#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3v s THR 5 N 0.00 0.00 0.05 6.66 2.01 -1.26 -5.19 115.64 117.92 3h3v s THR 5 Ca 0.00 0.00 0.01 0.00 0.31 0.00 0.00 61.69 62.01 3h3v s THR 5 Cb 0.00 -1.00 0.01 0.00 0.01 0.00 0.00 72.50 71.52 3h3v s THR 5 CO 0.00 0.00 0.07 -0.24 -0.69 0.00 0.00 174.62 173.76 3h3v n SER 6 N 0.96 0.19 -3.70 3.53 2.88 -1.26 -5.15 113.62 111.07 3h3v n SER 6 Ca -0.17 -1.14 -0.12 0.00 -1.33 0.00 0.00 58.87 56.11 3h3v n SER 6 Cb 0.57 -0.04 -0.10 0.00 -0.75 0.00 0.00 64.21 63.90 3h3v n SER 6 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 3h3v s THR 7 N 0.66 -0.01 -0.81 2.46 -1.32 -1.26 -5.07 115.64 110.30 3h3v s THR 7 Ca 0.05 0.02 -0.26 0.00 -1.21 0.00 0.00 61.69 60.30 3h3v s THR 7 Cb -0.00 -0.67 -0.13 0.00 -1.51 0.00 0.00 72.50 70.18 3h3v s THR 7 CO 0.03 0.01 2.36 -0.36 -2.21 0.00 0.00 174.62 174.45 3h3v s PHE 8 N 0.64 1.21 0.00 9.09 0.08 -1.26 -4.32 117.98 123.42 3h3v s PHE 8 Ca -0.03 1.85 0.00 0.00 0.12 0.00 0.00 56.93 58.87 3h3v s PHE 8 Cb -0.05 -3.50 0.00 0.00 -0.57 0.00 0.00 43.02 38.90 3h3v s PHE 8 CO -0.04 -1.58 0.00 0.94 -0.10 0.00 0.00 175.22 174.44 3h3v n GLN 9 N 8.82 0.00 -2.06 0.44 0.00 -1.26 -4.32 117.38 119.00 3h3v n GLN 9 Ca 0.46 0.00 -0.28 0.00 -0.00 0.00 0.00 57.00 57.18 3h3v n GLN 9 Cb 0.44 0.00 -0.06 0.00 0.00 0.00 0.00 30.24 30.61 3h3v n GLN 9 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 3h3v s THR 10 N 0.00 3.53 0.07 1.69 2.01 -1.26 -4.95 115.64 116.74 3h3v s THR 10 Ca 0.00 -0.87 -0.30 0.00 0.31 0.00 0.00 61.69 60.82 3h3v s THR 10 Cb 0.00 -4.52 -0.05 0.00 0.01 0.00 0.00 72.50 67.94 3h3v s THR 10 CO 0.00 -0.98 1.04 -0.60 -0.69 0.00 0.00 174.62 173.39 3h3v s ARG 11 N 6.52 4.57 -0.18 4.92 3.00 -1.26 -5.00 118.95 131.53 3h3v s ARG 11 Ca 0.69 1.55 -0.25 0.00 -1.00 0.00 0.00 55.73 56.72 3h3v s ARG 11 Cb -0.01 -3.38 -0.01 0.00 0.00 0.00 0.00 34.95 31.54 3h3v s ARG 11 CO 0.12 -0.01 0.83 -0.98 0.00 0.00 0.00 175.30 175.26 3h3v s ARG 12 N 0.54 4.29 -0.34 5.12 1.70 -1.26 -5.03 118.95 123.96 3h3v s ARG 12 Ca 0.52 1.01 -0.25 0.00 -0.47 0.00 0.00 55.73 56.54 3h3v s ARG 12 Cb -0.25 -3.58 0.01 0.00 -0.57 0.00 0.00 34.95 30.56 3h3v s ARG 12 CO 0.30 -0.34 0.86 1.03 -1.08 0.00 0.00 175.30 176.06 3h3v s ARG 13 N 2.21 3.89 -0.87 3.89 0.52 -1.26 -4.97 118.95 122.36 3h3v s ARG 13 Ca 0.38 0.58 -0.01 0.00 -0.52 0.00 0.00 55.73 56.16 3h3v s ARG 13 Cb -0.16 -3.77 0.34 0.00 0.52 0.00 0.00 34.95 31.88 3h3v s ARG 13 CO 0.12 -0.82 1.84 0.54 0.02 0.00 0.00 175.30 176.99 3h3v n ARG 14 N 6.50 3.81 0.00 3.54 1.74 -1.26 -4.94 116.66 126.05 3h3v n ARG 14 Ca 0.05 -4.08 0.00 0.00 -0.77 0.00 0.00 57.85 53.06 3h3v n ARG 14 Cb 0.48 -2.34 0.00 0.00 -1.02 0.00 0.00 32.46 29.58 3h3v n ARG 14 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3h3v n LEU 15 N -0.35 0.00 -4.56 0.55 7.94 -1.26 -4.78 117.00 114.55 3h3v n LEU 15 Ca 0.49 0.00 -0.37 0.00 -1.11 0.00 0.00 56.01 55.03 3h3v n LEU 15 Cb 0.28 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.19 3h3v n LEU 15 CO 0.49 0.00 1.40 -0.75 -1.11 0.00 0.00 177.39 177.42 3h3v s LYS 16 N 0.00 3.10 -1.30 1.96 2.20 -1.26 -4.92 119.74 119.52 3h3v s LYS 16 Ca 0.00 -0.51 -0.12 0.00 -0.36 0.00 0.00 55.97 54.98 3h3v s LYS 16 Cb 0.00 -4.94 0.13 0.00 -1.51 0.00 0.00 37.83 31.51 3h3v s LYS 16 CO 0.00 -2.60 1.82 1.17 -0.36 0.00 0.00 175.35 175.38 3h3v n LYS 17 N 9.00 3.35 -3.49 4.03 0.00 -1.26 -4.83 118.16 124.96 3h3v n LYS 17 Ca 0.28 -3.39 -0.02 0.00 0.00 0.00 0.00 58.31 55.18 3h3v n LYS 17 Cb 0.50 -3.10 -0.05 0.00 0.00 0.00 0.00 35.03 32.38 3h3v n LYS 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 3h3v s VAL 18 N 1.74 -0.89 0.00 3.15 0.11 -1.26 -4.90 120.40 118.35 3h3v s VAL 18 Ca 0.44 0.03 0.00 0.00 -2.93 0.00 0.00 61.98 59.51 3h3v s VAL 18 Cb 0.07 -0.91 0.00 0.00 -1.53 0.00 0.00 36.38 34.00 3h3v s VAL 18 CO -0.01 0.00 0.00 1.21 -3.33 0.00 0.00 175.10 172.98 3h3v n GLU 19 N 5.42 0.00 -1.22 1.54 4.07 -1.26 -5.08 120.64 124.11 3h3v n GLU 19 Ca -0.08 0.00 -0.24 0.00 -0.06 0.00 0.00 57.16 56.78 3h3v n GLU 19 Cb 0.50 0.00 -0.12 0.00 -0.06 0.00 0.00 31.44 31.76 3h3v n GLU 19 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 3h3v n GLU 20 N 0.00 0.06 0.00 5.31 -0.00 -1.26 -4.89 120.64 119.86 3h3v n GLU 20 Ca 0.00 -1.47 0.00 0.00 -0.00 0.00 0.00 57.16 55.69 3h3v n GLU 20 Cb 0.00 -3.47 0.00 0.00 -0.00 0.00 0.00 31.44 27.97 3h3v n GLU 20 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 3h3v n GLU 21 N 8.09 0.00 -3.62 3.44 -0.58 -1.26 -5.00 120.64 121.72 3h3v n GLU 21 Ca 0.43 0.00 -0.03 0.00 -0.42 0.00 0.00 57.16 57.14 3h3v n GLU 21 Cb 0.45 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 31.30 3h3v n GLU 21 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 3h3v s GLU 22 N 0.00 0.17 -0.34 3.49 4.04 -1.26 -5.14 118.70 119.67 3h3v s GLU 22 Ca 0.00 -0.04 -0.14 0.00 0.04 0.00 0.00 54.97 54.82 3h3v s GLU 22 Cb 0.00 0.08 -0.02 0.00 0.02 0.00 0.00 34.13 34.21 3h3v s GLU 22 CO 0.00 -0.07 0.33 -0.80 -1.84 0.00 0.00 175.26 172.88 3h3v s ASN 23 N -1.86 6.15 -0.00 0.83 0.01 -1.26 -4.79 114.94 114.01 3h3v s ASN 23 Ca 0.10 -0.26 0.00 0.00 -0.71 0.00 0.00 52.86 51.99 3h3v s ASN 23 Cb -0.01 -2.18 0.00 0.00 0.41 0.00 0.00 41.25 39.47 3h3v s ASN 23 CO -0.04 -0.30 -0.01 0.00 -1.51 0.00 0.00 177.10 175.24 3h3v s ALA 24 N 1.93 0.11 0.00 0.60 0.00 -1.21 -5.00 121.76 118.19 3h3v s ALA 24 Ca 0.10 -0.00 -0.01 0.00 0.00 0.00 0.00 51.96 52.05 3h3v s ALA 24 Cb -0.17 -0.06 -0.05 0.00 0.00 0.00 0.00 23.12 22.84 3h3v s ALA 24 CO 0.11 0.01 1.16 0.00 0.00 0.00 0.00 175.76 177.03 3h3v n ALA 25 N 3.22 2.66 -1.41 0.00 0.00 -1.26 -2.15 120.51 121.57 3h3v n ALA 25 Ca -0.15 -0.32 -0.11 0.00 0.00 0.00 0.00 53.44 52.87 3h3v n ALA 25 Cb 0.58 -1.95 0.19 0.00 0.00 0.00 0.00 19.45 18.27 3h3v n ALA 25 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3h3v n THR 26 N 2.30 2.76 -2.96 0.00 -1.04 -1.26 -4.16 114.28 109.92 3h3v n THR 26 Ca 0.07 -2.57 -0.19 0.00 -2.04 0.00 0.00 64.05 59.32 3h3v n THR 26 Cb 0.25 -0.39 0.00 0.00 -1.82 0.00 0.00 70.33 68.37 3h3v n THR 26 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3h3v n LEU 27 N -1.12 -1.68 -3.67 -4.42 4.77 -1.14 -4.86 117.00 104.88 3h3v n LEU 27 Ca 0.41 -0.17 -0.37 0.00 -0.03 0.00 0.00 56.01 55.86 3h3v n LEU 27 Cb 1.20 -2.34 -0.01 0.00 -2.33 0.00 0.00 43.42 39.94 3h3v n LEU 27 CO 0.32 0.07 0.86 0.00 -1.33 0.00 0.00 177.39 177.31 3h3v n GLN 28 N -3.47 4.14 -2.92 3.23 1.13 -0.91 -5.03 117.38 113.55 3h3v n GLN 28 Ca -0.09 -4.65 -0.38 0.00 -1.94 0.00 0.00 57.00 49.95 3h3v n GLN 28 Cb 0.59 -2.41 -0.06 0.00 0.11 0.00 0.00 30.24 28.46 3h3v n GLN 28 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3h3v s LEU 29 N -3.16 4.43 -0.09 1.08 1.43 -1.26 -3.34 118.68 117.76 3h3v s LEU 29 Ca 0.37 1.68 -0.39 0.00 -1.03 0.00 0.00 54.13 54.76 3h3v s LEU 29 Cb 0.13 -3.69 -0.16 0.00 0.03 0.00 0.00 46.19 42.50 3h3v s LEU 29 CO 0.00 0.05 1.52 0.61 0.23 0.00 0.00 176.35 178.76 3h3v n GLY 30 N 0.93 0.62 0.00 -3.19 0.00 -1.26 -4.58 105.19 97.71 3h3v n GLY 30 Ca -0.01 0.81 0.00 0.00 0.00 0.00 0.00 46.02 46.82 3h3v n GLY 30 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h3v n GLN 31 N 3.82 0.00 0.00 1.61 6.02 -1.26 0.11 117.38 127.68 3h3v n GLN 31 Ca 0.22 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.21 3h3v n GLN 31 Cb 0.15 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.42 3h3v n GLN 31 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 3h3v n GLU 32 N -2.52 0.02 -2.80 -1.09 4.07 -1.26 -2.42 120.64 114.63 3h3v n GLU 32 Ca 0.00 0.00 -0.01 0.00 -0.06 0.00 0.00 57.16 57.09 3h3v n GLU 32 Cb 0.00 -1.20 0.07 0.00 -0.06 0.00 0.00 31.44 30.24 3h3v n GLU 32 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 3h3v n PHE 33 N -0.70 0.55 -2.27 4.31 3.01 0.29 -5.08 117.46 117.58 3h3v n PHE 33 Ca 0.00 -2.06 -0.34 0.00 1.01 0.00 0.00 57.45 56.06 3h3v n PHE 33 Cb 0.00 0.15 -0.00 0.00 -0.01 0.00 0.00 39.48 39.61 3h3v n PHE 33 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 3h3v s GLN 34 N -2.97 3.43 0.00 -1.08 -0.21 -1.02 -4.77 119.66 113.04 3h3v s GLN 34 Ca 0.23 1.45 0.05 0.00 0.02 0.00 0.00 55.36 57.12 3h3v s GLN 34 Cb 0.35 -2.03 0.33 0.00 1.00 0.00 0.00 33.01 32.65 3h3v s GLN 34 CO -0.06 -0.76 0.80 1.28 -2.12 0.00 0.00 175.29 174.43 3h3v n LEU 35 N -1.41 0.00 -3.80 2.90 4.77 -1.26 -3.50 117.00 114.69 3h3v n LEU 35 Ca 0.10 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.80 3h3v n LEU 35 Cb 0.52 -0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.49 3h3v n LEU 35 CO 0.43 -0.00 -0.12 -0.54 -1.33 0.00 0.00 177.39 175.83 3h3v s LYS 36 N -2.00 2.04 0.44 3.23 1.02 -1.26 -2.65 119.74 120.55 3h3v s LYS 36 Ca 0.08 -2.93 0.07 0.00 0.02 0.00 0.00 55.97 53.21 3h3v s LYS 36 Cb 0.04 -2.98 -0.02 0.00 -0.52 0.00 0.00 37.83 34.35 3h3v s LYS 36 CO 0.06 -1.27 0.31 1.14 -0.92 0.00 0.00 175.35 174.68 3h3v s GLN 37 N -0.90 2.37 -0.16 1.68 -2.07 -1.12 -4.98 119.66 114.48 3h3v s GLN 37 Ca 0.25 -1.74 -0.06 0.00 -1.82 0.00 0.00 55.36 51.99 3h3v s GLN 37 Cb -0.08 -2.18 -0.04 0.00 -1.09 0.00 0.00 33.01 29.62 3h3v s GLN 37 CO -0.14 -0.25 0.04 0.42 -1.32 0.00 0.00 175.29 174.04 3h3v s ILE 38 N -2.57 4.57 0.52 3.63 1.01 -1.26 -1.45 121.20 125.65 3h3v s ILE 38 Ca 0.43 -0.12 -0.11 0.00 0.00 0.00 0.00 60.65 60.85 3h3v s ILE 38 Cb -0.00 -3.03 -0.05 0.00 0.01 0.00 0.00 42.46 39.38 3h3v s ILE 38 CO 0.25 0.49 0.92 0.21 0.00 0.00 0.00 174.94 176.80 3h3v s ASN 39 N 0.17 6.40 0.27 3.58 2.47 0.19 -4.77 114.94 123.25 3h3v s ASN 39 Ca 0.03 1.30 -0.01 0.00 0.42 0.00 0.00 52.86 54.61 3h3v s ASN 39 Cb -0.13 -2.41 0.54 0.00 -1.45 0.00 0.00 41.25 37.81 3h3v s ASN 39 CO 0.01 -0.65 1.77 1.12 -3.72 0.00 0.00 177.10 175.64 3h3v h HIS 40 N 0.42 0.83 0.00 0.43 2.07 -1.97 0.29 115.15 117.22 3h3v h HIS 40 Ca -0.46 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.09 3h3v h HIS 40 Cb 1.19 -0.24 0.00 0.00 2.57 0.00 0.00 27.41 30.93 3h3v h HIS 40 CO 0.63 0.22 0.00 1.04 -3.07 0.00 0.00 177.93 176.75 3h3v n GLN 41 N -4.83 0.32 -0.92 5.12 6.02 -1.26 -4.72 117.38 117.12 3h3v n GLN 41 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 3h3v n GLN 41 Cb 0.42 -1.15 0.00 0.00 1.02 0.00 0.00 30.24 30.54 3h3v n GLN 41 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3h3v n GLY 42 N -0.23 0.70 3.86 1.08 0.00 0.10 -4.99 105.19 105.71 3h3v n GLY 42 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3h3v n GLY 42 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3h3v s GLU 43 N -0.26 3.13 -0.02 1.61 2.02 -1.22 -4.75 118.70 119.21 3h3v s GLU 43 Ca 0.00 0.66 -0.17 0.00 0.02 0.00 0.00 54.97 55.48 3h3v s GLU 43 Cb 0.00 -2.04 -0.05 0.00 0.10 0.00 0.00 34.13 32.14 3h3v s GLU 43 CO 0.00 -0.88 0.46 -1.21 0.02 0.00 0.00 175.26 173.64 3h3v s GLU 44 N -5.23 4.10 -0.08 1.61 2.02 -1.26 0.57 118.70 120.42 3h3v s GLU 44 Ca 0.57 0.48 -0.07 0.00 0.02 0.00 0.00 54.97 55.97 3h3v s GLU 44 Cb -0.12 -3.29 0.02 0.00 0.10 0.00 0.00 34.13 30.85 3h3v s GLU 44 CO 0.53 0.53 0.22 -2.00 0.02 0.00 0.00 175.26 174.56 3h3v s GLU 45 N -0.60 0.24 0.39 1.61 2.12 -0.53 -4.84 118.70 117.09 3h3v s GLU 45 Ca 0.25 0.33 -0.28 0.00 0.36 0.00 0.00 54.97 55.64 3h3v s GLU 45 Cb -0.17 0.08 -0.10 0.00 0.26 0.00 0.00 34.13 34.20 3h3v s GLU 45 CO 0.13 -0.05 1.48 -2.00 -0.54 0.00 0.00 175.26 174.29 3h3v s GLU 46 N 0.29 4.02 0.26 4.30 2.12 -1.26 -2.79 118.70 125.63 3h3v s GLU 46 Ca -0.01 2.56 -0.28 0.00 0.36 0.00 0.00 54.97 57.60 3h3v s GLU 46 Cb -0.03 -2.91 -0.15 0.00 0.26 0.00 0.00 34.13 31.30 3h3v s GLU 46 CO -0.01 -0.60 0.76 -0.11 -0.54 0.00 0.00 175.26 174.76 3h3v n LEU 47 N 0.32 0.29 -4.31 2.70 -0.00 -1.08 -4.87 117.00 110.06 3h3v n LEU 47 Ca 0.02 1.14 -0.46 0.00 -0.00 0.00 0.00 56.01 56.71 3h3v n LEU 47 Cb 0.40 -1.12 -0.03 0.00 -0.00 0.00 0.00 43.42 42.66 3h3v n LEU 47 CO 0.63 -2.21 0.40 -0.63 -0.00 0.00 0.00 177.39 175.58 3h3v s ILE 48 N -1.06 5.44 -0.19 1.96 -1.09 -1.26 -4.91 121.20 120.10 3h3v s ILE 48 Ca 0.61 -2.57 -0.27 0.00 -2.23 0.00 0.00 60.65 56.19 3h3v s ILE 48 Cb -0.80 -4.37 -0.00 0.00 -1.58 0.00 0.00 42.46 35.71 3h3v s ILE 48 CO 0.58 -1.02 0.93 0.00 -1.23 0.00 0.00 174.94 174.20 3h3v s ALA 49 N 0.07 3.57 -0.19 9.38 0.00 -1.26 -5.03 121.76 128.29 3h3v s ALA 49 Ca 0.18 0.13 -0.04 0.00 0.00 0.00 0.00 51.96 52.23 3h3v s ALA 49 Cb -0.11 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 3h3v s ALA 49 CO -0.08 -0.81 -0.04 -1.17 0.00 0.00 0.00 175.76 173.66 3h3v s LEU 50 N 2.55 3.03 -0.08 0.00 0.20 -1.26 -4.82 118.68 118.30 3h3v s LEU 50 Ca 0.42 -0.29 -0.14 0.00 0.69 0.00 0.00 54.13 54.81 3h3v s LEU 50 Cb -0.16 -1.75 -0.05 0.00 -0.43 0.00 0.00 46.19 43.80 3h3v s LEU 50 CO 0.11 0.06 0.34 0.54 -0.29 0.00 0.00 176.35 177.11 3h3v s ASN 51 N 1.02 6.62 0.56 3.68 2.20 -1.26 -4.90 114.94 122.85 3h3v s ASN 51 Ca 0.01 0.73 -0.13 0.00 -0.94 0.00 0.00 52.86 52.53 3h3v s ASN 51 Cb -0.15 -2.21 -0.11 0.00 -2.00 0.00 0.00 41.25 36.79 3h3v s ASN 51 CO 0.01 0.23 -0.36 0.18 -2.94 0.00 0.00 177.10 174.21 3h3v n LEU 52 N 2.63 -3.61 0.00 3.54 4.77 -1.26 -0.54 117.00 122.52 3h3v n LEU 52 Ca -0.13 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 3h3v n LEU 52 Cb 0.52 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 3h3v n LEU 52 CO 0.38 -4.00 0.00 -1.54 -1.33 0.00 0.00 177.39 170.90 3h3v n SER 53 N 2.22 0.00 0.24 -1.43 3.41 -1.26 -4.20 113.62 112.60 3h3v n SER 53 Ca 0.02 0.00 0.13 0.00 -0.26 0.00 0.00 58.87 58.76 3h3v n SER 53 Cb 0.38 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 64.77 3h3v n SER 53 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3h3v h GLU 54 N 0.00 0.00 0.08 4.33 4.81 -1.22 -2.89 114.58 119.68 3h3v h GLU 54 Ca 0.00 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.09 3h3v h GLU 54 Cb 0.00 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.39 3h3v h GLU 54 CO 0.00 0.09 -0.66 0.00 -0.73 0.00 0.00 179.01 177.71 3h3v h ALA 55 N 1.91 0.01 -1.09 2.92 0.00 -1.62 -3.11 119.26 118.28 3h3v h ALA 55 Ca -0.00 -0.73 0.30 0.00 0.00 0.00 0.00 54.91 54.48 3h3v h ALA 55 Cb 0.77 0.17 -0.09 0.00 0.00 0.00 0.00 17.79 18.65 3h3v h ALA 55 CO 0.01 0.34 0.72 -0.09 0.00 0.00 0.00 179.25 180.23 3h3v h ARG 56 N -0.63 0.27 0.00 0.00 2.43 -1.82 0.97 114.38 115.61 3h3v h ARG 56 Ca -0.13 -0.02 -0.13 0.00 -0.81 0.00 0.00 59.98 58.89 3h3v h ARG 56 Cb 1.41 -0.06 0.01 0.00 -0.42 0.00 0.00 29.97 30.91 3h3v h ARG 56 CO 0.06 0.18 -0.50 -0.07 -1.51 0.00 0.00 179.97 178.13 3h3v h LEU 57 N 0.28 0.44 -0.20 3.80 3.38 -1.60 0.83 115.31 122.23 3h3v h LEU 57 Ca 0.60 -0.77 0.04 0.00 0.09 0.00 0.00 57.88 57.85 3h3v h LEU 57 Cb 1.75 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 42.33 3h3v h LEU 57 CO -0.24 1.15 -0.06 0.58 0.09 0.00 0.00 178.44 179.96 3h3v h VAL 58 N -0.23 0.78 0.29 1.22 2.07 -0.95 0.13 116.25 119.56 3h3v h VAL 58 Ca -0.06 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 3h3v h VAL 58 Cb 1.23 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 3h3v h VAL 58 CO 0.10 0.00 -0.14 0.40 0.02 0.00 0.00 177.57 177.95 3h3v h ILE 59 N -0.01 0.00 -0.74 4.57 2.04 -0.96 -2.34 117.51 120.07 3h3v h ILE 59 Ca 0.10 -0.06 0.08 0.00 1.00 0.00 0.00 64.86 65.97 3h3v h ILE 59 Cb 0.16 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.15 3h3v h ILE 59 CO -0.22 0.00 -0.41 1.17 0.00 0.00 0.00 178.15 178.70 3h3v n LYS 60 N -3.24 -0.29 0.12 2.37 4.81 0.28 0.74 118.16 122.95 3h3v n LYS 60 Ca -0.05 1.13 -0.08 0.00 -0.87 0.00 0.00 58.31 58.43 3h3v n LYS 60 Cb 0.16 -1.66 -0.05 0.00 0.02 0.00 0.00 35.03 33.50 3h3v n LYS 60 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 3h3v h GLU 61 N 0.00 -0.43 -0.64 1.64 4.81 -0.77 0.29 114.58 119.49 3h3v h GLU 61 Ca 0.15 0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.46 3h3v h GLU 61 Cb 0.33 0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.78 3h3v h GLU 61 CO -0.71 -0.29 0.42 0.00 -0.73 0.00 0.00 179.01 177.71 3h3v h ALA 62 N -1.27 1.73 -0.08 2.92 0.00 -0.79 0.73 119.26 122.50 3h3v h ALA 62 Ca -0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 3h3v h ALA 62 Cb 0.40 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3h3v h ALA 62 CO -0.06 0.18 -0.10 1.25 0.00 0.00 0.00 179.25 180.52 3h3v h LEU 63 N 0.68 0.11 0.00 0.00 7.12 0.68 -2.08 115.31 121.82 3h3v h LEU 63 Ca 0.27 -0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.26 3h3v h LEU 63 Cb 0.20 -0.03 0.00 0.00 -0.53 0.00 0.00 40.66 40.30 3h3v h LEU 63 CO -0.08 0.23 -0.02 0.58 -0.13 0.00 0.00 178.44 179.02 3h3v h VAL 64 N 0.11 0.00 0.00 1.05 2.07 0.76 -3.28 116.25 116.97 3h3v h VAL 64 Ca 0.02 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.89 3h3v h VAL 64 Cb 0.26 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.03 3h3v h VAL 64 CO 0.02 0.00 0.66 -0.08 0.02 0.00 0.00 177.57 178.18 3h3v h GLU 65 N -0.65 0.00 -0.01 1.57 4.81 -0.94 2.67 114.58 122.04 3h3v h GLU 65 Ca 0.00 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 3h3v h GLU 65 Cb 0.02 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.40 3h3v h GLU 65 CO 0.00 0.00 -0.31 -0.09 -0.73 0.00 0.00 179.01 177.88 3h3v h ARG 66 N 0.00 0.23 -0.61 1.92 2.43 -1.48 -2.97 114.38 113.90 3h3v h ARG 66 Ca 0.00 -0.23 0.18 0.00 -0.81 0.00 0.00 59.98 59.12 3h3v h ARG 66 Cb 1.32 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.90 3h3v h ARG 66 CO 0.00 0.94 0.48 -0.09 -1.51 0.00 0.00 179.97 179.79 3h3v h ARG 67 N -0.39 0.00 0.08 0.20 2.43 0.46 0.17 114.38 117.34 3h3v h ARG 67 Ca -0.03 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3h3v h ARG 67 Cb 1.04 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 3h3v h ARG 67 CO 0.06 0.00 -0.04 0.00 -1.51 0.00 0.00 179.97 178.48 3h3v h ARG 68 N 0.00 -0.10 0.00 0.20 3.08 -1.30 -2.96 114.38 113.30 3h3v h ARG 68 Ca 0.29 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.35 3h3v h ARG 68 Cb 1.25 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.33 3h3v h ARG 68 CO -0.00 0.40 0.00 0.00 -1.07 0.00 0.00 179.97 179.29 3h3v n ALA 69 N -2.45 2.53 0.64 0.04 0.00 -0.76 -1.52 120.51 118.99 3h3v n ALA 69 Ca -0.08 -0.17 0.10 0.00 0.00 0.00 0.00 53.44 53.28 3h3v n ALA 69 Cb 0.28 -1.47 0.27 0.00 0.00 0.00 0.00 19.45 18.53 3h3v n ALA 69 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3h3v n PHE 70 N -1.06 0.49 -0.65 0.00 7.35 0.54 -3.95 117.46 120.19 3h3v n PHE 70 Ca 0.20 -0.25 0.00 0.00 -0.76 0.00 0.00 57.45 56.64 3h3v n PHE 70 Cb 0.12 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.95 3h3v n PHE 70 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 3h3v n LYS 71 N 0.89 0.00 0.00 -4.13 5.02 -0.58 -4.70 118.16 114.65 3h3v n LYS 71 Ca 0.17 0.00 0.15 0.00 -2.02 0.00 0.00 58.31 56.61 3h3v n LYS 71 Cb 0.43 -0.25 0.75 0.00 -0.02 0.00 0.00 35.03 35.95 3h3v n LYS 71 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3h3v n ARG 72 N 0.00 0.45 -1.74 1.97 1.74 -0.73 -2.80 116.66 115.56 3h3v n ARG 72 Ca 0.00 0.01 -0.15 0.00 -0.77 0.00 0.00 57.85 56.93 3h3v n ARG 72 Cb 0.14 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.14 3h3v n ARG 72 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3h3v n SER 73 N -1.27 3.92 -0.00 0.55 3.41 -1.26 -4.67 113.62 114.30 3h3v n SER 73 Ca 0.15 -3.65 0.00 0.00 -0.26 0.00 0.00 58.87 55.11 3h3v n SER 73 Cb 0.23 -0.39 -0.00 0.00 -0.26 0.00 0.00 64.21 63.78 3h3v n SER 73 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h3v n GLN 74 N -0.77 5.68 0.02 4.33 6.02 -1.12 -4.64 117.38 126.90 3h3v n GLN 74 Ca 0.35 -0.00 -0.06 0.00 -0.01 0.00 0.00 57.00 57.28 3h3v n GLN 74 Cb 0.90 -0.61 -0.12 0.00 1.02 0.00 0.00 30.24 31.44 3h3v n GLN 74 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 3h3v h LYS 75 N 0.00 0.00 0.00 -1.09 1.57 -1.83 -3.52 116.57 111.70 3h3v h LYS 75 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3h3v h LYS 75 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3h3v h LYS 75 CO 0.00 0.64 0.00 1.17 -0.57 0.00 0.00 179.45 180.69 3h3v n LYS 76 N -3.14 0.00 -1.10 3.15 4.81 -1.26 -5.24 118.16 115.37 3h3v n LYS 76 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.35 3h3v n LYS 76 Cb 0.97 0.00 0.00 0.00 0.02 0.00 0.00 35.03 36.02 3h3v n LYS 76 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 3h3v n THR 118 N 0.00 0.00 0.00 3.15 -1.04 -1.26 -4.75 114.28 110.38 3h3v n THR 118 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3h3v n THR 118 Cb 0.00 -0.91 0.00 0.00 -1.82 0.00 0.00 70.33 67.60 3h3v n THR 118 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 3h3v n ARG 119 N -0.33 0.00 0.00 -2.82 0.63 -1.26 -1.86 116.66 111.01 3h3v n ARG 119 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3h3v n ARG 119 Cb 0.24 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.15 3h3v n ARG 119 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 3h3v n GLU 120 N 1.61 0.00 0.11 -0.14 2.13 -1.26 -0.34 120.64 122.75 3h3v n GLU 120 Ca 0.00 0.41 0.04 0.00 0.66 0.00 0.00 57.16 58.28 3h3v n GLU 120 Cb 0.00 -1.53 0.00 0.00 0.27 0.00 0.00 31.44 30.18 3h3v n GLU 120 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 3h3v h LYS 121 N 0.00 0.00 0.00 5.31 3.64 -1.84 -3.20 116.57 120.48 3h3v h LYS 121 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3h3v h LYS 121 Cb 0.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3h3v h LYS 121 CO 0.00 0.28 -0.37 -1.91 -2.27 0.00 0.00 179.45 175.18 3h3v n GLU 122 N -3.00 0.16 -0.03 1.90 2.13 0.54 -2.95 120.64 119.39 3h3v n GLU 122 Ca -0.02 0.07 -0.11 0.00 0.66 0.00 0.00 57.16 57.76 3h3v n GLU 122 Cb 0.71 -1.63 -0.05 0.00 0.27 0.00 0.00 31.44 30.74 3h3v n GLU 122 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 3h3v h LEU 123 N 0.00 0.19 -0.39 4.31 3.38 -1.53 -1.03 115.31 120.24 3h3v h LEU 123 Ca 0.00 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 57.74 3h3v h LEU 123 Cb 0.64 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 3h3v h LEU 123 CO 0.00 0.25 -0.21 -0.08 0.09 0.00 0.00 178.44 178.49 3h3v h GLU 124 N 0.12 0.84 0.00 1.13 4.81 -1.69 -2.01 114.58 117.78 3h3v h GLU 124 Ca 0.05 -0.38 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 3h3v h GLU 124 Cb 0.11 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.47 3h3v h GLU 124 CO -0.01 1.01 0.00 0.66 -0.73 0.00 0.00 179.01 179.95 3h3v h SER 125 N 0.65 0.00 0.11 1.04 4.64 -1.41 -2.78 113.55 115.80 3h3v h SER 125 Ca 0.09 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.05 3h3v h SER 125 Cb 0.77 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.85 3h3v h SER 125 CO 0.06 0.00 -1.92 -0.38 -0.87 0.00 0.00 176.83 173.72 3h3v n ILE 126 N -3.01 1.75 0.15 0.95 5.41 -0.40 -3.28 119.36 120.92 3h3v n ILE 126 Ca -0.00 -0.58 0.19 0.00 1.00 0.00 0.00 62.75 63.35 3h3v n ILE 126 Cb 0.22 -1.77 0.78 0.00 -0.71 0.00 0.00 39.64 38.17 3h3v n ILE 126 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 3h3v h ASP 127 N -0.05 0.00 0.00 4.38 3.45 -1.17 0.41 116.42 123.44 3h3v h ASP 127 Ca -0.42 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.04 3h3v h ASP 127 Cb 1.95 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.72 3h3v h ASP 127 CO 0.05 0.00 0.00 0.52 -1.57 0.00 0.00 179.24 178.24 3h3v n VAL 128 N -3.82 0.00 -0.35 -1.35 0.31 -1.06 -2.17 118.33 109.88 3h3v n VAL 128 Ca 0.04 0.72 0.37 0.00 -0.01 0.00 0.00 64.34 65.46 3h3v n VAL 128 Cb 0.46 -1.51 0.68 0.00 -0.91 0.00 0.00 33.84 32.56 3h3v n VAL 128 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3h3v h LEU 129 N 0.00 0.00 0.00 7.52 5.85 -1.45 -1.41 115.31 125.82 3h3v h LEU 129 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3h3v h LEU 129 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 3h3v h LEU 129 CO 0.00 0.00 0.00 0.18 -0.34 0.00 0.00 178.44 178.28 3h3v n LEU 130 N -3.75 0.27 -2.51 2.25 4.77 0.10 -2.74 117.00 115.39 3h3v n LEU 130 Ca 0.28 0.63 -0.03 0.00 -0.03 0.00 0.00 56.01 56.87 3h3v n LEU 130 Cb 1.49 -0.42 -0.03 0.00 -2.33 0.00 0.00 43.42 42.13 3h3v n LEU 130 CO 0.35 -0.42 0.81 -0.62 -1.33 0.00 0.00 177.39 176.17 3h3v n GLU 131 N -1.76 0.40 0.00 3.23 1.02 -0.53 -1.31 120.64 121.68 3h3v n GLU 131 Ca 0.00 -0.27 0.00 0.00 -0.02 0.00 0.00 57.16 56.87 3h3v n GLU 131 Cb 0.00 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 29.75 3h3v n GLU 131 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3h3v n GLN 132 N 3.19 0.00 0.00 3.49 6.02 -1.22 -4.96 117.38 123.90 3h3v n GLN 132 Ca 0.08 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.11 3h3v n GLN 132 Cb 0.14 -0.01 0.01 0.00 1.02 0.00 0.00 30.24 31.40 3h3v n GLN 132 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3h3v n THR 133 N -2.39 0.00 -2.17 5.09 -2.24 -0.66 -5.03 114.28 106.88 3h3v n THR 133 Ca 0.00 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 3h3v n THR 133 Cb 0.00 1.11 0.00 0.00 -2.10 0.00 0.00 70.33 69.34 3h3v n THR 133 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3h3v n THR 134 N -0.14 0.00 -0.07 4.28 -1.04 -0.43 -5.01 114.28 111.87 3h3v n THR 134 Ca 0.04 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.98 3h3v n THR 134 Cb 0.17 -1.14 -0.11 0.00 -1.82 0.00 0.00 70.33 67.43 3h3v n THR 134 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3h3v n GLY 135 N 5.00 -0.70 2.21 3.41 0.00 -1.26 -4.96 105.19 108.88 3h3v n GLY 135 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.77 3h3v n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h3v n GLY 136 N 2.09 2.93 0.96 -0.02 0.00 -1.26 -4.64 105.19 105.25 3h3v n GLY 136 Ca -0.22 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.92 3h3v n GLY 136 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3h3v n ASN 137 N 0.33 2.93 -2.33 1.61 2.04 -1.26 -4.06 115.26 114.51 3h3v n ASN 137 Ca 0.00 -1.92 -0.31 0.00 -0.44 0.00 0.00 54.58 51.90 3h3v n ASN 137 Cb 0.00 -0.13 0.06 0.00 -2.53 0.00 0.00 39.78 37.18 3h3v n ASN 137 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 3h3v n ASN 138 N 1.20 7.35 0.19 0.53 2.85 -1.26 -4.76 115.26 121.36 3h3v n ASN 138 Ca 0.17 -3.60 0.03 0.00 -0.11 0.00 0.00 54.58 51.07 3h3v n ASN 138 Cb 0.55 -1.03 0.16 0.00 1.24 0.00 0.00 39.78 40.71 3h3v n ASN 138 CO 0.00 0.00 0.00 0.07 -2.11 0.00 0.00 177.26 175.22 3h3v h LYS 139 N 2.09 0.00 0.37 1.20 5.09 -1.98 -1.02 116.57 122.32 3h3v h LYS 139 Ca 0.52 0.00 -0.02 0.00 0.09 0.00 0.00 60.65 61.24 3h3v h LYS 139 Cb 0.71 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.05 3h3v h LYS 139 CO 1.35 0.00 -0.18 -0.44 -2.09 0.00 0.00 179.45 178.09 3h3v h ASP 140 N 0.00 -0.42 -0.07 7.07 3.32 -1.95 -2.52 116.42 121.86 3h3v h ASP 140 Ca 0.00 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.08 3h3v h ASP 140 Cb 1.20 0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.85 3h3v h ASP 140 CO 0.00 -0.01 0.42 0.25 -1.72 0.00 0.00 179.24 178.18 3h3v h LEU 141 N -1.07 0.00 0.03 1.55 5.85 -1.60 1.80 115.31 121.88 3h3v h LEU 141 Ca -0.05 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 3h3v h LEU 141 Cb 0.38 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.41 3h3v h LEU 141 CO 0.08 0.00 -0.01 0.50 -0.34 0.00 0.00 178.44 178.67 3h3v h LYS 142 N 0.00 -0.04 -0.28 1.25 3.64 -1.53 -1.95 116.57 117.65 3h3v h LYS 142 Ca 0.03 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 3h3v h LYS 142 Cb 0.87 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.69 3h3v h LYS 142 CO -0.00 0.57 -0.09 -0.91 -2.27 0.00 0.00 179.45 176.75 3h3v h ASN 143 N -0.70 0.44 -0.45 4.20 2.35 0.26 -2.09 115.58 119.59 3h3v h ASN 143 Ca -0.00 -0.10 -0.14 0.00 -0.55 0.00 0.00 56.30 55.51 3h3v h ASN 143 Cb 0.63 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 3h3v h ASN 143 CO 0.01 0.58 -0.25 0.74 -1.65 0.00 0.00 177.43 176.85 3h3v h THR 144 N 0.43 1.27 0.00 2.81 2.02 0.14 -1.18 112.91 118.40 3h3v h THR 144 Ca 0.08 -1.42 -0.08 0.00 0.77 0.00 0.00 66.41 65.77 3h3v h THR 144 Cb 0.43 1.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.01 3h3v h THR 144 CO 0.02 0.49 -0.37 0.24 0.37 0.00 0.00 175.52 176.27 3h3v h MET 145 N 0.84 0.00 0.11 6.66 2.86 -1.13 0.61 114.93 124.87 3h3v h MET 145 Ca 0.10 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 3h3v h MET 145 Cb 0.83 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.49 3h3v h MET 145 CO 0.07 0.37 -0.05 0.37 1.06 0.00 0.00 176.91 178.73 3h3v h GLN 146 N 0.00 -0.14 -0.12 1.72 4.15 -1.05 0.41 115.11 120.07 3h3v h GLN 146 Ca -0.00 0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.45 3h3v h GLN 146 Cb 0.88 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.55 3h3v h GLN 146 CO 0.05 -0.09 -0.37 -0.92 -1.93 0.00 0.00 178.83 175.57 3h3v h TYR 147 N -0.20 -1.09 -0.76 3.99 3.20 -1.23 0.30 116.97 121.18 3h3v h TYR 147 Ca -0.01 0.04 0.17 0.00 3.14 0.00 0.00 58.73 62.07 3h3v h TYR 147 Cb 0.11 0.49 -0.12 0.00 1.54 0.00 0.00 36.73 38.76 3h3v h TYR 147 CO 0.12 -0.36 0.17 1.25 -1.64 0.00 0.00 178.16 177.70 3h3v h LEU 148 N -0.37 -0.03 -0.88 2.82 6.46 0.13 0.18 115.31 123.63 3h3v h LEU 148 Ca 0.03 0.16 -0.10 0.00 -0.12 0.00 0.00 57.88 57.85 3h3v h LEU 148 Cb 0.44 0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.58 3h3v h LEU 148 CO -0.31 -0.07 -0.24 0.00 -0.62 0.00 0.00 178.44 177.20 3h3v h THR 149 N 0.24 1.27 0.20 1.05 1.03 0.66 -2.94 112.91 114.41 3h3v h THR 149 Ca 0.43 -1.27 -0.01 0.00 -0.01 0.00 0.00 66.41 65.55 3h3v h THR 149 Cb 0.77 1.30 0.00 0.00 -1.07 0.00 0.00 68.15 69.15 3h3v h THR 149 CO -0.55 0.41 -0.09 0.78 -0.01 0.00 0.00 175.52 176.06 3h3v h ASN 150 N 0.50 -0.22 0.00 0.00 2.35 0.24 -3.29 115.58 115.15 3h3v h ASN 150 Ca 0.07 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3h3v h ASN 150 Cb 0.68 0.06 0.00 0.00 0.05 0.00 0.00 38.32 39.10 3h3v h ASN 150 CO 0.05 0.06 0.00 0.49 -1.65 0.00 0.00 177.43 176.38 3h3v n PHE 151 N -3.94 0.00 -1.74 1.19 3.01 -0.03 -4.84 117.46 111.11 3h3v n PHE 151 Ca -0.03 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.05 3h3v n PHE 151 Cb 0.10 -0.02 0.05 0.00 -0.01 0.00 0.00 39.48 39.60 3h3v n PHE 151 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3h3v n SER 152 N -0.30 2.61 -0.89 4.37 7.64 -1.11 -4.85 113.62 121.08 3h3v n SER 152 Ca 0.00 0.95 0.08 0.00 1.01 0.00 0.00 58.87 60.91 3h3v n SER 152 Cb 0.06 -1.58 0.20 0.00 -1.01 0.00 0.00 64.21 61.87 3h3v n SER 152 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 3h3v n ARG 153 N -1.23 2.51 0.00 1.43 0.63 -1.26 -5.00 116.66 113.73 3h3v n ARG 153 Ca 0.12 -2.15 0.00 0.00 -0.92 0.00 0.00 57.85 54.89 3h3v n ARG 153 Cb 0.45 -1.38 0.00 0.00 0.45 0.00 0.00 32.46 31.98 3h3v n ARG 153 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 3h3v n PHE 154 N 0.99 0.00 0.05 -0.14 3.01 -1.26 -3.97 117.46 116.13 3h3v n PHE 154 Ca 0.16 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.62 3h3v n PHE 154 Cb 0.49 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.96 3h3v n PHE 154 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 3h3v n ARG 155 N 0.00 0.00 -2.61 -1.08 0.63 -1.26 -4.96 116.66 107.38 3h3v n ARG 155 Ca 0.00 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.56 3h3v n ARG 155 Cb 0.00 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 32.86 3h3v n ARG 155 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 3h3v s ASP 156 N -2.00 7.05 0.00 6.15 1.01 -1.26 -4.90 116.67 122.73 3h3v s ASP 156 Ca 0.00 2.02 0.14 0.00 0.71 0.00 0.00 52.55 55.42 3h3v s ASP 156 Cb 0.00 -2.59 0.76 0.00 1.01 0.00 0.00 42.92 42.10 3h3v s ASP 156 CO 0.00 -0.28 1.50 1.67 0.21 0.00 0.00 175.17 178.27 3h3v n GLN 157 N 0.40 1.14 -0.11 8.23 -0.06 -1.26 -1.50 117.38 124.22 3h3v n GLN 157 Ca 0.03 -0.22 -0.24 0.00 -2.00 0.00 0.00 57.00 54.58 3h3v n GLN 157 Cb 0.49 -1.24 -0.08 0.00 -4.06 0.00 0.00 30.24 25.35 3h3v n GLN 157 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 3h3v n GLU 158 N -0.50 0.47 0.28 3.69 1.02 -1.26 -3.68 120.64 120.66 3h3v n GLU 158 Ca 0.11 0.21 -0.17 0.00 -0.02 0.00 0.00 57.16 57.28 3h3v n GLU 158 Cb 0.10 -1.29 -0.09 0.00 -0.02 0.00 0.00 31.44 30.14 3h3v n GLU 158 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3h3v h THR 159 N -0.80 0.14 0.00 2.62 1.35 -1.91 0.34 112.91 114.65 3h3v h THR 159 Ca -0.55 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 3h3v h THR 159 Cb 1.48 0.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 3h3v h THR 159 CO -0.34 0.00 0.00 0.52 -0.25 0.00 0.00 175.52 175.45 3h3v n VAL 160 N -5.53 1.48 0.03 6.82 0.31 -0.56 -0.93 118.33 119.96 3h3v n VAL 160 Ca -0.11 0.62 -0.08 0.00 -0.01 0.00 0.00 64.34 64.76 3h3v n VAL 160 Cb 0.42 -1.62 -0.05 0.00 -0.91 0.00 0.00 33.84 31.68 3h3v n VAL 160 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3h3v h GLY 161 N 0.02 -0.19 1.72 2.92 0.00 -0.47 -3.11 103.07 103.97 3h3v h GLY 161 Ca 0.00 0.07 -0.11 0.00 0.00 0.00 0.00 47.33 47.29 3h3v h GLY 161 CO 0.00 -0.07 -0.40 0.00 0.00 0.00 0.00 176.54 176.07 3h3v h ALA 162 N -0.63 1.07 -0.48 3.60 0.00 -0.32 -2.18 119.26 120.32 3h3v h ALA 162 Ca -0.02 -0.41 0.10 0.00 0.00 0.00 0.00 54.91 54.58 3h3v h ALA 162 Cb 0.42 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.01 3h3v h ALA 162 CO 0.03 0.59 -0.23 0.28 0.00 0.00 0.00 179.25 179.93 3h3v h VAL 163 N 0.26 0.34 0.55 0.00 2.07 -1.14 0.48 116.25 118.82 3h3v h VAL 163 Ca 0.02 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 3h3v h VAL 163 Cb 0.82 0.34 0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3h3v h VAL 163 CO 0.06 0.00 -0.27 0.40 0.02 0.00 0.00 177.57 177.79 3h3v h ILE 164 N -0.12 0.39 -0.54 4.57 2.04 -1.43 -2.03 117.51 120.38 3h3v h ILE 164 Ca 0.22 -0.25 0.16 0.00 1.00 0.00 0.00 64.86 65.99 3h3v h ILE 164 Cb 0.47 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 3h3v h ILE 164 CO -0.56 0.04 0.50 1.56 0.00 0.00 0.00 178.15 179.69 3h3v h GLN 165 N -0.91 0.00 0.00 2.37 4.20 -0.74 0.43 115.11 120.47 3h3v h GLN 165 Ca -0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.63 3h3v h GLN 165 Cb 0.63 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.41 3h3v h GLN 165 CO 0.12 0.00 0.00 -0.11 -0.67 0.00 0.00 178.83 178.17 3h3v n LEU 166 N -3.90 0.26 -0.31 1.46 7.94 0.16 -3.86 117.00 118.75 3h3v n LEU 166 Ca 0.10 0.61 0.11 0.00 -1.11 0.00 0.00 56.01 55.72 3h3v n LEU 166 Cb 0.71 -0.43 0.28 0.00 0.53 0.00 0.00 43.42 44.51 3h3v n LEU 166 CO 0.31 -0.43 1.11 -0.07 -1.11 0.00 0.00 177.39 177.19 3h3v h LEU 167 N 0.00 0.54 -6.75 -1.96 3.38 -1.11 -3.24 115.31 106.17 3h3v h LEU 167 Ca 0.00 0.11 -0.62 0.00 0.09 0.00 0.00 57.88 57.47 3h3v h LEU 167 Cb 0.00 0.04 0.10 0.00 0.09 0.00 0.00 40.66 40.89 3h3v h LEU 167 CO 0.00 0.16 1.81 0.29 0.09 0.00 0.00 178.44 180.79 3h3v n LYS 168 N -4.90 0.73 -1.15 1.13 4.76 0.15 -3.12 118.16 115.76 3h3v n LYS 168 Ca 0.21 -1.42 -0.00 0.00 -2.87 0.00 0.00 58.31 54.23 3h3v n LYS 168 Cb 0.55 -2.71 0.00 0.00 -1.84 0.00 0.00 35.03 31.03 3h3v n LYS 168 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 3h3v n SER 169 N 8.33 -0.08 0.00 4.39 3.41 -1.22 -4.83 113.62 123.62 3h3v n SER 169 Ca 0.48 -0.69 0.00 0.00 -0.26 0.00 0.00 58.87 58.40 3h3v n SER 169 Cb 0.41 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 3h3v n SER 169 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3h3v n THR 170 N -0.06 0.00 0.00 6.66 -1.04 -1.18 -5.03 114.28 113.64 3h3v n THR 170 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 3h3v n THR 170 Cb 0.42 -1.37 0.00 0.00 -1.82 0.00 0.00 70.33 67.57 3h3v n THR 170 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3h3v n GLY 171 N 2.91 1.19 3.67 3.41 0.00 -1.26 -5.07 105.19 110.03 3h3v n GLY 171 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3h3v n GLY 171 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h3v s LEU 172 N 0.00 4.31 -0.74 0.99 1.43 -1.26 -4.88 118.68 118.53 3h3v s LEU 172 Ca 0.00 2.19 -0.23 0.00 -1.03 0.00 0.00 54.13 55.06 3h3v s LEU 172 Cb 0.00 -3.54 -0.22 0.00 0.03 0.00 0.00 46.19 42.46 3h3v s LEU 172 CO 0.00 -0.89 1.84 1.41 0.23 0.00 0.00 176.35 178.95 3h3v n HIS 173 N 6.79 0.61 0.00 0.29 8.25 -1.26 -4.46 115.22 125.44 3h3v n HIS 173 Ca 0.16 -0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 3h3v n HIS 173 Cb 0.43 -1.98 0.00 0.00 1.12 0.00 0.00 29.99 29.56 3h3v n HIS 173 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3h3v n PRO 174 N 7.51 0.00 0.15 -0.41 -0.02 -1.26 -3.14 135.00 137.84 3h3v n PRO 174 Ca 0.35 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 3h3v n PRO 174 Cb 0.46 0.00 0.23 0.00 -0.02 0.00 0.00 33.50 34.17 3h3v n PRO 174 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3h3v h PHE 175 N 0.00 0.00 0.43 6.00 3.57 -1.95 -2.25 116.94 122.74 3h3v h PHE 175 Ca 0.00 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 3h3v h PHE 175 Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 3h3v h PHE 175 CO 0.00 0.53 -0.21 0.93 -2.23 0.00 0.00 178.31 177.34 3h3v h GLU 176 N 0.00 -0.55 -0.70 1.11 5.08 -1.83 -2.77 114.58 114.92 3h3v h GLU 176 Ca -0.01 0.04 0.12 0.00 -1.00 0.00 0.00 59.36 58.51 3h3v h GLU 176 Cb 0.95 0.13 -0.12 0.00 0.50 0.00 0.00 28.75 30.20 3h3v h GLU 176 CO 0.07 -0.37 -0.24 0.28 -1.00 0.00 0.00 179.01 177.75 3h3v n VAL 177 N -5.03 -0.34 -0.12 3.13 0.31 -1.19 0.19 118.33 115.28 3h3v n VAL 177 Ca -0.07 1.63 -0.09 0.00 -0.01 0.00 0.00 64.34 65.80 3h3v n VAL 177 Cb 0.23 -2.19 -0.01 0.00 -0.91 0.00 0.00 33.84 30.96 3h3v n VAL 177 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h3v h ALA 178 N 1.14 0.48 0.18 3.52 0.00 -1.46 -2.68 119.26 120.45 3h3v h ALA 178 Ca 0.28 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 3h3v h ALA 178 Cb 0.46 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3h3v h ALA 178 CO -0.71 -0.01 -0.09 1.96 0.00 0.00 0.00 179.25 180.40 3h3v h GLN 179 N 0.49 -0.23 -0.47 0.00 1.08 0.24 -0.73 115.11 115.49 3h3v h GLN 179 Ca 0.13 0.02 0.14 0.00 -1.45 0.00 0.00 58.65 57.49 3h3v h GLN 179 Cb 0.02 0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.49 3h3v h GLN 179 CO -0.02 -0.14 0.38 -0.07 -0.95 0.00 0.00 178.83 178.03 3h3v h LEU 180 N -0.26 0.00 0.26 1.46 3.38 -1.08 -1.53 115.31 117.54 3h3v h LEU 180 Ca -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3h3v h LEU 180 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3h3v h LEU 180 CO 0.04 0.00 -0.12 1.23 0.09 0.00 0.00 178.44 179.68 3h3v h GLY 181 N 0.00 -0.36 -0.14 0.83 0.00 -0.99 -3.35 103.07 99.06 3h3v h GLY 181 Ca 0.22 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.69 3h3v h GLY 181 CO -0.00 -0.13 0.00 -1.14 0.00 0.00 0.00 176.54 175.27 3h3v n SER 182 N -4.81 0.24 -4.01 0.19 3.41 -0.36 -4.74 113.62 103.54 3h3v n SER 182 Ca -0.04 -1.97 -0.31 0.00 -0.26 0.00 0.00 58.87 56.29 3h3v n SER 182 Cb 0.14 -0.03 -0.16 0.00 -0.26 0.00 0.00 64.21 63.90 3h3v n SER 182 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3h3v s LEU 183 N -1.03 2.21 -0.22 1.04 1.43 -0.61 -4.94 118.68 116.56 3h3v s LEU 183 Ca 0.04 -0.82 -0.29 0.00 -1.03 0.00 0.00 54.13 52.04 3h3v s LEU 183 Cb 0.02 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.94 3h3v s LEU 183 CO 0.03 -0.12 1.94 0.00 0.23 0.00 0.00 176.35 178.43 3h3v s ALA 184 N 1.39 2.98 0.10 4.21 0.00 -1.26 -4.83 121.76 124.36 3h3v s ALA 184 Ca 0.00 0.63 0.07 0.00 0.00 0.00 0.00 51.96 52.66 3h3v s ALA 184 Cb -0.15 -3.98 -0.03 0.00 0.00 0.00 0.00 23.12 18.95 3h3v s ALA 184 CO -0.09 -2.42 -0.18 0.00 0.00 0.00 0.00 175.76 173.06 3h3v n ASP 186 N 1.00 0.00 -4.89 0.00 8.00 -1.26 -4.88 116.55 114.52 3h3v n ASP 186 Ca -0.19 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.02 3h3v n ASP 186 Cb 0.54 -0.12 0.05 0.00 -0.02 0.00 0.00 41.12 41.57 3h3v n ASP 186 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3h3v s THR 187 N -0.56 3.33 -0.87 -3.53 2.01 -1.26 -4.89 115.64 109.87 3h3v s THR 187 Ca 0.00 0.34 0.18 0.00 0.31 0.00 0.00 61.69 62.52 3h3v s THR 187 Cb 0.00 -3.41 0.16 0.00 0.01 0.00 0.00 72.50 69.26 3h3v s THR 187 CO 0.00 -0.52 1.55 0.00 -0.69 0.00 0.00 174.62 174.96 3h3v n ALA 188 N -2.97 1.70 -0.06 7.40 0.00 -1.26 -2.56 120.51 122.76 3h3v n ALA 188 Ca 0.07 -0.02 -0.15 0.00 0.00 0.00 0.00 53.44 53.34 3h3v n ALA 188 Cb 0.58 -1.29 -0.13 0.00 0.00 0.00 0.00 19.45 18.61 3h3v n ALA 188 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 3h3v h ASP 189 N 0.00 0.04 -1.01 0.00 1.82 -1.96 -0.81 116.42 114.49 3h3v h ASP 189 Ca 0.00 -0.95 0.26 0.00 -0.39 0.00 0.00 57.03 55.95 3h3v h ASP 189 Cb 0.30 -0.01 -0.13 0.00 0.68 0.00 0.00 39.33 40.17 3h3v h ASP 189 CO 0.00 1.08 0.60 -0.08 -1.61 0.00 0.00 179.24 179.23 3h3v h GLU 190 N -0.94 0.49 0.12 0.28 4.81 -1.86 -0.24 114.58 117.24 3h3v h GLU 190 Ca -0.04 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 3h3v h GLU 190 Cb 1.08 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.35 3h3v h GLU 190 CO -0.00 0.33 -0.06 0.00 -0.73 0.00 0.00 179.01 178.55 3h3v h ALA 191 N 1.74 -0.36 0.00 2.92 0.00 -1.60 -1.82 119.26 120.14 3h3v h ALA 191 Ca 0.66 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.54 3h3v h ALA 191 Cb 1.36 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.21 3h3v h ALA 191 CO -0.48 -0.35 0.48 1.63 0.00 0.00 0.00 179.25 180.53 3h3v n LYS 192 N -3.12 0.05 -0.13 0.00 4.76 -0.31 0.40 118.16 119.81 3h3v n LYS 192 Ca -0.02 0.48 -0.28 0.00 -2.87 0.00 0.00 58.31 55.62 3h3v n LYS 192 Cb 0.06 -2.14 -0.09 0.00 -1.84 0.00 0.00 35.03 31.02 3h3v n LYS 192 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 3h3v n THR 193 N -1.83 1.49 0.90 -0.18 -1.04 -0.14 -3.50 114.28 109.98 3h3v n THR 193 Ca -0.00 -0.35 0.11 0.00 -2.04 0.00 0.00 64.05 61.76 3h3v n THR 193 Cb 0.49 -1.89 0.52 0.00 -1.82 0.00 0.00 70.33 67.63 3h3v n THR 193 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3h3v n LEU 194 N -4.23 0.00 -2.95 -4.42 4.77 -0.39 -3.23 117.00 106.55 3h3v n LEU 194 Ca -0.52 0.41 -0.17 0.00 -0.03 0.00 0.00 56.01 55.71 3h3v n LEU 194 Cb 0.86 -0.41 -0.01 0.00 -2.33 0.00 0.00 43.42 41.53 3h3v n LEU 194 CO 0.04 -0.10 -0.13 -0.38 -1.33 0.00 0.00 177.39 175.49 3h3v n ILE 195 N -1.41 0.69 0.28 -0.08 5.41 0.16 -4.98 119.36 119.44 3h3v n ILE 195 Ca 0.08 -4.22 0.05 0.00 1.00 0.00 0.00 62.75 59.66 3h3v n ILE 195 Cb 0.23 -0.14 0.26 0.00 -0.71 0.00 0.00 39.64 39.28 3h3v n ILE 195 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 3h3v h PRO 196 N 2.97 0.00 -0.08 0.38 0.13 -1.58 -1.18 132.00 132.63 3h3v h PRO 196 Ca 0.05 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.10 3h3v h PRO 196 Cb 0.99 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.10 3h3v h PRO 196 CO 0.55 0.00 -0.33 0.66 -0.23 0.00 0.00 178.00 178.66 3h3v h SER 197 N 0.00 0.15 0.00 1.44 4.64 -1.86 -3.34 113.55 114.58 3h3v h SER 197 Ca 0.00 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 3h3v h SER 197 Cb 1.39 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 3h3v h SER 197 CO 0.00 0.47 0.00 0.18 -0.87 0.00 0.00 176.83 176.61 3h3v n LEU 198 N -4.11 0.00 0.00 5.97 4.77 -0.45 -4.60 117.00 118.57 3h3v n LEU 198 Ca -0.01 0.49 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 3h3v n LEU 198 Cb 0.40 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 3h3v n LEU 198 CO 0.40 0.00 0.00 0.59 -1.33 0.00 0.00 177.39 177.05 3h3v n ASN 199 N -0.63 0.00 -0.03 -1.43 3.02 -1.26 -1.18 115.26 113.75 3h3v n ASN 199 Ca 0.00 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.58 3h3v n ASN 199 Cb 0.00 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.21 3h3v n ASN 199 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3h3v n ASN 200 N 0.00 1.91 -1.40 6.41 3.02 -1.26 -4.66 115.26 119.28 3h3v n ASN 200 Ca 0.00 -2.22 0.08 0.00 -0.03 0.00 0.00 54.58 52.41 3h3v n ASN 200 Cb 0.00 -0.12 0.31 0.00 -0.61 0.00 0.00 39.78 39.36 3h3v n ASN 200 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3h3v n LYS 201 N -0.70 3.32 0.00 3.52 5.02 -0.32 -4.93 118.16 124.07 3h3v n LYS 201 Ca 0.04 -2.44 0.00 0.00 -2.02 0.00 0.00 58.31 53.90 3h3v n LYS 201 Cb 0.38 -1.80 0.00 0.00 -0.02 0.00 0.00 35.03 33.59 3h3v n LYS 201 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 3h3v n ILE 202 N 0.94 0.00 -2.55 -0.18 3.06 -1.26 -5.01 119.36 114.37 3h3v n ILE 202 Ca 0.22 0.00 -0.42 0.00 -2.50 0.00 0.00 62.75 60.05 3h3v n ILE 202 Cb 0.78 0.00 -0.03 0.00 0.54 0.00 0.00 39.64 40.93 3h3v n ILE 202 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3h3v s SER 203 N 0.00 7.18 0.24 9.51 1.04 -1.26 -4.87 113.70 125.54 3h3v s SER 203 Ca 0.00 1.81 0.02 0.00 0.48 0.00 0.00 55.95 58.26 3h3v s SER 203 Cb 0.00 -2.57 0.60 0.00 0.10 0.00 0.00 66.02 64.16 3h3v s SER 203 CO 0.00 -0.43 1.21 0.47 0.98 0.00 0.00 173.24 175.47 3h3v n ASP 204 N 4.35 -0.08 -0.11 7.02 8.00 -1.26 0.59 116.55 135.06 3h3v n ASP 204 Ca 0.09 1.31 -0.05 0.00 0.71 0.00 0.00 54.79 56.84 3h3v n ASP 204 Cb 0.48 -0.48 0.02 0.00 -0.02 0.00 0.00 41.12 41.12 3h3v n ASP 204 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3h3v h ASP 205 N 0.00 -0.09 0.38 -2.24 3.32 -1.97 0.59 116.42 116.41 3h3v h ASP 205 Ca 0.47 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.58 3h3v h ASP 205 Cb 0.99 0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.67 3h3v h ASP 205 CO -0.72 -0.01 -0.21 -0.33 -1.72 0.00 0.00 179.24 176.25 3h3v h GLU 206 N 0.14 -0.52 0.00 3.56 4.39 -0.23 0.41 114.58 122.33 3h3v h GLU 206 Ca 0.18 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.92 3h3v h GLU 206 Cb 0.24 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 3h3v h GLU 206 CO -0.28 -0.35 0.38 1.25 -1.16 0.00 0.00 179.01 178.85 3h3v h LEU 207 N -0.54 0.00 0.19 1.33 5.85 -1.32 0.34 115.31 121.16 3h3v h LEU 207 Ca -0.05 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 3h3v h LEU 207 Cb 0.42 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.45 3h3v h LEU 207 CO 0.07 0.00 -0.09 -0.08 -0.34 0.00 0.00 178.44 178.00 3h3v h GLU 208 N 0.00 -0.25 -0.35 1.25 4.57 0.15 -0.45 114.58 119.51 3h3v h GLU 208 Ca 0.00 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 58.27 3h3v h GLU 208 Cb 0.75 0.06 -0.09 0.00 -0.16 0.00 0.00 28.75 29.31 3h3v h GLU 208 CO 0.00 -0.08 -0.33 0.00 -1.18 0.00 0.00 179.01 177.41 3h3v h ARG 209 N -1.05 -0.28 -0.58 1.92 3.08 0.35 0.52 114.38 118.35 3h3v h ARG 209 Ca -0.03 0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.13 3h3v h ARG 209 Cb 0.28 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 3h3v h ARG 209 CO 0.04 -0.19 0.39 0.82 -1.07 0.00 0.00 179.97 179.96 3h3v h ILE 210 N -0.29 0.92 0.00 2.04 2.04 -1.01 0.38 117.51 121.59 3h3v h ILE 210 Ca 0.15 -0.14 -0.09 0.00 1.00 0.00 0.00 64.86 65.78 3h3v h ILE 210 Cb 0.54 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 3h3v h ILE 210 CO -0.50 0.08 -0.44 -0.07 0.00 0.00 0.00 178.15 177.21 3h3v h LEU 211 N 0.42 0.00 0.10 1.44 3.38 0.16 -2.93 115.31 117.89 3h3v h LEU 211 Ca 0.26 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 3h3v h LEU 211 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3h3v h LEU 211 CO -0.07 0.44 -0.05 0.11 0.09 0.00 0.00 178.44 178.96 3h3v h LYS 212 N 0.00 -0.14 -1.30 1.13 1.57 0.27 -3.11 116.57 114.99 3h3v h LYS 212 Ca -0.00 0.01 0.38 0.00 -1.87 0.00 0.00 60.65 59.16 3h3v h LYS 212 Cb 1.07 0.03 -0.05 0.00 0.08 0.00 0.00 32.23 33.36 3h3v h LYS 212 CO 0.06 0.11 1.08 0.93 -0.57 0.00 0.00 179.45 181.06 3h3v h GLU 213 N -1.01 0.00 -0.00 3.15 4.39 -0.45 0.52 114.58 121.18 3h3v h GLU 213 Ca -0.01 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.57 3h3v h GLU 213 Cb 0.31 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.97 3h3v h GLU 213 CO 0.02 0.00 -0.44 -0.07 -1.16 0.00 0.00 179.01 177.37 3h3v h LEU 214 N 0.00 0.39 0.00 1.33 -0.00 -1.55 -2.69 115.31 112.79 3h3v h LEU 214 Ca 0.62 -0.77 0.00 0.00 -0.00 0.00 0.00 57.88 57.73 3h3v h LEU 214 Cb 2.77 -0.12 0.00 0.00 -0.00 0.00 0.00 40.66 43.31 3h3v h LEU 214 CO -0.01 1.10 0.00 -1.20 -0.00 0.00 0.00 178.44 178.34 3h3v n SER 215 N -4.35 0.00 0.00 -0.43 7.64 0.18 -1.61 113.62 115.05 3h3v n SER 215 Ca -0.10 -0.20 0.00 0.00 1.01 0.00 0.00 58.87 59.58 3h3v n SER 215 Cb 0.59 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 3h3v n SER 215 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3h3v n ASN 216 N -0.90 0.00 -0.60 6.43 4.13 -1.10 -4.58 115.26 118.63 3h3v n ASN 216 Ca 0.03 0.00 0.46 0.00 1.68 0.00 0.00 54.58 56.75 3h3v n ASN 216 Cb 0.01 0.00 0.71 0.00 -1.54 0.00 0.00 39.78 38.96 3h3v n ASN 216 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3h3v n LEU 217 N -1.33 0.02 -4.13 3.41 4.77 -1.02 -3.89 117.00 114.82 3h3v n LEU 217 Ca 0.00 0.90 -0.10 0.00 -0.03 0.00 0.00 56.01 56.78 3h3v n LEU 217 Cb 0.00 -0.45 -0.05 0.00 -2.33 0.00 0.00 43.42 40.58 3h3v n LEU 217 CO 0.00 -0.92 1.00 1.21 -1.33 0.00 0.00 177.39 177.36 3h3v n GLU 218 N -3.76 0.03 -1.31 3.23 2.13 -0.63 -4.83 120.64 115.50 3h3v n GLU 218 Ca 0.39 -0.68 -0.42 0.00 0.66 0.00 0.00 57.16 57.10 3h3v n GLU 218 Cb 1.73 -2.16 -0.01 0.00 0.27 0.00 0.00 31.44 31.27 3h3v n GLU 218 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 3h3v n THR 219 N 6.18 0.83 0.00 6.31 -1.04 -1.25 -4.95 114.28 120.36 3h3v n THR 219 Ca 0.19 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 3h3v n THR 219 Cb 0.44 -0.02 0.00 0.00 -1.82 0.00 0.00 70.33 68.93 3h3v n THR 219 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3h3v n LEU 220 N 2.26 0.00 0.00 -4.42 4.77 -1.26 -4.75 117.00 113.60 3h3v n LEU 220 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 3h3v n LEU 220 Cb 0.38 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 3h3v n LEU 220 CO 0.55 -0.11 0.00 -1.22 -1.33 0.00 0.00 177.39 175.28