#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gt3 n LEU 2 N 0.00 2.34 -4.32 -3.43 4.32 -1.26 -4.99 117.00 109.66 2gt3 n LEU 2 Ca 0.00 0.23 -0.17 0.00 -0.02 0.00 0.00 56.01 56.04 2gt3 n LEU 2 Cb 0.00 -0.97 -0.10 0.00 -1.62 0.00 0.00 43.42 40.73 2gt3 n LEU 2 CO 0.00 0.65 -0.43 0.72 -1.22 0.00 0.00 177.39 177.10 2gt3 s PHE 3 N -2.48 1.61 0.01 -1.77 -0.12 -1.26 -5.16 117.98 108.81 2gt3 s PHE 3 Ca -0.30 -0.61 0.01 0.00 -0.05 0.00 0.00 56.93 55.98 2gt3 s PHE 3 Cb 0.09 -0.76 -0.01 0.00 -0.63 0.00 0.00 43.02 41.71 2gt3 s PHE 3 CO 0.63 0.29 -0.04 -0.51 -0.05 0.00 0.00 175.22 175.54 2gt3 s ASP 4 N -3.26 0.49 -0.12 1.98 1.01 -1.26 -5.01 116.67 110.49 2gt3 s ASP 4 Ca 0.21 -0.24 0.03 0.00 0.71 0.00 0.00 52.55 53.27 2gt3 s ASP 4 Cb -0.00 -0.01 0.27 0.00 1.01 0.00 0.00 42.92 44.20 2gt3 s ASP 4 CO 0.05 -0.06 1.12 0.29 0.21 0.00 0.00 175.17 176.78 2gt3 n LYS 5 N 2.44 2.00 -0.04 8.23 5.02 -1.26 -3.90 118.16 130.65 2gt3 n LYS 5 Ca -0.17 -1.12 0.07 0.00 -2.02 0.00 0.00 58.31 55.07 2gt3 n LYS 5 Cb 0.57 -1.63 0.31 0.00 -0.02 0.00 0.00 35.03 34.27 2gt3 n LYS 5 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2gt3 n LYS 6 N 0.09 1.28 -2.46 1.97 4.81 -1.26 -4.84 118.16 117.75 2gt3 n LYS 6 Ca 0.15 -0.43 -0.42 0.00 -0.87 0.00 0.00 58.31 56.74 2gt3 n LYS 6 Cb 0.74 -1.24 -0.03 0.00 0.02 0.00 0.00 35.03 34.52 2gt3 n LYS 6 CO 0.00 0.00 0.00 -3.38 1.17 0.00 0.00 177.40 175.19 2gt3 s HIS 7 N -1.88 3.49 -0.18 5.64 -3.43 -1.25 -5.02 115.29 112.66 2gt3 s HIS 7 Ca 0.21 1.41 -0.08 0.00 -0.80 0.00 0.00 55.06 55.80 2gt3 s HIS 7 Cb 0.10 -3.36 -0.04 0.00 -1.43 0.00 0.00 32.58 27.85 2gt3 s HIS 7 CO 0.16 -1.01 0.07 -1.17 -2.00 0.00 0.00 174.74 170.79 2gt3 s LEU 8 N 0.64 3.89 0.69 5.38 2.96 -1.26 -5.07 118.68 125.92 2gt3 s LEU 8 Ca 0.56 0.12 -0.16 0.00 -0.22 0.00 0.00 54.13 54.42 2gt3 s LEU 8 Cb -0.29 -1.98 -0.02 0.00 0.50 0.00 0.00 46.19 44.40 2gt3 s LEU 8 CO 0.31 0.19 0.84 0.55 -1.32 0.00 0.00 176.35 176.92 2gt3 n VAL 9 N 3.43 2.73 -2.71 1.68 3.14 -1.26 -4.99 118.33 120.34 2gt3 n VAL 9 Ca -0.17 -0.41 -0.23 0.00 -2.96 0.00 0.00 64.34 60.58 2gt3 n VAL 9 Cb 0.52 -1.00 0.03 0.00 -1.06 0.00 0.00 33.84 32.33 2gt3 n VAL 9 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 2gt3 s SER 10 N -1.51 5.49 0.14 6.55 0.01 -1.26 -4.84 113.70 118.27 2gt3 s SER 10 Ca 0.72 0.23 -0.04 0.00 1.31 0.00 0.00 55.95 58.16 2gt3 s SER 10 Cb -0.36 -1.24 -0.06 0.00 0.21 0.00 0.00 66.02 64.57 2gt3 s SER 10 CO 0.51 -1.00 1.34 1.55 0.41 0.00 0.00 173.24 176.05 2gt3 h PRO 11 N 0.11 0.44 0.00 12.44 0.13 -1.94 0.94 132.00 144.13 2gt3 h PRO 11 Ca -0.44 -0.43 0.00 0.00 -0.87 0.00 0.00 66.00 64.26 2gt3 h PRO 11 Cb 1.28 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.52 2gt3 h PRO 11 CO 0.56 1.08 0.00 0.00 -0.23 0.00 0.00 178.00 179.41 2gt3 n ALA 12 N -2.54 1.91 -0.09 -0.56 0.00 -1.26 -2.92 120.51 115.05 2gt3 n ALA 12 Ca -0.06 0.04 -0.10 0.00 0.00 0.00 0.00 53.44 53.31 2gt3 n ALA 12 Cb 0.79 -1.42 -0.12 0.00 0.00 0.00 0.00 19.45 18.71 2gt3 n ALA 12 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2gt3 n ASP 13 N -2.21 1.43 -4.51 0.00 -0.08 -1.10 -4.99 116.55 105.09 2gt3 n ASP 13 Ca 0.04 -0.04 -0.39 0.00 -1.51 0.00 0.00 54.79 52.88 2gt3 n ASP 13 Cb 0.31 0.47 0.03 0.00 2.34 0.00 0.00 41.12 44.27 2gt3 n ASP 13 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2gt3 n ALA 14 N -2.79 -0.78 -1.57 -1.67 0.00 0.32 -4.85 120.51 109.17 2gt3 n ALA 14 Ca -0.31 0.07 -0.39 0.00 0.00 0.00 0.00 53.44 52.82 2gt3 n ALA 14 Cb 0.99 -1.90 0.04 0.00 0.00 0.00 0.00 19.45 18.57 2gt3 n ALA 14 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2gt3 n LEU 15 N 0.51 2.64 0.18 0.00 4.77 -0.15 -4.87 117.00 120.09 2gt3 n LEU 15 Ca 0.11 0.84 0.14 0.00 -0.03 0.00 0.00 56.01 57.07 2gt3 n LEU 15 Cb 0.44 -1.32 0.44 0.00 -2.33 0.00 0.00 43.42 40.65 2gt3 n LEU 15 CO 0.53 -2.11 0.89 1.55 -1.33 0.00 0.00 177.39 176.92 2gt3 h PRO 16 N 0.65 0.00 0.00 3.23 0.13 -1.92 -3.35 132.00 130.74 2gt3 h PRO 16 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2gt3 h PRO 16 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2gt3 h PRO 16 CO 0.51 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.69 2gt3 n GLY 17 N 0.61 1.42 3.24 1.56 0.00 -1.26 -4.23 105.19 106.53 2gt3 n GLY 17 Ca 0.03 -2.00 -0.14 0.00 0.00 0.00 0.00 46.02 43.92 2gt3 n GLY 17 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2gt3 s ARG 18 N -2.07 1.04 -1.20 1.61 3.52 -1.26 -5.00 118.95 115.60 2gt3 s ARG 18 Ca 0.00 -1.44 -0.16 0.00 -0.13 0.00 0.00 55.73 54.01 2gt3 s ARG 18 Cb 0.00 -0.59 0.14 0.00 -1.56 0.00 0.00 34.95 32.94 2gt3 s ARG 18 CO 0.00 0.07 1.48 0.54 -0.81 0.00 0.00 175.30 176.58 2gt3 s ASN 19 N -3.15 6.96 -0.31 -2.12 2.20 -1.26 -4.87 114.94 112.39 2gt3 s ASN 19 Ca 0.16 -2.73 -0.01 0.00 -0.94 0.00 0.00 52.86 49.34 2gt3 s ASN 19 Cb 0.03 -2.45 0.10 0.00 -2.00 0.00 0.00 41.25 36.93 2gt3 s ASN 19 CO 0.00 -0.90 0.11 -0.89 -2.94 0.00 0.00 177.10 172.48 2gt3 s THR 20 N 2.42 0.67 0.18 0.54 2.01 -1.26 -5.12 115.64 115.08 2gt3 s THR 20 Ca 0.45 -1.30 -0.30 0.00 0.31 0.00 0.00 61.69 60.84 2gt3 s THR 20 Cb -0.01 -1.51 -0.08 0.00 0.01 0.00 0.00 72.50 70.91 2gt3 s THR 20 CO 0.01 -0.70 1.12 -2.16 -0.69 0.00 0.00 174.62 172.19 2gt3 s PRO 21 N 1.67 4.58 -0.23 4.92 0.04 -1.26 -5.03 135.00 139.69 2gt3 s PRO 21 Ca 0.10 1.75 -0.04 0.00 0.04 0.00 0.00 61.00 62.85 2gt3 s PRO 21 Cb -0.17 -3.27 -0.00 0.00 0.04 0.00 0.00 34.50 31.10 2gt3 s PRO 21 CO -0.26 0.05 -0.02 1.41 0.04 0.00 0.00 177.00 178.22 2gt3 s MET 22 N -0.41 3.29 0.13 4.56 1.75 -1.26 -5.09 119.30 122.27 2gt3 s MET 22 Ca 0.50 -0.69 -0.30 0.00 -1.25 0.00 0.00 55.69 53.95 2gt3 s MET 22 Cb -0.30 -3.07 -0.07 0.00 2.84 0.00 0.00 34.83 34.24 2gt3 s MET 22 CO 0.36 -0.25 1.14 -1.25 -0.65 0.00 0.00 175.02 174.36 2gt3 s PRO 23 N 1.47 4.53 -0.04 4.11 0.04 -1.26 -5.00 135.00 138.85 2gt3 s PRO 23 Ca 0.05 1.74 -0.02 0.00 0.04 0.00 0.00 61.00 62.81 2gt3 s PRO 23 Cb -0.15 -3.30 -0.04 0.00 0.04 0.00 0.00 34.50 31.05 2gt3 s PRO 23 CO -0.02 -0.05 0.07 0.08 0.04 0.00 0.00 177.00 177.11 2gt3 s VAL 24 N 0.25 4.74 0.61 -0.36 1.01 -1.26 -4.73 120.40 120.65 2gt3 s VAL 24 Ca 0.53 -0.29 -0.18 0.00 0.00 0.00 0.00 61.98 62.04 2gt3 s VAL 24 Cb -0.29 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 2gt3 s VAL 24 CO 0.33 0.44 0.86 0.00 0.00 0.00 0.00 175.10 176.73 2gt3 n ALA 25 N 1.51 -0.16 0.09 5.51 0.00 -1.26 -4.90 120.51 121.29 2gt3 n ALA 25 Ca -0.15 -0.02 -0.06 0.00 0.00 0.00 0.00 53.44 53.20 2gt3 n ALA 25 Cb 0.53 -2.04 -0.01 0.00 0.00 0.00 0.00 19.45 17.93 2gt3 n ALA 25 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2gt3 h THR 26 N 0.34 1.57 -3.81 0.00 2.02 -1.97 -3.43 112.91 107.62 2gt3 h THR 26 Ca -0.48 -2.83 -0.24 0.00 0.77 0.00 0.00 66.41 63.63 2gt3 h THR 26 Cb 1.37 2.55 -0.16 0.00 -1.74 0.00 0.00 68.15 70.18 2gt3 h THR 26 CO 0.49 0.81 -0.70 -0.76 0.37 0.00 0.00 175.52 175.73 2gt3 s LEU 27 N -7.18 2.47 1.03 2.58 1.43 -1.26 -3.27 118.68 114.49 2gt3 s LEU 27 Ca -0.01 -0.93 -0.12 0.00 -1.03 0.00 0.00 54.13 52.03 2gt3 s LEU 27 Cb 0.11 -0.11 0.17 0.00 0.03 0.00 0.00 46.19 46.39 2gt3 s LEU 27 CO 0.81 -0.41 0.87 1.57 0.23 0.00 0.00 176.35 179.42 2gt3 n HIS 28 N 0.19 -0.43 0.03 0.29 -0.00 0.58 -4.76 115.22 111.11 2gt3 n HIS 28 Ca -0.14 0.16 -0.10 0.00 -0.00 0.00 0.00 57.72 57.65 2gt3 n HIS 28 Cb 0.60 -1.82 -0.07 0.00 -0.00 0.00 0.00 29.99 28.69 2gt3 n HIS 28 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2gt3 h ALA 29 N -2.14 -0.17 0.00 1.57 0.00 -1.92 -2.37 119.26 114.23 2gt3 h ALA 29 Ca -0.50 -0.23 -0.21 0.00 0.00 0.00 0.00 54.91 53.97 2gt3 h ALA 29 Cb 1.30 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.13 2gt3 h ALA 29 CO 0.42 -0.23 -1.24 0.28 0.00 0.00 0.00 179.25 178.48 2gt3 n VAL 30 N -4.87 1.51 -0.10 0.00 0.31 -1.26 -4.17 118.33 109.76 2gt3 n VAL 30 Ca -0.07 -0.01 0.09 0.00 -0.01 0.00 0.00 64.34 64.34 2gt3 n VAL 30 Cb 0.26 -2.10 0.45 0.00 -0.91 0.00 0.00 33.84 31.53 2gt3 n VAL 30 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 2gt3 h ASN 31 N -1.00 0.47 -0.26 4.52 -1.24 -1.86 -3.44 115.58 112.77 2gt3 h ASN 31 Ca -0.31 0.00 -0.11 0.00 0.71 0.00 0.00 56.30 56.59 2gt3 h ASN 31 Cb 1.18 -0.10 -0.04 0.00 0.73 0.00 0.00 38.32 40.09 2gt3 h ASN 31 CO -0.19 0.30 -0.10 0.61 -1.29 0.00 0.00 177.43 176.76 2gt3 n GLY 32 N -1.49 0.54 3.99 1.57 0.00 -0.89 -4.83 105.19 104.08 2gt3 n GLY 32 Ca 0.09 -0.01 -0.18 0.00 0.00 0.00 0.00 46.02 45.92 2gt3 n GLY 32 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2gt3 s HIS 33 N -1.49 2.92 -0.15 1.61 3.76 -1.26 -4.34 115.29 116.33 2gt3 s HIS 33 Ca 0.00 -0.33 -0.36 0.00 -0.15 0.00 0.00 55.06 54.22 2gt3 s HIS 33 Cb 0.00 -2.19 -0.13 0.00 1.11 0.00 0.00 32.58 31.37 2gt3 s HIS 33 CO 0.00 -0.22 1.85 0.43 -0.85 0.00 0.00 174.74 175.96 2gt3 n SER 34 N -1.73 3.13 0.07 1.40 7.64 -1.26 0.22 113.62 123.08 2gt3 n SER 34 Ca 0.04 0.99 -0.21 0.00 1.01 0.00 0.00 58.87 60.70 2gt3 n SER 34 Cb 0.59 -1.30 -0.15 0.00 -1.01 0.00 0.00 64.21 62.34 2gt3 n SER 34 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2gt3 h MET 35 N 8.73 0.35 0.10 1.43 2.86 -1.83 -3.38 114.93 123.19 2gt3 h MET 35 Ca -0.48 -0.60 -0.01 0.00 -2.06 0.00 0.00 59.70 56.56 2gt3 h MET 35 Cb 1.29 0.22 0.00 0.00 0.06 0.00 0.00 31.60 33.17 2gt3 h MET 35 CO 0.96 1.29 -0.05 1.79 1.06 0.00 0.00 176.91 181.95 2gt3 h THR 36 N -0.26 0.98 -2.73 2.22 1.35 -1.85 -3.44 112.91 109.17 2gt3 h THR 36 Ca -0.17 -1.35 -0.52 0.00 -0.55 0.00 0.00 66.41 63.81 2gt3 h THR 36 Cb 1.76 1.70 0.05 0.00 -1.73 0.00 0.00 68.15 69.93 2gt3 h THR 36 CO 0.18 0.28 0.96 0.21 -0.25 0.00 0.00 175.52 176.89 2gt3 s ASN 37 N -5.64 6.48 -0.06 5.36 2.47 -1.26 -5.00 114.94 117.30 2gt3 s ASN 37 Ca -0.13 2.73 0.05 0.00 0.42 0.00 0.00 52.86 55.94 2gt3 s ASN 37 Cb -0.00 -2.59 -0.01 0.00 -1.45 0.00 0.00 41.25 37.20 2gt3 s ASN 37 CO 0.48 -0.90 -0.23 -0.69 -3.72 0.00 0.00 177.10 172.04 2gt3 s VAL 38 N 1.27 1.86 0.46 -5.21 1.01 -1.26 -4.73 120.40 113.80 2gt3 s VAL 38 Ca 0.73 -0.96 -0.21 0.00 0.00 0.00 0.00 61.98 61.54 2gt3 s VAL 38 Cb -0.46 -1.58 -0.09 0.00 0.00 0.00 0.00 36.38 34.25 2gt3 s VAL 38 CO 0.32 0.52 1.04 -2.16 0.00 0.00 0.00 175.10 174.82 2gt3 s PRO 39 N -0.07 3.91 0.13 2.72 0.04 -1.26 -4.96 135.00 135.51 2gt3 s PRO 39 Ca -0.04 1.42 -0.31 0.00 0.04 0.00 0.00 61.00 62.10 2gt3 s PRO 39 Cb -0.13 -2.24 -0.10 0.00 0.04 0.00 0.00 34.50 32.07 2gt3 s PRO 39 CO 0.03 -0.34 1.73 0.34 0.04 0.00 0.00 177.00 178.80 2gt3 s ASP 40 N -1.84 6.48 0.00 6.66 2.15 -1.26 -1.54 116.67 127.32 2gt3 s ASP 40 Ca 0.64 2.69 0.00 0.00 0.43 0.00 0.00 52.55 56.32 2gt3 s ASP 40 Cb -0.18 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 39.86 2gt3 s ASP 40 CO 0.22 -0.94 0.00 0.61 -0.17 0.00 0.00 175.17 174.89 2gt3 n GLY 41 N 4.06 0.54 3.92 2.66 0.00 -1.26 -5.09 105.19 110.02 2gt3 n GLY 41 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 2gt3 n GLY 41 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2gt3 s MET 42 N -0.64 3.57 0.15 1.61 0.00 -0.59 -4.19 119.30 119.20 2gt3 s MET 42 Ca 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 55.69 55.63 2gt3 s MET 42 Cb 0.00 -2.59 -0.04 0.00 0.00 0.00 0.00 34.83 32.20 2gt3 s MET 42 CO 0.00 0.09 0.04 -1.21 0.00 0.00 0.00 175.02 173.95 2gt3 s GLU 43 N -4.08 1.00 0.14 4.11 0.41 -0.47 -4.95 118.70 114.86 2gt3 s GLU 43 Ca 0.44 -1.48 0.11 0.00 -0.41 0.00 0.00 54.97 53.62 2gt3 s GLU 43 Cb -0.10 0.08 -0.04 0.00 -1.78 0.00 0.00 34.13 32.29 2gt3 s GLU 43 CO 0.35 -0.23 -0.24 0.42 -0.49 0.00 0.00 175.26 175.07 2gt3 s ILE 44 N -3.93 2.40 -0.03 -1.63 1.01 -1.26 -1.12 121.20 116.65 2gt3 s ILE 44 Ca 0.25 -1.78 -0.01 0.00 0.00 0.00 0.00 60.65 59.11 2gt3 s ILE 44 Cb 0.07 -2.10 0.03 0.00 0.01 0.00 0.00 42.46 40.47 2gt3 s ILE 44 CO 0.03 0.04 0.04 0.00 0.00 0.00 0.00 174.94 175.04 2gt3 s ALA 45 N -1.23 0.22 -0.16 9.38 0.00 0.55 -4.49 121.76 126.03 2gt3 s ALA 45 Ca 0.16 0.21 -0.06 0.00 0.00 0.00 0.00 51.96 52.28 2gt3 s ALA 45 Cb -0.10 -0.44 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 2gt3 s ALA 45 CO 0.08 -0.28 0.03 0.42 0.00 0.00 0.00 175.76 176.00 2gt3 s ILE 46 N 1.56 4.47 0.00 0.00 1.09 -1.07 0.17 121.20 127.43 2gt3 s ILE 46 Ca -0.03 -0.15 -0.04 0.00 -1.10 0.00 0.00 60.65 59.32 2gt3 s ILE 46 Cb -0.13 -2.98 -0.01 0.00 -1.06 0.00 0.00 42.46 38.29 2gt3 s ILE 46 CO -0.03 0.49 0.08 -0.36 -0.10 0.00 0.00 174.94 175.02 2gt3 s PHE 47 N 0.21 0.10 -0.18 3.97 0.40 -0.71 -1.17 117.98 120.60 2gt3 s PHE 47 Ca 0.02 -0.23 0.01 0.00 -0.60 0.00 0.00 56.93 56.13 2gt3 s PHE 47 Cb -0.13 -0.09 0.03 0.00 0.51 0.00 0.00 43.02 43.34 2gt3 s PHE 47 CO 0.01 -0.23 -0.14 0.00 0.70 0.00 0.00 175.22 175.56 2gt3 s ALA 48 N -1.27 2.08 -0.01 5.36 0.00 0.12 -0.68 121.76 127.36 2gt3 s ALA 48 Ca -0.14 -1.14 0.02 0.00 0.00 0.00 0.00 51.96 50.70 2gt3 s ALA 48 Cb -0.08 -1.19 0.03 0.00 0.00 0.00 0.00 23.12 21.88 2gt3 s ALA 48 CO 0.01 -0.56 0.87 -0.12 0.00 0.00 0.00 175.76 175.96 2gt3 n MET 49 N 4.68 0.33 0.00 0.00 1.56 -1.24 -2.35 117.12 120.10 2gt3 n MET 49 Ca -0.17 -1.06 0.00 0.00 -0.27 0.00 0.00 57.70 56.20 2gt3 n MET 49 Cb 0.48 -0.64 0.00 0.00 2.15 0.00 0.00 33.22 35.21 2gt3 n MET 49 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2gt3 n GLY 50 N -0.19 0.82 3.32 -5.12 0.00 -1.22 -4.91 105.19 97.88 2gt3 n GLY 50 Ca 0.02 -1.23 -0.57 0.00 0.00 0.00 0.00 46.02 44.24 2gt3 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gt3 n PHE 52 N 8.30 0.01 0.19 0.00 1.16 -1.26 -2.58 117.46 123.28 2gt3 n PHE 52 Ca 0.50 -0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.99 2gt3 n PHE 52 Cb 0.05 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 37.88 2gt3 n PHE 52 CO 0.00 0.00 0.00 -1.49 -1.87 0.00 0.00 176.76 173.40 2gt3 h TRP 53 N 0.85 -0.51 0.09 2.97 4.06 -1.86 -2.04 115.95 119.50 2gt3 h TRP 53 Ca 0.00 -0.01 -0.21 0.00 2.06 0.00 0.00 58.89 60.73 2gt3 h TRP 53 Cb 0.18 0.17 0.02 0.00 -1.00 0.00 0.00 29.16 28.53 2gt3 h TRP 53 CO 0.00 -0.32 -0.87 0.78 -3.56 0.00 0.00 178.44 174.47 2gt3 h GLY 54 N -1.03 0.50 0.28 1.49 0.00 -1.81 -2.36 103.07 100.14 2gt3 h GLY 54 Ca -0.06 -1.04 0.10 0.00 0.00 0.00 0.00 47.33 46.33 2gt3 h GLY 54 CO 0.09 0.91 0.12 -2.08 0.00 0.00 0.00 176.54 175.59 2gt3 h VAL 55 N -0.08 0.69 -0.09 4.60 2.07 -1.65 0.19 116.25 121.98 2gt3 h VAL 55 Ca -0.13 -0.09 -0.11 0.00 0.82 0.00 0.00 66.70 67.19 2gt3 h VAL 55 Cb 1.61 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 2gt3 h VAL 55 CO 0.17 0.05 -0.44 -0.08 0.02 0.00 0.00 177.57 177.29 2gt3 h GLU 56 N 0.26 0.20 0.57 1.57 4.81 -1.44 -1.60 114.58 118.95 2gt3 h GLU 56 Ca 0.28 -0.10 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 2gt3 h GLU 56 Cb 0.40 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.78 2gt3 h GLU 56 CO -0.36 0.60 -0.27 -0.09 -0.73 0.00 0.00 179.01 178.16 2gt3 h ARG 57 N 0.17 -0.73 -0.20 1.92 2.43 -0.21 0.20 114.38 117.95 2gt3 h ARG 57 Ca 0.01 0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2gt3 h ARG 57 Cb 0.84 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.55 2gt3 h ARG 57 CO 0.07 -0.46 0.04 1.25 -1.51 0.00 0.00 179.97 179.36 2gt3 h LEU 58 N -0.85 0.25 0.23 3.80 6.46 -0.75 0.86 115.31 125.31 2gt3 h LEU 58 Ca -0.08 -0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.65 2gt3 h LEU 58 Cb 0.62 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.49 2gt3 h LEU 58 CO 0.13 0.26 -0.11 -0.26 -0.62 0.00 0.00 178.44 177.84 2gt3 h PHE 59 N 0.28 -0.28 0.00 1.25 0.04 -0.88 -1.92 116.94 115.42 2gt3 h PHE 59 Ca 0.07 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.81 2gt3 h PHE 59 Cb 0.12 0.09 -0.00 0.00 2.20 0.00 0.00 35.95 38.36 2gt3 h PHE 59 CO 0.00 -0.01 -0.08 0.11 -0.60 0.00 0.00 178.31 177.73 2gt3 h TRP 60 N -0.54 0.00 0.00 -0.55 0.09 -0.25 -2.09 115.95 112.61 2gt3 h TRP 60 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.95 2gt3 h TRP 60 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.64 2gt3 h TRP 60 CO 0.00 0.08 0.00 1.04 0.09 0.00 0.00 178.44 179.65 2gt3 n GLN 61 N -3.17 0.98 -3.11 0.12 6.02 0.30 -4.80 117.38 113.72 2gt3 n GLN 61 Ca 0.01 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.63 2gt3 n GLN 61 Cb 0.42 -1.48 -0.06 0.00 1.02 0.00 0.00 30.24 30.14 2gt3 n GLN 61 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2gt3 s LEU 62 N -1.96 4.45 -0.32 1.08 1.43 -0.75 -4.99 118.68 117.63 2gt3 s LEU 62 Ca 0.45 1.44 -0.29 0.00 -1.03 0.00 0.00 54.13 54.70 2gt3 s LEU 62 Cb 0.21 -3.37 0.00 0.00 0.03 0.00 0.00 46.19 43.06 2gt3 s LEU 62 CO 0.35 0.13 1.36 -2.16 0.23 0.00 0.00 176.35 176.25 2gt3 s PRO 63 N -1.59 3.83 0.00 1.29 0.04 -1.26 -2.58 135.00 134.73 2gt3 s PRO 63 Ca 0.38 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.64 2gt3 s PRO 63 Cb -0.19 -3.93 0.00 0.00 0.04 0.00 0.00 34.50 30.42 2gt3 s PRO 63 CO 0.22 -1.24 0.00 0.41 0.04 0.00 0.00 177.00 176.43 2gt3 n GLY 64 N 4.52 1.69 3.65 0.56 0.00 -1.26 -4.45 105.19 109.90 2gt3 n GLY 64 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2gt3 n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gt3 s VAL 65 N -1.88 4.76 -0.06 1.61 1.01 -1.06 -2.57 120.40 122.22 2gt3 s VAL 65 Ca 0.00 1.79 -0.18 0.00 0.00 0.00 0.00 61.98 63.59 2gt3 s VAL 65 Cb 0.00 -4.21 -0.13 0.00 0.00 0.00 0.00 36.38 32.04 2gt3 s VAL 65 CO 0.00 -0.12 0.73 0.22 0.00 0.00 0.00 175.10 175.93 2gt3 h TYR 66 N 7.56 -0.25 -3.45 5.22 3.20 0.19 -3.48 116.97 125.96 2gt3 h TYR 66 Ca -0.21 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.61 2gt3 h TYR 66 Cb 1.08 0.08 -0.11 0.00 1.54 0.00 0.00 36.73 39.32 2gt3 h TYR 66 CO 0.75 0.11 -0.07 -1.12 -1.64 0.00 0.00 178.16 176.20 2gt3 s SER 67 N -5.38 -0.18 0.14 -2.11 0.01 -1.02 -4.75 113.70 100.41 2gt3 s SER 67 Ca -0.11 -0.55 0.03 0.00 1.31 0.00 0.00 55.95 56.64 2gt3 s SER 67 Cb 0.00 0.53 -0.04 0.00 0.21 0.00 0.00 66.02 66.72 2gt3 s SER 67 CO 0.38 -0.99 -0.07 0.42 0.41 0.00 0.00 173.24 173.39 2gt3 s THR 68 N -3.88 0.97 0.01 1.44 -4.23 -1.26 0.25 115.64 108.93 2gt3 s THR 68 Ca 0.10 -2.01 -0.11 0.00 -1.18 0.00 0.00 61.69 58.48 2gt3 s THR 68 Cb 0.00 -1.86 0.01 0.00 1.34 0.00 0.00 72.50 72.00 2gt3 s THR 68 CO -0.04 -0.73 0.23 0.00 -0.54 0.00 0.00 174.62 173.55 2gt3 s ALA 69 N -3.45 -0.55 -0.22 3.99 0.00 0.27 -4.89 121.76 116.89 2gt3 s ALA 69 Ca 0.17 0.04 -0.04 0.00 0.00 0.00 0.00 51.96 52.13 2gt3 s ALA 69 Cb 0.04 0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.29 2gt3 s ALA 69 CO -0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 175.76 175.46 2gt3 s ALA 70 N -1.67 2.87 0.32 0.00 0.00 -1.26 0.19 121.76 122.20 2gt3 s ALA 70 Ca -0.12 -1.15 0.05 0.00 0.00 0.00 0.00 51.96 50.75 2gt3 s ALA 70 Cb -0.05 -1.75 -0.03 0.00 0.00 0.00 0.00 23.12 21.29 2gt3 s ALA 70 CO 0.01 -0.42 0.23 0.20 0.00 0.00 0.00 175.76 175.79 2gt3 s GLY 71 N 1.46 2.21 0.16 0.00 0.00 -0.35 0.98 107.32 111.78 2gt3 s GLY 71 Ca 0.05 -1.92 0.11 0.00 0.00 0.00 0.00 44.72 42.96 2gt3 s GLY 71 CO -0.02 -1.50 -0.25 -0.19 0.00 0.00 0.00 173.10 171.13 2gt3 s TYR 72 N -3.54 2.28 0.14 1.90 2.02 -0.84 -1.07 117.35 118.24 2gt3 s TYR 72 Ca 0.39 -0.37 -0.24 0.00 -0.37 0.00 0.00 57.07 56.47 2gt3 s TYR 72 Cb 0.03 -1.19 0.08 0.00 -0.40 0.00 0.00 41.96 40.48 2gt3 s TYR 72 CO 0.23 0.40 1.08 -0.08 -1.57 0.00 0.00 175.55 175.61 2gt3 s THR 73 N -1.33 0.00 0.00 -0.71 -1.32 -1.04 -2.73 115.64 108.51 2gt3 s THR 73 Ca 0.16 -0.52 0.00 0.00 -1.21 0.00 0.00 61.69 60.13 2gt3 s THR 73 Cb -0.09 -2.70 0.00 0.00 -1.51 0.00 0.00 72.50 68.20 2gt3 s THR 73 CO 0.07 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.09 2gt3 n GLY 74 N -0.68 3.06 0.00 6.08 0.00 -1.26 0.19 105.19 112.58 2gt3 n GLY 74 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2gt3 n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gt3 n GLY 75 N -0.77 0.27 0.02 -0.02 0.00 -1.03 -4.63 105.19 99.04 2gt3 n GLY 75 Ca 0.00 -1.85 -0.03 0.00 0.00 0.00 0.00 46.02 44.14 2gt3 n GLY 75 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2gt3 n TYR 76 N -1.06 0.00 -1.65 1.61 9.36 -0.84 -4.82 117.16 119.77 2gt3 n TYR 76 Ca 0.00 0.00 -0.51 0.00 3.32 0.00 0.00 57.90 60.71 2gt3 n TYR 76 Cb 0.00 -0.21 -0.06 0.00 -0.63 0.00 0.00 39.34 38.44 2gt3 n TYR 76 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 2gt3 n THR 77 N -2.38 0.43 -2.44 2.97 -1.04 -1.24 -4.89 114.28 105.70 2gt3 n THR 77 Ca -0.08 -0.13 -0.42 0.00 -2.04 0.00 0.00 64.05 61.37 2gt3 n THR 77 Cb 0.62 -1.69 -0.03 0.00 -1.82 0.00 0.00 70.33 67.42 2gt3 n THR 77 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2gt3 s PRO 78 N 4.41 4.36 -0.94 -2.82 0.04 -1.26 -3.68 135.00 135.11 2gt3 s PRO 78 Ca 0.98 1.71 -0.05 0.00 0.04 0.00 0.00 61.00 63.67 2gt3 s PRO 78 Cb -0.81 -3.53 -0.04 0.00 0.04 0.00 0.00 34.50 30.15 2gt3 s PRO 78 CO 0.55 -0.43 0.83 -1.71 0.04 0.00 0.00 177.00 176.27 2gt3 n ASN 79 N 5.06 -6.96 -4.81 6.66 2.85 -1.26 -4.12 115.26 112.68 2gt3 n ASN 79 Ca 0.11 -0.50 -0.30 0.00 -0.11 0.00 0.00 54.58 53.77 2gt3 n ASN 79 Cb 0.46 -5.07 0.08 0.00 1.24 0.00 0.00 39.78 36.49 2gt3 n ASN 79 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 2gt3 s PRO 80 N -4.00 2.23 0.25 1.20 0.04 -1.24 -4.56 135.00 128.92 2gt3 s PRO 80 Ca 0.29 0.70 0.11 0.00 0.04 0.00 0.00 61.00 62.14 2gt3 s PRO 80 Cb -0.04 -1.93 -0.05 0.00 0.04 0.00 0.00 34.50 32.52 2gt3 s PRO 80 CO 0.75 -1.53 -0.20 0.95 0.04 0.00 0.00 177.00 177.01 2gt3 s THR 81 N -3.13 2.31 0.23 1.26 -4.23 -1.26 -5.00 115.64 105.81 2gt3 s THR 81 Ca 0.60 -2.28 -0.06 0.00 -1.18 0.00 0.00 61.69 58.77 2gt3 s THR 81 Cb -0.14 -2.20 0.20 0.00 1.34 0.00 0.00 72.50 71.70 2gt3 s THR 81 CO 0.54 -0.37 1.71 0.22 -0.54 0.00 0.00 174.62 176.18 2gt3 h TYR 82 N 2.55 0.35 0.25 3.99 3.20 -1.98 0.29 116.97 125.62 2gt3 h TYR 82 Ca -0.41 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.49 2gt3 h TYR 82 Cb 1.24 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.46 2gt3 h TYR 82 CO 0.77 -0.00 -0.12 -0.09 -1.64 0.00 0.00 178.16 177.08 2gt3 h ARG 83 N 0.34 -0.32 -0.27 1.82 2.43 -1.98 0.56 114.38 116.96 2gt3 h ARG 83 Ca 0.38 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.62 2gt3 h ARG 83 Cb 0.59 0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 30.16 2gt3 h ARG 83 CO -0.43 -0.21 -0.03 0.93 -1.51 0.00 0.00 179.97 178.72 2gt3 h GLU 84 N -0.34 0.04 -0.82 0.20 5.08 -1.69 -0.87 114.58 116.18 2gt3 h GLU 84 Ca -0.03 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2gt3 h GLU 84 Cb 0.26 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 2gt3 h GLU 84 CO 0.06 0.03 0.48 0.28 -1.00 0.00 0.00 179.01 178.85 2gt3 h VAL 85 N 0.04 1.24 -0.86 3.13 2.07 -0.27 -0.64 116.25 120.96 2gt3 h VAL 85 Ca 0.13 -0.55 0.15 0.00 0.82 0.00 0.00 66.70 67.25 2gt3 h VAL 85 Cb 0.18 0.11 -0.07 0.00 -1.52 0.00 0.00 31.29 30.00 2gt3 h VAL 85 CO -0.25 0.26 0.56 0.00 0.02 0.00 0.00 177.57 178.16 2gt3 h SER 87 N 0.59 0.04 0.00 0.00 0.87 0.15 -3.48 113.55 111.72 2gt3 h SER 87 Ca 0.43 -0.43 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2gt3 h SER 87 Cb 0.81 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 2gt3 h SER 87 CO -0.18 0.46 0.00 0.61 -0.53 0.00 0.00 176.83 177.18 2gt3 n GLY 88 N 0.06 1.05 1.54 5.77 0.00 -0.19 -4.97 105.19 108.45 2gt3 n GLY 88 Ca -0.08 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.02 2gt3 n GLY 88 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2gt3 n ASP 89 N 0.00 4.56 -0.04 1.61 9.92 -1.24 -3.97 116.55 127.38 2gt3 n ASP 89 Ca 0.00 -2.49 -0.04 0.00 -0.53 0.00 0.00 54.79 51.73 2gt3 n ASP 89 Cb 0.00 -0.58 -0.07 0.00 -0.64 0.00 0.00 41.12 39.84 2gt3 n ASP 89 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 2gt3 n THR 90 N 0.92 0.53 -0.93 -3.53 -2.24 -1.26 -0.98 114.28 106.80 2gt3 n THR 90 Ca 0.24 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 2gt3 n THR 90 Cb 0.88 -0.71 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 2gt3 n THR 90 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gt3 n GLY 91 N 2.46 0.84 3.82 3.38 0.00 -1.26 -1.98 105.19 112.45 2gt3 n GLY 91 Ca -0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 2gt3 n GLY 91 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2gt3 s HIS 92 N -3.51 3.33 0.41 1.61 3.76 -1.26 -2.46 115.29 117.17 2gt3 s HIS 92 Ca 0.00 1.58 0.07 0.00 -0.15 0.00 0.00 55.06 56.56 2gt3 s HIS 92 Cb 0.00 -2.84 -0.06 0.00 1.11 0.00 0.00 32.58 30.78 2gt3 s HIS 92 CO 0.00 -0.18 0.10 0.00 -0.85 0.00 0.00 174.74 173.81 2gt3 s ALA 93 N -2.27 3.40 -0.34 -1.40 0.00 0.51 -4.63 121.76 117.02 2gt3 s ALA 93 Ca 0.61 -2.19 -0.27 0.00 0.00 0.00 0.00 51.96 50.11 2gt3 s ALA 93 Cb -0.09 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 22.89 2gt3 s ALA 93 CO 0.17 -0.14 0.98 -1.21 0.00 0.00 0.00 175.76 175.56 2gt3 s GLU 94 N -3.82 3.96 0.30 0.00 2.02 -0.69 -2.48 118.70 118.00 2gt3 s GLU 94 Ca 0.38 0.81 0.06 0.00 0.02 0.00 0.00 54.97 56.24 2gt3 s GLU 94 Cb 0.06 -3.76 -0.06 0.00 0.10 0.00 0.00 34.13 30.47 2gt3 s GLU 94 CO 0.21 -0.89 -0.02 0.00 0.02 0.00 0.00 175.26 174.57 2gt3 s ALA 95 N 3.49 2.43 -0.10 5.21 0.00 -0.23 -3.67 121.76 128.89 2gt3 s ALA 95 Ca 0.41 -1.98 -0.07 0.00 0.00 0.00 0.00 51.96 50.31 2gt3 s ALA 95 Cb -0.12 0.32 0.04 0.00 0.00 0.00 0.00 23.12 23.35 2gt3 s ALA 95 CO 0.16 -0.14 0.25 0.08 0.00 0.00 0.00 175.76 176.11 2gt3 s VAL 96 N -3.06 -0.02 -0.29 0.00 1.01 0.15 -1.22 120.40 116.97 2gt3 s VAL 96 Ca 0.32 0.07 -0.17 0.00 0.00 0.00 0.00 61.98 62.20 2gt3 s VAL 96 Cb 0.06 -0.37 -0.02 0.00 0.00 0.00 0.00 36.38 36.05 2gt3 s VAL 96 CO 0.13 0.03 0.47 -0.13 0.00 0.00 0.00 175.10 175.60 2gt3 s ARG 97 N 0.69 3.90 -0.18 2.72 0.52 0.50 -1.75 118.95 125.36 2gt3 s ARG 97 Ca -0.05 0.07 -0.04 0.00 -0.52 0.00 0.00 55.73 55.19 2gt3 s ARG 97 Cb -0.06 -3.71 -0.03 0.00 0.52 0.00 0.00 34.95 31.68 2gt3 s ARG 97 CO -0.04 -0.42 -0.02 0.42 0.02 0.00 0.00 175.30 175.26 2gt3 s ILE 98 N 2.26 3.93 -0.26 1.52 1.09 0.46 0.93 121.20 131.13 2gt3 s ILE 98 Ca 0.18 -0.33 -0.06 0.00 -1.10 0.00 0.00 60.65 59.34 2gt3 s ILE 98 Cb -0.16 -2.75 -0.01 0.00 -1.06 0.00 0.00 42.46 38.48 2gt3 s ILE 98 CO 0.11 0.46 0.04 -0.69 -0.10 0.00 0.00 174.94 174.76 2gt3 s VAL 99 N 0.72 3.93 0.08 2.92 1.01 0.14 0.21 120.40 129.40 2gt3 s VAL 99 Ca -0.01 -0.44 -0.03 0.00 0.00 0.00 0.00 61.98 61.51 2gt3 s VAL 99 Cb -0.14 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 2gt3 s VAL 99 CO 0.02 0.27 0.04 -0.72 0.00 0.00 0.00 175.10 174.72 2gt3 s TYR 100 N 1.54 0.55 -0.16 5.22 -0.85 -0.27 0.20 117.35 123.57 2gt3 s TYR 100 Ca 0.05 -1.03 -0.08 0.00 -0.52 0.00 0.00 57.07 55.49 2gt3 s TYR 100 Cb -0.16 -0.35 -0.04 0.00 0.38 0.00 0.00 41.96 41.79 2gt3 s TYR 100 CO 0.01 -0.46 0.10 0.16 -1.52 0.00 0.00 175.55 173.84 2gt3 s ASP 101 N -2.95 5.96 0.00 -0.18 3.84 -1.06 -1.37 116.67 120.91 2gt3 s ASP 101 Ca 0.12 0.23 0.23 0.00 -0.00 0.00 0.00 52.55 53.13 2gt3 s ASP 101 Cb 0.07 -1.98 1.38 0.00 -1.38 0.00 0.00 42.92 41.01 2gt3 s ASP 101 CO -0.06 0.26 1.76 -0.81 -0.00 0.00 0.00 175.17 176.31 2gt3 n PRO 102 N 3.00 0.75 0.09 2.11 -0.04 -1.24 -1.34 135.00 138.33 2gt3 n PRO 102 Ca -0.17 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.40 2gt3 n PRO 102 Cb 0.53 -1.48 0.02 0.00 -0.04 0.00 0.00 33.50 32.53 2gt3 n PRO 102 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2gt3 n SER 103 N -0.98 0.79 -0.00 3.54 3.41 -1.26 -4.57 113.62 114.55 2gt3 n SER 103 Ca 0.17 0.26 -0.03 0.00 -0.26 0.00 0.00 58.87 59.01 2gt3 n SER 103 Cb 0.08 0.47 -0.01 0.00 -0.26 0.00 0.00 64.21 64.49 2gt3 n SER 103 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2gt3 n VAL 104 N -2.55 1.12 -3.93 -3.33 0.31 -0.94 -5.07 118.33 103.94 2gt3 n VAL 104 Ca 0.00 0.29 -0.22 0.00 -0.01 0.00 0.00 64.34 64.40 2gt3 n VAL 104 Cb 0.53 -1.78 -0.05 0.00 -0.91 0.00 0.00 33.84 31.63 2gt3 n VAL 104 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 2gt3 s ILE 105 N -2.14 3.00 0.17 2.52 2.07 -0.45 -4.96 121.20 121.41 2gt3 s ILE 105 Ca -0.10 -1.55 0.10 0.00 -1.41 0.00 0.00 60.65 57.69 2gt3 s ILE 105 Cb 0.01 -3.04 -0.04 0.00 0.13 0.00 0.00 42.46 39.52 2gt3 s ILE 105 CO 0.14 -0.12 -0.21 -0.94 -1.91 0.00 0.00 174.94 171.90 2gt3 s SER 106 N -3.94 2.99 0.38 4.50 1.04 -1.26 -3.66 113.70 113.74 2gt3 s SER 106 Ca 0.41 -0.84 0.07 0.00 0.48 0.00 0.00 55.95 56.07 2gt3 s SER 106 Cb -0.03 -0.20 0.80 0.00 0.10 0.00 0.00 66.02 66.70 2gt3 s SER 106 CO 0.25 0.05 1.99 0.10 0.98 0.00 0.00 173.24 176.60 2gt3 h TYR 107 N 3.35 0.66 -0.32 5.02 -0.00 -1.96 -1.86 116.97 121.86 2gt3 h TYR 107 Ca -0.45 0.02 0.03 0.00 0.00 0.00 0.00 58.73 58.33 2gt3 h TYR 107 Cb 1.20 -0.22 -0.03 0.00 0.00 0.00 0.00 36.73 37.68 2gt3 h TYR 107 CO 0.67 0.37 0.13 1.49 -0.00 0.00 0.00 178.16 180.82 2gt3 h GLU 108 N 0.67 0.28 -0.62 0.10 4.81 -1.97 0.17 114.58 118.02 2gt3 h GLU 108 Ca 0.27 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.53 2gt3 h GLU 108 Cb 0.21 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 2gt3 h GLU 108 CO -0.08 0.18 0.41 1.96 -0.73 0.00 0.00 179.01 180.75 2gt3 h GLN 109 N 0.29 0.64 -0.21 1.92 4.20 -1.76 1.13 115.11 121.32 2gt3 h GLN 109 Ca 0.14 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.71 2gt3 h GLN 109 Cb 0.08 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.72 2gt3 h GLN 109 CO -0.12 0.43 -0.25 -0.07 -0.67 0.00 0.00 178.83 178.15 2gt3 h LEU 110 N 0.66 0.58 -0.27 1.46 3.38 -0.94 -1.21 115.31 118.97 2gt3 h LEU 110 Ca 0.26 -0.49 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 2gt3 h LEU 110 Cb 0.19 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2gt3 h LEU 110 CO -0.08 0.96 -0.07 -0.07 0.09 0.00 0.00 178.44 179.27 2gt3 h LEU 111 N 0.21 0.52 -1.35 1.67 4.07 0.37 -1.61 115.31 119.20 2gt3 h LEU 111 Ca 0.03 -0.37 0.06 0.00 0.08 0.00 0.00 57.88 57.68 2gt3 h LEU 111 Cb 0.81 -0.14 -0.05 0.00 1.08 0.00 0.00 40.66 42.36 2gt3 h LEU 111 CO 0.06 0.77 0.49 -0.61 -1.08 0.00 0.00 178.44 178.06 2gt3 h GLN 112 N 0.27 0.76 -0.27 1.13 4.15 0.13 -0.00 115.11 121.28 2gt3 h GLN 112 Ca 0.07 -0.05 -0.14 0.00 0.77 0.00 0.00 58.65 59.30 2gt3 h GLN 112 Cb 0.54 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.05 2gt3 h GLN 112 CO 0.03 0.50 -0.40 -0.24 -1.93 0.00 0.00 178.83 176.79 2gt3 h VAL 113 N 0.78 1.29 -0.04 2.39 3.04 -0.95 -0.73 116.25 122.04 2gt3 h VAL 113 Ca 0.32 -1.57 0.03 0.00 -1.01 0.00 0.00 66.70 64.48 2gt3 h VAL 113 Cb 0.25 1.52 -0.04 0.00 -2.01 0.00 0.00 31.29 31.01 2gt3 h VAL 113 CO -0.11 0.50 -0.20 0.15 -1.01 0.00 0.00 177.57 176.90 2gt3 h PHE 114 N 0.52 -0.52 0.00 3.17 3.57 -0.00 1.87 116.94 125.54 2gt3 h PHE 114 Ca 0.04 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.56 2gt3 h PHE 114 Cb 0.92 0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.89 2gt3 h PHE 114 CO 0.04 -0.28 0.00 -1.49 -2.23 0.00 0.00 178.31 174.35 2gt3 h TRP 115 N -0.29 0.00 -0.60 0.41 4.06 -1.42 -1.77 115.95 116.34 2gt3 h TRP 115 Ca 0.07 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.02 2gt3 h TRP 115 Cb 0.39 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.55 2gt3 h TRP 115 CO -0.26 0.00 0.00 0.39 -3.56 0.00 0.00 178.44 175.01 2gt3 n GLU 116 N -2.95 2.51 -0.05 0.49 1.02 0.21 -4.30 120.64 117.56 2gt3 n GLU 116 Ca 0.02 -2.33 -0.12 0.00 -0.02 0.00 0.00 57.16 54.71 2gt3 n GLU 116 Cb 0.36 -1.51 -0.04 0.00 -0.02 0.00 0.00 31.44 30.23 2gt3 n GLU 116 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2gt3 n ASN 117 N 1.42 0.87 -3.96 1.62 5.15 0.61 -4.60 115.26 116.38 2gt3 n ASN 117 Ca 0.22 0.15 -0.09 0.00 -0.60 0.00 0.00 54.58 54.25 2gt3 n ASN 117 Cb 0.56 -0.36 -0.06 0.00 -0.53 0.00 0.00 39.78 39.40 2gt3 n ASN 117 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 2gt3 s HIS 118 N -2.23 0.35 -0.34 1.20 2.46 -0.77 -3.52 115.29 112.44 2gt3 s HIS 118 Ca -0.16 -0.70 -0.19 0.00 0.47 0.00 0.00 55.06 54.48 2gt3 s HIS 118 Cb 0.06 0.10 -0.00 0.00 -0.13 0.00 0.00 32.58 32.61 2gt3 s HIS 118 CO 0.20 -0.88 0.57 -0.51 -2.47 0.00 0.00 174.74 171.65 2gt3 s ASP 119 N -2.99 6.38 0.00 9.88 1.11 -1.26 -4.34 116.67 125.45 2gt3 s ASP 119 Ca 0.20 0.10 0.24 0.00 0.18 0.00 0.00 52.55 53.27 2gt3 s ASP 119 Cb 0.01 -2.30 1.41 0.00 1.07 0.00 0.00 42.92 43.12 2gt3 s ASP 119 CO 0.05 -0.51 1.80 -0.81 1.18 0.00 0.00 175.17 176.87 2gt3 n PRO 120 N 5.86 0.72 -2.02 8.23 -0.04 -1.26 -3.34 135.00 143.15 2gt3 n PRO 120 Ca -0.03 0.01 -0.36 0.00 -0.04 0.00 0.00 63.50 63.08 2gt3 n PRO 120 Cb 0.49 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.48 2gt3 n PRO 120 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2gt3 n ALA 121 N -1.02 6.10 0.13 0.55 0.00 -1.26 -3.43 120.51 121.57 2gt3 n ALA 121 Ca 0.17 -4.12 0.11 0.00 0.00 0.00 0.00 53.44 49.61 2gt3 n ALA 121 Cb 0.09 -1.56 -0.16 0.00 0.00 0.00 0.00 19.45 17.82 2gt3 n ALA 121 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2gt3 n GLN 122 N -0.56 0.57 0.00 0.00 1.13 -1.21 -4.75 117.38 112.56 2gt3 n GLN 122 Ca 0.51 -0.17 0.00 0.00 -1.94 0.00 0.00 57.00 55.39 2gt3 n GLN 122 Cb 0.39 -1.52 0.00 0.00 0.11 0.00 0.00 30.24 29.23 2gt3 n GLN 122 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2gt3 n GLY 123 N 1.29 -0.49 2.26 1.08 0.00 -1.26 -4.30 105.19 103.76 2gt3 n GLY 123 Ca -0.03 -1.45 -0.20 0.00 0.00 0.00 0.00 46.02 44.34 2gt3 n GLY 123 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2gt3 n MET 124 N 0.00 2.29 -3.65 1.61 2.81 -1.26 -4.62 117.12 114.29 2gt3 n MET 124 Ca 0.00 -1.32 -0.01 0.00 -1.81 0.00 0.00 57.70 54.56 2gt3 n MET 124 Cb 0.00 -2.26 -0.04 0.00 -0.71 0.00 0.00 33.22 30.21 2gt3 n MET 124 CO 0.00 0.00 0.00 -0.98 1.51 0.00 0.00 175.97 176.50 2gt3 s ARG 125 N 2.00 0.00 -0.07 0.03 1.70 -1.22 -2.41 118.95 118.98 2gt3 s ARG 125 Ca 0.56 0.00 0.01 0.00 -0.47 0.00 0.00 55.73 55.83 2gt3 s ARG 125 Cb 0.21 0.00 0.02 0.00 -0.57 0.00 0.00 34.95 34.61 2gt3 s ARG 125 CO -0.02 -0.00 -0.08 1.14 -1.08 0.00 0.00 175.30 175.26 2gt3 s GLN 126 N -1.02 1.31 4.59 3.89 1.03 0.44 -4.61 119.66 125.29 2gt3 s GLN 126 Ca 0.10 -0.24 0.00 0.00 0.04 0.00 0.00 55.36 55.26 2gt3 s GLN 126 Cb -0.01 -1.23 0.00 0.00 0.03 0.00 0.00 33.01 31.80 2gt3 s GLN 126 CO -0.09 -0.10 0.00 0.41 -2.54 0.00 0.00 175.29 172.98 2gt3 n GLY 127 N 4.23 3.43 1.27 2.60 0.00 -1.26 0.14 105.19 115.60 2gt3 n GLY 127 Ca -0.20 0.23 0.10 0.00 0.00 0.00 0.00 46.02 46.16 2gt3 n GLY 127 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2gt3 n ASN 128 N 6.01 3.70 -4.44 1.61 4.13 -1.26 -4.86 115.26 120.15 2gt3 n ASN 128 Ca 0.00 -2.05 -0.34 0.00 1.68 0.00 0.00 54.58 53.87 2gt3 n ASN 128 Cb 0.00 -0.46 -0.13 0.00 -1.54 0.00 0.00 39.78 37.65 2gt3 n ASN 128 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 2gt3 s ASP 129 N -0.98 4.58 0.16 6.41 1.01 0.36 -5.11 116.67 123.10 2gt3 s ASP 129 Ca 0.45 -0.22 0.08 0.00 0.71 0.00 0.00 52.55 53.58 2gt3 s ASP 129 Cb 0.24 -1.75 -0.04 0.00 1.01 0.00 0.00 42.92 42.38 2gt3 s ASP 129 CO 0.29 0.13 -0.08 -2.28 0.21 0.00 0.00 175.17 173.45 2gt3 s HIS 130 N 0.60 2.71 0.00 4.23 5.65 -1.26 0.17 115.29 127.39 2gt3 s HIS 130 Ca -0.03 -0.19 0.00 0.00 0.25 0.00 0.00 55.06 55.09 2gt3 s HIS 130 Cb -0.15 -1.35 0.00 0.00 -1.18 0.00 0.00 32.58 29.91 2gt3 s HIS 130 CO 0.03 0.49 0.00 0.41 -0.65 0.00 0.00 174.74 175.01 2gt3 n GLY 131 N 0.20 3.55 0.14 1.59 0.00 -1.01 -4.92 105.19 104.74 2gt3 n GLY 131 Ca -0.11 -1.30 0.14 0.00 0.00 0.00 0.00 46.02 44.75 2gt3 n GLY 131 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2gt3 n THR 132 N -1.57 0.00 1.01 2.61 -1.04 -1.26 -3.07 114.28 110.97 2gt3 n THR 132 Ca 0.00 -0.07 0.12 0.00 -2.04 0.00 0.00 64.05 62.06 2gt3 n THR 132 Cb 0.00 -0.10 0.18 0.00 -1.82 0.00 0.00 70.33 68.59 2gt3 n THR 132 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2gt3 n GLN 133 N -0.84 0.07 -1.19 -2.82 10.64 -1.26 -4.04 117.38 117.94 2gt3 n GLN 133 Ca 0.16 -0.04 -0.28 0.00 -1.83 0.00 0.00 57.00 55.01 2gt3 n GLN 133 Cb 0.26 -1.50 0.09 0.00 -0.86 0.00 0.00 30.24 28.23 2gt3 n GLN 133 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 2gt3 n TYR 134 N -1.43 2.81 -0.89 2.61 4.01 -1.17 -1.70 117.16 121.40 2gt3 n TYR 134 Ca 0.06 -2.51 -0.02 0.00 -0.16 0.00 0.00 57.90 55.27 2gt3 n TYR 134 Cb 0.34 -1.22 0.01 0.00 -0.31 0.00 0.00 39.34 38.16 2gt3 n TYR 134 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2gt3 n ARG 135 N -0.71 -0.41 -3.85 -0.72 0.63 -1.26 -4.03 116.66 106.31 2gt3 n ARG 135 Ca 0.55 -0.12 -0.14 0.00 -0.92 0.00 0.00 57.85 57.22 2gt3 n ARG 135 Cb 0.87 -0.09 -0.15 0.00 0.45 0.00 0.00 32.46 33.54 2gt3 n ARG 135 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 2gt3 s SER 136 N -1.42 0.11 -0.16 6.15 0.01 -1.26 -3.43 113.70 113.70 2gt3 s SER 136 Ca 0.04 0.01 -0.29 0.00 1.31 0.00 0.00 55.95 57.02 2gt3 s SER 136 Cb -0.00 -0.06 0.11 0.00 0.21 0.00 0.00 66.02 66.28 2gt3 s SER 136 CO 0.03 -0.06 0.92 0.00 0.41 0.00 0.00 173.24 174.55 2gt3 s ALA 137 N 0.53 -1.90 -0.10 1.44 0.00 -0.99 -2.50 121.76 118.24 2gt3 s ALA 137 Ca -0.05 1.59 0.01 0.00 0.00 0.00 0.00 51.96 53.51 2gt3 s ALA 137 Cb -0.07 -0.69 -0.02 0.00 0.00 0.00 0.00 23.12 22.35 2gt3 s ALA 137 CO -0.01 -0.31 -0.13 0.42 0.00 0.00 0.00 175.76 175.73 2gt3 s ILE 138 N -0.87 3.11 -0.44 0.00 1.01 -1.01 -0.70 121.20 122.29 2gt3 s ILE 138 Ca -0.03 -0.66 0.02 0.00 0.00 0.00 0.00 60.65 59.98 2gt3 s ILE 138 Cb -0.01 -2.28 0.14 0.00 0.01 0.00 0.00 42.46 40.32 2gt3 s ILE 138 CO 0.02 0.55 0.24 -0.31 0.00 0.00 0.00 174.94 175.44 2gt3 s TYR 139 N -0.02 2.00 1.04 3.97 2.02 -0.31 -2.61 117.35 123.43 2gt3 s TYR 139 Ca -0.03 -2.43 -0.16 0.00 -0.37 0.00 0.00 57.07 54.07 2gt3 s TYR 139 Cb -0.14 -1.90 0.22 0.00 -0.40 0.00 0.00 41.96 39.74 2gt3 s TYR 139 CO 0.04 -0.78 1.20 -1.25 -1.57 0.00 0.00 175.55 173.19 2gt3 s PRO 140 N 0.34 0.07 -0.08 -1.71 0.04 -1.26 -2.60 135.00 129.81 2gt3 s PRO 140 Ca 0.18 -0.12 0.08 0.00 0.04 0.00 0.00 61.00 61.18 2gt3 s PRO 140 Cb -0.24 -1.75 -0.12 0.00 0.04 0.00 0.00 34.50 32.43 2gt3 s PRO 140 CO 0.00 -2.84 0.06 1.28 0.04 0.00 0.00 177.00 175.54 2gt3 n LEU 141 N -4.13 0.00 -4.65 -3.56 7.99 -1.26 -3.98 117.00 107.41 2gt3 n LEU 141 Ca 0.12 0.00 -0.26 0.00 -0.01 0.00 0.00 56.01 55.87 2gt3 n LEU 141 Cb 0.59 0.19 -0.09 0.00 -0.11 0.00 0.00 43.42 44.00 2gt3 n LEU 141 CO 0.48 0.19 -0.26 0.42 -1.51 0.00 0.00 177.39 176.71 2gt3 s THR 142 N -2.29 2.30 0.17 -5.08 -4.23 -1.26 -5.04 115.64 100.20 2gt3 s THR 142 Ca -0.04 -1.91 0.01 0.00 -1.18 0.00 0.00 61.69 58.56 2gt3 s THR 142 Cb 0.03 -2.91 -0.13 0.00 1.34 0.00 0.00 72.50 70.83 2gt3 s THR 142 CO 0.38 -0.07 1.40 1.55 -0.54 0.00 0.00 174.62 177.33 2gt3 h PRO 143 N 1.69 0.29 -0.41 3.99 0.13 -1.99 -2.82 132.00 132.88 2gt3 h PRO 143 Ca -0.43 -0.28 -0.03 0.00 -0.87 0.00 0.00 66.00 64.39 2gt3 h PRO 143 Cb 1.25 0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.43 2gt3 h PRO 143 CO 0.73 0.96 0.12 0.93 -0.23 0.00 0.00 178.00 180.51 2gt3 h GLU 144 N 0.18 0.60 -0.12 0.86 5.08 -1.99 0.22 114.58 119.41 2gt3 h GLU 144 Ca -0.04 -0.10 -0.20 0.00 -1.00 0.00 0.00 59.36 58.02 2gt3 h GLU 144 Cb 1.43 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.57 2gt3 h GLU 144 CO 0.13 0.54 -0.73 0.37 -1.00 0.00 0.00 179.01 178.32 2gt3 h GLN 145 N 0.59 0.57 -0.06 2.33 4.15 -1.96 -2.45 115.11 118.29 2gt3 h GLN 145 Ca 0.14 -0.46 -0.01 0.00 0.77 0.00 0.00 58.65 59.10 2gt3 h GLN 145 Cb 0.19 0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.97 2gt3 h GLN 145 CO -0.01 1.08 0.01 0.22 -1.93 0.00 0.00 178.83 178.20 2gt3 h ASP 146 N 0.40 0.09 -0.89 -0.69 -0.00 -1.14 0.60 116.42 114.79 2gt3 h ASP 146 Ca -0.03 -0.26 0.10 0.00 -0.00 0.00 0.00 57.03 56.83 2gt3 h ASP 146 Cb 1.32 -0.02 -0.07 0.00 -0.00 0.00 0.00 39.33 40.56 2gt3 h ASP 146 CO 0.14 0.33 0.58 0.00 -0.00 0.00 0.00 179.24 180.29 2gt3 h ALA 147 N 0.76 1.65 -0.14 -0.78 0.00 -0.99 0.43 119.26 120.19 2gt3 h ALA 147 Ca 0.02 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 2gt3 h ALA 147 Cb 0.28 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.88 2gt3 h ALA 147 CO 0.00 0.16 -0.61 0.00 0.00 0.00 0.00 179.25 178.80 2gt3 h ALA 148 N 1.56 0.26 0.11 0.00 0.00 -1.07 0.35 119.26 120.47 2gt3 h ALA 148 Ca 0.42 -0.54 0.01 0.00 0.00 0.00 0.00 54.91 54.79 2gt3 h ALA 148 Cb 0.43 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2gt3 h ALA 148 CO -0.18 0.52 -0.13 0.00 0.00 0.00 0.00 179.25 179.46 2gt3 h ALA 149 N 0.52 -0.25 -0.12 0.00 0.00 0.18 1.47 119.26 121.06 2gt3 h ALA 149 Ca -0.04 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2gt3 h ALA 149 Cb 1.25 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 2gt3 h ALA 149 CO 0.13 -0.66 -0.24 0.07 0.00 0.00 0.00 179.25 178.55 2gt3 h ARG 150 N -0.28 0.21 -0.05 0.00 0.11 -0.26 -1.17 114.38 112.94 2gt3 h ARG 150 Ca 0.01 -0.07 -0.03 0.00 0.10 0.00 0.00 59.98 60.00 2gt3 h ARG 150 Cb 0.28 -0.02 -0.00 0.00 1.11 0.00 0.00 29.97 31.34 2gt3 h ARG 150 CO -0.05 0.45 -0.08 0.00 0.10 0.00 0.00 179.97 180.39 2gt3 h ALA 151 N 1.56 0.07 -0.68 0.08 0.00 -0.08 -0.33 119.26 119.88 2gt3 h ALA 151 Ca 0.03 -0.31 0.06 0.00 0.00 0.00 0.00 54.91 54.70 2gt3 h ALA 151 Cb 0.53 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 2gt3 h ALA 151 CO 0.04 -0.09 0.38 0.66 0.00 0.00 0.00 179.25 180.23 2gt3 h SER 152 N -0.36 0.55 -0.32 0.00 4.64 0.22 0.33 113.55 118.62 2gt3 h SER 152 Ca 0.00 0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.33 2gt3 h SER 152 Cb 0.63 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 2gt3 h SER 152 CO 0.02 0.35 0.08 0.25 -0.87 0.00 0.00 176.83 176.66 2gt3 h LEU 153 N 0.69 0.48 -0.79 5.97 6.46 -1.20 1.29 115.31 128.20 2gt3 h LEU 153 Ca 0.31 -0.22 0.04 0.00 -0.12 0.00 0.00 57.88 57.88 2gt3 h LEU 153 Cb 0.21 -0.13 -0.05 0.00 -0.73 0.00 0.00 40.66 39.96 2gt3 h LEU 153 CO -0.19 0.58 0.50 -0.08 -0.62 0.00 0.00 178.44 178.63 2gt3 h GLU 154 N 0.36 0.94 -0.02 1.25 4.81 -0.10 0.29 114.58 122.11 2gt3 h GLU 154 Ca 0.10 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.18 2gt3 h GLU 154 Cb 0.28 -0.21 0.01 0.00 0.63 0.00 0.00 28.75 29.46 2gt3 h GLU 154 CO 0.00 0.62 -0.35 0.00 -0.73 0.00 0.00 179.01 178.55 2gt3 h ARG 155 N 0.97 0.27 -0.57 1.92 3.08 -0.08 -3.25 114.38 116.72 2gt3 h ARG 155 Ca 0.32 -0.26 0.08 0.00 0.07 0.00 0.00 59.98 60.18 2gt3 h ARG 155 Cb 0.03 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.09 2gt3 h ARG 155 CO -0.12 0.96 0.24 0.35 -1.07 0.00 0.00 179.97 180.32 2gt3 h PHE 156 N -0.32 0.42 -0.90 3.04 3.57 0.19 0.39 116.94 123.34 2gt3 h PHE 156 Ca -0.04 0.03 0.21 0.00 3.53 0.00 0.00 57.97 61.69 2gt3 h PHE 156 Cb 1.06 -0.10 -0.06 0.00 2.79 0.00 0.00 35.95 39.64 2gt3 h PHE 156 CO 0.16 0.14 0.60 0.37 -2.23 0.00 0.00 178.31 177.35 2gt3 h GLN 157 N 0.44 0.37 0.02 1.11 4.15 -0.49 0.60 115.11 121.31 2gt3 h GLN 157 Ca 0.28 -0.02 -0.22 0.00 0.77 0.00 0.00 58.65 59.46 2gt3 h GLN 157 Cb 0.29 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.89 2gt3 h GLN 157 CO -0.26 0.25 -0.95 0.00 -1.93 0.00 0.00 178.83 175.94 2gt3 h ALA 158 N 1.61 0.40 0.44 3.38 0.00 -1.01 -2.11 119.26 121.96 2gt3 h ALA 158 Ca 0.47 -0.75 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 2gt3 h ALA 158 Cb 1.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2gt3 h ALA 158 CO -0.17 0.90 -0.21 0.00 0.00 0.00 0.00 179.25 179.78 2gt3 h ALA 159 N 0.85 -0.59 -0.44 0.00 0.00 0.14 -1.73 119.26 117.49 2gt3 h ALA 159 Ca -0.07 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.69 2gt3 h ALA 159 Cb 1.60 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 19.60 2gt3 h ALA 159 CO 0.15 -0.70 0.29 0.00 0.00 0.00 0.00 179.25 178.99 2gt3 h MET 160 N -0.84 0.47 -0.73 0.00 -0.00 -0.60 -0.67 114.93 112.56 2gt3 h MET 160 Ca -0.06 -0.03 -0.04 0.00 -0.00 0.00 0.00 59.70 59.57 2gt3 h MET 160 Cb 0.56 -0.10 -0.03 0.00 -0.00 0.00 0.00 31.60 32.02 2gt3 h MET 160 CO 0.10 0.31 0.29 -0.07 -0.00 0.00 0.00 176.91 177.53 2gt3 h LEU 161 N 0.48 1.01 -1.58 -0.10 -0.00 -1.19 0.98 115.31 114.91 2gt3 h LEU 161 Ca 0.18 -0.15 0.00 0.00 -0.00 0.00 0.00 57.88 57.90 2gt3 h LEU 161 Cb 0.11 -0.26 0.00 0.00 -0.00 0.00 0.00 40.66 40.51 2gt3 h LEU 161 CO -0.04 0.90 0.00 0.00 -0.00 0.00 0.00 178.44 179.30 2gt3 h ALA 162 N 1.24 1.00 -0.34 1.53 0.00 -0.19 -0.80 119.26 121.70 2gt3 h ALA 162 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2gt3 h ALA 162 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2gt3 h ALA 162 CO -0.02 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.23 2gt3 n ALA 163 N -2.03 2.89 -1.79 0.00 0.00 -0.09 -4.84 120.51 114.65 2gt3 n ALA 163 Ca 0.00 -0.87 -0.13 0.00 0.00 0.00 0.00 53.44 52.44 2gt3 n ALA 163 Cb 0.25 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 18.64 2gt3 n ALA 163 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2gt3 n ASP 164 N 0.47 -4.39 -4.46 0.00 2.03 -0.31 -4.92 116.55 104.98 2gt3 n ASP 164 Ca 0.14 0.17 -0.44 0.00 0.52 0.00 0.00 54.79 55.18 2gt3 n ASP 164 Cb 0.57 -3.30 -0.02 0.00 -0.72 0.00 0.00 41.12 37.65 2gt3 n ASP 164 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2gt3 s ASP 165 N -2.65 6.76 0.00 1.67 -1.08 0.15 -4.78 116.67 116.74 2gt3 s ASP 165 Ca 0.00 -2.32 0.24 0.00 -0.52 0.00 0.00 52.55 49.95 2gt3 s ASP 165 Cb 0.00 -2.40 1.26 0.00 -1.46 0.00 0.00 42.92 40.32 2gt3 s ASP 165 CO 0.00 -0.98 1.80 0.47 0.52 0.00 0.00 175.17 176.99 2gt3 n ASP 166 N 6.33 0.00 -4.56 -0.34 10.43 -1.26 -4.08 116.55 123.07 2gt3 n ASP 166 Ca 0.28 -0.19 -0.37 0.00 2.57 0.00 0.00 54.79 57.08 2gt3 n ASP 166 Cb 0.47 -0.23 0.06 0.00 1.84 0.00 0.00 41.12 43.26 2gt3 n ASP 166 CO 0.00 0.00 0.00 -1.14 -1.07 0.00 0.00 177.20 174.99 2gt3 n ARG 167 N -1.23 0.66 -3.74 -1.24 3.00 -1.26 -4.97 116.66 107.88 2gt3 n ARG 167 Ca 0.13 0.27 -0.37 0.00 -0.00 0.00 0.00 57.85 57.87 2gt3 n ARG 167 Cb 0.17 -2.01 -0.06 0.00 0.00 0.00 0.00 32.46 30.56 2gt3 n ARG 167 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 2gt3 s HIS 168 N -1.65 3.64 -0.13 -0.14 5.65 -1.26 -5.03 115.29 116.37 2gt3 s HIS 168 Ca 0.73 0.69 -0.29 0.00 0.25 0.00 0.00 55.06 56.44 2gt3 s HIS 168 Cb -0.40 -2.07 -0.03 0.00 -1.18 0.00 0.00 32.58 28.89 2gt3 s HIS 168 CO 0.50 0.69 1.51 0.42 -0.65 0.00 0.00 174.74 177.21 2gt3 s ILE 169 N -1.00 3.84 -1.31 0.89 1.01 -1.26 -4.66 121.20 118.72 2gt3 s ILE 169 Ca 0.18 1.00 0.24 0.00 0.00 0.00 0.00 60.65 62.07 2gt3 s ILE 169 Cb -0.14 -3.70 -0.01 0.00 0.01 0.00 0.00 42.46 38.62 2gt3 s ILE 169 CO 0.07 -0.15 1.25 1.07 0.00 0.00 0.00 174.94 177.18 2gt3 n THR 170 N 5.67 0.00 -2.83 2.92 5.66 -1.23 -4.92 114.28 119.56 2gt3 n THR 170 Ca 0.16 -0.07 -0.34 0.00 -3.05 0.00 0.00 64.05 60.76 2gt3 n THR 170 Cb 0.44 0.65 -0.07 0.00 -1.55 0.00 0.00 70.33 69.80 2gt3 n THR 170 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 2gt3 s THR 171 N -2.82 4.37 0.02 1.09 -1.32 -1.22 -4.61 115.64 111.15 2gt3 s THR 171 Ca 0.14 1.53 0.00 0.00 -1.21 0.00 0.00 61.69 62.15 2gt3 s THR 171 Cb 0.18 -3.67 -0.02 0.00 -1.51 0.00 0.00 72.50 67.47 2gt3 s THR 171 CO 0.69 -0.23 -0.03 -1.83 -2.21 0.00 0.00 174.62 171.01 2gt3 s GLU 172 N -2.97 0.29 -0.17 7.08 -1.05 -1.04 -4.97 118.70 115.88 2gt3 s GLU 172 Ca 0.60 -0.57 -0.08 0.00 -0.15 0.00 0.00 54.97 54.76 2gt3 s GLU 172 Cb -0.11 0.09 -0.04 0.00 -0.44 0.00 0.00 34.13 33.63 2gt3 s GLU 172 CO 0.15 -0.04 0.11 0.42 0.95 0.00 0.00 175.26 176.85 2gt3 s ILE 173 N -1.36 5.27 0.12 1.83 1.09 -1.26 -2.41 121.20 124.48 2gt3 s ILE 173 Ca -0.15 0.13 -0.10 0.00 -1.10 0.00 0.00 60.65 59.44 2gt3 s ILE 173 Cb -0.09 -3.36 -0.00 0.00 -1.06 0.00 0.00 42.46 37.95 2gt3 s ILE 173 CO -0.01 0.50 0.25 0.00 -0.10 0.00 0.00 174.94 175.58 2gt3 s ALA 174 N -0.11 -0.22 0.89 9.38 0.00 -1.07 -4.98 121.76 125.66 2gt3 s ALA 174 Ca 0.09 -0.66 -0.11 0.00 0.00 0.00 0.00 51.96 51.29 2gt3 s ALA 174 Cb -0.12 0.64 0.13 0.00 0.00 0.00 0.00 23.12 23.77 2gt3 s ALA 174 CO 0.00 -0.57 1.16 -1.71 0.00 0.00 0.00 175.76 174.64 2gt3 n ASN 175 N -0.13 0.51 -4.68 0.00 5.15 -1.26 -4.29 115.26 110.55 2gt3 n ASN 175 Ca -0.12 0.47 -0.43 0.00 -0.60 0.00 0.00 54.58 53.90 2gt3 n ASN 175 Cb 0.63 -1.49 -0.02 0.00 -0.53 0.00 0.00 39.78 38.37 2gt3 n ASN 175 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2gt3 s ALA 176 N -2.49 3.48 0.57 5.20 0.00 -1.26 -4.88 121.76 122.39 2gt3 s ALA 176 Ca 0.69 0.42 0.09 0.00 0.00 0.00 0.00 51.96 53.16 2gt3 s ALA 176 Cb -0.25 -3.49 0.08 0.00 0.00 0.00 0.00 23.12 19.46 2gt3 s ALA 176 CO 0.56 -0.75 0.71 0.95 0.00 0.00 0.00 175.76 177.23 2gt3 s THR 177 N 2.33 2.03 -0.98 0.00 -4.23 -1.26 -5.01 115.64 108.51 2gt3 s THR 177 Ca 0.50 -1.11 -0.23 0.00 -1.18 0.00 0.00 61.69 59.67 2gt3 s THR 177 Cb -0.20 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 71.51 2gt3 s THR 177 CO 0.17 0.00 1.70 -2.16 -0.54 0.00 0.00 174.62 173.79 2gt3 s PRO 178 N -4.59 3.10 0.39 3.99 0.04 -1.26 -4.96 135.00 131.71 2gt3 s PRO 178 Ca 0.56 -0.78 -0.25 0.00 0.04 0.00 0.00 61.00 60.56 2gt3 s PRO 178 Cb -0.05 -5.23 -0.09 0.00 0.04 0.00 0.00 34.50 29.18 2gt3 s PRO 178 CO 0.35 -2.80 1.15 -0.06 0.04 0.00 0.00 177.00 175.68 2gt3 s PHE 179 N 7.47 3.12 -0.23 0.56 0.08 -1.26 -4.93 117.98 122.78 2gt3 s PHE 179 Ca 0.58 1.57 -0.04 0.00 0.12 0.00 0.00 56.93 59.16 2gt3 s PHE 179 Cb -0.03 -3.35 -0.01 0.00 -0.57 0.00 0.00 43.02 39.06 2gt3 s PHE 179 CO -0.04 -1.19 -0.02 0.71 -0.10 0.00 0.00 175.22 174.58 2gt3 s TYR 180 N -1.44 2.98 0.26 0.36 1.51 -1.11 -4.91 117.35 115.01 2gt3 s TYR 180 Ca 0.57 -0.86 -0.31 0.00 -1.01 0.00 0.00 57.07 55.46 2gt3 s TYR 180 Cb -0.29 -2.13 -0.12 0.00 -0.11 0.00 0.00 41.96 39.31 2gt3 s TYR 180 CO 0.37 -0.52 1.65 0.71 -1.11 0.00 0.00 175.55 176.65 2gt3 s TYR 181 N 1.50 2.81 0.61 2.71 1.51 -1.26 -1.98 117.35 123.25 2gt3 s TYR 181 Ca 0.06 0.61 -0.02 0.00 -1.01 0.00 0.00 57.07 56.71 2gt3 s TYR 181 Cb -0.14 -4.10 0.04 0.00 -0.11 0.00 0.00 41.96 37.65 2gt3 s TYR 181 CO -0.02 -3.88 0.87 0.00 -1.11 0.00 0.00 175.55 171.40 2gt3 s ALA 182 N 0.46 3.58 0.29 3.71 0.00 0.28 -4.92 121.76 125.15 2gt3 s ALA 182 Ca 0.68 -1.13 -0.30 0.00 0.00 0.00 0.00 51.96 51.21 2gt3 s ALA 182 Cb -0.49 -2.30 -0.13 0.00 0.00 0.00 0.00 23.12 20.20 2gt3 s ALA 182 CO 0.42 -0.94 1.37 0.39 0.00 0.00 0.00 175.76 177.00 2gt3 n GLU 183 N -2.56 2.13 -0.31 0.00 1.02 -1.26 -4.61 120.64 115.05 2gt3 n GLU 183 Ca 0.08 0.75 0.15 0.00 -0.02 0.00 0.00 57.16 58.12 2gt3 n GLU 183 Cb 0.60 -2.39 0.40 0.00 -0.02 0.00 0.00 31.44 30.03 2gt3 n GLU 183 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 2gt3 h ASP 184 N 3.57 0.63 -0.48 1.62 3.58 -1.88 0.91 116.42 124.37 2gt3 h ASP 184 Ca -0.46 0.07 0.14 0.00 0.42 0.00 0.00 57.03 57.20 2gt3 h ASP 184 Cb 1.27 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 42.26 2gt3 h ASP 184 CO 0.71 0.24 0.53 0.44 -2.88 0.00 0.00 179.24 178.28 2gt3 h ASP 185 N 0.62 0.00 0.01 2.28 3.32 -1.98 -1.33 116.42 119.34 2gt3 h ASP 185 Ca 0.53 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 57.16 2gt3 h ASP 185 Cb 0.99 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.48 2gt3 h ASP 185 CO -0.28 0.00 -2.37 1.41 -1.72 0.00 0.00 179.24 176.28 2gt3 n HIS 186 N -3.64 0.17 -1.62 4.55 8.25 0.29 -4.62 115.22 118.60 2gt3 n HIS 186 Ca 0.09 0.06 -0.47 0.00 -0.26 0.00 0.00 57.72 57.14 2gt3 n HIS 186 Cb 0.72 -1.02 -0.03 0.00 1.12 0.00 0.00 29.99 30.78 2gt3 n HIS 186 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2gt3 n GLN 187 N -4.00 1.59 -3.84 -0.41 6.02 0.21 -1.44 117.38 115.52 2gt3 n GLN 187 Ca -0.49 0.57 -0.23 0.00 -0.01 0.00 0.00 57.00 56.83 2gt3 n GLN 187 Cb 0.90 -2.15 -0.07 0.00 1.02 0.00 0.00 30.24 29.93 2gt3 n GLN 187 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2gt3 n GLN 188 N 1.97 -0.95 0.11 -1.09 10.64 -1.26 -4.74 117.38 122.06 2gt3 n GLN 188 Ca 0.14 0.07 0.05 0.00 -1.83 0.00 0.00 57.00 55.42 2gt3 n GLN 188 Cb 0.28 -2.69 0.49 0.00 -0.86 0.00 0.00 30.24 27.45 2gt3 n GLN 188 CO 0.00 0.00 0.00 -0.92 -1.83 0.00 0.00 177.06 174.31 2gt3 h TYR 189 N -1.04 0.29 0.00 2.61 3.20 -1.50 0.61 116.97 121.15 2gt3 h TYR 189 Ca -0.49 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.38 2gt3 h TYR 189 Cb 1.03 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 39.21 2gt3 h TYR 189 CO 0.39 0.22 0.00 1.25 -1.64 0.00 0.00 178.16 178.39 2gt3 h LEU 190 N 0.31 0.00 -0.56 2.82 7.12 -1.78 0.62 115.31 123.84 2gt3 h LEU 190 Ca 0.08 0.00 -0.16 0.00 0.13 0.00 0.00 57.88 57.93 2gt3 h LEU 190 Cb 0.04 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.16 2gt3 h LEU 190 CO -0.01 0.00 -0.54 1.12 -0.13 0.00 0.00 178.44 178.88 2gt3 h HIS 191 N 0.00 0.64 -0.23 1.25 2.07 -1.20 -3.06 115.15 114.62 2gt3 h HIS 191 Ca 0.00 -0.22 -0.08 0.00 -2.85 0.00 0.00 60.37 57.22 2gt3 h HIS 191 Cb 0.05 -0.12 -0.00 0.00 2.57 0.00 0.00 27.41 29.90 2gt3 h HIS 191 CO 0.00 0.94 -0.16 0.87 -3.07 0.00 0.00 177.93 176.51 2gt3 h LYS 192 N 0.39 0.51 -3.85 5.12 1.57 -0.97 -3.42 116.57 115.93 2gt3 h LYS 192 Ca 0.01 -0.24 -0.52 0.00 -1.87 0.00 0.00 60.65 58.03 2gt3 h LYS 192 Cb 1.07 -0.00 -0.39 0.00 0.08 0.00 0.00 32.23 32.99 2gt3 h LYS 192 CO 0.10 0.81 -0.78 0.54 -0.57 0.00 0.00 179.45 179.55 2gt3 s ASN 193 N -6.25 2.60 0.30 0.86 2.20 -1.08 -4.99 114.94 108.59 2gt3 s ASN 193 Ca -0.13 -0.60 0.26 0.00 -0.94 0.00 0.00 52.86 51.45 2gt3 s ASN 193 Cb 0.07 -0.70 0.89 0.00 -2.00 0.00 0.00 41.25 39.51 2gt3 s ASN 193 CO 0.78 -0.23 1.76 1.55 -2.94 0.00 0.00 177.10 178.02 2gt3 h PRO 194 N 8.21 0.00 -0.56 3.55 0.13 -1.79 -2.86 132.00 138.68 2gt3 h PRO 194 Ca -0.20 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.78 2gt3 h PRO 194 Cb 1.12 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.16 2gt3 h PRO 194 CO 0.35 0.00 0.14 2.48 -0.23 0.00 0.00 178.00 180.74 2gt3 n TYR 195 N -2.48 1.86 -0.72 1.56 4.11 -1.26 -4.98 117.16 115.25 2gt3 n TYR 195 Ca 0.03 -1.17 0.00 0.00 -0.00 0.00 0.00 57.90 56.76 2gt3 n TYR 195 Cb 0.35 -0.56 0.00 0.00 -0.00 0.00 0.00 39.34 39.13 2gt3 n TYR 195 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2gt3 n GLY 196 N -0.38 -1.30 3.71 -7.48 0.00 -1.08 -5.01 105.19 93.65 2gt3 n GLY 196 Ca 0.35 -1.62 -0.40 0.00 0.00 0.00 0.00 46.02 44.35 2gt3 n GLY 196 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gt3 s TYR 197 N -0.79 3.56 -0.01 1.61 1.51 -1.26 -4.90 117.35 117.07 2gt3 s TYR 197 Ca 0.00 1.26 -0.00 0.00 -1.01 0.00 0.00 57.07 57.32 2gt3 s TYR 197 Cb 0.00 -2.84 -0.00 0.00 -0.11 0.00 0.00 41.96 39.01 2gt3 s TYR 197 CO 0.00 0.05 -0.01 0.00 -1.11 0.00 0.00 175.55 174.48 2gt3 n GLY 199 N 3.25 1.14 3.49 0.00 0.00 -1.26 -4.69 105.19 107.12 2gt3 n GLY 199 Ca -0.01 -0.01 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 2gt3 n GLY 199 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2gt3 n ILE 200 N 0.00 2.40 -2.77 -0.61 3.06 -1.26 -4.82 119.36 115.37 2gt3 n ILE 200 Ca 0.00 -0.50 -0.03 0.00 -2.50 0.00 0.00 62.75 59.72 2gt3 n ILE 200 Cb 0.00 -0.74 0.02 0.00 0.54 0.00 0.00 39.64 39.45 2gt3 n ILE 200 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 2gt3 s GLY 201 N -1.15 -1.55 0.24 4.50 0.00 -1.26 -5.15 107.32 102.95 2gt3 s GLY 201 Ca 0.69 0.21 0.00 0.00 0.00 0.00 0.00 44.72 45.62 2gt3 s GLY 201 CO 0.54 3.98 0.00 0.61 0.00 0.00 0.00 173.10 178.23 2gt3 n GLY 202 N 3.02 -1.79 0.05 0.20 0.00 -1.23 -4.80 105.19 100.65 2gt3 n GLY 202 Ca 0.14 -1.28 -0.07 0.00 0.00 0.00 0.00 46.02 44.81 2gt3 n GLY 202 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2gt3 n ILE 203 N -3.23 0.65 0.00 -0.61 -5.35 -1.26 -4.29 119.36 105.27 2gt3 n ILE 203 Ca 0.00 -0.30 0.00 0.00 -0.27 0.00 0.00 62.75 62.18 2gt3 n ILE 203 Cb 0.44 -0.86 0.00 0.00 -1.74 0.00 0.00 39.64 37.48 2gt3 n ILE 203 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2gt3 n GLY 204 N 2.76 3.07 3.82 3.28 0.00 -1.26 -4.68 105.19 112.19 2gt3 n GLY 204 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 2gt3 n GLY 204 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2gt3 s VAL 205 N -2.10 4.31 0.13 1.61 1.01 -1.26 -5.07 120.40 119.04 2gt3 s VAL 205 Ca 0.00 1.29 0.09 0.00 0.00 0.00 0.00 61.98 63.36 2gt3 s VAL 205 Cb 0.00 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 2gt3 s VAL 205 CO 0.00 -0.45 -0.18 0.00 0.00 0.00 0.00 175.10 174.47 2gt3 s LEU 207 N -2.29 2.20 -0.09 0.00 -0.00 -1.26 -4.52 118.68 112.72 2gt3 s LEU 207 Ca 0.19 -0.80 -0.30 0.00 -0.00 0.00 0.00 54.13 53.23 2gt3 s LEU 207 Cb -0.10 0.35 -0.03 0.00 -0.00 0.00 0.00 46.19 46.42 2gt3 s LEU 207 CO 0.11 -0.55 1.24 -2.16 -0.00 0.00 0.00 176.35 174.98 2gt3 s PRO 208 N -3.29 4.30 -0.03 1.48 0.04 -1.26 -4.96 135.00 131.28 2gt3 s PRO 208 Ca 0.01 1.69 -0.04 0.00 0.04 0.00 0.00 61.00 62.70 2gt3 s PRO 208 Cb 0.03 -3.63 -0.02 0.00 0.04 0.00 0.00 34.50 30.92 2gt3 s PRO 208 CO -0.08 -0.55 0.31 -1.00 0.04 0.00 0.00 177.00 175.72 2gt3 h PRO 209 N 7.76 -0.14 -5.73 0.56 0.13 -2.07 -3.42 132.00 129.10 2gt3 h PRO 209 Ca -0.32 0.01 -0.50 0.00 -0.87 0.00 0.00 66.00 64.32 2gt3 h PRO 209 Cb 1.14 0.03 0.01 0.00 0.13 0.00 0.00 31.00 32.31 2gt3 h PRO 209 CO 0.91 -0.09 1.59 -1.21 -0.23 0.00 0.00 178.00 178.97 2gt3 s GLU 210 N -1.99 2.39 0.00 0.86 0.41 -1.26 -5.35 118.70 113.76 2gt3 s GLU 210 Ca -0.02 1.56 0.00 0.00 -0.41 0.00 0.00 54.97 56.10 2gt3 s GLU 210 Cb 0.00 -4.52 0.00 0.00 -1.78 0.00 0.00 34.13 27.83 2gt3 s GLU 210 CO 0.06 -2.95 0.00 0.00 -0.49 0.00 0.00 175.26 171.88