#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2orb s ILE 2 N 0.00 2.57 -0.09 0.53 1.01 -1.26 -5.03 121.20 118.93 2orb s ILE 2 Ca 0.00 0.37 0.02 0.00 0.00 0.00 0.00 60.65 61.04 2orb s ILE 2 Cb 0.00 -3.16 0.01 0.00 0.01 0.00 0.00 42.46 39.32 2orb s ILE 2 CO 0.00 -0.06 -0.15 -0.69 0.00 0.00 0.00 174.94 174.04 2orb s VAL 3 N -1.54 1.40 -0.10 2.92 1.01 -1.26 -4.88 120.40 117.95 2orb s VAL 3 Ca 0.76 -0.61 -0.04 0.00 0.00 0.00 0.00 61.98 62.09 2orb s VAL 3 Cb -0.32 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.76 2orb s VAL 3 CO 0.35 0.42 0.05 -0.76 0.00 0.00 0.00 175.10 175.16 2orb s LEU 4 N 0.80 3.87 -0.12 3.92 1.43 -1.26 -1.60 118.68 125.71 2orb s LEU 4 Ca -0.11 0.26 -0.01 0.00 -1.03 0.00 0.00 54.13 53.24 2orb s LEU 4 Cb -0.16 -1.91 0.03 0.00 0.03 0.00 0.00 46.19 44.19 2orb s LEU 4 CO 0.02 0.39 -0.05 -0.89 0.23 0.00 0.00 176.35 176.04 2orb s THR 5 N -0.92 0.91 0.09 5.49 2.01 -0.59 -4.32 115.64 118.32 2orb s THR 5 Ca 0.14 -0.31 0.02 0.00 0.31 0.00 0.00 61.69 61.84 2orb s THR 5 Cb -0.12 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.34 2orb s THR 5 CO 0.03 0.26 0.18 -1.10 -0.69 0.00 0.00 174.62 173.30 2orb s GLN 6 N 1.74 3.23 -0.16 4.92 -0.21 -1.26 -0.18 119.66 127.75 2orb s GLN 6 Ca 0.04 -0.59 -0.20 0.00 0.02 0.00 0.00 55.36 54.63 2orb s GLN 6 Cb -0.13 -2.90 0.05 0.00 1.00 0.00 0.00 33.01 31.03 2orb s GLN 6 CO -0.08 0.57 0.54 -1.54 -2.12 0.00 0.00 175.29 172.66 2orb s SER 7 N -2.69 -0.54 0.95 5.90 1.04 0.34 -4.60 113.70 114.09 2orb s SER 7 Ca 0.33 0.94 -0.14 0.00 0.48 0.00 0.00 55.95 57.56 2orb s SER 7 Cb -0.12 0.95 0.21 0.00 0.10 0.00 0.00 66.02 67.16 2orb s SER 7 CO 0.26 -0.28 1.29 -2.16 0.98 0.00 0.00 173.24 173.34 2orb s PRO 8 N -0.09 0.57 0.04 4.02 0.04 -1.26 -0.80 135.00 137.52 2orb s PRO 8 Ca -0.03 -0.67 -0.22 0.00 0.04 0.00 0.00 61.00 60.12 2orb s PRO 8 Cb -0.03 -1.92 -0.15 0.00 0.04 0.00 0.00 34.50 32.44 2orb s PRO 8 CO 0.02 -2.40 1.41 0.00 0.04 0.00 0.00 177.00 176.08 2orb h ALA 9 N -1.54 0.15 -3.67 8.56 0.00 -1.88 -3.44 119.26 117.44 2orb h ALA 9 Ca -0.42 -0.23 -0.48 0.00 0.00 0.00 0.00 54.91 53.78 2orb h ALA 9 Cb 1.22 -0.04 -0.23 0.00 0.00 0.00 0.00 17.79 18.74 2orb h ALA 9 CO 0.33 -0.10 -0.80 -1.54 0.00 0.00 0.00 179.25 177.14 2orb s SER 10 N -5.82 1.97 -0.09 0.00 1.04 -1.26 -0.93 113.70 108.61 2orb s SER 10 Ca -0.14 -0.57 -0.03 0.00 0.48 0.00 0.00 55.95 55.68 2orb s SER 10 Cb 0.05 -0.11 0.04 0.00 0.10 0.00 0.00 66.02 66.10 2orb s SER 10 CO 0.71 0.02 0.08 -0.22 0.98 0.00 0.00 173.24 174.82 2orb s LEU 11 N -1.51 0.18 -0.25 2.42 2.96 1.00 -4.93 118.68 118.54 2orb s LEU 11 Ca 0.02 -0.14 -0.08 0.00 -0.22 0.00 0.00 54.13 53.72 2orb s LEU 11 Cb -0.09 -0.13 -0.03 0.00 0.50 0.00 0.00 46.19 46.44 2orb s LEU 11 CO 0.02 -0.28 0.08 0.00 -1.32 0.00 0.00 176.35 174.85 2orb s ALA 12 N 2.17 3.19 -0.02 5.97 0.00 -1.25 -0.19 121.76 131.64 2orb s ALA 12 Ca 0.04 -1.14 0.02 0.00 0.00 0.00 0.00 51.96 50.87 2orb s ALA 12 Cb -0.13 -2.12 0.00 0.00 0.00 0.00 0.00 23.12 20.87 2orb s ALA 12 CO -0.05 -0.52 -0.06 0.08 0.00 0.00 0.00 175.76 175.21 2orb s VAL 13 N 1.62 0.53 0.71 0.00 1.01 -0.57 -4.89 120.40 118.80 2orb s VAL 13 Ca 0.06 -0.23 -0.15 0.00 0.00 0.00 0.00 61.98 61.66 2orb s VAL 13 Cb -0.15 -0.48 0.03 0.00 0.00 0.00 0.00 36.38 35.78 2orb s VAL 13 CO 0.04 0.17 1.17 -0.44 0.00 0.00 0.00 175.10 176.04 2orb s SER 14 N 0.17 4.51 0.28 3.32 0.01 -1.26 -2.34 113.70 118.38 2orb s SER 14 Ca -0.02 2.21 -0.30 0.00 1.31 0.00 0.00 55.95 59.15 2orb s SER 14 Cb -0.06 -2.57 -0.12 0.00 0.21 0.00 0.00 66.02 63.47 2orb s SER 14 CO -0.00 -2.05 1.55 -0.11 0.41 0.00 0.00 173.24 173.04 2orb n LEU 15 N -2.65 4.03 0.00 2.44 -0.00 -1.26 -2.24 117.00 117.32 2orb n LEU 15 Ca 0.12 1.15 0.00 0.00 -0.00 0.00 0.00 56.01 57.28 2orb n LEU 15 Cb 0.51 -1.55 0.00 0.00 -0.00 0.00 0.00 43.42 42.38 2orb n LEU 15 CO 0.48 -0.02 0.00 0.61 -0.00 0.00 0.00 177.39 178.46 2orb n GLY 16 N 2.15 2.77 0.19 -3.96 0.00 -0.09 -4.93 105.19 101.32 2orb n GLY 16 Ca 0.09 -0.37 -0.01 0.00 0.00 0.00 0.00 46.02 45.73 2orb n GLY 16 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2orb n GLN 17 N 0.00 -1.08 -4.59 1.61 6.02 -0.95 -3.73 117.38 114.66 2orb n GLN 17 Ca 0.00 -0.07 -0.33 0.00 -0.01 0.00 0.00 57.00 56.59 2orb n GLN 17 Cb 0.00 -0.10 -0.12 0.00 1.02 0.00 0.00 30.24 31.03 2orb n GLN 17 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2orb s ARG 18 N -2.33 3.28 -0.21 -1.09 3.52 -1.26 -1.63 118.95 119.24 2orb s ARG 18 Ca 0.03 -0.58 -0.07 0.00 -0.13 0.00 0.00 55.73 54.99 2orb s ARG 18 Cb -0.01 -2.72 -0.03 0.00 -1.56 0.00 0.00 34.95 30.63 2orb s ARG 18 CO 0.03 0.37 0.04 0.00 -0.81 0.00 0.00 175.30 174.93 2orb s ALA 19 N -0.02 3.20 -0.16 6.12 0.00 0.37 -4.92 121.76 126.35 2orb s ALA 19 Ca -0.01 -0.93 -0.00 0.00 0.00 0.00 0.00 51.96 51.02 2orb s ALA 19 Cb -0.14 -1.91 0.03 0.00 0.00 0.00 0.00 23.12 21.11 2orb s ALA 19 CO 0.03 -0.11 -0.09 0.99 0.00 0.00 0.00 175.76 176.58 2orb s THR 20 N 0.92 1.30 -0.05 0.00 2.01 -1.26 -0.62 115.64 117.95 2orb s THR 20 Ca 0.03 -0.62 0.06 0.00 0.31 0.00 0.00 61.69 61.47 2orb s THR 20 Cb -0.14 -1.36 -0.01 0.00 0.01 0.00 0.00 72.50 71.00 2orb s THR 20 CO 0.02 0.27 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.35 2orb s ILE 21 N 1.57 2.00 0.17 1.82 1.01 -0.68 -4.78 121.20 122.31 2orb s ILE 21 Ca 0.02 -1.05 0.08 0.00 0.00 0.00 0.00 60.65 59.71 2orb s ILE 21 Cb -0.14 -1.68 -0.04 0.00 0.01 0.00 0.00 42.46 40.60 2orb s ILE 21 CO -0.09 0.56 -0.08 -0.44 0.00 0.00 0.00 174.94 174.89 2orb s SER 22 N -0.26 4.34 -0.08 3.58 0.01 0.02 -1.03 113.70 120.28 2orb s SER 22 Ca -0.00 -0.53 -0.04 0.00 1.31 0.00 0.00 55.95 56.69 2orb s SER 22 Cb -0.13 -0.77 0.04 0.00 0.21 0.00 0.00 66.02 65.37 2orb s SER 22 CO 0.02 0.11 0.17 0.00 0.41 0.00 0.00 173.24 173.96 2orb s ARG 24 N 1.07 3.04 -0.10 0.00 3.52 0.75 -1.54 118.95 125.70 2orb s ARG 24 Ca -0.08 -0.87 -0.13 0.00 -0.13 0.00 0.00 55.73 54.52 2orb s ARG 24 Cb -0.10 -2.34 -0.05 0.00 -1.56 0.00 0.00 34.95 30.90 2orb s ARG 24 CO -0.06 0.13 0.31 0.00 -0.81 0.00 0.00 175.30 174.87 2orb s ALA 25 N 0.47 3.68 -0.86 6.12 0.00 -0.68 -1.54 121.76 128.94 2orb s ALA 25 Ca -0.16 -0.40 0.19 0.00 0.00 0.00 0.00 51.96 51.60 2orb s ALA 25 Cb -0.17 -2.32 0.80 0.00 0.00 0.00 0.00 23.12 21.43 2orb s ALA 25 CO 0.06 0.32 1.61 -1.13 0.00 0.00 0.00 175.76 176.62 2orb n SER 26 N 2.69 0.21 -3.92 0.00 3.41 -0.63 -4.76 113.62 110.62 2orb n SER 26 Ca -0.14 0.54 -0.12 0.00 -0.26 0.00 0.00 58.87 58.90 2orb n SER 26 Cb 0.53 -0.59 -0.07 0.00 -0.26 0.00 0.00 64.21 63.81 2orb n SER 26 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2orb s GLU 27 N -3.08 1.48 1.05 4.33 2.02 -1.26 -4.93 118.70 118.31 2orb s GLU 27 Ca 0.08 -1.53 -0.11 0.00 0.02 0.00 0.00 54.97 53.42 2orb s GLU 27 Cb 0.11 0.38 0.22 0.00 0.10 0.00 0.00 34.13 34.94 2orb s GLU 27 CO 0.35 -0.57 1.09 0.45 0.02 0.00 0.00 175.26 176.60 2orb n SER 27 N -0.58 -0.70 -2.70 -0.19 2.88 -1.26 -4.84 113.62 106.23 2orb n SER 27 Ca 0.01 0.13 -0.06 0.00 -1.33 0.00 0.00 58.87 57.61 2orb n SER 27 Cb 0.63 -1.37 0.07 0.00 -0.75 0.00 0.00 64.21 62.79 2orb n SER 27 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2orb n VAL 27 N -4.64 0.69 -3.83 2.46 0.31 -1.26 -5.01 118.33 107.05 2orb n VAL 27 Ca 0.07 -2.45 -0.13 0.00 -0.01 0.00 0.00 64.34 61.82 2orb n VAL 27 Cb 0.53 0.89 -0.14 0.00 -0.91 0.00 0.00 33.84 34.20 2orb n VAL 27 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2orb s ASP 27 N -2.56 -0.00 -0.99 4.52 1.11 -1.26 -0.25 116.67 117.24 2orb s ASP 27 Ca 0.24 0.06 -0.01 0.00 0.18 0.00 0.00 52.55 53.02 2orb s ASP 27 Cb 0.42 0.02 0.32 0.00 1.07 0.00 0.00 42.92 44.75 2orb s ASP 27 CO -0.02 -0.05 1.78 -1.20 1.18 0.00 0.00 175.17 176.86 2orb n SER 31 N 3.48 7.19 -3.75 0.27 7.64 -1.26 -5.15 113.62 122.04 2orb n SER 31 Ca -0.18 -3.70 -0.42 0.00 1.01 0.00 0.00 58.87 55.58 2orb n SER 31 Cb 0.56 -1.12 0.00 0.00 -1.01 0.00 0.00 64.21 62.64 2orb n SER 31 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2orb n PHE 32 N -0.10 3.26 -4.40 1.43 3.01 0.65 -4.29 117.46 117.03 2orb n PHE 32 Ca 0.46 -2.92 -0.26 0.00 1.01 0.00 0.00 57.45 55.75 2orb n PHE 32 Cb 0.27 -2.34 -0.17 0.00 -0.01 0.00 0.00 39.48 37.23 2orb n PHE 32 CO 0.00 0.00 0.00 1.41 1.01 0.00 0.00 176.76 179.18 2orb s MET 33 N 2.12 1.79 0.12 -1.08 1.75 -1.26 -2.61 119.30 120.13 2orb s MET 33 Ca 0.46 -0.41 0.03 0.00 -1.25 0.00 0.00 55.69 54.51 2orb s MET 33 Cb 0.13 -1.57 -0.04 0.00 2.84 0.00 0.00 34.83 36.19 2orb s MET 33 CO -0.06 -0.06 -0.08 -0.80 -0.65 0.00 0.00 175.02 173.37 2orb s ASN 34 N 0.99 1.43 -0.01 1.11 0.01 -0.69 0.99 114.94 118.76 2orb s ASN 34 Ca -0.08 -1.01 0.05 0.00 -0.71 0.00 0.00 52.86 51.12 2orb s ASN 34 Cb -0.15 0.05 -0.01 0.00 0.41 0.00 0.00 41.25 41.54 2orb s ASN 34 CO -0.00 -0.40 -0.17 0.26 -1.51 0.00 0.00 177.10 175.27 2orb s TRP 35 N -3.48 1.56 0.08 2.20 0.52 0.55 0.25 118.94 120.63 2orb s TRP 35 Ca 0.14 -0.30 0.08 0.00 0.02 0.00 0.00 56.10 56.04 2orb s TRP 35 Cb 0.04 -1.00 -0.03 0.00 -1.15 0.00 0.00 33.47 31.33 2orb s TRP 35 CO -0.02 -0.02 -0.22 -0.06 0.02 0.00 0.00 176.95 176.65 2orb s PHE 36 N -0.44 1.87 -0.16 -1.98 0.40 0.14 -1.02 117.98 116.79 2orb s PHE 36 Ca 0.07 -0.40 -0.01 0.00 -0.60 0.00 0.00 56.93 55.99 2orb s PHE 36 Cb -0.07 -1.06 -0.01 0.00 0.51 0.00 0.00 43.02 42.40 2orb s PHE 36 CO -0.01 0.18 -0.13 -1.14 0.70 0.00 0.00 175.22 174.82 2orb s GLN 37 N -1.66 3.28 -0.19 0.44 0.74 0.21 -1.14 119.66 121.34 2orb s GLN 37 Ca 0.08 -0.71 -0.00 0.00 0.05 0.00 0.00 55.36 54.77 2orb s GLN 37 Cb -0.10 -2.69 0.05 0.00 1.10 0.00 0.00 33.01 31.37 2orb s GLN 37 CO 0.04 0.03 -0.06 -1.14 -0.55 0.00 0.00 175.29 173.60 2orb s GLN 38 N 0.81 1.58 0.16 1.67 0.74 0.17 -0.69 119.66 124.10 2orb s GLN 38 Ca -0.04 -0.71 -0.06 0.00 0.05 0.00 0.00 55.36 54.59 2orb s GLN 38 Cb -0.15 -2.26 -0.06 0.00 1.10 0.00 0.00 33.01 31.64 2orb s GLN 38 CO 0.00 -0.49 0.41 0.15 -0.55 0.00 0.00 175.29 174.82 2orb s LYS 39 N 1.53 3.67 0.28 1.67 1.02 -1.26 -1.21 119.74 125.44 2orb s LYS 39 Ca -0.02 0.01 -0.27 0.00 0.02 0.00 0.00 55.97 55.71 2orb s LYS 39 Cb -0.17 -2.82 -0.15 0.00 -0.52 0.00 0.00 37.83 34.18 2orb s LYS 39 CO -0.07 0.44 0.75 -0.35 -0.92 0.00 0.00 175.35 175.20 2orb n PRO 40 N 0.10 0.74 -0.59 -1.68 -0.04 -1.26 -1.30 135.00 130.96 2orb n PRO 40 Ca -0.02 0.26 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 2orb n PRO 40 Cb 0.52 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 2orb n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2orb n GLY 41 N 1.59 0.70 3.51 0.55 0.00 -1.26 -4.96 105.19 105.33 2orb n GLY 41 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.90 2orb n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2orb s GLN 42 N -0.40 1.81 0.60 1.61 -0.21 -0.42 -5.13 119.66 117.52 2orb s GLN 42 Ca 0.00 -1.62 -0.09 0.00 0.02 0.00 0.00 55.36 53.67 2orb s GLN 42 Cb 0.00 -1.90 -0.02 0.00 1.00 0.00 0.00 33.01 32.09 2orb s GLN 42 CO 0.00 0.36 0.97 -1.25 -2.12 0.00 0.00 175.29 173.25 2orb s PRO 43 N -3.35 3.37 0.67 2.91 0.04 -1.26 -4.56 135.00 132.82 2orb s PRO 43 Ca 0.28 0.48 -0.17 0.00 0.04 0.00 0.00 61.00 61.63 2orb s PRO 43 Cb -0.06 -2.16 0.00 0.00 0.04 0.00 0.00 34.50 32.32 2orb s PRO 43 CO 0.15 -0.58 1.28 -0.35 0.04 0.00 0.00 177.00 177.54 2orb n PRO 44 N -2.66 0.98 -4.90 0.56 -0.04 -1.26 -4.66 135.00 123.01 2orb n PRO 44 Ca 0.05 0.39 -0.26 0.00 -0.04 0.00 0.00 63.50 63.64 2orb n PRO 44 Cb 0.55 -2.52 -0.15 0.00 -0.04 0.00 0.00 33.50 31.34 2orb n PRO 44 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2orb s LYS 45 N -3.48 1.53 -0.12 0.54 2.20 0.13 -4.94 119.74 115.60 2orb s LYS 45 Ca 0.81 -0.70 -0.29 0.00 -0.36 0.00 0.00 55.97 55.43 2orb s LYS 45 Cb -0.37 -1.49 -0.03 0.00 -1.51 0.00 0.00 37.83 34.43 2orb s LYS 45 CO 0.42 0.41 1.48 -1.17 -0.36 0.00 0.00 175.35 176.12 2orb s LEU 46 N -0.50 4.21 -0.07 5.43 2.96 -1.26 -0.62 118.68 128.83 2orb s LEU 46 Ca 0.07 1.92 -0.06 0.00 -0.22 0.00 0.00 54.13 55.84 2orb s LEU 46 Cb -0.07 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.06 2orb s LEU 46 CO -0.01 -0.89 -0.11 0.18 -1.32 0.00 0.00 176.35 174.20 2orb n LEU 47 N 7.05 0.80 -4.12 -0.68 4.77 -0.19 -4.45 117.00 120.18 2orb n LEU 47 Ca 0.16 0.27 -0.23 0.00 -0.03 0.00 0.00 56.01 56.18 2orb n LEU 47 Cb 0.44 -0.63 -0.15 0.00 -2.33 0.00 0.00 43.42 40.75 2orb n LEU 47 CO 0.60 -0.44 -0.48 -0.63 -1.33 0.00 0.00 177.39 175.11 2orb s ILE 48 N -1.68 1.16 0.09 -0.08 -1.09 -1.01 0.98 121.20 119.57 2orb s ILE 48 Ca -0.10 -0.67 0.06 0.00 -2.23 0.00 0.00 60.65 57.72 2orb s ILE 48 Cb 0.01 -0.98 -0.03 0.00 -1.58 0.00 0.00 42.46 39.88 2orb s ILE 48 CO 0.14 0.30 -0.17 -0.72 -1.23 0.00 0.00 174.94 173.26 2orb s TYR 49 N -0.40 1.46 -1.67 3.97 -0.85 0.11 -0.33 117.35 119.64 2orb s TYR 49 Ca 0.05 -0.45 -0.02 0.00 -0.52 0.00 0.00 57.07 56.13 2orb s TYR 49 Cb -0.06 -0.80 0.00 0.00 0.38 0.00 0.00 41.96 41.48 2orb s TYR 49 CO -0.00 0.13 0.23 0.00 -1.52 0.00 0.00 175.55 174.38 2orb n ALA 50 N 1.11 -0.76 0.00 9.51 0.00 -0.77 -1.38 120.51 128.22 2orb n ALA 50 Ca -0.20 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2orb n ALA 50 Cb 0.54 -2.80 0.00 0.00 0.00 0.00 0.00 19.45 17.19 2orb n ALA 50 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 2orb n ILE 51 N -4.17 0.00 0.00 0.00 0.13 0.28 -4.33 119.36 111.27 2orb n ILE 51 Ca -0.19 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.46 2orb n ILE 51 Cb 0.66 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 39.46 2orb n ILE 51 CO 0.00 0.00 0.00 -1.54 2.80 0.00 0.00 176.55 177.81 2orb n SER 52 N 0.00 1.82 -4.65 9.51 3.41 -1.15 -3.31 113.62 119.24 2orb n SER 52 Ca 0.00 -0.03 -0.41 0.00 -0.26 0.00 0.00 58.87 58.16 2orb n SER 52 Cb 0.00 0.43 -0.05 0.00 -0.26 0.00 0.00 64.21 64.34 2orb n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2orb s ASN 53 N -0.80 6.82 0.38 4.04 0.01 -0.48 -4.61 114.94 120.31 2orb s ASN 53 Ca 0.00 1.02 -0.25 0.00 -0.71 0.00 0.00 52.86 52.92 2orb s ASN 53 Cb 0.00 -2.42 -0.09 0.00 0.41 0.00 0.00 41.25 39.15 2orb s ASN 53 CO 0.00 -0.42 1.07 -0.13 -1.51 0.00 0.00 177.10 176.11 2orb s ARG 54 N 2.42 4.22 0.40 -0.60 0.52 -1.26 0.07 118.95 124.70 2orb s ARG 54 Ca 0.34 1.60 -0.26 0.00 -0.52 0.00 0.00 55.73 56.89 2orb s ARG 54 Cb -0.16 -2.65 -0.09 0.00 0.52 0.00 0.00 34.95 32.57 2orb s ARG 54 CO 0.10 -0.11 1.19 0.20 0.02 0.00 0.00 175.30 176.69 2orb s GLY 55 N -1.41 2.89 -0.42 -3.53 0.00 0.28 -4.86 107.32 100.25 2orb s GLY 55 Ca 0.56 1.02 -0.32 0.00 0.00 0.00 0.00 44.72 45.97 2orb s GLY 55 CO 0.31 1.55 2.29 -1.14 0.00 0.00 0.00 173.10 176.11 2orb n SER 56 N 0.14 2.11 0.00 1.64 3.41 -1.26 0.42 113.62 120.08 2orb n SER 56 Ca 0.04 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.84 2orb n SER 56 Cb 0.46 -1.32 0.00 0.00 -0.26 0.00 0.00 64.21 63.09 2orb n SER 56 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2orb n GLY 57 N 6.36 1.70 3.73 5.00 0.00 -1.26 -5.10 105.19 115.62 2orb n GLY 57 Ca 0.42 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.03 2orb n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2orb s VAL 58 N -2.04 4.26 0.71 1.61 1.01 0.17 -5.04 120.40 121.09 2orb s VAL 58 Ca 0.00 1.88 -0.11 0.00 0.00 0.00 0.00 61.98 63.76 2orb s VAL 58 Cb 0.00 -4.20 0.02 0.00 0.00 0.00 0.00 36.38 32.20 2orb s VAL 58 CO 0.00 0.29 1.07 -2.16 0.00 0.00 0.00 175.10 174.30 2orb s PRO 59 N -0.05 2.77 0.64 2.72 0.04 -1.26 -4.85 135.00 135.01 2orb s PRO 59 Ca 0.48 1.02 0.39 0.00 0.04 0.00 0.00 61.00 62.94 2orb s PRO 59 Cb -0.26 -1.97 2.21 0.00 0.04 0.00 0.00 34.50 34.52 2orb s PRO 59 CO 0.31 -1.23 2.33 0.00 0.04 0.00 0.00 177.00 178.45 2orb h ALA 60 N -0.79 1.20 -1.26 8.56 0.00 -1.98 -2.79 119.26 122.20 2orb h ALA 60 Ca -0.44 -0.00 0.37 0.00 0.00 0.00 0.00 54.91 54.84 2orb h ALA 60 Cb 1.22 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 2orb h ALA 60 CO 0.55 -0.01 0.91 0.00 0.00 0.00 0.00 179.25 180.70 2orb h ARG 61 N 0.00 0.00 -6.12 0.00 3.08 -1.92 -3.41 114.38 106.01 2orb h ARG 61 Ca 0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.48 2orb h ARG 61 Cb 0.02 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.02 2orb h ARG 61 CO -0.00 0.00 -0.53 -0.06 -1.07 0.00 0.00 179.97 178.31 2orb s PHE 62 N -4.93 3.29 -0.21 3.04 0.40 -1.05 -0.85 117.98 117.68 2orb s PHE 62 Ca -0.05 0.06 -0.29 0.00 -0.60 0.00 0.00 56.93 56.04 2orb s PHE 62 Cb 0.23 -1.59 0.15 0.00 0.51 0.00 0.00 43.02 42.32 2orb s PHE 62 CO 0.81 0.52 1.11 -1.54 0.70 0.00 0.00 175.22 176.82 2orb s SER 63 N -3.04 -0.28 0.17 1.36 1.04 -0.43 -4.97 113.70 107.55 2orb s SER 63 Ca 0.32 0.33 0.07 0.00 0.48 0.00 0.00 55.95 57.15 2orb s SER 63 Cb -0.11 0.26 -0.04 0.00 0.10 0.00 0.00 66.02 66.23 2orb s SER 63 CO 0.25 -0.24 -0.14 -0.83 0.98 0.00 0.00 173.24 173.26 2orb s GLY 64 N -0.95 1.29 0.17 7.32 0.00 -1.25 0.86 107.32 114.76 2orb s GLY 64 Ca 0.02 -1.53 -0.03 0.00 0.00 0.00 0.00 44.72 43.17 2orb s GLY 64 CO -0.02 -1.62 0.29 -1.14 0.00 0.00 0.00 173.10 170.61 2orb n SER 65 N -0.07 -0.82 0.00 1.64 3.41 -0.53 -4.35 113.62 112.90 2orb n SER 65 Ca -0.11 -1.81 0.00 0.00 -0.26 0.00 0.00 58.87 56.69 2orb n SER 65 Cb 0.59 1.43 0.00 0.00 -0.26 0.00 0.00 64.21 65.97 2orb n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2orb n GLY 66 N -0.26 -0.78 0.00 5.00 0.00 -1.26 -1.88 105.19 106.00 2orb n GLY 66 Ca -0.02 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.84 2orb n GLY 66 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2orb n SER 67 N 0.00 0.00 0.00 1.61 3.41 -1.21 -5.00 113.62 112.43 2orb n SER 67 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2orb n SER 67 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2orb n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2orb n GLY 68 N -0.36 1.65 0.11 5.00 0.00 -1.26 -4.10 105.19 106.21 2orb n GLY 68 Ca 0.00 -0.40 -0.19 0.00 0.00 0.00 0.00 46.02 45.43 2orb n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2orb n THR 69 N 0.00 1.50 -4.22 2.61 -2.24 -1.26 -4.35 114.28 106.32 2orb n THR 69 Ca 0.00 -0.05 -0.30 0.00 -2.27 0.00 0.00 64.05 61.42 2orb n THR 69 Cb 0.00 -2.12 -0.09 0.00 -2.10 0.00 0.00 70.33 66.02 2orb n THR 69 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2orb s ASP 70 N -6.66 4.71 0.28 3.42 1.47 -1.26 -1.69 116.67 116.95 2orb s ASP 70 Ca -0.29 -0.26 0.04 0.00 1.18 0.00 0.00 52.55 53.22 2orb s ASP 70 Cb 0.07 -1.03 -0.01 0.00 -0.34 0.00 0.00 42.92 41.61 2orb s ASP 70 CO 0.46 0.19 0.13 0.49 0.68 0.00 0.00 175.17 177.13 2orb n PHE 71 N 0.79 -0.09 -3.52 2.11 3.01 -0.59 -3.34 117.46 115.83 2orb n PHE 71 Ca -0.13 -1.96 -0.17 0.00 1.01 0.00 0.00 57.45 56.21 2orb n PHE 71 Cb 0.52 0.06 -0.05 0.00 -0.01 0.00 0.00 39.48 39.99 2orb n PHE 71 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2orb s SER 72 N -2.81 -0.60 -0.12 4.37 1.04 -0.79 -2.21 113.70 112.58 2orb s SER 72 Ca 0.19 0.53 -0.05 0.00 0.48 0.00 0.00 55.95 57.10 2orb s SER 72 Cb 0.01 0.53 -0.04 0.00 0.10 0.00 0.00 66.02 66.62 2orb s SER 72 CO 0.13 -0.66 0.07 -0.22 0.98 0.00 0.00 173.24 173.54 2orb s LEU 73 N -1.49 3.95 -0.08 2.42 0.20 -0.20 -1.45 118.68 122.03 2orb s LEU 73 Ca -0.09 0.26 0.01 0.00 0.69 0.00 0.00 54.13 55.00 2orb s LEU 73 Cb -0.00 -1.95 0.02 0.00 -0.43 0.00 0.00 46.19 43.82 2orb s LEU 73 CO 0.05 0.35 -0.11 0.20 -0.29 0.00 0.00 176.35 176.55 2orb s ASN 74 N -0.67 1.90 -0.13 3.68 -0.87 0.25 -1.68 114.94 117.42 2orb s ASN 74 Ca 0.12 -0.30 0.01 0.00 -1.57 0.00 0.00 52.86 51.12 2orb s ASN 74 Cb -0.12 -0.84 -0.01 0.00 -0.02 0.00 0.00 41.25 40.27 2orb s ASN 74 CO 0.02 -0.01 -0.18 -0.63 -2.57 0.00 0.00 177.10 173.74 2orb s ILE 75 N 0.97 2.58 -0.30 0.60 1.01 0.21 -1.31 121.20 124.95 2orb s ILE 75 Ca -0.09 -0.82 -0.15 0.00 0.00 0.00 0.00 60.65 59.59 2orb s ILE 75 Cb -0.15 -2.05 0.17 0.00 0.01 0.00 0.00 42.46 40.44 2orb s ILE 75 CO 0.00 0.54 1.02 -2.28 0.00 0.00 0.00 174.94 174.21 2orb s HIS 76 N 0.47 -0.62 0.36 3.97 2.46 -0.03 0.14 115.29 122.04 2orb s HIS 76 Ca -0.12 0.98 -0.26 0.00 0.47 0.00 0.00 55.06 56.13 2orb s HIS 76 Cb -0.16 0.34 -0.09 0.00 -0.13 0.00 0.00 32.58 32.53 2orb s HIS 76 CO 0.05 -0.31 1.05 -2.14 -2.47 0.00 0.00 174.74 170.92 2orb s PRO 77 N 2.50 4.34 0.07 2.88 0.02 -1.26 -4.57 135.00 138.98 2orb s PRO 77 Ca -0.01 1.57 -0.30 0.00 0.02 0.00 0.00 61.00 62.27 2orb s PRO 77 Cb -0.06 -2.75 -0.05 0.00 0.02 0.00 0.00 34.50 31.65 2orb s PRO 77 CO -0.16 0.01 1.12 0.08 -0.33 0.00 0.00 177.00 177.72 2orb s VAL 78 N -1.51 4.21 0.47 3.83 1.01 -0.65 -4.84 120.40 122.91 2orb s VAL 78 Ca 0.53 1.64 0.06 0.00 0.00 0.00 0.00 61.98 64.21 2orb s VAL 78 Cb -0.24 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.07 2orb s VAL 78 CO 0.31 0.16 0.23 -1.61 0.00 0.00 0.00 175.10 174.19 2orb s GLU 79 N 0.75 2.24 0.41 2.72 2.02 -1.26 -0.91 118.70 124.68 2orb s GLU 79 Ca 0.55 -1.97 0.10 0.00 0.02 0.00 0.00 54.97 53.67 2orb s GLU 79 Cb -0.27 -1.97 0.92 0.00 0.10 0.00 0.00 34.13 32.91 2orb s GLU 79 CO 0.30 -0.31 2.01 0.93 0.02 0.00 0.00 175.26 178.21 2orb h GLU 80 N 1.19 0.50 -0.07 1.61 5.08 -1.96 -2.33 114.58 118.60 2orb h GLU 80 Ca -0.41 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 2orb h GLU 80 Cb 1.28 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.42 2orb h GLU 80 CO 0.66 0.33 0.00 -3.47 -1.00 0.00 0.00 179.01 175.53 2orb n ASP 81 N -4.47 0.56 0.04 1.42 2.03 -1.26 -4.27 116.55 110.59 2orb n ASP 81 Ca 0.07 -1.68 -0.01 0.00 0.52 0.00 0.00 54.79 53.68 2orb n ASP 81 Cb 0.21 -0.05 -0.08 0.00 -0.72 0.00 0.00 41.12 40.49 2orb n ASP 81 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2orb h ASP 82 N 0.69 0.00 -1.60 1.67 3.32 -1.79 -3.47 116.42 115.24 2orb h ASP 82 Ca 0.00 0.00 -0.71 0.00 0.02 0.00 0.00 57.03 56.34 2orb h ASP 82 Cb 0.15 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.74 2orb h ASP 82 CO 0.00 0.65 0.60 -0.81 -1.72 0.00 0.00 179.24 177.96 2orb n PRO 83 N -2.99 1.09 -1.32 3.56 -0.04 -1.26 -4.84 135.00 129.20 2orb n PRO 83 Ca -0.08 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 2orb n PRO 83 Cb 0.86 -2.05 0.00 0.00 -0.04 0.00 0.00 33.50 32.27 2orb n PRO 83 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2orb n ALA 84 N 3.53 0.00 -2.98 0.55 0.00 -0.48 -4.89 120.51 116.24 2orb n ALA 84 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.32 2orb n ALA 84 Cb 0.16 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.49 2orb n ALA 84 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2orb s MET 85 N -1.18 3.68 -0.08 0.00 -1.94 -0.35 0.46 119.30 119.89 2orb s MET 85 Ca 0.00 -0.51 0.05 0.00 -1.71 0.00 0.00 55.69 53.52 2orb s MET 85 Cb 0.00 -2.97 -0.01 0.00 2.01 0.00 0.00 34.83 33.86 2orb s MET 85 CO 0.00 0.19 -0.23 0.71 -0.01 0.00 0.00 175.02 175.68 2orb s TYR 86 N 0.50 2.54 0.04 -0.03 1.51 0.66 0.43 117.35 123.01 2orb s TYR 86 Ca -0.02 -0.83 0.05 0.00 -1.01 0.00 0.00 57.07 55.25 2orb s TYR 86 Cb -0.14 -1.67 -0.02 0.00 -0.11 0.00 0.00 41.96 40.02 2orb s TYR 86 CO 0.02 -0.29 -0.14 -0.06 -1.11 0.00 0.00 175.55 173.98 2orb s PHE 87 N 0.07 1.18 0.15 2.71 0.40 -0.29 -0.34 117.98 121.86 2orb s PHE 87 Ca -0.10 -0.37 0.04 0.00 -0.60 0.00 0.00 56.93 55.90 2orb s PHE 87 Cb -0.16 -0.70 -0.04 0.00 0.51 0.00 0.00 43.02 42.64 2orb s PHE 87 CO 0.06 0.03 0.15 0.00 0.70 0.00 0.00 175.22 176.17 2orb s GLN 89 N -3.02 0.33 -0.19 0.00 0.74 0.14 0.13 119.66 117.80 2orb s GLN 89 Ca 0.31 -0.57 -0.02 0.00 0.05 0.00 0.00 55.36 55.14 2orb s GLN 89 Cb -0.11 -0.02 -0.00 0.00 1.10 0.00 0.00 33.01 33.98 2orb s GLN 89 CO 0.24 -0.02 -0.10 -1.14 -0.55 0.00 0.00 175.29 173.73 2orb s GLN 90 N -1.29 3.31 0.00 1.67 -0.44 0.12 -1.71 119.66 121.32 2orb s GLN 90 Ca -0.12 -0.68 0.01 0.00 -2.50 0.00 0.00 55.36 52.07 2orb s GLN 90 Cb -0.09 -2.82 0.01 0.00 -1.64 0.00 0.00 33.01 28.47 2orb s GLN 90 CO -0.01 -0.09 0.58 0.25 0.50 0.00 0.00 175.29 176.53 2orb n THR 91 N 4.41 0.09 -0.30 -0.34 -2.24 -1.07 -2.50 114.28 112.32 2orb n THR 91 Ca -0.19 -0.55 0.03 0.00 -2.27 0.00 0.00 64.05 61.07 2orb n THR 91 Cb 0.51 0.98 0.10 0.00 -2.10 0.00 0.00 70.33 69.82 2orb n THR 91 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2orb h LYS 92 N 0.23 -0.01 -2.63 -0.78 3.64 -1.91 -3.43 116.57 111.69 2orb h LYS 92 Ca 0.00 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 2orb h LYS 92 Cb 0.09 0.00 -0.18 0.00 -0.41 0.00 0.00 32.23 31.74 2orb h LYS 92 CO 0.00 -0.01 0.01 -1.83 -2.27 0.00 0.00 179.45 175.35 2orb s GLU 93 N -6.22 0.96 0.36 1.90 -1.05 -1.26 -5.06 118.70 108.34 2orb s GLU 93 Ca -0.15 -0.10 -0.28 0.00 -0.15 0.00 0.00 54.97 54.30 2orb s GLU 93 Cb 0.23 0.44 -0.11 0.00 -0.44 0.00 0.00 34.13 34.26 2orb s GLU 93 CO 0.76 -0.32 1.41 0.08 0.95 0.00 0.00 175.26 178.14 2orb s VAL 94 N -1.86 2.33 0.15 1.83 1.01 -1.26 -3.71 120.40 118.88 2orb s VAL 94 Ca -0.09 0.33 -0.25 0.00 0.00 0.00 0.00 61.98 61.97 2orb s VAL 94 Cb -0.01 -3.21 -0.08 0.00 0.00 0.00 0.00 36.38 33.08 2orb s VAL 94 CO 0.03 0.08 0.77 -2.16 0.00 0.00 0.00 175.10 173.82 2orb s PRO 95 N -1.99 4.56 0.36 2.72 0.04 -1.26 -4.91 135.00 134.51 2orb s PRO 95 Ca 0.51 1.15 -0.28 0.00 0.04 0.00 0.00 61.00 62.42 2orb s PRO 95 Cb -0.44 -3.27 -0.10 0.00 0.04 0.00 0.00 34.50 30.73 2orb s PRO 95 CO 0.59 0.55 1.35 -1.58 0.04 0.00 0.00 177.00 177.95 2orb s TRP 96 N -1.05 2.88 0.16 0.56 0.51 -1.24 -4.76 118.94 115.99 2orb s TRP 96 Ca 0.36 1.35 0.05 0.00 -2.12 0.00 0.00 56.10 55.74 2orb s TRP 96 Cb -0.23 -3.77 -0.04 0.00 -0.81 0.00 0.00 33.47 28.62 2orb s TRP 96 CO 0.26 -2.21 -0.11 0.95 -0.51 0.00 0.00 176.95 175.33 2orb s THR 97 N -1.16 1.28 0.16 2.01 -4.23 -1.04 -4.99 115.64 107.67 2orb s THR 97 Ca 0.51 -2.06 0.11 0.00 -1.18 0.00 0.00 61.69 59.07 2orb s THR 97 Cb -0.41 -1.86 -0.04 0.00 1.34 0.00 0.00 72.50 71.53 2orb s THR 97 CO 0.55 -0.70 -0.24 -0.36 -0.54 0.00 0.00 174.62 173.33 2orb s PHE 98 N -3.19 2.34 0.89 3.99 0.40 -1.26 -0.71 117.98 120.45 2orb s PHE 98 Ca 0.17 -0.35 -0.12 0.00 -0.60 0.00 0.00 56.93 56.03 2orb s PHE 98 Cb 0.01 -1.20 0.13 0.00 0.51 0.00 0.00 43.02 42.47 2orb s PHE 98 CO 0.02 0.43 1.10 0.20 0.70 0.00 0.00 175.22 177.66 2orb s GLY 99 N -2.40 1.61 0.41 4.36 0.00 0.12 -4.61 107.32 106.80 2orb s GLY 99 Ca 0.18 -0.18 0.29 0.00 0.00 0.00 0.00 44.72 45.01 2orb s GLY 99 CO 0.09 0.33 1.87 -1.33 0.00 0.00 0.00 173.10 174.05 2orb h GLY 100 N -1.51 0.00 0.00 0.20 0.00 -1.90 -3.44 103.07 96.43 2orb h GLY 100 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 2orb h GLY 100 CO 0.57 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.72 2orb n GLY 101 N -0.43 1.39 2.88 4.60 0.00 -1.26 -5.07 105.19 107.31 2orb n GLY 101 Ca 0.00 -1.53 -0.20 0.00 0.00 0.00 0.00 46.02 44.29 2orb n GLY 101 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2orb s THR 102 N -1.28 0.52 -0.24 2.61 -1.32 0.54 -4.84 115.64 111.63 2orb s THR 102 Ca 0.00 -0.10 -0.21 0.00 -1.21 0.00 0.00 61.69 60.17 2orb s THR 102 Cb 0.00 -0.55 -0.02 0.00 -1.51 0.00 0.00 72.50 70.42 2orb s THR 102 CO 0.00 0.22 0.66 -0.75 -2.21 0.00 0.00 174.62 172.55 2orb s LYS 103 N 0.98 4.15 -0.24 7.08 2.20 -0.11 -0.24 119.74 133.56 2orb s LYS 103 Ca -0.10 0.64 -0.13 0.00 -0.36 0.00 0.00 55.97 56.02 2orb s LYS 103 Cb -0.14 -3.63 -0.05 0.00 -1.51 0.00 0.00 37.83 32.50 2orb s LYS 103 CO -0.00 -0.38 0.26 -1.17 -0.36 0.00 0.00 175.35 173.70 2orb s LEU 104 N 2.39 4.11 -0.06 5.43 2.96 0.17 -0.00 118.68 133.68 2orb s LEU 104 Ca 0.28 0.24 0.05 0.00 -0.22 0.00 0.00 54.13 54.49 2orb s LEU 104 Cb -0.16 -2.27 -0.01 0.00 0.50 0.00 0.00 46.19 44.25 2orb s LEU 104 CO 0.09 -0.02 -0.24 -1.61 -1.32 0.00 0.00 176.35 173.25 2orb s GLU 105 N 1.33 2.63 0.54 1.98 2.02 0.73 -1.38 118.70 126.57 2orb s GLU 105 Ca 0.12 -0.88 -0.12 0.00 0.02 0.00 0.00 54.97 54.11 2orb s GLU 105 Cb -0.14 -2.21 -0.06 0.00 0.10 0.00 0.00 34.13 31.82 2orb s GLU 105 CO 0.07 0.37 0.96 0.42 0.02 0.00 0.00 175.26 177.10 2orb s ILE 106 N -0.13 4.68 -0.10 -1.63 -1.09 -1.26 -1.52 121.20 120.15 2orb s ILE 106 Ca -0.04 0.89 0.01 0.00 -2.23 0.00 0.00 60.65 59.27 2orb s ILE 106 Cb -0.14 -3.80 -0.02 0.00 -1.58 0.00 0.00 42.46 36.92 2orb s ILE 106 CO 0.04 -0.89 -0.12 -0.54 -1.23 0.00 0.00 174.94 172.20 2orb s LYS 107 N -4.60 3.08 0.22 2.79 1.02 -0.99 -4.74 119.74 116.52 2orb s LYS 107 Ca 0.55 -0.67 0.03 0.00 0.02 0.00 0.00 55.97 55.91 2orb s LYS 107 Cb -0.10 -2.57 -0.01 0.00 -0.52 0.00 0.00 37.83 34.63 2orb s LYS 107 CO 0.43 0.38 0.22 2.89 -0.92 0.00 0.00 175.35 178.35 2orb n ARG 108 N 3.05 0.32 -1.77 1.68 1.85 -1.26 -4.25 116.66 116.28 2orb n ARG 108 Ca -0.18 -2.07 -0.32 0.00 -1.00 0.00 0.00 57.85 54.28 2orb n ARG 108 Cb 0.53 1.77 0.04 0.00 -1.05 0.00 0.00 32.46 33.75 2orb n ARG 108 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2orb s ALA 109 N -2.73 2.56 0.69 2.89 0.00 -1.26 -4.96 121.76 118.95 2orb s ALA 109 Ca 0.24 0.41 -0.17 0.00 0.00 0.00 0.00 51.96 52.44 2orb s ALA 109 Cb 0.01 -3.27 0.02 0.00 0.00 0.00 0.00 23.12 19.88 2orb s ALA 109 CO 0.17 -1.18 1.26 -0.51 0.00 0.00 0.00 175.76 175.51 2orb s ASP 110 N -2.88 4.33 -0.12 0.00 1.01 -1.26 -4.81 116.67 112.94 2orb s ASP 110 Ca 0.64 2.53 -0.06 0.00 0.71 0.00 0.00 52.55 56.37 2orb s ASP 110 Cb -0.18 -2.61 0.05 0.00 1.01 0.00 0.00 42.92 41.20 2orb s ASP 110 CO 0.43 -2.18 0.27 0.00 0.21 0.00 0.00 175.17 173.90 2orb s ALA 111 N -1.65 -0.61 0.37 5.23 0.00 -0.15 -4.90 121.76 120.05 2orb s ALA 111 Ca 0.79 1.04 -0.25 0.00 0.00 0.00 0.00 51.96 53.55 2orb s ALA 111 Cb -0.34 -0.75 -0.09 0.00 0.00 0.00 0.00 23.12 21.94 2orb s ALA 111 CO 0.43 -0.30 1.05 0.00 0.00 0.00 0.00 175.76 176.94 2orb s ALA 112 N 1.52 3.15 0.43 0.00 0.00 -1.26 -1.25 121.76 124.35 2orb s ALA 112 Ca -0.07 0.73 -0.22 0.00 0.00 0.00 0.00 51.96 52.39 2orb s ALA 112 Cb -0.11 -3.28 -0.09 0.00 0.00 0.00 0.00 23.12 19.65 2orb s ALA 112 CO -0.09 -0.19 1.04 -1.25 0.00 0.00 0.00 175.76 175.27 2orb s PRO 113 N -2.28 4.03 -0.37 0.00 0.04 -1.26 -4.52 135.00 130.64 2orb s PRO 113 Ca 0.55 1.44 -0.21 0.00 0.04 0.00 0.00 61.00 62.83 2orb s PRO 113 Cb -0.24 -2.36 0.01 0.00 0.04 0.00 0.00 34.50 31.95 2orb s PRO 113 CO 0.30 -0.25 0.64 0.99 0.04 0.00 0.00 177.00 178.72 2orb s THR 114 N -1.80 4.88 -0.16 1.26 2.01 -0.27 -4.84 115.64 116.72 2orb s THR 114 Ca 0.62 0.53 -0.10 0.00 0.31 0.00 0.00 61.69 63.05 2orb s THR 114 Cb -0.19 -4.10 -0.05 0.00 0.01 0.00 0.00 72.50 68.17 2orb s THR 114 CO 0.24 -0.36 0.17 -0.69 -0.69 0.00 0.00 174.62 173.30 2orb s VAL 115 N 2.74 5.41 -0.06 3.82 1.01 -1.26 -1.88 120.40 130.18 2orb s VAL 115 Ca 0.24 0.28 0.01 0.00 0.00 0.00 0.00 61.98 62.51 2orb s VAL 115 Cb -0.14 -3.48 0.02 0.00 0.00 0.00 0.00 36.38 32.78 2orb s VAL 115 CO 0.15 0.51 -0.08 -0.44 0.00 0.00 0.00 175.10 175.24 2orb s SER 116 N -0.21 1.48 -0.07 3.32 0.01 -0.43 -4.97 113.70 112.83 2orb s SER 116 Ca 0.12 -0.22 -0.01 0.00 1.31 0.00 0.00 55.95 57.16 2orb s SER 116 Cb -0.12 -0.65 -0.03 0.00 0.21 0.00 0.00 66.02 65.43 2orb s SER 116 CO 0.02 -0.04 -0.02 -0.51 0.41 0.00 0.00 173.24 173.10 2orb s ILE 117 N 0.98 4.12 -0.07 1.44 2.07 -1.26 -0.64 121.20 127.84 2orb s ILE 117 Ca -0.09 -0.36 0.02 0.00 -1.41 0.00 0.00 60.65 58.81 2orb s ILE 117 Cb -0.15 -2.73 0.01 0.00 0.13 0.00 0.00 42.46 39.73 2orb s ILE 117 CO 0.00 0.57 -0.13 -0.36 -1.91 0.00 0.00 174.94 173.12 2orb s PHE 118 N -0.89 1.55 0.76 3.50 0.40 0.28 -4.98 117.98 118.59 2orb s PHE 118 Ca 0.14 -0.60 -0.11 0.00 -0.60 0.00 0.00 56.93 55.76 2orb s PHE 118 Cb -0.11 -1.13 0.05 0.00 0.51 0.00 0.00 43.02 42.33 2orb s PHE 118 CO 0.03 -0.31 1.08 -2.14 0.70 0.00 0.00 175.22 174.58 2orb s PRO 119 N 0.73 2.38 0.34 0.24 0.02 -1.26 -1.62 135.00 135.83 2orb s PRO 119 Ca -0.13 0.74 -0.29 0.00 0.02 0.00 0.00 61.00 61.35 2orb s PRO 119 Cb -0.16 -1.94 -0.11 0.00 0.02 0.00 0.00 34.50 32.31 2orb s PRO 119 CO 0.03 -1.44 1.43 -2.14 -0.33 0.00 0.00 177.00 174.55 2orb s PRO 120 N -5.12 4.21 0.69 5.54 0.02 -1.21 -4.79 135.00 134.34 2orb s PRO 120 Ca 0.60 2.42 -0.13 0.00 0.02 0.00 0.00 61.00 63.91 2orb s PRO 120 Cb -0.14 -3.03 0.01 0.00 0.02 0.00 0.00 34.50 31.37 2orb s PRO 120 CO 0.54 -0.41 1.09 -1.54 -0.33 0.00 0.00 177.00 176.35 2orb s SER 121 N -0.14 5.06 0.40 2.53 1.04 -1.26 -4.90 113.70 116.43 2orb s SER 121 Ca 0.53 1.86 0.07 0.00 0.48 0.00 0.00 55.95 58.90 2orb s SER 121 Cb -0.44 -2.53 0.83 0.00 0.10 0.00 0.00 66.02 63.98 2orb s SER 121 CO 0.56 -1.66 2.02 0.77 0.98 0.00 0.00 173.24 175.91 2orb h SER 122 N -0.38 0.43 -0.34 7.02 4.64 -1.99 -2.64 113.55 120.29 2orb h SER 122 Ca -0.45 -0.03 0.02 0.00 -0.47 0.00 0.00 61.79 60.86 2orb h SER 122 Cb 1.23 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 63.19 2orb h SER 122 CO 0.54 0.36 0.19 -0.33 -0.87 0.00 0.00 176.83 176.72 2orb h GLU 123 N 0.49 0.37 -0.52 4.77 3.07 -1.98 -1.18 114.58 119.61 2orb h GLU 123 Ca 0.13 -0.02 -0.09 0.00 -0.50 0.00 0.00 59.36 58.88 2orb h GLU 123 Cb 0.04 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 27.84 2orb h GLU 123 CO -0.02 0.25 -0.03 0.37 -1.40 0.00 0.00 179.01 178.18 2orb h GLN 124 N 0.38 0.89 -0.78 2.33 4.15 -1.76 -2.74 115.11 117.58 2orb h GLN 124 Ca 0.14 -0.27 -0.01 0.00 0.77 0.00 0.00 58.65 59.28 2orb h GLN 124 Cb 0.02 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 27.59 2orb h GLN 124 CO -0.08 0.90 0.45 -0.07 -1.93 0.00 0.00 178.83 178.10 2orb h LEU 125 N 0.82 0.95 -1.97 -2.39 -0.00 -1.11 -1.64 115.31 109.97 2orb h LEU 125 Ca 0.15 -0.07 -0.02 0.00 -0.00 0.00 0.00 57.88 57.94 2orb h LEU 125 Cb 0.53 -0.24 -0.00 0.00 -0.00 0.00 0.00 40.66 40.94 2orb h LEU 125 CO 0.03 0.75 -0.09 0.74 -0.00 0.00 0.00 178.44 179.86 2orb h THR 126 N 1.08 0.45 -0.63 0.22 2.02 -0.92 -1.97 112.91 113.17 2orb h THR 126 Ca 0.28 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.98 2orb h THR 126 Cb -0.01 1.33 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 2orb h THR 126 CO -0.05 0.09 0.00 -1.20 0.37 0.00 0.00 175.52 174.73 2orb n SER 127 N -3.53 4.24 0.00 4.18 7.64 -0.68 -4.93 113.62 120.53 2orb n SER 127 Ca -0.02 -2.29 0.00 0.00 1.01 0.00 0.00 58.87 57.57 2orb n SER 127 Cb 0.23 -0.53 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 2orb n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2orb n GLY 128 N 1.24 0.79 3.59 0.23 0.00 -0.74 -5.05 105.19 105.26 2orb n GLY 128 Ca 0.24 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.99 2orb n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2orb s GLY 129 N -1.87 1.72 -0.29 -0.02 0.00 -0.81 -1.49 107.32 104.56 2orb s GLY 129 Ca 0.00 -1.48 -0.01 0.00 0.00 0.00 0.00 44.72 43.24 2orb s GLY 129 CO 0.00 -1.50 0.27 0.00 0.00 0.00 0.00 173.10 171.87 2orb s ALA 130 N -1.78 -0.25 -0.19 3.20 0.00 -0.20 -2.90 121.76 119.63 2orb s ALA 130 Ca 0.26 -0.50 -0.07 0.00 0.00 0.00 0.00 51.96 51.65 2orb s ALA 130 Cb -0.09 -1.74 -0.04 0.00 0.00 0.00 0.00 23.12 21.26 2orb s ALA 130 CO 0.16 -1.72 0.05 -1.12 0.00 0.00 0.00 175.76 173.13 2orb s SER 131 N 2.26 5.42 -0.21 0.00 0.01 -1.26 0.64 113.70 120.56 2orb s SER 131 Ca 0.10 -0.01 -0.07 0.00 1.31 0.00 0.00 55.95 57.28 2orb s SER 131 Cb -0.14 -1.93 -0.03 0.00 0.21 0.00 0.00 66.02 64.12 2orb s SER 131 CO -0.32 0.13 0.05 -0.69 0.41 0.00 0.00 173.24 172.82 2orb s VAL 132 N 0.65 4.40 -0.01 3.43 1.01 0.27 -3.33 120.40 126.83 2orb s VAL 132 Ca 0.03 -0.16 0.03 0.00 0.00 0.00 0.00 61.98 61.88 2orb s VAL 132 Cb -0.13 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 2orb s VAL 132 CO 0.02 0.40 -0.08 -0.69 0.00 0.00 0.00 175.10 174.75 2orb s VAL 133 N 1.02 3.57 -0.03 2.92 1.01 -0.64 -1.10 120.40 127.15 2orb s VAL 133 Ca 0.03 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.27 2orb s VAL 133 Cb -0.14 -2.53 0.02 0.00 0.00 0.00 0.00 36.38 33.73 2orb s VAL 133 CO 0.03 0.43 -0.02 0.00 0.00 0.00 0.00 175.10 175.54 2orb s PHE 135 N 0.92 2.76 -0.33 0.00 0.08 0.19 -1.12 117.98 120.48 2orb s PHE 135 Ca -0.11 -0.37 0.04 0.00 0.12 0.00 0.00 56.93 56.61 2orb s PHE 135 Cb -0.14 -1.73 0.10 0.00 -0.57 0.00 0.00 43.02 40.68 2orb s PHE 135 CO -0.01 0.01 0.03 -0.51 -0.10 0.00 0.00 175.22 174.65 2orb s LEU 136 N -0.24 4.55 0.03 -0.37 1.02 0.31 -1.31 118.68 122.67 2orb s LEU 136 Ca 0.01 -2.06 0.01 0.00 0.02 0.00 0.00 54.13 52.12 2orb s LEU 136 Cb -0.13 -1.60 -0.04 0.00 0.02 0.00 0.00 46.19 44.44 2orb s LEU 136 CO 0.03 -0.36 0.06 0.20 0.02 0.00 0.00 176.35 176.30 2orb s ASN 137 N 0.94 5.51 -1.22 2.29 0.02 -0.79 0.61 114.94 122.30 2orb s ASN 137 Ca 0.09 0.05 -0.07 0.00 -1.02 0.00 0.00 52.86 51.91 2orb s ASN 137 Cb -0.19 -1.51 -0.01 0.00 0.02 0.00 0.00 41.25 39.55 2orb s ASN 137 CO -0.08 0.23 0.75 0.59 0.02 0.00 0.00 177.10 178.62 2orb n ASN 138 N 0.93 -3.26 -4.87 -1.22 4.13 -0.42 -1.12 115.26 109.43 2orb n ASN 138 Ca -0.12 -0.87 -0.28 0.00 1.68 0.00 0.00 54.58 55.00 2orb n ASN 138 Cb 0.52 -4.01 -0.02 0.00 -1.54 0.00 0.00 39.78 34.72 2orb n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 2orb s PHE 139 N -3.57 1.69 -0.29 3.10 -0.71 0.31 -4.54 117.98 113.96 2orb s PHE 139 Ca 0.22 -0.87 -0.24 0.00 -1.04 0.00 0.00 56.93 55.00 2orb s PHE 139 Cb -0.06 -1.83 0.15 0.00 -1.21 0.00 0.00 43.02 40.07 2orb s PHE 139 CO 0.82 -0.29 1.18 -0.47 -1.34 0.00 0.00 175.22 175.12 2orb s TYR 140 N -2.80 -0.32 1.18 3.49 6.14 -0.38 -0.46 117.35 124.20 2orb s TYR 140 Ca 0.26 0.75 -0.18 0.00 0.64 0.00 0.00 57.07 58.54 2orb s TYR 140 Cb -0.01 0.39 0.27 0.00 0.42 0.00 0.00 41.96 43.03 2orb s TYR 140 CO 0.16 -0.15 1.09 -1.25 0.64 0.00 0.00 175.55 176.04 2orb s PRO 141 N 0.31 -1.02 0.25 4.97 0.04 -1.26 -0.98 135.00 137.30 2orb s PRO 141 Ca 0.03 0.09 -0.03 0.00 0.04 0.00 0.00 61.00 61.13 2orb s PRO 141 Cb -0.05 -1.61 0.29 0.00 0.04 0.00 0.00 34.50 33.18 2orb s PRO 141 CO -0.11 -3.61 1.75 -0.22 0.04 0.00 0.00 177.00 174.85 2orb h LYS 142 N -2.51 0.85 -6.26 4.56 3.64 -1.99 -3.42 116.57 111.44 2orb h LYS 142 Ca -0.48 -0.23 -0.55 0.00 -1.27 0.00 0.00 60.65 58.13 2orb h LYS 142 Cb 1.31 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 2orb h LYS 142 CO 0.39 0.84 1.00 0.34 -2.27 0.00 0.00 179.45 179.75 2orb s ASP 143 N -6.62 6.76 -0.14 4.20 -1.08 -1.26 -4.96 116.67 113.57 2orb s ASP 143 Ca -0.10 2.10 -0.26 0.00 -0.52 0.00 0.00 52.55 53.76 2orb s ASP 143 Cb 0.15 -2.54 0.06 0.00 -1.46 0.00 0.00 42.92 39.13 2orb s ASP 143 CO 0.82 -0.85 0.65 -0.51 0.52 0.00 0.00 175.17 175.79 2orb s ILE 144 N 3.61 0.00 -0.05 4.11 2.07 -1.26 -4.73 121.20 124.95 2orb s ILE 144 Ca 0.67 -0.03 0.00 0.00 -1.41 0.00 0.00 60.65 59.88 2orb s ILE 144 Cb -0.30 -0.94 -0.03 0.00 0.13 0.00 0.00 42.46 41.31 2orb s ILE 144 CO 0.26 -0.02 -0.02 0.20 -1.91 0.00 0.00 174.94 173.45 2orb s ASN 145 N -0.48 5.01 -0.08 4.50 0.01 -0.04 -4.98 114.94 118.89 2orb s ASN 145 Ca -0.06 0.04 0.03 0.00 -0.71 0.00 0.00 52.86 52.16 2orb s ASN 145 Cb -0.03 -1.33 -0.02 0.00 0.41 0.00 0.00 41.25 40.28 2orb s ASN 145 CO 0.05 0.34 -0.16 -0.69 -1.51 0.00 0.00 177.10 175.13 2orb s VAL 146 N -0.93 2.86 -0.05 1.60 1.01 -1.26 -0.67 120.40 122.96 2orb s VAL 146 Ca 0.15 -0.77 0.03 0.00 0.00 0.00 0.00 61.98 61.38 2orb s VAL 146 Cb -0.11 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.14 2orb s VAL 146 CO 0.05 0.57 -0.12 -0.54 0.00 0.00 0.00 175.10 175.05 2orb s LYS 147 N -0.27 1.47 -0.04 2.72 1.02 0.11 -4.94 119.74 119.82 2orb s LYS 147 Ca 0.01 -0.40 -0.02 0.00 0.02 0.00 0.00 55.97 55.58 2orb s LYS 147 Cb -0.13 -1.27 -0.04 0.00 -0.52 0.00 0.00 37.83 35.87 2orb s LYS 147 CO 0.03 0.08 0.10 -1.58 -0.92 0.00 0.00 175.35 173.06 2orb s TRP 148 N 0.44 3.38 -0.02 3.18 0.52 -1.26 0.07 118.94 125.25 2orb s TRP 148 Ca -0.09 0.29 0.00 0.00 0.02 0.00 0.00 56.10 56.32 2orb s TRP 148 Cb -0.13 -1.80 0.02 0.00 -1.15 0.00 0.00 33.47 30.41 2orb s TRP 148 CO 0.02 0.59 0.01 0.15 0.02 0.00 0.00 176.95 177.75 2orb s LYS 149 N -1.53 0.15 -0.20 4.98 1.02 -0.28 -1.36 119.74 122.51 2orb s LYS 149 Ca 0.21 0.10 -0.02 0.00 0.02 0.00 0.00 55.97 56.28 2orb s LYS 149 Cb -0.12 -0.34 -0.00 0.00 -0.52 0.00 0.00 37.83 36.85 2orb s LYS 149 CO 0.11 -0.12 -0.09 0.42 -0.92 0.00 0.00 175.35 174.75 2orb s ILE 150 N 0.89 2.97 -1.36 2.17 1.01 0.54 -0.60 121.20 126.81 2orb s ILE 150 Ca -0.08 -0.63 -0.06 0.00 0.00 0.00 0.00 60.65 59.87 2orb s ILE 150 Cb -0.12 -2.32 0.04 0.00 0.01 0.00 0.00 42.46 40.07 2orb s ILE 150 CO -0.02 0.46 0.45 0.47 0.00 0.00 0.00 174.94 176.30 2orb n ASP 151 N 4.69 -4.63 0.00 3.58 9.92 0.13 -0.95 116.55 129.29 2orb n ASP 151 Ca -0.19 -0.26 0.00 0.00 -0.53 0.00 0.00 54.79 53.81 2orb n ASP 151 Cb 0.51 -3.80 0.00 0.00 -0.64 0.00 0.00 41.12 37.18 2orb n ASP 151 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2orb n GLY 152 N -1.24 2.33 3.66 0.44 0.00 -1.26 -5.01 105.19 104.11 2orb n GLY 152 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 2orb n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2orb s SER 153 N -2.12 5.78 0.25 1.61 0.01 -0.12 -4.99 113.70 114.12 2orb s SER 153 Ca 0.00 0.12 -0.31 0.00 1.31 0.00 0.00 55.95 57.07 2orb s SER 153 Cb 0.00 -2.00 -0.12 0.00 0.21 0.00 0.00 66.02 64.11 2orb s SER 153 CO 0.00 0.17 1.60 1.21 0.41 0.00 0.00 173.24 176.63 2orb n GLU 154 N 3.55 2.56 -4.41 12.44 2.13 -1.26 -0.34 120.64 135.30 2orb n GLU 154 Ca -0.16 0.91 -0.34 0.00 0.66 0.00 0.00 57.16 58.23 2orb n GLU 154 Cb 0.52 -2.69 -0.11 0.00 0.27 0.00 0.00 31.44 29.43 2orb n GLU 154 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 2orb s ARG 155 N 0.07 3.16 -0.12 5.31 6.06 -0.47 -4.87 118.95 128.09 2orb s ARG 155 Ca 0.69 -0.46 0.01 0.00 -2.50 0.00 0.00 55.73 53.47 2orb s ARG 155 Cb -0.54 -2.80 -0.08 0.00 0.06 0.00 0.00 34.95 31.59 2orb s ARG 155 CO 0.44 0.56 -0.11 0.94 -2.50 0.00 0.00 175.30 174.62 2orb n GLN 156 N 2.58 0.30 -3.01 5.12 -0.06 -1.26 -4.42 117.38 116.63 2orb n GLN 156 Ca -0.18 0.07 -0.37 0.00 -2.00 0.00 0.00 57.00 54.52 2orb n GLN 156 Cb 0.53 -1.23 -0.06 0.00 -4.06 0.00 0.00 30.24 25.41 2orb n GLN 156 CO 0.00 0.00 0.00 -0.80 -0.20 0.00 0.00 177.06 176.06 2orb s ASN 157 N -5.17 7.17 0.00 1.69 -0.87 -1.26 -4.17 114.94 112.33 2orb s ASN 157 Ca -0.16 1.55 0.00 0.00 -1.57 0.00 0.00 52.86 52.68 2orb s ASN 157 Cb 0.04 -2.47 0.00 0.00 -0.02 0.00 0.00 41.25 38.80 2orb s ASN 157 CO 0.28 0.04 0.00 0.61 -2.57 0.00 0.00 177.10 175.45 2orb n GLY 158 N 0.82 0.70 3.53 0.66 0.00 -1.26 -4.80 105.19 104.84 2orb n GLY 158 Ca -0.02 -0.35 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 2orb n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2orb s VAL 159 N -2.00 4.68 -0.16 1.61 1.01 -1.25 -0.72 120.40 123.56 2orb s VAL 159 Ca 0.00 -0.05 0.01 0.00 0.00 0.00 0.00 61.98 61.93 2orb s VAL 159 Cb 0.00 -3.18 0.00 0.00 0.00 0.00 0.00 36.38 33.20 2orb s VAL 159 CO 0.00 0.35 -0.17 -0.76 0.00 0.00 0.00 175.10 174.52 2orb s LEU 160 N 1.35 2.37 0.10 3.92 1.43 -0.22 -4.94 118.68 122.69 2orb s LEU 160 Ca 0.06 -0.52 0.07 0.00 -1.03 0.00 0.00 54.13 52.70 2orb s LEU 160 Cb -0.15 -1.54 -0.04 0.00 0.03 0.00 0.00 46.19 44.50 2orb s LEU 160 CO 0.05 0.06 -0.10 0.20 0.23 0.00 0.00 176.35 176.79 2orb s ASN 161 N 0.96 4.38 -0.16 2.29 0.01 -1.26 -0.72 114.94 120.44 2orb s ASN 161 Ca -0.03 -0.38 -0.07 0.00 -0.71 0.00 0.00 52.86 51.67 2orb s ASN 161 Cb -0.15 -0.84 0.07 0.00 0.41 0.00 0.00 41.25 40.74 2orb s ASN 161 CO -0.03 0.18 0.36 -0.55 -1.51 0.00 0.00 177.10 175.56 2orb s SER 162 N -2.15 -0.21 -0.01 -1.22 0.15 0.62 -4.97 113.70 105.92 2orb s SER 162 Ca 0.21 0.82 -0.02 0.00 0.70 0.00 0.00 55.95 57.65 2orb s SER 162 Cb -0.11 0.91 -0.04 0.00 -1.71 0.00 0.00 66.02 65.07 2orb s SER 162 CO 0.13 -0.21 0.17 0.26 1.20 0.00 0.00 173.24 174.79 2orb s TRP 163 N 2.02 3.52 0.42 3.44 0.51 -1.26 -0.35 118.94 127.25 2orb s TRP 163 Ca -0.04 0.34 -0.00 0.00 -2.12 0.00 0.00 56.10 54.27 2orb s TRP 163 Cb -0.11 -1.82 -0.02 0.00 -0.81 0.00 0.00 33.47 30.72 2orb s TRP 163 CO -0.11 0.64 0.65 0.95 -0.51 0.00 0.00 176.95 178.56 2orb s THR 164 N -1.31 4.50 0.96 2.01 -4.23 -0.36 -5.01 115.64 112.20 2orb s THR 164 Ca 0.27 -0.39 -0.12 0.00 -1.18 0.00 0.00 61.69 60.27 2orb s THR 164 Cb -0.13 -3.66 0.17 0.00 1.34 0.00 0.00 72.50 70.21 2orb s THR 164 CO 0.18 -0.48 1.09 -1.81 -0.54 0.00 0.00 174.62 173.06 2orb s ASP 165 N -4.14 2.96 0.29 3.99 1.01 -1.26 -4.51 116.67 115.00 2orb s ASP 165 Ca 0.45 1.29 -0.29 0.00 0.71 0.00 0.00 52.55 54.71 2orb s ASP 165 Cb -0.10 -1.96 -0.10 0.00 1.01 0.00 0.00 42.92 41.77 2orb s ASP 165 CO 0.38 -2.94 1.42 -1.58 0.21 0.00 0.00 175.17 172.66 2orb s GLN 166 N -4.96 4.26 0.34 8.23 0.74 -1.26 -4.72 119.66 122.29 2orb s GLN 166 Ca 0.65 2.33 -0.29 0.00 0.05 0.00 0.00 55.36 58.09 2orb s GLN 166 Cb -0.18 -3.08 -0.11 0.00 1.10 0.00 0.00 33.01 30.74 2orb s GLN 166 CO 0.57 -0.38 1.46 0.34 -0.55 0.00 0.00 175.29 176.73 2orb s ASP 167 N 0.07 6.48 -0.24 6.67 2.15 0.15 -4.91 116.67 127.04 2orb s ASP 167 Ca 0.56 2.91 0.09 0.00 0.43 0.00 0.00 52.55 56.53 2orb s ASP 167 Cb -0.42 -2.65 0.62 0.00 -0.30 0.00 0.00 42.92 40.17 2orb s ASP 167 CO 0.49 -0.78 1.57 -1.54 -0.17 0.00 0.00 175.17 174.74 2orb n SER 168 N 1.07 4.44 0.01 -0.34 3.41 -1.26 -2.33 113.62 118.62 2orb n SER 168 Ca 0.03 -2.91 0.00 0.00 -0.26 0.00 0.00 58.87 55.72 2orb n SER 168 Cb 0.40 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 2orb n SER 168 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2orb n LYS 169 N 0.10 0.00 -0.07 4.33 4.76 -1.26 -4.32 118.16 121.69 2orb n LYS 169 Ca 0.30 0.00 0.04 0.00 -2.87 0.00 0.00 58.31 55.78 2orb n LYS 169 Cb 1.15 -0.29 0.08 0.00 -1.84 0.00 0.00 35.03 34.12 2orb n LYS 169 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2orb n ASP 170 N -2.88 2.24 -2.30 4.39 5.68 -1.26 -5.00 116.55 117.41 2orb n ASP 170 Ca 0.00 -1.72 -0.17 0.00 -0.50 0.00 0.00 54.79 52.40 2orb n ASP 170 Cb 0.25 -0.10 -0.02 0.00 -1.14 0.00 0.00 41.12 40.12 2orb n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2orb n SER 171 N 0.30 -4.98 -5.00 -1.12 7.64 -0.98 -4.98 113.62 104.50 2orb n SER 171 Ca 0.07 0.12 -0.20 0.00 1.01 0.00 0.00 58.87 59.87 2orb n SER 171 Cb 0.30 -4.21 0.03 0.00 -1.01 0.00 0.00 64.21 59.32 2orb n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2orb s THR 172 N -2.81 2.38 0.34 0.44 -4.23 -1.26 -4.65 115.64 105.85 2orb s THR 172 Ca 0.00 -1.09 0.09 0.00 -1.18 0.00 0.00 61.69 59.52 2orb s THR 172 Cb 0.00 -2.47 -0.06 0.00 1.34 0.00 0.00 72.50 71.32 2orb s THR 172 CO 0.00 0.00 -0.03 -0.31 -0.54 0.00 0.00 174.62 173.74 2orb s TYR 173 N -2.57 2.49 0.01 3.99 2.02 0.39 0.31 117.35 123.99 2orb s TYR 173 Ca 0.56 -0.46 -0.05 0.00 -0.37 0.00 0.00 57.07 56.74 2orb s TYR 173 Cb -0.06 -1.45 -0.01 0.00 -0.40 0.00 0.00 41.96 40.04 2orb s TYR 173 CO 0.34 0.52 0.08 -1.12 -1.57 0.00 0.00 175.55 173.80 2orb s SER 174 N -3.67 0.12 -0.00 2.29 0.01 -1.26 -0.53 113.70 110.65 2orb s SER 174 Ca 0.34 -0.36 -0.09 0.00 1.31 0.00 0.00 55.95 57.15 2orb s SER 174 Cb 0.01 0.17 0.01 0.00 0.21 0.00 0.00 66.02 66.42 2orb s SER 174 CO 0.18 -0.37 0.18 -0.32 0.41 0.00 0.00 173.24 173.32 2orb s MET 175 N -1.62 0.53 -0.08 12.44 1.75 0.20 -1.23 119.30 131.29 2orb s MET 175 Ca -0.14 -0.35 0.05 0.00 -1.25 0.00 0.00 55.69 54.01 2orb s MET 175 Cb -0.07 0.22 -0.00 0.00 2.84 0.00 0.00 34.83 37.82 2orb s MET 175 CO -0.00 -0.13 -0.24 0.45 -0.65 0.00 0.00 175.02 174.44 2orb s SER 176 N -1.37 3.08 -0.09 1.11 0.15 0.53 -0.53 113.70 116.59 2orb s SER 176 Ca -0.14 -0.54 0.02 0.00 0.70 0.00 0.00 55.95 55.98 2orb s SER 176 Cb -0.07 -1.18 0.01 0.00 -1.71 0.00 0.00 66.02 63.07 2orb s SER 176 CO 0.02 0.19 -0.14 -0.55 1.20 0.00 0.00 173.24 173.97 2orb s SER 177 N 0.14 2.21 -0.13 5.45 0.15 -0.28 -0.27 113.70 120.96 2orb s SER 177 Ca -0.13 -0.38 0.02 0.00 0.70 0.00 0.00 55.95 56.16 2orb s SER 177 Cb -0.16 -0.99 0.01 0.00 -1.71 0.00 0.00 66.02 63.18 2orb s SER 177 CO 0.07 0.02 -0.17 -0.89 1.20 0.00 0.00 173.24 173.46 2orb s THR 178 N 0.90 1.70 -0.45 6.45 2.01 0.11 -1.30 115.64 125.06 2orb s THR 178 Ca -0.09 -0.75 -0.11 0.00 0.31 0.00 0.00 61.69 61.05 2orb s THR 178 Cb -0.15 -1.54 0.08 0.00 0.01 0.00 0.00 72.50 70.90 2orb s THR 178 CO 0.00 0.48 0.32 -0.22 -0.69 0.00 0.00 174.62 174.51 2orb s LEU 179 N 1.04 5.39 -0.24 4.42 0.20 -0.25 -1.05 118.68 128.19 2orb s LEU 179 Ca -0.04 -1.50 -0.12 0.00 0.69 0.00 0.00 54.13 53.16 2orb s LEU 179 Cb -0.15 -2.06 -0.05 0.00 -0.43 0.00 0.00 46.19 43.51 2orb s LEU 179 CO -0.04 -0.60 0.25 -0.89 -0.29 0.00 0.00 176.35 174.78 2orb s THR 180 N 1.49 5.29 0.47 3.68 2.01 0.10 -0.56 115.64 128.12 2orb s THR 180 Ca 0.04 0.35 0.02 0.00 0.31 0.00 0.00 61.69 62.41 2orb s THR 180 Cb -0.24 -3.58 -0.01 0.00 0.01 0.00 0.00 72.50 68.67 2orb s THR 180 CO 0.03 0.28 0.07 -0.76 -0.69 0.00 0.00 174.62 173.54 2orb s LEU 181 N 1.41 2.12 0.10 4.42 1.43 0.21 -4.64 118.68 123.73 2orb s LEU 181 Ca 0.11 -1.70 -0.06 0.00 -1.03 0.00 0.00 54.13 51.45 2orb s LEU 181 Cb -0.15 -0.42 -0.05 0.00 0.03 0.00 0.00 46.19 45.60 2orb s LEU 181 CO 0.07 -0.93 0.35 0.28 0.23 0.00 0.00 176.35 176.36 2orb s THR 182 N -3.03 5.18 0.25 5.49 -1.32 -1.26 -1.03 115.64 119.93 2orb s THR 182 Ca 0.12 0.14 -0.06 0.00 -1.21 0.00 0.00 61.69 60.68 2orb s THR 182 Cb 0.01 -3.62 0.29 0.00 -1.51 0.00 0.00 72.50 67.67 2orb s THR 182 CO 0.08 0.16 1.63 0.50 -2.21 0.00 0.00 174.62 174.78 2orb h LYS 183 N 3.27 0.11 -0.71 7.08 3.64 -1.48 0.46 116.57 128.94 2orb h LYS 183 Ca -0.47 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 58.96 2orb h LYS 183 Cb 1.18 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.92 2orb h LYS 183 CO 0.70 0.07 0.41 -0.44 -2.27 0.00 0.00 179.45 177.92 2orb h ASP 184 N 0.11 0.62 -0.17 4.20 3.45 -1.94 0.82 116.42 123.51 2orb h ASP 184 Ca 0.44 0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.91 2orb h ASP 184 Cb 0.79 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 39.45 2orb h ASP 184 CO -0.68 0.40 0.06 -0.33 -1.57 0.00 0.00 179.24 177.12 2orb h GLU 185 N 0.75 0.25 -0.61 3.56 5.08 -1.36 -2.83 114.58 119.43 2orb h GLU 185 Ca 0.32 -0.05 0.10 0.00 -1.00 0.00 0.00 59.36 58.73 2orb h GLU 185 Cb 0.18 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.32 2orb h GLU 185 CO -0.18 0.34 0.21 -0.92 -1.00 0.00 0.00 179.01 177.46 2orb h TYR 186 N 0.11 0.35 0.00 4.33 3.20 -0.39 -0.63 116.97 123.93 2orb h TYR 186 Ca 0.06 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.96 2orb h TYR 186 Cb 0.19 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.39 2orb h TYR 186 CO -0.01 0.06 0.00 0.93 -1.64 0.00 0.00 178.16 177.50 2orb h GLU 187 N 0.37 0.00 0.00 1.82 4.39 -0.71 -2.87 114.58 117.57 2orb h GLU 187 Ca 0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.01 2orb h GLU 187 Cb 0.41 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 2orb h GLU 187 CO -0.34 0.00 -0.53 0.54 -1.16 0.00 0.00 179.01 177.53 2orb n ARG 188 N -2.39 0.13 -4.37 2.33 1.74 -0.25 -4.90 116.66 108.95 2orb n ARG 188 Ca 0.01 0.04 -0.20 0.00 -0.77 0.00 0.00 57.85 56.93 2orb n ARG 188 Cb 0.17 -1.58 -0.10 0.00 -1.02 0.00 0.00 32.46 29.93 2orb n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2orb s HIS 189 N -3.08 1.82 -0.08 -1.55 3.76 -1.08 -5.09 115.29 110.00 2orb s HIS 189 Ca 0.09 -0.54 -0.00 0.00 -0.15 0.00 0.00 55.06 54.46 2orb s HIS 189 Cb 0.16 -0.85 -0.05 0.00 1.11 0.00 0.00 32.58 32.95 2orb s HIS 189 CO 0.70 0.41 -0.07 -1.71 -0.85 0.00 0.00 174.74 173.22 2orb n ASN 190 N -0.43 2.81 -4.77 1.40 5.15 -1.26 -4.77 115.26 113.39 2orb n ASN 190 Ca -0.07 -0.01 -0.36 0.00 -0.60 0.00 0.00 54.58 53.54 2orb n ASN 190 Cb 0.60 -0.14 -0.08 0.00 -0.53 0.00 0.00 39.78 39.64 2orb n ASN 190 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2orb s SER 191 N -4.94 6.24 -0.08 1.20 1.04 -1.26 0.34 113.70 116.24 2orb s SER 191 Ca -0.10 0.29 0.03 0.00 0.48 0.00 0.00 55.95 56.64 2orb s SER 191 Cb 0.03 -2.08 0.01 0.00 0.10 0.00 0.00 66.02 64.08 2orb s SER 191 CO 0.17 0.24 -0.16 -0.31 0.98 0.00 0.00 173.24 174.15 2orb s TYR 192 N -0.00 1.85 -0.00 5.02 1.51 -0.57 0.20 117.35 125.36 2orb s TYR 192 Ca 0.10 -0.73 0.03 0.00 -1.01 0.00 0.00 57.07 55.45 2orb s TYR 192 Cb -0.11 -1.31 -0.01 0.00 -0.11 0.00 0.00 41.96 40.42 2orb s TYR 192 CO -0.00 -0.34 -0.10 0.99 -1.11 0.00 0.00 175.55 174.99 2orb s THR 193 N 0.59 0.78 -0.17 -0.71 2.01 0.23 -1.77 115.64 116.59 2orb s THR 193 Ca -0.15 -0.45 -0.02 0.00 0.31 0.00 0.00 61.69 61.38 2orb s THR 193 Cb -0.16 -0.66 -0.01 0.00 0.01 0.00 0.00 72.50 71.68 2orb s THR 193 CO 0.05 0.20 -0.08 0.00 -0.69 0.00 0.00 174.62 174.10 2orb s GLU 195 N 0.87 2.36 -0.32 0.00 2.02 0.11 -1.69 118.70 122.05 2orb s GLU 195 Ca -0.02 -0.62 -0.08 0.00 0.02 0.00 0.00 54.97 54.27 2orb s GLU 195 Cb -0.15 -1.95 0.01 0.00 0.10 0.00 0.00 34.13 32.15 2orb s GLU 195 CO 0.01 -0.01 0.12 0.00 0.02 0.00 0.00 175.26 175.40 2orb s ALA 196 N 0.84 3.15 -0.18 5.21 0.00 -0.59 0.09 121.76 130.28 2orb s ALA 196 Ca -0.09 -1.54 -0.01 0.00 0.00 0.00 0.00 51.96 50.32 2orb s ALA 196 Cb -0.15 -2.31 -0.00 0.00 0.00 0.00 0.00 23.12 20.66 2orb s ALA 196 CO 0.00 -1.07 -0.11 0.95 0.00 0.00 0.00 175.76 175.53 2orb s THR 197 N 1.52 2.90 0.00 0.00 -4.23 0.15 -1.78 115.64 114.21 2orb s THR 197 Ca 0.02 -0.67 0.00 0.00 -1.18 0.00 0.00 61.69 59.86 2orb s THR 197 Cb -0.18 -2.27 0.00 0.00 1.34 0.00 0.00 72.50 71.39 2orb s THR 197 CO 0.04 0.48 0.00 1.57 -0.54 0.00 0.00 174.62 176.17 2orb n HIS 198 N 4.39 0.00 0.00 3.99 -0.00 -1.26 -0.86 115.22 121.48 2orb n HIS 198 Ca -0.19 0.00 0.00 0.00 0.46 0.00 0.00 57.72 57.99 2orb n HIS 198 Cb 0.51 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.38 2orb n HIS 198 CO 0.00 0.00 0.00 1.17 0.46 0.00 0.00 176.34 177.97 2orb n LYS 199 N 0.00 0.43 -0.02 1.57 4.81 -1.26 -4.72 118.16 118.96 2orb n LYS 199 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2orb n LYS 199 Cb 0.00 -0.33 0.02 0.00 0.02 0.00 0.00 35.03 34.73 2orb n LYS 199 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 2orb n THR 200 N -0.45 0.07 0.00 3.15 -2.24 -1.26 -4.30 114.28 109.26 2orb n THR 200 Ca 0.00 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 2orb n THR 200 Cb 0.00 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 2orb n THR 200 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2orb n SER 201 N -0.27 0.00 -0.64 3.42 2.88 -1.26 -5.01 113.62 112.74 2orb n SER 201 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2orb n SER 201 Cb 0.11 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.57 2orb n SER 201 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2orb n THR 202 N 0.00 0.16 -3.80 2.46 -2.24 -1.26 -4.00 114.28 105.60 2orb n THR 202 Ca 0.00 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.41 2orb n THR 202 Cb 0.00 -0.44 -0.13 0.00 -2.10 0.00 0.00 70.33 67.67 2orb n THR 202 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2orb s SER 203 N -0.02 5.02 0.63 3.42 0.01 -1.26 -4.98 113.70 116.52 2orb s SER 203 Ca 0.00 -0.89 -0.18 0.00 1.31 0.00 0.00 55.95 56.19 2orb s SER 203 Cb 0.00 -1.83 -0.02 0.00 0.21 0.00 0.00 66.02 64.39 2orb s SER 203 CO 0.00 -0.22 1.23 -2.16 0.41 0.00 0.00 173.24 172.50 2orb s PRO 204 N 1.43 2.74 -0.19 12.44 0.04 -1.26 -4.84 135.00 145.35 2orb s PRO 204 Ca 0.00 1.87 -0.06 0.00 0.04 0.00 0.00 61.00 62.85 2orb s PRO 204 Cb -0.18 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 2orb s PRO 204 CO 0.01 -1.40 0.03 0.42 0.04 0.00 0.00 177.00 176.10 2orb s ILE 205 N -1.62 4.35 0.21 0.56 1.01 -0.73 -4.96 121.20 120.01 2orb s ILE 205 Ca 0.78 -0.18 0.11 0.00 0.00 0.00 0.00 60.65 61.35 2orb s ILE 205 Cb -0.32 -2.96 -0.05 0.00 0.01 0.00 0.00 42.46 39.14 2orb s ILE 205 CO 0.37 0.44 -0.21 0.68 0.00 0.00 0.00 174.94 176.21 2orb s VAL 206 N 0.73 2.24 -0.12 2.92 -7.23 -1.26 -1.54 120.40 116.14 2orb s VAL 206 Ca 0.02 -2.11 -0.10 0.00 -1.81 0.00 0.00 61.98 57.97 2orb s VAL 206 Cb -0.14 -2.10 0.04 0.00 0.56 0.00 0.00 36.38 34.73 2orb s VAL 206 CO 0.02 -0.25 0.32 -0.75 -0.31 0.00 0.00 175.10 174.13 2orb s LYS 207 N -2.94 0.36 0.26 4.82 2.47 -0.68 -5.01 119.74 119.01 2orb s LYS 207 Ca 0.22 0.49 -0.20 0.00 -1.56 0.00 0.00 55.97 54.92 2orb s LYS 207 Cb -0.06 0.13 0.02 0.00 -1.46 0.00 0.00 37.83 36.45 2orb s LYS 207 CO 0.10 -0.07 0.66 -1.54 0.16 0.00 0.00 175.35 174.66 2orb s SER 208 N 0.42 -0.27 0.14 1.43 1.04 -1.26 -0.35 113.70 114.85 2orb s SER 208 Ca -0.02 -0.57 -0.07 0.00 0.48 0.00 0.00 55.95 55.77 2orb s SER 208 Cb -0.04 0.69 -0.02 0.00 0.10 0.00 0.00 66.02 66.75 2orb s SER 208 CO -0.02 -1.26 0.21 0.72 0.98 0.00 0.00 173.24 173.87 2orb s PHE 209 N -3.91 0.47 -0.12 5.02 -0.12 -0.73 -5.00 117.98 113.59 2orb s PHE 209 Ca 0.11 -0.85 0.00 0.00 -0.05 0.00 0.00 56.93 56.14 2orb s PHE 209 Cb -0.04 -0.16 -0.02 0.00 -0.63 0.00 0.00 43.02 42.17 2orb s PHE 209 CO 0.04 -0.64 -0.12 -0.80 -0.05 0.00 0.00 175.22 173.65 2orb s ASN 210 N -2.97 4.10 0.41 1.98 0.01 -1.26 -1.51 114.94 115.70 2orb s ASN 210 Ca 0.17 -0.28 0.14 0.00 -0.71 0.00 0.00 52.86 52.17 2orb s ASN 210 Cb 0.05 -1.52 0.99 0.00 0.41 0.00 0.00 41.25 41.18 2orb s ASN 210 CO -0.01 0.19 1.92 -0.09 -1.51 0.00 0.00 177.10 177.60 2orb h ARG 211 N 6.49 0.47 -0.01 -0.60 2.43 -0.41 -3.49 114.38 119.25 2orb h ARG 211 Ca -0.29 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 2orb h ARG 211 Cb 1.20 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 2orb h ARG 211 CO 0.55 0.31 0.00 0.27 -1.51 0.00 0.00 179.97 179.59