#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pg7 n ALA 2 N 0.00 -3.00 -2.86 -1.58 0.00 -1.26 -5.04 120.51 106.77 1pg7 n ALA 2 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.12 1pg7 n ALA 2 Cb 0.00 -0.50 -0.14 0.00 0.00 0.00 0.00 19.45 18.80 1pg7 n ALA 2 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1pg7 s VAL 3 N -0.60 2.89 -0.26 0.00 1.01 -1.26 -5.00 120.40 117.18 1pg7 s VAL 3 Ca 0.00 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.18 1pg7 s VAL 3 Cb 0.00 -2.16 -0.00 0.00 0.00 0.00 0.00 36.38 34.21 1pg7 s VAL 3 CO 0.00 0.55 0.03 -0.69 0.00 0.00 0.00 175.10 174.99 1pg7 s VAL 4 N -0.05 3.78 -0.12 2.92 1.01 -1.26 -2.10 120.40 124.59 1pg7 s VAL 4 Ca -0.04 -0.56 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 1pg7 s VAL 4 Cb -0.14 -2.85 -0.02 0.00 0.00 0.00 0.00 36.38 33.37 1pg7 s VAL 4 CO 0.04 0.24 -0.08 0.42 0.00 0.00 0.00 175.10 175.72 1pg7 s THR 5 N 1.50 3.57 0.25 3.92 -4.23 -0.62 -3.54 115.64 116.48 1pg7 s THR 5 Ca 0.04 -0.49 0.09 0.00 -1.18 0.00 0.00 61.69 60.15 1pg7 s THR 5 Cb -0.16 -2.51 -0.05 0.00 1.34 0.00 0.00 72.50 71.12 1pg7 s THR 5 CO 0.01 0.54 -0.15 -1.10 -0.54 0.00 0.00 174.62 173.37 1pg7 s GLN 6 N -0.04 1.50 0.24 3.99 -0.21 -1.26 -1.82 119.66 122.05 1pg7 s GLN 6 Ca -0.00 -1.69 -0.31 0.00 0.02 0.00 0.00 55.36 53.37 1pg7 s GLN 6 Cb -0.14 -1.37 -0.11 0.00 1.00 0.00 0.00 33.01 32.40 1pg7 s GLN 6 CO 0.03 0.21 1.59 -1.21 -2.12 0.00 0.00 175.29 173.79 1pg7 s GLU 7 N -3.61 4.17 0.10 2.91 8.01 -1.26 -4.86 118.70 124.17 1pg7 s GLU 7 Ca 0.26 2.48 -0.25 0.00 0.01 0.00 0.00 54.97 57.48 1pg7 s GLU 7 Cb -0.01 -3.08 -0.10 0.00 -4.31 0.00 0.00 34.13 26.63 1pg7 s GLU 7 CO 0.11 -0.61 1.68 0.66 0.01 0.00 0.00 175.26 177.10 1pg7 h SER 8 N 5.74 -0.41 -5.02 -0.19 4.64 -1.97 -3.35 113.55 112.98 1pg7 h SER 8 Ca -0.45 0.05 -0.13 0.00 -0.47 0.00 0.00 61.79 60.79 1pg7 h SER 8 Cb 1.21 0.16 -0.19 0.00 -0.31 0.00 0.00 62.40 63.27 1pg7 h SER 8 CO 0.85 -0.22 -0.42 0.00 -0.87 0.00 0.00 176.83 176.18 1pg7 s ALA 9 N -6.13 -0.41 -0.01 5.18 0.00 -1.26 -1.81 121.76 117.31 1pg7 s ALA 9 Ca -0.15 -0.12 -0.01 0.00 0.00 0.00 0.00 51.96 51.68 1pg7 s ALA 9 Cb 0.07 0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.37 1pg7 s ALA 9 CO 0.66 -0.28 0.03 -0.51 0.00 0.00 0.00 175.76 175.66 1pg7 s LEU 11 N -1.66 1.88 -0.09 0.00 1.43 -0.23 -4.91 118.68 115.10 1pg7 s LEU 11 Ca -0.11 0.04 0.04 0.00 -1.03 0.00 0.00 54.13 53.07 1pg7 s LEU 11 Cb -0.05 0.13 -0.01 0.00 0.03 0.00 0.00 46.19 46.30 1pg7 s LEU 11 CO -0.00 -0.03 -0.22 0.28 0.23 0.00 0.00 176.35 176.61 1pg7 s THR 12 N -0.08 2.26 0.36 5.49 -1.32 -1.26 -1.00 115.64 120.09 1pg7 s THR 12 Ca -0.01 -0.96 0.07 0.00 -1.21 0.00 0.00 61.69 59.58 1pg7 s THR 12 Cb -0.01 -1.87 -0.03 0.00 -1.51 0.00 0.00 72.50 69.09 1pg7 s THR 12 CO 0.00 0.56 0.24 -1.54 -2.21 0.00 0.00 174.62 171.67 1pg7 n SER 13 N 3.35 -0.12 -4.36 8.08 3.41 -0.01 -4.97 113.62 119.00 1pg7 n SER 13 Ca -0.18 -3.21 -0.19 0.00 -0.26 0.00 0.00 58.87 55.03 1pg7 n SER 13 Cb 0.53 1.49 -0.10 0.00 -0.26 0.00 0.00 64.21 65.87 1pg7 n SER 13 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1pg7 s SER 14 N -3.41 2.62 0.28 4.04 0.01 -1.26 -1.27 113.70 114.72 1pg7 s SER 14 Ca 0.34 -1.05 -0.30 0.00 1.31 0.00 0.00 55.95 56.25 1pg7 s SER 14 Cb 0.02 -0.14 -0.12 0.00 0.21 0.00 0.00 66.02 65.99 1pg7 s SER 14 CO 0.24 -0.20 1.57 -2.65 0.41 0.00 0.00 173.24 172.62 1pg7 n PRO 15 N -0.42 2.61 0.00 12.44 -0.02 -1.26 -1.71 135.00 146.64 1pg7 n PRO 15 Ca -0.07 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 1pg7 n PRO 15 Cb 0.61 -2.69 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 1pg7 n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pg7 n GLY 16 N 2.19 1.99 3.78 -1.23 0.00 -0.35 -4.94 105.19 106.62 1pg7 n GLY 16 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1pg7 n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1pg7 s GLU 17 N -0.66 1.99 -0.27 1.61 2.12 -0.69 -4.14 118.70 118.65 1pg7 s GLU 17 Ca 0.00 0.75 -0.05 0.00 0.36 0.00 0.00 54.97 56.03 1pg7 s GLU 17 Cb 0.00 -1.90 0.01 0.00 0.26 0.00 0.00 34.13 32.50 1pg7 s GLU 17 CO 0.00 -1.71 0.03 0.99 -0.54 0.00 0.00 175.26 174.03 1pg7 s THR 18 N -3.07 3.64 0.05 -1.70 2.01 -1.26 -0.42 115.64 114.89 1pg7 s THR 18 Ca 0.61 -0.75 0.05 0.00 0.31 0.00 0.00 61.69 61.91 1pg7 s THR 18 Cb -0.15 -2.85 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 1pg7 s THR 18 CO 0.55 0.15 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.85 1pg7 s VAL 19 N 1.45 3.50 -0.21 3.82 1.01 -0.10 -4.95 120.40 124.92 1pg7 s VAL 19 Ca 0.02 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.00 1pg7 s VAL 19 Cb -0.17 -2.57 0.06 0.00 0.00 0.00 0.00 36.38 33.70 1pg7 s VAL 19 CO 0.00 0.27 -0.03 -0.89 0.00 0.00 0.00 175.10 174.45 1pg7 s THR 20 N -1.09 1.19 0.00 3.92 2.01 -1.26 -0.65 115.64 119.77 1pg7 s THR 20 Ca 0.19 -0.93 -0.11 0.00 0.31 0.00 0.00 61.69 61.14 1pg7 s THR 20 Cb -0.11 -1.50 -0.05 0.00 0.01 0.00 0.00 72.50 70.85 1pg7 s THR 20 CO 0.10 -0.08 0.35 -0.76 -0.69 0.00 0.00 174.62 173.54 1pg7 s LEU 21 N 1.56 4.42 0.25 4.42 1.43 -0.20 -4.95 118.68 125.60 1pg7 s LEU 21 Ca -0.03 0.79 0.09 0.00 -1.03 0.00 0.00 54.13 53.95 1pg7 s LEU 21 Cb -0.18 -2.63 -0.05 0.00 0.03 0.00 0.00 46.19 43.37 1pg7 s LEU 21 CO -0.07 0.29 -0.15 0.42 0.23 0.00 0.00 176.35 177.07 1pg7 s THR 22 N -1.19 1.99 -0.09 5.49 -4.23 -1.26 -1.18 115.64 115.17 1pg7 s THR 22 Ca 0.25 -2.26 -0.03 0.00 -1.18 0.00 0.00 61.69 58.47 1pg7 s THR 22 Cb -0.15 -2.22 0.04 0.00 1.34 0.00 0.00 72.50 71.52 1pg7 s THR 22 CO 0.14 -0.47 0.07 0.00 -0.54 0.00 0.00 174.62 173.82 1pg7 s ARG 24 N 2.15 2.90 -0.13 0.00 3.52 -0.76 -2.05 118.95 124.58 1pg7 s ARG 24 Ca 0.04 -0.48 -0.08 0.00 -0.13 0.00 0.00 55.73 55.08 1pg7 s ARG 24 Cb -0.14 -2.70 -0.04 0.00 -1.56 0.00 0.00 34.95 30.51 1pg7 s ARG 24 CO -0.06 0.66 0.15 0.45 -0.81 0.00 0.00 175.30 175.69 1pg7 s SER 25 N -0.79 6.37 0.41 -2.12 0.15 -1.26 -1.60 113.70 114.87 1pg7 s SER 25 Ca 0.12 0.44 0.22 0.00 0.70 0.00 0.00 55.95 57.44 1pg7 s SER 25 Cb -0.11 -2.08 0.53 0.00 -1.71 0.00 0.00 66.02 62.65 1pg7 s SER 25 CO 0.02 0.36 1.66 0.77 1.20 0.00 0.00 173.24 177.26 1pg7 h SER 26 N 5.29 0.00 1.22 5.45 4.64 -1.81 -3.30 113.55 125.04 1pg7 h SER 26 Ca -0.52 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.66 1pg7 h SER 26 Cb 1.22 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.29 1pg7 h SER 26 CO 0.61 0.19 -0.65 0.71 -0.87 0.00 0.00 176.83 176.82 1pg7 h THR 27 N 0.00 1.17 0.00 2.95 1.35 -1.95 -3.49 112.91 112.94 1pg7 h THR 27 Ca -0.00 -2.52 0.00 0.00 -0.55 0.00 0.00 66.41 63.34 1pg7 h THR 27 Cb 0.99 2.49 0.00 0.00 -1.73 0.00 0.00 68.15 69.90 1pg7 h THR 27 CO 0.02 0.64 0.00 0.61 -0.25 0.00 0.00 175.52 176.54 1pg7 n GLY 27 N 1.11 -0.52 3.77 5.82 0.00 -1.24 -5.13 105.19 109.00 1pg7 n GLY 27 Ca 0.01 -0.93 -0.40 0.00 0.00 0.00 0.00 46.02 44.70 1pg7 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pg7 s ALA 27 N -1.00 3.34 0.01 4.61 0.00 -1.26 -4.29 121.76 123.16 1pg7 s ALA 27 Ca 0.00 1.18 -0.30 0.00 0.00 0.00 0.00 51.96 52.84 1pg7 s ALA 27 Cb 0.00 -3.46 -0.05 0.00 0.00 0.00 0.00 23.12 19.61 1pg7 s ALA 27 CO 0.00 -0.67 1.33 0.08 0.00 0.00 0.00 175.76 176.50 1pg7 s VAL 27 N -1.24 3.82 0.39 0.00 1.01 -0.47 -4.98 120.40 118.93 1pg7 s VAL 27 Ca 0.53 1.22 0.08 0.00 0.00 0.00 0.00 61.98 63.81 1pg7 s VAL 27 Cb -0.37 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.17 1pg7 s VAL 27 CO 0.48 0.02 0.13 0.28 0.00 0.00 0.00 175.10 176.01 1pg7 s THR 28 N 2.07 2.46 0.55 3.92 -1.32 -1.26 -4.66 115.64 117.41 1pg7 s THR 28 Ca 0.62 -1.78 0.40 0.00 -1.21 0.00 0.00 61.69 59.72 1pg7 s THR 28 Cb -0.30 -2.95 0.41 0.00 -1.51 0.00 0.00 72.50 68.15 1pg7 s THR 28 CO 0.26 -0.07 2.28 0.00 -2.21 0.00 0.00 174.62 174.88 1pg7 h THR 29 N 1.55 0.13 0.00 5.08 1.03 -2.00 -0.41 112.91 118.28 1pg7 h THR 29 Ca -0.43 -0.12 0.00 0.00 -0.01 0.00 0.00 66.41 65.85 1pg7 h THR 29 Cb 1.25 1.10 0.00 0.00 -1.07 0.00 0.00 68.15 69.44 1pg7 h THR 29 CO 0.69 0.01 0.00 -1.20 -0.01 0.00 0.00 175.52 175.01 1pg7 n SER 30 N -3.24 0.79 -0.14 0.00 7.64 -1.26 -2.63 113.62 114.78 1pg7 n SER 30 Ca -0.02 0.62 0.15 0.00 1.01 0.00 0.00 58.87 60.63 1pg7 n SER 30 Cb 0.12 -0.82 0.72 0.00 -1.01 0.00 0.00 64.21 63.23 1pg7 n SER 30 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1pg7 n ASN 31 N -2.30 0.49 -4.40 6.43 5.03 -0.16 -4.71 115.26 115.64 1pg7 n ASN 31 Ca 0.04 -0.89 -0.40 0.00 0.87 0.00 0.00 54.58 54.20 1pg7 n ASN 31 Cb 0.34 -0.05 -0.06 0.00 -1.02 0.00 0.00 39.78 39.00 1pg7 n ASN 31 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1pg7 n TYR 32 N -0.75 -1.42 -1.04 3.10 4.02 -1.08 0.31 117.16 120.30 1pg7 n TYR 32 Ca 0.19 0.73 -0.41 0.00 -0.01 0.00 0.00 57.90 58.41 1pg7 n TYR 32 Cb 0.23 -2.37 -0.05 0.00 -0.02 0.00 0.00 39.34 37.13 1pg7 n TYR 32 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1pg7 n ALA 33 N -4.22 -2.68 -3.54 -0.72 0.00 -1.26 -4.05 120.51 104.04 1pg7 n ALA 33 Ca 0.08 0.41 -0.23 0.00 0.00 0.00 0.00 53.44 53.71 1pg7 n ALA 33 Cb 0.48 -1.22 -0.16 0.00 0.00 0.00 0.00 19.45 18.54 1pg7 n ALA 33 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1pg7 s ASN 34 N -0.02 1.44 -0.11 0.00 2.47 0.13 -1.17 114.94 117.68 1pg7 s ASN 34 Ca 0.63 -0.23 0.01 0.00 0.42 0.00 0.00 52.86 53.69 1pg7 s ASN 34 Cb -0.87 -0.67 -0.02 0.00 -1.45 0.00 0.00 41.25 38.24 1pg7 s ASN 34 CO 0.40 -0.01 -0.14 0.26 -3.72 0.00 0.00 177.10 173.89 1pg7 s TRP 35 N 0.81 2.78 -0.02 0.43 0.52 0.06 -0.38 118.94 123.14 1pg7 s TRP 35 Ca -0.12 -0.55 0.06 0.00 0.02 0.00 0.00 56.10 55.50 1pg7 s TRP 35 Cb -0.15 -1.80 -0.01 0.00 -1.15 0.00 0.00 33.47 30.36 1pg7 s TRP 35 CO 0.02 -0.13 -0.21 0.08 0.02 0.00 0.00 176.95 176.73 1pg7 s VAL 36 N 0.13 1.64 -0.27 4.03 1.01 0.97 -0.28 120.40 127.62 1pg7 s VAL 36 Ca -0.07 -0.87 -0.09 0.00 0.00 0.00 0.00 61.98 60.95 1pg7 s VAL 36 Cb -0.15 -1.37 -0.03 0.00 0.00 0.00 0.00 36.38 34.83 1pg7 s VAL 36 CO 0.05 0.46 0.13 -1.58 0.00 0.00 0.00 175.10 174.16 1pg7 s GLN 37 N -0.37 3.70 -0.42 2.72 0.74 0.75 0.07 119.66 126.85 1pg7 s GLN 37 Ca 0.05 -0.47 -0.11 0.00 0.05 0.00 0.00 55.36 54.89 1pg7 s GLN 37 Cb -0.09 -3.49 0.06 0.00 1.10 0.00 0.00 33.01 30.59 1pg7 s GLN 37 CO 0.00 -0.23 0.27 -2.00 -0.55 0.00 0.00 175.29 172.78 1pg7 s GLU 38 N 1.67 2.72 0.47 1.67 2.12 0.17 -1.47 118.70 126.05 1pg7 s GLU 38 Ca 0.06 -1.35 -0.05 0.00 0.36 0.00 0.00 54.97 53.99 1pg7 s GLU 38 Cb -0.16 -3.83 -0.04 0.00 0.26 0.00 0.00 34.13 30.36 1pg7 s GLU 38 CO 0.07 -0.90 0.78 0.15 -0.54 0.00 0.00 175.26 174.81 1pg7 s LYS 39 N 1.49 3.56 0.32 4.30 -0.14 -0.10 -1.92 119.74 127.24 1pg7 s LYS 39 Ca 0.03 0.20 -0.28 0.00 -1.36 0.00 0.00 55.97 54.56 1pg7 s LYS 39 Cb -0.22 -2.39 -0.13 0.00 -1.68 0.00 0.00 37.83 33.41 1pg7 s LYS 39 CO 0.04 -0.18 1.24 -0.35 -0.76 0.00 0.00 175.35 175.33 1pg7 n PRO 40 N -2.17 1.94 -0.83 -1.68 -0.04 -1.26 -2.06 135.00 128.89 1pg7 n PRO 40 Ca 0.01 0.68 0.00 0.00 -0.04 0.00 0.00 63.50 64.15 1pg7 n PRO 40 Cb 0.55 -2.22 0.00 0.00 -0.04 0.00 0.00 33.50 31.79 1pg7 n PRO 40 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1pg7 n ASP 41 N 1.01 -0.80 -3.74 3.54 8.00 -1.26 -4.40 116.55 118.90 1pg7 n ASP 41 Ca 0.06 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.32 1pg7 n ASP 41 Cb 0.35 -0.25 0.02 0.00 -0.02 0.00 0.00 41.12 41.22 1pg7 n ASP 41 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1pg7 n HIS 42 N -2.48 -1.87 -3.57 1.24 8.25 -1.11 -4.97 115.22 110.71 1pg7 n HIS 42 Ca 0.00 0.73 -0.41 0.00 -0.26 0.00 0.00 57.72 57.78 1pg7 n HIS 42 Cb 0.17 -3.99 -0.09 0.00 1.12 0.00 0.00 29.99 27.20 1pg7 n HIS 42 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1pg7 s LEU 43 N -6.64 5.48 0.08 2.41 1.43 -0.87 -4.96 118.68 115.62 1pg7 s LEU 43 Ca 0.13 -1.75 -0.18 0.00 -1.03 0.00 0.00 54.13 51.30 1pg7 s LEU 43 Cb -0.04 -2.00 -0.07 0.00 0.03 0.00 0.00 46.19 44.11 1pg7 s LEU 43 CO 0.84 -0.63 0.55 -0.36 0.23 0.00 0.00 176.35 176.98 1pg7 s PHE 44 N 1.39 3.76 -0.11 0.29 0.40 -1.26 -0.93 117.98 121.52 1pg7 s PHE 44 Ca 0.05 1.21 -0.05 0.00 -0.60 0.00 0.00 56.93 57.53 1pg7 s PHE 44 Cb -0.25 -2.46 0.05 0.00 0.51 0.00 0.00 43.02 40.87 1pg7 s PHE 44 CO 0.00 0.56 0.25 0.99 0.70 0.00 0.00 175.22 177.72 1pg7 s THR 45 N -1.18 -0.11 0.29 0.64 2.01 -0.54 -4.99 115.64 111.75 1pg7 s THR 45 Ca 0.30 0.17 -0.29 0.00 0.31 0.00 0.00 61.69 62.19 1pg7 s THR 45 Cb -0.18 -0.40 -0.10 0.00 0.01 0.00 0.00 72.50 71.83 1pg7 s THR 45 CO 0.19 0.07 1.20 -0.83 -0.69 0.00 0.00 174.62 174.56 1pg7 s GLY 46 N 1.50 3.00 -0.12 4.40 0.00 -1.26 -0.18 107.32 114.66 1pg7 s GLY 46 Ca -0.07 1.07 -0.11 0.00 0.00 0.00 0.00 44.72 45.61 1pg7 s GLY 46 CO -0.09 1.72 -0.23 -0.62 0.00 0.00 0.00 173.10 173.88 1pg7 n VAL 47 N 1.14 1.25 -4.35 1.40 0.31 0.61 -4.75 118.33 113.94 1pg7 n VAL 47 Ca -0.00 0.05 -0.19 0.00 -0.01 0.00 0.00 64.34 64.18 1pg7 n VAL 47 Cb 0.43 -1.96 -0.14 0.00 -0.91 0.00 0.00 33.84 31.27 1pg7 n VAL 47 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1pg7 s ILE 48 N -2.50 0.96 0.07 2.52 -1.09 -1.08 -1.73 121.20 118.35 1pg7 s ILE 48 Ca -0.21 -0.82 0.01 0.00 -2.23 0.00 0.00 60.65 57.39 1pg7 s ILE 48 Cb 0.05 -0.86 -0.04 0.00 -1.58 0.00 0.00 42.46 40.04 1pg7 s ILE 48 CO 0.30 0.04 -0.06 -0.83 -1.23 0.00 0.00 174.94 173.16 1pg7 s GLY 49 N -0.89 0.59 -1.32 6.18 0.00 0.37 -0.76 107.32 111.49 1pg7 s GLY 49 Ca 0.01 -1.12 -0.05 0.00 0.00 0.00 0.00 44.72 43.56 1pg7 s GLY 49 CO 0.01 -1.21 1.01 0.61 0.00 0.00 0.00 173.10 173.51 1pg7 n GLY 50 N 0.46 -0.43 4.93 0.20 0.00 -1.12 -1.18 105.19 108.06 1pg7 n GLY 50 Ca -0.16 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1pg7 n GLY 50 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1pg7 n THR 51 N -4.54 0.00 -2.35 2.61 -1.04 -0.32 -4.03 114.28 104.62 1pg7 n THR 51 Ca -0.14 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 61.88 1pg7 n THR 51 Cb 0.61 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.12 1pg7 n THR 51 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1pg7 n ASN 52 N 1.18 0.52 -4.44 8.00 2.04 -1.23 -3.17 115.26 118.15 1pg7 n ASN 52 Ca 0.00 -1.97 -0.35 0.00 -0.44 0.00 0.00 54.58 51.81 1pg7 n ASN 52 Cb 0.00 -0.18 -0.13 0.00 -2.53 0.00 0.00 39.78 36.95 1pg7 n ASN 52 CO 0.00 0.00 0.00 0.20 -0.44 0.00 0.00 177.26 177.02 1pg7 s ASN 53 N -1.67 4.92 0.08 0.53 0.01 -0.32 -4.64 114.94 113.85 1pg7 s ASN 53 Ca 0.24 -0.21 -0.31 0.00 -0.71 0.00 0.00 52.86 51.87 1pg7 s ASN 53 Cb 0.27 -1.86 -0.06 0.00 0.41 0.00 0.00 41.25 40.01 1pg7 s ASN 53 CO -0.12 0.03 1.20 -0.60 -1.51 0.00 0.00 177.10 176.10 1pg7 s ARG 54 N 1.24 4.44 0.50 -0.60 3.52 -1.26 -0.48 118.95 126.31 1pg7 s ARG 54 Ca 0.04 1.78 -0.21 0.00 -0.13 0.00 0.00 55.73 57.21 1pg7 s ARG 54 Cb -0.15 -3.33 -0.07 0.00 -1.56 0.00 0.00 34.95 29.84 1pg7 s ARG 54 CO 0.02 -0.23 1.12 0.00 -0.81 0.00 0.00 175.30 175.39 1pg7 s ALA 55 N 0.92 2.81 0.24 6.12 0.00 -0.71 -4.91 121.76 126.23 1pg7 s ALA 55 Ca 0.58 0.80 -0.30 0.00 0.00 0.00 0.00 51.96 53.04 1pg7 s ALA 55 Cb -0.30 -3.34 -0.15 0.00 0.00 0.00 0.00 23.12 19.33 1pg7 s ALA 55 CO 0.30 -0.63 1.05 -2.30 0.00 0.00 0.00 175.76 174.18 1pg7 n PRO 56 N -0.98 1.20 0.00 0.00 -0.02 -1.26 -2.07 135.00 131.88 1pg7 n PRO 56 Ca 0.10 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1pg7 n PRO 56 Cb 0.50 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 1pg7 n PRO 56 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pg7 n GLY 57 N 1.61 2.99 3.71 -1.23 0.00 -1.26 -5.03 105.19 105.98 1pg7 n GLY 57 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1pg7 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pg7 s VAL 58 N -2.17 3.16 0.47 1.61 1.01 -0.88 -4.97 120.40 118.63 1pg7 s VAL 58 Ca 0.00 0.81 -0.23 0.00 0.00 0.00 0.00 61.98 62.56 1pg7 s VAL 58 Cb 0.00 -3.52 -0.09 0.00 0.00 0.00 0.00 36.38 32.77 1pg7 s VAL 58 CO 0.00 0.05 0.95 -2.65 0.00 0.00 0.00 175.10 173.45 1pg7 n PRO 59 N 4.14 1.18 0.27 2.72 -0.02 -1.26 -4.88 135.00 137.14 1pg7 n PRO 59 Ca 0.12 0.43 0.18 0.00 -2.02 0.00 0.00 63.50 62.21 1pg7 n PRO 59 Cb 0.41 -2.02 0.96 0.00 -0.02 0.00 0.00 33.50 32.83 1pg7 n PRO 59 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pg7 h ALA 60 N 1.22 1.00 0.00 3.55 0.00 -2.00 -2.55 119.26 120.48 1pg7 h ALA 60 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1pg7 h ALA 60 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1pg7 h ALA 60 CO 0.55 0.00 0.00 2.89 0.00 0.00 0.00 179.25 182.69 1pg7 n ARG 61 N -2.74 0.15 -3.52 0.00 1.85 -1.26 -4.67 116.66 106.47 1pg7 n ARG 61 Ca -0.02 0.36 -0.38 0.00 -1.00 0.00 0.00 57.85 56.81 1pg7 n ARG 61 Cb 0.06 -1.77 -0.06 0.00 -1.05 0.00 0.00 32.46 29.63 1pg7 n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1pg7 s PHE 62 N -3.22 3.63 -0.03 2.89 0.08 -0.96 -0.66 117.98 119.71 1pg7 s PHE 62 Ca 0.06 0.85 -0.25 0.00 0.12 0.00 0.00 56.93 57.70 1pg7 s PHE 62 Cb 0.10 -2.30 0.05 0.00 -0.57 0.00 0.00 43.02 40.30 1pg7 s PHE 62 CO 0.38 0.51 0.55 -1.54 -0.10 0.00 0.00 175.22 175.02 1pg7 s SER 63 N -0.53 -0.49 0.20 1.36 1.04 -0.71 -4.93 113.70 109.63 1pg7 s SER 63 Ca 0.22 0.48 0.09 0.00 0.48 0.00 0.00 55.95 57.22 1pg7 s SER 63 Cb -0.15 0.46 -0.04 0.00 0.10 0.00 0.00 66.02 66.39 1pg7 s SER 63 CO 0.10 -0.56 -0.17 -0.83 0.98 0.00 0.00 173.24 172.76 1pg7 s GLY 64 N -1.28 1.48 0.05 7.32 0.00 -1.26 -0.19 107.32 113.44 1pg7 s GLY 64 Ca -0.12 -1.61 -0.11 0.00 0.00 0.00 0.00 44.72 42.88 1pg7 s GLY 64 CO 0.08 -1.68 0.53 -1.14 0.00 0.00 0.00 173.10 170.89 1pg7 n SER 65 N -0.08 -0.74 -4.27 1.64 3.41 -0.14 -4.40 113.62 109.04 1pg7 n SER 65 Ca -0.10 -1.33 -0.34 0.00 -0.26 0.00 0.00 58.87 56.84 1pg7 n SER 65 Cb 0.59 1.20 -0.15 0.00 -0.26 0.00 0.00 64.21 65.59 1pg7 n SER 65 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1pg7 s LEU 66 N 0.00 2.68 -0.22 1.04 1.43 -1.26 -0.27 118.68 122.08 1pg7 s LEU 66 Ca 0.12 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 52.78 1pg7 s LEU 66 Cb -0.01 -1.66 0.05 0.00 0.03 0.00 0.00 46.19 44.61 1pg7 s LEU 66 CO 0.02 0.01 -0.07 -0.63 0.23 0.00 0.00 176.35 175.90 1pg7 s ILE 67 N 1.28 1.62 0.00 -0.59 -1.09 -0.54 -4.98 121.20 116.89 1pg7 s ILE 67 Ca 0.03 -1.18 0.00 0.00 -2.23 0.00 0.00 60.65 57.27 1pg7 s ILE 67 Cb -0.14 -1.80 0.00 0.00 -1.58 0.00 0.00 42.46 38.93 1pg7 s ILE 67 CO -0.04 -0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.27 1pg7 n GLY 68 N 4.66 1.26 1.93 6.18 0.00 -1.26 -3.07 105.19 114.88 1pg7 n GLY 68 Ca -0.13 -0.65 -0.02 0.00 0.00 0.00 0.00 46.02 45.21 1pg7 n GLY 68 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1pg7 n ASP 69 N 4.39 4.95 -3.88 1.61 5.75 -1.26 -4.90 116.55 123.21 1pg7 n ASP 69 Ca 0.00 -3.08 -0.09 0.00 -0.01 0.00 0.00 54.79 51.61 1pg7 n ASP 69 Cb 0.00 -0.72 -0.08 0.00 -1.03 0.00 0.00 41.12 39.29 1pg7 n ASP 69 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1pg7 s LYS 70 N -2.81 0.78 0.50 0.11 -2.85 -1.17 -1.37 119.74 112.93 1pg7 s LYS 70 Ca 0.52 -0.92 -0.14 0.00 -1.00 0.00 0.00 55.97 54.43 1pg7 s LYS 70 Cb 0.41 0.31 -0.07 0.00 -2.06 0.00 0.00 37.83 36.42 1pg7 s LYS 70 CO 0.14 -0.23 0.94 0.00 0.10 0.00 0.00 175.35 176.29 1pg7 s ALA 71 N -3.59 3.14 -0.01 0.59 0.00 -0.87 -1.47 121.76 119.55 1pg7 s ALA 71 Ca 0.03 0.06 -0.10 0.00 0.00 0.00 0.00 51.96 51.94 1pg7 s ALA 71 Cb 0.04 -3.01 0.01 0.00 0.00 0.00 0.00 23.12 20.16 1pg7 s ALA 71 CO -0.09 -0.23 0.21 0.00 0.00 0.00 0.00 175.76 175.65 1pg7 s ALA 72 N -2.62 -0.53 -0.18 0.00 0.00 0.63 -0.88 121.76 118.19 1pg7 s ALA 72 Ca 0.57 0.10 0.01 0.00 0.00 0.00 0.00 51.96 52.64 1pg7 s ALA 72 Cb -0.10 0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.11 1pg7 s ALA 72 CO 0.34 -0.22 -0.17 -1.17 0.00 0.00 0.00 175.76 174.53 1pg7 s LEU 73 N -1.27 2.08 -0.12 0.00 2.96 -0.33 -0.97 118.68 121.04 1pg7 s LEU 73 Ca -0.13 -0.66 -0.02 0.00 -0.22 0.00 0.00 54.13 53.10 1pg7 s LEU 73 Cb -0.06 -1.39 -0.03 0.00 0.50 0.00 0.00 46.19 45.21 1pg7 s LEU 73 CO 0.03 -0.03 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.07 1pg7 s THR 74 N 1.34 3.72 -0.28 3.68 2.01 0.73 -1.04 115.64 125.80 1pg7 s THR 74 Ca 0.04 -0.44 -0.02 0.00 0.31 0.00 0.00 61.69 61.58 1pg7 s THR 74 Cb -0.13 -2.59 0.04 0.00 0.01 0.00 0.00 72.50 69.83 1pg7 s THR 74 CO -0.12 0.53 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.70 1pg7 s ILE 75 N -0.01 3.01 -0.75 1.82 1.01 0.18 -1.74 121.20 124.72 1pg7 s ILE 75 Ca -0.00 -1.24 -0.16 0.00 0.00 0.00 0.00 60.65 59.25 1pg7 s ILE 75 Cb -0.13 -2.66 0.17 0.00 0.01 0.00 0.00 42.46 39.84 1pg7 s ILE 75 CO 0.03 -0.01 0.76 -0.89 0.00 0.00 0.00 174.94 174.83 1pg7 s THR 76 N 1.29 5.26 0.00 2.92 2.01 0.16 -0.93 115.64 126.35 1pg7 s THR 76 Ca -0.03 -1.88 0.00 0.00 0.31 0.00 0.00 61.69 60.08 1pg7 s THR 76 Cb -0.19 -4.50 0.00 0.00 0.01 0.00 0.00 72.50 67.83 1pg7 s THR 76 CO -0.02 -1.09 0.00 0.61 -0.69 0.00 0.00 174.62 173.43 1pg7 n GLY 77 N 4.68 0.90 3.67 4.40 0.00 -0.26 -4.74 105.19 113.84 1pg7 n GLY 77 Ca 0.06 -0.70 -0.47 0.00 0.00 0.00 0.00 46.02 44.91 1pg7 n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pg7 n ALA 78 N -0.34 1.16 -2.12 4.61 0.00 0.44 -4.56 120.51 119.71 1pg7 n ALA 78 Ca 0.00 0.40 -0.18 0.00 0.00 0.00 0.00 53.44 53.66 1pg7 n ALA 78 Cb 0.11 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.18 1pg7 n ALA 78 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1pg7 s GLN 79 N 1.82 2.88 0.31 0.00 -0.21 -1.26 -1.21 119.66 121.98 1pg7 s GLN 79 Ca 0.83 -1.21 0.01 0.00 0.02 0.00 0.00 55.36 55.02 1pg7 s GLN 79 Cb -0.69 -2.75 0.51 0.00 1.00 0.00 0.00 33.01 31.08 1pg7 s GLN 79 CO 0.42 -0.19 1.87 1.15 -2.12 0.00 0.00 175.29 176.41 1pg7 h THR 80 N 0.71 1.21 0.00 -0.19 2.02 -1.94 -2.01 112.91 112.70 1pg7 h THR 80 Ca -0.41 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 66.03 1pg7 h THR 80 Cb 1.27 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.42 1pg7 h THR 80 CO 0.47 0.27 0.00 -1.84 0.37 0.00 0.00 175.52 174.79 1pg7 n GLU 81 N -4.30 0.09 0.00 6.66 0.28 -1.26 -1.89 120.64 120.22 1pg7 n GLU 81 Ca 0.03 0.50 0.14 0.00 -0.16 0.00 0.00 57.16 57.67 1pg7 n GLU 81 Cb 0.21 -1.74 0.62 0.00 1.43 0.00 0.00 31.44 31.97 1pg7 n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1pg7 n ASP 82 N -1.91 0.75 -4.70 -1.84 8.00 -0.76 -4.85 116.55 111.24 1pg7 n ASP 82 Ca 0.00 -0.96 -0.42 0.00 0.71 0.00 0.00 54.79 54.12 1pg7 n ASP 82 Cb 0.08 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.14 1pg7 n ASP 82 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1pg7 s GLU 83 N -2.25 4.21 -0.07 -1.24 2.12 -0.79 -4.90 118.70 115.78 1pg7 s GLU 83 Ca 0.34 2.31 -0.22 0.00 0.36 0.00 0.00 54.97 57.76 1pg7 s GLU 83 Cb 0.21 -3.47 0.07 0.00 0.26 0.00 0.00 34.13 31.20 1pg7 s GLU 83 CO 0.42 -0.68 1.00 0.00 -0.54 0.00 0.00 175.26 175.46 1pg7 n ALA 84 N 5.10 -2.89 -2.88 6.30 0.00 -0.94 -4.90 120.51 120.31 1pg7 n ALA 84 Ca 0.15 -0.53 -0.35 0.00 0.00 0.00 0.00 53.44 52.71 1pg7 n ALA 84 Cb 0.40 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.75 1pg7 n ALA 84 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1pg7 s ILE 85 N -2.01 4.55 -0.23 0.00 1.01 -0.81 0.33 121.20 124.05 1pg7 s ILE 85 Ca 0.24 -0.11 -0.05 0.00 0.00 0.00 0.00 60.65 60.73 1pg7 s ILE 85 Cb -0.00 -3.06 -0.02 0.00 0.01 0.00 0.00 42.46 39.39 1pg7 s ILE 85 CO -0.02 0.44 -0.01 -0.31 0.00 0.00 0.00 174.94 175.04 1pg7 s TYR 86 N 0.64 3.00 -0.11 3.97 1.51 0.57 0.42 117.35 127.36 1pg7 s TYR 86 Ca 0.02 -0.73 -0.05 0.00 -1.01 0.00 0.00 57.07 55.30 1pg7 s TYR 86 Cb -0.13 -2.14 -0.04 0.00 -0.11 0.00 0.00 41.96 39.54 1pg7 s TYR 86 CO 0.02 -0.46 0.08 -0.06 -1.11 0.00 0.00 175.55 174.02 1pg7 s PHE 87 N 1.46 3.41 0.06 2.71 0.08 0.11 -0.82 117.98 125.00 1pg7 s PHE 87 Ca 0.05 0.38 0.04 0.00 0.12 0.00 0.00 56.93 57.52 1pg7 s PHE 87 Cb -0.15 -1.88 -0.04 0.00 -0.57 0.00 0.00 43.02 40.39 1pg7 s PHE 87 CO -0.01 0.62 0.02 0.00 -0.10 0.00 0.00 175.22 175.75 1pg7 s ALA 89 N -1.27 -0.19 -0.02 0.00 0.00 0.49 -0.47 121.76 120.30 1pg7 s ALA 89 Ca 0.25 0.55 0.07 0.00 0.00 0.00 0.00 51.96 52.83 1pg7 s ALA 89 Cb -0.12 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 1pg7 s ALA 89 CO 0.17 -0.13 -0.24 -0.51 0.00 0.00 0.00 175.76 175.04 1pg7 s LEU 90 N 0.99 2.05 -0.18 0.00 1.43 -0.85 -0.69 118.68 121.43 1pg7 s LEU 90 Ca -0.08 -0.45 -0.14 0.00 -1.03 0.00 0.00 54.13 52.43 1pg7 s LEU 90 Cb -0.10 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.81 1pg7 s LEU 90 CO -0.04 0.30 0.32 0.86 0.23 0.00 0.00 176.35 178.01 1pg7 s TRP 91 N -0.55 3.41 -0.71 0.29 -0.11 0.15 -1.80 118.94 119.63 1pg7 s TRP 91 Ca 0.09 0.56 0.05 0.00 1.22 0.00 0.00 56.10 58.02 1pg7 s TRP 91 Cb -0.10 -2.40 0.21 0.00 -1.50 0.00 0.00 33.47 29.68 1pg7 s TRP 91 CO -0.01 0.13 0.63 0.66 -4.62 0.00 0.00 176.95 173.74 1pg7 n TYR 92 N 3.98 3.47 0.00 5.86 4.02 -0.06 -4.09 117.16 130.34 1pg7 n TYR 92 Ca -0.11 -4.21 0.00 0.00 -0.01 0.00 0.00 57.90 53.57 1pg7 n TYR 92 Cb 0.52 -0.65 0.00 0.00 -0.02 0.00 0.00 39.34 39.18 1pg7 n TYR 92 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1pg7 n SER 93 N 1.56 0.00 0.00 7.72 7.64 -1.26 -3.66 113.62 125.62 1pg7 n SER 93 Ca 0.24 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.12 1pg7 n SER 93 Cb 0.37 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 1pg7 n SER 93 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1pg7 n ASN 94 N 1.92 0.45 -3.43 6.43 0.23 -1.26 -5.11 115.26 114.49 1pg7 n ASN 94 Ca 0.00 -1.21 -0.12 0.00 -0.53 0.00 0.00 54.58 52.72 1pg7 n ASN 94 Cb 0.00 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 37.68 1pg7 n ASN 94 CO 0.00 0.00 0.00 -1.38 -0.93 0.00 0.00 177.26 174.95 1pg7 s HIS 95 N -0.21 -0.53 0.00 -2.53 -3.43 -1.24 -5.16 115.29 102.19 1pg7 s HIS 95 Ca 0.00 0.32 -0.00 0.00 -0.80 0.00 0.00 55.06 54.58 1pg7 s HIS 95 Cb 0.00 0.56 -0.04 0.00 -1.43 0.00 0.00 32.58 31.67 1pg7 s HIS 95 CO 0.00 -0.84 0.08 -1.58 -2.00 0.00 0.00 174.74 170.40 1pg7 s TRP 96 N -3.72 3.27 -0.06 0.38 0.52 -1.26 -0.88 118.94 117.19 1pg7 s TRP 96 Ca 0.01 0.19 0.01 0.00 0.02 0.00 0.00 56.10 56.34 1pg7 s TRP 96 Cb -0.01 -1.72 0.02 0.00 -1.15 0.00 0.00 33.47 30.60 1pg7 s TRP 96 CO -0.13 0.54 -0.08 0.08 0.02 0.00 0.00 176.95 177.38 1pg7 s VAL 97 N -1.20 0.86 0.21 4.03 1.01 -0.74 -4.99 120.40 119.57 1pg7 s VAL 97 Ca 0.23 -0.30 -0.05 0.00 0.00 0.00 0.00 61.98 61.86 1pg7 s VAL 97 Cb -0.12 -0.83 -0.06 0.00 0.00 0.00 0.00 36.38 35.38 1pg7 s VAL 97 CO 0.14 0.30 0.46 -0.36 0.00 0.00 0.00 175.10 175.64 1pg7 s PHE 98 N 0.86 3.47 0.64 5.22 0.40 -1.26 -2.00 117.98 125.31 1pg7 s PHE 98 Ca -0.11 0.60 -0.05 0.00 -0.60 0.00 0.00 56.93 56.77 1pg7 s PHE 98 Cb -0.15 -2.06 0.04 0.00 0.51 0.00 0.00 43.02 41.37 1pg7 s PHE 98 CO 0.01 0.32 0.94 0.20 0.70 0.00 0.00 175.22 177.39 1pg7 s GLY 99 N -2.75 1.68 0.00 4.36 0.00 0.38 -4.42 107.32 106.57 1pg7 s GLY 99 Ca 0.43 -0.92 0.12 0.00 0.00 0.00 0.00 44.72 44.34 1pg7 s GLY 99 CO 0.26 -0.58 1.26 0.61 0.00 0.00 0.00 173.10 174.65 1pg7 n GLY 100 N -2.72 -0.62 0.00 0.20 0.00 -1.23 -4.63 105.19 96.19 1pg7 n GLY 100 Ca 0.07 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1pg7 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pg7 n GLY 101 N -0.28 -2.08 3.04 -0.02 0.00 -1.26 -5.00 105.19 99.58 1pg7 n GLY 101 Ca 0.06 -1.39 -0.29 0.00 0.00 0.00 0.00 46.02 44.40 1pg7 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pg7 s THR 102 N -3.59 1.51 -0.34 2.61 2.01 0.00 -4.52 115.64 113.31 1pg7 s THR 102 Ca 0.00 -0.62 -0.23 0.00 0.31 0.00 0.00 61.69 61.14 1pg7 s THR 102 Cb 0.00 -1.40 0.01 0.00 0.01 0.00 0.00 72.50 71.12 1pg7 s THR 102 CO 0.00 0.44 0.79 -0.75 -0.69 0.00 0.00 174.62 174.42 1pg7 s LYS 103 N 1.21 3.84 -0.25 4.92 2.20 -0.75 -0.31 119.74 130.59 1pg7 s LYS 103 Ca -0.02 0.44 -0.10 0.00 -0.36 0.00 0.00 55.97 55.93 1pg7 s LYS 103 Cb -0.14 -3.78 -0.04 0.00 -1.51 0.00 0.00 37.83 32.36 1pg7 s LYS 103 CO -0.05 -0.79 0.15 -1.17 -0.36 0.00 0.00 175.35 173.13 1pg7 s LEU 104 N 3.07 3.91 -0.15 5.43 2.96 0.15 -1.06 118.68 132.99 1pg7 s LEU 104 Ca 0.32 -0.01 -0.05 0.00 -0.22 0.00 0.00 54.13 54.17 1pg7 s LEU 104 Cb -0.13 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 44.46 1pg7 s LEU 104 CO 0.15 0.00 0.03 -0.89 -1.32 0.00 0.00 176.35 174.33 1pg7 s THR 105 N 1.42 4.54 -0.53 3.68 2.01 -0.17 -2.21 115.64 124.37 1pg7 s THR 105 Ca 0.07 -0.13 -0.05 0.00 0.31 0.00 0.00 61.69 61.88 1pg7 s THR 105 Cb -0.15 -3.00 0.14 0.00 0.01 0.00 0.00 72.50 69.50 1pg7 s THR 105 CO 0.07 0.51 0.37 -0.69 -0.69 0.00 0.00 174.62 174.19 1pg7 s VAL 106 N -0.01 3.86 -0.48 3.82 1.01 -1.26 -0.83 120.40 126.51 1pg7 s VAL 106 Ca 0.04 -2.33 -0.44 0.00 0.00 0.00 0.00 61.98 59.25 1pg7 s VAL 106 Cb -0.12 -3.55 -0.19 0.00 0.00 0.00 0.00 36.38 32.52 1pg7 s VAL 106 CO 0.01 -0.81 2.02 0.18 0.00 0.00 0.00 175.10 176.51 1pg7 n LEU 107 N 4.24 1.01 0.00 3.92 4.32 -0.39 -4.86 117.00 125.24 1pg7 n LEU 107 Ca 0.01 0.78 0.00 0.00 -0.02 0.00 0.00 56.01 56.78 1pg7 n LEU 107 Cb 0.40 -0.93 0.00 0.00 -1.62 0.00 0.00 43.42 41.27 1pg7 n LEU 107 CO 0.36 -0.77 0.41 0.61 -1.22 0.00 0.00 177.39 176.78 1pg7 n GLY 108 N 6.58 1.38 3.61 -0.72 0.00 -1.26 -4.44 105.19 110.34 1pg7 n GLY 108 Ca 0.48 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.42 1pg7 n GLY 108 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1pg7 s GLN 109 N -0.64 1.30 0.74 1.61 -2.07 -1.26 -5.16 119.66 114.18 1pg7 s GLN 109 Ca 0.00 -0.60 -0.15 0.00 -1.82 0.00 0.00 55.36 52.79 1pg7 s GLN 109 Cb 0.00 0.52 0.05 0.00 -1.09 0.00 0.00 33.01 32.48 1pg7 s GLN 109 CO 0.00 -0.58 1.21 -2.14 -1.32 0.00 0.00 175.29 172.46 1pg7 s PRO 110 N -3.58 2.05 0.71 9.60 0.02 -1.26 -4.95 135.00 137.59 1pg7 s PRO 110 Ca 0.06 1.78 -0.16 0.00 0.02 0.00 0.00 61.00 62.71 1pg7 s PRO 110 Cb -0.02 -1.82 0.03 0.00 0.02 0.00 0.00 34.50 32.70 1pg7 s PRO 110 CO -0.04 -1.91 1.22 0.15 -0.33 0.00 0.00 177.00 176.09 1pg7 s LYS 111 N -3.93 2.26 -0.08 5.54 -0.14 -1.26 -4.88 119.74 117.25 1pg7 s LYS 111 Ca 0.75 1.80 -0.04 0.00 -1.36 0.00 0.00 55.97 57.12 1pg7 s LYS 111 Cb -0.30 -1.84 0.04 0.00 -1.68 0.00 0.00 37.83 34.06 1pg7 s LYS 111 CO 0.46 -1.75 0.18 0.45 -0.76 0.00 0.00 175.35 173.93 1pg7 s SER 112 N -1.92 0.12 0.44 2.83 0.15 0.40 -4.90 113.70 110.82 1pg7 s SER 112 Ca 0.76 0.38 -0.21 0.00 0.70 0.00 0.00 55.95 57.58 1pg7 s SER 112 Cb -0.30 0.30 -0.11 0.00 -1.71 0.00 0.00 66.02 64.20 1pg7 s SER 112 CO 0.43 -0.19 0.96 -0.44 1.20 0.00 0.00 173.24 175.21 1pg7 s SER 113 N 1.60 6.89 0.17 5.45 0.01 -1.26 -0.79 113.70 125.76 1pg7 s SER 113 Ca -0.05 1.69 -0.30 0.00 1.31 0.00 0.00 55.95 58.59 1pg7 s SER 113 Cb -0.12 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.49 1pg7 s SER 113 CO -0.07 -0.40 1.30 -2.16 0.41 0.00 0.00 173.24 172.33 1pg7 s PRO 114 N -3.27 4.39 -0.30 12.44 0.04 -1.26 -4.38 135.00 142.66 1pg7 s PRO 114 Ca 0.62 2.01 -0.22 0.00 0.04 0.00 0.00 61.00 63.45 1pg7 s PRO 114 Cb -0.09 -3.22 -0.00 0.00 0.04 0.00 0.00 34.50 31.22 1pg7 s PRO 114 CO 0.15 -0.27 0.71 -1.12 0.04 0.00 0.00 177.00 176.52 1pg7 s SER 115 N 0.51 6.59 -0.13 6.66 0.01 0.57 -4.91 113.70 123.00 1pg7 s SER 115 Ca 0.58 0.57 -0.04 0.00 1.31 0.00 0.00 55.95 58.37 1pg7 s SER 115 Cb -0.35 -2.37 -0.03 0.00 0.21 0.00 0.00 66.02 63.47 1pg7 s SER 115 CO 0.36 -0.54 0.01 -0.69 0.41 0.00 0.00 173.24 172.79 1pg7 s VAL 116 N 2.78 4.37 -0.04 3.43 1.01 -1.26 -0.78 120.40 129.91 1pg7 s VAL 116 Ca 0.29 -0.20 -0.00 0.00 0.00 0.00 0.00 61.98 62.06 1pg7 s VAL 116 Cb -0.15 -2.89 0.03 0.00 0.00 0.00 0.00 36.38 33.37 1pg7 s VAL 116 CO 0.12 0.54 0.01 0.20 0.00 0.00 0.00 175.10 175.97 1pg7 s ASN 117 N -0.25 0.93 -0.13 3.32 -0.87 -0.25 -4.96 114.94 112.73 1pg7 s ASN 117 Ca 0.06 -0.04 -0.03 0.00 -1.57 0.00 0.00 52.86 51.28 1pg7 s ASN 117 Cb -0.12 -0.29 -0.03 0.00 -0.02 0.00 0.00 41.25 40.78 1pg7 s ASN 117 CO 0.02 -0.15 -0.01 -0.22 -2.57 0.00 0.00 177.10 174.17 1pg7 s LEU 118 N 1.48 3.42 -0.08 0.60 2.96 -1.26 -0.11 118.68 125.69 1pg7 s LEU 118 Ca -0.03 -0.01 0.02 0.00 -0.22 0.00 0.00 54.13 53.89 1pg7 s LEU 118 Cb -0.13 -1.81 -0.02 0.00 0.50 0.00 0.00 46.19 44.73 1pg7 s LEU 118 CO -0.03 0.24 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.73 1pg7 s PHE 119 N -0.05 2.72 0.64 5.38 0.08 0.20 -4.98 117.98 121.97 1pg7 s PHE 119 Ca 0.03 -0.41 -0.10 0.00 0.12 0.00 0.00 56.93 56.57 1pg7 s PHE 119 Cb -0.13 -1.71 -0.01 0.00 -0.57 0.00 0.00 43.02 40.60 1pg7 s PHE 119 CO 0.02 -0.01 1.03 -1.25 -0.10 0.00 0.00 175.22 174.91 1pg7 s PRO 120 N -0.24 3.23 0.37 0.24 0.04 -1.26 -2.66 135.00 134.71 1pg7 s PRO 120 Ca 0.01 0.52 -0.27 0.00 0.04 0.00 0.00 61.00 61.30 1pg7 s PRO 120 Cb -0.13 -2.10 -0.09 0.00 0.04 0.00 0.00 34.50 32.22 1pg7 s PRO 120 CO 0.03 -0.74 1.26 -2.14 0.04 0.00 0.00 177.00 175.44 1pg7 s PRO 121 N -5.20 4.18 0.55 0.56 0.02 -1.24 -4.82 135.00 129.05 1pg7 s PRO 121 Ca 0.56 2.08 -0.16 0.00 0.02 0.00 0.00 61.00 63.49 1pg7 s PRO 121 Cb -0.11 -2.89 -0.06 0.00 0.02 0.00 0.00 34.50 31.46 1pg7 s PRO 121 CO 0.52 -0.29 1.01 -1.54 -0.33 0.00 0.00 177.00 176.37 1pg7 s SER 122 N -0.75 6.32 0.34 2.53 1.04 -1.26 -4.94 113.70 116.98 1pg7 s SER 122 Ca 0.53 1.64 0.03 0.00 0.48 0.00 0.00 55.95 58.63 1pg7 s SER 122 Cb -0.37 -2.51 0.61 0.00 0.10 0.00 0.00 66.02 63.85 1pg7 s SER 122 CO 0.47 -0.80 1.94 0.77 0.98 0.00 0.00 173.24 176.60 1pg7 h SER 123 N 0.69 0.64 0.09 7.02 4.64 -1.99 -1.80 113.55 122.83 1pg7 h SER 123 Ca -0.47 -0.06 0.01 0.00 -0.47 0.00 0.00 61.79 60.80 1pg7 h SER 123 Cb 1.20 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 63.10 1pg7 h SER 123 CO 0.60 0.56 -0.17 -0.33 -0.87 0.00 0.00 176.83 176.63 1pg7 h GLU 124 N 0.71 -0.31 -0.39 4.77 3.07 -2.00 -2.50 114.58 117.92 1pg7 h GLU 124 Ca 0.17 0.02 -0.06 0.00 -0.50 0.00 0.00 59.36 59.00 1pg7 h GLU 124 Cb 0.11 0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.07 1pg7 h GLU 124 CO -0.02 -0.21 -0.00 1.49 -1.40 0.00 0.00 179.01 178.87 1pg7 h GLU 125 N -0.32 0.62 -0.02 2.33 4.81 -1.80 -1.93 114.58 118.27 1pg7 h GLU 125 Ca 0.02 -0.15 0.01 0.00 -0.13 0.00 0.00 59.36 59.11 1pg7 h GLU 125 Cb 0.34 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 1pg7 h GLU 125 CO -0.09 0.64 0.01 -0.07 -0.73 0.00 0.00 179.01 178.78 1pg7 h LEU 126 N 0.59 0.00 -2.26 1.64 3.38 -0.92 0.58 115.31 118.33 1pg7 h LEU 126 Ca 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1pg7 h LEU 126 Cb 0.38 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 1pg7 h LEU 126 CO 0.01 0.00 -0.02 0.11 0.09 0.00 0.00 178.44 178.63 1pg7 h LYS 127 N 0.00 0.00 -0.04 1.13 1.57 -0.96 0.34 116.57 118.61 1pg7 h LYS 127 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1pg7 h LYS 127 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1pg7 h LYS 127 CO -0.00 0.02 0.00 0.25 -0.57 0.00 0.00 179.45 179.15 1pg7 n THR 128 N -4.01 0.05 -2.75 -0.16 -2.24 0.20 -4.88 114.28 100.48 1pg7 n THR 128 Ca -0.03 -0.10 -0.17 0.00 -2.27 0.00 0.00 64.05 61.48 1pg7 n THR 128 Cb 0.11 -0.10 0.02 0.00 -2.10 0.00 0.00 70.33 68.26 1pg7 n THR 128 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1pg7 n LYS 129 N -0.48 -3.37 -4.06 -0.78 5.02 0.12 -5.01 118.16 109.59 1pg7 n LYS 129 Ca 0.17 0.71 -0.11 0.00 -2.02 0.00 0.00 58.31 57.06 1pg7 n LYS 129 Cb 0.16 -5.13 -0.11 0.00 -0.02 0.00 0.00 35.03 29.93 1pg7 n LYS 129 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1pg7 s LYS 130 N -5.32 0.54 -0.04 1.97 -0.14 -1.25 -2.90 119.74 112.60 1pg7 s LYS 130 Ca 0.19 -0.86 -0.01 0.00 -1.36 0.00 0.00 55.97 53.93 1pg7 s LYS 130 Cb -0.09 -0.16 0.03 0.00 -1.68 0.00 0.00 37.83 35.94 1pg7 s LYS 130 CO 0.24 0.01 0.08 0.00 -0.76 0.00 0.00 175.35 174.92 1pg7 s ALA 131 N -1.96 -0.09 -0.10 5.17 0.00 0.15 -3.57 121.76 121.37 1pg7 s ALA 131 Ca -0.06 0.44 0.02 0.00 0.00 0.00 0.00 51.96 52.35 1pg7 s ALA 131 Cb -0.06 -0.31 0.01 0.00 0.00 0.00 0.00 23.12 22.76 1pg7 s ALA 131 CO -0.02 -0.12 -0.14 0.99 0.00 0.00 0.00 175.76 176.48 1pg7 s THR 132 N 0.96 1.37 -0.19 0.00 2.01 -1.26 -0.70 115.64 117.82 1pg7 s THR 132 Ca -0.08 -0.58 -0.09 0.00 0.31 0.00 0.00 61.69 61.25 1pg7 s THR 132 Cb -0.10 -1.26 -0.05 0.00 0.01 0.00 0.00 72.50 71.10 1pg7 s THR 132 CO -0.04 0.41 0.11 -0.76 -0.69 0.00 0.00 174.62 173.66 1pg7 s LEU 133 N 0.94 4.10 -0.20 4.42 1.02 -0.26 -3.68 118.68 125.02 1pg7 s LEU 133 Ca -0.08 0.19 -0.05 0.00 0.02 0.00 0.00 54.13 54.21 1pg7 s LEU 133 Cb -0.15 -2.05 -0.02 0.00 0.02 0.00 0.00 46.19 43.98 1pg7 s LEU 133 CO -0.00 0.18 -0.01 -0.69 0.02 0.00 0.00 176.35 175.84 1pg7 s VAL 134 N 0.36 3.83 -0.33 -1.59 1.01 -1.09 -1.32 120.40 121.27 1pg7 s VAL 134 Ca 0.07 -0.35 -0.03 0.00 0.00 0.00 0.00 61.98 61.66 1pg7 s VAL 134 Cb -0.11 -2.73 0.06 0.00 0.00 0.00 0.00 36.38 33.60 1pg7 s VAL 134 CO -0.01 0.43 0.06 0.00 0.00 0.00 0.00 175.10 175.58 1pg7 s THR 136 N 1.25 5.14 -0.20 0.00 -4.23 0.84 -1.51 115.64 116.94 1pg7 s THR 136 Ca -0.02 0.74 -0.01 0.00 -1.18 0.00 0.00 61.69 61.23 1pg7 s THR 136 Cb -0.20 -3.68 0.05 0.00 1.34 0.00 0.00 72.50 70.01 1pg7 s THR 136 CO -0.01 0.52 -0.03 -0.63 -0.54 0.00 0.00 174.62 173.93 1pg7 s ILE 137 N -0.58 1.11 0.31 2.99 1.01 -0.47 -1.09 121.20 124.49 1pg7 s ILE 137 Ca 0.22 -0.83 0.03 0.00 0.00 0.00 0.00 60.65 60.07 1pg7 s ILE 137 Cb -0.15 -1.41 -0.06 0.00 0.01 0.00 0.00 42.46 40.85 1pg7 s ILE 137 CO 0.10 -0.04 0.06 0.42 0.00 0.00 0.00 174.94 175.49 1pg7 s THR 138 N 1.60 1.07 -1.36 2.92 -4.23 0.03 0.09 115.64 115.77 1pg7 s THR 138 Ca -0.02 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.48 1pg7 s THR 138 Cb -0.17 -2.76 0.01 0.00 1.34 0.00 0.00 72.50 70.92 1pg7 s THR 138 CO -0.07 -0.01 0.60 -0.62 -0.54 0.00 0.00 174.62 173.98 1pg7 n GLU 139 N -0.64 -4.28 -5.08 3.99 1.02 -0.58 -0.32 120.64 114.75 1pg7 n GLU 139 Ca -0.02 0.53 -0.32 0.00 -0.02 0.00 0.00 57.16 57.34 1pg7 n GLU 139 Cb 0.66 -4.94 -0.15 0.00 -0.02 0.00 0.00 31.44 27.00 1pg7 n GLU 139 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 1pg7 s PHE 140 N -3.77 2.50 -0.16 -0.32 -0.12 -0.88 -4.23 117.98 111.00 1pg7 s PHE 140 Ca 0.03 -0.31 -0.10 0.00 -0.05 0.00 0.00 56.93 56.51 1pg7 s PHE 140 Cb -0.02 -1.55 0.05 0.00 -0.63 0.00 0.00 43.02 40.88 1pg7 s PHE 140 CO 0.84 0.08 0.39 -0.47 -0.05 0.00 0.00 175.22 176.02 1pg7 s TYR 141 N -0.69 -0.55 0.95 3.49 5.04 0.03 -0.35 117.35 125.27 1pg7 s TYR 141 Ca 0.11 1.20 -0.11 0.00 -2.44 0.00 0.00 57.07 55.83 1pg7 s TYR 141 Cb -0.10 0.23 0.16 0.00 0.35 0.00 0.00 41.96 42.60 1pg7 s TYR 141 CO 0.00 -0.31 1.10 -1.25 -1.34 0.00 0.00 175.55 173.75 1pg7 s PRO 142 N 1.17 0.77 -1.19 4.97 0.04 -1.26 -0.45 135.00 139.04 1pg7 s PRO 142 Ca -0.08 1.14 -0.13 0.00 0.04 0.00 0.00 61.00 61.97 1pg7 s PRO 142 Cb -0.08 -1.73 -0.06 0.00 0.04 0.00 0.00 34.50 32.68 1pg7 s PRO 142 CO -0.10 -2.67 2.29 0.41 0.04 0.00 0.00 177.00 176.97 1pg7 n GLY 143 N -0.19 3.60 3.13 0.56 0.00 -1.26 -4.81 105.19 106.23 1pg7 n GLY 143 Ca 0.08 -1.31 -0.12 0.00 0.00 0.00 0.00 46.02 44.67 1pg7 n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pg7 s ALA 144 N 3.47 -0.77 0.16 4.61 0.00 -1.26 -4.85 121.76 123.11 1pg7 s ALA 144 Ca 0.53 1.20 -0.14 0.00 0.00 0.00 0.00 51.96 53.55 1pg7 s ALA 144 Cb 0.14 -0.88 0.02 0.00 0.00 0.00 0.00 23.12 22.40 1pg7 s ALA 144 CO -0.02 -0.38 0.41 0.14 0.00 0.00 0.00 175.76 175.91 1pg7 s VAL 145 N 1.70 0.06 -0.06 0.00 -7.23 -1.26 -4.56 120.40 109.05 1pg7 s VAL 145 Ca -0.06 -0.89 0.03 0.00 -1.81 0.00 0.00 61.98 59.25 1pg7 s VAL 145 Cb -0.10 -1.50 0.00 0.00 0.56 0.00 0.00 36.38 35.34 1pg7 s VAL 145 CO -0.10 -0.26 -0.15 -0.13 -0.31 0.00 0.00 175.10 174.15 1pg7 s ARG 146 N -3.87 1.81 -0.07 4.82 1.81 -0.71 -4.97 118.95 117.77 1pg7 s ARG 146 Ca 0.09 -0.54 0.01 0.00 -1.72 0.00 0.00 55.73 53.58 1pg7 s ARG 146 Cb 0.01 -1.52 -0.03 0.00 -0.45 0.00 0.00 34.95 32.97 1pg7 s ARG 146 CO -0.05 0.14 -0.10 0.08 -0.68 0.00 0.00 175.30 174.69 1pg7 s VAL 147 N 0.32 3.44 0.05 3.52 1.01 -1.26 -0.66 120.40 126.82 1pg7 s VAL 147 Ca -0.09 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.34 1pg7 s VAL 147 Cb -0.14 -2.40 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 1pg7 s VAL 147 CO 0.03 0.58 -0.08 -1.81 0.00 0.00 0.00 175.10 173.83 1pg7 s ASP 148 N -0.59 0.88 0.14 3.32 1.01 0.39 -4.99 116.67 116.84 1pg7 s ASP 148 Ca 0.09 -0.60 0.09 0.00 0.71 0.00 0.00 52.55 52.84 1pg7 s ASP 148 Cb -0.12 0.04 -0.04 0.00 1.01 0.00 0.00 42.92 43.82 1pg7 s ASP 148 CO 0.02 -0.23 -0.20 0.26 0.21 0.00 0.00 175.17 175.22 1pg7 s TRP 149 N -1.60 1.88 0.02 4.23 0.52 -1.26 0.26 118.94 122.99 1pg7 s TRP 149 Ca -0.08 -0.44 0.01 0.00 0.02 0.00 0.00 56.10 55.61 1pg7 s TRP 149 Cb -0.08 -0.97 -0.02 0.00 -1.15 0.00 0.00 33.47 31.25 1pg7 s TRP 149 CO -0.00 0.30 -0.04 0.15 0.02 0.00 0.00 176.95 177.38 1pg7 s LYS 150 N -2.44 0.32 -0.16 4.98 1.02 -0.52 -1.93 119.74 121.01 1pg7 s LYS 150 Ca 0.13 -0.50 -0.00 0.00 0.02 0.00 0.00 55.97 55.61 1pg7 s LYS 150 Cb -0.08 -0.06 0.04 0.00 -0.52 0.00 0.00 37.83 37.21 1pg7 s LYS 150 CO 0.06 -0.00 -0.06 0.00 -0.92 0.00 0.00 175.35 174.43 1pg7 s ALA 151 N -1.06 1.52 -1.52 5.17 0.00 -0.04 -1.18 121.76 124.66 1pg7 s ALA 151 Ca -0.10 -0.83 -0.03 0.00 0.00 0.00 0.00 51.96 51.00 1pg7 s ALA 151 Cb -0.08 -1.11 0.01 0.00 0.00 0.00 0.00 23.12 21.95 1pg7 s ALA 151 CO -0.00 -0.72 0.27 -0.25 0.00 0.00 0.00 175.76 175.05 1pg7 n ASP 152 N 4.86 -5.39 0.00 0.00 8.00 0.33 -1.64 116.55 122.72 1pg7 n ASP 152 Ca -0.12 -0.11 0.00 0.00 0.71 0.00 0.00 54.79 55.26 1pg7 n ASP 152 Cb 0.48 -4.44 0.00 0.00 -0.02 0.00 0.00 41.12 37.14 1pg7 n ASP 152 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pg7 n GLY 153 N -1.17 0.82 3.58 0.44 0.00 -1.26 -5.03 105.19 102.57 1pg7 n GLY 153 Ca -0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 1pg7 n GLY 153 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pg7 s THR 154 N -2.98 3.65 0.54 2.61 2.01 -0.65 -5.09 115.64 115.74 1pg7 s THR 154 Ca 0.00 -0.55 -0.20 0.00 0.31 0.00 0.00 61.69 61.25 1pg7 s THR 154 Cb 0.00 -2.51 -0.06 0.00 0.01 0.00 0.00 72.50 69.95 1pg7 s THR 154 CO 0.00 0.56 1.16 -2.84 -0.69 0.00 0.00 174.62 172.81 1pg7 s PRO 155 N -0.92 3.34 -0.10 4.92 0.02 -1.26 -0.86 135.00 140.14 1pg7 s PRO 155 Ca 0.13 1.72 -0.01 0.00 0.02 0.00 0.00 61.00 62.87 1pg7 s PRO 155 Cb -0.11 -2.08 -0.03 0.00 0.02 0.00 0.00 34.50 32.30 1pg7 s PRO 155 CO 0.03 -0.88 -0.07 0.14 -0.33 0.00 0.00 177.00 175.88 1pg7 s VAL 156 N -1.66 3.66 -0.36 3.83 -7.23 -0.81 -4.81 120.40 113.00 1pg7 s VAL 156 Ca 0.72 -0.47 0.10 0.00 -1.81 0.00 0.00 61.98 60.51 1pg7 s VAL 156 Cb -0.27 -2.53 -0.12 0.00 0.56 0.00 0.00 36.38 34.02 1pg7 s VAL 156 CO 0.31 0.56 0.37 0.35 -0.31 0.00 0.00 175.10 176.38 1pg7 n THR 157 N 2.80 0.00 -4.14 5.32 -2.24 -1.26 -4.65 114.28 110.11 1pg7 n THR 157 Ca -0.18 -0.26 -0.11 0.00 -2.27 0.00 0.00 64.05 61.23 1pg7 n THR 157 Cb 0.53 0.84 -0.10 0.00 -2.10 0.00 0.00 70.33 69.49 1pg7 n THR 157 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1pg7 s GLN 158 N -2.09 0.74 0.00 -0.78 -2.07 -1.26 -4.85 119.66 109.35 1pg7 s GLN 158 Ca 0.02 -1.15 0.00 0.00 -1.82 0.00 0.00 55.36 52.41 1pg7 s GLN 158 Cb 0.07 -0.24 0.00 0.00 -1.09 0.00 0.00 33.01 31.76 1pg7 s GLN 158 CO 0.41 0.01 0.00 0.41 -1.32 0.00 0.00 175.29 174.79 1pg7 n GLY 159 N 0.44 0.77 3.84 2.60 0.00 -1.26 -4.94 105.19 106.64 1pg7 n GLY 159 Ca -0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 1pg7 n GLY 159 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1pg7 s ASP 160 N -2.97 5.90 -0.15 1.61 1.47 -1.26 -0.91 116.67 120.35 1pg7 s ASP 160 Ca 0.00 0.13 -0.07 0.00 1.18 0.00 0.00 52.55 53.79 1pg7 s ASP 160 Cb 0.00 -1.70 0.07 0.00 -0.34 0.00 0.00 42.92 40.94 1pg7 s ASP 160 CO 0.00 0.18 0.34 -0.70 0.68 0.00 0.00 175.17 175.67 1pg7 s GLU 161 N -2.37 0.27 -0.04 2.11 2.56 -0.75 -4.97 118.70 115.51 1pg7 s GLU 161 Ca 0.31 0.79 0.07 0.00 0.00 0.00 0.00 54.97 56.14 1pg7 s GLU 161 Cb -0.13 0.05 -0.01 0.00 2.00 0.00 0.00 34.13 36.04 1pg7 s GLU 161 CO 0.24 -0.22 -0.25 0.99 -0.56 0.00 0.00 175.26 175.46 1pg7 s THR 162 N 1.95 2.01 0.57 -1.70 2.01 -1.26 -0.26 115.64 118.96 1pg7 s THR 162 Ca -0.05 -1.06 -0.14 0.00 0.31 0.00 0.00 61.69 60.75 1pg7 s THR 162 Cb -0.11 -1.68 -0.05 0.00 0.01 0.00 0.00 72.50 70.67 1pg7 s THR 162 CO -0.11 0.56 1.02 0.42 -0.69 0.00 0.00 174.62 175.82 1pg7 s THR 163 N -0.37 4.43 0.19 -0.82 -4.23 0.94 -4.99 115.64 110.78 1pg7 s THR 163 Ca 0.03 1.01 -0.30 0.00 -1.18 0.00 0.00 61.69 61.25 1pg7 s THR 163 Cb -0.12 -3.68 -0.08 0.00 1.34 0.00 0.00 72.50 69.96 1pg7 s THR 163 CO 0.01 -0.81 1.03 -1.58 -0.54 0.00 0.00 174.62 172.73 1pg7 s GLN 164 N -4.49 4.68 0.25 3.99 2.00 -1.26 -4.50 119.66 120.33 1pg7 s GLN 164 Ca 0.58 1.61 -0.31 0.00 -2.00 0.00 0.00 55.36 55.25 1pg7 s GLN 164 Cb -0.12 -3.29 -0.14 0.00 0.80 0.00 0.00 33.01 30.26 1pg7 s GLN 164 CO 0.41 0.22 1.27 -2.30 -0.50 0.00 0.00 175.29 174.39 1pg7 n PRO 165 N 2.15 1.74 -4.25 1.67 -0.02 -1.26 -4.87 135.00 130.17 1pg7 n PRO 165 Ca 0.01 0.62 -0.19 0.00 -2.02 0.00 0.00 63.50 61.92 1pg7 n PRO 165 Cb 0.47 -2.18 -0.11 0.00 -0.02 0.00 0.00 33.50 31.65 1pg7 n PRO 165 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1pg7 s SER 166 N 0.00 2.09 0.09 2.55 1.04 -0.79 -4.95 113.70 113.73 1pg7 s SER 166 Ca 0.66 -0.76 -0.30 0.00 0.48 0.00 0.00 55.95 56.02 1pg7 s SER 166 Cb -0.69 -0.08 -0.06 0.00 0.10 0.00 0.00 66.02 65.29 1pg7 s SER 166 CO 0.54 -0.09 1.06 -0.75 0.98 0.00 0.00 173.24 174.97 1pg7 s LYS 167 N -2.40 4.58 0.72 4.02 2.47 -1.26 -0.93 119.74 126.93 1pg7 s LYS 167 Ca 0.07 1.59 -0.07 0.00 -1.56 0.00 0.00 55.97 56.00 1pg7 s LYS 167 Cb -0.07 -3.36 0.16 0.00 -1.46 0.00 0.00 37.83 33.10 1pg7 s LYS 167 CO 0.03 0.01 0.98 1.04 0.16 0.00 0.00 175.35 177.57 1pg7 n GLN 168 N 3.19 -0.53 -0.08 4.03 6.02 0.38 -4.90 117.38 125.49 1pg7 n GLN 168 Ca 0.05 -2.03 -0.03 0.00 -0.01 0.00 0.00 57.00 54.97 1pg7 n GLN 168 Cb 0.48 -0.85 0.19 0.00 1.02 0.00 0.00 30.24 31.09 1pg7 n GLN 168 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1pg7 h SER 168 N -0.97 0.68 0.40 1.08 0.87 -1.98 -2.05 113.55 111.58 1pg7 h SER 168 Ca -0.32 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 1pg7 h SER 168 Cb 1.02 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.80 1pg7 h SER 168 CO 0.28 0.76 0.00 0.59 -0.53 0.00 0.00 176.83 177.93 1pg7 n ASN 168 N -4.22 0.23 0.00 6.23 5.03 -1.26 -4.86 115.26 116.40 1pg7 n ASN 168 Ca 0.02 0.57 0.00 0.00 0.87 0.00 0.00 54.58 56.04 1pg7 n ASN 168 Cb 0.29 -0.61 0.00 0.00 -1.02 0.00 0.00 39.78 38.44 1pg7 n ASN 168 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1pg7 n ASN 169 N -1.76 -0.14 -3.31 6.41 3.02 -0.77 -5.01 115.26 113.68 1pg7 n ASN 169 Ca 0.02 0.00 -0.17 0.00 -0.03 0.00 0.00 54.58 54.40 1pg7 n ASN 169 Cb 0.13 -0.12 0.11 0.00 -0.61 0.00 0.00 39.78 39.29 1pg7 n ASN 169 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1pg7 n LYS 170 N -2.04 -0.49 -4.46 3.52 5.02 -1.26 -4.72 118.16 113.73 1pg7 n LYS 170 Ca 0.00 -1.41 -0.24 0.00 -2.02 0.00 0.00 58.31 54.63 1pg7 n LYS 170 Cb 0.00 -0.71 -0.10 0.00 -0.02 0.00 0.00 35.03 34.21 1pg7 n LYS 170 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1pg7 s TYR 171 N -2.49 2.37 0.19 2.13 1.51 0.52 -0.47 117.35 121.11 1pg7 s TYR 171 Ca 0.45 -0.36 0.03 0.00 -1.01 0.00 0.00 57.07 56.18 1pg7 s TYR 171 Cb -0.02 -1.11 -0.05 0.00 -0.11 0.00 0.00 41.96 40.67 1pg7 s TYR 171 CO 0.31 0.67 -0.03 0.00 -1.11 0.00 0.00 175.55 175.39 1pg7 s MET 172 N -3.56 1.19 0.14 -0.62 0.23 -0.10 -1.53 119.30 115.05 1pg7 s MET 172 Ca 0.31 -1.57 -0.25 0.00 -1.03 0.00 0.00 55.69 53.15 1pg7 s MET 172 Cb -0.03 -0.50 0.07 0.00 -1.53 0.00 0.00 34.83 32.84 1pg7 s MET 172 CO 0.16 -0.06 1.02 0.00 -2.03 0.00 0.00 175.02 174.11 1pg7 s ALA 173 N -3.47 -1.72 -0.01 3.16 0.00 0.11 -1.88 121.76 117.94 1pg7 s ALA 173 Ca 0.24 0.11 -0.16 0.00 0.00 0.00 0.00 51.96 52.15 1pg7 s ALA 173 Cb 0.05 0.62 0.03 0.00 0.00 0.00 0.00 23.12 23.82 1pg7 s ALA 173 CO 0.05 -1.05 0.35 -1.54 0.00 0.00 0.00 175.76 173.57 1pg7 s SER 174 N -3.04 -0.23 0.03 0.00 1.04 -1.26 -1.37 113.70 108.86 1pg7 s SER 174 Ca 0.14 0.12 0.02 0.00 0.48 0.00 0.00 55.95 56.72 1pg7 s SER 174 Cb -0.01 0.34 -0.02 0.00 0.10 0.00 0.00 66.02 66.44 1pg7 s SER 174 CO 0.02 -0.48 -0.08 -0.55 0.98 0.00 0.00 173.24 173.13 1pg7 s SER 175 N -1.39 0.88 -0.03 7.02 0.15 -0.57 -0.04 113.70 119.72 1pg7 s SER 175 Ca -0.12 -0.39 0.05 0.00 0.70 0.00 0.00 55.95 56.19 1pg7 s SER 175 Cb -0.04 -0.02 -0.01 0.00 -1.71 0.00 0.00 66.02 64.24 1pg7 s SER 175 CO 0.04 -0.09 -0.18 -0.31 1.20 0.00 0.00 173.24 173.90 1pg7 s TYR 176 N -0.90 1.71 -0.27 3.44 2.02 0.64 -1.03 117.35 122.96 1pg7 s TYR 176 Ca -0.05 -0.39 -0.02 0.00 -0.37 0.00 0.00 57.07 56.25 1pg7 s TYR 176 Cb -0.07 -1.12 0.03 0.00 -0.40 0.00 0.00 41.96 40.40 1pg7 s TYR 176 CO 0.00 -0.08 -0.03 -1.17 -1.57 0.00 0.00 175.55 172.70 1pg7 s LEU 177 N -0.26 3.51 -0.33 -1.29 2.96 -0.44 -1.81 118.68 121.03 1pg7 s LEU 177 Ca 0.03 -1.03 -0.12 0.00 -0.22 0.00 0.00 54.13 52.79 1pg7 s LEU 177 Cb -0.09 -1.69 -0.02 0.00 0.50 0.00 0.00 46.19 44.89 1pg7 s LEU 177 CO 0.00 -0.19 0.22 -0.89 -1.32 0.00 0.00 176.35 174.18 1pg7 s THR 178 N 1.30 5.12 0.27 3.68 2.01 -0.09 -1.11 115.64 126.82 1pg7 s THR 178 Ca -0.02 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 61.77 1pg7 s THR 178 Cb -0.18 -3.61 -0.06 0.00 0.01 0.00 0.00 72.50 68.66 1pg7 s THR 178 CO -0.03 0.03 0.04 -0.76 -0.69 0.00 0.00 174.62 173.20 1pg7 s LEU 179 N 1.70 2.07 0.58 4.42 1.43 0.12 -4.78 118.68 124.22 1pg7 s LEU 179 Ca 0.06 -1.30 -0.05 0.00 -1.03 0.00 0.00 54.13 51.81 1pg7 s LEU 179 Cb -0.17 -0.24 0.01 0.00 0.03 0.00 0.00 46.19 45.82 1pg7 s LEU 179 CO 0.09 -0.59 0.88 0.42 0.23 0.00 0.00 176.35 177.39 1pg7 s THR 180 N -3.45 3.53 0.42 5.49 -4.23 -1.26 0.32 115.64 116.45 1pg7 s THR 180 Ca 0.33 -0.11 0.10 0.00 -1.18 0.00 0.00 61.69 60.83 1pg7 s THR 180 Cb 0.07 -3.39 0.20 0.00 1.34 0.00 0.00 72.50 70.72 1pg7 s THR 180 CO 0.12 -0.39 1.99 0.00 -0.54 0.00 0.00 174.62 175.80 1pg7 h ALA 181 N -0.14 1.65 0.59 3.99 0.00 -1.75 -1.95 119.26 121.65 1pg7 h ALA 181 Ca -0.45 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 1pg7 h ALA 181 Cb 1.26 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1pg7 h ALA 181 CO 0.60 0.27 -0.36 0.93 0.00 0.00 0.00 179.25 180.68 1pg7 h GLU 182 N 0.26 -0.87 -0.59 0.00 5.08 -1.93 -2.11 114.58 114.43 1pg7 h GLU 182 Ca 0.06 0.06 0.09 0.00 -1.00 0.00 0.00 59.36 58.57 1pg7 h GLU 182 Cb 0.20 0.20 -0.07 0.00 0.50 0.00 0.00 28.75 29.58 1pg7 h GLU 182 CO 0.01 -0.58 0.22 0.00 -1.00 0.00 0.00 179.01 177.65 1pg7 h ALA 183 N -0.57 0.75 -0.97 3.43 0.00 -1.86 -0.43 119.26 119.61 1pg7 h ALA 183 Ca -0.07 0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.97 1pg7 h ALA 183 Cb 0.73 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.51 1pg7 h ALA 183 CO 0.07 -0.19 0.63 2.35 0.00 0.00 0.00 179.25 182.11 1pg7 h TRP 184 N 0.40 1.16 0.00 0.00 2.91 -1.24 -2.48 115.95 116.71 1pg7 h TRP 184 Ca 0.29 0.03 -0.16 0.00 1.13 0.00 0.00 58.89 60.19 1pg7 h TRP 184 Cb 0.35 -0.38 -0.02 0.00 -0.51 0.00 0.00 29.16 28.60 1pg7 h TRP 184 CO -0.17 0.62 -0.75 0.93 -1.03 0.00 0.00 178.44 178.05 1pg7 h GLU 185 N 1.16 0.00 -0.35 2.65 5.08 -0.62 -3.31 114.58 119.19 1pg7 h GLU 185 Ca 0.41 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.63 1pg7 h GLU 185 Cb 0.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1pg7 h GLU 185 CO -0.16 0.75 -0.32 0.77 -1.00 0.00 0.00 179.01 179.05 1pg7 h SER 186 N 0.00 0.80 -1.99 1.42 0.02 -0.66 -3.45 113.55 109.70 1pg7 h SER 186 Ca -0.01 -0.33 -0.46 0.00 -0.84 0.00 0.00 61.79 60.15 1pg7 h SER 186 Cb 1.39 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 1pg7 h SER 186 CO 0.10 1.06 -0.40 -1.00 -1.14 0.00 0.00 176.83 175.45 1pg7 s HIS 187 N -4.44 3.22 0.00 3.45 3.76 -1.06 -5.06 115.29 115.16 1pg7 s HIS 187 Ca -0.09 -0.14 0.00 0.00 -0.15 0.00 0.00 55.06 54.68 1pg7 s HIS 187 Cb 0.12 -1.76 0.00 0.00 1.11 0.00 0.00 32.58 32.05 1pg7 s HIS 187 CO 0.85 0.23 0.00 -1.13 -0.85 0.00 0.00 174.74 173.83 1pg7 n SER 188 N -1.49 3.42 -4.12 1.40 3.41 -1.26 -4.91 113.62 110.07 1pg7 n SER 188 Ca -0.04 -0.14 -0.28 0.00 -0.26 0.00 0.00 58.87 58.15 1pg7 n SER 188 Cb 0.58 0.96 -0.17 0.00 -0.26 0.00 0.00 64.21 65.32 1pg7 n SER 188 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1pg7 s SER 189 N -1.64 2.38 -0.03 4.04 0.15 -1.26 -4.16 113.70 113.18 1pg7 s SER 189 Ca 0.00 -0.42 0.03 0.00 0.70 0.00 0.00 55.95 56.26 1pg7 s SER 189 Cb 0.00 -1.03 0.00 0.00 -1.71 0.00 0.00 66.02 63.28 1pg7 s SER 189 CO 0.00 0.11 -0.12 -0.31 1.20 0.00 0.00 173.24 174.12 1pg7 s TYR 190 N 0.43 1.20 -0.02 3.44 1.51 -0.96 -0.51 117.35 122.44 1pg7 s TYR 190 Ca -0.15 -0.32 0.02 0.00 -1.01 0.00 0.00 57.07 55.62 1pg7 s TYR 190 Cb -0.16 -0.84 0.00 0.00 -0.11 0.00 0.00 41.96 40.85 1pg7 s TYR 190 CO 0.06 -0.12 -0.08 -1.12 -1.11 0.00 0.00 175.55 173.17 1pg7 s SER 191 N 0.16 1.07 -0.25 2.29 0.01 -0.32 -1.71 113.70 114.95 1pg7 s SER 191 Ca -0.04 -0.16 -0.02 0.00 1.31 0.00 0.00 55.95 57.04 1pg7 s SER 191 Cb -0.10 -0.23 0.02 0.00 0.21 0.00 0.00 66.02 65.92 1pg7 s SER 191 CO 0.01 0.07 -0.05 0.00 0.41 0.00 0.00 173.24 173.68 1pg7 s HIS 193 N 1.36 3.37 -0.20 0.00 3.76 0.14 -1.89 115.29 121.82 1pg7 s HIS 193 Ca 0.01 0.26 -0.01 0.00 -0.15 0.00 0.00 55.06 55.17 1pg7 s HIS 193 Cb -0.16 -2.09 0.06 0.00 1.11 0.00 0.00 32.58 31.50 1pg7 s HIS 193 CO -0.04 0.31 -0.02 0.08 -0.85 0.00 0.00 174.74 174.22 1pg7 s VAL 194 N 0.13 1.05 -0.26 -0.90 1.01 0.39 -0.46 120.40 121.36 1pg7 s VAL 194 Ca 0.07 -0.84 -0.11 0.00 0.00 0.00 0.00 61.98 61.10 1pg7 s VAL 194 Cb -0.12 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.83 1pg7 s VAL 194 CO -0.00 -0.10 0.20 -0.89 0.00 0.00 0.00 175.10 174.31 1pg7 s THR 195 N 1.63 5.32 -0.11 3.92 2.01 0.17 0.12 115.64 128.69 1pg7 s THR 195 Ca -0.03 0.23 0.01 0.00 0.31 0.00 0.00 61.69 62.21 1pg7 s THR 195 Cb -0.17 -3.54 0.02 0.00 0.01 0.00 0.00 72.50 68.82 1pg7 s THR 195 CO -0.07 0.29 -0.13 -2.28 -0.69 0.00 0.00 174.62 171.74 1pg7 s HIS 196 N 1.43 1.86 -1.42 4.92 5.04 -0.83 -1.73 115.29 124.55 1pg7 s HIS 196 Ca 0.08 -0.91 -0.01 0.00 -1.54 0.00 0.00 55.06 52.68 1pg7 s HIS 196 Cb -0.15 -1.39 0.00 0.00 0.04 0.00 0.00 32.58 31.09 1pg7 s HIS 196 CO 0.08 -0.51 0.35 0.39 -2.34 0.00 0.00 174.74 172.71 1pg7 n GLU 197 N 4.44 -2.82 0.00 2.88 1.02 -1.26 -1.39 120.64 123.51 1pg7 n GLU 197 Ca -0.18 0.35 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 1pg7 n GLU 197 Cb 0.51 -4.34 0.00 0.00 -0.02 0.00 0.00 31.44 27.59 1pg7 n GLU 197 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pg7 n GLY 198 N -2.08 2.41 3.51 0.62 0.00 -1.26 -4.99 105.19 103.40 1pg7 n GLY 198 Ca -0.31 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.32 1pg7 n GLY 198 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1pg7 s GLN 199 N 0.00 3.59 -0.13 1.61 1.11 -0.49 -5.07 119.66 120.28 1pg7 s GLN 199 Ca 0.00 -0.56 -0.27 0.00 0.01 0.00 0.00 55.36 54.54 1pg7 s GLN 199 Cb 0.00 -3.65 -0.01 0.00 -1.01 0.00 0.00 33.01 28.34 1pg7 s GLN 199 CO 0.00 -0.34 0.90 0.45 0.01 0.00 0.00 175.29 176.31 1pg7 s SER 200 N 1.69 7.09 -0.17 5.90 0.15 -1.26 -1.96 113.70 125.13 1pg7 s SER 200 Ca 0.06 1.33 -0.04 0.00 0.70 0.00 0.00 55.95 58.00 1pg7 s SER 200 Cb -0.17 -2.50 -0.02 0.00 -1.71 0.00 0.00 66.02 61.62 1pg7 s SER 200 CO 0.09 -0.40 -0.03 -0.69 1.20 0.00 0.00 173.24 173.41 1pg7 s VAL 201 N 2.00 3.85 0.11 4.45 1.01 0.12 -4.93 120.40 127.01 1pg7 s VAL 201 Ca 0.43 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 62.08 1pg7 s VAL 201 Cb -0.17 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1pg7 s VAL 201 CO 0.15 0.47 -0.10 -1.83 0.00 0.00 0.00 175.10 173.79 1pg7 s GLU 202 N 0.63 0.90 -0.00 2.72 -1.05 -1.26 -0.46 118.70 120.18 1pg7 s GLU 202 Ca -0.02 -1.23 0.02 0.00 -0.15 0.00 0.00 54.97 53.59 1pg7 s GLU 202 Cb -0.14 -0.57 -0.01 0.00 -0.44 0.00 0.00 34.13 32.97 1pg7 s GLU 202 CO 0.02 0.09 -0.07 0.15 0.95 0.00 0.00 175.26 176.39 1pg7 s LYS 203 N -3.00 0.60 0.28 -4.83 -0.14 -0.79 -5.00 119.74 106.85 1pg7 s LYS 203 Ca 0.08 -0.29 0.03 0.00 -1.36 0.00 0.00 55.97 54.43 1pg7 s LYS 203 Cb -0.02 -0.57 -0.06 0.00 -1.68 0.00 0.00 37.83 35.51 1pg7 s LYS 203 CO 0.00 0.15 0.06 -1.12 -0.76 0.00 0.00 175.35 173.69 1pg7 s SER 204 N -0.24 1.84 0.23 2.83 0.01 -1.26 -1.19 113.70 115.92 1pg7 s SER 204 Ca 0.02 -1.35 -0.22 0.00 1.31 0.00 0.00 55.95 55.71 1pg7 s SER 204 Cb -0.03 0.02 0.04 0.00 0.21 0.00 0.00 66.02 66.26 1pg7 s SER 204 CO -0.00 -0.64 0.70 -1.48 0.41 0.00 0.00 173.24 172.23 1pg7 s LEU 205 N -3.39 -0.36 0.00 2.44 0.05 -0.70 -5.00 118.68 111.73 1pg7 s LEU 205 Ca 0.36 -0.39 0.00 0.00 0.05 0.00 0.00 54.13 54.15 1pg7 s LEU 205 Cb 0.08 2.64 0.00 0.00 -2.05 0.00 0.00 46.19 46.86 1pg7 s LEU 205 CO 0.14 -1.19 0.07 -1.20 -0.55 0.00 0.00 176.35 173.62