#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2plu s TYR 15 N 0.00 1.36 -0.06 1.96 2.02 -1.26 -1.50 117.35 119.87 2plu s TYR 15 Ca 0.00 -0.51 -0.01 0.00 -0.37 0.00 0.00 57.07 56.18 2plu s TYR 15 Cb 0.00 -0.74 0.03 0.00 -0.40 0.00 0.00 41.96 40.85 2plu s TYR 15 CO 0.00 0.11 0.01 0.12 -1.57 0.00 0.00 175.55 174.22 2plu s PHE 16 N -1.70 0.53 -1.29 2.71 5.36 0.82 -4.80 117.98 119.60 2plu s PHE 16 Ca 0.04 -0.08 -0.07 0.00 -0.96 0.00 0.00 56.93 55.86 2plu s PHE 16 Cb -0.07 -0.70 0.05 0.00 -0.34 0.00 0.00 43.02 41.96 2plu s PHE 16 CO 0.03 -0.28 0.44 1.04 -1.46 0.00 0.00 175.22 174.99 2plu n GLN 17 N 5.02 -3.49 -0.40 10.12 6.02 -1.26 -1.42 117.38 131.96 2plu n GLN 17 Ca -0.09 0.57 0.00 0.00 -0.01 0.00 0.00 57.00 57.47 2plu n GLN 17 Cb 0.50 -5.29 0.00 0.00 1.02 0.00 0.00 30.24 26.47 2plu n GLN 17 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2plu n GLY 18 N -1.18 1.16 3.69 1.08 0.00 -1.26 -5.04 105.19 103.63 2plu n GLY 18 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 2plu n GLY 18 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2plu s ASN 19 N -3.07 5.02 0.48 1.61 0.01 -0.51 -4.90 114.94 113.57 2plu s ASN 19 Ca 0.00 -0.18 -0.23 0.00 -0.71 0.00 0.00 52.86 51.74 2plu s ASN 19 Cb 0.00 -1.19 -0.07 0.00 0.41 0.00 0.00 41.25 40.40 2plu s ASN 19 CO 0.00 0.17 1.21 -2.16 -1.51 0.00 0.00 177.10 174.82 2plu s PRO 20 N -2.31 3.63 -0.08 -0.60 0.04 -1.25 -0.13 135.00 134.29 2plu s PRO 20 Ca 0.26 1.89 0.02 0.00 0.04 0.00 0.00 61.00 63.20 2plu s PRO 20 Cb -0.12 -2.38 -0.02 0.00 0.04 0.00 0.00 34.50 32.02 2plu s PRO 20 CO 0.18 -0.69 -0.13 0.08 0.04 0.00 0.00 177.00 176.48 2plu s VAL 21 N -1.48 3.10 0.30 -0.36 1.01 -0.56 -1.19 120.40 121.20 2plu s VAL 21 Ca 0.65 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.97 2plu s VAL 21 Cb -0.31 -2.25 -0.06 0.00 0.00 0.00 0.00 36.38 33.76 2plu s VAL 21 CO 0.38 0.57 0.08 0.68 0.00 0.00 0.00 175.10 176.80 2plu s VAL 22 N -0.31 0.87 0.03 2.92 -7.23 -0.34 -4.66 120.40 111.68 2plu s VAL 22 Ca 0.03 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.16 2plu s VAL 22 Cb -0.13 -2.71 -0.02 0.00 0.56 0.00 0.00 36.38 34.09 2plu s VAL 22 CO 0.03 0.00 0.05 -0.72 -0.31 0.00 0.00 175.10 174.14 2plu s TYR 23 N -3.51 0.27 -0.08 2.82 -0.85 -0.40 -0.43 117.35 115.18 2plu s TYR 23 Ca 0.37 -0.60 0.05 0.00 -0.52 0.00 0.00 57.07 56.37 2plu s TYR 23 Cb 0.08 -0.19 -0.01 0.00 0.38 0.00 0.00 41.96 42.22 2plu s TYR 23 CO 0.15 -0.32 -0.23 -0.06 -1.52 0.00 0.00 175.55 173.56 2plu s PHE 24 N -2.53 2.53 0.01 -3.49 0.08 0.13 -2.34 117.98 112.37 2plu s PHE 24 Ca -0.06 -0.77 -0.14 0.00 0.12 0.00 0.00 56.93 56.09 2plu s PHE 24 Cb -0.02 -1.66 -0.06 0.00 -0.57 0.00 0.00 43.02 40.72 2plu s PHE 24 CO -0.04 -0.25 0.40 -0.51 -0.10 0.00 0.00 175.22 174.72 2plu s ASP 25 N -0.01 6.77 -0.03 1.36 1.01 -0.22 -0.40 116.67 125.15 2plu s ASP 25 Ca -0.08 0.92 0.05 0.00 0.71 0.00 0.00 52.55 54.16 2plu s ASP 25 Cb -0.15 -2.23 -0.01 0.00 1.01 0.00 0.00 42.92 41.54 2plu s ASP 25 CO 0.05 0.30 -0.19 -0.63 0.21 0.00 0.00 175.17 174.91 2plu s ILE 26 N -1.14 1.53 0.12 0.77 -1.09 -0.55 -0.47 121.20 120.38 2plu s ILE 26 Ca 0.25 -0.80 0.09 0.00 -2.23 0.00 0.00 60.65 57.96 2plu s ILE 26 Cb -0.16 -1.29 -0.04 0.00 -1.58 0.00 0.00 42.46 39.39 2plu s ILE 26 CO 0.14 0.43 -0.17 -0.44 -1.23 0.00 0.00 174.94 173.68 2plu s SER 27 N -0.20 3.96 -0.18 3.58 0.01 -0.20 -0.16 113.70 120.52 2plu s SER 27 Ca 0.01 -0.54 0.01 0.00 1.31 0.00 0.00 55.95 56.74 2plu s SER 27 Cb -0.10 -0.59 0.03 0.00 0.21 0.00 0.00 66.02 65.57 2plu s SER 27 CO 0.01 0.17 -0.16 -0.63 0.41 0.00 0.00 173.24 173.04 2plu s ILE 28 N -1.19 1.87 0.00 1.44 1.01 0.03 -0.95 121.20 123.41 2plu s ILE 28 Ca 0.19 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 59.93 2plu s ILE 28 Cb -0.10 -1.76 0.00 0.00 0.01 0.00 0.00 42.46 40.61 2plu s ILE 28 CO 0.11 0.43 0.00 0.61 0.00 0.00 0.00 174.94 176.09 2plu n GLY 29 N 4.66 3.09 0.47 6.18 0.00 0.16 -1.53 105.19 118.22 2plu n GLY 29 Ca -0.18 -0.21 0.13 0.00 0.00 0.00 0.00 46.02 45.75 2plu n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2plu n GLN 30 N 14.00 1.63 -3.91 1.61 10.64 -1.26 -4.90 117.38 135.20 2plu n GLN 30 Ca 0.00 -0.94 -0.36 0.00 -1.83 0.00 0.00 57.00 53.88 2plu n GLN 30 Cb 0.00 -1.44 -0.11 0.00 -0.86 0.00 0.00 30.24 27.82 2plu n GLN 30 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 2plu s THR 31 N -1.92 4.50 0.24 -0.39 2.01 -0.58 -5.08 115.64 114.42 2plu s THR 31 Ca 0.36 -0.12 -0.31 0.00 0.31 0.00 0.00 61.69 61.93 2plu s THR 31 Cb 0.19 -3.06 -0.12 0.00 0.01 0.00 0.00 72.50 69.52 2plu s THR 31 CO 0.31 0.39 1.68 -2.84 -0.69 0.00 0.00 174.62 173.47 2plu s PRO 32 N 1.04 4.12 0.00 4.92 0.02 -1.26 -0.78 135.00 143.05 2plu s PRO 32 Ca 0.04 2.61 0.15 0.00 0.02 0.00 0.00 61.00 63.82 2plu s PRO 32 Cb -0.14 -3.05 -0.13 0.00 0.02 0.00 0.00 34.50 31.20 2plu s PRO 32 CO 0.03 -0.72 0.69 0.00 -0.33 0.00 0.00 177.00 176.67 2plu n ALA 33 N 3.30 3.82 0.00 -1.55 0.00 0.78 -4.86 120.51 122.00 2plu n ALA 33 Ca 0.13 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2plu n ALA 33 Cb 0.36 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.25 2plu n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2plu n GLY 34 N 1.32 -0.99 3.55 0.00 0.00 -1.20 -4.79 105.19 103.08 2plu n GLY 34 Ca 0.04 -2.15 -0.33 0.00 0.00 0.00 0.00 46.02 43.57 2plu n GLY 34 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2plu s ARG 35 N 0.00 2.65 -0.19 1.61 3.52 -1.26 -1.48 118.95 123.80 2plu s ARG 35 Ca 0.00 -0.61 -0.04 0.00 -0.13 0.00 0.00 55.73 54.95 2plu s ARG 35 Cb 0.00 -2.51 -0.02 0.00 -1.56 0.00 0.00 34.95 30.86 2plu s ARG 35 CO 0.00 0.65 -0.04 0.42 -0.81 0.00 0.00 175.30 175.51 2plu s ILE 36 N -0.80 3.57 -0.01 4.11 1.01 0.47 -3.94 121.20 125.60 2plu s ILE 36 Ca 0.12 -0.45 0.03 0.00 0.00 0.00 0.00 60.65 60.35 2plu s ILE 36 Cb -0.11 -2.59 -0.03 0.00 0.01 0.00 0.00 42.46 39.74 2plu s ILE 36 CO 0.02 0.45 -0.06 0.42 0.00 0.00 0.00 174.94 175.77 2plu s THR 37 N 0.98 3.73 -0.00 2.92 -4.23 -0.27 -0.69 115.64 118.08 2plu s THR 37 Ca 0.00 -0.70 0.03 0.00 -1.18 0.00 0.00 61.69 59.83 2plu s THR 37 Cb -0.15 -2.61 -0.01 0.00 1.34 0.00 0.00 72.50 71.07 2plu s THR 37 CO 0.01 0.42 -0.09 -0.04 -0.54 0.00 0.00 174.62 174.38 2plu s MET 38 N -1.35 0.69 -0.10 3.99 -1.94 0.43 -0.39 119.30 120.63 2plu s MET 38 Ca 0.17 -0.34 -0.15 0.00 -1.71 0.00 0.00 55.69 53.66 2plu s MET 38 Cb -0.11 -0.66 -0.05 0.00 2.01 0.00 0.00 34.83 36.02 2plu s MET 38 CO 0.07 0.18 0.36 -2.00 -0.01 0.00 0.00 175.02 173.62 2plu s GLU 39 N -0.29 4.12 -0.15 2.03 2.12 -0.22 -1.20 118.70 125.11 2plu s GLU 39 Ca 0.03 0.26 -0.05 0.00 0.36 0.00 0.00 54.97 55.57 2plu s GLU 39 Cb -0.04 -3.35 -0.03 0.00 0.26 0.00 0.00 34.13 30.97 2plu s GLU 39 CO -0.00 0.39 -0.00 -0.51 -0.54 0.00 0.00 175.26 174.60 2plu s LEU 40 N -0.05 3.47 -1.56 2.70 1.43 -0.33 -1.62 118.68 122.70 2plu s LEU 40 Ca 0.21 -0.02 -0.10 0.00 -1.03 0.00 0.00 54.13 53.18 2plu s LEU 40 Cb -0.15 -1.84 -0.08 0.00 0.03 0.00 0.00 46.19 44.16 2plu s LEU 40 CO 0.08 0.20 2.84 0.49 0.23 0.00 0.00 176.35 180.20 2plu n PHE 41 N 3.31 2.44 0.19 0.29 3.72 0.11 -3.90 117.46 123.63 2plu n PHE 41 Ca -0.17 -3.01 0.07 0.00 -0.05 0.00 0.00 57.45 54.29 2plu n PHE 41 Cb 0.53 -2.45 0.59 0.00 -0.94 0.00 0.00 39.48 37.21 2plu n PHE 41 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2plu h ALA 42 N 5.19 1.95 -0.66 4.37 0.00 -1.83 0.18 119.26 128.47 2plu h ALA 42 Ca 0.83 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.68 2plu h ALA 42 Cb 0.31 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2plu h ALA 42 CO 1.78 0.04 0.22 0.38 0.00 0.00 0.00 179.25 181.66 2plu h ASP 43 N 0.13 0.92 0.00 0.00 3.04 -1.91 -3.12 116.42 115.48 2plu h ASP 43 Ca 0.04 -0.15 0.00 0.00 -3.24 0.00 0.00 57.03 53.68 2plu h ASP 43 Cb 0.02 -0.24 0.00 0.00 -1.04 0.00 0.00 39.33 38.07 2plu h ASP 43 CO -0.01 0.85 -1.07 0.29 -2.04 0.00 0.00 179.24 177.26 2plu n LYS 44 N -4.28 1.36 -2.88 4.15 4.76 -1.04 -4.75 118.16 115.49 2plu n LYS 44 Ca 0.05 -0.05 -0.18 0.00 -2.87 0.00 0.00 58.31 55.26 2plu n LYS 44 Cb 0.21 -1.08 -0.01 0.00 -1.84 0.00 0.00 35.03 32.30 2plu n LYS 44 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2plu n VAL 45 N -1.60 1.18 -0.27 -0.18 0.31 0.62 -4.97 118.33 113.42 2plu n VAL 45 Ca -0.01 -4.39 -0.07 0.00 -0.01 0.00 0.00 64.34 59.87 2plu n VAL 45 Cb 0.17 -0.36 0.05 0.00 -0.91 0.00 0.00 33.84 32.79 2plu n VAL 45 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2plu h PRO 46 N 2.93 1.16 -0.23 5.55 0.13 -1.69 -0.48 132.00 139.37 2plu h PRO 46 Ca 0.08 -0.25 -0.02 0.00 -0.87 0.00 0.00 66.00 64.94 2plu h PRO 46 Cb 0.93 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 2plu h PRO 46 CO 0.61 0.99 0.07 0.82 -0.23 0.00 0.00 178.00 180.26 2plu h ILE 47 N 1.11 1.20 -0.17 -3.56 2.04 -1.94 -0.37 117.51 115.81 2plu h ILE 47 Ca 0.24 -0.63 -0.17 0.00 1.00 0.00 0.00 64.86 65.30 2plu h ILE 47 Cb 0.31 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.58 2plu h ILE 47 CO -0.01 0.20 -0.54 0.74 0.00 0.00 0.00 178.15 178.55 2plu h THR 48 N 0.20 1.32 -0.64 -0.27 2.02 -1.93 -2.37 112.91 111.24 2plu h THR 48 Ca 0.07 -1.78 0.05 0.00 0.77 0.00 0.00 66.41 65.52 2plu h THR 48 Cb 0.25 1.96 -0.05 0.00 -1.74 0.00 0.00 68.15 68.57 2plu h THR 48 CO -0.00 0.55 0.36 0.00 0.37 0.00 0.00 175.52 176.81 2plu h ALA 49 N 0.56 0.85 -0.42 6.16 0.00 -0.99 -2.22 119.26 123.20 2plu h ALA 49 Ca -0.02 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 2plu h ALA 49 Cb 1.16 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 2plu h ALA 49 CO 0.11 0.05 -0.33 1.49 0.00 0.00 0.00 179.25 180.58 2plu h GLU 50 N 0.68 0.96 -0.11 0.00 4.57 -1.05 0.09 114.58 119.73 2plu h GLU 50 Ca 0.28 -0.47 0.04 0.00 -1.18 0.00 0.00 59.36 58.03 2plu h GLU 50 Cb 0.14 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.69 2plu h GLU 50 CO -0.16 1.14 -0.16 -0.97 -1.18 0.00 0.00 179.01 177.67 2plu h ASN 51 N 0.80 -0.50 -0.30 1.04 -1.24 -1.30 -0.74 115.58 113.34 2plu h ASN 51 Ca 0.08 0.09 -0.01 0.00 0.71 0.00 0.00 56.30 57.16 2plu h ASN 51 Cb 0.92 0.23 -0.01 0.00 0.73 0.00 0.00 38.32 40.19 2plu h ASN 51 CO 0.09 -0.21 0.14 0.15 -1.29 0.00 0.00 177.43 176.30 2plu h PHE 52 N -0.21 0.44 -0.14 0.67 3.57 -1.22 -1.25 116.94 118.79 2plu h PHE 52 Ca 0.09 -0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.60 2plu h PHE 52 Cb 0.34 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.90 2plu h PHE 52 CO -0.27 0.41 -0.11 -0.09 -2.23 0.00 0.00 178.31 176.02 2plu h ARG 53 N 0.35 -0.12 -0.23 1.11 2.43 -0.79 -1.41 114.38 115.72 2plu h ARG 53 Ca 0.10 0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.22 2plu h ARG 53 Cb 0.14 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2plu h ARG 53 CO -0.01 -0.08 -0.12 0.00 -1.51 0.00 0.00 179.97 178.25 2plu h ALA 54 N 0.98 1.37 0.00 2.80 0.00 -1.02 -2.30 119.26 121.09 2plu h ALA 54 Ca 0.09 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.64 2plu h ALA 54 Cb 0.26 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2plu h ALA 54 CO -0.22 0.43 -0.57 -0.07 0.00 0.00 0.00 179.25 178.83 2plu h LEU 55 N 0.35 0.00 -0.11 0.00 3.38 -0.85 0.16 115.31 118.24 2plu h LEU 55 Ca 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2plu h LEU 55 Cb 0.44 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 2plu h LEU 55 CO 0.03 0.57 0.02 0.00 0.09 0.00 0.00 178.44 179.14 2plu h THR 57 N -0.06 1.43 -0.07 0.00 1.35 -1.31 -2.96 112.91 111.29 2plu h THR 57 Ca 0.03 -2.13 -0.03 0.00 -0.55 0.00 0.00 66.41 63.73 2plu h THR 57 Cb 0.29 2.12 -0.01 0.00 -1.73 0.00 0.00 68.15 68.82 2plu h THR 57 CO 0.00 0.62 -0.03 0.61 -0.25 0.00 0.00 175.52 176.48 2plu n GLY 58 N 0.36 0.49 0.33 5.82 0.00 0.56 -4.90 105.19 107.83 2plu n GLY 58 Ca -0.02 -0.23 0.21 0.00 0.00 0.00 0.00 46.02 45.98 2plu n GLY 58 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2plu h GLU 59 N 0.54 0.00 -0.00 1.61 4.11 -1.80 -2.59 114.58 116.45 2plu h GLU 59 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.40 2plu h GLU 59 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2plu h GLU 59 CO 0.04 0.00 -0.01 1.63 0.07 0.00 0.00 179.01 180.74 2plu n LYS 60 N -3.22 0.53 0.00 1.06 4.76 -1.26 -5.03 118.16 115.01 2plu n LYS 60 Ca -0.03 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.38 2plu n LYS 60 Cb 0.09 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.79 2plu n LYS 60 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2plu n GLY 61 N 1.25 0.77 3.85 0.72 0.00 -0.98 -4.86 105.19 105.94 2plu n GLY 61 Ca 0.16 -0.65 -0.36 0.00 0.00 0.00 0.00 46.02 45.16 2plu n GLY 61 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2plu s MET 62 N 0.00 3.90 0.66 1.61 -1.94 -1.26 -0.39 119.30 121.88 2plu s MET 62 Ca 0.00 0.37 -0.04 0.00 -1.71 0.00 0.00 55.69 54.31 2plu s MET 62 Cb 0.00 -3.08 0.05 0.00 2.01 0.00 0.00 34.83 33.82 2plu s MET 62 CO 0.00 0.59 0.94 0.20 -0.01 0.00 0.00 175.02 176.75 2plu s GLY 63 N -1.47 1.73 0.57 -0.03 0.00 0.29 -4.77 107.32 103.64 2plu s GLY 63 Ca 0.31 -1.06 0.28 0.00 0.00 0.00 0.00 44.72 44.25 2plu s GLY 63 CO 0.17 -0.68 1.99 1.46 0.00 0.00 0.00 173.10 176.04 2plu h GLN 64 N -0.41 0.00 0.00 2.90 4.20 -1.93 -2.34 115.11 117.53 2plu h GLN 64 Ca -0.44 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.27 2plu h GLN 64 Cb 1.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.09 2plu h GLN 64 CO 0.58 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 179.40 2plu h SER 65 N 0.00 0.00 0.00 1.46 4.64 -1.99 -3.46 113.55 114.21 2plu h SER 65 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2plu h SER 65 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 2plu h SER 65 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2plu n GLY 66 N 0.04 0.83 3.91 -0.77 0.00 -0.88 -5.07 105.19 103.25 2plu n GLY 66 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 2plu n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2plu s LYS 67 N -0.57 3.34 0.33 1.61 3.01 -1.26 -4.86 119.74 121.34 2plu s LYS 67 Ca 0.00 -0.58 -0.29 0.00 -1.01 0.00 0.00 55.97 54.10 2plu s LYS 67 Cb 0.00 -2.94 -0.11 0.00 -1.01 0.00 0.00 37.83 33.77 2plu s LYS 67 CO 0.00 0.55 1.42 -2.14 0.51 0.00 0.00 175.35 175.69 2plu s PRO 68 N -2.89 4.23 -1.21 -1.68 0.02 -1.26 -0.55 135.00 131.66 2plu s PRO 68 Ca 0.34 2.39 -0.18 0.00 0.02 0.00 0.00 61.00 63.57 2plu s PRO 68 Cb -0.12 -3.03 -0.02 0.00 0.02 0.00 0.00 34.50 31.35 2plu s PRO 68 CO 0.27 -0.39 2.00 1.28 -0.33 0.00 0.00 177.00 179.83 2plu n LEU 69 N 1.04 5.17 -3.68 -5.54 4.77 0.48 -4.77 117.00 114.47 2plu n LEU 69 Ca 0.02 -3.63 -0.13 0.00 -0.03 0.00 0.00 56.01 52.23 2plu n LEU 69 Cb 0.40 -1.55 -0.08 0.00 -2.33 0.00 0.00 43.42 39.85 2plu n LEU 69 CO 0.61 0.09 0.25 0.00 -1.33 0.00 0.00 177.39 177.02 2plu h TYR 71 N 5.28 0.00 -2.35 0.00 0.05 -1.22 -3.45 116.97 115.28 2plu h TYR 71 Ca -0.28 0.00 -0.56 0.00 0.05 0.00 0.00 58.73 57.94 2plu h TYR 71 Cb 1.17 0.00 0.04 0.00 1.01 0.00 0.00 36.73 38.95 2plu h TYR 71 CO 0.39 0.16 1.01 2.41 -1.05 0.00 0.00 178.16 181.08 2plu n THR 72 N -3.16 0.28 0.00 -2.88 -1.04 -1.26 -1.60 114.28 104.61 2plu n THR 72 Ca 0.03 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 2plu n THR 72 Cb 0.56 -1.90 0.00 0.00 -1.82 0.00 0.00 70.33 67.17 2plu n THR 72 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2plu n GLY 73 N 4.01 0.19 3.94 3.41 0.00 0.14 -5.04 105.19 111.85 2plu n GLY 73 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 2plu n GLY 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2plu s SER 74 N -1.97 5.20 0.24 1.61 1.04 -0.63 -4.82 113.70 114.38 2plu s SER 74 Ca 0.00 0.32 0.10 0.00 0.48 0.00 0.00 55.95 56.86 2plu s SER 74 Cb 0.00 -1.17 -0.04 0.00 0.10 0.00 0.00 66.02 64.91 2plu s SER 74 CO 0.00 -1.26 -0.11 -0.36 0.98 0.00 0.00 173.24 172.49 2plu s PHE 75 N -2.97 2.52 -0.69 5.02 0.40 -1.26 -0.65 117.98 120.35 2plu s PHE 75 Ca 0.57 -0.27 -0.25 0.00 -0.60 0.00 0.00 56.93 56.38 2plu s PHE 75 Cb -0.10 -1.15 0.05 0.00 0.51 0.00 0.00 43.02 42.32 2plu s PHE 75 CO 0.42 0.61 1.11 -0.06 0.70 0.00 0.00 175.22 178.01 2plu s PHE 76 N -2.16 2.50 -0.58 0.36 0.08 -0.24 -4.04 117.98 113.90 2plu s PHE 76 Ca 0.28 -0.26 0.24 0.00 0.12 0.00 0.00 56.93 57.31 2plu s PHE 76 Cb -0.07 -4.44 0.21 0.00 -0.57 0.00 0.00 43.02 38.15 2plu s PHE 76 CO 0.16 -1.83 1.20 -2.39 -0.10 0.00 0.00 175.22 172.26 2plu n HIS 77 N 8.48 0.52 -3.74 0.36 1.44 -0.62 -4.65 115.22 117.01 2plu n HIS 77 Ca -0.00 0.15 -0.23 0.00 -2.01 0.00 0.00 57.72 55.63 2plu n HIS 77 Cb 0.47 -0.63 -0.17 0.00 0.12 0.00 0.00 29.99 29.78 2plu n HIS 77 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 2plu s ARG 78 N -3.20 0.45 -0.13 -1.40 3.52 -1.14 -4.42 118.95 112.64 2plu s ARG 78 Ca 0.05 0.09 -0.03 0.00 -0.13 0.00 0.00 55.73 55.71 2plu s ARG 78 Cb 0.13 -1.07 0.05 0.00 -1.56 0.00 0.00 34.95 32.50 2plu s ARG 78 CO 0.75 -0.37 0.04 0.42 -0.81 0.00 0.00 175.30 175.34 2plu s ILE 79 N 2.01 0.24 -0.29 4.11 1.01 0.35 -0.55 121.20 128.08 2plu s ILE 79 Ca 0.04 -0.13 0.03 0.00 0.00 0.00 0.00 60.65 60.60 2plu s ILE 79 Cb -0.13 -0.65 0.08 0.00 0.01 0.00 0.00 42.46 41.76 2plu s ILE 79 CO -0.05 -0.03 -0.05 -0.63 0.00 0.00 0.00 174.94 174.18 2plu s ILE 80 N 2.00 2.19 0.39 2.92 1.01 -0.54 -1.71 121.20 127.46 2plu s ILE 80 Ca 0.02 -1.91 -0.26 0.00 0.00 0.00 0.00 60.65 58.50 2plu s ILE 80 Cb -0.15 -2.43 -0.11 0.00 0.01 0.00 0.00 42.46 39.79 2plu s ILE 80 CO -0.07 -0.26 1.22 -2.65 0.00 0.00 0.00 174.94 173.19 2plu n PRO 81 N 4.37 1.87 -1.73 2.79 -0.02 -1.26 -1.80 135.00 139.22 2plu n PRO 81 Ca -0.07 0.66 -0.12 0.00 -2.02 0.00 0.00 63.50 61.95 2plu n PRO 81 Cb 0.42 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.59 2plu n PRO 81 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2plu n GLN 82 N 0.27 -0.91 0.00 -0.52 3.00 -1.26 -4.81 117.38 113.15 2plu n GLN 82 Ca 0.07 0.79 0.00 0.00 -0.01 0.00 0.00 57.00 57.85 2plu n GLN 82 Cb 0.38 -4.88 0.00 0.00 0.00 0.00 0.00 30.24 25.73 2plu n GLN 82 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2plu n PHE 83 N -3.22 -0.21 -3.64 1.08 7.35 -0.74 -4.77 117.46 113.31 2plu n PHE 83 Ca -0.13 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.52 2plu n PHE 83 Cb 0.49 0.17 -0.01 0.00 0.35 0.00 0.00 39.48 40.48 2plu n PHE 83 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2plu s MET 84 N -0.34 0.84 -0.04 -4.13 0.23 -0.82 -1.34 119.30 113.70 2plu s MET 84 Ca 0.00 -0.42 0.06 0.00 -1.03 0.00 0.00 55.69 54.30 2plu s MET 84 Cb 0.00 0.32 -0.01 0.00 -1.53 0.00 0.00 34.83 33.61 2plu s MET 84 CO 0.00 -0.38 -0.22 0.96 -2.03 0.00 0.00 175.02 173.35 2plu s ILE 85 N -2.97 1.78 -0.03 3.16 -4.36 -0.54 -1.47 121.20 116.76 2plu s ILE 85 Ca 0.10 -0.93 0.03 0.00 -0.26 0.00 0.00 60.65 59.60 2plu s ILE 85 Cb 0.00 -1.51 0.00 0.00 1.25 0.00 0.00 42.46 42.20 2plu s ILE 85 CO -0.03 0.50 -0.13 -1.58 0.24 0.00 0.00 174.94 173.95 2plu s GLN 86 N -0.18 1.32 0.00 0.37 0.74 0.29 -0.98 119.66 121.23 2plu s GLN 86 Ca -0.01 -0.44 0.00 0.00 0.05 0.00 0.00 55.36 54.96 2plu s GLN 86 Cb -0.12 -1.18 0.00 0.00 1.10 0.00 0.00 33.01 32.81 2plu s GLN 86 CO 0.02 0.17 0.00 0.41 -0.55 0.00 0.00 175.29 175.34 2plu n GLY 87 N 3.24 4.66 0.55 2.59 0.00 -0.59 -1.60 105.19 114.05 2plu n GLY 87 Ca -0.18 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.59 2plu n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2plu n GLY 88 N 0.00 0.61 3.48 -0.02 0.00 -1.26 -1.69 105.19 106.32 2plu n GLY 88 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 2plu n GLY 88 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2plu s ASP 89 N -2.95 6.95 0.00 1.61 -1.08 -1.26 -3.73 116.67 116.20 2plu s ASP 89 Ca 0.00 -2.71 0.21 0.00 -0.52 0.00 0.00 52.55 49.53 2plu s ASP 89 Cb 0.00 -2.43 0.65 0.00 -1.46 0.00 0.00 42.92 39.68 2plu s ASP 89 CO 0.00 -0.88 1.50 2.22 0.52 0.00 0.00 175.17 178.53 2plu n PHE 90 N 6.27 0.28 -0.08 -5.34 1.16 -1.26 -2.19 117.46 116.30 2plu n PHE 90 Ca 0.36 -0.14 -0.09 0.00 -1.87 0.00 0.00 57.45 55.71 2plu n PHE 90 Cb 0.45 0.00 -0.12 0.00 -1.61 0.00 0.00 39.48 38.19 2plu n PHE 90 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 2plu n THR 91 N 0.66 1.11 -0.26 1.97 -2.24 -1.26 -4.81 114.28 109.44 2plu n THR 91 Ca 0.17 -0.64 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 2plu n THR 91 Cb 0.41 -0.68 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 2plu n THR 91 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2plu n ARG 92 N -2.67 1.37 -0.84 -0.78 1.74 -1.26 -4.89 116.66 109.32 2plu n ARG 92 Ca -0.28 -0.08 0.00 0.00 -0.77 0.00 0.00 57.85 56.72 2plu n ARG 92 Cb 1.00 -0.40 0.00 0.00 -1.02 0.00 0.00 32.46 32.04 2plu n ARG 92 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2plu n GLY 93 N 0.22 0.00 0.00 -0.13 0.00 -0.93 -4.76 105.19 99.59 2plu n GLY 93 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2plu n GLY 93 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2plu n ASP 94 N -0.66 0.40 0.00 1.61 5.68 -1.26 -4.84 116.55 117.48 2plu n ASP 94 Ca 0.00 -1.07 0.00 0.00 -0.50 0.00 0.00 54.79 53.22 2plu n ASP 94 Cb 0.35 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.33 2plu n ASP 94 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2plu n GLY 95 N -0.04 0.49 0.00 6.12 0.00 -1.26 -4.93 105.19 105.58 2plu n GLY 95 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.12 2plu n GLY 95 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2plu n THR 96 N -2.00 0.00 -2.39 2.61 -2.24 -1.26 -5.03 114.28 103.97 2plu n THR 96 Ca 0.00 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2plu n THR 96 Cb 0.00 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 2plu n THR 96 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2plu n GLY 97 N 1.40 5.58 0.00 3.38 0.00 -1.26 -5.01 105.19 109.28 2plu n GLY 97 Ca 0.01 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.06 2plu n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2plu n GLY 98 N 5.00 2.24 3.52 -0.02 0.00 -1.26 -4.72 105.19 109.95 2plu n GLY 98 Ca 0.00 -1.93 -0.17 0.00 0.00 0.00 0.00 46.02 43.92 2plu n GLY 98 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2plu s GLU 99 N -2.86 0.99 0.65 1.61 -1.05 -1.26 -4.69 118.70 112.09 2plu s GLU 99 Ca 0.00 0.37 -0.06 0.00 -0.15 0.00 0.00 54.97 55.13 2plu s GLU 99 Cb 0.00 0.47 0.03 0.00 -0.44 0.00 0.00 34.13 34.19 2plu s GLU 99 CO 0.00 -0.28 0.96 -1.54 0.95 0.00 0.00 175.26 175.35 2plu s SER 100 N -0.90 5.22 0.32 0.83 1.04 -1.24 -4.08 113.70 114.88 2plu s SER 100 Ca -0.09 0.61 0.25 0.00 0.48 0.00 0.00 55.95 57.19 2plu s SER 100 Cb -0.01 -1.43 1.15 0.00 0.10 0.00 0.00 66.02 65.83 2plu s SER 100 CO 0.08 -1.33 1.74 0.16 0.98 0.00 0.00 173.24 174.88 2plu h ILE 101 N -0.39 0.00 -0.02 -1.02 3.07 -1.87 -1.83 117.51 115.44 2plu h ILE 101 Ca -0.45 -0.15 0.00 0.00 1.55 0.00 0.00 64.86 65.81 2plu h ILE 101 Cb 1.28 0.82 0.00 0.00 -0.27 0.00 0.00 36.82 38.66 2plu h ILE 101 CO 0.61 0.00 0.00 -1.22 -1.05 0.00 0.00 178.15 176.49 2plu n TYR 102 N -2.34 0.01 -0.95 0.16 4.01 -1.26 -5.13 117.16 111.66 2plu n TYR 102 Ca 0.00 -0.01 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2plu n TYR 102 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 2plu n TYR 102 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2plu n GLY 103 N 1.16 0.44 3.74 2.72 0.00 -0.69 -5.04 105.19 107.52 2plu n GLY 103 Ca 0.19 -0.79 -0.31 0.00 0.00 0.00 0.00 46.02 45.12 2plu n GLY 103 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2plu s LYS 105 N -1.44 1.87 0.18 1.61 0.00 -1.26 -4.02 119.74 116.68 2plu s LYS 105 Ca 0.00 1.18 0.04 0.00 0.00 0.00 0.00 55.97 57.19 2plu s LYS 105 Cb 0.00 -1.85 -0.05 0.00 0.00 0.00 0.00 37.83 35.93 2plu s LYS 105 CO 0.00 -1.92 -0.05 -0.59 0.00 0.00 0.00 175.35 172.79 2plu s PHE 106 N -2.86 1.39 0.53 1.78 -0.71 -0.01 -4.91 117.98 113.19 2plu s PHE 106 Ca 0.62 -0.85 -0.22 0.00 -1.04 0.00 0.00 56.93 55.44 2plu s PHE 106 Cb -0.18 -0.76 -0.05 0.00 -1.21 0.00 0.00 43.02 40.81 2plu s PHE 106 CO 0.57 0.01 1.38 0.50 -1.34 0.00 0.00 175.22 176.33 2plu s ARG 107 N -3.81 3.23 -0.38 1.99 3.52 -1.26 -2.00 118.95 120.24 2plu s ARG 107 Ca 0.22 2.30 -0.28 0.00 -0.13 0.00 0.00 55.73 57.84 2plu s ARG 107 Cb 0.04 -2.34 -0.03 0.00 -1.56 0.00 0.00 34.95 31.06 2plu s ARG 107 CO 0.04 -1.14 2.01 -0.51 -0.81 0.00 0.00 175.30 174.89 2plu s ASP 108 N -0.84 5.44 0.20 -2.12 1.01 -1.26 -4.86 116.67 114.24 2plu s ASP 108 Ca 0.70 1.24 0.03 0.00 0.71 0.00 0.00 52.55 55.23 2plu s ASP 108 Cb -0.42 -2.52 0.12 0.00 1.01 0.00 0.00 42.92 41.12 2plu s ASP 108 CO 0.50 -2.07 1.47 1.05 0.21 0.00 0.00 175.17 176.33 2plu h GLU 109 N 14.84 0.25 -2.15 8.23 4.11 -2.01 -3.48 114.58 134.37 2plu h GLU 109 Ca -0.33 -0.21 0.23 0.00 0.07 0.00 0.00 59.36 59.12 2plu h GLU 109 Cb 1.20 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 30.42 2plu h GLU 109 CO 1.07 0.87 0.65 0.54 0.07 0.00 0.00 179.01 182.21 2plu s ASN 110 N -6.92 -0.07 -0.33 3.06 2.20 -1.26 -5.06 114.94 106.56 2plu s ASN 110 Ca -0.04 -0.40 0.12 0.00 -0.94 0.00 0.00 52.86 51.60 2plu s ASN 110 Cb 0.11 0.37 0.46 0.00 -2.00 0.00 0.00 41.25 40.19 2plu s ASN 110 CO 0.82 -0.71 1.10 0.49 -2.94 0.00 0.00 177.10 175.86 2plu n PHE 111 N -0.60 2.34 -0.24 1.54 3.72 -1.26 -4.75 117.46 118.22 2plu n PHE 111 Ca -0.05 -2.58 -0.05 0.00 -0.05 0.00 0.00 57.45 54.73 2plu n PHE 111 Cb 0.61 -0.25 0.06 0.00 -0.94 0.00 0.00 39.48 38.95 2plu n PHE 111 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2plu h VAL 112 N 3.15 1.14 -2.81 -4.37 2.07 -1.93 -3.42 116.25 110.07 2plu h VAL 112 Ca 0.16 -0.30 -0.64 0.00 0.82 0.00 0.00 66.70 66.74 2plu h VAL 112 Cb 1.24 0.19 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 2plu h VAL 112 CO 0.62 0.16 -0.46 -0.31 0.02 0.00 0.00 177.57 177.60 2plu s TYR 113 N -6.14 3.56 0.34 1.57 2.02 -1.26 -5.11 117.35 112.33 2plu s TYR 113 Ca -0.13 0.43 0.08 0.00 -0.37 0.00 0.00 57.07 57.08 2plu s TYR 113 Cb 0.14 -1.88 -0.03 0.00 -0.40 0.00 0.00 41.96 39.79 2plu s TYR 113 CO 0.76 0.65 0.26 0.95 -1.57 0.00 0.00 175.55 176.60 2plu s THR 114 N -1.29 3.40 -1.45 -0.71 -4.23 -1.26 -4.42 115.64 105.68 2plu s THR 114 Ca 0.26 -1.44 -0.08 0.00 -1.18 0.00 0.00 61.69 59.25 2plu s THR 114 Cb -0.13 -3.14 0.04 0.00 1.34 0.00 0.00 72.50 70.62 2plu s THR 114 CO 0.16 -0.17 2.55 1.41 -0.54 0.00 0.00 174.62 178.04 2plu n HIS 115 N -1.33 2.62 1.22 3.99 -0.00 -1.26 -4.68 115.22 115.79 2plu n HIS 115 Ca -0.02 -2.94 0.13 0.00 -0.00 0.00 0.00 57.72 54.89 2plu n HIS 115 Cb 0.60 -2.15 0.32 0.00 -0.00 0.00 0.00 29.99 28.76 2plu n HIS 115 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 2plu n ASP 116 N 2.93 1.35 -3.82 0.41 5.68 -1.26 -0.51 116.55 121.33 2plu n ASP 116 Ca 0.66 -1.13 -0.09 0.00 -0.50 0.00 0.00 54.79 53.72 2plu n ASP 116 Cb 0.26 0.18 -0.07 0.00 -1.14 0.00 0.00 41.12 40.35 2plu n ASP 116 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2plu s ALA 117 N -2.41 -0.36 0.78 2.12 0.00 -1.26 -4.67 121.76 115.96 2plu s ALA 117 Ca 0.25 -0.48 -0.11 0.00 0.00 0.00 0.00 51.96 51.62 2plu s ALA 117 Cb 0.19 0.50 0.06 0.00 0.00 0.00 0.00 23.12 23.87 2plu s ALA 117 CO 0.50 -0.51 1.10 -1.25 0.00 0.00 0.00 175.76 175.59 2plu s PRO 118 N -3.71 2.16 -0.57 0.00 0.04 -1.26 -3.99 135.00 127.67 2plu s PRO 118 Ca 0.04 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.30 2plu s PRO 118 Cb 0.04 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.70 2plu s PRO 118 CO -0.10 -1.72 0.00 1.19 0.04 0.00 0.00 177.00 176.40 2plu n PHE 119 N -3.53 -0.08 -3.27 0.56 3.72 0.99 -4.95 117.46 110.89 2plu n PHE 119 Ca 0.09 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.14 2plu n PHE 119 Cb 0.53 -1.46 -0.06 0.00 -0.94 0.00 0.00 39.48 37.55 2plu n PHE 119 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2plu s LEU 120 N -1.39 4.34 -0.13 4.37 1.43 -1.26 -0.74 118.68 125.29 2plu s LEU 120 Ca 0.00 1.19 -0.18 0.00 -1.03 0.00 0.00 54.13 54.11 2plu s LEU 120 Cb 0.00 -3.37 -0.04 0.00 0.03 0.00 0.00 46.19 42.81 2plu s LEU 120 CO 0.00 0.08 0.46 -0.76 0.23 0.00 0.00 176.35 176.36 2plu s LEU 121 N -1.96 4.25 0.04 1.79 1.43 -0.00 -1.19 118.68 123.05 2plu s LEU 121 Ca 0.39 0.76 -0.03 0.00 -1.03 0.00 0.00 54.13 54.22 2plu s LEU 121 Cb -0.16 -2.65 -0.02 0.00 0.03 0.00 0.00 46.19 43.39 2plu s LEU 121 CO 0.20 -0.01 0.02 -0.55 0.23 0.00 0.00 176.35 176.24 2plu s SER 122 N 0.68 0.32 -0.11 2.29 0.15 -0.42 -1.32 113.70 115.29 2plu s SER 122 Ca 0.24 -0.73 -0.26 0.00 0.70 0.00 0.00 55.95 55.91 2plu s SER 122 Cb -0.15 0.20 -0.02 0.00 -1.71 0.00 0.00 66.02 64.33 2plu s SER 122 CO 0.09 -0.52 0.83 -0.04 1.20 0.00 0.00 173.24 174.81 2plu s MET 123 N -3.00 4.39 0.60 5.44 -1.94 -0.60 -0.66 119.30 123.53 2plu s MET 123 Ca -0.02 1.07 -0.17 0.00 -1.71 0.00 0.00 55.69 54.86 2plu s MET 123 Cb 0.01 -3.52 -0.03 0.00 2.01 0.00 0.00 34.83 33.30 2plu s MET 123 CO -0.07 -0.17 1.14 0.00 -0.01 0.00 0.00 175.02 175.91 2plu s ALA 124 N 1.58 2.56 0.37 3.03 0.00 -0.93 -4.34 121.76 124.04 2plu s ALA 124 Ca 0.41 0.75 -0.16 0.00 0.00 0.00 0.00 51.96 52.96 2plu s ALA 124 Cb -0.18 -3.36 0.05 0.00 0.00 0.00 0.00 23.12 19.63 2plu s ALA 124 CO 0.17 -1.06 0.77 0.54 0.00 0.00 0.00 175.76 176.18 2plu s ASN 125 N -2.06 -0.01 -0.29 0.00 2.20 -1.26 -4.58 114.94 108.94 2plu s ASN 125 Ca 0.71 -1.09 0.08 0.00 -0.94 0.00 0.00 52.86 51.63 2plu s ASN 125 Cb -0.24 0.83 0.46 0.00 -2.00 0.00 0.00 41.25 40.31 2plu s ASN 125 CO 0.34 -1.64 1.18 0.00 -2.94 0.00 0.00 177.10 174.04 2plu n ALA 126 N -0.52 4.81 0.00 3.54 0.00 -1.26 -5.08 120.51 121.99 2plu n ALA 126 Ca -0.08 -3.71 0.00 0.00 0.00 0.00 0.00 53.44 49.66 2plu n ALA 126 Cb 0.60 -0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.68 2plu n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2plu n GLY 127 N -0.70 -0.93 3.66 0.00 0.00 -1.26 -4.95 105.19 101.01 2plu n GLY 127 Ca 0.41 -2.24 -0.49 0.00 0.00 0.00 0.00 46.02 43.69 2plu n GLY 127 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2plu n PRO 128 N -0.45 1.77 -3.41 1.61 -0.02 -1.26 -3.10 135.00 130.15 2plu n PRO 128 Ca 0.00 0.64 -0.20 0.00 -2.02 0.00 0.00 63.50 61.93 2plu n PRO 128 Cb 0.00 -2.39 0.07 0.00 -0.02 0.00 0.00 33.50 31.16 2plu n PRO 128 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2plu n ASN 129 N 4.12 -5.23 -0.78 2.55 3.02 -1.26 -4.93 115.26 112.75 2plu n ASN 129 Ca 0.20 -0.47 0.06 0.00 -0.03 0.00 0.00 54.58 54.33 2plu n ASN 129 Cb 0.24 -4.39 0.17 0.00 -0.61 0.00 0.00 39.78 35.19 2plu n ASN 129 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2plu n THR 130 N -4.51 1.73 -1.91 3.41 -2.24 -1.18 -4.43 114.28 105.15 2plu n THR 130 Ca -0.03 -2.75 -0.42 0.00 -2.27 0.00 0.00 64.05 58.59 2plu n THR 130 Cb 0.56 0.02 -0.02 0.00 -2.10 0.00 0.00 70.33 68.80 2plu n THR 130 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2plu s ASN 131 N -2.96 6.54 0.00 3.42 0.01 -0.85 -4.46 114.94 116.63 2plu s ASN 131 Ca 0.37 2.76 0.00 0.00 -0.71 0.00 0.00 52.86 55.28 2plu s ASN 131 Cb 0.37 -2.62 0.00 0.00 0.41 0.00 0.00 41.25 39.41 2plu s ASN 131 CO -0.09 -0.80 0.00 0.61 -1.51 0.00 0.00 177.10 175.31 2plu n GLY 132 N 2.52 1.86 0.00 0.66 0.00 -1.26 -0.83 105.19 108.14 2plu n GLY 132 Ca 0.09 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2plu n GLY 132 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2plu n SER 133 N 0.00 2.16 -4.75 1.61 3.41 -1.26 -3.71 113.62 111.08 2plu n SER 133 Ca 0.00 -0.14 -0.41 0.00 -0.26 0.00 0.00 58.87 58.06 2plu n SER 133 Cb 0.00 0.71 -0.02 0.00 -0.26 0.00 0.00 64.21 64.64 2plu n SER 133 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2plu s GLN 134 N -1.14 4.28 0.16 4.33 -0.21 -1.24 -4.55 119.66 121.29 2plu s GLN 134 Ca 0.00 2.29 -0.02 0.00 0.02 0.00 0.00 55.36 57.65 2plu s GLN 134 Cb 0.00 -3.09 -0.04 0.00 1.00 0.00 0.00 33.01 30.89 2plu s GLN 134 CO 0.00 -0.36 0.12 -0.59 -2.12 0.00 0.00 175.29 172.34 2plu s PHE 135 N -0.41 0.89 0.06 0.91 -0.12 -0.68 -2.19 117.98 116.44 2plu s PHE 135 Ca 0.56 -1.21 0.01 0.00 -0.05 0.00 0.00 56.93 56.23 2plu s PHE 135 Cb -0.41 -0.44 -0.03 0.00 -0.63 0.00 0.00 43.02 41.51 2plu s PHE 135 CO 0.47 -0.60 -0.06 -0.59 -0.05 0.00 0.00 175.22 174.40 2plu s PHE 136 N -4.08 0.65 -0.21 3.49 -0.12 0.17 -1.54 117.98 116.34 2plu s PHE 136 Ca 0.28 -0.78 -0.03 0.00 -0.05 0.00 0.00 56.93 56.35 2plu s PHE 136 Cb 0.07 -0.41 -0.00 0.00 -0.63 0.00 0.00 43.02 42.05 2plu s PHE 136 CO 0.05 -0.19 -0.07 0.42 -0.05 0.00 0.00 175.22 175.38 2plu s ILE 137 N -2.76 3.12 0.53 -4.49 1.01 -0.15 -1.30 121.20 117.16 2plu s ILE 137 Ca 0.01 -0.58 -0.19 0.00 0.00 0.00 0.00 60.65 59.89 2plu s ILE 137 Cb -0.01 -2.41 -0.06 0.00 0.01 0.00 0.00 42.46 39.99 2plu s ILE 137 CO -0.04 0.45 1.08 0.42 0.00 0.00 0.00 174.94 176.85 2plu s THR 138 N 1.44 3.49 -0.18 2.92 -4.23 -0.33 -1.47 115.64 117.29 2plu s THR 138 Ca 0.06 0.89 0.01 0.00 -1.18 0.00 0.00 61.69 61.47 2plu s THR 138 Cb -0.14 -3.35 0.01 0.00 1.34 0.00 0.00 72.50 70.36 2plu s THR 138 CO -0.05 -0.24 0.53 0.35 -0.54 0.00 0.00 174.62 174.67 2plu n THR 139 N -1.30 0.00 -3.94 3.99 -2.24 -0.45 -0.01 114.28 110.33 2plu n THR 139 Ca 0.10 -0.50 -0.09 0.00 -2.27 0.00 0.00 64.05 61.29 2plu n THR 139 Cb 0.52 1.03 -0.08 0.00 -2.10 0.00 0.00 70.33 69.70 2plu n THR 139 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2plu s VAL 140 N -0.16 0.11 0.35 2.28 -7.23 -1.23 -4.71 120.40 109.81 2plu s VAL 140 Ca 0.02 -1.37 -0.29 0.00 -1.81 0.00 0.00 61.98 58.53 2plu s VAL 140 Cb 0.01 -1.62 -0.11 0.00 0.56 0.00 0.00 36.38 35.22 2plu s VAL 140 CO 0.02 -0.52 1.51 -2.84 -0.31 0.00 0.00 175.10 172.96 2plu s PRO 141 N -3.93 4.12 -0.53 4.82 0.02 -1.26 -4.22 135.00 134.02 2plu s PRO 141 Ca 0.12 2.56 0.07 0.00 0.02 0.00 0.00 61.00 63.77 2plu s PRO 141 Cb 0.05 -2.99 0.33 0.00 0.02 0.00 0.00 34.50 31.91 2plu s PRO 141 CO -0.05 -0.55 0.86 0.00 -0.33 0.00 0.00 177.00 176.92 2plu h PRO 143 N 3.16 0.00 0.00 0.00 0.13 -1.93 -0.59 132.00 132.76 2plu h PRO 143 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2plu h PRO 143 Cb 0.64 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.77 2plu h PRO 143 CO 0.73 0.04 0.00 -2.67 -0.23 0.00 0.00 178.00 175.87 2plu n TRP 144 N -3.96 0.55 0.83 1.56 2.14 -1.26 -1.86 117.44 115.45 2plu n TRP 144 Ca -0.03 0.28 0.11 0.00 2.07 0.00 0.00 57.50 59.93 2plu n TRP 144 Cb 0.13 -0.95 -0.00 0.00 -0.81 0.00 0.00 31.31 29.68 2plu n TRP 144 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 2plu n LEU 145 N -2.06 0.72 -4.70 5.67 4.77 -0.23 -4.93 117.00 116.24 2plu n LEU 145 Ca -0.01 -0.23 -0.43 0.00 -0.03 0.00 0.00 56.01 55.31 2plu n LEU 145 Cb 0.04 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 2plu n LEU 145 CO 0.08 0.15 1.08 0.47 -1.33 0.00 0.00 177.39 177.85 2plu n ASP 146 N -1.66 3.16 0.00 -1.43 8.00 -0.78 -1.52 116.55 122.32 2plu n ASP 146 Ca 0.03 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.69 2plu n ASP 146 Cb 0.37 -1.50 0.00 0.00 -0.02 0.00 0.00 41.12 39.98 2plu n ASP 146 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2plu n GLY 147 N 1.97 0.48 0.00 0.44 0.00 -1.26 -4.76 105.19 102.06 2plu n GLY 147 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2plu n GLY 147 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2plu n LYS 148 N -1.77 2.47 -4.85 1.61 5.02 -0.58 -5.04 118.16 115.02 2plu n LYS 148 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.02 2plu n LYS 148 Cb 0.09 -0.96 -0.16 0.00 -0.02 0.00 0.00 35.03 33.97 2plu n LYS 148 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2plu s HIS 149 N -1.90 1.82 -0.34 2.13 3.76 -0.87 -4.92 115.29 114.97 2plu s HIS 149 Ca 0.00 -0.61 -0.28 0.00 -0.15 0.00 0.00 55.06 54.02 2plu s HIS 149 Cb 0.00 -1.25 0.02 0.00 1.11 0.00 0.00 32.58 32.46 2plu s HIS 149 CO 0.00 -0.25 1.01 0.08 -0.85 0.00 0.00 174.74 174.73 2plu s VAL 150 N 0.27 4.54 -0.02 -0.90 1.01 -1.26 -4.82 120.40 119.22 2plu s VAL 150 Ca -0.10 1.50 -0.27 0.00 0.00 0.00 0.00 61.98 63.12 2plu s VAL 150 Cb -0.14 -4.38 -0.04 0.00 0.00 0.00 0.00 36.38 31.83 2plu s VAL 150 CO 0.04 -0.51 0.86 -0.69 0.00 0.00 0.00 175.10 174.80 2plu s VAL 151 N 3.59 4.92 0.00 2.92 1.01 -1.26 -1.56 120.40 130.01 2plu s VAL 151 Ca 0.42 1.79 0.00 0.00 0.00 0.00 0.00 61.98 64.20 2plu s VAL 151 Cb -0.12 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.06 2plu s VAL 151 CO 0.17 0.21 0.06 2.22 0.00 0.00 0.00 175.10 177.76 2plu n PHE 152 N 3.74 0.00 -3.71 5.22 1.16 -0.43 -4.63 117.46 118.81 2plu n PHE 152 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.61 2plu n PHE 152 Cb 0.51 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.38 2plu n PHE 152 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2plu n GLY 153 N 0.00 0.84 3.35 4.97 0.00 -1.19 0.04 105.19 113.20 2plu n GLY 153 Ca 0.00 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 2plu n GLY 153 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2plu s LYS 154 N -2.00 1.01 0.13 1.61 -2.85 -0.64 -0.82 119.74 116.17 2plu s LYS 154 Ca 0.03 -0.41 -0.30 0.00 -1.00 0.00 0.00 55.97 54.29 2plu s LYS 154 Cb -0.00 0.45 -0.07 0.00 -2.06 0.00 0.00 37.83 36.15 2plu s LYS 154 CO 0.00 -0.37 1.09 0.08 0.10 0.00 0.00 175.35 176.26 2plu s VAL 155 N -2.84 4.06 -0.18 1.79 1.01 0.08 -1.05 120.40 123.27 2plu s VAL 155 Ca -0.03 1.68 -0.15 0.00 0.00 0.00 0.00 61.98 63.48 2plu s VAL 155 Cb -0.00 -4.07 -0.06 0.00 0.00 0.00 0.00 36.38 32.24 2plu s VAL 155 CO -0.05 0.24 -0.26 0.18 0.00 0.00 0.00 175.10 175.21 2plu n LEU 156 N 2.86 1.89 -4.34 3.92 4.77 0.47 -4.88 117.00 121.70 2plu n LEU 156 Ca 0.04 0.44 -0.18 0.00 -0.03 0.00 0.00 56.01 56.28 2plu n LEU 156 Cb 0.47 -0.81 -0.10 0.00 -2.33 0.00 0.00 43.42 40.65 2plu n LEU 156 CO 0.54 -0.24 -0.44 -1.61 -1.33 0.00 0.00 177.39 174.31 2plu s GLU 157 N -2.61 1.32 0.00 3.23 2.02 -1.16 -4.82 118.70 116.67 2plu s GLU 157 Ca -0.25 -1.57 0.00 0.00 0.02 0.00 0.00 54.97 53.17 2plu s GLU 157 Cb 0.04 -1.12 0.00 0.00 0.10 0.00 0.00 34.13 33.16 2plu s GLU 157 CO 0.37 0.19 0.00 0.41 0.02 0.00 0.00 175.26 176.25 2plu n GLY 158 N -0.33 0.69 0.36 -1.39 0.00 -1.25 -1.11 105.19 102.15 2plu n GLY 158 Ca -0.08 -0.54 0.11 0.00 0.00 0.00 0.00 46.02 45.51 2plu n GLY 158 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2plu h MET 159 N 0.09 0.79 -0.17 1.61 2.86 -1.88 0.52 114.93 118.74 2plu h MET 159 Ca 0.00 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.54 2plu h MET 159 Cb 0.00 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.47 2plu h MET 159 CO 0.00 0.52 -0.12 0.93 1.06 0.00 0.00 176.91 179.30 2plu h GLU 160 N 0.81 0.28 -0.57 1.72 4.39 -1.96 -1.01 114.58 118.23 2plu h GLU 160 Ca 0.53 -0.06 -0.07 0.00 0.34 0.00 0.00 59.36 60.09 2plu h GLU 160 Cb 0.76 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.35 2plu h GLU 160 CO -0.30 0.40 0.09 0.28 -1.16 0.00 0.00 179.01 178.32 2plu h VAL 161 N 0.26 1.26 -0.58 3.13 2.07 -1.24 0.27 116.25 121.42 2plu h VAL 161 Ca 0.05 -0.99 0.03 0.00 0.82 0.00 0.00 66.70 66.61 2plu h VAL 161 Cb 0.38 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 2plu h VAL 161 CO 0.02 0.36 0.35 0.58 0.02 0.00 0.00 177.57 178.90 2plu h VAL 162 N 0.85 1.05 -0.57 2.57 2.07 -0.90 -1.34 116.25 119.98 2plu h VAL 162 Ca 0.17 -0.24 -0.07 0.00 0.82 0.00 0.00 66.70 67.39 2plu h VAL 162 Cb 0.43 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 2plu h VAL 162 CO 0.01 0.13 0.09 0.11 0.02 0.00 0.00 177.57 177.92 2plu h LYS 163 N 0.69 0.92 -0.62 1.57 1.79 -0.81 -0.31 116.57 119.79 2plu h LYS 163 Ca 0.24 -0.22 -0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2plu h LYS 163 Cb 0.04 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.54 2plu h LYS 163 CO -0.11 0.85 0.38 0.77 -1.08 0.00 0.00 179.45 180.26 2plu h SER 164 N 0.87 0.74 -0.34 0.86 0.02 -0.52 -2.08 113.55 113.09 2plu h SER 164 Ca 0.18 -0.06 -0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2plu h SER 164 Cb 0.39 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 2plu h SER 164 CO 0.01 0.58 0.20 0.40 -1.14 0.00 0.00 176.83 176.87 2plu h ILE 165 N 0.84 1.13 -0.99 3.27 2.04 -0.89 -2.96 117.51 119.94 2plu h ILE 165 Ca 0.22 -0.33 0.13 0.00 1.00 0.00 0.00 64.86 65.88 2plu h ILE 165 Cb -0.03 0.72 -0.08 0.00 -0.74 0.00 0.00 36.82 36.69 2plu h ILE 165 CO -0.04 0.13 0.63 -0.08 0.00 0.00 0.00 178.15 178.79 2plu h GLU 166 N 0.44 0.93 0.00 2.37 4.81 -0.77 -0.31 114.58 122.06 2plu h GLU 166 Ca 0.12 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 2plu h GLU 166 Cb 0.04 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.21 2plu h GLU 166 CO -0.02 0.62 -0.00 0.87 -0.73 0.00 0.00 179.01 179.74 2plu h LYS 167 N 0.96 0.00 -0.17 1.92 1.57 -1.21 -1.45 116.57 118.19 2plu h LYS 167 Ca 0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 2plu h LYS 167 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2plu h LYS 167 CO -0.26 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.62 2plu n GLY 169 N 0.95 1.05 3.21 0.00 0.00 -0.55 -0.43 105.19 109.43 2plu n GLY 169 Ca 0.12 -2.04 -0.09 0.00 0.00 0.00 0.00 46.02 44.00 2plu n GLY 169 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2plu s SER 170 N -3.01 0.20 0.26 1.61 0.01 -0.69 -4.74 113.70 107.34 2plu s SER 170 Ca 0.33 -0.90 -0.02 0.00 1.31 0.00 0.00 55.95 56.68 2plu s SER 170 Cb -0.02 0.34 0.52 0.00 0.21 0.00 0.00 66.02 67.07 2plu s SER 170 CO 0.22 -0.76 1.75 1.56 0.41 0.00 0.00 173.24 176.42 2plu h GLN 171 N 2.78 0.56 -0.02 12.44 4.20 -1.92 -1.01 115.11 132.13 2plu h GLN 171 Ca -0.34 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.34 2plu h GLN 171 Cb 1.20 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.85 2plu h GLN 171 CO 0.56 0.37 0.00 0.27 -0.67 0.00 0.00 178.83 179.36 2plu n ASN 172 N -4.91 0.19 0.00 1.46 0.23 -1.26 -4.91 115.26 106.07 2plu n ASN 172 Ca 0.17 -1.58 0.00 0.00 -0.53 0.00 0.00 54.58 52.63 2plu n ASN 172 Cb 0.44 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 38.12 2plu n ASN 172 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2plu n GLY 173 N 0.76 2.03 3.67 4.83 0.00 -0.38 -4.97 105.19 111.13 2plu n GLY 173 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2plu n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2plu s LYS 174 N -0.01 4.24 0.41 1.61 1.02 -1.26 -0.50 119.74 125.26 2plu s LYS 174 Ca 0.00 1.98 -0.26 0.00 0.02 0.00 0.00 55.97 57.70 2plu s LYS 174 Cb 0.00 -3.73 -0.09 0.00 -0.52 0.00 0.00 37.83 33.49 2plu s LYS 174 CO 0.00 -0.68 1.39 -2.14 -0.92 0.00 0.00 175.35 173.00 2plu s PRO 175 N 3.08 3.91 0.00 -1.68 0.02 -1.26 -3.49 135.00 135.58 2plu s PRO 175 Ca 0.65 2.35 0.22 0.00 0.02 0.00 0.00 61.00 64.24 2plu s PRO 175 Cb -0.30 -2.79 -0.03 0.00 0.02 0.00 0.00 34.50 31.41 2plu s PRO 175 CO 0.25 -0.61 1.04 0.25 -0.33 0.00 0.00 177.00 177.61 2plu n THR 176 N 0.12 0.00 -4.04 0.99 -2.24 0.43 -4.90 114.28 104.63 2plu n THR 176 Ca 0.03 -0.03 -0.08 0.00 -2.27 0.00 0.00 64.05 61.70 2plu n THR 176 Cb 0.42 0.85 -0.11 0.00 -2.10 0.00 0.00 70.33 69.39 2plu n THR 176 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2plu s LYS 177 N -2.94 0.48 -0.29 -0.78 1.02 -1.26 -5.10 119.74 110.88 2plu s LYS 177 Ca 0.10 -0.92 -0.29 0.00 0.02 0.00 0.00 55.97 54.88 2plu s LYS 177 Cb 0.17 0.11 -0.00 0.00 -0.52 0.00 0.00 37.83 37.58 2plu s LYS 177 CO 0.80 -0.07 1.31 0.45 -0.92 0.00 0.00 175.35 176.92 2plu s SER 178 N -2.19 6.68 -0.30 2.83 0.15 -1.26 -4.85 113.70 114.77 2plu s SER 178 Ca -0.04 1.25 -0.06 0.00 0.70 0.00 0.00 55.95 57.80 2plu s SER 178 Cb -0.01 -2.54 0.02 0.00 -1.71 0.00 0.00 66.02 61.78 2plu s SER 178 CO -0.05 -1.06 0.07 -0.69 1.20 0.00 0.00 173.24 172.70 2plu s VAL 179 N 4.33 3.74 -0.03 4.45 1.01 -1.26 -0.67 120.40 131.98 2plu s VAL 179 Ca 0.56 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.74 2plu s VAL 179 Cb -0.17 -2.99 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 2plu s VAL 179 CO 0.23 0.02 -0.25 0.00 0.00 0.00 0.00 175.10 175.09 2plu s ILE 181 N -0.51 4.14 -0.30 0.00 1.01 0.17 -1.03 121.20 124.69 2plu s ILE 181 Ca 0.07 0.52 0.23 0.00 0.00 0.00 0.00 60.65 61.46 2plu s ILE 181 Cb -0.10 -4.68 0.10 0.00 0.01 0.00 0.00 42.46 37.79 2plu s ILE 181 CO -0.00 -1.33 1.21 0.71 0.00 0.00 0.00 174.94 175.53 2plu h THR 182 N 6.08 0.00 -2.68 2.92 1.35 -1.08 0.41 112.91 119.90 2plu h THR 182 Ca -0.26 -1.00 -0.06 0.00 -0.55 0.00 0.00 66.41 64.54 2plu h THR 182 Cb 1.06 1.65 -0.17 0.00 -1.73 0.00 0.00 68.15 68.96 2plu h THR 182 CO 1.16 0.00 0.03 0.00 -0.25 0.00 0.00 175.52 176.46 2plu s ALA 183 N -3.32 -1.35 0.03 6.62 0.00 -1.23 -4.77 121.76 117.75 2plu s ALA 183 Ca 0.02 0.68 -0.20 0.00 0.00 0.00 0.00 51.96 52.45 2plu s ALA 183 Cb 0.08 0.30 0.04 0.00 0.00 0.00 0.00 23.12 23.55 2plu s ALA 183 CO 0.75 -0.47 0.46 -1.54 0.00 0.00 0.00 175.76 174.97 2plu s SER 184 N -1.81 -0.35 0.00 0.00 1.04 -1.26 -1.06 113.70 110.25 2plu s SER 184 Ca -0.07 0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.48 2plu s SER 184 Cb -0.01 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.56 2plu s SER 184 CO 0.00 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.17 2plu n GLY 185 N 0.56 -0.24 0.18 7.32 0.00 -0.99 -4.53 105.19 107.49 2plu n GLY 185 Ca -0.19 -1.04 0.02 0.00 0.00 0.00 0.00 46.02 44.82 2plu n GLY 185 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65