1o3y s ASN 52 CO -0.11 0.14 0.15 0.54 0.02 0.00 0.00 177.10 177.84 1o3y s VAL 53 N -1.40 -0.02 -0.00 1.60 0.11 -1.26 -0.55 120.40 118.87 1o3y s VAL 53 Ca 0.17 0.08 -0.10 0.00 -2.93 0.00 0.00 61.98 59.20 1o3y s VAL 53 Cb -0.09 -0.23 0.01 0.00 -1.53 0.00 0.00 36.38 34.54 1o3y s VAL 53 CO 0.08 0.03 0.20 -1.61 -3.33 0.00 0.00 175.10 170.47 1o3y s GLU 54 N 0.56 0.55 -0.22 1.54 0.41 -1.09 -5.01 118.70 115.44 1o3y s GLU 54 Ca -0.04 -0.33 -0.13 0.00 -0.41 0.00 0.00 54.97 54.06 1o3y s GLU 54 Cb -0.06 0.24 -0.04 0.00 -1.78 0.00 0.00 34.13 32.49 1o3y s GLU 54 CO -0.03 -0.14 0.28 0.99 -0.49 0.00 0.00 175.26 175.88 1o3y s THR 55 N -1.37 5.27 -0.16 3.63 2.01 -1.26 -0.88 115.64 122.88 1o3y s THR 55 Ca -0.14 0.44 -0.02 0.00 0.31 0.00 0.00 61.69 62.28 1o3y s THR 55 Cb -0.07 -3.62 -0.02 0.00 0.01 0.00 0.00 72.50 68.81 1o3y s THR 55 CO 0.03 0.29 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.48 1o3y s VAL 56 N 1.25 3.43 -0.17 3.82 1.01 0.13 -4.92 120.40 124.94 1o3y s VAL 56 Ca 0.13 -0.51 -0.14 0.00 0.00 0.00 0.00 61.98 61.46 1o3y s VAL 56 Cb -0.14 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1o3y s VAL 56 CO 0.06 0.49 0.32 -0.70 0.00 0.00 0.00 175.10 175.27 1o3y s GLU 57 N 0.66 4.23 -0.05 2.72 2.12 -1.26 0.01 118.70 127.13 1o3y s GLU 57 Ca -0.04 0.12 -0.00 0.00 0.36 0.00 0.00 54.97 55.41 1o3y s GLU 57 Cb -0.15 -3.46 0.03 0.00 0.26 0.00 0.00 34.13 30.81 1o3y s GLU 57 CO 0.02 0.16 -0.00 -0.47 -0.54 0.00 0.00 175.26 174.43 1o3y s TYR 58 N 0.72 0.47 -1.55 5.30 5.04 0.32 -4.85 117.35 122.80 1o3y s TYR 58 Ca 0.17 -0.06 -0.08 0.00 -2.44 0.00 0.00 57.07 54.66 1o3y s TYR 58 Cb -0.14 -0.58 0.07 0.00 0.35 0.00 0.00 41.96 41.66 1o3y s TYR 58 CO 0.05 -0.21 0.51 1.63 -1.34 0.00 0.00 175.55 176.19 1o3y n LYS 59 N 4.56 -2.88 -1.27 4.97 5.02 -1.26 -1.29 118.16 126.00 1o3y n LYS 59 Ca -0.18 0.35 -0.09 0.00 -2.02 0.00 0.00 58.31 56.37 1o3y n LYS 59 Cb 0.50 -4.63 -0.04 0.00 -0.02 0.00 0.00 35.03 30.84 1o3y n LYS 59 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1o3y n ASN 60 N -2.83 -4.51 -4.34 4.39 5.15 -1.26 -5.01 115.26 106.85 1o3y n ASN 60 Ca -0.15 0.23 -0.32 0.00 -0.60 0.00 0.00 54.58 53.74 1o3y n ASN 60 Cb 0.61 -2.83 -0.15 0.00 -0.53 0.00 0.00 39.78 36.87 1o3y n ASN 60 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1o3y s ILE 61 N -2.22 2.51 -0.22 -1.44 -1.09 -0.41 -5.12 121.20 113.20 1o3y s ILE 61 Ca 0.00 -0.90 -0.09 0.00 -2.23 0.00 0.00 60.65 57.43 1o3y s ILE 61 Cb 0.00 -1.96 -0.04 0.00 -1.58 0.00 0.00 42.46 38.87 1o3y s ILE 61 CO 0.00 0.57 0.12 -0.44 -1.23 0.00 0.00 174.94 173.95 1o3y s SER 62 N -0.18 5.84 -0.21 3.58 0.01 -1.26 -0.52 113.70 120.96 1o3y s SER 62 Ca -0.02 0.06 -0.03 0.00 1.31 0.00 0.00 55.95 57.28 1o3y s SER 62 Cb -0.14 -2.04 -0.00 0.00 0.21 0.00 0.00 66.02 64.05 1o3y s SER 62 CO 0.03 0.09 -0.08 -0.36 0.41 0.00 0.00 173.24 173.33 1o3y s PHE 63 N 0.90 2.91 -0.40 2.43 0.40 0.10 -0.80 117.98 123.52 1o3y s PHE 63 Ca 0.06 -1.07 -0.24 0.00 -0.60 0.00 0.00 56.93 55.09 1o3y s PHE 63 Cb -0.13 -2.05 0.02 0.00 0.51 0.00 0.00 43.02 41.36 1o3y s PHE 63 CO 0.03 -0.58 0.81 0.99 0.70 0.00 0.00 175.22 177.16 1o3y s THR 64 N 1.38 4.67 -0.27 0.64 2.01 0.18 0.17 115.64 124.41 1o3y s THR 64 Ca 0.05 0.75 -0.07 0.00 0.31 0.00 0.00 61.69 62.72 1o3y s THR 64 Cb -0.14 -4.27 -0.01 0.00 0.01 0.00 0.00 72.50 68.08 1o3y s THR 64 CO -0.05 -0.57 0.09 -0.69 -0.69 0.00 0.00 174.62 172.71 1o3y s VAL 65 N 3.25 4.22 -0.41 3.82 1.01 -0.06 -0.76 120.40 131.48 1o3y s VAL 65 Ca 0.32 -0.40 -0.17 0.00 0.00 0.00 0.00 61.98 61.73 1o3y s VAL 65 Cb -0.12 -3.07 0.01 0.00 0.00 0.00 0.00 36.38 33.20 1o3y s VAL 65 CO 0.20 0.21 0.44 0.26 0.00 0.00 0.00 175.10 176.20 1o3y s TRP 66 N 1.57 3.17 -0.51 5.22 0.52 0.16 -2.65 118.94 126.42 1o3y s TRP 66 Ca 0.05 -0.28 -0.18 0.00 0.02 0.00 0.00 56.10 55.71 1o3y s TRP 66 Cb -0.16 -2.88 0.07 0.00 -1.15 0.00 0.00 33.47 29.36 1o3y s TRP 66 CO 0.03 -0.66 0.54 0.34 0.02 0.00 0.00 176.95 177.23 1o3y s ASP 67 N 1.80 6.19 -0.13 2.95 2.15 0.28 0.00 116.67 129.91 1o3y s ASP 67 Ca 0.13 -1.19 -0.04 0.00 0.43 0.00 0.00 52.55 51.88 1o3y s ASP 67 Cb -0.17 -2.25 -0.03 0.00 -0.30 0.00 0.00 42.92 40.17 1o3y s ASP 67 CO 0.13 -0.83 -0.01 -0.69 -0.17 0.00 0.00 175.17 173.61 1o3y s VAL 68 N 2.19 4.18 0.31 1.11 1.01 -1.02 -0.49 120.40 127.69 1o3y s VAL 68 Ca 0.10 -0.27 -0.29 0.00 0.00 0.00 0.00 61.98 61.52 1o3y s VAL 68 Cb -0.22 -2.81 -0.12 0.00 0.00 0.00 0.00 36.38 33.22 1o3y s VAL 68 CO 0.09 0.53 1.38 0.61 0.00 0.00 0.00 175.10 177.70 1o3y n GLY 69 N 3.03 0.78 0.88 4.51 0.00 -0.85 -4.75 105.19 108.79 1o3y n GLY 69 Ca -0.18 0.38 0.09 0.00 0.00 0.00 0.00 46.02 46.32 1o3y n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o3y n GLY 70 N 1.28 1.47 3.71 -0.02 0.00 -1.26 -4.58 105.19 105.79 1o3y n GLY 70 Ca 0.07 -0.57 -0.43 0.00 0.00 0.00 0.00 46.02 45.09 1o3y n GLY 70 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1o3y n LEU 71 N 1.09 3.74 -0.26 0.99 4.77 -1.26 -2.23 117.00 123.84 1o3y n LEU 71 Ca 0.15 1.18 0.07 0.00 -0.03 0.00 0.00 56.01 57.38 1o3y n LEU 71 Cb 0.50 -1.51 0.20 0.00 -2.33 0.00 0.00 43.42 40.28 1o3y n LEU 71 CO 0.12 -0.29 0.95 -0.78 -1.33 0.00 0.00 177.39 176.05 1o3y h ASP 72 N 3.40 0.05 -0.75 -1.43 3.58 -1.99 -1.10 116.42 118.17 1o3y h ASP 72 Ca -0.47 0.15 0.16 0.00 0.42 0.00 0.00 57.03 57.30 1o3y h ASP 72 Cb 1.27 0.19 -0.05 0.00 1.72 0.00 0.00 39.33 42.46 1o3y h ASP 72 CO 0.69 -0.04 0.51 0.50 -2.88 0.00 0.00 179.24 178.02 1o3y h LYS 73 N 0.29 0.33 -0.16 0.28 3.64 -1.99 -1.93 116.57 117.03 1o3y h LYS 73 Ca 0.44 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.80 1o3y h LYS 73 Cb 0.76 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1o3y h LYS 73 CO -0.52 0.22 0.00 0.44 -2.27 0.00 0.00 179.45 177.32 1o3y n ILE 74 N -4.46 0.25 0.04 2.00 -5.35 -0.45 -4.50 119.36 106.89 1o3y n ILE 74 Ca 0.15 -0.62 0.12 0.00 -0.27 0.00 0.00 62.75 62.12 1o3y n ILE 74 Cb 0.58 1.17 0.57 0.00 -1.74 0.00 0.00 39.64 40.22 1o3y n ILE 74 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 1o3y h ARG 75 N 3.58 0.21 -0.55 6.28 3.08 -0.96 -0.92 114.38 125.11 1o3y h ARG 75 Ca 0.00 -0.01 0.16 0.00 0.07 0.00 0.00 59.98 60.20 1o3y h ARG 75 Cb 0.80 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.78 1o3y h ARG 75 CO 0.00 0.14 0.46 -1.35 -1.07 0.00 0.00 179.97 178.16 1o3y h PRO 76 N 0.22 0.00 0.00 0.04 0.11 -1.79 -1.71 132.00 128.88 1o3y h PRO 76 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1o3y h PRO 76 Cb 0.44 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.55 1o3y h PRO 76 CO -0.03 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.04 1o3y n LEU 77 N -4.05 0.51 -0.35 2.35 4.77 -0.35 -3.19 117.00 116.69 1o3y n LEU 77 Ca 0.10 0.58 0.06 0.00 -0.03 0.00 0.00 56.01 56.72 1o3y n LEU 77 Cb 0.69 -0.45 0.24 0.00 -2.33 0.00 0.00 43.42 41.56 1o3y n LEU 77 CO 0.33 -0.27 1.24 -0.50 -1.33 0.00 0.00 177.39 176.86 1o3y h TRP 78 N 0.00 1.12 -0.24 -1.77 4.06 -1.44 -2.07 115.95 115.60 1o3y h TRP 78 Ca 0.00 0.03 0.07 0.00 2.06 0.00 0.00 58.89 61.05 1o3y h TRP 78 Cb 0.52 -0.36 -0.01 0.00 -1.00 0.00 0.00 29.16 28.31 1o3y h TRP 78 CO 0.00 0.49 0.23 0.07 -3.56 0.00 0.00 178.44 175.67 1o3y h ARG 79 N 1.01 0.00 0.00 0.49 0.11 -1.76 0.26 114.38 114.50 1o3y h ARG 79 Ca 0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.55 1o3y h ARG 79 Cb 0.40 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.48 1o3y h ARG 79 CO -0.22 0.00 0.00 0.72 0.10 0.00 0.00 179.97 180.57 1o3y n HIS 80 N -4.00 0.48 0.42 4.08 8.25 -0.78 -2.80 115.22 120.87 1o3y n HIS 80 Ca 0.03 0.20 0.06 0.00 -0.26 0.00 0.00 57.72 57.75 1o3y n HIS 80 Cb 0.37 -0.82 0.07 0.00 1.12 0.00 0.00 29.99 30.73 1o3y n HIS 80 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1o3y n TYR 81 N -1.94 0.06 -0.14 4.41 4.02 0.08 -4.62 117.16 119.03 1o3y n TYR 81 Ca 0.02 -0.06 -0.12 0.00 -0.01 0.00 0.00 57.90 57.73 1o3y n TYR 81 Cb 0.18 -0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.49 1o3y n TYR 81 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 176.86 176.59 1o3y h PHE 82 N 2.38 1.13 -1.96 -0.72 0.05 -1.55 -3.42 116.94 112.85 1o3y h PHE 82 Ca 0.00 -0.31 -0.64 0.00 3.82 0.00 0.00 57.97 60.85 1o3y h PHE 82 Cb 0.54 -0.25 0.03 0.00 2.00 0.00 0.00 35.95 38.27 1o3y h PHE 82 CO 0.03 1.14 0.93 0.94 -0.18 0.00 0.00 178.31 181.16 1o3y n GLN 83 N -4.10 1.88 -0.91 1.51 -0.06 -1.26 -1.68 117.38 112.76 1o3y n GLN 83 Ca -0.01 0.69 0.00 0.00 -2.00 0.00 0.00 57.00 55.67 1o3y n GLN 83 Cb 0.50 -2.46 0.00 0.00 -4.06 0.00 0.00 30.24 24.22 1o3y n GLN 83 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 1o3y n ASN 84 N 5.24 -2.38 -4.72 1.69 3.02 -1.26 -4.99 115.26 111.86 1o3y n ASN 84 Ca 0.22 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.35 1o3y n ASN 84 Cb 0.25 -1.42 -0.03 0.00 -0.61 0.00 0.00 39.78 37.98 1o3y n ASN 84 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1o3y s THR 85 N -2.11 3.10 -0.11 3.41 2.01 -0.68 -4.73 115.64 116.53 1o3y s THR 85 Ca 0.00 0.82 0.19 0.00 0.31 0.00 0.00 61.69 63.01 1o3y s THR 85 Cb 0.00 -3.52 -0.28 0.00 0.01 0.00 0.00 72.50 68.71 1o3y s THR 85 CO 0.00 0.08 0.26 0.00 -0.69 0.00 0.00 174.62 174.27 1o3y n GLN 86 N 3.56 0.75 -3.82 4.92 6.02 -0.11 -4.58 117.38 124.12 1o3y n GLN 86 Ca 0.10 -0.10 -0.12 0.00 -0.01 0.00 0.00 57.00 56.87 1o3y n GLN 86 Cb 0.41 -1.49 -0.12 0.00 1.02 0.00 0.00 30.24 30.07 1o3y n GLN 86 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1o3y s GLY 87 N -4.86 -0.11 -0.15 1.08 0.00 -0.98 -2.11 107.32 100.19 1o3y s GLY 87 Ca -0.08 0.41 -0.02 0.00 0.00 0.00 0.00 44.72 45.03 1o3y s GLY 87 CO 0.82 0.33 -0.09 1.08 0.00 0.00 0.00 173.10 175.24 1o3y s LEU 88 N -0.14 2.92 -0.30 0.66 1.43 0.99 -1.04 118.68 123.21 1o3y s LEU 88 Ca -0.02 -0.26 -0.07 0.00 -1.03 0.00 0.00 54.13 52.74 1o3y s LEU 88 Cb -0.02 -1.68 0.00 0.00 0.03 0.00 0.00 46.19 44.52 1o3y s LEU 88 CO 0.00 0.15 0.09 -0.63 0.23 0.00 0.00 176.35 176.20 1o3y s ILE 89 N 0.43 4.10 -0.34 -0.59 1.01 0.06 -0.15 121.20 125.72 1o3y s ILE 89 Ca -0.07 -0.62 -0.10 0.00 0.00 0.00 0.00 60.65 59.86 1o3y s ILE 89 Cb -0.15 -3.10 0.01 0.00 0.01 0.00 0.00 42.46 39.24 1o3y s ILE 89 CO 0.04 0.09 0.17 0.12 0.00 0.00 0.00 174.94 175.36 1o3y s PHE 90 N 1.53 3.21 -0.18 3.97 5.36 0.22 -1.20 117.98 130.89 1o3y s PHE 90 Ca 0.03 -0.84 -0.12 0.00 -0.96 0.00 0.00 56.93 55.03 1o3y s PHE 90 Cb -0.17 -2.39 -0.05 0.00 -0.34 0.00 0.00 43.02 40.08 1o3y s PHE 90 CO 0.03 -0.58 0.23 0.08 -1.46 0.00 0.00 175.22 173.53 1o3y s VAL 91 N 1.56 5.34 -0.06 3.12 1.01 -0.46 -0.92 120.40 129.98 1o3y s VAL 91 Ca 0.03 0.41 0.06 0.00 0.00 0.00 0.00 61.98 62.47 1o3y s VAL 91 Cb -0.18 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 1o3y s VAL 91 CO 0.06 0.39 -0.24 -0.69 0.00 0.00 0.00 175.10 174.62 1o3y s VAL 92 N 0.53 2.01 -0.58 2.92 1.01 -0.28 -4.17 120.40 121.83 1o3y s VAL 92 Ca 0.13 -1.03 -0.28 0.00 0.00 0.00 0.00 61.98 60.80 1o3y s VAL 92 Cb -0.12 -1.71 0.01 0.00 0.00 0.00 0.00 36.38 34.56 1o3y s VAL 92 CO 0.02 0.56 1.42 -0.62 0.00 0.00 0.00 175.10 176.48 1o3y s ASP 93 N -0.08 6.09 0.28 3.32 3.68 -1.26 -0.81 116.67 127.89 1o3y s ASP 93 Ca -0.06 0.20 0.24 0.00 2.13 0.00 0.00 52.55 55.07 1o3y s ASP 93 Cb -0.14 -2.55 1.01 0.00 -1.45 0.00 0.00 42.92 39.80 1o3y s ASP 93 CO 0.04 -1.76 1.72 -1.20 0.13 0.00 0.00 175.17 174.11 1o3y n SER 94 N 9.72 0.71 0.01 -0.34 7.64 -0.31 -1.70 113.62 129.36 1o3y n SER 94 Ca 0.12 0.68 0.12 0.00 1.01 0.00 0.00 58.87 60.80 1o3y n SER 94 Cb 0.49 -0.83 0.31 0.00 -1.01 0.00 0.00 64.21 63.18 1o3y n SER 94 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1o3y n ASN 95 N -2.29 0.45 -4.33 6.43 2.85 -1.26 -0.69 115.26 116.42 1o3y n ASN 95 Ca 0.02 -0.02 -0.44 0.00 -0.11 0.00 0.00 54.58 54.02 1o3y n ASN 95 Cb 0.22 0.07 0.00 0.00 1.24 0.00 0.00 39.78 41.31 1o3y n ASN 95 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1o3y n ASP 96 N -1.63 5.50 -0.17 1.20 4.64 -0.69 -4.81 116.55 120.59 1o3y n ASP 96 Ca 0.05 -3.05 -0.03 0.00 -1.38 0.00 0.00 54.79 50.38 1o3y n ASP 96 Cb 0.36 -1.43 0.17 0.00 -1.04 0.00 0.00 41.12 39.18 1o3y n ASP 96 CO 0.00 0.00 0.00 -0.09 -0.82 0.00 0.00 177.20 176.29 1o3y h ARG 97 N 6.65 0.91 -0.43 -0.67 2.43 -1.84 -2.67 114.38 118.77 1o3y h ARG 97 Ca 0.23 -0.17 0.06 0.00 -0.81 0.00 0.00 59.98 59.29 1o3y h ARG 97 Cb 0.84 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 30.22 1o3y h ARG 97 CO 1.13 0.78 0.29 0.93 -1.51 0.00 0.00 179.97 181.59 1o3y h GLU 98 N 0.89 0.30 -0.31 0.20 4.39 -1.98 -2.71 114.58 115.36 1o3y h GLU 98 Ca 0.20 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.88 1o3y h GLU 98 Cb 0.25 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1o3y h GLU 98 CO -0.01 0.20 0.00 0.54 -1.16 0.00 0.00 179.01 178.58 1o3y n ARG 99 N -4.47 2.35 -0.00 2.33 1.74 -1.10 -4.62 116.66 112.89 1o3y n ARG 99 Ca 0.06 -1.94 -0.02 0.00 -0.77 0.00 0.00 57.85 55.18 1o3y n ARG 99 Cb 0.27 -1.30 0.24 0.00 -1.02 0.00 0.00 32.46 30.65 1o3y n ARG 99 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 1o3y h VAL 100 N 2.46 1.23 -0.42 1.55 3.04 -1.14 -0.75 116.25 122.22 1o3y h VAL 100 Ca 0.00 -1.01 -0.11 0.00 -1.01 0.00 0.00 66.70 64.57 1o3y h VAL 100 Cb 0.72 1.11 -0.02 0.00 -2.01 0.00 0.00 31.29 31.09 1o3y h VAL 100 CO 0.00 0.33 -0.19 0.78 -1.01 0.00 0.00 177.57 177.48 1o3y h ASN 101 N 0.49 0.82 -0.68 3.17 4.21 -1.82 -0.72 115.58 121.05 1o3y h ASN 101 Ca 0.09 -0.28 -0.00 0.00 1.21 0.00 0.00 56.30 57.31 1o3y h ASN 101 Cb 0.48 -0.22 -0.03 0.00 -1.12 0.00 0.00 38.32 37.43 1o3y h ASN 101 CO 0.03 0.99 0.40 -0.08 -1.29 0.00 0.00 177.43 177.49 1o3y h GLU 102 N 0.71 0.92 -0.39 0.81 4.81 -1.73 -0.09 114.58 119.62 1o3y h GLU 102 Ca 0.10 -0.09 0.04 0.00 -0.13 0.00 0.00 59.36 59.29 1o3y h GLU 102 Cb 0.70 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.85 1o3y h GLU 102 CO 0.05 0.66 0.16 0.00 -0.73 0.00 0.00 179.01 179.16 1o3y h ALA 103 N 1.21 0.47 -0.47 2.92 0.00 -0.76 -1.05 119.26 121.58 1o3y h ALA 103 Ca 0.24 0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.26 1o3y h ALA 103 Cb -0.02 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.69 1o3y h ALA 103 CO -0.04 -0.22 0.10 -0.09 0.00 0.00 0.00 179.25 178.99 1o3y h ARG 104 N 0.34 0.22 -0.48 0.00 2.43 -0.78 -0.50 114.38 115.61 1o3y h ARG 104 Ca 0.17 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1o3y h ARG 104 Cb 0.12 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 1o3y h ARG 104 CO -0.15 0.15 0.30 0.93 -1.51 0.00 0.00 179.97 179.69 1o3y h GLU 105 N 0.23 0.59 -0.66 0.20 5.08 -0.46 0.29 114.58 119.84 1o3y h GLU 105 Ca 0.23 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.47 1o3y h GLU 105 Cb 0.30 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 1o3y h GLU 105 CO -0.30 0.39 0.09 0.93 -1.00 0.00 0.00 179.01 179.12 1o3y h GLU 106 N 0.61 1.11 -0.09 2.33 4.39 -0.90 -0.78 114.58 121.24 1o3y h GLU 106 Ca 0.18 -0.31 -0.00 0.00 0.34 0.00 0.00 59.36 59.57 1o3y h GLU 106 Cb -0.03 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.49 1o3y h GLU 106 CO -0.06 1.02 0.04 1.25 -1.16 0.00 0.00 179.01 180.11 1o3y h LEU 107 N 1.03 0.12 -0.88 1.33 5.85 -0.64 -2.35 115.31 119.78 1o3y h LEU 107 Ca 0.20 -0.12 -0.09 0.00 0.84 0.00 0.00 57.88 58.71 1o3y h LEU 107 Cb 0.46 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 1o3y h LEU 107 CO 0.02 0.20 -0.14 0.24 -0.34 0.00 0.00 178.44 178.41 1o3y h MET 108 N 0.03 0.67 -0.97 1.25 2.86 -0.78 -0.24 114.93 117.74 1o3y h MET 108 Ca 0.03 -0.23 0.04 0.00 -2.06 0.00 0.00 59.70 57.48 1o3y h MET 108 Cb 0.11 -0.05 -0.06 0.00 0.06 0.00 0.00 31.60 31.66 1o3y h MET 108 CO -0.00 0.79 0.63 -0.09 1.06 0.00 0.00 176.91 179.30 1o3y h ARG 109 N 0.61 1.19 -0.14 1.72 2.43 -1.09 -1.33 114.38 117.76 1o3y h ARG 109 Ca 0.10 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.12 1o3y h ARG 109 Cb 0.59 -0.27 -0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1o3y h ARG 109 CO 0.04 0.78 -0.22 1.98 -1.51 0.00 0.00 179.97 181.05 1o3y h MET 110 N 1.22 0.40 0.00 0.20 4.05 -0.95 -3.23 114.93 116.63 1o3y h MET 110 Ca 0.39 -0.24 0.00 0.00 -0.28 0.00 0.00 59.70 59.57 1o3y h MET 110 Cb 0.01 0.02 0.00 0.00 -0.80 0.00 0.00 31.60 30.84 1o3y h MET 110 CO -0.13 0.82 0.00 -0.07 0.23 0.00 0.00 176.91 177.77 1o3y h LEU 111 N 0.00 0.00 -1.30 3.39 3.38 -0.76 -1.56 115.31 118.46 1o3y h LEU 111 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1o3y h LEU 111 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1o3y h LEU 111 CO 0.05 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.58 1o3y h ALA 112 N 2.02 1.00 -2.27 1.53 0.00 -1.26 -3.45 119.26 116.83 1o3y h ALA 112 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1o3y h ALA 112 Cb 0.31 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1o3y h ALA 112 CO 0.00 0.00 0.87 -1.21 0.00 0.00 0.00 179.25 178.91 1o3y s GLU 113 N -3.59 4.27 0.38 0.00 0.41 -0.59 -4.92 118.70 114.66 1o3y s GLU 113 Ca 0.02 1.84 0.12 0.00 -0.41 0.00 0.00 54.97 56.54 1o3y s GLU 113 Cb 0.09 -3.69 0.92 0.00 -1.78 0.00 0.00 34.13 29.67 1o3y s GLU 113 CO 0.50 -0.63 1.87 -0.44 -0.49 0.00 0.00 175.26 176.07 1o3y h ASP 114 N 8.13 0.55 -0.17 -0.19 3.32 -1.89 -1.29 116.42 124.88 1o3y h ASP 114 Ca -0.34 0.04 0.05 0.00 0.02 0.00 0.00 57.03 56.80 1o3y h ASP 114 Cb 1.15 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 1o3y h ASP 114 CO 0.93 0.27 0.15 -0.08 -1.72 0.00 0.00 179.24 178.79 1o3y h GLU 115 N 0.58 0.00 -0.57 3.56 4.57 -1.95 -1.91 114.58 118.86 1o3y h GLU 115 Ca 0.44 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.62 1o3y h GLU 115 Cb 0.85 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.44 1o3y h GLU 115 CO -0.19 0.00 0.00 1.28 -1.18 0.00 0.00 179.01 178.92 1o3y n LEU 116 N -4.05 3.56 0.30 1.64 4.77 -0.49 -4.65 117.00 118.08 1o3y n LEU 116 Ca 0.01 -1.93 0.17 0.00 -0.03 0.00 0.00 56.01 54.23 1o3y n LEU 116 Cb 0.28 -0.38 0.98 0.00 -2.33 0.00 0.00 43.42 41.97 1o3y n LEU 116 CO 0.30 0.88 1.14 0.08 -1.33 0.00 0.00 177.39 178.46 1o3y h ARG 117 N 3.57 0.00 -0.01 3.23 0.11 -1.34 -0.77 114.38 119.17 1o3y h ARG 117 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1o3y h ARG 117 Cb 0.90 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.98 1o3y h ARG 117 CO 0.00 0.00 -0.40 -0.25 0.10 0.00 0.00 179.97 179.42 1o3y n ASP 118 N -3.65 1.74 -4.77 0.08 8.00 -1.26 -4.94 116.55 111.75 1o3y n ASP 118 Ca -0.03 -1.37 -0.41 0.00 0.71 0.00 0.00 54.79 53.70 1o3y n ASP 118 Cb 0.10 0.49 -0.02 0.00 -0.02 0.00 0.00 41.12 41.68 1o3y n ASP 118 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1o3y s ALA 119 N -2.13 3.49 0.33 2.24 0.00 -0.30 -4.97 121.76 120.42 1o3y s ALA 119 Ca 0.15 1.31 -0.14 0.00 0.00 0.00 0.00 51.96 53.28 1o3y s ALA 119 Cb 0.15 -3.50 -0.08 0.00 0.00 0.00 0.00 23.12 19.68 1o3y s ALA 119 CO 0.48 -0.73 0.73 0.14 0.00 0.00 0.00 175.76 176.38 1o3y s VAL 120 N -1.15 4.72 -0.22 0.00 -7.23 -0.90 -4.66 120.40 110.97 1o3y s VAL 120 Ca 0.50 0.84 0.02 0.00 -1.81 0.00 0.00 61.98 61.53 1o3y s VAL 120 Cb -0.41 -3.63 0.04 0.00 0.56 0.00 0.00 36.38 32.94 1o3y s VAL 120 CO 0.54 -0.24 -0.15 -0.22 -0.31 0.00 0.00 175.10 174.72 1o3y s LEU 121 N -3.14 2.80 -0.25 1.32 2.96 -0.17 -0.01 118.68 122.18 1o3y s LEU 121 Ca 0.53 -1.04 -0.07 0.00 -0.22 0.00 0.00 54.13 53.33 1o3y s LEU 121 Cb -0.10 -1.50 -0.03 0.00 0.50 0.00 0.00 46.19 45.06 1o3y s LEU 121 CO 0.20 -0.11 0.07 -0.22 -1.32 0.00 0.00 176.35 174.98 1o3y s LEU 122 N 1.20 3.47 -0.25 -0.68 2.96 0.78 -1.30 118.68 124.85 1o3y s LEU 122 Ca -0.02 -0.22 -0.12 0.00 -0.22 0.00 0.00 54.13 53.54 1o3y s LEU 122 Cb -0.17 -1.92 -0.05 0.00 0.50 0.00 0.00 46.19 44.55 1o3y s LEU 122 CO -0.09 -0.04 0.24 -0.69 -1.32 0.00 0.00 176.35 174.45 1o3y s VAL 123 N 1.61 5.29 -0.41 1.68 1.01 0.48 -0.61 120.40 129.45 1o3y s VAL 123 Ca 0.06 0.31 -0.18 0.00 0.00 0.00 0.00 61.98 62.17 1o3y s VAL 123 Cb -0.15 -3.57 0.02 0.00 0.00 0.00 0.00 36.38 32.67 1o3y s VAL 123 CO 0.04 0.27 0.48 -0.36 0.00 0.00 0.00 175.10 175.53 1o3y s PHE 124 N 1.51 3.15 -1.02 5.22 2.99 -0.10 -0.65 117.98 129.07 1o3y s PHE 124 Ca 0.10 -0.21 -0.20 0.00 0.00 0.00 0.00 56.93 56.62 1o3y s PHE 124 Cb -0.15 -2.98 0.09 0.00 0.00 0.00 0.00 43.02 39.99 1o3y s PHE 124 CO 0.08 -0.70 1.35 0.00 -0.00 0.00 0.00 175.22 175.95 1o3y s ALA 125 N 2.30 3.13 0.58 5.36 0.00 -0.02 -1.12 121.76 131.99 1o3y s ALA 125 Ca 0.15 -2.61 -0.03 0.00 0.00 0.00 0.00 51.96 49.47 1o3y s ALA 125 Cb -0.16 -4.32 0.02 0.00 0.00 0.00 0.00 23.12 18.66 1o3y s ALA 125 CO 0.15 -3.27 0.85 1.21 0.00 0.00 0.00 175.76 174.69 1o3y s ASN 126 N 4.20 5.39 -0.86 0.00 2.47 0.01 -1.19 114.94 124.96 1o3y s ASN 126 Ca 0.41 0.38 -0.02 0.00 0.42 0.00 0.00 52.86 54.05 1o3y s ASN 126 Cb -0.02 -1.32 0.00 0.00 -1.45 0.00 0.00 41.25 38.46 1o3y s ASN 126 CO -0.07 -1.13 0.31 0.29 -3.72 0.00 0.00 177.10 172.78 1o3y n LYS 127 N -2.49 -2.59 0.11 0.43 5.02 -0.77 -1.16 118.16 116.71 1o3y n LYS 127 Ca 0.05 0.50 0.09 0.00 -2.02 0.00 0.00 58.31 56.94 1o3y n LYS 127 Cb 0.59 -4.52 0.44 0.00 -0.02 0.00 0.00 35.03 31.52 1o3y n LYS 127 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1o3y n GLN 128 N -2.51 0.12 0.24 1.97 1.13 -0.69 -2.08 117.38 115.56 1o3y n GLN 128 Ca -0.07 0.48 0.11 0.00 -1.94 0.00 0.00 57.00 55.58 1o3y n GLN 128 Cb 0.57 -1.80 0.58 0.00 0.11 0.00 0.00 30.24 29.69 1o3y n GLN 128 CO 0.00 0.00 0.00 0.38 -1.44 0.00 0.00 177.06 176.00 1o3y h ASP 129 N 0.00 0.00 -3.60 1.08 -0.00 -1.91 -3.44 116.42 108.54 1o3y h ASP 129 Ca 0.00 0.00 -0.51 0.00 -0.00 0.00 0.00 57.03 56.52 1o3y h ASP 129 Cb 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.51 1o3y h ASP 129 CO 0.00 0.20 0.47 -0.76 -0.00 0.00 0.00 179.24 179.14 1o3y s LEU 130 N -7.12 4.51 0.48 0.15 1.43 -0.88 -4.93 118.68 112.31 1o3y s LEU 130 Ca -0.01 2.09 0.16 0.00 -1.03 0.00 0.00 54.13 55.34 1o3y s LEU 130 Cb 0.12 -3.61 1.14 0.00 0.03 0.00 0.00 46.19 43.87 1o3y s LEU 130 CO 0.62 -0.18 2.05 1.55 0.23 0.00 0.00 176.35 180.61 1o3y h PRO 131 N 4.91 0.00 -0.68 1.29 0.13 -1.90 -2.05 132.00 133.71 1o3y h PRO 131 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1o3y h PRO 131 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1o3y h PRO 131 CO 0.71 0.13 0.00 0.09 -0.23 0.00 0.00 178.00 178.70 1o3y n ASN 132 N -4.30 4.21 -4.75 1.44 5.03 -1.26 -4.97 115.26 110.65 1o3y n ASN 132 Ca -0.03 -2.23 -0.42 0.00 0.87 0.00 0.00 54.58 52.77 1o3y n ASN 132 Cb 0.20 -0.52 -0.02 0.00 -1.02 0.00 0.00 39.78 38.42 1o3y n ASN 132 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1o3y s ALA 133 N -1.49 3.77 0.23 5.41 0.00 -0.77 -4.73 121.76 124.18 1o3y s ALA 133 Ca 0.48 1.60 -0.30 0.00 0.00 0.00 0.00 51.96 53.74 1o3y s ALA 133 Cb 0.28 -3.66 -0.09 0.00 0.00 0.00 0.00 23.12 19.66 1o3y s ALA 133 CO 0.27 -1.00 1.21 -1.64 0.00 0.00 0.00 175.76 174.60 1o3y s MET 134 N -0.42 4.49 0.91 0.00 -1.94 0.13 -4.93 119.30 117.55 1o3y s MET 134 Ca 0.64 1.94 -0.13 0.00 -1.71 0.00 0.00 55.69 56.43 1o3y s MET 134 Cb -0.48 -3.19 0.18 0.00 2.01 0.00 0.00 34.83 33.34 1o3y s MET 134 CO 0.47 -0.06 1.26 0.54 -0.01 0.00 0.00 175.02 177.23 1o3y s ASN 135 N -0.16 3.41 0.23 3.03 2.20 -1.26 -4.74 114.94 117.65 1o3y s ASN 135 Ca 0.51 0.22 -0.07 0.00 -0.94 0.00 0.00 52.86 52.58 1o3y s ASN 135 Cb -0.34 -0.35 0.28 0.00 -2.00 0.00 0.00 41.25 38.84 1o3y s ASN 135 CO 0.40 -2.54 1.85 0.00 -2.94 0.00 0.00 177.10 173.87 1o3y h ALA 136 N -1.43 1.07 -0.68 3.54 0.00 -1.96 0.23 119.26 120.03 1o3y h ALA 136 Ca -0.43 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1o3y h ALA 136 Cb 1.25 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1o3y h ALA 136 CO 0.41 0.24 0.39 0.00 0.00 0.00 0.00 179.25 180.29 1o3y h ALA 137 N 1.37 0.88 -0.36 0.00 0.00 -1.98 0.07 119.26 119.23 1o3y h ALA 137 Ca 0.34 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.09 1o3y h ALA 137 Cb 0.12 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1o3y h ALA 137 CO -0.15 0.37 -0.02 1.49 0.00 0.00 0.00 179.25 180.94 1o3y h GLU 138 N 0.94 0.66 -0.64 0.00 4.81 -1.71 -2.63 114.58 116.00 1o3y h GLU 138 Ca 0.24 -0.22 -0.05 0.00 -0.13 0.00 0.00 59.36 59.21 1o3y h GLU 138 Cb 0.01 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.30 1o3y h GLU 138 CO -0.04 0.77 0.21 0.82 -0.73 0.00 0.00 179.01 180.04 1o3y h ILE 139 N 0.47 1.24 -0.55 2.32 1.08 -0.77 -1.17 117.51 120.12 1o3y h ILE 139 Ca 0.10 -0.81 0.09 0.00 -0.39 0.00 0.00 64.86 63.86 1o3y h ILE 139 Cb 0.49 0.52 -0.07 0.00 -3.07 0.00 0.00 36.82 34.69 1o3y h ILE 139 CO 0.02 0.31 0.15 0.74 -0.69 0.00 0.00 178.15 178.68 1o3y h THR 140 N 0.94 0.72 -0.15 -0.27 2.02 -0.79 0.06 112.91 115.44 1o3y h THR 140 Ca 0.21 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.28 1o3y h THR 140 Cb 0.26 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 1o3y h THR 140 CO -0.01 0.05 0.05 0.44 0.37 0.00 0.00 175.52 176.42 1o3y h ASP 141 N 0.30 0.22 0.18 4.18 3.45 -1.05 -1.97 116.42 121.72 1o3y h ASP 141 Ca 0.28 -0.20 -0.03 0.00 0.43 0.00 0.00 57.03 57.51 1o3y h ASP 141 Cb 0.37 -0.06 -0.00 0.00 -0.56 0.00 0.00 39.33 39.08 1o3y h ASP 141 CO -0.33 0.36 -0.16 0.11 -1.57 0.00 0.00 179.24 177.65 1o3y h LYS 142 N 0.07 0.00 -0.00 3.56 1.79 -0.68 -2.09 116.57 119.22 1o3y h LYS 142 Ca 0.05 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1o3y h LYS 142 Cb 0.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.86 1o3y h LYS 142 CO -0.00 0.16 -0.59 1.28 -1.08 0.00 0.00 179.45 179.21 1o3y n LEU 143 N -4.28 0.79 -1.64 2.94 4.77 -0.04 -4.80 117.00 114.74 1o3y n LEU 143 Ca -0.02 -0.21 -0.14 0.00 -0.03 0.00 0.00 56.01 55.61 1o3y n LEU 143 Cb 0.23 -0.15 -0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1o3y n LEU 143 CO 0.35 0.18 -0.14 0.61 -1.33 0.00 0.00 177.39 177.07 1o3y n GLY 144 N 1.47 -0.17 0.26 -0.72 0.00 -0.79 -4.93 105.19 100.32 1o3y n GLY 144 Ca 0.06 -0.29 0.04 0.00 0.00 0.00 0.00 46.02 45.83 1o3y n GLY 144 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1o3y h LEU 145 N -0.19 0.25 -1.04 0.99 3.38 -1.71 -2.56 115.31 114.44 1o3y h LEU 145 Ca -0.33 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1o3y h LEU 145 Cb 1.24 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1o3y h LEU 145 CO 0.38 0.31 0.00 0.45 0.09 0.00 0.00 178.44 179.66 1o3y h HIS 146 N 0.27 0.00 0.00 1.13 3.86 -1.92 -2.26 115.15 116.24 1o3y h HIS 146 Ca 0.07 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1o3y h HIS 146 Cb 0.19 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.66 1o3y h HIS 146 CO 0.00 0.00 -0.30 -1.13 0.86 0.00 0.00 177.93 177.37 1o3y n SER 147 N -2.51 0.53 -4.77 2.45 3.41 -0.97 -4.92 113.62 106.85 1o3y n SER 147 Ca 0.01 0.25 -0.41 0.00 -0.26 0.00 0.00 58.87 58.46 1o3y n SER 147 Cb 0.23 -0.22 -0.01 0.00 -0.26 0.00 0.00 64.21 63.95 1o3y n SER 147 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1o3y s LEU 148 N -3.78 4.38 -0.00 1.04 1.43 -0.85 -5.02 118.68 115.87 1o3y s LEU 148 Ca 0.10 2.82 0.05 0.00 -1.03 0.00 0.00 54.13 56.08 1o3y s LEU 148 Cb 0.15 -3.65 -0.03 0.00 0.03 0.00 0.00 46.19 42.69 1o3y s LEU 148 CO 0.64 -0.71 -0.16 -0.13 0.23 0.00 0.00 176.35 176.22 1o3y s ARG 149 N -1.51 2.29 -1.45 1.70 0.52 -1.26 -4.72 118.95 114.51 1o3y s ARG 149 Ca 0.53 -0.84 -0.09 0.00 -0.52 0.00 0.00 55.73 54.81 1o3y s ARG 149 Cb -0.43 -2.28 0.05 0.00 0.52 0.00 0.00 34.95 32.82 1o3y s ARG 149 CO 0.54 0.58 0.73 0.72 0.02 0.00 0.00 175.30 177.89 1o3y n HIS 150 N 1.93 -2.09 -4.25 -0.53 8.25 -1.26 -4.97 115.22 112.31 1o3y n HIS 150 Ca -0.16 0.66 -0.24 0.00 -0.26 0.00 0.00 57.72 57.71 1o3y n HIS 150 Cb 0.52 -3.89 -0.17 0.00 1.12 0.00 0.00 29.99 27.58 1o3y n HIS 150 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1o3y s ARG 151 N -6.13 1.45 -0.30 -0.41 6.06 -1.26 -4.97 118.95 113.39 1o3y s ARG 151 Ca 0.47 -0.28 -0.27 0.00 -2.50 0.00 0.00 55.73 53.15 1o3y s ARG 151 Cb -0.23 -1.35 0.01 0.00 0.06 0.00 0.00 34.95 33.44 1o3y s ARG 151 CO 0.57 -0.10 0.95 -0.80 -2.50 0.00 0.00 175.30 173.42 1o3y s ASN 152 N 1.11 6.84 0.04 -2.12 0.01 -1.26 -5.02 114.94 114.54 1o3y s ASN 152 Ca -0.07 0.94 -0.05 0.00 -0.71 0.00 0.00 52.86 52.97 1o3y s ASN 152 Cb -0.14 -2.49 -0.01 0.00 0.41 0.00 0.00 41.25 39.02 1o3y s ASN 152 CO -0.01 -0.73 0.09 -1.66 -1.51 0.00 0.00 177.10 173.28 1o3y s TRP 153 N 3.29 0.20 -0.14 2.20 1.48 -1.26 -1.00 118.94 123.71 1o3y s TRP 153 Ca 0.40 -0.50 -0.13 0.00 -1.06 0.00 0.00 56.10 54.80 1o3y s TRP 153 Cb -0.13 -0.14 0.04 0.00 -1.16 0.00 0.00 33.47 32.07 1o3y s TRP 153 CO 0.13 -0.36 0.39 -0.47 -4.06 0.00 0.00 176.95 172.57 1o3y s TYR 154 N -2.59 -0.42 -0.07 1.66 5.04 -0.42 -4.98 117.35 115.57 1o3y s TYR 154 Ca -0.05 1.03 0.04 0.00 -2.44 0.00 0.00 57.07 55.65 1o3y s TYR 154 Cb -0.01 0.15 -0.02 0.00 0.35 0.00 0.00 41.96 42.42 1o3y s TYR 154 CO -0.04 -0.21 -0.17 -1.50 -1.34 0.00 0.00 175.55 172.28 1o3y s ILE 155 N 0.19 2.75 -0.09 3.14 2.07 -1.26 -0.39 121.20 127.61 1o3y s ILE 155 Ca -0.00 -0.82 -0.00 0.00 -1.41 0.00 0.00 60.65 58.42 1o3y s ILE 155 Cb -0.03 -2.07 0.02 0.00 0.13 0.00 0.00 42.46 40.51 1o3y s ILE 155 CO 0.01 0.57 -0.06 -1.58 -1.91 0.00 0.00 174.94 171.96 1o3y s GLN 156 N -0.35 1.28 0.12 3.50 2.00 0.18 -4.96 119.66 121.42 1o3y s GLN 156 Ca 0.03 -0.18 -0.31 0.00 -2.00 0.00 0.00 55.36 52.90 1o3y s GLN 156 Cb -0.12 -1.35 -0.08 0.00 0.80 0.00 0.00 33.01 32.25 1o3y s GLN 156 CO 0.02 -0.21 1.43 0.00 -0.50 0.00 0.00 175.29 176.03 1o3y s ALA 157 N 1.54 3.63 0.05 1.58 0.00 -1.26 -0.84 121.76 126.45 1o3y s ALA 157 Ca 0.01 1.16 0.01 0.00 0.00 0.00 0.00 51.96 53.13 1o3y s ALA 157 Cb -0.13 -3.56 -0.03 0.00 0.00 0.00 0.00 23.12 19.40 1o3y s ALA 157 CO -0.05 -0.66 -0.05 0.95 0.00 0.00 0.00 175.76 175.95 1o3y s THR 158 N 1.19 0.36 -0.27 0.00 -4.23 -0.33 -4.33 115.64 108.03 1o3y s THR 158 Ca 0.66 -1.37 0.02 0.00 -1.18 0.00 0.00 61.69 59.82 1o3y s THR 158 Cb -0.38 -0.93 0.07 0.00 1.34 0.00 0.00 72.50 72.60 1o3y s THR 158 CO 0.30 -0.66 -0.03 0.00 -0.54 0.00 0.00 174.62 173.69 1o3y h ALA 160 N 7.83 1.35 -0.12 0.00 0.00 -1.92 0.51 119.26 126.90 1o3y h ALA 160 Ca -0.15 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1o3y h ALA 160 Cb 1.05 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1o3y h ALA 160 CO 0.46 0.59 -0.30 1.79 0.00 0.00 0.00 179.25 181.78 1o3y h THR 161 N 1.17 1.26 0.00 0.00 1.35 -1.95 -2.85 112.91 111.89 1o3y h THR 161 Ca 0.31 -1.24 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 1o3y h THR 161 Cb -0.10 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 67.83 1o3y h THR 161 CO -0.06 0.37 -1.11 -1.54 -0.25 0.00 0.00 175.52 172.93 1o3y n SER 162 N -4.12 0.59 0.00 5.36 3.41 -1.06 -4.91 113.62 112.90 1o3y n SER 162 Ca -0.01 -0.16 0.00 0.00 -0.26 0.00 0.00 58.87 58.44 1o3y n SER 162 Cb 0.40 0.87 0.00 0.00 -0.26 0.00 0.00 64.21 65.22 1o3y n SER 162 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1o3y n GLY 163 N 1.34 1.61 3.72 5.00 0.00 0.14 -5.02 105.19 111.98 1o3y n GLY 163 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1o3y n GLY 163 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1o3y s ASP 164 N -3.14 6.43 0.00 1.61 1.01 -1.00 -2.38 116.67 119.19 1o3y s ASP 164 Ca 0.00 2.81 0.00 0.00 0.71 0.00 0.00 52.55 56.07 1o3y s ASP 164 Cb 0.00 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.33 1o3y s ASP 164 CO 0.00 -0.95 0.00 0.61 0.21 0.00 0.00 175.17 175.04 1o3y n GLY 165 N 3.96 2.27 0.10 0.21 0.00 -1.26 -1.50 105.19 108.97 1o3y n GLY 165 Ca 0.16 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.06 1o3y n GLY 165 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1o3y h LEU 166 N 0.00 0.21 -1.23 0.99 3.38 -1.77 -2.30 115.31 114.60 1o3y h LEU 166 Ca 0.00 -0.29 -0.08 0.00 0.09 0.00 0.00 57.88 57.60 1o3y h LEU 166 Cb 0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1o3y h LEU 166 CO 0.00 0.45 -0.36 0.10 0.09 0.00 0.00 178.44 178.73 1o3y h TYR 167 N -0.04 0.06 -0.53 1.13 -0.00 -1.92 -1.62 116.97 114.06 1o3y h TYR 167 Ca 0.04 -0.01 -0.07 0.00 -0.00 0.00 0.00 58.73 58.69 1o3y h TYR 167 Cb 0.34 -0.01 -0.02 0.00 -0.00 0.00 0.00 36.73 37.04 1o3y h TYR 167 CO 0.03 0.40 0.07 0.93 -0.00 0.00 0.00 178.16 179.59 1o3y h GLU 168 N 0.04 0.89 -0.31 0.10 3.07 -1.92 0.14 114.58 116.59 1o3y h GLU 168 Ca 0.00 -0.25 0.04 0.00 -0.50 0.00 0.00 59.36 58.66 1o3y h GLU 168 Cb 0.65 -0.10 -0.04 0.00 -0.84 0.00 0.00 28.75 28.43 1o3y h GLU 168 CO 0.05 0.88 0.07 0.78 -1.40 0.00 0.00 179.01 179.38 1o3y h GLY 169 N 0.77 0.35 1.72 -3.84 0.00 -0.93 -2.69 103.07 98.45 1o3y h GLY 169 Ca 0.16 -0.02 -0.05 0.00 0.00 0.00 0.00 47.33 47.41 1o3y h GLY 169 CO 0.01 -0.01 -0.09 1.41 0.00 0.00 0.00 176.54 177.87 1o3y h LEU 170 N 0.18 0.33 -0.13 3.11 3.38 -0.97 -1.74 115.31 119.47 1o3y h LEU 170 Ca 0.14 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.07 1o3y h LEU 170 Cb 0.15 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1o3y h LEU 170 CO -0.18 0.46 -0.03 -0.78 0.09 0.00 0.00 178.44 178.00 1o3y h ASP 171 N 0.34 -0.11 -0.26 -0.43 1.82 -0.43 0.98 116.42 118.32 1o3y h ASP 171 Ca 0.07 0.04 -0.01 0.00 -0.39 0.00 0.00 57.03 56.74 1o3y h ASP 171 Cb 0.37 0.08 -0.01 0.00 0.68 0.00 0.00 39.33 40.44 1o3y h ASP 171 CO 0.02 -0.04 0.14 -0.25 -1.61 0.00 0.00 179.24 177.50 1o3y h TRP 172 N 0.00 0.36 -0.34 0.28 7.01 -1.18 -1.44 115.95 120.65 1o3y h TRP 172 Ca 0.06 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.03 1o3y h TRP 172 Cb 0.09 -0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.02 1o3y h TRP 172 CO -0.17 0.31 0.11 1.25 -2.79 0.00 0.00 178.44 177.15 1o3y h LEU 173 N 0.31 0.48 -0.74 0.65 5.85 -1.17 -0.83 115.31 119.85 1o3y h LEU 173 Ca 0.09 -0.19 0.03 0.00 0.84 0.00 0.00 57.88 58.65 1o3y h LEU 173 Cb 0.07 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 40.93 1o3y h LEU 173 CO -0.01 0.55 0.47 0.77 -0.34 0.00 0.00 178.44 179.87 1o3y h SER 174 N 0.39 0.78 -0.55 1.25 4.64 -0.80 -2.32 113.55 116.95 1o3y h SER 174 Ca 0.11 -0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.38 1o3y h SER 174 Cb 0.23 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.12 1o3y h SER 174 CO -0.01 0.54 0.17 0.78 -0.87 0.00 0.00 176.83 177.45 1o3y h ASN 175 N 0.93 0.84 -0.66 4.97 2.35 -0.91 -0.61 115.58 122.48 1o3y h ASN 175 Ca 0.30 -0.14 -0.04 0.00 -0.55 0.00 0.00 56.30 55.86 1o3y h ASN 175 Cb 0.00 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.12 1o3y h ASN 175 CO -0.11 0.80 0.28 1.56 -1.65 0.00 0.00 177.43 178.32 1o3y h GLN 176 N 0.87 1.01 0.00 0.81 1.08 -0.83 -3.34 115.11 114.71 1o3y h GLN 176 Ca 0.19 -0.17 -0.11 0.00 -1.45 0.00 0.00 58.65 57.12 1o3y h GLN 176 Cb 0.28 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.51 1o3y h GLN 176 CO -0.01 0.82 -2.10 1.28 -0.95 0.00 0.00 178.83 177.88 1o3y n LEU 177 N -4.30 0.02 -4.88 1.46 4.77 -0.90 -4.91 117.00 108.25 1o3y n LEU 177 Ca 0.06 0.01 -0.30 0.00 -0.03 0.00 0.00 56.01 55.75 1o3y n LEU 177 Cb 0.17 0.14 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 1o3y n LEU 177 CO 0.40 0.14 0.40 0.00 -1.33 0.00 0.00 177.39 177.00 1o3y s ARG 178 N -3.21 3.77 0.00 3.23 1.70 -0.27 -5.02 118.95 119.16 1o3y s ARG 178 Ca -0.08 0.41 0.06 0.00 -0.47 0.00 0.00 55.73 55.64 1o3y s ARG 178 Cb 0.12 -2.44 0.04 0.00 -0.57 0.00 0.00 34.95 32.10 1o3y s ARG 178 CO 0.88 0.02 0.65 0.09 -1.08 0.00 0.00 175.30 175.86 1o3y n ASN 179 N -1.15 1.38 -3.69 -2.89 3.02 -1.26 -4.86 115.26 105.80 1o3y n ASN 179 Ca 0.02 -1.19 -0.03 0.00 -0.03 0.00 0.00 54.58 53.35 1o3y n ASN 179 Cb 0.54 0.07 -0.01 0.00 -0.61 0.00 0.00 39.78 39.77 1o3y n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1o3y s GLN 180 N -0.54 1.15 0.00 3.52 0.00 -1.26 -5.24 119.66 117.29 1o3y s GLN 180 Ca 0.06 -0.65 0.00 0.00 -0.00 0.00 0.00 55.36 54.78 1o3y s GLN 180 Cb 0.05 0.38 0.02 0.00 0.00 0.00 0.00 33.01 33.46 1o3y s GLN 180 CO 0.08 -0.53 0.52 0.36 0.00 0.00 0.00 175.29 175.73