#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pq7 s VAL 17 N 0.00 5.31 -0.49 1.39 1.01 0.19 -3.88 120.40 123.93 1pq7 s VAL 17 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1pq7 s VAL 17 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1pq7 s VAL 17 CO 0.00 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1pq7 n GLY 18 N 3.07 0.59 4.02 4.51 0.00 -1.23 -1.95 105.19 114.19 1pq7 n GLY 18 Ca -0.17 -0.80 -0.21 0.00 0.00 0.00 0.00 46.02 44.84 1pq7 n GLY 18 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pq7 s GLY 19 N -2.90 1.75 0.21 -0.02 0.00 -1.26 -4.87 107.32 100.23 1pq7 s GLY 19 Ca 0.00 -1.95 0.04 0.00 0.00 0.00 0.00 44.72 42.81 1pq7 s GLY 19 CO 0.00 -1.46 -0.04 -0.51 0.00 0.00 0.00 173.10 171.09 1pq7 s THR 20 N -2.85 1.10 0.15 0.90 -4.23 -0.07 -4.90 115.64 105.74 1pq7 s THR 20 Ca 0.63 -2.05 -0.31 0.00 -1.18 0.00 0.00 61.69 58.79 1pq7 s THR 20 Cb -0.06 -2.19 -0.09 0.00 1.34 0.00 0.00 72.50 71.51 1pq7 s THR 20 CO 0.41 -0.46 1.43 -0.94 -0.54 0.00 0.00 174.62 174.52 1pq7 s SER 21 N -3.27 6.76 0.44 3.99 1.04 -1.26 -0.65 113.70 120.75 1pq7 s SER 21 Ca 0.25 2.44 -0.24 0.00 0.48 0.00 0.00 55.95 58.87 1pq7 s SER 21 Cb 0.05 -2.59 -0.08 0.00 0.10 0.00 0.00 66.02 63.50 1pq7 s SER 21 CO 0.06 -0.69 1.23 0.00 0.98 0.00 0.00 173.24 174.82 1pq7 s ALA 22 N 0.93 3.07 0.45 5.32 0.00 -0.44 -4.84 121.76 126.26 1pq7 s ALA 22 Ca 0.65 1.07 -0.08 0.00 0.00 0.00 0.00 51.96 53.59 1pq7 s ALA 22 Cb -0.39 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.25 1pq7 s ALA 22 CO 0.32 -0.76 0.79 -1.12 0.00 0.00 0.00 175.76 174.99 1pq7 s SER 23 N -1.09 6.40 0.19 0.00 0.01 -1.26 -4.88 113.70 113.06 1pq7 s SER 23 Ca 0.61 1.07 -0.33 0.00 1.31 0.00 0.00 55.95 58.61 1pq7 s SER 23 Cb -0.33 -2.30 -0.14 0.00 0.21 0.00 0.00 66.02 63.46 1pq7 s SER 23 CO 0.41 -0.50 1.51 0.00 0.41 0.00 0.00 173.24 175.07 1pq7 n ALA 24 N -1.77 1.23 -0.93 1.44 0.00 -1.26 -1.42 120.51 117.79 1pq7 n ALA 24 Ca 0.02 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1pq7 n ALA 24 Cb 0.54 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.68 1pq7 n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pq7 n GLY 25 N 2.94 0.89 0.32 0.00 0.00 -1.26 -4.91 105.19 103.17 1pq7 n GLY 25 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1pq7 n GLY 25 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1pq7 h ASP 26 N 0.00 0.70 -2.48 1.61 3.32 -1.63 -3.35 116.42 114.59 1pq7 h ASP 26 Ca 0.00 -0.06 -0.59 0.00 0.02 0.00 0.00 57.03 56.40 1pq7 h ASP 26 Cb 0.00 -0.18 -0.38 0.00 0.22 0.00 0.00 39.33 38.99 1pq7 h ASP 26 CO 0.00 0.58 -0.92 -0.36 -1.72 0.00 0.00 179.24 176.82 1pq7 s PHE 27 N -5.50 1.23 0.59 4.55 0.08 -1.26 -5.00 117.98 112.67 1pq7 s PHE 27 Ca -0.10 -2.30 0.29 0.00 0.12 0.00 0.00 56.93 54.94 1pq7 s PHE 27 Cb 0.17 -1.07 1.77 0.00 -0.57 0.00 0.00 43.02 43.32 1pq7 s PHE 27 CO 0.77 -0.81 2.22 -1.35 -0.10 0.00 0.00 175.22 175.95 1pq7 h PRO 28 N 5.84 0.00 -0.01 0.24 0.11 -1.78 -1.46 132.00 134.94 1pq7 h PRO 28 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 1pq7 h PRO 28 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1pq7 h PRO 28 CO 0.38 0.00 -0.26 1.97 -0.21 0.00 0.00 178.00 179.88 1pq7 n PHE 29 N -3.86 0.00 -2.38 0.65 1.16 -1.12 -1.57 117.46 110.34 1pq7 n PHE 29 Ca -0.02 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.16 1pq7 n PHE 29 Cb 0.14 -0.08 -0.04 0.00 -1.61 0.00 0.00 39.48 37.89 1pq7 n PHE 29 CO 0.00 0.00 0.00 -1.50 -1.87 0.00 0.00 176.76 173.39 1pq7 s ILE 30 N -2.42 3.29 0.08 1.97 2.07 -0.55 -0.05 121.20 125.59 1pq7 s ILE 30 Ca 0.25 1.30 0.09 0.00 -1.41 0.00 0.00 60.65 60.88 1pq7 s ILE 30 Cb 0.19 -3.83 -0.03 0.00 0.13 0.00 0.00 42.46 38.92 1pq7 s ILE 30 CO 0.50 0.31 -0.23 0.68 -1.91 0.00 0.00 174.94 174.29 1pq7 s VAL 31 N -1.16 1.89 0.18 4.00 -7.23 -0.31 -4.20 120.40 113.57 1pq7 s VAL 31 Ca 0.46 -1.44 -0.16 0.00 -1.81 0.00 0.00 61.98 59.02 1pq7 s VAL 31 Cb -0.34 -1.66 -0.07 0.00 0.56 0.00 0.00 36.38 34.86 1pq7 s VAL 31 CO 0.44 0.14 0.61 -0.94 -0.31 0.00 0.00 175.10 175.04 1pq7 s SER 32 N -1.57 6.88 -0.34 4.85 1.04 -0.52 -1.15 113.70 122.90 1pq7 s SER 32 Ca 0.09 1.18 0.03 0.00 0.48 0.00 0.00 55.95 57.73 1pq7 s SER 32 Cb -0.10 -2.33 0.09 0.00 0.10 0.00 0.00 66.02 63.79 1pq7 s SER 32 CO 0.03 0.06 0.05 -0.63 0.98 0.00 0.00 173.24 173.73 1pq7 s ILE 33 N -1.52 2.43 0.47 -1.02 1.01 0.11 -1.40 121.20 121.27 1pq7 s ILE 33 Ca 0.40 -2.19 -0.16 0.00 0.00 0.00 0.00 60.65 58.70 1pq7 s ILE 33 Cb -0.15 -2.72 -0.08 0.00 0.01 0.00 0.00 42.46 39.52 1pq7 s ILE 33 CO 0.20 -0.52 0.93 -0.44 0.00 0.00 0.00 174.94 175.10 1pq7 s SER 34 N 1.06 6.68 -0.03 3.58 0.01 -0.12 -1.55 113.70 123.33 1pq7 s SER 34 Ca 0.08 1.50 0.01 0.00 1.31 0.00 0.00 55.95 58.84 1pq7 s SER 34 Cb -0.20 -2.47 0.02 0.00 0.21 0.00 0.00 66.02 63.58 1pq7 s SER 34 CO -0.07 -0.49 -0.01 -0.60 0.41 0.00 0.00 173.24 172.48 1pq7 s ARG 35 N -3.79 0.45 -1.54 12.44 3.52 -0.17 -1.45 118.95 128.41 1pq7 s ARG 35 Ca 0.58 0.02 -0.01 0.00 -0.13 0.00 0.00 55.73 56.18 1pq7 s ARG 35 Cb -0.10 -0.57 0.00 0.00 -1.56 0.00 0.00 34.95 32.73 1pq7 s ARG 35 CO 0.27 -0.11 0.10 0.09 -0.81 0.00 0.00 175.30 174.84 1pq7 n ASN 36 N 4.06 -5.33 0.00 -2.12 3.02 0.23 -1.38 115.26 113.73 1pq7 n ASN 36 Ca -0.26 -0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.28 1pq7 n ASN 36 Cb 0.51 -4.43 0.00 0.00 -0.61 0.00 0.00 39.78 35.24 1pq7 n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pq7 n GLY 37 N -1.03 2.25 3.77 7.41 0.00 -1.26 -5.02 105.19 111.30 1pq7 n GLY 37 Ca -0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.56 1pq7 n GLY 37 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pq7 s GLY 38 N -2.00 2.48 0.61 -0.02 0.00 -0.48 -5.05 107.32 102.86 1pq7 s GLY 38 Ca 0.00 -1.66 -0.19 0.00 0.00 0.00 0.00 44.72 42.87 1pq7 s GLY 38 CO 0.00 -1.98 1.31 -4.14 0.00 0.00 0.00 173.10 168.28 1pq7 s PRO 39 N -3.96 2.80 0.29 2.90 0.02 -1.26 -1.00 135.00 134.79 1pq7 s PRO 39 Ca 0.33 2.10 0.00 0.00 0.02 0.00 0.00 61.00 63.45 1pq7 s PRO 39 Cb 0.03 -1.99 0.00 0.00 0.02 0.00 0.00 34.50 32.55 1pq7 s PRO 39 CO 0.18 -1.42 0.00 1.87 -0.33 0.00 0.00 177.00 177.31 1pq7 n TRP 40 N -1.57 -3.16 -3.85 6.54 -0.00 -1.18 -4.59 117.44 109.62 1pq7 n TRP 40 Ca 0.14 0.82 -0.05 0.00 -0.00 0.00 0.00 57.50 58.41 1pq7 n TRP 40 Cb 0.47 2.01 0.02 0.00 -0.00 0.00 0.00 31.31 33.81 1pq7 n TRP 40 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1pq7 s GLY 42 N -3.26 2.71 0.20 0.00 0.00 0.04 0.08 107.32 107.09 1pq7 s GLY 42 Ca 0.19 -0.88 -0.14 0.00 0.00 0.00 0.00 44.72 43.88 1pq7 s GLY 42 CO 0.08 -2.08 0.71 0.61 0.00 0.00 0.00 173.10 172.42 1pq7 n GLY 43 N -1.45 0.94 2.93 0.20 0.00 -0.30 -2.97 105.19 104.54 1pq7 n GLY 43 Ca -0.11 -1.13 -0.23 0.00 0.00 0.00 0.00 46.02 44.55 1pq7 n GLY 43 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pq7 s SER 44 N -2.74 1.45 -0.31 1.61 0.01 -0.07 -1.17 113.70 112.48 1pq7 s SER 44 Ca 0.15 -0.20 -0.29 0.00 1.31 0.00 0.00 55.95 56.92 1pq7 s SER 44 Cb -0.03 -0.63 0.01 0.00 0.21 0.00 0.00 66.02 65.59 1pq7 s SER 44 CO 0.06 -0.05 1.17 -0.22 0.41 0.00 0.00 173.24 174.61 1pq7 s LEU 45 N 1.04 3.92 -0.03 2.44 2.96 0.93 -0.48 118.68 129.47 1pq7 s LEU 45 Ca -0.09 1.13 0.10 0.00 -0.22 0.00 0.00 54.13 55.05 1pq7 s LEU 45 Cb -0.14 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 42.77 1pq7 s LEU 45 CO -0.00 -0.95 0.70 -0.07 -1.32 0.00 0.00 176.35 174.70 1pq7 h LEU 46 N 10.36 0.05 0.00 -0.68 3.38 -1.19 -0.99 115.31 126.24 1pq7 h LEU 46 Ca -0.23 -0.11 0.10 0.00 0.09 0.00 0.00 57.88 57.73 1pq7 h LEU 46 Cb 1.08 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 1pq7 h LEU 46 CO 1.03 1.10 0.44 -0.46 0.09 0.00 0.00 178.44 180.64 1pq7 n ASN 47 N -3.13 -1.59 0.26 -0.43 0.23 -1.22 -4.44 115.26 104.96 1pq7 n ASN 47 Ca -0.17 -1.91 0.13 0.00 -0.53 0.00 0.00 54.58 52.10 1pq7 n ASN 47 Cb 1.04 2.60 0.79 0.00 -2.08 0.00 0.00 39.78 42.13 1pq7 n ASN 47 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1pq7 h ALA 48 N 2.00 1.77 -0.34 -2.53 0.00 -1.96 -2.83 119.26 115.37 1pq7 h ALA 48 Ca -0.24 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1pq7 h ALA 48 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1pq7 h ALA 48 CO 0.32 -0.05 0.00 0.09 0.00 0.00 0.00 179.25 179.61 1pq7 n ASN 49 N -4.14 2.96 -3.73 0.00 3.02 -1.26 -0.59 115.26 111.53 1pq7 n ASN 49 Ca -0.02 -2.05 -0.12 0.00 -0.03 0.00 0.00 54.58 52.36 1pq7 n ASN 49 Cb 0.12 -0.24 -0.11 0.00 -0.61 0.00 0.00 39.78 38.94 1pq7 n ASN 49 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1pq7 s THR 50 N -1.08 -0.02 -0.03 3.41 2.01 -1.07 -1.49 115.64 117.37 1pq7 s THR 50 Ca 0.24 0.07 0.07 0.00 0.31 0.00 0.00 61.69 62.38 1pq7 s THR 50 Cb 0.13 -0.50 -0.02 0.00 0.01 0.00 0.00 72.50 72.12 1pq7 s THR 50 CO 0.15 0.03 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.18 1pq7 s VAL 51 N 0.86 1.95 -0.20 3.82 1.01 -0.20 -0.61 120.40 127.03 1pq7 s VAL 51 Ca -0.06 -1.04 -0.10 0.00 0.00 0.00 0.00 61.98 60.78 1pq7 s VAL 51 Cb -0.06 -1.63 -0.05 0.00 0.00 0.00 0.00 36.38 34.64 1pq7 s VAL 51 CO -0.06 0.55 0.15 -0.22 0.00 0.00 0.00 175.10 175.51 1pq7 s LEU 52 N -0.43 4.21 0.00 3.92 2.96 0.37 -0.43 118.68 129.28 1pq7 s LEU 52 Ca 0.05 0.25 0.03 0.00 -0.22 0.00 0.00 54.13 54.24 1pq7 s LEU 52 Cb -0.11 -2.12 -0.01 0.00 0.50 0.00 0.00 46.19 44.46 1pq7 s LEU 52 CO 0.00 0.17 0.18 1.07 -1.32 0.00 0.00 176.35 176.45 1pq7 n THR 53 N 3.57 0.00 -2.72 3.68 5.66 -0.55 -0.89 114.28 123.03 1pq7 n THR 53 Ca -0.16 -1.25 -0.40 0.00 -3.05 0.00 0.00 64.05 59.20 1pq7 n THR 53 Cb 0.52 0.65 -0.06 0.00 -1.55 0.00 0.00 70.33 69.89 1pq7 n THR 53 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1pq7 s ALA 54 N -2.62 3.33 0.30 1.79 0.00 -1.26 -0.83 121.76 122.47 1pq7 s ALA 54 Ca 0.20 0.65 0.01 0.00 0.00 0.00 0.00 51.96 52.82 1pq7 s ALA 54 Cb 0.01 -3.22 0.55 0.00 0.00 0.00 0.00 23.12 20.45 1pq7 s ALA 54 CO 0.15 0.15 1.89 0.00 0.00 0.00 0.00 175.76 177.95 1pq7 h ALA 55 N 3.98 1.53 0.00 0.00 0.00 -1.66 -1.98 119.26 121.13 1pq7 h ALA 55 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1pq7 h ALA 55 Cb 1.20 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1pq7 h ALA 55 CO 0.67 0.30 0.00 1.12 0.00 0.00 0.00 179.25 181.35 1pq7 h HIS 56 N 1.01 0.00 0.00 0.00 2.07 -1.93 0.12 115.15 116.42 1pq7 h HIS 56 Ca 0.42 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.89 1pq7 h HIS 56 Cb 0.29 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.26 1pq7 h HIS 56 CO -0.00 0.00 -0.22 0.00 -3.07 0.00 0.00 177.93 174.64 1pq7 n VAL 58 N -3.86 0.00 -1.68 0.00 0.24 -0.64 -4.98 118.33 107.41 1pq7 n VAL 58 Ca -0.02 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.86 1pq7 n VAL 58 Cb 0.31 0.03 -0.03 0.00 -1.47 0.00 0.00 33.84 32.68 1pq7 n VAL 58 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1pq7 n SER 59 N -1.11 4.07 0.00 -1.34 2.88 0.32 -2.19 113.62 116.26 1pq7 n SER 59 Ca 0.00 0.96 0.00 0.00 -1.33 0.00 0.00 58.87 58.50 1pq7 n SER 59 Cb 0.10 -1.53 0.00 0.00 -0.75 0.00 0.00 64.21 62.02 1pq7 n SER 59 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1pq7 n GLY 60 N 4.34 1.52 3.89 0.46 0.00 -1.26 -5.01 105.19 109.13 1pq7 n GLY 60 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1pq7 n GLY 60 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pq7 s TYR 61 N -2.86 3.51 -0.29 1.61 2.02 -0.93 -4.97 117.35 115.43 1pq7 s TYR 61 Ca 0.00 1.06 -0.28 0.00 -0.37 0.00 0.00 57.07 57.47 1pq7 s TYR 61 Cb 0.00 -2.70 -0.03 0.00 -0.40 0.00 0.00 41.96 38.83 1pq7 s TYR 61 CO 0.00 -0.71 1.90 0.00 -1.57 0.00 0.00 175.55 175.16 1pq7 s ALA 62 N -3.10 2.86 0.54 3.71 0.00 -1.26 -4.86 121.76 119.65 1pq7 s ALA 62 Ca 0.54 0.41 0.20 0.00 0.00 0.00 0.00 51.96 53.11 1pq7 s ALA 62 Cb -0.11 -4.02 1.41 0.00 0.00 0.00 0.00 23.12 20.41 1pq7 s ALA 62 CO 0.50 -2.63 2.17 -0.56 0.00 0.00 0.00 175.76 175.25 1pq7 h GLN 63 N 13.31 0.00 0.00 0.00 3.07 -1.93 -1.90 115.11 127.65 1pq7 h GLN 63 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.38 1pq7 h GLN 63 Cb 1.19 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.75 1pq7 h GLN 63 CO 1.01 0.00 0.00 -1.13 0.09 0.00 0.00 178.83 178.80 1pq7 n SER 64 N -4.36 0.54 0.02 0.06 3.41 -1.26 -1.70 113.62 110.34 1pq7 n SER 64 Ca -0.03 0.71 0.11 0.00 -0.26 0.00 0.00 58.87 59.41 1pq7 n SER 64 Cb 0.11 -0.80 0.47 0.00 -0.26 0.00 0.00 64.21 63.73 1pq7 n SER 64 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pq7 n GLY 65 N -0.92 -1.31 3.88 5.00 0.00 -0.71 -4.83 105.19 106.30 1pq7 n GLY 65 Ca -0.00 -0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 1pq7 n GLY 65 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1pq7 s PHE 66 N -3.04 3.60 -0.06 1.61 0.08 -0.69 -0.60 117.98 118.88 1pq7 s PHE 66 Ca 0.10 0.60 0.00 0.00 0.12 0.00 0.00 56.93 57.75 1pq7 s PHE 66 Cb 0.14 -2.00 0.02 0.00 -0.57 0.00 0.00 43.02 40.61 1pq7 s PHE 66 CO 0.42 0.66 -0.03 -1.14 -0.10 0.00 0.00 175.22 175.03 1pq7 s GLN 67 N -1.44 0.80 0.07 0.44 0.74 -0.53 -4.32 119.66 115.41 1pq7 s GLN 67 Ca 0.23 -0.04 -0.15 0.00 0.05 0.00 0.00 55.36 55.45 1pq7 s GLN 67 Cb -0.13 -0.93 -0.06 0.00 1.10 0.00 0.00 33.01 32.99 1pq7 s GLN 67 CO 0.12 -0.17 0.49 0.42 -0.55 0.00 0.00 175.29 175.60 1pq7 s ILE 68 N 1.31 4.92 -0.04 -2.34 1.09 0.08 -0.94 121.20 125.27 1pq7 s ILE 68 Ca -0.05 0.88 0.01 0.00 -1.10 0.00 0.00 60.65 60.39 1pq7 s ILE 68 Cb -0.14 -3.75 0.02 0.00 -1.06 0.00 0.00 42.46 37.53 1pq7 s ILE 68 CO -0.02 0.44 -0.06 -0.60 -0.10 0.00 0.00 174.94 174.60 1pq7 s ARG 69 N -1.45 0.95 0.21 2.79 3.52 -0.50 -1.08 118.95 123.40 1pq7 s ARG 69 Ca 0.30 -0.17 0.10 0.00 -0.13 0.00 0.00 55.73 55.83 1pq7 s ARG 69 Cb -0.17 -0.90 -0.04 0.00 -1.56 0.00 0.00 34.95 32.28 1pq7 s ARG 69 CO 0.17 -0.04 -0.12 0.00 -0.81 0.00 0.00 175.30 174.50 1pq7 s ALA 70 N 0.78 2.88 0.00 6.12 0.00 -0.11 -1.44 121.76 129.99 1pq7 s ALA 70 Ca -0.11 -1.60 0.00 0.00 0.00 0.00 0.00 51.96 50.25 1pq7 s ALA 70 Cb -0.14 -0.59 0.00 0.00 0.00 0.00 0.00 23.12 22.39 1pq7 s ALA 70 CO 0.01 0.39 0.00 0.41 0.00 0.00 0.00 175.76 176.57 1pq7 n GLY 71 N -0.20 0.42 3.03 0.00 0.00 -1.26 -1.08 105.19 106.10 1pq7 n GLY 71 Ca -0.09 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 44.98 1pq7 n GLY 71 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pq7 s SER 72 N -2.77 0.54 0.16 1.61 0.15 -1.26 -4.06 113.70 108.07 1pq7 s SER 72 Ca 0.00 -0.60 0.26 0.00 0.70 0.00 0.00 55.95 56.31 1pq7 s SER 72 Cb 0.00 0.09 0.68 0.00 -1.71 0.00 0.00 66.02 65.07 1pq7 s SER 72 CO 0.00 -0.30 1.62 0.18 1.20 0.00 0.00 173.24 175.94 1pq7 n LEU 73 N 1.30 0.70 -4.87 3.45 4.77 -1.26 -4.86 117.00 116.23 1pq7 n LEU 73 Ca -0.22 0.43 -0.27 0.00 -0.03 0.00 0.00 56.01 55.93 1pq7 n LEU 73 Cb 0.56 -0.28 -0.04 0.00 -2.33 0.00 0.00 43.42 41.32 1pq7 n LEU 73 CO 0.22 -0.11 -0.16 -0.55 -1.33 0.00 0.00 177.39 175.45 1pq7 s SER 74 N -4.25 5.95 0.37 -1.43 0.15 -1.26 -0.82 113.70 112.40 1pq7 s SER 74 Ca 0.09 0.04 0.19 0.00 0.70 0.00 0.00 55.95 56.98 1pq7 s SER 74 Cb 0.13 -1.69 0.24 0.00 -1.71 0.00 0.00 66.02 62.99 1pq7 s SER 74 CO 0.64 0.07 1.54 -0.09 1.20 0.00 0.00 173.24 176.60 1pq7 h ARG 75 N 2.37 0.00 -0.01 5.44 2.43 -1.90 -3.40 114.38 119.32 1pq7 h ARG 75 Ca -0.48 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1pq7 h ARG 75 Cb 1.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 1pq7 h ARG 75 CO 0.67 0.23 -0.03 0.25 -1.51 0.00 0.00 179.97 179.58 1pq7 n THR 76 N -3.16 0.00 -3.69 0.20 -2.24 -1.26 -4.89 114.28 99.24 1pq7 n THR 76 Ca 0.03 -0.49 -0.09 0.00 -2.27 0.00 0.00 64.05 61.23 1pq7 n THR 76 Cb 0.62 1.12 -0.02 0.00 -2.10 0.00 0.00 70.33 69.95 1pq7 n THR 76 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1pq7 s SER 77 N -0.64 -0.37 0.00 3.42 1.04 -1.26 -5.16 113.70 110.73 1pq7 s SER 77 Ca 0.07 -0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.12 1pq7 s SER 77 Cb 0.05 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.84 1pq7 s SER 77 CO 0.10 -1.19 0.00 0.61 0.98 0.00 0.00 173.24 173.74 1pq7 n GLY 78 N -0.42 -0.98 7.00 7.32 0.00 -1.26 -4.44 105.19 112.41 1pq7 n GLY 78 Ca -0.09 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1pq7 n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pq7 n GLY 79 N -0.71 0.60 3.07 -0.02 0.00 -1.26 -4.70 105.19 102.17 1pq7 n GLY 79 Ca 0.00 -0.79 -0.25 0.00 0.00 0.00 0.00 46.02 44.99 1pq7 n GLY 79 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1pq7 s ILE 80 N 0.00 1.20 0.29 -0.61 -1.09 -0.24 -4.96 121.20 115.78 1pq7 s ILE 80 Ca 0.00 -0.56 0.07 0.00 -2.23 0.00 0.00 60.65 57.93 1pq7 s ILE 80 Cb 0.00 -1.07 -0.03 0.00 -1.58 0.00 0.00 42.46 39.78 1pq7 s ILE 80 CO 0.00 0.36 0.24 0.42 -1.23 0.00 0.00 174.94 174.73 1pq7 s THR 81 N 0.34 4.09 -0.07 2.92 -4.23 -1.26 -0.93 115.64 116.50 1pq7 s THR 81 Ca -0.09 -1.38 -0.20 0.00 -1.18 0.00 0.00 61.69 58.84 1pq7 s THR 81 Cb -0.13 -3.32 0.04 0.00 1.34 0.00 0.00 72.50 70.43 1pq7 s THR 81 CO 0.03 -0.28 0.45 -0.55 -0.54 0.00 0.00 174.62 173.73 1pq7 s SER 82 N -3.91 -0.40 0.87 3.99 0.15 -0.24 -4.84 113.70 109.33 1pq7 s SER 82 Ca 0.36 0.49 -0.11 0.00 0.70 0.00 0.00 55.95 57.40 1pq7 s SER 82 Cb -0.07 0.55 0.17 0.00 -1.71 0.00 0.00 66.02 64.96 1pq7 s SER 82 CO 0.26 -0.41 1.20 -0.94 1.20 0.00 0.00 173.24 174.54 1pq7 s SER 83 N -0.86 3.63 -0.08 5.45 1.04 -1.26 -0.74 113.70 120.88 1pq7 s SER 83 Ca -0.09 0.10 -0.06 0.00 0.48 0.00 0.00 55.95 56.38 1pq7 s SER 83 Cb -0.03 -0.29 -0.04 0.00 0.10 0.00 0.00 66.02 65.76 1pq7 s SER 83 CO 0.05 -2.38 0.16 -0.76 0.98 0.00 0.00 173.24 171.29 1pq7 s LEU 84 N -5.62 4.38 -0.13 2.42 1.43 -1.26 -1.14 118.68 118.77 1pq7 s LEU 84 Ca 0.70 0.44 0.06 0.00 -1.03 0.00 0.00 54.13 54.30 1pq7 s LEU 84 Cb -0.05 -2.27 -0.23 0.00 0.03 0.00 0.00 46.19 43.67 1pq7 s LEU 84 CO 0.50 0.36 0.31 -1.54 0.23 0.00 0.00 176.35 176.20 1pq7 n SER 85 N 1.61 1.31 -3.53 2.29 3.41 0.68 -4.64 113.62 114.76 1pq7 n SER 85 Ca -0.17 0.18 -0.10 0.00 -0.26 0.00 0.00 58.87 58.52 1pq7 n SER 85 Cb 0.54 -0.19 -0.02 0.00 -0.26 0.00 0.00 64.21 64.28 1pq7 n SER 85 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1pq7 s SER 86 N -6.36 -0.47 -0.04 4.04 1.04 -1.17 -4.98 113.70 105.76 1pq7 s SER 86 Ca -0.16 -0.14 0.02 0.00 0.48 0.00 0.00 55.95 56.15 1pq7 s SER 86 Cb 0.07 0.60 0.01 0.00 0.10 0.00 0.00 66.02 66.80 1pq7 s SER 86 CO 0.77 -1.00 -0.07 -0.69 0.98 0.00 0.00 173.24 173.23 1pq7 s VAL 87 N -3.70 0.65 -0.10 5.02 1.01 -1.26 -1.34 120.40 120.68 1pq7 s VAL 87 Ca 0.04 -0.23 -0.02 0.00 0.00 0.00 0.00 61.98 61.77 1pq7 s VAL 87 Cb -0.02 -0.62 0.03 0.00 0.00 0.00 0.00 36.38 35.77 1pq7 s VAL 87 CO -0.08 0.23 0.00 -0.60 0.00 0.00 0.00 175.10 174.66 1pq7 s ARG 88 N 0.58 0.68 0.49 2.72 3.52 -0.08 -5.01 118.95 121.85 1pq7 s ARG 88 Ca -0.08 -0.03 -0.06 0.00 -0.13 0.00 0.00 55.73 55.43 1pq7 s ARG 88 Cb -0.12 -1.26 -0.04 0.00 -1.56 0.00 0.00 34.95 31.97 1pq7 s ARG 88 CO 0.01 -0.37 0.80 0.14 -0.81 0.00 0.00 175.30 175.06 1pq7 s VAL 89 N 1.93 4.90 0.32 7.11 -7.23 -1.26 -0.60 120.40 125.56 1pq7 s VAL 89 Ca 0.04 0.25 -0.29 0.00 -1.81 0.00 0.00 61.98 60.17 1pq7 s VAL 89 Cb -0.13 -3.86 -0.13 0.00 0.56 0.00 0.00 36.38 32.82 1pq7 s VAL 89 CO -0.06 -0.87 1.30 1.57 -0.31 0.00 0.00 175.10 176.73 1pq7 n HIS 90 N -2.28 2.20 0.29 2.82 -0.00 -0.35 -4.84 115.22 113.06 1pq7 n HIS 90 Ca 0.01 0.54 0.11 0.00 0.46 0.00 0.00 57.72 58.84 1pq7 n HIS 90 Cb 0.55 -2.42 0.53 0.00 -0.12 0.00 0.00 29.99 28.53 1pq7 n HIS 90 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1pq7 n PRO 91 N 0.87 0.17 -0.34 1.57 -0.04 -1.26 -1.46 135.00 134.50 1pq7 n PRO 91 Ca 0.06 0.52 0.08 0.00 -0.04 0.00 0.00 63.50 64.12 1pq7 n PRO 91 Cb 0.35 -1.91 0.22 0.00 -0.04 0.00 0.00 33.50 32.12 1pq7 n PRO 91 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1pq7 n SER 92 N -2.24 3.50 -4.69 3.54 7.64 -1.26 -5.02 113.62 115.08 1pq7 n SER 92 Ca 0.01 -2.73 -0.44 0.00 1.01 0.00 0.00 58.87 56.72 1pq7 n SER 92 Cb 0.14 -0.44 -0.04 0.00 -1.01 0.00 0.00 64.21 62.87 1pq7 n SER 92 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1pq7 n TYR 93 N -0.29 2.50 -3.62 1.43 9.36 -0.54 -4.67 117.16 121.33 1pq7 n TYR 93 Ca 0.18 0.17 -0.03 0.00 3.32 0.00 0.00 57.90 61.54 1pq7 n TYR 93 Cb 0.74 -2.60 -0.05 0.00 -0.63 0.00 0.00 39.34 36.80 1pq7 n TYR 93 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1pq7 s SER 94 N 1.00 -0.95 1.68 2.98 0.15 -0.72 -5.02 113.70 112.82 1pq7 s SER 94 Ca 0.77 1.39 0.00 0.00 0.70 0.00 0.00 55.95 58.81 1pq7 s SER 94 Cb -0.60 1.82 0.00 0.00 -1.71 0.00 0.00 66.02 65.53 1pq7 s SER 94 CO 0.36 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.20 1pq7 n GLY 95 N 4.84 3.43 0.12 9.45 0.00 -1.26 -0.65 105.19 121.14 1pq7 n GLY 95 Ca -0.15 -0.10 0.13 0.00 0.00 0.00 0.00 46.02 45.90 1pq7 n GLY 95 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pq7 n ASN 96 N 4.22 0.59 -4.74 1.61 5.03 -1.26 -4.93 115.26 115.77 1pq7 n ASN 96 Ca 0.00 -0.52 -0.40 0.00 0.87 0.00 0.00 54.58 54.53 1pq7 n ASN 96 Cb 0.00 -0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 38.70 1pq7 n ASN 96 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1pq7 s ASN 97 N -2.61 7.48 -1.04 6.41 2.47 0.18 -3.88 114.94 123.96 1pq7 s ASN 97 Ca 0.24 1.76 -0.01 0.00 0.42 0.00 0.00 52.86 55.27 1pq7 s ASN 97 Cb 0.19 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.43 1pq7 s ASN 97 CO 0.53 0.05 0.87 0.59 -3.72 0.00 0.00 177.10 175.41 1pq7 n ASN 98 N 2.25 -2.38 -3.59 -4.21 3.02 -1.26 -1.75 115.26 107.33 1pq7 n ASN 98 Ca -0.01 -0.52 -0.41 0.00 -0.03 0.00 0.00 54.58 53.61 1pq7 n ASN 98 Cb 0.49 -4.44 -0.01 0.00 -0.61 0.00 0.00 39.78 35.21 1pq7 n ASN 98 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1pq7 n ASP 99 N -2.77 6.72 -4.12 6.41 2.03 -1.25 -4.30 116.55 119.27 1pq7 n ASP 99 Ca -0.22 -2.97 -0.16 0.00 0.52 0.00 0.00 54.79 51.95 1pq7 n ASP 99 Cb 0.64 -1.48 -0.12 0.00 -0.72 0.00 0.00 41.12 39.44 1pq7 n ASP 99 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1pq7 s LEU 100 N -0.44 2.27 0.01 -2.67 1.43 -1.26 -2.81 118.68 115.20 1pq7 s LEU 100 Ca 0.52 -0.58 -0.03 0.00 -1.03 0.00 0.00 54.13 53.01 1pq7 s LEU 100 Cb 0.15 -0.37 -0.01 0.00 0.03 0.00 0.00 46.19 46.00 1pq7 s LEU 100 CO -0.06 -0.13 0.04 0.00 0.23 0.00 0.00 176.35 176.43 1pq7 s ALA 101 N -1.31 -0.06 -0.22 4.21 0.00 -0.01 -1.22 121.76 123.15 1pq7 s ALA 101 Ca -0.05 -0.33 -0.09 0.00 0.00 0.00 0.00 51.96 51.49 1pq7 s ALA 101 Cb -0.10 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 1pq7 s ALA 101 CO 0.01 -0.15 0.11 0.42 0.00 0.00 0.00 175.76 176.15 1pq7 s ILE 102 N -1.20 4.94 -0.12 0.00 -1.09 0.23 -1.49 121.20 122.47 1pq7 s ILE 102 Ca -0.13 0.03 -0.02 0.00 -2.23 0.00 0.00 60.65 58.30 1pq7 s ILE 102 Cb -0.08 -3.28 -0.03 0.00 -1.58 0.00 0.00 42.46 37.50 1pq7 s ILE 102 CO -0.00 0.38 -0.03 -0.76 -1.23 0.00 0.00 174.94 173.30 1pq7 s LEU 103 N 0.95 3.32 -0.12 2.97 1.43 0.43 -0.90 118.68 126.75 1pq7 s LEU 103 Ca 0.05 -0.04 -0.06 0.00 -1.03 0.00 0.00 54.13 53.05 1pq7 s LEU 103 Cb -0.14 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 1pq7 s LEU 103 CO 0.03 0.26 0.11 -0.54 0.23 0.00 0.00 176.35 176.44 1pq7 s LYS 104 N -0.16 3.43 -0.05 1.70 -0.14 -0.45 -1.03 119.74 123.04 1pq7 s LYS 104 Ca 0.03 -0.19 -0.11 0.00 -1.36 0.00 0.00 55.97 54.34 1pq7 s LYS 104 Cb -0.13 -3.14 -0.05 0.00 -1.68 0.00 0.00 37.83 32.84 1pq7 s LYS 104 CO 0.02 0.71 0.29 -0.51 -0.76 0.00 0.00 175.35 175.11 1pq7 s LEU 105 N -0.85 4.44 0.37 3.17 1.43 -0.55 -0.23 118.68 126.46 1pq7 s LEU 105 Ca 0.14 0.75 0.17 0.00 -1.03 0.00 0.00 54.13 54.15 1pq7 s LEU 105 Cb -0.12 -2.37 0.71 0.00 0.03 0.00 0.00 46.19 44.44 1pq7 s LEU 105 CO 0.03 0.36 1.77 0.28 0.23 0.00 0.00 176.35 179.02 1pq7 h SER 106 N 4.80 0.00 -3.20 2.29 0.02 -1.39 -3.42 113.55 112.64 1pq7 h SER 106 Ca -0.53 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 59.75 1pq7 h SER 106 Cb 1.22 0.00 -0.34 0.00 0.14 0.00 0.00 62.40 63.42 1pq7 h SER 106 CO 0.60 0.39 -0.87 -0.89 -1.14 0.00 0.00 176.83 174.92 1pq7 s THR 107 N -3.79 2.08 0.30 -2.27 2.01 -1.26 -4.99 115.64 107.72 1pq7 s THR 107 Ca -0.01 -0.97 -0.29 0.00 0.31 0.00 0.00 61.69 60.73 1pq7 s THR 107 Cb 0.12 -1.83 -0.10 0.00 0.01 0.00 0.00 72.50 70.71 1pq7 s THR 107 CO 0.70 0.55 1.12 -0.44 -0.69 0.00 0.00 174.62 175.86 1pq7 s SER 108 N 0.81 7.14 -0.24 3.53 0.01 -1.26 -4.81 113.70 118.89 1pq7 s SER 108 Ca -0.07 2.31 -0.01 0.00 1.31 0.00 0.00 55.95 59.49 1pq7 s SER 108 Cb -0.16 -2.63 0.03 0.00 0.21 0.00 0.00 66.02 63.48 1pq7 s SER 108 CO -0.02 -0.23 -0.09 -0.63 0.41 0.00 0.00 173.24 172.68 1pq7 s ILE 109 N -1.20 2.67 0.43 1.44 1.01 0.24 -5.02 121.20 120.77 1pq7 s ILE 109 Ca 0.46 -1.06 -0.19 0.00 0.00 0.00 0.00 60.65 59.87 1pq7 s ILE 109 Cb -0.32 -2.34 -0.10 0.00 0.01 0.00 0.00 42.46 39.71 1pq7 s ILE 109 CO 0.42 0.24 0.92 -2.16 0.00 0.00 0.00 174.94 174.35 1pq7 s PRO 110 N 1.30 4.14 0.26 2.79 0.04 -1.26 -4.26 135.00 138.00 1pq7 s PRO 110 Ca 0.00 1.00 -0.30 0.00 0.04 0.00 0.00 61.00 61.75 1pq7 s PRO 110 Cb -0.16 -2.22 -0.09 0.00 0.04 0.00 0.00 34.50 32.07 1pq7 s PRO 110 CO -0.06 -0.04 1.07 0.45 0.04 0.00 0.00 177.00 178.47 1pq7 s SER 111 N -2.37 7.33 0.00 6.66 0.15 -1.26 -4.85 113.70 119.36 1pq7 s SER 111 Ca 0.60 2.20 0.00 0.00 0.70 0.00 0.00 55.95 59.45 1pq7 s SER 111 Cb -0.09 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.60 1pq7 s SER 111 CO 0.17 -0.11 0.00 0.61 1.20 0.00 0.00 173.24 175.12 1pq7 n GLY 112 N 1.36 4.27 7.00 9.45 0.00 0.16 -5.00 105.19 122.43 1pq7 n GLY 112 Ca -0.01 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.01 1pq7 n GLY 112 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pq7 n GLY 113 N -1.64 2.56 0.36 -0.02 0.00 -1.26 -1.73 105.19 103.46 1pq7 n GLY 113 Ca 0.00 -0.35 0.08 0.00 0.00 0.00 0.00 46.02 45.75 1pq7 n GLY 113 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pq7 n ASN 114 N 4.26 1.07 -4.74 1.61 3.02 -1.26 -4.78 115.26 114.44 1pq7 n ASN 114 Ca 0.00 -1.74 -0.36 0.00 -0.03 0.00 0.00 54.58 52.46 1pq7 n ASN 114 Cb 0.00 -0.09 -0.08 0.00 -0.61 0.00 0.00 39.78 39.00 1pq7 n ASN 114 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1pq7 s ILE 115 N -1.81 5.02 0.31 2.41 1.01 -0.70 -4.46 121.20 122.97 1pq7 s ILE 115 Ca 0.25 0.04 -0.12 0.00 0.00 0.00 0.00 60.65 60.81 1pq7 s ILE 115 Cb 0.13 -3.21 0.01 0.00 0.01 0.00 0.00 42.46 39.40 1pq7 s ILE 115 CO 0.19 0.55 0.58 -0.83 0.00 0.00 0.00 174.94 175.43 1pq7 s GLY 116 N -0.40 0.64 0.05 6.18 0.00 -0.61 -0.66 107.32 112.52 1pq7 s GLY 116 Ca 0.10 -0.92 0.01 0.00 0.00 0.00 0.00 44.72 43.91 1pq7 s GLY 116 CO 0.02 -0.57 0.10 -0.19 0.00 0.00 0.00 173.10 172.46 1pq7 s TYR 117 N -3.39 3.27 0.43 1.90 2.02 -1.26 -2.79 117.35 117.53 1pq7 s TYR 117 Ca 0.21 0.15 -0.24 0.00 -0.37 0.00 0.00 57.07 56.82 1pq7 s TYR 117 Cb -0.02 -1.68 -0.08 0.00 -0.40 0.00 0.00 41.96 39.78 1pq7 s TYR 117 CO 0.12 0.54 1.16 0.00 -1.57 0.00 0.00 175.55 175.80 1pq7 s ALA 118 N -1.34 3.05 -0.10 3.71 0.00 -0.38 -4.83 121.76 121.88 1pq7 s ALA 118 Ca 0.28 0.93 -0.06 0.00 0.00 0.00 0.00 51.96 53.11 1pq7 s ALA 118 Cb -0.12 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 1pq7 s ALA 118 CO 0.20 -0.57 0.14 1.03 0.00 0.00 0.00 175.76 176.55 1pq7 s ARG 119 N -2.53 3.40 0.07 0.00 1.81 -1.26 -4.90 118.95 115.54 1pq7 s ARG 119 Ca 0.61 -0.18 0.03 0.00 -1.72 0.00 0.00 55.73 54.47 1pq7 s ARG 119 Cb -0.29 -3.15 -0.04 0.00 -0.45 0.00 0.00 34.95 31.03 1pq7 s ARG 119 CO 0.36 0.76 0.06 -0.51 -0.68 0.00 0.00 175.30 175.28 1pq7 s LEU 120 N -1.16 3.72 0.47 2.53 1.43 -1.26 -0.66 118.68 123.75 1pq7 s LEU 120 Ca 0.17 -0.03 -0.24 0.00 -1.03 0.00 0.00 54.13 53.00 1pq7 s LEU 120 Cb -0.12 -2.38 -0.08 0.00 0.03 0.00 0.00 46.19 43.64 1pq7 s LEU 120 CO 0.06 0.19 1.31 0.00 0.23 0.00 0.00 176.35 178.14 1pq7 n ALA 121 N 0.59 1.47 -1.74 4.21 0.00 -0.15 -4.81 120.51 120.09 1pq7 n ALA 121 Ca -0.10 0.21 -0.39 0.00 0.00 0.00 0.00 53.44 53.17 1pq7 n ALA 121 Cb 0.52 -2.31 0.04 0.00 0.00 0.00 0.00 19.45 17.70 1pq7 n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pq7 n ALA 122 N -0.51 1.53 -1.69 0.00 0.00 -1.26 -4.40 120.51 114.18 1pq7 n ALA 122 Ca 0.08 0.13 -0.44 0.00 0.00 0.00 0.00 53.44 53.21 1pq7 n ALA 122 Cb 0.42 -2.34 -0.03 0.00 0.00 0.00 0.00 19.45 17.49 1pq7 n ALA 122 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1pq7 n SER 123 N -0.91 3.44 0.00 0.00 2.88 -1.26 -1.52 113.62 116.24 1pq7 n SER 123 Ca 0.10 1.09 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 1pq7 n SER 123 Cb 0.44 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.41 1pq7 n SER 123 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1pq7 n GLY 124 N 3.35 1.05 3.82 0.46 0.00 0.05 -5.04 105.19 108.88 1pq7 n GLY 124 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1pq7 n GLY 124 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pq7 s SER 125 N -3.05 5.54 -0.12 1.61 1.04 -0.58 -4.94 113.70 113.20 1pq7 s SER 125 Ca 0.00 1.66 -0.05 0.00 0.48 0.00 0.00 55.95 58.05 1pq7 s SER 125 Cb 0.00 -2.51 0.06 0.00 0.10 0.00 0.00 66.02 63.67 1pq7 s SER 125 CO 0.00 -1.33 0.25 -0.62 0.98 0.00 0.00 173.24 172.51 1pq7 s ASP 126 N -3.51 0.25 0.30 7.02 2.15 -1.26 -4.11 116.67 117.51 1pq7 s ASP 126 Ca 0.59 0.54 -0.30 0.00 0.43 0.00 0.00 52.55 53.82 1pq7 s ASP 126 Cb -0.14 0.58 -0.12 0.00 -0.30 0.00 0.00 42.92 42.94 1pq7 s ASP 126 CO 0.49 -0.22 1.56 -2.65 -0.17 0.00 0.00 175.17 174.18 1pq7 n PRO 127 N 5.08 2.62 -2.95 4.34 -0.02 -1.26 -4.93 135.00 137.89 1pq7 n PRO 127 Ca -0.11 0.93 -0.40 0.00 -2.02 0.00 0.00 63.50 61.90 1pq7 n PRO 127 Cb 0.50 -2.69 -0.05 0.00 -0.02 0.00 0.00 33.50 31.25 1pq7 n PRO 127 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1pq7 s VAL 128 N -0.15 4.82 0.22 -1.45 1.01 -1.26 -4.98 120.40 118.61 1pq7 s VAL 128 Ca 0.63 1.67 -0.31 0.00 0.00 0.00 0.00 61.98 63.96 1pq7 s VAL 128 Cb -0.51 -4.14 -0.15 0.00 0.00 0.00 0.00 36.38 31.59 1pq7 s VAL 128 CO 0.51 0.30 1.22 0.00 0.00 0.00 0.00 175.10 177.13 1pq7 n ALA 129 N 3.22 -0.00 0.00 5.51 0.00 -1.26 -1.50 120.51 126.47 1pq7 n ALA 129 Ca -0.01 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1pq7 n ALA 129 Cb 0.51 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.84 1pq7 n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pq7 n GLY 130 N 1.90 2.88 3.74 0.00 0.00 0.13 -4.93 105.19 108.90 1pq7 n GLY 130 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 1pq7 n GLY 130 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pq7 s SER 131 N -1.36 3.89 0.25 1.61 1.04 -0.56 -4.67 113.70 113.89 1pq7 s SER 131 Ca 0.00 1.58 -0.12 0.00 0.48 0.00 0.00 55.95 57.88 1pq7 s SER 131 Cb 0.00 -2.27 -0.08 0.00 0.10 0.00 0.00 66.02 63.77 1pq7 s SER 131 CO 0.00 -2.39 0.61 -0.55 0.98 0.00 0.00 173.24 171.89 1pq7 s SER 132 N -3.45 6.72 0.03 7.02 0.15 -1.26 -0.88 113.70 122.03 1pq7 s SER 132 Ca 0.62 1.07 -0.04 0.00 0.70 0.00 0.00 55.95 58.31 1pq7 s SER 132 Cb -0.17 -2.29 -0.02 0.00 -1.71 0.00 0.00 66.02 61.83 1pq7 s SER 132 CO 0.56 -0.09 0.05 0.00 1.20 0.00 0.00 173.24 174.97 1pq7 s ALA 133 N -1.81 0.04 -0.07 5.45 0.00 -0.05 -3.64 121.76 121.68 1pq7 s ALA 133 Ca 0.48 -0.62 0.03 0.00 0.00 0.00 0.00 51.96 51.85 1pq7 s ALA 133 Cb -0.12 0.21 0.01 0.00 0.00 0.00 0.00 23.12 23.22 1pq7 s ALA 133 CO 0.20 -0.27 -0.15 0.99 0.00 0.00 0.00 175.76 176.53 1pq7 s THR 134 N -2.37 1.33 0.10 0.00 2.01 -0.21 -0.76 115.64 115.74 1pq7 s THR 134 Ca -0.07 -0.60 0.10 0.00 0.31 0.00 0.00 61.69 61.43 1pq7 s THR 134 Cb -0.03 -1.19 -0.04 0.00 0.01 0.00 0.00 72.50 71.25 1pq7 s THR 134 CO -0.04 0.40 -0.26 0.54 -0.69 0.00 0.00 174.62 174.57 1pq7 s VAL 135 N 0.53 2.15 0.02 3.82 0.11 -0.20 -0.52 120.40 126.30 1pq7 s VAL 135 Ca -0.14 -1.61 -0.01 0.00 -2.93 0.00 0.00 61.98 57.29 1pq7 s VAL 135 Cb -0.16 -1.89 -0.02 0.00 -1.53 0.00 0.00 36.38 32.79 1pq7 s VAL 135 CO 0.05 0.17 -0.01 0.00 -3.33 0.00 0.00 175.10 171.97 1pq7 s ALA 136 N -0.98 0.06 0.00 1.54 0.00 -1.00 -1.09 121.76 120.29 1pq7 s ALA 136 Ca 0.12 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1pq7 s ALA 136 Cb -0.10 0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.16 1pq7 s ALA 136 CO 0.04 -0.16 0.00 0.41 0.00 0.00 0.00 175.76 176.05 1pq7 n GLY 137 N 1.64 -1.39 1.18 0.00 0.00 -0.30 -4.21 105.19 102.11 1pq7 n GLY 137 Ca -0.23 -1.04 0.08 0.00 0.00 0.00 0.00 46.02 44.82 1pq7 n GLY 137 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1pq7 n TRP 138 N 0.01 1.11 -1.57 1.61 8.01 -1.26 -2.02 117.44 123.34 1pq7 n TRP 138 Ca 0.00 -0.66 -0.29 0.00 -1.31 0.00 0.00 57.50 55.25 1pq7 n TRP 138 Cb 0.00 -0.22 0.21 0.00 -2.01 0.00 0.00 31.31 29.29 1pq7 n TRP 138 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1pq7 n GLY 139 N 0.52 -1.97 3.76 6.99 0.00 -1.25 -4.28 105.19 108.96 1pq7 n GLY 139 Ca 0.21 -1.63 -0.39 0.00 0.00 0.00 0.00 46.02 44.21 1pq7 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pq7 s ALA 140 N -3.62 2.98 -1.32 4.61 0.00 -0.27 -3.09 121.76 121.05 1pq7 s ALA 140 Ca 0.71 1.42 0.25 0.00 0.00 0.00 0.00 51.96 54.34 1pq7 s ALA 140 Cb -0.04 -3.59 0.53 0.00 0.00 0.00 0.00 23.12 20.02 1pq7 s ALA 140 CO 0.52 -1.35 1.42 0.25 0.00 0.00 0.00 175.76 176.60 1pq7 n THR 141 N -0.72 0.00 -3.84 0.00 -2.24 -1.25 -0.80 114.28 105.42 1pq7 n THR 141 Ca 0.08 -0.06 -0.12 0.00 -2.27 0.00 0.00 64.05 61.69 1pq7 n THR 141 Cb 0.43 0.40 -0.12 0.00 -2.10 0.00 0.00 70.33 68.94 1pq7 n THR 141 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1pq7 s SER 142 N -2.79 -0.09 0.10 3.42 0.15 -1.26 -4.52 113.70 108.71 1pq7 s SER 142 Ca 0.16 0.15 -0.22 0.00 0.70 0.00 0.00 55.95 56.74 1pq7 s SER 142 Cb 0.18 0.24 -0.13 0.00 -1.71 0.00 0.00 66.02 64.61 1pq7 s SER 142 CO 0.64 -0.10 0.48 -1.84 1.20 0.00 0.00 173.24 173.61 1pq7 n GLU 143 N 2.72 0.00 -0.70 5.44 0.00 -1.26 -1.19 120.64 125.65 1pq7 n GLU 143 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.02 1pq7 n GLU 143 Cb 0.58 -0.80 0.00 0.00 0.00 0.00 0.00 31.44 31.22 1pq7 n GLU 143 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1pq7 n GLY 144 N 1.31 0.00 3.76 -1.84 0.00 -1.26 -4.89 105.19 102.26 1pq7 n GLY 144 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 1pq7 n GLY 144 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pq7 s GLY 145 N -1.45 2.73 -0.18 -0.02 0.00 -0.33 -4.94 107.32 103.13 1pq7 s GLY 145 Ca 0.00 0.99 0.12 0.00 0.00 0.00 0.00 44.72 45.83 1pq7 s GLY 145 CO 0.00 1.38 0.12 1.44 0.00 0.00 0.00 173.10 176.04 1pq7 n SER 146 N -1.51 0.77 -4.85 1.64 7.64 -1.26 -4.85 113.62 111.20 1pq7 n SER 146 Ca 0.13 0.05 -0.33 0.00 1.01 0.00 0.00 58.87 59.74 1pq7 n SER 146 Cb 0.50 0.36 -0.06 0.00 -1.01 0.00 0.00 64.21 63.99 1pq7 n SER 146 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1pq7 s SER 147 N -5.95 6.79 0.07 6.43 0.01 -1.26 -5.07 113.70 114.72 1pq7 s SER 147 Ca -0.16 1.29 0.01 0.00 1.31 0.00 0.00 55.95 58.40 1pq7 s SER 147 Cb 0.07 -2.38 -0.04 0.00 0.21 0.00 0.00 66.02 63.89 1pq7 s SER 147 CO 0.77 -0.19 -0.05 0.42 0.41 0.00 0.00 173.24 174.60 1pq7 s THR 148 N -1.96 0.47 0.46 1.44 -4.23 -1.26 -4.48 115.64 106.08 1pq7 s THR 148 Ca 0.53 -1.77 -0.21 0.00 -1.18 0.00 0.00 61.69 59.07 1pq7 s THR 148 Cb -0.11 -1.46 -0.09 0.00 1.34 0.00 0.00 72.50 72.18 1pq7 s THR 148 CO 0.18 -0.86 1.01 -2.16 -0.54 0.00 0.00 174.62 172.25 1pq7 s PRO 149 N -3.56 3.95 0.01 3.99 0.04 -1.26 -4.97 135.00 133.20 1pq7 s PRO 149 Ca 0.07 1.31 -0.25 0.00 0.04 0.00 0.00 61.00 62.17 1pq7 s PRO 149 Cb 0.04 -2.15 -0.18 0.00 0.04 0.00 0.00 34.50 32.25 1pq7 s PRO 149 CO -0.06 -0.30 1.37 0.28 0.04 0.00 0.00 177.00 178.33 1pq7 h VAL 150 N 1.71 1.31 -2.94 -0.36 2.07 -1.94 -3.45 116.25 112.64 1pq7 h VAL 150 Ca -0.49 -0.95 -0.61 0.00 0.82 0.00 0.00 66.70 65.47 1pq7 h VAL 150 Cb 1.21 1.90 -0.06 0.00 -1.52 0.00 0.00 31.29 32.82 1pq7 h VAL 150 CO 0.60 0.25 -0.54 0.20 0.02 0.00 0.00 177.57 178.10 1pq7 s ASN 151 N -5.66 6.00 0.25 0.57 0.02 -1.26 -3.85 114.94 111.01 1pq7 s ASN 151 Ca -0.15 0.13 -0.31 0.00 -1.02 0.00 0.00 52.86 51.50 1pq7 s ASN 151 Cb 0.03 -1.74 -0.13 0.00 0.02 0.00 0.00 41.25 39.43 1pq7 s ASN 151 CO 0.68 0.15 1.46 -0.11 0.02 0.00 0.00 177.10 179.30 1pq7 n LEU 152 N 0.19 3.40 -4.70 0.60 7.94 -0.00 -4.92 117.00 119.50 1pq7 n LEU 152 Ca -0.07 1.14 -0.24 0.00 -1.11 0.00 0.00 56.01 55.73 1pq7 n LEU 152 Cb 0.52 -1.47 -0.07 0.00 0.53 0.00 0.00 43.42 42.94 1pq7 n LEU 152 CO 0.48 -0.33 -0.28 -0.76 -1.11 0.00 0.00 177.39 175.39 1pq7 s LEU 153 N 0.02 3.41 0.04 -1.96 1.43 -0.86 -1.32 118.68 119.44 1pq7 s LEU 153 Ca 0.68 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 53.31 1pq7 s LEU 153 Cb -0.61 -1.98 -0.03 0.00 0.03 0.00 0.00 46.19 43.60 1pq7 s LEU 153 CO 0.49 0.02 -0.00 -1.59 0.23 0.00 0.00 176.35 175.50 1pq7 s LYS 154 N -3.47 0.53 -0.02 1.70 -2.85 0.18 -1.15 119.74 114.65 1pq7 s LYS 154 Ca 0.31 -0.96 -0.13 0.00 -1.00 0.00 0.00 55.97 54.19 1pq7 s LYS 154 Cb -0.08 0.19 0.02 0.00 -2.06 0.00 0.00 37.83 35.90 1pq7 s LYS 154 CO 0.21 -0.10 0.27 0.54 0.10 0.00 0.00 175.35 176.36 1pq7 s VAL 155 N -2.99 0.06 -0.16 1.79 0.11 -0.25 -0.89 120.40 118.07 1pq7 s VAL 155 Ca -0.02 -0.47 -0.04 0.00 -2.93 0.00 0.00 61.98 58.53 1pq7 s VAL 155 Cb 0.01 -0.55 -0.03 0.00 -1.53 0.00 0.00 36.38 34.28 1pq7 s VAL 155 CO -0.07 -0.26 -0.03 -0.89 -3.33 0.00 0.00 175.10 170.53 1pq7 s THR 156 N -1.16 3.96 0.03 5.04 2.01 -1.26 -1.04 115.64 123.22 1pq7 s THR 156 Ca -0.12 -0.33 0.00 0.00 0.31 0.00 0.00 61.69 61.55 1pq7 s THR 156 Cb -0.05 -2.74 -0.02 0.00 0.01 0.00 0.00 72.50 69.69 1pq7 s THR 156 CO 0.03 0.49 -0.04 0.68 -0.69 0.00 0.00 174.62 175.10 1pq7 s VAL 157 N 0.36 0.18 0.44 3.82 -7.23 0.06 -4.97 120.40 113.06 1pq7 s VAL 157 Ca -0.04 -1.08 -0.21 0.00 -1.81 0.00 0.00 61.98 58.84 1pq7 s VAL 157 Cb -0.14 -0.51 -0.11 0.00 0.56 0.00 0.00 36.38 36.18 1pq7 s VAL 157 CO 0.03 -0.57 0.95 -2.16 -0.31 0.00 0.00 175.10 173.04 1pq7 s PRO 158 N -1.90 4.21 0.34 4.82 0.04 -1.26 -0.87 135.00 140.38 1pq7 s PRO 158 Ca -0.11 1.12 -0.29 0.00 0.04 0.00 0.00 61.00 61.76 1pq7 s PRO 158 Cb -0.07 -2.18 -0.11 0.00 0.04 0.00 0.00 34.50 32.19 1pq7 s PRO 158 CO -0.02 -0.05 1.40 0.42 0.04 0.00 0.00 177.00 178.79 1pq7 s ILE 159 N -2.20 2.44 -0.14 0.56 -1.09 -0.06 -1.39 121.20 119.32 1pq7 s ILE 159 Ca 0.62 0.43 -0.04 0.00 -2.23 0.00 0.00 60.65 59.43 1pq7 s ILE 159 Cb -0.09 -3.27 -0.03 0.00 -1.58 0.00 0.00 42.46 37.48 1pq7 s ILE 159 CO 0.14 0.10 -0.01 -0.69 -1.23 0.00 0.00 174.94 173.25 1pq7 s VAL 160 N -0.94 4.18 0.62 2.92 1.01 -0.18 -0.70 120.40 127.31 1pq7 s VAL 160 Ca 0.52 -0.26 -0.18 0.00 0.00 0.00 0.00 61.98 62.06 1pq7 s VAL 160 Cb -0.43 -2.82 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 1pq7 s VAL 160 CO 0.55 0.51 1.10 -1.54 0.00 0.00 0.00 175.10 175.72 1pq7 n SER 161 N 3.21 1.29 -0.15 3.32 3.41 -1.26 -4.04 113.62 119.40 1pq7 n SER 161 Ca -0.17 0.81 0.03 0.00 -0.26 0.00 0.00 58.87 59.28 1pq7 n SER 161 Cb 0.53 -1.46 0.32 0.00 -0.26 0.00 0.00 64.21 63.34 1pq7 n SER 161 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1pq7 h ARG 162 N 0.49 0.81 -0.26 4.33 2.43 -1.94 0.12 114.38 120.36 1pq7 h ARG 162 Ca -0.49 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 58.62 1pq7 h ARG 162 Cb 1.35 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.71 1pq7 h ARG 162 CO 0.52 0.54 0.16 0.00 -1.51 0.00 0.00 179.97 179.67 1pq7 h ALA 163 N 1.60 0.34 -0.70 2.80 0.00 -1.99 0.92 119.26 122.23 1pq7 h ALA 163 Ca 0.26 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 1pq7 h ALA 163 Cb -0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1pq7 h ALA 163 CO -0.07 -0.16 0.20 1.15 0.00 0.00 0.00 179.25 180.38 1pq7 h THR 164 N 0.33 1.25 -0.77 0.00 2.02 -1.76 -1.24 112.91 112.74 1pq7 h THR 164 Ca 0.09 -0.90 -0.03 0.00 0.77 0.00 0.00 66.41 66.35 1pq7 h THR 164 Cb 0.02 0.50 -0.04 0.00 -1.74 0.00 0.00 68.15 66.89 1pq7 h THR 164 CO -0.02 0.35 0.36 0.00 0.37 0.00 0.00 175.52 176.58 1pq7 h ARG 166 N 1.10 0.17 -0.71 0.00 3.08 -0.48 -0.67 114.38 116.87 1pq7 h ARG 166 Ca 0.27 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.22 1pq7 h ARG 166 Cb 0.12 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 1pq7 h ARG 166 CO -0.03 0.54 0.34 0.00 -1.07 0.00 0.00 179.97 179.75 1pq7 h ALA 167 N 1.46 1.27 -0.11 0.04 0.00 -0.29 0.18 119.26 121.81 1pq7 h ALA 167 Ca 0.01 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 1pq7 h ALA 167 Cb 0.76 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.27 1pq7 h ALA 167 CO 0.06 0.57 -0.43 1.96 0.00 0.00 0.00 179.25 181.40 1pq7 h GLN 168 N 1.00 0.48 0.00 0.00 4.20 -0.63 -3.39 115.11 116.78 1pq7 h GLN 168 Ca 0.25 -0.38 0.00 0.00 0.06 0.00 0.00 58.65 58.58 1pq7 h GLN 168 Cb 0.10 0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1pq7 h GLN 168 CO -0.03 1.00 -0.96 0.66 -0.67 0.00 0.00 178.83 178.83 1pq7 n TYR 169 N -4.29 0.00 0.00 2.96 4.01 -0.32 -5.05 117.16 114.47 1pq7 n TYR 169 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 1pq7 n TYR 169 Cb 0.56 -0.11 0.00 0.00 -0.31 0.00 0.00 39.34 39.48 1pq7 n TYR 169 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pq7 n GLY 170 N 1.57 2.61 0.06 2.72 0.00 0.64 -4.65 105.19 108.14 1pq7 n GLY 170 Ca 0.00 -1.81 -0.13 0.00 0.00 0.00 0.00 46.02 44.08 1pq7 n GLY 170 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1pq7 h THR 171 N 0.00 1.10 0.00 2.61 2.02 -1.93 -3.04 112.91 113.67 1pq7 h THR 171 Ca 0.00 -0.43 -0.06 0.00 0.77 0.00 0.00 66.41 66.69 1pq7 h THR 171 Cb 0.00 1.39 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 1pq7 h THR 171 CO 0.00 0.11 -0.27 0.28 0.37 0.00 0.00 175.52 176.01 1pq7 h SER 172 N -0.24 0.00 0.69 4.18 0.02 -1.93 -3.16 113.55 113.11 1pq7 h SER 172 Ca -0.01 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 1pq7 h SER 172 Cb 0.22 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 1pq7 h SER 172 CO 0.01 0.27 -0.37 0.00 -1.14 0.00 0.00 176.83 175.60 1pq7 h ALA 173 N 1.73 1.09 -3.24 3.77 0.00 -1.80 -3.39 119.26 117.42 1pq7 h ALA 173 Ca -0.00 -0.34 -0.68 0.00 0.00 0.00 0.00 54.91 53.89 1pq7 h ALA 173 Cb 0.57 -0.06 -0.30 0.00 0.00 0.00 0.00 17.79 18.00 1pq7 h ALA 173 CO 0.03 0.46 -0.69 0.42 0.00 0.00 0.00 179.25 179.47 1pq7 s ILE 174 N -3.77 3.26 0.54 0.00 -1.09 -1.20 -4.98 121.20 113.96 1pq7 s ILE 174 Ca -0.01 -1.01 0.09 0.00 -2.23 0.00 0.00 60.65 57.49 1pq7 s ILE 174 Cb 0.12 -2.72 0.06 0.00 -1.58 0.00 0.00 42.46 38.35 1pq7 s ILE 174 CO 0.69 0.08 0.69 0.42 -1.23 0.00 0.00 174.94 175.59 1pq7 s THR 175 N 1.36 2.25 -1.33 2.92 -4.23 -1.26 -4.95 115.64 110.40 1pq7 s THR 175 Ca -0.00 -1.07 0.13 0.00 -1.18 0.00 0.00 61.69 59.57 1pq7 s THR 175 Cb -0.18 -2.32 0.21 0.00 1.34 0.00 0.00 72.50 71.55 1pq7 s THR 175 CO -0.01 0.00 1.37 0.59 -0.54 0.00 0.00 174.62 176.02 1pq7 n ASN 176 N -2.10 0.00 -1.30 3.99 3.02 -1.26 -2.01 115.26 115.60 1pq7 n ASN 176 Ca 0.12 0.19 0.09 0.00 -0.03 0.00 0.00 54.58 54.94 1pq7 n ASN 176 Cb 0.61 -0.34 0.31 0.00 -0.61 0.00 0.00 39.78 39.76 1pq7 n ASN 176 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pq7 n GLN 177 N -1.34 3.47 -4.26 3.52 3.00 -1.26 -4.82 117.38 115.69 1pq7 n GLN 177 Ca 0.06 -2.74 -0.22 0.00 -0.01 0.00 0.00 57.00 54.09 1pq7 n GLN 177 Cb 0.12 -1.78 -0.12 0.00 0.00 0.00 0.00 30.24 28.46 1pq7 n GLN 177 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.06 175.42 1pq7 s MET 178 N -1.87 1.06 0.16 -1.09 -1.94 -0.85 -1.33 119.30 113.44 1pq7 s MET 178 Ca 0.45 -1.14 0.00 0.00 -1.71 0.00 0.00 55.69 53.29 1pq7 s MET 178 Cb 0.30 -1.23 -0.04 0.00 2.01 0.00 0.00 34.83 35.87 1pq7 s MET 178 CO 0.20 0.28 0.05 -0.59 -0.01 0.00 0.00 175.02 174.95 1pq7 s PHE 179 N -1.33 1.07 0.19 -0.03 -0.12 -0.42 -4.74 117.98 112.60 1pq7 s PHE 179 Ca 0.05 -1.19 0.10 0.00 -0.05 0.00 0.00 56.93 55.84 1pq7 s PHE 179 Cb -0.09 -0.59 -0.04 0.00 -0.63 0.00 0.00 43.02 41.66 1pq7 s PHE 179 CO 0.04 -0.43 -0.19 0.00 -0.05 0.00 0.00 175.22 174.59 1pq7 s ALA 181 N -2.09 -1.44 0.00 0.00 0.00 -0.45 -1.01 121.76 116.78 1pq7 s ALA 181 Ca 0.19 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.47 1pq7 s ALA 181 Cb -0.06 -0.48 0.00 0.00 0.00 0.00 0.00 23.12 22.59 1pq7 s ALA 181 CO 0.08 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 175.95 1pq7 n GLY 182 N 1.91 -2.46 3.39 0.00 0.00 -0.49 -1.12 105.19 106.42 1pq7 n GLY 182 Ca -0.17 -1.39 -0.29 0.00 0.00 0.00 0.00 46.02 44.17 1pq7 n GLY 182 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1pq7 s VAL 183 N -1.97 2.26 0.33 1.61 -7.23 -1.26 -4.18 120.40 109.96 1pq7 s VAL 183 Ca 0.00 -1.70 0.02 0.00 -1.81 0.00 0.00 61.98 58.49 1pq7 s VAL 183 Cb 0.00 -1.99 0.28 0.00 0.56 0.00 0.00 36.38 35.23 1pq7 s VAL 183 CO 0.00 0.13 1.96 -1.28 -0.31 0.00 0.00 175.10 175.60 1pq7 h SER 184 N 4.00 0.80 0.53 4.85 0.87 -1.98 -1.02 113.55 121.60 1pq7 h SER 184 Ca -0.50 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 1pq7 h SER 184 Cb 1.17 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1pq7 h SER 184 CO 0.40 0.55 0.00 -1.54 -0.53 0.00 0.00 176.83 175.70 1pq7 n SER 185 N -4.46 0.00 -0.51 6.23 3.41 -1.26 -1.03 113.62 116.00 1pq7 n SER 185 Ca 0.10 0.30 0.00 0.00 -0.26 0.00 0.00 58.87 59.01 1pq7 n SER 185 Cb 0.14 -0.41 -0.00 0.00 -0.26 0.00 0.00 64.21 63.67 1pq7 n SER 185 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1pq7 n GLY 186 N 0.40 -1.52 0.59 5.00 0.00 -0.39 -4.23 105.19 105.05 1pq7 n GLY 186 Ca 0.06 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1pq7 n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pq7 n GLY 187 N -0.04 0.59 2.69 -0.02 0.00 -0.07 -4.83 105.19 103.51 1pq7 n GLY 187 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1pq7 n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pq7 s LYS 188 N -0.80 0.13 0.03 1.61 1.02 -1.26 -3.55 119.74 116.92 1pq7 s LYS 188 Ca 0.00 0.20 -0.29 0.00 0.02 0.00 0.00 55.97 55.90 1pq7 s LYS 188 Cb 0.00 -0.91 0.10 0.00 -0.52 0.00 0.00 37.83 36.50 1pq7 s LYS 188 CO 0.00 -0.40 1.16 0.34 -0.92 0.00 0.00 175.35 175.54 1pq7 s ASP 189 N 2.11 -0.11 0.57 2.83 -1.08 -0.82 -4.57 116.67 115.58 1pq7 s ASP 189 Ca 0.04 -0.21 -0.07 0.00 -0.52 0.00 0.00 52.55 51.79 1pq7 s ASP 189 Cb -0.13 0.27 -0.01 0.00 -1.46 0.00 0.00 42.92 41.59 1pq7 s ASP 189 CO -0.05 -0.50 0.91 -0.94 0.52 0.00 0.00 175.17 175.11 1pq7 s SER 190 N -2.89 5.92 0.00 -0.34 1.04 -1.26 -0.63 113.70 115.54 1pq7 s SER 190 Ca 0.13 0.96 0.00 0.00 0.48 0.00 0.00 55.95 57.52 1pq7 s SER 190 Cb 0.02 -2.05 0.00 0.00 0.10 0.00 0.00 66.02 64.09 1pq7 s SER 190 CO -0.02 -0.89 0.00 0.00 0.98 0.00 0.00 173.24 173.31 1pq7 s GLN 192 N 1.01 4.32 0.00 0.00 1.11 -1.26 -0.75 119.66 124.08 1pq7 s GLN 192 Ca 0.00 2.14 0.00 0.00 0.01 0.00 0.00 55.36 57.51 1pq7 s GLN 192 Cb 0.00 -3.20 0.00 0.00 -1.01 0.00 0.00 33.01 28.80 1pq7 s GLN 192 CO 0.00 -0.41 0.00 0.41 0.01 0.00 0.00 175.29 175.30 1pq7 n GLY 193 N 3.09 1.74 0.03 3.09 0.00 -1.26 -1.11 105.19 110.77 1pq7 n GLY 193 Ca 0.10 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.24 1pq7 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pq7 n ASP 194 N 0.00 0.53 -4.60 1.61 8.00 0.07 -3.82 116.55 118.33 1pq7 n ASP 194 Ca 0.00 0.06 -0.42 0.00 0.71 0.00 0.00 54.79 55.14 1pq7 n ASP 194 Cb 0.00 0.05 0.01 0.00 -0.02 0.00 0.00 41.12 41.15 1pq7 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1pq7 n SER 195 N -1.80 1.23 0.00 -2.24 7.64 -1.23 -1.91 113.62 115.31 1pq7 n SER 195 Ca 0.05 1.05 0.00 0.00 1.01 0.00 0.00 58.87 60.98 1pq7 n SER 195 Cb 0.38 -1.34 0.00 0.00 -1.01 0.00 0.00 64.21 62.24 1pq7 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pq7 n GLY 196 N 1.20 3.05 3.80 0.23 0.00 0.13 -0.78 105.19 112.81 1pq7 n GLY 196 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 1pq7 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pq7 s GLY 197 N -1.37 1.64 0.25 -0.02 0.00 -0.80 -3.58 107.32 103.44 1pq7 s GLY 197 Ca 0.00 -0.85 -0.21 0.00 0.00 0.00 0.00 44.72 43.66 1pq7 s GLY 197 CO 0.00 -0.15 0.79 2.56 0.00 0.00 0.00 173.10 176.29 1pq7 s PRO 198 N -5.53 4.33 -0.10 2.90 0.04 -1.26 -1.10 135.00 134.28 1pq7 s PRO 198 Ca 0.68 0.99 0.04 0.00 0.04 0.00 0.00 61.00 62.75 1pq7 s PRO 198 Cb -0.10 -2.84 -0.00 0.00 0.04 0.00 0.00 34.50 31.60 1pq7 s PRO 198 CO 0.53 0.35 -0.22 -1.50 0.04 0.00 0.00 177.00 176.20 1pq7 s ILE 199 N -1.57 2.21 0.24 0.56 2.07 -0.78 -2.39 121.20 121.55 1pq7 s ILE 199 Ca 0.45 -0.97 0.11 0.00 -1.41 0.00 0.00 60.65 58.84 1pq7 s ILE 199 Cb -0.17 -1.85 -0.05 0.00 0.13 0.00 0.00 42.46 40.52 1pq7 s ILE 199 CO 0.21 0.56 -0.19 0.68 -1.91 0.00 0.00 174.94 174.29 1pq7 s VAL 200 N 0.25 2.57 0.64 4.00 -7.23 0.32 -1.07 120.40 119.88 1pq7 s VAL 200 Ca -0.15 -2.18 -0.10 0.00 -1.81 0.00 0.00 61.98 57.73 1pq7 s VAL 200 Cb -0.17 -2.30 0.15 0.00 0.56 0.00 0.00 36.38 34.61 1pq7 s VAL 200 CO 0.08 -0.28 0.87 -0.90 -0.31 0.00 0.00 175.10 174.56 1pq7 n ASP 201 N -0.28 0.10 0.16 4.85 5.68 -0.35 -1.04 116.55 125.67 1pq7 n ASP 201 Ca -0.08 -1.33 0.13 0.00 -0.50 0.00 0.00 54.79 53.00 1pq7 n ASP 201 Cb 0.58 -0.66 0.58 0.00 -1.14 0.00 0.00 41.12 40.48 1pq7 n ASP 201 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1pq7 h SER 202 N -1.12 0.00 -0.07 -1.12 4.64 -1.90 -1.21 113.55 112.76 1pq7 h SER 202 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1pq7 h SER 202 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1pq7 h SER 202 CO 0.20 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.96 1pq7 n SER 203 N -2.35 1.95 -0.47 4.97 7.64 -1.26 -4.95 113.62 119.15 1pq7 n SER 203 Ca 0.00 -1.67 -0.06 0.00 1.01 0.00 0.00 58.87 58.15 1pq7 n SER 203 Cb 0.16 -0.04 -0.03 0.00 -1.01 0.00 0.00 64.21 63.29 1pq7 n SER 203 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1pq7 n ASN 204 N 0.52 -4.06 -4.74 6.43 3.02 -0.46 -5.03 115.26 110.94 1pq7 n ASN 204 Ca 0.17 0.15 -0.41 0.00 -0.03 0.00 0.00 54.58 54.47 1pq7 n ASN 204 Cb 0.41 -2.10 -0.05 0.00 -0.61 0.00 0.00 39.78 37.43 1pq7 n ASN 204 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1pq7 s THR 205 N -2.12 4.12 -0.31 3.41 2.01 -1.26 -4.78 115.64 116.71 1pq7 s THR 205 Ca 0.00 1.95 -0.29 0.00 0.31 0.00 0.00 61.69 63.66 1pq7 s THR 205 Cb 0.00 -4.24 0.00 0.00 0.01 0.00 0.00 72.50 68.27 1pq7 s THR 205 CO 0.00 0.39 1.32 -0.22 -0.69 0.00 0.00 174.62 175.42 1pq7 s LEU 206 N -0.69 3.86 -0.02 4.42 2.96 0.16 -1.21 118.68 128.16 1pq7 s LEU 206 Ca 0.45 1.19 0.18 0.00 -0.22 0.00 0.00 54.13 55.72 1pq7 s LEU 206 Cb -0.26 -3.54 -0.25 0.00 0.50 0.00 0.00 46.19 42.64 1pq7 s LEU 206 CO 0.33 -1.11 0.51 2.30 -1.32 0.00 0.00 176.35 177.05 1pq7 n ILE 207 N 6.28 0.00 -3.84 6.68 -5.35 -0.23 -0.98 119.36 121.92 1pq7 n ILE 207 Ca 0.15 -0.30 -0.02 0.00 -0.27 0.00 0.00 62.75 62.31 1pq7 n ILE 207 Cb 0.47 0.41 0.01 0.00 -1.74 0.00 0.00 39.64 38.79 1pq7 n ILE 207 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1pq7 s GLY 208 N -3.55 -0.02 -0.01 3.28 0.00 -0.87 -1.27 107.32 104.88 1pq7 s GLY 208 Ca -0.02 -0.13 0.07 0.00 0.00 0.00 0.00 44.72 44.64 1pq7 s GLY 208 CO 0.73 1.93 -0.23 0.00 0.00 0.00 0.00 173.10 175.52 1pq7 s ALA 209 N -2.42 1.94 0.16 3.20 0.00 -0.76 -1.87 121.76 122.02 1pq7 s ALA 209 Ca 0.20 -1.03 -0.34 0.00 0.00 0.00 0.00 51.96 50.79 1pq7 s ALA 209 Cb -0.02 -0.48 -0.14 0.00 0.00 0.00 0.00 23.12 22.49 1pq7 s ALA 209 CO 0.04 0.47 1.59 0.28 0.00 0.00 0.00 175.76 178.14 1pq7 n VAL 210 N 2.41 0.01 0.01 0.00 0.31 -0.26 -1.33 118.33 119.49 1pq7 n VAL 210 Ca -0.16 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1pq7 n VAL 210 Cb 0.52 -1.56 0.00 0.00 -0.91 0.00 0.00 33.84 31.89 1pq7 n VAL 210 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1pq7 n SER 211 N 3.50 0.14 -3.58 4.52 2.88 -0.94 -0.70 113.62 119.44 1pq7 n SER 211 Ca 0.17 0.04 -0.07 0.00 -1.33 0.00 0.00 58.87 57.68 1pq7 n SER 211 Cb 0.29 -0.02 -0.01 0.00 -0.75 0.00 0.00 64.21 63.72 1pq7 n SER 211 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1pq7 s TRP 212 N -1.18 -0.10 0.00 0.66 1.48 -0.69 -4.93 118.94 114.18 1pq7 s TRP 212 Ca 0.00 -0.42 0.00 0.00 -1.06 0.00 0.00 56.10 54.62 1pq7 s TRP 212 Cb 0.00 0.75 0.00 0.00 -1.16 0.00 0.00 33.47 33.06 1pq7 s TRP 212 CO 0.00 -1.32 0.00 0.41 -4.06 0.00 0.00 176.95 171.98 1pq7 n GLY 213 N -0.48 -0.46 3.46 3.67 0.00 -1.26 -0.57 105.19 109.55 1pq7 n GLY 213 Ca -0.05 -0.93 -0.43 0.00 0.00 0.00 0.00 46.02 44.60 1pq7 n GLY 213 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1pq7 s ASN 214 N 0.00 6.19 0.86 1.61 2.47 -1.26 -4.88 114.94 119.93 1pq7 s ASN 214 Ca 0.00 -0.91 0.00 0.00 0.42 0.00 0.00 52.86 52.37 1pq7 s ASN 214 Cb 0.00 -2.42 0.00 0.00 -1.45 0.00 0.00 41.25 37.38 1pq7 s ASN 214 CO 0.00 -1.43 0.00 0.61 -3.72 0.00 0.00 177.10 172.56 1pq7 n GLY 215 N 5.31 0.52 2.98 1.21 0.00 -1.26 -4.62 105.19 109.33 1pq7 n GLY 215 Ca -0.03 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.79 1pq7 n GLY 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pq7 n ALA 217 N 4.75 -0.27 -1.79 0.00 0.00 -1.26 -4.52 120.51 117.42 1pq7 n ALA 217 Ca -0.15 0.12 -0.35 0.00 0.00 0.00 0.00 53.44 53.06 1pq7 n ALA 217 Cb 0.48 -1.36 -0.05 0.00 0.00 0.00 0.00 19.45 18.52 1pq7 n ALA 217 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1pq7 s ARG 218 N -3.95 4.13 0.29 0.00 0.52 -1.26 -0.89 118.95 117.78 1pq7 s ARG 218 Ca 0.00 1.39 -0.30 0.00 -0.52 0.00 0.00 55.73 56.30 1pq7 s ARG 218 Cb 0.00 -2.40 -0.13 0.00 0.52 0.00 0.00 34.95 32.95 1pq7 s ARG 218 CO 0.00 -0.15 1.41 -2.30 0.02 0.00 0.00 175.30 174.28 1pq7 n PRO 219 N -0.32 2.22 -2.31 3.54 -0.02 -1.26 -2.90 135.00 133.94 1pq7 n PRO 219 Ca 0.06 0.79 -0.20 0.00 -2.02 0.00 0.00 63.50 62.13 1pq7 n PRO 219 Cb 0.51 -2.45 -0.02 0.00 -0.02 0.00 0.00 33.50 31.53 1pq7 n PRO 219 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1pq7 n ASN 220 N 1.64 -5.65 -3.58 2.55 3.02 -0.20 -4.89 115.26 108.15 1pq7 n ASN 220 Ca 0.08 0.06 -0.29 0.00 -0.03 0.00 0.00 54.58 54.40 1pq7 n ASN 220 Cb 0.34 -4.75 -0.14 0.00 -0.61 0.00 0.00 39.78 34.62 1pq7 n ASN 220 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1pq7 s TYR 221 N -2.96 0.79 0.75 3.10 2.02 -1.14 -4.84 117.35 115.07 1pq7 s TYR 221 Ca 0.00 -1.30 -0.14 0.00 -0.37 0.00 0.00 57.07 55.26 1pq7 s TYR 221 Cb 0.00 -1.13 0.05 0.00 -0.40 0.00 0.00 41.96 40.47 1pq7 s TYR 221 CO 0.00 -0.84 1.18 -1.12 -1.57 0.00 0.00 175.55 173.21 1pq7 s SER 222 N 1.69 4.14 0.40 2.29 0.01 -1.26 -4.48 113.70 116.49 1pq7 s SER 222 Ca 0.11 2.27 -0.25 0.00 1.31 0.00 0.00 55.95 59.39 1pq7 s SER 222 Cb -0.18 -2.58 -0.08 0.00 0.21 0.00 0.00 66.02 63.39 1pq7 s SER 222 CO -0.25 -2.29 1.15 -0.83 0.41 0.00 0.00 173.24 171.43 1pq7 s GLY 223 N -2.24 2.85 -0.09 3.44 0.00 -0.28 -4.57 107.32 106.42 1pq7 s GLY 223 Ca 0.72 0.93 0.02 0.00 0.00 0.00 0.00 44.72 46.39 1pq7 s GLY 223 CO 0.47 1.43 -0.15 0.14 0.00 0.00 0.00 173.10 175.00 1pq7 s VAL 224 N -1.44 2.95 0.00 1.40 1.01 0.27 -1.34 120.40 123.24 1pq7 s VAL 224 Ca 0.57 -0.73 0.06 0.00 0.00 0.00 0.00 61.98 61.89 1pq7 s VAL 224 Cb -0.29 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 1pq7 s VAL 224 CO 0.37 0.55 -0.19 -0.31 0.00 0.00 0.00 175.10 175.52 1pq7 s TYR 225 N -0.08 1.68 0.05 5.22 1.51 0.35 -1.70 117.35 124.38 1pq7 s TYR 225 Ca -0.03 -0.33 -0.31 0.00 -1.01 0.00 0.00 57.07 55.40 1pq7 s TYR 225 Cb -0.14 -1.06 -0.06 0.00 -0.11 0.00 0.00 41.96 40.59 1pq7 s TYR 225 CO 0.04 0.00 1.24 0.00 -1.11 0.00 0.00 175.55 175.72 1pq7 s ALA 226 N -0.54 3.45 -0.35 3.71 0.00 -0.44 -1.29 121.76 126.30 1pq7 s ALA 226 Ca 0.07 0.87 -0.21 0.00 0.00 0.00 0.00 51.96 52.68 1pq7 s ALA 226 Cb -0.08 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1pq7 s ALA 226 CO -0.00 -0.54 0.68 0.45 0.00 0.00 0.00 175.76 176.35 1pq7 s SER 227 N 1.18 6.48 0.18 0.00 0.15 -0.44 -1.82 113.70 119.43 1pq7 s SER 227 Ca 0.60 0.27 -0.13 0.00 0.70 0.00 0.00 55.95 57.38 1pq7 s SER 227 Cb -0.30 -2.35 0.09 0.00 -1.71 0.00 0.00 66.02 61.75 1pq7 s SER 227 CO 0.28 -0.61 1.84 0.58 1.20 0.00 0.00 173.24 176.53 1pq7 h VAL 228 N 5.67 1.16 -0.60 4.45 2.07 -1.50 -2.17 116.25 125.33 1pq7 h VAL 228 Ca -0.26 -0.31 0.07 0.00 0.82 0.00 0.00 66.70 67.02 1pq7 h VAL 228 Cb 1.11 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 1pq7 h VAL 228 CO 0.85 0.15 0.40 1.23 0.02 0.00 0.00 177.57 180.23 1pq7 h GLY 229 N 0.79 0.72 1.74 2.17 0.00 -1.77 -1.56 103.07 105.16 1pq7 h GLY 229 Ca 0.21 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1pq7 h GLY 229 CO -0.04 0.17 -0.22 0.00 0.00 0.00 0.00 176.54 176.44 1pq7 h ALA 230 N 1.68 0.87 -0.02 3.60 0.00 -1.60 0.18 119.26 123.97 1pq7 h ALA 230 Ca 0.26 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1pq7 h ALA 230 Cb 0.31 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1pq7 h ALA 230 CO -0.08 0.00 -0.07 1.28 0.00 0.00 0.00 179.25 180.38 1pq7 n LEU 231 N -2.52 2.50 0.20 0.00 4.77 -0.63 -4.74 117.00 116.57 1pq7 n LEU 231 Ca 0.04 -3.22 0.04 0.00 -0.03 0.00 0.00 56.01 52.84 1pq7 n LEU 231 Cb 0.47 -0.45 0.42 0.00 -2.33 0.00 0.00 43.42 41.53 1pq7 n LEU 231 CO 0.34 0.82 0.79 0.03 -1.33 0.00 0.00 177.39 178.03 1pq7 h ARG 232 N 0.24 0.00 -0.39 3.23 2.47 -1.59 -2.60 114.38 115.75 1pq7 h ARG 232 Ca 0.00 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.72 1pq7 h ARG 232 Cb 1.03 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.33 1pq7 h ARG 232 CO 0.01 0.30 0.22 1.03 0.56 0.00 0.00 179.97 182.09 1pq7 h SER 233 N 0.00 0.48 -0.10 7.04 0.87 -1.90 0.15 113.55 120.09 1pq7 h SER 233 Ca -0.00 -0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.48 1pq7 h SER 233 Cb 0.54 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 62.37 1pq7 h SER 233 CO 0.04 0.42 0.06 0.15 -0.53 0.00 0.00 176.83 176.97 1pq7 h PHE 234 N 0.50 0.13 -0.03 2.24 3.57 -1.91 -1.06 116.94 120.38 1pq7 h PHE 234 Ca 0.14 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1pq7 h PHE 234 Cb 0.04 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 1pq7 h PHE 234 CO -0.03 0.14 0.00 0.82 -2.23 0.00 0.00 178.31 177.01 1pq7 h ILE 235 N 0.08 0.98 -0.49 1.41 2.04 -1.26 -2.40 117.51 117.88 1pq7 h ILE 235 Ca 0.03 -0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.83 1pq7 h ILE 235 Cb 0.05 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1pq7 h ILE 235 CO -0.01 0.00 0.05 0.44 0.00 0.00 0.00 178.15 178.64 1pq7 h ASP 236 N 0.01 0.74 -0.58 1.72 3.32 -0.62 0.76 116.42 121.77 1pq7 h ASP 236 Ca 0.01 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 56.82 1pq7 h ASP 236 Cb 0.01 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 1pq7 h ASP 236 CO -0.02 0.78 0.02 0.74 -1.72 0.00 0.00 179.24 179.04 1pq7 h THR 237 N 0.74 1.26 0.00 0.35 2.02 -0.93 -3.34 112.91 113.02 1pq7 h THR 237 Ca 0.15 -1.11 0.00 0.00 0.77 0.00 0.00 66.41 66.23 1pq7 h THR 237 Cb 0.38 0.83 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 1pq7 h THR 237 CO 0.01 0.40 -0.92 -1.22 0.37 0.00 0.00 175.52 174.16 1pq7 n TYR 238 N -4.24 0.00 0.35 3.16 4.01 -0.93 -5.11 117.16 114.40 1pq7 n TYR 238 Ca 0.02 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.79 1pq7 n TYR 238 Cb 0.33 -0.08 0.16 0.00 -0.31 0.00 0.00 39.34 39.44 1pq7 n TYR 238 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40