#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h2q s SER 6 N 0.00 3.82 0.79 -5.58 0.15 -1.26 -2.45 113.70 109.17 1h2q s SER 6 Ca 0.00 -0.49 -0.12 0.00 0.70 0.00 0.00 55.95 56.04 1h2q s SER 6 Cb 0.00 -0.57 0.07 0.00 -1.71 0.00 0.00 66.02 63.81 1h2q s SER 6 CO 0.00 0.22 1.13 0.00 1.20 0.00 0.00 173.24 175.80 1h2q s PRO 8 N -5.40 2.58 0.08 0.00 0.02 -1.26 -4.93 135.00 126.07 1h2q s PRO 8 Ca 0.61 1.18 -0.31 0.00 0.02 0.00 0.00 61.00 62.50 1h2q s PRO 8 Cb -0.12 -1.94 -0.09 0.00 0.02 0.00 0.00 34.50 32.37 1h2q s PRO 8 CO 0.51 -1.40 1.77 1.21 -0.33 0.00 0.00 177.00 178.77 1h2q s ASN 9 N -3.25 6.51 0.28 2.53 2.47 -1.26 -4.86 114.94 117.36 1h2q s ASN 9 Ca 0.62 2.60 -0.00 0.00 0.42 0.00 0.00 52.86 56.50 1h2q s ASN 9 Cb -0.17 -2.56 0.65 0.00 -1.45 0.00 0.00 41.25 37.72 1h2q s ASN 9 CO 0.51 -0.96 1.64 -0.65 -3.72 0.00 0.00 177.10 173.92 1h2q h PRO 10 N 8.89 0.17 0.00 0.43 0.11 -2.01 -3.47 132.00 136.13 1h2q h PRO 10 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1h2q h PRO 10 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1h2q h PRO 10 CO 0.94 0.12 0.00 0.41 -0.21 0.00 0.00 178.00 179.26 1h2q n GLY 11 N -1.39 0.87 3.42 -0.55 0.00 -1.26 -5.01 105.19 101.28 1h2q n GLY 11 Ca 0.20 -1.26 -0.12 0.00 0.00 0.00 0.00 46.02 44.84 1h2q n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h2q s GLU 12 N 0.00 1.25 -0.17 1.61 2.02 -1.26 -4.99 118.70 117.16 1h2q s GLU 12 Ca 0.00 -0.46 -0.00 0.00 0.02 0.00 0.00 54.97 54.53 1h2q s GLU 12 Cb 0.00 0.58 0.04 0.00 0.10 0.00 0.00 34.13 34.85 1h2q s GLU 12 CO 0.00 -0.55 -0.05 0.42 0.02 0.00 0.00 175.26 175.10 1h2q s ILE 13 N -3.71 1.16 0.22 -1.63 1.01 -1.26 -5.05 121.20 111.94 1h2q s ILE 13 Ca 0.01 -0.68 -0.32 0.00 0.00 0.00 0.00 60.65 59.66 1h2q s ILE 13 Cb -0.01 -1.33 -0.12 0.00 0.01 0.00 0.00 42.46 41.00 1h2q s ILE 13 CO -0.13 0.12 1.63 -2.11 0.00 0.00 0.00 174.94 174.45 1h2q n ARG 14 N 4.85 2.55 -2.09 2.79 -4.01 -1.26 -1.52 116.66 117.98 1h2q n ARG 14 Ca -0.12 0.92 -0.20 0.00 -1.04 0.00 0.00 57.85 57.41 1h2q n ARG 14 Cb 0.47 -2.71 -0.04 0.00 -3.04 0.00 0.00 32.46 27.15 1h2q n ARG 14 CO 0.00 0.00 0.00 0.09 -3.04 0.00 0.00 177.63 174.68 1h2q n ASN 15 N 3.19 -5.59 -3.01 2.89 4.13 -1.26 -4.38 115.26 111.23 1h2q n ASN 15 Ca 0.14 0.17 -0.08 0.00 1.68 0.00 0.00 54.58 56.48 1h2q n ASN 15 Cb 0.34 -4.70 0.02 0.00 -1.54 0.00 0.00 39.78 33.90 1h2q n ASN 15 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1h2q s GLY 16 N -2.35 0.33 -0.07 7.41 0.00 -0.58 -0.44 107.32 111.62 1h2q s GLY 16 Ca 0.00 -0.70 -0.05 0.00 0.00 0.00 0.00 44.72 43.97 1h2q s GLY 16 CO 0.00 -0.16 0.16 1.20 0.00 0.00 0.00 173.10 174.30 1h2q s GLN 17 N -2.40 0.16 -0.19 2.90 -0.21 0.14 -4.40 119.66 115.67 1h2q s GLN 17 Ca 0.15 0.29 -0.23 0.00 0.02 0.00 0.00 55.36 55.60 1h2q s GLN 17 Cb -0.05 -0.00 -0.02 0.00 1.00 0.00 0.00 33.01 33.93 1h2q s GLN 17 CO 0.11 -0.08 0.72 0.42 -2.12 0.00 0.00 175.29 174.34 1h2q s ILE 18 N 0.50 4.96 -0.12 1.08 -1.09 -1.26 -1.88 121.20 123.38 1h2q s ILE 18 Ca -0.03 1.38 -0.08 0.00 -2.23 0.00 0.00 60.65 59.68 1h2q s ILE 18 Cb -0.05 -4.03 -0.04 0.00 -1.58 0.00 0.00 42.46 36.76 1h2q s ILE 18 CO -0.02 0.07 0.17 -0.62 -1.23 0.00 0.00 174.94 173.31 1h2q s ASP 19 N 1.18 6.41 -0.47 3.58 -1.08 0.31 -4.96 116.67 121.64 1h2q s ASP 19 Ca 0.33 0.49 0.07 0.00 -0.52 0.00 0.00 52.55 52.92 1h2q s ASP 19 Cb -0.16 -2.09 0.24 0.00 -1.46 0.00 0.00 42.92 39.45 1h2q s ASP 19 CO 0.11 0.36 0.58 0.52 0.52 0.00 0.00 175.17 177.26 1h2q n VAL 20 N 2.22 0.24 -0.04 1.11 0.31 -1.26 -2.21 118.33 118.69 1h2q n VAL 20 Ca -0.19 -4.36 -0.01 0.00 -0.01 0.00 0.00 64.34 59.78 1h2q n VAL 20 Cb 0.54 -1.99 0.26 0.00 -0.91 0.00 0.00 33.84 31.75 1h2q n VAL 20 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1h2q h PRO 21 N 4.18 0.62 -1.19 5.55 0.13 -1.97 -3.34 132.00 135.99 1h2q h PRO 21 Ca 0.12 -0.13 -0.52 0.00 -0.87 0.00 0.00 66.00 64.60 1h2q h PRO 21 Cb 0.81 -0.09 -0.42 0.00 0.13 0.00 0.00 31.00 31.43 1h2q h PRO 21 CO 0.57 0.61 -0.85 0.41 -0.23 0.00 0.00 178.00 178.52 1h2q n GLY 22 N -0.88 5.16 6.89 1.56 0.00 -1.26 -5.10 105.19 111.56 1h2q n GLY 22 Ca 0.02 -2.42 0.00 0.00 0.00 0.00 0.00 46.02 43.63 1h2q n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h2q n GLY 23 N -0.48 -1.49 0.57 -0.02 0.00 -1.26 -4.57 105.19 97.94 1h2q n GLY 23 Ca 0.34 -1.20 0.05 0.00 0.00 0.00 0.00 46.02 45.20 1h2q n GLY 23 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1h2q n ILE 24 N -1.08 0.98 -1.85 -0.61 -6.64 -1.26 -4.58 119.36 104.31 1h2q n ILE 24 Ca 0.00 -1.47 -0.29 0.00 -1.77 0.00 0.00 62.75 59.22 1h2q n ILE 24 Cb 0.01 0.23 0.08 0.00 -1.44 0.00 0.00 39.64 38.51 1h2q n ILE 24 CO 0.00 0.00 0.00 -0.76 -1.77 0.00 0.00 176.55 174.02 1h2q s LEU 25 N -1.48 2.62 0.04 7.28 1.43 -1.26 -1.59 118.68 125.72 1h2q s LEU 25 Ca 0.23 0.95 -0.38 0.00 -1.03 0.00 0.00 54.13 53.89 1h2q s LEU 25 Cb 0.22 -3.54 -0.18 0.00 0.03 0.00 0.00 46.19 42.72 1h2q s LEU 25 CO -0.03 -1.75 1.18 0.33 0.23 0.00 0.00 176.35 176.30 1h2q n PHE 26 N -3.24 1.00 0.00 0.29 7.35 -1.03 -1.10 117.46 120.73 1h2q n PHE 26 Ca 0.07 0.87 0.00 0.00 -0.76 0.00 0.00 57.45 57.64 1h2q n PHE 26 Cb 0.59 -2.19 0.00 0.00 0.35 0.00 0.00 39.48 38.23 1h2q n PHE 26 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1h2q n GLY 27 N 1.95 2.03 3.85 7.13 0.00 0.24 -5.03 105.19 115.35 1h2q n GLY 27 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1h2q n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2q s ALA 28 N -2.32 3.23 -0.00 4.61 0.00 -0.26 -4.84 121.76 122.17 1h2q s ALA 28 Ca 0.00 0.07 0.06 0.00 0.00 0.00 0.00 51.96 52.09 1h2q s ALA 28 Cb 0.00 -2.89 -0.02 0.00 0.00 0.00 0.00 23.12 20.21 1h2q s ALA 28 CO 0.00 0.10 -0.18 0.99 0.00 0.00 0.00 175.76 176.67 1h2q s THR 29 N -2.24 1.45 -0.03 0.00 2.01 -1.26 -0.80 115.64 114.77 1h2q s THR 29 Ca 0.56 -0.84 0.02 0.00 0.31 0.00 0.00 61.69 61.74 1h2q s THR 29 Cb -0.10 -1.22 -0.03 0.00 0.01 0.00 0.00 72.50 71.16 1h2q s THR 29 CO 0.23 0.36 -0.06 0.27 -0.69 0.00 0.00 174.62 174.73 1h2q s ILE 30 N -0.49 3.76 0.22 1.82 -4.36 -0.13 -4.65 121.20 117.37 1h2q s ILE 30 Ca 0.07 -0.62 0.08 0.00 -0.26 0.00 0.00 60.65 59.92 1h2q s ILE 30 Cb -0.07 -2.60 -0.04 0.00 1.25 0.00 0.00 42.46 41.00 1h2q s ILE 30 CO -0.00 0.48 0.04 -0.44 0.24 0.00 0.00 174.94 175.25 1h2q s SER 31 N -1.18 4.84 0.12 4.36 0.01 -0.94 -1.65 113.70 119.26 1h2q s SER 31 Ca 0.15 -0.46 0.08 0.00 1.31 0.00 0.00 55.95 57.04 1h2q s SER 31 Cb -0.11 -1.03 -0.04 0.00 0.21 0.00 0.00 66.02 65.05 1h2q s SER 31 CO 0.05 0.03 -0.21 -0.36 0.41 0.00 0.00 173.24 173.17 1h2q s PHE 32 N -2.04 1.82 0.28 2.43 0.08 -1.08 -0.53 117.98 118.95 1h2q s PHE 32 Ca 0.30 -0.43 -0.15 0.00 0.12 0.00 0.00 56.93 56.77 1h2q s PHE 32 Cb -0.08 -0.97 0.01 0.00 -0.57 0.00 0.00 43.02 41.41 1h2q s PHE 32 CO 0.20 0.24 0.59 -1.54 -0.10 0.00 0.00 175.22 174.61 1h2q s SER 33 N -2.11 -0.05 0.17 1.36 1.04 -0.79 -4.92 113.70 108.41 1h2q s SER 33 Ca 0.09 -0.90 0.05 0.00 0.48 0.00 0.00 55.95 55.67 1h2q s SER 33 Cb -0.09 0.67 -0.05 0.00 0.10 0.00 0.00 66.02 66.65 1h2q s SER 33 CO 0.05 -1.28 -0.09 0.00 0.98 0.00 0.00 173.24 172.91 1h2q s ASN 35 N -3.22 6.13 0.25 0.00 0.02 0.42 -4.85 114.94 113.70 1h2q s ASN 35 Ca 0.20 2.27 -0.29 0.00 -1.02 0.00 0.00 52.86 54.02 1h2q s ASN 35 Cb 0.03 -2.60 -0.15 0.00 0.02 0.00 0.00 41.25 38.55 1h2q s ASN 35 CO 0.03 -0.94 1.00 0.41 0.02 0.00 0.00 177.10 177.62 1h2q n THR 36 N -0.59 1.73 -0.10 1.60 -1.04 -1.26 -1.74 114.28 112.87 1h2q n THR 36 Ca 0.08 -0.43 0.00 0.00 -2.04 0.00 0.00 64.05 61.66 1h2q n THR 36 Cb 0.49 -0.86 0.00 0.00 -1.82 0.00 0.00 70.33 68.13 1h2q n THR 36 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1h2q n GLY 37 N 1.49 0.54 3.22 3.41 0.00 -1.26 -4.96 105.19 107.62 1h2q n GLY 37 Ca 0.12 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.97 1h2q n GLY 37 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1h2q s TYR 38 N -2.22 1.27 -0.05 1.61 1.51 -0.71 -0.32 117.35 118.44 1h2q s TYR 38 Ca 0.00 -0.59 0.03 0.00 -1.01 0.00 0.00 57.07 55.50 1h2q s TYR 38 Cb 0.00 -0.67 0.01 0.00 -0.11 0.00 0.00 41.96 41.18 1h2q s TYR 38 CO 0.00 0.09 -0.12 -1.59 -1.11 0.00 0.00 175.55 172.82 1h2q s LYS 39 N -2.69 1.51 0.49 -0.62 -2.85 0.15 -4.75 119.74 110.99 1h2q s LYS 39 Ca 0.07 -0.42 -0.23 0.00 -1.00 0.00 0.00 55.97 54.39 1h2q s LYS 39 Cb -0.04 -1.29 -0.06 0.00 -2.06 0.00 0.00 37.83 34.37 1h2q s LYS 39 CO 0.02 0.09 1.31 -1.17 0.10 0.00 0.00 175.35 175.70 1h2q s LEU 40 N 0.42 3.97 -0.25 2.77 2.96 -1.26 -1.82 118.68 125.46 1h2q s LEU 40 Ca -0.09 2.66 -0.03 0.00 -0.22 0.00 0.00 54.13 56.44 1h2q s LEU 40 Cb -0.13 -4.18 0.08 0.00 0.50 0.00 0.00 46.19 42.47 1h2q s LEU 40 CO 0.02 -1.27 0.10 0.12 -1.32 0.00 0.00 176.35 174.00 1h2q s PHE 41 N -1.34 0.73 -2.65 5.38 5.36 0.81 -4.90 117.98 121.38 1h2q s PHE 41 Ca 0.66 -0.95 0.00 0.00 -0.96 0.00 0.00 56.93 55.68 1h2q s PHE 41 Cb -0.38 -1.06 0.00 0.00 -0.34 0.00 0.00 43.02 41.24 1h2q s PHE 41 CO 0.46 -0.74 0.00 0.41 -1.46 0.00 0.00 175.22 173.89 1h2q n GLY 42 N 5.13 0.74 3.71 13.12 0.00 -1.26 -1.21 105.19 125.41 1h2q n GLY 42 Ca -0.06 -2.03 -0.42 0.00 0.00 0.00 0.00 46.02 43.51 1h2q n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1h2q s SER 43 N -4.00 6.59 0.00 1.61 0.01 -1.26 -4.90 113.70 111.74 1h2q s SER 43 Ca 0.00 2.57 0.27 0.00 1.31 0.00 0.00 55.95 60.11 1h2q s SER 43 Cb 0.00 -2.58 1.54 0.00 0.21 0.00 0.00 66.02 65.19 1h2q s SER 43 CO 0.00 -0.85 1.96 0.35 0.41 0.00 0.00 173.24 175.11 1h2q n THR 44 N 4.26 0.06 -3.64 1.44 -2.24 -1.26 -4.40 114.28 108.50 1h2q n THR 44 Ca 0.15 0.01 -0.02 0.00 -2.27 0.00 0.00 64.05 61.92 1h2q n THR 44 Cb 0.39 -0.58 -0.05 0.00 -2.10 0.00 0.00 70.33 68.00 1h2q n THR 44 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1h2q s SER 45 N -2.21 -0.05 0.00 3.42 1.04 -1.26 -2.63 113.70 112.01 1h2q s SER 45 Ca 0.35 0.06 0.08 0.00 0.48 0.00 0.00 55.95 56.93 1h2q s SER 45 Cb 0.19 0.05 -0.02 0.00 0.10 0.00 0.00 66.02 66.33 1h2q s SER 45 CO 0.35 -0.04 -0.26 -0.55 0.98 0.00 0.00 173.24 173.72 1h2q s SER 46 N -0.86 3.08 -0.16 7.02 0.15 -0.66 -4.66 113.70 117.61 1h2q s SER 46 Ca 0.08 -0.51 -0.00 0.00 0.70 0.00 0.00 55.95 56.22 1h2q s SER 46 Cb -0.02 -0.32 -0.01 0.00 -1.71 0.00 0.00 66.02 63.97 1h2q s SER 46 CO -0.09 0.30 -0.13 0.12 1.20 0.00 0.00 173.24 174.64 1h2q s PHE 47 N -0.68 2.82 -1.02 3.44 5.36 -1.26 -0.96 117.98 125.69 1h2q s PHE 47 Ca 0.11 -0.93 -0.23 0.00 -0.96 0.00 0.00 56.93 54.91 1h2q s PHE 47 Cb -0.10 -1.91 -0.02 0.00 -0.34 0.00 0.00 43.02 40.65 1h2q s PHE 47 CO 0.00 -0.42 1.79 0.00 -1.46 0.00 0.00 175.22 175.13 1h2q n LEU 49 N 12.13 1.57 -1.20 0.00 -0.00 -1.26 -0.59 117.00 127.66 1h2q n LEU 49 Ca 0.40 -0.60 0.00 0.00 -0.00 0.00 0.00 56.01 55.80 1h2q n LEU 49 Cb 0.48 -0.02 0.00 0.00 -0.00 0.00 0.00 43.42 43.88 1h2q n LEU 49 CO 0.64 0.31 -0.04 0.00 -0.00 0.00 0.00 177.39 178.30 1h2q n GLN 56 N -0.58 -0.43 -1.73 1.47 10.64 -1.26 -4.88 117.38 120.60 1h2q n GLN 56 Ca 0.08 0.32 -0.36 0.00 -1.83 0.00 0.00 57.00 55.21 1h2q n GLN 56 Cb 0.41 -0.82 0.07 0.00 -0.86 0.00 0.00 30.24 29.04 1h2q n GLN 56 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.06 173.65 1h2q s TRP 57 N -2.50 2.15 -0.05 2.61 0.52 -1.26 -4.98 118.94 115.43 1h2q s TRP 57 Ca 0.00 1.53 -0.14 0.00 0.02 0.00 0.00 56.10 57.51 1h2q s TRP 57 Cb 0.00 -3.57 -0.09 0.00 -1.15 0.00 0.00 33.47 28.66 1h2q s TRP 57 CO 0.00 -2.64 0.55 0.66 0.02 0.00 0.00 176.95 175.54 1h2q h SER 58 N 0.40 -0.30 -2.90 2.95 4.64 -0.87 -3.47 113.55 113.99 1h2q h SER 58 Ca -0.50 -0.09 -0.60 0.00 -0.47 0.00 0.00 61.79 60.13 1h2q h SER 58 Cb 1.31 0.08 -0.08 0.00 -0.31 0.00 0.00 62.40 63.40 1h2q h SER 58 CO 0.53 0.19 -0.59 -1.81 -0.87 0.00 0.00 176.83 174.27 1h2q s ASP 59 N -5.20 5.43 0.81 4.97 1.11 -1.26 -4.94 116.67 117.59 1h2q s ASP 59 Ca -0.08 -0.12 -0.12 0.00 0.18 0.00 0.00 52.55 52.42 1h2q s ASP 59 Cb 0.00 -1.40 0.08 0.00 1.07 0.00 0.00 42.92 42.67 1h2q s ASP 59 CO 0.25 0.11 1.17 -2.16 1.18 0.00 0.00 175.17 175.72 1h2q s PRO 60 N -2.82 1.96 0.34 8.23 0.04 -1.26 -4.73 135.00 136.76 1h2q s PRO 60 Ca 0.30 0.15 -0.28 0.00 0.04 0.00 0.00 61.00 61.21 1h2q s PRO 60 Cb -0.11 -1.95 -0.10 0.00 0.04 0.00 0.00 34.50 32.39 1h2q s PRO 60 CO 0.22 -1.61 1.23 -0.51 0.04 0.00 0.00 177.00 176.37 1h2q s LEU 61 N -5.60 4.38 0.00 -3.56 1.02 -1.26 -4.54 118.68 109.12 1h2q s LEU 61 Ca 0.62 2.51 -0.03 0.00 0.02 0.00 0.00 54.13 57.25 1h2q s LEU 61 Cb -0.11 -3.75 0.14 0.00 0.02 0.00 0.00 46.19 42.49 1h2q s LEU 61 CO 0.50 -0.50 0.94 -0.81 0.02 0.00 0.00 176.35 176.49 1h2q n PRO 62 N 0.66 -0.27 -4.43 1.29 -0.04 -1.26 -4.85 135.00 126.11 1h2q n PRO 62 Ca 0.01 -2.27 -0.26 0.00 -0.04 0.00 0.00 63.50 60.95 1h2q n PRO 62 Cb 0.44 -0.72 -0.09 0.00 -0.04 0.00 0.00 33.50 33.08 1h2q n PRO 62 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1h2q s GLU 63 N -4.95 2.00 -0.23 0.54 2.02 -0.35 -4.93 118.70 112.79 1h2q s GLU 63 Ca 0.60 -1.88 0.01 0.00 0.02 0.00 0.00 54.97 53.72 1h2q s GLU 63 Cb -0.03 -1.82 0.06 0.00 0.10 0.00 0.00 34.13 32.44 1h2q s GLU 63 CO 0.40 0.08 -0.08 0.00 0.02 0.00 0.00 175.26 175.68 1h2q s ARG 65 N 1.34 3.02 -0.01 0.00 3.00 -0.76 -4.89 118.95 120.64 1h2q s ARG 65 Ca -0.05 -0.55 -0.30 0.00 0.00 0.00 0.00 55.73 54.83 1h2q s ARG 65 Cb -0.18 -2.82 -0.03 0.00 0.00 0.00 0.00 34.95 31.92 1h2q s ARG 65 CO -0.06 0.62 1.02 -2.00 0.00 0.00 0.00 175.30 174.87 1h2q s GLU 66 N -1.96 4.52 0.23 3.54 2.12 -1.26 0.35 118.70 126.24 1h2q s GLU 66 Ca 0.25 1.47 -0.30 0.00 0.36 0.00 0.00 54.97 56.75 1h2q s GLU 66 Cb -0.12 -3.46 -0.09 0.00 0.26 0.00 0.00 34.13 30.72 1h2q s GLU 66 CO 0.17 -0.12 1.04 0.42 -0.54 0.00 0.00 175.26 176.23 1h2q s ILE 67 N 1.19 3.83 0.16 -3.70 1.01 0.56 -4.88 121.20 119.37 1h2q s ILE 67 Ca 0.52 1.75 0.10 0.00 0.00 0.00 0.00 60.65 63.02 1h2q s ILE 67 Cb -0.22 -4.11 -0.04 0.00 0.01 0.00 0.00 42.46 38.10 1h2q s ILE 67 CO 0.27 0.38 -0.22 -0.31 0.00 0.00 0.00 174.94 175.05 1h2q s TYR 68 N -0.85 2.04 -0.10 3.97 2.02 -1.26 -4.49 117.35 118.69 1h2q s TYR 68 Ca 0.45 -0.41 -0.05 0.00 -0.37 0.00 0.00 57.07 56.69 1h2q s TYR 68 Cb -0.29 -1.05 -0.04 0.00 -0.40 0.00 0.00 41.96 40.19 1h2q s TYR 68 CO 0.36 0.37 0.12 0.00 -1.57 0.00 0.00 175.55 174.83 1h2q n PRO 70 N 1.85 -0.27 -1.51 0.00 -0.04 -1.25 -4.47 135.00 129.31 1h2q n PRO 70 Ca -0.18 -0.01 -0.45 0.00 -0.04 0.00 0.00 63.50 62.81 1h2q n PRO 70 Cb 0.54 -2.31 -0.02 0.00 -0.04 0.00 0.00 33.50 31.68 1h2q n PRO 70 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1h2q n ALA 71 N -3.90 -1.19 -1.42 0.55 0.00 -1.26 -4.90 120.51 108.40 1h2q n ALA 71 Ca 0.12 0.37 -0.34 0.00 0.00 0.00 0.00 53.44 53.59 1h2q n ALA 71 Cb 0.52 -1.86 0.07 0.00 0.00 0.00 0.00 19.45 18.18 1h2q n ALA 71 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1h2q s PRO 72 N -1.40 2.43 0.69 0.00 0.04 -1.26 -5.01 135.00 130.49 1h2q s PRO 72 Ca 0.61 1.59 -0.12 0.00 0.04 0.00 0.00 61.00 63.12 1h2q s PRO 72 Cb -0.75 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 31.91 1h2q s PRO 72 CO 0.59 -1.58 1.07 -1.25 0.04 0.00 0.00 177.00 175.87 1h2q s PRO 73 N -3.99 2.86 0.30 0.56 0.04 -1.26 -5.07 135.00 128.45 1h2q s PRO 73 Ca 0.71 1.07 0.07 0.00 0.04 0.00 0.00 61.00 62.89 1h2q s PRO 73 Cb -0.25 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 1h2q s PRO 73 CO 0.43 -1.16 0.29 -0.65 0.04 0.00 0.00 177.00 175.95 1h2q s GLN 74 N -4.77 2.89 0.17 4.56 -1.52 -1.26 -5.02 119.66 114.71 1h2q s GLN 74 Ca 0.60 -1.14 0.04 0.00 -1.95 0.00 0.00 55.36 52.91 1h2q s GLN 74 Cb -0.15 -2.58 -0.05 0.00 -0.22 0.00 0.00 33.01 30.01 1h2q s GLN 74 CO 0.51 0.21 -0.07 0.96 -0.25 0.00 0.00 175.29 176.65 1h2q s ILE 75 N -2.21 1.08 0.16 1.08 -4.36 -1.26 -5.06 121.20 110.63 1h2q s ILE 75 Ca 0.38 -2.04 -0.25 0.00 -0.26 0.00 0.00 60.65 58.48 1h2q s ILE 75 Cb -0.07 -2.00 -0.08 0.00 1.25 0.00 0.00 42.46 41.56 1h2q s ILE 75 CO 0.27 -0.61 0.76 -1.81 0.24 0.00 0.00 174.94 173.78 1h2q s ASP 76 N -3.20 7.36 -1.27 4.36 1.01 -1.26 -3.82 116.67 119.85 1h2q s ASP 76 Ca 0.20 1.61 -0.00 0.00 0.71 0.00 0.00 52.55 55.07 1h2q s ASP 76 Cb 0.04 -2.49 0.00 0.00 1.01 0.00 0.00 42.92 41.48 1h2q s ASP 76 CO 0.03 0.22 0.81 0.59 0.21 0.00 0.00 175.17 177.03 1h2q n ASN 77 N 1.61 -1.56 -3.63 0.27 3.02 -1.26 -4.49 115.26 109.22 1h2q n ASN 77 Ca -0.06 -0.75 -0.05 0.00 -0.03 0.00 0.00 54.58 53.69 1h2q n ASN 77 Cb 0.49 -4.44 -0.05 0.00 -0.61 0.00 0.00 39.78 35.17 1h2q n ASN 77 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1h2q s GLY 78 N -4.34 0.03 0.35 7.41 0.00 -1.25 -2.89 107.32 106.64 1h2q s GLY 78 Ca 0.02 2.76 0.04 0.00 0.00 0.00 0.00 44.72 47.53 1h2q s GLY 78 CO 0.78 1.35 0.07 -0.26 0.00 0.00 0.00 173.10 175.05 1h2q s ILE 79 N -0.68 1.03 -0.17 0.90 -4.36 -0.88 -4.34 121.20 112.71 1h2q s ILE 79 Ca 0.05 -2.00 -0.03 0.00 -0.26 0.00 0.00 60.65 58.41 1h2q s ILE 79 Cb -0.02 -2.65 -0.02 0.00 1.25 0.00 0.00 42.46 41.01 1h2q s ILE 79 CO -0.07 0.00 -0.04 -0.63 0.24 0.00 0.00 174.94 174.44 1h2q s ILE 80 N -3.26 3.72 -0.01 8.37 1.01 -1.26 -2.03 121.20 127.74 1h2q s ILE 80 Ca 0.32 -0.41 -0.30 0.00 0.00 0.00 0.00 60.65 60.26 1h2q s ILE 80 Cb 0.07 -2.64 -0.03 0.00 0.01 0.00 0.00 42.46 39.87 1h2q s ILE 80 CO 0.15 0.47 1.04 -1.10 0.00 0.00 0.00 174.94 175.51 1h2q s GLN 81 N 0.63 4.50 -0.89 2.79 -0.21 -0.86 -4.27 119.66 121.34 1h2q s GLN 81 Ca -0.03 1.50 -0.06 0.00 0.02 0.00 0.00 55.36 56.79 1h2q s GLN 81 Cb -0.15 -3.46 0.01 0.00 1.00 0.00 0.00 33.01 30.41 1h2q s GLN 81 CO 0.02 -0.17 0.63 0.41 -2.12 0.00 0.00 175.29 174.07 1h2q n GLY 82 N 3.03 -1.22 3.68 3.09 0.00 -1.26 -4.70 105.19 107.81 1h2q n GLY 82 Ca 0.07 0.55 -0.43 0.00 0.00 0.00 0.00 46.02 46.21 1h2q n GLY 82 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1h2q s GLU 83 N -5.21 4.30 0.83 1.61 2.12 -1.26 -5.04 118.70 116.06 1h2q s GLU 83 Ca 0.10 1.64 -0.09 0.00 0.36 0.00 0.00 54.97 56.98 1h2q s GLU 83 Cb -0.05 -3.64 0.18 0.00 0.26 0.00 0.00 34.13 30.88 1h2q s GLU 83 CO 0.89 -0.56 1.14 0.54 -0.54 0.00 0.00 175.26 176.73 1h2q n ARG 84 N 5.81 -0.77 -0.01 4.30 3.00 -1.26 -5.04 116.66 122.69 1h2q n ARG 84 Ca 0.12 -2.21 -0.18 0.00 -0.01 0.00 0.00 57.85 55.57 1h2q n ARG 84 Cb 0.46 -1.03 -0.14 0.00 0.00 0.00 0.00 32.46 31.75 1h2q n ARG 84 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 1h2q h ASP 85 N -1.22 0.25 -2.18 0.55 3.32 -2.04 -3.48 116.42 111.61 1h2q h ASP 85 Ca -0.37 -0.93 -0.60 0.00 0.02 0.00 0.00 57.03 55.15 1h2q h ASP 85 Cb 1.14 -0.08 -0.14 0.00 0.22 0.00 0.00 39.33 40.47 1h2q h ASP 85 CO 0.31 1.27 -0.70 -1.00 -1.72 0.00 0.00 179.24 177.39 1h2q s HIS 86 N -2.35 2.29 -0.07 4.55 3.76 -1.26 -4.96 115.29 117.26 1h2q s HIS 86 Ca -0.17 -0.48 -0.03 0.00 -0.15 0.00 0.00 55.06 54.23 1h2q s HIS 86 Cb -0.00 -1.22 0.04 0.00 1.11 0.00 0.00 32.58 32.50 1h2q s HIS 86 CO 0.75 0.57 0.06 0.71 -0.85 0.00 0.00 174.74 175.99 1h2q s TYR 87 N -2.65 0.10 0.00 1.40 1.51 -1.26 -5.06 117.35 111.39 1h2q s TYR 87 Ca 0.31 0.14 0.00 0.00 -1.01 0.00 0.00 57.07 56.51 1h2q s TYR 87 Cb 0.01 -0.53 0.00 0.00 -0.11 0.00 0.00 41.96 41.33 1h2q s TYR 87 CO 0.15 -0.25 0.00 0.41 -1.11 0.00 0.00 175.55 174.75 1h2q n GLY 88 N 5.29 2.39 3.66 0.71 0.00 -1.26 -1.31 105.19 114.67 1h2q n GLY 88 Ca -0.04 -2.14 -0.43 0.00 0.00 0.00 0.00 46.02 43.41 1h2q n GLY 88 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1h2q n TYR 89 N -0.78 1.90 0.00 1.61 9.36 -1.26 -1.86 117.16 126.12 1h2q n TYR 89 Ca 0.00 0.60 0.00 0.00 3.32 0.00 0.00 57.90 61.82 1h2q n TYR 89 Cb 0.00 -2.35 0.00 0.00 -0.63 0.00 0.00 39.34 36.36 1h2q n TYR 89 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1h2q n ARG 90 N 0.57 0.00 -1.79 2.98 5.12 -0.83 -4.95 116.66 117.76 1h2q n ARG 90 Ca 0.07 0.00 -0.38 0.00 -1.93 0.00 0.00 57.85 55.61 1h2q n ARG 90 Cb 0.35 -2.91 0.05 0.00 -1.16 0.00 0.00 32.46 28.79 1h2q n ARG 90 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1h2q s GLN 91 N 0.00 2.88 0.09 5.56 -0.21 -0.78 -4.65 119.66 122.55 1h2q s GLN 91 Ca 0.00 2.13 0.04 0.00 0.02 0.00 0.00 55.36 57.55 1h2q s GLN 91 Cb 0.00 -2.06 -0.03 0.00 1.00 0.00 0.00 33.01 31.92 1h2q s GLN 91 CO 0.00 -1.36 -0.11 -1.54 -2.12 0.00 0.00 175.29 170.16 1h2q s SER 92 N -1.19 1.51 -0.03 5.90 1.04 -1.26 -0.21 113.70 119.46 1h2q s SER 92 Ca 0.77 -0.75 0.08 0.00 0.48 0.00 0.00 55.95 56.53 1h2q s SER 92 Cb -0.38 -0.01 -0.02 0.00 0.10 0.00 0.00 66.02 65.71 1h2q s SER 92 CO 0.43 -0.20 -0.26 0.68 0.98 0.00 0.00 173.24 174.87 1h2q s VAL 93 N -2.06 2.05 -0.11 5.02 -7.23 -0.49 -5.01 120.40 112.57 1h2q s VAL 93 Ca 0.03 -1.10 0.03 0.00 -1.81 0.00 0.00 61.98 59.13 1h2q s VAL 93 Cb -0.05 -1.71 0.01 0.00 0.56 0.00 0.00 36.38 35.19 1h2q s VAL 93 CO 0.01 0.58 -0.21 -0.89 -0.31 0.00 0.00 175.10 174.28 1h2q s THR 94 N -0.53 1.91 0.19 5.32 2.01 -1.26 -1.59 115.64 121.69 1h2q s THR 94 Ca 0.07 -0.91 0.01 0.00 0.31 0.00 0.00 61.69 61.18 1h2q s THR 94 Cb -0.11 -1.68 -0.04 0.00 0.01 0.00 0.00 72.50 70.69 1h2q s THR 94 CO -0.00 0.52 0.34 -0.31 -0.69 0.00 0.00 174.62 174.49 1h2q s TYR 95 N 0.61 3.48 -0.11 4.92 1.51 -0.56 -2.03 117.35 125.18 1h2q s TYR 95 Ca -0.13 0.20 -0.06 0.00 -1.01 0.00 0.00 57.07 56.08 1h2q s TYR 95 Cb -0.17 -1.74 0.05 0.00 -0.11 0.00 0.00 41.96 39.99 1h2q s TYR 95 CO 0.03 0.44 0.26 0.00 -1.11 0.00 0.00 175.55 175.17 1h2q s ALA 96 N -1.84 -0.60 0.67 3.71 0.00 -0.86 -4.85 121.76 117.99 1h2q s ALA 96 Ca 0.36 1.04 -0.14 0.00 0.00 0.00 0.00 51.96 53.22 1h2q s ALA 96 Cb -0.11 -0.67 0.00 0.00 0.00 0.00 0.00 23.12 22.34 1h2q s ALA 96 CO 0.29 -0.22 1.09 0.00 0.00 0.00 0.00 175.76 176.92 1h2q s ASN 98 N -2.86 5.64 -0.51 0.00 0.01 -1.14 -4.87 114.94 111.22 1h2q s ASN 98 Ca 0.65 1.11 -0.33 0.00 -0.71 0.00 0.00 52.86 53.57 1h2q s ASN 98 Cb -0.18 -2.00 -0.13 0.00 0.41 0.00 0.00 41.25 39.34 1h2q s ASN 98 CO 0.44 -1.18 2.33 1.17 -1.51 0.00 0.00 177.10 178.34 1h2q n LYS 99 N -2.87 0.79 0.00 -0.60 4.81 -1.26 -0.09 118.16 118.94 1h2q n LYS 99 Ca 0.06 0.16 0.00 0.00 -0.87 0.00 0.00 58.31 57.66 1h2q n LYS 99 Cb 0.57 -2.39 0.00 0.00 0.02 0.00 0.00 35.03 33.22 1h2q n LYS 99 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1h2q n GLY 100 N 6.51 1.09 3.64 3.14 0.00 -1.26 -5.11 105.19 113.20 1h2q n GLY 100 Ca 0.46 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.23 1h2q n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1h2q s PHE 101 N -2.00 2.75 -0.10 1.61 0.40 0.87 -4.63 117.98 116.89 1h2q s PHE 101 Ca 0.00 -0.18 0.03 0.00 -0.60 0.00 0.00 56.93 56.17 1h2q s PHE 101 Cb 0.00 -1.30 0.01 0.00 0.51 0.00 0.00 43.02 42.24 1h2q s PHE 101 CO 0.00 0.55 -0.18 0.95 0.70 0.00 0.00 175.22 177.24 1h2q s THR 102 N -1.93 1.67 -0.03 0.64 -4.23 0.27 -4.64 115.64 107.39 1h2q s THR 102 Ca 0.28 -0.78 -0.30 0.00 -1.18 0.00 0.00 61.69 59.72 1h2q s THR 102 Cb -0.08 -1.48 -0.04 0.00 1.34 0.00 0.00 72.50 72.24 1h2q s THR 102 CO 0.18 0.47 1.24 -0.32 -0.54 0.00 0.00 174.62 175.66 1h2q s MET 103 N 0.62 4.35 0.01 3.99 1.75 -1.26 -1.12 119.30 127.63 1h2q s MET 103 Ca -0.14 1.75 0.05 0.00 -1.25 0.00 0.00 55.69 56.10 1h2q s MET 103 Cb -0.16 -3.53 -0.03 0.00 2.84 0.00 0.00 34.83 33.95 1h2q s MET 103 CO 0.04 -0.45 -0.12 0.42 -0.65 0.00 0.00 175.02 174.27 1h2q s ILE 104 N 2.08 3.24 0.00 10.11 -1.09 0.30 -4.96 121.20 130.88 1h2q s ILE 104 Ca 0.58 -0.92 0.00 0.00 -2.23 0.00 0.00 60.65 58.08 1h2q s ILE 104 Cb -0.27 -2.37 0.00 0.00 -1.58 0.00 0.00 42.46 38.24 1h2q s ILE 104 CO 0.24 0.40 0.00 0.61 -1.23 0.00 0.00 174.94 174.97 1h2q n GLY 105 N 1.67 -1.77 3.80 6.18 0.00 -1.26 0.32 105.19 114.12 1h2q n GLY 105 Ca -0.16 -1.92 -0.39 0.00 0.00 0.00 0.00 46.02 43.56 1h2q n GLY 105 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h2q s GLU 106 N 0.00 4.25 0.40 1.61 2.02 -1.26 -4.91 118.70 120.81 1h2q s GLU 106 Ca 0.00 0.77 0.14 0.00 0.02 0.00 0.00 54.97 55.91 1h2q s GLU 106 Cb 0.00 -3.26 1.00 0.00 0.10 0.00 0.00 34.13 31.97 1h2q s GLU 106 CO 0.00 0.59 1.89 1.25 0.02 0.00 0.00 175.26 179.00 1h2q h HIS 107 N 4.71 0.59 -2.69 1.61 -0.00 -1.93 -3.35 115.15 114.11 1h2q h HIS 107 Ca -0.49 0.02 -0.11 0.00 -0.00 0.00 0.00 60.37 59.79 1h2q h HIS 107 Cb 1.21 -0.19 -0.23 0.00 -0.00 0.00 0.00 27.41 28.21 1h2q h HIS 107 CO 0.67 0.20 -0.18 -1.54 -0.00 0.00 0.00 177.93 177.08 1h2q s SER 108 N -5.81 -0.42 0.06 3.26 1.04 -1.26 -1.50 113.70 109.07 1h2q s SER 108 Ca -0.09 0.72 0.03 0.00 0.48 0.00 0.00 55.95 57.10 1h2q s SER 108 Cb 0.22 0.76 -0.04 0.00 0.10 0.00 0.00 66.02 67.06 1h2q s SER 108 CO 0.78 -0.25 0.04 0.27 0.98 0.00 0.00 173.24 175.06 1h2q s ILE 109 N -0.19 4.31 -0.04 -1.02 -0.00 -0.62 -4.95 121.20 118.70 1h2q s ILE 109 Ca -0.04 -0.77 0.03 0.00 -0.00 0.00 0.00 60.65 59.87 1h2q s ILE 109 Cb -0.03 -3.03 -0.03 0.00 -0.00 0.00 0.00 42.46 39.37 1h2q s ILE 109 CO 0.02 0.19 -0.12 -0.31 -0.00 0.00 0.00 174.94 174.73 1h2q s TYR 110 N -1.28 2.78 0.01 1.37 2.02 -1.26 -1.39 117.35 119.59 1h2q s TYR 110 Ca 0.26 -0.10 -0.30 0.00 -0.37 0.00 0.00 57.07 56.55 1h2q s TYR 110 Cb -0.12 -1.64 -0.05 0.00 -0.40 0.00 0.00 41.96 39.76 1h2q s TYR 110 CO 0.18 0.25 1.26 0.00 -1.57 0.00 0.00 175.55 175.67 1h2q s THR 112 N 1.75 1.33 -0.27 0.00 -4.23 -0.16 -1.97 115.64 112.09 1h2q s THR 112 Ca 0.59 -1.90 0.01 0.00 -1.18 0.00 0.00 61.69 59.22 1h2q s THR 112 Cb -0.29 -2.22 0.07 0.00 1.34 0.00 0.00 72.50 71.40 1h2q s THR 112 CO 0.26 0.00 -0.01 0.68 -0.54 0.00 0.00 174.62 175.01 1h2q s VAL 113 N -2.84 1.58 -0.20 2.29 -7.23 -1.26 -2.34 120.40 110.40 1h2q s VAL 113 Ca 0.13 -1.47 0.01 0.00 -1.81 0.00 0.00 61.98 58.85 1h2q s VAL 113 Cb 0.01 -1.95 0.03 0.00 0.56 0.00 0.00 36.38 35.03 1h2q s VAL 113 CO 0.08 -0.28 -0.17 0.20 -0.31 0.00 0.00 175.10 174.61 1h2q s ASN 114 N 1.33 3.43 -1.28 4.85 0.02 0.16 -4.75 114.94 118.69 1h2q s ASN 114 Ca -0.00 -0.83 -0.04 0.00 -1.02 0.00 0.00 52.86 50.97 1h2q s ASN 114 Cb -0.19 -1.48 -0.01 0.00 0.02 0.00 0.00 41.25 39.60 1h2q s ASN 114 CO -0.09 -0.05 0.68 -0.46 0.02 0.00 0.00 177.10 177.19 1h2q n ASN 115 N 4.58 -1.97 -4.00 -1.22 0.23 -1.26 -1.43 115.26 110.19 1h2q n ASN 115 Ca -0.19 -0.88 -0.31 0.00 -0.53 0.00 0.00 54.58 52.67 1h2q n ASN 115 Cb 0.48 -3.84 0.01 0.00 -2.08 0.00 0.00 39.78 34.35 1h2q n ASN 115 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1h2q n ASP 116 N -2.99 -3.92 -3.62 0.53 10.43 -1.26 -4.96 116.55 110.76 1h2q n ASP 116 Ca -0.26 -0.87 -0.15 0.00 2.57 0.00 0.00 54.79 56.09 1h2q n ASP 116 Cb 0.66 -3.50 -0.13 0.00 1.84 0.00 0.00 41.12 39.99 1h2q n ASP 116 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 1h2q s GLU 117 N -6.68 0.15 -0.30 -1.24 2.02 -0.52 -5.01 118.70 107.12 1h2q s GLU 117 Ca 0.62 0.60 -0.29 0.00 0.02 0.00 0.00 54.97 55.92 1h2q s GLU 117 Cb -0.32 -0.34 -0.01 0.00 0.10 0.00 0.00 34.13 33.56 1h2q s GLU 117 CO 0.86 -0.38 1.52 0.20 0.02 0.00 0.00 175.26 177.48 1h2q s GLY 118 N 2.39 1.18 0.07 -1.39 0.00 -1.19 -0.67 107.32 107.71 1h2q s GLY 118 Ca 0.03 0.21 0.09 0.00 0.00 0.00 0.00 44.72 45.05 1h2q s GLY 118 CO -0.09 2.88 -0.23 -0.54 0.00 0.00 0.00 173.10 175.12 1h2q s GLU 119 N 4.73 1.42 0.54 2.90 0.41 -0.99 -3.84 118.70 123.87 1h2q s GLU 119 Ca 0.66 -1.10 -0.19 0.00 -0.41 0.00 0.00 54.97 53.93 1h2q s GLU 119 Cb -0.20 -1.65 -0.06 0.00 -1.78 0.00 0.00 34.13 30.44 1h2q s GLU 119 CO 0.29 0.41 1.12 -1.58 -0.49 0.00 0.00 175.26 175.01 1h2q s TRP 120 N -0.93 2.71 0.13 1.61 0.52 -1.26 -0.98 118.94 120.74 1h2q s TRP 120 Ca 0.09 1.55 -0.31 0.00 0.02 0.00 0.00 56.10 57.45 1h2q s TRP 120 Cb -0.10 -3.26 -0.08 0.00 -1.15 0.00 0.00 33.47 28.89 1h2q s TRP 120 CO 0.03 -1.49 1.57 0.66 0.02 0.00 0.00 176.95 177.74 1h2q h SER 121 N 1.23 -1.54 -0.87 2.95 4.64 0.07 -3.45 113.55 116.58 1h2q h SER 121 Ca -0.50 0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1h2q h SER 121 Cb 1.26 0.62 0.00 0.00 -0.31 0.00 0.00 62.40 63.97 1h2q h SER 121 CO 0.57 -0.44 0.00 0.61 -0.87 0.00 0.00 176.83 176.70 1h2q n GLY 122 N -1.43 3.73 3.81 -0.77 0.00 -1.26 -5.01 105.19 104.27 1h2q n GLY 122 Ca -0.04 -1.29 -0.35 0.00 0.00 0.00 0.00 46.02 44.33 1h2q n GLY 122 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h2q s PRO 123 N -0.62 4.28 0.82 1.61 0.04 -1.26 -4.99 135.00 134.87 1h2q s PRO 123 Ca 0.00 0.97 -0.14 0.00 0.04 0.00 0.00 61.00 61.87 1h2q s PRO 123 Cb 0.00 -2.69 0.05 0.00 0.04 0.00 0.00 34.50 31.90 1h2q s PRO 123 CO 0.00 0.27 0.88 -0.35 0.04 0.00 0.00 177.00 177.84 1h2q n PRO 124 N 0.31 0.10 -1.26 0.56 -0.04 -1.26 -4.82 135.00 128.59 1h2q n PRO 124 Ca 0.01 0.10 -0.30 0.00 -0.04 0.00 0.00 63.50 63.27 1h2q n PRO 124 Cb 0.52 -2.17 0.22 0.00 -0.04 0.00 0.00 33.50 32.02 1h2q n PRO 124 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1h2q s PRO 125 N -3.70 -0.55 0.03 0.54 0.04 -1.26 -4.88 135.00 125.21 1h2q s PRO 125 Ca 0.68 -0.02 0.07 0.00 0.04 0.00 0.00 61.00 61.77 1h2q s PRO 125 Cb -0.29 -1.67 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 1h2q s PRO 125 CO 0.56 -3.28 -0.21 -2.00 0.04 0.00 0.00 177.00 172.12 1h2q s GLU 126 N -5.42 1.47 -0.13 4.56 2.12 0.15 -4.96 118.70 116.49 1h2q s GLU 126 Ca 0.70 -0.87 -0.02 0.00 0.36 0.00 0.00 54.97 55.13 1h2q s GLU 126 Cb -0.10 -1.53 -0.03 0.00 0.26 0.00 0.00 34.13 32.73 1h2q s GLU 126 CO 0.56 0.40 -0.05 0.00 -0.54 0.00 0.00 175.26 175.62 1h2q s ARG 128 N 0.09 1.76 0.00 0.00 3.52 -0.28 -4.88 118.95 119.17 1h2q s ARG 128 Ca -0.01 -1.93 0.22 0.00 -0.13 0.00 0.00 55.73 53.87 1h2q s ARG 128 Cb -0.14 -1.47 0.17 0.00 -1.56 0.00 0.00 34.95 31.95 1h2q s ARG 128 CO 0.03 0.05 1.19 0.41 -0.81 0.00 0.00 175.30 176.16