#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gt3 n LEU 2 N 0.00 2.47 -4.21 -3.43 4.77 -1.26 -4.88 117.00 110.45 2gt3 n LEU 2 Ca 0.00 0.07 -0.36 0.00 -0.03 0.00 0.00 56.01 55.69 2gt3 n LEU 2 Cb 0.00 -0.81 -0.13 0.00 -2.33 0.00 0.00 43.42 40.15 2gt3 n LEU 2 CO 0.00 0.74 -0.32 -0.36 -1.33 0.00 0.00 177.39 176.12 2gt3 s PHE 3 N -2.48 3.25 -0.03 -1.77 0.08 -1.26 -4.89 117.98 110.88 2gt3 s PHE 3 Ca -0.34 -1.68 0.16 0.00 0.12 0.00 0.00 56.93 55.20 2gt3 s PHE 3 Cb 0.11 -2.17 0.29 0.00 -0.57 0.00 0.00 43.02 40.68 2gt3 s PHE 3 CO 0.51 -0.77 1.12 -3.47 -0.10 0.00 0.00 175.22 172.52 2gt3 n ASP 4 N 4.70 0.83 0.00 1.36 -0.08 -1.26 -4.78 116.55 117.32 2gt3 n ASP 4 Ca -0.13 -2.23 0.14 0.00 -1.51 0.00 0.00 54.79 51.06 2gt3 n ASP 4 Cb 0.44 -0.30 0.75 0.00 2.34 0.00 0.00 41.12 44.36 2gt3 n ASP 4 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 2gt3 n LYS 5 N 0.10 0.58 -0.10 -0.67 2.85 -1.26 -2.12 118.16 117.54 2gt3 n LYS 5 Ca 0.06 0.02 0.09 0.00 -1.05 0.00 0.00 58.31 57.42 2gt3 n LYS 5 Cb 0.94 -1.50 0.13 0.00 -0.65 0.00 0.00 35.03 33.96 2gt3 n LYS 5 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2gt3 n LYS 6 N -1.18 1.92 -2.10 -1.58 5.02 -1.26 -4.74 118.16 114.23 2gt3 n LYS 6 Ca 0.16 -1.84 -0.42 0.00 -2.02 0.00 0.00 58.31 54.19 2gt3 n LYS 6 Cb 0.18 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 2gt3 n LYS 6 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 2gt3 n HIS 7 N 1.02 3.47 -4.35 2.13 -0.00 -0.90 -4.91 115.22 111.67 2gt3 n HIS 7 Ca 0.13 -2.91 -0.27 0.00 0.46 0.00 0.00 57.72 55.13 2gt3 n HIS 7 Cb 0.47 -2.30 -0.13 0.00 -0.12 0.00 0.00 29.99 27.91 2gt3 n HIS 7 CO 0.00 0.00 0.00 -1.17 0.46 0.00 0.00 176.34 175.63 2gt3 s LEU 8 N 1.38 2.33 0.64 0.27 2.96 -1.26 -5.05 118.68 119.96 2gt3 s LEU 8 Ca 0.44 -0.75 -0.18 0.00 -0.22 0.00 0.00 54.13 53.43 2gt3 s LEU 8 Cb 0.11 -1.08 -0.01 0.00 0.50 0.00 0.00 46.19 45.71 2gt3 s LEU 8 CO -0.03 0.12 1.27 0.54 -1.32 0.00 0.00 176.35 176.93 2gt3 s VAL 9 N -1.22 2.16 0.73 1.68 0.11 -1.26 -5.02 120.40 117.59 2gt3 s VAL 9 Ca 0.12 0.10 -0.00 0.00 -2.93 0.00 0.00 61.98 59.27 2gt3 s VAL 9 Cb -0.10 -3.01 0.14 0.00 -1.53 0.00 0.00 36.38 31.88 2gt3 s VAL 9 CO 0.06 -0.02 1.01 -0.55 -3.33 0.00 0.00 175.10 172.26 2gt3 s SER 10 N -1.48 4.26 -0.00 3.54 0.15 -1.26 -4.85 113.70 114.06 2gt3 s SER 10 Ca 0.81 -0.45 -0.21 0.00 0.70 0.00 0.00 55.95 56.80 2gt3 s SER 10 Cb -0.36 0.13 -0.22 0.00 -1.71 0.00 0.00 66.02 63.86 2gt3 s SER 10 CO 0.39 -1.93 1.12 1.55 1.20 0.00 0.00 173.24 175.56 2gt3 h PRO 11 N -0.56 0.34 0.00 5.44 0.13 -1.94 0.75 132.00 136.16 2gt3 h PRO 11 Ca -0.35 -0.33 0.00 0.00 -0.87 0.00 0.00 66.00 64.44 2gt3 h PRO 11 Cb 1.26 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.48 2gt3 h PRO 11 CO 0.38 1.01 0.00 0.00 -0.23 0.00 0.00 178.00 179.16 2gt3 h ALA 12 N 0.35 1.00 0.13 -0.56 0.00 -2.01 -2.99 119.26 115.18 2gt3 h ALA 12 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.53 2gt3 h ALA 12 Cb 1.14 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2gt3 h ALA 12 CO 0.09 0.00 -1.71 -0.44 0.00 0.00 0.00 179.25 177.19 2gt3 h ASP 13 N 0.00 0.42 -3.06 0.00 5.19 -1.93 -3.47 116.42 113.57 2gt3 h ASP 13 Ca 0.00 -0.68 -0.53 0.00 -0.62 0.00 0.00 57.03 55.19 2gt3 h ASP 13 Cb 0.64 -0.14 0.22 0.00 0.18 0.00 0.00 39.33 40.24 2gt3 h ASP 13 CO 0.00 1.58 -0.89 0.00 -3.12 0.00 0.00 179.24 176.82 2gt3 n ALA 14 N -2.78 -3.31 -2.56 3.45 0.00 0.25 -4.89 120.51 110.67 2gt3 n ALA 14 Ca -0.22 -0.64 -0.42 0.00 0.00 0.00 0.00 53.44 52.16 2gt3 n ALA 14 Cb 1.05 -1.64 -0.06 0.00 0.00 0.00 0.00 19.45 18.80 2gt3 n ALA 14 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2gt3 s LEU 15 N 1.05 4.27 -0.65 0.00 2.96 0.18 -4.94 118.68 121.56 2gt3 s LEU 15 Ca 0.53 0.07 -0.06 0.00 -0.22 0.00 0.00 54.13 54.45 2gt3 s LEU 15 Cb -0.20 -2.84 -0.13 0.00 0.50 0.00 0.00 46.19 43.52 2gt3 s LEU 15 CO 0.71 -0.69 2.65 -0.81 -1.32 0.00 0.00 176.35 176.89 2gt3 n PRO 16 N 6.23 2.18 -3.99 0.98 -0.04 -1.26 -4.49 135.00 134.61 2gt3 n PRO 16 Ca -0.00 -1.30 -0.31 0.00 -0.04 0.00 0.00 63.50 61.85 2gt3 n PRO 16 Cb 0.48 -2.26 -0.15 0.00 -0.04 0.00 0.00 33.50 31.53 2gt3 n PRO 16 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2gt3 s GLY 17 N 2.58 1.60 0.03 0.55 0.00 -1.26 -4.98 107.32 105.84 2gt3 s GLY 17 Ca 0.51 -1.88 -0.19 0.00 0.00 0.00 0.00 44.72 43.17 2gt3 s GLY 17 CO -0.02 0.88 0.53 1.09 0.00 0.00 0.00 173.10 175.58 2gt3 s ARG 18 N 1.16 4.17 0.43 2.90 1.70 -1.24 -4.73 118.95 123.35 2gt3 s ARG 18 Ca -0.01 0.65 0.08 0.00 -0.47 0.00 0.00 55.73 55.98 2gt3 s ARG 18 Cb -0.19 -3.27 0.01 0.00 -0.57 0.00 0.00 34.95 30.93 2gt3 s ARG 18 CO -0.08 0.57 0.56 1.21 -1.08 0.00 0.00 175.30 176.47 2gt3 s ASN 19 N -0.81 5.51 0.42 -2.89 3.84 0.65 -5.03 114.94 116.64 2gt3 s ASN 19 Ca 0.28 -0.52 -0.25 0.00 0.21 0.00 0.00 52.86 52.59 2gt3 s ASN 19 Cb -0.18 -0.56 -0.08 0.00 -0.55 0.00 0.00 41.25 39.88 2gt3 s ASN 19 CO 0.17 -0.79 1.20 -0.89 -2.79 0.00 0.00 177.10 173.99 2gt3 s THR 20 N -2.40 3.00 0.21 -5.21 2.01 -1.26 -4.81 115.64 107.19 2gt3 s THR 20 Ca 0.54 0.83 -0.30 0.00 0.31 0.00 0.00 61.69 63.08 2gt3 s THR 20 Cb -0.08 -3.46 -0.08 0.00 0.01 0.00 0.00 72.50 68.88 2gt3 s THR 20 CO 0.33 0.07 1.10 -2.16 -0.69 0.00 0.00 174.62 173.27 2gt3 s PRO 21 N -2.38 4.61 0.46 4.92 0.04 -1.26 -5.03 135.00 136.36 2gt3 s PRO 21 Ca 0.59 1.75 -0.09 0.00 0.04 0.00 0.00 61.00 63.29 2gt3 s PRO 21 Cb -0.32 -3.25 -0.05 0.00 0.04 0.00 0.00 34.50 30.92 2gt3 s PRO 21 CO 0.40 0.12 0.82 -1.64 0.04 0.00 0.00 177.00 176.73 2gt3 s MET 22 N -0.72 3.69 0.28 4.56 -1.94 -1.26 -5.05 119.30 118.86 2gt3 s MET 22 Ca 0.48 0.44 -0.29 0.00 -1.71 0.00 0.00 55.69 54.60 2gt3 s MET 22 Cb -0.30 -2.34 -0.09 0.00 2.01 0.00 0.00 34.83 34.10 2gt3 s MET 22 CO 0.37 -0.16 1.08 -1.25 -0.01 0.00 0.00 175.02 175.04 2gt3 s PRO 23 N -4.31 4.64 0.24 2.03 0.04 -1.26 -5.02 135.00 131.36 2gt3 s PRO 23 Ca 0.51 1.75 0.06 0.00 0.04 0.00 0.00 61.00 63.36 2gt3 s PRO 23 Cb -0.10 -3.16 -0.03 0.00 0.04 0.00 0.00 34.50 31.24 2gt3 s PRO 23 CO 0.38 0.23 0.23 0.08 0.04 0.00 0.00 177.00 177.96 2gt3 s VAL 24 N -1.20 4.62 0.54 -0.36 1.01 -1.26 -4.75 120.40 119.01 2gt3 s VAL 24 Ca 0.45 -1.30 -0.11 0.00 0.00 0.00 0.00 61.98 61.02 2gt3 s VAL 24 Cb -0.31 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 2gt3 s VAL 24 CO 0.39 -0.33 0.94 0.00 0.00 0.00 0.00 175.10 176.10 2gt3 s ALA 25 N -2.08 3.19 0.18 5.51 0.00 -1.26 -4.98 121.76 122.32 2gt3 s ALA 25 Ca 0.33 -0.13 0.05 0.00 0.00 0.00 0.00 51.96 52.21 2gt3 s ALA 25 Cb -0.08 -2.94 0.04 0.00 0.00 0.00 0.00 23.12 20.14 2gt3 s ALA 25 CO 0.26 -0.43 1.42 1.15 0.00 0.00 0.00 175.76 178.15 2gt3 h THR 26 N 0.24 1.53 -3.69 0.00 2.02 -1.99 -3.46 112.91 107.55 2gt3 h THR 26 Ca -0.46 -2.66 -0.45 0.00 0.77 0.00 0.00 66.41 63.62 2gt3 h THR 26 Cb 1.19 2.46 -0.14 0.00 -1.74 0.00 0.00 68.15 69.92 2gt3 h THR 26 CO 0.62 0.77 -0.55 -0.76 0.37 0.00 0.00 175.52 175.97 2gt3 s LEU 27 N -7.33 1.77 0.92 2.58 1.43 -1.26 -4.20 118.68 112.59 2gt3 s LEU 27 Ca -0.02 -1.59 -0.12 0.00 -1.03 0.00 0.00 54.13 51.38 2gt3 s LEU 27 Cb 0.11 0.13 0.14 0.00 0.03 0.00 0.00 46.19 46.60 2gt3 s LEU 27 CO 0.81 -0.89 1.11 -2.28 0.23 0.00 0.00 176.35 175.32 2gt3 s HIS 28 N -3.50 2.39 -0.02 0.29 5.65 0.49 -4.80 115.29 115.79 2gt3 s HIS 28 Ca 0.34 1.02 -0.09 0.00 0.25 0.00 0.00 55.06 56.57 2gt3 s HIS 28 Cb 0.04 -3.26 -0.05 0.00 -1.18 0.00 0.00 32.58 28.13 2gt3 s HIS 28 CO 0.18 -2.46 0.57 0.00 -0.65 0.00 0.00 174.74 172.37 2gt3 h ALA 29 N -1.58 -0.52 0.02 1.58 0.00 -1.91 -2.71 119.26 114.14 2gt3 h ALA 29 Ca -0.51 -0.07 -0.27 0.00 0.00 0.00 0.00 54.91 54.05 2gt3 h ALA 29 Cb 1.31 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 2gt3 h ALA 29 CO 0.59 -0.49 -1.49 0.28 0.00 0.00 0.00 179.25 178.13 2gt3 n VAL 30 N -3.84 1.57 0.12 0.00 0.31 -1.26 -4.06 118.33 111.16 2gt3 n VAL 30 Ca -0.04 -0.16 0.12 0.00 -0.01 0.00 0.00 64.34 64.25 2gt3 n VAL 30 Cb 0.13 -1.97 0.62 0.00 -0.91 0.00 0.00 33.84 31.71 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 -0.82 0.08 -1.17 4.52 -1.24 -1.91 -3.44 115.58 111.60 2gt3 h ASN 31 Ca -0.39 0.00 -0.25 0.00 0.71 0.00 0.00 56.30 56.37 2gt3 h ASN 31 Cb 1.45 -0.02 -0.10 0.00 0.73 0.00 0.00 38.32 40.39 2gt3 h ASN 31 CO -0.18 0.05 -0.23 0.61 -1.29 0.00 0.00 177.43 176.40 2gt3 n GLY 32 N -1.56 1.17 3.99 1.57 0.00 -1.02 -4.79 105.19 104.55 2gt3 n GLY 32 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.00 2.98 -0.10 1.61 3.76 -1.26 -4.27 115.29 116.00 2gt3 s HIS 33 Ca 0.00 -0.30 -0.29 0.00 -0.15 0.00 0.00 55.06 54.31 2gt3 s HIS 33 Cb 0.00 -2.15 -0.04 0.00 1.11 0.00 0.00 32.58 31.49 2gt3 s HIS 33 CO 0.00 -0.18 1.53 -1.54 -0.85 0.00 0.00 174.74 173.70 2gt3 s SER 34 N -4.24 6.74 -0.12 1.40 1.04 -1.26 0.18 113.70 117.44 2gt3 s SER 34 Ca 0.49 2.02 -0.14 0.00 0.48 0.00 0.00 55.95 58.80 2gt3 s SER 34 Cb -0.10 -2.53 -0.13 0.00 0.10 0.00 0.00 66.02 63.36 2gt3 s SER 34 CO 0.32 -0.89 0.37 -0.03 0.98 0.00 0.00 173.24 173.98 2gt3 h MET 35 N 9.17 0.00 0.12 4.02 4.05 -1.88 -3.37 114.93 127.04 2gt3 h MET 35 Ca -0.35 0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.08 2gt3 h MET 35 Cb 1.15 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.93 2gt3 h MET 35 CO 0.96 0.50 -0.19 1.79 0.23 0.00 0.00 176.91 180.19 2gt3 h THR 36 N -1.00 0.56 -2.93 -0.77 1.35 -1.90 -3.40 112.91 104.83 2gt3 h THR 36 Ca -0.01 0.00 -0.54 0.00 -0.55 0.00 0.00 66.41 65.32 2gt3 h THR 36 Cb 0.51 0.56 0.01 0.00 -1.73 0.00 0.00 68.15 67.50 2gt3 h THR 36 CO -0.00 0.00 0.80 0.20 -0.25 0.00 0.00 175.52 176.27 2gt3 s ASN 37 N -4.88 6.83 -0.07 5.36 -0.87 -1.26 -5.01 114.94 115.04 2gt3 s ASN 37 Ca -0.15 2.20 0.04 0.00 -1.57 0.00 0.00 52.86 53.38 2gt3 s ASN 37 Cb 0.07 -2.57 -0.02 0.00 -0.02 0.00 0.00 41.25 38.72 2gt3 s ASN 37 CO 0.65 -0.70 -0.19 -0.69 -2.57 0.00 0.00 177.10 173.60 2gt3 s VAL 38 N 1.96 2.60 0.49 1.60 1.01 -1.26 -4.73 120.40 122.06 2gt3 s VAL 38 Ca 0.65 -0.87 -0.20 0.00 0.00 0.00 0.00 61.98 61.55 2gt3 s VAL 38 Cb -0.34 -2.00 -0.08 0.00 0.00 0.00 0.00 36.38 33.96 2gt3 s VAL 38 CO 0.28 0.57 1.04 -2.16 0.00 0.00 0.00 175.10 174.83 2gt3 s PRO 39 N -0.28 3.80 0.12 2.72 0.04 -1.26 -4.98 135.00 135.15 2gt3 s PRO 39 Ca 0.01 1.36 -0.31 0.00 0.04 0.00 0.00 61.00 62.09 2gt3 s PRO 39 Cb -0.13 -2.09 -0.08 0.00 0.04 0.00 0.00 34.50 32.24 2gt3 s PRO 39 CO 0.03 -0.43 1.42 0.34 0.04 0.00 0.00 177.00 178.39 2gt3 s ASP 40 N -2.00 6.78 0.00 6.66 2.15 -1.26 -2.24 116.67 126.77 2gt3 s ASP 40 Ca 0.67 2.37 0.00 0.00 0.43 0.00 0.00 52.55 56.02 2gt3 s ASP 40 Cb -0.16 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.87 2gt3 s ASP 40 CO 0.20 -0.69 0.00 0.61 -0.17 0.00 0.00 175.17 175.12 2gt3 n GLY 41 N 3.55 3.04 3.93 2.66 0.00 -1.26 -5.07 105.19 112.03 2gt3 n GLY 41 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 2gt3 n GLY 41 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2gt3 s MET 42 N -0.66 2.66 0.14 1.61 -1.94 -0.95 -4.10 119.30 116.07 2gt3 s MET 42 Ca 0.00 -0.24 -0.04 0.00 -1.71 0.00 0.00 55.69 53.70 2gt3 s MET 42 Cb 0.00 -2.30 -0.03 0.00 2.01 0.00 0.00 34.83 34.51 2gt3 s MET 42 CO 0.00 -0.82 0.14 -1.21 -0.01 0.00 0.00 175.02 173.13 2gt3 s GLU 43 N -4.99 1.01 0.19 2.03 2.02 0.24 -4.95 118.70 114.25 2gt3 s GLU 43 Ca 0.56 -1.33 0.09 0.00 0.02 0.00 0.00 54.97 54.30 2gt3 s GLU 43 Cb -0.10 0.29 -0.04 0.00 0.10 0.00 0.00 34.13 34.38 2gt3 s GLU 43 CO 0.43 -0.32 -0.06 0.42 0.02 0.00 0.00 175.26 175.75 2gt3 s ILE 44 N -4.01 3.34 -0.16 -1.63 1.01 -1.26 -1.17 121.20 117.32 2gt3 s ILE 44 Ca 0.21 -1.65 -0.07 0.00 0.00 0.00 0.00 60.65 59.14 2gt3 s ILE 44 Cb 0.06 -2.68 0.07 0.00 0.01 0.00 0.00 42.46 39.91 2gt3 s ILE 44 CO 0.01 -0.15 0.36 0.00 0.00 0.00 0.00 174.94 175.16 2gt3 s ALA 45 N -1.80 -0.91 -0.19 9.38 0.00 0.35 -4.55 121.76 124.04 2gt3 s ALA 45 Ca 0.26 1.33 -0.12 0.00 0.00 0.00 0.00 51.96 53.43 2gt3 s ALA 45 Cb -0.09 -0.99 -0.05 0.00 0.00 0.00 0.00 23.12 22.00 2gt3 s ALA 45 CO 0.17 -0.44 0.22 0.42 0.00 0.00 0.00 175.76 176.13 2gt3 s ILE 46 N 1.85 5.34 -0.01 0.00 1.01 -0.53 0.11 121.20 128.97 2gt3 s ILE 46 Ca -0.06 0.39 0.02 0.00 0.00 0.00 0.00 60.65 61.00 2gt3 s ILE 46 Cb -0.10 -3.56 -0.00 0.00 0.01 0.00 0.00 42.46 38.80 2gt3 s ILE 46 CO -0.11 0.39 -0.07 -0.36 0.00 0.00 0.00 174.94 174.79 2gt3 s PHE 47 N 0.56 0.62 -0.25 3.97 0.08 -0.65 -0.84 117.98 121.47 2gt3 s PHE 47 Ca 0.12 -0.12 0.02 0.00 0.12 0.00 0.00 56.93 57.08 2gt3 s PHE 47 Cb -0.12 -0.40 0.06 0.00 -0.57 0.00 0.00 43.02 41.98 2gt3 s PHE 47 CO 0.02 -0.02 -0.09 0.00 -0.10 0.00 0.00 175.22 175.04 2gt3 s ALA 48 N -0.13 2.32 -0.18 5.36 0.00 -0.46 -0.89 121.76 127.78 2gt3 s ALA 48 Ca 0.02 -1.60 0.18 0.00 0.00 0.00 0.00 51.96 50.56 2gt3 s ALA 48 Cb -0.03 -1.53 0.45 0.00 0.00 0.00 0.00 23.12 22.02 2gt3 s ALA 48 CO -0.00 -1.20 1.17 -1.33 0.00 0.00 0.00 175.76 174.40 2gt3 n MET 49 N 4.53 1.55 0.00 0.00 2.81 -1.25 -1.92 117.12 122.84 2gt3 n MET 49 Ca -0.13 -3.14 0.00 0.00 -1.81 0.00 0.00 57.70 52.62 2gt3 n MET 49 Cb 0.43 -1.26 0.00 0.00 -0.71 0.00 0.00 33.22 31.68 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 -0.41 0.66 3.38 3.03 0.00 -1.26 -4.82 105.19 105.77 2gt3 n GLY 50 Ca 0.17 -0.68 -0.61 0.00 0.00 0.00 0.00 46.02 44.90 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 6.76 0.00 0.22 0.00 1.16 -1.26 -2.42 117.46 121.91 2gt3 n PHE 52 Ca 0.49 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.97 2gt3 n PHE 52 Cb -0.03 -0.10 -0.04 0.00 -1.61 0.00 0.00 39.48 37.69 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 0.66 -0.57 0.05 2.97 6.55 -1.90 -1.81 115.95 121.89 2gt3 h TRP 53 Ca 0.00 -0.01 -0.20 0.00 0.95 0.00 0.00 58.89 59.63 2gt3 h TRP 53 Cb 0.27 0.19 0.02 0.00 -0.86 0.00 0.00 29.16 28.78 2gt3 h TRP 53 CO 0.00 -0.35 -0.81 0.78 -1.05 0.00 0.00 178.44 177.01 2gt3 h GLY 54 N -1.10 0.52 0.29 1.49 0.00 -1.81 -2.54 103.07 99.92 2gt3 h GLY 54 Ca -0.06 -1.01 0.05 0.00 0.00 0.00 0.00 47.33 46.31 2gt3 h GLY 54 CO 0.10 0.89 -0.21 -2.08 0.00 0.00 0.00 176.54 175.24 2gt3 h VAL 55 N -0.02 0.46 -0.83 4.60 2.07 -1.63 0.54 116.25 121.45 2gt3 h VAL 55 Ca -0.11 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.41 2gt3 h VAL 55 Cb 1.53 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 31.72 2gt3 h VAL 55 CO 0.16 0.00 0.54 -0.08 0.02 0.00 0.00 177.57 178.21 2gt3 h GLU 56 N -0.25 1.10 -0.66 1.57 4.81 -1.41 -0.80 114.58 118.93 2gt3 h GLU 56 Ca 0.11 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 2gt3 h GLU 56 Cb 0.42 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 2gt3 h GLU 56 CO -0.32 0.73 0.35 -0.09 -0.73 0.00 0.00 179.01 178.96 2gt3 h ARG 57 N 1.12 0.91 -0.21 1.92 2.43 -0.74 1.20 114.38 121.02 2gt3 h ARG 57 Ca 0.30 -0.10 -0.11 0.00 -0.81 0.00 0.00 59.98 59.26 2gt3 h ARG 57 Cb -0.12 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.24 2gt3 h ARG 57 CO -0.06 0.67 -0.35 1.37 -1.51 0.00 0.00 179.97 180.09 2gt3 h LEU 58 N 0.92 0.47 0.08 3.80 8.10 0.96 0.49 115.31 130.13 2gt3 h LEU 58 Ca 0.23 -0.19 -0.26 0.00 0.11 0.00 0.00 57.88 57.78 2gt3 h LEU 58 Cb 0.03 -0.13 -0.01 0.00 -0.44 0.00 0.00 40.66 40.11 2gt3 h LEU 58 CO -0.04 0.78 -1.23 -0.26 -4.11 0.00 0.00 178.44 173.59 2gt3 h PHE 59 N 0.38 0.31 -0.06 0.17 0.04 -0.01 -2.44 116.94 115.34 2gt3 h PHE 59 Ca 0.04 -0.22 -0.22 0.00 2.80 0.00 0.00 57.97 60.37 2gt3 h PHE 59 Cb 0.80 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.94 2gt3 h PHE 59 CO 0.03 1.19 -0.85 2.35 -0.60 0.00 0.00 178.31 180.43 2gt3 h TRP 60 N 0.05 0.75 0.00 -0.55 2.91 0.16 -2.76 115.95 116.51 2gt3 h TRP 60 Ca -0.12 -0.36 0.00 0.00 1.13 0.00 0.00 58.89 59.54 2gt3 h TRP 60 Cb 1.92 -0.10 0.00 0.00 -0.51 0.00 0.00 29.16 30.46 2gt3 h TRP 60 CO 0.04 1.17 0.00 1.04 -1.03 0.00 0.00 178.44 179.66 2gt3 n GLN 61 N -3.83 0.14 -2.19 2.65 6.02 0.17 -4.81 117.38 115.53 2gt3 n GLN 61 Ca -0.07 0.05 -0.41 0.00 -0.01 0.00 0.00 57.00 56.56 2gt3 n GLN 61 Cb 0.78 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.51 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 -2.84 4.42 -0.31 1.08 1.43 -0.92 -4.94 118.68 116.59 2gt3 s LEU 62 Ca 0.17 2.45 -0.29 0.00 -1.03 0.00 0.00 54.13 55.44 2gt3 s LEU 62 Cb 0.17 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.78 2gt3 s LEU 62 CO 0.45 -0.54 1.36 -2.16 0.23 0.00 0.00 176.35 175.69 2gt3 s PRO 63 N -0.27 3.83 0.00 1.29 0.04 -1.26 -2.59 135.00 136.04 2gt3 s PRO 63 Ca 0.56 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.83 2gt3 s PRO 63 Cb -0.37 -3.93 0.00 0.00 0.04 0.00 0.00 34.50 30.24 2gt3 s PRO 63 CO 0.40 -1.23 0.00 0.41 0.04 0.00 0.00 177.00 176.61 2gt3 n GLY 64 N 4.51 1.33 3.64 0.56 0.00 -1.26 -4.55 105.19 109.42 2gt3 n GLY 64 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.95 4.88 0.01 1.61 1.01 -1.07 -2.55 120.40 122.35 2gt3 s VAL 65 Ca 0.00 1.39 -0.21 0.00 0.00 0.00 0.00 61.98 63.16 2gt3 s VAL 65 Cb 0.00 -4.06 -0.18 0.00 0.00 0.00 0.00 36.38 32.14 2gt3 s VAL 65 CO 0.00 -0.05 1.22 0.22 0.00 0.00 0.00 175.10 176.49 2gt3 h TYR 66 N 7.78 0.42 -2.48 5.22 3.20 0.20 -3.48 116.97 127.83 2gt3 h TYR 66 Ca -0.24 -0.17 0.13 0.00 3.14 0.00 0.00 58.73 61.59 2gt3 h TYR 66 Cb 1.10 -0.07 -0.09 0.00 1.54 0.00 0.00 36.73 39.21 2gt3 h TYR 66 CO 0.75 0.87 0.42 -1.12 -1.64 0.00 0.00 178.16 177.45 2gt3 s SER 67 N -6.29 -0.25 0.13 -2.11 0.01 -1.10 -4.90 113.70 99.19 2gt3 s SER 67 Ca -0.14 -0.34 -0.01 0.00 1.31 0.00 0.00 55.95 56.77 2gt3 s SER 67 Cb 0.04 0.52 -0.04 0.00 0.21 0.00 0.00 66.02 66.75 2gt3 s SER 67 CO 0.76 -0.93 0.04 0.42 0.41 0.00 0.00 173.24 173.94 2gt3 s THR 68 N -3.39 0.16 -0.20 1.44 -4.23 -1.26 -0.92 115.64 107.24 2gt3 s THR 68 Ca 0.10 -1.91 -0.16 0.00 -1.18 0.00 0.00 61.69 58.54 2gt3 s THR 68 Cb -0.02 -2.00 0.06 0.00 1.34 0.00 0.00 72.50 71.87 2gt3 s THR 68 CO 0.00 -0.52 0.53 0.00 -0.54 0.00 0.00 174.62 174.09 2gt3 s ALA 69 N -4.00 -1.33 0.11 3.99 0.00 -0.15 -4.93 121.76 115.45 2gt3 s ALA 69 Ca 0.22 1.60 -0.08 0.00 0.00 0.00 0.00 51.96 53.71 2gt3 s ALA 69 Cb 0.07 -0.94 -0.06 0.00 0.00 0.00 0.00 23.12 22.19 2gt3 s ALA 69 CO 0.01 -0.27 0.39 0.00 0.00 0.00 0.00 175.76 175.90 2gt3 s ALA 70 N 0.64 3.74 0.02 0.00 0.00 -1.26 0.13 121.76 125.03 2gt3 s ALA 70 Ca -0.03 -0.45 -0.04 0.00 0.00 0.00 0.00 51.96 51.45 2gt3 s ALA 70 Cb -0.05 -2.22 0.01 0.00 0.00 0.00 0.00 23.12 20.87 2gt3 s ALA 70 CO -0.04 0.60 0.17 0.41 0.00 0.00 0.00 175.76 176.90 2gt3 n GLY 71 N 0.55 1.03 2.99 0.00 0.00 -0.34 -0.30 105.19 109.12 2gt3 n GLY 71 Ca -0.06 -0.93 -0.14 0.00 0.00 0.00 0.00 46.02 44.90 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 -4.74 0.48 0.12 1.61 2.02 -1.03 -2.16 117.35 113.66 2gt3 s TYR 72 Ca 0.04 -0.27 -0.24 0.00 -0.37 0.00 0.00 57.07 56.22 2gt3 s TYR 72 Cb -0.00 -0.30 0.08 0.00 -0.40 0.00 0.00 41.96 41.34 2gt3 s TYR 72 CO 0.01 -0.05 1.11 -0.08 -1.57 0.00 0.00 175.55 174.96 2gt3 s THR 73 N -0.70 0.00 0.00 -0.71 -1.32 -0.90 -2.69 115.64 109.32 2gt3 s THR 73 Ca -0.04 -0.47 0.00 0.00 -1.21 0.00 0.00 61.69 59.97 2gt3 s THR 73 Cb -0.06 -2.79 0.00 0.00 -1.51 0.00 0.00 72.50 68.14 2gt3 s THR 73 CO -0.00 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.02 2gt3 n GLY 74 N -0.72 2.21 0.00 6.08 0.00 -1.26 0.14 105.19 111.64 2gt3 n GLY 74 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.63 0.88 0.10 -0.02 0.00 -1.21 -4.59 105.19 98.72 2gt3 n GLY 75 Ca 0.00 -1.82 -0.04 0.00 0.00 0.00 0.00 46.02 44.16 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 0.00 0.00 -1.69 1.61 4.19 -0.78 -4.81 117.16 115.69 2gt3 n TYR 76 Ca 0.00 0.00 -0.55 0.00 3.31 0.00 0.00 57.90 60.66 2gt3 n TYR 76 Cb 0.00 -0.19 -0.07 0.00 0.49 0.00 0.00 39.34 39.57 2gt3 n TYR 76 CO 0.00 0.00 0.00 2.41 0.91 0.00 0.00 176.86 180.18 2gt3 n THR 77 N -2.70 0.36 -2.48 2.97 -1.04 -1.24 -4.88 114.28 105.26 2gt3 n THR 77 Ca -0.09 -0.08 -0.41 0.00 -2.04 0.00 0.00 64.05 61.43 2gt3 n THR 77 Cb 0.59 -1.39 -0.04 0.00 -1.82 0.00 0.00 70.33 67.68 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 3.87 4.52 -1.02 -2.82 0.04 -1.26 -3.76 135.00 134.58 2gt3 s PRO 78 Ca 0.98 1.73 -0.15 0.00 0.04 0.00 0.00 61.00 63.60 2gt3 s PRO 78 Cb -0.98 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 30.25 2gt3 s PRO 78 CO 0.62 -0.07 0.72 0.09 0.04 0.00 0.00 177.00 178.40 2gt3 n ASN 79 N 3.02 -5.37 -4.79 6.66 3.02 -1.26 -3.70 115.26 112.85 2gt3 n ASN 79 Ca 0.05 -0.92 -0.29 0.00 -0.03 0.00 0.00 54.58 53.39 2gt3 n ASN 79 Cb 0.46 -2.93 0.13 0.00 -0.61 0.00 0.00 39.78 36.84 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 -5.55 1.17 0.16 3.52 0.04 -1.25 -0.25 135.00 132.85 2gt3 s PRO 80 Ca 0.29 0.29 0.10 0.00 0.04 0.00 0.00 61.00 61.72 2gt3 s PRO 80 Cb -0.12 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2gt3 s PRO 80 CO 0.87 -2.18 -0.16 0.99 0.04 0.00 0.00 177.00 176.57 2gt3 s THR 81 N -3.28 2.86 0.24 1.26 2.01 -1.26 -4.79 115.64 112.68 2gt3 s THR 81 Ca 0.64 -1.70 -0.05 0.00 0.31 0.00 0.00 61.69 60.88 2gt3 s THR 81 Cb -0.15 -2.37 0.22 0.00 0.01 0.00 0.00 72.50 70.21 2gt3 s THR 81 CO 0.53 -0.04 1.70 0.22 -0.69 0.00 0.00 174.62 176.34 2gt3 h TYR 82 N 3.25 0.34 -0.59 4.92 5.03 -1.98 0.37 116.97 128.32 2gt3 h TYR 82 Ca -0.48 0.04 -0.01 0.00 2.58 0.00 0.00 58.73 60.87 2gt3 h TYR 82 Cb 1.19 -0.04 -0.03 0.00 1.55 0.00 0.00 36.73 39.41 2gt3 h TYR 82 CO 0.64 -0.04 0.34 0.00 -1.32 0.00 0.00 178.16 177.78 2gt3 h ARG 83 N 0.31 0.81 -0.23 1.82 3.08 -1.98 0.36 114.38 118.56 2gt3 h ARG 83 Ca 0.41 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.36 2gt3 h ARG 83 Cb 0.67 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 2gt3 h ARG 83 CO -0.47 0.60 0.10 0.93 -1.07 0.00 0.00 179.97 180.06 2gt3 h GLU 84 N 0.80 0.33 -0.53 0.04 5.08 -1.29 -1.97 114.58 117.03 2gt3 h GLU 84 Ca 0.21 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.47 2gt3 h GLU 84 Cb 0.01 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 2gt3 h GLU 84 CO -0.04 0.36 0.15 0.28 -1.00 0.00 0.00 179.01 178.76 2gt3 h VAL 85 N 0.23 1.22 -0.88 3.13 2.07 -0.08 -1.32 116.25 120.61 2gt3 h VAL 85 Ca 0.08 -0.75 0.07 0.00 0.82 0.00 0.00 66.70 66.91 2gt3 h VAL 85 Cb 0.14 0.65 -0.06 0.00 -1.52 0.00 0.00 31.29 30.50 2gt3 h VAL 85 CO -0.01 0.28 0.57 0.00 0.02 0.00 0.00 177.57 178.44 2gt3 h SER 87 N 0.98 0.46 0.00 0.00 0.02 -0.52 -3.48 113.55 111.01 2gt3 h SER 87 Ca 0.38 -0.33 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 2gt3 h SER 87 Cb 0.23 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.64 2gt3 h SER 87 CO -0.14 0.68 0.00 0.61 -1.14 0.00 0.00 176.83 176.84 2gt3 n GLY 88 N -0.27 0.90 1.55 -3.77 0.00 -0.48 -4.96 105.19 98.16 2gt3 n GLY 88 Ca -0.03 -0.17 0.09 0.00 0.00 0.00 0.00 46.02 45.90 2gt3 n GLY 88 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2gt3 n ASP 89 N 0.32 4.61 -0.05 1.61 -0.08 -1.24 -4.07 116.55 117.64 2gt3 n ASP 89 Ca 0.00 -2.46 -0.06 0.00 -1.51 0.00 0.00 54.79 50.76 2gt3 n ASP 89 Cb 0.00 -0.58 -0.06 0.00 2.34 0.00 0.00 41.12 42.83 2gt3 n ASP 89 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2gt3 n THR 90 N 1.01 0.57 0.00 5.18 -2.24 -1.26 -0.64 114.28 116.90 2gt3 n THR 90 Ca 0.24 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 2gt3 n THR 90 Cb 0.88 -0.83 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 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 2.76 1.70 3.77 3.38 0.00 -1.26 -1.86 105.19 113.68 2gt3 n GLY 91 Ca -0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.35 2.62 0.40 1.61 3.76 -1.26 -3.36 115.29 116.70 2gt3 s HIS 92 Ca 0.00 1.52 0.08 0.00 -0.15 0.00 0.00 55.06 56.51 2gt3 s HIS 92 Cb 0.00 -3.40 -0.07 0.00 1.11 0.00 0.00 32.58 30.21 2gt3 s HIS 92 CO 0.00 -1.83 0.01 0.00 -0.85 0.00 0.00 174.74 172.07 2gt3 s ALA 93 N -1.63 3.17 -0.26 -1.40 0.00 0.37 -4.63 121.76 117.38 2gt3 s ALA 93 Ca 0.72 -2.24 -0.29 0.00 0.00 0.00 0.00 51.96 50.15 2gt3 s ALA 93 Cb -0.28 0.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 2gt3 s ALA 93 CO 0.32 -0.08 1.32 -1.21 0.00 0.00 0.00 175.76 176.12 2gt3 s GLU 94 N -3.71 3.98 0.09 0.00 2.02 -0.53 -2.11 118.70 118.44 2gt3 s GLU 94 Ca 0.35 1.39 0.03 0.00 0.02 0.00 0.00 54.97 56.75 2gt3 s GLU 94 Cb 0.08 -3.87 -0.04 0.00 0.10 0.00 0.00 34.13 30.40 2gt3 s GLU 94 CO 0.18 -1.04 -0.08 0.00 0.02 0.00 0.00 175.26 174.34 2gt3 s ALA 95 N 4.25 0.99 -0.00 5.21 0.00 -0.92 -3.91 121.76 127.38 2gt3 s ALA 95 Ca 0.57 -1.22 -0.01 0.00 0.00 0.00 0.00 51.96 51.31 2gt3 s ALA 95 Cb -0.19 0.10 -0.00 0.00 0.00 0.00 0.00 23.12 23.03 2gt3 s ALA 95 CO 0.22 -0.13 0.01 0.08 0.00 0.00 0.00 175.76 175.94 2gt3 s VAL 96 N -2.90 0.02 -0.14 0.00 1.01 -0.07 -1.20 120.40 117.11 2gt3 s VAL 96 Ca 0.07 -0.13 -0.23 0.00 0.00 0.00 0.00 61.98 61.69 2gt3 s VAL 96 Cb 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 36.38 36.29 2gt3 s VAL 96 CO -0.02 -0.07 0.70 -0.13 0.00 0.00 0.00 175.10 175.58 2gt3 s ARG 97 N -0.21 4.32 -0.19 2.72 0.52 0.35 -1.63 118.95 124.84 2gt3 s ARG 97 Ca -0.02 0.81 -0.01 0.00 -0.52 0.00 0.00 55.73 55.98 2gt3 s ARG 97 Cb -0.02 -3.52 0.00 0.00 0.52 0.00 0.00 34.95 31.94 2gt3 s ARG 97 CO -0.00 -0.13 -0.13 0.42 0.02 0.00 0.00 175.30 175.48 2gt3 s ILE 98 N 1.51 2.70 -0.30 1.52 1.09 0.30 -0.98 121.20 127.03 2gt3 s ILE 98 Ca 0.34 -0.73 -0.06 0.00 -1.10 0.00 0.00 60.65 59.10 2gt3 s ILE 98 Cb -0.17 -2.18 0.01 0.00 -1.06 0.00 0.00 42.46 39.07 2gt3 s ILE 98 CO 0.14 0.49 0.08 -0.69 -0.10 0.00 0.00 174.94 174.85 2gt3 s VAL 99 N 1.24 3.89 0.21 2.92 1.01 -0.09 0.13 120.40 129.71 2gt3 s VAL 99 Ca 0.03 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.28 2gt3 s VAL 99 Cb -0.14 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.17 2gt3 s VAL 99 CO -0.06 0.06 0.02 -0.72 0.00 0.00 0.00 175.10 174.40 2gt3 s TYR 100 N 1.48 1.37 -0.10 5.22 1.13 -0.31 0.20 117.35 126.33 2gt3 s TYR 100 Ca 0.02 -1.03 -0.01 0.00 -1.41 0.00 0.00 57.07 54.64 2gt3 s TYR 100 Cb -0.17 -0.79 -0.03 0.00 -1.10 0.00 0.00 41.96 39.87 2gt3 s TYR 100 CO 0.02 -0.20 -0.05 0.16 -2.51 0.00 0.00 175.55 172.98 2gt3 s ASP 101 N -3.24 4.80 0.00 -0.18 3.84 -1.06 -0.59 116.67 120.24 2gt3 s ASP 101 Ca 0.28 -0.04 0.22 0.00 -0.00 0.00 0.00 52.55 53.01 2gt3 s ASP 101 Cb 0.06 -1.46 1.30 0.00 -1.38 0.00 0.00 42.92 41.44 2gt3 s ASP 101 CO 0.07 0.29 1.70 -0.81 -0.00 0.00 0.00 175.17 176.42 2gt3 n PRO 102 N 2.71 0.75 0.01 2.11 -0.04 -1.22 -1.05 135.00 138.27 2gt3 n PRO 102 Ca -0.18 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.24 2gt3 n PRO 102 Cb 0.53 -1.45 -0.11 0.00 -0.04 0.00 0.00 33.50 32.43 2gt3 n PRO 102 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2gt3 n SER 103 N -0.95 0.88 -0.04 3.54 2.88 -1.26 -4.61 113.62 114.06 2gt3 n SER 103 Ca 0.16 0.40 -0.05 0.00 -1.33 0.00 0.00 58.87 58.05 2gt3 n SER 103 Cb 0.07 0.04 -0.02 0.00 -0.75 0.00 0.00 64.21 63.56 2gt3 n SER 103 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2gt3 n VAL 104 N -2.96 1.18 -4.19 2.46 0.31 -1.00 -5.05 118.33 109.07 2gt3 n VAL 104 Ca -0.13 0.24 -0.22 0.00 -0.01 0.00 0.00 64.34 64.22 2gt3 n VAL 104 Cb 0.93 -1.99 -0.06 0.00 -0.91 0.00 0.00 33.84 31.82 2gt3 n VAL 104 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 2gt3 s ILE 105 N -2.35 3.86 -0.00 2.52 2.07 -0.22 -4.97 121.20 122.11 2gt3 s ILE 105 Ca -0.17 -1.66 0.08 0.00 -1.41 0.00 0.00 60.65 57.49 2gt3 s ILE 105 Cb 0.02 -3.11 -0.02 0.00 0.13 0.00 0.00 42.46 39.48 2gt3 s ILE 105 CO 0.25 -0.35 -0.24 -0.94 -1.91 0.00 0.00 174.94 171.75 2gt3 s SER 106 N -3.77 2.86 0.43 4.50 1.04 -1.26 -3.38 113.70 114.12 2gt3 s SER 106 Ca 0.33 -0.47 0.26 0.00 0.48 0.00 0.00 55.95 56.55 2gt3 s SER 106 Cb -0.07 -0.30 1.31 0.00 0.10 0.00 0.00 66.02 67.06 2gt3 s SER 106 CO 0.22 0.28 1.69 0.22 0.98 0.00 0.00 173.24 176.63 2gt3 h TYR 107 N 5.34 0.54 -0.79 5.02 3.20 -1.96 0.92 116.97 129.26 2gt3 h TYR 107 Ca -0.43 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.48 2gt3 h TYR 107 Cb 1.13 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 39.22 2gt3 h TYR 107 CO 0.42 -0.09 0.52 0.93 -1.64 0.00 0.00 178.16 178.29 2gt3 h GLU 108 N 0.20 1.03 -0.23 1.82 4.39 -2.00 -1.19 114.58 118.59 2gt3 h GLU 108 Ca 0.72 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 60.34 2gt3 h GLU 108 Cb 2.16 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 30.57 2gt3 h GLU 108 CO -0.35 0.68 0.04 1.96 -1.16 0.00 0.00 179.01 180.18 2gt3 h GLN 109 N 1.06 0.33 -0.28 2.33 4.20 0.47 -0.35 115.11 122.88 2gt3 h GLN 109 Ca 0.29 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.88 2gt3 h GLN 109 Cb -0.11 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 2gt3 h GLN 109 CO -0.07 0.33 -0.16 -0.07 -0.67 0.00 0.00 178.83 178.19 2gt3 h LEU 110 N 0.33 0.47 -0.37 1.46 3.38 -0.85 -1.48 115.31 118.24 2gt3 h LEU 110 Ca 0.08 -0.13 -0.17 0.00 0.09 0.00 0.00 57.88 57.75 2gt3 h LEU 110 Cb 0.16 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2gt3 h LEU 110 CO -0.00 0.65 -0.82 -0.07 0.09 0.00 0.00 178.44 178.29 2gt3 h LEU 111 N 0.44 0.04 0.42 1.67 3.38 -0.67 -2.82 115.31 117.77 2gt3 h LEU 111 Ca 0.08 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2gt3 h LEU 111 Cb 0.54 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2gt3 h LEU 111 CO 0.03 0.84 -0.20 -0.61 0.09 0.00 0.00 178.44 178.59 2gt3 h GLN 112 N 0.02 -0.54 -0.82 1.13 -0.00 -0.42 -2.80 115.11 111.67 2gt3 h GLN 112 Ca -0.01 0.04 0.11 0.00 -0.00 0.00 0.00 58.65 58.78 2gt3 h GLN 112 Cb 1.44 0.12 -0.08 0.00 0.00 0.00 0.00 27.48 28.97 2gt3 h GLN 112 CO 0.11 -0.26 0.45 -0.24 0.00 0.00 0.00 178.83 178.89 2gt3 h VAL 113 N -0.79 0.86 -0.45 2.39 3.04 -1.36 -1.99 116.25 117.95 2gt3 h VAL 113 Ca -0.06 -0.25 0.08 0.00 -1.01 0.00 0.00 66.70 65.46 2gt3 h VAL 113 Cb 0.54 0.06 -0.09 0.00 -2.01 0.00 0.00 31.29 29.79 2gt3 h VAL 113 CO 0.09 0.13 -0.42 0.15 -1.01 0.00 0.00 177.57 176.52 2gt3 h PHE 114 N 0.73 -1.21 -0.22 3.17 3.04 -1.34 1.27 116.94 122.38 2gt3 h PHE 114 Ca 0.41 0.07 0.06 0.00 3.98 0.00 0.00 57.97 62.49 2gt3 h PHE 114 Cb 0.42 0.60 -0.01 0.00 2.56 0.00 0.00 35.95 39.52 2gt3 h PHE 114 CO -0.07 -0.43 0.18 -1.49 -2.02 0.00 0.00 178.31 174.47 2gt3 h TRP 115 N -0.29 0.00 -0.29 0.41 4.06 -1.12 1.21 115.95 119.93 2gt3 h TRP 115 Ca 0.15 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.10 2gt3 h TRP 115 Cb 0.57 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.73 2gt3 h TRP 115 CO -0.64 0.00 0.00 -1.91 -3.56 0.00 0.00 178.44 172.33 2gt3 n GLU 116 N -4.26 1.89 -0.05 0.49 2.13 0.37 -3.92 120.64 117.30 2gt3 n GLU 116 Ca 0.02 -1.37 -0.06 0.00 0.66 0.00 0.00 57.16 56.41 2gt3 n GLU 116 Cb 0.32 -1.37 -0.04 0.00 0.27 0.00 0.00 31.44 30.61 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 0.59 3.24 -3.70 4.31 5.03 0.37 -4.88 115.26 120.22 2gt3 n ASN 117 Ca 0.15 -0.04 -0.02 0.00 0.87 0.00 0.00 54.58 55.54 2gt3 n ASN 117 Cb 0.36 -0.15 -0.01 0.00 -1.02 0.00 0.00 39.78 38.97 2gt3 n ASN 117 CO 0.00 0.00 0.00 -1.38 -1.83 0.00 0.00 177.26 174.05 2gt3 s HIS 118 N -2.18 -0.11 -0.08 3.10 -3.43 0.13 -4.27 115.29 108.46 2gt3 s HIS 118 Ca -0.12 -0.13 -0.04 0.00 -0.80 0.00 0.00 55.06 53.97 2gt3 s HIS 118 Cb 0.03 0.61 -0.04 0.00 -1.43 0.00 0.00 32.58 31.75 2gt3 s HIS 118 CO 0.21 -0.63 0.10 0.34 -2.00 0.00 0.00 174.74 172.75 2gt3 s ASP 119 N -2.93 5.98 0.00 7.38 -1.08 -1.26 -4.03 116.67 120.73 2gt3 s ASP 119 Ca 0.13 0.32 0.00 0.00 -0.52 0.00 0.00 52.55 52.48 2gt3 s ASP 119 Cb 0.01 -1.84 0.00 0.00 -1.46 0.00 0.00 42.92 39.63 2gt3 s ASP 119 CO -0.00 0.36 0.71 -0.81 0.52 0.00 0.00 175.17 175.95 2gt3 n PRO 120 N 1.75 0.75 -2.67 4.34 -0.04 -1.26 -3.25 135.00 134.62 2gt3 n PRO 120 Ca -0.17 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.20 2gt3 n PRO 120 Cb 0.54 -1.15 0.03 0.00 -0.04 0.00 0.00 33.50 32.88 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 0.57 3.37 0.80 0.55 0.00 -1.26 -2.00 120.51 122.54 2gt3 n ALA 121 Ca 0.00 -3.10 0.09 0.00 0.00 0.00 0.00 53.44 50.43 2gt3 n ALA 121 Cb 0.35 -0.94 0.05 0.00 0.00 0.00 0.00 19.45 18.92 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 -0.09 1.62 0.00 0.00 10.64 -1.20 -4.88 117.38 123.47 2gt3 n GLN 122 Ca 0.09 -1.39 0.00 0.00 -1.83 0.00 0.00 57.00 53.87 2gt3 n GLN 122 Cb 0.82 -1.36 0.00 0.00 -0.86 0.00 0.00 30.24 28.84 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 1.13 0.59 2.62 2.61 0.00 -1.26 -3.63 105.19 107.25 2gt3 n GLY 123 Ca 0.10 -0.84 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 2gt3 n GLY 123 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2gt3 n MET 124 N 0.00 4.27 0.00 1.61 0.00 -1.26 -4.41 117.12 117.33 2gt3 n MET 124 Ca 0.00 -3.51 0.00 0.00 0.00 0.00 0.00 57.70 54.19 2gt3 n MET 124 Cb 0.00 -2.73 0.00 0.00 0.00 0.00 0.00 33.22 30.49 2gt3 n MET 124 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 175.97 178.86 2gt3 n ARG 125 N 2.43 0.00 -3.91 3.17 -4.01 -1.21 -2.62 116.66 110.51 2gt3 n ARG 125 Ca 0.54 0.00 -0.28 0.00 -1.04 0.00 0.00 57.85 57.07 2gt3 n ARG 125 Cb 0.29 0.00 -0.16 0.00 -3.04 0.00 0.00 32.46 29.54 2gt3 n ARG 125 CO 0.00 0.00 0.00 -1.14 -3.04 0.00 0.00 177.63 173.45 2gt3 s GLN 126 N -1.57 1.57 5.12 2.89 0.74 0.26 -4.82 119.66 123.86 2gt3 s GLN 126 Ca 0.00 -0.50 0.00 0.00 0.05 0.00 0.00 55.36 54.91 2gt3 s GLN 126 Cb 0.00 -1.98 0.00 0.00 1.10 0.00 0.00 33.01 32.13 2gt3 s GLN 126 CO 0.00 -0.39 0.00 0.41 -0.55 0.00 0.00 175.29 174.76 2gt3 n GLY 127 N 4.86 3.47 0.38 2.59 0.00 -1.26 0.15 105.19 115.39 2gt3 n GLY 127 Ca -0.13 0.13 0.05 0.00 0.00 0.00 0.00 46.02 46.07 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 5.55 1.11 -4.60 1.61 4.13 -1.26 -4.76 115.26 117.04 2gt3 n ASN 128 Ca 0.00 -1.92 -0.36 0.00 1.68 0.00 0.00 54.58 53.98 2gt3 n ASN 128 Cb 0.00 -0.13 -0.10 0.00 -1.54 0.00 0.00 39.78 38.01 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 -1.11 5.69 -0.03 6.41 1.01 0.40 -5.09 116.67 123.96 2gt3 s ASP 129 Ca 0.17 0.02 0.07 0.00 0.71 0.00 0.00 52.55 53.53 2gt3 s ASP 129 Cb 0.09 -2.01 -0.02 0.00 1.01 0.00 0.00 42.92 42.00 2gt3 s ASP 129 CO 0.13 0.08 -0.25 -1.38 0.21 0.00 0.00 175.17 173.96 2gt3 s HIS 130 N 0.92 2.38 0.00 4.23 -3.43 -1.26 0.91 115.29 119.04 2gt3 s HIS 130 Ca 0.05 -0.53 0.00 0.00 -0.80 0.00 0.00 55.06 53.78 2gt3 s HIS 130 Cb -0.14 -1.54 0.00 0.00 -1.43 0.00 0.00 32.58 29.48 2gt3 s HIS 130 CO 0.03 -0.09 0.00 0.41 -2.00 0.00 0.00 174.74 173.08 2gt3 n GLY 131 N 2.61 2.82 0.26 -1.38 0.00 -1.08 -4.94 105.19 103.48 2gt3 n GLY 131 Ca -0.17 -1.11 0.15 0.00 0.00 0.00 0.00 46.02 44.90 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 -1.18 0.00 1.10 2.61 -2.24 -1.26 -3.16 114.28 110.14 2gt3 n THR 132 Ca 0.00 -0.14 0.12 0.00 -2.27 0.00 0.00 64.05 61.76 2gt3 n THR 132 Cb 0.00 0.06 0.21 0.00 -2.10 0.00 0.00 70.33 68.50 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 -0.36 0.50 -1.37 -0.78 3.00 -1.26 -4.03 117.38 113.07 2gt3 n GLN 133 Ca 0.21 -0.33 -0.29 0.00 -0.01 0.00 0.00 57.00 56.58 2gt3 n GLN 133 Cb 0.25 -1.49 0.10 0.00 0.00 0.00 0.00 30.24 29.09 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 -0.96 2.99 -3.29 1.08 4.01 -1.19 -1.46 117.16 118.34 2gt3 n TYR 134 Ca 0.08 -2.61 -0.33 0.00 -0.16 0.00 0.00 57.90 54.89 2gt3 n TYR 134 Cb 0.36 -1.14 -0.06 0.00 -0.31 0.00 0.00 39.34 38.19 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 -3.66 3.93 -0.08 -0.72 6.06 -1.26 -3.30 118.95 119.93 2gt3 s ARG 135 Ca 0.60 0.49 -0.12 0.00 -2.50 0.00 0.00 55.73 54.20 2gt3 s ARG 135 Cb 0.48 -2.63 -0.05 0.00 0.06 0.00 0.00 34.95 32.81 2gt3 s ARG 135 CO 0.02 0.29 0.30 -1.54 -2.50 0.00 0.00 175.30 171.87 2gt3 s SER 136 N -2.17 6.59 -0.19 -2.12 1.04 -1.26 -4.14 113.70 111.45 2gt3 s SER 136 Ca 0.48 0.70 -0.29 0.00 0.48 0.00 0.00 55.95 57.32 2gt3 s SER 136 Cb -0.12 -2.18 0.13 0.00 0.10 0.00 0.00 66.02 63.95 2gt3 s SER 136 CO 0.20 0.29 1.00 0.00 0.98 0.00 0.00 173.24 175.71 2gt3 s ALA 137 N -0.66 -1.94 -0.19 5.32 0.00 -0.81 -2.47 121.76 121.01 2gt3 s ALA 137 Ca 0.19 1.66 -0.04 0.00 0.00 0.00 0.00 51.96 53.77 2gt3 s ALA 137 Cb -0.14 -0.89 -0.02 0.00 0.00 0.00 0.00 23.12 22.07 2gt3 s ALA 137 CO 0.08 -0.29 -0.04 0.42 0.00 0.00 0.00 175.76 175.93 2gt3 s ILE 138 N -0.76 3.61 -0.55 0.00 1.01 -1.02 -1.36 121.20 122.13 2gt3 s ILE 138 Ca -0.01 -0.43 0.03 0.00 0.00 0.00 0.00 60.65 60.24 2gt3 s ILE 138 Cb -0.02 -2.61 0.14 0.00 0.01 0.00 0.00 42.46 39.98 2gt3 s ILE 138 CO -0.00 0.45 0.30 -0.31 0.00 0.00 0.00 174.94 175.38 2gt3 s TYR 139 N 0.95 3.24 0.43 3.97 2.02 -0.02 -2.85 117.35 125.09 2gt3 s TYR 139 Ca 0.00 -3.12 -0.07 0.00 -0.37 0.00 0.00 57.07 53.51 2gt3 s TYR 139 Cb -0.15 -2.88 0.10 0.00 -0.40 0.00 0.00 41.96 38.64 2gt3 s TYR 139 CO 0.01 -0.75 0.47 -0.35 -1.57 0.00 0.00 175.55 173.36 2gt3 n PRO 140 N 3.10 -1.16 -0.01 -1.71 -0.04 -1.25 -1.45 135.00 132.48 2gt3 n PRO 140 Ca 0.06 -0.73 -0.01 0.00 -0.04 0.00 0.00 63.50 62.78 2gt3 n PRO 140 Cb 0.33 -0.58 -0.01 0.00 -0.04 0.00 0.00 33.50 33.20 2gt3 n PRO 140 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2gt3 n LEU 141 N 0.00 2.48 -4.98 1.53 7.99 -1.26 -1.01 117.00 121.74 2gt3 n LEU 141 Ca 0.06 -0.01 -0.20 0.00 -0.01 0.00 0.00 56.01 55.86 2gt3 n LEU 141 Cb 0.22 -0.04 0.00 0.00 -0.11 0.00 0.00 43.42 43.49 2gt3 n LEU 141 CO 0.16 0.44 0.11 0.42 -1.51 0.00 0.00 177.39 177.02 2gt3 s THR 142 N -2.03 3.95 0.17 -5.08 -4.23 -1.26 -4.87 115.64 102.29 2gt3 s THR 142 Ca -0.02 -0.90 0.02 0.00 -1.18 0.00 0.00 61.69 59.61 2gt3 s THR 142 Cb 0.01 -3.38 -0.13 0.00 1.34 0.00 0.00 72.50 70.33 2gt3 s THR 142 CO 0.04 -0.17 1.41 1.55 -0.54 0.00 0.00 174.62 176.91 2gt3 h PRO 143 N 0.77 0.25 -0.02 3.99 0.13 -2.00 -2.85 132.00 132.26 2gt3 h PRO 143 Ca -0.45 -0.25 -0.07 0.00 -0.87 0.00 0.00 66.00 64.36 2gt3 h PRO 143 Cb 1.26 0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.44 2gt3 h PRO 143 CO 0.53 0.94 -0.30 1.49 -0.23 0.00 0.00 178.00 180.43 2gt3 h GLU 144 N 0.15 0.04 -0.13 0.86 4.57 -1.99 -1.99 114.58 116.09 2gt3 h GLU 144 Ca -0.04 -0.01 -0.22 0.00 -1.18 0.00 0.00 59.36 57.91 2gt3 h GLU 144 Cb 1.42 -0.00 0.01 0.00 -0.16 0.00 0.00 28.75 30.02 2gt3 h GLU 144 CO 0.13 0.34 -0.77 1.96 -1.18 0.00 0.00 179.01 179.49 2gt3 h GLN 145 N 0.03 0.75 -0.86 1.92 4.20 -1.95 -1.16 115.11 118.04 2gt3 h GLN 145 Ca 0.00 -0.63 -0.02 0.00 0.06 0.00 0.00 58.65 58.06 2gt3 h GLN 145 Cb 0.55 0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.43 2gt3 h GLN 145 CO 0.04 1.24 0.48 -0.44 -0.67 0.00 0.00 178.83 179.48 2gt3 h ASP 146 N 0.46 1.07 -0.01 1.46 3.45 -1.24 1.32 116.42 122.93 2gt3 h ASP 146 Ca -0.06 -0.09 -0.16 0.00 0.43 0.00 0.00 57.03 57.15 2gt3 h ASP 146 Cb 1.41 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 39.90 2gt3 h ASP 146 CO 0.16 0.86 -0.52 0.00 -1.57 0.00 0.00 179.24 178.17 2gt3 h ALA 147 N 1.32 0.71 -0.20 3.45 0.00 -1.33 -0.70 119.26 122.51 2gt3 h ALA 147 Ca 0.31 -0.50 -0.17 0.00 0.00 0.00 0.00 54.91 54.55 2gt3 h ALA 147 Cb 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2gt3 h ALA 147 CO -0.05 0.68 -0.53 0.00 0.00 0.00 0.00 179.25 179.35 2gt3 h ALA 148 N 0.98 0.33 0.44 0.00 0.00 -0.29 0.40 119.26 121.11 2gt3 h ALA 148 Ca 0.02 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 2gt3 h ALA 148 Cb 1.06 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2gt3 h ALA 148 CO 0.10 0.54 -0.21 0.00 0.00 0.00 0.00 179.25 179.68 2gt3 h ALA 149 N 0.59 -0.59 -0.10 0.00 0.00 0.18 -2.01 119.26 117.34 2gt3 h ALA 149 Ca -0.01 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 2gt3 h ALA 149 Cb 1.15 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 2gt3 h ALA 149 CO 0.12 -0.82 -0.29 0.07 0.00 0.00 0.00 179.25 178.33 2gt3 h ARG 150 N -0.61 0.18 -0.77 0.00 0.11 -1.16 -2.55 114.38 109.57 2gt3 h ARG 150 Ca -0.06 -0.06 0.10 0.00 0.10 0.00 0.00 59.98 60.06 2gt3 h ARG 150 Cb 0.46 -0.01 -0.07 0.00 1.11 0.00 0.00 29.97 31.45 2gt3 h ARG 150 CO 0.10 0.46 0.41 0.00 0.10 0.00 0.00 179.97 181.03 2gt3 h ALA 151 N 1.55 1.09 -0.18 0.08 0.00 0.24 0.59 119.26 122.63 2gt3 h ALA 151 Ca 0.02 0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 2gt3 h ALA 151 Cb 0.60 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2gt3 h ALA 151 CO 0.04 0.00 -0.52 0.66 0.00 0.00 0.00 179.25 179.43 2gt3 h SER 152 N 0.68 0.57 -0.05 0.00 4.64 -0.99 -2.46 113.55 115.93 2gt3 h SER 152 Ca 0.38 -0.29 0.02 0.00 -0.47 0.00 0.00 61.79 61.43 2gt3 h SER 152 Cb 0.40 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 2gt3 h SER 152 CO -0.27 0.98 -0.08 0.25 -0.87 0.00 0.00 176.83 176.84 2gt3 h LEU 153 N 0.40 -0.24 -1.38 5.97 6.46 -0.61 1.35 115.31 127.26 2gt3 h LEU 153 Ca 0.01 0.04 -0.01 0.00 -0.12 0.00 0.00 57.88 57.81 2gt3 h LEU 153 Cb 1.05 0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 41.07 2gt3 h LEU 153 CO 0.10 -0.11 0.29 -0.33 -0.62 0.00 0.00 178.44 177.76 2gt3 h GLU 154 N -0.11 0.71 0.00 1.25 5.08 -0.94 -0.75 114.58 119.82 2gt3 h GLU 154 Ca 0.05 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 2gt3 h GLU 154 Cb 0.18 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2gt3 h GLU 154 CO -0.12 0.52 -0.51 -0.09 -1.00 0.00 0.00 179.01 177.81 2gt3 h ARG 155 N 0.72 0.00 -0.25 2.33 2.43 -0.77 -3.24 114.38 115.60 2gt3 h ARG 155 Ca 0.19 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.28 2gt3 h ARG 155 Cb 0.01 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 2gt3 h ARG 155 CO -0.03 0.51 -0.15 0.35 -1.51 0.00 0.00 179.97 179.13 2gt3 h PHE 156 N 0.00 0.63 -0.92 2.20 3.04 0.32 -1.07 116.94 121.13 2gt3 h PHE 156 Ca -0.01 -0.17 0.22 0.00 3.98 0.00 0.00 57.97 62.00 2gt3 h PHE 156 Cb 1.24 -0.14 -0.06 0.00 2.56 0.00 0.00 35.95 39.54 2gt3 h PHE 156 CO 0.00 0.82 0.62 -0.56 -2.02 0.00 0.00 178.31 177.17 2gt3 h GLN 157 N 0.26 0.32 0.22 1.11 3.07 -1.35 0.37 115.11 119.12 2gt3 h GLN 157 Ca 0.05 -0.02 -0.30 0.00 0.09 0.00 0.00 58.65 58.47 2gt3 h GLN 157 Cb 0.67 -0.07 0.03 0.00 0.08 0.00 0.00 27.48 28.19 2gt3 h GLN 157 CO 0.04 0.21 -1.36 0.00 0.09 0.00 0.00 178.83 177.82 2gt3 h ALA 158 N 1.60 -0.12 0.30 0.06 0.00 -1.60 -2.12 119.26 117.38 2gt3 h ALA 158 Ca 0.48 -0.85 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2gt3 h ALA 158 Cb 1.31 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.27 2gt3 h ALA 158 CO -0.16 0.65 -0.34 0.00 0.00 0.00 0.00 179.25 179.40 2gt3 h ALA 159 N 0.13 -0.69 -0.46 0.00 0.00 0.60 0.14 119.26 118.96 2gt3 h ALA 159 Ca -0.24 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 2gt3 h ALA 159 Cb 2.04 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 20.30 2gt3 h ALA 159 CO 0.24 -0.93 0.14 0.00 0.00 0.00 0.00 179.25 178.69 2gt3 h MET 160 N -0.68 0.68 -0.54 0.00 -0.00 -0.54 -2.36 114.93 111.49 2gt3 h MET 160 Ca -0.01 -0.11 0.02 0.00 -0.00 0.00 0.00 59.70 59.59 2gt3 h MET 160 Cb 0.63 -0.11 -0.03 0.00 -0.00 0.00 0.00 31.60 32.08 2gt3 h MET 160 CO -0.09 0.60 0.34 -0.07 -0.00 0.00 0.00 176.91 177.69 2gt3 h LEU 161 N 0.66 0.56 -2.44 -0.10 3.38 -0.67 0.15 115.31 116.85 2gt3 h LEU 161 Ca 0.15 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.14 2gt3 h LEU 161 Cb 0.21 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2gt3 h LEU 161 CO -0.01 0.40 0.09 0.00 0.09 0.00 0.00 178.44 179.01 2gt3 h ALA 162 N 1.23 1.53 -0.30 1.53 0.00 -0.21 0.94 119.26 123.97 2gt3 h ALA 162 Ca 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2gt3 h ALA 162 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2gt3 h ALA 162 CO -0.08 -0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.05 2gt3 n ALA 163 N -2.26 2.46 -2.02 0.00 0.00 0.32 -4.85 120.51 114.15 2gt3 n ALA 163 Ca -0.01 -0.55 -0.10 0.00 0.00 0.00 0.00 53.44 52.78 2gt3 n ALA 163 Cb 0.18 -0.99 -0.01 0.00 0.00 0.00 0.00 19.45 18.63 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 0.41 -3.52 -4.17 0.00 2.03 0.33 -4.98 116.55 106.64 2gt3 n ASP 164 Ca 0.11 0.04 -0.39 0.00 0.52 0.00 0.00 54.79 55.07 2gt3 n ASP 164 Cb 0.27 -2.62 -0.10 0.00 -0.72 0.00 0.00 41.12 37.96 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 -2.62 5.52 -0.11 1.67 1.11 -0.03 -4.90 116.67 117.32 2gt3 s ASP 165 Ca 0.00 -1.98 0.08 0.00 0.18 0.00 0.00 52.55 50.83 2gt3 s ASP 165 Cb 0.00 -1.94 0.42 0.00 1.07 0.00 0.00 42.92 42.47 2gt3 s ASP 165 CO 0.00 -0.63 1.18 -0.90 1.18 0.00 0.00 175.17 176.00 2gt3 n ASP 166 N 4.76 3.29 -4.38 0.27 5.68 -1.26 -3.09 116.55 121.83 2gt3 n ASP 166 Ca -0.05 -2.42 -0.33 0.00 -0.50 0.00 0.00 54.79 51.49 2gt3 n ASP 166 Cb 0.41 -0.55 0.14 0.00 -1.14 0.00 0.00 41.12 39.99 2gt3 n ASP 166 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2gt3 n ARG 167 N 0.38 -0.82 -3.78 0.11 1.74 -1.26 -4.96 116.66 108.05 2gt3 n ARG 167 Ca 0.14 -0.21 -0.35 0.00 -0.77 0.00 0.00 57.85 56.66 2gt3 n ARG 167 Cb 0.69 -1.83 -0.08 0.00 -1.02 0.00 0.00 32.46 30.22 2gt3 n ARG 167 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2gt3 s HIS 168 N -2.35 3.42 -0.75 -1.55 5.65 -1.26 -5.01 115.29 113.44 2gt3 s HIS 168 Ca 0.57 0.33 -0.26 0.00 0.25 0.00 0.00 55.06 55.96 2gt3 s HIS 168 Cb -0.18 -2.12 -0.05 0.00 -1.18 0.00 0.00 32.58 29.05 2gt3 s HIS 168 CO 0.67 0.34 2.01 0.42 -0.65 0.00 0.00 174.74 177.52 2gt3 s ILE 169 N 0.16 3.33 -1.05 0.89 1.01 -1.26 -4.69 121.20 119.58 2gt3 s ILE 169 Ca 0.09 -0.09 0.17 0.00 0.00 0.00 0.00 60.65 60.81 2gt3 s ILE 169 Cb -0.11 -3.79 0.16 0.00 0.01 0.00 0.00 42.46 38.73 2gt3 s ILE 169 CO -0.01 -0.75 1.54 0.35 0.00 0.00 0.00 174.94 176.07 2gt3 n THR 170 N 7.75 0.80 -2.27 2.92 -2.24 -1.02 -4.77 114.28 115.44 2gt3 n THR 170 Ca 0.33 0.20 -0.36 0.00 -2.27 0.00 0.00 64.05 61.96 2gt3 n THR 170 Cb 0.49 -0.91 -0.00 0.00 -2.10 0.00 0.00 70.33 67.81 2gt3 n THR 170 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2gt3 s THR 171 N -2.95 3.18 0.02 4.28 -1.32 -0.85 -4.72 115.64 113.28 2gt3 s THR 171 Ca 0.09 0.77 0.04 0.00 -1.21 0.00 0.00 61.69 61.39 2gt3 s THR 171 Cb 0.11 -3.33 -0.02 0.00 -1.51 0.00 0.00 72.50 67.75 2gt3 s THR 171 CO 0.30 -0.12 -0.13 -1.83 -2.21 0.00 0.00 174.62 170.64 2gt3 s GLU 172 N -3.12 0.90 -0.15 7.08 -1.05 -1.03 -4.99 118.70 116.33 2gt3 s GLU 172 Ca 0.70 -0.65 -0.03 0.00 -0.15 0.00 0.00 54.97 54.84 2gt3 s GLU 172 Cb -0.25 -0.88 -0.03 0.00 -0.44 0.00 0.00 34.13 32.54 2gt3 s GLU 172 CO 0.29 0.22 -0.05 0.42 0.95 0.00 0.00 175.26 177.09 2gt3 s ILE 173 N -0.70 3.78 0.11 1.83 -1.09 -1.26 -2.44 121.20 121.43 2gt3 s ILE 173 Ca 0.02 -0.40 -0.17 0.00 -2.23 0.00 0.00 60.65 57.87 2gt3 s ILE 173 Cb -0.07 -2.64 0.04 0.00 -1.58 0.00 0.00 42.46 38.20 2gt3 s ILE 173 CO 0.01 0.50 0.41 0.00 -1.23 0.00 0.00 174.94 174.63 2gt3 s ALA 174 N 0.30 -0.96 0.79 9.38 0.00 -1.13 -5.01 121.76 125.11 2gt3 s ALA 174 Ca -0.04 0.02 -0.11 0.00 0.00 0.00 0.00 51.96 51.82 2gt3 s ALA 174 Cb -0.14 0.65 0.07 0.00 0.00 0.00 0.00 23.12 23.69 2gt3 s ALA 174 CO 0.03 -0.62 1.12 1.21 0.00 0.00 0.00 175.76 177.50 2gt3 s ASN 175 N -2.68 4.19 -0.07 0.00 2.47 -1.26 -3.79 114.94 113.79 2gt3 s ASN 175 Ca 0.02 1.98 -0.30 0.00 0.42 0.00 0.00 52.86 54.98 2gt3 s ASN 175 Cb 0.01 -2.54 -0.06 0.00 -1.45 0.00 0.00 41.25 37.22 2gt3 s ASN 175 CO -0.11 -2.25 1.73 0.00 -3.72 0.00 0.00 177.10 172.75 2gt3 s ALA 176 N -2.69 3.52 0.34 1.71 0.00 -0.18 -4.78 121.76 119.67 2gt3 s ALA 176 Ca 0.64 0.92 0.04 0.00 0.00 0.00 0.00 51.96 53.57 2gt3 s ALA 176 Cb -0.20 -3.79 -0.02 0.00 0.00 0.00 0.00 23.12 19.11 2gt3 s ALA 176 CO 0.53 -1.57 0.49 0.95 0.00 0.00 0.00 175.76 176.17 2gt3 s THR 177 N 4.48 4.48 -1.08 0.00 -4.23 -1.26 -5.00 115.64 113.02 2gt3 s THR 177 Ca 0.77 -0.83 -0.22 0.00 -1.18 0.00 0.00 61.69 60.23 2gt3 s THR 177 Cb -0.34 -3.59 -0.00 0.00 1.34 0.00 0.00 72.50 69.91 2gt3 s THR 177 CO 0.32 -0.28 1.75 -2.16 -0.54 0.00 0.00 174.62 173.70 2gt3 s PRO 178 N -4.22 3.17 0.43 3.99 0.04 -1.26 -4.96 135.00 132.19 2gt3 s PRO 178 Ca 0.42 -1.09 -0.17 0.00 0.04 0.00 0.00 61.00 60.20 2gt3 s PRO 178 Cb -0.09 -5.29 -0.09 0.00 0.04 0.00 0.00 34.50 29.06 2gt3 s PRO 178 CO 0.33 -2.91 0.89 -0.59 0.04 0.00 0.00 177.00 174.76 2gt3 s PHE 179 N 7.46 3.38 -0.19 0.56 -0.71 -1.26 -4.96 117.98 122.25 2gt3 s PHE 179 Ca 0.59 1.42 -0.09 0.00 -1.04 0.00 0.00 56.93 57.81 2gt3 s PHE 179 Cb -0.01 -2.72 -0.05 0.00 -1.21 0.00 0.00 43.02 39.04 2gt3 s PHE 179 CO 0.01 -0.14 0.10 1.52 -1.34 0.00 0.00 175.22 175.37 2gt3 s TYR 180 N -2.30 3.35 0.15 3.49 -0.85 -1.10 -4.90 117.35 115.21 2gt3 s TYR 180 Ca 0.58 0.23 -0.32 0.00 -0.52 0.00 0.00 57.07 57.05 2gt3 s TYR 180 Cb -0.10 -2.12 -0.11 0.00 0.38 0.00 0.00 41.96 40.01 2gt3 s TYR 180 CO 0.22 0.25 1.79 0.66 -1.52 0.00 0.00 175.55 176.94 2gt3 n TYR 181 N 3.49 2.66 -1.07 -3.49 4.01 -1.26 -2.45 117.16 119.05 2gt3 n TYR 181 Ca -0.16 -0.07 -0.28 0.00 -0.16 0.00 0.00 57.90 57.23 2gt3 n TYR 181 Cb 0.52 -2.71 0.19 0.00 -0.31 0.00 0.00 39.34 37.04 2gt3 n TYR 181 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2gt3 s ALA 182 N 2.12 0.65 0.98 -0.72 0.00 0.59 -4.80 121.76 120.56 2gt3 s ALA 182 Ca 0.79 -0.36 -0.13 0.00 0.00 0.00 0.00 51.96 52.26 2gt3 s ALA 182 Cb -0.50 -3.13 0.08 0.00 0.00 0.00 0.00 23.12 19.57 2gt3 s ALA 182 CO 0.36 -3.06 0.52 -1.91 0.00 0.00 0.00 175.76 171.66 2gt3 n GLU 183 N -4.34 -0.58 -0.11 0.00 2.13 -1.26 -4.59 120.64 111.89 2gt3 n GLU 183 Ca 0.05 -0.13 -0.06 0.00 0.66 0.00 0.00 57.16 57.68 2gt3 n GLU 183 Cb 0.57 -1.95 0.13 0.00 0.27 0.00 0.00 31.44 30.46 2gt3 n GLU 183 CO 0.00 0.00 0.00 0.22 -0.41 0.00 0.00 177.13 176.94 2gt3 h ASP 184 N -1.74 0.79 -0.54 4.31 -0.00 -1.90 0.26 116.42 117.60 2gt3 h ASP 184 Ca -0.45 -0.22 0.06 0.00 -0.00 0.00 0.00 57.03 56.42 2gt3 h ASP 184 Cb 1.29 -0.21 -0.03 0.00 -0.00 0.00 0.00 39.33 40.38 2gt3 h ASP 184 CO 0.37 0.89 0.36 -0.78 -0.00 0.00 0.00 179.24 180.08 2gt3 h ASP 185 N 0.74 0.43 0.17 2.28 3.58 -1.98 -1.96 116.42 119.68 2gt3 h ASP 185 Ca 0.13 0.00 -0.30 0.00 0.42 0.00 0.00 57.03 57.29 2gt3 h ASP 185 Cb 0.54 -0.09 0.01 0.00 1.72 0.00 0.00 39.33 41.51 2gt3 h ASP 185 CO 0.03 0.28 -1.42 0.45 -2.88 0.00 0.00 179.24 175.70 2gt3 h HIS 186 N 0.49 0.66 -2.00 0.28 3.86 -1.71 -3.40 115.15 113.34 2gt3 h HIS 186 Ca 0.23 -0.48 -0.63 0.00 -1.16 0.00 0.00 60.37 58.33 2gt3 h HIS 186 Cb 0.30 -0.03 0.03 0.00 1.06 0.00 0.00 27.41 28.77 2gt3 h HIS 186 CO -0.00 1.55 0.97 1.04 0.86 0.00 0.00 177.93 182.35 2gt3 n GLN 187 N -3.82 1.98 -3.91 2.45 6.02 0.84 -1.55 117.38 119.39 2gt3 n GLN 187 Ca -0.21 0.72 -0.29 0.00 -0.01 0.00 0.00 57.00 57.21 2gt3 n GLN 187 Cb 0.98 -2.52 -0.00 0.00 1.02 0.00 0.00 30.24 29.72 2gt3 n GLN 187 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2gt3 n GLN 188 N 5.54 -2.32 0.16 -1.09 3.00 -1.26 -4.88 117.38 116.53 2gt3 n GLN 188 Ca 0.22 0.37 -0.14 0.00 -0.01 0.00 0.00 57.00 57.44 2gt3 n GLN 188 Cb 0.27 -4.19 -0.08 0.00 0.00 0.00 0.00 30.24 26.24 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 -1.92 -0.35 -0.92 1.08 3.20 -1.49 -2.03 116.97 114.54 2gt3 h TYR 189 Ca -0.65 -0.01 0.27 0.00 3.14 0.00 0.00 58.73 61.48 2gt3 h TYR 189 Cb 1.38 0.12 -0.04 0.00 1.54 0.00 0.00 36.73 39.72 2gt3 h TYR 189 CO 0.44 -0.12 0.82 1.25 -1.64 0.00 0.00 178.16 178.90 2gt3 h LEU 190 N -0.52 0.00 -0.19 2.82 7.12 -1.77 1.55 115.31 124.32 2gt3 h LEU 190 Ca -0.04 0.00 -0.21 0.00 0.13 0.00 0.00 57.88 57.77 2gt3 h LEU 190 Cb 0.38 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.52 2gt3 h LEU 190 CO 0.06 0.00 -0.68 -0.74 -0.13 0.00 0.00 178.44 176.95 2gt3 h HIS 191 N 0.00 1.05 -0.12 1.25 -0.00 -1.72 -2.91 115.15 112.70 2gt3 h HIS 191 Ca 0.44 -0.44 -0.16 0.00 -0.00 0.00 0.00 60.37 60.21 2gt3 h HIS 191 Cb 2.07 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 29.30 2gt3 h HIS 191 CO 0.00 1.27 -0.59 -0.22 -0.00 0.00 0.00 177.93 178.38 2gt3 h LYS 192 N 0.54 0.41 -3.82 5.26 3.64 0.23 -3.38 116.57 119.44 2gt3 h LYS 192 Ca -0.03 -0.27 -0.62 0.00 -1.27 0.00 0.00 60.65 58.46 2gt3 h LYS 192 Cb 1.31 0.04 -0.40 0.00 -0.41 0.00 0.00 32.23 32.77 2gt3 h LYS 192 CO 0.14 0.88 -0.73 -0.80 -2.27 0.00 0.00 179.45 176.67 2gt3 s ASN 193 N -6.92 4.23 0.27 4.20 0.01 0.97 -4.95 114.94 112.76 2gt3 s ASN 193 Ca -0.06 -2.07 0.25 0.00 -0.71 0.00 0.00 52.86 50.28 2gt3 s ASN 193 Cb 0.11 -1.20 0.89 0.00 0.41 0.00 0.00 41.25 41.47 2gt3 s ASN 193 CO 0.82 -0.37 1.75 1.55 -1.51 0.00 0.00 177.10 179.35 2gt3 h PRO 194 N 7.60 0.00 -0.01 -0.60 0.13 -1.71 -2.64 132.00 134.77 2gt3 h PRO 194 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2gt3 h PRO 194 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 2gt3 h PRO 194 CO 0.50 0.00 -0.34 2.48 -0.23 0.00 0.00 178.00 180.41 2gt3 n TYR 195 N -2.37 0.00 0.00 1.56 4.11 -1.26 -4.94 117.16 114.26 2gt3 n TYR 195 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.94 2gt3 n TYR 195 Cb 0.34 -0.05 0.00 0.00 -0.00 0.00 0.00 39.34 39.63 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 1.37 -2.88 3.67 -7.48 0.00 -0.99 -4.88 105.19 94.01 2gt3 n GLY 196 Ca 0.11 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 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 -0.21 3.41 -0.52 1.61 1.51 -1.26 -4.95 117.35 116.94 2gt3 s TYR 197 Ca 0.00 1.36 0.06 0.00 -1.01 0.00 0.00 57.07 57.47 2gt3 s TYR 197 Cb 0.00 -3.10 0.37 0.00 -0.11 0.00 0.00 41.96 39.12 2gt3 s TYR 197 CO 0.00 -0.30 0.99 0.00 -1.11 0.00 0.00 175.55 175.13 2gt3 s GLY 199 N -3.43 1.94 -0.21 0.00 0.00 -1.26 -4.93 107.32 99.43 2gt3 s GLY 199 Ca 0.48 -1.17 -0.07 0.00 0.00 0.00 0.00 44.72 43.96 2gt3 s GLY 199 CO -0.15 0.68 -0.24 4.51 0.00 0.00 0.00 173.10 177.90 2gt3 n ILE 200 N 5.07 1.14 -0.41 0.90 0.13 -1.26 -4.93 119.36 119.99 2gt3 n ILE 200 Ca -0.14 -0.33 0.00 0.00 -1.10 0.00 0.00 62.75 61.18 2gt3 n ILE 200 Cb 0.51 -1.61 0.00 0.00 -0.84 0.00 0.00 39.64 37.70 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 1.94 0.62 0.00 4.50 0.00 -1.26 -4.67 105.19 106.32 2gt3 n GLY 201 Ca -0.39 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.57 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 1.36 0.14 -0.02 0.00 -1.26 -4.98 105.19 100.43 2gt3 n GLY 202 Ca 0.00 -0.94 -0.21 0.00 0.00 0.00 0.00 46.02 44.88 2gt3 n GLY 202 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2gt3 n ILE 203 N -0.53 1.46 -3.64 -0.61 -5.35 -1.26 -4.64 119.36 104.80 2gt3 n ILE 203 Ca 0.00 -0.51 -0.24 0.00 -0.27 0.00 0.00 62.75 61.73 2gt3 n ILE 203 Cb 0.00 -1.52 0.07 0.00 -1.74 0.00 0.00 39.64 36.45 2gt3 n ILE 203 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2gt3 n GLY 204 N 2.03 -0.47 3.49 3.28 0.00 -1.26 -4.99 105.19 107.27 2gt3 n GLY 204 Ca -0.47 0.20 -0.31 0.00 0.00 0.00 0.00 46.02 45.44 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 -3.36 3.04 -0.20 1.61 1.01 -1.26 -5.05 120.40 116.19 2gt3 s VAL 205 Ca 0.43 -1.01 -0.36 0.00 0.00 0.00 0.00 61.98 61.03 2gt3 s VAL 205 Cb -0.20 -2.28 -0.13 0.00 0.00 0.00 0.00 36.38 33.78 2gt3 s VAL 205 CO 0.76 0.39 1.90 0.00 0.00 0.00 0.00 175.10 178.14 2gt3 s LEU 207 N 4.53 2.16 -0.20 0.00 -0.00 -1.26 -4.66 118.68 119.25 2gt3 s LEU 207 Ca 0.98 -0.34 -0.29 0.00 -0.00 0.00 0.00 54.13 54.47 2gt3 s LEU 207 Cb -0.83 -0.02 -0.01 0.00 -0.00 0.00 0.00 46.19 45.33 2gt3 s LEU 207 CO 0.56 -0.17 1.29 -2.16 -0.00 0.00 0.00 176.35 175.88 2gt3 s PRO 208 N -0.97 4.13 -0.70 1.48 0.04 -1.26 -4.90 135.00 132.82 2gt3 s PRO 208 Ca -0.09 1.56 -0.06 0.00 0.04 0.00 0.00 61.00 62.45 2gt3 s PRO 208 Cb -0.07 -3.81 -0.13 0.00 0.04 0.00 0.00 34.50 30.54 2gt3 s PRO 208 CO -0.00 -0.84 2.64 -0.35 0.04 0.00 0.00 177.00 178.48 2gt3 n PRO 209 N 6.85 2.23 0.07 0.56 -0.04 -1.26 -4.24 135.00 139.17 2gt3 n PRO 209 Ca 0.14 -1.34 -0.20 0.00 -0.04 0.00 0.00 63.50 62.07 2gt3 n PRO 209 Cb 0.45 -2.29 -0.15 0.00 -0.04 0.00 0.00 33.50 31.48 2gt3 n PRO 209 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2gt3 h GLU 210 N 4.89 0.32 0.00 0.54 5.08 -2.07 -3.58 114.58 119.76 2gt3 h GLU 210 Ca 0.44 -0.54 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2gt3 h GLU 210 Cb 0.61 0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.06 2gt3 h GLU 210 CO 1.04 1.20 0.00 0.00 -1.00 0.00 0.00 179.01 180.25