#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 4.72 -0.22 -3.43 -0.00 -1.26 -4.41 117.00 112.40 2gt3 n LEU 2 Ca 0.00 -2.38 -0.06 0.00 -0.00 0.00 0.00 56.01 53.57 2gt3 n LEU 2 Cb 0.00 -0.58 0.04 0.00 -0.00 0.00 0.00 43.42 42.88 2gt3 n LEU 2 CO 0.00 0.78 1.14 -0.26 -0.00 0.00 0.00 177.39 179.05 2gt3 h PHE 3 N 4.01 0.79 -3.66 1.47 -1.00 -2.01 -3.42 116.94 113.12 2gt3 h PHE 3 Ca 0.00 0.02 -0.67 0.00 2.81 0.00 0.00 57.97 60.13 2gt3 h PHE 3 Cb 1.46 -0.27 -0.17 0.00 3.61 0.00 0.00 35.95 40.58 2gt3 h PHE 3 CO 0.78 0.49 -0.76 0.16 -1.61 0.00 0.00 178.31 177.36 2gt3 s ASP 4 N -5.76 4.19 0.00 2.17 1.47 -1.26 -4.21 116.67 113.26 2gt3 s ASP 4 Ca -0.13 -0.43 0.00 0.00 1.18 0.00 0.00 52.55 53.17 2gt3 s ASP 4 Cb 0.14 -0.74 0.00 0.00 -0.34 0.00 0.00 42.92 41.98 2gt3 s ASP 4 CO 0.76 0.19 0.38 0.29 0.68 0.00 0.00 175.17 177.47 2gt3 n LYS 5 N 0.88 0.00 -0.02 2.11 4.76 -1.23 -4.84 118.16 119.82 2gt3 n LYS 5 Ca -0.14 0.33 -0.06 0.00 -2.87 0.00 0.00 58.31 55.56 2gt3 n LYS 5 Cb 0.52 -1.05 -0.02 0.00 -1.84 0.00 0.00 35.03 32.64 2gt3 n LYS 5 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2gt3 n LYS 6 N -1.48 0.16 -0.05 1.97 3.00 -1.26 -4.94 118.16 115.56 2gt3 n LYS 6 Ca 0.00 0.07 -0.10 0.00 -0.00 0.00 0.00 58.31 58.28 2gt3 n LYS 6 Cb 0.00 -0.78 -0.03 0.00 0.00 0.00 0.00 35.03 34.22 2gt3 n LYS 6 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 2gt3 n HIS 7 N -3.54 0.00 -4.05 5.64 1.44 -1.26 -5.10 115.22 108.35 2gt3 n HIS 7 Ca -0.11 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.50 2gt3 n HIS 7 Cb 0.41 -0.39 -0.06 0.00 0.12 0.00 0.00 29.99 30.07 2gt3 n HIS 7 CO 0.00 0.00 0.00 -0.48 -2.81 0.00 0.00 176.34 173.05 2gt3 s LEU 8 N -7.24 0.55 0.35 2.39 0.05 -1.26 -4.88 118.68 108.64 2gt3 s LEU 8 Ca -0.19 -1.07 -0.20 0.00 0.05 0.00 0.00 54.13 52.72 2gt3 s LEU 8 Cb 0.05 1.43 -0.15 0.00 -2.05 0.00 0.00 46.19 45.47 2gt3 s LEU 8 CO 0.25 -1.08 0.13 0.55 -0.55 0.00 0.00 176.35 175.65 2gt3 n VAL 9 N -0.37 0.74 -1.16 1.48 3.14 -1.26 -3.50 118.33 117.40 2gt3 n VAL 9 Ca -0.01 -0.46 -0.29 0.00 -2.96 0.00 0.00 64.34 60.62 2gt3 n VAL 9 Cb 0.63 0.00 0.18 0.00 -1.06 0.00 0.00 33.84 33.59 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 -0.93 2.46 0.06 6.55 0.01 -1.26 -4.85 113.70 115.75 2gt3 s SER 10 Ca 0.55 1.14 -0.15 0.00 1.31 0.00 0.00 55.95 58.80 2gt3 s SER 10 Cb -0.62 -1.79 -0.21 0.00 0.21 0.00 0.00 66.02 63.61 2gt3 s SER 10 CO 0.57 -3.23 1.20 1.55 0.41 0.00 0.00 173.24 173.75 2gt3 h PRO 11 N -1.96 0.65 0.00 12.44 0.13 -1.95 -2.08 132.00 139.24 2gt3 h PRO 11 Ca -0.55 -0.64 0.00 0.00 -0.87 0.00 0.00 66.00 63.95 2gt3 h PRO 11 Cb 1.33 0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.63 2gt3 h PRO 11 CO 0.57 1.24 0.00 0.00 -0.23 0.00 0.00 178.00 179.58 2gt3 h ALA 12 N 0.43 1.00 0.12 -0.56 0.00 -2.02 -3.07 119.26 115.15 2gt3 h ALA 12 Ca -0.09 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.63 2gt3 h ALA 12 Cb 1.49 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.30 2gt3 h ALA 12 CO 0.17 0.00 -0.82 0.22 0.00 0.00 0.00 179.25 178.82 2gt3 h ASP 13 N 0.00 0.52 -2.95 0.00 1.82 -1.91 -3.46 116.42 110.45 2gt3 h ASP 13 Ca 0.00 -0.90 -0.53 0.00 -0.39 0.00 0.00 57.03 55.21 2gt3 h ASP 13 Cb 0.67 -0.17 0.22 0.00 0.68 0.00 0.00 39.33 40.73 2gt3 h ASP 13 CO 0.00 1.38 -0.96 0.00 -1.61 0.00 0.00 179.24 178.05 2gt3 n ALA 14 N -2.65 -3.46 -2.56 -0.78 0.00 -0.79 -4.88 120.51 105.38 2gt3 n ALA 14 Ca -0.13 -0.70 -0.42 0.00 0.00 0.00 0.00 53.44 52.18 2gt3 n ALA 14 Cb 0.81 -1.60 -0.05 0.00 0.00 0.00 0.00 19.45 18.60 2gt3 n ALA 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2gt3 s LEU 15 N 1.17 4.20 -0.55 0.00 1.02 0.03 -4.93 118.68 119.62 2gt3 s LEU 15 Ca 0.52 0.12 -0.06 0.00 0.02 0.00 0.00 54.13 54.74 2gt3 s LEU 15 Cb -0.19 -2.97 -0.14 0.00 0.02 0.00 0.00 46.19 42.91 2gt3 s LEU 15 CO 0.71 -0.79 2.68 -0.81 0.02 0.00 0.00 176.35 178.15 2gt3 n PRO 16 N 6.50 2.08 -2.71 1.29 -0.04 -1.26 -4.53 135.00 136.33 2gt3 n PRO 16 Ca 0.02 -1.21 -0.06 0.00 -0.04 0.00 0.00 63.50 62.21 2gt3 n PRO 16 Cb 0.48 -2.20 -0.02 0.00 -0.04 0.00 0.00 33.50 31.72 2gt3 n PRO 16 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2gt3 n GLY 17 N 3.10 3.68 3.62 0.55 0.00 -1.26 -5.10 105.19 109.79 2gt3 n GLY 17 Ca 0.44 -1.75 -0.13 0.00 0.00 0.00 0.00 46.02 44.58 2gt3 n GLY 17 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2gt3 s ARG 18 N -2.43 0.78 0.40 1.61 1.04 -1.26 -3.78 118.95 115.30 2gt3 s ARG 18 Ca 0.12 0.85 0.08 0.00 -1.04 0.00 0.00 55.73 55.74 2gt3 s ARG 18 Cb 0.01 0.38 -0.00 0.00 -2.04 0.00 0.00 34.95 33.29 2gt3 s ARG 18 CO 0.09 -0.11 0.50 -0.80 -0.04 0.00 0.00 175.30 174.94 2gt3 s ASN 19 N 0.22 5.61 0.73 -2.89 -0.87 -0.83 -5.05 114.94 111.86 2gt3 s ASN 19 Ca -0.00 -0.43 -0.11 0.00 -1.57 0.00 0.00 52.86 50.75 2gt3 s ASN 19 Cb -0.05 -0.79 0.03 0.00 -0.02 0.00 0.00 41.25 40.43 2gt3 s ASN 19 CO 0.00 -0.65 1.08 0.42 -2.57 0.00 0.00 177.10 175.38 2gt3 s THR 20 N -2.33 3.62 0.34 1.60 -4.23 -1.26 -4.76 115.64 108.62 2gt3 s THR 20 Ca 0.51 0.55 -0.27 0.00 -1.18 0.00 0.00 61.69 61.30 2gt3 s THR 20 Cb -0.09 -3.13 -0.09 0.00 1.34 0.00 0.00 72.50 70.53 2gt3 s THR 20 CO 0.31 -0.67 1.07 -2.16 -0.54 0.00 0.00 174.62 172.63 2gt3 s PRO 21 N -4.89 4.40 0.17 3.99 0.04 -1.26 -5.01 135.00 132.44 2gt3 s PRO 21 Ca 0.60 1.65 -0.04 0.00 0.04 0.00 0.00 61.00 63.25 2gt3 s PRO 21 Cb -0.16 -2.86 -0.05 0.00 0.04 0.00 0.00 34.50 31.47 2gt3 s PRO 21 CO 0.54 0.04 0.39 -1.64 0.04 0.00 0.00 177.00 176.37 2gt3 s MET 22 N -1.97 3.59 0.39 4.56 -1.94 -1.26 -5.08 119.30 117.59 2gt3 s MET 22 Ca 0.51 -0.16 -0.24 0.00 -1.71 0.00 0.00 55.69 54.09 2gt3 s MET 22 Cb -0.27 -2.84 -0.09 0.00 2.01 0.00 0.00 34.83 33.65 2gt3 s MET 22 CO 0.34 0.44 1.06 -1.25 -0.01 0.00 0.00 175.02 175.59 2gt3 s PRO 23 N -2.89 4.20 0.12 2.03 0.04 -1.26 -4.99 135.00 132.24 2gt3 s PRO 23 Ca 0.40 1.54 0.06 0.00 0.04 0.00 0.00 61.00 63.05 2gt3 s PRO 23 Cb -0.12 -2.59 -0.04 0.00 0.04 0.00 0.00 34.50 31.79 2gt3 s PRO 23 CO 0.26 -0.12 -0.05 0.08 0.04 0.00 0.00 177.00 177.22 2gt3 s VAL 24 N -1.61 3.65 0.66 -0.36 1.01 -1.26 -4.56 120.40 117.93 2gt3 s VAL 24 Ca 0.57 -1.23 -0.17 0.00 0.00 0.00 0.00 61.98 61.15 2gt3 s VAL 24 Cb -0.23 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.40 2gt3 s VAL 24 CO 0.29 0.06 1.19 0.00 0.00 0.00 0.00 175.10 176.63 2gt3 s ALA 25 N -1.38 2.36 0.17 5.51 0.00 -1.26 -4.94 121.76 122.23 2gt3 s ALA 25 Ca 0.24 0.87 -0.01 0.00 0.00 0.00 0.00 51.96 53.06 2gt3 s ALA 25 Cb -0.11 -3.43 0.03 0.00 0.00 0.00 0.00 23.12 19.61 2gt3 s ALA 25 CO 0.16 -1.47 1.40 1.15 0.00 0.00 0.00 175.76 177.01 2gt3 h THR 26 N 0.26 1.40 -3.94 0.00 2.02 -1.99 -3.43 112.91 107.22 2gt3 h THR 26 Ca -0.49 -2.27 -0.23 0.00 0.77 0.00 0.00 66.41 64.20 2gt3 h THR 26 Cb 1.29 2.22 -0.22 0.00 -1.74 0.00 0.00 68.15 69.69 2gt3 h THR 26 CO 0.53 0.68 -0.72 -0.76 0.37 0.00 0.00 175.52 175.61 2gt3 s LEU 27 N -7.83 2.20 1.11 2.58 1.43 -1.26 -3.72 118.68 113.20 2gt3 s LEU 27 Ca -0.05 -0.43 -0.19 0.00 -1.03 0.00 0.00 54.13 52.42 2gt3 s LEU 27 Cb 0.10 -0.05 0.09 0.00 0.03 0.00 0.00 46.19 46.36 2gt3 s LEU 27 CO 0.84 -0.20 -0.13 1.57 0.23 0.00 0.00 176.35 178.66 2gt3 n HIS 28 N 1.83 -1.49 0.11 0.29 -0.00 0.84 -4.73 115.22 112.06 2gt3 n HIS 28 Ca -0.21 0.17 -0.05 0.00 -0.00 0.00 0.00 57.72 57.63 2gt3 n HIS 28 Cb 0.56 -1.52 -0.02 0.00 -0.00 0.00 0.00 29.99 29.00 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 -2.04 -0.50 0.00 1.57 0.00 -1.91 -2.88 119.26 113.51 2gt3 h ALA 29 Ca -0.50 -0.07 -0.23 0.00 0.00 0.00 0.00 54.91 54.10 2gt3 h ALA 29 Cb 1.32 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 2gt3 h ALA 29 CO 0.35 -0.47 -1.35 0.28 0.00 0.00 0.00 179.25 178.05 2gt3 n VAL 30 N -3.83 1.52 0.27 0.00 0.31 -1.26 -4.04 118.33 111.30 2gt3 n VAL 30 Ca -0.04 -0.04 0.18 0.00 -0.01 0.00 0.00 64.34 64.43 2gt3 n VAL 30 Cb 0.13 -2.07 0.95 0.00 -0.91 0.00 0.00 33.84 31.94 2gt3 n VAL 30 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 2gt3 h ASN 31 N -1.00 0.00 -4.79 4.52 -0.26 -1.89 -3.44 115.58 108.72 2gt3 h ASN 31 Ca -0.35 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.39 2gt3 h ASN 31 Cb 1.24 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.50 2gt3 h ASN 31 CO -0.21 0.00 0.00 0.61 -1.06 0.00 0.00 177.43 176.77 2gt3 n GLY 32 N -1.28 -0.47 3.99 2.83 0.00 -1.09 -4.76 105.19 104.42 2gt3 n GLY 32 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.92 3.09 -0.04 1.61 4.02 -1.26 -4.38 115.29 116.41 2gt3 s HIS 33 Ca 0.00 -0.21 -0.30 0.00 1.02 0.00 0.00 55.06 55.57 2gt3 s HIS 33 Cb 0.00 -2.05 -0.07 0.00 -1.02 0.00 0.00 32.58 29.44 2gt3 s HIS 33 CO 0.00 -0.08 1.79 -1.54 1.02 0.00 0.00 174.74 175.93 2gt3 s SER 34 N -4.20 6.52 -0.12 1.40 1.04 -1.26 -0.11 113.70 116.97 2gt3 s SER 34 Ca 0.46 2.34 -0.14 0.00 0.48 0.00 0.00 55.95 59.10 2gt3 s SER 34 Cb -0.10 -2.53 -0.12 0.00 0.10 0.00 0.00 66.02 63.37 2gt3 s SER 34 CO 0.32 -1.03 0.33 0.24 0.98 0.00 0.00 173.24 174.08 2gt3 h MET 35 N 10.22 0.00 0.26 4.02 2.86 -1.84 -3.39 114.93 127.07 2gt3 h MET 35 Ca -0.43 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.20 2gt3 h MET 35 Cb 1.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.86 2gt3 h MET 35 CO 0.95 0.47 -0.13 1.79 1.06 0.00 0.00 176.91 181.06 2gt3 h THR 36 N -1.00 0.79 -3.85 2.22 1.35 -1.85 -3.43 112.91 107.15 2gt3 h THR 36 Ca -0.01 -0.45 -0.52 0.00 -0.55 0.00 0.00 66.41 64.88 2gt3 h THR 36 Cb 0.50 1.05 0.05 0.00 -1.73 0.00 0.00 68.15 68.01 2gt3 h THR 36 CO -0.01 0.10 0.57 0.20 -0.25 0.00 0.00 175.52 176.13 2gt3 s ASN 37 N -5.08 6.96 -0.04 5.36 -0.87 -1.26 -5.03 114.94 114.99 2gt3 s ASN 37 Ca -0.15 2.52 0.05 0.00 -1.57 0.00 0.00 52.86 53.71 2gt3 s ASN 37 Cb 0.03 -2.64 -0.01 0.00 -0.02 0.00 0.00 41.25 38.61 2gt3 s ASN 37 CO 0.60 -0.38 -0.18 -0.69 -2.57 0.00 0.00 177.10 173.87 2gt3 s VAL 38 N -1.15 1.49 0.42 1.60 1.01 -1.26 -4.69 120.40 117.82 2gt3 s VAL 38 Ca 0.47 -0.77 -0.23 0.00 0.00 0.00 0.00 61.98 61.45 2gt3 s VAL 38 Cb -0.36 -1.27 -0.09 0.00 0.00 0.00 0.00 36.38 34.66 2gt3 s VAL 38 CO 0.48 0.43 1.05 -2.16 0.00 0.00 0.00 175.10 174.90 2gt3 s PRO 39 N -0.12 4.08 0.05 2.72 0.04 -1.26 -4.96 135.00 135.54 2gt3 s PRO 39 Ca -0.00 1.50 -0.30 0.00 0.04 0.00 0.00 61.00 62.23 2gt3 s PRO 39 Cb -0.10 -2.45 -0.08 0.00 0.04 0.00 0.00 34.50 31.90 2gt3 s PRO 39 CO 0.01 -0.21 1.76 0.34 0.04 0.00 0.00 177.00 178.94 2gt3 s ASP 40 N -1.63 6.55 0.00 6.66 3.68 -1.26 -1.22 116.67 129.45 2gt3 s ASP 40 Ca 0.60 2.53 0.00 0.00 2.13 0.00 0.00 52.55 57.81 2gt3 s ASP 40 Cb -0.21 -2.55 0.00 0.00 -1.45 0.00 0.00 42.92 38.71 2gt3 s ASP 40 CO 0.26 -0.96 0.00 0.61 0.13 0.00 0.00 175.17 175.22 2gt3 n GLY 41 N 4.20 0.46 3.89 2.66 0.00 -1.26 -5.08 105.19 110.06 2gt3 n GLY 41 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.72 3.52 0.26 1.61 0.00 -0.36 -4.10 119.30 119.52 2gt3 s MET 42 Ca 0.00 -0.13 0.06 0.00 0.00 0.00 0.00 55.69 55.62 2gt3 s MET 42 Cb 0.00 -3.12 -0.06 0.00 0.00 0.00 0.00 34.83 31.65 2gt3 s MET 42 CO 0.00 0.70 -0.06 -1.21 0.00 0.00 0.00 175.02 174.44 2gt3 s GLU 43 N -1.56 1.50 0.15 4.11 2.02 -0.28 -4.83 118.70 119.81 2gt3 s GLU 43 Ca 0.24 -1.75 0.09 0.00 0.02 0.00 0.00 54.97 53.57 2gt3 s GLU 43 Cb -0.13 -1.08 -0.04 0.00 0.10 0.00 0.00 34.13 32.98 2gt3 s GLU 43 CO 0.13 0.04 -0.14 0.42 0.02 0.00 0.00 175.26 175.73 2gt3 s ILE 44 N -3.06 3.03 -0.07 -1.63 1.01 -1.26 -0.57 121.20 118.65 2gt3 s ILE 44 Ca 0.29 -1.60 0.00 0.00 0.00 0.00 0.00 60.65 59.33 2gt3 s ILE 44 Cb 0.03 -2.45 0.02 0.00 0.01 0.00 0.00 42.46 40.08 2gt3 s ILE 44 CO 0.11 -0.02 -0.05 0.00 0.00 0.00 0.00 174.94 174.98 2gt3 s ALA 45 N -1.48 0.89 -0.21 9.38 0.00 0.47 -4.70 121.76 126.11 2gt3 s ALA 45 Ca 0.22 -0.23 -0.09 0.00 0.00 0.00 0.00 51.96 51.86 2gt3 s ALA 45 Cb -0.09 -0.65 -0.05 0.00 0.00 0.00 0.00 23.12 22.33 2gt3 s ALA 45 CO 0.13 -0.23 0.12 0.42 0.00 0.00 0.00 175.76 176.20 2gt3 s ILE 46 N 1.40 5.15 0.05 0.00 1.01 -1.06 0.87 121.20 128.62 2gt3 s ILE 46 Ca -0.03 0.10 -0.14 0.00 0.00 0.00 0.00 60.65 60.59 2gt3 s ILE 46 Cb -0.13 -3.37 0.02 0.00 0.01 0.00 0.00 42.46 38.99 2gt3 s ILE 46 CO -0.03 0.40 0.31 -0.36 0.00 0.00 0.00 174.94 175.26 2gt3 s PHE 47 N 0.70 -0.11 -0.24 3.97 0.40 -0.79 -0.30 117.98 121.62 2gt3 s PHE 47 Ca 0.06 -0.04 0.02 0.00 -0.60 0.00 0.00 56.93 56.37 2gt3 s PHE 47 Cb -0.13 0.10 0.04 0.00 0.51 0.00 0.00 43.02 43.55 2gt3 s PHE 47 CO 0.01 -0.51 -0.13 0.00 0.70 0.00 0.00 175.22 175.29 2gt3 s ALA 48 N -2.63 2.52 -0.08 5.36 0.00 0.21 0.60 121.76 127.73 2gt3 s ALA 48 Ca -0.04 -1.57 0.12 0.00 0.00 0.00 0.00 51.96 50.46 2gt3 s ALA 48 Cb -0.01 -1.48 0.21 0.00 0.00 0.00 0.00 23.12 21.84 2gt3 s ALA 48 CO -0.04 -0.90 1.11 -1.33 0.00 0.00 0.00 175.76 174.59 2gt3 n MET 49 N 4.52 0.74 0.00 0.00 2.81 -1.24 -2.64 117.12 121.31 2gt3 n MET 49 Ca -0.16 -2.04 0.00 0.00 -1.81 0.00 0.00 57.70 53.69 2gt3 n MET 49 Cb 0.45 -1.02 0.00 0.00 -0.71 0.00 0.00 33.22 31.94 2gt3 n MET 49 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2gt3 n GLY 50 N -0.72 0.39 3.31 3.03 0.00 -1.25 -4.85 105.19 105.10 2gt3 n GLY 50 Ca 0.10 -1.15 -0.56 0.00 0.00 0.00 0.00 46.02 44.40 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 8.26 0.00 0.01 0.00 1.16 -1.26 -2.81 117.46 122.81 2gt3 n PHE 52 Ca 0.54 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 56.01 2gt3 n PHE 52 Cb 0.02 0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 37.80 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 0.00 -0.11 0.00 2.97 6.55 -1.89 0.51 115.95 123.97 2gt3 h TRP 53 Ca 0.00 -0.00 -0.13 0.00 0.95 0.00 0.00 58.89 59.70 2gt3 h TRP 53 Cb 0.00 0.04 -0.02 0.00 -0.86 0.00 0.00 29.16 28.32 2gt3 h TRP 53 CO 0.00 0.43 -0.63 0.78 -1.05 0.00 0.00 178.44 177.97 2gt3 h GLY 54 N -0.83 0.00 0.35 1.49 0.00 -1.74 -2.80 103.07 99.54 2gt3 h GLY 54 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 2gt3 h GLY 54 CO 0.02 0.00 -0.11 -2.08 0.00 0.00 0.00 176.54 174.37 2gt3 h VAL 55 N 0.00 0.50 -0.37 4.60 2.07 -1.60 0.13 116.25 121.59 2gt3 h VAL 55 Ca -0.01 -0.94 0.08 0.00 0.82 0.00 0.00 66.70 66.65 2gt3 h VAL 55 Cb 1.38 0.84 -0.08 0.00 -1.52 0.00 0.00 31.29 31.91 2gt3 h VAL 55 CO 0.08 0.13 -0.18 1.05 0.02 0.00 0.00 177.57 178.67 2gt3 h GLU 56 N -0.97 -0.12 0.00 1.57 4.11 -0.99 0.36 114.58 118.55 2gt3 h GLU 56 Ca -0.03 0.01 -0.04 0.00 0.07 0.00 0.00 59.36 59.37 2gt3 h GLU 56 Cb 0.46 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2gt3 h GLU 56 CO 0.05 -0.08 -0.18 0.07 0.07 0.00 0.00 179.01 178.94 2gt3 h ARG 57 N -0.12 0.00 -0.42 1.06 -0.00 -1.58 0.51 114.38 113.83 2gt3 h ARG 57 Ca 0.18 0.00 -0.13 0.00 -0.00 0.00 0.00 59.98 60.04 2gt3 h ARG 57 Cb 0.40 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.36 2gt3 h ARG 57 CO -0.45 0.18 -0.23 1.25 -0.00 0.00 0.00 179.97 180.72 2gt3 h LEU 58 N 0.00 0.93 0.06 0.08 5.85 0.24 -1.54 115.31 120.93 2gt3 h LEU 58 Ca -0.00 -0.42 -0.29 0.00 0.84 0.00 0.00 57.88 58.01 2gt3 h LEU 58 Cb 0.59 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2gt3 h LEU 58 CO 0.02 1.14 -1.53 -0.26 -0.34 0.00 0.00 178.44 177.48 2gt3 h PHE 59 N 0.72 0.23 0.10 1.25 0.04 -0.31 -3.12 116.94 115.84 2gt3 h PHE 59 Ca 0.09 -0.17 0.00 0.00 2.80 0.00 0.00 57.97 60.70 2gt3 h PHE 59 Cb 0.81 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.94 2gt3 h PHE 59 CO 0.06 1.22 -0.10 2.35 -0.60 0.00 0.00 178.31 181.24 2gt3 h TRP 60 N 0.03 -0.27 0.00 -0.55 -0.00 0.02 0.12 115.95 115.30 2gt3 h TRP 60 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.66 2gt3 h TRP 60 Cb 1.97 0.11 0.00 0.00 -0.00 0.00 0.00 29.16 31.24 2gt3 h TRP 60 CO 0.03 -0.16 0.00 1.04 -0.00 0.00 0.00 178.44 179.35 2gt3 n GLN 61 N -5.22 0.36 -2.91 2.65 6.02 -0.58 -4.72 117.38 112.98 2gt3 n GLN 61 Ca -0.07 0.08 -0.40 0.00 -0.01 0.00 0.00 57.00 56.60 2gt3 n GLN 61 Cb 0.15 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 29.85 2gt3 n GLN 61 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 2gt3 s LEU 62 N -2.40 4.54 -0.24 1.08 0.20 0.42 -5.00 118.68 117.27 2gt3 s LEU 62 Ca 0.21 1.65 -0.29 0.00 0.69 0.00 0.00 54.13 56.39 2gt3 s LEU 62 Cb 0.13 -3.37 -0.01 0.00 -0.43 0.00 0.00 46.19 42.51 2gt3 s LEU 62 CO 0.27 0.09 1.32 -2.16 -0.29 0.00 0.00 176.35 175.58 2gt3 s PRO 63 N -0.61 4.03 0.00 0.98 0.04 -1.26 -2.80 135.00 135.38 2gt3 s PRO 63 Ca 0.39 1.45 0.00 0.00 0.04 0.00 0.00 61.00 62.88 2gt3 s PRO 63 Cb -0.23 -3.85 0.00 0.00 0.04 0.00 0.00 34.50 30.46 2gt3 s PRO 63 CO 0.27 -0.97 0.00 0.41 0.04 0.00 0.00 177.00 176.74 2gt3 n GLY 64 N 4.07 1.71 3.65 0.56 0.00 -1.26 -4.75 105.19 109.17 2gt3 n GLY 64 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.63 5.16 -0.09 1.61 1.01 -1.12 -2.61 120.40 122.73 2gt3 s VAL 65 Ca 0.00 0.76 -0.23 0.00 0.00 0.00 0.00 61.98 62.51 2gt3 s VAL 65 Cb 0.00 -3.76 -0.28 0.00 0.00 0.00 0.00 36.38 32.34 2gt3 s VAL 65 CO 0.00 0.21 0.76 0.22 0.00 0.00 0.00 175.10 176.28 2gt3 h TYR 66 N 7.56 0.34 -3.25 5.22 3.20 0.20 -3.47 116.97 126.76 2gt3 h TYR 66 Ca -0.34 -0.24 0.00 0.00 3.14 0.00 0.00 58.73 61.29 2gt3 h TYR 66 Cb 1.16 -0.01 -0.08 0.00 1.54 0.00 0.00 36.73 39.33 2gt3 h TYR 66 CO 0.70 1.28 0.08 -1.54 -1.64 0.00 0.00 178.16 177.04 2gt3 s SER 67 N -6.76 -0.25 0.25 -2.11 1.04 -1.05 -4.87 113.70 99.95 2gt3 s SER 67 Ca -0.17 -0.58 0.01 0.00 0.48 0.00 0.00 55.95 55.69 2gt3 s SER 67 Cb 0.01 0.63 -0.05 0.00 0.10 0.00 0.00 66.02 66.71 2gt3 s SER 67 CO 0.76 -1.16 0.09 0.42 0.98 0.00 0.00 173.24 174.34 2gt3 s THR 68 N -3.91 0.54 -0.14 2.02 -4.23 -1.26 -0.25 115.64 108.41 2gt3 s THR 68 Ca 0.12 -2.00 -0.28 0.00 -1.18 0.00 0.00 61.69 58.34 2gt3 s THR 68 Cb -0.03 -2.62 0.07 0.00 1.34 0.00 0.00 72.50 71.27 2gt3 s THR 68 CO 0.02 -0.01 0.70 0.00 -0.54 0.00 0.00 174.62 174.78 2gt3 s ALA 69 N -3.77 -1.77 0.09 3.99 0.00 0.08 -4.94 121.76 115.44 2gt3 s ALA 69 Ca 0.37 1.62 0.05 0.00 0.00 0.00 0.00 51.96 54.00 2gt3 s ALA 69 Cb 0.08 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 2gt3 s ALA 69 CO 0.13 -0.36 0.01 0.00 0.00 0.00 0.00 175.76 175.54 2gt3 s ALA 70 N -0.52 3.32 0.00 0.00 0.00 -1.26 0.54 121.76 123.84 2gt3 s ALA 70 Ca -0.06 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 50.79 2gt3 s ALA 70 Cb -0.02 -1.22 0.00 0.00 0.00 0.00 0.00 23.12 21.88 2gt3 s ALA 70 CO 0.06 0.71 0.00 0.41 0.00 0.00 0.00 175.76 176.94 2gt3 n GLY 71 N 0.57 1.63 3.20 0.00 0.00 0.19 0.92 105.19 111.70 2gt3 n GLY 71 Ca -0.11 -0.61 -0.13 0.00 0.00 0.00 0.00 46.02 45.18 2gt3 n GLY 71 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gt3 s TYR 72 N -2.19 -0.17 -0.01 1.61 2.02 -0.96 -2.06 117.35 115.58 2gt3 s TYR 72 Ca 0.00 0.30 -0.30 0.00 -0.37 0.00 0.00 57.07 56.70 2gt3 s TYR 72 Cb 0.00 0.07 0.11 0.00 -0.40 0.00 0.00 41.96 41.73 2gt3 s TYR 72 CO 0.00 -0.32 1.05 -0.08 -1.57 0.00 0.00 175.55 174.63 2gt3 s THR 73 N -1.02 0.00 0.00 -0.71 -1.32 -0.85 -2.75 115.64 108.98 2gt3 s THR 73 Ca -0.11 -0.19 0.00 0.00 -1.21 0.00 0.00 61.69 60.18 2gt3 s THR 73 Cb -0.05 -1.41 0.00 0.00 -1.51 0.00 0.00 72.50 69.53 2gt3 s THR 73 CO 0.03 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.05 2gt3 n GLY 74 N -0.30 1.74 0.00 6.08 0.00 -1.26 -0.71 105.19 110.73 2gt3 n GLY 74 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.66 -0.09 0.51 -0.02 0.00 -1.03 -4.62 105.19 98.28 2gt3 n GLY 75 Ca 0.00 -1.64 -0.04 0.00 0.00 0.00 0.00 46.02 44.34 2gt3 n GLY 75 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2gt3 n TYR 76 N 0.00 0.00 -1.65 1.61 4.02 -0.33 -4.78 117.16 116.03 2gt3 n TYR 76 Ca 0.00 0.00 -0.48 0.00 -0.01 0.00 0.00 57.90 57.41 2gt3 n TYR 76 Cb 0.00 -0.15 -0.05 0.00 -0.02 0.00 0.00 39.34 39.12 2gt3 n TYR 76 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 2gt3 n THR 77 N -2.95 0.54 -2.48 -0.72 -1.04 -1.23 -4.91 114.28 101.50 2gt3 n THR 77 Ca -0.08 -0.15 -0.41 0.00 -2.04 0.00 0.00 64.05 61.36 2gt3 n THR 77 Cb 0.57 -1.94 -0.03 0.00 -1.82 0.00 0.00 70.33 67.10 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 4.53 4.52 -1.08 -2.82 0.04 -1.25 -3.63 135.00 135.31 2gt3 s PRO 78 Ca 0.95 1.74 -0.07 0.00 0.04 0.00 0.00 61.00 63.65 2gt3 s PRO 78 Cb -0.66 -3.31 -0.06 0.00 0.04 0.00 0.00 34.50 30.51 2gt3 s PRO 78 CO 0.50 -0.07 0.90 0.09 0.04 0.00 0.00 177.00 178.46 2gt3 n ASN 79 N 3.03 -6.01 -4.80 6.66 3.02 -1.26 -4.03 115.26 111.88 2gt3 n ASN 79 Ca 0.05 -0.75 -0.29 0.00 -0.03 0.00 0.00 54.58 53.56 2gt3 n ASN 79 Cb 0.46 -4.95 0.11 0.00 -0.61 0.00 0.00 39.78 34.80 2gt3 n ASN 79 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2gt3 s PRO 80 N -4.71 1.62 0.09 3.52 0.04 -1.24 -1.96 135.00 132.36 2gt3 s PRO 80 Ca 0.42 0.46 0.08 0.00 0.04 0.00 0.00 61.00 61.99 2gt3 s PRO 80 Cb -0.07 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.56 2gt3 s PRO 80 CO 0.76 -1.90 -0.20 0.95 0.04 0.00 0.00 177.00 176.64 2gt3 s THR 81 N -3.22 1.66 0.54 1.26 -4.23 -1.26 -4.90 115.64 105.48 2gt3 s THR 81 Ca 0.62 -1.47 0.31 0.00 -1.18 0.00 0.00 61.69 59.97 2gt3 s THR 81 Cb -0.14 -1.50 0.47 0.00 1.34 0.00 0.00 72.50 72.67 2gt3 s THR 81 CO 0.54 -0.03 1.89 0.22 -0.54 0.00 0.00 174.62 176.69 2gt3 h TYR 82 N 4.22 0.00 0.91 3.99 3.20 -1.97 0.35 116.97 127.67 2gt3 h TYR 82 Ca -0.45 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.37 2gt3 h TYR 82 Cb 1.18 0.00 0.01 0.00 1.54 0.00 0.00 36.73 39.46 2gt3 h TYR 82 CO 0.60 0.00 -0.44 -0.09 -1.64 0.00 0.00 178.16 176.59 2gt3 h ARG 83 N 0.00 -1.17 -0.32 1.82 2.43 -1.99 0.24 114.38 115.39 2gt3 h ARG 83 Ca 0.41 0.08 -0.05 0.00 -0.81 0.00 0.00 59.98 59.61 2gt3 h ARG 83 Cb 1.66 0.27 -0.01 0.00 -0.42 0.00 0.00 29.97 31.46 2gt3 h ARG 83 CO -0.00 -0.78 0.00 1.05 -1.51 0.00 0.00 179.97 178.73 2gt3 h GLU 84 N -1.25 0.56 -1.00 0.20 4.11 -1.69 -2.72 114.58 112.78 2gt3 h GLU 84 Ca -0.12 -0.18 0.15 0.00 0.07 0.00 0.00 59.36 59.28 2gt3 h GLU 84 Cb 0.93 -0.05 -0.09 0.00 0.50 0.00 0.00 28.75 30.04 2gt3 h GLU 84 CO 0.20 0.69 0.62 0.28 0.07 0.00 0.00 179.01 180.88 2gt3 h VAL 85 N 0.36 0.83 -0.88 -1.06 2.07 -0.34 0.40 116.25 117.62 2gt3 h VAL 85 Ca 0.09 -0.30 0.11 0.00 0.82 0.00 0.00 66.70 67.41 2gt3 h VAL 85 Cb 0.44 -0.14 -0.08 0.00 -1.52 0.00 0.00 31.29 29.99 2gt3 h VAL 85 CO 0.02 0.16 0.52 0.00 0.02 0.00 0.00 177.57 178.29 2gt3 h SER 87 N 0.84 0.60 0.00 0.00 0.02 -0.19 -3.48 113.55 111.35 2gt3 h SER 87 Ca 0.43 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2gt3 h SER 87 Cb 0.42 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.80 2gt3 h SER 87 CO -0.26 0.78 0.00 0.61 -1.14 0.00 0.00 176.83 176.81 2gt3 n GLY 88 N -0.31 0.98 1.99 -3.77 0.00 -0.23 -4.93 105.19 98.91 2gt3 n GLY 88 Ca -0.02 -0.22 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 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 0.41 4.25 0.00 1.61 8.00 -1.24 -4.03 116.55 125.55 2gt3 n ASP 89 Ca 0.00 -3.24 0.00 0.00 0.71 0.00 0.00 54.79 52.26 2gt3 n ASP 89 Cb 0.01 -0.76 0.00 0.00 -0.02 0.00 0.00 41.12 40.36 2gt3 n ASP 89 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2gt3 n THR 90 N -0.44 0.00 -0.21 -3.53 -2.24 -1.26 -0.79 114.28 105.82 2gt3 n THR 90 Ca 0.44 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.22 2gt3 n THR 90 Cb 1.41 -0.69 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 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 3.16 0.70 3.77 3.38 0.00 -1.26 -1.19 105.19 113.77 2gt3 n GLY 91 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.49 3.79 0.26 1.61 3.76 -1.26 -2.46 115.29 118.50 2gt3 s HIS 92 Ca 0.00 1.77 0.08 0.00 -0.15 0.00 0.00 55.06 56.76 2gt3 s HIS 92 Cb 0.00 -2.89 -0.04 0.00 1.11 0.00 0.00 32.58 30.76 2gt3 s HIS 92 CO 0.00 0.32 0.13 0.00 -0.85 0.00 0.00 174.74 174.35 2gt3 s ALA 93 N -1.44 3.45 -0.19 -1.40 0.00 0.11 -4.33 121.76 117.96 2gt3 s ALA 93 Ca 0.45 -1.50 -0.29 0.00 0.00 0.00 0.00 51.96 50.62 2gt3 s ALA 93 Cb -0.21 -1.13 -0.03 0.00 0.00 0.00 0.00 23.12 21.76 2gt3 s ALA 93 CO 0.26 0.25 1.58 -2.00 0.00 0.00 0.00 175.76 175.85 2gt3 s GLU 94 N -3.79 3.90 0.18 0.00 2.56 -0.86 -2.02 118.70 118.67 2gt3 s GLU 94 Ca 0.32 1.72 0.09 0.00 0.00 0.00 0.00 54.97 57.10 2gt3 s GLU 94 Cb -0.07 -4.00 -0.04 0.00 2.00 0.00 0.00 34.13 32.02 2gt3 s GLU 94 CO 0.23 -1.16 -0.18 0.00 -0.56 0.00 0.00 175.26 173.59 2gt3 s ALA 95 N 4.83 2.05 -0.01 6.30 0.00 -0.88 -3.61 121.76 130.44 2gt3 s ALA 95 Ca 0.69 -1.54 0.00 0.00 0.00 0.00 0.00 51.96 51.11 2gt3 s ALA 95 Cb -0.26 -0.17 0.01 0.00 0.00 0.00 0.00 23.12 22.71 2gt3 s ALA 95 CO 0.28 0.21 0.01 0.08 0.00 0.00 0.00 175.76 176.33 2gt3 s VAL 96 N -2.25 -0.02 -0.36 0.00 1.01 0.20 -0.64 120.40 118.34 2gt3 s VAL 96 Ca 0.18 0.10 -0.18 0.00 0.00 0.00 0.00 61.98 62.08 2gt3 s VAL 96 Cb -0.05 -0.05 -0.00 0.00 0.00 0.00 0.00 36.38 36.29 2gt3 s VAL 96 CO 0.07 0.04 0.48 -0.13 0.00 0.00 0.00 175.10 175.56 2gt3 s ARG 97 N 0.49 3.53 -0.23 2.72 0.52 0.19 -1.88 118.95 124.29 2gt3 s ARG 97 Ca -0.04 -0.30 -0.08 0.00 -0.52 0.00 0.00 55.73 54.80 2gt3 s ARG 97 Cb -0.06 -3.83 -0.04 0.00 0.52 0.00 0.00 34.95 31.54 2gt3 s ARG 97 CO -0.01 -0.67 0.08 0.42 0.02 0.00 0.00 175.30 175.14 2gt3 s ILE 98 N 2.31 4.59 -0.34 1.52 1.01 0.25 -0.74 121.20 129.81 2gt3 s ILE 98 Ca 0.17 -0.08 -0.12 0.00 0.00 0.00 0.00 60.65 60.61 2gt3 s ILE 98 Cb -0.16 -3.13 -0.01 0.00 0.01 0.00 0.00 42.46 39.18 2gt3 s ILE 98 CO 0.13 0.37 0.22 -0.69 0.00 0.00 0.00 174.94 174.97 2gt3 s VAL 99 N 1.19 5.01 0.18 2.92 1.01 0.65 0.18 120.40 131.54 2gt3 s VAL 99 Ca 0.05 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 61.65 2gt3 s VAL 99 Cb -0.14 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 2gt3 s VAL 99 CO 0.04 -0.04 0.02 -0.72 0.00 0.00 0.00 175.10 174.39 2gt3 s TYR 100 N 1.67 1.23 -0.14 5.22 -0.85 0.26 0.20 117.35 124.94 2gt3 s TYR 100 Ca 0.05 -1.05 -0.07 0.00 -0.52 0.00 0.00 57.07 55.48 2gt3 s TYR 100 Cb -0.18 -0.70 -0.04 0.00 0.38 0.00 0.00 41.96 41.42 2gt3 s TYR 100 CO 0.09 -0.25 0.10 -0.51 -1.52 0.00 0.00 175.55 173.46 2gt3 s ASP 101 N -3.18 6.00 0.00 -0.18 -0.00 -1.07 -1.13 116.67 117.11 2gt3 s ASP 101 Ca 0.26 0.28 0.23 0.00 -0.00 0.00 0.00 52.55 53.32 2gt3 s ASP 101 Cb 0.06 -1.95 1.12 0.00 -0.00 0.00 0.00 42.92 42.15 2gt3 s ASP 101 CO 0.05 0.31 1.73 -0.81 -0.00 0.00 0.00 175.17 176.45 2gt3 n PRO 102 N 2.66 0.29 0.10 8.23 -0.04 -1.25 -1.33 135.00 143.66 2gt3 n PRO 102 Ca -0.18 0.08 0.10 0.00 -0.04 0.00 0.00 63.50 63.46 2gt3 n PRO 102 Cb 0.54 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.48 2gt3 n PRO 102 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2gt3 n SER 103 N -1.31 0.85 -0.03 3.54 7.64 -1.26 -4.54 113.62 118.51 2gt3 n SER 103 Ca 0.10 0.33 -0.04 0.00 1.01 0.00 0.00 58.87 60.28 2gt3 n SER 103 Cb 0.19 0.42 -0.01 0.00 -1.01 0.00 0.00 64.21 63.79 2gt3 n SER 103 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2gt3 n VAL 104 N -2.70 0.65 -4.04 0.44 0.31 -0.96 -5.05 118.33 106.98 2gt3 n VAL 104 Ca -0.01 0.33 -0.22 0.00 -0.01 0.00 0.00 64.34 64.42 2gt3 n VAL 104 Cb 0.58 -1.82 -0.06 0.00 -0.91 0.00 0.00 33.84 31.64 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 -1.81 3.27 0.14 2.52 2.07 -0.44 -5.00 121.20 121.96 2gt3 s ILE 105 Ca -0.12 -1.61 0.09 0.00 -1.41 0.00 0.00 60.65 57.61 2gt3 s ILE 105 Cb 0.02 -3.04 -0.04 0.00 0.13 0.00 0.00 42.46 39.52 2gt3 s ILE 105 CO 0.17 -0.20 -0.22 -0.94 -1.91 0.00 0.00 174.94 171.84 2gt3 s SER 106 N -3.87 2.91 0.27 4.50 1.04 -1.26 -3.85 113.70 113.44 2gt3 s SER 106 Ca 0.38 -0.79 -0.01 0.00 0.48 0.00 0.00 55.95 56.01 2gt3 s SER 106 Cb -0.04 -0.18 0.49 0.00 0.10 0.00 0.00 66.02 66.38 2gt3 s SER 106 CO 0.24 0.07 1.82 0.10 0.98 0.00 0.00 173.24 176.45 2gt3 h TYR 107 N 3.62 1.02 -0.89 5.02 -0.00 -1.95 -0.27 116.97 123.51 2gt3 h TYR 107 Ca -0.46 0.03 0.09 0.00 0.00 0.00 0.00 58.73 58.39 2gt3 h TYR 107 Cb 1.19 -0.32 -0.07 0.00 0.00 0.00 0.00 36.73 37.53 2gt3 h TYR 107 CO 0.65 0.41 0.54 1.49 -0.00 0.00 0.00 178.16 181.25 2gt3 h GLU 108 N 0.91 0.90 -0.49 0.10 4.81 -1.96 0.32 114.58 119.17 2gt3 h GLU 108 Ca 0.46 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.53 2gt3 h GLU 108 Cb 0.44 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 2gt3 h GLU 108 CO -0.26 0.60 -0.10 1.96 -0.73 0.00 0.00 179.01 180.48 2gt3 h GLN 109 N 0.93 0.90 0.05 1.92 4.20 -1.49 -1.56 115.11 120.05 2gt3 h GLN 109 Ca 0.42 -0.31 -0.00 0.00 0.06 0.00 0.00 58.65 58.81 2gt3 h GLN 109 Cb 0.31 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.03 2gt3 h GLN 109 CO -0.22 0.96 -0.02 -0.07 -0.67 0.00 0.00 178.83 178.80 2gt3 h LEU 110 N 0.81 -0.05 -1.17 1.46 3.38 -0.24 -0.48 115.31 119.03 2gt3 h LEU 110 Ca 0.13 -0.25 0.14 0.00 0.09 0.00 0.00 57.88 57.99 2gt3 h LEU 110 Cb 0.62 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.31 2gt3 h LEU 110 CO 0.04 0.23 0.60 -0.07 0.09 0.00 0.00 178.44 179.33 2gt3 h LEU 111 N -0.34 0.76 -0.29 1.67 3.38 -0.33 0.08 115.31 120.24 2gt3 h LEU 111 Ca -0.01 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 2gt3 h LEU 111 Cb 0.30 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2gt3 h LEU 111 CO 0.01 0.38 0.01 1.56 0.09 0.00 0.00 178.44 180.49 2gt3 h GLN 112 N 0.80 0.51 -0.44 1.13 4.20 -0.95 -2.83 115.11 117.53 2gt3 h GLN 112 Ca 0.48 -0.16 0.08 0.00 0.06 0.00 0.00 58.65 59.11 2gt3 h GLN 112 Cb 0.67 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.34 2gt3 h GLN 112 CO -0.24 0.65 0.05 0.28 -0.67 0.00 0.00 178.83 178.90 2gt3 h VAL 113 N 0.31 0.72 -0.24 -0.54 2.07 0.66 0.39 116.25 119.62 2gt3 h VAL 113 Ca 0.08 -0.06 0.06 0.00 0.82 0.00 0.00 66.70 67.61 2gt3 h VAL 113 Cb 0.41 0.54 -0.08 0.00 -1.52 0.00 0.00 31.29 30.64 2gt3 h VAL 113 CO 0.01 0.03 -0.35 -0.26 0.02 0.00 0.00 177.57 177.02 2gt3 h PHE 114 N 0.17 -0.99 0.00 1.57 0.04 -1.06 1.50 116.94 118.18 2gt3 h PHE 114 Ca 0.22 0.05 0.00 0.00 2.80 0.00 0.00 57.97 61.04 2gt3 h PHE 114 Cb 0.29 0.47 0.00 0.00 2.20 0.00 0.00 35.95 38.91 2gt3 h PHE 114 CO -0.24 -0.41 0.00 -1.49 -0.60 0.00 0.00 178.31 175.57 2gt3 h TRP 115 N -0.36 0.00 -0.00 -0.55 -0.00 -1.15 1.58 115.95 115.46 2gt3 h TRP 115 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.01 2gt3 h TRP 115 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.72 2gt3 h TRP 115 CO -0.48 0.00 -0.41 -1.91 -0.00 0.00 0.00 178.44 175.63 2gt3 n GLU 116 N -3.07 0.15 -0.04 0.49 4.07 0.24 -3.95 120.64 118.53 2gt3 n GLU 116 Ca -0.01 -0.08 -0.04 0.00 -0.06 0.00 0.00 57.16 56.97 2gt3 n GLU 116 Cb 0.21 -1.50 -0.06 0.00 -0.06 0.00 0.00 31.44 30.03 2gt3 n GLU 116 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2gt3 n ASN 117 N -1.35 3.06 -3.59 4.31 3.02 0.45 -4.85 115.26 116.30 2gt3 n ASN 117 Ca 0.07 -0.01 -0.14 0.00 -0.03 0.00 0.00 54.58 54.48 2gt3 n ASN 117 Cb 0.34 0.58 -0.06 0.00 -0.61 0.00 0.00 39.78 40.02 2gt3 n ASN 117 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 2gt3 s HIS 118 N -2.19 -0.60 0.59 3.10 2.46 0.51 -4.02 115.29 115.14 2gt3 s HIS 118 Ca -0.05 1.27 -0.15 0.00 0.47 0.00 0.00 55.06 56.59 2gt3 s HIS 118 Cb 0.03 0.37 -0.04 0.00 -0.13 0.00 0.00 32.58 32.80 2gt3 s HIS 118 CO 0.31 -0.41 1.04 -0.51 -2.47 0.00 0.00 174.74 172.70 2gt3 s ASP 119 N -0.43 5.96 0.00 9.88 1.11 -1.25 -3.30 116.67 128.64 2gt3 s ASP 119 Ca -0.03 1.73 0.23 0.00 0.18 0.00 0.00 52.55 54.66 2gt3 s ASP 119 Cb -0.03 -2.52 1.37 0.00 1.07 0.00 0.00 42.92 42.81 2gt3 s ASP 119 CO 0.02 -1.05 1.75 -0.81 1.18 0.00 0.00 175.17 176.26 2gt3 n PRO 120 N -2.05 0.75 -2.39 8.23 -0.04 -1.26 -3.19 135.00 135.06 2gt3 n PRO 120 Ca 0.08 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.25 2gt3 n PRO 120 Cb 0.53 -1.48 0.01 0.00 -0.04 0.00 0.00 33.50 32.52 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 -0.98 5.33 0.72 0.55 0.00 -1.26 -1.52 120.51 123.35 2gt3 n ALA 121 Ca 0.17 -4.30 0.13 0.00 0.00 0.00 0.00 53.44 49.44 2gt3 n ALA 121 Cb 0.08 -0.80 0.48 0.00 0.00 0.00 0.00 19.45 19.20 2gt3 n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gt3 n GLN 122 N -0.49 0.15 -0.70 0.00 10.64 -1.19 -4.88 117.38 120.91 2gt3 n GLN 122 Ca 0.42 0.16 0.10 0.00 -1.83 0.00 0.00 57.00 55.85 2gt3 n GLN 122 Cb 0.58 -1.69 -0.02 0.00 -0.86 0.00 0.00 30.24 28.25 2gt3 n GLN 122 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2gt3 n GLY 123 N 1.16 -2.06 2.73 2.61 0.00 -1.26 -4.07 105.19 104.31 2gt3 n GLY 123 Ca 0.06 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.44 2gt3 n GLY 123 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2gt3 n MET 124 N -2.57 2.05 0.00 1.61 1.56 -1.26 -4.50 117.12 114.01 2gt3 n MET 124 Ca 0.00 -1.66 0.00 0.00 -0.27 0.00 0.00 57.70 55.78 2gt3 n MET 124 Cb 0.32 -2.64 0.00 0.00 2.15 0.00 0.00 33.22 33.05 2gt3 n MET 124 CO 0.00 0.00 0.00 2.89 -0.73 0.00 0.00 175.97 178.13 2gt3 n ARG 125 N 5.03 -0.11 -3.52 2.12 0.00 -0.73 -2.60 116.66 116.85 2gt3 n ARG 125 Ca 0.48 0.00 -0.13 0.00 -0.00 0.00 0.00 57.85 58.21 2gt3 n ARG 125 Cb 0.22 0.00 -0.11 0.00 -0.00 0.00 0.00 32.46 32.57 2gt3 n ARG 125 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 2gt3 s GLN 126 N -2.00 0.25 7.86 2.89 2.00 0.30 -4.50 119.66 126.45 2gt3 s GLN 126 Ca 0.00 0.58 0.00 0.00 -2.00 0.00 0.00 55.36 53.94 2gt3 s GLN 126 Cb 0.00 -0.42 0.00 0.00 0.80 0.00 0.00 33.01 33.39 2gt3 s GLN 126 CO 0.00 -0.49 0.00 0.41 -0.50 0.00 0.00 175.29 174.71 2gt3 n GLY 127 N 5.35 4.03 1.34 2.59 0.00 -1.26 -0.25 105.19 116.99 2gt3 n GLY 127 Ca -0.05 0.12 0.10 0.00 0.00 0.00 0.00 46.02 46.19 2gt3 n GLY 127 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2gt3 n ASN 128 N 9.20 3.91 -4.45 1.61 2.85 -1.26 -4.87 115.26 122.25 2gt3 n ASN 128 Ca 0.00 -2.16 -0.33 0.00 -0.11 0.00 0.00 54.58 51.98 2gt3 n ASN 128 Cb 0.00 -0.49 -0.13 0.00 1.24 0.00 0.00 39.78 40.40 2gt3 n ASN 128 CO 0.00 0.00 0.00 -1.81 -2.11 0.00 0.00 177.26 173.34 2gt3 s ASP 129 N -0.94 4.45 0.05 1.20 1.11 0.66 -5.11 116.67 118.09 2gt3 s ASP 129 Ca 0.46 -0.20 0.08 0.00 0.18 0.00 0.00 52.55 53.07 2gt3 s ASP 129 Cb 0.26 -1.64 -0.03 0.00 1.07 0.00 0.00 42.92 42.57 2gt3 s ASP 129 CO 0.28 0.19 -0.22 -1.38 1.18 0.00 0.00 175.17 175.21 2gt3 s HIS 130 N 0.23 2.44 -5.00 4.23 -3.43 -1.26 0.11 115.29 112.61 2gt3 s HIS 130 Ca -0.05 -0.33 0.00 0.00 -0.80 0.00 0.00 55.06 53.88 2gt3 s HIS 130 Cb -0.15 -1.41 0.00 0.00 -1.43 0.00 0.00 32.58 29.59 2gt3 s HIS 130 CO 0.04 0.22 0.00 0.41 -2.00 0.00 0.00 174.74 173.40 2gt3 n GLY 131 N 1.55 -0.82 0.33 -1.38 0.00 -1.07 -4.91 105.19 98.90 2gt3 n GLY 131 Ca -0.17 -1.63 0.13 0.00 0.00 0.00 0.00 46.02 44.36 2gt3 n GLY 131 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gt3 n THR 132 N 0.43 0.00 1.32 2.61 -2.24 -1.26 -3.33 114.28 111.81 2gt3 n THR 132 Ca 0.00 -0.17 0.13 0.00 -2.27 0.00 0.00 64.05 61.74 2gt3 n THR 132 Cb 0.00 0.44 0.38 0.00 -2.10 0.00 0.00 70.33 69.05 2gt3 n THR 132 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2gt3 n GLN 133 N -0.35 1.58 -2.40 -0.78 0.00 -1.26 -4.10 117.38 110.06 2gt3 n GLN 133 Ca 0.15 -1.04 -0.24 0.00 0.00 0.00 0.00 57.00 55.86 2gt3 n GLN 133 Cb 0.35 -1.48 0.01 0.00 0.00 0.00 0.00 30.24 29.12 2gt3 n GLN 133 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2gt3 n TYR 134 N 0.20 3.06 -3.37 2.61 4.01 -1.23 -2.03 117.16 120.40 2gt3 n TYR 134 Ca 0.16 -2.87 -0.22 0.00 -0.16 0.00 0.00 57.90 54.80 2gt3 n TYR 134 Cb 0.41 -0.16 0.03 0.00 -0.31 0.00 0.00 39.34 39.30 2gt3 n TYR 134 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2gt3 s ARG 135 N -3.53 2.32 -0.17 -0.72 3.00 -1.26 -1.78 118.95 116.82 2gt3 s ARG 135 Ca 0.47 -1.76 -0.02 0.00 -1.00 0.00 0.00 55.73 53.41 2gt3 s ARG 135 Cb 0.40 -2.44 -0.02 0.00 0.00 0.00 0.00 34.95 32.90 2gt3 s ARG 135 CO -0.12 -0.71 -0.08 -1.12 0.00 0.00 0.00 175.30 173.27 2gt3 s SER 136 N -4.48 4.31 -0.03 -2.12 0.01 -1.26 -3.86 113.70 106.26 2gt3 s SER 136 Ca 0.51 -0.30 -0.15 0.00 1.31 0.00 0.00 55.95 57.32 2gt3 s SER 136 Cb -0.04 -1.70 0.02 0.00 0.21 0.00 0.00 66.02 64.51 2gt3 s SER 136 CO 0.32 0.10 0.32 0.00 0.41 0.00 0.00 173.24 174.39 2gt3 s ALA 137 N 0.74 -0.80 -0.09 1.44 0.00 -1.08 -2.43 121.76 119.53 2gt3 s ALA 137 Ca -0.03 0.43 0.04 0.00 0.00 0.00 0.00 51.96 52.39 2gt3 s ALA 137 Cb -0.15 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.96 2gt3 s ALA 137 CO 0.02 -0.25 -0.21 0.42 0.00 0.00 0.00 175.76 175.74 2gt3 s ILE 138 N -1.11 1.85 -0.49 0.00 1.01 0.37 -0.62 121.20 122.22 2gt3 s ILE 138 Ca -0.12 -0.89 0.03 0.00 0.00 0.00 0.00 60.65 59.67 2gt3 s ILE 138 Cb -0.05 -1.61 0.14 0.00 0.01 0.00 0.00 42.46 40.95 2gt3 s ILE 138 CO 0.04 0.51 0.29 -0.31 0.00 0.00 0.00 174.94 175.48 2gt3 s TYR 139 N 0.45 2.25 0.95 3.97 2.02 0.59 -2.66 117.35 124.91 2gt3 s TYR 139 Ca -0.17 -2.64 -0.13 0.00 -0.37 0.00 0.00 57.07 53.76 2gt3 s TYR 139 Cb -0.17 -2.00 0.16 0.00 -0.40 0.00 0.00 41.96 39.55 2gt3 s TYR 139 CO 0.07 -0.74 1.15 -1.25 -1.57 0.00 0.00 175.55 173.21 2gt3 s PRO 140 N -0.04 0.85 -0.07 -1.71 0.04 -1.26 -2.56 135.00 130.25 2gt3 s PRO 140 Ca 0.21 0.18 0.05 0.00 0.04 0.00 0.00 61.00 61.47 2gt3 s PRO 140 Cb -0.18 -1.82 -0.08 0.00 0.04 0.00 0.00 34.50 32.47 2gt3 s PRO 140 CO -0.05 -2.37 -0.00 1.28 0.04 0.00 0.00 177.00 175.90 2gt3 n LEU 141 N -3.86 0.77 -4.88 -3.56 7.99 -1.26 -2.72 117.00 109.48 2gt3 n LEU 141 Ca 0.08 -0.01 -0.21 0.00 -0.01 0.00 0.00 56.01 55.86 2gt3 n LEU 141 Cb 0.59 0.05 -0.03 0.00 -0.11 0.00 0.00 43.42 43.92 2gt3 n LEU 141 CO 0.55 0.29 -0.09 0.42 -1.51 0.00 0.00 177.39 177.05 2gt3 s THR 142 N -2.17 4.17 0.16 -5.08 -4.23 -1.26 -4.98 115.64 102.26 2gt3 s THR 142 Ca -0.05 -1.28 0.12 0.00 -1.18 0.00 0.00 61.69 59.30 2gt3 s THR 142 Cb 0.02 -3.39 -0.01 0.00 1.34 0.00 0.00 72.50 70.46 2gt3 s THR 142 CO 0.26 -0.26 1.55 1.55 -0.54 0.00 0.00 174.62 177.18 2gt3 h PRO 143 N 1.27 0.00 -0.02 3.99 0.13 -2.00 -2.84 132.00 132.53 2gt3 h PRO 143 Ca -0.47 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.53 2gt3 h PRO 143 Cb 1.25 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 2gt3 h PRO 143 CO 0.59 0.62 -0.60 1.49 -0.23 0.00 0.00 178.00 179.87 2gt3 h GLU 144 N 0.00 0.07 -0.20 0.86 4.81 -1.99 -2.52 114.58 115.62 2gt3 h GLU 144 Ca -0.01 -0.05 -0.18 0.00 -0.13 0.00 0.00 59.36 58.99 2gt3 h GLU 144 Cb 1.22 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.62 2gt3 h GLU 144 CO 0.08 0.65 -0.58 1.96 -0.73 0.00 0.00 179.01 180.40 2gt3 h GLN 145 N 0.06 0.74 -0.32 1.92 4.20 -1.95 -1.04 115.11 118.72 2gt3 h GLN 145 Ca -0.01 -0.53 0.00 0.00 0.06 0.00 0.00 58.65 58.17 2gt3 h GLN 145 Cb 1.08 0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.93 2gt3 h GLN 145 CO 0.08 1.15 0.20 0.22 -0.67 0.00 0.00 178.83 179.82 2gt3 h ASP 146 N 0.46 0.37 -0.46 1.46 1.82 -1.43 1.28 116.42 119.92 2gt3 h ASP 146 Ca -0.02 -0.02 -0.06 0.00 -0.39 0.00 0.00 57.03 56.54 2gt3 h ASP 146 Cb 1.20 -0.09 -0.02 0.00 0.68 0.00 0.00 39.33 41.09 2gt3 h ASP 146 CO 0.12 0.28 0.08 0.00 -1.61 0.00 0.00 179.24 178.12 2gt3 h ALA 147 N 1.10 1.17 -0.33 -0.78 0.00 -1.45 -0.96 119.26 118.01 2gt3 h ALA 147 Ca 0.11 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 2gt3 h ALA 147 Cb -0.03 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 2gt3 h ALA 147 CO -0.02 0.56 -0.48 0.00 0.00 0.00 0.00 179.25 179.30 2gt3 h ALA 148 N 1.31 0.51 -0.01 0.00 0.00 -0.37 0.39 119.26 121.07 2gt3 h ALA 148 Ca 0.17 -0.49 0.02 0.00 0.00 0.00 0.00 54.91 54.60 2gt3 h ALA 148 Cb 0.35 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2gt3 h ALA 148 CO 0.01 0.68 -0.08 0.00 0.00 0.00 0.00 179.25 179.85 2gt3 h ALA 149 N 0.72 -0.07 -0.35 0.00 0.00 0.21 -0.15 119.26 119.62 2gt3 h ALA 149 Ca 0.03 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 2gt3 h ALA 149 Cb 1.08 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2gt3 h ALA 149 CO 0.11 -0.57 -0.37 -0.09 0.00 0.00 0.00 179.25 178.33 2gt3 h ARG 150 N -0.13 0.82 -0.95 0.00 2.43 -1.15 -0.56 114.38 114.84 2gt3 h ARG 150 Ca 0.04 -0.42 0.14 0.00 -0.81 0.00 0.00 59.98 58.93 2gt3 h ARG 150 Cb 0.18 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.65 2gt3 h ARG 150 CO -0.09 1.05 0.60 0.00 -1.51 0.00 0.00 179.97 180.02 2gt3 h ALA 151 N 0.90 1.71 0.13 2.80 0.00 0.24 0.53 119.26 125.56 2gt3 h ALA 151 Ca 0.06 0.03 -0.28 0.00 0.00 0.00 0.00 54.91 54.72 2gt3 h ALA 151 Cb 0.93 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2gt3 h ALA 151 CO 0.09 0.03 -1.27 0.66 0.00 0.00 0.00 179.25 178.76 2gt3 h SER 152 N 0.81 0.42 0.19 0.00 4.64 -0.80 -2.41 113.55 116.39 2gt3 h SER 152 Ca 0.48 -0.45 -0.01 0.00 -0.47 0.00 0.00 61.79 61.34 2gt3 h SER 152 Cb 0.67 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2gt3 h SER 152 CO -0.25 1.36 -0.09 0.25 -0.87 0.00 0.00 176.83 177.23 2gt3 h LEU 153 N 0.07 -0.22 -0.57 5.97 6.46 0.69 0.29 115.31 128.00 2gt3 h LEU 153 Ca -0.14 -0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.56 2gt3 h LEU 153 Cb 1.97 0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 41.93 2gt3 h LEU 153 CO 0.20 -0.11 0.26 1.05 -0.62 0.00 0.00 178.44 179.22 2gt3 h GLU 154 N -0.30 0.83 -0.73 1.25 4.11 -0.15 0.81 114.58 120.39 2gt3 h GLU 154 Ca -0.03 -0.13 0.02 0.00 0.07 0.00 0.00 59.36 59.29 2gt3 h GLU 154 Cb 0.24 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 2gt3 h GLU 154 CO 0.04 0.69 0.47 0.00 0.07 0.00 0.00 179.01 180.28 2gt3 h ARG 155 N 0.77 0.91 0.00 1.06 2.47 -1.19 -1.55 114.38 116.86 2gt3 h ARG 155 Ca 0.19 -0.05 -0.11 0.00 -1.26 0.00 0.00 59.98 58.75 2gt3 h ARG 155 Cb 0.15 -0.20 -0.02 0.00 -1.65 0.00 0.00 29.97 28.25 2gt3 h ARG 155 CO -0.02 0.60 -0.52 0.35 0.56 0.00 0.00 179.97 180.94 2gt3 h PHE 156 N 0.93 0.00 -0.62 3.04 3.57 -0.03 -1.55 116.94 122.29 2gt3 h PHE 156 Ca 0.28 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.87 2gt3 h PHE 156 Cb -0.03 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 38.64 2gt3 h PHE 156 CO -0.03 0.52 0.26 0.37 -2.23 0.00 0.00 178.31 177.19 2gt3 h GLN 157 N 0.00 0.44 0.10 1.11 4.15 0.20 0.74 115.11 121.86 2gt3 h GLN 157 Ca -0.01 -0.03 -0.27 0.00 0.77 0.00 0.00 58.65 59.12 2gt3 h GLN 157 Cb 0.93 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 28.51 2gt3 h GLN 157 CO 0.07 0.29 -1.24 0.00 -1.93 0.00 0.00 178.83 176.02 2gt3 h ALA 158 N 1.40 0.17 0.58 3.38 0.00 -1.41 -2.50 119.26 120.89 2gt3 h ALA 158 Ca 0.31 -0.93 -0.02 0.00 0.00 0.00 0.00 54.91 54.27 2gt3 h ALA 158 Cb 0.35 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2gt3 h ALA 158 CO -0.28 1.06 -0.32 0.00 0.00 0.00 0.00 179.25 179.70 2gt3 h ALA 159 N 0.66 -0.85 -0.47 0.00 0.00 -0.26 0.47 119.26 118.82 2gt3 h ALA 159 Ca -0.13 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 2gt3 h ALA 159 Cb 1.94 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 20.09 2gt3 h ALA 159 CO 0.18 -0.99 0.16 0.00 0.00 0.00 0.00 179.25 178.61 2gt3 h MET 160 N -0.84 0.67 -0.37 0.00 -0.00 0.35 -2.43 114.93 112.30 2gt3 h MET 160 Ca -0.07 -0.10 0.01 0.00 -0.00 0.00 0.00 59.70 59.54 2gt3 h MET 160 Cb 0.67 -0.12 -0.02 0.00 -0.00 0.00 0.00 31.60 32.13 2gt3 h MET 160 CO 0.09 0.58 0.23 -0.07 -0.00 0.00 0.00 176.91 177.74 2gt3 h LEU 161 N 0.67 0.37 -2.26 -0.10 3.38 -1.04 0.12 115.31 116.45 2gt3 h LEU 161 Ca 0.16 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.16 2gt3 h LEU 161 Cb 0.17 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2gt3 h LEU 161 CO -0.01 0.27 0.24 0.00 0.09 0.00 0.00 178.44 179.03 2gt3 h ALA 162 N 1.16 1.54 -0.30 1.53 0.00 -0.41 1.52 119.26 124.30 2gt3 h ALA 162 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2gt3 h ALA 162 Cb -0.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2gt3 h ALA 162 CO -0.06 -0.30 0.00 0.00 0.00 0.00 0.00 179.25 178.89 2gt3 n ALA 163 N -2.14 2.52 -0.84 0.00 0.00 0.25 -4.83 120.51 115.47 2gt3 n ALA 163 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.88 2gt3 n ALA 163 Cb 0.33 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2gt3 n ALA 163 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2gt3 n ASP 164 N 0.37 0.00 -4.56 0.00 5.75 0.52 -4.94 116.55 113.69 2gt3 n ASP 164 Ca 0.10 0.00 -0.32 0.00 -0.01 0.00 0.00 54.79 54.56 2gt3 n ASP 164 Cb 0.30 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.35 2gt3 n ASP 164 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2gt3 s ASP 165 N -3.12 5.61 -0.08 -1.12 -1.08 -0.31 -4.73 116.67 111.84 2gt3 s ASP 165 Ca 0.00 -0.84 0.08 0.00 -0.52 0.00 0.00 52.55 51.28 2gt3 s ASP 165 Cb 0.00 -2.56 0.39 0.00 -1.46 0.00 0.00 42.92 39.29 2gt3 s ASP 165 CO 0.00 -2.30 1.18 -0.90 0.52 0.00 0.00 175.17 173.67 2gt3 n ASP 166 N 12.15 2.97 -4.76 -0.34 5.68 -1.26 -3.19 116.55 127.80 2gt3 n ASP 166 Ca 0.35 -2.32 -0.32 0.00 -0.50 0.00 0.00 54.79 51.99 2gt3 n ASP 166 Cb 0.49 -0.49 0.07 0.00 -1.14 0.00 0.00 41.12 40.05 2gt3 n ASP 166 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 2gt3 s ARG 167 N -1.77 2.46 -0.20 0.11 1.81 -1.26 -5.01 118.95 115.09 2gt3 s ARG 167 Ca 0.27 1.37 -0.13 0.00 -1.72 0.00 0.00 55.73 55.52 2gt3 s ARG 167 Cb 0.19 -1.91 -0.05 0.00 -0.45 0.00 0.00 34.95 32.73 2gt3 s ARG 167 CO 0.11 -1.51 0.26 -1.58 -0.68 0.00 0.00 175.30 171.89 2gt3 s HIS 168 N -2.50 3.39 -0.05 -0.53 5.65 -1.26 -5.01 115.29 114.97 2gt3 s HIS 168 Ca 0.66 0.45 -0.29 0.00 0.25 0.00 0.00 55.06 56.13 2gt3 s HIS 168 Cb -0.20 -2.34 -0.08 0.00 -1.18 0.00 0.00 32.58 28.78 2gt3 s HIS 168 CO 0.47 0.13 2.06 0.42 -0.65 0.00 0.00 174.74 177.18 2gt3 s ILE 169 N 0.85 3.01 -1.20 0.89 1.01 -1.26 -4.74 121.20 119.75 2gt3 s ILE 169 Ca 0.13 0.01 0.10 0.00 0.00 0.00 0.00 60.65 60.89 2gt3 s ILE 169 Cb -0.13 -3.01 0.43 0.00 0.01 0.00 0.00 42.46 39.76 2gt3 s ILE 169 CO 0.04 -0.00 1.26 1.07 0.00 0.00 0.00 174.94 177.31 2gt3 n THR 170 N 6.35 1.14 -2.92 2.92 5.66 -0.57 -4.90 114.28 121.95 2gt3 n THR 170 Ca 0.24 -0.70 -0.40 0.00 -3.05 0.00 0.00 64.05 60.14 2gt3 n THR 170 Cb 0.42 -0.08 -0.06 0.00 -1.55 0.00 0.00 70.33 69.07 2gt3 n THR 170 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2gt3 s THR 171 N -1.75 4.38 -0.12 1.09 2.01 -1.01 -4.38 115.64 115.85 2gt3 s THR 171 Ca 0.30 1.80 0.03 0.00 0.31 0.00 0.00 61.69 64.13 2gt3 s THR 171 Cb 0.20 -4.19 0.01 0.00 0.01 0.00 0.00 72.50 68.53 2gt3 s THR 171 CO 0.14 0.48 -0.22 -1.83 -0.69 0.00 0.00 174.62 172.49 2gt3 s GLU 172 N -0.89 2.97 -0.25 4.92 -1.05 -1.02 -4.98 118.70 118.39 2gt3 s GLU 172 Ca 0.38 -0.84 -0.04 0.00 -0.15 0.00 0.00 54.97 54.31 2gt3 s GLU 172 Cb -0.23 -2.32 0.01 0.00 -0.44 0.00 0.00 34.13 31.14 2gt3 s GLU 172 CO 0.27 0.08 -0.01 0.42 0.95 0.00 0.00 175.26 176.97 2gt3 s ILE 173 N 0.59 3.44 0.05 1.83 1.01 -1.26 -0.47 121.20 126.38 2gt3 s ILE 173 Ca -0.13 -0.71 -0.11 0.00 0.00 0.00 0.00 60.65 59.70 2gt3 s ILE 173 Cb -0.17 -2.69 0.01 0.00 0.01 0.00 0.00 42.46 39.62 2gt3 s ILE 173 CO 0.03 0.24 0.24 0.00 0.00 0.00 0.00 174.94 175.46 2gt3 s ALA 174 N 1.44 -0.47 0.38 9.38 0.00 -1.09 -5.02 121.76 126.38 2gt3 s ALA 174 Ca 0.03 -0.24 -0.24 0.00 0.00 0.00 0.00 51.96 51.52 2gt3 s ALA 174 Cb -0.16 0.36 -0.13 0.00 0.00 0.00 0.00 23.12 23.18 2gt3 s ALA 174 CO -0.02 -0.42 0.56 -1.71 0.00 0.00 0.00 175.76 174.17 2gt3 n ASN 175 N 0.45 -0.82 -4.66 0.00 2.85 -1.26 -4.25 115.26 107.58 2gt3 n ASN 175 Ca -0.18 0.96 -0.50 0.00 -0.11 0.00 0.00 54.58 54.75 2gt3 n ASN 175 Cb 0.60 -1.10 -0.05 0.00 1.24 0.00 0.00 39.78 40.47 2gt3 n ASN 175 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2gt3 n ALA 176 N -0.65 0.76 -1.98 5.20 0.00 -1.10 -4.88 120.51 117.85 2gt3 n ALA 176 Ca 0.12 0.24 -0.26 0.00 0.00 0.00 0.00 53.44 53.54 2gt3 n ALA 176 Cb 0.37 -2.48 0.05 0.00 0.00 0.00 0.00 19.45 17.39 2gt3 n ALA 176 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2gt3 s THR 177 N 4.55 2.78 -1.13 0.00 -4.23 -1.26 -4.94 115.64 111.40 2gt3 s THR 177 Ca 0.96 -0.19 -0.19 0.00 -1.18 0.00 0.00 61.69 61.10 2gt3 s THR 177 Cb -0.76 -3.16 -0.05 0.00 1.34 0.00 0.00 72.50 69.87 2gt3 s THR 177 CO 0.53 -0.17 2.01 -0.81 -0.54 0.00 0.00 174.62 175.64 2gt3 n PRO 178 N -2.78 2.21 -1.78 3.99 -0.04 -1.26 -4.94 135.00 130.40 2gt3 n PRO 178 Ca 0.07 -2.38 -0.37 0.00 -0.04 0.00 0.00 63.50 60.78 2gt3 n PRO 178 Cb 0.59 -3.23 0.05 0.00 -0.04 0.00 0.00 33.50 30.88 2gt3 n PRO 178 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 2gt3 s PHE 179 N 5.02 2.19 -0.11 0.54 2.19 -1.26 -4.95 117.98 121.60 2gt3 s PHE 179 Ca 0.55 1.44 0.03 0.00 0.33 0.00 0.00 56.93 59.28 2gt3 s PHE 179 Cb 0.11 -3.72 -0.01 0.00 -1.31 0.00 0.00 43.02 38.09 2gt3 s PHE 179 CO 0.04 -2.86 -0.21 0.71 1.83 0.00 0.00 175.22 174.74 2gt3 s TYR 180 N -1.37 2.63 0.35 10.12 1.51 -1.11 -4.96 117.35 124.52 2gt3 s TYR 180 Ca 0.78 -0.90 -0.29 0.00 -1.01 0.00 0.00 57.07 55.65 2gt3 s TYR 180 Cb -0.38 -1.75 -0.11 0.00 -0.11 0.00 0.00 41.96 39.61 2gt3 s TYR 180 CO 0.42 -0.34 1.52 0.66 -1.11 0.00 0.00 175.55 176.70 2gt3 n TYR 181 N 3.49 2.93 -2.39 2.71 4.02 -1.26 -2.27 117.16 124.38 2gt3 n TYR 181 Ca -0.19 0.39 -0.25 0.00 -0.01 0.00 0.00 57.90 57.84 2gt3 n TYR 181 Cb 0.53 -2.55 0.05 0.00 -0.02 0.00 0.00 39.34 37.35 2gt3 n TYR 181 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2gt3 s ALA 182 N -0.75 3.41 0.46 -0.72 0.00 0.26 -4.80 121.76 119.62 2gt3 s ALA 182 Ca 0.57 -0.99 -0.21 0.00 0.00 0.00 0.00 51.96 51.32 2gt3 s ALA 182 Cb -0.48 -2.44 -0.12 0.00 0.00 0.00 0.00 23.12 20.07 2gt3 s ALA 182 CO 0.59 -1.01 0.47 0.39 0.00 0.00 0.00 175.76 176.19 2gt3 n GLU 183 N -2.66 0.49 0.07 0.00 1.02 -1.26 -4.69 120.64 113.61 2gt3 n GLU 183 Ca 0.07 0.18 0.03 0.00 -0.02 0.00 0.00 57.16 57.42 2gt3 n GLU 183 Cb 0.60 -1.49 0.40 0.00 -0.02 0.00 0.00 31.44 30.93 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 0.59 0.33 -0.78 1.62 1.82 -1.93 -0.97 116.42 117.09 2gt3 h ASP 184 Ca -0.41 -0.05 0.19 0.00 -0.39 0.00 0.00 57.03 56.37 2gt3 h ASP 184 Cb 1.40 -0.09 -0.05 0.00 0.68 0.00 0.00 39.33 41.28 2gt3 h ASP 184 CO 0.49 0.38 0.54 0.44 -1.61 0.00 0.00 179.24 179.48 2gt3 h ASP 185 N 0.36 0.24 0.40 2.28 3.32 -1.97 0.14 116.42 121.18 2gt3 h ASP 185 Ca 0.08 0.02 -0.32 0.00 0.02 0.00 0.00 57.03 56.84 2gt3 h ASP 185 Cb 0.22 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 2gt3 h ASP 185 CO 0.00 0.11 -1.60 0.45 -1.72 0.00 0.00 179.24 176.49 2gt3 h HIS 186 N 0.25 0.48 -1.10 4.55 3.86 -1.53 -3.40 115.15 118.25 2gt3 h HIS 186 Ca 0.39 -0.35 -0.67 0.00 -1.16 0.00 0.00 60.37 58.58 2gt3 h HIS 186 Cb 1.15 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 29.58 2gt3 h HIS 186 CO -0.00 1.43 1.40 1.04 0.86 0.00 0.00 177.93 182.67 2gt3 n GLN 187 N -3.46 1.08 -3.43 2.45 1.13 0.49 -1.14 117.38 114.51 2gt3 n GLN 187 Ca -0.19 0.30 -0.20 0.00 -1.94 0.00 0.00 57.00 54.97 2gt3 n GLN 187 Cb 1.05 -2.45 0.06 0.00 0.11 0.00 0.00 30.24 29.01 2gt3 n GLN 187 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2gt3 n GLN 188 N 8.12 -2.72 -0.05 -1.09 1.13 -1.26 -4.89 117.38 116.62 2gt3 n GLN 188 Ca 0.41 0.73 -0.14 0.00 -1.94 0.00 0.00 57.00 56.06 2gt3 n GLN 188 Cb 0.23 -5.33 -0.07 0.00 0.11 0.00 0.00 30.24 25.18 2gt3 n GLN 188 CO 0.00 0.00 0.00 -0.92 -1.44 0.00 0.00 177.06 174.70 2gt3 h TYR 189 N -1.46 0.55 0.00 1.08 5.03 -1.36 -2.69 116.97 118.13 2gt3 h TYR 189 Ca -0.62 -0.20 0.00 0.00 2.58 0.00 0.00 58.73 60.49 2gt3 h TYR 189 Cb 1.33 -0.10 0.00 0.00 1.55 0.00 0.00 36.73 39.51 2gt3 h TYR 189 CO 0.34 0.89 0.00 1.28 -1.32 0.00 0.00 178.16 179.35 2gt3 n LEU 190 N -4.42 0.01 0.11 2.82 4.77 -1.26 -1.60 117.00 117.42 2gt3 n LEU 190 Ca -0.06 0.50 -0.02 0.00 -0.03 0.00 0.00 56.01 56.40 2gt3 n LEU 190 Cb 0.45 -0.50 0.21 0.00 -2.33 0.00 0.00 43.42 41.25 2gt3 n LEU 190 CO 0.42 -0.33 0.61 1.12 -1.33 0.00 0.00 177.39 177.88 2gt3 h HIS 191 N 0.00 0.22 0.15 -1.77 2.07 -1.83 -2.91 115.15 111.08 2gt3 h HIS 191 Ca 0.00 -0.07 -0.31 0.00 -2.85 0.00 0.00 60.37 57.14 2gt3 h HIS 191 Cb 0.18 -0.05 0.00 0.00 2.57 0.00 0.00 27.41 30.12 2gt3 h HIS 191 CO 0.00 0.62 -1.53 -0.22 -3.07 0.00 0.00 177.93 173.73 2gt3 h LYS 192 N 0.15 0.31 -3.93 5.12 3.64 -1.40 -3.43 116.57 117.04 2gt3 h LYS 192 Ca 0.01 -0.53 -0.59 0.00 -1.27 0.00 0.00 60.65 58.27 2gt3 h LYS 192 Cb 0.88 0.20 -0.39 0.00 -0.41 0.00 0.00 32.23 32.51 2gt3 h LYS 192 CO 0.07 1.20 -0.76 0.54 -2.27 0.00 0.00 179.45 178.23 2gt3 s ASN 193 N -7.13 3.85 0.18 4.20 2.20 -1.13 -4.96 114.94 112.14 2gt3 s ASN 193 Ca -0.09 -1.40 0.24 0.00 -0.94 0.00 0.00 52.86 50.66 2gt3 s ASN 193 Cb 0.06 -1.00 0.91 0.00 -2.00 0.00 0.00 41.25 39.22 2gt3 s ASN 193 CO 0.87 -0.34 1.73 -0.81 -2.94 0.00 0.00 177.10 175.62 2gt3 n PRO 194 N 4.76 0.17 -0.50 3.55 -0.04 -1.11 -2.37 135.00 139.46 2gt3 n PRO 194 Ca -0.06 0.27 0.10 0.00 -0.04 0.00 0.00 63.50 63.78 2gt3 n PRO 194 Cb 0.44 -1.76 0.33 0.00 -0.04 0.00 0.00 33.50 32.47 2gt3 n PRO 194 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2gt3 n TYR 195 N -2.08 1.23 0.00 0.54 4.11 -1.26 -4.95 117.16 114.75 2gt3 n TYR 195 Ca 0.04 -0.57 0.00 0.00 -0.00 0.00 0.00 57.90 57.37 2gt3 n TYR 195 Cb 0.31 -0.15 0.00 0.00 -0.00 0.00 0.00 39.34 39.51 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 1.23 -1.93 3.86 -7.48 0.00 -1.00 -5.02 105.19 94.86 2gt3 n GLY 196 Ca 0.24 -1.38 -0.35 0.00 0.00 0.00 0.00 46.02 44.54 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 0.00 3.60 0.00 1.61 1.51 -1.26 -4.96 117.35 117.84 2gt3 s TYR 197 Ca 0.00 0.83 0.00 0.00 -1.01 0.00 0.00 57.07 56.89 2gt3 s TYR 197 Cb 0.00 -2.19 0.00 0.00 -0.11 0.00 0.00 41.96 39.66 2gt3 s TYR 197 CO 0.00 0.52 0.00 0.00 -1.11 0.00 0.00 175.55 174.96 2gt3 n GLY 199 N 2.21 -0.33 0.27 0.00 0.00 -1.26 -4.41 105.19 101.66 2gt3 n GLY 199 Ca 0.00 0.21 -0.18 0.00 0.00 0.00 0.00 46.02 46.05 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 -4.57 1.09 -1.71 -0.61 0.13 -1.26 -4.40 119.36 108.04 2gt3 n ILE 200 Ca -0.27 -0.33 -0.65 0.00 -1.10 0.00 0.00 62.75 60.40 2gt3 n ILE 200 Cb 0.67 -1.54 -0.09 0.00 -0.84 0.00 0.00 39.64 37.83 2gt3 n ILE 200 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2gt3 n GLY 201 N 2.07 0.23 0.00 4.50 0.00 -1.26 -4.66 105.19 106.07 2gt3 n GLY 201 Ca -0.37 0.96 0.00 0.00 0.00 0.00 0.00 46.02 46.60 2gt3 n GLY 201 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gt3 n GLY 202 N 3.65 -1.28 3.48 -0.02 0.00 -1.26 -5.02 105.19 104.75 2gt3 n GLY 202 Ca 0.29 0.52 -0.23 0.00 0.00 0.00 0.00 46.02 46.60 2gt3 n GLY 202 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2gt3 s ILE 203 N 0.00 1.35 0.00 -0.61 -0.00 -1.26 -3.91 121.20 116.77 2gt3 s ILE 203 Ca 0.00 -2.00 0.00 0.00 -0.00 0.00 0.00 60.65 58.65 2gt3 s ILE 203 Cb 0.00 -2.83 0.00 0.00 -0.00 0.00 0.00 42.46 39.63 2gt3 s ILE 203 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 174.94 175.55 2gt3 n GLY 204 N -0.75 0.47 3.05 6.27 0.00 -1.26 -5.11 105.19 107.86 2gt3 n GLY 204 Ca -0.03 -0.29 -0.11 0.00 0.00 0.00 0.00 46.02 45.59 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 0.00 0.40 -0.68 1.61 1.01 -1.26 -5.06 120.40 116.42 2gt3 s VAL 205 Ca 0.00 -1.12 -0.32 0.00 0.00 0.00 0.00 61.98 60.55 2gt3 s VAL 205 Cb 0.00 -0.61 -0.15 0.00 0.00 0.00 0.00 36.38 35.61 2gt3 s VAL 205 CO 0.00 -0.48 2.47 0.00 0.00 0.00 0.00 175.10 177.09 2gt3 s LEU 207 N 9.34 4.54 0.60 0.00 2.96 -1.26 -4.05 118.68 130.80 2gt3 s LEU 207 Ca 1.19 1.76 -0.15 0.00 -0.22 0.00 0.00 54.13 56.71 2gt3 s LEU 207 Cb -0.89 -3.50 -0.03 0.00 0.50 0.00 0.00 46.19 42.26 2gt3 s LEU 207 CO 0.44 0.03 1.05 -2.16 -1.32 0.00 0.00 176.35 174.39 2gt3 s PRO 208 N -0.43 3.33 -0.68 0.98 0.04 -1.26 -4.90 135.00 132.08 2gt3 s PRO 208 Ca 0.43 1.13 -0.06 0.00 0.04 0.00 0.00 61.00 62.54 2gt3 s PRO 208 Cb -0.23 -2.04 -0.13 0.00 0.04 0.00 0.00 34.50 32.14 2gt3 s PRO 208 CO 0.29 -0.80 2.64 -0.35 0.04 0.00 0.00 177.00 178.82 2gt3 n PRO 209 N -2.16 2.21 0.09 0.56 -0.04 -1.26 -4.25 135.00 130.14 2gt3 n PRO 209 Ca 0.08 -1.32 -0.23 0.00 -0.04 0.00 0.00 63.50 61.99 2gt3 n PRO 209 Cb 0.53 -2.28 -0.15 0.00 -0.04 0.00 0.00 33.50 31.56 2gt3 n PRO 209 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2gt3 h GLU 210 N 4.88 0.43 0.00 0.54 4.22 -2.04 -3.57 114.58 119.03 2gt3 h GLU 210 Ca 0.43 -0.73 0.00 0.00 0.08 0.00 0.00 59.36 59.14 2gt3 h GLU 210 Cb 0.62 0.27 0.00 0.00 0.50 0.00 0.00 28.75 30.14 2gt3 h GLU 210 CO 1.02 1.35 0.00 0.00 -2.18 0.00 0.00 179.01 179.20