#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r2c s SER 37 N 0.00 5.34 0.07 4.39 0.01 -1.26 -5.13 113.70 117.12 2r2c s SER 37 Ca 0.00 -0.13 0.05 0.00 1.31 0.00 0.00 55.95 57.18 2r2c s SER 37 Cb 0.00 -1.36 -0.03 0.00 0.21 0.00 0.00 66.02 64.84 2r2c s SER 37 CO 0.00 0.12 -0.14 -0.31 0.41 0.00 0.00 173.24 173.32 2r2c s TYR 38 N -1.56 1.20 0.27 2.43 2.02 -1.26 -5.12 117.35 115.33 2r2c s TYR 38 Ca 0.29 -0.45 -0.30 0.00 -0.37 0.00 0.00 57.07 56.24 2r2c s TYR 38 Cb -0.11 -0.68 -0.11 0.00 -0.40 0.00 0.00 41.96 40.66 2r2c s TYR 38 CO 0.21 0.05 1.54 0.21 -1.57 0.00 0.00 175.55 176.00 2r2c s LYS 39 N -1.70 4.18 0.32 -0.62 2.20 -1.26 -4.90 119.74 117.95 2r2c s LYS 39 Ca -0.02 2.47 0.07 0.00 -0.36 0.00 0.00 55.97 58.13 2r2c s LYS 39 Cb -0.10 -3.06 -0.02 0.00 -1.51 0.00 0.00 37.83 33.14 2r2c s LYS 39 CO 0.02 -0.56 0.35 0.95 -0.36 0.00 0.00 175.35 175.75 2r2c s THR 40 N 0.07 3.91 -0.28 3.43 -4.23 -1.26 -1.02 115.64 116.26 2r2c s THR 40 Ca 0.62 -1.22 -0.29 0.00 -1.18 0.00 0.00 61.69 59.62 2r2c s THR 40 Cb -0.45 -3.33 -0.00 0.00 1.34 0.00 0.00 72.50 70.06 2r2c s THR 40 CO 0.45 -0.19 1.32 0.86 -0.54 0.00 0.00 174.62 176.52 2r2c s TRP 41 N -2.22 2.66 -0.03 3.99 -0.00 0.10 -4.74 118.94 118.69 2r2c s TRP 41 Ca 0.41 0.86 0.03 0.00 -0.00 0.00 0.00 56.10 57.40 2r2c s TRP 41 Cb -0.07 -3.88 0.00 0.00 -0.00 0.00 0.00 33.47 29.52 2r2c s TRP 41 CO 0.28 -1.79 -0.11 -0.51 -0.00 0.00 0.00 176.95 174.81 2r2c s ASP 42 N 2.82 1.48 -0.06 5.86 1.01 -1.26 -4.83 116.67 121.69 2r2c s ASP 42 Ca 0.57 -0.23 0.03 0.00 0.71 0.00 0.00 52.55 53.62 2r2c s ASP 42 Cb -0.18 -0.42 0.01 0.00 1.01 0.00 0.00 42.92 43.34 2r2c s ASP 42 CO 0.23 0.08 -0.13 0.54 0.21 0.00 0.00 175.17 176.10 2r2c s VAL 43 N 0.20 1.22 0.45 -1.27 0.11 -1.26 -5.13 120.40 114.71 2r2c s VAL 43 Ca -0.04 -0.54 -0.25 0.00 -2.93 0.00 0.00 61.98 58.22 2r2c s VAL 43 Cb -0.10 -1.10 -0.09 0.00 -1.53 0.00 0.00 36.38 33.57 2r2c s VAL 43 CO 0.01 0.37 1.40 -2.65 -3.33 0.00 0.00 175.10 170.90 2r2c n PRO 44 N 3.70 2.16 -1.57 1.54 -0.02 -1.26 -5.23 135.00 134.32 2r2c n PRO 44 Ca -0.22 0.77 -0.39 0.00 -2.02 0.00 0.00 63.50 61.64 2r2c n PRO 44 Cb 0.52 -2.58 -0.03 0.00 -0.02 0.00 0.00 33.50 31.39 2r2c n PRO 44 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 2r2c n ILE 45 N -0.25 0.12 -3.82 4.25 5.41 -1.26 -5.09 119.36 118.72 2r2c n ILE 45 Ca 0.06 -0.64 -0.13 0.00 1.00 0.00 0.00 62.75 63.04 2r2c n ILE 45 Cb 0.41 -2.70 -0.13 0.00 -0.71 0.00 0.00 39.64 36.51 2r2c n ILE 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2r2c s ALA 53 N 10.39 -0.27 -0.63 -1.39 0.00 -1.26 -5.20 121.76 123.39 2r2c s ALA 53 Ca 0.99 0.36 0.25 0.00 0.00 0.00 0.00 51.96 53.57 2r2c s ALA 53 Cb -0.25 -0.22 0.60 0.00 0.00 0.00 0.00 23.12 23.25 2r2c s ALA 53 CO 0.30 -0.07 1.63 0.87 0.00 0.00 0.00 175.76 178.50 2r2c h LYS 54 N 6.15 0.00 -2.52 0.00 1.57 -1.98 -3.46 116.57 116.34 2r2c h LYS 54 Ca -0.27 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.42 2r2c h LYS 54 Cb 1.19 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.30 2r2c h LYS 54 CO 0.44 0.00 -0.07 -1.50 -0.57 0.00 0.00 179.45 177.75 2r2c s ILE 55 N -3.15 0.02 -0.16 1.86 -1.16 -1.26 -1.21 121.20 116.14 2r2c s ILE 55 Ca 0.09 -0.17 -0.00 0.00 -0.51 0.00 0.00 60.65 60.05 2r2c s ILE 55 Cb 0.11 -0.78 -0.00 0.00 0.61 0.00 0.00 42.46 42.40 2r2c s ILE 55 CO 0.64 -0.09 -0.14 0.20 -2.81 0.00 0.00 174.94 172.73 2r2c s ASN 56 N -0.79 3.72 -0.10 4.50 0.01 -0.39 -4.61 114.94 117.27 2r2c s ASN 56 Ca -0.09 -0.46 -0.05 0.00 -0.71 0.00 0.00 52.86 51.56 2r2c s ASN 56 Cb -0.03 -1.58 -0.04 0.00 0.41 0.00 0.00 41.25 40.02 2r2c s ASN 56 CO 0.05 0.08 0.08 -0.51 -1.51 0.00 0.00 177.10 175.29 2r2c s ILE 57 N 0.83 5.00 0.08 0.60 1.10 -1.26 -0.61 121.20 126.93 2r2c s ILE 57 Ca -0.05 0.01 0.06 0.00 -0.51 0.00 0.00 60.65 60.16 2r2c s ILE 57 Cb -0.15 -3.15 -0.03 0.00 0.15 0.00 0.00 42.46 39.28 2r2c s ILE 57 CO -0.00 0.61 -0.16 -0.36 -2.11 0.00 0.00 174.94 172.92 2r2c s PHE 58 N -0.97 1.34 0.06 3.50 0.08 0.39 -4.55 117.98 117.83 2r2c s PHE 58 Ca 0.15 -0.46 -0.17 0.00 0.12 0.00 0.00 56.93 56.57 2r2c s PHE 58 Cb -0.12 -0.75 0.03 0.00 -0.57 0.00 0.00 43.02 41.62 2r2c s PHE 58 CO 0.04 0.09 0.40 0.00 -0.10 0.00 0.00 175.22 175.64 2r2c s ALA 59 N -1.28 -0.95 -0.01 5.36 0.00 -1.26 -1.90 121.76 121.71 2r2c s ALA 59 Ca 0.00 0.18 0.01 0.00 0.00 0.00 0.00 51.96 52.14 2r2c s ALA 59 Cb -0.10 0.43 0.01 0.00 0.00 0.00 0.00 23.12 23.47 2r2c s ALA 59 CO 0.03 -0.50 -0.01 0.08 0.00 0.00 0.00 175.76 175.35 2r2c s VAL 60 N -2.84 0.18 0.03 0.00 1.01 -0.29 -4.98 120.40 113.52 2r2c s VAL 60 Ca -0.03 -0.02 0.05 0.00 0.00 0.00 0.00 61.98 61.98 2r2c s VAL 60 Cb -0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 36.38 36.15 2r2c s VAL 60 CO -0.05 0.09 -0.16 0.00 0.00 0.00 0.00 175.10 174.98 2r2c s ALA 61 N 0.39 1.33 -0.01 5.51 0.00 -1.26 -1.02 121.76 126.69 2r2c s ALA 61 Ca -0.04 -0.84 -0.19 0.00 0.00 0.00 0.00 51.96 50.89 2r2c s ALA 61 Cb -0.06 -0.25 0.04 0.00 0.00 0.00 0.00 23.12 22.84 2r2c s ALA 61 CO -0.01 0.28 0.42 -1.83 0.00 0.00 0.00 175.76 174.62 2r2c s GLU 62 N -0.97 0.80 0.15 0.00 -1.05 -0.58 -1.35 118.70 115.69 2r2c s GLU 62 Ca 0.04 -0.11 -0.30 0.00 -0.15 0.00 0.00 54.97 54.45 2r2c s GLU 62 Cb -0.08 0.36 -0.07 0.00 -0.44 0.00 0.00 34.13 33.91 2r2c s GLU 62 CO 0.01 -0.24 1.12 0.71 0.95 0.00 0.00 175.26 177.81 2r2c s TYR 63 N -1.48 3.55 -0.45 4.83 2.02 0.40 -1.11 117.35 125.11 2r2c s TYR 63 Ca -0.12 1.52 0.13 0.00 -0.37 0.00 0.00 57.07 58.24 2r2c s TYR 63 Cb -0.03 -3.31 -0.16 0.00 -0.40 0.00 0.00 41.96 38.05 2r2c s TYR 63 CO 0.05 -0.78 0.48 0.25 -1.57 0.00 0.00 175.55 173.98 2r2c n THR 64 N 2.77 0.00 -3.92 -0.71 -2.24 0.48 -3.81 114.28 106.85 2r2c n THR 64 Ca 0.04 -0.23 -0.11 0.00 -2.27 0.00 0.00 64.05 61.49 2r2c n THR 64 Cb 0.46 0.77 -0.01 0.00 -2.10 0.00 0.00 70.33 69.46 2r2c n THR 64 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2r2c s ASP 65 N -2.60 0.29 0.21 3.42 2.15 -1.13 -4.97 116.67 114.04 2r2c s ASP 65 Ca 0.02 -1.21 -0.12 0.00 0.43 0.00 0.00 52.55 51.67 2r2c s ASP 65 Cb 0.09 0.76 0.25 0.00 -0.30 0.00 0.00 42.92 43.73 2r2c s ASP 65 CO 0.54 -1.49 1.65 0.74 -0.17 0.00 0.00 175.17 176.45 2r2c h THR 66 N 2.06 0.48 -0.16 1.71 2.02 -2.02 -2.95 112.91 114.04 2r2c h THR 66 Ca -0.29 -0.03 -0.13 0.00 0.77 0.00 0.00 66.41 66.73 2r2c h THR 66 Cb 1.25 0.40 -0.14 0.00 -1.74 0.00 0.00 68.15 67.91 2r2c h THR 66 CO 0.38 0.01 -0.64 0.00 0.37 0.00 0.00 175.52 175.64 2r2c n GLN 67 N -5.32 1.80 -4.79 6.66 6.02 -1.26 -4.97 117.38 115.51 2r2c n GLN 67 Ca 0.08 -3.33 -0.24 0.00 -0.01 0.00 0.00 57.00 53.50 2r2c n GLN 67 Cb 0.33 -1.56 -0.15 0.00 1.02 0.00 0.00 30.24 29.88 2r2c n GLN 67 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2r2c s LYS 68 N -2.95 1.36 0.18 -1.09 -0.14 -1.12 -0.01 119.74 115.98 2r2c s LYS 68 Ca 0.40 -0.60 0.07 0.00 -1.36 0.00 0.00 55.97 54.48 2r2c s LYS 68 Cb 0.38 -1.31 -0.05 0.00 -1.68 0.00 0.00 37.83 35.17 2r2c s LYS 68 CO -0.06 0.36 -0.13 0.96 -0.76 0.00 0.00 175.35 175.72 2r2c s ILE 69 N -0.38 1.54 -0.06 2.17 -4.36 -0.10 -0.39 121.20 119.62 2r2c s ILE 69 Ca 0.06 -2.14 0.04 0.00 -0.26 0.00 0.00 60.65 58.35 2r2c s ILE 69 Cb -0.06 -1.96 -0.00 0.00 1.25 0.00 0.00 42.46 41.69 2r2c s ILE 69 CO -0.01 -0.64 -0.18 -0.75 0.24 0.00 0.00 174.94 173.60 2r2c s LYS 70 N -3.63 2.09 -0.03 0.37 2.20 -0.27 -1.82 119.74 118.65 2r2c s LYS 70 Ca 0.20 -0.65 0.02 0.00 -0.36 0.00 0.00 55.97 55.18 2r2c s LYS 70 Cb 0.00 -1.73 0.00 0.00 -1.51 0.00 0.00 37.83 34.60 2r2c s LYS 70 CO 0.05 0.20 -0.09 0.54 -0.36 0.00 0.00 175.35 175.69 2r2c s VAL 71 N 0.20 0.76 0.00 4.02 0.11 0.50 -1.53 120.40 124.47 2r2c s VAL 71 Ca -0.09 -0.34 0.05 0.00 -2.93 0.00 0.00 61.98 58.67 2r2c s VAL 71 Cb -0.14 -0.69 -0.03 0.00 -1.53 0.00 0.00 36.38 33.99 2r2c s VAL 71 CO 0.04 0.24 -0.14 0.42 -3.33 0.00 0.00 175.10 172.33 2r2c s THR 72 N 0.26 3.07 0.00 5.04 -4.23 -0.19 -0.45 115.64 119.14 2r2c s THR 72 Ca -0.04 -0.95 -0.00 0.00 -1.18 0.00 0.00 61.69 59.52 2r2c s THR 72 Cb -0.09 -2.27 -0.01 0.00 1.34 0.00 0.00 72.50 71.47 2r2c s THR 72 CO 0.01 0.43 -0.01 -0.69 -0.54 0.00 0.00 174.62 173.82 2r2c s VAL 73 N -0.88 0.03 -0.19 2.29 1.01 -0.48 -1.13 120.40 121.04 2r2c s VAL 73 Ca 0.14 -0.24 -0.18 0.00 0.00 0.00 0.00 61.98 61.70 2r2c s VAL 73 Cb -0.11 -0.08 0.05 0.00 0.00 0.00 0.00 36.38 36.25 2r2c s VAL 73 CO 0.04 -0.13 0.52 -0.75 0.00 0.00 0.00 175.10 174.78 2r2c s LYS 74 N -0.38 0.62 0.21 2.72 2.20 -0.80 -0.35 119.74 123.96 2r2c s LYS 74 Ca -0.04 0.69 0.11 0.00 -0.36 0.00 0.00 55.97 56.37 2r2c s LYS 74 Cb -0.03 0.30 -0.05 0.00 -1.51 0.00 0.00 37.83 36.55 2r2c s LYS 74 CO -0.00 -0.08 -0.23 0.20 -0.36 0.00 0.00 175.35 174.88 2r2c s GLY 75 N 0.21 1.75 -0.12 5.54 0.00 -1.26 -0.46 107.32 112.98 2r2c s GLY 75 Ca -0.01 -1.69 -0.02 0.00 0.00 0.00 0.00 44.72 43.01 2r2c s GLY 75 CO 0.01 -1.73 0.02 1.25 0.00 0.00 0.00 173.10 172.66 2r2c s LYS 76 N -2.86 0.53 0.20 2.90 2.20 0.22 -1.42 119.74 121.52 2r2c s LYS 76 Ca 0.23 -0.07 -0.30 0.00 -0.36 0.00 0.00 55.97 55.47 2r2c s LYS 76 Cb -0.07 -1.40 -0.09 0.00 -1.51 0.00 0.00 37.83 34.76 2r2c s LYS 76 CO 0.11 -0.45 1.29 0.42 -0.36 0.00 0.00 175.35 176.36 2r2c s ILE 77 N 1.96 3.26 0.07 5.43 1.01 -1.26 -1.27 121.20 130.41 2r2c s ILE 77 Ca 0.03 1.04 -0.31 0.00 0.00 0.00 0.00 60.65 61.41 2r2c s ILE 77 Cb -0.14 -3.67 -0.08 0.00 0.01 0.00 0.00 42.46 38.59 2r2c s ILE 77 CO -0.06 0.16 1.51 -0.76 0.00 0.00 0.00 174.94 175.79 2r2c s LEU 78 N -0.15 4.35 0.13 2.97 1.02 -0.35 -4.80 118.68 121.85 2r2c s LEU 78 Ca 0.56 2.36 -0.23 0.00 0.02 0.00 0.00 54.13 56.85 2r2c s LEU 78 Cb -0.36 -3.57 -0.13 0.00 0.02 0.00 0.00 46.19 42.15 2r2c s LEU 78 CO 0.38 -0.78 0.46 -0.62 0.02 0.00 0.00 176.35 175.81 2r2c n GLU 79 N 4.95 0.00 0.00 1.70 -0.58 -1.26 -1.10 120.64 124.35 2r2c n GLU 79 Ca 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 2r2c n GLU 79 Cb 0.41 -0.81 0.00 0.00 -0.57 0.00 0.00 31.44 30.47 2r2c n GLU 79 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2r2c n GLY 80 N 1.45 2.73 3.97 0.62 0.00 -1.26 -5.01 105.19 107.70 2r2c n GLY 80 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 2r2c n GLY 80 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2r2c s ASN 81 N -2.45 6.23 0.36 1.61 0.02 -0.26 -5.13 114.94 115.32 2r2c s ASN 81 Ca 0.00 0.05 0.08 0.00 -1.02 0.00 0.00 52.86 51.97 2r2c s ASN 81 Cb 0.00 -1.73 -0.05 0.00 0.02 0.00 0.00 41.25 39.49 2r2c s ASN 81 CO 0.00 -0.18 0.08 0.42 0.02 0.00 0.00 177.10 177.44 2r2c s THR 82 N -2.06 2.58 -0.02 1.60 -4.23 -1.26 -4.82 115.64 107.44 2r2c s THR 82 Ca 0.37 -1.85 0.01 0.00 -1.18 0.00 0.00 61.69 59.05 2r2c s THR 82 Cb -0.09 -2.90 0.01 0.00 1.34 0.00 0.00 72.50 70.86 2r2c s THR 82 CO 0.30 -0.13 -0.04 -0.22 -0.54 0.00 0.00 174.62 173.99 2r2c s LEU 83 N -3.79 1.69 1.03 4.79 2.96 -1.26 -5.02 118.68 119.08 2r2c s LEU 83 Ca 0.37 -0.08 -0.11 0.00 -0.22 0.00 0.00 54.13 54.09 2r2c s LEU 83 Cb 0.01 -0.28 0.20 0.00 0.50 0.00 0.00 46.19 46.62 2r2c s LEU 83 CO 0.21 0.00 1.06 -2.65 -1.32 0.00 0.00 176.35 173.65 2r2c n PRO 84 N 3.43 -1.29 -1.65 0.98 -0.02 -1.26 -4.87 135.00 130.32 2r2c n PRO 84 Ca -0.18 -0.32 -0.50 0.00 -2.02 0.00 0.00 63.50 60.47 2r2c n PRO 84 Cb 0.55 -2.27 -0.05 0.00 -0.02 0.00 0.00 33.50 31.70 2r2c n PRO 84 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2r2c n LYS 85 N -4.46 1.68 0.00 -0.52 4.81 -1.26 -4.90 118.16 113.51 2r2c n LYS 85 Ca 0.08 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 58.13 2r2c n LYS 85 Cb 0.53 -2.33 0.00 0.00 0.02 0.00 0.00 35.03 33.24 2r2c n LYS 85 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2r2c n SER 86 N 3.83 0.00 -3.70 3.14 7.64 -1.26 -1.50 113.62 121.77 2r2c n SER 86 Ca 0.19 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.93 2r2c n SER 86 Cb 0.23 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.29 2r2c n SER 86 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2r2c s VAL 88 N 0.28 -0.20 -0.08 0.44 0.11 0.58 -0.69 120.40 120.84 2r2c s VAL 88 Ca 0.00 0.26 0.00 0.00 -2.93 0.00 0.00 61.98 59.31 2r2c s VAL 88 Cb 0.00 -0.33 -0.03 0.00 -1.53 0.00 0.00 36.38 34.49 2r2c s VAL 88 CO 0.00 0.11 -0.08 -1.58 -3.33 0.00 0.00 175.10 170.22 2r2c s GLN 89 N 1.85 2.90 -0.11 1.54 2.00 -0.14 -1.55 119.66 126.15 2r2c s GLN 89 Ca -0.03 -0.57 0.03 0.00 -2.00 0.00 0.00 55.36 52.80 2r2c s GLN 89 Cb -0.12 -2.62 0.00 0.00 0.80 0.00 0.00 33.01 31.08 2r2c s GLN 89 CO -0.07 0.57 -0.23 0.08 -0.50 0.00 0.00 175.29 175.14 2r2c s VAL 90 N -0.54 2.15 0.02 1.34 1.01 -1.26 -1.21 120.40 121.89 2r2c s VAL 90 Ca 0.08 -0.98 0.07 0.00 0.00 0.00 0.00 61.98 61.15 2r2c s VAL 90 Cb -0.12 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.40 2r2c s VAL 90 CO 0.02 0.55 -0.22 -0.31 0.00 0.00 0.00 175.10 175.14 2r2c s TYR 91 N 0.43 2.45 -0.10 5.22 2.02 -0.04 -1.37 117.35 125.96 2r2c s TYR 91 Ca -0.16 -0.33 -0.23 0.00 -0.37 0.00 0.00 57.07 55.97 2r2c s TYR 91 Cb -0.17 -1.47 -0.03 0.00 -0.40 0.00 0.00 41.96 39.88 2r2c s TYR 91 CO 0.07 0.14 0.72 -1.17 -1.57 0.00 0.00 175.55 173.73 2r2c s LEU 92 N -1.09 4.27 0.19 -1.29 2.96 -0.13 -1.52 118.68 122.06 2r2c s LEU 92 Ca 0.12 1.14 0.10 0.00 -0.22 0.00 0.00 54.13 55.27 2r2c s LEU 92 Cb -0.10 -3.09 -0.04 0.00 0.50 0.00 0.00 46.19 43.45 2r2c s LEU 92 CO 0.02 -0.19 -0.14 -0.76 -1.32 0.00 0.00 176.35 173.96 2r2c s LEU 93 N 1.20 2.81 -0.06 -0.68 1.43 0.23 -0.35 118.68 123.26 2r2c s LEU 93 Ca 0.37 -0.68 0.02 0.00 -1.03 0.00 0.00 54.13 52.80 2r2c s LEU 93 Cb -0.17 -1.49 0.02 0.00 0.03 0.00 0.00 46.19 44.57 2r2c s LEU 93 CO 0.16 0.10 -0.09 -0.70 0.23 0.00 0.00 176.35 176.05 2r2c s GLU 94 N -2.84 1.34 -0.26 1.70 2.12 -0.44 -1.30 118.70 119.03 2r2c s GLU 94 Ca 0.24 -0.28 -0.29 0.00 0.36 0.00 0.00 54.97 55.00 2r2c s GLU 94 Cb -0.08 -1.18 0.01 0.00 0.26 0.00 0.00 34.13 33.13 2r2c s GLU 94 CO 0.14 -0.02 1.15 0.34 -0.54 0.00 0.00 175.26 176.32 2r2c s ASP 95 N 0.79 6.93 0.00 -1.70 -1.08 0.27 -1.03 116.67 120.85 2r2c s ASP 95 Ca -0.13 1.30 0.00 0.00 -0.52 0.00 0.00 52.55 53.20 2r2c s ASP 95 Cb -0.15 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.77 2r2c s ASP 95 CO 0.02 -0.84 0.53 1.17 0.52 0.00 0.00 175.17 176.57 2r2c n LYS 96 N 6.76 0.00 -1.92 4.34 4.81 -1.26 -4.93 118.16 125.96 2r2c n LYS 96 Ca 0.13 -0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.38 2r2c n LYS 96 Cb 0.46 -0.10 0.00 0.00 0.02 0.00 0.00 35.03 35.41 2r2c n LYS 96 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2r2c n ASN 114 N 0.00 -7.85 -4.63 3.14 2.85 -1.26 -4.95 115.26 102.56 2r2c n ASN 114 Ca 0.00 1.34 -0.40 0.00 -0.11 0.00 0.00 54.58 55.41 2r2c n ASN 114 Cb 0.53 -4.60 -0.07 0.00 1.24 0.00 0.00 39.78 36.88 2r2c n ASN 114 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 2r2c s HIS 115 N -1.34 3.29 0.03 1.20 3.76 -1.26 -4.94 115.29 116.03 2r2c s HIS 115 Ca 0.00 0.76 -0.18 0.00 -0.15 0.00 0.00 55.06 55.49 2r2c s HIS 115 Cb 0.00 -2.79 -0.06 0.00 1.11 0.00 0.00 32.58 30.84 2r2c s HIS 115 CO 0.00 -0.29 0.53 0.08 -0.85 0.00 0.00 174.74 174.21 2r2c s VAL 116 N 2.35 4.86 0.13 -0.90 1.01 -0.19 -0.72 120.40 126.93 2r2c s VAL 116 Ca 0.24 1.11 -0.31 0.00 0.00 0.00 0.00 61.98 63.03 2r2c s VAL 116 Cb -0.16 -3.85 -0.08 0.00 0.00 0.00 0.00 36.38 32.29 2r2c s VAL 116 CO 0.09 0.53 1.41 -0.76 0.00 0.00 0.00 175.10 176.37 2r2c s LEU 117 N -0.85 4.37 -0.07 3.92 1.43 -0.19 -1.32 118.68 125.98 2r2c s LEU 117 Ca 0.28 2.37 0.05 0.00 -1.03 0.00 0.00 54.13 55.80 2r2c s LEU 117 Cb -0.18 -3.59 -0.08 0.00 0.03 0.00 0.00 46.19 42.37 2r2c s LEU 117 CO 0.17 -0.67 0.01 0.54 0.23 0.00 0.00 176.35 176.63 2r2c n ARG 118 N 3.89 2.71 -3.57 1.70 5.12 0.53 -4.81 116.66 122.23 2r2c n ARG 118 Ca 0.12 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.91 2r2c n ARG 118 Cb 0.42 -1.17 -0.06 0.00 -1.16 0.00 0.00 32.46 30.49 2r2c n ARG 118 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2r2c s GLY 119 N -3.88 -0.37 -0.70 -0.13 0.00 -1.09 -4.97 107.32 96.19 2r2c s GLY 119 Ca -0.04 1.88 -0.18 0.00 0.00 0.00 0.00 44.72 46.39 2r2c s GLY 119 CO 0.26 1.16 0.79 0.00 0.00 0.00 0.00 173.10 175.31 2r2c s ALA 120 N -0.86 3.53 0.26 3.20 0.00 -1.26 -0.96 121.76 125.66 2r2c s ALA 120 Ca -0.04 -2.53 -0.04 0.00 0.00 0.00 0.00 51.96 49.36 2r2c s ALA 120 Cb -0.01 -3.62 0.37 0.00 0.00 0.00 0.00 23.12 19.86 2r2c s ALA 120 CO 0.03 -2.45 1.88 0.28 0.00 0.00 0.00 175.76 175.50 2r2c h VAL 121 N 5.70 1.09 -0.45 0.00 2.07 -1.56 -2.23 116.25 120.86 2r2c h VAL 121 Ca -0.14 -0.39 -0.22 0.00 0.82 0.00 0.00 66.70 66.77 2r2c h VAL 121 Cb 1.07 -0.14 -0.13 0.00 -1.52 0.00 0.00 31.29 30.56 2r2c h VAL 121 CO 1.04 0.21 0.04 -0.46 0.02 0.00 0.00 177.57 178.42 2r2c n ASN 122 N -4.53 2.78 0.00 0.57 6.94 -1.25 -4.85 115.26 114.92 2r2c n ASN 122 Ca 0.14 -3.70 0.00 0.00 -0.02 0.00 0.00 54.58 51.00 2r2c n ASN 122 Cb 0.17 -0.66 0.00 0.00 -2.36 0.00 0.00 39.78 36.92 2r2c n ASN 122 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2r2c n GLY 123 N -1.07 -0.05 3.70 4.83 0.00 -0.84 -4.13 105.19 107.63 2r2c n GLY 123 Ca 0.37 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 2r2c n GLY 123 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2r2c s ILE 124 N -2.14 3.08 0.00 -0.61 1.01 -1.26 -1.63 121.20 119.66 2r2c s ILE 124 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 60.65 61.32 2r2c s ILE 124 Cb 0.00 -3.43 0.00 0.00 0.01 0.00 0.00 42.46 39.04 2r2c s ILE 124 CO 0.00 0.03 0.00 0.79 0.00 0.00 0.00 174.94 175.76 2r2c n TRP 125 N 4.73 0.00 -4.04 3.97 8.01 -1.26 -4.90 117.44 123.95 2r2c n TRP 125 Ca 0.14 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.33 2r2c n TRP 125 Cb 0.41 -0.08 0.00 0.00 -2.01 0.00 0.00 31.31 29.63 2r2c n TRP 125 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2r2c n GLY 126 N -1.96 -0.12 3.23 6.99 0.00 -0.65 -4.60 105.19 108.09 2r2c n GLY 126 Ca 0.00 -1.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.86 2r2c n GLY 126 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2r2c s GLU 127 N 0.00 1.22 0.24 1.61 -1.05 -0.60 -4.82 118.70 115.30 2r2c s GLU 127 Ca 0.00 -1.60 -0.32 0.00 -0.15 0.00 0.00 54.97 52.91 2r2c s GLU 127 Cb 0.00 0.28 -0.13 0.00 -0.44 0.00 0.00 34.13 33.85 2r2c s GLU 127 CO 0.00 -0.41 1.57 -1.91 0.95 0.00 0.00 175.26 175.46 2r2c n GLU 128 N -0.28 2.44 -2.68 -4.83 2.13 -1.26 -0.31 120.64 115.85 2r2c n GLU 128 Ca 0.02 0.87 -0.42 0.00 0.66 0.00 0.00 57.16 58.29 2r2c n GLU 128 Cb 0.66 -2.63 -0.03 0.00 0.27 0.00 0.00 31.44 29.71 2r2c n GLU 128 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 2r2c s PHE 129 N 0.41 3.58 -0.14 4.31 5.36 0.14 -4.65 117.98 126.99 2r2c s PHE 129 Ca 0.70 1.63 0.00 0.00 -0.96 0.00 0.00 56.93 58.31 2r2c s PHE 129 Cb -0.57 -3.17 0.02 0.00 -0.34 0.00 0.00 43.02 38.96 2r2c s PHE 129 CO 0.43 -0.18 -0.13 0.08 -1.46 0.00 0.00 175.22 173.96 2r2c s VAL 130 N 1.46 1.47 0.15 3.12 1.01 -1.26 -4.72 120.40 121.63 2r2c s VAL 130 Ca 0.51 -0.58 -0.34 0.00 0.00 0.00 0.00 61.98 61.57 2r2c s VAL 130 Cb -0.20 -1.39 -0.14 0.00 0.00 0.00 0.00 36.38 34.65 2r2c s VAL 130 CO 0.24 0.44 1.58 -3.20 0.00 0.00 0.00 175.10 174.16 2r2c n ASN 131 N 4.69 3.05 0.00 3.32 5.15 -1.26 -2.08 115.26 128.13 2r2c n ASN 131 Ca -0.17 1.08 0.00 0.00 -0.60 0.00 0.00 54.58 54.89 2r2c n ASN 131 Cb 0.50 -1.42 0.00 0.00 -0.53 0.00 0.00 39.78 38.34 2r2c n ASN 131 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2r2c n LEU 132 N 3.48 0.48 -4.75 1.20 4.77 -0.51 -4.99 117.00 116.69 2r2c n LEU 132 Ca 0.17 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.74 2r2c n LEU 132 Cb 0.28 -0.74 -0.03 0.00 -2.33 0.00 0.00 43.42 40.60 2r2c n LEU 132 CO 0.64 -0.25 1.04 -0.75 -1.33 0.00 0.00 177.39 176.74 2r2c s LYS 133 N -0.50 4.33 -0.22 3.23 2.20 -0.88 -4.89 119.74 123.00 2r2c s LYS 133 Ca 0.00 2.19 -0.20 0.00 -0.36 0.00 0.00 55.97 57.60 2r2c s LYS 133 Cb 0.00 -3.13 -0.02 0.00 -1.51 0.00 0.00 37.83 33.16 2r2c s LYS 133 CO 0.00 -0.31 0.60 -0.51 -0.36 0.00 0.00 175.35 174.76 2r2c s ASP 134 N 0.20 6.60 -0.07 1.43 1.01 -1.26 -4.31 116.67 120.28 2r2c s ASP 134 Ca 0.57 0.73 -0.04 0.00 0.71 0.00 0.00 52.55 54.52 2r2c s ASP 134 Cb -0.39 -2.33 -0.04 0.00 1.01 0.00 0.00 42.92 41.17 2r2c s ASP 134 CO 0.43 -0.29 0.11 -0.31 0.21 0.00 0.00 175.17 175.32 2r2c s TYR 135 N 2.10 3.44 -0.07 4.23 2.02 0.53 -4.97 117.35 124.63 2r2c s TYR 135 Ca 0.26 0.36 -0.00 0.00 -0.37 0.00 0.00 57.07 57.32 2r2c s TYR 135 Cb -0.16 -1.84 0.02 0.00 -0.40 0.00 0.00 41.96 39.59 2r2c s TYR 135 CO 0.09 0.63 -0.03 -1.17 -1.57 0.00 0.00 175.55 173.50 2r2c s LEU 136 N -1.34 0.96 0.08 -1.29 2.96 -1.26 -1.39 118.68 117.40 2r2c s LEU 136 Ca 0.19 -0.16 0.06 0.00 -0.22 0.00 0.00 54.13 54.01 2r2c s LEU 136 Cb -0.12 -0.55 -0.03 0.00 0.50 0.00 0.00 46.19 45.99 2r2c s LEU 136 CO 0.09 -0.13 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.51 2r2c s TYR 137 N 1.58 1.44 0.16 5.38 2.02 0.40 -5.00 117.35 123.34 2r2c s TYR 137 Ca -0.00 -0.44 0.07 0.00 -0.37 0.00 0.00 57.07 56.33 2r2c s TYR 137 Cb -0.13 -0.80 -0.04 0.00 -0.40 0.00 0.00 41.96 40.59 2r2c s TYR 137 CO -0.04 0.11 -0.16 0.95 -1.57 0.00 0.00 175.55 174.85 2r2c s THR 138 N -1.22 1.63 -0.26 -0.71 -4.23 -1.26 -0.37 115.64 109.22 2r2c s THR 138 Ca 0.01 -1.95 -0.24 0.00 -1.18 0.00 0.00 61.69 58.34 2r2c s THR 138 Cb -0.10 -1.81 0.07 0.00 1.34 0.00 0.00 72.50 72.00 2r2c s THR 138 CO 0.03 -0.44 0.70 -0.47 -0.54 0.00 0.00 174.62 173.90 2r2c s TYR 139 N -2.38 -0.77 -0.35 3.99 5.04 -0.76 -4.99 117.35 117.13 2r2c s TYR 139 Ca 0.16 1.88 -0.15 0.00 -2.44 0.00 0.00 57.07 56.51 2r2c s TYR 139 Cb -0.04 0.27 -0.01 0.00 0.35 0.00 0.00 41.96 42.54 2r2c s TYR 139 CO 0.05 -0.37 0.37 0.00 -1.34 0.00 0.00 175.55 174.26 2r2c s ALA 140 N 0.41 3.49 0.03 3.97 0.00 -1.26 -0.92 121.76 127.48 2r2c s ALA 140 Ca -0.00 -1.25 -0.25 0.00 0.00 0.00 0.00 51.96 50.45 2r2c s ALA 140 Cb -0.05 -2.84 -0.05 0.00 0.00 0.00 0.00 23.12 20.18 2r2c s ALA 140 CO 0.00 -1.13 0.78 0.08 0.00 0.00 0.00 175.76 175.49 2r2c s VAL 141 N 2.02 4.77 -0.01 0.00 1.01 0.99 -5.01 120.40 124.17 2r2c s VAL 141 Ca 0.12 1.65 0.03 0.00 0.00 0.00 0.00 61.98 63.78 2r2c s VAL 141 Cb -0.17 -4.13 -0.00 0.00 0.00 0.00 0.00 36.38 32.08 2r2c s VAL 141 CO 0.12 0.33 -0.09 -1.61 0.00 0.00 0.00 175.10 173.85 2r2c s GLU 142 N 0.14 0.80 0.65 2.72 0.41 -1.26 -4.81 118.70 117.35 2r2c s GLU 142 Ca 0.40 -0.31 -0.15 0.00 -0.41 0.00 0.00 54.97 54.49 2r2c s GLU 142 Cb -0.20 -0.77 -0.00 0.00 -1.78 0.00 0.00 34.13 31.37 2r2c s GLU 142 CO 0.23 0.16 1.10 -1.25 -0.49 0.00 0.00 175.26 175.02 2r2c s PRO 143 N -0.06 2.87 0.64 0.39 0.04 -1.26 -5.00 135.00 132.62 2r2c s PRO 143 Ca 0.01 1.36 -0.18 0.00 0.04 0.00 0.00 61.00 62.24 2r2c s PRO 143 Cb -0.05 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.51 2r2c s PRO 143 CO -0.00 -1.19 1.19 1.28 0.04 0.00 0.00 177.00 178.32 2r2c n LEU 144 N -2.37 5.33 -4.63 -3.56 4.77 -1.26 -4.85 117.00 110.42 2r2c n LEU 144 Ca 0.10 0.81 -0.47 0.00 -0.03 0.00 0.00 56.01 56.42 2r2c n LEU 144 Cb 0.52 -1.51 -0.03 0.00 -2.33 0.00 0.00 43.42 40.07 2r2c n LEU 144 CO 0.48 -1.28 0.91 -1.20 -1.33 0.00 0.00 177.39 174.97 2r2c n SER 145 N -1.64 2.18 -1.98 -1.43 7.64 -1.26 -4.70 113.62 112.44 2r2c n SER 145 Ca 0.15 1.14 -0.05 0.00 1.01 0.00 0.00 58.87 61.12 2r2c n SER 145 Cb 0.48 -1.33 0.03 0.00 -1.01 0.00 0.00 64.21 62.37 2r2c n SER 145 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2r2c n GLY 146 N 2.22 0.21 3.34 0.23 0.00 -1.26 -5.24 105.19 104.69 2r2c n GLY 146 Ca 0.14 -0.09 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 2r2c n GLY 146 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2r2c s SER 148 N -3.24 2.64 -0.22 1.61 1.04 -1.26 -5.23 113.70 109.04 2r2c s SER 148 Ca 0.10 -0.91 -0.23 0.00 0.48 0.00 0.00 55.95 55.39 2r2c s SER 148 Cb -0.01 -0.15 -0.02 0.00 0.10 0.00 0.00 66.02 65.94 2r2c s SER 148 CO 0.24 -0.08 0.73 0.12 0.98 0.00 0.00 173.24 175.23 2r2c s PHE 149 N -2.36 3.34 -0.30 5.02 5.36 -1.26 -4.84 117.98 122.94 2r2c s PHE 149 Ca 0.18 1.03 0.03 0.00 -0.96 0.00 0.00 56.93 57.21 2r2c s PHE 149 Cb -0.04 -2.93 0.08 0.00 -0.34 0.00 0.00 43.02 39.79 2r2c s PHE 149 CO 0.07 -0.29 -0.02 0.08 -1.46 0.00 0.00 175.22 173.60 2r2c s VAL 150 N 2.37 2.13 0.32 3.12 1.01 -1.26 -5.02 120.40 123.06 2r2c s VAL 150 Ca 0.32 -1.95 0.02 0.00 0.00 0.00 0.00 61.98 60.37 2r2c s VAL 150 Cb -0.16 -2.43 0.28 0.00 0.00 0.00 0.00 36.38 34.08 2r2c s VAL 150 CO 0.09 -0.34 1.92 0.00 0.00 0.00 0.00 175.10 176.77 2r2c h ALA 151 N 7.72 1.57 0.00 5.51 0.00 -1.95 -2.15 119.26 129.95 2r2c h ALA 151 Ca -0.11 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2r2c h ALA 151 Cb 1.03 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2r2c h ALA 151 CO 0.49 0.29 0.00 0.93 0.00 0.00 0.00 179.25 180.96 2r2c h GLU 152 N 0.96 0.00 -0.00 0.00 3.07 -1.95 -2.91 114.58 113.74 2r2c h GLU 152 Ca 0.38 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.24 2r2c h GLU 152 Cb 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 2r2c h GLU 152 CO -0.14 0.00 -0.13 0.09 -1.40 0.00 0.00 179.01 177.43 2r2c n ASN 153 N -2.39 0.36 -4.91 1.42 3.02 -0.81 -4.87 115.26 107.08 2r2c n ASN 153 Ca 0.03 -0.33 -0.31 0.00 -0.03 0.00 0.00 54.58 53.94 2r2c n ASN 153 Cb 0.29 -0.12 -0.04 0.00 -0.61 0.00 0.00 39.78 39.30 2r2c n ASN 153 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2r2c s TYR 154 N -2.63 3.49 0.32 3.10 2.02 -1.10 -0.56 117.35 121.99 2r2c s TYR 154 Ca 0.24 0.42 -0.09 0.00 -0.37 0.00 0.00 57.07 57.27 2r2c s TYR 154 Cb 0.20 -1.90 0.01 0.00 -0.40 0.00 0.00 41.96 39.87 2r2c s TYR 154 CO 0.51 0.49 0.55 -1.54 -1.57 0.00 0.00 175.55 173.99 2r2c s SER 155 N -2.53 0.36 -0.03 2.29 1.04 -0.42 -4.17 113.70 110.25 2r2c s SER 155 Ca 0.39 -1.21 0.04 0.00 0.48 0.00 0.00 55.95 55.65 2r2c s SER 155 Cb -0.12 0.68 -0.01 0.00 0.10 0.00 0.00 66.02 66.67 2r2c s SER 155 CO 0.26 -1.33 -0.15 -0.63 0.98 0.00 0.00 173.24 172.37 2r2c s ILE 156 N -3.23 1.24 -0.03 -1.02 -1.09 -0.32 -0.60 121.20 116.14 2r2c s ILE 156 Ca 0.24 -0.63 0.07 0.00 -2.23 0.00 0.00 60.65 58.10 2r2c s ILE 156 Cb -0.02 -1.06 -0.02 0.00 -1.58 0.00 0.00 42.46 39.79 2r2c s ILE 156 CO 0.14 0.36 -0.24 0.54 -1.23 0.00 0.00 174.94 174.51 2r2c s VAL 157 N -0.08 1.95 -0.02 2.92 0.11 -0.58 -0.55 120.40 124.15 2r2c s VAL 157 Ca 0.00 -1.04 0.06 0.00 -2.93 0.00 0.00 61.98 58.07 2r2c s VAL 157 Cb -0.09 -1.63 -0.01 0.00 -1.53 0.00 0.00 36.38 33.12 2r2c s VAL 157 CO 0.01 0.55 -0.19 0.00 -3.33 0.00 0.00 175.10 172.13 2r2c s ALA 158 N -0.44 1.63 0.07 1.54 0.00 -0.24 -0.86 121.76 123.46 2r2c s ALA 158 Ca 0.05 -0.83 -0.09 0.00 0.00 0.00 0.00 51.96 51.09 2r2c s ALA 158 Cb -0.11 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.58 2r2c s ALA 158 CO 0.00 0.38 0.20 -0.59 0.00 0.00 0.00 175.76 175.76 2r2c s PHE 159 N -0.39 0.10 -0.13 0.00 -0.12 -0.35 -0.81 117.98 116.28 2r2c s PHE 159 Ca 0.06 -0.45 0.00 0.00 -0.05 0.00 0.00 56.93 56.49 2r2c s PHE 159 Cb -0.08 -0.03 -0.01 0.00 -0.63 0.00 0.00 43.02 42.27 2r2c s PHE 159 CO -0.00 -0.51 -0.15 0.08 -0.05 0.00 0.00 175.22 174.58 2r2c s VAL 160 N -3.41 2.82 0.05 -2.49 1.01 -0.75 -0.97 120.40 116.66 2r2c s VAL 160 Ca 0.01 -0.74 0.05 0.00 0.00 0.00 0.00 61.98 61.30 2r2c s VAL 160 Cb 0.03 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.21 2r2c s VAL 160 CO -0.09 0.52 -0.13 -0.72 0.00 0.00 0.00 175.10 174.69 2r2c s TYR 161 N 0.49 1.13 0.05 5.22 -0.85 -1.26 -0.23 117.35 121.90 2r2c s TYR 161 Ca -0.10 -0.41 -0.31 0.00 -0.52 0.00 0.00 57.07 55.73 2r2c s TYR 161 Cb -0.16 -0.66 -0.07 0.00 0.38 0.00 0.00 41.96 41.46 2r2c s TYR 161 CO 0.05 0.03 1.43 0.34 -1.52 0.00 0.00 175.55 175.88 2r2c s ASP 162 N -1.45 6.81 0.44 -0.18 -1.08 0.27 -4.35 116.67 117.12 2r2c s ASP 162 Ca -0.01 2.25 0.10 0.00 -0.52 0.00 0.00 52.55 54.36 2r2c s ASP 162 Cb -0.09 -2.57 0.96 0.00 -1.46 0.00 0.00 42.92 39.76 2r2c s ASP 162 CO 0.02 -0.72 2.04 0.58 0.52 0.00 0.00 175.17 177.61 2r2c h VAL 163 N 4.66 1.09 0.03 1.11 2.07 -1.59 -0.81 116.25 122.81 2r2c h VAL 163 Ca -0.40 -0.30 -0.28 0.00 0.82 0.00 0.00 66.70 66.54 2r2c h VAL 163 Cb 1.19 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.79 2r2c h VAL 163 CO 0.89 0.11 -1.53 0.00 0.02 0.00 0.00 177.57 177.07 2r2c n GLN 164 N -4.44 0.62 0.01 1.57 1.13 -1.26 -4.52 117.38 110.49 2r2c n GLN 164 Ca 0.00 0.48 0.11 0.00 -1.94 0.00 0.00 57.00 55.65 2r2c n GLN 164 Cb 0.13 -1.73 -0.03 0.00 0.11 0.00 0.00 30.24 28.73 2r2c n GLN 164 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2r2c n THR 165 N -4.16 0.07 -0.90 5.09 -2.24 -1.24 -4.96 114.28 105.95 2r2c n THR 165 Ca -0.33 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 2r2c n THR 165 Cb 0.79 0.45 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 2r2c n THR 165 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2r2c n PHE 166 N -1.80 0.00 -1.71 4.78 3.72 -0.31 -4.97 117.46 117.17 2r2c n PHE 166 Ca 0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.00 2r2c n PHE 166 Cb 0.41 -1.00 -0.03 0.00 -0.94 0.00 0.00 39.48 37.92 2r2c n PHE 166 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 2r2c n GLU 167 N -1.24 2.69 -2.81 -1.08 2.13 -1.26 -4.57 120.64 114.51 2r2c n GLU 167 Ca 0.00 0.97 -0.43 0.00 0.66 0.00 0.00 57.16 58.36 2r2c n GLU 167 Cb 0.18 -2.81 -0.04 0.00 0.27 0.00 0.00 31.44 29.04 2r2c n GLU 167 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2r2c s VAL 168 N 1.12 4.51 0.04 6.31 1.01 -1.26 -0.56 120.40 131.58 2r2c s VAL 168 Ca 0.75 0.97 -0.03 0.00 0.00 0.00 0.00 61.98 63.67 2r2c s VAL 168 Cb -0.53 -4.39 -0.28 0.00 0.00 0.00 0.00 36.38 31.18 2r2c s VAL 168 CO 0.33 -0.70 1.02 1.88 0.00 0.00 0.00 175.10 177.63 2r2c h TYR 169 N 8.80 0.46 -2.97 5.22 0.05 -0.97 -3.48 116.97 124.08 2r2c h TYR 169 Ca -0.24 -0.34 -0.02 0.00 0.05 0.00 0.00 58.73 58.18 2r2c h TYR 169 Cb 1.08 -0.02 -0.12 0.00 1.01 0.00 0.00 36.73 38.68 2r2c h TYR 169 CO 0.86 1.31 0.20 0.34 -1.05 0.00 0.00 178.16 179.83 2r2c s ASP 170 N -7.06 -0.57 0.01 3.88 2.15 -1.23 -4.58 116.67 109.27 2r2c s ASP 170 Ca -0.06 0.02 0.00 0.00 0.43 0.00 0.00 52.55 52.94 2r2c s ASP 170 Cb 0.07 0.60 -0.01 0.00 -0.30 0.00 0.00 42.92 43.28 2r2c s ASP 170 CO 0.87 -0.96 -0.02 -0.69 -0.17 0.00 0.00 175.17 174.21 2r2c s VAL 171 N -3.66 0.09 -0.03 1.11 1.01 -1.26 -1.81 120.40 115.84 2r2c s VAL 171 Ca 0.01 -0.32 0.02 0.00 0.00 0.00 0.00 61.98 61.69 2r2c s VAL 171 Cb -0.01 -0.13 0.01 0.00 0.00 0.00 0.00 36.38 36.25 2r2c s VAL 171 CO -0.12 -0.15 -0.06 0.54 0.00 0.00 0.00 175.10 175.31 2r2c s VAL 172 N -0.47 0.60 -0.18 2.92 0.11 0.01 -4.85 120.40 118.54 2r2c s VAL 172 Ca -0.05 -0.22 0.01 0.00 -2.93 0.00 0.00 61.98 58.79 2r2c s VAL 172 Cb -0.03 -0.57 0.02 0.00 -1.53 0.00 0.00 36.38 34.26 2r2c s VAL 172 CO -0.00 0.21 -0.19 -2.28 -3.33 0.00 0.00 175.10 169.51 2r2c s HIS 173 N 0.48 2.79 0.11 1.54 2.46 -1.26 -1.08 115.29 120.33 2r2c s HIS 173 Ca -0.07 -1.57 0.08 0.00 0.47 0.00 0.00 55.06 53.97 2r2c s HIS 173 Cb -0.10 -1.93 -0.04 0.00 -0.13 0.00 0.00 32.58 30.38 2r2c s HIS 173 CO 0.00 -0.78 -0.20 0.14 -2.47 0.00 0.00 174.74 171.44 2r2c s VAL 174 N 1.28 1.70 0.83 0.89 -7.23 0.29 -5.00 120.40 113.15 2r2c s VAL 174 Ca 0.04 -1.62 -0.11 0.00 -1.81 0.00 0.00 61.98 58.48 2r2c s VAL 174 Cb -0.13 -1.60 0.09 0.00 0.56 0.00 0.00 36.38 35.30 2r2c s VAL 174 CO -0.12 -0.13 1.09 -0.54 -0.31 0.00 0.00 175.10 175.09 2r2c s LYS 175 N -2.12 1.82 -0.40 4.82 1.02 -1.26 -1.17 119.74 122.44 2r2c s LYS 175 Ca 0.08 0.78 -0.14 0.00 0.02 0.00 0.00 55.97 56.72 2r2c s LYS 175 Cb -0.09 -1.88 0.03 0.00 -0.52 0.00 0.00 37.83 35.37 2r2c s LYS 175 CO 0.05 -1.84 0.28 0.42 -0.92 0.00 0.00 175.35 173.33 2r2c s ILE 176 N -3.04 5.03 0.42 2.17 1.01 -1.26 -4.27 121.20 121.27 2r2c s ILE 176 Ca 0.62 -0.77 -0.25 0.00 0.00 0.00 0.00 60.65 60.25 2r2c s ILE 176 Cb -0.16 -3.83 -0.08 0.00 0.01 0.00 0.00 42.46 38.40 2r2c s ILE 176 CO 0.56 -0.31 1.20 0.20 0.00 0.00 0.00 174.94 176.58 2r2c s ASN 177 N 1.71 6.38 0.93 3.58 0.01 -0.46 -4.70 114.94 122.38 2r2c s ASN 177 Ca 0.04 2.42 -0.11 0.00 -0.71 0.00 0.00 52.86 54.50 2r2c s ASN 177 Cb -0.20 -2.62 0.15 0.00 0.41 0.00 0.00 41.25 39.00 2r2c s ASN 177 CO 0.09 -0.78 1.12 -2.84 -1.51 0.00 0.00 177.10 173.17 2r2c s PRO 178 N -2.37 0.93 0.50 -0.60 0.02 -1.26 -0.45 135.00 131.77 2r2c s PRO 178 Ca 0.59 1.37 -0.23 0.00 0.02 0.00 0.00 61.00 62.75 2r2c s PRO 178 Cb -0.32 -1.73 -0.07 0.00 0.02 0.00 0.00 34.50 32.40 2r2c s PRO 178 CO 0.40 -2.63 1.21 1.04 -0.33 0.00 0.00 177.00 176.69 2r2c n GLN 179 N -4.22 1.58 0.00 5.54 6.02 -1.25 -4.54 117.38 120.51 2r2c n GLN 179 Ca 0.10 0.58 0.00 0.00 -0.01 0.00 0.00 57.00 57.67 2r2c n GLN 179 Cb 0.53 -2.37 0.00 0.00 1.02 0.00 0.00 30.24 29.41 2r2c n GLN 179 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92