#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hve s ASP 9 N 0.00 -1.12 0.50 -3.46 2.15 -1.26 -5.00 116.67 108.48 3hve s ASP 9 Ca 0.00 -0.66 0.34 0.00 0.43 0.00 0.00 52.55 52.65 3hve s ASP 9 Cb 0.00 1.44 1.76 0.00 -0.30 0.00 0.00 42.92 45.82 3hve s ASP 9 CO 0.00 -0.11 2.02 1.55 -0.17 0.00 0.00 175.17 178.46 3hve h PRO 10 N 6.25 0.00 0.00 4.34 0.13 -2.07 -0.49 132.00 140.16 3hve h PRO 10 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 3hve h PRO 10 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3hve h PRO 10 CO 0.03 0.00 0.00 0.94 -0.23 0.00 0.00 178.00 178.74 3hve n GLN 11 N -2.71 0.80 0.14 0.86 -0.06 -1.26 -3.91 117.38 111.25 3hve n GLN 11 Ca -0.02 0.00 -0.06 0.00 -2.00 0.00 0.00 57.00 54.93 3hve n GLN 11 Cb 0.09 -1.07 -0.03 0.00 -4.06 0.00 0.00 30.24 25.17 3hve n GLN 11 CO 0.00 0.00 0.00 1.25 -0.20 0.00 0.00 177.06 178.11 3hve h HIS 12 N 0.00 -0.35 -0.26 3.69 -0.00 -1.51 -2.44 115.15 114.27 3hve h HIS 12 Ca 0.00 -0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.38 3hve h HIS 12 Cb 0.00 0.12 -0.03 0.00 -0.00 0.00 0.00 27.41 27.50 3hve h HIS 12 CO 0.00 -0.22 0.11 0.00 -0.00 0.00 0.00 177.93 177.82 3hve h ALA 13 N -1.72 0.31 0.00 5.26 0.00 -1.83 0.17 119.26 121.45 3hve h ALA 13 Ca -0.04 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3hve h ALA 13 Cb 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3hve h ALA 13 CO 0.06 -0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.02 3hve n ALA 14 N -2.25 1.18 -0.09 0.00 0.00 -1.25 0.74 120.51 118.84 3hve n ALA 14 Ca -0.01 0.09 -0.22 0.00 0.00 0.00 0.00 53.44 53.30 3hve n ALA 14 Cb 0.08 -1.21 -0.12 0.00 0.00 0.00 0.00 19.45 18.20 3hve n ALA 14 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3hve n ARG 15 N -1.92 0.60 -0.29 0.00 0.63 -0.18 -3.46 116.66 112.04 3hve n ARG 15 Ca 0.00 0.51 -0.04 0.00 -0.92 0.00 0.00 57.85 57.40 3hve n ARG 15 Cb 0.06 -1.73 0.11 0.00 0.45 0.00 0.00 32.46 31.35 3hve n ARG 15 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 3hve h LEU 16 N -0.80 1.06 -1.10 6.15 5.85 0.59 -2.26 115.31 124.80 3hve h LEU 16 Ca -0.38 -0.12 -0.09 0.00 0.84 0.00 0.00 57.88 58.13 3hve h LEU 16 Cb 1.45 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 3hve h LEU 16 CO -0.16 0.88 -0.42 0.25 -0.34 0.00 0.00 178.44 178.64 3hve h LEU 17 N 1.17 0.05 -1.02 2.25 5.85 0.16 -0.85 115.31 122.92 3hve h LEU 17 Ca 0.29 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.88 3hve h LEU 17 Cb 0.09 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 3hve h LEU 17 CO -0.04 0.47 -0.49 -0.09 -0.34 0.00 0.00 178.44 177.95 3hve h ARG 18 N 0.04 0.00 0.32 1.25 2.43 -1.45 -1.97 114.38 115.01 3hve h ARG 18 Ca 0.00 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 3hve h ARG 18 Cb 0.77 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 3hve h ARG 18 CO 0.06 0.49 -0.15 0.00 -1.51 0.00 0.00 179.97 178.85 3hve h ALA 19 N 1.51 -0.43 -0.98 2.80 0.00 -0.89 -2.96 119.26 118.31 3hve h ALA 19 Ca -0.00 -0.19 0.22 0.00 0.00 0.00 0.00 54.91 54.94 3hve h ALA 19 Cb 0.86 0.17 -0.12 0.00 0.00 0.00 0.00 17.79 18.70 3hve h ALA 19 CO 0.06 -0.56 0.57 -0.07 0.00 0.00 0.00 179.25 179.26 3hve h LEU 20 N -0.79 0.67 -0.84 0.00 -0.00 -1.04 -2.09 115.31 111.23 3hve h LEU 20 Ca -0.04 0.12 0.21 0.00 -0.00 0.00 0.00 57.88 58.17 3hve h LEU 20 Cb 0.51 0.02 -0.13 0.00 -0.00 0.00 0.00 40.66 41.06 3hve h LEU 20 CO 0.07 0.15 0.23 -1.28 -0.00 0.00 0.00 178.44 177.61 3hve h SER 21 N 0.62 0.03 0.55 -0.43 0.87 -1.18 -0.70 113.55 113.31 3hve h SER 21 Ca 0.61 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 61.34 3hve h SER 21 Cb 1.08 0.23 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 3hve h SER 21 CO -0.45 -0.10 0.00 -1.54 -0.53 0.00 0.00 176.83 174.21 3hve n SER 22 N -5.19 0.00 -2.08 6.23 3.41 -0.78 -3.35 113.62 111.86 3hve n SER 22 Ca 0.19 -0.08 -0.20 0.00 -0.26 0.00 0.00 58.87 58.52 3hve n SER 22 Cb 0.60 -0.30 0.01 0.00 -0.26 0.00 0.00 64.21 64.27 3hve n SER 22 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3hve n PHE 23 N -1.30 1.63 -3.36 7.33 3.72 -0.27 -4.78 117.46 120.43 3hve n PHE 23 Ca 0.13 -2.02 -0.45 0.00 -0.05 0.00 0.00 57.45 55.06 3hve n PHE 23 Cb 0.23 -1.10 -0.05 0.00 -0.94 0.00 0.00 39.48 37.61 3hve n PHE 23 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3hve s ARG 24 N -1.88 2.98 0.00 -1.08 0.52 -1.21 -4.67 118.95 113.62 3hve s ARG 24 Ca 0.41 -1.85 0.00 0.00 -0.52 0.00 0.00 55.73 53.77 3hve s ARG 24 Cb 0.30 -4.24 0.00 0.00 0.52 0.00 0.00 34.95 31.52 3hve s ARG 24 CO -0.06 -1.30 0.00 -0.85 0.02 0.00 0.00 175.30 173.11 3hve n GLU 25 N 4.96 0.00 0.00 3.54 0.28 -1.26 -5.08 120.64 123.08 3hve n GLU 25 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.92 3hve n GLU 25 Cb 0.41 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.28 3hve n GLU 25 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 3hve n ARG 28 N 0.00 0.00 -0.00 3.44 3.00 -1.26 -3.82 116.66 118.02 3hve n ARG 28 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 57.85 57.91 3hve n ARG 28 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 32.46 32.38 3hve n ARG 28 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 3hve n PHE 29 N 0.00 0.00 -2.65 -0.14 3.01 -1.26 -4.91 117.46 111.51 3hve n PHE 29 Ca 0.00 0.00 -0.43 0.00 1.01 0.00 0.00 57.45 58.03 3hve n PHE 29 Cb 0.00 -0.20 -0.02 0.00 -0.01 0.00 0.00 39.48 39.24 3hve n PHE 29 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3hve n ASP 31 N 7.25 4.45 -1.89 0.00 3.85 -1.15 -4.91 116.55 124.16 3hve n ASP 31 Ca 0.11 -2.37 -0.05 0.00 -0.71 0.00 0.00 54.79 51.77 3hve n ASP 31 Cb 0.48 -0.53 0.01 0.00 -1.35 0.00 0.00 41.12 39.73 3hve n ASP 31 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3hve n ALA 32 N 1.06 -0.86 -3.18 2.12 0.00 -1.15 -4.02 120.51 114.48 3hve n ALA 32 Ca 0.24 -0.63 -0.13 0.00 0.00 0.00 0.00 53.44 52.92 3hve n ALA 32 Cb 0.81 0.51 -0.11 0.00 0.00 0.00 0.00 19.45 20.66 3hve n ALA 32 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3hve s HIS 33 N -5.56 -0.31 -0.24 0.00 3.76 -1.09 -2.70 115.29 109.15 3hve s HIS 33 Ca 0.08 0.75 -0.09 0.00 -0.15 0.00 0.00 55.06 55.66 3hve s HIS 33 Cb -0.02 0.11 -0.04 0.00 1.11 0.00 0.00 32.58 33.73 3hve s HIS 33 CO 0.06 -0.16 0.11 -1.17 -0.85 0.00 0.00 174.74 172.73 3hve s LEU 34 N 0.10 3.75 -0.74 0.89 2.96 0.24 -1.26 118.68 124.62 3hve s LEU 34 Ca -0.00 -0.06 -0.15 0.00 -0.22 0.00 0.00 54.13 53.70 3hve s LEU 34 Cb -0.02 -2.00 0.18 0.00 0.50 0.00 0.00 46.19 44.85 3hve s LEU 34 CO 0.00 0.02 0.72 -0.69 -1.32 0.00 0.00 176.35 175.08 3hve s VAL 35 N 1.30 5.39 0.11 1.68 1.01 -0.05 0.22 120.40 130.06 3hve s VAL 35 Ca 0.06 -2.05 0.10 0.00 0.00 0.00 0.00 61.98 60.09 3hve s VAL 35 Cb -0.15 -4.46 -0.04 0.00 0.00 0.00 0.00 36.38 31.74 3hve s VAL 35 CO 0.05 -1.03 -0.25 -0.76 0.00 0.00 0.00 175.10 173.11 3hve s LEU 36 N 0.90 2.29 0.00 3.92 1.02 -0.52 -1.08 118.68 125.21 3hve s LEU 36 Ca 0.14 -0.71 0.00 0.00 0.02 0.00 0.00 54.13 53.59 3hve s LEU 36 Cb -0.16 -1.13 0.00 0.00 0.02 0.00 0.00 46.19 44.92 3hve s LEU 36 CO -0.05 0.16 0.00 0.47 0.02 0.00 0.00 176.35 176.95 3hve n ASP 37 N 1.09 0.00 -0.55 2.29 8.00 -1.26 -0.27 116.55 125.85 3hve n ASP 37 Ca -0.18 0.00 0.05 0.00 0.71 0.00 0.00 54.79 55.37 3hve n ASP 37 Cb 0.53 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.72 3hve n ASP 37 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hve n GLY 38 N 0.00 2.93 3.51 0.44 0.00 -1.26 -5.06 105.19 105.75 3hve n GLY 38 Ca 0.00 -0.78 -0.25 0.00 0.00 0.00 0.00 46.02 45.00 3hve n GLY 38 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hve s GLU 39 N -1.58 1.75 0.04 1.61 2.02 0.63 -5.14 118.70 118.03 3hve s GLU 39 Ca 0.24 -1.91 0.07 0.00 0.02 0.00 0.00 54.97 53.39 3hve s GLU 39 Cb 0.23 -1.49 -0.03 0.00 0.10 0.00 0.00 34.13 32.94 3hve s GLU 39 CO -0.03 0.07 -0.19 -1.21 0.02 0.00 0.00 175.26 173.93 3hve s GLU 40 N -3.67 2.05 -0.09 1.61 2.02 -1.25 -1.44 118.70 117.92 3hve s GLU 40 Ca 0.32 -0.99 -0.00 0.00 0.02 0.00 0.00 54.97 54.32 3hve s GLU 40 Cb 0.04 -2.17 0.02 0.00 0.10 0.00 0.00 34.13 32.12 3hve s GLU 40 CO 0.15 0.54 -0.06 0.42 0.02 0.00 0.00 175.26 176.33 3hve s ILE 41 N -0.92 0.85 -0.12 -1.63 1.01 0.13 -4.84 121.20 115.68 3hve s ILE 41 Ca 0.14 -0.20 -0.29 0.00 0.00 0.00 0.00 60.65 60.30 3hve s ILE 41 Cb -0.10 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 3hve s ILE 41 CO 0.05 0.33 1.50 -2.16 0.00 0.00 0.00 174.94 174.66 3hve s PRO 42 N 1.59 4.16 0.20 2.79 0.04 -1.26 0.81 135.00 143.33 3hve s PRO 42 Ca 0.01 1.92 0.06 0.00 0.04 0.00 0.00 61.00 63.04 3hve s PRO 42 Cb -0.13 -3.91 -0.05 0.00 0.04 0.00 0.00 34.50 30.46 3hve s PRO 42 CO -0.06 -0.84 -0.11 0.14 0.04 0.00 0.00 177.00 176.17 3hve s VAL 43 N 3.96 1.51 -0.56 -0.36 -7.23 -1.10 -4.79 120.40 111.83 3hve s VAL 43 Ca 0.66 -2.14 -0.20 0.00 -1.81 0.00 0.00 61.98 58.49 3hve s VAL 43 Cb -0.28 -2.08 0.07 0.00 0.56 0.00 0.00 36.38 34.65 3hve s VAL 43 CO 0.24 -0.56 0.71 -1.10 -0.31 0.00 0.00 175.10 174.07 3hve s GLN 44 N -3.70 3.11 0.49 4.82 -0.21 -1.26 -2.91 119.66 119.98 3hve s GLN 44 Ca 0.23 -1.00 0.30 0.00 0.02 0.00 0.00 55.36 54.91 3hve s GLN 44 Cb 0.01 -4.17 1.40 0.00 1.00 0.00 0.00 33.01 31.25 3hve s GLN 44 CO 0.06 -1.42 1.77 -0.22 -2.12 0.00 0.00 175.29 173.37 3hve h LYS 45 N 9.14 0.14 0.01 2.91 3.11 -1.88 -2.06 116.57 127.94 3hve h LYS 45 Ca -0.28 -0.01 -0.00 0.00 -2.81 0.00 0.00 60.65 57.55 3hve h LYS 45 Cb 1.09 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 32.29 3hve h LYS 45 CO 1.05 0.09 -0.00 -2.95 -2.81 0.00 0.00 179.45 174.82 3hve h ASN 46 N 0.14 -0.01 -0.67 4.20 -1.07 -1.97 -1.62 115.58 114.57 3hve h ASN 46 Ca 0.61 -0.72 0.09 0.00 0.07 0.00 0.00 56.30 56.35 3hve h ASN 46 Cb 2.08 0.00 -0.07 0.00 -2.07 0.00 0.00 38.32 38.26 3hve h ASN 46 CO -0.14 0.73 0.31 0.40 0.07 0.00 0.00 177.43 178.80 3hve h ILE 47 N -0.77 0.82 0.00 6.14 2.04 -1.87 0.90 117.51 124.78 3hve h ILE 47 Ca -0.00 -0.18 -0.09 0.00 1.00 0.00 0.00 64.86 65.58 3hve h ILE 47 Cb 0.73 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 3hve h ILE 47 CO 0.00 0.10 -0.43 0.25 0.00 0.00 0.00 178.15 178.07 3hve h LEU 48 N 0.54 0.00 -0.12 1.44 6.46 -1.46 -2.90 115.31 119.26 3hve h LEU 48 Ca 0.33 0.00 -0.24 0.00 -0.12 0.00 0.00 57.88 57.86 3hve h LEU 48 Cb 0.37 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.31 3hve h LEU 48 CO -0.28 0.43 -0.94 0.00 -0.62 0.00 0.00 178.44 177.03 3hve h ALA 49 N 1.57 0.28 0.00 1.25 0.00 0.23 -2.80 119.26 119.78 3hve h ALA 49 Ca -0.00 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.23 3hve h ALA 49 Cb 0.92 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3hve h ALA 49 CO 0.06 0.74 0.00 0.00 0.00 0.00 0.00 179.25 180.04 3hve n ALA 50 N -2.59 2.27 0.00 0.00 0.00 0.29 -3.45 120.51 117.02 3hve n ALA 50 Ca -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3hve n ALA 50 Cb 0.83 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 19.12 3hve n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hve n ALA 51 N -0.72 0.56 -3.86 0.00 0.00 -1.20 -4.98 120.51 110.31 3hve n ALA 51 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.21 3hve n ALA 51 Cb 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.34 3hve n ALA 51 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3hve s SER 52 N -0.36 4.18 0.59 0.00 0.15 -1.06 -4.73 113.70 112.48 3hve s SER 52 Ca 0.00 -2.50 0.29 0.00 0.70 0.00 0.00 55.95 54.44 3hve s SER 52 Cb 0.00 -1.35 1.36 0.00 -1.71 0.00 0.00 66.02 64.32 3hve s SER 52 CO 0.00 -0.30 1.75 -0.65 1.20 0.00 0.00 173.24 175.24 3hve h PRO 53 N 7.06 0.00 0.31 5.44 0.11 -1.72 0.10 132.00 143.29 3hve h PRO 53 Ca -0.06 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.04 3hve h PRO 53 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 3hve h PRO 53 CO 0.56 0.00 -0.15 -0.92 -0.21 0.00 0.00 178.00 177.28 3hve h TYR 54 N 0.00 -0.38 -0.89 0.65 3.20 -1.86 -2.59 116.97 115.10 3hve h TYR 54 Ca 0.29 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.29 3hve h TYR 54 Cb 1.64 0.13 -0.07 0.00 1.54 0.00 0.00 36.73 39.96 3hve h TYR 54 CO 0.00 -0.07 0.57 0.82 -1.64 0.00 0.00 178.16 177.84 3hve h ILE 55 N -1.00 0.85 0.54 1.81 1.08 -1.34 -2.60 117.51 116.86 3hve h ILE 55 Ca -0.04 -0.25 -0.03 0.00 -0.39 0.00 0.00 64.86 64.16 3hve h ILE 55 Cb 0.48 0.07 0.01 0.00 -3.07 0.00 0.00 36.82 34.31 3hve h ILE 55 CO 0.07 0.13 -0.26 -0.09 -0.69 0.00 0.00 178.15 177.31 3hve h ARG 56 N 0.72 -0.70 -0.58 2.37 2.43 -1.03 -2.81 114.38 114.78 3hve h ARG 56 Ca 0.44 0.05 0.09 0.00 -0.81 0.00 0.00 59.98 59.75 3hve h ARG 56 Cb 0.68 0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.35 3hve h ARG 56 CO -0.20 -0.41 0.39 1.79 -1.51 0.00 0.00 179.97 180.02 3hve h THR 57 N -0.85 0.90 0.00 0.20 1.35 -1.22 0.41 112.91 113.71 3hve h THR 57 Ca -0.07 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.65 3hve h THR 57 Cb 0.60 0.47 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 3hve h THR 57 CO 0.12 0.07 0.00 0.29 -0.25 0.00 0.00 175.52 175.75 3hve n LYS 58 N -4.47 0.84 -4.63 4.72 5.02 -1.00 -5.13 118.16 113.52 3hve n LYS 58 Ca 0.09 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.13 3hve n LYS 58 Cb 0.36 -1.34 -0.14 0.00 -0.02 0.00 0.00 35.03 33.89 3hve n LYS 58 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3hve s LEU 59 N 0.00 2.15 0.00 -0.35 1.02 0.13 -5.05 118.68 116.59 3hve s LEU 59 Ca 0.00 -0.49 0.00 0.00 0.02 0.00 0.00 54.13 53.66 3hve s LEU 59 Cb 0.00 -0.92 0.00 0.00 0.02 0.00 0.00 46.19 45.29 3hve s LEU 59 CO 0.00 0.15 0.00 0.00 0.02 0.00 0.00 176.35 176.52 3hve n TYR 71 N 1.93 0.00 -3.60 0.29 9.36 -1.26 -5.16 117.16 118.72 3hve n TYR 71 Ca -0.17 0.00 -0.28 0.00 3.32 0.00 0.00 57.90 60.77 3hve n TYR 71 Cb 0.54 0.00 -0.16 0.00 -0.63 0.00 0.00 39.34 39.09 3hve n TYR 71 CO 0.00 0.00 0.00 -1.59 0.22 0.00 0.00 176.86 175.49 3hve s LYS 72 N -2.74 0.26 -0.48 2.98 -2.85 -1.26 -2.67 119.74 112.98 3hve s LYS 72 Ca 0.00 -0.44 -0.19 0.00 -1.00 0.00 0.00 55.97 54.34 3hve s LYS 72 Cb 0.00 -1.56 0.05 0.00 -2.06 0.00 0.00 37.83 34.25 3hve s LYS 72 CO 0.00 -0.87 0.59 0.42 0.10 0.00 0.00 175.35 175.60 3hve s ILE 73 N 2.03 4.91 -0.23 3.79 -1.09 -0.39 -4.93 121.20 125.29 3hve s ILE 73 Ca 0.06 -0.36 -0.21 0.00 -2.23 0.00 0.00 60.65 57.91 3hve s ILE 73 Cb -0.16 -4.23 -0.02 0.00 -1.58 0.00 0.00 42.46 36.46 3hve s ILE 73 CO -0.24 -0.70 0.65 -1.61 -1.23 0.00 0.00 174.94 171.81 3hve s GLU 74 N 2.57 4.15 -0.00 2.79 2.02 -1.26 -0.87 118.70 128.09 3hve s GLU 74 Ca 0.16 0.60 -0.16 0.00 0.02 0.00 0.00 54.97 55.59 3hve s GLU 74 Cb -0.18 -3.63 -0.06 0.00 0.10 0.00 0.00 34.13 30.37 3hve s GLU 74 CO 0.13 -0.36 0.45 -0.51 0.02 0.00 0.00 175.26 174.99 3hve s LEU 75 N 2.34 4.46 -0.56 1.80 1.43 -0.24 -4.89 118.68 123.02 3hve s LEU 75 Ca 0.28 1.00 -0.19 0.00 -1.03 0.00 0.00 54.13 54.18 3hve s LEU 75 Cb -0.16 -2.66 0.08 0.00 0.03 0.00 0.00 46.19 43.48 3hve s LEU 75 CO 0.09 0.27 0.70 -0.70 0.23 0.00 0.00 176.35 176.94 3hve s GLU 76 N -0.83 3.09 -0.31 1.70 2.12 -1.26 -4.55 118.70 118.66 3hve s GLU 76 Ca 0.25 -1.06 -0.00 0.00 0.36 0.00 0.00 54.97 54.52 3hve s GLU 76 Cb -0.17 -4.18 -0.00 0.00 0.26 0.00 0.00 34.13 30.03 3hve s GLU 76 CO 0.14 -1.42 0.29 0.41 -0.54 0.00 0.00 175.26 174.13 3hve n GLY 77 N 5.23 -0.59 3.21 -1.50 0.00 -1.26 -5.09 105.19 105.19 3hve n GLY 77 Ca -0.07 0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 3hve n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hve s ILE 78 N -3.02 -0.54 0.22 -0.61 1.01 -1.26 -4.97 121.20 112.03 3hve s ILE 78 Ca 0.02 0.19 -0.32 0.00 0.00 0.00 0.00 60.65 60.54 3hve s ILE 78 Cb -0.00 -0.61 -0.12 0.00 0.01 0.00 0.00 42.46 41.73 3hve s ILE 78 CO 0.30 0.08 1.66 -1.54 0.00 0.00 0.00 174.94 175.44 3hve n SER 79 N 5.28 3.80 -2.11 3.58 3.41 -1.26 -4.26 113.62 122.06 3hve n SER 79 Ca -0.09 1.09 0.00 0.00 -0.26 0.00 0.00 58.87 59.60 3hve n SER 79 Cb 0.50 -1.55 0.00 0.00 -0.26 0.00 0.00 64.21 62.90 3hve n SER 79 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3hve n VAL 80 N 3.37 0.00 -1.45 -3.33 0.31 -1.26 -4.75 118.33 111.22 3hve n VAL 80 Ca 0.14 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.46 3hve n VAL 80 Cb 0.34 -0.50 -0.00 0.00 -0.91 0.00 0.00 33.84 32.77 3hve n VAL 80 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3hve n VAL 82 N 1.44 0.00 0.00 2.52 0.31 -1.26 -4.81 118.33 116.53 3hve n VAL 82 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3hve n VAL 82 Cb 0.00 -0.01 0.00 0.00 -0.91 0.00 0.00 33.84 32.92 3hve n VAL 82 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3hve n ARG 84 N -0.54 0.00 -0.07 5.55 5.12 -1.26 0.05 116.66 125.51 3hve n ARG 84 Ca 0.00 0.00 -0.10 0.00 -1.93 0.00 0.00 57.85 55.82 3hve n ARG 84 Cb 0.02 0.00 0.04 0.00 -1.16 0.00 0.00 32.46 31.35 3hve n ARG 84 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 3hve h GLU 85 N 0.00 0.77 -0.26 5.56 3.07 -1.96 0.35 114.58 122.10 3hve h GLU 85 Ca 0.00 -0.40 -0.14 0.00 -0.50 0.00 0.00 59.36 58.32 3hve h GLU 85 Cb 0.00 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 27.91 3hve h GLU 85 CO 0.00 1.02 -0.41 0.82 -1.40 0.00 0.00 179.01 179.04 3hve h ILE 86 N 0.63 1.30 -0.38 3.13 2.04 -0.80 0.11 117.51 123.53 3hve h ILE 86 Ca 0.05 -1.59 -0.12 0.00 1.00 0.00 0.00 64.86 64.20 3hve h ILE 86 Cb 0.95 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.56 3hve h ILE 86 CO 0.09 0.51 -0.26 -0.07 0.00 0.00 0.00 178.15 178.42 3hve h LEU 87 N 0.52 0.81 -0.44 1.44 3.38 -1.69 -0.13 115.31 119.19 3hve h LEU 87 Ca 0.04 -0.31 -0.18 0.00 0.09 0.00 0.00 57.88 57.53 3hve h LEU 87 Cb 0.94 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 3hve h LEU 87 CO 0.08 1.03 -0.67 0.44 0.09 0.00 0.00 178.44 179.41 3hve h ASP 88 N 0.68 0.53 -0.40 -0.43 5.19 -0.16 -2.63 116.42 119.19 3hve h ASP 88 Ca 0.09 -0.32 0.06 0.00 -0.62 0.00 0.00 57.03 56.23 3hve h ASP 88 Cb 0.78 -0.15 -0.05 0.00 0.18 0.00 0.00 39.33 40.09 3hve h ASP 88 CO 0.06 1.05 0.09 0.22 -3.12 0.00 0.00 179.24 177.55 3hve h TYR 89 N 0.32 0.15 -0.94 4.55 3.20 -0.40 -0.62 116.97 123.23 3hve h TYR 89 Ca -0.02 0.02 0.14 0.00 3.14 0.00 0.00 58.73 62.02 3hve h TYR 89 Cb 1.23 -0.01 -0.08 0.00 1.54 0.00 0.00 36.73 39.41 3hve h TYR 89 CO 0.04 0.03 0.60 0.82 -1.64 0.00 0.00 178.16 178.01 3hve h ILE 90 N 0.22 0.84 0.00 1.81 2.04 -0.66 -0.41 117.51 121.36 3hve h ILE 90 Ca 0.19 -0.27 -0.05 0.00 1.00 0.00 0.00 64.86 65.73 3hve h ILE 90 Cb 0.22 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.28 3hve h ILE 90 CO -0.24 0.14 -0.73 -0.26 0.00 0.00 0.00 178.15 177.06 3hve h PHE 91 N 0.78 0.00 0.00 1.37 -1.00 -1.04 -3.40 116.94 113.65 3hve h PHE 91 Ca 0.48 0.00 -0.28 0.00 2.81 0.00 0.00 57.97 60.98 3hve h PHE 91 Cb 0.69 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.20 3hve h PHE 91 CO -0.00 0.21 -2.02 -1.13 -1.61 0.00 0.00 178.31 173.75 3hve n SER 92 N -2.93 2.41 0.00 2.17 3.41 -0.38 -4.73 113.62 113.58 3hve n SER 92 Ca -0.01 -0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 3hve n SER 92 Cb 0.64 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 3hve n SER 92 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hve n GLY 93 N 2.51 0.50 3.15 5.00 0.00 -0.20 -5.07 105.19 111.09 3hve n GLY 93 Ca -0.33 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 3hve n GLY 93 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hve s GLN 94 N -0.76 2.73 -0.13 1.61 -0.21 -1.26 -5.06 119.66 116.58 3hve s GLN 94 Ca 0.00 -0.76 -0.04 0.00 0.02 0.00 0.00 55.36 54.58 3hve s GLN 94 Cb 0.00 -2.16 -0.03 0.00 1.00 0.00 0.00 33.01 31.82 3hve s GLN 94 CO 0.00 0.06 0.00 -1.50 -2.12 0.00 0.00 175.29 171.74 3hve s ILE 95 N 0.63 4.30 -0.82 1.08 1.10 -1.26 -4.32 121.20 121.91 3hve s ILE 95 Ca -0.13 -0.23 -0.23 0.00 -0.51 0.00 0.00 60.65 59.55 3hve s ILE 95 Cb -0.16 -2.86 0.07 0.00 0.15 0.00 0.00 42.46 39.65 3hve s ILE 95 CO 0.03 0.54 1.19 -0.13 -2.11 0.00 0.00 174.94 174.47 3hve s ARG 96 N -0.25 3.35 0.15 3.50 0.52 -1.26 -4.99 118.95 119.96 3hve s ARG 96 Ca 0.06 -0.96 0.10 0.00 -0.52 0.00 0.00 55.73 54.42 3hve s ARG 96 Cb -0.12 -4.64 -0.04 0.00 0.52 0.00 0.00 34.95 30.67 3hve s ARG 96 CO 0.02 -1.98 -0.22 -0.51 0.02 0.00 0.00 175.30 172.63 3hve s LEU 97 N 4.40 2.52 0.17 2.53 1.02 -1.26 -5.03 118.68 123.02 3hve s LEU 97 Ca 0.33 -0.72 0.00 0.00 0.02 0.00 0.00 54.13 53.76 3hve s LEU 97 Cb -0.08 -1.33 0.00 0.00 0.02 0.00 0.00 46.19 44.80 3hve s LEU 97 CO 0.02 0.15 0.00 0.59 0.02 0.00 0.00 176.35 177.14 3hve n ASN 98 N 0.58 -1.49 0.00 2.29 5.03 -1.26 -5.06 115.26 115.36 3hve n ASN 98 Ca -0.15 0.41 0.00 0.00 0.87 0.00 0.00 54.58 55.72 3hve n ASN 98 Cb 0.54 1.62 0.00 0.00 -1.02 0.00 0.00 39.78 40.92 3hve n ASN 98 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 3hve n ASP 100 N -2.84 0.00 0.00 6.41 8.00 -1.26 -3.52 116.55 123.34 3hve n ASP 100 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3hve n ASP 100 Cb 0.00 -0.14 0.00 0.00 -0.02 0.00 0.00 41.12 40.96 3hve n ASP 100 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3hve n THR 101 N -1.01 0.00 -0.20 -3.53 -1.04 -1.26 -4.89 114.28 102.34 3hve n THR 101 Ca 0.00 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 3hve n THR 101 Cb 0.00 -0.19 -0.05 0.00 -1.82 0.00 0.00 70.33 68.27 3hve n THR 101 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 3hve n ILE 102 N -1.37 -0.33 0.12 12.58 5.41 -1.23 0.64 119.36 135.17 3hve n ILE 102 Ca 0.00 1.44 0.08 0.00 1.00 0.00 0.00 62.75 65.27 3hve n ILE 102 Cb 0.19 -1.80 0.41 0.00 -0.71 0.00 0.00 39.64 37.73 3hve n ILE 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3hve n GLN 103 N -4.24 0.10 0.03 0.38 10.64 -1.26 -1.16 117.38 121.86 3hve n GLN 103 Ca 0.01 0.59 -0.19 0.00 -1.83 0.00 0.00 57.00 55.58 3hve n GLN 103 Cb 0.13 -1.86 -0.13 0.00 -0.86 0.00 0.00 30.24 27.52 3hve n GLN 103 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.06 174.79 3hve h ASP 104 N 0.00 0.48 1.10 2.61 3.45 -0.16 -2.95 116.42 120.95 3hve h ASP 104 Ca 0.00 -0.88 0.00 0.00 0.43 0.00 0.00 57.03 56.58 3hve h ASP 104 Cb 0.07 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 38.69 3hve h ASP 104 CO 0.00 1.31 0.00 0.58 -1.57 0.00 0.00 179.24 179.56 3hve h VAL 105 N -0.29 0.00 0.15 -1.35 2.07 -0.96 -2.92 116.25 112.96 3hve h VAL 105 Ca -0.11 -0.53 -0.33 0.00 0.82 0.00 0.00 66.70 66.54 3hve h VAL 105 Cb 1.49 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.77 3hve h VAL 105 CO 0.13 0.00 -1.68 0.58 0.02 0.00 0.00 177.57 176.63 3hve h VAL 106 N 0.00 1.00 -0.90 2.57 2.07 -1.47 -1.48 116.25 118.04 3hve h VAL 106 Ca 0.00 -2.62 -0.00 0.00 0.82 0.00 0.00 66.70 64.90 3hve h VAL 106 Cb 0.55 2.74 -0.04 0.00 -1.52 0.00 0.00 31.29 33.02 3hve h VAL 106 CO 0.00 0.83 0.56 -0.61 0.02 0.00 0.00 177.57 178.37 3hve h GLN 107 N 0.09 1.21 -0.01 1.57 4.15 -1.40 0.27 115.11 121.00 3hve h GLN 107 Ca -0.31 -0.10 -0.26 0.00 0.77 0.00 0.00 58.65 58.76 3hve h GLN 107 Cb 2.06 -0.26 0.02 0.00 0.21 0.00 0.00 27.48 29.51 3hve h GLN 107 CO 0.17 0.83 -1.02 0.00 -1.93 0.00 0.00 178.83 176.88 3hve h ALA 108 N 1.38 0.18 -0.72 3.38 0.00 -1.58 -0.83 119.26 121.08 3hve h ALA 108 Ca 0.33 -0.70 -0.00 0.00 0.00 0.00 0.00 54.91 54.53 3hve h ALA 108 Cb -0.08 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3hve h ALA 108 CO -0.06 0.71 0.43 0.00 0.00 0.00 0.00 179.25 180.32 3hve h ALA 109 N 0.47 1.41 0.40 0.00 0.00 -0.72 -0.15 119.26 120.67 3hve h ALA 109 Ca -0.12 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3hve h ALA 109 Cb 1.67 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3hve h ALA 109 CO 0.20 0.51 -0.19 0.22 0.00 0.00 0.00 179.25 179.99 3hve h ASP 110 N 0.99 -0.45 -0.77 0.00 3.58 -0.32 -0.53 116.42 118.91 3hve h ASP 110 Ca 0.26 0.02 0.14 0.00 0.42 0.00 0.00 57.03 57.87 3hve h ASP 110 Cb -0.03 0.12 -0.14 0.00 1.72 0.00 0.00 39.33 40.99 3hve h ASP 110 CO -0.05 -0.28 -0.26 0.25 -2.88 0.00 0.00 179.24 176.03 3hve h LEU 111 N -0.62 -0.93 -0.22 2.28 7.12 -0.91 0.14 115.31 122.17 3hve h LEU 111 Ca -0.05 0.24 0.00 0.00 0.13 0.00 0.00 57.88 58.20 3hve h LEU 111 Cb 0.41 0.55 0.00 0.00 -0.53 0.00 0.00 40.66 41.08 3hve h LEU 111 CO 0.09 -0.28 -0.04 0.18 -0.13 0.00 0.00 178.44 178.26 3hve n LEU 112 N -5.49 0.39 -3.35 2.25 4.77 -0.09 -4.84 117.00 110.64 3hve n LEU 112 Ca 0.09 -0.02 -0.18 0.00 -0.03 0.00 0.00 56.01 55.87 3hve n LEU 112 Cb 0.39 -0.11 0.06 0.00 -2.33 0.00 0.00 43.42 41.42 3hve n LEU 112 CO -0.03 0.07 0.03 0.18 -1.33 0.00 0.00 177.39 176.31 3hve n LEU 113 N -0.86 -4.99 -4.09 2.23 4.77 0.04 -3.61 117.00 110.48 3hve n LEU 113 Ca 0.18 -0.73 -0.38 0.00 -0.03 0.00 0.00 56.01 55.05 3hve n LEU 113 Cb 0.23 -2.99 -0.04 0.00 -2.33 0.00 0.00 43.42 38.28 3hve n LEU 113 CO 0.21 0.08 0.51 0.18 -1.33 0.00 0.00 177.39 177.04 3hve n LEU 114 N -3.32 4.70 -0.20 2.23 4.77 -0.61 -4.16 117.00 120.41 3hve n LEU 114 Ca -0.07 -5.15 0.01 0.00 -0.03 0.00 0.00 56.01 50.77 3hve n LEU 114 Cb 0.60 -1.16 0.11 0.00 -2.33 0.00 0.00 43.42 40.64 3hve n LEU 114 CO 0.61 1.57 0.91 0.74 -1.33 0.00 0.00 177.39 179.89 3hve h THR 115 N 3.82 0.63 -0.16 -5.08 2.02 -1.91 0.54 112.91 112.77 3hve h THR 115 Ca 0.17 -0.08 0.02 0.00 0.77 0.00 0.00 66.41 67.29 3hve h THR 115 Cb 0.79 0.36 -0.05 0.00 -1.74 0.00 0.00 68.15 67.51 3hve h THR 115 CO 0.94 0.05 -0.37 -2.24 0.37 0.00 0.00 175.52 174.27 3hve h ASP 116 N 0.25 -1.19 -0.03 4.18 2.03 -1.96 0.89 116.42 120.58 3hve h ASP 116 Ca 0.31 0.15 -0.04 0.00 -0.73 0.00 0.00 57.03 56.72 3hve h ASP 116 Cb 0.47 0.47 -0.01 0.00 -0.83 0.00 0.00 39.33 39.43 3hve h ASP 116 CO -0.41 -0.30 -0.07 0.25 -1.03 0.00 0.00 179.24 177.68 3hve h LEU 117 N -0.35 0.23 -1.50 0.15 5.85 -1.81 -1.95 115.31 115.94 3hve h LEU 117 Ca 0.03 -0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 3hve h LEU 117 Cb 0.43 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 3hve h LEU 117 CO -0.33 0.34 -0.19 0.50 -0.34 0.00 0.00 178.44 178.42 3hve h LYS 118 N 0.24 0.09 -0.02 1.25 3.11 0.12 -1.46 116.57 119.90 3hve h LYS 118 Ca 0.05 -0.02 -0.23 0.00 -2.81 0.00 0.00 60.65 57.64 3hve h LYS 118 Cb 0.28 -0.01 0.02 0.00 -1.00 0.00 0.00 32.23 31.52 3hve h LYS 118 CO 0.01 0.28 -0.89 1.15 -2.81 0.00 0.00 179.45 177.19 3hve h THR 119 N 0.08 1.32 -0.07 1.00 2.02 -0.08 -2.50 112.91 114.68 3hve h THR 119 Ca 0.02 -2.16 0.00 0.00 0.77 0.00 0.00 66.41 65.03 3hve h THR 119 Cb 0.38 2.39 -0.00 0.00 -1.74 0.00 0.00 68.15 69.18 3hve h THR 119 CO 0.03 0.66 0.04 -0.07 0.37 0.00 0.00 175.52 176.55 3hve h LEU 120 N 0.27 0.08 -1.58 2.58 4.07 -1.23 0.54 115.31 120.04 3hve h LEU 120 Ca -0.11 -0.02 0.09 0.00 0.08 0.00 0.00 57.88 57.93 3hve h LEU 120 Cb 1.55 -0.02 -0.04 0.00 1.08 0.00 0.00 40.66 43.24 3hve h LEU 120 CO 0.18 0.08 0.41 0.00 -1.08 0.00 0.00 178.44 178.03 3hve h GLU 123 N 0.51 -0.75 -0.34 0.00 5.08 0.79 -1.90 114.58 117.97 3hve h GLU 123 Ca 0.03 0.05 0.07 0.00 -1.00 0.00 0.00 59.36 58.52 3hve h GLU 123 Cb 1.00 0.17 -0.08 0.00 0.50 0.00 0.00 28.75 30.35 3hve h GLU 123 CO 0.09 -0.48 -0.18 0.35 -1.00 0.00 0.00 179.01 177.79 3hve h PHE 124 N -0.82 -0.46 -0.90 4.33 3.57 -0.87 -1.32 116.94 120.47 3hve h PHE 124 Ca -0.08 0.04 0.14 0.00 3.53 0.00 0.00 57.97 61.60 3hve h PHE 124 Cb 0.61 0.26 -0.07 0.00 2.79 0.00 0.00 35.95 39.54 3hve h PHE 124 CO -0.03 -0.26 0.58 -0.07 -2.23 0.00 0.00 178.31 176.30 3hve h LEU 125 N -0.13 0.70 0.02 0.59 3.38 -1.03 -2.35 115.31 116.48 3hve h LEU 125 Ca 0.17 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 3hve h LEU 125 Cb 0.40 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3hve h LEU 125 CO -0.42 0.36 -0.01 -0.33 0.09 0.00 0.00 178.44 178.13 3hve h GLU 126 N 0.74 -0.02 0.00 1.13 5.08 -0.41 -2.41 114.58 118.69 3hve h GLU 126 Ca 0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.81 3hve h GLU 126 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 3hve h GLU 126 CO -0.21 0.05 0.00 0.41 -1.00 0.00 0.00 179.01 178.25 3hve n GLY 127 N -0.94 -0.66 0.02 -3.84 0.00 -0.90 -1.72 105.19 97.16 3hve n GLY 127 Ca -0.07 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.04 3hve n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hve n ILE 129 N -1.74 0.55 -3.78 0.00 5.41 -0.70 -4.76 119.36 114.35 3hve n ILE 129 Ca 0.04 -0.13 0.00 0.00 1.00 0.00 0.00 62.75 63.66 3hve n ILE 129 Cb 0.38 -1.88 0.00 0.00 -0.71 0.00 0.00 39.64 37.43 3hve n ILE 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3hve n ALA 130 N 7.01 0.00 1.18 -1.39 0.00 -1.26 -5.01 120.51 121.04 3hve n ALA 130 Ca 0.24 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.74 3hve n ALA 130 Cb 0.29 0.00 0.22 0.00 0.00 0.00 0.00 19.45 19.96 3hve n ALA 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hve n ALA 131 N -3.00 2.48 0.00 0.00 0.00 -1.26 -3.51 120.51 115.22 3hve n ALA 131 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.96 3hve n ALA 131 Cb 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.42 3hve n ALA 131 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3hve n GLU 132 N 0.26 0.00 -0.94 0.00 4.71 -1.26 -4.57 120.64 118.85 3hve n GLU 132 Ca 0.12 0.00 -0.15 0.00 -0.01 0.00 0.00 57.16 57.12 3hve n GLU 132 Cb 0.25 -0.83 -0.01 0.00 -1.01 0.00 0.00 31.44 29.85 3hve n GLU 132 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3hve n ASN 133 N -2.38 6.14 -0.08 1.62 5.03 -1.25 -4.14 115.26 120.20 3hve n ASN 133 Ca 0.00 -2.91 -0.14 0.00 0.87 0.00 0.00 54.58 52.40 3hve n ASN 133 Cb 0.40 -1.14 -0.05 0.00 -1.02 0.00 0.00 39.78 37.97 3hve n ASN 133 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3hve h ILE 135 N -0.72 1.43 0.41 0.00 2.04 -1.89 -2.19 117.51 116.58 3hve h ILE 135 Ca -0.25 -1.65 -0.01 0.00 1.00 0.00 0.00 64.86 63.95 3hve h ILE 135 Cb 1.08 2.31 -0.03 0.00 -0.74 0.00 0.00 36.82 39.45 3hve h ILE 135 CO -0.15 0.47 -0.47 1.23 0.00 0.00 0.00 178.15 179.23 3hve h GLY 136 N -0.21 -1.11 1.59 5.37 0.00 -1.82 0.51 103.07 107.40 3hve h GLY 136 Ca -0.01 0.54 0.03 0.00 0.00 0.00 0.00 47.33 47.89 3hve h GLY 136 CO 0.05 -0.34 0.17 -2.22 0.00 0.00 0.00 176.54 174.21 3hve h ILE 137 N -0.90 0.33 0.09 2.60 2.04 -1.62 -1.85 117.51 118.20 3hve h ILE 137 Ca -0.04 0.00 -0.27 0.00 1.00 0.00 0.00 64.86 65.54 3hve h ILE 137 Cb 0.81 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 3hve h ILE 137 CO -0.10 0.00 -1.33 -0.09 0.00 0.00 0.00 178.15 176.63 3hve h ARG 138 N 0.00 0.19 -0.18 2.37 2.43 -0.37 -1.92 114.38 116.90 3hve h ARG 138 Ca 0.06 -0.33 -0.11 0.00 -0.81 0.00 0.00 59.98 58.79 3hve h ARG 138 Cb 0.40 0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.08 3hve h ARG 138 CO -0.00 1.09 -0.31 -0.44 -1.51 0.00 0.00 179.97 178.80 3hve h ASP 139 N 0.05 0.58 -0.93 -3.80 3.32 -0.31 -2.66 116.42 112.68 3hve h ASP 139 Ca -0.16 -0.54 0.00 0.00 0.02 0.00 0.00 57.03 56.36 3hve h ASP 139 Cb 1.95 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 41.29 3hve h ASP 139 CO 0.17 1.01 0.58 0.15 -1.72 0.00 0.00 179.24 179.43 3hve h PHE 140 N 0.18 1.20 0.00 4.55 3.57 -1.44 -1.96 116.94 123.04 3hve h PHE 140 Ca 0.01 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.42 3hve h PHE 140 Cb 0.90 -0.40 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 3hve h PHE 140 CO 0.09 0.78 -0.48 0.00 -2.23 0.00 0.00 178.31 176.48 3hve h ALA 141 N 1.32 1.15 -0.24 2.41 0.00 -1.29 -2.53 119.26 120.08 3hve h ALA 141 Ca 0.34 -0.44 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3hve h ALA 141 Cb -0.09 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3hve h ALA 141 CO -0.07 0.60 0.00 1.25 0.00 0.00 0.00 179.25 181.03 3hve h LEU 142 N 0.00 0.42 0.13 0.00 5.85 -1.09 0.60 115.31 121.23 3hve h LEU 142 Ca -0.00 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 3hve h LEU 142 Cb 0.88 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.80 3hve h LEU 142 CO 0.06 0.63 -0.06 -0.74 -0.34 0.00 0.00 178.44 177.98 3hve h HIS 143 N 0.20 -0.17 -0.14 1.25 2.76 -1.16 -2.55 115.15 115.35 3hve h HIS 143 Ca 0.07 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 3hve h HIS 143 Cb 0.41 0.06 0.00 0.00 1.55 0.00 0.00 27.41 29.42 3hve h HIS 143 CO 0.03 -0.02 0.00 0.66 -1.30 0.00 0.00 177.93 177.30 3hve n TYR 144 N -5.12 0.18 -2.81 5.26 4.02 -0.97 -4.91 117.16 112.81 3hve n TYR 144 Ca -0.08 -0.09 -0.17 0.00 -0.01 0.00 0.00 57.90 57.54 3hve n TYR 144 Cb 0.13 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.48 3hve n TYR 144 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3hve s LEU 146 N -5.20 3.53 0.00 0.00 1.43 0.20 -4.89 118.68 113.75 3hve s LEU 146 Ca 0.22 -1.64 0.00 0.00 -1.03 0.00 0.00 54.13 51.68 3hve s LEU 146 Cb -0.10 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.55 3hve s LEU 146 CO 0.27 -1.63 0.91 1.41 0.23 0.00 0.00 176.35 177.54 3hve n HIS 147 N 9.58 0.00 -0.19 0.29 8.25 -1.26 -1.04 115.22 130.85 3hve n HIS 147 Ca 0.39 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 58.01 3hve n HIS 147 Cb 0.49 -0.41 0.50 0.00 1.12 0.00 0.00 29.99 31.69 3hve n HIS 147 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 3hve h HIS 148 N 0.00 0.51 -0.52 4.41 -0.00 -1.97 0.37 115.15 117.94 3hve h HIS 148 Ca 0.00 0.01 -0.11 0.00 -0.00 0.00 0.00 60.37 60.27 3hve h HIS 148 Cb 0.00 -0.16 -0.02 0.00 -0.00 0.00 0.00 27.41 27.23 3hve h HIS 148 CO -0.41 0.18 -0.11 0.28 -0.00 0.00 0.00 177.93 177.88 3hve h VAL 149 N 0.42 1.27 -0.48 5.26 2.07 -1.86 -1.09 116.25 121.84 3hve h VAL 149 Ca 0.40 -1.25 -0.11 0.00 0.82 0.00 0.00 66.70 66.56 3hve h VAL 149 Cb 0.92 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 3hve h VAL 149 CO -0.13 0.44 -0.13 -0.74 0.02 0.00 0.00 177.57 177.03 3hve h HIS 150 N 0.87 0.99 0.54 1.57 2.76 0.70 -1.97 115.15 120.61 3hve h HIS 150 Ca 0.14 -0.20 -0.02 0.00 -2.20 0.00 0.00 60.37 58.09 3hve h HIS 150 Cb 0.66 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.36 3hve h HIS 150 CO 0.04 0.96 -0.41 -0.92 -1.30 0.00 0.00 177.93 176.30 3hve h TYR 151 N 0.79 -1.10 -0.51 5.26 3.20 -0.51 0.99 116.97 125.10 3hve h TYR 151 Ca 0.13 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.09 3hve h TYR 151 Cb 0.65 0.41 -0.09 0.00 1.54 0.00 0.00 36.73 39.25 3hve h TYR 151 CO 0.04 -0.57 -0.04 -0.07 -1.64 0.00 0.00 178.16 175.87 3hve h LEU 152 N -0.91 -0.30 -1.35 2.82 3.38 -1.16 0.16 115.31 117.95 3hve h LEU 152 Ca -0.07 0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 3hve h LEU 152 Cb 0.75 0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 3hve h LEU 152 CO 0.02 -0.11 -0.27 0.00 0.09 0.00 0.00 178.44 178.18 3hve h ALA 153 N 1.47 1.18 -0.11 1.53 0.00 -1.30 -0.12 119.26 121.91 3hve h ALA 153 Ca 0.25 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3hve h ALA 153 Cb 0.39 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3hve h ALA 153 CO -0.46 0.34 -0.11 1.15 0.00 0.00 0.00 179.25 180.17 3hve h THR 154 N 0.00 1.36 -0.36 0.00 2.02 0.12 -2.69 112.91 113.35 3hve h THR 154 Ca -0.00 -1.27 0.04 0.00 0.77 0.00 0.00 66.41 65.95 3hve h THR 154 Cb 0.64 1.95 -0.04 0.00 -1.74 0.00 0.00 68.15 68.96 3hve h THR 154 CO 0.03 0.36 0.13 -0.08 0.37 0.00 0.00 175.52 176.34 3hve h GLU 155 N -0.14 0.28 0.16 6.66 4.81 -0.28 -0.56 114.58 125.52 3hve h GLU 155 Ca 0.02 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 3hve h GLU 155 Cb 0.63 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 3hve h GLU 155 CO 0.03 0.19 -0.25 -0.92 -0.73 0.00 0.00 179.01 177.32 3hve h TYR 156 N 0.29 -0.67 -0.57 0.92 3.20 -1.05 0.11 116.97 119.20 3hve h TYR 156 Ca 0.16 0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.15 3hve h TYR 156 Cb 0.13 0.28 -0.11 0.00 1.54 0.00 0.00 36.73 38.57 3hve h TYR 156 CO -0.14 -0.36 -0.27 1.25 -1.64 0.00 0.00 178.16 177.00 3hve h LEU 157 N -0.48 -0.95 -0.62 2.82 6.46 -1.12 0.19 115.31 121.61 3hve h LEU 157 Ca 0.02 0.21 0.03 0.00 -0.12 0.00 0.00 57.88 58.02 3hve h LEU 157 Cb 0.49 0.50 -0.04 0.00 -0.73 0.00 0.00 40.66 40.88 3hve h LEU 157 CO -0.11 -0.28 0.38 -0.33 -0.62 0.00 0.00 178.44 177.47 3hve h GLU 158 N -0.13 0.71 -0.31 1.25 5.08 0.09 0.67 114.58 121.94 3hve h GLU 158 Ca 0.25 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 3hve h GLU 158 Cb 0.52 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.61 3hve h GLU 158 CO -0.65 0.47 0.00 0.25 -1.00 0.00 0.00 179.01 178.09 3hve n THR 159 N -4.74 0.41 -1.39 1.13 -2.24 0.27 -4.06 114.28 103.66 3hve n THR 159 Ca 0.06 -0.51 0.00 0.00 -2.27 0.00 0.00 64.05 61.33 3hve n THR 159 Cb 0.09 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 3hve n THR 159 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3hve n HIS 160 N 0.70 0.00 -0.25 4.78 8.25 0.57 -4.92 115.22 124.35 3hve n HIS 160 Ca 0.16 -0.05 -0.01 0.00 -0.26 0.00 0.00 57.72 57.56 3hve n HIS 160 Cb 0.39 -0.03 0.06 0.00 1.12 0.00 0.00 29.99 31.53 3hve n HIS 160 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 3hve h PHE 161 N 0.00 -0.62 -0.96 4.41 3.57 -1.02 -1.45 116.94 120.88 3hve h PHE 161 Ca 0.00 0.07 0.22 0.00 3.53 0.00 0.00 57.97 61.80 3hve h PHE 161 Cb 1.15 0.38 -0.18 0.00 2.79 0.00 0.00 35.95 40.09 3hve h PHE 161 CO 0.04 -0.35 -0.11 0.00 -2.23 0.00 0.00 178.31 175.66 3hve h ARG 162 N -0.06 0.01 0.10 1.11 -0.00 -1.90 0.69 114.38 114.34 3hve h ARG 162 Ca 0.31 -0.00 -0.00 0.00 -0.50 0.00 0.00 59.98 59.79 3hve h ARG 162 Cb 0.55 -0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.52 3hve h ARG 162 CO -0.75 0.01 -0.05 0.38 0.00 0.00 0.00 179.97 179.56 3hve h ASP 163 N 0.01 -0.12 -1.10 7.04 3.04 -1.69 -3.19 116.42 120.41 3hve h ASP 163 Ca 0.52 -0.46 0.33 0.00 -3.24 0.00 0.00 57.03 54.18 3hve h ASP 163 Cb 0.93 0.03 -0.13 0.00 -1.04 0.00 0.00 39.33 39.12 3hve h ASP 163 CO -0.94 0.46 0.68 0.58 -2.04 0.00 0.00 179.24 177.98 3hve h VAL 164 N -0.76 0.33 -1.29 4.15 2.07 -0.71 0.81 116.25 120.85 3hve h VAL 164 Ca -0.01 -0.10 0.38 0.00 0.82 0.00 0.00 66.70 67.78 3hve h VAL 164 Cb 0.56 0.01 -0.08 0.00 -1.52 0.00 0.00 31.29 30.27 3hve h VAL 164 CO 0.02 0.05 0.89 0.28 0.02 0.00 0.00 177.57 178.84 3hve h SER 165 N 0.29 0.15 -0.76 0.57 0.02 -0.91 0.46 113.55 113.37 3hve h SER 165 Ca 0.71 0.04 -0.44 0.00 -0.84 0.00 0.00 61.79 61.27 3hve h SER 165 Cb 1.85 0.03 -0.23 0.00 0.14 0.00 0.00 62.40 64.19 3hve h SER 165 CO -0.45 -0.01 0.56 -1.20 -1.14 0.00 0.00 176.83 174.58 3hve n SER 166 N -4.34 4.74 -4.37 3.07 7.64 0.28 -4.77 113.62 115.88 3hve n SER 166 Ca 0.30 -3.31 -0.32 0.00 1.01 0.00 0.00 58.87 56.56 3hve n SER 166 Cb 1.30 -0.84 -0.15 0.00 -1.01 0.00 0.00 64.21 63.51 3hve n SER 166 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3hve s THR 167 N -2.90 2.51 0.52 0.44 2.01 0.16 -5.00 115.64 113.37 3hve s THR 167 Ca 0.46 -0.92 0.18 0.00 0.31 0.00 0.00 61.69 61.71 3hve s THR 167 Cb 0.37 -1.94 0.27 0.00 0.01 0.00 0.00 72.50 71.21 3hve s THR 167 CO 0.05 0.58 2.14 1.05 -0.69 0.00 0.00 174.62 177.75 3hve h GLU 168 N 5.67 0.00 -0.55 4.92 4.11 -1.91 0.11 114.58 126.92 3hve h GLU 168 Ca -0.40 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 58.96 3hve h GLU 168 Cb 1.15 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.38 3hve h GLU 168 CO 0.49 0.03 0.09 1.05 0.07 0.00 0.00 179.01 180.74 3hve h GLU 169 N 0.00 0.91 0.00 1.06 9.09 -1.92 -1.76 114.58 121.96 3hve h GLU 169 Ca -0.00 -0.24 -0.13 0.00 0.05 0.00 0.00 59.36 59.03 3hve h GLU 169 Cb 0.05 -0.11 -0.02 0.00 -1.65 0.00 0.00 28.75 27.03 3hve h GLU 169 CO 0.00 0.88 -0.64 0.35 0.05 0.00 0.00 179.01 179.65 3hve h PHE 170 N 0.80 0.00 0.00 2.06 3.57 -1.43 -3.26 116.94 118.68 3hve h PHE 170 Ca 0.17 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 3hve h PHE 170 Cb 0.41 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.15 3hve h PHE 170 CO 0.03 0.64 -0.14 -0.07 -2.23 0.00 0.00 178.31 176.54 3hve h LEU 171 N 0.00 0.00 -0.23 0.59 3.38 -0.73 -3.30 115.31 115.02 3hve h LEU 171 Ca -0.01 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.47 3hve h LEU 171 Cb 1.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.21 3hve h LEU 171 CO 0.08 0.83 0.00 -1.84 0.09 0.00 0.00 178.44 177.60 3hve n GLU 172 N -4.66 0.83 -0.46 1.13 0.28 -0.67 -4.82 120.64 112.27 3hve n GLU 172 Ca -0.08 0.00 -0.30 0.00 -0.16 0.00 0.00 57.16 56.62 3hve n GLU 172 Cb 0.30 -1.10 0.28 0.00 1.43 0.00 0.00 31.44 32.35 3hve n GLU 172 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 3hve s LEU 173 N -0.77 -0.45 0.12 -1.84 2.96 -1.23 -5.03 118.68 112.44 3hve s LEU 173 Ca 0.00 1.05 -0.03 0.00 -0.22 0.00 0.00 54.13 54.93 3hve s LEU 173 Cb 0.00 -2.64 -0.05 0.00 0.50 0.00 0.00 46.19 44.00 3hve s LEU 173 CO 0.00 -4.97 0.33 -0.44 -1.32 0.00 0.00 176.35 169.95 3hve s SER 174 N -2.97 6.44 0.51 3.68 0.01 -1.26 -4.98 113.70 115.14 3hve s SER 174 Ca 0.69 0.48 0.25 0.00 1.31 0.00 0.00 55.95 58.68 3hve s SER 174 Cb -0.17 -2.04 1.40 0.00 0.21 0.00 0.00 66.02 65.42 3hve s SER 174 CO 0.60 0.08 2.07 1.55 0.41 0.00 0.00 173.24 177.95 3hve h PRO 175 N 2.84 0.00 0.00 12.44 0.13 -1.97 0.11 132.00 145.54 3hve h PRO 175 Ca -0.46 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.48 3hve h PRO 175 Cb 1.16 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 3hve h PRO 175 CO 0.73 0.12 -0.98 1.96 -0.23 0.00 0.00 178.00 179.60 3hve h GLN 176 N 0.00 0.00 0.16 0.86 7.50 -1.99 -2.87 115.11 118.76 3hve h GLN 176 Ca -0.00 0.00 -0.25 0.00 0.50 0.00 0.00 58.65 58.90 3hve h GLN 176 Cb 0.31 0.00 0.03 0.00 0.05 0.00 0.00 27.48 27.87 3hve h GLN 176 CO 0.02 0.82 -1.06 1.57 -1.50 0.00 0.00 178.83 178.68 3hve h LYS 177 N 0.00 0.44 -0.02 1.46 2.10 -1.71 -3.24 116.57 115.61 3hve h LYS 177 Ca -0.04 -0.69 -0.01 0.00 -2.00 0.00 0.00 60.65 57.91 3hve h LYS 177 Cb 1.71 0.25 -0.00 0.00 -0.90 0.00 0.00 32.23 33.28 3hve h LYS 177 CO 0.11 1.31 -0.05 1.25 -2.00 0.00 0.00 179.45 180.08 3hve h LEU 178 N -0.08 0.02 -1.17 7.07 6.46 -0.92 0.22 115.31 126.91 3hve h LEU 178 Ca -0.18 -0.00 -0.08 0.00 -0.12 0.00 0.00 57.88 57.50 3hve h LEU 178 Cb 1.81 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 41.73 3hve h LEU 178 CO 0.20 0.07 -0.39 0.11 -0.62 0.00 0.00 178.44 177.81 3hve h LYS 179 N 0.02 0.00 0.00 1.25 1.57 -1.53 -1.97 116.57 115.91 3hve h LYS 179 Ca 0.01 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.57 3hve h LYS 179 Cb 0.10 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.37 3hve h LYS 179 CO 0.01 0.39 -1.59 -0.85 -0.57 0.00 0.00 179.45 176.84 3hve n GLU 180 N -3.90 0.63 -0.13 3.15 0.28 -0.47 -3.08 120.64 117.12 3hve n GLU 180 Ca -0.01 0.22 -0.06 0.00 -0.16 0.00 0.00 57.16 57.14 3hve n GLU 180 Cb 0.45 -1.77 0.11 0.00 1.43 0.00 0.00 31.44 31.65 3hve n GLU 180 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 3hve h VAL 181 N 0.00 1.25 -0.04 3.84 2.07 -0.79 -2.38 116.25 120.21 3hve h VAL 181 Ca -0.23 -1.11 -0.16 0.00 0.82 0.00 0.00 66.70 66.02 3hve h VAL 181 Cb 1.75 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.43 3hve h VAL 181 CO 0.05 0.39 -0.70 0.40 0.02 0.00 0.00 177.57 177.73 3hve h ILE 182 N 0.79 1.43 -0.13 4.57 2.04 -1.49 -3.32 117.51 121.40 3hve h ILE 182 Ca 0.14 -2.22 0.01 0.00 1.00 0.00 0.00 64.86 63.80 3hve h ILE 182 Cb 0.53 2.17 -0.02 0.00 -0.74 0.00 0.00 36.82 38.77 3hve h ILE 182 CO 0.03 0.65 -0.12 -1.28 0.00 0.00 0.00 178.15 177.43 3hve h SER 183 N 0.15 -0.42 -1.43 1.72 0.87 -1.35 -3.40 113.55 109.70 3hve h SER 183 Ca -0.02 0.06 -0.72 0.00 -1.23 0.00 0.00 61.79 59.88 3hve h SER 183 Cb 1.25 0.18 0.05 0.00 -0.44 0.00 0.00 62.40 63.44 3hve h SER 183 CO 0.11 -0.07 0.33 0.18 -0.53 0.00 0.00 176.83 176.85 3hve n LEU 184 N -3.35 1.07 -4.67 2.23 4.77 -1.19 -5.11 117.00 110.75 3hve n LEU 184 Ca -0.00 1.13 -0.48 0.00 -0.03 0.00 0.00 56.01 56.63 3hve n LEU 184 Cb 0.07 -1.09 -0.05 0.00 -2.33 0.00 0.00 43.42 40.02 3hve n LEU 184 CO -0.01 -1.33 1.34 -1.84 -1.33 0.00 0.00 177.39 174.22 3hve n GLU 185 N 2.26 2.11 0.00 3.23 -0.00 -1.26 -5.02 120.64 121.95 3hve n GLU 185 Ca 0.19 0.77 0.00 0.00 -0.00 0.00 0.00 57.16 58.12 3hve n GLU 185 Cb 0.15 -2.57 0.00 0.00 -0.00 0.00 0.00 31.44 29.02 3hve n GLU 185 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.13 180.02 3hve n ARG 193 N 5.10 0.00 0.25 3.44 -4.01 -1.26 -4.99 116.66 115.19 3hve n ARG 193 Ca 0.20 0.00 0.08 0.00 -1.04 0.00 0.00 57.85 57.09 3hve n ARG 193 Cb 0.28 0.00 0.61 0.00 -3.04 0.00 0.00 32.46 30.32 3hve n ARG 193 CO 0.00 0.00 0.00 0.10 -3.04 0.00 0.00 177.63 174.69 3hve h TYR 194 N 0.00 0.00 0.00 2.89 -0.00 -2.03 0.17 116.97 118.00 3hve h TYR 194 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 58.73 58.48 3hve h TYR 194 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 36.69 3hve h TYR 194 CO 0.00 0.10 -1.41 0.28 -0.00 0.00 0.00 178.16 177.13 3hve n VAL 195 N -4.28 1.53 0.25 -0.90 0.31 -1.26 -3.98 118.33 110.00 3hve n VAL 195 Ca -0.03 -0.06 0.18 0.00 -0.01 0.00 0.00 64.34 64.42 3hve n VAL 195 Cb 0.17 -2.04 0.89 0.00 -0.91 0.00 0.00 33.84 31.95 3hve n VAL 195 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 3hve h PHE 196 N -1.00 0.00 -0.95 3.52 0.05 -1.99 0.26 116.94 116.83 3hve h PHE 196 Ca -0.38 0.00 -0.56 0.00 3.82 0.00 0.00 57.97 60.85 3hve h PHE 196 Cb 1.30 0.00 -0.29 0.00 2.00 0.00 0.00 35.95 38.95 3hve h PHE 196 CO 0.04 0.00 0.65 0.39 -0.18 0.00 0.00 178.31 179.21 3hve n GLU 197 N -3.40 2.43 0.00 1.51 1.02 0.59 -3.50 120.64 119.28 3hve n GLU 197 Ca 0.00 -3.16 0.00 0.00 -0.02 0.00 0.00 57.16 53.98 3hve n GLU 197 Cb 0.33 -2.20 0.00 0.00 -0.02 0.00 0.00 31.44 29.55 3hve n GLU 197 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hve n ALA 198 N -1.05 1.27 0.05 0.62 0.00 0.87 -4.47 120.51 117.80 3hve n ALA 198 Ca 0.59 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.91 3hve n ALA 198 Cb 1.23 0.05 -0.02 0.00 0.00 0.00 0.00 19.45 20.72 3hve n ALA 198 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3hve h VAL 199 N 0.00 1.38 0.00 0.00 2.07 -1.54 -1.11 116.25 117.05 3hve h VAL 199 Ca 0.00 -2.28 -0.11 0.00 0.82 0.00 0.00 66.70 65.13 3hve h VAL 199 Cb 0.20 2.26 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 3hve h VAL 199 CO 0.00 0.69 -0.54 0.40 0.02 0.00 0.00 177.57 178.14 3hve h ILE 200 N 0.28 1.06 0.00 4.57 2.04 -1.83 -2.50 117.51 121.12 3hve h ILE 200 Ca -0.06 -2.10 0.00 0.00 1.00 0.00 0.00 64.86 63.70 3hve h ILE 200 Cb 1.45 2.25 0.00 0.00 -0.74 0.00 0.00 36.82 39.79 3hve h ILE 200 CO 0.15 0.53 0.00 -0.09 0.00 0.00 0.00 178.15 178.73 3hve h ARG 201 N 0.00 0.00 0.00 2.37 2.43 -1.74 -3.08 114.38 114.36 3hve h ARG 201 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3hve h ARG 201 Cb 1.21 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 3hve h ARG 201 CO 0.07 0.00 0.00 1.87 -1.51 0.00 0.00 179.97 180.40 3hve n TRP 202 N -2.68 0.00 -3.13 2.20 -0.00 -0.44 -4.38 117.44 109.02 3hve n TRP 202 Ca 0.05 0.00 -0.45 0.00 -0.00 0.00 0.00 57.50 57.09 3hve n TRP 202 Cb 0.47 -0.44 -0.03 0.00 -0.00 0.00 0.00 31.31 31.31 3hve n TRP 202 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 177.69 178.11 3hve s ILE 203 N -2.87 5.12 -0.14 5.87 1.01 -1.17 -4.75 121.20 124.27 3hve s ILE 203 Ca 0.11 -1.87 -0.18 0.00 0.00 0.00 0.00 60.65 58.71 3hve s ILE 203 Cb 0.11 -4.60 -0.24 0.00 0.01 0.00 0.00 42.46 37.74 3hve s ILE 203 CO 0.30 -1.25 0.44 0.00 0.00 0.00 0.00 174.94 174.44 3hve h ALA 204 N 8.44 0.22 -2.05 9.38 0.00 -1.90 -3.50 119.26 129.86 3hve h ALA 204 Ca 0.06 -1.10 -0.50 0.00 0.00 0.00 0.00 54.91 53.37 3hve h ALA 204 Cb 1.04 0.54 -0.05 0.00 0.00 0.00 0.00 17.79 19.33 3hve h ALA 204 CO 0.96 0.76 -0.50 -3.38 0.00 0.00 0.00 179.25 177.08 3hve s HIS 205 N -2.42 3.01 0.00 0.00 0.00 -1.26 -5.03 115.29 109.59 3hve s HIS 205 Ca -0.23 -0.20 0.00 0.00 -3.00 0.00 0.00 55.06 51.63 3hve s HIS 205 Cb 0.04 -1.56 0.00 0.00 -4.00 0.00 0.00 32.58 27.06 3hve s HIS 205 CO 0.70 0.38 0.00 -0.85 -1.00 0.00 0.00 174.74 173.97 3hve n GLU 208 N -1.25 0.00 -0.03 -0.38 0.00 -1.26 0.18 120.64 117.90 3hve n GLU 208 Ca -0.05 0.00 -0.07 0.00 0.00 0.00 0.00 57.16 57.03 3hve n GLU 208 Cb 0.59 0.00 -0.02 0.00 0.00 0.00 0.00 31.44 32.00 3hve n GLU 208 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 3hve n ILE 209 N 0.00 1.18 1.41 3.84 -6.64 -1.26 -4.67 119.36 113.22 3hve n ILE 209 Ca 0.00 0.14 0.12 0.00 -1.77 0.00 0.00 62.75 61.24 3hve n ILE 209 Cb 0.00 -1.88 0.46 0.00 -1.44 0.00 0.00 39.64 36.78 3hve n ILE 209 CO 0.00 0.00 0.00 0.54 -1.77 0.00 0.00 176.55 175.32 3hve n ARG 210 N -3.86 1.61 -1.22 6.28 1.74 0.48 -4.37 116.66 117.33 3hve n ARG 210 Ca -0.13 -0.91 -0.19 0.00 -0.77 0.00 0.00 57.85 55.86 3hve n ARG 210 Cb 0.38 -1.41 -0.12 0.00 -1.02 0.00 0.00 32.46 30.29 3hve n ARG 210 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3hve n LYS 211 N 0.12 2.21 0.00 5.56 5.02 -1.19 -3.92 118.16 125.95 3hve n LYS 211 Ca 0.17 -1.60 0.00 0.00 -2.02 0.00 0.00 58.31 54.86 3hve n LYS 211 Cb 0.30 -2.08 0.00 0.00 -0.02 0.00 0.00 35.03 33.24 3hve n LYS 211 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 3hve n VAL 212 N 1.83 0.00 -2.31 -0.18 3.14 -1.26 -4.88 118.33 114.67 3hve n VAL 212 Ca 0.46 0.00 -0.37 0.00 -2.96 0.00 0.00 64.34 61.47 3hve n VAL 212 Cb 0.75 -0.85 -0.03 0.00 -1.06 0.00 0.00 33.84 32.66 3hve n VAL 212 CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 3hve n HIS 213 N -2.64 3.75 0.00 1.45 8.25 -1.25 -4.66 115.22 120.12 3hve n HIS 213 Ca 0.00 -2.24 0.00 0.00 -0.26 0.00 0.00 57.72 55.22 3hve n HIS 213 Cb 0.46 -2.61 0.00 0.00 1.12 0.00 0.00 29.99 28.96 3hve n HIS 213 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 3hve n LYS 215 N 8.25 0.00 0.15 -0.41 0.00 -1.26 -1.51 118.16 123.38 3hve n LYS 215 Ca 0.47 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.82 3hve n LYS 215 Cb 0.46 0.00 0.44 0.00 -0.00 0.00 0.00 35.03 35.93 3hve n LYS 215 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.40 177.78 3hve h ASP 216 N 0.00 0.15 0.00 -5.58 -0.00 -2.04 -1.14 116.42 107.81 3hve h ASP 216 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 57.03 57.00 3hve h ASP 216 Cb 0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 39.33 39.29 3hve h ASP 216 CO 0.00 0.30 0.00 0.52 -0.00 0.00 0.00 179.24 180.06 3hve n VAL 217 N -4.31 0.36 0.00 4.15 0.31 -0.57 -1.88 118.33 116.39 3hve n VAL 217 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 3hve n VAL 217 Cb 0.24 -0.60 0.00 0.00 -0.91 0.00 0.00 33.84 32.57 3hve n VAL 217 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 3hve n SER 219 N 0.45 0.00 0.03 4.52 2.88 -0.43 0.21 113.62 121.28 3hve n SER 219 Ca 0.00 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.46 3hve n SER 219 Cb 0.25 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 63.80 3hve n SER 219 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hve h ALA 220 N 0.00 0.76 -0.76 -1.46 0.00 -1.63 -3.06 119.26 113.11 3hve h ALA 220 Ca 0.00 -0.51 0.04 0.00 0.00 0.00 0.00 54.91 54.44 3hve h ALA 220 Cb 0.00 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 3hve h ALA 220 CO 0.00 0.69 0.47 -0.07 0.00 0.00 0.00 179.25 180.34 3hve h LEU 221 N 0.35 0.75 0.12 0.00 3.38 -0.51 -1.28 115.31 118.12 3hve h LEU 221 Ca 0.00 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3hve h LEU 221 Cb 1.08 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.68 3hve h LEU 221 CO 0.10 0.50 -0.06 -0.25 0.09 0.00 0.00 178.44 178.83 3hve h TRP 222 N 0.89 -0.15 -0.23 1.13 7.01 -1.79 -0.49 115.95 122.32 3hve h TRP 222 Ca 0.32 -0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.36 3hve h TRP 222 Cb 0.09 0.05 -0.05 0.00 -2.10 0.00 0.00 29.16 27.15 3hve h TRP 222 CO -0.04 -0.07 -0.09 0.28 -2.79 0.00 0.00 178.44 175.74 3hve h VAL 223 N -0.19 0.70 -0.95 2.65 2.07 -1.37 -1.53 116.25 117.62 3hve h VAL 223 Ca -0.02 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.51 3hve h VAL 223 Cb 0.15 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 3hve h VAL 223 CO 0.03 0.00 0.62 0.28 0.02 0.00 0.00 177.57 178.51 3hve h SER 224 N -0.05 1.11 0.06 0.57 0.02 -1.10 0.25 113.55 114.42 3hve h SER 224 Ca 0.12 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 3hve h SER 224 Cb 0.22 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.49 3hve h SER 224 CO -0.26 0.82 0.00 0.61 -1.14 0.00 0.00 176.83 176.85 3hve n GLY 225 N -1.35 -0.35 0.07 -3.77 0.00 -0.21 -1.77 105.19 97.81 3hve n GLY 225 Ca 0.11 -0.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 3hve n GLY 225 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 3hve h LEU 226 N 0.00 -0.01 -0.56 0.99 -0.00 -0.16 -3.33 115.31 112.24 3hve h LEU 226 Ca 0.00 -0.79 0.00 0.00 -0.00 0.00 0.00 57.88 57.09 3hve h LEU 226 Cb 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.69 3hve h LEU 226 CO 0.00 0.82 0.00 -0.90 -0.00 0.00 0.00 178.44 178.36 3hve n ASP 227 N -4.69 0.50 -0.68 0.17 3.85 -0.73 -5.15 116.55 109.82 3hve n ASP 227 Ca -0.09 -1.81 0.00 0.00 -0.71 0.00 0.00 54.79 52.18 3hve n ASP 227 Cb 0.39 -0.25 0.00 0.00 -1.35 0.00 0.00 41.12 39.91 3hve n ASP 227 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.20 175.95 3hve n SER 229 N -0.19 0.00 0.00 -1.12 2.88 -1.25 -5.14 113.62 108.80 3hve n SER 229 Ca 0.00 -0.68 0.00 0.00 -1.33 0.00 0.00 58.87 56.86 3hve n SER 229 Cb 0.13 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.59 3hve n SER 229 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hve n TYR 230 N 0.00 0.00 0.00 0.66 9.36 -1.26 -4.78 117.16 121.14 3hve n TYR 230 Ca 0.00 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.08 3hve n TYR 230 Cb 0.00 -1.34 -0.14 0.00 -0.63 0.00 0.00 39.34 37.23 3hve n TYR 230 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 3hve h LEU 231 N 0.00 0.21 -0.20 2.98 5.85 -1.96 -2.89 115.31 119.30 3hve h LEU 231 Ca 0.00 -0.41 -0.00 0.00 0.84 0.00 0.00 57.88 58.30 3hve h LEU 231 Cb 0.34 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 3hve h LEU 231 CO 0.00 1.37 0.11 0.03 -0.34 0.00 0.00 178.44 179.61 3hve h ARG 232 N 0.04 0.28 0.15 1.25 3.08 -1.93 -3.12 114.38 114.13 3hve h ARG 232 Ca -0.32 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 59.70 3hve h ARG 232 Cb 2.01 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 32.01 3hve h ARG 232 CO 0.10 0.26 -0.07 1.49 -1.07 0.00 0.00 179.97 180.67 3hve h GLU 233 N 0.22 -0.20 -0.17 0.04 4.81 -1.97 -1.91 114.58 115.41 3hve h GLU 233 Ca 0.07 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 3hve h GLU 233 Cb 0.06 0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.48 3hve h GLU 233 CO -0.01 0.06 0.00 1.04 -0.73 0.00 0.00 179.01 179.37 3hve n GLN 234 N -5.07 0.00 0.00 1.92 6.02 -1.09 -2.45 117.38 116.71 3hve n GLN 234 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.90 3hve n GLN 234 Cb 0.19 -0.84 0.00 0.00 1.02 0.00 0.00 30.24 30.61 3hve n GLN 234 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3hve n LEU 236 N 0.36 0.00 -1.48 1.08 4.77 -0.72 -4.67 117.00 116.35 3hve n LEU 236 Ca 0.00 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.07 3hve n LEU 236 Cb 0.00 0.00 0.33 0.00 -2.33 0.00 0.00 43.42 41.42 3hve n LEU 236 CO 0.00 0.00 0.78 0.59 -1.33 0.00 0.00 177.39 177.43 3hve n ASN 237 N 0.00 4.36 -4.30 -1.43 4.13 -1.03 -4.88 115.26 112.12 3hve n ASN 237 Ca 0.00 -2.37 -0.16 0.00 1.68 0.00 0.00 54.58 53.73 3hve n ASN 237 Cb 0.00 -0.55 -0.10 0.00 -1.54 0.00 0.00 39.78 37.59 3hve n ASN 237 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 3hve s GLU 238 N -1.76 1.37 0.00 3.52 8.01 -1.26 -5.00 118.70 123.59 3hve s GLU 238 Ca 0.47 -1.73 0.00 0.00 0.01 0.00 0.00 54.97 53.72 3hve s GLU 238 Cb 0.30 -0.18 0.00 0.00 -4.31 0.00 0.00 34.13 29.93 3hve s GLU 238 CO 0.24 -0.30 0.05 -0.35 0.01 0.00 0.00 175.26 174.90 3hve n PRO 239 N -0.43 0.08 0.13 0.39 -0.04 -1.26 -1.81 135.00 132.07 3hve n PRO 239 Ca 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.45 3hve n PRO 239 Cb 0.66 -1.04 0.16 0.00 -0.04 0.00 0.00 33.50 33.25 3hve n PRO 239 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3hve h LEU 240 N 0.77 0.00 -1.02 1.53 3.38 -1.94 -3.00 115.31 115.04 3hve h LEU 240 Ca 0.00 -0.00 0.35 0.00 0.09 0.00 0.00 57.88 58.32 3hve h LEU 240 Cb 0.04 -0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.63 3hve h LEU 240 CO 0.00 0.63 0.57 0.58 0.09 0.00 0.00 178.44 180.31 3hve h VAL 241 N 0.00 0.21 -0.09 1.22 2.07 -1.69 0.10 116.25 118.07 3hve h VAL 241 Ca -0.01 -0.08 0.04 0.00 0.82 0.00 0.00 66.70 67.48 3hve h VAL 241 Cb 1.12 -0.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 3hve h VAL 241 CO 0.08 0.04 -0.20 0.03 0.02 0.00 0.00 177.57 177.54 3hve h ARG 242 N 0.22 -0.27 0.00 1.57 3.08 -1.81 0.75 114.38 117.93 3hve h ARG 242 Ca 0.77 0.02 -0.10 0.00 0.07 0.00 0.00 59.98 60.74 3hve h ARG 242 Cb 1.87 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.97 3hve h ARG 242 CO -0.65 -0.18 -0.47 1.05 -1.07 0.00 0.00 179.97 178.65 3hve h GLU 243 N -0.28 0.00 0.04 0.04 4.11 -1.08 -3.23 114.58 114.18 3hve h GLU 243 Ca 0.09 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.52 3hve h GLU 243 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 3hve h GLU 243 CO -0.25 0.47 -0.02 -0.84 0.07 0.00 0.00 179.01 178.44 3hve h ILE 244 N 0.00 1.27 -0.30 -1.06 -2.65 -0.17 -3.32 117.51 111.27 3hve h ILE 244 Ca -0.00 -1.06 0.03 0.00 1.03 0.00 0.00 64.86 64.85 3hve h ILE 244 Cb 1.07 1.97 -0.05 0.00 -2.05 0.00 0.00 36.82 37.76 3hve h ILE 244 CO 0.06 0.27 -0.30 0.58 0.03 0.00 0.00 178.15 178.78 3hve h VAL 245 N -0.53 0.00 -1.24 0.16 2.07 0.47 -3.29 116.25 113.89 3hve h VAL 245 Ca -0.01 0.00 -0.39 0.00 0.82 0.00 0.00 66.70 67.13 3hve h VAL 245 Cb 0.48 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.20 3hve h VAL 245 CO 0.01 0.00 1.00 -0.54 0.02 0.00 0.00 177.57 178.06 3hve s LYS 246 N -4.39 2.64 0.00 1.57 3.01 -1.22 -5.12 119.74 116.23 3hve s LYS 246 Ca -0.07 0.01 0.00 0.00 -1.01 0.00 0.00 55.97 54.89 3hve s LYS 246 Cb 0.05 -4.80 0.00 0.00 -1.01 0.00 0.00 37.83 32.06 3hve s LYS 246 CO 0.33 -3.06 0.00 -0.85 0.51 0.00 0.00 175.35 172.27