#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v1q n ASN -3 N 0.00 0.00 -0.01 3.54 0.23 -1.26 -2.87 115.26 114.88 1v1q n ASN -3 Ca 0.00 0.00 -0.10 0.00 -0.53 0.00 0.00 54.58 53.95 1v1q n ASN -3 Cb 0.00 0.00 0.04 0.00 -2.08 0.00 0.00 39.78 37.74 1v1q n ASN -3 CO 0.00 0.00 0.00 -1.28 -0.93 0.00 0.00 177.26 175.05 1v1q h SER -2 N 0.00 0.69 -0.61 0.53 0.87 -2.11 -3.13 113.55 109.80 1v1q h SER -2 Ca 0.00 -0.36 -0.10 0.00 -1.23 0.00 0.00 61.79 60.09 1v1q h SER -2 Cb 0.00 -0.20 -0.06 0.00 -0.44 0.00 0.00 62.40 61.70 1v1q h SER -2 CO 0.00 1.09 0.13 -0.11 -0.53 0.00 0.00 176.83 177.41 1v1q n LEU -1 N -3.97 5.56 -0.43 2.23 7.94 -1.14 -4.38 117.00 122.82 1v1q n LEU -1 Ca -0.03 -2.86 0.08 0.00 -1.11 0.00 0.00 56.01 52.09 1v1q n LEU -1 Cb 0.61 -0.70 0.01 0.00 0.53 0.00 0.00 43.42 43.86 1v1q n LEU -1 CO 0.48 0.68 0.30 0.23 -1.11 0.00 0.00 177.39 177.97 1v1q n MET 1 N 0.23 1.61 -1.64 1.96 2.81 -1.18 -5.01 117.12 115.90 1v1q n MET 1 Ca 0.32 -0.93 -0.56 0.00 -1.81 0.00 0.00 57.70 54.71 1v1q n MET 1 Cb 1.22 -1.30 -0.07 0.00 -0.71 0.00 0.00 33.22 32.35 1v1q n MET 1 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1v1q n THR 2 N 0.04 0.12 -3.20 2.03 -1.04 -1.26 -4.94 114.28 106.04 1v1q n THR 2 Ca 0.07 -0.02 -0.00 0.00 -2.04 0.00 0.00 64.05 62.06 1v1q n THR 2 Cb 0.36 -0.88 -0.02 0.00 -1.82 0.00 0.00 70.33 67.98 1v1q n THR 2 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1v1q s ASN 3 N 1.81 -0.96 -0.17 8.00 3.84 -1.26 -5.14 114.94 121.06 1v1q s ASN 3 Ca 0.92 0.03 -0.09 0.00 0.21 0.00 0.00 52.86 53.94 1v1q s ASN 3 Cb -1.07 1.73 0.07 0.00 -0.55 0.00 0.00 41.25 41.43 1v1q s ASN 3 CO 0.58 -0.32 0.41 -0.60 -2.79 0.00 0.00 177.10 174.38 1v1q s ARG 4 N 2.74 0.37 -0.05 0.43 3.52 -1.26 -4.53 118.95 120.16 1v1q s ARG 4 Ca 0.10 0.84 0.04 0.00 -0.13 0.00 0.00 55.73 56.59 1v1q s ARG 4 Cb -0.11 0.06 0.00 0.00 -1.56 0.00 0.00 34.95 33.34 1v1q s ARG 4 CO -0.27 -0.18 -0.16 -1.17 -0.81 0.00 0.00 175.30 172.70 1v1q s LEU 5 N 1.72 1.88 -0.14 -0.88 2.96 -0.08 -5.00 118.68 119.13 1v1q s LEU 5 Ca -0.07 -0.35 0.01 0.00 -0.22 0.00 0.00 54.13 53.50 1v1q s LEU 5 Cb -0.09 -0.95 0.02 0.00 0.50 0.00 0.00 46.19 45.66 1v1q s LEU 5 CO -0.13 0.13 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.19 1v1q s VAL 6 N 0.17 1.64 -0.08 1.68 1.01 -1.26 -1.60 120.40 121.95 1v1q s VAL 6 Ca -0.06 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 1v1q s VAL 6 Cb -0.12 -1.51 0.04 0.00 0.00 0.00 0.00 36.38 34.78 1v1q s VAL 6 CO 0.03 0.47 0.19 -0.22 0.00 0.00 0.00 175.10 175.57 1v1q s LEU 7 N 1.32 0.59 0.10 3.92 2.96 -0.16 -4.99 118.68 122.42 1v1q s LEU 7 Ca 0.02 0.40 0.02 0.00 -0.22 0.00 0.00 54.13 54.35 1v1q s LEU 7 Cb -0.13 0.54 -0.04 0.00 0.50 0.00 0.00 46.19 47.05 1v1q s LEU 7 CO -0.08 -0.15 0.19 -0.44 -1.32 0.00 0.00 176.35 174.54 1v1q s SER 8 N 1.19 6.09 0.00 3.68 0.01 -1.26 -0.80 113.70 122.61 1v1q s SER 8 Ca -0.09 0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.31 1v1q s SER 8 Cb -0.11 -1.79 0.00 0.00 0.21 0.00 0.00 66.02 64.33 1v1q s SER 8 CO -0.07 0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.32 1v1q n GLY 9 N 0.05 -1.23 3.33 3.44 0.00 -0.28 -4.49 105.19 106.02 1v1q n GLY 9 Ca -0.07 -0.80 -0.33 0.00 0.00 0.00 0.00 46.02 44.82 1v1q n GLY 9 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v1q s THR 10 N -3.00 2.86 -0.21 2.61 2.01 -0.08 -1.46 115.64 118.37 1v1q s THR 10 Ca 0.00 -0.73 -0.29 0.00 0.31 0.00 0.00 61.69 60.98 1v1q s THR 10 Cb 0.00 -2.19 -0.03 0.00 0.01 0.00 0.00 72.50 70.29 1v1q s THR 10 CO 0.00 0.53 1.70 -0.69 -0.69 0.00 0.00 174.62 175.47 1v1q s VAL 11 N 0.41 3.58 -0.75 3.82 1.01 -0.24 -0.39 120.40 127.84 1v1q s VAL 11 Ca -0.11 0.64 0.17 0.00 0.00 0.00 0.00 61.98 62.68 1v1q s VAL 11 Cb -0.16 -3.60 -0.20 0.00 0.00 0.00 0.00 36.38 32.42 1v1q s VAL 11 CO 0.06 -0.27 0.71 0.00 0.00 0.00 0.00 175.10 175.60 1v1q s ARG 13 N -2.70 2.46 0.20 0.00 6.06 -1.23 -4.94 118.95 118.80 1v1q s ARG 13 Ca 0.05 -0.62 -0.32 0.00 -2.50 0.00 0.00 55.73 52.34 1v1q s ARG 13 Cb 0.13 -2.19 -0.14 0.00 0.06 0.00 0.00 34.95 32.82 1v1q s ARG 13 CO 0.72 -0.20 1.50 0.00 -2.50 0.00 0.00 175.30 174.82 1v1q n ALA 14 N 4.65 1.32 -1.55 6.12 0.00 -1.26 -3.92 120.51 125.86 1v1q n ALA 14 Ca -0.18 0.43 -0.42 0.00 0.00 0.00 0.00 53.44 53.27 1v1q n ALA 14 Cb 0.50 -2.32 -0.04 0.00 0.00 0.00 0.00 19.45 17.59 1v1q n ALA 14 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1v1q n PRO 15 N 2.73 1.43 -3.76 0.00 -0.02 -1.26 -4.77 135.00 129.35 1v1q n PRO 15 Ca 0.14 0.29 -0.36 0.00 -2.02 0.00 0.00 63.50 61.55 1v1q n PRO 15 Cb 0.30 -3.12 -0.07 0.00 -0.02 0.00 0.00 33.50 30.59 1v1q n PRO 15 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1v1q s LEU 16 N 9.55 4.28 -0.20 2.45 1.43 0.18 -4.88 118.68 131.49 1v1q s LEU 16 Ca 1.03 0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 54.34 1v1q s LEU 16 Cb -0.40 -2.11 -0.05 0.00 0.03 0.00 0.00 46.19 43.66 1v1q s LEU 16 CO 0.35 0.25 0.24 -0.60 0.23 0.00 0.00 176.35 176.82 1v1q s ARG 17 N -0.12 4.18 0.16 1.70 3.52 -1.26 -0.86 118.95 126.27 1v1q s ARG 17 Ca 0.11 -0.05 0.08 0.00 -0.13 0.00 0.00 55.73 55.74 1v1q s ARG 17 Cb -0.12 -3.48 -0.04 0.00 -1.56 0.00 0.00 34.95 29.76 1v1q s ARG 17 CO 0.01 0.15 -0.18 0.15 -0.81 0.00 0.00 175.30 174.62 1v1q s LYS 18 N 0.76 1.25 -0.09 5.12 1.02 -0.06 -4.97 119.74 122.78 1v1q s LYS 18 Ca 0.13 -1.39 0.04 0.00 0.02 0.00 0.00 55.97 54.77 1v1q s LYS 18 Cb -0.13 -1.29 -0.00 0.00 -0.52 0.00 0.00 37.83 35.89 1v1q s LYS 18 CO 0.03 0.26 -0.22 0.08 -0.92 0.00 0.00 175.35 174.58 1v1q s VAL 19 N -2.05 1.92 0.85 3.17 1.01 -1.26 -0.17 120.40 123.88 1v1q s VAL 19 Ca 0.15 -0.95 -0.11 0.00 0.00 0.00 0.00 61.98 61.07 1v1q s VAL 19 Cb -0.06 -1.66 0.10 0.00 0.00 0.00 0.00 36.38 34.77 1v1q s VAL 19 CO 0.06 0.53 1.10 -0.94 0.00 0.00 0.00 175.10 175.85 1v1q s SER 20 N 0.29 3.76 0.37 3.32 1.04 0.07 -4.82 113.70 117.73 1v1q s SER 20 Ca -0.15 1.75 0.13 0.00 0.48 0.00 0.00 55.95 58.16 1v1q s SER 20 Cb -0.17 -2.40 0.95 0.00 0.10 0.00 0.00 66.02 64.50 1v1q s SER 20 CO 0.07 -2.50 1.81 -0.65 0.98 0.00 0.00 173.24 172.96 1v1q h PRO 21 N -1.45 0.53 0.00 4.02 0.11 -2.00 0.53 132.00 133.75 1v1q h PRO 21 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1v1q h PRO 21 Cb 1.26 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1v1q h PRO 21 CO 0.51 0.35 0.00 -1.13 -0.21 0.00 0.00 178.00 177.52 1v1q n SER 22 N -4.62 0.00 0.00 -2.05 3.41 -1.26 -4.87 113.62 104.23 1v1q n SER 22 Ca 0.22 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 59.27 1v1q n SER 22 Cb 0.67 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 1v1q n SER 22 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v1q n GLY 23 N 0.47 0.85 3.68 5.00 0.00 0.19 -5.07 105.19 110.31 1v1q n GLY 23 Ca 0.05 -0.23 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 1v1q n GLY 23 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1v1q s ILE 24 N -2.00 5.02 0.38 -0.61 -1.09 -1.25 -4.79 121.20 116.87 1v1q s ILE 24 Ca 0.00 1.28 -0.25 0.00 -2.23 0.00 0.00 60.65 59.45 1v1q s ILE 24 Cb 0.00 -3.98 -0.09 0.00 -1.58 0.00 0.00 42.46 36.81 1v1q s ILE 24 CO 0.00 0.15 1.05 -2.16 -1.23 0.00 0.00 174.94 172.76 1v1q s PRO 25 N 1.57 4.22 0.01 2.79 0.04 -1.26 -0.75 135.00 141.62 1v1q s PRO 25 Ca 0.32 1.54 -0.03 0.00 0.04 0.00 0.00 61.00 62.87 1v1q s PRO 25 Cb -0.16 -2.62 -0.01 0.00 0.04 0.00 0.00 34.50 31.75 1v1q s PRO 25 CO 0.12 -0.10 0.03 -1.01 0.04 0.00 0.00 177.00 176.09 1v1q s HIS 26 N -1.60 0.15 -0.11 0.56 3.76 0.76 -1.64 115.29 117.17 1v1q s HIS 26 Ca 0.56 -0.33 0.02 0.00 -0.15 0.00 0.00 55.06 55.17 1v1q s HIS 26 Cb -0.23 -0.12 0.01 0.00 1.11 0.00 0.00 32.58 33.35 1v1q s HIS 26 CO 0.29 -0.20 -0.17 0.00 -0.85 0.00 0.00 174.74 173.80 1v1q s GLN 28 N 0.90 1.86 0.28 0.00 -0.21 -0.04 -0.55 119.66 121.89 1v1q s GLN 28 Ca -0.08 -0.92 -0.20 0.00 0.02 0.00 0.00 55.36 54.18 1v1q s GLN 28 Cb -0.15 -1.86 0.05 0.00 1.00 0.00 0.00 33.01 32.04 1v1q s GLN 28 CO -0.01 0.50 0.82 -0.59 -2.12 0.00 0.00 175.29 173.89 1v1q s PHE 29 N -0.64 -0.05 -0.05 0.91 -0.71 -0.77 -0.65 117.98 116.03 1v1q s PHE 29 Ca 0.10 -0.44 0.06 0.00 -1.04 0.00 0.00 56.93 55.61 1v1q s PHE 29 Cb -0.09 0.74 -0.02 0.00 -1.21 0.00 0.00 43.02 42.44 1v1q s PHE 29 CO -0.00 -1.23 -0.23 0.08 -1.34 0.00 0.00 175.22 172.50 1v1q s VAL 30 N -3.11 2.28 -0.22 -2.49 1.01 -1.25 0.38 120.40 116.99 1v1q s VAL 30 Ca 0.14 -1.00 -0.04 0.00 0.00 0.00 0.00 61.98 61.07 1v1q s VAL 30 Cb -0.04 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.49 1v1q s VAL 30 CO 0.07 0.58 -0.02 -0.22 0.00 0.00 0.00 175.10 175.51 1v1q s LEU 31 N -0.40 3.02 -0.36 3.92 2.96 0.12 -2.20 118.68 125.73 1v1q s LEU 31 Ca 0.04 -0.34 -0.19 0.00 -0.22 0.00 0.00 54.13 53.41 1v1q s LEU 31 Cb -0.12 -1.77 0.00 0.00 0.50 0.00 0.00 46.19 44.80 1v1q s LEU 31 CO 0.02 -0.01 0.58 -0.70 -1.32 0.00 0.00 176.35 174.91 1v1q s GLU 32 N 1.43 3.62 -0.16 1.98 2.12 0.48 -0.55 118.70 127.62 1v1q s GLU 32 Ca 0.05 -0.08 -0.06 0.00 0.36 0.00 0.00 54.97 55.24 1v1q s GLU 32 Cb -0.14 -3.82 -0.04 0.00 0.26 0.00 0.00 34.13 30.39 1v1q s GLU 32 CO -0.01 -0.71 0.04 -1.58 -0.54 0.00 0.00 175.26 172.45 1v1q s HIS 33 N 2.57 3.22 -0.12 5.30 5.65 0.88 -0.90 115.29 131.89 1v1q s HIS 33 Ca 0.22 0.06 -0.04 0.00 0.25 0.00 0.00 55.06 55.54 1v1q s HIS 33 Cb -0.15 -2.00 0.06 0.00 -1.18 0.00 0.00 32.58 29.31 1v1q s HIS 33 CO 0.14 0.21 0.21 0.50 -0.65 0.00 0.00 174.74 175.15 1v1q s ARG 34 N 0.08 0.10 0.30 2.88 6.06 -1.26 -1.12 118.95 125.99 1v1q s ARG 34 Ca 0.04 0.58 -0.12 0.00 -2.50 0.00 0.00 55.73 53.73 1v1q s ARG 34 Cb -0.12 -0.33 0.05 0.00 0.06 0.00 0.00 34.95 34.60 1v1q s ARG 34 CO 0.01 -0.35 0.63 -1.13 -2.50 0.00 0.00 175.30 171.96 1v1q n SER 35 N 5.33 -1.77 -4.08 -2.12 3.41 -0.16 -5.00 113.62 109.23 1v1q n SER 35 Ca -0.05 -2.21 -0.30 0.00 -0.26 0.00 0.00 58.87 56.04 1v1q n SER 35 Cb 0.50 2.95 -0.16 0.00 -0.26 0.00 0.00 64.21 67.23 1v1q n SER 35 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1v1q s VAL 36 N -2.29 1.70 0.29 -3.33 1.01 -1.26 0.25 120.40 116.78 1v1q s VAL 36 Ca 0.13 -0.75 0.10 0.00 0.00 0.00 0.00 61.98 61.46 1v1q s VAL 36 Cb -0.04 -1.55 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 1v1q s VAL 36 CO 0.09 0.48 -0.05 -1.10 0.00 0.00 0.00 175.10 174.52 1v1q s GLN 37 N 1.13 2.07 -0.08 2.72 -1.52 0.11 -4.89 119.66 119.21 1v1q s GLN 37 Ca -0.02 -1.60 -0.30 0.00 -1.95 0.00 0.00 55.36 51.49 1v1q s GLN 37 Cb -0.14 -1.99 -0.02 0.00 -0.22 0.00 0.00 33.01 30.64 1v1q s GLN 37 CO -0.06 0.29 1.00 -1.21 -0.25 0.00 0.00 175.29 175.07 1v1q s GLU 38 N -3.64 4.46 -0.11 2.91 0.41 -1.26 -0.41 118.70 121.05 1v1q s GLU 38 Ca 0.32 1.40 -0.04 0.00 -0.41 0.00 0.00 54.97 56.25 1v1q s GLU 38 Cb -0.04 -3.52 0.05 0.00 -1.78 0.00 0.00 34.13 28.84 1v1q s GLU 38 CO 0.18 -0.25 0.12 -2.00 -0.49 0.00 0.00 175.26 172.83 1v1q s GLU 39 N 1.77 0.03 -1.22 1.61 2.12 0.55 -4.86 118.70 118.70 1v1q s GLU 39 Ca 0.49 0.29 0.00 0.00 0.36 0.00 0.00 54.97 56.11 1v1q s GLU 39 Cb -0.19 -0.89 0.00 0.00 0.26 0.00 0.00 34.13 33.31 1v1q s GLU 39 CO 0.20 -0.46 0.00 0.00 -0.54 0.00 0.00 175.26 174.46 1v1q n ALA 40 N 5.31 -0.66 0.00 6.30 0.00 -1.26 -0.48 120.51 129.72 1v1q n ALA 40 Ca -0.05 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1v1q n ALA 40 Cb 0.50 -1.58 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1v1q n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1v1q n GLY 41 N -0.74 1.53 3.95 0.00 0.00 -1.26 -5.05 105.19 103.62 1v1q n GLY 41 Ca -0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.63 1v1q n GLY 41 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1v1q s PHE 42 N -2.34 1.65 -0.24 1.61 0.40 0.37 -5.10 117.98 114.33 1v1q s PHE 42 Ca 0.00 -0.77 -0.07 0.00 -0.60 0.00 0.00 56.93 55.49 1v1q s PHE 42 Cb 0.00 -2.04 -0.03 0.00 0.51 0.00 0.00 43.02 41.46 1v1q s PHE 42 CO 0.00 -0.69 0.06 -1.01 0.70 0.00 0.00 175.22 174.29 1v1q s HIS 43 N -2.71 3.09 -0.11 0.36 3.76 -1.26 -0.33 115.29 118.09 1v1q s HIS 43 Ca 0.45 -0.40 0.02 0.00 -0.15 0.00 0.00 55.06 54.98 1v1q s HIS 43 Cb -0.04 -2.21 -0.01 0.00 1.11 0.00 0.00 32.58 31.43 1v1q s HIS 43 CO 0.28 -0.32 -0.17 0.50 -0.85 0.00 0.00 174.74 174.18 1v1q s ARG 44 N 1.48 3.11 0.24 1.40 6.06 0.45 -4.93 118.95 126.76 1v1q s ARG 44 Ca 0.06 -0.76 -0.30 0.00 -2.50 0.00 0.00 55.73 52.23 1v1q s ARG 44 Cb -0.15 -2.47 -0.09 0.00 0.06 0.00 0.00 34.95 32.30 1v1q s ARG 44 CO 0.03 0.27 1.09 -0.65 -2.50 0.00 0.00 175.30 173.55 1v1q s GLN 45 N 0.16 4.63 -0.07 5.12 -0.21 -1.26 0.09 119.66 128.13 1v1q s GLN 45 Ca -0.09 1.75 0.02 0.00 0.02 0.00 0.00 55.36 57.06 1v1q s GLN 45 Cb -0.16 -3.23 0.01 0.00 1.00 0.00 0.00 33.01 30.64 1v1q s GLN 45 CO 0.06 0.17 -0.13 0.00 -2.12 0.00 0.00 175.29 173.27 1v1q s ALA 46 N -0.78 1.34 0.01 6.09 0.00 0.14 -4.89 121.76 123.67 1v1q s ALA 46 Ca 0.46 -0.47 0.02 0.00 0.00 0.00 0.00 51.96 51.98 1v1q s ALA 46 Cb -0.31 -0.60 -0.01 0.00 0.00 0.00 0.00 23.12 22.20 1v1q s ALA 46 CO 0.38 0.11 -0.07 -0.46 0.00 0.00 0.00 175.76 175.72 1v1q s TRP 47 N 0.67 0.62 -0.27 0.00 -0.00 -1.26 -0.98 118.94 117.72 1v1q s TRP 47 Ca -0.14 -0.21 -0.25 0.00 -0.00 0.00 0.00 56.10 55.49 1v1q s TRP 47 Cb -0.16 -0.39 0.12 0.00 -0.00 0.00 0.00 33.47 33.04 1v1q s TRP 47 CO 0.04 -0.02 0.99 0.00 -0.00 0.00 0.00 176.95 177.96 1v1q s GLN 49 N 0.12 2.52 -0.32 0.00 -0.21 -1.26 -0.08 119.66 120.43 1v1q s GLN 49 Ca 0.02 -1.54 -0.11 0.00 0.02 0.00 0.00 55.36 53.75 1v1q s GLN 49 Cb -0.05 -3.77 -0.01 0.00 1.00 0.00 0.00 33.01 30.18 1v1q s GLN 49 CO -0.05 -1.00 0.20 1.41 -2.12 0.00 0.00 175.29 173.73 1v1q s MET 50 N 1.38 3.44 0.35 2.91 -2.45 0.29 -4.88 119.30 120.35 1v1q s MET 50 Ca 0.04 -0.66 -0.27 0.00 -1.25 0.00 0.00 55.69 53.55 1v1q s MET 50 Cb -0.23 -3.68 -0.09 0.00 1.25 0.00 0.00 34.83 32.07 1v1q s MET 50 CO 0.01 -0.42 1.13 -1.25 1.05 0.00 0.00 175.02 175.54 1v1q s PRO 51 N 1.67 4.30 0.09 4.11 0.04 -1.26 0.13 135.00 144.08 1v1q s PRO 51 Ca 0.05 1.79 0.07 0.00 0.04 0.00 0.00 61.00 62.95 1v1q s PRO 51 Cb -0.17 -2.85 -0.03 0.00 0.04 0.00 0.00 34.50 31.48 1v1q s PRO 51 CO 0.08 -0.10 -0.17 0.08 0.04 0.00 0.00 177.00 176.94 1v1q s VAL 52 N -1.36 1.39 -0.02 -0.36 1.01 0.16 -1.61 120.40 119.62 1v1q s VAL 52 Ca 0.52 -1.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 1v1q s VAL 52 Cb -0.30 -1.34 0.01 0.00 0.00 0.00 0.00 36.38 34.75 1v1q s VAL 52 CO 0.38 -0.19 0.04 -0.51 0.00 0.00 0.00 175.10 174.83 1v1q s ILE 53 N -1.35 -0.01 -0.29 2.22 2.07 -0.78 -1.84 121.20 121.21 1v1q s ILE 53 Ca 0.03 0.05 0.01 0.00 -1.41 0.00 0.00 60.65 59.33 1v1q s ILE 53 Cb -0.09 -0.08 0.06 0.00 0.13 0.00 0.00 42.46 42.48 1v1q s ILE 53 CO 0.03 0.02 -0.04 -0.69 -1.91 0.00 0.00 174.94 172.36 1v1q s VAL 54 N 0.29 2.54 -0.11 4.00 1.01 0.29 -1.05 120.40 127.37 1v1q s VAL 54 Ca -0.02 -1.64 -0.05 0.00 0.00 0.00 0.00 61.98 60.26 1v1q s VAL 54 Cb -0.03 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 1v1q s VAL 54 CO -0.01 -0.15 0.11 -0.55 0.00 0.00 0.00 175.10 174.50 1v1q s SER 55 N 1.17 6.10 0.00 3.32 0.15 -1.26 -1.16 113.70 122.02 1v1q s SER 55 Ca -0.05 0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.98 1v1q s SER 55 Cb -0.20 -1.91 0.00 0.00 -1.71 0.00 0.00 66.02 62.20 1v1q s SER 55 CO -0.04 0.40 0.00 0.61 1.20 0.00 0.00 173.24 175.41 1v1q n GLY 56 N 1.97 2.46 0.53 9.45 0.00 -0.65 -4.56 105.19 114.39 1v1q n GLY 56 Ca -0.19 -1.71 -0.21 0.00 0.00 0.00 0.00 46.02 43.91 1v1q n GLY 56 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1v1q h HIS 57 N 0.00 -1.26 -0.04 1.61 2.76 -1.96 -2.76 115.15 113.50 1v1q h HIS 57 Ca 0.00 -0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.13 1v1q h HIS 57 Cb 0.00 0.42 -0.00 0.00 1.55 0.00 0.00 27.41 29.38 1v1q h HIS 57 CO 0.00 -0.77 -0.02 1.05 -1.30 0.00 0.00 177.93 176.89 1v1q h GLU 58 N -1.33 0.06 0.00 5.26 4.11 -1.98 -1.43 114.58 119.27 1v1q h GLU 58 Ca -0.13 -0.01 -0.03 0.00 0.07 0.00 0.00 59.36 59.26 1v1q h GLU 58 Cb 1.02 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 1v1q h GLU 58 CO 0.21 0.09 -0.14 -0.91 0.07 0.00 0.00 179.01 178.32 1v1q h ASN 59 N 0.06 0.00 -0.01 3.06 4.21 -1.77 -2.83 115.58 118.30 1v1q h ASN 59 Ca 0.01 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.53 1v1q h ASN 59 Cb 0.08 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.28 1v1q h ASN 59 CO 0.00 0.14 0.02 1.56 -1.29 0.00 0.00 177.43 177.86 1v1q h GLN 60 N 0.00 0.00 -0.21 0.81 1.08 -0.96 -2.38 115.11 113.45 1v1q h GLN 60 Ca -0.00 0.00 0.06 0.00 -1.45 0.00 0.00 58.65 57.26 1v1q h GLN 60 Cb 0.53 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.95 1v1q h GLN 60 CO 0.02 0.00 0.16 0.00 -0.95 0.00 0.00 178.83 178.06 1v1q h ALA 61 N 1.97 2.13 -0.14 3.87 0.00 -1.66 -2.05 119.26 123.38 1v1q h ALA 61 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1v1q h ALA 61 Cb 0.05 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1v1q h ALA 61 CO -0.00 -0.27 0.00 0.44 0.00 0.00 0.00 179.25 179.42 1v1q n ILE 62 N -4.36 0.18 -0.11 0.00 -5.35 -0.90 -3.74 119.36 105.09 1v1q n ILE 62 Ca 0.02 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 62.28 1v1q n ILE 62 Cb 0.30 0.10 0.00 0.00 -1.74 0.00 0.00 39.64 38.30 1v1q n ILE 62 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1v1q n THR 63 N -0.06 0.24 0.36 7.28 -2.24 -0.77 -4.75 114.28 114.33 1v1q n THR 63 Ca 0.11 -0.56 0.11 0.00 -2.27 0.00 0.00 64.05 61.43 1v1q n THR 63 Cb 0.19 0.96 0.46 0.00 -2.10 0.00 0.00 70.33 69.84 1v1q n THR 63 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1v1q n HIS 64 N -0.12 0.64 0.24 4.78 8.25 -1.24 -2.97 115.22 124.80 1v1q n HIS 64 Ca 0.00 0.26 0.04 0.00 -0.26 0.00 0.00 57.72 57.77 1v1q n HIS 64 Cb 0.10 -0.93 0.05 0.00 1.12 0.00 0.00 29.99 30.33 1v1q n HIS 64 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1v1q n SER 65 N -2.10 1.93 -4.86 0.41 3.41 -1.26 -5.02 113.62 106.14 1v1q n SER 65 Ca 0.02 -1.50 -0.34 0.00 -0.26 0.00 0.00 58.87 56.79 1v1q n SER 65 Cb 0.18 -0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 64.04 1v1q n SER 65 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1v1q s ILE 66 N -0.77 4.95 0.35 -1.33 -4.36 -1.16 -5.05 121.20 113.83 1v1q s ILE 66 Ca 0.12 0.57 -0.02 0.00 -0.26 0.00 0.00 60.65 61.06 1v1q s ILE 66 Cb 0.07 -3.67 0.01 0.00 1.25 0.00 0.00 42.46 40.13 1v1q s ILE 66 CO 0.11 0.13 0.49 0.35 0.24 0.00 0.00 174.94 176.25 1v1q n THR 67 N 0.44 0.00 -1.78 8.37 -2.24 -1.26 -4.82 114.28 112.99 1v1q n THR 67 Ca -0.04 -1.76 -0.41 0.00 -2.27 0.00 0.00 64.05 59.58 1v1q n THR 67 Cb 0.52 1.09 0.00 0.00 -2.10 0.00 0.00 70.33 69.84 1v1q n THR 67 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 1v1q n VAL 68 N -0.57 2.09 0.00 2.28 3.14 -1.26 -1.74 118.33 122.26 1v1q n VAL 68 Ca 0.01 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.89 1v1q n VAL 68 Cb 0.58 -1.97 0.00 0.00 -1.06 0.00 0.00 33.84 31.39 1v1q n VAL 68 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1v1q n GLY 69 N 0.46 3.27 3.75 7.55 0.00 0.89 -4.98 105.19 116.13 1v1q n GLY 69 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1v1q n GLY 69 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v1q s SER 70 N -0.91 6.40 -0.28 1.61 0.01 -0.71 -4.66 113.70 115.16 1v1q s SER 70 Ca 0.00 2.93 -0.10 0.00 1.31 0.00 0.00 55.95 60.09 1v1q s SER 70 Cb 0.00 -2.64 -0.03 0.00 0.21 0.00 0.00 66.02 63.56 1v1q s SER 70 CO 0.00 -0.88 0.15 -0.13 0.41 0.00 0.00 173.24 172.79 1v1q s ARG 71 N -0.70 3.69 0.28 12.44 0.52 -1.26 -1.07 118.95 132.84 1v1q s ARG 71 Ca 0.61 -0.48 0.03 0.00 -0.52 0.00 0.00 55.73 55.37 1v1q s ARG 71 Cb -0.47 -3.55 -0.03 0.00 0.52 0.00 0.00 34.95 31.42 1v1q s ARG 71 CO 0.49 -0.26 0.24 0.96 0.02 0.00 0.00 175.30 176.76 1v1q s ILE 72 N 1.68 0.00 -0.18 1.52 -4.36 -0.53 -2.82 121.20 116.51 1v1q s ILE 72 Ca 0.06 -1.95 -0.00 0.00 -0.26 0.00 0.00 60.65 58.50 1v1q s ILE 72 Cb -0.16 -2.50 0.04 0.00 1.25 0.00 0.00 42.46 41.09 1v1q s ILE 72 CO 0.08 0.00 -0.06 -0.89 0.24 0.00 0.00 174.94 174.30 1v1q s THR 73 N -3.70 1.26 -0.14 8.37 2.01 0.11 -1.12 115.64 122.43 1v1q s THR 73 Ca 0.39 -0.75 -0.07 0.00 0.31 0.00 0.00 61.69 61.56 1v1q s THR 73 Cb 0.04 -1.42 -0.04 0.00 0.01 0.00 0.00 72.50 71.09 1v1q s THR 73 CO 0.21 0.12 0.11 -0.69 -0.69 0.00 0.00 174.62 173.68 1v1q s VAL 74 N 1.56 5.28 -0.04 3.82 1.01 0.02 -1.42 120.40 130.64 1v1q s VAL 74 Ca -0.00 0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.15 1v1q s VAL 74 Cb -0.16 -3.33 -0.00 0.00 0.00 0.00 0.00 36.38 32.90 1v1q s VAL 74 CO -0.08 0.56 -0.16 -1.58 0.00 0.00 0.00 175.10 173.85 1v1q s GLN 75 N -0.58 1.65 0.00 2.72 0.74 -0.41 -0.99 119.66 122.80 1v1q s GLN 75 Ca 0.12 -0.56 0.00 0.00 0.05 0.00 0.00 55.36 54.97 1v1q s GLN 75 Cb -0.12 -1.45 0.00 0.00 1.10 0.00 0.00 33.01 32.55 1v1q s GLN 75 CO 0.02 0.22 0.00 0.41 -0.55 0.00 0.00 175.29 175.39 1v1q n GLY 76 N 3.18 -0.61 3.42 2.59 0.00 -0.63 -0.18 105.19 112.96 1v1q n GLY 76 Ca -0.18 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 44.93 1v1q n GLY 76 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1v1q s PHE 77 N -3.44 2.38 0.18 1.61 -0.71 -0.84 -0.90 117.98 116.25 1v1q s PHE 77 Ca 0.00 -0.34 0.02 0.00 -1.04 0.00 0.00 56.93 55.57 1v1q s PHE 77 Cb 0.00 -1.28 -0.04 0.00 -1.21 0.00 0.00 43.02 40.50 1v1q s PHE 77 CO 0.00 0.36 0.33 0.96 -1.34 0.00 0.00 175.22 175.53 1v1q s ILE 78 N -1.11 5.28 0.02 -4.49 -5.25 -1.26 0.05 121.20 114.44 1v1q s ILE 78 Ca 0.15 -0.64 -0.09 0.00 -0.99 0.00 0.00 60.65 59.08 1v1q s ILE 78 Cb -0.10 -3.76 0.01 0.00 2.95 0.00 0.00 42.46 41.56 1v1q s ILE 78 CO 0.07 -0.15 0.19 -0.55 -1.79 0.00 0.00 174.94 172.71 1v1q s SER 79 N -3.33 0.00 0.32 4.36 0.15 -0.72 -4.95 113.70 109.53 1v1q s SER 79 Ca 0.36 -0.26 0.03 0.00 0.70 0.00 0.00 55.95 56.78 1v1q s SER 79 Cb -0.11 0.26 -0.04 0.00 -1.71 0.00 0.00 66.02 64.43 1v1q s SER 79 CO 0.29 -0.48 0.14 0.00 1.20 0.00 0.00 173.24 174.39 1v1q s HIS 81 N -3.54 1.29 0.17 0.00 2.46 0.03 -4.99 115.29 110.71 1v1q s HIS 81 Ca 0.34 -0.50 -0.14 0.00 0.47 0.00 0.00 55.06 55.23 1v1q s HIS 81 Cb 0.05 -0.71 0.12 0.00 -0.13 0.00 0.00 32.58 31.91 1v1q s HIS 81 CO 0.17 0.09 1.78 1.57 -2.47 0.00 0.00 174.74 175.88 1v1q h LYS 82 N 3.99 0.46 -0.14 2.88 2.10 -1.89 -3.36 116.57 120.60 1v1q h LYS 82 Ca -0.41 -0.03 -0.06 0.00 -2.00 0.00 0.00 60.65 58.16 1v1q h LYS 82 Cb 1.19 -0.10 -0.02 0.00 -0.90 0.00 0.00 32.23 32.39 1v1q h LYS 82 CO 0.44 0.30 -0.06 0.00 -2.00 0.00 0.00 179.45 178.14 1v1q n ALA 83 N -2.32 -0.05 -2.17 0.07 0.00 -1.26 -1.75 120.51 113.04 1v1q n ALA 83 Ca 0.04 0.05 -0.18 0.00 0.00 0.00 0.00 53.44 53.34 1v1q n ALA 83 Cb 0.13 -1.56 -0.03 0.00 0.00 0.00 0.00 19.45 17.98 1v1q n ALA 83 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1v1q n LYS 84 N 0.47 -1.72 -3.78 0.00 5.02 -1.26 -4.92 118.16 111.96 1v1q n LYS 84 Ca -0.03 0.95 -0.10 0.00 -2.02 0.00 0.00 58.31 57.11 1v1q n LYS 84 Cb 0.52 -5.52 -0.07 0.00 -0.02 0.00 0.00 35.03 29.95 1v1q n LYS 84 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1v1q s ASN 85 N -2.19 -0.02 -0.97 4.39 3.84 -0.72 -5.06 114.94 114.21 1v1q s ASN 85 Ca 0.00 -0.46 -0.24 0.00 0.21 0.00 0.00 52.86 52.36 1v1q s ASN 85 Cb 0.00 0.37 -0.17 0.00 -0.55 0.00 0.00 41.25 40.90 1v1q s ASN 85 CO 0.00 -0.72 1.94 0.61 -2.79 0.00 0.00 177.10 176.14 1v1q n GLY 86 N 0.09 0.86 2.52 1.21 0.00 -1.26 -4.06 105.19 104.55 1v1q n GLY 86 Ca -0.16 -0.62 -0.01 0.00 0.00 0.00 0.00 46.02 45.23 1v1q n GLY 86 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1v1q n LEU 87 N 14.10 -7.00 -0.03 0.99 -0.00 -1.26 -5.03 117.00 118.77 1v1q n LEU 87 Ca 0.45 1.09 -0.05 0.00 -0.00 0.00 0.00 56.01 57.49 1v1q n LEU 87 Cb 0.45 -2.96 -0.02 0.00 -0.00 0.00 0.00 43.42 40.89 1v1q n LEU 87 CO 0.77 -2.58 -0.68 -0.24 -0.00 0.00 0.00 177.39 174.66 1v1q n SER 88 N 0.45 0.99 -4.41 1.96 2.88 -1.26 -4.93 113.62 109.30 1v1q n SER 88 Ca 0.01 0.05 -0.44 0.00 -1.33 0.00 0.00 58.87 57.16 1v1q n SER 88 Cb 0.06 -0.14 -0.03 0.00 -0.75 0.00 0.00 64.21 63.34 1v1q n SER 88 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1v1q s LYS 89 N -2.10 3.35 -0.01 -1.46 1.02 -1.26 -5.01 119.74 114.26 1v1q s LYS 89 Ca -0.07 -1.54 0.03 0.00 0.02 0.00 0.00 55.97 54.41 1v1q s LYS 89 Cb 0.03 -4.54 -0.03 0.00 -0.52 0.00 0.00 37.83 32.77 1v1q s LYS 89 CO 0.10 -1.66 -0.08 0.00 -0.92 0.00 0.00 175.35 172.79 1v1q s MET 90 N 2.65 2.57 -0.05 1.68 0.23 -1.26 -0.79 119.30 124.32 1v1q s MET 90 Ca 0.23 -0.70 -0.04 0.00 -1.03 0.00 0.00 55.69 54.16 1v1q s MET 90 Cb -0.13 -2.50 0.02 0.00 -1.53 0.00 0.00 34.83 30.69 1v1q s MET 90 CO -0.01 0.61 0.12 0.08 -2.03 0.00 0.00 175.02 173.79 1v1q s VAL 91 N -0.93 -0.01 -0.40 5.16 1.01 -0.27 -4.39 120.40 120.57 1v1q s VAL 91 Ca 0.15 0.04 -0.16 0.00 0.00 0.00 0.00 61.98 62.02 1v1q s VAL 91 Cb -0.11 -0.18 0.01 0.00 0.00 0.00 0.00 36.38 36.10 1v1q s VAL 91 CO 0.06 0.02 0.38 -0.22 0.00 0.00 0.00 175.10 175.33 1v1q s LEU 92 N 0.31 4.82 -0.69 3.92 2.96 -0.63 -1.76 118.68 127.61 1v1q s LEU 92 Ca -0.02 -0.63 -0.26 0.00 -0.22 0.00 0.00 54.13 53.01 1v1q s LEU 92 Cb -0.03 -2.31 0.04 0.00 0.50 0.00 0.00 46.19 44.39 1v1q s LEU 92 CO -0.01 -0.49 1.16 -1.00 -1.32 0.00 0.00 176.35 174.70 1v1q s HIS 93 N 1.99 2.45 0.18 5.38 3.76 0.11 -1.86 115.29 127.29 1v1q s HIS 93 Ca 0.10 -0.14 -0.30 0.00 -0.15 0.00 0.00 55.06 54.56 1v1q s HIS 93 Cb -0.17 -4.49 -0.08 0.00 1.11 0.00 0.00 32.58 28.94 1v1q s HIS 93 CO 0.12 -1.87 1.30 0.00 -0.85 0.00 0.00 174.74 173.44 1v1q s ALA 94 N 5.10 3.52 -0.03 -1.40 0.00 -0.22 -1.99 121.76 126.74 1v1q s ALA 94 Ca 0.32 1.08 0.06 0.00 0.00 0.00 0.00 51.96 53.42 1v1q s ALA 94 Cb -0.11 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.44 1v1q s ALA 94 CO 0.15 -0.53 0.10 0.39 0.00 0.00 0.00 175.76 175.87 1v1q n GLU 95 N 2.85 1.28 -3.76 0.00 1.02 0.74 -4.62 120.64 118.16 1v1q n GLU 95 Ca 0.07 -0.04 -0.13 0.00 -0.02 0.00 0.00 57.16 57.04 1v1q n GLU 95 Cb 0.43 -1.16 -0.10 0.00 -0.02 0.00 0.00 31.44 30.59 1v1q n GLU 95 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1v1q s GLN 96 N -2.35 0.44 -0.04 3.49 -0.21 -0.84 -5.02 119.66 115.14 1v1q s GLN 96 Ca -0.03 0.37 0.02 0.00 0.02 0.00 0.00 55.36 55.75 1v1q s GLN 96 Cb 0.03 0.21 0.01 0.00 1.00 0.00 0.00 33.01 34.26 1v1q s GLN 96 CO 0.27 -0.07 -0.09 0.42 -2.12 0.00 0.00 175.29 173.71 1v1q s ILE 97 N -0.05 0.81 -0.07 1.08 1.01 -1.26 -1.29 121.20 121.42 1v1q s ILE 97 Ca -0.02 -0.33 0.04 0.00 0.00 0.00 0.00 60.65 60.34 1v1q s ILE 97 Cb -0.03 -0.74 -0.00 0.00 0.01 0.00 0.00 42.46 41.69 1v1q s ILE 97 CO 0.01 0.27 -0.21 -0.70 0.00 0.00 0.00 174.94 174.31 1v1q s GLU 98 N 0.46 2.40 -0.50 2.79 2.12 -0.50 -4.96 118.70 120.51 1v1q s GLU 98 Ca -0.08 -0.76 -0.19 0.00 0.36 0.00 0.00 54.97 54.30 1v1q s GLU 98 Cb -0.12 -1.95 0.06 0.00 0.26 0.00 0.00 34.13 32.38 1v1q s GLU 98 CO 0.01 0.24 0.61 -0.51 -0.54 0.00 0.00 175.26 175.07 1v1q s LEU 99 N 0.15 4.96 0.60 2.70 1.43 -1.26 -0.71 118.68 126.55 1v1q s LEU 99 Ca -0.10 -0.89 0.32 0.00 -1.03 0.00 0.00 54.13 52.43 1v1q s LEU 99 Cb -0.15 -2.45 1.88 0.00 0.03 0.00 0.00 46.19 45.50 1v1q s LEU 99 CO 0.05 -0.87 2.25 0.16 0.23 0.00 0.00 176.35 178.17 1v1q h ILE 100 N 5.85 0.44 -0.48 -0.59 3.07 -1.87 -1.81 117.51 122.12 1v1q h ILE 100 Ca -0.27 -0.07 0.00 0.00 1.55 0.00 0.00 64.86 66.06 1v1q h ILE 100 Cb 1.10 1.05 0.00 0.00 -0.27 0.00 0.00 36.82 38.69 1v1q h ILE 100 CO 0.95 0.01 0.00 0.47 -1.05 0.00 0.00 178.15 178.54 1v1q n ASP 101 N -3.69 4.41 -4.31 2.16 8.00 -1.26 -4.92 116.55 116.94 1v1q n ASP 101 Ca -0.03 -2.58 -0.21 0.00 0.71 0.00 0.00 54.79 52.68 1v1q n ASP 101 Cb 0.10 -0.60 -0.10 0.00 -0.02 0.00 0.00 41.12 40.51 1v1q n ASP 101 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1v1q s SER 102 N -0.69 2.11 -0.38 -2.24 0.01 -0.68 -5.07 113.70 106.76 1v1q s SER 102 Ca 0.42 -1.46 0.06 0.00 1.31 0.00 0.00 55.95 56.28 1v1q s SER 102 Cb 0.30 0.14 0.44 0.00 0.21 0.00 0.00 66.02 67.11 1v1q s SER 102 CO 0.15 -0.73 1.21 1.33 0.41 0.00 0.00 173.24 175.62 1v1q n VAL 103 N -0.67 2.54 0.00 3.43 0.24 -1.26 -4.90 118.33 117.70 1v1q n VAL 103 Ca -0.02 -4.45 0.00 0.00 -2.04 0.00 0.00 64.34 57.82 1v1q n VAL 103 Cb 0.66 -1.19 0.00 0.00 -1.47 0.00 0.00 33.84 31.84 1v1q n VAL 103 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1v1q n ASP 104 N -0.62 0.00 -4.55 -1.34 -0.08 -1.26 -4.97 116.55 103.73 1v1q n ASP 104 Ca 0.43 0.00 -0.41 0.00 -1.51 0.00 0.00 54.79 53.30 1v1q n ASP 104 Cb 0.82 -0.18 -0.08 0.00 2.34 0.00 0.00 41.12 44.02 1v1q n ASP 104 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1v1q s LYS 105 N 0.00 3.59 -1.33 -0.67 3.01 -1.26 -4.94 119.74 118.13 1v1q s LYS 105 Ca 0.00 -0.21 -0.10 0.00 -1.01 0.00 0.00 55.97 54.65 1v1q s LYS 105 Cb 0.00 -3.81 0.13 0.00 -1.01 0.00 0.00 37.83 33.13 1v1q s LYS 105 CO 0.00 -0.64 2.07 1.28 0.51 0.00 0.00 175.35 178.57 1v1q n LEU 106 N 5.70 7.02 0.00 3.17 4.32 -1.26 -5.07 117.00 130.88 1v1q n LEU 106 Ca -0.05 -4.59 0.00 0.00 -0.02 0.00 0.00 56.01 51.35 1v1q n LEU 106 Cb 0.49 -1.49 0.00 0.00 -1.62 0.00 0.00 43.42 40.80 1v1q n LEU 106 CO 0.45 1.48 0.00 0.00 -1.22 0.00 0.00 177.39 178.09