#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 3.53 -4.47 -3.43 7.94 -1.26 -4.92 117.00 114.39 2gt3 n LEU 2 Ca 0.00 -2.49 -0.43 0.00 -1.11 0.00 0.00 56.01 51.98 2gt3 n LEU 2 Cb 0.00 -0.40 -0.07 0.00 0.53 0.00 0.00 43.42 43.48 2gt3 n LEU 2 CO 0.00 0.71 0.32 -0.36 -1.11 0.00 0.00 177.39 176.96 2gt3 s PHE 3 N -1.88 3.06 -0.39 1.96 0.08 -1.26 -4.96 117.98 114.60 2gt3 s PHE 3 Ca 0.34 -0.38 0.03 0.00 0.12 0.00 0.00 56.93 57.05 2gt3 s PHE 3 Cb 0.24 -3.41 0.16 0.00 -0.57 0.00 0.00 43.02 39.44 2gt3 s PHE 3 CO 0.14 -0.95 0.39 0.16 -0.10 0.00 0.00 175.22 174.86 2gt3 s ASP 4 N 2.38 1.10 -0.11 1.36 -4.77 -1.26 -4.97 116.67 110.40 2gt3 s ASP 4 Ca 0.17 -1.89 0.04 0.00 -3.30 0.00 0.00 52.55 47.56 2gt3 s ASP 4 Cb -0.17 0.45 0.28 0.00 -1.09 0.00 0.00 42.92 42.39 2gt3 s ASP 4 CO 0.14 -0.23 1.09 0.29 0.70 0.00 0.00 175.17 177.16 2gt3 n LYS 5 N 3.87 2.09 0.00 2.11 4.76 -1.26 -4.28 118.16 125.45 2gt3 n LYS 5 Ca 0.15 -1.13 0.23 0.00 -2.87 0.00 0.00 58.31 54.69 2gt3 n LYS 5 Cb 0.46 -1.66 0.68 0.00 -1.84 0.00 0.00 35.03 32.67 2gt3 n LYS 5 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2gt3 h LYS 6 N 1.08 0.00 -6.77 1.97 6.56 -2.02 -3.40 116.57 114.00 2gt3 h LYS 6 Ca 0.08 0.00 -0.52 0.00 -1.06 0.00 0.00 60.65 59.15 2gt3 h LYS 6 Cb 1.27 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 32.96 2gt3 h LYS 6 CO 0.26 0.00 0.57 -1.01 -2.06 0.00 0.00 179.45 177.21 2gt3 s HIS 7 N -4.59 3.35 0.23 -1.35 3.76 -1.26 -5.03 115.29 110.39 2gt3 s HIS 7 Ca -0.04 1.48 0.00 0.00 -0.15 0.00 0.00 55.06 56.35 2gt3 s HIS 7 Cb 0.16 -3.48 -0.05 0.00 1.11 0.00 0.00 32.58 30.32 2gt3 s HIS 7 CO 0.54 -1.28 0.11 -0.48 -0.85 0.00 0.00 174.74 172.79 2gt3 s LEU 8 N -1.03 1.37 0.41 0.89 2.34 -1.26 -5.08 118.68 116.32 2gt3 s LEU 8 Ca 0.50 -1.39 -0.23 0.00 0.06 0.00 0.00 54.13 53.07 2gt3 s LEU 8 Cb -0.35 0.22 -0.10 0.00 -0.56 0.00 0.00 46.19 45.40 2gt3 s LEU 8 CO 0.43 -0.79 0.98 0.54 -1.06 0.00 0.00 176.35 176.45 2gt3 s VAL 9 N -3.97 4.14 0.62 1.48 0.11 -1.26 -5.05 120.40 116.47 2gt3 s VAL 9 Ca 0.38 1.48 -0.08 0.00 -2.93 0.00 0.00 61.98 60.83 2gt3 s VAL 9 Cb 0.07 -3.68 0.00 0.00 -1.53 0.00 0.00 36.38 31.24 2gt3 s VAL 9 CO 0.13 -0.14 0.97 -0.44 -3.33 0.00 0.00 175.10 172.28 2gt3 s SER 10 N -1.91 5.67 0.10 3.54 0.01 -1.26 -4.86 113.70 114.98 2gt3 s SER 10 Ca 0.59 0.95 -0.11 0.00 1.31 0.00 0.00 55.95 58.69 2gt3 s SER 10 Cb -0.15 -1.91 -0.17 0.00 0.21 0.00 0.00 66.02 64.00 2gt3 s SER 10 CO 0.19 -1.10 1.26 1.55 0.41 0.00 0.00 173.24 175.55 2gt3 h PRO 11 N -0.32 0.67 0.00 12.44 0.13 -1.94 0.37 132.00 143.35 2gt3 h PRO 11 Ca -0.45 -0.66 -0.01 0.00 -0.87 0.00 0.00 66.00 64.01 2gt3 h PRO 11 Cb 1.24 0.17 -0.00 0.00 0.13 0.00 0.00 31.00 32.54 2gt3 h PRO 11 CO 0.62 1.26 -0.03 0.00 -0.23 0.00 0.00 178.00 179.62 2gt3 h ALA 12 N 0.53 0.99 0.13 -0.56 0.00 -1.96 -3.11 119.26 115.27 2gt3 h ALA 12 Ca -0.09 -0.02 -0.36 0.00 0.00 0.00 0.00 54.91 54.44 2gt3 h ALA 12 Cb 1.57 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.35 2gt3 h ALA 12 CO 0.18 0.03 -1.92 -0.44 0.00 0.00 0.00 179.25 177.11 2gt3 h ASP 13 N 0.00 0.43 -3.15 0.00 3.32 -1.93 -3.47 116.42 111.62 2gt3 h ASP 13 Ca -0.00 -0.88 -0.56 0.00 0.02 0.00 0.00 57.03 55.62 2gt3 h ASP 13 Cb 0.78 -0.14 0.20 0.00 0.22 0.00 0.00 39.33 40.38 2gt3 h ASP 13 CO 0.00 1.78 -0.54 0.00 -1.72 0.00 0.00 179.24 178.76 2gt3 n ALA 14 N -2.93 -2.02 -1.39 3.45 0.00 0.13 -4.85 120.51 112.90 2gt3 n ALA 14 Ca -0.29 -0.34 -0.37 0.00 0.00 0.00 0.00 53.44 52.44 2gt3 n ALA 14 Cb 1.05 -1.79 0.05 0.00 0.00 0.00 0.00 19.45 18.77 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 -0.21 0.87 0.15 0.00 4.32 -0.29 -4.88 117.00 116.96 2gt3 n LEU 15 Ca 0.09 0.68 0.01 0.00 -0.02 0.00 0.00 56.01 56.77 2gt3 n LEU 15 Cb 0.51 -1.19 0.16 0.00 -1.62 0.00 0.00 43.42 41.28 2gt3 n LEU 15 CO 0.51 -3.05 0.51 1.55 -1.22 0.00 0.00 177.39 175.68 2gt3 h PRO 16 N 0.01 0.00 0.00 3.23 0.13 -1.93 -3.38 132.00 130.06 2gt3 h PRO 16 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2gt3 h PRO 16 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 2gt3 h PRO 16 CO 0.45 0.55 0.00 0.41 -0.23 0.00 0.00 178.00 179.19 2gt3 n GLY 17 N 0.61 3.50 3.11 1.56 0.00 -1.26 -4.20 105.19 108.52 2gt3 n GLY 17 Ca 0.00 -1.86 -0.08 0.00 0.00 0.00 0.00 46.02 44.08 2gt3 n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gt3 s ARG 18 N -2.88 0.68 -0.91 1.61 0.52 -1.17 -4.97 118.95 111.82 2gt3 s ARG 18 Ca 0.00 -1.24 -0.15 0.00 -0.52 0.00 0.00 55.73 53.82 2gt3 s ARG 18 Cb 0.00 0.07 0.19 0.00 0.52 0.00 0.00 34.95 35.73 2gt3 s ARG 18 CO 0.00 -0.08 0.97 -0.80 0.02 0.00 0.00 175.30 175.41 2gt3 s ASN 19 N -2.91 6.79 -0.31 0.23 -0.87 -1.26 -4.62 114.94 111.98 2gt3 s ASN 19 Ca 0.08 -2.58 -0.01 0.00 -1.57 0.00 0.00 52.86 48.78 2gt3 s ASN 19 Cb 0.06 -2.29 0.10 0.00 -0.02 0.00 0.00 41.25 39.11 2gt3 s ASN 19 CO -0.08 -0.72 0.11 -0.89 -2.57 0.00 0.00 177.10 172.95 2gt3 s THR 20 N 0.97 0.72 0.16 1.60 2.01 -1.26 -5.12 115.64 114.72 2gt3 s THR 20 Ca 0.26 -1.35 -0.30 0.00 0.31 0.00 0.00 61.69 60.61 2gt3 s THR 20 Cb -0.08 -1.55 -0.07 0.00 0.01 0.00 0.00 72.50 70.81 2gt3 s THR 20 CO -0.09 -0.71 1.13 -2.16 -0.69 0.00 0.00 174.62 172.11 2gt3 s PRO 21 N 1.63 4.55 -0.14 4.92 0.04 -1.26 -4.97 135.00 139.77 2gt3 s PRO 21 Ca 0.10 1.74 -0.01 0.00 0.04 0.00 0.00 61.00 62.87 2gt3 s PRO 21 Cb -0.18 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 31.06 2gt3 s PRO 21 CO -0.25 0.00 -0.10 -1.64 0.04 0.00 0.00 177.00 175.05 2gt3 s MET 22 N -0.15 3.49 0.35 4.56 -1.94 -1.26 -5.10 119.30 119.25 2gt3 s MET 22 Ca 0.51 -0.63 -0.26 0.00 -1.71 0.00 0.00 55.69 53.60 2gt3 s MET 22 Cb -0.30 -2.73 -0.09 0.00 2.01 0.00 0.00 34.83 33.72 2gt3 s MET 22 CO 0.34 0.22 1.06 -1.25 -0.01 0.00 0.00 175.02 175.39 2gt3 s PRO 23 N 0.35 4.35 -0.16 2.03 0.04 -1.26 -5.03 135.00 135.32 2gt3 s PRO 23 Ca -0.09 1.62 -0.02 0.00 0.04 0.00 0.00 61.00 62.55 2gt3 s PRO 23 Cb -0.15 -2.79 -0.02 0.00 0.04 0.00 0.00 34.50 31.58 2gt3 s PRO 23 CO 0.05 -0.00 -0.09 0.08 0.04 0.00 0.00 177.00 177.08 2gt3 s VAL 24 N -1.47 3.34 0.70 -0.36 1.01 -1.26 -4.53 120.40 117.84 2gt3 s VAL 24 Ca 0.53 -0.54 -0.16 0.00 0.00 0.00 0.00 61.98 61.80 2gt3 s VAL 24 Cb -0.26 -2.45 -0.00 0.00 0.00 0.00 0.00 36.38 33.67 2gt3 s VAL 24 CO 0.33 0.49 0.98 0.00 0.00 0.00 0.00 175.10 176.90 2gt3 n ALA 25 N 3.80 -0.13 0.01 5.51 0.00 -1.26 -4.92 120.51 123.52 2gt3 n ALA 25 Ca -0.18 -0.15 -0.19 0.00 0.00 0.00 0.00 53.44 52.92 2gt3 n ALA 25 Cb 0.52 -2.12 -0.09 0.00 0.00 0.00 0.00 19.45 17.76 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 -0.12 1.28 -3.57 0.00 2.02 -1.98 -3.45 112.91 107.09 2gt3 h THR 26 Ca -0.48 -2.12 -0.36 0.00 0.77 0.00 0.00 66.41 64.22 2gt3 h THR 26 Cb 1.34 2.20 -0.14 0.00 -1.74 0.00 0.00 68.15 69.80 2gt3 h THR 26 CO 0.48 0.67 -0.63 -0.76 0.37 0.00 0.00 175.52 175.64 2gt3 s LEU 27 N -8.25 1.86 1.09 2.58 1.43 -1.26 -3.50 118.68 112.63 2gt3 s LEU 27 Ca -0.10 -1.33 -0.13 0.00 -1.03 0.00 0.00 54.13 51.54 2gt3 s LEU 27 Cb 0.08 -0.09 0.24 0.00 0.03 0.00 0.00 46.19 46.45 2gt3 s LEU 27 CO 0.92 -0.66 1.06 -2.28 0.23 0.00 0.00 176.35 175.61 2gt3 s HIS 28 N -3.62 1.66 -0.02 0.29 5.65 0.03 -4.81 115.29 114.47 2gt3 s HIS 28 Ca 0.34 1.12 -0.08 0.00 0.25 0.00 0.00 55.06 56.70 2gt3 s HIS 28 Cb 0.07 -3.17 -0.04 0.00 -1.18 0.00 0.00 32.58 28.26 2gt3 s HIS 28 CO 0.12 -3.46 0.49 0.00 -0.65 0.00 0.00 174.74 171.24 2gt3 h ALA 29 N -2.32 -0.45 0.00 1.58 0.00 -1.92 -2.84 119.26 113.31 2gt3 h ALA 29 Ca -0.58 -0.06 -0.27 0.00 0.00 0.00 0.00 54.91 54.00 2gt3 h ALA 29 Cb 1.33 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.19 2gt3 h ALA 29 CO 0.53 -0.43 -1.44 0.28 0.00 0.00 0.00 179.25 178.19 2gt3 n VAL 30 N -3.78 1.54 0.22 0.00 0.31 -1.26 -4.06 118.33 111.30 2gt3 n VAL 30 Ca -0.04 -0.09 0.14 0.00 -0.01 0.00 0.00 64.34 64.34 2gt3 n VAL 30 Cb 0.11 -2.01 0.77 0.00 -0.91 0.00 0.00 33.84 31.80 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 -0.97 0.00 -3.47 4.52 -0.73 -1.89 -3.44 115.58 109.60 2gt3 h ASN 31 Ca -0.40 0.00 -0.07 0.00 1.87 0.00 0.00 56.30 57.71 2gt3 h ASN 31 Cb 1.37 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.94 2gt3 h ASN 31 CO -0.23 0.00 -0.08 0.61 -0.37 0.00 0.00 177.43 177.36 2gt3 n GLY 32 N -1.46 -0.15 0.74 1.57 0.00 -1.07 -4.78 105.19 100.02 2gt3 n GLY 32 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 2gt3 n GLY 32 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2gt3 n HIS 33 N -2.10 -2.80 -1.67 1.61 -0.00 -1.26 -4.40 115.22 104.60 2gt3 n HIS 33 Ca -0.04 -0.40 -0.45 0.00 -0.00 0.00 0.00 57.72 56.83 2gt3 n HIS 33 Cb 0.35 -0.10 -0.04 0.00 -0.00 0.00 0.00 29.99 30.20 2gt3 n HIS 33 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 2gt3 n SER 34 N -2.83 3.77 -0.04 0.41 7.64 -1.26 -0.79 113.62 120.52 2gt3 n SER 34 Ca 0.03 0.95 -0.15 0.00 1.01 0.00 0.00 58.87 60.71 2gt3 n SER 34 Cb 0.11 -1.45 -0.13 0.00 -1.01 0.00 0.00 64.21 61.73 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 9.50 0.08 0.00 1.43 2.86 -1.86 -3.41 114.93 123.53 2gt3 h MET 35 Ca -0.49 -0.13 -0.43 0.00 -2.06 0.00 0.00 59.70 56.60 2gt3 h MET 35 Cb 1.25 0.04 -0.06 0.00 0.06 0.00 0.00 31.60 32.89 2gt3 h MET 35 CO 0.94 1.02 -2.33 0.25 1.06 0.00 0.00 176.91 177.85 2gt3 n THR 36 N -4.51 1.53 -1.65 2.22 -2.24 -1.26 -4.94 114.28 103.44 2gt3 n THR 36 Ca -0.11 -0.33 -0.50 0.00 -2.27 0.00 0.00 64.05 60.84 2gt3 n THR 36 Cb 0.54 -1.89 -0.05 0.00 -2.10 0.00 0.00 70.33 66.83 2gt3 n THR 36 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2gt3 n ASN 37 N -4.25 2.48 -4.35 3.42 3.02 -1.26 -4.96 115.26 109.37 2gt3 n ASN 37 Ca -0.51 1.08 -0.32 0.00 -0.03 0.00 0.00 54.58 54.80 2gt3 n ASN 37 Cb 0.86 -1.28 -0.15 0.00 -0.61 0.00 0.00 39.78 38.59 2gt3 n ASN 37 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2gt3 s VAL 38 N 1.61 2.65 0.47 2.41 1.01 -1.26 -4.69 120.40 122.61 2gt3 s VAL 38 Ca 0.86 -0.83 -0.21 0.00 0.00 0.00 0.00 61.98 61.80 2gt3 s VAL 38 Cb -0.85 -2.05 -0.09 0.00 0.00 0.00 0.00 36.38 33.40 2gt3 s VAL 38 CO 0.48 0.56 1.04 -2.16 0.00 0.00 0.00 175.10 175.01 2gt3 s PRO 39 N -0.02 3.85 0.01 2.72 0.04 -1.26 -4.95 135.00 135.39 2gt3 s PRO 39 Ca -0.05 1.38 -0.30 0.00 0.04 0.00 0.00 61.00 62.07 2gt3 s PRO 39 Cb -0.14 -2.16 -0.08 0.00 0.04 0.00 0.00 34.50 32.16 2gt3 s PRO 39 CO 0.05 -0.39 1.93 0.34 0.04 0.00 0.00 177.00 178.97 2gt3 s ASP 40 N -1.92 6.43 0.00 6.66 2.15 -1.26 -0.84 116.67 127.89 2gt3 s ASP 40 Ca 0.66 2.55 0.00 0.00 0.43 0.00 0.00 52.55 56.19 2gt3 s ASP 40 Cb -0.17 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 2gt3 s ASP 40 CO 0.21 -1.09 0.00 0.61 -0.17 0.00 0.00 175.17 174.73 2gt3 n GLY 41 N 4.55 2.02 3.83 2.66 0.00 -1.26 -5.08 105.19 111.91 2gt3 n GLY 41 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.52 4.07 0.24 1.61 0.00 -0.02 -4.04 119.30 120.64 2gt3 s MET 42 Ca 0.00 0.61 0.05 0.00 0.00 0.00 0.00 55.69 56.35 2gt3 s MET 42 Cb 0.00 -2.93 -0.05 0.00 0.00 0.00 0.00 34.83 31.85 2gt3 s MET 42 CO 0.00 0.46 -0.05 -1.21 0.00 0.00 0.00 175.02 174.22 2gt3 s GLU 43 N -1.92 1.40 0.19 4.11 2.02 -0.11 -4.81 118.70 119.57 2gt3 s GLU 43 Ca 0.39 -1.70 0.07 0.00 0.02 0.00 0.00 54.97 53.76 2gt3 s GLU 43 Cb -0.16 -0.89 -0.04 0.00 0.10 0.00 0.00 34.13 33.14 2gt3 s GLU 43 CO 0.20 -0.00 0.01 0.42 0.02 0.00 0.00 175.26 175.90 2gt3 s ILE 44 N -3.20 3.74 -0.05 -1.63 1.01 -1.26 -0.65 121.20 119.15 2gt3 s ILE 44 Ca 0.27 -1.47 -0.02 0.00 0.00 0.00 0.00 60.65 59.43 2gt3 s ILE 44 Cb 0.04 -2.90 0.04 0.00 0.01 0.00 0.00 42.46 39.65 2gt3 s ILE 44 CO 0.09 -0.15 0.11 0.00 0.00 0.00 0.00 174.94 174.99 2gt3 s ALA 45 N -1.82 -0.15 -0.18 9.38 0.00 0.61 -4.69 121.76 124.92 2gt3 s ALA 45 Ca 0.28 0.56 -0.03 0.00 0.00 0.00 0.00 51.96 52.76 2gt3 s ALA 45 Cb -0.09 -0.40 -0.02 0.00 0.00 0.00 0.00 23.12 22.62 2gt3 s ALA 45 CO 0.19 -0.15 -0.05 0.42 0.00 0.00 0.00 175.76 176.17 2gt3 s ILE 46 N 1.17 3.54 -0.05 0.00 1.09 -1.08 0.11 121.20 125.98 2gt3 s ILE 46 Ca -0.09 -0.46 -0.08 0.00 -1.10 0.00 0.00 60.65 58.93 2gt3 s ILE 46 Cb -0.12 -2.57 0.01 0.00 -1.06 0.00 0.00 42.46 38.72 2gt3 s ILE 46 CO -0.05 0.46 0.19 -0.36 -0.10 0.00 0.00 174.94 175.08 2gt3 s PHE 47 N 0.93 -0.15 -0.31 3.97 0.08 -1.09 0.00 117.98 121.42 2gt3 s PHE 47 Ca -0.00 0.34 -0.07 0.00 0.12 0.00 0.00 56.93 57.32 2gt3 s PHE 47 Cb -0.15 0.04 0.02 0.00 -0.57 0.00 0.00 43.02 42.36 2gt3 s PHE 47 CO 0.01 -0.18 0.08 0.00 -0.10 0.00 0.00 175.22 175.03 2gt3 s ALA 48 N -0.41 3.05 -0.08 5.36 0.00 0.39 -2.43 121.76 127.64 2gt3 s ALA 48 Ca -0.05 -1.52 0.12 0.00 0.00 0.00 0.00 51.96 50.50 2gt3 s ALA 48 Cb -0.03 -2.17 0.18 0.00 0.00 0.00 0.00 23.12 21.09 2gt3 s ALA 48 CO 0.01 -1.02 1.07 -1.33 0.00 0.00 0.00 175.76 174.49 2gt3 n MET 49 N 4.85 1.02 0.00 0.00 2.81 -1.24 -2.00 117.12 122.56 2gt3 n MET 49 Ca -0.14 -1.99 0.00 0.00 -1.81 0.00 0.00 57.70 53.76 2gt3 n MET 49 Cb 0.47 -1.15 0.00 0.00 -0.71 0.00 0.00 33.22 31.83 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 -0.92 0.70 3.32 3.03 0.00 -1.23 -4.89 105.19 105.20 2gt3 n GLY 50 Ca 0.10 -1.22 -0.59 0.00 0.00 0.00 0.00 46.02 44.31 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 7.51 0.00 0.20 0.00 1.16 -1.26 -2.29 117.46 122.78 2gt3 n PHE 52 Ca 0.51 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 56.00 2gt3 n PHE 52 Cb -0.01 -0.12 -0.04 0.00 -1.61 0.00 0.00 39.48 37.71 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 0.42 -0.52 0.03 2.97 6.55 -1.91 -2.02 115.95 121.47 2gt3 h TRP 53 Ca 0.00 -0.01 -0.16 0.00 0.95 0.00 0.00 58.89 59.66 2gt3 h TRP 53 Cb 0.22 0.17 0.01 0.00 -0.86 0.00 0.00 29.16 28.71 2gt3 h TRP 53 CO 0.00 -0.33 -0.66 0.78 -1.05 0.00 0.00 178.44 177.18 2gt3 h GLY 54 N -1.04 0.44 0.20 1.49 0.00 -1.83 -2.61 103.07 99.72 2gt3 h GLY 54 Ca -0.06 -0.83 0.02 0.00 0.00 0.00 0.00 47.33 46.46 2gt3 h GLY 54 CO 0.09 0.74 -0.44 -2.08 0.00 0.00 0.00 176.54 174.85 2gt3 h VAL 55 N -0.15 0.13 -0.94 4.60 2.07 -1.61 0.88 116.25 121.23 2gt3 h VAL 55 Ca -0.09 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.51 2gt3 h VAL 55 Cb 1.40 0.13 -0.07 0.00 -1.52 0.00 0.00 31.29 31.22 2gt3 h VAL 55 CO 0.13 0.00 0.58 -0.08 0.02 0.00 0.00 177.57 178.22 2gt3 h GLU 56 N -0.64 0.97 0.36 1.57 4.81 -1.47 0.19 114.58 120.37 2gt3 h GLU 56 Ca 0.03 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 2gt3 h GLU 56 Cb 0.68 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.85 2gt3 h GLU 56 CO -0.28 0.64 -0.17 -0.09 -0.73 0.00 0.00 179.01 178.38 2gt3 h ARG 57 N 1.00 -0.47 -0.37 1.92 1.12 -0.78 0.23 114.38 117.03 2gt3 h ARG 57 Ca 0.43 0.03 0.06 0.00 -1.11 0.00 0.00 59.98 59.39 2gt3 h ARG 57 Cb 0.30 0.11 -0.05 0.00 -0.01 0.00 0.00 29.97 30.31 2gt3 h ARG 57 CO -0.21 -0.26 0.07 1.25 -3.11 0.00 0.00 179.97 177.70 2gt3 h LEU 58 N -0.57 0.01 -1.72 3.80 5.85 0.13 0.69 115.31 123.50 2gt3 h LEU 58 Ca -0.05 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2gt3 h LEU 58 Cb 0.42 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 2gt3 h LEU 58 CO 0.08 0.04 0.11 -0.26 -0.34 0.00 0.00 178.44 178.07 2gt3 h PHE 59 N 0.20 0.28 -0.05 1.25 -1.00 -0.46 -0.09 116.94 117.08 2gt3 h PHE 59 Ca 0.18 0.00 -0.25 0.00 2.81 0.00 0.00 57.97 60.71 2gt3 h PHE 59 Cb 0.21 -0.09 0.02 0.00 3.61 0.00 0.00 35.95 39.70 2gt3 h PHE 59 CO -0.19 0.21 -0.96 2.35 -1.61 0.00 0.00 178.31 178.10 2gt3 h TRP 60 N 0.29 1.05 0.00 -0.55 2.91 0.15 -2.79 115.95 117.01 2gt3 h TRP 60 Ca 0.08 -0.54 0.00 0.00 1.13 0.00 0.00 58.89 59.56 2gt3 h TRP 60 Cb 0.02 -0.13 0.00 0.00 -0.51 0.00 0.00 29.16 28.54 2gt3 h TRP 60 CO 0.00 1.37 0.00 1.04 -1.03 0.00 0.00 178.44 179.83 2gt3 n GLN 61 N -3.88 0.40 -2.89 2.65 6.02 0.22 -4.74 117.38 115.15 2gt3 n GLN 61 Ca -0.10 0.07 -0.38 0.00 -0.01 0.00 0.00 57.00 56.58 2gt3 n GLN 61 Cb 0.84 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 30.54 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 -2.38 4.48 -0.17 1.08 1.43 -0.16 -5.00 118.68 117.96 2gt3 s LEU 62 Ca 0.22 1.72 -0.29 0.00 -1.03 0.00 0.00 54.13 54.76 2gt3 s LEU 62 Cb 0.13 -3.64 -0.01 0.00 0.03 0.00 0.00 46.19 42.70 2gt3 s LEU 62 CO 0.27 0.08 1.28 -2.16 0.23 0.00 0.00 176.35 176.05 2gt3 s PRO 63 N -1.60 4.21 0.00 1.29 0.04 -1.26 -2.80 135.00 134.88 2gt3 s PRO 63 Ca 0.43 1.66 0.00 0.00 0.04 0.00 0.00 61.00 63.12 2gt3 s PRO 63 Cb -0.21 -3.78 0.00 0.00 0.04 0.00 0.00 34.50 30.55 2gt3 s PRO 63 CO 0.26 -0.74 0.00 0.41 0.04 0.00 0.00 177.00 176.97 2gt3 n GLY 64 N 3.67 1.89 3.58 0.56 0.00 -1.26 -4.64 105.19 109.00 2gt3 n GLY 64 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.02 4.76 -0.10 1.61 1.01 -1.12 -2.48 120.40 122.07 2gt3 s VAL 65 Ca 0.00 0.81 -0.21 0.00 0.00 0.00 0.00 61.98 62.57 2gt3 s VAL 65 Cb 0.00 -4.19 -0.18 0.00 0.00 0.00 0.00 36.38 32.01 2gt3 s VAL 65 CO 0.00 -0.42 0.70 0.22 0.00 0.00 0.00 175.10 175.59 2gt3 h TYR 66 N 8.49 -0.05 -3.64 5.22 3.20 0.19 -3.48 116.97 126.90 2gt3 h TYR 66 Ca -0.25 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.54 2gt3 h TYR 66 Cb 1.10 0.02 -0.14 0.00 1.54 0.00 0.00 36.73 39.24 2gt3 h TYR 66 CO 0.78 0.57 -0.30 -1.12 -1.64 0.00 0.00 178.16 176.46 2gt3 s SER 67 N -5.86 0.01 0.09 -2.11 0.01 -1.07 -4.87 113.70 99.90 2gt3 s SER 67 Ca -0.14 -0.51 0.01 0.00 1.31 0.00 0.00 55.95 56.63 2gt3 s SER 67 Cb -0.01 0.36 -0.04 0.00 0.21 0.00 0.00 66.02 66.54 2gt3 s SER 67 CO 0.51 -0.73 -0.06 0.42 0.41 0.00 0.00 173.24 173.79 2gt3 s THR 68 N -3.59 0.58 0.04 1.44 -4.23 -1.26 0.26 115.64 108.89 2gt3 s THR 68 Ca 0.03 -1.91 -0.01 0.00 -1.18 0.00 0.00 61.69 58.62 2gt3 s THR 68 Cb 0.03 -1.65 -0.04 0.00 1.34 0.00 0.00 72.50 72.19 2gt3 s THR 68 CO -0.10 -0.90 -0.03 0.00 -0.54 0.00 0.00 174.62 173.05 2gt3 s ALA 69 N -3.69 0.43 0.00 3.99 0.00 0.83 -4.94 121.76 118.37 2gt3 s ALA 69 Ca 0.11 -1.06 0.08 0.00 0.00 0.00 0.00 51.96 51.09 2gt3 s ALA 69 Cb 0.06 0.24 -0.02 0.00 0.00 0.00 0.00 23.12 23.39 2gt3 s ALA 69 CO -0.06 -0.31 -0.25 0.00 0.00 0.00 0.00 175.76 175.14 2gt3 s ALA 70 N -3.29 2.24 0.00 0.00 0.00 -1.26 -1.82 121.76 117.63 2gt3 s ALA 70 Ca 0.01 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 50.81 2gt3 s ALA 70 Cb 0.03 -0.57 0.00 0.00 0.00 0.00 0.00 23.12 22.59 2gt3 s ALA 70 CO -0.08 0.54 0.00 0.41 0.00 0.00 0.00 175.76 176.63 2gt3 n GLY 71 N 2.19 1.21 3.04 0.00 0.00 -0.65 0.15 105.19 111.13 2gt3 n GLY 71 Ca -0.16 -0.60 -0.11 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.13 0.51 0.14 1.61 2.02 -0.98 -2.49 117.35 116.04 2gt3 s TYR 72 Ca 0.00 -0.61 -0.25 0.00 -0.37 0.00 0.00 57.07 55.84 2gt3 s TYR 72 Cb 0.00 -0.33 0.07 0.00 -0.40 0.00 0.00 41.96 41.30 2gt3 s TYR 72 CO 0.00 -0.16 1.01 -0.08 -1.57 0.00 0.00 175.55 174.75 2gt3 s THR 73 N -1.87 0.00 0.00 -0.71 -1.32 -0.40 -2.49 115.64 108.84 2gt3 s THR 73 Ca -0.09 -0.61 0.00 0.00 -1.21 0.00 0.00 61.69 59.79 2gt3 s THR 73 Cb -0.07 -2.12 0.00 0.00 -1.51 0.00 0.00 72.50 68.80 2gt3 s THR 73 CO -0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.00 2gt3 n GLY 74 N -0.51 2.22 0.76 6.08 0.00 -1.26 0.14 105.19 112.61 2gt3 n GLY 74 Ca -0.06 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.00 -0.08 0.03 -0.02 0.00 -0.69 -4.60 105.19 97.83 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 -1.96 0.00 -1.67 1.61 9.36 -0.69 -4.80 117.16 119.00 2gt3 n TYR 76 Ca 0.03 0.00 -0.44 0.00 3.32 0.00 0.00 57.90 60.81 2gt3 n TYR 76 Cb 0.11 -0.30 -0.04 0.00 -0.63 0.00 0.00 39.34 38.49 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 -2.32 0.71 -2.47 2.97 -1.04 -1.18 -4.92 114.28 106.01 2gt3 n THR 77 Ca -0.11 -0.13 -0.42 0.00 -2.04 0.00 0.00 64.05 61.36 2gt3 n THR 77 Cb 0.69 -2.18 -0.03 0.00 -1.82 0.00 0.00 70.33 66.98 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 4.31 4.51 -0.98 -2.82 0.04 -1.26 -3.75 135.00 135.05 2gt3 s PRO 78 Ca 0.90 1.73 -0.10 0.00 0.04 0.00 0.00 61.00 63.57 2gt3 s PRO 78 Cb -0.51 -3.32 -0.01 0.00 0.04 0.00 0.00 34.50 30.69 2gt3 s PRO 78 CO 0.45 -0.09 0.76 0.09 0.04 0.00 0.00 177.00 178.25 2gt3 n ASN 79 N 3.15 -6.07 -4.79 6.66 4.13 -1.26 -3.04 115.26 114.04 2gt3 n ASN 79 Ca 0.06 -0.73 -0.29 0.00 1.68 0.00 0.00 54.58 55.29 2gt3 n ASN 79 Cb 0.46 -3.86 0.13 0.00 -1.54 0.00 0.00 39.78 34.97 2gt3 n ASN 79 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 2gt3 s PRO 80 N -4.86 1.31 0.15 3.52 0.04 -1.25 -4.08 135.00 129.84 2gt3 s PRO 80 Ca 0.29 0.35 0.10 0.00 0.04 0.00 0.00 61.00 61.78 2gt3 s PRO 80 Cb -0.09 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 2gt3 s PRO 80 CO 0.82 -2.09 -0.23 0.99 0.04 0.00 0.00 177.00 176.53 2gt3 s THR 81 N -3.26 2.08 0.22 1.26 2.01 -1.26 -5.01 115.64 111.68 2gt3 s THR 81 Ca 0.63 -1.84 -0.09 0.00 0.31 0.00 0.00 61.69 60.70 2gt3 s THR 81 Cb -0.15 -1.91 0.19 0.00 0.01 0.00 0.00 72.50 70.64 2gt3 s THR 81 CO 0.53 -0.10 1.69 0.22 -0.69 0.00 0.00 174.62 176.27 2gt3 h TYR 82 N 3.56 0.15 -0.91 4.92 3.20 -1.98 0.48 116.97 126.40 2gt3 h TYR 82 Ca -0.46 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.45 2gt3 h TYR 82 Cb 1.19 0.03 -0.05 0.00 1.54 0.00 0.00 36.73 39.45 2gt3 h TYR 82 CO 0.65 -0.08 0.60 0.00 -1.64 0.00 0.00 178.16 177.69 2gt3 h ARG 83 N 0.22 1.20 -0.03 1.82 3.08 -1.98 0.41 114.38 119.10 2gt3 h ARG 83 Ca 0.34 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.31 2gt3 h ARG 83 Cb 0.54 -0.27 -0.00 0.00 0.08 0.00 0.00 29.97 30.32 2gt3 h ARG 83 CO -0.46 0.79 -0.01 0.93 -1.07 0.00 0.00 179.97 180.15 2gt3 h GLU 84 N 1.23 0.06 -0.61 0.04 5.08 -1.14 -2.63 114.58 116.62 2gt3 h GLU 84 Ca 0.33 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.66 2gt3 h GLU 84 Cb -0.14 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.07 2gt3 h GLU 84 CO -0.07 0.45 0.35 0.28 -1.00 0.00 0.00 179.01 179.02 2gt3 h VAL 85 N -0.33 1.18 -0.84 3.13 2.07 0.17 -0.19 116.25 121.44 2gt3 h VAL 85 Ca 0.01 -0.41 0.07 0.00 0.82 0.00 0.00 66.70 67.18 2gt3 h VAL 85 Cb 0.43 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 30.47 2gt3 h VAL 85 CO 0.00 0.19 0.55 0.00 0.02 0.00 0.00 177.57 178.33 2gt3 h SER 87 N 0.92 0.13 0.00 0.00 0.87 -0.70 -3.48 113.55 111.28 2gt3 h SER 87 Ca 0.37 -0.49 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2gt3 h SER 87 Cb 0.25 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 2gt3 h SER 87 CO -0.13 0.59 0.00 0.61 -0.53 0.00 0.00 176.83 177.37 2gt3 n GLY 88 N 0.23 0.97 1.66 5.77 0.00 -0.57 -4.94 105.19 108.32 2gt3 n GLY 88 Ca -0.08 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 45.98 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 0.08 4.96 -0.03 1.61 10.43 -1.24 -4.01 116.55 128.36 2gt3 n ASP 89 Ca 0.00 -2.63 -0.03 0.00 2.57 0.00 0.00 54.79 54.71 2gt3 n ASP 89 Cb 0.00 -0.62 -0.05 0.00 1.84 0.00 0.00 41.12 42.29 2gt3 n ASP 89 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 2gt3 n THR 90 N 0.86 0.40 -0.74 -3.53 -2.24 -1.26 -1.14 114.28 106.63 2gt3 n THR 90 Ca 0.25 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2gt3 n THR 90 Cb 0.98 -0.71 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 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 2.55 0.78 3.80 3.38 0.00 -1.26 -1.71 105.19 112.73 2gt3 n GLY 91 Ca -0.10 0.00 -0.37 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 -2.92 3.70 0.37 1.61 3.76 -1.26 -1.70 115.29 118.84 2gt3 s HIS 92 Ca 0.00 1.51 0.08 0.00 -0.15 0.00 0.00 55.06 56.51 2gt3 s HIS 92 Cb 0.00 -2.71 -0.06 0.00 1.11 0.00 0.00 32.58 30.92 2gt3 s HIS 92 CO 0.00 0.33 0.01 0.00 -0.85 0.00 0.00 174.74 174.24 2gt3 s ALA 93 N -1.49 3.20 -0.18 -1.40 0.00 0.37 -4.67 121.76 117.58 2gt3 s ALA 93 Ca 0.44 -2.08 -0.29 0.00 0.00 0.00 0.00 51.96 50.02 2gt3 s ALA 93 Cb -0.18 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 22.72 2gt3 s ALA 93 CO 0.22 -0.00 1.58 -1.21 0.00 0.00 0.00 175.76 176.35 2gt3 s GLU 94 N -3.72 3.93 0.06 0.00 8.01 -0.85 -1.28 118.70 124.85 2gt3 s GLU 94 Ca 0.35 1.77 0.03 0.00 0.01 0.00 0.00 54.97 57.13 2gt3 s GLU 94 Cb 0.03 -3.99 -0.03 0.00 -4.31 0.00 0.00 34.13 25.83 2gt3 s GLU 94 CO 0.19 -1.13 -0.10 0.00 0.01 0.00 0.00 175.26 174.23 2gt3 s ALA 95 N 4.75 0.82 -0.02 5.21 0.00 -1.04 -3.73 121.76 127.75 2gt3 s ALA 95 Ca 0.70 -0.92 -0.02 0.00 0.00 0.00 0.00 51.96 51.72 2gt3 s ALA 95 Cb -0.26 0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.88 2gt3 s ALA 95 CO 0.27 0.01 0.06 0.14 0.00 0.00 0.00 175.76 176.24 2gt3 s VAL 96 N -1.65 0.01 -0.32 0.00 -7.23 -1.02 -1.63 120.40 108.56 2gt3 s VAL 96 Ca -0.05 -0.11 -0.17 0.00 -1.81 0.00 0.00 61.98 59.85 2gt3 s VAL 96 Cb -0.08 -0.12 -0.01 0.00 0.56 0.00 0.00 36.38 36.72 2gt3 s VAL 96 CO 0.00 -0.06 0.45 -0.13 -0.31 0.00 0.00 175.10 175.06 2gt3 s ARG 97 N -0.16 3.73 -0.14 4.82 0.52 -0.76 -2.67 118.95 124.30 2gt3 s ARG 97 Ca -0.02 -0.13 -0.04 0.00 -0.52 0.00 0.00 55.73 55.02 2gt3 s ARG 97 Cb -0.02 -3.76 -0.03 0.00 0.52 0.00 0.00 34.95 31.66 2gt3 s ARG 97 CO 0.00 -0.51 -0.02 0.42 0.02 0.00 0.00 175.30 175.21 2gt3 s ILE 98 N 2.23 4.04 -0.29 1.52 1.09 0.30 -0.12 121.20 129.98 2gt3 s ILE 98 Ca 0.17 -0.31 -0.05 0.00 -1.10 0.00 0.00 60.65 59.35 2gt3 s ILE 98 Cb -0.16 -2.76 0.02 0.00 -1.06 0.00 0.00 42.46 38.50 2gt3 s ILE 98 CO 0.12 0.51 0.04 -0.69 -0.10 0.00 0.00 174.94 174.82 2gt3 s VAL 99 N 0.11 3.59 0.20 2.92 1.01 0.14 0.22 120.40 128.59 2gt3 s VAL 99 Ca 0.00 -0.88 0.02 0.00 0.00 0.00 0.00 61.98 61.12 2gt3 s VAL 99 Cb -0.13 -2.88 -0.05 0.00 0.00 0.00 0.00 36.38 33.32 2gt3 s VAL 99 CO 0.02 0.07 0.02 -0.72 0.00 0.00 0.00 175.10 174.49 2gt3 s TYR 100 N 1.42 1.33 -0.13 5.22 -0.85 0.17 0.20 117.35 124.72 2gt3 s TYR 100 Ca 0.01 -1.05 -0.08 0.00 -0.52 0.00 0.00 57.07 55.43 2gt3 s TYR 100 Cb -0.17 -0.77 -0.04 0.00 0.38 0.00 0.00 41.96 41.36 2gt3 s TYR 100 CO 0.00 -0.22 0.16 0.34 -1.52 0.00 0.00 175.55 174.32 2gt3 s ASP 101 N -3.22 6.39 0.22 -0.18 -1.08 -1.03 -0.94 116.67 116.83 2gt3 s ASP 101 Ca 0.28 0.46 0.25 0.00 -0.52 0.00 0.00 52.55 53.02 2gt3 s ASP 101 Cb 0.06 -2.09 0.90 0.00 -1.46 0.00 0.00 42.92 40.33 2gt3 s ASP 101 CO 0.07 0.35 1.74 -0.81 0.52 0.00 0.00 175.17 177.04 2gt3 n PRO 102 N 2.33 0.22 0.10 4.34 -0.04 -1.25 -0.58 135.00 140.12 2gt3 n PRO 102 Ca -0.18 0.31 0.12 0.00 -0.04 0.00 0.00 63.50 63.70 2gt3 n PRO 102 Cb 0.54 -1.82 0.10 0.00 -0.04 0.00 0.00 33.50 32.28 2gt3 n PRO 102 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2gt3 h SER 103 N 0.00 0.00 0.00 3.54 0.87 -1.93 -3.40 113.55 112.62 2gt3 h SER 103 Ca 0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 2gt3 h SER 103 Cb 0.54 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 2gt3 h SER 103 CO 0.00 0.05 -0.45 0.52 -0.53 0.00 0.00 176.83 176.42 2gt3 n VAL 104 N -2.45 0.74 -4.20 2.23 0.31 -0.99 -5.03 118.33 108.93 2gt3 n VAL 104 Ca 0.02 0.31 -0.25 0.00 -0.01 0.00 0.00 64.34 64.41 2gt3 n VAL 104 Cb 0.49 -1.86 -0.07 0.00 -0.91 0.00 0.00 33.84 31.50 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 -1.91 3.89 0.04 2.52 2.07 0.26 -4.96 121.20 123.11 2gt3 s ILE 105 Ca -0.13 -1.50 0.08 0.00 -1.41 0.00 0.00 60.65 57.68 2gt3 s ILE 105 Cb 0.02 -3.02 -0.03 0.00 0.13 0.00 0.00 42.46 39.55 2gt3 s ILE 105 CO 0.19 -0.22 -0.20 -0.94 -1.91 0.00 0.00 174.94 171.85 2gt3 s SER 106 N -3.33 3.61 0.46 4.50 1.04 -1.26 -3.83 113.70 114.89 2gt3 s SER 106 Ca 0.30 -0.46 0.24 0.00 0.48 0.00 0.00 55.95 56.51 2gt3 s SER 106 Cb -0.08 -0.52 1.26 0.00 0.10 0.00 0.00 66.02 66.77 2gt3 s SER 106 CO 0.21 0.26 1.82 0.10 0.98 0.00 0.00 173.24 176.61 2gt3 h TYR 107 N 4.68 0.38 -0.70 5.02 -0.00 -1.94 0.34 116.97 124.74 2gt3 h TYR 107 Ca -0.47 0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.27 2gt3 h TYR 107 Cb 1.15 -0.11 -0.03 0.00 0.00 0.00 0.00 36.73 37.73 2gt3 h TYR 107 CO 0.51 0.05 0.44 0.93 -0.00 0.00 0.00 178.16 180.10 2gt3 h GLU 108 N 0.24 0.94 -0.08 0.10 4.39 -1.96 0.90 114.58 119.12 2gt3 h GLU 108 Ca 0.53 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 60.15 2gt3 h GLU 108 Cb 1.62 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 30.06 2gt3 h GLU 108 CO -0.16 0.65 0.02 1.96 -1.16 0.00 0.00 179.01 180.31 2gt3 h GLN 109 N 0.95 0.12 -0.04 2.33 4.20 -0.75 0.06 115.11 121.99 2gt3 h GLN 109 Ca 0.25 -0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.96 2gt3 h GLN 109 Cb -0.07 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.66 2gt3 h GLN 109 CO -0.05 0.32 -0.17 -0.07 -0.67 0.00 0.00 178.83 178.19 2gt3 h LEU 110 N -0.09 -0.51 -0.57 1.46 3.38 -1.10 0.39 115.31 118.25 2gt3 h LEU 110 Ca 0.02 0.08 0.08 0.00 0.09 0.00 0.00 57.88 58.15 2gt3 h LEU 110 Cb 0.25 0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.16 2gt3 h LEU 110 CO 0.00 -0.23 0.23 -0.07 0.09 0.00 0.00 178.44 178.46 2gt3 h LEU 111 N -0.26 0.25 -0.41 1.67 3.38 -0.75 -0.25 115.31 118.94 2gt3 h LEU 111 Ca 0.07 0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.12 2gt3 h LEU 111 Cb 0.35 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.11 2gt3 h LEU 111 CO -0.19 0.16 0.23 -0.61 0.09 0.00 0.00 178.44 178.12 2gt3 h GLN 112 N 0.42 0.45 -0.80 1.13 4.15 0.03 -1.47 115.11 119.02 2gt3 h GLN 112 Ca 0.28 -0.03 0.09 0.00 0.77 0.00 0.00 58.65 59.76 2gt3 h GLN 112 Cb 0.31 -0.10 -0.07 0.00 0.21 0.00 0.00 27.48 27.83 2gt3 h GLN 112 CO -0.27 0.30 0.46 0.28 -1.93 0.00 0.00 178.83 177.67 2gt3 h VAL 113 N 0.47 0.92 -0.34 2.39 2.07 0.92 1.34 116.25 124.02 2gt3 h VAL 113 Ca 0.17 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 2gt3 h VAL 113 Cb 0.03 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 29.85 2gt3 h VAL 113 CO -0.09 0.14 0.14 -0.26 0.02 0.00 0.00 177.57 177.52 2gt3 h PHE 114 N 0.78 0.47 0.00 1.57 0.04 -0.21 1.52 116.94 121.12 2gt3 h PHE 114 Ca 0.38 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 61.14 2gt3 h PHE 114 Cb 0.33 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.33 2gt3 h PHE 114 CO -0.06 0.38 -0.62 -1.49 -0.60 0.00 0.00 178.31 175.91 2gt3 h TRP 115 N 0.48 0.00 -0.00 -0.55 -0.00 0.11 0.43 115.95 116.42 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 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.26 2gt3 h TRP 115 CO 0.00 0.00 -0.62 -1.91 -0.00 0.00 0.00 178.44 175.91 2gt3 n GLU 116 N -2.83 0.18 -0.04 0.49 2.13 0.44 -4.22 120.64 116.79 2gt3 n GLU 116 Ca 0.02 -0.12 -0.05 0.00 0.66 0.00 0.00 57.16 57.67 2gt3 n GLU 116 Cb 0.54 -1.50 -0.04 0.00 0.27 0.00 0.00 31.44 30.71 2gt3 n GLU 116 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2gt3 n ASN 117 N -1.30 3.42 -4.28 4.31 3.02 0.50 -4.46 115.26 116.47 2gt3 n ASN 117 Ca 0.06 -0.03 -0.15 0.00 -0.03 0.00 0.00 54.58 54.43 2gt3 n ASN 117 Cb 0.34 0.19 -0.10 0.00 -0.61 0.00 0.00 39.78 39.60 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 -2.16 1.40 -0.01 3.10 2.46 0.15 -4.68 115.29 115.54 2gt3 s HIS 118 Ca -0.08 -1.14 0.01 0.00 0.47 0.00 0.00 55.06 54.32 2gt3 s HIS 118 Cb 0.02 -0.80 -0.04 0.00 -0.13 0.00 0.00 32.58 31.64 2gt3 s HIS 118 CO 0.21 -0.32 0.00 0.34 -2.47 0.00 0.00 174.74 172.51 2gt3 s ASP 119 N -3.25 5.15 0.00 9.88 2.15 -1.26 -3.66 116.67 125.68 2gt3 s ASP 119 Ca 0.33 0.02 0.24 0.00 0.43 0.00 0.00 52.55 53.57 2gt3 s ASP 119 Cb 0.07 -1.36 1.43 0.00 -0.30 0.00 0.00 42.92 42.76 2gt3 s ASP 119 CO 0.10 0.29 1.80 -0.81 -0.17 0.00 0.00 175.17 176.39 2gt3 n PRO 120 N 1.50 0.75 -2.55 4.34 -0.04 -1.26 -3.07 135.00 134.66 2gt3 n PRO 120 Ca -0.15 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.10 2gt3 n PRO 120 Cb 0.53 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.50 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 -1.00 4.51 0.16 0.55 0.00 -1.26 0.47 120.51 123.94 2gt3 n ALA 121 Ca 0.18 -3.94 0.07 0.00 0.00 0.00 0.00 53.44 49.75 2gt3 n ALA 121 Cb 0.08 -0.67 0.24 0.00 0.00 0.00 0.00 19.45 19.10 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 -0.34 2.64 0.00 0.00 1.13 -1.18 -4.86 117.38 114.78 2gt3 n GLN 122 Ca 0.29 -1.95 0.00 0.00 -1.94 0.00 0.00 57.00 53.40 2gt3 n GLN 122 Cb 0.71 -1.59 0.00 0.00 0.11 0.00 0.00 30.24 29.47 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 1.06 0.87 2.01 1.08 0.00 -1.26 -1.37 105.19 107.58 2gt3 n GLY 123 Ca 0.18 -0.58 -0.16 0.00 0.00 0.00 0.00 46.02 45.45 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 0.40 1.87 -3.64 1.61 2.81 -1.26 -4.24 117.12 114.66 2gt3 n MET 124 Ca 0.00 -1.46 -0.15 0.00 -1.81 0.00 0.00 57.70 54.28 2gt3 n MET 124 Cb 0.00 -1.72 -0.07 0.00 -0.71 0.00 0.00 33.22 30.72 2gt3 n MET 124 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2gt3 s ARG 125 N -1.11 0.88 -0.09 0.03 0.52 -0.47 -2.56 118.95 116.14 2gt3 s ARG 125 Ca 0.39 -0.05 -0.03 0.00 -0.52 0.00 0.00 55.73 55.52 2gt3 s ARG 125 Cb 0.25 0.40 0.04 0.00 0.52 0.00 0.00 34.95 36.17 2gt3 s ARG 125 CO -0.06 -0.27 0.07 1.14 0.02 0.00 0.00 175.30 176.19 2gt3 s GLN 126 N -1.53 0.02 7.49 3.54 1.03 -0.93 -4.70 119.66 124.58 2gt3 s GLN 126 Ca -0.11 0.18 0.00 0.00 0.04 0.00 0.00 55.36 55.47 2gt3 s GLN 126 Cb -0.02 -1.07 0.00 0.00 0.03 0.00 0.00 33.01 31.95 2gt3 s GLN 126 CO 0.05 -0.47 0.00 0.41 -2.54 0.00 0.00 175.29 172.75 2gt3 n GLY 127 N 5.28 3.23 1.19 2.60 0.00 -1.26 -1.26 105.19 114.96 2gt3 n GLY 127 Ca -0.05 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 9.64 3.39 -4.49 1.61 4.13 -1.26 -4.97 115.26 123.31 2gt3 n ASN 128 Ca 0.00 -3.38 -0.31 0.00 1.68 0.00 0.00 54.58 52.57 2gt3 n ASN 128 Cb 0.00 -0.62 -0.12 0.00 -1.54 0.00 0.00 39.78 37.50 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 -2.06 4.00 0.02 6.41 1.11 -0.39 -5.13 116.67 120.63 2gt3 s ASP 129 Ca 0.45 -0.40 0.09 0.00 0.18 0.00 0.00 52.55 52.87 2gt3 s ASP 129 Cb 0.39 -0.70 -0.03 0.00 1.07 0.00 0.00 42.92 43.65 2gt3 s ASP 129 CO 0.06 0.24 -0.26 -1.38 1.18 0.00 0.00 175.17 175.01 2gt3 s HIS 130 N -0.99 2.33 0.00 4.23 -3.43 -1.26 -2.19 115.29 113.97 2gt3 s HIS 130 Ca 0.16 -0.42 0.00 0.00 -0.80 0.00 0.00 55.06 54.00 2gt3 s HIS 130 Cb -0.11 -1.43 0.00 0.00 -1.43 0.00 0.00 32.58 29.61 2gt3 s HIS 130 CO 0.07 0.07 0.00 0.41 -2.00 0.00 0.00 174.74 173.29 2gt3 n GLY 131 N 2.01 4.10 0.00 -1.38 0.00 -1.06 -4.94 105.19 103.92 2gt3 n GLY 131 Ca -0.17 -0.84 0.13 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.45 0.00 1.23 2.61 -1.04 -1.25 -2.29 114.28 112.09 2gt3 n THR 132 Ca 0.00 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.14 2gt3 n THR 132 Cb 0.00 -0.57 0.30 0.00 -1.82 0.00 0.00 70.33 68.24 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 -0.99 1.96 -1.68 -2.82 10.64 -1.26 -4.13 117.38 119.10 2gt3 n GLN 133 Ca 0.20 -1.43 -0.30 0.00 -1.83 0.00 0.00 57.00 53.64 2gt3 n GLN 133 Cb 0.09 -1.47 0.05 0.00 -0.86 0.00 0.00 30.24 28.05 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 0.73 3.00 -0.46 2.61 4.01 -0.97 -2.01 117.16 124.07 2gt3 n TYR 134 Ca 0.16 -2.63 0.00 0.00 -0.16 0.00 0.00 57.90 55.27 2gt3 n TYR 134 Cb 0.48 -0.89 0.00 0.00 -0.31 0.00 0.00 39.34 38.61 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 -0.81 0.58 -3.72 -0.72 0.63 -1.26 -3.39 116.66 107.98 2gt3 n ARG 135 Ca 0.53 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 57.28 2gt3 n ARG 135 Cb 0.81 0.00 -0.17 0.00 0.45 0.00 0.00 32.46 33.55 2gt3 n ARG 135 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2gt3 s SER 136 N -1.00 0.79 0.13 6.15 0.15 -1.26 -3.49 113.70 115.17 2gt3 s SER 136 Ca 0.00 0.06 -0.13 0.00 0.70 0.00 0.00 55.95 56.58 2gt3 s SER 136 Cb 0.00 -0.13 0.01 0.00 -1.71 0.00 0.00 66.02 64.19 2gt3 s SER 136 CO 0.00 -0.20 0.34 0.00 1.20 0.00 0.00 173.24 174.57 2gt3 s ALA 137 N 1.77 -0.53 -0.01 5.45 0.00 -0.85 -2.24 121.76 125.34 2gt3 s ALA 137 Ca -0.00 -0.41 0.04 0.00 0.00 0.00 0.00 51.96 51.58 2gt3 s ALA 137 Cb -0.12 0.69 -0.01 0.00 0.00 0.00 0.00 23.12 23.68 2gt3 s ALA 137 CO -0.03 -0.63 -0.12 0.42 0.00 0.00 0.00 175.76 175.40 2gt3 s ILE 138 N -3.87 0.99 -0.43 0.00 1.01 -1.05 -0.46 121.20 117.39 2gt3 s ILE 138 Ca 0.07 -0.52 0.02 0.00 0.00 0.00 0.00 60.65 60.23 2gt3 s ILE 138 Cb 0.03 -0.83 0.15 0.00 0.01 0.00 0.00 42.46 41.81 2gt3 s ILE 138 CO -0.08 0.28 0.27 -0.31 0.00 0.00 0.00 174.94 175.11 2gt3 s TYR 139 N -0.19 1.53 1.05 3.97 2.02 0.10 -2.69 117.35 123.15 2gt3 s TYR 139 Ca 0.03 -2.22 -0.17 0.00 -0.37 0.00 0.00 57.07 54.34 2gt3 s TYR 139 Cb -0.06 -1.45 0.23 0.00 -0.40 0.00 0.00 41.96 40.27 2gt3 s TYR 139 CO -0.00 -0.79 1.20 -1.25 -1.57 0.00 0.00 175.55 173.15 2gt3 s PRO 140 N 0.38 -0.05 -0.07 -1.71 0.04 -1.26 -2.65 135.00 129.68 2gt3 s PRO 140 Ca 0.21 -0.16 0.05 0.00 0.04 0.00 0.00 61.00 61.15 2gt3 s PRO 140 Cb -0.17 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.55 2gt3 s PRO 140 CO -0.05 -2.92 0.00 1.28 0.04 0.00 0.00 177.00 175.36 2gt3 n LEU 141 N -4.18 0.56 -4.80 -3.56 7.99 -1.26 -3.88 117.00 107.87 2gt3 n LEU 141 Ca 0.13 -0.01 -0.22 0.00 -0.01 0.00 0.00 56.01 55.90 2gt3 n LEU 141 Cb 0.59 0.08 -0.05 0.00 -0.11 0.00 0.00 43.42 43.94 2gt3 n LEU 141 CO 0.47 0.27 -0.11 0.42 -1.51 0.00 0.00 177.39 176.93 2gt3 s THR 142 N -2.18 2.88 0.15 -5.08 -4.23 -1.26 -5.04 115.64 100.88 2gt3 s THR 142 Ca -0.05 -1.53 -0.03 0.00 -1.18 0.00 0.00 61.69 58.90 2gt3 s THR 142 Cb 0.02 -3.03 -0.15 0.00 1.34 0.00 0.00 72.50 70.68 2gt3 s THR 142 CO 0.28 -0.09 1.35 1.55 -0.54 0.00 0.00 174.62 177.17 2gt3 h PRO 143 N 1.31 0.41 -0.20 3.99 0.13 -1.99 -2.84 132.00 132.81 2gt3 h PRO 143 Ca -0.43 -0.40 -0.02 0.00 -0.87 0.00 0.00 66.00 64.27 2gt3 h PRO 143 Cb 1.26 0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.48 2gt3 h PRO 143 CO 0.62 1.06 0.02 1.49 -0.23 0.00 0.00 178.00 180.96 2gt3 h GLU 144 N 0.25 0.29 -0.13 0.86 4.57 -1.99 0.18 114.58 118.62 2gt3 h GLU 144 Ca -0.06 -0.04 -0.19 0.00 -1.18 0.00 0.00 59.36 57.89 2gt3 h GLU 144 Cb 1.48 -0.05 0.01 0.00 -0.16 0.00 0.00 28.75 30.02 2gt3 h GLU 144 CO 0.15 0.30 -0.66 1.96 -1.18 0.00 0.00 179.01 179.59 2gt3 h GLN 145 N 0.29 0.67 -0.46 1.92 4.20 -1.96 -1.80 115.11 117.96 2gt3 h GLN 145 Ca 0.07 -0.55 -0.02 0.00 0.06 0.00 0.00 58.65 58.21 2gt3 h GLN 145 Cb 0.17 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 2gt3 h GLN 145 CO 0.00 1.16 0.20 0.22 -0.67 0.00 0.00 178.83 179.74 2gt3 h ASP 146 N 0.34 0.62 -0.68 1.46 -0.00 -1.17 0.95 116.42 117.94 2gt3 h ASP 146 Ca -0.05 -0.16 -0.03 0.00 -0.00 0.00 0.00 57.03 56.80 2gt3 h ASP 146 Cb 1.29 -0.16 -0.03 0.00 -0.00 0.00 0.00 39.33 40.43 2gt3 h ASP 146 CO 0.14 0.61 0.34 0.00 -0.00 0.00 0.00 179.24 180.32 2gt3 h ALA 147 N 1.04 1.27 -0.18 -0.78 0.00 -0.99 0.28 119.26 119.89 2gt3 h ALA 147 Ca 0.15 -0.14 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 2gt3 h ALA 147 Cb 0.17 -0.28 0.01 0.00 0.00 0.00 0.00 17.79 17.68 2gt3 h ALA 147 CO -0.01 0.57 -0.67 0.00 0.00 0.00 0.00 179.25 179.13 2gt3 h ALA 148 N 1.37 0.32 0.40 0.00 0.00 -0.71 0.76 119.26 121.41 2gt3 h ALA 148 Ca 0.24 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 2gt3 h ALA 148 Cb 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2gt3 h ALA 148 CO -0.03 0.62 -0.19 0.00 0.00 0.00 0.00 179.25 179.65 2gt3 h ALA 149 N 0.57 -0.54 -0.17 0.00 0.00 0.15 0.61 119.26 119.87 2gt3 h ALA 149 Ca -0.03 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 2gt3 h ALA 149 Cb 1.30 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 2gt3 h ALA 149 CO 0.14 -0.79 -0.10 0.07 0.00 0.00 0.00 179.25 178.56 2gt3 h ARG 150 N -0.56 0.27 -0.14 0.00 0.11 -0.51 -1.47 114.38 112.07 2gt3 h ARG 150 Ca -0.06 -0.06 -0.03 0.00 0.10 0.00 0.00 59.98 59.93 2gt3 h ARG 150 Cb 0.43 -0.04 -0.00 0.00 1.11 0.00 0.00 29.97 31.47 2gt3 h ARG 150 CO 0.09 0.38 -0.05 0.00 0.10 0.00 0.00 179.97 180.50 2gt3 h ALA 151 N 1.64 0.20 -0.76 0.08 0.00 -0.33 -1.93 119.26 118.16 2gt3 h ALA 151 Ca 0.05 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.75 2gt3 h ALA 151 Cb 0.35 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 2gt3 h ALA 151 CO 0.02 -0.03 0.50 0.66 0.00 0.00 0.00 179.25 180.40 2gt3 h SER 152 N -0.03 0.81 0.04 0.00 4.64 0.62 -1.02 113.55 118.60 2gt3 h SER 152 Ca 0.03 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2gt3 h SER 152 Cb 0.49 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 2gt3 h SER 152 CO 0.02 0.57 -0.02 0.25 -0.87 0.00 0.00 176.83 176.77 2gt3 h LEU 153 N 0.95 -0.05 -1.34 5.97 6.46 -1.08 -1.28 115.31 124.94 2gt3 h LEU 153 Ca 0.30 -0.09 0.09 0.00 -0.12 0.00 0.00 57.88 58.06 2gt3 h LEU 153 Cb 0.02 0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 39.91 2gt3 h LEU 153 CO -0.08 0.05 0.51 -0.08 -0.62 0.00 0.00 178.44 178.22 2gt3 h GLU 154 N -0.15 0.73 -0.22 1.25 4.57 -0.64 0.57 114.58 120.69 2gt3 h GLU 154 Ca -0.01 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 2gt3 h GLU 154 Cb 0.13 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 2gt3 h GLU 154 CO 0.01 0.48 0.09 -0.09 -1.18 0.00 0.00 179.01 178.33 2gt3 h ARG 155 N 0.75 0.32 -0.40 1.92 9.65 -0.65 -2.68 114.38 123.29 2gt3 h ARG 155 Ca 0.36 -0.05 -0.06 0.00 -1.10 0.00 0.00 59.98 59.12 2gt3 h ARG 155 Cb 0.39 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.90 2gt3 h ARG 155 CO -0.13 0.36 -0.00 0.35 2.80 0.00 0.00 179.97 183.34 2gt3 h PHE 156 N 0.20 0.67 -0.89 2.20 3.04 -0.17 -1.04 116.94 120.96 2gt3 h PHE 156 Ca 0.07 -0.08 0.14 0.00 3.98 0.00 0.00 57.97 62.09 2gt3 h PHE 156 Cb 0.16 -0.19 -0.09 0.00 2.56 0.00 0.00 35.95 38.38 2gt3 h PHE 156 CO -0.01 0.65 0.49 0.37 -2.02 0.00 0.00 178.31 177.78 2gt3 h GLN 157 N 0.61 0.68 0.13 1.11 5.75 -0.59 1.23 115.11 124.03 2gt3 h GLN 157 Ca 0.12 -0.04 -0.28 0.00 -0.15 0.00 0.00 58.65 58.31 2gt3 h GLN 157 Cb 0.39 -0.15 0.01 0.00 1.07 0.00 0.00 27.48 28.79 2gt3 h GLN 157 CO 0.01 0.45 -1.24 0.00 -2.65 0.00 0.00 178.83 175.40 2gt3 h ALA 158 N 1.56 0.09 -0.39 3.38 0.00 -1.29 -3.22 119.26 119.38 2gt3 h ALA 158 Ca 0.48 -0.87 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 2gt3 h ALA 158 Cb 0.64 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2gt3 h ALA 158 CO -0.34 0.94 0.04 0.00 0.00 0.00 0.00 179.25 179.88 2gt3 h ALA 159 N 0.55 1.33 -0.22 0.00 0.00 0.31 -2.74 119.26 118.48 2gt3 h ALA 159 Ca -0.14 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.61 2gt3 h ALA 159 Cb 1.96 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 19.55 2gt3 h ALA 159 CO 0.21 0.47 -0.02 0.52 0.00 0.00 0.00 179.25 180.43 2gt3 h MET 160 N 0.59 0.04 -0.96 0.00 2.07 0.14 -0.80 114.93 116.02 2gt3 h MET 160 Ca 0.13 -0.00 0.17 0.00 -2.07 0.00 0.00 59.70 57.93 2gt3 h MET 160 Cb 0.32 -0.01 -0.09 0.00 -1.87 0.00 0.00 31.60 29.95 2gt3 h MET 160 CO 0.01 0.03 0.61 -0.07 1.07 0.00 0.00 176.91 178.55 2gt3 h LEU 161 N 0.05 0.69 -1.60 1.22 -0.00 -1.55 0.90 115.31 115.01 2gt3 h LEU 161 Ca 0.11 0.06 -0.04 0.00 -0.00 0.00 0.00 57.88 58.01 2gt3 h LEU 161 Cb 0.14 -0.07 -0.01 0.00 -0.00 0.00 0.00 40.66 40.73 2gt3 h LEU 161 CO -0.19 0.29 -0.18 0.00 -0.00 0.00 0.00 178.44 178.36 2gt3 h ALA 162 N 1.61 1.67 -0.48 1.53 0.00 -1.09 -0.00 119.26 122.50 2gt3 h ALA 162 Ca 0.51 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 55.11 2gt3 h ALA 162 Cb 0.87 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.54 2gt3 h ALA 162 CO -0.27 0.25 0.18 0.00 0.00 0.00 0.00 179.25 179.40 2gt3 n ALA 163 N -2.50 3.85 -2.80 0.00 0.00 0.29 -4.85 120.51 114.50 2gt3 n ALA 163 Ca -0.02 -1.48 -0.14 0.00 0.00 0.00 0.00 53.44 51.80 2gt3 n ALA 163 Cb 0.25 -1.17 -0.01 0.00 0.00 0.00 0.00 19.45 18.53 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 0.00 -3.04 -4.23 0.00 2.03 -0.01 -4.87 116.55 106.42 2gt3 n ASP 164 Ca 0.26 0.05 -0.42 0.00 0.52 0.00 0.00 54.79 55.20 2gt3 n ASP 164 Cb 1.02 -2.60 -0.07 0.00 -0.72 0.00 0.00 41.12 38.74 2gt3 n ASP 164 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 2gt3 s ASP 165 N -2.27 5.83 -0.00 1.67 1.11 -0.14 -4.88 116.67 117.99 2gt3 s ASP 165 Ca 0.15 -1.93 0.08 0.00 0.18 0.00 0.00 52.55 51.03 2gt3 s ASP 165 Cb -0.08 -2.06 0.24 0.00 1.07 0.00 0.00 42.92 42.10 2gt3 s ASP 165 CO 0.18 -0.72 1.20 -0.90 1.18 0.00 0.00 175.17 176.11 2gt3 n ASP 166 N 4.93 1.50 -4.54 0.27 5.75 -1.26 -3.68 116.55 119.52 2gt3 n ASP 166 Ca -0.08 -2.01 -0.32 0.00 -0.01 0.00 0.00 54.79 52.37 2gt3 n ASP 166 Cb 0.41 -0.19 0.14 0.00 -1.03 0.00 0.00 41.12 40.44 2gt3 n ASP 166 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 2gt3 n ARG 167 N 0.31 -0.27 -3.56 0.11 0.63 -1.26 -4.96 116.66 107.66 2gt3 n ARG 167 Ca 0.09 -0.02 -0.38 0.00 -0.92 0.00 0.00 57.85 56.63 2gt3 n ARG 167 Cb 0.24 -2.11 -0.10 0.00 0.45 0.00 0.00 32.46 30.95 2gt3 n ARG 167 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 2gt3 s HIS 168 N -2.42 3.29 -0.07 -0.14 5.65 -1.26 -5.02 115.29 115.31 2gt3 s HIS 168 Ca 0.63 0.28 -0.37 0.00 0.25 0.00 0.00 55.06 55.85 2gt3 s HIS 168 Cb -0.24 -2.39 -0.15 0.00 -1.18 0.00 0.00 32.58 28.63 2gt3 s HIS 168 CO 0.62 -0.06 1.63 1.51 -0.65 0.00 0.00 174.74 177.79 2gt3 n ILE 169 N 4.64 0.22 -0.01 0.89 3.06 -1.26 -4.79 119.36 122.11 2gt3 n ILE 169 Ca -0.13 -0.04 0.10 0.00 -2.50 0.00 0.00 62.75 60.18 2gt3 n ILE 169 Cb 0.52 -1.28 -0.16 0.00 0.54 0.00 0.00 39.64 39.25 2gt3 n ILE 169 CO 0.00 0.00 0.00 1.07 -2.50 0.00 0.00 176.55 175.12 2gt3 n THR 170 N 3.91 0.07 -1.68 9.51 5.66 -0.21 -4.96 114.28 126.58 2gt3 n THR 170 Ca 0.22 -0.50 -0.45 0.00 -3.05 0.00 0.00 64.05 60.27 2gt3 n THR 170 Cb 0.20 -0.01 -0.03 0.00 -1.55 0.00 0.00 70.33 68.94 2gt3 n THR 170 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 2gt3 n THR 171 N -2.26 0.54 -4.18 1.09 -1.04 0.18 -4.76 114.28 103.85 2gt3 n THR 171 Ca -0.05 -0.14 -0.23 0.00 -2.04 0.00 0.00 64.05 61.59 2gt3 n THR 171 Cb 0.58 -1.58 -0.17 0.00 -1.82 0.00 0.00 70.33 67.35 2gt3 n THR 171 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 2gt3 s GLU 172 N 0.17 1.16 -0.16 -2.82 -1.05 -0.95 -5.00 118.70 110.05 2gt3 s GLU 172 Ca 0.72 -0.19 -0.06 0.00 -0.15 0.00 0.00 54.97 55.29 2gt3 s GLU 172 Cb -0.64 -1.14 -0.04 0.00 -0.44 0.00 0.00 34.13 31.87 2gt3 s GLU 172 CO 0.44 -0.11 0.06 0.42 0.95 0.00 0.00 175.26 177.02 2gt3 s ILE 173 N 1.12 4.78 0.13 1.83 1.09 -1.26 -2.53 121.20 126.36 2gt3 s ILE 173 Ca -0.07 -0.05 -0.09 0.00 -1.10 0.00 0.00 60.65 59.34 2gt3 s ILE 173 Cb -0.14 -3.12 -0.00 0.00 -1.06 0.00 0.00 42.46 38.13 2gt3 s ILE 173 CO -0.01 0.50 0.24 0.00 -0.10 0.00 0.00 174.94 175.57 2gt3 s ALA 174 N 0.03 -0.12 0.32 9.38 0.00 -1.10 -4.98 121.76 125.29 2gt3 s ALA 174 Ca 0.06 -0.75 -0.28 0.00 0.00 0.00 0.00 51.96 50.99 2gt3 s ALA 174 Cb -0.12 0.69 -0.13 0.00 0.00 0.00 0.00 23.12 23.56 2gt3 s ALA 174 CO 0.01 -0.58 1.11 -1.71 0.00 0.00 0.00 175.76 174.58 2gt3 n ASN 175 N -0.15 1.80 -4.65 0.00 5.15 -1.26 -4.41 115.26 111.74 2gt3 n ASN 175 Ca -0.11 1.18 -0.48 0.00 -0.60 0.00 0.00 54.58 54.57 2gt3 n ASN 175 Cb 0.63 -1.36 -0.05 0.00 -0.53 0.00 0.00 39.78 38.47 2gt3 n ASN 175 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2gt3 n ALA 176 N 0.21 0.60 -2.28 5.20 0.00 -1.25 -4.97 120.51 118.03 2gt3 n ALA 176 Ca 0.08 0.45 -0.19 0.00 0.00 0.00 0.00 53.44 53.78 2gt3 n ALA 176 Cb 0.34 -2.28 -0.00 0.00 0.00 0.00 0.00 19.45 17.50 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 1.14 3.50 -1.24 0.00 -4.23 -1.26 -5.00 115.64 108.53 2gt3 s THR 177 Ca 0.82 -1.07 -0.20 0.00 -1.18 0.00 0.00 61.69 60.06 2gt3 s THR 177 Cb -0.77 -3.20 -0.01 0.00 1.34 0.00 0.00 72.50 69.86 2gt3 s THR 177 CO 0.42 -0.09 1.84 -0.81 -0.54 0.00 0.00 174.62 175.45 2gt3 n PRO 178 N -1.68 2.42 -1.79 3.99 -0.04 -1.26 -4.95 135.00 131.68 2gt3 n PRO 178 Ca 0.03 -2.88 -0.38 0.00 -0.04 0.00 0.00 63.50 60.24 2gt3 n PRO 178 Cb 0.59 -3.61 0.05 0.00 -0.04 0.00 0.00 33.50 30.49 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 7.50 2.22 -0.16 0.54 2.19 -1.26 -4.97 117.98 124.04 2gt3 s PHE 179 Ca 0.61 1.43 -0.00 0.00 0.33 0.00 0.00 56.93 59.29 2gt3 s PHE 179 Cb 0.02 -3.73 -0.00 0.00 -1.31 0.00 0.00 43.02 37.99 2gt3 s PHE 179 CO 0.11 -2.84 -0.14 0.71 1.83 0.00 0.00 175.22 174.89 2gt3 s TYR 180 N -1.36 2.81 0.37 10.12 2.02 -1.04 -4.99 117.35 125.28 2gt3 s TYR 180 Ca 0.76 -1.01 -0.28 0.00 -0.37 0.00 0.00 57.07 56.17 2gt3 s TYR 180 Cb -0.38 -1.92 -0.11 0.00 -0.40 0.00 0.00 41.96 39.15 2gt3 s TYR 180 CO 0.43 -0.47 1.49 0.66 -1.57 0.00 0.00 175.55 176.10 2gt3 n TYR 181 N 4.13 2.98 -2.39 2.71 4.02 -1.26 -2.31 117.16 125.03 2gt3 n TYR 181 Ca -0.19 0.44 -0.24 0.00 -0.01 0.00 0.00 57.90 57.89 2gt3 n TYR 181 Cb 0.52 -2.54 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 -1.05 3.43 0.91 -0.72 0.00 0.40 -4.87 121.76 119.86 2gt3 s ALA 182 Ca 0.54 -1.03 -0.13 0.00 0.00 0.00 0.00 51.96 51.33 2gt3 s ALA 182 Cb -0.48 -2.42 0.02 0.00 0.00 0.00 0.00 23.12 20.25 2gt3 s ALA 182 CO 0.63 -1.03 0.42 0.39 0.00 0.00 0.00 175.76 176.17 2gt3 n GLU 183 N -2.67 -0.18 -0.13 0.00 1.02 -1.26 -4.59 120.64 112.84 2gt3 n GLU 183 Ca 0.07 -0.01 -0.05 0.00 -0.02 0.00 0.00 57.16 57.15 2gt3 n GLU 183 Cb 0.60 -1.85 0.13 0.00 -0.02 0.00 0.00 31.44 30.30 2gt3 n GLU 183 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 2gt3 h ASP 184 N -1.34 0.82 -0.79 1.62 2.03 -1.91 0.34 116.42 117.19 2gt3 h ASP 184 Ca -0.44 -0.21 0.09 0.00 -0.73 0.00 0.00 57.03 55.74 2gt3 h ASP 184 Cb 1.29 -0.22 -0.05 0.00 -0.83 0.00 0.00 39.33 39.52 2gt3 h ASP 184 CO 0.36 0.88 0.52 0.44 -1.03 0.00 0.00 179.24 180.41 2gt3 h ASP 185 N 0.79 0.69 0.46 4.15 3.32 -1.98 -1.25 116.42 122.60 2gt3 h ASP 185 Ca 0.15 0.01 -0.31 0.00 0.02 0.00 0.00 57.03 56.91 2gt3 h ASP 185 Cb 0.47 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2gt3 h ASP 185 CO 0.02 0.42 -1.48 0.45 -1.72 0.00 0.00 179.24 176.93 2gt3 h HIS 186 N 0.77 0.52 -1.89 4.55 3.86 -1.72 -3.40 115.15 117.85 2gt3 h HIS 186 Ca 0.36 -0.38 -0.63 0.00 -1.16 0.00 0.00 60.37 58.56 2gt3 h HIS 186 Cb 0.37 -0.02 0.01 0.00 1.06 0.00 0.00 27.41 28.84 2gt3 h HIS 186 CO -0.00 1.40 1.15 1.04 0.86 0.00 0.00 177.93 182.37 2gt3 n GLN 187 N -3.50 1.98 -3.69 2.45 1.13 0.11 -1.44 117.38 114.43 2gt3 n GLN 187 Ca -0.15 0.70 -0.23 0.00 -1.94 0.00 0.00 57.00 55.38 2gt3 n GLN 187 Cb 1.05 -2.63 0.03 0.00 0.11 0.00 0.00 30.24 28.80 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 6.89 -3.67 -0.01 -1.09 3.00 -1.26 -4.91 117.38 116.33 2gt3 n GLN 188 Ca 0.25 0.58 -0.13 0.00 -0.01 0.00 0.00 57.00 57.70 2gt3 n GLN 188 Cb 0.29 -4.93 -0.10 0.00 0.00 0.00 0.00 30.24 25.50 2gt3 n GLN 188 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.06 176.14 2gt3 h TYR 189 N -1.80 0.01 0.00 1.08 5.03 -1.46 -2.53 116.97 117.30 2gt3 h TYR 189 Ca -0.63 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.68 2gt3 h TYR 189 Cb 1.36 -0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.63 2gt3 h TYR 189 CO 0.42 0.45 0.00 -0.11 -1.32 0.00 0.00 178.16 177.61 2gt3 n LEU 190 N -4.87 0.50 0.05 2.82 -0.00 -1.26 -0.57 117.00 113.67 2gt3 n LEU 190 Ca -0.08 0.70 -0.09 0.00 -0.00 0.00 0.00 56.01 56.53 2gt3 n LEU 190 Cb 0.23 -0.72 -0.13 0.00 -0.00 0.00 0.00 43.42 42.81 2gt3 n LEU 190 CO 0.34 -0.77 -0.05 0.45 -0.00 0.00 0.00 177.39 177.35 2gt3 h HIS 191 N 0.00 0.09 0.04 1.96 3.86 -1.74 -3.31 115.15 116.05 2gt3 h HIS 191 Ca 0.00 -0.07 -0.25 0.00 -1.16 0.00 0.00 60.37 58.89 2gt3 h HIS 191 Cb 0.10 -0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.59 2gt3 h HIS 191 CO 0.00 1.06 -1.02 0.87 0.86 0.00 0.00 177.93 179.71 2gt3 h LYS 192 N 0.01 0.62 -4.93 2.45 1.57 -0.49 -3.42 116.57 112.37 2gt3 h LYS 192 Ca -0.10 -0.72 -0.67 0.00 -1.87 0.00 0.00 60.65 57.30 2gt3 h LYS 192 Cb 1.86 0.22 -0.32 0.00 0.08 0.00 0.00 32.23 34.07 2gt3 h LYS 192 CO 0.13 1.30 -0.76 -0.80 -0.57 0.00 0.00 179.45 178.76 2gt3 s ASN 193 N -7.22 4.18 0.44 0.86 0.01 -0.74 -4.97 114.94 107.49 2gt3 s ASN 193 Ca -0.10 -0.79 0.24 0.00 -0.71 0.00 0.00 52.86 51.50 2gt3 s ASN 193 Cb 0.06 -1.65 0.72 0.00 0.41 0.00 0.00 41.25 40.78 2gt3 s ASN 193 CO 0.90 -0.10 1.74 1.55 -1.51 0.00 0.00 177.10 179.68 2gt3 h PRO 194 N 8.01 0.00 -0.30 -0.60 0.13 -1.83 -2.97 132.00 134.44 2gt3 h PRO 194 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2gt3 h PRO 194 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2gt3 h PRO 194 CO 0.58 0.16 0.00 0.66 -0.23 0.00 0.00 178.00 179.17 2gt3 n TYR 195 N -3.21 0.97 -0.01 1.56 4.02 -1.26 -5.01 117.16 114.22 2gt3 n TYR 195 Ca 0.02 -0.81 0.00 0.00 -0.01 0.00 0.00 57.90 57.10 2gt3 n TYR 195 Cb 0.48 -0.29 0.00 0.00 -0.02 0.00 0.00 39.34 39.51 2gt3 n TYR 195 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2gt3 n GLY 196 N -0.26 -3.56 3.62 2.72 0.00 -1.12 -4.79 105.19 101.80 2gt3 n GLY 196 Ca 0.21 -1.21 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.50 1.53 0.01 1.61 1.51 -1.26 -4.95 117.35 115.29 2gt3 s TYR 197 Ca 0.00 0.39 -0.00 0.00 -1.01 0.00 0.00 57.07 56.45 2gt3 s TYR 197 Cb 0.00 -4.04 -0.01 0.00 -0.11 0.00 0.00 41.96 37.80 2gt3 s TYR 197 CO 0.00 -3.84 -0.01 0.00 -1.11 0.00 0.00 175.55 170.58 2gt3 n GLY 199 N 2.02 -0.04 3.49 0.00 0.00 -1.26 -5.10 105.19 104.30 2gt3 n GLY 199 Ca -0.21 -0.08 -0.38 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.78 2.49 0.00 -0.61 3.06 -1.26 -4.73 119.36 116.52 2gt3 n ILE 200 Ca 0.00 -0.50 0.00 0.00 -2.50 0.00 0.00 62.75 59.75 2gt3 n ILE 200 Cb 0.00 -0.76 0.00 0.00 0.54 0.00 0.00 39.64 39.42 2gt3 n ILE 200 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2gt3 n GLY 201 N 1.70 0.31 2.69 4.50 0.00 -1.26 -5.09 105.19 108.05 2gt3 n GLY 201 Ca 0.12 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.08 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 0.00 0.33 3.21 -0.02 0.00 -1.26 -5.15 105.19 102.29 2gt3 n GLY 202 Ca 0.00 0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 2gt3 n GLY 202 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2gt3 s ILE 203 N 0.16 0.02 0.00 -0.61 2.07 -1.26 -5.09 121.20 116.49 2gt3 s ILE 203 Ca 0.18 -2.00 0.00 0.00 -1.41 0.00 0.00 60.65 57.42 2gt3 s ILE 203 Cb 0.29 -2.50 0.00 0.00 0.13 0.00 0.00 42.46 40.37 2gt3 s ILE 203 CO -0.08 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 173.56 2gt3 n GLY 204 N -0.29 0.92 3.77 1.50 0.00 -1.26 -4.85 105.19 104.98 2gt3 n GLY 204 Ca 0.02 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 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 3.28 -0.22 1.61 1.01 -1.26 -5.02 120.40 119.80 2gt3 s VAL 205 Ca 0.00 0.57 -0.05 0.00 0.00 0.00 0.00 61.98 62.50 2gt3 s VAL 205 Cb 0.00 -3.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.27 2gt3 s VAL 205 CO 0.00 -0.39 0.01 0.00 0.00 0.00 0.00 175.10 174.71 2gt3 n LEU 207 N 4.65 -0.13 -4.71 0.00 -0.00 -1.26 -4.70 117.00 110.84 2gt3 n LEU 207 Ca -0.17 0.59 -0.42 0.00 -0.00 0.00 0.00 56.01 56.01 2gt3 n LEU 207 Cb 0.51 -1.14 -0.03 0.00 -0.00 0.00 0.00 43.42 42.76 2gt3 n LEU 207 CO 0.30 -3.49 0.88 -2.16 -0.00 0.00 0.00 177.39 172.93 2gt3 s PRO 208 N -2.43 4.43 -0.15 1.47 0.04 -1.26 -4.98 135.00 132.11 2gt3 s PRO 208 Ca 0.63 1.72 -0.29 0.00 0.04 0.00 0.00 61.00 63.09 2gt3 s PRO 208 Cb -0.37 -3.41 -0.02 0.00 0.04 0.00 0.00 34.50 30.75 2gt3 s PRO 208 CO 0.60 -0.28 1.27 -1.25 0.04 0.00 0.00 177.00 177.38 2gt3 s PRO 209 N 1.33 4.25 -0.02 0.56 0.04 -1.26 -4.91 135.00 134.98 2gt3 s PRO 209 Ca 0.57 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 63.18 2gt3 s PRO 209 Cb -0.28 -3.74 -0.32 0.00 0.04 0.00 0.00 34.50 30.20 2gt3 s PRO 209 CO 0.27 -0.68 0.77 1.49 0.04 0.00 0.00 177.00 178.89 2gt3 h GLU 210 N 8.15 0.43 0.00 4.56 4.81 -2.04 -3.55 114.58 126.93 2gt3 h GLU 210 Ca -0.28 -0.73 0.00 0.00 -0.13 0.00 0.00 59.36 58.22 2gt3 h GLU 210 Cb 1.11 0.27 0.00 0.00 0.63 0.00 0.00 28.75 30.76 2gt3 h GLU 210 CO 0.96 1.34 0.00 0.00 -0.73 0.00 0.00 179.01 180.58