#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w3g s ILE 4 N 0.00 2.45 -0.34 0.53 2.07 -1.26 -4.96 121.20 119.69 1w3g s ILE 4 Ca 0.00 0.24 -0.24 0.00 -1.41 0.00 0.00 60.65 59.24 1w3g s ILE 4 Cb 0.00 -2.89 0.01 0.00 0.13 0.00 0.00 42.46 39.71 1w3g s ILE 4 CO 0.00 -0.10 0.82 -0.47 -1.91 0.00 0.00 174.94 173.28 1w3g s TYR 5 N -1.88 3.14 -0.22 3.50 5.04 -1.26 -5.03 117.35 120.64 1w3g s TYR 5 Ca 0.75 0.72 -0.07 0.00 -2.44 0.00 0.00 57.07 56.03 1w3g s TYR 5 Cb -0.29 -3.39 -0.03 0.00 0.35 0.00 0.00 41.96 38.60 1w3g s TYR 5 CO 0.42 -0.69 0.05 0.42 -1.34 0.00 0.00 175.55 174.41 1w3g s ILE 6 N 3.13 4.32 0.64 3.14 -1.09 -1.26 -5.03 121.20 125.05 1w3g s ILE 6 Ca 0.34 -0.18 -0.18 0.00 -2.23 0.00 0.00 60.65 58.39 1w3g s ILE 6 Cb -0.13 -2.99 -0.02 0.00 -1.58 0.00 0.00 42.46 37.74 1w3g s ILE 6 CO 0.15 0.38 1.27 -2.16 -1.23 0.00 0.00 174.94 173.36 1w3g s PRO 7 N 1.21 2.65 1.04 2.79 0.04 -1.26 -5.02 135.00 136.44 1w3g s PRO 7 Ca 0.04 2.01 -0.17 0.00 0.04 0.00 0.00 61.00 62.92 1w3g s PRO 7 Cb -0.14 -1.86 0.23 0.00 0.04 0.00 0.00 34.50 32.76 1w3g s PRO 7 CO 0.03 -1.51 1.25 -1.25 0.04 0.00 0.00 177.00 175.56 1w3g s PRO 8 N -3.37 0.02 0.52 0.56 0.04 -1.26 -4.87 135.00 126.63 1w3g s PRO 8 Ca 0.81 -0.29 0.20 0.00 0.04 0.00 0.00 61.00 61.76 1w3g s PRO 8 Cb -0.36 -1.76 1.31 0.00 0.04 0.00 0.00 34.50 33.73 1w3g s PRO 8 CO 0.38 -2.85 2.08 0.93 0.04 0.00 0.00 177.00 177.58 1w3g h GLU 9 N -1.96 0.02 -0.31 4.56 5.08 -1.96 -3.12 114.58 116.89 1w3g h GLU 9 Ca -0.45 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1w3g h GLU 9 Cb 1.26 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1w3g h GLU 9 CO 0.37 0.01 0.00 0.41 -1.00 0.00 0.00 179.01 178.80 1w3g n GLY 10 N -1.58 0.91 3.80 -3.84 0.00 -1.26 -4.34 105.19 98.88 1w3g n GLY 10 Ca 0.03 -0.53 -0.36 0.00 0.00 0.00 0.00 46.02 45.16 1w3g n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1w3g s LEU 11 N -1.40 4.28 0.19 0.99 2.96 -1.18 -4.90 118.68 119.62 1w3g s LEU 11 Ca 0.34 0.34 0.01 0.00 -0.22 0.00 0.00 54.13 54.60 1w3g s LEU 11 Cb 0.19 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 1w3g s LEU 11 CO 0.26 0.29 0.35 -0.31 -1.32 0.00 0.00 176.35 175.62 1w3g s TYR 12 N -0.31 3.48 0.28 5.38 1.51 -1.26 -4.51 117.35 121.93 1w3g s TYR 12 Ca 0.11 0.22 -0.20 0.00 -1.01 0.00 0.00 57.07 56.19 1w3g s TYR 12 Cb -0.12 -1.75 0.02 0.00 -0.11 0.00 0.00 41.96 40.00 1w3g s TYR 12 CO 0.01 0.44 0.69 -0.59 -1.11 0.00 0.00 175.55 174.99 1w3g s PHE 13 N -1.83 -0.12 0.07 2.71 -0.12 0.13 -1.79 117.98 117.03 1w3g s PHE 13 Ca 0.36 -0.34 0.05 0.00 -0.05 0.00 0.00 56.93 56.96 1w3g s PHE 13 Cb -0.11 0.65 -0.04 0.00 -0.63 0.00 0.00 43.02 42.90 1w3g s PHE 13 CO 0.29 -1.22 -0.05 1.03 -0.05 0.00 0.00 175.22 175.22 1w3g s ARG 14 N -3.88 2.41 -0.56 1.99 3.00 -0.78 -0.62 118.95 120.51 1w3g s ARG 14 Ca 0.12 -0.87 -0.11 0.00 0.00 0.00 0.00 55.73 54.88 1w3g s ARG 14 Cb -0.05 -2.46 0.14 0.00 0.00 0.00 0.00 34.95 32.58 1w3g s ARG 14 CO 0.07 0.55 0.46 -0.51 0.00 0.00 0.00 175.30 175.87 1w3g s LEU 15 N -2.05 5.95 -0.10 2.53 1.43 -1.26 -1.58 118.68 123.60 1w3g s LEU 15 Ca 0.22 -2.09 -0.21 0.00 -1.03 0.00 0.00 54.13 51.03 1w3g s LEU 15 Cb -0.11 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 1w3g s LEU 15 CO 0.14 -0.69 0.58 -0.22 0.23 0.00 0.00 176.35 176.39 1w3g s LEU 16 N 1.11 4.29 0.06 1.79 2.96 -0.81 -2.53 118.68 125.54 1w3g s LEU 16 Ca 0.08 0.98 -0.22 0.00 -0.22 0.00 0.00 54.13 54.75 1w3g s LEU 16 Cb -0.24 -2.87 -0.06 0.00 0.50 0.00 0.00 46.19 43.51 1w3g s LEU 16 CO -0.01 -0.06 0.65 -0.83 -1.32 0.00 0.00 176.35 174.77 1w3g s GLY 17 N 0.73 2.71 0.10 7.98 0.00 -0.37 -0.93 107.32 117.56 1w3g s GLY 17 Ca 0.31 0.13 -0.22 0.00 0.00 0.00 0.00 44.72 44.94 1w3g s GLY 17 CO 0.14 0.75 1.72 -2.75 0.00 0.00 0.00 173.10 172.96 1w3g h PHE 18 N 5.10 -0.07 0.25 1.90 3.57 -1.66 0.99 116.94 127.02 1w3g h PHE 18 Ca -0.47 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.03 1w3g h PHE 18 Cb 1.21 0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.99 1w3g h PHE 18 CO 0.66 -0.05 -0.12 0.00 -2.23 0.00 0.00 178.31 176.57 1w3g h ALA 19 N 1.02 -0.46 0.00 2.41 0.00 -1.79 -3.33 119.26 117.12 1w3g h ALA 19 Ca 0.03 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1w3g h ALA 19 Cb 0.08 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1w3g h ALA 19 CO -0.08 -0.44 -0.08 0.66 0.00 0.00 0.00 179.25 179.31 1w3g h SER 20 N -0.76 0.00 -2.20 0.00 4.64 -1.65 -3.46 113.55 110.12 1w3g h SER 20 Ca -0.03 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.89 1w3g h SER 20 Cb 0.26 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.27 1w3g h SER 20 CO 0.06 0.08 -0.44 0.54 -0.87 0.00 0.00 176.83 176.20 1w3g n ARG 21 N -3.68 -1.62 -4.36 4.77 1.74 0.34 -4.88 116.66 108.98 1w3g n ARG 21 Ca -0.02 1.04 -0.20 0.00 -0.77 0.00 0.00 57.85 57.90 1w3g n ARG 21 Cb 0.19 -5.56 -0.10 0.00 -1.02 0.00 0.00 32.46 25.97 1w3g n ARG 21 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1w3g s GLN 22 N -4.41 1.36 0.04 5.56 -0.21 -1.25 -4.84 119.66 115.90 1w3g s GLN 22 Ca 0.00 -1.58 -0.03 0.00 0.02 0.00 0.00 55.36 53.77 1w3g s GLN 22 Cb 0.00 -1.22 -0.04 0.00 1.00 0.00 0.00 33.01 32.75 1w3g s GLN 22 CO 0.00 0.21 0.24 0.08 -2.12 0.00 0.00 175.29 173.70 1w3g s VAL 23 N -2.78 5.35 0.26 1.09 1.01 -0.14 -1.23 120.40 123.96 1w3g s VAL 23 Ca 0.22 -0.12 -0.29 0.00 0.00 0.00 0.00 61.98 61.79 1w3g s VAL 23 Cb -0.02 -3.59 -0.09 0.00 0.00 0.00 0.00 36.38 32.68 1w3g s VAL 23 CO 0.08 0.24 0.98 -0.63 0.00 0.00 0.00 175.10 175.76 1w3g s ILE 24 N -1.42 3.96 0.08 2.22 1.01 -1.05 -0.27 121.20 125.72 1w3g s ILE 24 Ca 0.32 1.91 0.06 0.00 0.00 0.00 0.00 60.65 62.94 1w3g s ILE 24 Cb -0.13 -4.19 -0.03 0.00 0.01 0.00 0.00 42.46 38.12 1w3g s ILE 24 CO 0.22 0.41 -0.17 0.72 0.00 0.00 0.00 174.94 176.12 1w3g s PHE 25 N -1.25 1.42 -0.16 3.97 -0.12 0.78 -4.51 117.98 118.11 1w3g s PHE 25 Ca 0.43 -0.44 -0.04 0.00 -0.05 0.00 0.00 56.93 56.83 1w3g s PHE 25 Cb -0.26 -0.79 0.07 0.00 -0.63 0.00 0.00 43.02 41.41 1w3g s PHE 25 CO 0.33 0.11 0.17 0.00 -0.05 0.00 0.00 175.22 175.77 1w3g s ALA 26 N -1.21 -0.06 0.41 1.99 0.00 -1.02 -1.81 121.76 120.07 1w3g s ALA 26 Ca 0.01 0.19 0.04 0.00 0.00 0.00 0.00 51.96 52.21 1w3g s ALA 26 Cb -0.10 -1.11 -0.02 0.00 0.00 0.00 0.00 23.12 21.89 1w3g s ALA 26 CO 0.03 -1.02 0.15 -0.98 0.00 0.00 0.00 175.76 173.94 1w3g s ARG 27 N 2.27 1.95 0.02 0.00 1.70 0.02 -4.39 118.95 120.52 1w3g s ARG 27 Ca 0.05 -2.20 0.22 0.00 -0.47 0.00 0.00 55.73 53.33 1w3g s ARG 27 Cb -0.15 -0.52 -0.09 0.00 -0.57 0.00 0.00 34.95 33.62 1w3g s ARG 27 CO -0.10 -0.52 0.91 0.09 -1.08 0.00 0.00 175.30 174.60 1w3g n ASN 28 N -1.40 0.63 -3.64 -2.89 3.02 -1.26 -4.70 115.26 105.02 1w3g n ASN 28 Ca -0.05 -0.44 -0.02 0.00 -0.03 0.00 0.00 54.58 54.03 1w3g n ASN 28 Cb 0.65 1.04 -0.02 0.00 -0.61 0.00 0.00 39.78 40.84 1w3g n ASN 28 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1w3g s SER 29 N -3.66 -0.02 0.74 6.41 1.04 -1.26 -4.93 113.70 112.02 1w3g s SER 29 Ca 0.04 -0.00 0.00 0.00 0.48 0.00 0.00 55.95 56.46 1w3g s SER 29 Cb 0.15 0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.29 1w3g s SER 29 CO 0.84 -0.03 0.00 -2.65 0.98 0.00 0.00 173.24 172.38 1w3g n PRO 30 N -0.03 -1.13 0.00 4.02 -0.02 -1.26 -5.06 135.00 131.52 1w3g n PRO 30 Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 1w3g n PRO 30 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.05 1w3g n PRO 30 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1w3g n SER 31 N -2.22 0.00 -4.67 2.55 7.64 -1.26 -4.13 113.62 111.53 1w3g n SER 31 Ca 0.00 0.31 -0.43 0.00 1.01 0.00 0.00 58.87 59.77 1w3g n SER 31 Cb 0.00 -0.11 -0.02 0.00 -1.01 0.00 0.00 64.21 63.07 1w3g n SER 31 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1w3g s PRO 32 N -2.07 4.25 0.16 1.43 0.04 -1.26 -4.92 135.00 132.63 1w3g s PRO 32 Ca 0.00 1.82 -0.04 0.00 0.04 0.00 0.00 61.00 62.82 1w3g s PRO 32 Cb 0.00 -3.74 0.02 0.00 0.04 0.00 0.00 34.50 30.82 1w3g s PRO 32 CO 0.00 -0.67 1.42 0.38 0.04 0.00 0.00 177.00 178.17 1w3g h ASP 33 N 8.27 0.59 -4.37 6.66 2.03 -1.84 -3.46 116.42 124.30 1w3g h ASP 33 Ca -0.32 -0.38 -0.38 0.00 -0.73 0.00 0.00 57.03 55.22 1w3g h ASP 33 Cb 1.14 -0.17 -0.20 0.00 -0.83 0.00 0.00 39.33 39.27 1w3g h ASP 33 CO 0.94 1.13 -0.76 0.68 -1.03 0.00 0.00 179.24 180.20 1w3g s VAL 34 N -3.68 1.09 -1.72 4.15 -7.23 -1.26 -0.80 120.40 110.95 1w3g s VAL 34 Ca -0.07 -1.47 0.00 0.00 -1.81 0.00 0.00 61.98 58.63 1w3g s VAL 34 Cb 0.10 -1.22 0.00 0.00 0.56 0.00 0.00 36.38 35.82 1w3g s VAL 34 CO 0.85 -0.36 0.00 0.61 -0.31 0.00 0.00 175.10 175.89 1w3g n GLY 35 N 0.94 -0.54 3.56 2.32 0.00 -0.75 -4.98 105.19 105.75 1w3g n GLY 35 Ca -0.19 -0.77 -0.29 0.00 0.00 0.00 0.00 46.02 44.77 1w3g n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1w3g s LEU 36 N 0.00 2.98 -0.02 0.99 1.43 -1.26 -0.16 118.68 122.64 1w3g s LEU 36 Ca 0.00 -0.46 -0.26 0.00 -1.03 0.00 0.00 54.13 52.38 1w3g s LEU 36 Cb 0.00 -1.75 0.06 0.00 0.03 0.00 0.00 46.19 44.53 1w3g s LEU 36 CO 0.00 0.16 0.57 -0.55 0.23 0.00 0.00 176.35 176.75 1w3g s SER 37 N -2.37 -0.51 0.53 2.29 0.15 0.63 -4.90 113.70 109.51 1w3g s SER 37 Ca 0.22 0.46 -0.22 0.00 0.70 0.00 0.00 55.95 57.11 1w3g s SER 37 Cb -0.10 0.48 -0.05 0.00 -1.71 0.00 0.00 66.02 64.63 1w3g s SER 37 CO 0.14 -0.60 1.29 -2.84 1.20 0.00 0.00 173.24 172.43 1w3g s PRO 38 N -1.52 3.29 0.36 5.44 0.02 -1.26 -0.97 135.00 140.36 1w3g s PRO 38 Ca -0.10 2.08 -0.27 0.00 0.02 0.00 0.00 61.00 62.72 1w3g s PRO 38 Cb -0.01 -2.27 -0.12 0.00 0.02 0.00 0.00 34.50 32.12 1w3g s PRO 38 CO 0.06 -1.02 1.30 0.28 -0.33 0.00 0.00 177.00 177.28 1w3g n VAL 39 N -0.93 2.12 -3.38 3.83 0.31 -1.26 -4.84 118.33 114.18 1w3g n VAL 39 Ca 0.10 -0.50 -0.16 0.00 -0.01 0.00 0.00 64.34 63.76 1w3g n VAL 39 Cb 0.46 -1.60 -0.09 0.00 -0.91 0.00 0.00 33.84 31.71 1w3g n VAL 39 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1w3g s ASN 40 N -0.35 1.44 0.37 4.52 3.04 -1.26 -5.04 114.94 117.67 1w3g s ASN 40 Ca 0.56 -0.94 0.14 0.00 0.04 0.00 0.00 52.86 52.66 1w3g s ASN 40 Cb -0.55 0.57 0.77 0.00 -1.54 0.00 0.00 41.25 40.50 1w3g s ASN 40 CO 0.61 -0.35 1.34 0.44 -3.04 0.00 0.00 177.10 176.10 1w3g h ASP 41 N 7.94 0.00 -0.00 -4.21 3.32 -2.02 -0.70 116.42 120.75 1w3g h ASP 41 Ca -0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.97 1w3g h ASP 41 Cb 1.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.62 1w3g h ASP 41 CO 0.29 0.00 -0.88 0.00 -1.72 0.00 0.00 179.24 176.94 1w3g n GLN 42 N -2.14 0.71 -2.32 3.56 6.02 -1.26 -4.85 117.38 117.10 1w3g n GLN 42 Ca -0.01 -0.05 -0.40 0.00 -0.01 0.00 0.00 57.00 56.53 1w3g n GLN 42 Cb 0.36 -1.40 -0.03 0.00 1.02 0.00 0.00 30.24 30.18 1w3g n GLN 42 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1w3g s ALA 43 N -2.78 2.48 0.52 -1.58 0.00 -0.27 -4.78 121.76 115.34 1w3g s ALA 43 Ca 0.08 -1.09 0.30 0.00 0.00 0.00 0.00 51.96 51.24 1w3g s ALA 43 Cb 0.15 -4.29 1.42 0.00 0.00 0.00 0.00 23.12 20.39 1w3g s ALA 43 CO 0.77 -3.59 1.87 1.15 0.00 0.00 0.00 175.76 175.96 1w3g h THR 44 N 6.44 0.55 -0.99 0.00 2.02 -1.88 0.52 112.91 119.57 1w3g h THR 44 Ca -0.25 -0.02 0.37 0.00 0.77 0.00 0.00 66.41 67.27 1w3g h THR 44 Cb 1.10 0.48 -0.17 0.00 -1.74 0.00 0.00 68.15 67.81 1w3g h THR 44 CO 1.26 0.01 0.44 -0.78 0.37 0.00 0.00 175.52 176.82 1w3g h ASP 45 N 0.07 0.20 -0.30 4.18 1.82 -1.86 -1.44 116.42 119.10 1w3g h ASP 45 Ca 0.45 0.25 0.00 0.00 -0.39 0.00 0.00 57.03 57.34 1w3g h ASP 45 Cb 1.68 0.28 0.00 0.00 0.68 0.00 0.00 39.33 41.97 1w3g h ASP 45 CO -0.04 -0.35 0.00 0.00 -1.61 0.00 0.00 179.24 177.24 1w3g n GLN 46 N -5.26 1.83 -4.28 0.28 6.02 0.17 -2.42 117.38 113.73 1w3g n GLN 46 Ca 0.33 -1.28 -0.34 0.00 -0.01 0.00 0.00 57.00 55.70 1w3g n GLN 46 Cb 1.11 -1.34 -0.09 0.00 1.02 0.00 0.00 30.24 30.94 1w3g n GLN 46 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1w3g s TYR 47 N -1.60 3.18 0.10 1.08 1.51 -0.54 -4.22 117.35 116.86 1w3g s TYR 47 Ca 0.28 0.18 -0.02 0.00 -1.01 0.00 0.00 57.07 56.50 1w3g s TYR 47 Cb 0.15 -1.76 -0.03 0.00 -0.11 0.00 0.00 41.96 40.21 1w3g s TYR 47 CO 0.21 0.50 0.06 -0.06 -1.11 0.00 0.00 175.55 175.14 1w3g s PHE 48 N -1.00 0.62 0.24 2.71 0.40 0.21 -1.16 117.98 120.01 1w3g s PHE 48 Ca 0.17 -1.07 0.01 0.00 -0.60 0.00 0.00 56.93 55.44 1w3g s PHE 48 Cb -0.12 -0.37 -0.04 0.00 0.51 0.00 0.00 43.02 43.01 1w3g s PHE 48 CO 0.06 -0.49 0.13 -1.54 0.70 0.00 0.00 175.22 174.09 1w3g s SER 49 N -2.97 0.77 0.13 1.36 1.04 -0.82 -0.69 113.70 112.52 1w3g s SER 49 Ca 0.15 -1.43 0.06 0.00 0.48 0.00 0.00 55.95 55.21 1w3g s SER 49 Cb 0.07 0.32 -0.04 0.00 0.10 0.00 0.00 66.02 66.47 1w3g s SER 49 CO -0.04 -0.82 -0.02 -0.76 0.98 0.00 0.00 173.24 172.58 1w3g s LEU 50 N -3.25 3.31 -0.27 2.42 1.43 -1.26 -1.33 118.68 119.73 1w3g s LEU 50 Ca 0.38 -0.32 -0.01 0.00 -1.03 0.00 0.00 54.13 53.16 1w3g s LEU 50 Cb 0.07 -2.02 0.04 0.00 0.03 0.00 0.00 46.19 44.31 1w3g s LEU 50 CO 0.14 0.14 -0.05 -0.63 0.23 0.00 0.00 176.35 176.18 1w3g s ILE 51 N -1.48 2.74 -0.08 -0.59 1.01 -0.76 -4.33 121.20 117.72 1w3g s ILE 51 Ca 0.26 -1.31 -0.30 0.00 0.00 0.00 0.00 60.65 59.30 1w3g s ILE 51 Cb -0.10 -2.51 -0.05 0.00 0.01 0.00 0.00 42.46 39.80 1w3g s ILE 51 CO 0.18 0.03 1.64 -0.31 0.00 0.00 0.00 174.94 176.47 1w3g s TYR 52 N 1.24 2.02 0.58 3.97 1.51 -1.26 -2.13 117.35 123.29 1w3g s TYR 52 Ca -0.04 0.27 -0.19 0.00 -1.01 0.00 0.00 57.07 56.09 1w3g s TYR 52 Cb -0.19 -3.90 -0.04 0.00 -0.11 0.00 0.00 41.96 37.72 1w3g s TYR 52 CO -0.03 -3.67 1.22 0.20 -1.11 0.00 0.00 175.55 172.16 1w3g s GLY 53 N 3.41 2.77 0.37 0.71 0.00 -0.31 -5.00 107.32 109.27 1w3g s GLY 53 Ca 0.73 1.05 0.04 0.00 0.00 0.00 0.00 44.72 46.53 1w3g s GLY 53 CO 0.29 1.45 0.14 -0.51 0.00 0.00 0.00 173.10 174.48 1w3g s THR 54 N -1.55 0.53 0.00 0.90 -4.23 -1.26 -3.72 115.64 106.31 1w3g s THR 54 Ca 0.76 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.27 1w3g s THR 54 Cb -0.32 -2.44 0.00 0.00 1.34 0.00 0.00 72.50 71.09 1w3g s THR 54 CO 0.35 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.04 1w3g n GLY 55 N -0.79 3.08 0.00 3.99 0.00 -1.26 -0.90 105.19 109.30 1w3g n GLY 55 Ca -0.03 -0.19 0.15 0.00 0.00 0.00 0.00 46.02 45.95 1w3g n GLY 55 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1w3g n GLU 56 N 13.56 0.62 0.00 1.61 1.02 -1.26 -2.51 120.64 133.67 1w3g n GLU 56 Ca 0.00 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.25 1w3g n GLU 56 Cb 0.00 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 29.94 1w3g n GLU 56 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1w3g n HIS 57 N -1.18 0.00 -1.62 -0.32 8.25 -0.08 -4.98 115.22 115.29 1w3g n HIS 57 Ca 0.17 0.00 -0.49 0.00 -0.26 0.00 0.00 57.72 57.14 1w3g n HIS 57 Cb 0.19 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.25 1w3g n HIS 57 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1w3g n ALA 58 N 0.24 -0.10 -0.19 -1.41 0.00 -1.05 -0.60 120.51 117.41 1w3g n ALA 58 Ca 0.10 0.48 0.00 0.00 0.00 0.00 0.00 53.44 54.02 1w3g n ALA 58 Cb 0.46 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.74 1w3g n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w3g n GLY 59 N 2.72 0.60 3.62 0.00 0.00 -1.26 -4.94 105.19 105.94 1w3g n GLY 59 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 1w3g n GLY 59 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1w3g s LEU 60 N 0.00 2.75 0.04 0.99 1.43 0.23 -4.79 118.68 119.32 1w3g s LEU 60 Ca 0.00 -1.41 -0.05 0.00 -1.03 0.00 0.00 54.13 51.64 1w3g s LEU 60 Cb 0.00 -0.83 -0.01 0.00 0.03 0.00 0.00 46.19 45.38 1w3g s LEU 60 CO 0.00 -0.51 0.09 -0.31 0.23 0.00 0.00 176.35 175.85 1w3g s TYR 61 N -2.78 0.20 0.01 0.29 1.51 -0.21 -1.16 117.35 115.20 1w3g s TYR 61 Ca 0.32 -0.49 0.03 0.00 -1.01 0.00 0.00 57.07 55.92 1w3g s TYR 61 Cb 0.09 -0.14 -0.03 0.00 -0.11 0.00 0.00 41.96 41.76 1w3g s TYR 61 CO 0.16 -0.36 -0.06 0.00 -1.11 0.00 0.00 175.55 174.18 1w3g s ALA 62 N -2.51 3.03 -0.39 3.71 0.00 -0.90 0.09 121.76 124.79 1w3g s ALA 62 Ca -0.06 -1.02 -0.08 0.00 0.00 0.00 0.00 51.96 50.80 1w3g s ALA 62 Cb -0.02 -1.14 0.06 0.00 0.00 0.00 0.00 23.12 22.03 1w3g s ALA 62 CO -0.04 0.62 0.20 0.42 0.00 0.00 0.00 175.76 176.96 1w3g s ILE 63 N -1.01 4.13 -0.16 0.00 1.01 -1.26 -1.83 121.20 122.08 1w3g s ILE 63 Ca 0.17 -1.25 -0.15 0.00 0.00 0.00 0.00 60.65 59.43 1w3g s ILE 63 Cb -0.11 -3.45 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 1w3g s ILE 63 CO 0.08 -0.37 0.34 -0.75 0.00 0.00 0.00 174.94 174.23 1w3g s LYS 64 N 1.43 4.25 0.14 2.79 2.20 -0.44 -1.26 119.74 128.85 1w3g s LYS 64 Ca 0.02 0.16 -0.31 0.00 -0.36 0.00 0.00 55.97 55.48 1w3g s LYS 64 Cb -0.21 -3.45 -0.08 0.00 -1.51 0.00 0.00 37.83 32.58 1w3g s LYS 64 CO 0.03 0.17 1.32 0.45 -0.36 0.00 0.00 175.35 176.96 1w3g s SER 65 N 0.62 6.91 0.17 1.43 0.15 0.87 -1.94 113.70 121.91 1w3g s SER 65 Ca 0.18 2.30 0.07 0.00 0.70 0.00 0.00 55.95 59.20 1w3g s SER 65 Cb -0.14 -2.59 -0.03 0.00 -1.71 0.00 0.00 66.02 61.55 1w3g s SER 65 CO 0.06 -0.56 1.38 0.50 1.20 0.00 0.00 173.24 175.81 1w3g h LYS 66 N 6.21 0.03 0.07 5.44 3.64 -1.40 0.29 116.57 130.85 1w3g h LYS 66 Ca -0.43 -0.04 -0.25 0.00 -1.27 0.00 0.00 60.65 58.66 1w3g h LYS 66 Cb 1.21 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1w3g h LYS 66 CO 0.82 0.90 -1.09 0.00 -2.27 0.00 0.00 179.45 177.80 1w3g h ALA 67 N 1.09 0.25 0.00 5.00 0.00 -1.77 -3.38 119.26 120.44 1w3g h ALA 67 Ca -0.02 -0.81 -0.02 0.00 0.00 0.00 0.00 54.91 54.06 1w3g h ALA 67 Cb 1.56 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.32 1w3g h ALA 67 CO 0.12 0.93 -1.55 2.41 0.00 0.00 0.00 179.25 181.16 1w3g n THR 68 N -3.61 0.08 0.00 0.00 -1.04 -1.23 -4.95 114.28 103.53 1w3g n THR 68 Ca -0.07 -0.29 0.00 0.00 -2.04 0.00 0.00 64.05 61.66 1w3g n THR 68 Cb 0.93 0.13 0.00 0.00 -1.82 0.00 0.00 70.33 69.57 1w3g n THR 68 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1w3g n GLY 69 N 1.90 2.93 3.78 3.41 0.00 0.10 -4.98 105.19 112.34 1w3g n GLY 69 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 1w3g n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w3g s LYS 70 N 0.00 2.33 0.06 1.61 1.02 -1.26 -4.56 119.74 118.94 1w3g s LYS 70 Ca 0.00 1.02 0.04 0.00 0.02 0.00 0.00 55.97 57.05 1w3g s LYS 70 Cb 0.00 -1.92 -0.04 0.00 -0.52 0.00 0.00 37.83 35.36 1w3g s LYS 70 CO 0.00 -1.55 -0.02 0.08 -0.92 0.00 0.00 175.35 172.95 1w3g s VAL 71 N -2.97 3.95 0.54 3.17 1.01 -0.05 -0.09 120.40 125.96 1w3g s VAL 71 Ca 0.60 -0.89 -0.16 0.00 0.00 0.00 0.00 61.98 61.53 1w3g s VAL 71 Cb -0.16 -2.83 -0.07 0.00 0.00 0.00 0.00 36.38 33.32 1w3g s VAL 71 CO 0.56 0.22 1.00 -0.76 0.00 0.00 0.00 175.10 176.12 1w3g s LEU 72 N -2.01 3.57 0.07 3.92 1.43 -0.39 -1.47 118.68 123.82 1w3g s LEU 72 Ca 0.23 1.62 -0.03 0.00 -1.03 0.00 0.00 54.13 54.92 1w3g s LEU 72 Cb -0.12 -4.51 -0.03 0.00 0.03 0.00 0.00 46.19 41.56 1w3g s LEU 72 CO 0.15 -0.73 0.04 0.72 0.23 0.00 0.00 176.35 176.75 1w3g s PHE 73 N -2.62 0.49 -0.19 0.29 -0.12 -0.75 -4.33 117.98 110.75 1w3g s PHE 73 Ca 0.60 -0.98 -0.05 0.00 -0.05 0.00 0.00 56.93 56.44 1w3g s PHE 73 Cb -0.11 -0.32 0.09 0.00 -0.63 0.00 0.00 43.02 42.05 1w3g s PHE 73 CO 0.34 -0.45 0.36 0.45 -0.05 0.00 0.00 175.22 175.87 1w3g s SER 74 N -2.93 0.09 0.04 1.98 0.15 -1.03 -3.29 113.70 108.71 1w3g s SER 74 Ca 0.09 0.66 -0.02 0.00 0.70 0.00 0.00 55.95 57.38 1w3g s SER 74 Cb 0.07 1.09 -0.03 0.00 -1.71 0.00 0.00 66.02 65.44 1w3g s SER 74 CO -0.08 -0.25 -0.00 0.00 1.20 0.00 0.00 173.24 174.10 1w3g s ARG 75 N 2.54 0.53 -0.04 5.44 1.70 -0.20 -4.80 118.95 124.11 1w3g s ARG 75 Ca 0.03 -0.95 0.17 0.00 -0.47 0.00 0.00 55.73 54.51 1w3g s ARG 75 Cb -0.13 0.19 -0.26 0.00 -0.57 0.00 0.00 34.95 34.18 1w3g s ARG 75 CO -0.12 -0.10 0.34 0.54 -1.08 0.00 0.00 175.30 174.87 1w3g n ARG 76 N 0.66 0.64 -0.00 3.89 5.12 -1.26 -4.43 116.66 121.28 1w3g n ARG 76 Ca -0.18 -0.14 -0.00 0.00 -1.93 0.00 0.00 57.85 55.60 1w3g n ARG 76 Cb 0.59 -1.41 -0.00 0.00 -1.16 0.00 0.00 32.46 30.47 1w3g n ARG 76 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1w3g h PRO 77 N 0.00 0.00 -6.90 5.56 0.13 -1.97 -3.47 132.00 125.34 1w3g h PRO 77 Ca -0.06 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.55 1w3g h PRO 77 Cb 0.96 0.00 0.07 0.00 0.13 0.00 0.00 31.00 32.16 1w3g h PRO 77 CO 0.00 0.00 0.61 0.00 -0.23 0.00 0.00 178.00 178.39 1w3g s ALA 78 N -2.98 3.39 -0.05 -0.56 0.00 -1.26 -4.98 121.76 115.31 1w3g s ALA 78 Ca -0.00 1.22 -0.04 0.00 0.00 0.00 0.00 51.96 53.14 1w3g s ALA 78 Cb 0.00 -3.47 -0.04 0.00 0.00 0.00 0.00 23.12 19.61 1w3g s ALA 78 CO 0.00 -0.67 0.14 -2.00 0.00 0.00 0.00 175.76 173.23 1w3g s GLU 79 N -1.97 3.36 0.55 0.00 2.56 -1.26 -3.62 118.70 118.32 1w3g s GLU 79 Ca 0.52 -0.28 -0.16 0.00 0.00 0.00 0.00 54.97 55.05 1w3g s GLU 79 Cb -0.38 -3.08 -0.06 0.00 2.00 0.00 0.00 34.13 32.61 1w3g s GLU 79 CO 0.50 0.71 1.02 -1.25 -0.56 0.00 0.00 175.26 175.68 1w3g s PRO 80 N -1.50 3.63 0.54 4.30 0.04 -1.26 -5.07 135.00 135.67 1w3g s PRO 80 Ca 0.21 1.08 0.32 0.00 0.04 0.00 0.00 61.00 62.65 1w3g s PRO 80 Cb -0.12 -2.08 1.45 0.00 0.04 0.00 0.00 34.50 33.78 1w3g s PRO 80 CO 0.11 -0.54 2.03 1.88 0.04 0.00 0.00 177.00 180.52 1w3g h TYR 81 N 0.67 0.00 -4.05 0.56 0.05 -1.77 -3.45 116.97 108.97 1w3g h TYR 81 Ca -0.47 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.14 1w3g h TYR 81 Cb 1.20 0.00 -0.16 0.00 1.01 0.00 0.00 36.73 38.78 1w3g h TYR 81 CO 0.61 0.08 -0.69 0.14 -1.05 0.00 0.00 178.16 177.25 1w3g s VAL 82 N -3.87 0.38 -3.97 -2.88 -7.23 -1.26 -1.03 120.40 100.54 1w3g s VAL 82 Ca -0.01 -1.65 0.00 0.00 -1.81 0.00 0.00 61.98 58.51 1w3g s VAL 82 Cb 0.11 -1.30 0.00 0.00 0.56 0.00 0.00 36.38 35.75 1w3g s VAL 82 CO 0.55 -0.83 0.00 0.61 -0.31 0.00 0.00 175.10 175.12 1w3g n GLY 83 N 0.41 -0.51 3.82 2.32 0.00 -1.21 -5.00 105.19 105.02 1w3g n GLY 83 Ca -0.16 -0.95 -0.22 0.00 0.00 0.00 0.00 46.02 44.68 1w3g n GLY 83 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1w3g s GLN 84 N -1.59 2.40 -0.28 1.61 -0.21 -1.26 -1.81 119.66 118.52 1w3g s GLN 84 Ca 0.00 -1.68 -0.27 0.00 0.02 0.00 0.00 55.36 53.44 1w3g s GLN 84 Cb 0.00 -2.21 0.18 0.00 1.00 0.00 0.00 33.01 31.98 1w3g s GLN 84 CO 0.00 -0.17 1.32 -1.50 -2.12 0.00 0.00 175.29 172.82 1w3g s ILE 85 N -2.53 0.00 1.24 1.08 1.10 -0.54 -4.88 121.20 116.67 1w3g s ILE 85 Ca 0.45 0.00 -0.20 0.00 -0.51 0.00 0.00 60.65 60.39 1w3g s ILE 85 Cb -0.00 -1.00 0.30 0.00 0.15 0.00 0.00 42.46 41.91 1w3g s ILE 85 CO 0.26 0.00 1.11 -1.81 -2.11 0.00 0.00 174.94 172.38 1w3g s ASP 86 N -0.40 0.61 -0.12 4.50 1.01 -1.26 -0.87 116.67 120.14 1w3g s ASP 86 Ca 0.06 0.55 -0.02 0.00 0.71 0.00 0.00 52.55 53.85 1w3g s ASP 86 Cb -0.03 -0.73 0.01 0.00 1.01 0.00 0.00 42.92 43.18 1w3g s ASP 86 CO -0.10 -4.30 0.05 0.61 0.21 0.00 0.00 175.17 171.63 1w3g n GLY 87 N -0.88 -3.71 2.93 0.21 0.00 -1.26 -4.60 105.19 97.88 1w3g n GLY 87 Ca 0.14 0.29 -0.08 0.00 0.00 0.00 0.00 46.02 46.37 1w3g n GLY 87 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1w3g n ASP 88 N 0.50 -0.12 0.00 1.61 8.00 -1.26 -0.75 116.55 124.52 1w3g n ASP 88 Ca -0.08 -1.15 0.00 0.00 0.71 0.00 0.00 54.79 54.28 1w3g n ASP 88 Cb 0.12 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.04 1w3g n ASP 88 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1w3g n GLY 89 N 3.54 1.10 0.26 0.44 0.00 -1.26 -4.99 105.19 104.28 1w3g n GLY 89 Ca 0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 46.02 45.88 1w3g n GLY 89 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1w3g h ARG 90 N 0.00 0.67 -5.91 1.61 2.43 -1.19 -3.43 114.38 108.57 1w3g h ARG 90 Ca 0.00 -0.04 -0.62 0.00 -0.81 0.00 0.00 59.98 58.51 1w3g h ARG 90 Cb 0.06 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.41 1w3g h ARG 90 CO 0.00 0.44 -0.48 0.71 -1.51 0.00 0.00 179.97 179.14 1w3g s TYR 91 N -6.09 3.53 0.04 2.20 1.51 -1.26 -4.97 117.35 112.30 1w3g s TYR 91 Ca -0.13 0.31 0.26 0.00 -1.01 0.00 0.00 57.07 56.51 1w3g s TYR 91 Cb 0.16 -1.81 1.41 0.00 -0.11 0.00 0.00 41.96 41.62 1w3g s TYR 91 CO 0.76 0.59 1.78 -1.00 -1.11 0.00 0.00 175.55 176.58 1w3g h PRO 92 N 3.27 0.00 0.00 -1.71 0.13 -2.00 -1.00 132.00 130.69 1w3g h PRO 92 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1w3g h PRO 92 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1w3g h PRO 92 CO 0.74 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.26 1w3g n ASP 93 N -2.43 0.08 -0.36 1.44 8.00 -1.26 -3.28 116.55 118.74 1w3g n ASP 93 Ca -0.02 0.52 0.12 0.00 0.71 0.00 0.00 54.79 56.12 1w3g n ASP 93 Cb 0.08 -0.53 0.23 0.00 -0.02 0.00 0.00 41.12 40.88 1w3g n ASP 93 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1w3g n ASN 94 N -1.58 1.46 -4.75 -2.24 3.02 -0.38 -2.47 115.26 108.32 1w3g n ASN 94 Ca 0.05 -1.17 -0.35 0.00 -0.03 0.00 0.00 54.58 53.07 1w3g n ASN 94 Cb 0.24 0.26 -0.08 0.00 -0.61 0.00 0.00 39.78 39.59 1w3g n ASN 94 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1w3g s TRP 95 N -2.47 3.43 0.12 3.10 0.52 -1.21 -4.02 118.94 118.41 1w3g s TRP 95 Ca 0.23 0.35 0.08 0.00 0.02 0.00 0.00 56.10 56.77 1w3g s TRP 95 Cb 0.19 -2.09 -0.04 0.00 -1.15 0.00 0.00 33.47 30.38 1w3g s TRP 95 CO 0.53 0.38 -0.19 -0.06 0.02 0.00 0.00 176.95 177.63 1w3g s PHE 96 N 0.01 1.73 -0.13 -1.98 0.40 0.11 -4.37 117.98 113.75 1w3g s PHE 96 Ca 0.09 -0.44 -0.04 0.00 -0.60 0.00 0.00 56.93 55.93 1w3g s PHE 96 Cb -0.11 -0.92 -0.04 0.00 0.51 0.00 0.00 43.02 42.46 1w3g s PHE 96 CO -0.00 0.22 0.03 0.21 0.70 0.00 0.00 175.22 176.38 1w3g s LYS 97 N -2.16 3.47 -0.45 0.44 2.20 0.36 -1.05 119.74 122.55 1w3g s LYS 97 Ca 0.08 -0.38 -0.16 0.00 -0.36 0.00 0.00 55.97 55.15 1w3g s LYS 97 Cb -0.09 -2.99 0.04 0.00 -1.51 0.00 0.00 37.83 33.29 1w3g s LYS 97 CO 0.05 0.50 0.40 0.42 -0.36 0.00 0.00 175.35 176.36 1w3g s ILE 98 N -0.29 5.17 -0.50 5.43 1.01 -1.26 -1.23 121.20 129.53 1w3g s ILE 98 Ca 0.07 -0.72 -0.08 0.00 0.00 0.00 0.00 60.65 59.92 1w3g s ILE 98 Cb -0.12 -4.07 0.13 0.00 0.01 0.00 0.00 42.46 38.41 1w3g s ILE 98 CO 0.02 -0.49 0.37 -1.61 0.00 0.00 0.00 174.94 173.23 1w3g s GLU 99 N 1.88 2.52 0.36 2.79 2.02 -0.49 -4.91 118.70 122.87 1w3g s GLU 99 Ca 0.07 -1.88 -0.27 0.00 0.02 0.00 0.00 54.97 52.91 1w3g s GLU 99 Cb -0.21 -3.92 -0.12 0.00 0.10 0.00 0.00 34.13 29.99 1w3g s GLU 99 CO 0.10 -1.19 1.26 -2.30 0.02 0.00 0.00 175.26 173.15 1w3g n PRO 100 N 4.71 2.01 -1.94 0.39 -0.02 -1.26 -1.08 135.00 137.81 1w3g n PRO 100 Ca -0.05 0.71 -0.20 0.00 -2.02 0.00 0.00 63.50 61.94 1w3g n PRO 100 Cb 0.41 -2.31 0.12 0.00 -0.02 0.00 0.00 33.50 31.70 1w3g n PRO 100 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1w3g n GLY 101 N 0.82 -0.12 3.53 -1.23 0.00 -0.13 -4.89 105.19 103.17 1w3g n GLY 101 Ca 0.05 -1.90 -0.25 0.00 0.00 0.00 0.00 46.02 43.93 1w3g n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w3g s LYS 102 N -4.86 1.79 4.92 1.61 1.02 -1.25 -3.77 119.74 119.20 1w3g s LYS 102 Ca 0.56 -1.99 0.00 0.00 0.02 0.00 0.00 55.97 54.56 1w3g s LYS 102 Cb -0.02 -1.32 0.00 0.00 -0.52 0.00 0.00 37.83 35.96 1w3g s LYS 102 CO 0.38 -0.07 0.00 2.41 -0.92 0.00 0.00 175.35 177.15 1w3g n THR 103 N -0.81 0.00 0.43 2.17 -1.04 -1.26 -0.39 114.28 113.38 1w3g n THR 103 Ca -0.04 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.04 1w3g n THR 103 Cb 0.66 0.00 0.29 0.00 -1.82 0.00 0.00 70.33 69.46 1w3g n THR 103 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1w3g n TYR 104 N 14.00 0.08 -0.85 -1.42 0.18 -1.26 -2.02 117.16 125.87 1w3g n TYR 104 Ca 0.00 0.03 0.08 0.00 1.88 0.00 0.00 57.90 59.89 1w3g n TYR 104 Cb 0.00 -0.55 0.25 0.00 -0.38 0.00 0.00 39.34 38.66 1w3g n TYR 104 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1w3g n LEU 105 N -1.58 3.86 0.26 -3.48 4.77 0.48 -4.68 117.00 116.63 1w3g n LEU 105 Ca 0.03 -2.83 0.13 0.00 -0.03 0.00 0.00 56.01 53.30 1w3g n LEU 105 Cb 0.15 -0.50 0.71 0.00 -2.33 0.00 0.00 43.42 41.45 1w3g n LEU 105 CO 0.12 0.68 0.96 0.77 -1.33 0.00 0.00 177.39 178.60 1w3g h SER 106 N 2.02 0.00 -0.60 -1.43 4.64 -1.39 -1.50 113.55 115.29 1w3g h SER 106 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1w3g h SER 106 Cb 1.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 1w3g h SER 106 CO 0.20 0.13 0.00 0.29 -0.87 0.00 0.00 176.83 176.58 1w3g n LYS 107 N -3.57 3.64 -4.56 4.77 5.02 -1.26 -4.57 118.16 117.64 1w3g n LYS 107 Ca -0.01 -2.84 -0.26 0.00 -2.02 0.00 0.00 58.31 53.18 1w3g n LYS 107 Cb 0.26 -1.85 -0.11 0.00 -0.02 0.00 0.00 35.03 33.31 1w3g n LYS 107 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1w3g s TYR 108 N -1.86 2.32 0.12 2.13 1.51 -0.59 -4.53 117.35 116.46 1w3g s TYR 108 Ca 0.49 -0.75 -0.25 0.00 -1.01 0.00 0.00 57.07 55.55 1w3g s TYR 108 Cb 0.32 -1.58 0.07 0.00 -0.11 0.00 0.00 41.96 40.65 1w3g s TYR 108 CO 0.23 0.31 0.62 -0.59 -1.11 0.00 0.00 175.55 175.01 1w3g s PHE 109 N -2.90 -0.56 0.20 2.71 -0.12 0.25 -0.95 117.98 116.60 1w3g s PHE 109 Ca 0.35 0.48 -0.06 0.00 -0.05 0.00 0.00 56.93 57.65 1w3g s PHE 109 Cb 0.09 0.53 -0.06 0.00 -0.63 0.00 0.00 43.02 42.95 1w3g s PHE 109 CO 0.17 -0.80 0.46 1.03 -0.05 0.00 0.00 175.22 176.03 1w3g s ARG 110 N -3.26 3.68 -0.61 1.99 0.52 -0.24 0.25 118.95 121.27 1w3g s ARG 110 Ca -0.01 0.04 -0.01 0.00 -0.52 0.00 0.00 55.73 55.22 1w3g s ARG 110 Cb -0.01 -2.75 0.16 0.00 0.52 0.00 0.00 34.95 32.87 1w3g s ARG 110 CO -0.09 0.38 0.41 -0.51 0.02 0.00 0.00 175.30 175.51 1w3g s LEU 111 N -2.87 5.02 -0.16 2.53 1.43 -1.26 -1.40 118.68 121.96 1w3g s LEU 111 Ca 0.44 -2.94 -0.14 0.00 -1.03 0.00 0.00 54.13 50.46 1w3g s LEU 111 Cb -0.12 -1.80 -0.05 0.00 0.03 0.00 0.00 46.19 44.26 1w3g s LEU 111 CO 0.24 -0.32 0.29 -0.69 0.23 0.00 0.00 176.35 176.09 1w3g s VAL 112 N -0.19 5.31 -0.63 -1.59 1.01 -0.36 -1.86 120.40 122.08 1w3g s VAL 112 Ca 0.17 0.53 -0.13 0.00 0.00 0.00 0.00 61.98 62.56 1w3g s VAL 112 Cb -0.21 -3.63 0.16 0.00 0.00 0.00 0.00 36.38 32.70 1w3g s VAL 112 CO -0.03 0.39 0.56 -1.58 0.00 0.00 0.00 175.10 174.44 1w3g s GLN 113 N 0.47 3.07 0.10 2.72 2.00 0.26 0.14 119.66 128.41 1w3g s GLN 113 Ca 0.16 -2.04 -0.23 0.00 -2.00 0.00 0.00 55.36 51.25 1w3g s GLN 113 Cb -0.13 -4.23 -0.07 0.00 0.80 0.00 0.00 33.01 29.38 1w3g s GLN 113 CO 0.04 -1.28 1.39 -1.35 -0.50 0.00 0.00 175.29 173.59 1w3g h PRO 114 N 8.29 -0.20 -1.45 1.67 0.11 -1.83 -1.17 132.00 137.43 1w3g h PRO 114 Ca -0.12 0.01 0.47 0.00 0.11 0.00 0.00 66.00 66.47 1w3g h PRO 114 Cb 1.06 0.04 -0.11 0.00 0.11 0.00 0.00 31.00 32.11 1w3g h PRO 114 CO 0.88 -0.13 0.98 0.45 -0.21 0.00 0.00 178.00 179.98 1w3g n SER 115 N -4.61 0.12 -0.20 -2.05 2.88 -1.26 0.03 113.62 108.52 1w3g n SER 115 Ca -0.01 1.14 0.03 0.00 -1.33 0.00 0.00 58.87 58.70 1w3g n SER 115 Cb 0.23 -0.56 0.01 0.00 -0.75 0.00 0.00 64.21 63.14 1w3g n SER 115 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1w3g n THR 116 N -4.25 0.00 -3.59 2.46 -2.24 -0.91 -5.00 114.28 100.75 1w3g n THR 116 Ca 0.38 -0.46 -0.23 0.00 -2.27 0.00 0.00 64.05 61.47 1w3g n THR 116 Cb 1.58 1.11 0.08 0.00 -2.10 0.00 0.00 70.33 70.99 1w3g n THR 116 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1w3g n GLY 117 N 0.59 -0.52 3.26 3.38 0.00 0.10 -4.77 105.19 107.24 1w3g n GLY 117 Ca 0.03 0.24 -0.25 0.00 0.00 0.00 0.00 46.02 46.04 1w3g n GLY 117 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1w3g s THR 118 N -3.33 1.69 -0.01 2.61 -1.32 -1.14 0.26 115.64 114.41 1w3g s THR 118 Ca 0.51 -1.31 0.08 0.00 -1.21 0.00 0.00 61.69 59.77 1w3g s THR 118 Cb -0.23 -1.49 -0.02 0.00 -1.51 0.00 0.00 72.50 69.25 1w3g s THR 118 CO 0.73 0.13 -0.26 0.00 -2.21 0.00 0.00 174.62 173.01 1w3g s ALA 119 N -0.91 2.16 0.60 11.08 0.00 0.37 -0.58 121.76 134.49 1w3g s ALA 119 Ca 0.07 -1.14 -0.18 0.00 0.00 0.00 0.00 51.96 50.71 1w3g s ALA 119 Cb -0.09 -0.53 -0.03 0.00 0.00 0.00 0.00 23.12 22.47 1w3g s ALA 119 CO 0.03 0.53 1.19 -0.51 0.00 0.00 0.00 175.76 176.99 1w3g s LEU 120 N -0.74 3.62 -0.04 0.00 1.43 -0.78 -0.58 118.68 121.59 1w3g s LEU 120 Ca 0.10 2.33 0.04 0.00 -1.03 0.00 0.00 54.13 55.57 1w3g s LEU 120 Cb -0.10 -4.59 -0.00 0.00 0.03 0.00 0.00 46.19 41.53 1w3g s LEU 120 CO -0.00 -1.61 -0.16 -0.69 0.23 0.00 0.00 176.35 174.12 1w3g s VAL 121 N -1.71 1.32 -0.29 -1.59 1.01 0.13 -4.46 120.40 114.81 1w3g s VAL 121 Ca 0.76 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 62.06 1w3g s VAL 121 Cb -0.29 -1.14 0.09 0.00 0.00 0.00 0.00 36.38 35.05 1w3g s VAL 121 CO 0.34 0.38 0.09 -0.55 0.00 0.00 0.00 175.10 175.37 1w3g s SER 122 N 0.08 3.74 0.18 3.32 0.15 0.45 -1.98 113.70 119.64 1w3g s SER 122 Ca -0.04 -1.42 -0.02 0.00 0.70 0.00 0.00 55.95 55.17 1w3g s SER 122 Cb -0.11 -0.71 -0.04 0.00 -1.71 0.00 0.00 66.02 63.45 1w3g s SER 122 CO 0.02 -0.40 0.13 0.00 1.20 0.00 0.00 173.24 174.18 1w3g s ARG 123 N 1.76 1.13 0.00 5.44 1.70 -0.50 -3.07 118.95 125.41 1w3g s ARG 123 Ca 0.08 -1.55 0.00 0.00 -0.47 0.00 0.00 55.73 53.78 1w3g s ARG 123 Cb -0.17 0.27 0.00 0.00 -0.57 0.00 0.00 34.95 34.48 1w3g s ARG 123 CO -0.25 -0.36 0.11 0.25 -1.08 0.00 0.00 175.30 173.97 1w3g n THR 124 N -0.22 0.00 0.05 4.99 -2.24 -1.26 -4.44 114.28 111.16 1w3g n THR 124 Ca -0.00 -0.28 -0.01 0.00 -2.27 0.00 0.00 64.05 61.49 1w3g n THR 124 Cb 0.65 1.17 -0.07 0.00 -2.10 0.00 0.00 70.33 69.99 1w3g n THR 124 CO 0.00 0.00 0.00 1.12 -0.57 0.00 0.00 175.07 175.62 1w3g h HIS 125 N 0.00 0.00 -3.41 4.78 2.07 -1.97 -3.47 115.15 113.15 1w3g h HIS 125 Ca 0.00 0.00 -0.35 0.00 -2.85 0.00 0.00 60.37 57.17 1w3g h HIS 125 Cb 0.09 0.00 -0.16 0.00 2.57 0.00 0.00 27.41 29.91 1w3g h HIS 125 CO 0.00 0.62 -0.72 -1.17 -3.07 0.00 0.00 177.93 173.59 1w3g s LEU 126 N -6.01 2.50 0.00 6.12 0.20 -1.26 -5.15 118.68 115.08 1w3g s LEU 126 Ca -0.01 -0.96 0.04 0.00 0.69 0.00 0.00 54.13 53.89 1w3g s LEU 126 Cb 0.08 -0.40 -0.03 0.00 -0.43 0.00 0.00 46.19 45.41 1w3g s LEU 126 CO 0.80 -0.28 -0.10 -1.58 -0.29 0.00 0.00 176.35 174.90 1w3g s GLN 127 N -3.46 2.46 0.41 1.98 0.74 -1.26 -3.49 119.66 117.05 1w3g s GLN 127 Ca 0.15 -0.77 -0.24 0.00 0.05 0.00 0.00 55.36 54.55 1w3g s GLN 127 Cb 0.00 -2.43 -0.08 0.00 1.10 0.00 0.00 33.01 31.60 1w3g s GLN 127 CO 0.01 0.59 1.13 -2.14 -0.55 0.00 0.00 175.29 174.34 1w3g s PRO 128 N -1.35 4.02 0.22 1.67 0.02 -1.26 -5.09 135.00 133.23 1w3g s PRO 128 Ca 0.16 1.73 -0.07 0.00 0.02 0.00 0.00 61.00 62.84 1w3g s PRO 128 Cb -0.11 -2.58 0.17 0.00 0.02 0.00 0.00 34.50 32.00 1w3g s PRO 128 CO 0.06 -0.32 1.76 1.88 -0.33 0.00 0.00 177.00 180.06 1w3g h TYR 129 N 2.47 1.18 -3.64 6.54 -1.99 -1.77 -3.36 116.97 116.40 1w3g h TYR 129 Ca -0.49 -0.11 -0.70 0.00 2.00 0.00 0.00 58.73 59.44 1w3g h TYR 129 Cb 1.23 -0.35 -0.27 0.00 2.00 0.00 0.00 36.73 39.34 1w3g h TYR 129 CO 0.55 0.92 -0.59 0.12 -0.00 0.00 0.00 178.16 179.17 1w3g s PHE 130 N -5.43 3.24 0.00 4.88 5.36 -1.26 -1.41 117.98 123.35 1w3g s PHE 130 Ca -0.12 -1.25 0.00 0.00 -0.96 0.00 0.00 56.93 54.60 1w3g s PHE 130 Cb 0.15 -2.31 0.00 0.00 -0.34 0.00 0.00 43.02 40.52 1w3g s PHE 130 CO 0.84 -0.69 0.00 1.87 -1.46 0.00 0.00 175.22 175.78 1w3g n TRP 131 N 4.86 0.00 -4.07 10.12 -0.00 -0.84 -4.93 117.44 122.59 1w3g n TRP 131 Ca -0.13 0.00 -0.11 0.00 -0.00 0.00 0.00 57.50 57.26 1w3g n TRP 131 Cb 0.45 0.00 -0.06 0.00 -0.00 0.00 0.00 31.31 31.70 1w3g n TRP 131 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 1w3g s ASN 132 N 1.52 0.23 0.03 5.87 2.20 -1.26 0.20 114.94 123.72 1w3g s ASN 132 Ca 0.00 -1.19 -0.12 0.00 -0.94 0.00 0.00 52.86 50.62 1w3g s ASN 132 Cb 0.00 0.55 0.01 0.00 -2.00 0.00 0.00 41.25 39.82 1w3g s ASN 132 CO 0.00 -1.10 0.24 -2.28 -2.94 0.00 0.00 177.10 171.02 1w3g s HIS 133 N -3.81 -0.04 -0.28 1.54 2.46 0.25 -4.83 115.29 110.59 1w3g s HIS 133 Ca 0.29 -0.08 -0.33 0.00 0.47 0.00 0.00 55.06 55.41 1w3g s HIS 133 Cb 0.01 0.03 -0.10 0.00 -0.13 0.00 0.00 32.58 32.40 1w3g s HIS 133 CO 0.13 -0.43 2.16 -2.30 -2.47 0.00 0.00 174.74 171.82 1w3g n PRO 134 N 0.84 1.48 0.04 2.88 -0.02 -1.26 -0.48 135.00 138.48 1w3g n PRO 134 Ca -0.20 0.43 0.17 0.00 -2.02 0.00 0.00 63.50 61.88 1w3g n PRO 134 Cb 0.58 -2.72 0.35 0.00 -0.02 0.00 0.00 33.50 31.69 1w3g n PRO 134 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1w3g h GLN 135 N 12.76 0.00 0.00 -0.52 -0.00 -0.46 -1.20 115.11 125.68 1w3g h GLN 135 Ca -0.34 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.31 1w3g h GLN 135 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.77 1w3g h GLN 135 CO 0.99 0.00 0.00 1.79 0.00 0.00 0.00 178.83 181.61 1w3g h THR 136 N 0.00 0.00 -3.34 2.39 1.35 -1.86 -3.40 112.91 108.05 1w3g h THR 136 Ca 0.26 -0.79 -0.72 0.00 -0.55 0.00 0.00 66.41 64.61 1w3g h THR 136 Cb 2.28 1.79 -0.30 0.00 -1.73 0.00 0.00 68.15 70.18 1w3g h THR 136 CO -0.00 0.00 -0.41 -0.70 -0.25 0.00 0.00 175.52 174.16 1w3g s GLU 137 N -3.40 2.42 -0.28 4.72 2.12 -0.46 -5.06 118.70 118.76 1w3g s GLU 137 Ca 0.05 -1.81 -0.28 0.00 0.36 0.00 0.00 54.97 53.28 1w3g s GLU 137 Cb 0.07 -3.87 0.01 0.00 0.26 0.00 0.00 34.13 30.60 1w3g s GLU 137 CO 0.62 -1.18 1.02 0.08 -0.54 0.00 0.00 175.26 175.26 1w3g s VAL 138 N 1.26 4.61 0.18 3.70 1.01 -1.26 -4.84 120.40 125.07 1w3g s VAL 138 Ca 0.07 1.79 0.11 0.00 0.00 0.00 0.00 61.98 63.94 1w3g s VAL 138 Cb -0.25 -4.34 -0.04 0.00 0.00 0.00 0.00 36.38 31.75 1w3g s VAL 138 CO -0.02 -0.33 -0.21 -0.36 0.00 0.00 0.00 175.10 174.19 1w3g s PHE 139 N 3.38 2.39 0.45 5.22 0.40 -1.26 -5.04 117.98 123.52 1w3g s PHE 139 Ca 0.43 -0.33 0.15 0.00 -0.60 0.00 0.00 56.93 56.59 1w3g s PHE 139 Cb -0.14 -1.20 1.08 0.00 0.51 0.00 0.00 43.02 43.28 1w3g s PHE 139 CO 0.11 0.48 2.00 -0.44 0.70 0.00 0.00 175.22 178.07 1w3g h ASP 140 N 3.25 0.30 0.00 1.36 5.19 -2.01 -2.60 116.42 121.91 1w3g h ASP 140 Ca -0.47 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 55.94 1w3g h ASP 140 Cb 1.20 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 40.65 1w3g h ASP 140 CO 0.48 0.18 0.00 -0.90 -3.12 0.00 0.00 179.24 175.88 1w3g n ASP 141 N -4.46 0.43 -0.81 6.45 5.68 -1.26 -2.53 116.55 120.05 1w3g n ASP 141 Ca 0.08 -1.53 0.07 0.00 -0.50 0.00 0.00 54.79 52.91 1w3g n ASP 141 Cb 0.36 -0.21 0.18 0.00 -1.14 0.00 0.00 41.12 40.30 1w3g n ASP 141 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1w3g n GLN 142 N -0.16 2.46 -4.02 0.11 6.02 -0.98 -0.41 117.38 120.40 1w3g n GLN 142 Ca 0.00 -2.06 -0.34 0.00 -0.01 0.00 0.00 57.00 54.59 1w3g n GLN 142 Cb 0.11 -1.35 -0.06 0.00 1.02 0.00 0.00 30.24 29.96 1w3g n GLN 142 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1w3g s TYR 143 N -1.05 3.43 0.11 1.08 1.51 -1.05 -4.19 117.35 117.18 1w3g s TYR 143 Ca 0.28 0.33 0.04 0.00 -1.01 0.00 0.00 57.07 56.71 1w3g s TYR 143 Cb 0.15 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 40.14 1w3g s TYR 143 CO 0.21 0.62 -0.10 -0.06 -1.11 0.00 0.00 175.55 175.11 1w3g s PHE 144 N -1.15 1.10 0.08 2.71 0.40 0.14 -1.83 117.98 119.43 1w3g s PHE 144 Ca 0.21 -0.70 0.03 0.00 -0.60 0.00 0.00 56.93 55.87 1w3g s PHE 144 Cb -0.12 -0.59 -0.03 0.00 0.51 0.00 0.00 43.02 42.78 1w3g s PHE 144 CO 0.11 0.01 -0.08 -0.08 0.70 0.00 0.00 175.22 175.88 1w3g s THR 145 N -2.74 0.76 -0.10 0.64 -1.32 -0.10 0.85 115.64 113.62 1w3g s THR 145 Ca 0.09 -1.58 -0.27 0.00 -1.21 0.00 0.00 61.69 58.72 1w3g s THR 145 Cb -0.01 -1.26 -0.02 0.00 -1.51 0.00 0.00 72.50 69.70 1w3g s THR 145 CO -0.00 -0.61 0.88 -0.36 -2.21 0.00 0.00 174.62 172.32 1w3g s PHE 146 N -2.52 3.51 -0.81 9.09 2.99 -1.26 -1.93 117.98 127.06 1w3g s PHE 146 Ca 0.03 1.42 0.02 0.00 0.00 0.00 0.00 56.93 58.40 1w3g s PHE 146 Cb -0.02 -3.04 0.23 0.00 0.00 0.00 0.00 43.02 40.19 1w3g s PHE 146 CO -0.01 -0.14 0.81 -0.11 -0.00 0.00 0.00 175.22 175.77 1w3g n LEU 147 N 4.68 4.13 -4.31 -0.37 0.00 -0.62 -4.96 117.00 115.55 1w3g n LEU 147 Ca 0.05 -5.26 -0.34 0.00 0.00 0.00 0.00 56.01 50.46 1w3g n LEU 147 Cb 0.50 -0.92 0.10 0.00 0.00 0.00 0.00 43.42 43.09 1w3g n LEU 147 CO 0.50 1.77 -0.41 0.49 0.00 0.00 0.00 177.39 179.74 1w3g n PHE 148 N 1.66 -2.42 -1.32 1.96 3.01 -1.26 -1.87 117.46 117.22 1w3g n PHE 148 Ca 0.24 0.17 -0.31 0.00 1.01 0.00 0.00 57.45 58.56 1w3g n PHE 148 Cb 0.37 -1.70 0.09 0.00 -0.01 0.00 0.00 39.48 38.23 1w3g n PHE 148 CO 0.00 0.00 0.00 -1.83 1.01 0.00 0.00 176.76 175.94 1w3g s GLU 149 N -3.17 2.32 -0.01 -1.08 -1.05 -0.74 -4.79 118.70 110.17 1w3g s GLU 149 Ca 0.53 1.10 -0.30 0.00 -0.15 0.00 0.00 54.97 56.15 1w3g s GLU 149 Cb -0.21 -1.91 -0.07 0.00 -0.44 0.00 0.00 34.13 31.50 1w3g s GLU 149 CO 0.71 -1.58 1.88 0.34 0.95 0.00 0.00 175.26 177.56 1w3g s ASP 150 N -3.48 6.45 0.09 0.83 2.15 -1.26 -4.98 116.67 116.47 1w3g s ASP 150 Ca 0.61 2.46 0.06 0.00 0.43 0.00 0.00 52.55 56.11 1w3g s ASP 150 Cb -0.17 -2.53 -0.04 0.00 -0.30 0.00 0.00 42.92 39.89 1w3g s ASP 150 CO 0.56 -1.08 -0.07 -0.32 -0.17 0.00 0.00 175.17 174.09 1w3g s MET 151 N 4.45 2.29 -0.10 4.34 1.75 -1.26 -3.11 119.30 127.66 1w3g s MET 151 Ca 0.84 -0.93 -0.00 0.00 -1.25 0.00 0.00 55.69 54.34 1w3g s MET 151 Cb -0.39 -2.39 -0.03 0.00 2.84 0.00 0.00 34.83 34.87 1w3g s MET 151 CO 0.37 0.53 -0.08 -1.54 -0.65 0.00 0.00 175.02 173.65 1w3g s SER 152 N -2.11 4.50 -0.71 1.11 1.04 -0.46 -4.93 113.70 112.13 1w3g s SER 152 Ca 0.22 -0.13 -0.24 0.00 0.48 0.00 0.00 55.95 56.28 1w3g s SER 152 Cb -0.11 -1.41 0.06 0.00 0.10 0.00 0.00 66.02 64.66 1w3g s SER 152 CO 0.14 0.26 1.09 -0.63 0.98 0.00 0.00 173.24 175.08 1w3g s ILE 153 N -0.22 4.14 0.14 -1.02 1.01 -1.26 -2.08 121.20 121.91 1w3g s ILE 153 Ca 0.02 -0.20 0.06 0.00 0.00 0.00 0.00 60.65 60.53 1w3g s ILE 153 Cb -0.13 -4.78 -0.18 0.00 0.01 0.00 0.00 42.46 37.38 1w3g s ILE 153 CO 0.03 -1.61 1.32 0.44 0.00 0.00 0.00 174.94 175.12 1w3g h ASP 154 N 9.68 0.07 -4.21 3.58 3.32 -1.19 -3.48 116.42 124.20 1w3g h ASP 154 Ca -0.24 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 56.73 1w3g h ASP 154 Cb 1.06 -0.02 -0.22 0.00 0.22 0.00 0.00 39.33 40.37 1w3g h ASP 154 CO 1.22 0.98 0.27 -0.75 -1.72 0.00 0.00 179.24 179.24 1w3g s LYS 155 N -2.89 0.81 -0.16 3.56 2.20 -1.04 -4.98 119.74 117.25 1w3g s LYS 155 Ca -0.00 0.55 0.02 0.00 -0.36 0.00 0.00 55.97 56.17 1w3g s LYS 155 Cb 0.10 0.39 0.01 0.00 -1.51 0.00 0.00 37.83 36.83 1w3g s LYS 155 CO 0.82 -0.18 -0.21 0.42 -0.36 0.00 0.00 175.35 175.84 1w3g s ILE 156 N -0.40 2.04 -0.24 5.43 -1.09 -1.26 -0.36 121.20 125.32 1w3g s ILE 156 Ca -0.03 -0.95 0.02 0.00 -2.23 0.00 0.00 60.65 57.46 1w3g s ILE 156 Cb -0.03 -1.82 0.05 0.00 -1.58 0.00 0.00 42.46 39.08 1w3g s ILE 156 CO 0.03 0.54 -0.11 -1.61 -1.23 0.00 0.00 174.94 172.56 1w3g s GLU 157 N 1.05 2.14 0.34 2.79 2.02 -0.27 -4.98 118.70 121.80 1w3g s GLU 157 Ca -0.01 -1.14 -0.21 0.00 0.02 0.00 0.00 54.97 53.63 1w3g s GLU 157 Cb -0.14 -2.72 -0.10 0.00 0.10 0.00 0.00 34.13 31.27 1w3g s GLU 157 CO -0.07 -0.52 0.87 0.71 0.02 0.00 0.00 175.26 176.27 1w3g s TYR 158 N 1.23 3.50 -1.15 1.61 1.51 -1.26 -1.50 117.35 121.29 1w3g s TYR 158 Ca -0.06 1.55 -0.05 0.00 -1.01 0.00 0.00 57.07 57.51 1w3g s TYR 158 Cb -0.18 -2.77 0.25 0.00 -0.11 0.00 0.00 41.96 39.15 1w3g s TYR 158 CO -0.07 0.10 1.80 -3.47 -1.11 0.00 0.00 175.55 172.81 1w3g n ASP 159 N 0.01 6.64 -0.38 2.29 2.03 -0.64 -4.86 116.55 121.64 1w3g n ASP 159 Ca 0.03 -3.38 0.30 0.00 0.52 0.00 0.00 54.79 52.27 1w3g n ASP 159 Cb 0.52 -1.30 0.57 0.00 -0.72 0.00 0.00 41.12 40.19 1w3g n ASP 159 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1w3g h LEU 160 N 5.66 0.37 -2.28 -2.67 3.38 -1.92 0.12 115.31 117.96 1w3g h LEU 160 Ca 0.41 0.15 0.04 0.00 0.09 0.00 0.00 57.88 58.57 1w3g h LEU 160 Cb 0.49 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1w3g h LEU 160 CO 1.38 -0.15 0.19 0.07 0.09 0.00 0.00 178.44 180.02 1w3g h LYS 161 N 0.20 0.00 -0.66 1.13 2.10 -1.91 -1.44 116.57 115.98 1w3g h LYS 161 Ca 0.76 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.41 1w3g h LYS 161 Cb 2.10 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.43 1w3g h LYS 161 CO -0.48 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 176.72 1w3g n ASP 162 N -3.68 4.44 -4.58 7.07 8.00 0.03 -4.99 116.55 122.83 1w3g n ASP 162 Ca 0.01 -2.30 -0.34 0.00 0.71 0.00 0.00 54.79 52.87 1w3g n ASP 162 Cb 0.30 -0.54 0.11 0.00 -0.02 0.00 0.00 41.12 40.97 1w3g n ASP 162 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1w3g n GLY 163 N 1.25 -0.76 3.24 0.44 0.00 -0.54 -4.71 105.19 104.10 1w3g n GLY 163 Ca 0.25 -0.50 -0.13 0.00 0.00 0.00 0.00 46.02 45.64 1w3g n GLY 163 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1w3g s ARG 164 N -3.66 0.40 -0.29 1.61 3.52 -0.60 -5.02 118.95 114.91 1w3g s ARG 164 Ca 0.68 0.52 -0.14 0.00 -0.13 0.00 0.00 55.73 56.67 1w3g s ARG 164 Cb -0.29 0.16 -0.03 0.00 -1.56 0.00 0.00 34.95 33.23 1w3g s ARG 164 CO 0.56 -0.06 0.31 0.42 -0.81 0.00 0.00 175.30 175.71 1w3g s ILE 165 N 0.35 5.22 -0.08 4.11 1.01 -1.26 -2.25 121.20 128.30 1w3g s ILE 165 Ca -0.01 0.30 0.14 0.00 0.00 0.00 0.00 60.65 61.07 1w3g s ILE 165 Cb -0.03 -3.68 -0.13 0.00 0.01 0.00 0.00 42.46 38.63 1w3g s ILE 165 CO -0.01 0.12 0.99 -0.07 0.00 0.00 0.00 174.94 175.97 1w3g h LEU 166 N 8.56 0.00 -7.83 2.97 3.38 -1.54 -3.48 115.31 117.37 1w3g h LEU 166 Ca -0.32 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 1w3g h LEU 166 Cb 1.17 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.82 1w3g h LEU 166 CO 0.63 0.71 -0.02 -0.94 0.09 0.00 0.00 178.44 178.91 1w3g s SER 167 N -6.13 -0.20 -0.30 -0.43 1.04 -1.13 -4.89 113.70 101.66 1w3g s SER 167 Ca -0.01 -0.60 -0.14 0.00 0.48 0.00 0.00 55.95 55.68 1w3g s SER 167 Cb 0.08 0.57 0.16 0.00 0.10 0.00 0.00 66.02 66.94 1w3g s SER 167 CO 0.80 -1.07 0.95 -0.55 0.98 0.00 0.00 173.24 174.35 1w3g s SER 168 N -2.91 -0.65 -0.01 7.02 0.15 -1.26 -3.68 113.70 112.36 1w3g s SER 168 Ca 0.12 0.88 0.01 0.00 0.70 0.00 0.00 55.95 57.66 1w3g s SER 168 Cb -0.01 1.74 0.01 0.00 -1.71 0.00 0.00 66.02 66.05 1w3g s SER 168 CO -0.00 -0.12 -0.01 -0.89 1.20 0.00 0.00 173.24 173.41 1w3g s THR 169 N 2.52 0.16 0.34 6.45 2.01 -0.07 -4.97 115.64 122.08 1w3g s THR 169 Ca -0.03 -0.02 -0.27 0.00 0.31 0.00 0.00 61.69 61.68 1w3g s THR 169 Cb -0.07 -0.18 -0.09 0.00 0.01 0.00 0.00 72.50 72.16 1w3g s THR 169 CO -0.18 0.08 1.17 -2.16 -0.69 0.00 0.00 174.62 172.85 1w3g s PRO 170 N 0.34 4.33 -0.12 4.92 0.04 -1.26 -1.57 135.00 141.68 1w3g s PRO 170 Ca -0.03 1.90 -0.00 0.00 0.04 0.00 0.00 61.00 62.91 1w3g s PRO 170 Cb -0.05 -2.94 0.02 0.00 0.04 0.00 0.00 34.50 31.57 1w3g s PRO 170 CO -0.01 -0.10 -0.09 -0.80 0.04 0.00 0.00 177.00 176.04 1w3g s ASN 171 N -0.91 2.24 -0.37 6.66 0.02 0.26 -4.88 114.94 117.96 1w3g s ASN 171 Ca 0.51 -0.33 -0.24 0.00 -1.02 0.00 0.00 52.86 51.78 1w3g s ASN 171 Cb -0.33 -0.90 0.01 0.00 0.02 0.00 0.00 41.25 40.06 1w3g s ASN 171 CO 0.42 -0.10 0.82 0.54 0.02 0.00 0.00 177.10 178.80 1w3g s VAL 172 N 1.60 4.69 -0.02 1.60 0.11 -1.26 -0.32 120.40 126.80 1w3g s VAL 172 Ca 0.04 0.96 -0.18 0.00 -2.93 0.00 0.00 61.98 59.86 1w3g s VAL 172 Cb -0.13 -4.24 -0.10 0.00 -1.53 0.00 0.00 36.38 30.38 1w3g s VAL 172 CO -0.08 -0.46 0.76 -0.07 -3.33 0.00 0.00 175.10 171.92 1w3g h LEU 173 N 9.82 -0.54 -7.58 2.54 3.38 -1.44 -3.42 115.31 118.08 1w3g h LEU 173 Ca -0.24 0.01 -0.65 0.00 0.09 0.00 0.00 57.88 57.09 1w3g h LEU 173 Cb 1.09 0.14 -0.40 0.00 0.09 0.00 0.00 40.66 41.58 1w3g h LEU 173 CO 0.93 -0.12 -0.72 0.00 0.09 0.00 0.00 178.44 178.62 1w3g s ALA 174 N -4.19 2.73 -0.03 1.53 0.00 -1.14 -4.98 121.76 115.67 1w3g s ALA 174 Ca -0.10 -2.48 -0.01 0.00 0.00 0.00 0.00 51.96 49.38 1w3g s ALA 174 Cb 0.01 -1.94 -0.00 0.00 0.00 0.00 0.00 23.12 21.19 1w3g s ALA 174 CO 0.29 -1.72 -0.01 1.15 0.00 0.00 0.00 175.76 175.47 1w3g h THR 175 N 6.48 0.00 -1.67 0.00 2.02 -1.82 -2.01 112.91 115.91 1w3g h THR 175 Ca -0.06 -0.30 -0.68 0.00 0.77 0.00 0.00 66.41 66.14 1w3g h THR 175 Cb 1.01 0.00 0.06 0.00 -1.74 0.00 0.00 68.15 67.48 1w3g h THR 175 CO 0.53 0.00 0.38 0.00 0.37 0.00 0.00 175.52 176.79 1w3g n GLN 176 N -2.87 1.04 -2.80 6.66 1.13 -1.26 -4.56 117.38 114.73 1w3g n GLN 176 Ca -0.00 0.38 0.00 0.00 -1.94 0.00 0.00 57.00 55.43 1w3g n GLN 176 Cb 0.02 -1.97 0.01 0.00 0.11 0.00 0.00 30.24 28.41 1w3g n GLN 176 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1w3g s THR 177 N 0.30 -0.34 -0.55 5.09 2.01 -1.26 -4.92 115.64 115.97 1w3g s THR 177 Ca 0.83 -0.10 0.05 0.00 0.31 0.00 0.00 61.69 62.78 1w3g s THR 177 Cb -0.96 0.00 0.37 0.00 0.01 0.00 0.00 72.50 71.92 1w3g s THR 177 CO 0.49 0.00 1.06 0.18 -0.69 0.00 0.00 174.62 175.66 1w3g n LEU 178 N 3.49 4.74 -4.55 4.42 4.77 -1.26 -3.92 117.00 124.68 1w3g n LEU 178 Ca 0.08 -5.49 -0.43 0.00 -0.03 0.00 0.00 56.01 50.15 1w3g n LEU 178 Cb 0.63 -0.55 -0.04 0.00 -2.33 0.00 0.00 43.42 41.12 1w3g n LEU 178 CO -0.09 2.29 0.73 -0.70 -1.33 0.00 0.00 177.39 178.28 1w3g s GLU 179 N -3.54 3.46 0.00 3.23 2.12 -1.21 -4.98 118.70 117.77 1w3g s GLU 179 Ca 0.48 0.02 0.00 0.00 0.36 0.00 0.00 54.97 55.83 1w3g s GLU 179 Cb 0.33 -3.96 0.00 0.00 0.26 0.00 0.00 34.13 30.75 1w3g s GLU 179 CO -0.16 -1.28 0.00 0.27 -0.54 0.00 0.00 175.26 173.54 1w3g n ASN 180 N 7.19 0.65 0.00 -1.70 2.04 -1.26 -3.20 115.26 118.98 1w3g n ASN 180 Ca 0.05 -0.29 0.00 0.00 -0.44 0.00 0.00 54.58 53.89 1w3g n ASN 180 Cb 0.48 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.73 1w3g n ASN 180 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 1w3g n THR 181 N 0.00 0.00 -0.05 5.53 -2.24 -1.26 -5.02 114.28 111.24 1w3g n THR 181 Ca 0.00 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.75 1w3g n THR 181 Cb 0.00 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.22 1w3g n THR 181 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1w3g h SER 182 N 0.00 0.00 -5.34 3.42 0.02 -1.99 -3.42 113.55 106.25 1w3g h SER 182 Ca 0.00 0.00 0.18 0.00 -0.84 0.00 0.00 61.79 61.13 1w3g h SER 182 Cb 0.00 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.46 1w3g h SER 182 CO 0.00 0.56 0.49 -0.55 -1.14 0.00 0.00 176.83 176.19 1w3g s SER 183 N -5.24 -0.17 -0.71 3.07 0.15 -1.26 -3.01 113.70 106.53 1w3g s SER 183 Ca -0.09 -0.42 -0.07 0.00 0.70 0.00 0.00 55.95 56.07 1w3g s SER 183 Cb 0.01 0.49 0.07 0.00 -1.71 0.00 0.00 66.02 64.88 1w3g s SER 183 CO 0.13 -0.90 0.21 0.00 1.20 0.00 0.00 173.24 173.88 1w3g n GLN 184 N -0.48 -2.40 0.00 5.44 1.13 -1.26 -4.91 117.38 114.90 1w3g n GLN 184 Ca -0.06 0.13 0.00 0.00 -1.94 0.00 0.00 57.00 55.13 1w3g n GLN 184 Cb 0.61 -4.68 0.00 0.00 0.11 0.00 0.00 30.24 26.27 1w3g n GLN 184 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1w3g n THR 185 N -3.13 0.00 0.00 5.09 -1.04 -1.26 -5.03 114.28 108.91 1w3g n THR 185 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1w3g n THR 185 Cb 0.50 -0.17 0.00 0.00 -1.82 0.00 0.00 70.33 68.83 1w3g n THR 185 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 1w3g n GLN 186 N 0.00 0.00 -3.70 -2.82 -0.06 -1.26 -5.08 117.38 104.46 1w3g n GLN 186 Ca 0.00 0.00 -0.11 0.00 -2.00 0.00 0.00 57.00 54.89 1w3g n GLN 186 Cb 0.00 0.00 -0.10 0.00 -4.06 0.00 0.00 30.24 26.08 1w3g n GLN 186 CO 0.00 0.00 0.00 -1.21 -0.20 0.00 0.00 177.06 175.65 1w3g s GLU 187 N 0.00 0.46 -0.30 3.69 0.41 -1.26 -4.83 118.70 116.88 1w3g s GLU 187 Ca 0.00 0.75 0.03 0.00 -0.41 0.00 0.00 54.97 55.34 1w3g s GLU 187 Cb 0.00 0.10 0.17 0.00 -1.78 0.00 0.00 34.13 32.61 1w3g s GLU 187 CO 0.00 -0.12 0.45 -1.64 -0.49 0.00 0.00 175.26 173.46 1w3g s MET 188 N 0.95 0.46 0.00 1.61 -1.94 -1.26 -5.03 119.30 114.09 1w3g s MET 188 Ca -0.06 0.16 -0.02 0.00 -1.71 0.00 0.00 55.69 54.06 1w3g s MET 188 Cb -0.06 -0.21 -0.04 0.00 2.01 0.00 0.00 34.83 36.53 1w3g s MET 188 CO -0.08 -1.05 0.18 0.45 -0.01 0.00 0.00 175.02 174.51 1w3g s SER 189 N 2.54 6.29 0.06 3.03 0.15 -1.26 -0.91 113.70 123.59 1w3g s SER 189 Ca 0.10 0.31 0.09 0.00 0.70 0.00 0.00 55.95 57.15 1w3g s SER 189 Cb -0.12 -1.95 -0.03 0.00 -1.71 0.00 0.00 66.02 62.21 1w3g s SER 189 CO -0.28 0.25 -0.23 -0.36 1.20 0.00 0.00 173.24 173.82 1w3g s PHE 190 N -1.34 2.42 -0.12 3.44 0.40 0.43 -4.94 117.98 118.27 1w3g s PHE 190 Ca 0.28 -0.34 0.00 0.00 -0.60 0.00 0.00 56.93 56.27 1w3g s PHE 190 Cb -0.13 -1.40 0.02 0.00 0.51 0.00 0.00 43.02 42.03 1w3g s PHE 190 CO 0.20 0.21 -0.10 -0.80 0.70 0.00 0.00 175.22 175.43 1w3g s ASN 191 N -1.45 2.29 -0.16 1.36 0.01 -1.26 -1.56 114.94 114.17 1w3g s ASN 191 Ca 0.13 -0.36 -0.03 0.00 -0.71 0.00 0.00 52.86 51.89 1w3g s ASN 191 Cb -0.10 -0.94 -0.02 0.00 0.41 0.00 0.00 41.25 40.59 1w3g s ASN 191 CO 0.04 -0.08 -0.04 -0.22 -1.51 0.00 0.00 177.10 175.28 1w3g s LEU 192 N 1.54 3.16 -0.33 0.60 1.98 0.27 -4.94 118.68 120.95 1w3g s LEU 192 Ca 0.03 -0.18 0.03 0.00 -2.89 0.00 0.00 54.13 51.11 1w3g s LEU 192 Cb -0.13 -1.76 0.16 0.00 0.66 0.00 0.00 46.19 45.11 1w3g s LEU 192 CO -0.08 0.14 0.40 -0.55 -1.89 0.00 0.00 176.35 174.37 1w3g s SER 193 N 0.54 0.67 -0.01 3.68 0.15 -1.21 -0.78 113.70 116.75 1w3g s SER 193 Ca -0.03 -0.89 0.04 0.00 0.70 0.00 0.00 55.95 55.77 1w3g s SER 193 Cb -0.14 0.91 -0.01 0.00 -1.71 0.00 0.00 66.02 65.06 1w3g s SER 193 CO 0.03 -0.31 -0.14 -1.10 1.20 0.00 0.00 173.24 172.91 1w3g s GLN 194 N 2.07 1.15 -0.07 5.44 -1.52 -0.56 -4.96 119.66 121.21 1w3g s GLN 194 Ca 0.13 -0.53 0.04 0.00 -1.95 0.00 0.00 55.36 53.05 1w3g s GLN 194 Cb -0.13 -1.12 -0.01 0.00 -0.22 0.00 0.00 33.01 31.53 1w3g s GLN 194 CO -0.19 0.31 -0.21 0.99 -0.25 0.00 0.00 175.29 175.93 1w3g s THR 195 N -0.37 2.40 -0.07 -0.19 2.01 -1.26 -0.04 115.64 118.11 1w3g s THR 195 Ca 0.05 -0.93 0.05 0.00 0.31 0.00 0.00 61.69 61.17 1w3g s THR 195 Cb -0.06 -1.91 -0.01 0.00 0.01 0.00 0.00 72.50 70.53 1w3g s THR 195 CO -0.00 0.56 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.49 1w3g s LEU 196 N -0.10 2.05 -0.28 4.42 1.43 0.19 -4.95 118.68 121.44 1w3g s LEU 196 Ca -0.04 -0.50 -0.29 0.00 -1.03 0.00 0.00 54.13 52.26 1w3g s LEU 196 Cb -0.14 -1.33 0.01 0.00 0.03 0.00 0.00 46.19 44.76 1w3g s LEU 196 CO 0.04 0.21 1.09 -0.89 0.23 0.00 0.00 176.35 177.03 1w3g s THR 197 N 0.00 4.53 0.57 5.49 2.01 -1.26 -1.64 115.64 125.34 1w3g s THR 197 Ca -0.08 1.80 0.06 0.00 0.31 0.00 0.00 61.69 63.78 1w3g s THR 197 Cb -0.15 -4.34 0.07 0.00 0.01 0.00 0.00 72.50 68.10 1w3g s THR 197 CO 0.05 -0.35 0.79 -1.10 -0.69 0.00 0.00 174.62 173.31 1w3g s GLN 198 N 3.52 2.31 0.12 4.92 -1.52 0.22 -4.92 119.66 124.30 1w3g s GLN 198 Ca 0.46 -1.35 0.07 0.00 -1.95 0.00 0.00 55.36 52.58 1w3g s GLN 198 Cb -0.14 -2.59 -0.04 0.00 -0.22 0.00 0.00 33.01 30.02 1w3g s GLN 198 CO 0.12 -0.84 -0.16 0.99 -0.25 0.00 0.00 175.29 175.15 1w3g s THR 199 N -2.71 1.43 -0.17 -0.19 2.01 -0.76 -2.24 115.64 113.02 1w3g s THR 199 Ca 0.61 -1.65 -0.09 0.00 0.31 0.00 0.00 61.69 60.86 1w3g s THR 199 Cb -0.07 -1.51 0.06 0.00 0.01 0.00 0.00 72.50 70.99 1w3g s THR 199 CO 0.39 -0.31 0.40 -0.55 -0.69 0.00 0.00 174.62 173.86 1w3g s SER 200 N -2.28 -0.50 -0.14 3.53 0.15 0.27 -3.76 113.70 110.96 1w3g s SER 200 Ca 0.08 0.88 -0.07 0.00 0.70 0.00 0.00 55.95 57.54 1w3g s SER 200 Cb -0.07 0.76 0.06 0.00 -1.71 0.00 0.00 66.02 65.06 1w3g s SER 200 CO 0.04 -0.19 0.32 -0.89 1.20 0.00 0.00 173.24 173.72 1w3g s THR 201 N 1.32 -0.14 -0.45 6.45 2.01 -0.58 -0.04 115.64 124.21 1w3g s THR 201 Ca -0.09 0.15 -0.10 0.00 0.31 0.00 0.00 61.69 61.96 1w3g s THR 201 Cb -0.08 -0.50 0.10 0.00 0.01 0.00 0.00 72.50 72.03 1w3g s THR 201 CO -0.12 0.06 0.31 -0.36 -0.69 0.00 0.00 174.62 173.83 1w3g s PHE 202 N 1.59 3.38 -0.10 4.92 0.40 -1.26 -1.14 117.98 125.76 1w3g s PHE 202 Ca -0.07 -1.67 -0.13 0.00 -0.60 0.00 0.00 56.93 54.46 1w3g s PHE 202 Cb -0.10 -3.25 -0.05 0.00 0.51 0.00 0.00 43.02 40.13 1w3g s PHE 202 CO -0.10 -0.92 0.30 0.00 0.70 0.00 0.00 175.22 175.19 1w3g s ALA 203 N 1.41 3.69 0.34 5.36 0.00 -0.46 -1.69 121.76 130.40 1w3g s ALA 203 Ca 0.04 -0.42 -0.29 0.00 0.00 0.00 0.00 51.96 51.30 1w3g s ALA 203 Cb -0.25 -2.30 -0.11 0.00 0.00 0.00 0.00 23.12 20.46 1w3g s ALA 203 CO 0.01 0.33 1.43 -0.47 0.00 0.00 0.00 175.76 177.06 1w3g s TYR 204 N -0.34 2.79 0.00 0.00 5.04 -1.26 -1.05 117.35 122.53 1w3g s TYR 204 Ca 0.19 1.21 0.00 0.00 -2.44 0.00 0.00 57.07 56.02 1w3g s TYR 204 Cb -0.14 -3.90 0.00 0.00 0.35 0.00 0.00 41.96 38.28 1w3g s TYR 204 CO 0.07 -2.63 0.00 2.41 -1.34 0.00 0.00 175.55 174.06 1w3g n THR 205 N 0.87 0.00 -3.81 4.34 -1.04 0.04 -4.78 114.28 109.89 1w3g n THR 205 Ca 0.02 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 62.00 1w3g n THR 205 Cb 0.40 -0.84 0.00 0.00 -1.82 0.00 0.00 70.33 68.08 1w3g n THR 205 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1w3g s ALA 206 N -1.88 -1.63 0.00 2.41 0.00 -0.90 -4.98 121.76 114.78 1w3g s ALA 206 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 51.86 1w3g s ALA 206 Cb 0.00 0.69 0.00 0.00 0.00 0.00 0.00 23.12 23.81 1w3g s ALA 206 CO 0.00 -1.05 0.00 0.41 0.00 0.00 0.00 175.76 175.12 1w3g n GLY 207 N -0.59 -1.48 3.66 0.00 0.00 -1.26 -0.04 105.19 105.47 1w3g n GLY 207 Ca -0.05 -1.44 -0.45 0.00 0.00 0.00 0.00 46.02 44.08 1w3g n GLY 207 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1w3g n PHE 208 N 0.00 2.01 -2.82 1.61 7.35 -0.04 -4.88 117.46 120.69 1w3g n PHE 208 Ca 0.00 0.50 -0.43 0.00 -0.76 0.00 0.00 57.45 56.76 1w3g n PHE 208 Cb 0.00 -2.42 -0.02 0.00 0.35 0.00 0.00 39.48 37.39 1w3g n PHE 208 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1w3g s THR 209 N -0.28 4.53 0.29 -2.13 -4.23 -1.26 -4.68 115.64 107.88 1w3g s THR 209 Ca 0.66 -1.47 -0.30 0.00 -1.18 0.00 0.00 61.69 59.41 1w3g s THR 209 Cb -0.67 -4.88 -0.11 0.00 1.34 0.00 0.00 72.50 68.19 1w3g s THR 209 CO 0.52 -1.65 1.49 -0.63 -0.54 0.00 0.00 174.62 173.82 1w3g s ILE 210 N 3.23 2.35 0.23 2.99 1.01 -1.26 -4.91 121.20 124.85 1w3g s ILE 210 Ca 0.38 0.31 -0.31 0.00 0.00 0.00 0.00 60.65 61.03 1w3g s ILE 210 Cb -0.03 -3.20 -0.11 0.00 0.01 0.00 0.00 42.46 39.13 1w3g s ILE 210 CO -0.08 0.06 1.60 0.00 0.00 0.00 0.00 174.94 176.51 1w3g s ALA 211 N -0.29 3.79 0.23 9.38 0.00 -1.26 -4.91 121.76 128.69 1w3g s ALA 211 Ca 0.59 1.49 -0.31 0.00 0.00 0.00 0.00 51.96 53.73 1w3g s ALA 211 Cb -0.45 -3.64 -0.11 0.00 0.00 0.00 0.00 23.12 18.92 1w3g s ALA 211 CO 0.49 -0.88 1.63 0.08 0.00 0.00 0.00 175.76 177.08 1w3g s VAL 212 N 0.59 2.20 0.00 0.00 1.01 -1.26 -2.18 120.40 120.76 1w3g s VAL 212 Ca 0.67 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.81 1w3g s VAL 212 Cb -0.46 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 32.82 1w3g s VAL 212 CO 0.39 0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.11 1w3g n GLY 213 N 3.27 3.23 3.64 4.51 0.00 -0.23 -4.94 105.19 114.66 1w3g n GLY 213 Ca 0.13 0.00 -0.59 0.00 0.00 0.00 0.00 46.02 45.56 1w3g n GLY 213 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1w3g n THR 214 N -1.46 0.09 -3.04 2.61 -1.04 -0.93 -4.11 114.28 106.40 1w3g n THR 214 Ca 0.00 -0.02 -0.39 0.00 -2.04 0.00 0.00 64.05 61.60 1w3g n THR 214 Cb 0.00 -0.70 -0.05 0.00 -1.82 0.00 0.00 70.33 67.76 1w3g n THR 214 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1w3g s ALA 215 N 1.83 3.43 0.24 2.41 0.00 -1.26 -0.86 121.76 127.55 1w3g s ALA 215 Ca 0.94 0.25 -0.22 0.00 0.00 0.00 0.00 51.96 52.93 1w3g s ALA 215 Cb -1.17 -2.91 0.05 0.00 0.00 0.00 0.00 23.12 19.08 1w3g s ALA 215 CO 0.62 0.18 0.85 -0.59 0.00 0.00 0.00 175.76 176.83 1w3g s PHE 216 N -0.52 -0.10 0.03 0.00 -0.12 -0.82 -4.97 117.98 111.48 1w3g s PHE 216 Ca 0.36 -0.32 0.06 0.00 -0.05 0.00 0.00 56.93 56.97 1w3g s PHE 216 Cb -0.21 0.70 -0.02 0.00 -0.63 0.00 0.00 43.02 42.86 1w3g s PHE 216 CO 0.23 -1.09 -0.16 0.15 -0.05 0.00 0.00 175.22 174.29 1w3g s LYS 217 N -3.31 1.15 -0.07 1.99 1.02 -1.26 -1.02 119.74 118.24 1w3g s LYS 217 Ca 0.13 -0.77 -0.30 0.00 0.02 0.00 0.00 55.97 55.05 1w3g s LYS 217 Cb -0.04 -1.18 0.11 0.00 -0.52 0.00 0.00 37.83 36.21 1w3g s LYS 217 CO 0.06 0.30 0.96 0.00 -0.92 0.00 0.00 175.35 175.75 1w3g s ALA 218 N -0.73 -1.89 0.77 5.17 0.00 -1.26 -4.97 121.76 118.85 1w3g s ALA 218 Ca 0.04 1.22 -0.11 0.00 0.00 0.00 0.00 51.96 53.12 1w3g s ALA 218 Cb -0.08 0.12 0.05 0.00 0.00 0.00 0.00 23.12 23.21 1w3g s ALA 218 CO 0.01 -0.60 1.09 0.20 0.00 0.00 0.00 175.76 176.46 1w3g s GLY 219 N -2.17 1.69 0.14 0.00 0.00 -1.26 -4.86 107.32 100.85 1w3g s GLY 219 Ca 0.04 0.26 0.10 0.00 0.00 0.00 0.00 44.72 45.13 1w3g s GLY 219 CO -0.06 0.61 -0.25 0.54 0.00 0.00 0.00 173.10 173.94 1w3g s VAL 220 N -2.90 2.13 0.73 1.40 0.11 -1.07 -4.88 120.40 115.92 1w3g s VAL 220 Ca 0.61 -1.76 -0.15 0.00 -2.93 0.00 0.00 61.98 57.74 1w3g s VAL 220 Cb -0.17 -1.92 0.04 0.00 -1.53 0.00 0.00 36.38 32.80 1w3g s VAL 220 CO 0.56 0.00 1.22 -2.84 -3.33 0.00 0.00 175.10 170.71 1w3g s PRO 221 N -2.16 2.13 -0.07 1.54 0.02 -1.26 -0.25 135.00 134.95 1w3g s PRO 221 Ca 0.14 1.81 -0.11 0.00 0.02 0.00 0.00 61.00 62.86 1w3g s PRO 221 Cb -0.09 -1.83 0.02 0.00 0.02 0.00 0.00 34.50 32.62 1w3g s PRO 221 CO 0.06 -1.86 0.28 0.42 -0.33 0.00 0.00 177.00 175.57 1w3g s ILE 222 N -1.91 0.03 -0.25 2.83 -1.09 0.29 -4.70 121.20 116.40 1w3g s ILE 222 Ca 0.76 -0.24 -0.12 0.00 -2.23 0.00 0.00 60.65 58.82 1w3g s ILE 222 Cb -0.30 -0.48 -0.05 0.00 -1.58 0.00 0.00 42.46 40.05 1w3g s ILE 222 CO 0.45 -0.13 0.24 0.12 -1.23 0.00 0.00 174.94 174.39 1w3g s PHE 223 N -0.50 3.29 0.00 3.97 5.36 -1.26 0.10 117.98 128.93 1w3g s PHE 223 Ca -0.06 0.28 0.00 0.00 -0.96 0.00 0.00 56.93 56.19 1w3g s PHE 223 Cb -0.04 -2.39 0.00 0.00 -0.34 0.00 0.00 43.02 40.26 1w3g s PHE 223 CO 0.02 -0.06 0.02 0.00 -1.46 0.00 0.00 175.22 173.74 1w3g n ALA 224 N 4.70 0.00 0.00 11.12 0.00 0.44 -4.55 120.51 132.22 1w3g n ALA 224 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1w3g n ALA 224 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1w3g n ALA 224 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1w3g n GLU 225 N -0.19 0.42 0.00 0.00 1.02 -1.26 -4.33 120.64 116.30 1w3g n GLU 225 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1w3g n GLU 225 Cb 0.00 -0.25 0.00 0.00 -0.02 0.00 0.00 31.44 31.17 1w3g n GLU 225 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1w3g n THR 226 N -0.43 0.00 -4.00 2.62 -2.24 -1.26 -5.12 114.28 103.86 1w3g n THR 226 Ca 0.00 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.67 1w3g n THR 226 Cb 0.00 1.23 -0.04 0.00 -2.10 0.00 0.00 70.33 69.42 1w3g n THR 226 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1w3g s GLU 227 N 0.00 1.75 0.07 -0.78 2.02 -1.26 -5.16 118.70 115.34 1w3g s GLU 227 Ca 0.00 -1.42 0.03 0.00 0.02 0.00 0.00 54.97 53.60 1w3g s GLU 227 Cb 0.00 0.49 -0.04 0.00 0.10 0.00 0.00 34.13 34.68 1w3g s GLU 227 CO 0.00 -0.74 0.06 -0.06 0.02 0.00 0.00 175.26 174.53 1w3g s PHE 228 N -3.51 3.15 0.07 1.61 0.40 -1.26 -0.42 117.98 118.02 1w3g s PHE 228 Ca 0.24 0.07 -0.03 0.00 -0.60 0.00 0.00 56.93 56.60 1w3g s PHE 228 Cb -0.01 -1.62 -0.03 0.00 0.51 0.00 0.00 43.02 41.87 1w3g s PHE 228 CO 0.13 0.51 0.04 0.15 0.70 0.00 0.00 175.22 176.75 1w3g s LYS 229 N -2.23 0.71 -0.20 0.44 1.02 0.28 -4.88 119.74 114.88 1w3g s LYS 229 Ca 0.27 -1.16 -0.17 0.00 0.02 0.00 0.00 55.97 54.93 1w3g s LYS 229 Cb -0.12 0.25 -0.04 0.00 -0.52 0.00 0.00 37.83 37.41 1w3g s LYS 229 CO 0.19 -0.17 0.46 0.08 -0.92 0.00 0.00 175.35 174.99 1w3g s VAL 230 N -3.91 5.15 -0.60 3.17 1.01 -1.26 0.11 120.40 124.07 1w3g s VAL 230 Ca 0.08 0.83 -0.23 0.00 0.00 0.00 0.00 61.98 62.66 1w3g s VAL 230 Cb 0.07 -3.78 0.06 0.00 0.00 0.00 0.00 36.38 32.72 1w3g s VAL 230 CO -0.09 0.22 0.91 -0.62 0.00 0.00 0.00 175.10 175.52 1w3g s ASP 231 N 1.09 6.24 0.00 3.32 -1.08 0.66 -4.88 116.67 122.02 1w3g s ASP 231 Ca 0.22 -0.74 0.29 0.00 -0.52 0.00 0.00 52.55 51.80 1w3g s ASP 231 Cb -0.15 -2.41 1.32 0.00 -1.46 0.00 0.00 42.92 40.22 1w3g s ASP 231 CO 0.09 -1.29 1.96 -0.38 0.52 0.00 0.00 175.17 176.07 1w3g n ILE 232 N 5.99 0.02 -0.10 4.11 5.41 -1.26 -2.61 119.36 130.91 1w3g n ILE 232 Ca -0.02 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.61 1w3g n ILE 232 Cb 0.46 -0.51 -0.04 0.00 -0.71 0.00 0.00 39.64 38.84 1w3g n ILE 232 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1w3g h SER 233 N 0.00 0.62 -1.56 4.38 4.64 -1.96 -3.42 113.55 116.24 1w3g h SER 233 Ca 0.00 -0.41 -0.60 0.00 -0.47 0.00 0.00 61.79 60.31 1w3g h SER 233 Cb 0.43 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 1w3g h SER 233 CO 0.00 0.89 1.49 0.52 -0.87 0.00 0.00 176.83 178.87 1w3g n VAL 234 N -4.42 0.23 -1.46 0.95 0.31 -1.25 -4.83 118.33 107.86 1w3g n VAL 234 Ca -0.03 -0.42 -0.05 0.00 -0.01 0.00 0.00 64.34 63.83 1w3g n VAL 234 Cb 0.37 -2.21 0.20 0.00 -0.91 0.00 0.00 33.84 31.29 1w3g n VAL 234 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1w3g n ASP 235 N 11.53 2.44 -4.78 4.52 5.75 -1.26 -4.60 116.55 130.15 1w3g n ASP 235 Ca 0.36 -3.80 -0.31 0.00 -0.01 0.00 0.00 54.79 51.03 1w3g n ASP 235 Cb 0.37 -0.64 0.09 0.00 -1.03 0.00 0.00 41.12 39.91 1w3g n ASP 235 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 1w3g s ASN 236 N -2.55 4.60 -0.28 -1.12 -0.87 -1.26 -5.00 114.94 108.47 1w3g s ASN 236 Ca 0.45 1.64 -0.15 0.00 -1.57 0.00 0.00 52.86 53.23 1w3g s ASN 236 Cb 0.41 -2.40 -0.03 0.00 -0.02 0.00 0.00 41.25 39.21 1w3g s ASN 236 CO -0.01 -1.95 0.39 -1.58 -2.57 0.00 0.00 177.10 171.39 1w3g s GLN 237 N -4.98 3.98 0.41 -0.60 0.74 -1.26 -4.56 119.66 113.38 1w3g s GLN 237 Ca 0.60 0.03 0.01 0.00 0.05 0.00 0.00 55.36 56.05 1w3g s GLN 237 Cb -0.16 -3.67 -0.01 0.00 1.10 0.00 0.00 33.01 30.27 1w3g s GLN 237 CO 0.56 -0.31 0.61 -1.58 -0.55 0.00 0.00 175.29 174.02 1w3g s TRP 238 N 2.09 3.32 -0.17 1.67 0.23 -0.19 -4.91 118.94 120.99 1w3g s TRP 238 Ca 0.15 0.25 0.00 0.00 -2.03 0.00 0.00 56.10 54.47 1w3g s TRP 238 Cb -0.16 -2.14 0.03 0.00 0.03 0.00 0.00 33.47 31.23 1w3g s TRP 238 CO 0.10 -0.16 -0.11 -0.80 0.96 0.00 0.00 176.95 176.94 1w3g s ASN 239 N -4.15 2.95 0.13 2.95 0.01 -1.26 -1.95 114.94 113.62 1w3g s ASN 239 Ca 0.45 -0.66 -0.35 0.00 -0.71 0.00 0.00 52.86 51.59 1w3g s ASN 239 Cb -0.10 -1.13 -0.16 0.00 0.41 0.00 0.00 41.25 40.27 1w3g s ASN 239 CO 0.37 -0.12 1.37 1.87 -1.51 0.00 0.00 177.10 179.08 1w3g n TRP 240 N 4.77 1.71 -1.24 2.20 -0.00 -0.04 -1.91 117.44 122.93 1w3g n TRP 240 Ca -0.15 0.54 -0.08 0.00 -0.00 0.00 0.00 57.50 57.81 1w3g n TRP 240 Cb 0.48 -2.38 -0.04 0.00 -0.00 0.00 0.00 31.31 29.37 1w3g n TRP 240 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1w3g n GLY 241 N 2.62 0.95 3.21 5.87 0.00 -0.68 -1.07 105.19 116.08 1w3g n GLY 241 Ca 0.17 -0.26 -0.18 0.00 0.00 0.00 0.00 46.02 45.75 1w3g n GLY 241 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1w3g s GLU 242 N -2.42 0.94 0.00 1.61 2.02 -0.80 -4.93 118.70 115.12 1w3g s GLU 242 Ca 0.00 -1.12 -0.30 0.00 0.02 0.00 0.00 54.97 53.57 1w3g s GLU 242 Cb 0.00 -0.87 -0.03 0.00 0.10 0.00 0.00 34.13 33.32 1w3g s GLU 242 CO 0.00 0.18 1.04 -2.00 0.02 0.00 0.00 175.26 174.50 1w3g s GLU 243 N -2.28 4.51 0.23 1.61 2.12 -1.26 -4.43 118.70 119.20 1w3g s GLU 243 Ca 0.04 1.51 0.11 0.00 0.36 0.00 0.00 54.97 56.99 1w3g s GLU 243 Cb -0.07 -3.44 -0.05 0.00 0.26 0.00 0.00 34.13 30.83 1w3g s GLU 243 CO 0.03 -0.13 -0.20 -0.80 -0.54 0.00 0.00 175.26 173.61 1w3g s ASN 244 N 1.05 3.32 0.17 -1.70 0.01 0.94 -4.97 114.94 113.76 1w3g s ASN 244 Ca 0.53 -0.96 0.10 0.00 -0.71 0.00 0.00 52.86 51.82 1w3g s ASN 244 Cb -0.23 -0.25 -0.04 0.00 0.41 0.00 0.00 41.25 41.14 1w3g s ASN 244 CO 0.27 0.03 -0.21 0.42 -1.51 0.00 0.00 177.10 176.10 1w3g s THR 245 N -2.27 2.04 0.08 1.60 -4.23 -1.26 -0.57 115.64 111.04 1w3g s THR 245 Ca 0.25 -1.94 -0.21 0.00 -1.18 0.00 0.00 61.69 58.61 1w3g s THR 245 Cb -0.05 -1.94 0.05 0.00 1.34 0.00 0.00 72.50 71.89 1w3g s THR 245 CO 0.12 -0.21 0.50 0.72 -0.54 0.00 0.00 174.62 175.21 1w3g s PHE 246 N -1.82 -0.38 0.17 3.99 -0.12 -0.95 -4.97 117.98 113.90 1w3g s PHE 246 Ca 0.17 0.30 -0.11 0.00 -0.05 0.00 0.00 56.93 57.25 1w3g s PHE 246 Cb -0.07 0.35 -0.07 0.00 -0.63 0.00 0.00 43.02 42.60 1w3g s PHE 246 CO 0.08 -0.69 0.51 -1.12 -0.05 0.00 0.00 175.22 173.95 1w3g s SER 247 N -2.29 6.69 -0.10 1.98 0.01 -1.26 0.70 113.70 119.43 1w3g s SER 247 Ca -0.02 0.93 -0.01 0.00 1.31 0.00 0.00 55.95 58.15 1w3g s SER 247 Cb -0.00 -2.23 0.03 0.00 0.21 0.00 0.00 66.02 64.03 1w3g s SER 247 CO -0.06 0.04 -0.01 -0.75 0.41 0.00 0.00 173.24 172.87 1w3g s LYS 248 N -2.34 0.84 -0.13 12.44 2.47 -0.65 -4.89 119.74 127.47 1w3g s LYS 248 Ca 0.41 -0.08 -0.01 0.00 -1.56 0.00 0.00 55.97 54.72 1w3g s LYS 248 Cb -0.13 -1.33 -0.02 0.00 -1.46 0.00 0.00 37.83 34.88 1w3g s LYS 248 CO 0.20 -0.36 -0.08 0.99 0.16 0.00 0.00 175.35 176.26 1w3g s THR 249 N 1.89 3.55 -0.23 3.43 2.01 -1.26 -0.64 115.64 124.39 1w3g s THR 249 Ca 0.04 -0.50 -0.08 0.00 0.31 0.00 0.00 61.69 61.46 1w3g s THR 249 Cb -0.13 -2.51 -0.04 0.00 0.01 0.00 0.00 72.50 69.83 1w3g s THR 249 CO -0.06 0.53 0.08 -0.31 -0.69 0.00 0.00 174.62 174.16 1w3g s TYR 250 N 0.10 3.16 -0.02 4.92 1.51 0.94 -4.95 117.35 123.02 1w3g s TYR 250 Ca -0.03 -0.15 0.05 0.00 -1.01 0.00 0.00 57.07 55.94 1w3g s TYR 250 Cb -0.14 -2.19 -0.01 0.00 -0.11 0.00 0.00 41.96 39.51 1w3g s TYR 250 CO 0.04 -0.12 -0.17 0.99 -1.11 0.00 0.00 175.55 175.17 1w3g s THR 251 N 1.12 1.39 -0.21 -0.71 2.01 -1.24 -1.49 115.64 116.51 1w3g s THR 251 Ca 0.05 -0.74 -0.27 0.00 0.31 0.00 0.00 61.69 61.04 1w3g s THR 251 Cb -0.14 -1.17 0.08 0.00 0.01 0.00 0.00 72.50 71.28 1w3g s THR 251 CO 0.04 0.40 0.76 0.00 -0.69 0.00 0.00 174.62 175.12 1w3g s ALA 252 N -0.29 -1.81 -0.11 7.40 0.00 0.04 -4.93 121.76 122.07 1w3g s ALA 252 Ca 0.04 1.82 -0.00 0.00 0.00 0.00 0.00 51.96 53.82 1w3g s ALA 252 Cb -0.08 -0.90 0.02 0.00 0.00 0.00 0.00 23.12 22.16 1w3g s ALA 252 CO 0.00 -0.33 -0.07 0.99 0.00 0.00 0.00 175.76 176.34 1w3g s THR 253 N -0.09 0.97 -0.01 0.00 2.01 -1.26 0.94 115.64 118.21 1w3g s THR 253 Ca -0.02 -0.26 -0.08 0.00 0.31 0.00 0.00 61.69 61.63 1w3g s THR 253 Cb -0.04 -1.00 0.01 0.00 0.01 0.00 0.00 72.50 71.49 1w3g s THR 253 CO 0.02 0.36 0.17 0.72 -0.69 0.00 0.00 174.62 175.20 1w3g s PHE 254 N 1.65 -0.03 0.06 4.92 -0.12 -0.60 -4.96 117.98 118.91 1w3g s PHE 254 Ca 0.03 0.01 0.07 0.00 -0.05 0.00 0.00 56.93 57.00 1w3g s PHE 254 Cb -0.13 -0.01 -0.03 0.00 -0.63 0.00 0.00 43.02 42.22 1w3g s PHE 254 CO -0.07 -0.27 -0.18 -1.54 -0.05 0.00 0.00 175.22 173.10 1w3g s SER 255 N -1.16 2.18 -0.05 1.98 1.04 -1.26 0.16 113.70 116.60 1w3g s SER 255 Ca -0.12 -0.56 -0.02 0.00 0.48 0.00 0.00 55.95 55.73 1w3g s SER 255 Cb -0.06 -0.14 0.03 0.00 0.10 0.00 0.00 66.02 65.94 1w3g s SER 255 CO 0.02 0.07 0.10 -0.69 0.98 0.00 0.00 173.24 173.72 1w3g s VAL 256 N -0.96 -0.04 0.00 5.02 1.01 -0.08 -4.96 120.40 120.38 1w3g s VAL 256 Ca 0.04 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.17 1w3g s VAL 256 Cb -0.09 -0.17 0.00 0.00 0.00 0.00 0.00 36.38 36.12 1w3g s VAL 256 CO 0.02 0.06 0.00 -1.14 0.00 0.00 0.00 175.10 174.04 1w3g n ARG 257 N 3.92 0.00 0.00 2.72 3.00 -1.26 -4.07 116.66 120.97 1w3g n ARG 257 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.62 1w3g n ARG 257 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.99 1w3g n ARG 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1w3g n ALA 258 N 0.00 0.00 -2.55 5.13 0.00 -1.26 -4.81 120.51 117.01 1w3g n ALA 258 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1w3g n ALA 258 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1w3g n ALA 258 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1w3g s GLY 259 N 0.00 2.64 0.24 0.00 0.00 -1.26 -5.02 107.32 103.92 1w3g s GLY 259 Ca 0.00 -1.05 0.22 0.00 0.00 0.00 0.00 44.72 43.89 1w3g s GLY 259 CO 0.00 -2.04 1.66 -1.05 0.00 0.00 0.00 173.10 171.66 1w3g n PRO 260 N -1.47 0.16 0.00 2.90 -0.02 -1.26 -4.34 135.00 130.98 1w3g n PRO 260 Ca -0.09 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 1w3g n PRO 260 Cb 0.65 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.29 1w3g n PRO 260 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1w3g n GLY 261 N -0.31 0.81 3.26 -1.23 0.00 -1.26 -4.59 105.19 101.87 1w3g n GLY 261 Ca 0.01 0.37 -0.15 0.00 0.00 0.00 0.00 46.02 46.26 1w3g n GLY 261 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1w3g s GLU 262 N 0.00 1.39 -0.56 1.61 0.41 -1.16 -4.75 118.70 115.63 1w3g s GLU 262 Ca 0.00 -1.76 0.04 0.00 -0.41 0.00 0.00 54.97 52.84 1w3g s GLU 262 Cb 0.00 0.13 0.15 0.00 -1.78 0.00 0.00 34.13 32.63 1w3g s GLU 262 CO 0.00 -0.42 0.37 0.99 -0.49 0.00 0.00 175.26 175.70 1w3g s THR 263 N -3.89 2.04 0.21 3.63 2.01 -0.40 -4.20 115.64 115.03 1w3g s THR 263 Ca 0.38 -3.43 -0.32 0.00 0.31 0.00 0.00 61.69 58.63 1w3g s THR 263 Cb 0.06 -2.37 -0.14 0.00 0.01 0.00 0.00 72.50 70.06 1w3g s THR 263 CO 0.16 -0.99 1.39 0.52 -0.69 0.00 0.00 174.62 175.01 1w3g n VAL 264 N 2.68 0.71 -4.89 3.82 0.31 -1.20 -2.98 118.33 116.79 1w3g n VAL 264 Ca 0.17 -0.18 -0.26 0.00 -0.01 0.00 0.00 64.34 64.06 1w3g n VAL 264 Cb 0.37 -1.34 -0.16 0.00 -0.91 0.00 0.00 33.84 31.80 1w3g n VAL 264 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1w3g s LYS 265 N -0.12 1.69 -0.07 5.55 2.20 -0.33 -3.35 119.74 125.30 1w3g s LYS 265 Ca 0.72 -0.65 0.03 0.00 -0.36 0.00 0.00 55.97 55.70 1w3g s LYS 265 Cb -0.71 -1.54 0.01 0.00 -1.51 0.00 0.00 37.83 34.09 1w3g s LYS 265 CO 0.48 0.33 -0.15 0.00 -0.36 0.00 0.00 175.35 175.65 1w3g s ALA 266 N -0.20 1.44 -0.19 3.13 0.00 -1.25 -1.53 121.76 123.16 1w3g s ALA 266 Ca 0.02 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.45 1w3g s ALA 266 Cb -0.09 -0.62 0.04 0.00 0.00 0.00 0.00 23.12 22.45 1w3g s ALA 266 CO 0.01 0.15 -0.08 0.08 0.00 0.00 0.00 175.76 175.91 1w3g s VAL 267 N 0.60 1.43 -0.19 0.00 1.01 -0.73 -4.39 120.40 118.14 1w3g s VAL 267 Ca -0.15 -0.86 -0.14 0.00 0.00 0.00 0.00 61.98 60.83 1w3g s VAL 267 Cb -0.16 -1.55 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 1w3g s VAL 267 CO 0.05 0.15 0.30 -0.44 0.00 0.00 0.00 175.10 175.16 1w3g s SER 268 N 1.49 6.37 0.04 3.32 0.01 -0.76 -1.75 113.70 122.42 1w3g s SER 268 Ca -0.00 0.43 0.01 0.00 1.31 0.00 0.00 55.95 57.70 1w3g s SER 268 Cb -0.16 -2.18 -0.02 0.00 0.21 0.00 0.00 66.02 63.86 1w3g s SER 268 CO -0.08 0.04 -0.05 0.28 0.41 0.00 0.00 173.24 173.83 1w3g s THR 269 N 0.85 0.33 0.10 1.44 -1.32 0.73 -1.03 115.64 116.73 1w3g s THR 269 Ca 0.16 -1.09 0.02 0.00 -1.21 0.00 0.00 61.69 59.56 1w3g s THR 269 Cb -0.14 -0.56 -0.04 0.00 -1.51 0.00 0.00 72.50 70.26 1w3g s THR 269 CO 0.05 -0.50 -0.06 0.54 -2.21 0.00 0.00 174.62 172.44 1w3g s VAL 270 N -1.69 0.67 -0.25 5.08 0.11 0.56 0.13 120.40 125.01 1w3g s VAL 270 Ca -0.11 -1.92 -0.10 0.00 -2.93 0.00 0.00 61.98 56.92 1w3g s VAL 270 Cb -0.08 -1.67 -0.05 0.00 -1.53 0.00 0.00 36.38 33.05 1w3g s VAL 270 CO -0.01 -0.88 0.16 -1.81 -3.33 0.00 0.00 175.10 169.23 1w3g s ASP 271 N -3.03 6.01 0.20 3.54 -0.00 0.11 0.93 116.67 124.43 1w3g s ASP 271 Ca 0.11 0.05 0.11 0.00 -0.00 0.00 0.00 52.55 52.83 1w3g s ASP 271 Cb 0.05 -2.09 -0.04 0.00 -0.00 0.00 0.00 42.92 40.83 1w3g s ASP 271 CO -0.05 0.02 -0.24 -0.94 -0.00 0.00 0.00 175.17 173.97 1w3g s SER 272 N 1.31 3.44 0.00 0.27 1.04 -0.61 0.54 113.70 119.69 1w3g s SER 272 Ca 0.07 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.62 1w3g s SER 272 Cb -0.14 -0.26 0.00 0.00 0.10 0.00 0.00 66.02 65.72 1w3g s SER 272 CO 0.07 0.11 0.00 0.61 0.98 0.00 0.00 173.24 175.01 1w3g n GLY 273 N 0.17 -2.01 3.83 7.32 0.00 -0.68 -0.89 105.19 112.93 1w3g n GLY 273 Ca -0.12 -1.17 -0.35 0.00 0.00 0.00 0.00 46.02 44.37 1w3g n GLY 273 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1w3g s ILE 274 N -2.28 4.68 -0.05 -0.61 1.01 -1.24 -1.03 121.20 121.68 1w3g s ILE 274 Ca 0.00 1.09 -0.12 0.00 0.00 0.00 0.00 60.65 61.62 1w3g s ILE 274 Cb 0.00 -3.79 0.02 0.00 0.01 0.00 0.00 42.46 38.70 1w3g s ILE 274 CO 0.00 0.17 0.28 -0.63 0.00 0.00 0.00 174.94 174.76 1w3g s ILE 275 N -1.56 0.04 0.02 2.92 1.01 -0.10 -1.22 121.20 122.30 1w3g s ILE 275 Ca 0.43 -0.33 -0.03 0.00 0.00 0.00 0.00 60.65 60.71 1w3g s ILE 275 Cb -0.15 -0.51 -0.01 0.00 0.01 0.00 0.00 42.46 41.80 1w3g s ILE 275 CO 0.20 -0.18 0.05 0.54 0.00 0.00 0.00 174.94 175.55 1w3g s ASN 276 N -0.77 0.16 -0.10 3.58 2.20 -0.96 -0.48 114.94 118.59 1w3g s ASN 276 Ca -0.09 -0.42 -0.07 0.00 -0.94 0.00 0.00 52.86 51.35 1w3g s ASN 276 Cb -0.04 0.16 0.04 0.00 -2.00 0.00 0.00 41.25 39.40 1w3g s ASN 276 CO 0.02 -0.36 0.25 -0.69 -2.94 0.00 0.00 177.10 173.38 1w3g s VAL 277 N -1.66 -0.02 0.85 3.54 1.01 0.93 -1.56 120.40 123.49 1w3g s VAL 277 Ca -0.13 0.07 -0.11 0.00 0.00 0.00 0.00 61.98 61.81 1w3g s VAL 277 Cb -0.07 -0.37 0.10 0.00 0.00 0.00 0.00 36.38 36.04 1w3g s VAL 277 CO -0.01 0.03 1.09 -2.84 0.00 0.00 0.00 175.10 173.38 1w3g s PRO 278 N 0.68 1.65 0.08 2.72 0.02 -1.26 -0.03 135.00 138.86 1w3g s PRO 278 Ca -0.05 1.04 -0.26 0.00 0.02 0.00 0.00 61.00 61.75 1w3g s PRO 278 Cb -0.06 -1.84 0.08 0.00 0.02 0.00 0.00 34.50 32.71 1w3g s PRO 278 CO -0.04 -2.03 0.81 -0.59 -0.33 0.00 0.00 177.00 174.81 1w3g s PHE 279 N -2.89 -0.36 -0.03 6.54 -0.12 0.11 -1.63 117.98 119.61 1w3g s PHE 279 Ca 0.63 0.17 0.05 0.00 -0.05 0.00 0.00 56.93 57.72 1w3g s PHE 279 Cb -0.18 0.57 -0.01 0.00 -0.63 0.00 0.00 43.02 42.77 1w3g s PHE 279 CO 0.57 -0.71 -0.18 0.99 -0.05 0.00 0.00 175.22 175.84 1w3g s THR 280 N -3.37 1.49 -0.08 -4.49 2.01 -0.56 -0.45 115.64 110.19 1w3g s THR 280 Ca 0.05 -0.78 0.02 0.00 0.31 0.00 0.00 61.69 61.30 1w3g s THR 280 Cb -0.01 -1.26 -0.02 0.00 0.01 0.00 0.00 72.50 71.22 1w3g s THR 280 CO -0.08 0.42 -0.15 0.00 -0.69 0.00 0.00 174.62 174.13 1w3g s ALA 281 N -0.22 2.59 -0.22 7.40 0.00 0.60 -1.11 121.76 130.80 1w3g s ALA 281 Ca 0.02 -0.95 -0.06 0.00 0.00 0.00 0.00 51.96 50.96 1w3g s ALA 281 Cb -0.09 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.97 1w3g s ALA 281 CO 0.01 0.42 0.04 0.71 0.00 0.00 0.00 175.76 176.93 1w3g s TYR 282 N -0.24 3.08 0.32 0.00 1.51 0.51 -1.47 117.35 121.06 1w3g s TYR 282 Ca 0.01 -0.37 0.07 0.00 -1.01 0.00 0.00 57.07 55.76 1w3g s TYR 282 Cb -0.13 -2.14 -0.06 0.00 -0.11 0.00 0.00 41.96 39.51 1w3g s TYR 282 CO 0.03 -0.23 -0.03 -0.51 -1.11 0.00 0.00 175.55 173.70 1w3g s LEU 283 N 1.15 2.52 -0.05 -1.29 1.02 -0.84 -0.57 118.68 120.61 1w3g s LEU 283 Ca 0.04 -1.25 -0.19 0.00 0.02 0.00 0.00 54.13 52.74 1w3g s LEU 283 Cb -0.14 -0.68 0.04 0.00 0.02 0.00 0.00 46.19 45.42 1w3g s LEU 283 CO 0.02 -0.39 0.43 -0.94 0.02 0.00 0.00 176.35 175.50 1w3g s SER 284 N -3.51 -0.36 0.21 2.29 1.04 -0.89 -1.98 113.70 110.50 1w3g s SER 284 Ca 0.32 0.39 -0.31 0.00 0.48 0.00 0.00 55.95 56.83 1w3g s SER 284 Cb 0.05 0.48 -0.11 0.00 0.10 0.00 0.00 66.02 66.55 1w3g s SER 284 CO 0.14 -0.44 1.56 -0.55 0.98 0.00 0.00 173.24 174.93 1w3g s SER 285 N -1.03 6.54 0.33 7.02 0.15 0.77 -1.35 113.70 126.14 1w3g s SER 285 Ca -0.11 2.72 0.13 0.00 0.70 0.00 0.00 55.95 59.40 1w3g s SER 285 Cb -0.04 -2.61 0.58 0.00 -1.71 0.00 0.00 66.02 62.25 1w3g s SER 285 CO 0.05 -0.83 1.72 0.11 1.20 0.00 0.00 173.24 175.49 1w3g h LYS 286 N 6.02 0.00 0.06 5.44 1.57 -1.90 0.52 116.57 128.28 1w3g h LYS 286 Ca -0.44 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.03 1w3g h LYS 286 Cb 1.21 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.49 1w3g h LYS 286 CO 0.87 0.47 -1.69 0.66 -0.57 0.00 0.00 179.45 179.19 1w3g h SER 287 N 0.00 0.21 0.00 0.86 4.64 -1.91 -3.42 113.55 113.93 1w3g h SER 287 Ca -0.00 -0.39 -0.11 0.00 -0.47 0.00 0.00 61.79 60.82 1w3g h SER 287 Cb 0.88 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.89 1w3g h SER 287 CO 0.06 1.34 -1.42 0.41 -0.87 0.00 0.00 176.83 176.35 1w3g n THR 288 N -3.28 0.42 -0.23 2.95 -1.04 -1.21 -5.01 114.28 106.87 1w3g n THR 288 Ca -0.19 -0.20 0.00 0.00 -2.04 0.00 0.00 64.05 61.62 1w3g n THR 288 Cb 1.04 -0.80 0.00 0.00 -1.82 0.00 0.00 70.33 68.75 1w3g n THR 288 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1w3g n GLY 289 N 2.93 0.69 3.65 3.41 0.00 0.18 -4.92 105.19 111.13 1w3g n GLY 289 Ca -0.12 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.43 1w3g n GLY 289 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1w3g n PHE 290 N -2.06 2.08 -3.79 1.61 7.35 -1.26 -4.24 117.46 117.15 1w3g n PHE 290 Ca 0.00 0.37 -0.29 0.00 -0.76 0.00 0.00 57.45 56.77 1w3g n PHE 290 Cb 0.00 -2.49 -0.04 0.00 0.35 0.00 0.00 39.48 37.31 1w3g n PHE 290 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1w3g s GLU 291 N 0.73 3.51 0.30 -4.13 2.02 -1.26 -0.16 118.70 119.70 1w3g s GLU 291 Ca 0.80 -0.36 -0.17 0.00 0.02 0.00 0.00 54.97 55.26 1w3g s GLU 291 Cb -0.75 -2.91 0.02 0.00 0.10 0.00 0.00 34.13 30.59 1w3g s GLU 291 CO 0.41 0.49 0.66 0.14 0.02 0.00 0.00 175.26 176.97 1w3g s VAL 292 N -1.72 0.00 0.14 2.63 -7.23 -0.84 -4.99 120.40 108.40 1w3g s VAL 292 Ca 0.37 -1.14 0.02 0.00 -1.81 0.00 0.00 61.98 59.42 1w3g s VAL 292 Cb -0.12 -2.27 -0.04 0.00 0.56 0.00 0.00 36.38 34.51 1w3g s VAL 292 CO 0.28 0.00 -0.03 0.42 -0.31 0.00 0.00 175.10 175.46 1w3g s THR 293 N -3.57 0.67 -0.03 5.32 -4.23 -1.26 -2.00 115.64 110.55 1w3g s THR 293 Ca 0.16 -1.96 -0.01 0.00 -1.18 0.00 0.00 61.69 58.70 1w3g s THR 293 Cb -0.04 -1.93 0.02 0.00 1.34 0.00 0.00 72.50 71.90 1w3g s THR 293 CO 0.09 -0.65 0.06 -0.89 -0.54 0.00 0.00 174.62 172.69 1w3g s THR 294 N -3.65 -0.04 0.02 3.99 2.01 -0.54 -0.86 115.64 116.57 1w3g s THR 294 Ca 0.19 0.15 -0.06 0.00 0.31 0.00 0.00 61.69 62.28 1w3g s THR 294 Cb 0.06 -0.11 -0.05 0.00 0.01 0.00 0.00 72.50 72.41 1w3g s THR 294 CO 0.00 0.06 0.27 -1.61 -0.69 0.00 0.00 174.62 172.65 1w3g s GLU 295 N 0.82 3.56 0.27 4.92 0.41 0.94 -0.29 118.70 129.32 1w3g s GLU 295 Ca -0.07 -0.12 -0.20 0.00 -0.41 0.00 0.00 54.97 54.17 1w3g s GLU 295 Cb -0.09 -3.06 0.02 0.00 -1.78 0.00 0.00 34.13 29.22 1w3g s GLU 295 CO -0.03 0.63 0.69 0.20 -0.49 0.00 0.00 175.26 176.26 1w3g s GLY 296 N -1.84 -0.06 -0.15 -1.39 0.00 0.40 -0.78 107.32 103.51 1w3g s GLY 296 Ca 0.29 -0.32 0.02 0.00 0.00 0.00 0.00 44.72 44.71 1w3g s GLY 296 CO 0.18 -0.13 -0.21 -0.42 0.00 0.00 0.00 173.10 172.51 1w3g s ILE 297 N -3.92 2.10 -0.02 0.90 1.01 -0.21 0.10 121.20 121.15 1w3g s ILE 297 Ca 0.12 -0.96 -0.17 0.00 0.00 0.00 0.00 60.65 59.64 1w3g s ILE 297 Cb -0.05 -1.85 -0.05 0.00 0.01 0.00 0.00 42.46 40.51 1w3g s ILE 297 CO 0.06 0.54 0.46 0.86 0.00 0.00 0.00 174.94 176.87 1w3g s TRP 298 N 0.94 3.67 0.01 3.97 -0.00 0.96 -1.36 118.94 127.13 1w3g s TRP 298 Ca -0.04 1.02 0.00 0.00 -0.00 0.00 0.00 56.10 57.08 1w3g s TRP 298 Cb -0.15 -2.42 -0.01 0.00 -0.00 0.00 0.00 33.47 30.89 1w3g s TRP 298 CO -0.05 0.47 -0.02 0.50 -0.00 0.00 0.00 176.95 177.86 1w3g s ARG 299 N -0.50 0.18 -0.21 5.86 3.52 -0.29 -0.05 118.95 127.45 1w3g s ARG 299 Ca 0.26 -0.30 -0.36 0.00 -0.13 0.00 0.00 55.73 55.19 1w3g s ARG 299 Cb -0.17 0.02 0.14 0.00 -1.56 0.00 0.00 34.95 33.38 1w3g s ARG 299 CO 0.13 -0.01 1.28 0.20 -0.81 0.00 0.00 175.30 176.09 1w3g s GLY 300 N -0.70 -0.28 -0.12 8.12 0.00 0.37 -1.52 107.32 113.19 1w3g s GLY 300 Ca -0.07 1.63 -0.28 0.00 0.00 0.00 0.00 44.72 46.00 1w3g s GLY 300 CO -0.00 0.53 0.92 0.14 0.00 0.00 0.00 173.10 174.69 1w3g s VAL 301 N -2.28 4.84 0.11 1.40 1.01 -1.25 -0.93 120.40 123.32 1w3g s VAL 301 Ca 0.11 1.86 0.02 0.00 0.00 0.00 0.00 61.98 63.97 1w3g s VAL 301 Cb -0.00 -4.23 -0.01 0.00 0.00 0.00 0.00 36.38 32.14 1w3g s VAL 301 CO -0.04 0.04 0.07 -0.24 0.00 0.00 0.00 175.10 174.93 1w3g n SER 302 N 4.93 0.40 -3.88 3.32 2.88 -0.20 -1.82 113.62 119.25 1w3g n SER 302 Ca 0.06 -1.68 -0.09 0.00 -1.33 0.00 0.00 58.87 55.84 1w3g n SER 302 Cb 0.49 0.42 -0.08 0.00 -0.75 0.00 0.00 64.21 64.29 1w3g n SER 302 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1w3g s SER 303 N -1.75 0.13 0.16 -3.46 1.04 -1.26 -1.69 113.70 106.87 1w3g s SER 303 Ca 0.09 -0.60 -0.25 0.00 0.48 0.00 0.00 55.95 55.68 1w3g s SER 303 Cb 0.00 0.31 0.07 0.00 0.10 0.00 0.00 66.02 66.50 1w3g s SER 303 CO 0.07 -0.66 0.98 -1.66 0.98 0.00 0.00 173.24 172.94 1w3g s TRP 304 N -3.46 -0.10 -1.04 5.02 -2.14 0.19 -4.71 118.94 112.70 1w3g s TRP 304 Ca 0.02 -0.22 -0.09 0.00 2.66 0.00 0.00 56.10 58.47 1w3g s TRP 304 Cb 0.03 0.65 -0.05 0.00 -3.10 0.00 0.00 33.47 31.00 1w3g s TRP 304 CO -0.09 -0.84 0.86 -0.25 -2.66 0.00 0.00 176.95 173.98 1w3g n ASP 305 N -0.58 -6.44 -4.69 -2.66 8.00 -1.26 0.05 116.55 108.98 1w3g n ASP 305 Ca -0.06 -0.72 -0.42 0.00 0.71 0.00 0.00 54.79 54.30 1w3g n ASP 305 Cb 0.61 -4.74 -0.03 0.00 -0.02 0.00 0.00 41.12 36.94 1w3g n ASP 305 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1w3g s LEU 306 N -5.50 4.35 0.03 0.64 2.96 -1.26 -4.24 118.68 115.66 1w3g s LEU 306 Ca 0.41 2.40 0.07 0.00 -0.22 0.00 0.00 54.13 56.80 1w3g s LEU 306 Cb -0.08 -3.56 -0.03 0.00 0.50 0.00 0.00 46.19 43.02 1w3g s LEU 306 CO 0.77 -0.86 -0.19 -0.13 -1.32 0.00 0.00 176.35 174.62 1w3g s ARG 307 N 2.73 2.08 -0.20 1.98 3.00 0.35 -4.94 118.95 123.96 1w3g s ARG 307 Ca 0.72 -0.97 0.00 0.00 0.00 0.00 0.00 55.73 55.49 1w3g s ARG 307 Cb -0.38 -2.17 0.05 0.00 0.00 0.00 0.00 34.95 32.45 1w3g s ARG 307 CO 0.31 0.55 -0.06 -1.01 0.00 0.00 0.00 175.30 175.09 1w3g s HIS 308 N -0.86 2.05 -0.18 -0.53 3.76 -1.26 -0.19 115.29 118.07 1w3g s HIS 308 Ca 0.14 -1.41 -0.02 0.00 -0.15 0.00 0.00 55.06 53.62 1w3g s HIS 308 Cb -0.10 -1.46 -0.01 0.00 1.11 0.00 0.00 32.58 32.12 1w3g s HIS 308 CO 0.04 -0.70 -0.09 0.99 -0.85 0.00 0.00 174.74 174.13 1w3g s THR 309 N 1.51 3.19 -0.14 1.30 2.01 -0.72 -4.95 115.64 117.85 1w3g s THR 309 Ca -0.02 -0.58 -0.03 0.00 0.31 0.00 0.00 61.69 61.37 1w3g s THR 309 Cb -0.17 -2.40 -0.03 0.00 0.01 0.00 0.00 72.50 69.91 1w3g s THR 309 CO -0.07 0.47 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.55 1w3g s LEU 310 N 0.98 3.36 -0.07 4.42 1.43 -1.26 -1.78 118.68 125.77 1w3g s LEU 310 Ca -0.01 -0.06 -0.04 0.00 -1.03 0.00 0.00 54.13 53.00 1w3g s LEU 310 Cb -0.15 -1.80 0.03 0.00 0.03 0.00 0.00 46.19 44.31 1w3g s LEU 310 CO -0.00 0.22 0.16 0.42 0.23 0.00 0.00 176.35 177.37 1w3g s THR 311 N 0.08 -0.04 0.34 5.49 -4.23 -0.58 -4.96 115.64 111.73 1w3g s THR 311 Ca 0.01 0.13 -0.10 0.00 -1.18 0.00 0.00 61.69 60.55 1w3g s THR 311 Cb -0.13 -0.25 -0.07 0.00 1.34 0.00 0.00 72.50 73.39 1w3g s THR 311 CO 0.02 0.05 0.68 -0.44 -0.54 0.00 0.00 174.62 174.40 1w3g s SER 312 N 0.89 6.57 0.08 3.99 0.01 -1.26 -1.19 113.70 122.78 1w3g s SER 312 Ca -0.07 1.03 0.02 0.00 1.31 0.00 0.00 55.95 58.25 1w3g s SER 312 Cb -0.09 -2.28 -0.03 0.00 0.21 0.00 0.00 66.02 63.83 1w3g s SER 312 CO -0.05 -0.27 -0.07 -0.69 0.41 0.00 0.00 173.24 172.57 1w3g s VAL 313 N -2.16 0.64 0.36 3.43 1.01 -1.16 -4.87 120.40 117.65 1w3g s VAL 313 Ca 0.50 -1.60 -0.06 0.00 0.00 0.00 0.00 61.98 60.82 1w3g s VAL 313 Cb -0.10 -1.26 0.02 0.00 0.00 0.00 0.00 36.38 35.03 1w3g s VAL 313 CO 0.27 -0.67 0.55 -0.89 0.00 0.00 0.00 175.10 174.36 1w3g s THR 314 N -2.72 0.00 0.00 3.92 2.01 -1.26 -1.28 115.64 116.31 1w3g s THR 314 Ca 0.03 -1.45 0.00 0.00 0.31 0.00 0.00 61.69 60.58 1w3g s THR 314 Cb -0.01 -2.70 0.00 0.00 0.01 0.00 0.00 72.50 69.80 1w3g s THR 314 CO -0.03 0.00 0.00 0.00 -0.69 0.00 0.00 174.62 173.90