#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h2p s SER 6 N 0.00 0.94 1.02 -5.58 0.15 -1.26 -1.96 113.70 107.01 1h2p s SER 6 Ca 0.00 0.18 -0.12 0.00 0.70 0.00 0.00 55.95 56.71 1h2p s SER 6 Cb 0.00 0.03 0.20 0.00 -1.71 0.00 0.00 66.02 64.54 1h2p s SER 6 CO 0.00 -0.24 1.09 0.00 1.20 0.00 0.00 173.24 175.28 1h2p s PRO 8 N -4.93 4.30 0.11 0.00 0.02 -1.26 -4.93 135.00 128.32 1h2p s PRO 8 Ca 0.66 1.45 -0.36 0.00 0.02 0.00 0.00 61.00 62.77 1h2p s PRO 8 Cb -0.19 -2.62 -0.16 0.00 0.02 0.00 0.00 34.50 31.55 1h2p s PRO 8 CO 0.58 -0.00 1.34 -1.71 -0.33 0.00 0.00 177.00 176.88 1h2p n ASN 9 N 0.12 1.80 -0.35 2.53 5.15 -1.26 -4.82 115.26 118.44 1h2p n ASN 9 Ca 0.04 1.12 -0.11 0.00 -0.60 0.00 0.00 54.58 55.03 1h2p n ASN 9 Cb 0.50 -1.23 -0.10 0.00 -0.53 0.00 0.00 39.78 38.42 1h2p n ASN 9 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1h2p h PRO 10 N 4.53 -0.07 0.00 1.20 0.11 -1.99 -3.49 132.00 132.29 1h2p h PRO 10 Ca -0.47 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1h2p h PRO 10 Cb 1.33 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.45 1h2p h PRO 10 CO 0.78 -0.05 0.00 0.41 -0.21 0.00 0.00 178.00 178.93 1h2p n GLY 11 N -1.26 0.27 3.54 -0.55 0.00 -1.26 -4.98 105.19 100.95 1h2p n GLY 11 Ca 0.01 -2.30 -0.32 0.00 0.00 0.00 0.00 46.02 43.41 1h2p n GLY 11 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1h2p s GLN 12 N -0.39 2.39 -0.29 1.61 0.74 -1.26 -4.92 119.66 117.55 1h2p s GLN 12 Ca 0.00 -0.80 -0.07 0.00 0.05 0.00 0.00 55.36 54.54 1h2p s GLN 12 Cb 0.00 -2.39 0.01 0.00 1.10 0.00 0.00 33.01 31.73 1h2p s GLN 12 CO 0.00 0.58 0.08 0.42 -0.55 0.00 0.00 175.29 175.82 1h2p s ILE 13 N -0.95 3.96 -0.02 -2.34 1.01 -1.26 -5.05 121.20 116.55 1h2p s ILE 13 Ca 0.16 -0.67 -0.30 0.00 0.00 0.00 0.00 60.65 59.84 1h2p s ILE 13 Cb -0.11 -3.03 -0.06 0.00 0.01 0.00 0.00 42.46 39.27 1h2p s ILE 13 CO 0.06 0.10 1.69 0.00 0.00 0.00 0.00 174.94 176.79 1h2p s ARG 14 N 1.50 4.18 -0.97 2.79 1.04 -1.26 -1.03 118.95 125.20 1h2p s ARG 14 Ca 0.03 2.27 0.00 0.00 -1.04 0.00 0.00 55.73 56.98 1h2p s ARG 14 Cb -0.17 -3.93 0.00 0.00 -2.04 0.00 0.00 34.95 28.81 1h2p s ARG 14 CO 0.02 -0.83 0.00 0.09 -0.04 0.00 0.00 175.30 174.54 1h2p n ASN 15 N 6.88 -3.72 -3.42 -2.89 5.03 -1.26 -4.30 115.26 111.59 1h2p n ASN 15 Ca 0.17 0.06 -0.19 0.00 0.87 0.00 0.00 54.58 55.50 1h2p n ASN 15 Cb 0.42 -2.74 -0.08 0.00 -1.02 0.00 0.00 39.78 36.36 1h2p n ASN 15 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1h2p s GLY 16 N -2.62 2.22 -0.01 7.41 0.00 -0.20 -0.81 107.32 113.32 1h2p s GLY 16 Ca 0.00 -2.02 0.02 0.00 0.00 0.00 0.00 44.72 42.72 1h2p s GLY 16 CO 0.00 -1.44 -0.06 1.62 0.00 0.00 0.00 173.10 173.22 1h2p s GLN 17 N -3.49 0.53 -0.19 2.90 2.00 -0.58 -4.59 119.66 116.23 1h2p s GLN 17 Ca 0.40 -0.21 -0.02 0.00 -2.00 0.00 0.00 55.36 53.53 1h2p s GLN 17 Cb 0.03 -0.51 -0.00 0.00 0.80 0.00 0.00 33.01 33.32 1h2p s GLN 17 CO 0.26 0.12 -0.10 0.42 -0.50 0.00 0.00 175.29 175.49 1h2p s ILE 18 N -0.08 2.98 -0.13 -2.34 1.01 -1.26 -2.15 121.20 119.23 1h2p s ILE 18 Ca 0.01 -0.64 -0.05 0.00 0.00 0.00 0.00 60.65 59.98 1h2p s ILE 18 Cb -0.03 -2.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 1h2p s ILE 18 CO -0.00 0.47 0.04 -1.81 0.00 0.00 0.00 174.94 173.63 1h2p s ASP 19 N 1.25 5.49 -0.61 3.58 1.01 -0.52 -4.95 116.67 121.91 1h2p s ASP 19 Ca 0.03 0.15 0.04 0.00 0.71 0.00 0.00 52.55 53.48 1h2p s ASP 19 Cb -0.14 -1.75 0.15 0.00 1.01 0.00 0.00 42.92 42.19 1h2p s ASP 19 CO -0.04 0.30 0.38 -0.69 0.21 0.00 0.00 175.17 175.32 1h2p s VAL 20 N -0.39 2.69 -1.51 -1.27 1.01 -1.26 -1.26 120.40 118.41 1h2p s VAL 20 Ca 0.08 -3.78 0.00 0.00 0.00 0.00 0.00 61.98 58.28 1h2p s VAL 20 Cb -0.12 -2.82 0.00 0.00 0.00 0.00 0.00 36.38 33.44 1h2p s VAL 20 CO 0.02 -0.91 0.21 -0.81 0.00 0.00 0.00 175.10 173.61 1h2p n PRO 21 N 2.54 0.00 0.00 2.72 -0.04 -1.26 -4.10 135.00 134.86 1h2p n PRO 21 Ca 0.13 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1h2p n PRO 21 Cb 0.34 -1.28 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 1h2p n PRO 21 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1h2p n GLY 22 N -0.66 -1.79 0.16 0.55 0.00 -1.26 -5.11 105.19 97.08 1h2p n GLY 22 Ca 0.00 0.69 0.02 0.00 0.00 0.00 0.00 46.02 46.74 1h2p n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h2p n GLY 23 N 0.00 -1.54 0.17 -0.02 0.00 -1.26 -4.80 105.19 97.74 1h2p n GLY 23 Ca 0.00 -1.48 0.03 0.00 0.00 0.00 0.00 46.02 44.57 1h2p n GLY 23 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1h2p n ILE 24 N -1.77 0.84 -1.59 -0.61 -0.00 -1.26 -4.69 119.36 110.29 1h2p n ILE 24 Ca -0.00 -0.98 -0.29 0.00 -0.00 0.00 0.00 62.75 61.48 1h2p n ILE 24 Cb 0.07 0.33 0.16 0.00 -0.00 0.00 0.00 39.64 40.20 1h2p n ILE 24 CO 0.00 0.00 0.00 -0.76 -0.00 0.00 0.00 176.55 175.79 1h2p s LEU 25 N -1.19 2.02 -0.18 7.28 1.43 -1.26 -2.12 118.68 124.66 1h2p s LEU 25 Ca 0.11 0.75 -0.39 0.00 -1.03 0.00 0.00 54.13 53.56 1h2p s LEU 25 Cb 0.10 -2.94 -0.16 0.00 0.03 0.00 0.00 46.19 43.21 1h2p s LEU 25 CO 0.01 -2.75 1.62 0.33 0.23 0.00 0.00 176.35 175.79 1h2p n PHE 26 N -3.87 1.88 0.00 0.29 7.35 -0.83 -1.63 117.46 120.65 1h2p n PHE 26 Ca 0.09 0.59 0.00 0.00 -0.76 0.00 0.00 57.45 57.38 1h2p n PHE 26 Cb 0.59 -2.41 0.00 0.00 0.35 0.00 0.00 39.48 38.01 1h2p n PHE 26 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1h2p n GLY 27 N 3.70 2.21 3.79 7.13 0.00 -0.66 -5.04 105.19 116.32 1h2p n GLY 27 Ca 0.24 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.93 1h2p n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h2p s ALA 28 N -2.14 2.62 -0.10 4.61 0.00 -0.65 -4.74 121.76 121.36 1h2p s ALA 28 Ca 0.00 0.49 -0.00 0.00 0.00 0.00 0.00 51.96 52.44 1h2p s ALA 28 Cb 0.00 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.87 1h2p s ALA 28 CO 0.00 -1.01 -0.06 0.99 0.00 0.00 0.00 175.76 175.67 1h2p s THR 29 N -2.36 0.87 0.02 0.00 2.01 -1.26 -0.58 115.64 114.34 1h2p s THR 29 Ca 0.66 -0.20 0.01 0.00 0.31 0.00 0.00 61.69 62.47 1h2p s THR 29 Cb -0.18 -0.92 -0.04 0.00 0.01 0.00 0.00 72.50 71.37 1h2p s THR 29 CO 0.38 0.34 0.04 0.27 -0.69 0.00 0.00 174.62 174.96 1h2p s ILE 30 N 1.68 4.39 0.09 1.82 -0.00 -0.63 -4.34 121.20 124.22 1h2p s ILE 30 Ca 0.03 -0.60 0.03 0.00 -0.00 0.00 0.00 60.65 60.12 1h2p s ILE 30 Cb -0.13 -3.01 -0.04 0.00 -0.00 0.00 0.00 42.46 39.28 1h2p s ILE 30 CO -0.07 0.31 0.10 -0.44 -0.00 0.00 0.00 174.94 174.84 1h2p s SER 31 N -1.81 5.59 0.03 4.36 0.01 -0.39 -1.39 113.70 120.09 1h2p s SER 31 Ca 0.23 -0.01 0.07 0.00 1.31 0.00 0.00 55.95 57.55 1h2p s SER 31 Cb -0.12 -1.51 -0.03 0.00 0.21 0.00 0.00 66.02 64.57 1h2p s SER 31 CO 0.14 0.15 -0.19 -0.36 0.41 0.00 0.00 173.24 173.40 1h2p s PHE 32 N -1.46 2.55 0.21 2.43 0.08 -0.21 -1.44 117.98 120.14 1h2p s PHE 32 Ca 0.30 -0.26 -0.14 0.00 0.12 0.00 0.00 56.93 56.94 1h2p s PHE 32 Cb -0.12 -1.48 0.01 0.00 -0.57 0.00 0.00 43.02 40.86 1h2p s PHE 32 CO 0.23 0.22 0.46 -1.54 -0.10 0.00 0.00 175.22 174.48 1h2p s SER 33 N -1.29 -0.13 0.02 1.36 1.04 -0.91 -4.82 113.70 108.96 1h2p s SER 33 Ca 0.14 -0.73 0.07 0.00 0.48 0.00 0.00 55.95 55.91 1h2p s SER 33 Cb -0.10 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.55 1h2p s SER 33 CO 0.04 -1.05 -0.20 0.00 0.98 0.00 0.00 173.24 173.01 1h2p n ASN 35 N 2.21 -1.50 -4.77 0.00 5.03 0.01 -4.80 115.26 111.45 1h2p n ASN 35 Ca -0.16 -0.03 -0.41 0.00 0.87 0.00 0.00 54.58 54.85 1h2p n ASN 35 Cb 0.53 -1.25 -0.01 0.00 -1.02 0.00 0.00 39.78 38.03 1h2p n ASN 35 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1h2p s THR 36 N -2.42 2.31 0.00 3.41 2.01 -1.26 -2.54 115.64 117.15 1h2p s THR 36 Ca 0.66 0.29 0.00 0.00 0.31 0.00 0.00 61.69 62.95 1h2p s THR 36 Cb -0.23 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 69.10 1h2p s THR 36 CO 0.64 0.06 0.00 0.61 -0.69 0.00 0.00 174.62 175.24 1h2p n GLY 37 N 1.17 0.77 3.31 4.40 0.00 -1.26 -5.00 105.19 108.58 1h2p n GLY 37 Ca 0.03 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.36 1h2p n GLY 37 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1h2p s TYR 38 N -2.00 -0.53 0.16 1.61 1.51 -1.05 -1.58 117.35 115.46 1h2p s TYR 38 Ca 0.00 1.22 0.07 0.00 -1.01 0.00 0.00 57.07 57.35 1h2p s TYR 38 Cb 0.00 0.21 -0.04 0.00 -0.11 0.00 0.00 41.96 42.02 1h2p s TYR 38 CO 0.00 -0.28 0.00 -1.59 -1.11 0.00 0.00 175.55 172.58 1h2p s LYS 39 N 0.73 2.45 0.25 -0.62 -2.85 -1.05 -4.62 119.74 114.01 1h2p s LYS 39 Ca -0.04 -1.04 -0.11 0.00 -1.00 0.00 0.00 55.97 53.78 1h2p s LYS 39 Cb -0.05 -2.40 -0.08 0.00 -2.06 0.00 0.00 37.83 33.24 1h2p s LYS 39 CO -0.05 0.47 0.59 -1.17 0.10 0.00 0.00 175.35 175.29 1h2p s LEU 40 N -2.81 4.15 -0.22 2.77 2.96 -1.26 -1.88 118.68 122.39 1h2p s LEU 40 Ca 0.27 1.01 -0.04 0.00 -0.22 0.00 0.00 54.13 55.15 1h2p s LEU 40 Cb -0.10 -3.75 0.09 0.00 0.50 0.00 0.00 46.19 42.93 1h2p s LEU 40 CO 0.19 -0.09 0.16 -0.36 -1.32 0.00 0.00 176.35 174.93 1h2p s PHE 41 N -1.83 -0.01 -4.01 5.38 0.40 -0.43 -4.97 117.98 112.51 1h2p s PHE 41 Ca 0.48 -0.25 0.00 0.00 -0.60 0.00 0.00 56.93 56.57 1h2p s PHE 41 Cb -0.11 -0.60 0.00 0.00 0.51 0.00 0.00 43.02 42.81 1h2p s PHE 41 CO 0.20 -0.66 0.00 0.41 0.70 0.00 0.00 175.22 175.88 1h2p n GLY 42 N 5.29 0.72 3.76 4.36 0.00 -1.26 -1.82 105.19 116.23 1h2p n GLY 42 Ca -0.06 -1.77 -0.38 0.00 0.00 0.00 0.00 46.02 43.81 1h2p n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1h2p s SER 43 N -4.00 5.64 -0.01 1.61 0.01 -1.26 -4.90 113.70 110.79 1h2p s SER 43 Ca 0.00 2.63 0.17 0.00 1.31 0.00 0.00 55.95 60.06 1h2p s SER 43 Cb 0.00 -2.63 -0.23 0.00 0.21 0.00 0.00 66.02 63.38 1h2p s SER 43 CO 0.00 -1.31 0.57 0.35 0.41 0.00 0.00 173.24 173.26 1h2p n THR 44 N -0.74 0.00 -3.79 1.44 -2.24 -1.26 -4.48 114.28 103.20 1h2p n THR 44 Ca 0.09 -0.24 -0.10 0.00 -2.27 0.00 0.00 64.05 61.53 1h2p n THR 44 Cb 0.46 0.57 -0.05 0.00 -2.10 0.00 0.00 70.33 69.21 1h2p n THR 44 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1h2p s SER 45 N -3.29 -0.13 -0.02 3.42 0.15 -1.26 -1.04 113.70 111.53 1h2p s SER 45 Ca 0.00 -0.58 -0.08 0.00 0.70 0.00 0.00 55.95 55.99 1h2p s SER 45 Cb 0.12 0.49 0.01 0.00 -1.71 0.00 0.00 66.02 64.94 1h2p s SER 45 CO 0.72 -0.94 0.18 -0.55 1.20 0.00 0.00 173.24 173.85 1h2p s SER 46 N -2.89 -0.06 -0.02 5.45 0.15 -0.49 -4.62 113.70 111.22 1h2p s SER 46 Ca 0.10 -0.01 0.06 0.00 0.70 0.00 0.00 55.95 56.80 1h2p s SER 46 Cb 0.01 0.27 -0.01 0.00 -1.71 0.00 0.00 66.02 64.58 1h2p s SER 46 CO -0.05 -0.31 -0.20 0.12 1.20 0.00 0.00 173.24 174.00 1h2p s PHE 47 N -1.02 1.86 -0.79 3.44 5.36 -1.26 -1.60 117.98 123.97 1h2p s PHE 47 Ca -0.11 -0.38 -0.23 0.00 -0.96 0.00 0.00 56.93 55.24 1h2p s PHE 47 Cb -0.06 -1.20 0.06 0.00 -0.34 0.00 0.00 43.02 41.48 1h2p s PHE 47 CO 0.02 -0.06 1.17 0.00 -1.46 0.00 0.00 175.22 174.89 1h2p n LEU 49 N 8.23 0.00 -3.24 0.00 -0.00 -0.28 -1.65 117.00 120.05 1h2p n LEU 49 Ca 0.09 -2.07 -0.26 0.00 -0.00 0.00 0.00 56.01 53.77 1h2p n LEU 49 Cb 0.48 -0.21 -0.06 0.00 -0.00 0.00 0.00 43.42 43.63 1h2p n LEU 49 CO 0.64 -0.60 0.05 0.00 -0.00 0.00 0.00 177.39 177.48 1h2p n ILE 50 N -1.78 2.20 -1.77 1.47 3.06 -1.25 -2.02 119.36 119.26 1h2p n ILE 50 Ca 0.07 -5.20 -0.41 0.00 -2.50 0.00 0.00 62.75 54.71 1h2p n ILE 50 Cb 0.48 -1.79 -0.01 0.00 0.54 0.00 0.00 39.64 38.86 1h2p n ILE 50 CO 0.00 0.00 0.00 -0.24 -2.50 0.00 0.00 176.55 173.81 1h2p n SER 51 N 0.54 3.86 0.00 9.51 2.88 -0.64 -4.18 113.62 125.58 1h2p n SER 51 Ca 0.29 1.20 0.00 0.00 -1.33 0.00 0.00 58.87 59.03 1h2p n SER 51 Cb 0.43 -1.62 0.00 0.00 -0.75 0.00 0.00 64.21 62.27 1h2p n SER 51 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1h2p n GLY 52 N 1.05 0.21 1.71 0.46 0.00 -1.26 -0.32 105.19 107.04 1h2p n GLY 52 Ca 0.04 0.69 -0.03 0.00 0.00 0.00 0.00 46.02 46.72 1h2p n GLY 52 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1h2p n SER 53 N 4.93 -0.59 -4.17 1.61 7.64 -1.26 -5.12 113.62 116.67 1h2p n SER 53 Ca 0.00 -2.06 -0.11 0.00 1.01 0.00 0.00 58.87 57.70 1h2p n SER 53 Cb 0.00 0.24 -0.10 0.00 -1.01 0.00 0.00 64.21 63.34 1h2p n SER 53 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1h2p s SER 54 N -1.45 1.20 -0.25 6.43 1.04 0.56 -5.13 113.70 116.10 1h2p s SER 54 Ca 0.10 -0.96 -0.07 0.00 0.48 0.00 0.00 55.95 55.50 1h2p s SER 54 Cb 0.21 0.07 -0.03 0.00 0.10 0.00 0.00 66.02 66.38 1h2p s SER 54 CO -0.07 -0.42 0.08 -0.69 0.98 0.00 0.00 173.24 173.12 1h2p s VAL 55 N -3.34 4.36 0.31 5.02 1.01 -1.26 -1.63 120.40 124.87 1h2p s VAL 55 Ca 0.10 -0.16 -0.18 0.00 0.00 0.00 0.00 61.98 61.75 1h2p s VAL 55 Cb 0.03 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.40 1h2p s VAL 55 CO -0.04 0.34 0.71 0.00 0.00 0.00 0.00 175.10 176.10 1h2p s GLN 56 N 1.62 1.90 0.56 2.72 -2.07 -0.85 -4.74 119.66 118.79 1h2p s GLN 56 Ca 0.06 -1.18 -0.17 0.00 -1.82 0.00 0.00 55.36 52.25 1h2p s GLN 56 Cb -0.15 0.59 -0.05 0.00 -1.09 0.00 0.00 33.01 32.31 1h2p s GLN 56 CO 0.04 -0.87 1.04 -1.58 -1.32 0.00 0.00 175.29 172.60 1h2p s TRP 57 N -3.42 3.06 0.03 9.60 0.52 -1.26 -1.13 118.94 126.34 1h2p s TRP 57 Ca 0.14 1.52 -0.08 0.00 0.02 0.00 0.00 56.10 57.70 1h2p s TRP 57 Cb -0.05 -2.99 -0.31 0.00 -1.15 0.00 0.00 33.47 28.98 1h2p s TRP 57 CO 0.09 -0.93 0.98 0.66 0.02 0.00 0.00 176.95 177.77 1h2p h SER 58 N 0.78 0.56 -4.23 2.95 4.64 -0.47 -3.45 113.55 114.32 1h2p h SER 58 Ca -0.47 -0.65 -0.49 0.00 -0.47 0.00 0.00 61.79 59.70 1h2p h SER 58 Cb 1.21 -0.18 -0.21 0.00 -0.31 0.00 0.00 62.40 62.91 1h2p h SER 58 CO 0.58 1.53 -0.80 -1.81 -0.87 0.00 0.00 176.83 175.46 1h2p s ASP 59 N -7.24 2.19 0.47 4.97 1.11 -1.26 -4.92 116.67 111.99 1h2p s ASP 59 Ca -0.08 -0.69 -0.18 0.00 0.18 0.00 0.00 52.55 51.78 1h2p s ASP 59 Cb 0.06 -0.10 -0.09 0.00 1.07 0.00 0.00 42.92 43.86 1h2p s ASP 59 CO 0.89 -0.02 0.96 -2.16 1.18 0.00 0.00 175.17 176.03 1h2p s PRO 60 N -1.99 4.06 0.58 8.23 0.04 -1.26 -4.83 135.00 139.82 1h2p s PRO 60 Ca 0.04 1.00 -0.20 0.00 0.04 0.00 0.00 61.00 61.88 1h2p s PRO 60 Cb -0.09 -2.17 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 1h2p s PRO 60 CO 0.04 -0.16 1.32 1.28 0.04 0.00 0.00 177.00 179.52 1h2p n LEU 61 N -1.17 5.61 0.00 -3.56 4.32 -1.26 -4.25 117.00 116.68 1h2p n LEU 61 Ca 0.07 0.93 -0.21 0.00 -0.02 0.00 0.00 56.01 56.77 1h2p n LEU 61 Cb 0.54 -1.56 0.12 0.00 -1.62 0.00 0.00 43.42 40.90 1h2p n LEU 61 CO 0.43 -0.76 0.55 -0.81 -1.22 0.00 0.00 177.39 175.57 1h2p n PRO 62 N -1.28 -0.35 -4.43 3.23 -0.04 -1.26 -4.80 135.00 126.07 1h2p n PRO 62 Ca 0.12 -2.07 -0.22 0.00 -0.04 0.00 0.00 63.50 61.29 1h2p n PRO 62 Cb 0.46 -0.74 -0.10 0.00 -0.04 0.00 0.00 33.50 33.07 1h2p n PRO 62 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1h2p s GLU 63 N -4.89 1.55 -0.26 0.54 -1.05 -0.76 -4.87 118.70 108.97 1h2p s GLU 63 Ca 0.57 -1.69 0.01 0.00 -0.15 0.00 0.00 54.97 53.71 1h2p s GLU 63 Cb -0.03 -1.56 0.07 0.00 -0.44 0.00 0.00 34.13 32.17 1h2p s GLU 63 CO 0.39 0.29 -0.02 0.00 0.95 0.00 0.00 175.26 176.86 1h2p s ARG 65 N 1.35 3.88 0.14 0.00 0.52 -0.79 -4.83 118.95 119.22 1h2p s ARG 65 Ca -0.02 0.35 -0.31 0.00 -0.52 0.00 0.00 55.73 55.23 1h2p s ARG 65 Cb -0.19 -3.07 -0.10 0.00 0.52 0.00 0.00 34.95 32.11 1h2p s ARG 65 CO -0.09 0.59 1.74 -1.21 0.02 0.00 0.00 175.30 176.35 1h2p s GLU 66 N -1.60 4.16 -0.19 3.54 2.02 -1.26 -2.53 118.70 122.83 1h2p s GLU 66 Ca 0.31 2.52 -0.28 0.00 0.02 0.00 0.00 54.97 57.53 1h2p s GLU 66 Cb -0.15 -3.43 0.00 0.00 0.10 0.00 0.00 34.13 30.65 1h2p s GLU 66 CO 0.17 -0.77 0.99 0.42 0.02 0.00 0.00 175.26 176.09 1h2p s ILE 67 N 2.18 4.74 -0.02 -1.63 1.01 -0.61 -4.96 121.20 121.91 1h2p s ILE 67 Ca 0.77 1.96 0.02 0.00 0.00 0.00 0.00 60.65 63.40 1h2p s ILE 67 Cb -0.45 -4.28 -0.03 0.00 0.01 0.00 0.00 42.46 37.71 1h2p s ILE 67 CO 0.34 -0.10 -0.07 -0.31 0.00 0.00 0.00 174.94 174.80 1h2p s TYR 68 N 2.74 2.91 0.77 3.97 2.02 -1.26 -4.04 117.35 124.45 1h2p s TYR 68 Ca 0.44 -0.02 -0.11 0.00 -0.37 0.00 0.00 57.07 57.01 1h2p s TYR 68 Cb -0.16 -1.64 0.05 0.00 -0.40 0.00 0.00 41.96 39.81 1h2p s TYR 68 CO 0.10 0.36 1.10 0.00 -1.57 0.00 0.00 175.55 175.54 1h2p s PRO 70 N -5.25 -0.39 0.26 0.00 0.04 -1.23 -4.53 135.00 123.90 1h2p s PRO 70 Ca 0.60 -0.29 -0.30 0.00 0.04 0.00 0.00 61.00 61.05 1h2p s PRO 70 Cb -0.13 -1.71 -0.11 0.00 0.04 0.00 0.00 34.50 32.59 1h2p s PRO 70 CO 0.53 -3.12 1.52 0.00 0.04 0.00 0.00 177.00 175.97 1h2p s ALA 71 N -3.48 3.69 0.25 8.56 0.00 -1.26 -4.86 121.76 124.66 1h2p s ALA 71 Ca 0.73 1.44 -0.30 0.00 0.00 0.00 0.00 51.96 53.83 1h2p s ALA 71 Cb -0.06 -3.60 -0.10 0.00 0.00 0.00 0.00 23.12 19.36 1h2p s ALA 71 CO 0.55 -0.85 1.43 -1.25 0.00 0.00 0.00 175.76 175.63 1h2p s PRO 72 N -0.32 4.28 1.09 0.00 0.04 -1.26 -4.98 135.00 133.85 1h2p s PRO 72 Ca 0.62 2.28 -0.18 0.00 0.04 0.00 0.00 61.00 63.76 1h2p s PRO 72 Cb -0.45 -3.12 0.09 0.00 0.04 0.00 0.00 34.50 31.07 1h2p s PRO 72 CO 0.44 -0.41 0.04 -0.35 0.04 0.00 0.00 177.00 176.77 1h2p n PRO 73 N 2.35 -1.37 -4.81 0.56 -0.04 -1.26 -5.02 135.00 125.40 1h2p n PRO 73 Ca 0.07 -0.38 -0.31 0.00 -0.04 0.00 0.00 63.50 62.84 1h2p n PRO 73 Cb 0.40 -1.71 -0.13 0.00 -0.04 0.00 0.00 33.50 32.02 1h2p n PRO 73 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1h2p s GLN 74 N -3.44 2.09 -0.09 0.54 -1.52 -1.26 -4.99 119.66 110.97 1h2p s GLN 74 Ca 0.56 -0.96 0.02 0.00 -1.95 0.00 0.00 55.36 53.03 1h2p s GLN 74 Cb -0.13 -2.16 -0.02 0.00 -0.22 0.00 0.00 33.01 30.49 1h2p s GLN 74 CO 0.66 0.55 -0.15 0.96 -0.25 0.00 0.00 175.29 177.06 1h2p s ILE 75 N -0.84 2.89 0.58 1.08 -4.36 -1.26 -5.10 121.20 114.19 1h2p s ILE 75 Ca 0.13 -0.75 -0.20 0.00 -0.26 0.00 0.00 60.65 59.57 1h2p s ILE 75 Cb -0.10 -2.17 -0.04 0.00 1.25 0.00 0.00 42.46 41.40 1h2p s ILE 75 CO 0.03 0.55 1.31 -1.81 0.24 0.00 0.00 174.94 175.27 1h2p s ASP 76 N -0.07 5.10 -1.41 4.36 1.01 -1.26 -2.40 116.67 122.00 1h2p s ASP 76 Ca -0.03 2.65 -0.02 0.00 0.71 0.00 0.00 52.55 55.86 1h2p s ASP 76 Cb -0.14 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 41.18 1h2p s ASP 76 CO 0.04 -1.67 0.20 0.59 0.21 0.00 0.00 175.17 174.53 1h2p n ASN 77 N -1.33 -4.94 -3.59 0.27 3.02 -1.26 -4.43 115.26 102.99 1h2p n ASN 77 Ca 0.12 -0.05 -0.06 0.00 -0.03 0.00 0.00 54.58 54.57 1h2p n ASN 77 Cb 0.47 -4.11 -0.02 0.00 -0.61 0.00 0.00 39.78 35.51 1h2p n ASN 77 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1h2p s GLY 78 N -2.27 -0.37 0.23 7.41 0.00 -1.01 -1.21 107.32 110.10 1h2p s GLY 78 Ca 0.12 0.81 0.01 0.00 0.00 0.00 0.00 44.72 45.66 1h2p s GLY 78 CO 0.15 0.25 0.17 -0.26 0.00 0.00 0.00 173.10 173.40 1h2p s ILE 79 N -3.02 0.00 -0.47 0.90 -5.25 -0.08 -4.40 121.20 108.88 1h2p s ILE 79 Ca 0.08 -1.99 -0.16 0.00 -0.99 0.00 0.00 60.65 57.59 1h2p s ILE 79 Cb -0.01 -2.50 0.06 0.00 2.95 0.00 0.00 42.46 42.97 1h2p s ILE 79 CO -0.05 0.00 0.44 -0.63 -1.79 0.00 0.00 174.94 172.91 1h2p s ILE 80 N -4.00 5.15 -0.85 8.37 1.01 -1.26 -1.00 121.20 128.62 1h2p s ILE 80 Ca 0.39 -0.84 -0.22 0.00 0.00 0.00 0.00 60.65 59.98 1h2p s ILE 80 Cb 0.06 -4.14 -0.19 0.00 0.01 0.00 0.00 42.46 38.21 1h2p s ILE 80 CO 0.15 -0.59 2.13 0.00 0.00 0.00 0.00 174.94 176.64 1h2p n GLN 81 N 5.45 0.26 -2.01 2.79 6.02 -0.67 -3.25 117.38 125.97 1h2p n GLN 81 Ca -0.11 -1.02 -0.03 0.00 -0.01 0.00 0.00 57.00 55.84 1h2p n GLN 81 Cb 0.45 -3.27 0.00 0.00 1.02 0.00 0.00 30.24 28.44 1h2p n GLN 81 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1h2p n GLY 82 N 6.19 -0.90 3.79 1.08 0.00 -1.26 -4.76 105.19 109.34 1h2p n GLY 82 Ca 0.42 0.37 -0.33 0.00 0.00 0.00 0.00 46.02 46.48 1h2p n GLY 82 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1h2p s GLU 83 N -1.75 3.27 0.26 1.61 2.12 -1.20 -4.97 118.70 118.04 1h2p s GLU 83 Ca 0.08 1.31 0.08 0.00 0.36 0.00 0.00 54.97 56.81 1h2p s GLU 83 Cb -0.02 -2.02 -0.04 0.00 0.26 0.00 0.00 34.13 32.31 1h2p s GLU 83 CO 0.29 -0.86 0.12 1.03 -0.54 0.00 0.00 175.26 175.29 1h2p s ARG 84 N -3.88 2.67 0.13 4.30 0.52 -1.26 -5.04 118.95 116.39 1h2p s ARG 84 Ca 0.66 -1.21 -0.16 0.00 -0.52 0.00 0.00 55.73 54.50 1h2p s ARG 84 Cb -0.18 -2.40 -0.01 0.00 0.52 0.00 0.00 34.95 32.88 1h2p s ARG 84 CO 0.35 0.38 1.67 0.38 0.02 0.00 0.00 175.30 178.09 1h2p h ASP 85 N 1.64 0.54 -4.37 0.23 -0.00 -2.04 -3.44 116.42 108.98 1h2p h ASP 85 Ca -0.47 -0.18 -0.24 0.00 -0.00 0.00 0.00 57.03 56.15 1h2p h ASP 85 Cb 1.24 -0.14 -0.24 0.00 -0.00 0.00 0.00 39.33 40.19 1h2p h ASP 85 CO 0.61 0.58 -0.72 -1.00 -0.00 0.00 0.00 179.24 178.70 1h2p s HIS 86 N -5.50 0.30 -0.17 4.15 3.76 -1.26 -5.05 115.29 111.52 1h2p s HIS 86 Ca -0.13 -0.29 0.01 0.00 -0.15 0.00 0.00 55.06 54.50 1h2p s HIS 86 Cb 0.10 -0.19 0.02 0.00 1.11 0.00 0.00 32.58 33.61 1h2p s HIS 86 CO 0.75 -0.08 -0.20 0.71 -0.85 0.00 0.00 174.74 175.08 1h2p s TYR 87 N -0.77 2.76 0.42 1.40 1.51 -1.26 -5.04 117.35 116.37 1h2p s TYR 87 Ca -0.07 -1.53 0.08 0.00 -1.01 0.00 0.00 57.07 54.54 1h2p s TYR 87 Cb -0.06 -1.90 -0.02 0.00 -0.11 0.00 0.00 41.96 39.87 1h2p s TYR 87 CO -0.00 -0.74 0.39 0.20 -1.11 0.00 0.00 175.55 174.28 1h2p s GLY 88 N 1.18 2.13 0.19 0.71 0.00 -1.26 -0.47 107.32 109.79 1h2p s GLY 88 Ca 0.02 -1.88 -0.30 0.00 0.00 0.00 0.00 44.72 42.57 1h2p s GLY 88 CO -0.10 -1.69 0.70 2.98 0.00 0.00 0.00 173.10 174.99 1h2p n TYR 89 N -1.57 0.02 0.00 1.90 9.36 -1.26 -0.76 117.16 124.85 1h2p n TYR 89 Ca 0.04 0.92 0.00 0.00 3.32 0.00 0.00 57.90 62.18 1h2p n TYR 89 Cb 0.62 -2.04 0.00 0.00 -0.63 0.00 0.00 39.34 37.29 1h2p n TYR 89 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1h2p n ARG 90 N 1.07 0.00 -2.28 2.98 1.74 -0.05 -4.96 116.66 115.17 1h2p n ARG 90 Ca 0.17 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.83 1h2p n ARG 90 Cb 0.24 -0.33 -0.03 0.00 -1.02 0.00 0.00 32.46 31.32 1h2p n ARG 90 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1h2p s GLN 91 N 0.00 4.40 0.41 5.56 -0.21 0.06 -4.68 119.66 125.19 1h2p s GLN 91 Ca 0.00 1.96 0.03 0.00 0.02 0.00 0.00 55.36 57.37 1h2p s GLN 91 Cb 0.00 -3.25 0.03 0.00 1.00 0.00 0.00 33.01 30.79 1h2p s GLN 91 CO 0.00 -0.27 0.25 -1.13 -2.12 0.00 0.00 175.29 172.02 1h2p n SER 92 N 3.25 2.47 -3.97 5.90 3.41 -1.26 -1.08 113.62 122.33 1h2p n SER 92 Ca 0.08 -2.48 -0.15 0.00 -0.26 0.00 0.00 58.87 56.06 1h2p n SER 92 Cb 0.44 0.03 -0.14 0.00 -0.26 0.00 0.00 64.21 64.28 1h2p n SER 92 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1h2p s VAL 93 N -2.12 0.39 -0.12 -3.33 -7.23 -0.99 -4.94 120.40 102.06 1h2p s VAL 93 Ca 0.19 -0.40 0.03 0.00 -1.81 0.00 0.00 61.98 59.98 1h2p s VAL 93 Cb -0.02 -0.37 0.01 0.00 0.56 0.00 0.00 36.38 36.57 1h2p s VAL 93 CO 0.12 -0.02 -0.20 -0.89 -0.31 0.00 0.00 175.10 173.79 1h2p s THR 94 N -0.42 1.88 0.30 5.32 2.01 -1.26 -1.95 115.64 121.52 1h2p s THR 94 Ca -0.01 -0.89 0.06 0.00 0.31 0.00 0.00 61.69 61.16 1h2p s THR 94 Cb -0.04 -1.66 -0.02 0.00 0.01 0.00 0.00 72.50 70.80 1h2p s THR 94 CO -0.00 0.52 0.42 -0.31 -0.69 0.00 0.00 174.62 174.55 1h2p s TYR 95 N 0.70 3.20 0.04 4.92 1.51 -0.15 -1.66 117.35 125.91 1h2p s TYR 95 Ca -0.11 -0.16 -0.08 0.00 -1.01 0.00 0.00 57.07 55.70 1h2p s TYR 95 Cb -0.16 -1.84 0.00 0.00 -0.11 0.00 0.00 41.96 39.85 1h2p s TYR 95 CO 0.02 0.15 0.17 0.00 -1.11 0.00 0.00 175.55 174.78 1h2p s ALA 96 N -2.12 -0.30 0.36 3.71 0.00 -0.17 -4.86 121.76 118.38 1h2p s ALA 96 Ca 0.41 -0.33 0.07 0.00 0.00 0.00 0.00 51.96 52.11 1h2p s ALA 96 Cb -0.09 0.26 -0.00 0.00 0.00 0.00 0.00 23.12 23.29 1h2p s ALA 96 CO 0.30 -0.34 0.50 0.00 0.00 0.00 0.00 175.76 176.22 1h2p s ASN 98 N -4.23 5.10 0.00 0.00 0.01 -0.35 -4.83 114.94 110.64 1h2p s ASN 98 Ca 0.48 0.76 0.00 0.00 -0.71 0.00 0.00 52.86 53.39 1h2p s ASN 98 Cb -0.10 -1.49 0.00 0.00 0.41 0.00 0.00 41.25 40.07 1h2p s ASN 98 CO 0.32 -1.47 0.02 1.17 -1.51 0.00 0.00 177.10 175.63 1h2p n LYS 99 N -2.94 0.02 0.00 -0.60 4.81 -1.26 -1.46 118.16 116.73 1h2p n LYS 99 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 1h2p n LYS 99 Cb 0.59 -1.00 0.00 0.00 0.02 0.00 0.00 35.03 34.64 1h2p n LYS 99 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1h2p n GLY 100 N -0.17 1.00 3.68 3.14 0.00 -1.26 -5.06 105.19 106.52 1h2p n GLY 100 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1h2p n GLY 100 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1h2p s PHE 101 N 0.00 3.38 -0.09 1.61 0.40 -0.53 -4.36 117.98 118.40 1h2p s PHE 101 Ca 0.00 0.57 -0.19 0.00 -0.60 0.00 0.00 56.93 56.71 1h2p s PHE 101 Cb 0.00 -2.46 -0.04 0.00 0.51 0.00 0.00 43.02 41.02 1h2p s PHE 101 CO 0.00 0.04 0.51 0.95 0.70 0.00 0.00 175.22 177.43 1h2p s THR 102 N 1.14 5.12 0.19 0.64 -4.23 1.10 -4.43 115.64 115.16 1h2p s THR 102 Ca 0.17 1.04 -0.30 0.00 -1.18 0.00 0.00 61.69 61.43 1h2p s THR 102 Cb -0.14 -3.85 -0.08 0.00 1.34 0.00 0.00 72.50 69.76 1h2p s THR 102 CO 0.07 0.35 1.21 -0.32 -0.54 0.00 0.00 174.62 175.39 1h2p s MET 103 N 0.39 4.48 -0.73 3.99 1.75 -1.26 -0.81 119.30 127.10 1h2p s MET 103 Ca 0.28 1.90 0.04 0.00 -1.25 0.00 0.00 55.69 56.66 1h2p s MET 103 Cb -0.16 -3.23 0.18 0.00 2.84 0.00 0.00 34.83 34.45 1h2p s MET 103 CO 0.12 -0.11 0.53 0.42 -0.65 0.00 0.00 175.02 175.34 1h2p s ILE 104 N -0.03 3.08 -1.67 10.11 1.01 -0.86 -4.94 121.20 127.90 1h2p s ILE 104 Ca 0.53 -4.25 0.00 0.00 0.00 0.00 0.00 60.65 56.94 1h2p s ILE 104 Cb -0.33 -3.00 0.00 0.00 0.01 0.00 0.00 42.46 39.14 1h2p s ILE 104 CO 0.37 -1.02 0.00 0.61 0.00 0.00 0.00 174.94 174.90 1h2p n GLY 105 N 2.00 0.44 3.56 6.18 0.00 -1.26 -2.63 105.19 113.48 1h2p n GLY 105 Ca 0.20 -1.63 -0.19 0.00 0.00 0.00 0.00 46.02 44.40 1h2p n GLY 105 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1h2p s GLU 106 N -1.30 1.74 0.12 1.61 8.01 -1.26 -4.92 118.70 122.70 1h2p s GLU 106 Ca 0.00 0.70 -0.30 0.00 0.01 0.00 0.00 54.97 55.37 1h2p s GLU 106 Cb 0.00 -4.74 -0.08 0.00 -4.31 0.00 0.00 34.13 25.00 1h2p s GLU 106 CO 0.00 -4.15 1.58 0.45 0.01 0.00 0.00 175.26 173.15 1h2p h HIS 107 N 14.37 -1.26 -4.03 1.61 3.86 -1.95 -3.27 115.15 124.48 1h2p h HIS 107 Ca -0.06 0.04 -0.42 0.00 -1.16 0.00 0.00 60.37 58.78 1h2p h HIS 107 Cb 1.07 0.56 -0.25 0.00 1.06 0.00 0.00 27.41 29.84 1h2p h HIS 107 CO 1.11 -0.50 -0.79 -1.54 0.86 0.00 0.00 177.93 177.07 1h2p s SER 108 N -4.81 1.49 0.50 2.45 1.04 -1.26 -0.98 113.70 112.13 1h2p s SER 108 Ca -0.16 -0.41 0.02 0.00 0.48 0.00 0.00 55.95 55.87 1h2p s SER 108 Cb 0.08 -0.10 0.02 0.00 0.10 0.00 0.00 66.02 66.12 1h2p s SER 108 CO 0.63 0.03 0.13 2.30 0.98 0.00 0.00 173.24 177.31 1h2p n ILE 109 N 2.03 0.00 -3.57 -1.02 -5.35 -0.82 -4.98 119.36 105.64 1h2p n ILE 109 Ca -0.18 -2.22 -0.13 0.00 -0.27 0.00 0.00 62.75 59.95 1h2p n ILE 109 Cb 0.55 0.29 -0.05 0.00 -1.74 0.00 0.00 39.64 38.69 1h2p n ILE 109 CO 0.00 0.00 0.00 -0.72 -1.76 0.00 0.00 176.55 174.07 1h2p s TYR 110 N -2.70 -0.40 -0.30 4.28 1.13 -1.26 -2.36 117.35 115.74 1h2p s TYR 110 Ca 0.10 0.40 -0.29 0.00 -1.41 0.00 0.00 57.07 55.87 1h2p s TYR 110 Cb -0.01 0.34 0.00 0.00 -1.10 0.00 0.00 41.96 41.20 1h2p s TYR 110 CO 0.06 -0.66 1.25 0.00 -2.51 0.00 0.00 175.55 173.69 1h2p s THR 112 N 4.16 2.95 0.45 0.00 -4.23 -0.43 -0.87 115.64 117.67 1h2p s THR 112 Ca 0.54 -1.72 0.07 0.00 -1.18 0.00 0.00 61.69 59.40 1h2p s THR 112 Cb -0.16 -2.96 -0.01 0.00 1.34 0.00 0.00 72.50 70.72 1h2p s THR 112 CO 0.21 -0.18 0.39 0.68 -0.54 0.00 0.00 174.62 175.18 1h2p s VAL 113 N -2.44 2.39 -0.30 2.29 -7.23 -1.26 -0.86 120.40 112.98 1h2p s VAL 113 Ca 0.38 -1.39 -0.14 0.00 -1.81 0.00 0.00 61.98 59.01 1h2p s VAL 113 Cb -0.02 -2.78 0.19 0.00 0.56 0.00 0.00 36.38 34.33 1h2p s VAL 113 CO 0.22 0.00 1.16 0.21 -0.31 0.00 0.00 175.10 176.39 1h2p s ASN 114 N -4.17 -0.01 -0.64 4.85 2.47 0.34 -4.78 114.94 113.00 1h2p s ASN 114 Ca 0.45 -0.00 -0.00 0.00 0.42 0.00 0.00 52.86 53.73 1h2p s ASN 114 Cb -0.02 0.19 -0.00 0.00 -1.45 0.00 0.00 41.25 39.97 1h2p s ASN 114 CO 0.27 -0.00 0.53 -0.46 -3.72 0.00 0.00 177.10 173.72 1h2p n ASN 115 N 3.78 -2.04 -3.71 -4.21 0.23 -1.26 -3.62 115.26 104.42 1h2p n ASN 115 Ca 0.05 -0.33 -0.23 0.00 -0.53 0.00 0.00 54.58 53.54 1h2p n ASN 115 Cb 0.64 -2.97 0.03 0.00 -2.08 0.00 0.00 39.78 35.40 1h2p n ASN 115 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1h2p n ASP 116 N -2.14 -1.90 -3.64 0.53 8.00 -1.26 -4.98 116.55 111.17 1h2p n ASP 116 Ca -0.15 -0.87 -0.10 0.00 0.71 0.00 0.00 54.79 54.37 1h2p n ASP 116 Cb 0.59 -3.86 -0.07 0.00 -0.02 0.00 0.00 41.12 37.76 1h2p n ASP 116 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1h2p s GLU 117 N -5.98 0.76 -0.24 -1.24 8.01 -1.24 -5.02 118.70 113.74 1h2p s GLU 117 Ca 0.09 1.11 -0.20 0.00 0.01 0.00 0.00 54.97 55.98 1h2p s GLU 117 Cb -0.03 0.26 -0.02 0.00 -4.31 0.00 0.00 34.13 30.03 1h2p s GLU 117 CO 0.83 -0.13 0.63 0.20 0.01 0.00 0.00 175.26 176.80 1h2p s GLY 118 N 1.07 1.88 0.19 -1.39 0.00 -1.21 -0.50 107.32 107.34 1h2p s GLY 118 Ca -0.05 -0.38 0.09 0.00 0.00 0.00 0.00 44.72 44.37 1h2p s GLY 118 CO -0.11 1.41 -0.18 -1.83 0.00 0.00 0.00 173.10 172.40 1h2p s GLU 119 N 2.33 1.34 0.21 2.90 -1.05 -0.04 -3.58 118.70 120.82 1h2p s GLU 119 Ca 0.27 -1.49 -0.16 0.00 -0.15 0.00 0.00 54.97 53.44 1h2p s GLU 119 Cb -0.16 -1.36 -0.08 0.00 -0.44 0.00 0.00 34.13 32.10 1h2p s GLU 119 CO 0.09 0.26 0.64 -1.58 0.95 0.00 0.00 175.26 175.62 1h2p s TRP 120 N -2.29 3.56 0.16 4.83 0.52 -1.26 -1.32 118.94 123.14 1h2p s TRP 120 Ca 0.19 1.17 -0.16 0.00 0.02 0.00 0.00 56.10 57.32 1h2p s TRP 120 Cb -0.05 -2.47 0.07 0.00 -1.15 0.00 0.00 33.47 29.87 1h2p s TRP 120 CO 0.08 0.32 1.74 0.66 0.02 0.00 0.00 176.95 179.77 1h2p h SER 121 N 3.16 0.10 -2.19 2.95 4.64 -1.69 -3.47 113.55 117.05 1h2p h SER 121 Ca -0.48 0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 60.87 1h2p h SER 121 Cb 1.19 0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1h2p h SER 121 CO 0.66 0.09 -0.01 0.61 -0.87 0.00 0.00 176.83 177.31 1h2p n GLY 122 N -1.22 4.03 3.89 -0.77 0.00 -1.26 -5.03 105.19 104.82 1h2p n GLY 122 Ca 0.01 -1.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.01 1h2p n GLY 122 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h2p s PRO 123 N -2.03 3.60 0.75 1.61 0.04 -1.26 -4.97 135.00 132.74 1h2p s PRO 123 Ca 0.01 0.50 -0.11 0.00 0.04 0.00 0.00 61.00 61.43 1h2p s PRO 123 Cb 0.00 -2.23 0.04 0.00 0.04 0.00 0.00 34.50 32.35 1h2p s PRO 123 CO 0.01 -0.36 1.08 -1.25 0.04 0.00 0.00 177.00 176.52 1h2p s PRO 124 N -4.84 2.50 1.27 0.56 0.04 -1.26 -4.77 135.00 128.50 1h2p s PRO 124 Ca 0.52 0.79 -0.21 0.00 0.04 0.00 0.00 61.00 62.13 1h2p s PRO 124 Cb -0.11 -1.95 0.32 0.00 0.04 0.00 0.00 34.50 32.80 1h2p s PRO 124 CO 0.47 -1.37 1.10 -1.25 0.04 0.00 0.00 177.00 175.99 1h2p s PRO 125 N -5.11 -1.77 0.37 0.56 0.04 -1.23 -4.82 135.00 123.04 1h2p s PRO 125 Ca 0.59 -0.19 0.07 0.00 0.04 0.00 0.00 61.00 61.52 1h2p s PRO 125 Cb -0.14 -1.54 -0.07 0.00 0.04 0.00 0.00 34.50 32.78 1h2p s PRO 125 CO 0.55 -4.05 -0.01 -2.00 0.04 0.00 0.00 177.00 171.53 1h2p s GLU 126 N -5.49 1.85 -0.22 4.56 2.12 -1.08 -4.93 118.70 115.51 1h2p s GLU 126 Ca 0.72 -2.01 -0.03 0.00 0.36 0.00 0.00 54.97 54.01 1h2p s GLU 126 Cb -0.08 -1.49 0.07 0.00 0.26 0.00 0.00 34.13 32.89 1h2p s GLU 126 CO 0.56 -0.02 0.05 0.00 -0.54 0.00 0.00 175.26 175.31 1h2p s ARG 128 N 1.84 3.63 0.00 0.00 3.52 0.00 -4.83 118.95 123.11 1h2p s ARG 128 Ca 0.01 -0.41 0.10 0.00 -0.13 0.00 0.00 55.73 55.30 1h2p s ARG 128 Cb -0.17 -3.01 0.08 0.00 -1.56 0.00 0.00 34.95 30.29 1h2p s ARG 128 CO -0.13 0.38 0.82 0.41 -0.81 0.00 0.00 175.30 175.97