#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v1q n ARG -6 N 0.00 0.35 -1.95 1.61 1.85 -1.26 -4.99 116.66 112.27 1v1q n ARG -6 Ca 0.00 0.19 -0.32 0.00 -1.00 0.00 0.00 57.85 56.72 1v1q n ARG -6 Cb 0.00 -2.36 0.02 0.00 -1.05 0.00 0.00 32.46 29.07 1v1q n ARG -6 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1v1q s ASP -5 N -1.90 5.79 0.59 2.89 -0.00 -1.26 -5.02 116.67 117.77 1v1q s ASP -5 Ca 0.74 1.71 -0.17 0.00 -0.00 0.00 0.00 52.55 54.83 1v1q s ASP -5 Cb -0.31 -2.52 -0.04 0.00 -0.00 0.00 0.00 42.92 40.06 1v1q s ASP -5 CO 0.50 -1.16 1.08 -2.16 -0.00 0.00 0.00 175.17 173.43 1v1q s PRO -4 N -4.40 3.25 0.52 8.23 0.04 -1.26 -4.92 135.00 136.46 1v1q s PRO -4 Ca 0.61 1.33 0.19 0.00 0.04 0.00 0.00 61.00 63.17 1v1q s PRO -4 Cb -0.14 -2.01 1.30 0.00 0.04 0.00 0.00 34.50 33.68 1v1q s PRO -4 CO 0.42 -0.89 2.10 -0.91 0.04 0.00 0.00 177.00 177.76 1v1q h ASN -3 N 0.58 0.02 0.26 6.66 2.35 -2.02 -1.76 115.58 121.66 1v1q h ASN -3 Ca -0.48 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 1v1q h ASN -3 Cb 1.23 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.60 1v1q h ASN -3 CO 0.57 0.01 0.00 0.28 -1.65 0.00 0.00 177.43 176.64 1v1q h SER -2 N 0.02 0.00 0.33 5.81 0.02 -2.03 -1.02 113.55 116.68 1v1q h SER -2 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1v1q h SER -2 Cb 0.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1v1q h SER -2 CO -0.00 0.00 -0.37 -0.11 -1.14 0.00 0.00 176.83 175.21 1v1q n LEU -1 N -2.65 0.83 0.12 5.07 7.94 -0.66 -4.15 117.00 123.50 1v1q n LEU -1 Ca -0.01 -0.17 0.12 0.00 -1.11 0.00 0.00 56.01 54.84 1v1q n LEU -1 Cb 0.11 -0.17 0.21 0.00 0.53 0.00 0.00 43.42 44.11 1v1q n LEU -1 CO 0.17 0.17 0.56 0.24 -1.11 0.00 0.00 177.39 177.42 1v1q h MET 1 N 0.72 0.00 -6.07 1.96 2.86 -1.31 -3.48 114.93 109.61 1v1q h MET 1 Ca 0.00 0.00 -0.78 0.00 -2.06 0.00 0.00 59.70 56.86 1v1q h MET 1 Cb 0.51 0.00 0.04 0.00 0.06 0.00 0.00 31.60 32.21 1v1q h MET 1 CO 0.00 0.00 0.33 2.41 1.06 0.00 0.00 176.91 180.71 1v1q n THR 2 N -2.48 0.02 -3.13 2.22 -1.04 -1.26 -4.95 114.28 103.67 1v1q n THR 2 Ca 0.04 -0.00 0.02 0.00 -2.04 0.00 0.00 64.05 62.07 1v1q n THR 2 Cb 0.48 -0.37 -0.00 0.00 -1.82 0.00 0.00 70.33 68.61 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 0.93 -1.32 -0.07 8.00 3.84 -1.26 -5.13 114.94 119.92 1v1q s ASN 3 Ca 0.93 -0.34 -0.03 0.00 0.21 0.00 0.00 52.86 53.62 1v1q s ASN 3 Cb -1.22 1.74 0.04 0.00 -0.55 0.00 0.00 41.25 41.25 1v1q s ASN 3 CO 0.60 -0.18 0.15 -0.60 -2.79 0.00 0.00 177.10 174.28 1v1q s ARG 4 N 2.25 0.07 -0.03 0.43 3.52 -1.26 -4.38 118.95 119.56 1v1q s ARG 4 Ca 0.15 0.44 0.02 0.00 -0.13 0.00 0.00 55.73 56.21 1v1q s ARG 4 Cb -0.05 -0.21 0.01 0.00 -1.56 0.00 0.00 34.95 33.14 1v1q s ARG 4 CO -0.15 -0.21 -0.07 -1.17 -0.81 0.00 0.00 175.30 172.88 1v1q s LEU 5 N 1.55 1.69 -0.12 -0.88 2.96 0.12 -4.99 118.68 119.01 1v1q s LEU 5 Ca -0.05 -0.16 0.01 0.00 -0.22 0.00 0.00 54.13 53.70 1v1q s LEU 5 Cb -0.12 -0.49 0.02 0.00 0.50 0.00 0.00 46.19 46.10 1v1q s LEU 5 CO -0.06 0.03 -0.13 0.54 -1.32 0.00 0.00 176.35 175.42 1v1q s VAL 6 N 0.35 1.40 -0.01 1.68 0.11 -1.26 -0.69 120.40 121.97 1v1q s VAL 6 Ca -0.05 -0.54 0.00 0.00 -2.93 0.00 0.00 61.98 58.46 1v1q s VAL 6 Cb -0.09 -1.32 0.01 0.00 -1.53 0.00 0.00 36.38 33.45 1v1q s VAL 6 CO 0.00 0.43 0.00 -0.22 -3.33 0.00 0.00 175.10 171.98 1v1q s LEU 7 N 1.35 1.58 0.20 2.54 2.96 0.24 -4.99 118.68 122.57 1v1q s LEU 7 Ca 0.01 -0.01 0.06 0.00 -0.22 0.00 0.00 54.13 53.97 1v1q s LEU 7 Cb -0.13 -0.10 -0.04 0.00 0.50 0.00 0.00 46.19 46.42 1v1q s LEU 7 CO -0.07 -0.05 0.17 -0.44 -1.32 0.00 0.00 176.35 174.65 1v1q s SER 8 N 0.48 5.59 0.00 3.68 0.01 -1.26 -0.54 113.70 121.66 1v1q s SER 8 Ca -0.04 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.07 1v1q s SER 8 Cb -0.07 -1.47 0.00 0.00 0.21 0.00 0.00 66.02 64.70 1v1q s SER 8 CO -0.01 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.27 1v1q n GLY 9 N -0.69 -1.26 3.30 3.44 0.00 -0.33 -4.46 105.19 105.19 1v1q n GLY 9 Ca -0.08 -0.92 -0.32 0.00 0.00 0.00 0.00 46.02 44.69 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 2.57 -0.40 2.61 2.01 -0.44 -1.49 115.64 117.50 1v1q s THR 10 Ca 0.00 -0.84 -0.28 0.00 0.31 0.00 0.00 61.69 60.88 1v1q s THR 10 Cb 0.00 -2.03 -0.00 0.00 0.01 0.00 0.00 72.50 70.47 1v1q s THR 10 CO 0.00 0.54 1.62 -0.69 -0.69 0.00 0.00 174.62 175.41 1v1q s VAL 11 N 0.27 3.66 -0.51 3.82 1.01 -0.41 -0.43 120.40 127.81 1v1q s VAL 11 Ca -0.13 0.64 0.23 0.00 0.00 0.00 0.00 61.98 62.72 1v1q s VAL 11 Cb -0.16 -3.95 -0.12 0.00 0.00 0.00 0.00 36.38 32.15 1v1q s VAL 11 CO 0.07 -0.65 0.98 0.00 0.00 0.00 0.00 175.10 175.50 1v1q s ARG 13 N -3.25 2.74 0.14 0.00 6.06 -1.23 -4.92 118.95 118.50 1v1q s ARG 13 Ca 0.02 -1.03 -0.34 0.00 -2.50 0.00 0.00 55.73 51.88 1v1q s ARG 13 Cb 0.14 -2.88 -0.15 0.00 0.06 0.00 0.00 34.95 32.12 1v1q s ARG 13 CO 0.81 -0.40 1.49 0.00 -2.50 0.00 0.00 175.30 174.70 1v1q n ALA 14 N 4.61 0.61 -1.66 6.12 0.00 -1.26 -3.79 120.51 125.15 1v1q n ALA 14 Ca -0.17 0.47 -0.45 0.00 0.00 0.00 0.00 53.44 53.29 1v1q n ALA 14 Cb 0.47 -2.26 -0.02 0.00 0.00 0.00 0.00 19.45 17.64 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 3.02 1.86 -4.88 0.00 -0.02 -1.26 -4.80 135.00 128.92 1v1q n PRO 15 Ca 0.17 0.66 -0.30 0.00 -2.02 0.00 0.00 63.50 62.00 1v1q n PRO 15 Cb 0.26 -2.23 -0.17 0.00 -0.02 0.00 0.00 33.50 31.34 1v1q n PRO 15 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1v1q s LEU 16 N -0.08 1.96 0.12 2.45 0.20 0.82 -4.93 118.68 119.22 1v1q s LEU 16 Ca 0.64 -0.50 0.07 0.00 0.69 0.00 0.00 54.13 55.03 1v1q s LEU 16 Cb -0.66 -1.27 -0.04 0.00 -0.43 0.00 0.00 46.19 43.79 1v1q s LEU 16 CO 0.55 0.10 -0.10 -0.13 -0.29 0.00 0.00 176.35 176.48 1v1q s ARG 17 N 0.60 2.12 0.14 1.98 0.52 -1.26 -0.46 118.95 122.58 1v1q s ARG 17 Ca -0.14 -1.06 -0.25 0.00 -0.52 0.00 0.00 55.73 53.77 1v1q s ARG 17 Cb -0.17 -2.29 0.07 0.00 0.52 0.00 0.00 34.95 33.08 1v1q s ARG 17 CO 0.04 0.50 0.83 -1.59 0.02 0.00 0.00 175.30 175.10 1v1q s LYS 18 N -2.30 1.23 -0.15 3.54 0.00 -0.27 -5.01 119.74 116.77 1v1q s LYS 18 Ca 0.22 -0.60 0.01 0.00 0.00 0.00 0.00 55.97 55.61 1v1q s LYS 18 Cb -0.11 0.47 0.00 0.00 0.00 0.00 0.00 37.83 38.20 1v1q s LYS 18 CO 0.14 -0.55 -0.19 0.08 0.00 0.00 0.00 175.35 174.83 1v1q s VAL 19 N -3.45 2.35 0.78 1.79 1.01 -1.26 -0.20 120.40 121.42 1v1q s VAL 19 Ca 0.08 -0.88 -0.13 0.00 0.00 0.00 0.00 61.98 61.05 1v1q s VAL 19 Cb -0.02 -1.97 0.07 0.00 0.00 0.00 0.00 36.38 34.46 1v1q s VAL 19 CO -0.03 0.53 1.15 -0.94 0.00 0.00 0.00 175.10 175.82 1v1q s SER 20 N 0.82 4.02 0.65 3.32 1.04 -0.22 -4.85 113.70 118.48 1v1q s SER 20 Ca -0.06 2.14 0.33 0.00 0.48 0.00 0.00 55.95 58.84 1v1q s SER 20 Cb -0.15 -2.56 1.82 0.00 0.10 0.00 0.00 66.02 65.22 1v1q s SER 20 CO -0.01 -2.37 2.05 -0.65 0.98 0.00 0.00 173.24 173.24 1v1q h PRO 21 N -0.89 0.00 -0.19 4.02 0.11 -2.00 0.38 132.00 133.43 1v1q h PRO 21 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1v1q h PRO 21 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1v1q h PRO 21 CO 0.48 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.14 1v1q n SER 22 N -3.09 2.06 0.00 -2.05 3.41 -1.26 -4.94 113.62 107.75 1v1q n SER 22 Ca -0.01 -1.76 0.00 0.00 -0.26 0.00 0.00 58.87 56.84 1v1q n SER 22 Cb 0.32 -0.12 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 1.22 0.85 3.63 5.00 0.00 0.12 -5.07 105.19 110.94 1v1q n GLY 23 Ca 0.17 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 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 5.23 0.21 -0.61 -1.09 -1.25 -4.85 121.20 116.83 1v1q s ILE 24 Ca 0.00 0.49 -0.30 0.00 -2.23 0.00 0.00 60.65 58.61 1v1q s ILE 24 Cb 0.00 -3.65 -0.08 0.00 -1.58 0.00 0.00 42.46 37.15 1v1q s ILE 24 CO 0.00 0.23 1.00 -2.16 -1.23 0.00 0.00 174.94 172.78 1v1q s PRO 25 N 1.63 4.75 -0.00 2.79 0.04 -1.26 -1.06 135.00 141.89 1v1q s PRO 25 Ca 0.14 1.57 0.04 0.00 0.04 0.00 0.00 61.00 62.79 1v1q s PRO 25 Cb -0.15 -3.29 -0.01 0.00 0.04 0.00 0.00 34.50 31.09 1v1q s PRO 25 CO 0.08 0.33 -0.12 -1.01 0.04 0.00 0.00 177.00 176.33 1v1q s HIS 26 N -0.77 1.07 -0.10 0.56 3.76 0.72 -2.23 115.29 118.30 1v1q s HIS 26 Ca 0.44 -0.22 -0.00 0.00 -0.15 0.00 0.00 55.06 55.13 1v1q s HIS 26 Cb -0.27 -0.68 0.02 0.00 1.11 0.00 0.00 32.58 32.76 1v1q s HIS 26 CO 0.33 -0.01 -0.07 0.00 -0.85 0.00 0.00 174.74 174.15 1v1q s GLN 28 N 1.66 1.53 0.30 0.00 -0.21 0.39 -1.18 119.66 122.15 1v1q s GLN 28 Ca 0.03 -1.00 -0.19 0.00 0.02 0.00 0.00 55.36 54.22 1v1q s GLN 28 Cb -0.13 -1.67 0.04 0.00 1.00 0.00 0.00 33.01 32.26 1v1q s GLN 28 CO -0.07 0.43 0.80 -0.59 -2.12 0.00 0.00 175.29 173.74 1v1q s PHE 29 N -0.80 -0.03 -0.09 0.91 -0.71 -0.75 -0.13 117.98 116.38 1v1q s PHE 29 Ca 0.09 -0.50 0.03 0.00 -1.04 0.00 0.00 56.93 55.51 1v1q s PHE 29 Cb -0.09 0.76 -0.02 0.00 -1.21 0.00 0.00 43.02 42.46 1v1q s PHE 29 CO 0.02 -1.31 -0.18 0.08 -1.34 0.00 0.00 175.22 172.49 1v1q s VAL 30 N -3.03 2.69 -0.26 -2.49 1.01 -1.25 0.32 120.40 117.39 1v1q s VAL 30 Ca 0.14 -0.82 -0.06 0.00 0.00 0.00 0.00 61.98 61.24 1v1q s VAL 30 Cb -0.05 -2.06 -0.00 0.00 0.00 0.00 0.00 36.38 34.27 1v1q s VAL 30 CO 0.08 0.56 0.04 -0.22 0.00 0.00 0.00 175.10 175.56 1v1q s LEU 31 N -0.08 3.45 -0.35 3.92 2.96 0.64 -2.31 118.68 126.91 1v1q s LEU 31 Ca -0.04 -0.51 -0.21 0.00 -0.22 0.00 0.00 54.13 53.15 1v1q s LEU 31 Cb -0.14 -1.84 0.00 0.00 0.50 0.00 0.00 46.19 44.71 1v1q s LEU 31 CO 0.04 -0.10 0.68 -0.70 -1.32 0.00 0.00 176.35 174.95 1v1q s GLU 32 N 1.51 3.71 -0.10 1.98 2.12 0.43 -0.11 118.70 128.25 1v1q s GLU 32 Ca 0.04 0.14 -0.03 0.00 0.36 0.00 0.00 54.97 55.49 1v1q s GLU 32 Cb -0.16 -3.80 -0.03 0.00 0.26 0.00 0.00 34.13 30.39 1v1q s GLU 32 CO 0.01 -0.76 0.01 -1.58 -0.54 0.00 0.00 175.26 172.40 1v1q s HIS 33 N 2.81 3.19 -0.05 5.30 5.65 0.29 -1.33 115.29 131.15 1v1q s HIS 33 Ca 0.26 0.19 -0.02 0.00 0.25 0.00 0.00 55.06 55.74 1v1q s HIS 33 Cb -0.14 -1.82 0.04 0.00 -1.18 0.00 0.00 32.58 29.47 1v1q s HIS 33 CO 0.15 0.45 0.09 1.03 -0.65 0.00 0.00 174.74 175.81 1v1q s ARG 34 N -0.77 -0.03 0.06 2.88 0.52 -1.26 -1.40 118.95 118.96 1v1q s ARG 34 Ca 0.12 0.40 -0.07 0.00 -0.52 0.00 0.00 55.73 55.67 1v1q s ARG 34 Cb -0.12 -0.37 -0.01 0.00 0.52 0.00 0.00 34.95 34.97 1v1q s ARG 34 CO 0.02 -0.28 0.13 -1.54 0.02 0.00 0.00 175.30 173.64 1v1q s SER 35 N 1.95 0.19 -0.09 0.23 1.04 0.03 -4.98 113.70 112.06 1v1q s SER 35 Ca 0.01 -0.64 -0.15 0.00 0.48 0.00 0.00 55.95 55.66 1v1q s SER 35 Cb -0.12 0.28 -0.05 0.00 0.10 0.00 0.00 66.02 66.23 1v1q s SER 35 CO -0.04 -0.62 0.37 -0.69 0.98 0.00 0.00 173.24 173.24 1v1q s VAL 36 N -3.33 5.19 0.35 5.02 1.01 -1.26 -0.26 120.40 127.12 1v1q s VAL 36 Ca 0.01 0.74 0.03 0.00 0.00 0.00 0.00 61.98 62.76 1v1q s VAL 36 Cb 0.03 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 1v1q s VAL 36 CO -0.08 0.46 0.11 -1.10 0.00 0.00 0.00 175.10 174.49 1v1q s GLN 37 N -0.15 1.74 -0.02 2.72 -1.52 0.48 -4.90 119.66 118.02 1v1q s GLN 37 Ca 0.21 -2.02 -0.02 0.00 -1.95 0.00 0.00 55.36 51.59 1v1q s GLN 37 Cb -0.15 -0.57 0.00 0.00 -0.22 0.00 0.00 33.01 32.08 1v1q s GLN 37 CO 0.09 -0.37 0.05 -1.83 -0.25 0.00 0.00 175.29 172.98 1v1q s GLU 38 N -3.81 0.06 -0.18 2.91 -1.05 -1.26 -2.21 118.70 113.15 1v1q s GLU 38 Ca 0.31 0.06 -0.11 0.00 -0.15 0.00 0.00 54.97 55.08 1v1q s GLU 38 Cb 0.05 0.03 0.06 0.00 -0.44 0.00 0.00 34.13 33.83 1v1q s GLU 38 CO 0.15 -0.01 0.44 -1.83 0.95 0.00 0.00 175.26 174.97 1v1q s GLU 39 N 0.01 0.45 -1.63 -4.83 -1.05 -0.02 -4.85 118.70 106.78 1v1q s GLU 39 Ca -0.00 0.80 0.00 0.00 -0.15 0.00 0.00 54.97 55.62 1v1q s GLU 39 Cb -0.00 0.04 0.00 0.00 -0.44 0.00 0.00 34.13 33.73 1v1q s GLU 39 CO 0.00 -0.14 0.00 0.00 0.95 0.00 0.00 175.26 176.07 1v1q n ALA 40 N 3.99 -0.40 -0.99 -0.84 0.00 -1.26 -1.15 120.51 119.87 1v1q n ALA 40 Ca -0.21 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1v1q n ALA 40 Cb 0.56 -1.84 0.00 0.00 0.00 0.00 0.00 19.45 18.16 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 -0.95 0.53 3.60 0.00 0.00 -1.26 -5.02 105.19 102.08 1v1q n GLY 41 Ca -0.19 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.22 2.63 0.15 1.61 0.08 -0.30 -5.12 117.98 114.81 1v1q s PHE 42 Ca 0.00 -0.23 -0.02 0.00 0.12 0.00 0.00 56.93 56.80 1v1q s PHE 42 Cb 0.00 -1.21 -0.05 0.00 -0.57 0.00 0.00 43.02 41.20 1v1q s PHE 42 CO 0.00 0.59 0.35 -1.01 -0.10 0.00 0.00 175.22 175.05 1v1q s HIS 43 N -2.10 3.49 -0.03 0.36 3.76 -1.26 -0.84 115.29 118.67 1v1q s HIS 43 Ca 0.29 0.39 -0.30 0.00 -0.15 0.00 0.00 55.06 55.29 1v1q s HIS 43 Cb -0.07 -1.88 0.11 0.00 1.11 0.00 0.00 32.58 31.84 1v1q s HIS 43 CO 0.17 0.44 0.94 -0.98 -0.85 0.00 0.00 174.74 174.46 1v1q s ARG 44 N -2.94 0.75 -0.14 1.40 1.70 -0.94 -4.96 118.95 113.82 1v1q s ARG 44 Ca 0.39 -0.28 -0.07 0.00 -0.47 0.00 0.00 55.73 55.30 1v1q s ARG 44 Cb -0.12 0.34 -0.04 0.00 -0.57 0.00 0.00 34.95 34.56 1v1q s ARG 44 CO 0.27 -0.33 0.11 -1.14 -1.08 0.00 0.00 175.30 173.14 1v1q s GLN 45 N -3.02 3.56 -0.25 3.89 0.74 -1.26 -0.39 119.66 122.93 1v1q s GLN 45 Ca 0.06 -0.20 -0.11 0.00 0.05 0.00 0.00 55.36 55.15 1v1q s GLN 45 Cb -0.01 -3.18 -0.05 0.00 1.10 0.00 0.00 33.01 30.87 1v1q s GLN 45 CO -0.08 0.64 0.19 0.00 -0.55 0.00 0.00 175.29 175.49 1v1q s ALA 46 N -0.63 3.58 0.05 1.58 0.00 0.64 -4.93 121.76 122.04 1v1q s ALA 46 Ca 0.12 -0.94 0.04 0.00 0.00 0.00 0.00 51.96 51.19 1v1q s ALA 46 Cb -0.12 -2.41 -0.02 0.00 0.00 0.00 0.00 23.12 20.57 1v1q s ALA 46 CO 0.02 -0.35 -0.13 -0.46 0.00 0.00 0.00 175.76 174.85 1v1q s TRP 47 N 1.37 1.10 -0.21 0.00 -0.00 -1.26 -0.79 118.94 119.14 1v1q s TRP 47 Ca 0.08 -0.40 -0.28 0.00 -0.00 0.00 0.00 56.10 55.50 1v1q s TRP 47 Cb -0.15 -0.64 0.13 0.00 -0.00 0.00 0.00 33.47 32.82 1v1q s TRP 47 CO 0.07 0.02 1.05 0.00 -0.00 0.00 0.00 176.95 178.10 1v1q s GLN 49 N -0.60 2.10 -0.25 0.00 -0.21 -1.26 0.10 119.66 119.55 1v1q s GLN 49 Ca 0.01 -2.08 -0.21 0.00 0.02 0.00 0.00 55.36 53.09 1v1q s GLN 49 Cb -0.02 -3.57 -0.02 0.00 1.00 0.00 0.00 33.01 30.40 1v1q s GLN 49 CO -0.02 -1.09 0.67 1.41 -2.12 0.00 0.00 175.29 174.14 1v1q s MET 50 N 0.68 4.14 0.05 2.91 -2.45 0.85 -4.83 119.30 120.65 1v1q s MET 50 Ca 0.12 0.65 -0.31 0.00 -1.25 0.00 0.00 55.69 54.90 1v1q s MET 50 Cb -0.22 -3.64 -0.06 0.00 1.25 0.00 0.00 34.83 32.16 1v1q s MET 50 CO -0.04 -0.42 1.38 -2.14 1.05 0.00 0.00 175.02 174.85 1v1q s PRO 51 N 2.52 4.31 0.08 4.11 0.02 -1.26 -0.26 135.00 144.52 1v1q s PRO 51 Ca 0.28 1.99 0.09 0.00 0.02 0.00 0.00 61.00 63.38 1v1q s PRO 51 Cb -0.15 -3.44 -0.04 0.00 0.02 0.00 0.00 34.50 30.89 1v1q s PRO 51 CO 0.08 -0.49 -0.22 0.08 -0.33 0.00 0.00 177.00 176.12 1v1q s VAL 52 N 1.80 2.53 -0.00 3.83 1.01 0.15 -0.87 120.40 128.85 1v1q s VAL 52 Ca 0.64 -1.45 -0.00 0.00 0.00 0.00 0.00 61.98 61.17 1v1q s VAL 52 Cb -0.33 -2.09 0.01 0.00 0.00 0.00 0.00 36.38 33.97 1v1q s VAL 52 CO 0.28 0.23 0.01 -0.51 0.00 0.00 0.00 175.10 175.11 1v1q s ILE 53 N -0.98 -0.01 -0.30 2.22 2.07 -0.76 -1.81 121.20 121.63 1v1q s ILE 53 Ca 0.15 0.04 0.02 0.00 -1.41 0.00 0.00 60.65 59.45 1v1q s ILE 53 Cb -0.10 -0.03 0.07 0.00 0.13 0.00 0.00 42.46 42.53 1v1q s ILE 53 CO 0.06 0.01 -0.03 -0.69 -1.91 0.00 0.00 174.94 172.38 1v1q s VAL 54 N 0.18 2.36 0.12 4.00 1.01 -0.32 -1.01 120.40 126.74 1v1q s VAL 54 Ca -0.01 -1.85 0.05 0.00 0.00 0.00 0.00 61.98 60.16 1v1q s VAL 54 Cb -0.02 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 1v1q s VAL 54 CO -0.00 -0.25 0.07 -0.44 0.00 0.00 0.00 175.10 174.48 1v1q s SER 55 N 1.09 5.32 0.00 3.32 0.01 -1.26 -1.94 113.70 120.25 1v1q s SER 55 Ca -0.01 -0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.11 1v1q s SER 55 Cb -0.20 -1.35 0.00 0.00 0.21 0.00 0.00 66.02 64.68 1v1q s SER 55 CO -0.05 0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.33 1v1q n GLY 56 N 0.11 0.61 0.19 3.44 0.00 -0.95 -4.63 105.19 103.96 1v1q n GLY 56 Ca -0.09 -1.64 -0.13 0.00 0.00 0.00 0.00 46.02 44.16 1v1q n GLY 56 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1v1q h HIS 57 N 0.00 0.68 -1.14 1.61 3.86 -1.95 -3.30 115.15 114.92 1v1q h HIS 57 Ca 0.00 -0.19 0.35 0.00 -1.16 0.00 0.00 60.37 59.37 1v1q h HIS 57 Cb 0.00 -0.15 -0.12 0.00 1.06 0.00 0.00 27.41 28.20 1v1q h HIS 57 CO 0.00 0.87 0.71 1.49 0.86 0.00 0.00 177.93 181.86 1v1q h GLU 58 N 0.30 0.25 -0.14 2.45 4.57 -1.99 -2.35 114.58 117.66 1v1q h GLU 58 Ca 0.05 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1v1q h GLU 58 Cb 0.72 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.26 1v1q h GLU 58 CO 0.05 0.16 0.00 0.27 -1.18 0.00 0.00 179.01 178.31 1v1q n ASN 59 N -4.77 3.06 0.06 1.04 2.04 -1.24 -4.69 115.26 110.76 1v1q n ASN 59 Ca 0.32 -2.89 -0.07 0.00 -0.44 0.00 0.00 54.58 51.50 1v1q n ASN 59 Cb 1.12 -0.43 0.09 0.00 -2.53 0.00 0.00 39.78 38.03 1v1q n ASN 59 CO 0.00 0.00 0.00 1.56 -0.44 0.00 0.00 177.26 178.38 1v1q h GLN 60 N 0.97 0.32 -0.42 -3.83 1.08 -1.49 -3.31 115.11 108.43 1v1q h GLN 60 Ca 0.00 -0.23 0.06 0.00 -1.45 0.00 0.00 58.65 57.04 1v1q h GLN 60 Cb 1.14 0.04 -0.05 0.00 -0.05 0.00 0.00 27.48 28.55 1v1q h GLN 60 CO 0.10 0.84 0.11 0.00 -0.95 0.00 0.00 178.83 178.93 1v1q h ALA 61 N 1.11 0.48 0.00 3.87 0.00 -1.84 -2.92 119.26 119.96 1v1q h ALA 61 Ca -0.01 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1v1q h ALA 61 Cb 1.14 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1v1q h ALA 61 CO 0.10 -0.29 0.00 0.44 0.00 0.00 0.00 179.25 179.50 1v1q n ILE 62 N -5.07 0.38 0.00 0.00 -5.35 -1.25 -3.40 119.36 104.68 1v1q n ILE 62 Ca 0.03 -0.05 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 1v1q n ILE 62 Cb 0.18 -0.81 0.00 0.00 -1.74 0.00 0.00 39.64 37.27 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 1.20 0.00 0.00 7.28 -2.24 -1.10 -4.87 114.28 114.55 1v1q n THR 63 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1v1q n THR 63 Cb 0.14 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 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 -1.52 0.00 -1.01 4.78 8.25 -1.22 -0.83 115.22 123.67 1v1q n HIS 64 Ca 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.52 1v1q n HIS 64 Cb 0.15 -0.13 0.30 0.00 1.12 0.00 0.00 29.99 31.43 1v1q n HIS 64 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1v1q n SER 65 N -1.07 4.38 -4.25 0.41 7.64 -1.26 -4.96 113.62 114.52 1v1q n SER 65 Ca 0.00 -3.08 -0.31 0.00 1.01 0.00 0.00 58.87 56.49 1v1q n SER 65 Cb 0.02 -0.61 -0.17 0.00 -1.01 0.00 0.00 64.21 62.45 1v1q n SER 65 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1v1q s ILE 66 N -2.87 1.99 0.00 0.44 1.01 -0.01 -5.08 121.20 116.67 1v1q s ILE 66 Ca 0.47 -1.02 0.00 0.00 0.00 0.00 0.00 60.65 60.10 1v1q s ILE 66 Cb 0.38 -1.69 0.00 0.00 0.01 0.00 0.00 42.46 41.16 1v1q s ILE 66 CO 0.11 0.55 0.00 0.35 0.00 0.00 0.00 174.94 175.95 1v1q n THR 67 N 3.06 0.00 -2.19 2.92 -2.24 -1.26 -4.66 114.28 109.91 1v1q n THR 67 Ca -0.18 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.23 1v1q n THR 67 Cb 0.52 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.75 1v1q n THR 67 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1v1q s VAL 68 N -2.08 2.94 0.00 2.28 1.01 -1.26 -2.53 120.40 120.76 1v1q s VAL 68 Ca 0.00 0.73 0.00 0.00 0.00 0.00 0.00 61.98 62.71 1v1q s VAL 68 Cb 0.00 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 33.00 1v1q s VAL 68 CO 0.00 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.72 1v1q n GLY 69 N 0.53 2.15 3.70 4.51 0.00 0.26 -4.97 105.19 111.38 1v1q n GLY 69 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.78 6.83 -0.24 1.61 0.01 -1.05 -4.76 113.70 113.33 1v1q s SER 70 Ca 0.00 2.25 -0.17 0.00 1.31 0.00 0.00 55.95 59.34 1v1q s SER 70 Cb 0.00 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.62 1v1q s SER 70 CO 0.00 -0.68 0.45 -0.13 0.41 0.00 0.00 173.24 173.29 1v1q s ARG 71 N 1.65 4.10 0.21 12.44 0.52 -1.26 -1.29 118.95 135.32 1v1q s ARG 71 Ca 0.65 0.24 -0.05 0.00 -0.52 0.00 0.00 55.73 56.05 1v1q s ARG 71 Cb -0.35 -3.61 -0.03 0.00 0.52 0.00 0.00 34.95 31.48 1v1q s ARG 71 CO 0.29 -0.23 0.23 0.96 0.02 0.00 0.00 175.30 176.57 1v1q s ILE 72 N 1.91 0.01 -0.13 1.52 -4.36 -0.56 -1.92 121.20 117.68 1v1q s ILE 72 Ca 0.20 -1.80 0.00 0.00 -0.26 0.00 0.00 60.65 58.78 1v1q s ILE 72 Cb -0.15 -2.36 0.02 0.00 1.25 0.00 0.00 42.46 41.22 1v1q s ILE 72 CO 0.09 -0.04 -0.12 -0.89 0.24 0.00 0.00 174.94 174.22 1v1q s THR 73 N -4.11 1.34 -0.09 8.37 2.01 -0.53 -1.19 115.64 121.44 1v1q s THR 73 Ca 0.33 -0.50 -0.00 0.00 0.31 0.00 0.00 61.69 61.83 1v1q s THR 73 Cb 0.05 -1.28 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 1v1q s THR 73 CO 0.10 0.42 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.69 1v1q s VAL 74 N 1.47 3.68 -0.03 3.82 1.01 0.30 -0.75 120.40 129.91 1v1q s VAL 74 Ca 0.03 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.57 1v1q s VAL 74 Cb -0.13 -2.53 -0.00 0.00 0.00 0.00 0.00 36.38 33.72 1v1q s VAL 74 CO -0.08 0.57 -0.12 -1.58 0.00 0.00 0.00 175.10 173.89 1v1q s GLN 75 N -0.49 1.18 0.00 2.72 0.74 -0.33 -0.59 119.66 122.90 1v1q s GLN 75 Ca 0.07 -0.42 0.00 0.00 0.05 0.00 0.00 55.36 55.06 1v1q s GLN 75 Cb -0.12 -1.09 0.00 0.00 1.10 0.00 0.00 33.01 32.90 1v1q s GLN 75 CO 0.02 0.19 0.00 0.41 -0.55 0.00 0.00 175.29 175.36 1v1q n GLY 76 N 3.11 -0.72 3.45 2.59 0.00 0.13 -1.05 105.19 112.70 1v1q n GLY 76 Ca -0.17 -0.41 -0.27 0.00 0.00 0.00 0.00 46.02 45.16 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 -3.91 2.39 0.08 1.61 -0.71 -0.90 0.14 117.98 116.67 1v1q s PHE 77 Ca 0.00 -0.33 0.01 0.00 -1.04 0.00 0.00 56.93 55.57 1v1q s PHE 77 Cb 0.00 -1.21 -0.04 0.00 -1.21 0.00 0.00 43.02 40.56 1v1q s PHE 77 CO 0.00 0.46 0.20 0.96 -1.34 0.00 0.00 175.22 175.50 1v1q s ILE 78 N -1.52 5.24 -0.05 -4.49 -4.36 -1.26 -0.21 121.20 114.55 1v1q s ILE 78 Ca 0.20 -0.50 -0.05 0.00 -0.26 0.00 0.00 60.65 60.04 1v1q s ILE 78 Cb -0.09 -3.57 0.02 0.00 1.25 0.00 0.00 42.46 40.06 1v1q s ILE 78 CO 0.10 0.10 0.14 -0.55 0.24 0.00 0.00 174.94 174.97 1v1q s SER 79 N -2.61 -0.15 -0.26 4.36 0.15 -0.37 -4.95 113.70 109.88 1v1q s SER 79 Ca 0.34 0.29 0.16 0.00 0.70 0.00 0.00 55.95 57.44 1v1q s SER 79 Cb -0.13 0.28 0.48 0.00 -1.71 0.00 0.00 66.02 64.95 1v1q s SER 79 CO 0.27 -0.06 1.15 0.00 1.20 0.00 0.00 173.24 175.80 1v1q n HIS 81 N -0.62 0.28 0.55 0.00 8.25 -1.26 -4.47 115.22 117.96 1v1q n HIS 81 Ca 0.22 0.36 0.04 0.00 -0.26 0.00 0.00 57.72 58.09 1v1q n HIS 81 Cb 0.88 -2.00 0.16 0.00 1.12 0.00 0.00 29.99 30.15 1v1q n HIS 81 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 1v1q n LYS 82 N -2.36 2.26 0.00 -0.41 2.85 -1.26 -4.51 118.16 114.72 1v1q n LYS 82 Ca 0.11 -1.29 0.00 0.00 -1.05 0.00 0.00 58.31 56.08 1v1q n LYS 82 Cb 0.51 -1.55 0.00 0.00 -0.65 0.00 0.00 35.03 33.34 1v1q n LYS 82 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1v1q n ALA 83 N 0.37 0.00 0.38 0.58 0.00 -1.26 -3.58 120.51 117.01 1v1q n ALA 83 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.37 1v1q n ALA 83 Cb 0.48 0.04 -0.10 0.00 0.00 0.00 0.00 19.45 19.87 1v1q n ALA 83 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1v1q h LYS 84 N 0.00 -1.08 -1.41 0.00 3.64 -1.99 -3.46 116.57 112.26 1v1q h LYS 84 Ca 0.00 0.07 0.12 0.00 -1.27 0.00 0.00 60.65 59.57 1v1q h LYS 84 Cb 0.00 0.25 -0.29 0.00 -0.41 0.00 0.00 32.23 31.78 1v1q h LYS 84 CO 0.00 -0.72 0.56 1.21 -2.27 0.00 0.00 179.45 178.23 1v1q s ASN 85 N -4.11 -0.34 0.08 4.20 3.04 -1.23 -5.13 114.94 111.45 1v1q s ASN 85 Ca -0.18 0.61 0.00 0.00 0.04 0.00 0.00 52.86 53.33 1v1q s ASN 85 Cb 0.03 0.81 0.00 0.00 -1.54 0.00 0.00 41.25 40.55 1v1q s ASN 85 CO 0.58 -0.10 0.00 0.61 -3.04 0.00 0.00 177.10 175.14 1v1q n GLY 86 N 2.55 -4.50 0.14 1.21 0.00 -1.26 -4.45 105.19 98.89 1v1q n GLY 86 Ca -0.14 -0.43 0.11 0.00 0.00 0.00 0.00 46.02 45.56 1v1q n GLY 86 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1v1q n LEU 87 N 0.97 0.56 -1.03 0.99 -0.00 -1.26 -1.20 117.00 116.03 1v1q n LEU 87 Ca 0.00 0.71 0.04 0.00 -0.00 0.00 0.00 56.01 56.76 1v1q n LEU 87 Cb 0.00 -0.72 0.18 0.00 -0.00 0.00 0.00 43.42 42.88 1v1q n LEU 87 CO 0.00 -0.78 0.57 -1.54 -0.00 0.00 0.00 177.39 175.64 1v1q n SER 88 N -2.20 2.89 -4.44 1.45 3.41 -1.26 -4.61 113.62 108.86 1v1q n SER 88 Ca -0.00 -2.33 -0.44 0.00 -0.26 0.00 0.00 58.87 55.84 1v1q n SER 88 Cb 0.10 -0.50 -0.02 0.00 -0.26 0.00 0.00 64.21 63.54 1v1q n SER 88 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1v1q s LYS 89 N -1.76 3.71 -0.15 4.33 2.36 -0.34 -5.00 119.74 122.89 1v1q s LYS 89 Ca 0.25 -2.02 -0.29 0.00 -2.55 0.00 0.00 55.97 51.36 1v1q s LYS 89 Cb 0.18 -4.89 -0.01 0.00 -1.05 0.00 0.00 37.83 32.06 1v1q s LYS 89 CO 0.10 -1.71 0.98 1.41 1.55 0.00 0.00 175.35 177.67 1v1q s MET 90 N 2.13 4.36 -0.01 4.03 -2.45 -1.26 -4.24 119.30 121.87 1v1q s MET 90 Ca 0.33 1.30 0.07 0.00 -1.25 0.00 0.00 55.69 56.15 1v1q s MET 90 Cb -0.05 -3.57 -0.02 0.00 1.25 0.00 0.00 34.83 32.44 1v1q s MET 90 CO -0.08 -0.38 -0.22 0.08 1.05 0.00 0.00 175.02 175.47 1v1q s VAL 91 N 2.29 1.74 -0.43 10.11 1.01 0.61 -4.31 120.40 131.42 1v1q s VAL 91 Ca 0.45 -0.98 -0.15 0.00 0.00 0.00 0.00 61.98 61.31 1v1q s VAL 91 Cb -0.17 -1.45 0.04 0.00 0.00 0.00 0.00 36.38 34.80 1v1q s VAL 91 CO 0.14 0.46 0.33 -0.22 0.00 0.00 0.00 175.10 175.81 1v1q s LEU 92 N -0.61 5.28 -0.55 3.92 2.96 -0.05 -1.23 118.68 128.40 1v1q s LEU 92 Ca 0.08 -1.09 -0.28 0.00 -0.22 0.00 0.00 54.13 52.62 1v1q s LEU 92 Cb -0.09 -2.15 0.03 0.00 0.50 0.00 0.00 46.19 44.48 1v1q s LEU 92 CO -0.00 -0.52 1.17 -1.00 -1.32 0.00 0.00 176.35 174.67 1v1q s HIS 93 N 1.65 2.67 0.19 5.38 3.76 0.71 -1.83 115.29 127.82 1v1q s HIS 93 Ca 0.04 0.48 -0.30 0.00 -0.15 0.00 0.00 55.06 55.14 1v1q s HIS 93 Cb -0.21 -4.48 -0.08 0.00 1.11 0.00 0.00 32.58 28.92 1v1q s HIS 93 CO 0.08 -1.50 1.06 0.00 -0.85 0.00 0.00 174.74 173.54 1v1q s ALA 94 N 4.79 3.36 -0.00 -1.40 0.00 -0.18 -2.11 121.76 126.22 1v1q s ALA 94 Ca 0.44 0.78 0.00 0.00 0.00 0.00 0.00 51.96 53.18 1v1q s ALA 94 Cb -0.07 -3.32 -0.00 0.00 0.00 0.00 0.00 23.12 19.72 1v1q s ALA 94 CO 0.27 -0.13 0.00 0.39 0.00 0.00 0.00 175.76 176.29 1v1q n GLU 95 N 2.13 0.34 -3.76 0.00 -0.58 -0.22 -4.61 120.64 113.94 1v1q n GLU 95 Ca 0.01 -0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 56.62 1v1q n GLU 95 Cb 0.46 -0.98 -0.11 0.00 -0.57 0.00 0.00 31.44 30.25 1v1q n GLU 95 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 1v1q s GLN 96 N -1.96 0.42 -0.02 3.49 0.74 -0.92 -5.02 119.66 116.38 1v1q s GLN 96 Ca -0.00 0.40 -0.01 0.00 0.05 0.00 0.00 55.36 55.80 1v1q s GLN 96 Cb 0.00 0.20 0.02 0.00 1.10 0.00 0.00 33.01 34.33 1v1q s GLN 96 CO 0.01 -0.06 0.05 0.42 -0.55 0.00 0.00 175.29 175.16 1v1q s ILE 97 N 0.03 -0.03 -0.06 -2.34 1.01 -1.26 -1.18 121.20 117.37 1v1q s ILE 97 Ca -0.01 0.10 0.06 0.00 0.00 0.00 0.00 60.65 60.79 1v1q s ILE 97 Cb -0.03 -0.09 -0.01 0.00 0.01 0.00 0.00 42.46 42.34 1v1q s ILE 97 CO 0.01 0.04 -0.24 -1.61 0.00 0.00 0.00 174.94 173.14 1v1q s GLU 98 N 0.52 2.47 -0.16 2.79 2.02 0.07 -4.96 118.70 121.46 1v1q s GLU 98 Ca -0.04 -0.87 -0.24 0.00 0.02 0.00 0.00 54.97 53.83 1v1q s GLU 98 Cb -0.06 -2.09 -0.02 0.00 0.10 0.00 0.00 34.13 32.06 1v1q s GLU 98 CO -0.02 0.36 0.79 -0.51 0.02 0.00 0.00 175.26 175.90 1v1q s LEU 99 N -0.13 4.19 0.07 1.80 2.01 -1.26 -1.46 118.68 123.91 1v1q s LEU 99 Ca -0.04 1.14 0.16 0.00 0.01 0.00 0.00 54.13 55.40 1v1q s LEU 99 Cb -0.14 -3.17 -0.13 0.00 0.01 0.00 0.00 46.19 42.77 1v1q s LEU 99 CO 0.04 -0.34 0.87 0.40 1.01 0.00 0.00 176.35 178.33 1v1q h ILE 100 N 5.12 0.57 -2.21 -0.59 2.04 -1.75 -3.44 117.51 117.25 1v1q h ILE 100 Ca -0.31 -2.08 -0.39 0.00 1.00 0.00 0.00 64.86 63.08 1v1q h ILE 100 Cb 1.14 2.10 -0.34 0.00 -0.74 0.00 0.00 36.82 38.98 1v1q h ILE 100 CO 0.81 0.32 -0.69 -1.81 0.00 0.00 0.00 178.15 176.79 1v1q s ASP 101 N -5.87 1.89 -0.36 1.72 1.01 -1.25 -5.07 116.67 108.74 1v1q s ASP 101 Ca -0.02 -1.17 -0.02 0.00 0.71 0.00 0.00 52.55 52.05 1v1q s ASP 101 Cb 0.09 0.34 0.08 0.00 1.01 0.00 0.00 42.92 44.43 1v1q s ASP 101 CO 0.81 -0.35 0.11 -0.55 0.21 0.00 0.00 175.17 175.39 1v1q s SER 102 N 1.97 5.08 0.00 0.27 0.15 -1.26 -4.80 113.70 115.11 1v1q s SER 102 Ca 0.12 -1.71 0.00 0.00 0.70 0.00 0.00 55.95 55.06 1v1q s SER 102 Cb -0.15 -1.77 0.00 0.00 -1.71 0.00 0.00 66.02 62.39 1v1q s SER 102 CO -0.23 -0.41 0.00 0.52 1.20 0.00 0.00 173.24 174.32 1v1q n VAL 103 N 4.59 0.00 -1.08 4.45 0.31 -1.26 -5.16 118.33 120.17 1v1q n VAL 103 Ca -0.06 0.00 0.14 0.00 -0.01 0.00 0.00 64.34 64.41 1v1q n VAL 103 Cb 0.42 -0.01 -0.04 0.00 -0.91 0.00 0.00 33.84 33.30 1v1q n VAL 103 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1v1q n ASP 104 N -0.90 -6.46 0.00 4.52 4.64 -1.26 -5.32 116.55 111.77 1v1q n ASP 104 Ca 0.00 0.55 0.00 0.00 -1.38 0.00 0.00 54.79 53.96 1v1q n ASP 104 Cb 0.01 -3.36 0.00 0.00 -1.04 0.00 0.00 41.12 36.73 1v1q n ASP 104 CO 0.00 0.00 0.00 2.29 -0.82 0.00 0.00 177.20 178.67