#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w4m h LEU -4 N 0.00 -0.43 -0.33 1.20 5.85 -2.01 -1.80 115.31 117.80 2w4m h LEU -4 Ca 0.00 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.72 2w4m h LEU -4 Cb 0.00 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.08 2w4m h LEU -4 CO 0.00 -0.20 -0.06 0.22 -0.34 0.00 0.00 178.44 178.06 2w4m h TYR -3 N -0.65 -0.14 -0.82 1.25 -0.00 -2.01 -1.87 116.97 112.73 2w4m h TYR -3 Ca -0.05 0.03 0.00 0.00 -0.00 0.00 0.00 58.73 58.71 2w4m h TYR -3 Cb 0.47 0.11 -0.04 0.00 -0.00 0.00 0.00 36.73 37.27 2w4m h TYR -3 CO -0.02 -0.12 0.52 0.74 -0.00 0.00 0.00 178.16 179.28 2w4m h PHE -2 N 0.02 1.06 0.40 -3.82 0.04 -1.87 -1.14 116.94 111.63 2w4m h PHE -2 Ca 0.16 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.92 2w4m h PHE -2 Cb 0.24 -0.35 0.00 0.00 2.20 0.00 0.00 35.95 38.04 2w4m h PHE -2 CO -0.29 0.69 -0.19 1.96 -0.60 0.00 0.00 178.31 179.88 2w4m h GLN -1 N 1.12 -0.51 -1.15 1.51 4.20 -1.11 -0.74 115.11 118.43 2w4m h GLN -1 Ca 0.30 0.03 0.42 0.00 0.06 0.00 0.00 58.65 59.46 2w4m h GLN -1 Cb -0.09 0.12 -0.15 0.00 0.30 0.00 0.00 27.48 27.66 2w4m h GLN -1 CO -0.06 -0.33 0.69 1.03 -0.67 0.00 0.00 178.83 179.48 2w4m h SER 0 N -0.54 0.31 1.01 1.46 0.87 -0.86 0.26 113.55 116.06 2w4m h SER 0 Ca -0.05 0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 2w4m h SER 0 Cb 0.41 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2w4m h SER 0 CO 0.09 -0.28 -0.46 0.23 -0.53 0.00 0.00 176.83 175.88 2w4m n MET 1 N -4.98 0.27 -1.76 2.24 2.81 -0.47 -4.99 117.12 110.24 2w4m n MET 1 Ca 0.37 0.11 -0.01 0.00 -1.81 0.00 0.00 57.70 56.37 2w4m n MET 1 Cb 1.32 -1.71 0.00 0.00 -0.71 0.00 0.00 33.22 32.13 2w4m n MET 1 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2w4m n GLY 2 N 1.34 -0.59 3.24 3.03 0.00 0.91 -5.06 105.19 108.06 2w4m n GLY 2 Ca 0.04 -0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.09 2w4m n GLY 2 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2w4m s LEU 3 N -1.96 -1.11 -0.12 0.99 2.96 -1.08 -5.03 118.68 113.32 2w4m s LEU 3 Ca 0.02 0.86 -0.09 0.00 -0.22 0.00 0.00 54.13 54.70 2w4m s LEU 3 Cb -0.00 2.00 -0.04 0.00 0.50 0.00 0.00 46.19 48.64 2w4m s LEU 3 CO 0.13 -0.21 0.18 -0.55 -1.32 0.00 0.00 176.35 174.58 2w4m s SER 4 N 2.85 6.41 0.90 3.68 0.15 -1.26 -4.27 113.70 122.16 2w4m s SER 4 Ca 0.11 0.49 -0.12 0.00 0.70 0.00 0.00 55.95 57.13 2w4m s SER 4 Cb -0.13 -2.10 0.07 0.00 -1.71 0.00 0.00 66.02 62.15 2w4m s SER 4 CO -0.19 0.35 0.78 -1.14 1.20 0.00 0.00 173.24 174.25 2w4m n ARG 5 N 2.27 -0.21 -2.17 5.44 3.00 -1.26 -4.96 116.66 118.76 2w4m n ARG 5 Ca -0.18 -0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.25 2w4m n ARG 5 Cb 0.54 -2.12 -0.03 0.00 0.00 0.00 0.00 32.46 30.86 2w4m n ARG 5 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2w4m s VAL 6 N -2.38 3.06 -0.08 5.15 1.01 -1.26 -4.89 120.40 121.00 2w4m s VAL 6 Ca 0.64 0.89 0.11 0.00 0.00 0.00 0.00 61.98 63.62 2w4m s VAL 6 Cb -0.24 -3.57 -0.16 0.00 0.00 0.00 0.00 36.38 32.41 2w4m s VAL 6 CO 0.61 0.14 0.11 0.54 0.00 0.00 0.00 175.10 176.50 2w4m n ARG 7 N 2.37 1.58 -3.80 2.72 1.74 -0.13 -4.90 116.66 116.24 2w4m n ARG 7 Ca 0.05 -0.04 -0.12 0.00 -0.77 0.00 0.00 57.85 56.97 2w4m n ARG 7 Cb 0.42 -1.29 -0.10 0.00 -1.02 0.00 0.00 32.46 30.47 2w4m n ARG 7 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2w4m s ALA 8 N -2.46 -0.60 -0.10 7.54 0.00 -1.15 -1.41 121.76 123.58 2w4m s ALA 8 Ca -0.05 0.35 0.03 0.00 0.00 0.00 0.00 51.96 52.29 2w4m s ALA 8 Cb 0.05 -0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.07 2w4m s ALA 8 CO 0.48 -0.19 -0.20 0.08 0.00 0.00 0.00 175.76 175.93 2w4m s VAL 9 N -0.78 1.78 -0.20 0.00 1.01 -0.48 -1.74 120.40 119.99 2w4m s VAL 9 Ca -0.09 -0.84 -0.09 0.00 0.00 0.00 0.00 61.98 60.96 2w4m s VAL 9 Cb -0.05 -1.57 -0.05 0.00 0.00 0.00 0.00 36.38 34.72 2w4m s VAL 9 CO 0.02 0.50 0.12 -0.36 0.00 0.00 0.00 175.10 175.37 2w4m s PHE 10 N 0.62 3.38 -0.07 5.22 0.08 0.53 -1.94 117.98 125.80 2w4m s PHE 10 Ca -0.13 0.28 -0.00 0.00 0.12 0.00 0.00 56.93 57.19 2w4m s PHE 10 Cb -0.17 -2.14 -0.03 0.00 -0.57 0.00 0.00 43.02 40.11 2w4m s PHE 10 CO 0.04 0.27 -0.03 -0.06 -0.10 0.00 0.00 175.22 175.34 2w4m s PHE 11 N 0.35 3.06 0.77 0.36 0.08 0.20 -0.49 117.98 122.31 2w4m s PHE 11 Ca 0.07 0.11 -0.12 0.00 0.12 0.00 0.00 56.93 57.11 2w4m s PHE 11 Cb -0.11 -1.74 0.06 0.00 -0.57 0.00 0.00 43.02 40.65 2w4m s PHE 11 CO -0.02 0.41 1.13 0.34 -0.10 0.00 0.00 175.22 176.99 2w4m s ASP 12 N -0.93 4.26 -0.05 1.36 2.15 -0.56 -0.27 116.67 122.63 2w4m s ASP 12 Ca 0.14 2.04 -0.05 0.00 0.43 0.00 0.00 52.55 55.10 2w4m s ASP 12 Cb -0.11 -2.55 -0.02 0.00 -0.30 0.00 0.00 42.92 39.94 2w4m s ASP 12 CO 0.03 -2.21 -0.10 -0.11 -0.17 0.00 0.00 175.17 172.61 2w4m n LEU 13 N -3.26 0.68 -4.66 -1.34 7.94 -1.26 -4.16 117.00 110.93 2w4m n LEU 13 Ca 0.11 0.11 -0.42 0.00 -1.11 0.00 0.00 56.01 54.70 2w4m n LEU 13 Cb 0.52 -0.49 -0.03 0.00 0.53 0.00 0.00 43.42 43.95 2w4m n LEU 13 CO 0.50 -0.45 1.42 -1.81 -1.11 0.00 0.00 177.39 175.94 2w4m s ASP 14 N -4.88 6.61 -1.47 1.96 1.01 -1.26 -1.68 116.67 116.96 2w4m s ASP 14 Ca -0.09 2.38 0.00 0.00 0.71 0.00 0.00 52.55 55.55 2w4m s ASP 14 Cb 0.01 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.41 2w4m s ASP 14 CO 0.13 -0.95 0.00 0.59 0.21 0.00 0.00 175.17 175.15 2w4m n ASN 15 N 7.02 -4.78 0.00 0.27 3.02 0.86 -4.77 115.26 116.88 2w4m n ASN 15 Ca 0.18 0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.88 2w4m n ASN 15 Cb 0.42 -4.07 0.00 0.00 -0.61 0.00 0.00 39.78 35.52 2w4m n ASN 15 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2w4m n THR 16 N -3.39 0.00 0.03 3.41 -1.04 -0.87 -4.74 114.28 107.68 2w4m n THR 16 Ca -0.19 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 61.88 2w4m n THR 16 Cb 0.63 -1.43 -0.09 0.00 -1.82 0.00 0.00 70.33 67.62 2w4m n THR 16 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2w4m n LEU 17 N -2.96 0.03 -4.08 -4.42 4.77 -0.67 -4.82 117.00 104.85 2w4m n LEU 17 Ca 0.00 -0.03 -0.13 0.00 -0.03 0.00 0.00 56.01 55.82 2w4m n LEU 17 Cb 0.48 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.46 2w4m n LEU 17 CO 0.00 0.01 -0.40 0.27 -1.33 0.00 0.00 177.39 175.94 2w4m s ILE 18 N -2.76 0.57 -1.26 -0.08 -4.36 -1.16 -4.47 121.20 107.67 2w4m s ILE 18 Ca -0.04 -1.23 -0.11 0.00 -0.26 0.00 0.00 60.65 59.01 2w4m s ILE 18 Cb 0.08 -0.80 0.17 0.00 1.25 0.00 0.00 42.46 43.15 2w4m s ILE 18 CO 0.48 -0.47 1.76 -0.67 0.24 0.00 0.00 174.94 176.28 2w4m n ASP 19 N 1.19 5.12 -0.12 4.36 2.03 -1.26 -0.10 116.55 127.77 2w4m n ASP 19 Ca -0.21 -3.07 -0.08 0.00 0.52 0.00 0.00 54.79 51.95 2w4m n ASP 19 Cb 0.56 -1.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.45 2w4m n ASP 19 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 2w4m h THR 20 N 3.99 1.08 -0.46 5.18 2.02 -1.92 0.37 112.91 123.18 2w4m h THR 20 Ca 0.38 -0.17 0.05 0.00 0.77 0.00 0.00 66.41 67.43 2w4m h THR 20 Cb 0.69 0.53 -0.05 0.00 -1.74 0.00 0.00 68.15 67.59 2w4m h THR 20 CO 1.53 0.09 0.19 0.00 0.37 0.00 0.00 175.52 177.69 2w4m h ALA 21 N 1.15 0.56 -0.18 6.16 0.00 -1.97 0.14 119.26 125.12 2w4m h ALA 21 Ca 0.15 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 2w4m h ALA 21 Cb -0.04 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2w4m h ALA 21 CO -0.04 -0.19 -0.04 0.78 0.00 0.00 0.00 179.25 179.75 2w4m h GLY 22 N 0.37 0.38 0.98 0.00 0.00 -1.86 -0.88 103.07 102.06 2w4m h GLY 22 Ca 0.21 -0.32 0.01 0.00 0.00 0.00 0.00 47.33 47.23 2w4m h GLY 22 CO -0.19 0.29 0.42 0.00 0.00 0.00 0.00 176.54 177.06 2w4m h ALA 23 N 0.73 0.83 -0.40 3.60 0.00 -0.80 -0.51 119.26 122.70 2w4m h ALA 23 Ca 0.05 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 2w4m h ALA 23 Cb 0.48 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2w4m h ALA 23 CO 0.02 0.23 -0.28 0.77 0.00 0.00 0.00 179.25 179.99 2w4m h SER 24 N 0.86 0.87 -0.27 0.00 0.02 -0.48 -0.94 113.55 113.61 2w4m h SER 24 Ca 0.24 -0.35 0.01 0.00 -0.84 0.00 0.00 61.79 60.86 2w4m h SER 24 Cb -0.07 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.21 2w4m h SER 24 CO -0.06 1.09 0.16 -0.09 -1.14 0.00 0.00 176.83 176.79 2w4m h ARG 25 N 0.72 0.32 -0.81 3.45 2.43 -0.97 -1.54 114.38 117.98 2w4m h ARG 25 Ca 0.09 -0.02 0.16 0.00 -0.81 0.00 0.00 59.98 59.39 2w4m h ARG 25 Cb 0.82 -0.07 -0.10 0.00 -0.42 0.00 0.00 29.97 30.20 2w4m h ARG 25 CO 0.07 0.21 0.35 0.00 -1.51 0.00 0.00 179.97 179.09 2w4m h ARG 26 N 0.33 0.46 -0.54 0.20 3.08 -0.61 -0.14 114.38 117.16 2w4m h ARG 26 Ca 0.11 -0.03 0.07 0.00 0.07 0.00 0.00 59.98 60.20 2w4m h ARG 26 Cb -0.01 -0.10 -0.06 0.00 0.08 0.00 0.00 29.97 29.88 2w4m h ARG 26 CO -0.05 0.31 0.22 0.78 -1.07 0.00 0.00 179.97 180.16 2w4m h GLY 27 N 0.48 0.75 1.26 0.04 0.00 -0.25 -1.83 103.07 103.51 2w4m h GLY 27 Ca 0.45 -0.13 -0.14 0.00 0.00 0.00 0.00 47.33 47.51 2w4m h GLY 27 CO -0.42 0.03 -0.32 -0.33 0.00 0.00 0.00 176.54 175.50 2w4m h MET 28 N 0.42 0.83 -0.95 4.80 2.86 -0.31 -2.10 114.93 120.49 2w4m h MET 28 Ca 0.26 -0.40 0.08 0.00 -2.06 0.00 0.00 59.70 57.58 2w4m h MET 28 Cb 0.26 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 31.85 2w4m h MET 28 CO -0.24 1.03 0.60 -0.07 1.06 0.00 0.00 176.91 179.29 2w4m h LEU 29 N 0.70 0.93 -0.55 1.22 3.38 -0.52 -0.48 115.31 119.99 2w4m h LEU 29 Ca 0.07 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.92 2w4m h LEU 29 Cb 0.88 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2w4m h LEU 29 CO 0.08 0.57 -0.43 -0.33 0.09 0.00 0.00 178.44 178.42 2w4m h GLU 30 N 1.05 0.69 -0.61 1.13 4.39 -0.83 -0.37 114.58 120.03 2w4m h GLU 30 Ca 0.42 -0.37 -0.05 0.00 0.34 0.00 0.00 59.36 59.70 2w4m h GLU 30 Cb 0.24 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.88 2w4m h GLU 30 CO -0.20 0.98 0.18 0.28 -1.16 0.00 0.00 179.01 179.10 2w4m h VAL 31 N 0.56 1.24 -0.09 3.13 2.07 -0.66 0.11 116.25 122.60 2w4m h VAL 31 Ca 0.04 -0.82 -0.02 0.00 0.82 0.00 0.00 66.70 66.72 2w4m h VAL 31 Cb 0.97 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 31.32 2w4m h VAL 31 CO 0.09 0.31 -0.01 0.40 0.02 0.00 0.00 177.57 178.38 2w4m h ILE 32 N 0.90 1.28 -0.71 4.57 2.04 -0.75 0.26 117.51 125.10 2w4m h ILE 32 Ca 0.20 -0.90 0.11 0.00 1.00 0.00 0.00 64.86 65.27 2w4m h ILE 32 Cb 0.28 1.70 -0.08 0.00 -0.74 0.00 0.00 36.82 37.98 2w4m h ILE 32 CO -0.01 0.25 0.31 0.50 0.00 0.00 0.00 178.15 179.20 2w4m h LYS 33 N -0.15 0.49 0.30 2.37 3.64 -0.84 -0.87 116.57 121.51 2w4m h LYS 33 Ca 0.02 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2w4m h LYS 33 Cb 0.40 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2w4m h LYS 33 CO 0.01 0.32 -0.14 1.25 -2.27 0.00 0.00 179.45 178.62 2w4m h LEU 34 N 0.50 -0.34 -1.64 5.20 5.85 -0.42 -1.45 115.31 123.02 2w4m h LEU 34 Ca 0.37 -0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.99 2w4m h LEU 34 Cb 0.47 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 2w4m h LEU 34 CO -0.33 -0.15 -0.15 -0.07 -0.34 0.00 0.00 178.44 177.40 2w4m h LEU 35 N -0.51 0.04 0.00 2.25 3.38 0.23 -0.83 115.31 119.87 2w4m h LEU 35 Ca -0.04 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 2w4m h LEU 35 Cb 0.38 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 2w4m h LEU 35 CO 0.07 0.20 -0.46 1.56 0.09 0.00 0.00 178.44 179.90 2w4m h GLN 36 N 0.04 0.00 -0.16 1.13 4.20 -1.15 -1.54 115.11 117.62 2w4m h GLN 36 Ca 0.01 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.66 2w4m h GLN 36 Cb 0.29 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 2w4m h GLN 36 CO 0.02 0.52 -0.11 0.66 -0.67 0.00 0.00 178.83 179.25 2w4m h SER 37 N -1.00 0.38 0.03 1.46 4.64 -1.26 0.65 113.55 118.45 2w4m h SER 37 Ca -0.09 -0.44 -0.00 0.00 -0.47 0.00 0.00 61.79 60.79 2w4m h SER 37 Cb 0.72 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 2w4m h SER 37 CO -0.06 0.73 -0.02 0.50 -0.87 0.00 0.00 176.83 177.12 2w4m h LYS 38 N 0.02 -0.04 -0.14 4.77 3.64 -1.32 -3.37 116.57 120.12 2w4m h LYS 38 Ca 0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2w4m h LYS 38 Cb 0.61 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2w4m h LYS 38 CO 0.03 0.64 0.00 0.66 -2.27 0.00 0.00 179.45 178.51 2w4m n TYR 39 N -4.75 0.16 -2.93 1.91 4.01 -1.05 -4.98 117.16 109.53 2w4m n TYR 39 Ca -0.08 -0.10 -0.16 0.00 -0.16 0.00 0.00 57.90 57.39 2w4m n TYR 39 Cb 0.34 -0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.41 2w4m n TYR 39 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2w4m n HIS 40 N 1.14 -1.59 -2.68 -0.72 8.25 0.22 -4.93 115.22 114.91 2w4m n HIS 40 Ca 0.13 0.47 -0.37 0.00 -0.26 0.00 0.00 57.72 57.69 2w4m n HIS 40 Cb 0.50 -3.63 -0.05 0.00 1.12 0.00 0.00 29.99 27.93 2w4m n HIS 40 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2w4m s TYR 41 N -3.06 3.50 0.00 4.41 1.51 -0.64 -4.97 117.35 118.11 2w4m s TYR 41 Ca 0.27 1.72 0.00 0.00 -1.01 0.00 0.00 57.07 58.05 2w4m s TYR 41 Cb -0.12 -3.02 0.00 0.00 -0.11 0.00 0.00 41.96 38.71 2w4m s TYR 41 CO 0.34 -0.17 0.00 1.63 -1.11 0.00 0.00 175.55 176.24 2w4m n LYS 42 N 0.28 1.37 0.25 -0.62 4.76 -1.26 -4.23 118.16 118.72 2w4m n LYS 42 Ca 0.03 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.59 2w4m n LYS 42 Cb 0.50 0.00 0.67 0.00 -1.84 0.00 0.00 35.03 34.36 2w4m n LYS 42 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 2w4m h GLU 43 N 0.00 0.00 0.00 1.97 4.22 -2.02 -2.39 114.58 116.36 2w4m h GLU 43 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2w4m h GLU 43 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2w4m h GLU 43 CO 0.00 0.15 0.00 1.05 -2.18 0.00 0.00 179.01 178.03 2w4m h GLU 44 N 0.00 0.00 -0.74 1.92 9.09 -2.01 0.44 114.58 123.28 2w4m h GLU 44 Ca -0.00 0.00 0.03 0.00 0.05 0.00 0.00 59.36 59.44 2w4m h GLU 44 Cb 0.40 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.46 2w4m h GLU 44 CO 0.02 0.00 0.49 0.00 0.05 0.00 0.00 179.01 179.57 2w4m h ALA 45 N 1.99 1.54 -0.36 1.06 0.00 -1.75 -2.10 119.26 119.64 2w4m h ALA 45 Ca 0.00 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.73 2w4m h ALA 45 Cb 0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2w4m h ALA 45 CO 0.00 0.39 -0.32 0.93 0.00 0.00 0.00 179.25 180.25 2w4m h GLU 46 N 0.93 0.80 -0.31 0.00 5.08 -1.14 -2.97 114.58 116.97 2w4m h GLU 46 Ca 0.29 -0.38 0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2w4m h GLU 46 Cb 0.01 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 2w4m h GLU 46 CO -0.08 1.01 0.08 0.82 -1.00 0.00 0.00 179.01 179.84 2w4m h ILE 47 N 0.67 0.88 -0.64 3.13 2.04 -1.44 -1.07 117.51 121.08 2w4m h ILE 47 Ca 0.07 -0.07 0.10 0.00 1.00 0.00 0.00 64.86 65.96 2w4m h ILE 47 Cb 0.87 0.66 -0.07 0.00 -0.74 0.00 0.00 36.82 37.54 2w4m h ILE 47 CO 0.08 0.04 0.26 0.40 0.00 0.00 0.00 178.15 178.92 2w4m h ILE 48 N 0.20 0.77 -0.36 -0.67 2.04 -1.32 -1.11 117.51 117.05 2w4m h ILE 48 Ca 0.14 -0.15 -0.10 0.00 1.00 0.00 0.00 64.86 65.74 2w4m h ILE 48 Cb 0.13 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 2w4m h ILE 48 CO -0.17 0.08 -0.20 0.00 0.00 0.00 0.00 178.15 177.86 2w4m h ASP 50 N 0.61 -0.07 -1.00 0.00 3.32 -0.79 -0.62 116.42 117.86 2w4m h ASP 50 Ca 0.09 -0.02 0.11 0.00 0.02 0.00 0.00 57.03 57.23 2w4m h ASP 50 Cb 0.68 0.02 -0.08 0.00 0.22 0.00 0.00 39.33 40.17 2w4m h ASP 50 CO 0.05 -0.03 0.64 0.11 -1.72 0.00 0.00 179.24 178.29 2w4m h LYS 51 N -0.10 1.00 -0.15 3.56 1.57 -0.90 -0.02 116.57 121.53 2w4m h LYS 51 Ca -0.01 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 2w4m h LYS 51 Cb 0.08 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.16 2w4m h LYS 51 CO 0.01 0.66 -0.07 0.28 -0.57 0.00 0.00 179.45 179.76 2w4m h VAL 52 N 1.03 1.32 -0.81 0.50 2.07 -0.73 -1.64 116.25 117.98 2w4m h VAL 52 Ca 0.48 -1.12 0.18 0.00 0.82 0.00 0.00 66.70 67.06 2w4m h VAL 52 Cb 0.42 1.75 -0.12 0.00 -1.52 0.00 0.00 31.29 31.82 2w4m h VAL 52 CO -0.24 0.33 0.27 1.56 0.02 0.00 0.00 177.57 179.51 2w4m h GLN 53 N -0.03 0.33 -0.06 1.57 1.08 -0.45 0.35 115.11 117.90 2w4m h GLN 53 Ca 0.03 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.21 2w4m h GLN 53 Cb 0.55 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.90 2w4m h GLN 53 CO 0.02 0.22 0.02 0.28 -0.95 0.00 0.00 178.83 178.42 2w4m h VAL 54 N 0.34 1.16 -0.98 -0.54 2.07 -0.78 -1.26 116.25 116.25 2w4m h VAL 54 Ca 0.47 -0.46 0.03 0.00 0.82 0.00 0.00 66.70 67.56 2w4m h VAL 54 Cb 0.84 1.36 -0.05 0.00 -1.52 0.00 0.00 31.29 31.92 2w4m h VAL 54 CO -0.52 0.13 0.65 0.11 0.02 0.00 0.00 177.57 177.96 2w4m h LYS 55 N -0.09 1.24 -0.69 1.57 1.57 -0.45 -0.78 116.57 118.93 2w4m h LYS 55 Ca 0.02 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 2w4m h LYS 55 Cb 0.19 -0.28 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 2w4m h LYS 55 CO -0.00 0.82 0.31 -0.07 -0.57 0.00 0.00 179.45 179.94 2w4m h LEU 56 N 1.28 0.91 -0.27 2.94 3.38 -0.08 -1.80 115.31 121.67 2w4m h LEU 56 Ca 0.38 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 58.16 2w4m h LEU 56 Cb -0.06 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 2w4m h LEU 56 CO -0.11 0.78 -0.39 0.77 0.09 0.00 0.00 178.44 179.59 2w4m h SER 57 N 0.99 0.00 -0.53 -0.43 4.64 0.06 -2.12 113.55 116.16 2w4m h SER 57 Ca 0.24 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.54 2w4m h SER 57 Cb 0.14 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 2w4m h SER 57 CO -0.03 0.39 0.02 2.29 -0.87 0.00 0.00 176.83 178.63 2w4m n LYS 58 N -3.26 4.46 -1.75 4.77 2.85 -0.87 -5.03 118.16 119.32 2w4m n LYS 58 Ca 0.02 -3.11 -0.41 0.00 -1.05 0.00 0.00 58.31 53.76 2w4m n LYS 58 Cb 0.64 -2.19 0.00 0.00 -0.65 0.00 0.00 35.03 32.84 2w4m n LYS 58 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2w4m n GLU 59 N 0.35 2.41 -3.74 -1.58 2.13 -0.69 -4.98 120.64 114.54 2w4m n GLU 59 Ca 0.28 0.85 -0.30 0.00 0.66 0.00 0.00 57.16 58.65 2w4m n GLU 59 Cb 1.16 -2.57 -0.14 0.00 0.27 0.00 0.00 31.44 30.16 2w4m n GLU 59 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2w4m s PHE 61 N 0.90 3.12 -0.53 0.00 5.99 -1.26 -5.02 117.98 121.19 2w4m s PHE 61 Ca 0.14 0.06 -0.11 0.00 0.00 0.00 0.00 56.93 57.02 2w4m s PHE 61 Cb -0.21 -3.16 0.13 0.00 0.00 0.00 0.00 43.02 39.78 2w4m s PHE 61 CO -0.10 -0.72 0.43 -1.01 -0.00 0.00 0.00 175.22 173.82 2w4m s HIS 62 N 2.63 3.40 0.49 10.12 3.76 -1.26 -4.97 115.29 129.46 2w4m s HIS 62 Ca 0.21 -1.75 0.21 0.00 -0.15 0.00 0.00 55.06 53.58 2w4m s HIS 62 Cb -0.15 -3.60 1.26 0.00 1.11 0.00 0.00 32.58 31.20 2w4m s HIS 62 CO 0.16 -1.00 1.97 -1.35 -0.85 0.00 0.00 174.74 173.68 2w4m h PRO 63 N 8.46 0.16 0.00 8.40 0.11 -1.96 0.03 132.00 147.20 2w4m h PRO 63 Ca -0.20 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.89 2w4m h PRO 63 Cb 1.07 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 2w4m h PRO 63 CO 0.90 0.10 -0.05 0.10 -0.21 0.00 0.00 178.00 178.85 2w4m h TYR 64 N 0.16 0.00 0.00 0.65 -0.00 -2.03 -3.26 116.97 112.49 2w4m h TYR 64 Ca 0.29 0.00 -0.24 0.00 0.00 0.00 0.00 58.73 58.78 2w4m h TYR 64 Cb 0.93 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 37.61 2w4m h TYR 64 CO -0.00 0.05 -2.03 -1.71 -0.00 0.00 0.00 178.16 174.47 2w4m n ASN 65 N -4.09 1.12 -3.82 0.10 5.15 -0.07 -5.06 115.26 108.59 2w4m n ASN 65 Ca -0.03 0.00 -0.08 0.00 -0.60 0.00 0.00 54.58 53.88 2w4m n ASN 65 Cb 0.13 1.05 -0.02 0.00 -0.53 0.00 0.00 39.78 40.41 2w4m n ASN 65 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 2w4m s THR 66 N -2.52 0.00 0.42 -0.44 -1.32 -0.81 -5.10 115.64 105.87 2w4m s THR 66 Ca -0.07 -0.93 0.08 0.00 -1.21 0.00 0.00 61.69 59.55 2w4m s THR 66 Cb 0.06 -1.91 -0.02 0.00 -1.51 0.00 0.00 72.50 69.12 2w4m s THR 66 CO 0.66 -0.00 0.35 0.00 -2.21 0.00 0.00 174.62 173.41 2w4m h ILE 68 N 1.07 1.30 -0.85 0.00 6.09 -1.97 -2.44 117.51 120.70 2w4m h ILE 68 Ca -0.41 -1.53 -0.03 0.00 -1.37 0.00 0.00 64.86 61.52 2w4m h ILE 68 Cb 1.27 1.57 -0.04 0.00 0.47 0.00 0.00 36.82 40.09 2w4m h ILE 68 CO 0.59 0.48 0.41 0.74 -3.07 0.00 0.00 178.15 177.30 2w4m h THR 69 N 0.39 1.26 -0.39 2.19 2.02 -1.99 -1.57 112.91 114.82 2w4m h THR 69 Ca 0.04 -0.72 -0.11 0.00 0.77 0.00 0.00 66.41 66.39 2w4m h THR 69 Cb 0.86 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 2w4m h THR 69 CO 0.07 0.31 -0.17 0.44 0.37 0.00 0.00 175.52 176.54 2w4m h ASP 70 N 1.21 0.83 -0.51 4.18 3.32 -1.86 -1.10 116.42 122.48 2w4m h ASP 70 Ca 0.29 -0.40 -0.02 0.00 0.02 0.00 0.00 57.03 56.93 2w4m h ASP 70 Cb 0.11 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 2w4m h ASP 70 CO -0.04 1.04 0.24 0.25 -1.72 0.00 0.00 179.24 179.01 2w4m h LEU 71 N 0.61 0.67 -0.48 1.55 5.85 -1.20 -1.31 115.31 121.01 2w4m h LEU 71 Ca 0.09 -0.13 -0.17 0.00 0.84 0.00 0.00 57.88 58.51 2w4m h LEU 71 Cb 0.72 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 2w4m h LEU 71 CO 0.05 0.61 -0.76 0.03 -0.34 0.00 0.00 178.44 178.04 2w4m h ARG 72 N 0.68 0.09 -0.28 1.25 3.08 -1.25 -1.21 114.38 116.74 2w4m h ARG 72 Ca 0.17 -0.08 -0.09 0.00 0.07 0.00 0.00 59.98 60.05 2w4m h ARG 72 Cb 0.12 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 2w4m h ARG 72 CO -0.02 0.80 -0.22 1.15 -1.07 0.00 0.00 179.97 180.61 2w4m h THR 73 N 0.05 1.26 -0.45 2.04 2.02 -1.06 -2.72 112.91 114.05 2w4m h THR 73 Ca -0.02 -1.22 -0.11 0.00 0.77 0.00 0.00 66.41 65.83 2w4m h THR 73 Cb 1.33 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 69.01 2w4m h THR 73 CO 0.11 0.39 -0.15 0.28 0.37 0.00 0.00 175.52 176.52 2w4m h SER 74 N 0.47 0.86 -0.35 4.18 0.02 -0.40 -0.89 113.55 117.44 2w4m h SER 74 Ca 0.07 -0.29 0.07 0.00 -0.84 0.00 0.00 61.79 60.81 2w4m h SER 74 Cb 0.64 -0.23 -0.09 0.00 0.14 0.00 0.00 62.40 62.86 2w4m h SER 74 CO 0.05 1.01 -0.32 0.45 -1.14 0.00 0.00 176.83 176.88 2w4m h HIS 75 N 0.76 -0.88 -0.98 3.45 -0.00 -0.94 0.17 115.15 116.73 2w4m h HIS 75 Ca 0.12 0.05 0.02 0.00 -0.00 0.00 0.00 60.37 60.56 2w4m h HIS 75 Cb 0.67 0.44 -0.05 0.00 -0.00 0.00 0.00 27.41 28.47 2w4m h HIS 75 CO 0.04 -0.38 0.65 -1.49 -0.00 0.00 0.00 177.93 176.75 2w4m h TRP 76 N -0.27 1.22 -0.43 2.45 4.06 -1.30 -0.68 115.95 121.00 2w4m h TRP 76 Ca 0.16 0.03 -0.07 0.00 2.06 0.00 0.00 58.89 61.07 2w4m h TRP 76 Cb 0.53 -0.41 -0.02 0.00 -1.00 0.00 0.00 29.16 28.27 2w4m h TRP 76 CO -0.51 0.75 -0.02 1.49 -3.56 0.00 0.00 178.44 176.59 2w4m h GLU 77 N 1.30 0.77 0.05 0.49 4.81 0.00 -0.56 114.58 121.45 2w4m h GLU 77 Ca 0.37 -0.25 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 2w4m h GLU 77 Cb -0.10 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.21 2w4m h GLU 77 CO -0.09 0.85 -0.03 0.93 -0.73 0.00 0.00 179.01 179.94 2w4m h GLU 78 N 0.60 -0.07 -0.99 1.92 5.08 -0.47 -2.27 114.58 118.38 2w4m h GLU 78 Ca 0.12 0.00 0.17 0.00 -1.00 0.00 0.00 59.36 58.66 2w4m h GLU 78 Cb 0.51 0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.68 2w4m h GLU 78 CO 0.03 0.18 0.62 0.00 -1.00 0.00 0.00 179.01 178.84 2w4m h ALA 79 N 0.61 1.69 0.03 3.43 0.00 -0.88 0.45 119.26 124.59 2w4m h ALA 79 Ca -0.01 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2w4m h ALA 79 Cb 0.29 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2w4m h ALA 79 CO 0.01 -0.02 -0.02 0.82 0.00 0.00 0.00 179.25 180.05 2w4m h ILE 80 N 0.79 1.23 -0.17 0.00 2.04 -0.96 -1.44 117.51 119.00 2w4m h ILE 80 Ca 0.55 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 2w4m h ILE 80 Cb 0.82 1.78 -0.01 0.00 -0.74 0.00 0.00 36.82 38.67 2w4m h ILE 80 CO -0.33 0.21 0.07 -0.61 0.00 0.00 0.00 178.15 177.49 2w4m h GLN 81 N -0.41 0.26 -0.89 2.37 4.15 -0.72 0.31 115.11 120.18 2w4m h GLN 81 Ca -0.00 -0.05 0.24 0.00 0.77 0.00 0.00 58.65 59.61 2w4m h GLN 81 Cb 0.38 -0.04 -0.14 0.00 0.21 0.00 0.00 27.48 27.89 2w4m h GLN 81 CO 0.01 0.34 0.31 0.93 -1.93 0.00 0.00 178.83 178.48 2w4m h GLU 82 N 0.12 0.26 0.04 1.69 5.08 -0.14 0.28 114.58 121.91 2w4m h GLU 82 Ca 0.06 -0.02 -0.22 0.00 -1.00 0.00 0.00 59.36 58.18 2w4m h GLU 82 Cb 0.17 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2w4m h GLU 82 CO -0.00 0.17 -1.19 1.15 -1.00 0.00 0.00 179.01 178.14 2w4m h THR 83 N 0.27 1.03 -0.02 1.13 2.02 -0.50 -3.39 112.91 113.45 2w4m h THR 83 Ca 0.57 -2.27 0.00 0.00 0.77 0.00 0.00 66.41 65.48 2w4m h THR 83 Cb 1.14 2.52 0.00 0.00 -1.74 0.00 0.00 68.15 70.07 2w4m h THR 83 CO -0.61 0.50 -0.21 0.29 0.37 0.00 0.00 175.52 175.86 2w4m n LYS 84 N -4.25 1.58 -0.30 6.66 5.02 0.10 -5.09 118.16 121.89 2w4m n LYS 84 Ca -0.27 -1.17 0.04 0.00 -2.02 0.00 0.00 58.31 54.88 2w4m n LYS 84 Cb 0.74 -1.33 -0.01 0.00 -0.02 0.00 0.00 35.03 34.41 2w4m n LYS 84 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2w4m n GLY 85 N 1.13 -1.34 2.94 0.72 0.00 0.96 -4.99 105.19 104.61 2w4m n GLY 85 Ca 0.09 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 45.00 2w4m n GLY 85 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w4m n GLY 86 N -0.92 -1.75 3.79 -0.02 0.00 -1.26 -4.69 105.19 100.33 2w4m n GLY 86 Ca 0.00 -1.72 -0.37 0.00 0.00 0.00 0.00 46.02 43.93 2w4m n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w4m s ALA 87 N -1.58 3.21 0.17 4.61 0.00 -1.26 -4.98 121.76 121.93 2w4m s ALA 87 Ca 0.00 0.49 -0.33 0.00 0.00 0.00 0.00 51.96 52.12 2w4m s ALA 87 Cb 0.00 -3.16 -0.16 0.00 0.00 0.00 0.00 23.12 19.81 2w4m s ALA 87 CO 0.00 0.18 1.16 0.00 0.00 0.00 0.00 175.76 177.10 2w4m n ALA 88 N 0.46 -0.77 -3.75 0.00 0.00 -1.26 -4.92 120.51 110.28 2w4m n ALA 88 Ca 0.02 0.46 -0.28 0.00 0.00 0.00 0.00 53.44 53.64 2w4m n ALA 88 Cb 0.50 -2.03 -0.12 0.00 0.00 0.00 0.00 19.45 17.81 2w4m n ALA 88 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2w4m s ASN 89 N -0.01 3.75 0.29 0.00 3.84 -1.26 -4.97 114.94 116.58 2w4m s ASN 89 Ca 0.73 -3.31 -0.02 0.00 0.21 0.00 0.00 52.86 50.47 2w4m s ASN 89 Cb -0.85 -1.23 0.43 0.00 -0.55 0.00 0.00 41.25 39.05 2w4m s ASN 89 CO 0.52 -0.16 1.94 -0.09 -2.79 0.00 0.00 177.10 176.52 2w4m h ARG 90 N 5.87 1.04 -0.61 0.43 9.65 -1.95 -1.73 114.38 127.09 2w4m h ARG 90 Ca 0.11 -0.09 -0.09 0.00 -1.10 0.00 0.00 59.98 58.81 2w4m h ARG 90 Cb 0.84 -0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 29.18 2w4m h ARG 90 CO 0.58 0.73 0.03 0.87 2.80 0.00 0.00 179.97 184.98 2w4m h LYS 91 N 1.06 1.05 -0.42 0.20 6.56 -1.99 0.69 116.57 123.73 2w4m h LYS 91 Ca 0.28 -0.32 -0.11 0.00 -1.06 0.00 0.00 60.65 59.43 2w4m h LYS 91 Cb -0.04 -0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 31.50 2w4m h LYS 91 CO -0.05 1.02 -0.20 1.25 -2.06 0.00 0.00 179.45 179.41 2w4m h LEU 92 N 0.95 0.83 -0.41 2.94 5.85 -1.91 -0.89 115.31 122.66 2w4m h LEU 92 Ca 0.18 -0.29 0.06 0.00 0.84 0.00 0.00 57.88 58.67 2w4m h LEU 92 Cb 0.52 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.27 2w4m h LEU 92 CO 0.03 1.01 0.08 0.00 -0.34 0.00 0.00 178.44 179.22 2w4m h ALA 93 N 1.06 0.45 -0.51 1.25 0.00 -0.55 -1.12 119.26 119.83 2w4m h ALA 93 Ca 0.10 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 2w4m h ALA 93 Cb 0.72 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 2w4m h ALA 93 CO 0.06 -0.32 0.20 0.93 0.00 0.00 0.00 179.25 180.12 2w4m h GLU 94 N 0.22 0.77 -0.74 0.00 5.08 -0.49 -0.27 114.58 119.15 2w4m h GLU 94 Ca 0.20 -0.14 0.06 0.00 -1.00 0.00 0.00 59.36 58.47 2w4m h GLU 94 Cb 0.24 -0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.31 2w4m h GLU 94 CO -0.26 0.69 0.43 1.49 -1.00 0.00 0.00 179.01 180.36 2w4m h GLU 95 N 0.69 0.77 0.25 2.33 4.81 -0.66 -0.16 114.58 122.61 2w4m h GLU 95 Ca 0.17 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 2w4m h GLU 95 Cb 0.21 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.42 2w4m h GLU 95 CO -0.01 0.51 -0.12 0.00 -0.73 0.00 0.00 179.01 178.66 2w4m h TYR 97 N -0.70 0.81 -0.00 0.00 3.20 -0.79 0.09 116.97 119.58 2w4m h TYR 97 Ca -0.03 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.70 2w4m h TYR 97 Cb 0.48 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 2w4m h TYR 97 CO 0.03 0.30 -0.79 0.74 -1.64 0.00 0.00 178.16 176.79 2w4m h PHE 98 N 0.73 0.04 -0.53 -3.82 0.04 -1.04 -0.37 116.94 111.98 2w4m h PHE 98 Ca 0.41 -0.02 -0.12 0.00 2.80 0.00 0.00 57.97 61.03 2w4m h PHE 98 Cb 0.43 -0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.56 2w4m h PHE 98 CO -0.07 0.81 -0.14 1.25 -0.60 0.00 0.00 178.31 179.55 2w4m h LEU 99 N 0.01 1.04 -0.32 1.54 5.85 -0.72 -0.70 115.31 122.02 2w4m h LEU 99 Ca -0.01 -0.36 -0.01 0.00 0.84 0.00 0.00 57.88 58.33 2w4m h LEU 99 Cb 1.40 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 2w4m h LEU 99 CO 0.11 1.17 0.15 -0.25 -0.34 0.00 0.00 178.44 179.27 2w4m h TRP 100 N 0.91 0.48 -0.17 1.25 7.01 -0.78 -1.65 115.95 123.00 2w4m h TRP 100 Ca 0.13 -0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.06 2w4m h TRP 100 Cb 0.72 -0.15 -0.00 0.00 -2.10 0.00 0.00 29.16 27.63 2w4m h TRP 100 CO 0.05 0.43 -0.09 -0.22 -2.79 0.00 0.00 178.44 175.82 2w4m h LYS 101 N 0.38 0.36 -0.59 2.65 3.64 -0.87 -1.69 116.57 120.45 2w4m h LYS 101 Ca 0.11 -0.16 -0.10 0.00 -1.27 0.00 0.00 60.65 59.23 2w4m h LYS 101 Cb 0.14 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 2w4m h LYS 101 CO -0.01 0.67 -0.03 0.66 -2.27 0.00 0.00 179.45 178.48 2w4m h SER 102 N 0.03 1.03 -0.15 4.20 4.64 -1.15 -1.57 113.55 120.58 2w4m h SER 102 Ca 0.04 -0.30 -0.01 0.00 -0.47 0.00 0.00 61.79 61.04 2w4m h SER 102 Cb 0.57 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 2w4m h SER 102 CO 0.03 1.09 0.04 0.74 -0.87 0.00 0.00 176.83 177.86 2w4m h THR 103 N 0.95 1.20 -0.15 2.95 2.02 -1.19 -1.00 112.91 117.69 2w4m h THR 103 Ca 0.16 -0.62 -0.11 0.00 0.77 0.00 0.00 66.41 66.61 2w4m h THR 103 Cb 0.58 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 68.32 2w4m h THR 103 CO 0.03 0.19 -0.39 0.08 0.37 0.00 0.00 175.52 175.81 2w4m h ARG 104 N 0.04 0.32 -0.34 6.66 0.11 -1.16 -2.16 114.38 117.85 2w4m h ARG 104 Ca 0.05 -0.15 -0.17 0.00 0.10 0.00 0.00 59.98 59.81 2w4m h ARG 104 Cb 0.26 -0.01 -0.00 0.00 1.11 0.00 0.00 29.97 31.33 2w4m h ARG 104 CO 0.00 0.66 -0.46 -0.07 0.10 0.00 0.00 179.97 180.21 2w4m h LEU 105 N 0.27 0.99 -0.88 0.08 3.38 -1.18 -2.17 115.31 115.80 2w4m h LEU 105 Ca 0.03 -0.50 0.17 0.00 0.09 0.00 0.00 57.88 57.68 2w4m h LEU 105 Cb 0.80 -0.28 -0.10 0.00 0.09 0.00 0.00 40.66 41.17 2w4m h LEU 105 CO 0.06 1.29 0.45 -0.61 0.09 0.00 0.00 178.44 179.73 2w4m h GLN 106 N 0.72 0.56 -0.55 1.13 4.15 -0.80 -2.64 115.11 117.68 2w4m h GLN 106 Ca 0.04 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2w4m h GLN 106 Cb 1.06 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.62 2w4m h GLN 106 CO 0.11 0.37 0.00 0.72 -1.93 0.00 0.00 178.83 178.10 2w4m n HIS 107 N -4.91 0.73 -3.27 3.99 8.25 -0.85 -4.78 115.22 114.39 2w4m n HIS 107 Ca 0.19 -0.37 -0.42 0.00 -0.26 0.00 0.00 57.72 56.87 2w4m n HIS 107 Cb 0.52 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.55 2w4m n HIS 107 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2w4m s MET 108 N -1.27 3.47 -0.08 -0.41 -1.94 -0.86 -4.73 119.30 113.48 2w4m s MET 108 Ca 0.41 -0.34 -0.08 0.00 -1.71 0.00 0.00 55.69 53.96 2w4m s MET 108 Cb 0.22 -3.85 0.02 0.00 2.01 0.00 0.00 34.83 33.23 2w4m s MET 108 CO 0.29 -0.71 0.23 0.99 -0.01 0.00 0.00 175.02 175.82 2w4m s THR 109 N 2.33 0.00 0.04 2.05 2.01 -1.26 -3.49 115.64 117.33 2w4m s THR 109 Ca 0.17 -0.03 -0.29 0.00 0.31 0.00 0.00 61.69 61.84 2w4m s THR 109 Cb -0.16 -0.34 -0.04 0.00 0.01 0.00 0.00 72.50 71.97 2w4m s THR 109 CO 0.14 -0.02 0.95 -0.76 -0.69 0.00 0.00 174.62 174.24 2w4m s LEU 110 N 0.05 4.42 0.56 4.42 1.43 -1.26 -4.61 118.68 123.69 2w4m s LEU 110 Ca -0.01 1.68 -0.20 0.00 -1.03 0.00 0.00 54.13 54.57 2w4m s LEU 110 Cb -0.02 -3.54 -0.05 0.00 0.03 0.00 0.00 46.19 42.62 2w4m s LEU 110 CO 0.00 -0.16 1.20 0.00 0.23 0.00 0.00 176.35 177.62 2w4m s ALA 111 N 0.55 2.67 0.25 4.21 0.00 -1.26 -4.80 121.76 123.38 2w4m s ALA 111 Ca 0.49 0.99 -0.03 0.00 0.00 0.00 0.00 51.96 53.41 2w4m s ALA 111 Cb -0.22 -3.43 0.50 0.00 0.00 0.00 0.00 23.12 19.96 2w4m s ALA 111 CO 0.28 -1.03 1.72 0.93 0.00 0.00 0.00 175.76 177.66 2w4m h GLU 112 N 1.18 0.40 -0.23 0.00 4.39 -1.99 0.13 114.58 118.47 2w4m h GLU 112 Ca -0.50 -0.02 -0.10 0.00 0.34 0.00 0.00 59.36 59.08 2w4m h GLU 112 Cb 1.28 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.83 2w4m h GLU 112 CO 0.56 0.27 -0.27 0.38 -1.16 0.00 0.00 179.01 178.79 2w4m h ASP 113 N 0.41 0.45 -0.41 1.42 2.03 -1.99 0.81 116.42 119.14 2w4m h ASP 113 Ca 0.44 -0.15 -0.11 0.00 -0.73 0.00 0.00 57.03 56.47 2w4m h ASP 113 Cb 0.70 -0.12 -0.01 0.00 -0.83 0.00 0.00 39.33 39.06 2w4m h ASP 113 CO -0.44 0.71 -0.17 0.58 -1.03 0.00 0.00 179.24 178.89 2w4m h VAL 114 N 0.39 1.28 -0.13 4.15 2.07 -1.58 -0.87 116.25 121.55 2w4m h VAL 114 Ca 0.06 -1.30 0.03 0.00 0.82 0.00 0.00 66.70 66.30 2w4m h VAL 114 Cb 0.68 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 2w4m h VAL 114 CO 0.05 0.44 -0.05 0.11 0.02 0.00 0.00 177.57 178.14 2w4m h LYS 115 N 0.65 -0.03 -0.79 1.57 1.57 -0.42 -1.03 116.57 118.10 2w4m h LYS 115 Ca 0.09 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.97 2w4m h LYS 115 Cb 0.72 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.97 2w4m h LYS 115 CO 0.05 -0.02 0.44 0.00 -0.57 0.00 0.00 179.45 179.35 2w4m h ALA 116 N 1.10 1.11 0.69 3.86 0.00 -0.67 -1.93 119.26 123.43 2w4m h ALA 116 Ca 0.07 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2w4m h ALA 116 Cb 0.13 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.82 2w4m h ALA 116 CO -0.15 0.06 -0.33 1.98 0.00 0.00 0.00 179.25 180.80 2w4m h MET 117 N 0.73 -0.89 -1.17 0.00 1.85 -0.70 -2.60 114.93 112.16 2w4m h MET 117 Ca 0.38 0.06 0.33 0.00 -0.61 0.00 0.00 59.70 59.86 2w4m h MET 117 Cb 0.36 0.20 -0.09 0.00 0.43 0.00 0.00 31.60 32.51 2w4m h MET 117 CO -0.25 -0.58 0.78 -0.07 -0.40 0.00 0.00 176.91 176.39 2w4m h LEU 118 N -1.21 0.27 -0.31 3.39 3.38 -0.98 0.78 115.31 120.63 2w4m h LEU 118 Ca -0.09 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2w4m h LEU 118 Cb 0.73 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 2w4m h LEU 118 CO 0.16 0.01 0.08 0.74 0.09 0.00 0.00 178.44 179.51 2w4m h THR 119 N 0.21 1.22 0.22 0.22 2.02 -1.27 -2.58 112.91 112.96 2w4m h THR 119 Ca 0.64 -0.73 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 2w4m h THR 119 Cb 2.00 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 69.52 2w4m h THR 119 CO -0.23 0.24 -0.11 -0.08 0.37 0.00 0.00 175.52 175.71 2w4m h GLU 120 N 0.34 -0.28 -1.00 6.66 4.22 0.91 -2.97 114.58 122.45 2w4m h GLU 120 Ca 0.10 0.02 0.09 0.00 0.08 0.00 0.00 59.36 59.64 2w4m h GLU 120 Cb 0.29 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.53 2w4m h GLU 120 CO 0.00 -0.15 0.64 -0.07 -2.18 0.00 0.00 179.01 177.26 2w4m h LEU 121 N -0.35 0.99 -1.60 1.64 3.38 -1.19 -1.97 115.31 116.21 2w4m h LEU 121 Ca -0.03 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2w4m h LEU 121 Cb 0.27 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2w4m h LEU 121 CO 0.05 0.60 -0.22 -0.09 0.09 0.00 0.00 178.44 178.87 2w4m h ARG 122 N 1.10 0.00 -0.42 1.13 2.43 -1.30 0.22 114.38 117.55 2w4m h ARG 122 Ca 0.45 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.69 2w4m h ARG 122 Cb 0.29 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 2w4m h ARG 122 CO -0.20 0.22 0.28 0.87 -1.51 0.00 0.00 179.97 179.63 2w4m h LYS 123 N 0.00 0.26 0.00 0.20 1.57 -1.29 -3.29 116.57 114.01 2w4m h LYS 123 Ca -0.00 -0.02 -0.17 0.00 -1.87 0.00 0.00 60.65 58.59 2w4m h LYS 123 Cb 0.44 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 2w4m h LYS 123 CO 0.03 0.17 -1.78 0.39 -0.57 0.00 0.00 179.45 177.69 2w4m n GLU 124 N -4.47 1.65 -4.11 3.15 1.02 -0.08 -5.05 120.64 112.74 2w4m n GLU 124 Ca 0.06 -0.03 -0.08 0.00 -0.02 0.00 0.00 57.16 57.08 2w4m n GLU 124 Cb 0.29 -1.31 -0.10 0.00 -0.02 0.00 0.00 31.44 30.30 2w4m n GLU 124 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2w4m s VAL 125 N -2.43 0.15 0.52 2.62 -7.23 0.59 -4.98 120.40 109.65 2w4m s VAL 125 Ca -0.06 -1.83 -0.19 0.00 -1.81 0.00 0.00 61.98 58.10 2w4m s VAL 125 Cb 0.05 -1.79 -0.07 0.00 0.56 0.00 0.00 36.38 35.13 2w4m s VAL 125 CO 0.51 -0.70 1.04 -0.13 -0.31 0.00 0.00 175.10 175.51 2w4m s ARG 126 N -3.98 3.66 -0.05 4.82 1.81 -0.50 -4.09 118.95 120.62 2w4m s ARG 126 Ca 0.16 1.28 0.02 0.00 -1.72 0.00 0.00 55.73 55.47 2w4m s ARG 126 Cb 0.07 -2.08 0.01 0.00 -0.45 0.00 0.00 34.95 32.51 2w4m s ARG 126 CO -0.04 -0.54 -0.10 -0.51 -0.68 0.00 0.00 175.30 173.43 2w4m s LEU 127 N -3.83 1.63 -0.02 2.53 1.43 -1.26 -1.38 118.68 117.77 2w4m s LEU 127 Ca 0.66 -0.24 0.02 0.00 -1.03 0.00 0.00 54.13 53.53 2w4m s LEU 127 Cb -0.16 -0.70 0.00 0.00 0.03 0.00 0.00 46.19 45.37 2w4m s LEU 127 CO 0.26 0.03 -0.07 -0.22 0.23 0.00 0.00 176.35 176.58 2w4m s LEU 128 N 0.58 1.79 -0.21 1.79 0.20 -0.82 -0.40 118.68 121.61 2w4m s LEU 128 Ca -0.11 -0.15 -0.14 0.00 0.69 0.00 0.00 54.13 54.42 2w4m s LEU 128 Cb -0.14 -0.44 -0.04 0.00 -0.43 0.00 0.00 46.19 45.14 2w4m s LEU 128 CO 0.02 0.05 0.34 -0.22 -0.29 0.00 0.00 176.35 176.25 2w4m s LEU 129 N 0.19 4.15 -0.26 -0.68 2.96 -0.89 -0.62 118.68 123.53 2w4m s LEU 129 Ca -0.02 0.42 0.01 0.00 -0.22 0.00 0.00 54.13 54.32 2w4m s LEU 129 Cb -0.07 -2.41 0.07 0.00 0.50 0.00 0.00 46.19 44.28 2w4m s LEU 129 CO 0.00 -0.03 -0.02 -0.22 -1.32 0.00 0.00 176.35 174.75 2w4m s LEU 130 N 1.20 2.89 -0.05 -0.68 2.96 0.63 -0.67 118.68 124.96 2w4m s LEU 130 Ca 0.16 -1.38 0.02 0.00 -0.22 0.00 0.00 54.13 52.72 2w4m s LEU 130 Cb -0.14 -1.23 0.01 0.00 0.50 0.00 0.00 46.19 45.33 2w4m s LEU 130 CO 0.07 -0.27 -0.11 0.28 -1.32 0.00 0.00 176.35 175.00 2w4m s THR 131 N 1.33 1.00 0.59 3.68 -1.32 -0.44 -4.19 115.64 116.29 2w4m s THR 131 Ca -0.02 -0.43 -0.12 0.00 -1.21 0.00 0.00 61.69 59.92 2w4m s THR 131 Cb -0.19 -0.92 -0.05 0.00 -1.51 0.00 0.00 72.50 69.84 2w4m s THR 131 CO -0.08 0.32 1.00 0.20 -2.21 0.00 0.00 174.62 173.85 2w4m s ASN 132 N 0.54 6.33 0.00 8.08 -0.87 -1.26 0.32 114.94 128.07 2w4m s ASN 132 Ca -0.11 1.43 0.00 0.00 -1.57 0.00 0.00 52.86 52.61 2w4m s ASN 132 Cb -0.14 -2.47 0.00 0.00 -0.02 0.00 0.00 41.25 38.63 2w4m s ASN 132 CO 0.02 -0.78 0.00 0.61 -2.57 0.00 0.00 177.10 174.38 2w4m n GLY 133 N -2.43 2.66 3.77 0.66 0.00 -1.26 -4.73 105.19 103.85 2w4m n GLY 133 Ca 0.06 -2.12 -0.36 0.00 0.00 0.00 0.00 46.02 43.60 2w4m n GLY 133 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2w4m s ASP 134 N 0.00 5.90 0.16 1.61 1.47 -1.26 -0.48 116.67 124.07 2w4m s ASP 134 Ca 0.00 2.26 -0.28 0.00 1.18 0.00 0.00 52.55 55.71 2w4m s ASP 134 Cb 0.00 -2.59 -0.01 0.00 -0.34 0.00 0.00 42.92 39.98 2w4m s ASP 134 CO 0.00 -1.10 1.56 -0.09 0.68 0.00 0.00 175.17 176.22 2w4m h ARG 135 N 1.58 -0.22 -0.06 2.11 2.43 -1.94 -1.71 114.38 116.57 2w4m h ARG 135 Ca -0.50 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 58.68 2w4m h ARG 135 Cb 1.26 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.86 2w4m h ARG 135 CO 0.58 -0.15 0.02 0.37 -1.51 0.00 0.00 179.97 179.28 2w4m h GLN 136 N -0.23 0.09 -0.33 0.20 4.15 -1.99 -0.82 115.11 116.19 2w4m h GLN 136 Ca 0.15 -0.02 -0.00 0.00 0.77 0.00 0.00 58.65 59.55 2w4m h GLN 136 Cb 0.55 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.21 2w4m h GLN 136 CO -0.72 0.28 0.19 1.15 -1.93 0.00 0.00 178.83 177.81 2w4m h THR 137 N -0.11 1.12 -0.35 2.39 2.02 -1.88 -0.14 112.91 115.95 2w4m h THR 137 Ca 0.02 -0.30 -0.11 0.00 0.77 0.00 0.00 66.41 66.79 2w4m h THR 137 Cb 0.23 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 2w4m h THR 137 CO -0.00 0.12 -0.23 1.56 0.37 0.00 0.00 175.52 177.35 2w4m h GLN 138 N 0.42 0.77 -0.53 6.66 1.08 -1.26 -1.77 115.11 120.49 2w4m h GLN 138 Ca 0.12 -0.36 -0.05 0.00 -1.45 0.00 0.00 58.65 56.90 2w4m h GLN 138 Cb 0.03 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.42 2w4m h GLN 138 CO -0.02 0.98 0.11 0.00 -0.95 0.00 0.00 178.83 178.95 2w4m h ARG 139 N 0.56 0.82 -0.94 1.46 2.47 -0.98 0.17 114.38 117.93 2w4m h ARG 139 Ca 0.07 -0.18 -0.00 0.00 -1.26 0.00 0.00 59.98 58.61 2w4m h ARG 139 Cb 0.78 -0.12 -0.05 0.00 -1.65 0.00 0.00 29.97 28.94 2w4m h ARG 139 CO 0.06 0.76 0.58 0.93 0.56 0.00 0.00 179.97 182.86 2w4m h GLU 140 N 0.79 1.27 -0.00 0.04 5.08 -0.81 -1.37 114.58 119.57 2w4m h GLU 140 Ca 0.17 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2w4m h GLU 140 Cb 0.32 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2w4m h GLU 140 CO 0.00 0.87 -0.00 0.87 -1.00 0.00 0.00 179.01 179.76 2w4m h LYS 141 N 1.29 0.01 -0.89 2.33 1.57 -0.38 0.16 116.57 120.66 2w4m h LYS 141 Ca 0.34 -0.00 0.15 0.00 -1.87 0.00 0.00 60.65 59.27 2w4m h LYS 141 Cb -0.08 -0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.13 2w4m h LYS 141 CO -0.07 0.34 0.48 0.82 -0.57 0.00 0.00 179.45 180.46 2w4m h ILE 142 N -0.33 0.73 -0.27 1.86 2.04 -0.57 -1.39 117.51 119.58 2w4m h ILE 142 Ca 0.00 -0.23 -0.12 0.00 1.00 0.00 0.00 64.86 65.51 2w4m h ILE 142 Cb 0.34 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.42 2w4m h ILE 142 CO 0.00 0.12 -0.30 -0.08 0.00 0.00 0.00 178.15 177.89 2w4m h GLU 143 N 0.67 0.68 -1.00 2.37 4.81 -1.07 -2.52 114.58 118.53 2w4m h GLU 143 Ca 0.49 -0.37 0.11 0.00 -0.13 0.00 0.00 59.36 59.45 2w4m h GLU 143 Cb 0.70 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 30.02 2w4m h GLU 143 CO -0.36 0.98 0.64 0.00 -0.73 0.00 0.00 179.01 179.54 2w4m h ALA 144 N 0.69 1.50 -0.48 2.92 0.00 0.07 -1.20 119.26 122.76 2w4m h ALA 144 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2w4m h ALA 144 Cb 0.88 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2w4m h ALA 144 CO 0.07 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.60 2w4m n ALA 146 N 1.43 -1.25 0.76 0.00 0.00 -0.46 -4.35 120.51 116.65 2w4m n ALA 146 Ca 0.20 0.32 0.08 0.00 0.00 0.00 0.00 53.44 54.04 2w4m n ALA 146 Cb 0.58 -4.93 -0.07 0.00 0.00 0.00 0.00 19.45 15.04 2w4m n ALA 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2w4m h GLN 148 N 0.51 0.44 0.00 0.00 4.15 -1.89 -0.76 115.11 117.55 2w4m h GLN 148 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 2w4m h GLN 148 Cb 0.43 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.03 2w4m h GLN 148 CO 0.00 0.29 0.00 0.66 -1.93 0.00 0.00 178.83 177.85 2w4m h SER 149 N 0.45 0.00 0.51 -0.69 4.64 -1.96 -1.87 113.55 114.62 2w4m h SER 149 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2w4m h SER 149 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 2w4m h SER 149 CO -0.03 0.00 -0.06 -1.22 -0.87 0.00 0.00 176.83 174.65 2w4m n TYR 150 N -2.75 0.00 -4.36 4.77 4.01 -0.29 -4.90 117.16 113.64 2w4m n TYR 150 Ca -0.02 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.46 2w4m n TYR 150 Cb 0.09 -0.25 -0.12 0.00 -0.31 0.00 0.00 39.34 38.74 2w4m n TYR 150 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2w4m s PHE 151 N -2.57 2.09 -0.12 -0.72 0.08 -0.71 -4.88 117.98 111.16 2w4m s PHE 151 Ca 0.27 -0.40 0.17 0.00 0.12 0.00 0.00 56.93 57.09 2w4m s PHE 151 Cb 0.20 -1.10 0.21 0.00 -0.57 0.00 0.00 43.02 41.75 2w4m s PHE 151 CO 0.48 0.33 1.51 -0.44 -0.10 0.00 0.00 175.22 177.00 2w4m h ASP 152 N 3.72 0.00 -5.04 1.36 3.32 -1.02 -3.47 116.42 115.29 2w4m h ASP 152 Ca -0.47 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.55 2w4m h ASP 152 Cb 1.19 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.62 2w4m h ASP 152 CO 0.43 0.44 0.10 0.00 -1.72 0.00 0.00 179.24 178.49 2w4m s ALA 153 N -3.09 -1.27 -0.08 3.45 0.00 -1.19 -5.04 121.76 114.54 2w4m s ALA 153 Ca 0.03 0.15 -0.03 0.00 0.00 0.00 0.00 51.96 52.12 2w4m s ALA 153 Cb 0.08 0.83 0.04 0.00 0.00 0.00 0.00 23.12 24.07 2w4m s ALA 153 CO 0.73 -0.76 0.16 0.08 0.00 0.00 0.00 175.76 175.97 2w4m s VAL 154 N -3.80 -0.11 -0.05 0.00 1.01 -1.26 -2.09 120.40 114.10 2w4m s VAL 154 Ca 0.04 0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.26 2w4m s VAL 154 Cb -0.01 -0.28 0.02 0.00 0.00 0.00 0.00 36.38 36.11 2w4m s VAL 154 CO -0.09 0.09 -0.08 -0.69 0.00 0.00 0.00 175.10 174.33 2w4m s VAL 155 N 1.48 0.81 -0.16 2.92 1.01 0.16 -4.96 120.40 121.66 2w4m s VAL 155 Ca -0.06 -0.30 0.01 0.00 0.00 0.00 0.00 61.98 61.63 2w4m s VAL 155 Cb -0.12 -0.77 0.01 0.00 0.00 0.00 0.00 36.38 35.49 2w4m s VAL 155 CO -0.06 0.28 -0.17 -0.69 0.00 0.00 0.00 175.10 174.46 2w4m s VAL 156 N 0.72 2.43 0.30 2.92 1.01 -1.26 -1.33 120.40 125.19 2w4m s VAL 156 Ca -0.12 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.00 2w4m s VAL 156 Cb -0.15 -2.02 0.26 0.00 0.00 0.00 0.00 36.38 34.48 2w4m s VAL 156 CO 0.02 0.52 1.96 1.23 0.00 0.00 0.00 175.10 178.84 2w4m h GLY 157 N 7.50 1.18 2.00 4.51 0.00 -0.29 -0.71 103.07 117.26 2w4m h GLY 157 Ca -0.36 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.54 2w4m h GLY 157 CO 0.58 0.42 0.00 -1.33 0.00 0.00 0.00 176.54 176.21 2w4m h GLY 158 N 1.12 0.00 0.92 4.60 0.00 -1.03 -0.94 103.07 107.74 2w4m h GLY 158 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.64 2w4m h GLY 158 CO -0.07 0.00 -0.58 1.18 0.00 0.00 0.00 176.54 177.07 2w4m n GLU 159 N -2.88 0.04 -3.75 4.80 1.02 -0.28 -4.64 120.64 114.95 2w4m n GLU 159 Ca -0.02 0.01 -0.23 0.00 -0.02 0.00 0.00 57.16 56.90 2w4m n GLU 159 Cb 0.09 -1.52 -0.03 0.00 -0.02 0.00 0.00 31.44 29.95 2w4m n GLU 159 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2w4m s GLN 160 N -3.03 2.39 0.21 3.49 -1.52 -0.36 -5.03 119.66 115.82 2w4m s GLN 160 Ca 0.10 -1.73 0.11 0.00 -1.95 0.00 0.00 55.36 51.89 2w4m s GLN 160 Cb 0.17 -2.23 0.04 0.00 -0.22 0.00 0.00 33.01 30.77 2w4m s GLN 160 CO 0.72 -0.30 1.42 0.07 -0.25 0.00 0.00 175.29 176.94 2w4m h ARG 161 N 1.02 0.00 -4.52 2.91 0.11 -1.93 -3.45 114.38 108.53 2w4m h ARG 161 Ca -0.40 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.49 2w4m h ARG 161 Cb 1.27 0.00 -0.15 0.00 1.11 0.00 0.00 29.97 32.20 2w4m h ARG 161 CO 0.60 0.74 -0.69 -1.21 0.10 0.00 0.00 179.97 179.50 2w4m s GLU 162 N -2.99 0.75 0.31 0.08 2.02 -1.26 -5.14 118.70 112.46 2w4m s GLU 162 Ca 0.01 -1.28 0.00 0.00 0.02 0.00 0.00 54.97 53.73 2w4m s GLU 162 Cb 0.10 -0.08 0.00 0.00 0.10 0.00 0.00 34.13 34.26 2w4m s GLU 162 CO 0.78 -0.05 0.03 -0.85 0.02 0.00 0.00 175.26 175.19 2w4m n GLU 163 N 0.06 1.23 -1.74 1.61 0.28 -1.26 -4.53 120.64 116.28 2w4m n GLU 163 Ca -0.13 -2.20 -0.42 0.00 -0.16 0.00 0.00 57.16 54.25 2w4m n GLU 163 Cb 0.61 0.54 -0.02 0.00 1.43 0.00 0.00 31.44 34.01 2w4m n GLU 163 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2w4m n LYS 164 N -0.83 2.66 -0.78 3.44 5.02 -1.26 -0.53 118.16 125.89 2w4m n LYS 164 Ca -0.11 0.95 0.08 0.00 -2.02 0.00 0.00 58.31 57.20 2w4m n LYS 164 Cb 0.38 -2.72 0.38 0.00 -0.02 0.00 0.00 35.03 33.05 2w4m n LYS 164 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2w4m n PRO 165 N 2.11 4.41 -1.72 1.97 -0.04 -1.26 -4.83 135.00 135.64 2w4m n PRO 165 Ca 0.09 -3.06 -0.43 0.00 -0.04 0.00 0.00 63.50 60.06 2w4m n PRO 165 Cb 0.36 -2.13 -0.02 0.00 -0.04 0.00 0.00 33.50 31.68 2w4m n PRO 165 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2w4m n ALA 166 N 0.61 2.10 0.18 0.55 0.00 0.31 -4.15 120.51 120.12 2w4m n ALA 166 Ca 0.27 0.39 0.05 0.00 0.00 0.00 0.00 53.44 54.14 2w4m n ALA 166 Cb 1.09 -2.41 0.32 0.00 0.00 0.00 0.00 19.45 18.46 2w4m n ALA 166 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2w4m h PRO 167 N 4.83 0.00 -1.09 0.00 0.13 -1.86 -3.19 132.00 130.81 2w4m h PRO 167 Ca -0.46 0.00 0.33 0.00 -0.87 0.00 0.00 66.00 65.00 2w4m h PRO 167 Cb 1.24 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.24 2w4m h PRO 167 CO 0.80 0.40 0.66 0.66 -0.23 0.00 0.00 178.00 180.29 2w4m h SER 168 N 0.00 0.45 0.15 1.44 4.64 -1.93 0.24 113.55 118.54 2w4m h SER 168 Ca -0.00 0.14 -0.17 0.00 -0.47 0.00 0.00 61.79 61.29 2w4m h SER 168 Cb 0.90 0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.08 2w4m h SER 168 CO 0.05 -0.07 -0.62 -0.29 -0.87 0.00 0.00 176.83 175.04 2w4m h ILE 169 N 0.31 1.35 -0.53 0.95 2.10 -1.79 -0.83 117.51 119.08 2w4m h ILE 169 Ca 0.71 -1.93 -0.07 0.00 1.08 0.00 0.00 64.86 64.65 2w4m h ILE 169 Cb 1.80 1.92 -0.02 0.00 -1.09 0.00 0.00 36.82 39.43 2w4m h ILE 169 CO -0.47 0.59 0.06 -0.26 -1.08 0.00 0.00 178.15 176.99 2w4m h PHE 170 N 0.34 0.95 -0.58 2.19 -1.00 -0.74 -0.70 116.94 117.40 2w4m h PHE 170 Ca -0.01 -0.14 -0.09 0.00 2.81 0.00 0.00 57.97 60.54 2w4m h PHE 170 Cb 1.16 -0.26 -0.02 0.00 3.61 0.00 0.00 35.95 40.44 2w4m h PHE 170 CO 0.04 0.86 0.01 1.88 -1.61 0.00 0.00 178.31 179.49 2w4m h TYR 171 N 0.77 1.08 -0.55 -0.55 0.05 -1.02 -1.17 116.97 115.59 2w4m h TYR 171 Ca 0.16 -0.17 0.05 0.00 0.05 0.00 0.00 58.73 58.82 2w4m h TYR 171 Cb 0.44 -0.29 -0.05 0.00 1.01 0.00 0.00 36.73 37.84 2w4m h TYR 171 CO 0.03 0.96 0.27 -0.92 -1.05 0.00 0.00 178.16 177.45 2w4m h TYR 172 N 0.92 0.50 -0.71 4.88 3.20 -0.92 -1.14 116.97 123.70 2w4m h TYR 172 Ca 0.17 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.09 2w4m h TYR 172 Cb 0.52 -0.14 -0.05 0.00 1.54 0.00 0.00 36.73 38.60 2w4m h TYR 172 CO 0.03 0.23 0.44 0.00 -1.64 0.00 0.00 178.16 177.22 2w4m h ASN 175 N 0.66 0.94 -0.85 0.00 2.35 -1.00 0.26 115.58 117.93 2w4m h ASN 175 Ca 0.18 -0.23 0.15 0.00 -0.55 0.00 0.00 56.30 55.85 2w4m h ASN 175 Cb -0.01 -0.25 -0.10 0.00 0.05 0.00 0.00 38.32 38.01 2w4m h ASN 175 CO -0.03 0.92 0.43 -0.07 -1.65 0.00 0.00 177.43 177.02 2w4m h LEU 176 N 0.91 0.50 0.00 1.61 3.38 -0.80 -1.84 115.31 119.07 2w4m h LEU 176 Ca 0.20 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.27 2w4m h LEU 176 Cb 0.34 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2w4m h LEU 176 CO -0.00 0.20 -0.47 0.18 0.09 0.00 0.00 178.44 178.44 2w4m n LEU 177 N -4.89 0.47 -1.78 1.67 4.77 -0.85 -4.96 117.00 111.42 2w4m n LEU 177 Ca 0.17 0.04 -0.12 0.00 -0.03 0.00 0.00 56.01 56.08 2w4m n LEU 177 Cb 0.46 -0.27 0.02 0.00 -2.33 0.00 0.00 43.42 41.30 2w4m n LEU 177 CO 0.20 0.11 0.03 0.61 -1.33 0.00 0.00 177.39 177.01 2w4m n GLY 178 N 1.50 0.09 3.49 -0.72 0.00 0.81 -5.04 105.19 105.31 2w4m n GLY 178 Ca 0.06 -0.28 -0.23 0.00 0.00 0.00 0.00 46.02 45.56 2w4m n GLY 178 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2w4m s VAL 179 N -2.94 0.97 0.14 1.61 -7.23 -0.56 -5.02 120.40 107.37 2w4m s VAL 179 Ca 0.19 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.36 2w4m s VAL 179 Cb -0.08 -2.60 -0.04 0.00 0.56 0.00 0.00 36.38 34.21 2w4m s VAL 179 CO 0.24 0.00 0.30 -1.10 -0.31 0.00 0.00 175.10 174.23 2w4m s GLN 180 N -3.83 3.48 0.31 4.82 -1.52 -1.26 -4.33 119.66 117.33 2w4m s GLN 180 Ca 0.30 -0.43 0.02 0.00 -1.95 0.00 0.00 55.36 53.31 2w4m s GLN 180 Cb 0.06 -2.94 0.59 0.00 -0.22 0.00 0.00 33.01 30.50 2w4m s GLN 180 CO 0.14 0.51 1.90 -1.35 -0.25 0.00 0.00 175.29 176.24 2w4m h PRO 181 N 2.43 0.93 0.00 2.91 0.11 -1.89 -0.24 132.00 136.25 2w4m h PRO 181 Ca -0.47 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2w4m h PRO 181 Cb 1.18 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.08 2w4m h PRO 181 CO 0.71 0.62 0.00 0.41 -0.21 0.00 0.00 178.00 179.53 2w4m n GLY 182 N -1.40 -0.68 1.14 -0.55 0.00 -1.25 -1.54 105.19 100.91 2w4m n GLY 182 Ca 0.15 0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.36 2w4m n GLY 182 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2w4m n ASP 183 N -1.81 3.46 -4.31 1.61 8.00 -0.10 -4.07 116.55 119.33 2w4m n ASP 183 Ca -0.00 -1.98 -0.30 0.00 0.71 0.00 0.00 54.79 53.21 2w4m n ASP 183 Cb 0.03 -0.25 -0.15 0.00 -0.02 0.00 0.00 41.12 40.72 2w4m n ASP 183 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2w4m s VAL 185 N -0.70 2.70 -0.17 0.00 1.01 -0.71 -1.28 120.40 121.25 2w4m s VAL 185 Ca 0.10 -0.78 -0.15 0.00 0.00 0.00 0.00 61.98 61.16 2w4m s VAL 185 Cb -0.10 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 2w4m s VAL 185 CO 0.01 0.53 0.33 -0.32 0.00 0.00 0.00 175.10 175.64 2w4m s MET 186 N 0.46 4.24 -0.11 2.72 1.75 -0.45 -0.35 119.30 127.57 2w4m s MET 186 Ca -0.12 0.14 0.03 0.00 -1.25 0.00 0.00 55.69 54.49 2w4m s MET 186 Cb -0.16 -3.45 -0.00 0.00 2.84 0.00 0.00 34.83 34.05 2w4m s MET 186 CO 0.05 0.17 -0.21 0.08 -0.65 0.00 0.00 175.02 174.46 2w4m s VAL 187 N 0.68 2.35 -0.02 10.11 1.01 0.36 -0.76 120.40 134.13 2w4m s VAL 187 Ca 0.18 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 60.93 2w4m s VAL 187 Cb -0.14 -1.93 0.12 0.00 0.00 0.00 0.00 36.38 34.44 2w4m s VAL 187 CO 0.05 0.55 1.28 -0.83 0.00 0.00 0.00 175.10 176.15 2w4m s GLY 188 N 0.32 -0.41 0.00 4.51 0.00 -0.77 -1.49 107.32 109.48 2w4m s GLY 188 Ca -0.16 0.73 0.24 0.00 0.00 0.00 0.00 44.72 45.53 2w4m s GLY 188 CO 0.08 0.14 1.33 2.09 0.00 0.00 0.00 173.10 176.74 2w4m n ASP 189 N -0.47 3.17 -3.99 1.64 5.75 -1.26 -1.35 116.55 120.04 2w4m n ASP 189 Ca -0.08 -1.99 -0.30 0.00 -0.01 0.00 0.00 54.79 52.41 2w4m n ASP 189 Cb 0.63 -0.11 -0.16 0.00 -1.03 0.00 0.00 41.12 40.45 2w4m n ASP 189 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2w4m s THR 190 N -1.79 1.57 0.31 2.12 2.01 -1.26 -4.81 115.64 113.80 2w4m s THR 190 Ca 0.33 -0.89 -0.01 0.00 0.31 0.00 0.00 61.69 61.43 2w4m s THR 190 Cb 0.21 -1.62 0.27 0.00 0.01 0.00 0.00 72.50 71.37 2w4m s THR 190 CO 0.31 0.23 1.97 -0.07 -0.69 0.00 0.00 174.62 176.36 2w4m h LEU 191 N 8.01 0.90 0.00 4.42 3.38 -1.93 -1.54 115.31 128.54 2w4m h LEU 191 Ca -0.30 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2w4m h LEU 191 Cb 1.11 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2w4m h LEU 191 CO 0.48 0.64 -0.39 -1.84 0.09 0.00 0.00 178.44 177.42 2w4m n GLU 192 N -4.43 0.20 -0.01 1.13 0.00 -1.26 -1.27 120.64 115.00 2w4m n GLU 192 Ca 0.10 0.09 -0.02 0.00 0.00 0.00 0.00 57.16 57.32 2w4m n GLU 192 Cb 0.06 -1.66 -0.01 0.00 0.00 0.00 0.00 31.44 29.83 2w4m n GLU 192 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 2w4m n THR 193 N -1.97 0.64 0.41 3.84 -2.24 -1.08 -4.46 114.28 109.42 2w4m n THR 193 Ca 0.05 0.27 -0.17 0.00 -2.27 0.00 0.00 64.05 61.92 2w4m n THR 193 Cb 0.41 -1.62 -0.08 0.00 -2.10 0.00 0.00 70.33 66.93 2w4m n THR 193 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2w4m h ASP 194 N -0.26 -0.88 -0.06 3.42 3.32 -1.50 -1.11 116.42 119.35 2w4m h ASP 194 Ca 0.00 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 2w4m h ASP 194 Cb 0.26 0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.03 2w4m h ASP 194 CO 0.00 -0.55 -0.01 0.40 -1.72 0.00 0.00 179.24 177.36 2w4m h ILE 195 N -1.20 1.28 -0.76 0.35 1.08 -1.58 -1.91 117.51 114.78 2w4m h ILE 195 Ca -0.11 -0.86 -0.01 0.00 -0.39 0.00 0.00 64.86 63.49 2w4m h ILE 195 Cb 0.81 1.75 -0.04 0.00 -3.07 0.00 0.00 36.82 36.28 2w4m h ILE 195 CO 0.18 0.24 0.45 -0.61 -0.69 0.00 0.00 178.15 177.71 2w4m h GLN 196 N -0.22 1.04 -0.19 2.37 5.75 -1.29 -0.88 115.11 121.68 2w4m h GLN 196 Ca 0.01 -0.10 0.04 0.00 -0.15 0.00 0.00 58.65 58.45 2w4m h GLN 196 Cb 0.38 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 2w4m h GLN 196 CO 0.00 0.74 -0.04 0.78 -2.65 0.00 0.00 178.83 177.67 2w4m h GLY 197 N 1.04 0.14 0.08 2.39 0.00 -1.13 0.36 103.07 105.95 2w4m h GLY 197 Ca 0.27 0.05 0.09 0.00 0.00 0.00 0.00 47.33 47.75 2w4m h GLY 197 CO -0.05 -0.07 -0.12 -1.33 0.00 0.00 0.00 176.54 174.97 2w4m h GLY 198 N 0.01 0.30 0.96 4.60 0.00 -1.02 -0.39 103.07 107.54 2w4m h GLY 198 Ca 0.09 0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.58 2w4m h GLY 198 CO -0.19 -0.18 0.15 1.41 0.00 0.00 0.00 176.54 177.74 2w4m h LEU 199 N -0.01 0.33 -1.49 3.11 3.38 -0.54 -2.22 115.31 117.86 2w4m h LEU 199 Ca 0.22 -0.07 0.07 0.00 0.09 0.00 0.00 57.88 58.18 2w4m h LEU 199 Cb 0.34 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2w4m h LEU 199 CO -0.47 0.30 0.42 0.78 0.09 0.00 0.00 178.44 179.56 2w4m h ASN 200 N 0.32 0.55 0.01 -0.43 2.35 0.44 -2.54 115.58 116.28 2w4m h ASN 200 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 2w4m h ASN 200 Cb 0.04 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.29 2w4m h ASN 200 CO -0.02 0.35 -0.06 0.00 -1.65 0.00 0.00 177.43 176.06 2w4m n ALA 201 N -2.47 2.66 -2.44 -0.83 0.00 -0.23 -4.86 120.51 112.34 2w4m n ALA 201 Ca 0.09 -0.51 -0.11 0.00 0.00 0.00 0.00 53.44 52.91 2w4m n ALA 201 Cb 0.25 -1.06 0.01 0.00 0.00 0.00 0.00 19.45 18.64 2w4m n ALA 201 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2w4m n GLY 202 N 1.25 -0.01 3.75 0.00 0.00 -0.88 -4.85 105.19 104.44 2w4m n GLY 202 Ca 0.16 -0.36 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 2w4m n GLY 202 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2w4m s LEU 203 N -3.45 3.78 0.27 0.99 1.02 -0.94 -3.97 118.68 116.38 2w4m s LEU 203 Ca 0.08 2.59 -0.08 0.00 0.02 0.00 0.00 54.13 56.74 2w4m s LEU 203 Cb -0.04 -4.40 0.45 0.00 0.02 0.00 0.00 46.19 42.22 2w4m s LEU 203 CO 0.10 -1.56 1.57 0.50 0.02 0.00 0.00 176.35 176.98 2w4m h LYS 204 N 1.25 0.00 -2.78 1.70 3.64 -0.83 -3.44 116.57 116.12 2w4m h LYS 204 Ca -0.51 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 58.81 2w4m h LYS 204 Cb 1.30 -0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 32.95 2w4m h LYS 204 CO 0.56 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.75 2w4m s ALA 205 N -6.23 -1.27 -0.07 5.00 0.00 -1.17 -5.03 121.76 113.00 2w4m s ALA 205 Ca -0.15 0.58 0.04 0.00 0.00 0.00 0.00 51.96 52.43 2w4m s ALA 205 Cb 0.26 0.33 0.00 0.00 0.00 0.00 0.00 23.12 23.71 2w4m s ALA 205 CO 0.77 -0.47 -0.19 0.95 0.00 0.00 0.00 175.76 176.83 2w4m s THR 206 N -2.28 1.62 -0.16 0.00 -4.23 -1.26 -1.34 115.64 107.98 2w4m s THR 206 Ca -0.06 -0.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 2w4m s THR 206 Cb -0.01 -1.42 0.00 0.00 1.34 0.00 0.00 72.50 72.42 2w4m s THR 206 CO -0.01 0.46 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.68 2w4m s VAL 207 N 0.35 2.50 -0.30 2.29 1.01 0.06 -1.85 120.40 124.45 2w4m s VAL 207 Ca -0.13 -0.82 -0.14 0.00 0.00 0.00 0.00 61.98 60.89 2w4m s VAL 207 Cb -0.16 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 2w4m s VAL 207 CO 0.05 0.52 0.31 0.86 0.00 0.00 0.00 175.10 176.84 2w4m s TRP 208 N 0.96 3.22 -0.22 5.22 -0.00 -0.53 -1.85 118.94 125.74 2w4m s TRP 208 Ca -0.03 0.12 -0.29 0.00 -0.00 0.00 0.00 56.10 55.90 2w4m s TRP 208 Cb -0.15 -2.55 0.01 0.00 -0.00 0.00 0.00 33.47 30.78 2w4m s TRP 208 CO -0.03 -0.30 1.05 0.42 -0.00 0.00 0.00 176.95 178.10 2w4m s ILE 209 N 1.93 4.66 -0.59 5.86 -1.09 -0.46 -1.71 121.20 129.81 2w4m s ILE 209 Ca 0.11 2.00 0.06 0.00 -2.23 0.00 0.00 60.65 60.58 2w4m s ILE 209 Cb -0.16 -4.29 0.20 0.00 -1.58 0.00 0.00 42.46 36.63 2w4m s ILE 209 CO 0.11 -0.17 0.54 -3.20 -1.23 0.00 0.00 174.94 171.00 2w4m n ASN 210 N 6.27 2.17 -0.19 3.58 5.15 -0.31 -4.44 115.26 127.49 2w4m n ASN 210 Ca 0.12 -3.05 0.08 0.00 -0.60 0.00 0.00 54.58 51.13 2w4m n ASN 210 Cb 0.46 -0.68 0.37 0.00 -0.53 0.00 0.00 39.78 39.40 2w4m n ASN 210 CO 0.00 0.00 0.00 0.50 1.40 0.00 0.00 177.26 179.16 2w4m h LYS 211 N 4.87 0.69 -0.46 1.20 3.64 -1.79 -2.45 116.57 122.28 2w4m h LYS 211 Ca 0.18 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 2w4m h LYS 211 Cb 0.77 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2w4m h LYS 211 CO 0.65 0.46 0.00 0.09 -2.27 0.00 0.00 179.45 178.38 2w4m n ASN 212 N -4.49 3.41 -3.66 4.20 3.02 -1.26 -4.96 115.26 111.51 2w4m n ASN 212 Ca 0.12 -1.96 -0.22 0.00 -0.03 0.00 0.00 54.58 52.49 2w4m n ASN 212 Cb 0.29 -0.30 0.05 0.00 -0.61 0.00 0.00 39.78 39.21 2w4m n ASN 212 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2w4m n GLY 213 N 1.30 -0.37 3.83 7.41 0.00 -0.92 -4.97 105.19 111.46 2w4m n GLY 213 Ca 0.19 0.15 -0.33 0.00 0.00 0.00 0.00 46.02 46.02 2w4m n GLY 213 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2w4m s ILE 214 N -3.49 4.48 -0.17 -0.61 -5.25 -1.26 -5.07 121.20 109.83 2w4m s ILE 214 Ca 0.19 1.32 -0.17 0.00 -0.99 0.00 0.00 60.65 61.01 2w4m s ILE 214 Cb -0.09 -3.62 -0.04 0.00 2.95 0.00 0.00 42.46 41.66 2w4m s ILE 214 CO 0.79 -0.25 0.42 -0.69 -1.79 0.00 0.00 174.94 173.42 2w4m s VAL 215 N -2.09 5.20 0.89 8.37 1.01 -1.26 -5.09 120.40 127.44 2w4m s VAL 215 Ca 0.59 0.79 -0.11 0.00 0.00 0.00 0.00 61.98 63.24 2w4m s VAL 215 Cb -0.10 -3.75 0.18 0.00 0.00 0.00 0.00 36.38 32.71 2w4m s VAL 215 CO 0.15 0.28 1.23 -2.16 0.00 0.00 0.00 175.10 174.59 2w4m s PRO 216 N 1.05 0.91 0.60 2.72 0.04 -1.26 -5.06 135.00 134.01 2w4m s PRO 216 Ca 0.21 -0.67 -0.16 0.00 0.04 0.00 0.00 61.00 60.42 2w4m s PRO 216 Cb -0.15 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 2w4m s PRO 216 CO 0.08 -2.14 1.09 -0.51 0.04 0.00 0.00 177.00 175.55 2w4m s LEU 217 N -5.66 3.53 0.16 -3.56 1.43 -1.26 -4.97 118.68 108.35 2w4m s LEU 217 Ca 0.72 1.95 -0.27 0.00 -1.03 0.00 0.00 54.13 55.50 2w4m s LEU 217 Cb -0.04 -4.55 0.00 0.00 0.03 0.00 0.00 46.19 41.64 2w4m s LEU 217 CO 0.50 -1.31 1.57 0.50 0.23 0.00 0.00 176.35 177.85 2w4m h LYS 218 N 0.52 -0.27 -1.10 1.70 3.64 -2.04 -2.77 116.57 116.26 2w4m h LYS 218 Ca -0.48 0.02 -0.19 0.00 -1.27 0.00 0.00 60.65 58.74 2w4m h LYS 218 Cb 1.24 0.06 -0.11 0.00 -0.41 0.00 0.00 32.23 33.01 2w4m h LYS 218 CO 0.56 -0.18 0.24 -1.13 -2.27 0.00 0.00 179.45 176.67 2w4m n SER 219 N -5.40 3.68 -4.89 4.20 3.41 -1.26 -4.91 113.62 108.44 2w4m n SER 219 Ca 0.00 -2.60 -0.23 0.00 -0.26 0.00 0.00 58.87 55.78 2w4m n SER 219 Cb 0.35 -0.68 -0.03 0.00 -0.26 0.00 0.00 64.21 63.58 2w4m n SER 219 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2w4m s SER 220 N 0.28 5.94 0.37 4.04 1.04 -1.05 -5.04 113.70 119.28 2w4m s SER 220 Ca 0.20 -0.05 -0.28 0.00 0.48 0.00 0.00 55.95 56.30 2w4m s SER 220 Cb 0.17 -1.66 -0.11 0.00 0.10 0.00 0.00 66.02 64.52 2w4m s SER 220 CO 0.03 -0.02 1.50 -2.84 0.98 0.00 0.00 173.24 172.90 2w4m s PRO 221 N -3.66 4.10 -0.26 4.02 0.02 -1.26 -4.98 135.00 132.98 2w4m s PRO 221 Ca 0.33 2.59 -0.13 0.00 0.02 0.00 0.00 61.00 63.81 2w4m s PRO 221 Cb -0.09 -2.97 -0.04 0.00 0.02 0.00 0.00 34.50 31.42 2w4m s PRO 221 CO 0.27 -0.56 0.27 0.08 -0.33 0.00 0.00 177.00 176.73 2w4m s VAL 222 N -1.04 5.26 0.87 3.83 1.01 -1.26 -4.97 120.40 124.11 2w4m s VAL 222 Ca 0.54 0.36 -0.13 0.00 0.00 0.00 0.00 61.98 62.74 2w4m s VAL 222 Cb -0.47 -3.60 0.12 0.00 0.00 0.00 0.00 36.38 32.44 2w4m s VAL 222 CO 0.62 0.24 1.21 -2.16 0.00 0.00 0.00 175.10 175.01 2w4m s PRO 223 N 1.69 1.43 0.07 2.72 0.04 -1.26 -5.00 135.00 134.69 2w4m s PRO 223 Ca 0.11 -0.01 -0.09 0.00 0.04 0.00 0.00 61.00 61.05 2w4m s PRO 223 Cb -0.15 -1.90 -0.27 0.00 0.04 0.00 0.00 34.50 32.22 2w4m s PRO 223 CO 0.09 -1.94 1.13 0.45 0.04 0.00 0.00 177.00 176.77 2w4m h HIS 224 N -1.31 0.71 -4.33 0.56 3.86 -1.77 -3.47 115.15 109.40 2w4m h HIS 224 Ca -0.46 -0.48 -0.15 0.00 -1.16 0.00 0.00 60.37 58.11 2w4m h HIS 224 Cb 1.30 -0.04 -0.15 0.00 1.06 0.00 0.00 27.41 29.58 2w4m h HIS 224 CO -0.15 1.36 -0.66 0.71 0.86 0.00 0.00 177.93 180.05 2w4m s TYR 225 N -2.79 0.69 -0.03 2.45 2.02 -0.93 -5.01 117.35 113.75 2w4m s TYR 225 Ca -0.06 -1.15 0.01 0.00 -0.37 0.00 0.00 57.07 55.50 2w4m s TYR 225 Cb 0.06 -0.43 0.01 0.00 -0.40 0.00 0.00 41.96 41.20 2w4m s TYR 225 CO 0.90 -0.45 -0.05 1.41 -1.57 0.00 0.00 175.55 175.80 2w4m s MET 226 N -3.98 0.67 0.14 -0.62 -2.45 -1.26 -1.45 119.30 110.34 2w4m s MET 226 Ca 0.16 -0.12 0.04 0.00 -1.25 0.00 0.00 55.69 54.51 2w4m s MET 226 Cb 0.08 -0.68 -0.04 0.00 1.25 0.00 0.00 34.83 35.43 2w4m s MET 226 CO -0.04 -0.02 -0.08 0.14 1.05 0.00 0.00 175.02 176.07 2w4m s VAL 227 N 0.58 1.02 -0.74 10.11 -7.23 -0.69 -4.95 120.40 118.50 2w4m s VAL 227 Ca -0.07 -2.03 0.25 0.00 -1.81 0.00 0.00 61.98 58.33 2w4m s VAL 227 Cb -0.11 -1.86 0.16 0.00 0.56 0.00 0.00 36.38 35.13 2w4m s VAL 227 CO -0.00 -0.73 1.56 -1.20 -0.31 0.00 0.00 175.10 174.42 2w4m n SER 228 N -0.18 0.67 -3.71 4.85 7.64 -1.26 -1.16 113.62 120.47 2w4m n SER 228 Ca -0.10 0.31 -0.14 0.00 1.01 0.00 0.00 58.87 59.95 2w4m n SER 228 Cb 0.61 -0.27 -0.09 0.00 -1.01 0.00 0.00 64.21 63.45 2w4m n SER 228 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2w4m s SER 229 N -4.15 -0.44 0.52 6.43 0.15 -1.26 -3.86 113.70 111.08 2w4m s SER 229 Ca 0.09 0.78 0.23 0.00 0.70 0.00 0.00 55.95 57.75 2w4m s SER 229 Cb 0.14 0.81 1.40 0.00 -1.71 0.00 0.00 66.02 66.66 2w4m s SER 229 CO 0.65 -0.23 2.11 -0.37 1.20 0.00 0.00 173.24 176.60 2w4m h VAL 230 N 4.24 0.76 0.00 4.45 -1.51 -1.91 -2.69 116.25 119.59 2w4m h VAL 230 Ca -0.28 -0.37 0.00 0.00 -1.23 0.00 0.00 66.70 64.83 2w4m h VAL 230 Cb 1.18 1.22 0.00 0.00 -2.13 0.00 0.00 31.29 31.55 2w4m h VAL 230 CO 0.26 0.09 0.00 0.18 -1.23 0.00 0.00 177.57 176.87 2w4m n LEU 231 N -3.98 0.61 0.15 4.19 4.77 -1.26 -0.60 117.00 120.88 2w4m n LEU 231 Ca -0.02 0.75 0.12 0.00 -0.03 0.00 0.00 56.01 56.83 2w4m n LEU 231 Cb 0.18 -0.78 0.28 0.00 -2.33 0.00 0.00 43.42 40.77 2w4m n LEU 231 CO 0.32 -0.87 0.78 -0.33 -1.33 0.00 0.00 177.39 175.96 2w4m h GLU 232 N 0.00 0.00 -0.74 3.23 5.08 -1.90 -3.39 114.58 116.85 2w4m h GLU 232 Ca 0.00 0.00 0.16 0.00 -1.00 0.00 0.00 59.36 58.52 2w4m h GLU 232 Cb 0.10 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.24 2w4m h GLU 232 CO 0.00 0.00 0.18 -0.07 -1.00 0.00 0.00 179.01 178.12 2w4m h LEU 233 N 0.00 0.02 0.07 1.33 -0.00 -1.02 -2.34 115.31 113.36 2w4m h LEU 233 Ca 0.00 0.15 0.02 0.00 -0.00 0.00 0.00 57.88 58.04 2w4m h LEU 233 Cb 0.85 0.20 -0.03 0.00 -0.00 0.00 0.00 40.66 41.68 2w4m h LEU 233 CO 0.00 -0.04 -0.17 -0.65 -0.00 0.00 0.00 178.44 177.59 2w4m h PRO 234 N 0.27 -0.30 -0.61 1.13 0.11 -1.80 0.16 132.00 130.97 2w4m h PRO 234 Ca 0.42 0.02 0.10 0.00 0.11 0.00 0.00 66.00 66.65 2w4m h PRO 234 Cb 0.72 0.07 -0.08 0.00 0.11 0.00 0.00 31.00 31.82 2w4m h PRO 234 CO -0.51 -0.20 0.20 0.00 -0.21 0.00 0.00 178.00 177.28 2w4m h ALA 235 N 0.56 0.77 -0.31 -0.75 0.00 -1.80 -1.99 119.26 115.74 2w4m h ALA 235 Ca 0.03 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2w4m h ALA 235 Cb 0.34 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2w4m h ALA 235 CO -0.11 -0.23 0.13 1.25 0.00 0.00 0.00 179.25 180.29 2w4m h LEU 236 N 0.36 0.42 -1.01 0.00 5.85 -0.84 -2.59 115.31 117.49 2w4m h LEU 236 Ca 0.31 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.91 2w4m h LEU 236 Cb 0.41 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.28 2w4m h LEU 236 CO -0.34 0.46 0.66 -0.07 -0.34 0.00 0.00 178.44 178.81 2w4m h LEU 237 N 0.36 1.12 -0.51 2.25 3.38 -0.32 0.26 115.31 121.84 2w4m h LEU 237 Ca 0.11 -0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.14 2w4m h LEU 237 Cb 0.16 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.58 2w4m h LEU 237 CO -0.01 0.78 0.15 1.56 0.09 0.00 0.00 178.44 181.01 2w4m h GLN 238 N 1.30 0.31 -0.57 1.13 4.20 -1.12 -0.33 115.11 120.03 2w4m h GLN 238 Ca 0.39 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 59.02 2w4m h GLN 238 Cb -0.05 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 2w4m h GLN 238 CO -0.11 0.20 0.12 0.77 -0.67 0.00 0.00 178.83 179.14 2w4m h SER 239 N 0.32 0.88 -0.86 1.46 0.02 -0.64 -2.52 113.55 112.21 2w4m h SER 239 Ca 0.25 -0.25 0.08 0.00 -0.84 0.00 0.00 61.79 61.04 2w4m h SER 239 Cb 0.30 -0.23 -0.07 0.00 0.14 0.00 0.00 62.40 62.54 2w4m h SER 239 CO -0.28 0.90 0.52 0.40 -1.14 0.00 0.00 176.83 177.22 2w4m h ILE 240 N 0.83 0.98 0.00 3.27 2.04 -0.03 -0.11 117.51 124.48 2w4m h ILE 240 Ca 0.18 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2w4m h ILE 240 Cb 0.38 -0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 2w4m h ILE 240 CO 0.01 0.16 0.00 0.47 0.00 0.00 0.00 178.15 178.79 2w4m n ASP 241 N -4.67 0.00 -0.00 1.72 8.00 -0.18 -1.87 116.55 119.55 2w4m n ASP 241 Ca 0.13 0.07 0.09 0.00 0.71 0.00 0.00 54.79 55.80 2w4m n ASP 241 Cb 0.23 -0.23 -0.12 0.00 -0.02 0.00 0.00 41.12 40.98 2w4m n ASP 241 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2w4m s LYS 243 N -2.91 3.86 0.00 0.00 2.20 -0.78 -5.13 119.74 116.98 2w4m s LYS 243 Ca 0.05 1.74 0.00 0.00 -0.36 0.00 0.00 55.97 57.41 2w4m s LYS 243 Cb 0.14 -2.46 0.00 0.00 -1.51 0.00 0.00 37.83 34.00 2w4m s LYS 243 CO 0.80 -0.46 0.44 0.28 -0.36 0.00 0.00 175.35 176.05