#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ugq n ASN 2 N 0.00 7.64 -4.86 3.17 5.03 -1.26 -4.95 115.26 120.03 1ugq n ASN 2 Ca 0.00 -2.68 -0.31 0.00 0.87 0.00 0.00 54.58 52.45 1ugq n ASN 2 Cb 0.00 -1.47 -0.01 0.00 -1.02 0.00 0.00 39.78 37.28 1ugq n ASN 2 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1ugq s GLY 3 N 1.72 1.83 0.50 7.41 0.00 -1.26 -4.95 107.32 112.57 1ugq s GLY 3 Ca 0.66 0.01 0.19 0.00 0.00 0.00 0.00 44.72 45.58 1ugq s GLY 3 CO -0.06 0.27 2.09 -2.08 0.00 0.00 0.00 173.10 173.32 1ugq h VAL 4 N 0.24 0.91 -0.28 1.40 2.07 -1.92 -2.31 116.25 116.36 1ugq h VAL 4 Ca -0.45 -0.35 0.08 0.00 0.82 0.00 0.00 66.70 66.80 1ugq h VAL 4 Cb 1.19 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1ugq h VAL 4 CO 0.62 0.10 0.30 0.10 0.02 0.00 0.00 177.57 178.71 1ugq h TYR 5 N 0.00 0.00 -0.35 1.57 -0.00 -1.92 -3.23 116.97 113.04 1ugq h TYR 5 Ca -0.00 0.00 -0.66 0.00 0.00 0.00 0.00 58.73 58.07 1ugq h TYR 5 Cb 0.19 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 36.88 1ugq h TYR 5 CO 0.00 0.00 2.52 -3.47 -0.00 0.00 0.00 178.16 177.21 1ugq n ASP 6 N -3.78 4.01 0.00 0.10 2.03 -0.87 -4.75 116.55 113.29 1ugq n ASP 6 Ca 0.04 -2.84 0.13 0.00 0.52 0.00 0.00 54.79 52.65 1ugq n ASP 6 Cb 0.45 -1.63 0.47 0.00 -0.72 0.00 0.00 41.12 39.69 1ugq n ASP 6 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1ugq n VAL 7 N 5.92 0.00 -1.69 5.18 0.24 -1.22 -4.85 118.33 121.91 1ugq n VAL 7 Ca 0.50 -0.00 -0.52 0.00 -2.04 0.00 0.00 64.34 62.28 1ugq n VAL 7 Cb 0.42 -0.20 -0.06 0.00 -1.47 0.00 0.00 33.84 32.54 1ugq n VAL 7 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ugq n GLY 8 N 1.50 1.21 1.11 7.63 0.00 -1.26 -0.47 105.19 114.91 1ugq n GLY 8 Ca 0.06 0.89 0.00 0.00 0.00 0.00 0.00 46.02 46.98 1ugq n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ugq n GLY 9 N 4.38 1.21 3.74 -0.02 0.00 -1.26 -4.59 105.19 108.65 1ugq n GLY 9 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1ugq n GLY 9 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ugq s THR 10 N -2.36 3.00 0.24 2.61 2.01 0.38 -5.02 115.64 116.49 1ugq s THR 10 Ca 0.00 0.84 0.06 0.00 0.31 0.00 0.00 61.69 62.90 1ugq s THR 10 Cb 0.00 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 68.94 1ugq s THR 10 CO 0.00 0.14 0.29 -1.81 -0.69 0.00 0.00 174.62 172.54 1ugq s ASP 11 N 0.26 6.00 0.00 3.53 1.01 -1.26 -4.65 116.67 121.56 1ugq s ASP 11 Ca 0.57 -0.05 0.00 0.00 0.71 0.00 0.00 52.55 53.78 1ugq s ASP 11 Cb -0.38 -1.68 0.00 0.00 1.01 0.00 0.00 42.92 41.86 1ugq s ASP 11 CO 0.41 -0.05 0.00 0.61 0.21 0.00 0.00 175.17 176.35 1ugq n GLY 12 N -1.24 0.63 0.02 0.21 0.00 -1.26 -4.94 105.19 98.60 1ugq n GLY 12 Ca -0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.06 1ugq n GLY 12 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ugq n LEU 13 N 0.00 0.14 0.00 0.99 4.32 -1.26 -5.02 117.00 116.16 1ugq n LEU 13 Ca 0.00 0.52 0.00 0.00 -0.02 0.00 0.00 56.01 56.51 1ugq n LEU 13 Cb 0.00 -0.48 0.00 0.00 -1.62 0.00 0.00 43.42 41.32 1ugq n LEU 13 CO 0.00 -0.11 0.00 0.61 -1.22 0.00 0.00 177.39 176.67 1ugq n GLY 14 N 1.03 0.21 3.77 -0.72 0.00 -1.26 -5.00 105.19 103.23 1ugq n GLY 14 Ca 0.06 -1.92 -0.33 0.00 0.00 0.00 0.00 46.02 43.82 1ugq n GLY 14 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ugq s PRO 15 N -1.48 2.84 0.26 1.61 0.04 -1.26 -4.98 135.00 132.03 1ugq s PRO 15 Ca 0.00 1.46 -0.29 0.00 0.04 0.00 0.00 61.00 62.21 1ugq s PRO 15 Cb 0.00 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.50 1ugq s PRO 15 CO 0.00 -1.23 1.22 0.42 0.04 0.00 0.00 177.00 177.45 1ugq s ILE 16 N -2.20 3.21 -0.47 0.56 1.01 -1.26 -4.99 121.20 117.06 1ugq s ILE 16 Ca 0.69 1.14 -0.16 0.00 0.00 0.00 0.00 60.65 62.32 1ugq s ILE 16 Cb -0.22 -3.72 0.07 0.00 0.01 0.00 0.00 42.46 38.59 1ugq s ILE 16 CO 0.39 0.24 0.41 0.21 0.00 0.00 0.00 174.94 176.19 1ugq s ASN 17 N -0.35 6.15 -0.29 3.58 2.47 -1.26 -5.02 114.94 120.22 1ugq s ASN 17 Ca 0.50 -1.24 -0.02 0.00 0.42 0.00 0.00 52.86 52.51 1ugq s ASN 17 Cb -0.35 -2.19 0.09 0.00 -1.45 0.00 0.00 41.25 37.35 1ugq s ASN 17 CO 0.43 -0.65 0.10 -0.60 -3.72 0.00 0.00 177.10 172.67 1ugq s ARG 18 N 1.74 0.48 0.78 0.43 3.52 -1.26 -5.13 118.95 119.50 1ugq s ARG 18 Ca 0.05 -0.77 -0.11 0.00 -0.13 0.00 0.00 55.73 54.78 1ugq s ARG 18 Cb -0.23 -1.66 0.06 0.00 -1.56 0.00 0.00 34.95 31.56 1ugq s ARG 18 CO 0.08 -0.96 1.10 -2.14 -0.81 0.00 0.00 175.30 172.57 1ugq s PRO 19 N 1.85 2.16 0.35 5.12 0.02 -1.26 -4.91 135.00 138.33 1ugq s PRO 19 Ca 0.08 1.25 0.05 0.00 0.02 0.00 0.00 61.00 62.40 1ugq s PRO 19 Cb -0.17 -1.88 0.70 0.00 0.02 0.00 0.00 34.50 33.18 1ugq s PRO 19 CO -0.28 -1.73 1.96 0.00 -0.33 0.00 0.00 177.00 176.62 1ugq h ALA 20 N -1.08 1.67 -2.80 -1.55 0.00 -2.06 -3.44 119.26 110.00 1ugq h ALA 20 Ca -0.44 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 1ugq h ALA 20 Cb 1.24 -0.21 -0.13 0.00 0.00 0.00 0.00 17.79 18.69 1ugq h ALA 20 CO 0.50 0.22 0.15 0.34 0.00 0.00 0.00 179.25 180.46 1ugq s ASP 21 N -6.19 -0.51 0.07 0.00 2.15 -1.26 -5.19 116.67 105.74 1ugq s ASP 21 Ca -0.10 0.05 -0.19 0.00 0.43 0.00 0.00 52.55 52.74 1ugq s ASP 21 Cb 0.19 0.56 0.04 0.00 -0.30 0.00 0.00 42.92 43.42 1ugq s ASP 21 CO 0.78 -0.88 0.45 -1.83 -0.17 0.00 0.00 175.17 173.51 1ugq s GLU 22 N -3.32 1.02 0.70 4.34 -1.05 -1.26 -5.16 118.70 113.95 1ugq s GLU 22 Ca -0.01 -0.42 -0.11 0.00 -0.15 0.00 0.00 54.97 54.28 1ugq s GLU 22 Cb -0.00 0.46 0.01 0.00 -0.44 0.00 0.00 34.13 34.15 1ugq s GLU 22 CO -0.09 -0.37 1.07 -1.25 0.95 0.00 0.00 175.26 175.56 1ugq s PRO 23 N -2.90 2.94 0.13 -4.83 0.04 -1.26 -4.96 135.00 124.17 1ugq s PRO 23 Ca -0.03 0.73 -0.15 0.00 0.04 0.00 0.00 61.00 61.59 1ugq s PRO 23 Cb -0.00 -2.01 -0.01 0.00 0.04 0.00 0.00 34.50 32.53 1ugq s PRO 23 CO -0.05 -1.04 1.64 0.28 0.04 0.00 0.00 177.00 177.87 1ugq h VAL 24 N -0.66 1.22 -3.09 -0.36 2.07 -2.03 -3.40 116.25 110.01 1ugq h VAL 24 Ca -0.45 -0.76 -0.67 0.00 0.82 0.00 0.00 66.70 65.64 1ugq h VAL 24 Cb 1.22 0.94 -0.35 0.00 -1.52 0.00 0.00 31.29 31.59 1ugq h VAL 24 CO 0.60 0.27 -0.85 -0.36 0.02 0.00 0.00 177.57 177.24 1ugq s PHE 25 N -5.35 2.78 -0.49 1.57 0.40 -1.26 -5.01 117.98 110.63 1ugq s PHE 25 Ca -0.13 -1.59 0.24 0.00 -0.60 0.00 0.00 56.93 54.85 1ugq s PHE 25 Cb 0.10 -1.92 0.53 0.00 0.51 0.00 0.00 43.02 42.24 1ugq s PHE 25 CO 0.77 -0.78 1.67 0.00 0.70 0.00 0.00 175.22 177.58 1ugq h ARG 26 N 7.90 0.00 -3.24 0.44 3.08 -1.98 -3.47 114.38 117.11 1ugq h ARG 26 Ca -0.45 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.56 1ugq h ARG 26 Cb 1.14 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 31.07 1ugq h ARG 26 CO 0.63 0.00 0.04 0.00 -1.07 0.00 0.00 179.97 179.57 1ugq s ALA 27 N -3.21 -1.19 0.35 0.04 0.00 -1.26 -5.05 121.76 111.44 1ugq s ALA 27 Ca 0.08 0.16 0.03 0.00 0.00 0.00 0.00 51.96 52.23 1ugq s ALA 27 Cb 0.07 0.76 0.65 0.00 0.00 0.00 0.00 23.12 24.61 1ugq s ALA 27 CO 0.64 -0.69 1.98 0.93 0.00 0.00 0.00 175.76 178.62 1ugq h GLU 28 N 2.23 0.83 0.00 0.00 4.39 -2.02 -1.73 114.58 118.28 1ugq h GLU 28 Ca -0.34 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.30 1ugq h GLU 28 Cb 1.28 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 29.74 1ugq h GLU 28 CO 0.43 0.55 -0.06 0.11 -1.16 0.00 0.00 179.01 178.89 1ugq h TRP 29 N 0.85 0.00 -0.35 4.33 5.08 -2.00 -1.48 115.95 122.38 1ugq h TRP 29 Ca 0.28 0.00 -0.10 0.00 1.08 0.00 0.00 58.89 60.15 1ugq h TRP 29 Cb 0.06 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.20 1ugq h TRP 29 CO -0.00 0.06 -0.19 0.93 -1.28 0.00 0.00 178.44 177.96 1ugq h GLU 30 N 0.00 0.66 -0.50 0.12 5.08 -1.73 -0.41 114.58 117.80 1ugq h GLU 30 Ca -0.00 -0.24 -0.03 0.00 -1.00 0.00 0.00 59.36 58.09 1ugq h GLU 30 Cb 0.11 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1ugq h GLU 30 CO 0.01 0.81 0.20 0.87 -1.00 0.00 0.00 179.01 179.90 1ugq h LYS 31 N 0.59 0.75 -0.00 2.33 1.57 -1.31 -0.19 116.57 120.31 1ugq h LYS 31 Ca 0.09 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1ugq h LYS 31 Cb 0.65 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1ugq h LYS 31 CO 0.05 0.67 0.00 0.28 -0.57 0.00 0.00 179.45 179.88 1ugq h VAL 32 N 0.67 1.09 -0.65 0.50 2.07 -1.22 -1.18 116.25 117.54 1ugq h VAL 32 Ca 0.17 -0.26 0.08 0.00 0.82 0.00 0.00 66.70 67.51 1ugq h VAL 32 Cb 0.19 1.26 -0.07 0.00 -1.52 0.00 0.00 31.29 31.16 1ugq h VAL 32 CO -0.01 0.07 0.31 0.00 0.02 0.00 0.00 177.57 177.95 1ugq h ALA 33 N 0.89 0.88 -0.01 1.67 0.00 -0.87 -0.98 119.26 120.83 1ugq h ALA 33 Ca 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ugq h ALA 33 Cb 0.11 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1ugq h ALA 33 CO -0.00 -0.08 0.01 0.35 0.00 0.00 0.00 179.25 179.52 1ugq h PHE 34 N 0.54 0.01 0.00 0.00 3.57 -0.83 -2.89 116.94 117.35 1ugq h PHE 34 Ca 0.32 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.79 1ugq h PHE 34 Cb 0.33 -0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.06 1ugq h PHE 34 CO -0.12 0.10 -0.12 0.00 -2.23 0.00 0.00 178.31 175.94 1ugq h ALA 35 N 0.91 1.24 0.00 2.41 0.00 -0.70 -2.49 119.26 120.64 1ugq h ALA 35 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1ugq h ALA 35 Cb 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1ugq h ALA 35 CO -0.00 0.15 0.00 0.52 0.00 0.00 0.00 179.25 179.92 1ugq h MET 36 N 0.00 0.00 0.71 0.00 2.86 -0.97 -3.11 114.93 114.42 1ugq h MET 36 Ca -0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 1ugq h MET 36 Cb 0.37 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.03 1ugq h MET 36 CO 0.02 0.00 -0.34 0.35 1.06 0.00 0.00 176.91 177.99 1ugq h PHE 37 N 0.00 -0.89 0.00 -0.22 -0.00 -1.52 0.42 116.94 114.73 1ugq h PHE 37 Ca 0.00 -0.02 -0.03 0.00 -0.00 0.00 0.00 57.97 57.92 1ugq h PHE 37 Cb 0.27 0.29 -0.00 0.00 -0.00 0.00 0.00 35.95 36.51 1ugq h PHE 37 CO 0.00 -0.55 -0.12 -1.00 -0.00 0.00 0.00 178.31 176.63 1ugq h PRO 38 N -1.00 0.00 0.25 6.41 0.13 -1.76 -1.17 132.00 134.85 1ugq h PRO 38 Ca -0.10 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.02 1ugq h PRO 38 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1ugq h PRO 38 CO 0.16 0.12 -0.12 0.00 -0.23 0.00 0.00 178.00 177.94 1ugq h ALA 39 N 1.88 -0.33 -0.05 -0.56 0.00 -1.45 -0.63 119.26 118.11 1ugq h ALA 39 Ca -0.00 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 1ugq h ALA 39 Cb 0.23 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1ugq h ALA 39 CO 0.02 -0.58 -0.49 1.79 0.00 0.00 0.00 179.25 179.98 1ugq h THR 40 N -0.55 1.35 -0.05 0.00 1.35 -0.76 -1.99 112.91 112.26 1ugq h THR 40 Ca -0.03 -1.71 -0.00 0.00 -0.55 0.00 0.00 66.41 64.12 1ugq h THR 40 Cb 0.40 1.86 -0.00 0.00 -1.73 0.00 0.00 68.15 68.68 1ugq h THR 40 CO 0.06 0.50 0.02 0.15 -0.25 0.00 0.00 175.52 175.99 1ugq h PHE 41 N 0.10 0.08 -0.31 4.73 3.57 -1.15 -0.32 116.94 123.64 1ugq h PHE 41 Ca 0.00 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 1ugq h PHE 41 Cb 0.91 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 1ugq h PHE 41 CO 0.01 0.23 0.08 -0.09 -2.23 0.00 0.00 178.31 176.31 1ugq h ARG 42 N -0.09 0.45 0.00 1.11 2.43 -0.99 -1.98 114.38 115.31 1ugq h ARG 42 Ca 0.02 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1ugq h ARG 42 Cb 0.19 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1ugq h ARG 42 CO -0.00 0.41 0.00 0.00 -1.51 0.00 0.00 179.97 178.87 1ugq n ALA 43 N -2.48 2.57 -0.88 2.80 0.00 -0.76 -4.91 120.51 116.85 1ugq n ALA 43 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1ugq n ALA 43 Cb 0.17 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.12 1ugq n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ugq n GLY 44 N 1.09 0.49 0.30 0.00 0.00 -0.74 -4.94 105.19 101.39 1ugq n GLY 44 Ca 0.19 -0.68 -0.06 0.00 0.00 0.00 0.00 46.02 45.47 1ugq n GLY 44 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1ugq h PHE 45 N 0.00 1.04 -1.55 1.61 -1.00 -1.29 -3.47 116.94 112.27 1ugq h PHE 45 Ca 0.00 -0.06 0.30 0.00 2.81 0.00 0.00 57.97 61.02 1ugq h PHE 45 Cb 0.00 -0.32 -0.13 0.00 3.61 0.00 0.00 35.95 39.11 1ugq h PHE 45 CO 0.00 0.78 0.79 0.00 -1.61 0.00 0.00 178.31 178.26 1ugq s MET 46 N -5.66 0.47 0.56 1.51 0.23 -1.26 -4.83 119.30 110.32 1ugq s MET 46 Ca -0.13 -0.25 0.09 0.00 -1.03 0.00 0.00 55.69 54.37 1ugq s MET 46 Cb 0.14 0.17 0.09 0.00 -1.53 0.00 0.00 34.83 33.70 1ugq s MET 46 CO 0.81 -0.21 0.72 0.41 -2.03 0.00 0.00 175.02 174.71 1ugq n GLY 47 N -0.43 2.10 0.20 3.16 0.00 -1.26 -4.49 105.19 104.47 1ugq n GLY 47 Ca -0.07 -2.24 -0.07 0.00 0.00 0.00 0.00 46.02 43.64 1ugq n GLY 47 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ugq h LEU 48 N 0.00 0.50 -0.46 0.99 5.85 -1.99 -0.23 115.31 119.97 1ugq h LEU 48 Ca -0.28 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.39 1ugq h LEU 48 Cb 1.23 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 1ugq h LEU 48 CO 0.41 0.36 0.12 0.44 -0.34 0.00 0.00 178.44 179.42 1ugq h ASP 49 N 0.60 0.70 -0.51 1.25 5.19 -1.95 -2.08 116.42 119.62 1ugq h ASP 49 Ca 0.18 -0.23 -0.07 0.00 -0.62 0.00 0.00 57.03 56.29 1ugq h ASP 49 Cb -0.04 -0.18 -0.02 0.00 0.18 0.00 0.00 39.33 39.26 1ugq h ASP 49 CO -0.06 0.74 0.07 -0.33 -3.12 0.00 0.00 179.24 176.55 1ugq h GLU 50 N 0.61 0.90 -0.38 3.56 5.08 -1.70 -1.76 114.58 120.90 1ugq h GLU 50 Ca 0.14 -0.23 0.07 0.00 -1.00 0.00 0.00 59.36 58.35 1ugq h GLU 50 Cb 0.32 -0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.38 1ugq h GLU 50 CO 0.00 0.85 -0.06 0.35 -1.00 0.00 0.00 179.01 179.15 1ugq h PHE 51 N 0.85 -0.14 -0.71 4.33 3.04 -0.69 -0.63 116.94 122.98 1ugq h PHE 51 Ca 0.17 0.03 -0.06 0.00 3.98 0.00 0.00 57.97 62.09 1ugq h PHE 51 Cb 0.41 0.12 -0.03 0.00 2.56 0.00 0.00 35.95 39.01 1ugq h PHE 51 CO 0.02 -0.13 0.20 0.00 -2.02 0.00 0.00 178.31 176.38 1ugq h ARG 52 N 0.03 1.13 -0.49 1.11 3.08 -0.97 -2.69 114.38 115.58 1ugq h ARG 52 Ca 0.18 -0.26 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1ugq h ARG 52 Cb 0.28 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1ugq h ARG 52 CO -0.36 0.98 0.24 0.35 -1.07 0.00 0.00 179.97 180.10 1ugq h PHE 53 N 1.07 0.66 -0.80 3.04 3.57 -0.44 -0.94 116.94 123.10 1ugq h PHE 53 Ca 0.23 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 1ugq h PHE 53 Cb 0.34 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 38.83 1ugq h PHE 53 CO 0.03 0.48 0.36 0.78 -2.23 0.00 0.00 178.31 177.73 1ugq h GLY 54 N 0.78 1.25 1.39 2.40 0.00 -0.81 -2.36 103.07 105.71 1ugq h GLY 54 Ca 0.17 -0.64 -0.14 0.00 0.00 0.00 0.00 47.33 46.72 1ugq h GLY 54 CO -0.02 0.61 -0.38 -2.22 0.00 0.00 0.00 176.54 174.52 1ugq h ILE 55 N 1.14 1.29 0.00 2.60 2.04 -1.22 -2.88 117.51 120.48 1ugq h ILE 55 Ca 0.27 -1.55 -0.01 0.00 1.00 0.00 0.00 64.86 64.57 1ugq h ILE 55 Cb 0.15 1.48 -0.00 0.00 -0.74 0.00 0.00 36.82 37.71 1ugq h ILE 55 CO -0.03 0.50 -0.06 -0.33 0.00 0.00 0.00 178.15 178.23 1ugq h GLU 56 N 0.56 0.00 -0.25 2.37 5.08 -0.80 -1.97 114.58 119.56 1ugq h GLU 56 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1ugq h GLU 56 Cb 0.91 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1ugq h GLU 56 CO 0.08 0.06 0.00 1.04 -1.00 0.00 0.00 179.01 179.19 1ugq n GLN 57 N -3.36 1.82 -1.10 2.33 6.02 -0.93 -4.85 117.38 117.31 1ugq n GLN 57 Ca -0.02 -1.24 -0.31 0.00 -0.01 0.00 0.00 57.00 55.42 1ugq n GLN 57 Cb 0.21 -1.37 0.13 0.00 1.02 0.00 0.00 30.24 30.23 1ugq n GLN 57 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1ugq s MET 58 N -1.67 1.58 0.05 -1.09 -1.94 -0.74 -4.93 119.30 110.56 1ugq s MET 58 Ca 0.30 1.14 -0.30 0.00 -1.71 0.00 0.00 55.69 55.12 1ugq s MET 58 Cb 0.16 -1.82 -0.08 0.00 2.01 0.00 0.00 34.83 35.10 1ugq s MET 58 CO 0.23 -2.11 1.66 1.21 -0.01 0.00 0.00 175.02 176.00 1ugq s ASN 59 N -3.21 6.62 0.26 3.03 3.04 -1.26 -4.88 114.94 118.53 1ugq s ASN 59 Ca 0.63 2.44 -0.02 0.00 0.04 0.00 0.00 52.86 55.95 1ugq s ASN 59 Cb -0.19 -2.56 0.47 0.00 -1.54 0.00 0.00 41.25 37.43 1ugq s ASN 59 CO 0.57 -0.89 1.80 -0.65 -3.04 0.00 0.00 177.10 174.89 1ugq h PRO 60 N 8.57 0.77 -0.79 0.43 0.11 -1.94 -0.22 132.00 138.94 1ugq h PRO 60 Ca -0.42 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 1ugq h PRO 60 Cb 1.20 -0.17 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 1ugq h PRO 60 CO 0.93 0.51 0.35 0.00 -0.21 0.00 0.00 178.00 179.58 1ugq h ALA 61 N 1.50 1.13 -0.26 -0.75 0.00 -2.00 -1.10 119.26 117.78 1ugq h ALA 61 Ca 0.44 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 1ugq h ALA 61 Cb 0.47 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ugq h ALA 61 CO -0.28 0.64 -0.24 1.49 0.00 0.00 0.00 179.25 180.86 1ugq h GLU 62 N 1.13 0.62 -0.36 0.00 4.81 -1.73 -3.18 114.58 115.87 1ugq h GLU 62 Ca 0.27 -0.32 0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1ugq h GLU 62 Cb 0.16 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1ugq h GLU 62 CO -0.03 0.91 0.22 -0.92 -0.73 0.00 0.00 179.01 178.46 1ugq h TYR 63 N 0.34 0.41 0.00 0.92 5.03 -0.75 -0.31 116.97 122.61 1ugq h TYR 63 Ca 0.04 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.34 1ugq h TYR 63 Cb 0.79 -0.13 -0.00 0.00 1.55 0.00 0.00 36.73 38.93 1ugq h TYR 63 CO 0.07 0.24 -0.14 -0.07 -1.32 0.00 0.00 178.16 176.95 1ugq h LEU 64 N 0.44 0.00 -0.62 2.82 3.38 -1.24 -3.31 115.31 116.78 1ugq h LEU 64 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1ugq h LEU 64 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1ugq h LEU 64 CO -0.06 0.14 0.00 -0.62 0.09 0.00 0.00 178.44 177.99 1ugq n GLU 65 N -4.06 1.20 -2.51 1.13 1.02 -1.15 -5.06 120.64 111.22 1ugq n GLU 65 Ca -0.02 -0.31 -0.31 0.00 -0.02 0.00 0.00 57.16 56.50 1ugq n GLU 65 Cb 0.22 -0.79 -0.02 0.00 -0.02 0.00 0.00 31.44 30.83 1ugq n GLU 65 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1ugq s SER 66 N -0.26 6.47 0.39 1.62 1.04 -0.14 -5.00 113.70 117.82 1ugq s SER 66 Ca 0.00 1.29 -0.27 0.00 0.48 0.00 0.00 55.95 57.45 1ugq s SER 66 Cb 0.00 -2.40 -0.11 0.00 0.10 0.00 0.00 66.02 63.62 1ugq s SER 66 CO 0.00 -0.57 1.43 -2.65 0.98 0.00 0.00 173.24 172.44 1ugq n PRO 67 N -1.77 2.47 -0.26 4.02 -0.02 -1.26 -4.89 135.00 133.28 1ugq n PRO 67 Ca 0.04 0.87 -0.04 0.00 -2.02 0.00 0.00 63.50 62.35 1ugq n PRO 67 Cb 0.54 -2.59 0.02 0.00 -0.02 0.00 0.00 33.50 31.45 1ugq n PRO 67 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1ugq h TYR 68 N 2.71 -0.96 0.00 6.00 3.20 -1.94 -0.25 116.97 125.73 1ugq h TYR 68 Ca -0.50 0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.45 1ugq h TYR 68 Cb 1.26 0.53 0.00 0.00 1.54 0.00 0.00 36.73 40.06 1ugq h TYR 68 CO 0.52 -0.39 0.00 0.66 -1.64 0.00 0.00 178.16 177.31 1ugq n TYR 69 N -5.45 0.69 0.08 -3.82 4.01 -1.26 -1.06 117.16 110.35 1ugq n TYR 69 Ca 0.06 0.32 -0.02 0.00 -0.16 0.00 0.00 57.90 58.10 1ugq n TYR 69 Cb 0.37 -1.01 0.22 0.00 -0.31 0.00 0.00 39.34 38.61 1ugq n TYR 69 CO 0.00 0.00 0.00 2.35 -0.46 0.00 0.00 176.86 178.75 1ugq h TRP 70 N 0.00 0.32 -1.00 -0.72 2.91 -1.38 -2.21 115.95 113.86 1ugq h TRP 70 Ca 0.00 -0.08 0.03 0.00 1.13 0.00 0.00 58.89 59.97 1ugq h TRP 70 Cb 0.14 -0.07 -0.06 0.00 -0.51 0.00 0.00 29.16 28.67 1ugq h TRP 70 CO 0.00 0.63 0.66 0.45 -1.03 0.00 0.00 178.44 179.14 1ugq h HIS 71 N 0.23 1.24 -0.65 2.65 -0.00 -1.16 -0.87 115.15 116.59 1ugq h HIS 71 Ca 0.02 0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 60.40 1ugq h HIS 71 Cb 0.79 -0.41 -0.03 0.00 -0.00 0.00 0.00 27.41 27.76 1ugq h HIS 71 CO 0.02 0.73 0.29 -1.49 -0.00 0.00 0.00 177.93 177.48 1ugq h TRP 72 N 1.29 0.95 -0.55 2.45 4.06 -1.49 -1.95 115.95 120.71 1ugq h TRP 72 Ca 0.39 -0.06 -0.01 0.00 2.06 0.00 0.00 58.89 61.28 1ugq h TRP 72 Cb -0.03 -0.29 -0.03 0.00 -1.00 0.00 0.00 29.16 27.82 1ugq h TRP 72 CO -0.00 0.73 0.31 0.82 -3.56 0.00 0.00 178.44 176.73 1ugq h ILE 73 N 0.90 1.18 -0.61 1.49 1.08 -0.94 -1.58 117.51 119.03 1ugq h ILE 73 Ca 0.22 -0.45 0.05 0.00 -0.39 0.00 0.00 64.86 64.29 1ugq h ILE 73 Cb 0.15 0.48 -0.05 0.00 -3.07 0.00 0.00 36.82 34.33 1ugq h ILE 73 CO -0.02 0.19 0.33 0.03 -0.69 0.00 0.00 178.15 177.99 1ugq h ARG 74 N 0.74 0.61 -0.20 2.37 2.47 -0.81 -1.65 114.38 117.90 1ugq h ARG 74 Ca 0.19 -0.04 -0.11 0.00 -1.26 0.00 0.00 59.98 58.77 1ugq h ARG 74 Cb 0.04 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.21 1ugq h ARG 74 CO -0.03 0.40 -0.33 0.00 0.56 0.00 0.00 179.97 180.57 1ugq h THR 75 N 0.63 1.28 -0.32 2.04 1.03 -0.99 0.71 112.91 117.30 1ugq h THR 75 Ca 0.27 -1.40 -0.01 0.00 -0.01 0.00 0.00 66.41 65.26 1ugq h THR 75 Cb 0.15 1.49 -0.01 0.00 -1.07 0.00 0.00 68.15 68.71 1ugq h THR 75 CO -0.17 0.43 0.17 1.88 -0.01 0.00 0.00 175.52 177.82 1ugq h TYR 76 N 0.36 0.45 -0.53 0.00 0.99 -0.74 -1.00 116.97 116.50 1ugq h TYR 76 Ca 0.04 -0.02 -0.07 0.00 2.00 0.00 0.00 58.73 60.69 1ugq h TYR 76 Cb 0.76 -0.14 -0.02 0.00 1.00 0.00 0.00 36.73 38.33 1ugq h TYR 76 CO 0.02 0.38 0.06 0.82 -0.00 0.00 0.00 178.16 179.44 1ugq h ILE 77 N 0.39 1.26 -0.07 -2.88 2.04 -1.11 0.21 117.51 117.34 1ugq h ILE 77 Ca 0.11 -0.99 0.04 0.00 1.00 0.00 0.00 64.86 65.01 1ugq h ILE 77 Cb 0.09 0.87 -0.04 0.00 -0.74 0.00 0.00 36.82 37.00 1ugq h ILE 77 CO -0.02 0.36 -0.18 -0.74 0.00 0.00 0.00 178.15 177.57 1ugq h HIS 78 N 0.77 -0.48 0.00 1.37 2.76 -0.46 -0.96 115.15 118.15 1ugq h HIS 78 Ca 0.16 0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.21 1ugq h HIS 78 Cb 0.44 0.22 -0.02 0.00 1.55 0.00 0.00 27.41 29.61 1ugq h HIS 78 CO 0.03 -0.26 -0.64 0.45 -1.30 0.00 0.00 177.93 176.21 1ugq h HIS 79 N -0.26 0.00 -0.61 5.26 3.86 -1.11 -1.33 115.15 120.96 1ugq h HIS 79 Ca 0.08 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.27 1ugq h HIS 79 Cb 0.37 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.81 1ugq h HIS 79 CO -0.27 0.64 0.31 0.78 0.86 0.00 0.00 177.93 180.26 1ugq h GLY 80 N 2.58 0.92 0.79 2.45 0.00 -0.20 0.42 103.07 110.03 1ugq h GLY 80 Ca -0.01 -0.44 -0.10 0.00 0.00 0.00 0.00 47.33 46.79 1ugq h GLY 80 CO 0.08 0.42 -0.29 -2.08 0.00 0.00 0.00 176.54 174.67 1ugq h VAL 81 N 0.82 1.37 -0.51 4.60 2.07 -1.13 0.45 116.25 123.93 1ugq h VAL 81 Ca 0.21 -1.56 0.09 0.00 0.82 0.00 0.00 66.70 66.26 1ugq h VAL 81 Cb 0.08 2.03 -0.07 0.00 -1.52 0.00 0.00 31.29 31.81 1ugq h VAL 81 CO -0.03 0.46 0.11 -0.09 0.02 0.00 0.00 177.57 178.04 1ugq h ARG 82 N 0.04 0.24 -0.00 1.57 2.43 -0.97 -1.06 114.38 116.63 1ugq h ARG 82 Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1ugq h ARG 82 Cb 0.88 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.38 1ugq h ARG 82 CO 0.06 0.16 -0.16 0.25 -1.51 0.00 0.00 179.97 178.78 1ugq n THR 83 N -5.10 0.00 -1.15 0.20 -2.24 0.12 -4.92 114.28 101.19 1ugq n THR 83 Ca 0.06 -0.03 -0.05 0.00 -2.27 0.00 0.00 64.05 61.76 1ugq n THR 83 Cb 0.25 -0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.31 1ugq n THR 83 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ugq n GLY 84 N 1.38 0.73 0.01 3.38 0.00 -0.40 -4.90 105.19 105.39 1ugq n GLY 84 Ca 0.11 -0.85 0.12 0.00 0.00 0.00 0.00 46.02 45.39 1ugq n GLY 84 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ugq n LYS 85 N -2.85 0.05 -4.20 1.61 5.02 0.14 -4.82 118.16 113.12 1ugq n LYS 85 Ca -0.05 0.01 -0.25 0.00 -2.02 0.00 0.00 58.31 56.00 1ugq n LYS 85 Cb 0.16 -1.52 -0.17 0.00 -0.02 0.00 0.00 35.03 33.48 1ugq n LYS 85 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ugq s ILE 86 N -3.03 1.00 -0.45 -0.18 -1.09 -0.29 -4.97 121.20 112.19 1ugq s ILE 86 Ca 0.10 -0.33 -0.22 0.00 -2.23 0.00 0.00 60.65 57.96 1ugq s ILE 86 Cb 0.17 -0.98 0.03 0.00 -1.58 0.00 0.00 42.46 40.10 1ugq s ILE 86 CO 0.72 0.34 0.72 -0.62 -1.23 0.00 0.00 174.94 174.88 1ugq s ASP 87 N 1.22 6.36 0.21 3.58 -1.08 -1.26 -4.19 116.67 121.51 1ugq s ASP 87 Ca -0.04 -0.26 -0.09 0.00 -0.52 0.00 0.00 52.55 51.64 1ugq s ASP 87 Cb -0.14 -2.35 0.28 0.00 -1.46 0.00 0.00 42.92 39.25 1ugq s ASP 87 CO -0.03 -0.87 1.76 -0.07 0.52 0.00 0.00 175.17 176.48 1ugq h LEU 88 N 9.97 0.32 -0.91 -1.34 3.38 -1.98 -0.74 115.31 124.02 1ugq h LEU 88 Ca -0.25 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1ugq h LEU 88 Cb 1.09 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.82 1ugq h LEU 88 CO 0.94 0.19 0.54 -0.33 0.09 0.00 0.00 178.44 179.87 1ugq h GLU 89 N 0.48 1.23 -0.44 1.13 3.07 -1.99 0.25 114.58 118.31 1ugq h GLU 89 Ca 0.31 -0.11 -0.13 0.00 -0.50 0.00 0.00 59.36 58.93 1ugq h GLU 89 Cb 0.35 -0.26 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 1ugq h GLU 89 CO -0.28 0.86 -0.25 1.49 -1.40 0.00 0.00 179.01 179.43 1ugq h GLU 90 N 1.25 0.92 -0.73 2.33 4.57 -1.83 -1.95 114.58 119.14 1ugq h GLU 90 Ca 0.32 -0.41 -0.02 0.00 -1.18 0.00 0.00 59.36 58.08 1ugq h GLU 90 Cb -0.05 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.48 1ugq h GLU 90 CO -0.06 1.07 0.39 1.25 -1.18 0.00 0.00 179.01 180.48 1ugq h LEU 91 N 0.79 0.92 -0.53 1.64 5.85 -0.51 -0.95 115.31 122.52 1ugq h LEU 91 Ca 0.10 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 1ugq h LEU 91 Cb 0.82 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 1ugq h LEU 91 CO 0.07 0.76 0.17 -0.33 -0.34 0.00 0.00 178.44 178.78 1ugq h GLU 92 N 1.01 0.81 -0.38 1.25 5.08 -0.79 -0.42 114.58 121.14 1ugq h GLU 92 Ca 0.26 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1ugq h GLU 92 Cb 0.05 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1ugq h GLU 92 CO -0.04 0.74 0.23 -0.09 -1.00 0.00 0.00 179.01 178.85 1ugq h ARG 93 N 0.72 0.53 -0.13 2.33 2.43 -0.94 -2.21 114.38 117.09 1ugq h ARG 93 Ca 0.17 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.20 1ugq h ARG 93 Cb 0.26 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.69 1ugq h ARG 93 CO -0.01 0.40 -0.31 0.00 -1.51 0.00 0.00 179.97 178.55 1ugq h ARG 94 N 0.50 0.26 -0.36 0.20 3.08 -1.00 -1.44 114.38 115.62 1ugq h ARG 94 Ca 0.14 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 60.07 1ugq h ARG 94 Cb 0.01 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1ugq h ARG 94 CO -0.03 0.55 0.16 1.15 -1.07 0.00 0.00 179.97 180.73 1ugq h THR 95 N 0.23 1.17 -0.79 2.04 2.02 -0.70 -0.33 112.91 116.55 1ugq h THR 95 Ca 0.03 -0.50 -0.04 0.00 0.77 0.00 0.00 66.41 66.67 1ugq h THR 95 Cb 0.66 0.85 -0.04 0.00 -1.74 0.00 0.00 68.15 67.88 1ugq h THR 95 CO 0.05 0.18 0.34 -0.61 0.37 0.00 0.00 175.52 175.85 1ugq h GLN 96 N 0.43 1.17 -0.34 6.66 5.75 -1.14 -0.03 115.11 127.61 1ugq h GLN 96 Ca 0.12 -0.20 0.03 0.00 -0.15 0.00 0.00 58.65 58.45 1ugq h GLN 96 Cb 0.14 -0.20 -0.03 0.00 1.07 0.00 0.00 27.48 28.46 1ugq h GLN 96 CO -0.01 0.93 0.15 -0.92 -2.65 0.00 0.00 178.83 176.33 1ugq h TYR 97 N 1.14 0.27 0.00 3.99 3.20 -0.74 -1.49 116.97 123.34 1ugq h TYR 97 Ca 0.27 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.15 1ugq h TYR 97 Cb 0.18 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.38 1ugq h TYR 97 CO 0.02 0.13 0.00 1.88 -1.64 0.00 0.00 178.16 178.55 1ugq h TYR 98 N 0.32 0.00 -0.10 -3.82 -1.99 -0.73 0.11 116.97 110.75 1ugq h TYR 98 Ca 0.15 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.82 1ugq h TYR 98 Cb 0.09 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.82 1ugq h TYR 98 CO -0.12 0.00 -0.16 0.00 -0.00 0.00 0.00 178.16 177.88 1ugq h ARG 99 N 0.00 0.29 0.00 4.88 3.08 -0.19 -1.78 114.38 120.66 1ugq h ARG 99 Ca 0.00 -0.18 -0.10 0.00 0.07 0.00 0.00 59.98 59.77 1ugq h ARG 99 Cb 0.68 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 1ugq h ARG 99 CO 0.00 0.75 -0.49 0.93 -1.07 0.00 0.00 179.97 180.09 1ugq h GLU 100 N -0.14 0.00 -2.07 0.04 5.08 -1.14 -3.36 114.58 112.98 1ugq h GLU 100 Ca 0.01 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.81 1ugq h GLU 100 Cb 0.73 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.57 1ugq h GLU 100 CO 0.04 0.49 -0.95 0.09 -1.00 0.00 0.00 179.01 177.68 1ugq n ASN 101 N -3.34 1.54 -0.01 1.42 3.02 0.38 -4.97 115.26 113.30 1ugq n ASN 101 Ca 0.01 -3.01 0.19 0.00 -0.03 0.00 0.00 54.58 51.74 1ugq n ASN 101 Cb 0.67 -0.64 0.66 0.00 -0.61 0.00 0.00 39.78 39.86 1ugq n ASN 101 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1ugq h PRO 102 N 3.85 0.06 -0.57 3.52 0.13 -1.49 -1.47 132.00 136.04 1ugq h PRO 102 Ca 0.11 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1ugq h PRO 102 Cb 0.81 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1ugq h PRO 102 CO 0.59 0.04 0.00 -0.25 -0.23 0.00 0.00 178.00 178.15 1ugq n ASP 103 N -4.40 3.24 -4.75 1.44 8.00 -1.26 -4.95 116.55 113.87 1ugq n ASP 103 Ca 0.10 -1.99 -0.37 0.00 0.71 0.00 0.00 54.79 53.25 1ugq n ASP 103 Cb 0.58 -0.38 0.04 0.00 -0.02 0.00 0.00 41.12 41.34 1ugq n ASP 103 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ugq s ALA 104 N -1.24 2.56 0.83 2.24 0.00 -0.55 -4.97 121.76 120.63 1ugq s ALA 104 Ca 0.40 1.14 -0.11 0.00 0.00 0.00 0.00 51.96 53.40 1ugq s ALA 104 Cb 0.21 -3.51 0.09 0.00 0.00 0.00 0.00 23.12 19.92 1ugq s ALA 104 CO 0.28 -1.33 1.09 -1.25 0.00 0.00 0.00 175.76 174.55 1ugq s PRO 105 N -3.23 1.77 0.59 0.00 0.04 -1.26 -5.05 135.00 127.85 1ugq s PRO 105 Ca 0.77 0.83 -0.05 0.00 0.04 0.00 0.00 61.00 62.60 1ugq s PRO 105 Cb -0.35 -1.87 0.02 0.00 0.04 0.00 0.00 34.50 32.34 1ugq s PRO 105 CO 0.38 -1.89 0.88 -0.51 0.04 0.00 0.00 177.00 175.91 1ugq s LEU 106 N -6.00 3.22 0.46 -3.56 1.43 -1.26 -5.02 118.68 107.95 1ugq s LEU 106 Ca 0.62 0.57 -0.24 0.00 -1.03 0.00 0.00 54.13 54.04 1ugq s LEU 106 Cb -0.16 -3.38 -0.07 0.00 0.03 0.00 0.00 46.19 42.60 1ugq s LEU 106 CO 0.56 -1.11 1.36 -2.84 0.23 0.00 0.00 176.35 174.55 1ugq s PRO 107 N -4.96 3.62 0.47 1.29 0.02 -1.26 -4.94 135.00 129.24 1ugq s PRO 107 Ca 0.54 2.26 -0.24 0.00 0.02 0.00 0.00 61.00 63.58 1ugq s PRO 107 Cb -0.10 -2.56 -0.07 0.00 0.02 0.00 0.00 34.50 31.78 1ugq s PRO 107 CO 0.44 -0.81 1.39 -1.21 -0.33 0.00 0.00 177.00 176.47 1ugq s GLU 108 N -2.53 3.58 -0.04 5.54 0.41 -1.26 -5.00 118.70 119.40 1ugq s GLU 108 Ca 0.63 2.32 -0.29 0.00 -0.41 0.00 0.00 54.97 57.22 1ugq s GLU 108 Cb -0.40 -2.56 0.09 0.00 -1.78 0.00 0.00 34.13 29.48 1ugq s GLU 108 CO 0.51 -0.87 0.81 -3.38 -0.49 0.00 0.00 175.26 171.84 1ugq s HIS 109 N -1.25 -0.49 0.14 1.61 -3.43 -1.26 -5.16 115.29 105.45 1ugq s HIS 109 Ca 0.63 0.67 -0.15 0.00 -0.80 0.00 0.00 55.06 55.41 1ugq s HIS 109 Cb -0.42 0.47 -0.07 0.00 -1.43 0.00 0.00 32.58 31.14 1ugq s HIS 109 CO 0.52 -0.55 0.55 -1.83 -2.00 0.00 0.00 174.74 171.43 1ugq s GLU 110 N -1.95 4.00 0.56 -0.38 -1.05 -1.26 -5.06 118.70 113.55 1ugq s GLU 110 Ca -0.03 0.51 -0.16 0.00 -0.15 0.00 0.00 54.97 55.14 1ugq s GLU 110 Cb -0.00 -2.97 -0.05 0.00 -0.44 0.00 0.00 34.13 30.66 1ugq s GLU 110 CO 0.00 0.50 1.03 -0.65 0.95 0.00 0.00 175.26 177.09 1ugq s GLN 111 N -1.85 3.57 -0.17 -4.83 -1.52 -1.26 -5.05 119.66 108.55 1ugq s GLN 111 Ca 0.36 1.14 -0.01 0.00 -1.95 0.00 0.00 55.36 54.91 1ugq s GLN 111 Cb -0.15 -2.07 0.05 0.00 -0.22 0.00 0.00 33.01 30.61 1ugq s GLN 111 CO 0.19 -0.60 -0.04 0.15 -0.25 0.00 0.00 175.29 174.74 1ugq s LYS 112 N -3.99 1.36 0.48 2.91 1.02 -1.26 -5.01 119.74 115.26 1ugq s LYS 112 Ca 0.62 -0.55 0.16 0.00 0.02 0.00 0.00 55.97 56.23 1ugq s LYS 112 Cb -0.14 -2.06 1.17 0.00 -0.52 0.00 0.00 37.83 36.28 1ugq s LYS 112 CO 0.33 -0.47 2.06 -1.00 -0.92 0.00 0.00 175.35 175.35 1ugq h PRO 113 N 8.12 0.19 -0.35 -1.68 0.13 -2.01 -1.84 132.00 134.57 1ugq h PRO 113 Ca -0.23 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.88 1ugq h PRO 113 Cb 1.11 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.18 1ugq h PRO 113 CO 0.39 0.13 0.16 0.93 -0.23 0.00 0.00 178.00 179.38 1ugq h GLU 114 N 0.20 0.48 -0.16 0.86 3.07 -1.99 -0.77 114.58 116.26 1ugq h GLU 114 Ca 0.15 -0.05 -0.13 0.00 -0.50 0.00 0.00 59.36 58.83 1ugq h GLU 114 Cb 0.36 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.17 1ugq h GLU 114 CO -0.03 0.38 -0.46 -0.07 -1.40 0.00 0.00 179.01 177.43 1ugq h LEU 115 N 0.48 0.44 -0.24 1.33 3.38 -1.77 0.24 115.31 119.17 1ugq h LEU 115 Ca 0.12 -0.21 -0.20 0.00 0.09 0.00 0.00 57.88 57.68 1ugq h LEU 115 Cb 0.06 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1ugq h LEU 115 CO -0.02 0.84 -0.65 0.40 0.09 0.00 0.00 178.44 179.10 1ugq h ILE 116 N 0.33 1.28 -0.67 1.22 1.08 -1.39 -1.81 117.51 117.55 1ugq h ILE 116 Ca 0.02 -1.84 0.01 0.00 -0.39 0.00 0.00 64.86 62.66 1ugq h ILE 116 Cb 0.94 1.79 -0.03 0.00 -3.07 0.00 0.00 36.82 36.45 1ugq h ILE 116 CO 0.08 0.59 0.44 -0.33 -0.69 0.00 0.00 178.15 178.24 1ugq h GLU 117 N 0.61 0.86 -0.16 2.37 5.08 -0.96 -0.61 114.58 121.77 1ugq h GLU 117 Ca -0.02 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1ugq h GLU 117 Cb 1.27 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 1ugq h GLU 117 CO 0.14 0.57 0.10 0.35 -1.00 0.00 0.00 179.01 179.17 1ugq h PHE 118 N 0.89 0.21 0.13 4.33 3.57 -0.79 -0.69 116.94 124.58 1ugq h PHE 118 Ca 0.25 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.76 1ugq h PHE 118 Cb -0.08 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.56 1ugq h PHE 118 CO -0.03 0.16 -0.20 0.28 -2.23 0.00 0.00 178.31 176.29 1ugq h VAL 119 N 0.20 0.55 -0.88 1.41 2.07 -0.86 0.59 116.25 119.34 1ugq h VAL 119 Ca 0.06 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.59 1ugq h VAL 119 Cb 0.01 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.29 1ugq h VAL 119 CO -0.01 0.00 0.57 0.78 0.02 0.00 0.00 177.57 178.93 1ugq h ASN 120 N -0.39 1.01 -0.32 0.57 2.35 -1.02 -0.64 115.58 117.14 1ugq h ASN 120 Ca 0.02 -0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 1ugq h ASN 120 Cb 0.40 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.50 1ugq h ASN 120 CO -0.10 0.74 0.06 1.56 -1.65 0.00 0.00 177.43 178.05 1ugq h GLN 121 N 1.19 0.53 -0.47 0.81 4.20 -0.81 -1.89 115.11 118.67 1ugq h GLN 121 Ca 0.32 -0.14 -0.09 0.00 0.06 0.00 0.00 58.65 58.81 1ugq h GLN 121 Cb -0.12 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.58 1ugq h GLN 121 CO -0.07 0.61 -0.05 0.00 -0.67 0.00 0.00 178.83 178.66 1ugq h ALA 122 N 0.90 0.65 0.29 3.87 0.00 -0.65 0.50 119.26 124.82 1ugq h ALA 122 Ca 0.10 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1ugq h ALA 122 Cb 0.33 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ugq h ALA 122 CO 0.00 0.49 -0.14 0.28 0.00 0.00 0.00 179.25 179.88 1ugq h VAL 123 N 0.72 0.73 0.00 0.00 2.07 -1.10 0.36 116.25 119.03 1ugq h VAL 123 Ca 0.13 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 1ugq h VAL 123 Cb 0.57 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 1ugq h VAL 123 CO 0.03 0.11 -0.71 1.88 0.02 0.00 0.00 177.57 178.90 1ugq h TYR 124 N -0.69 0.00 0.00 1.57 0.05 -1.42 -3.34 116.97 113.14 1ugq h TYR 124 Ca -0.04 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.55 1ugq h TYR 124 Cb 0.48 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.18 1ugq h TYR 124 CO 0.02 0.08 -2.01 0.41 -1.05 0.00 0.00 178.16 175.61 1ugq n GLY 125 N 1.18 -1.05 0.24 3.88 0.00 0.17 -5.07 105.19 104.54 1ugq n GLY 125 Ca 0.00 -0.35 0.03 0.00 0.00 0.00 0.00 46.02 45.70 1ugq n GLY 125 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ugq n GLY 126 N 1.49 -1.60 2.38 -0.02 0.00 0.13 -4.74 105.19 102.82 1ugq n GLY 126 Ca -0.17 -1.46 -0.26 0.00 0.00 0.00 0.00 46.02 44.13 1ugq n GLY 126 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ugq n LEU 127 N -1.96 2.02 -4.65 0.99 4.77 -1.26 -4.71 117.00 112.21 1ugq n LEU 127 Ca -0.00 -5.06 -0.48 0.00 -0.03 0.00 0.00 56.01 50.44 1ugq n LEU 127 Cb 0.11 -0.09 -0.05 0.00 -2.33 0.00 0.00 43.42 41.06 1ugq n LEU 127 CO 0.00 2.02 1.14 -0.81 -1.33 0.00 0.00 177.39 178.41 1ugq n PRO 128 N 1.32 1.84 0.00 3.23 -0.04 -1.26 -4.90 135.00 135.19 1ugq n PRO 128 Ca 0.26 0.66 0.12 0.00 -0.04 0.00 0.00 63.50 64.50 1ugq n PRO 128 Cb 0.45 -2.40 0.18 0.00 -0.04 0.00 0.00 33.50 31.69 1ugq n PRO 128 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ugq n ALA 129 N 3.47 2.96 -1.77 0.55 0.00 -1.26 -4.95 120.51 119.52 1ugq n ALA 129 Ca 0.18 -0.59 -0.39 0.00 0.00 0.00 0.00 53.44 52.64 1ugq n ALA 129 Cb 0.26 -0.91 -0.02 0.00 0.00 0.00 0.00 19.45 18.78 1ugq n ALA 129 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ugq s SER 130 N -2.25 6.51 0.09 0.00 1.04 -1.26 -1.91 113.70 115.92 1ugq s SER 130 Ca 0.26 2.47 -0.07 0.00 0.48 0.00 0.00 55.95 59.09 1ugq s SER 130 Cb 0.19 -2.63 -0.01 0.00 0.10 0.00 0.00 66.02 63.68 1ugq s SER 130 CO 0.44 -0.70 0.15 -0.13 0.98 0.00 0.00 173.24 173.98 1ugq s ARG 131 N -2.19 0.84 -0.11 4.02 1.81 -0.34 -4.91 118.95 118.07 1ugq s ARG 131 Ca 0.56 -1.06 -0.04 0.00 -1.72 0.00 0.00 55.73 53.47 1ugq s ARG 131 Cb -0.34 0.32 -0.04 0.00 -0.45 0.00 0.00 34.95 34.44 1ugq s ARG 131 CO 0.43 -0.26 0.05 -1.21 -0.68 0.00 0.00 175.30 173.64 1ugq s GLU 132 N -3.89 3.22 0.23 3.54 2.02 -1.26 -3.86 118.70 118.69 1ugq s GLU 132 Ca 0.08 -0.32 0.08 0.00 0.02 0.00 0.00 54.97 54.84 1ugq s GLU 132 Cb 0.05 -2.95 -0.05 0.00 0.10 0.00 0.00 34.13 31.28 1ugq s GLU 132 CO -0.09 0.69 -0.14 0.14 0.02 0.00 0.00 175.26 175.88 1ugq s VAL 133 N -0.81 1.89 -0.44 2.63 -7.23 -1.26 -5.04 120.40 110.13 1ugq s VAL 133 Ca 0.13 -2.24 0.23 0.00 -1.81 0.00 0.00 61.98 58.29 1ugq s VAL 133 Cb -0.12 -2.17 0.32 0.00 0.56 0.00 0.00 36.38 34.97 1ugq s VAL 133 CO 0.03 -0.50 1.58 0.44 -0.31 0.00 0.00 175.10 176.34 1ugq h ASP 134 N 2.44 0.00 -3.39 4.85 5.19 -1.99 -3.45 116.42 120.07 1ugq h ASP 134 Ca -0.39 -0.00 -0.55 0.00 -0.62 0.00 0.00 57.03 55.47 1ugq h ASP 134 Cb 1.23 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.71 1ugq h ASP 134 CO 0.63 0.00 -0.03 0.00 -3.12 0.00 0.00 179.24 176.71 1ugq s ARG 135 N -3.21 4.04 0.64 3.56 1.70 -1.26 -5.08 118.95 119.34 1ugq s ARG 135 Ca 0.07 0.58 -0.10 0.00 -0.47 0.00 0.00 55.73 55.81 1ugq s ARG 135 Cb 0.06 -2.90 -0.00 0.00 -0.57 0.00 0.00 34.95 31.53 1ugq s ARG 135 CO 0.67 0.45 1.01 -1.25 -1.08 0.00 0.00 175.30 175.10 1ugq s PRO 136 N -2.00 3.09 0.32 3.89 0.04 -1.26 -5.00 135.00 134.08 1ugq s PRO 136 Ca 0.40 0.40 -0.29 0.00 0.04 0.00 0.00 61.00 61.55 1ugq s PRO 136 Cb -0.15 -2.12 -0.11 0.00 0.04 0.00 0.00 34.50 32.16 1ugq s PRO 136 CO 0.20 -0.79 1.47 -1.25 0.04 0.00 0.00 177.00 176.67 1ugq s PRO 137 N -5.19 4.20 0.14 0.56 0.04 -1.26 -4.92 135.00 128.57 1ugq s PRO 137 Ca 0.56 2.44 0.05 0.00 0.04 0.00 0.00 61.00 64.09 1ugq s PRO 137 Cb -0.11 -3.04 -0.11 0.00 0.04 0.00 0.00 34.50 31.29 1ugq s PRO 137 CO 0.50 -0.47 1.32 -0.22 0.04 0.00 0.00 177.00 178.18 1ugq h LYS 138 N 4.03 0.07 -5.71 4.56 3.64 -1.99 -3.46 116.57 117.71 1ugq h LYS 138 Ca -0.48 -0.10 -0.62 0.00 -1.27 0.00 0.00 60.65 58.17 1ugq h LYS 138 Cb 1.23 0.04 -0.13 0.00 -0.41 0.00 0.00 32.23 32.95 1ugq h LYS 138 CO 0.71 0.97 -0.60 -0.06 -2.27 0.00 0.00 179.45 178.21 1ugq s PHE 139 N -2.91 2.51 0.16 1.91 0.40 -1.26 -5.10 117.98 113.69 1ugq s PHE 139 Ca -0.01 -0.65 -0.10 0.00 -0.60 0.00 0.00 56.93 55.58 1ugq s PHE 139 Cb 0.10 -1.75 -0.00 0.00 0.51 0.00 0.00 43.02 41.88 1ugq s PHE 139 CO 0.82 0.45 0.29 -1.59 0.70 0.00 0.00 175.22 175.89 1ugq s LYS 140 N -3.71 1.13 0.16 0.44 -2.85 -1.26 -4.97 119.74 108.68 1ugq s LYS 140 Ca 0.35 -1.12 -0.34 0.00 -1.00 0.00 0.00 55.97 53.86 1ugq s LYS 140 Cb 0.09 0.38 -0.15 0.00 -2.06 0.00 0.00 37.83 36.09 1ugq s LYS 140 CO 0.18 -0.41 1.33 0.39 0.10 0.00 0.00 175.35 176.94 1ugq n GLU 141 N -0.20 1.48 0.00 1.78 1.02 -1.26 -1.61 120.64 121.85 1ugq n GLU 141 Ca -0.09 0.53 0.00 0.00 -0.02 0.00 0.00 57.16 57.59 1ugq n GLU 141 Cb 0.63 -2.15 0.00 0.00 -0.02 0.00 0.00 31.44 29.90 1ugq n GLU 141 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ugq n GLY 142 N 2.42 3.36 3.76 0.62 0.00 -0.42 -4.99 105.19 109.93 1ugq n GLY 142 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1ugq n GLY 142 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ugq s ASP 143 N -0.45 6.64 -0.21 1.61 1.01 -0.63 -4.72 116.67 119.93 1ugq s ASP 143 Ca 0.00 2.75 -0.14 0.00 0.71 0.00 0.00 52.55 55.86 1ugq s ASP 143 Cb 0.00 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.25 1ugq s ASP 143 CO 0.00 -0.67 0.33 -0.69 0.21 0.00 0.00 175.17 174.35 1ugq s VAL 144 N -0.66 5.25 0.23 -1.27 1.01 0.20 -0.85 120.40 124.30 1ugq s VAL 144 Ca 0.54 0.56 0.04 0.00 0.00 0.00 0.00 61.98 63.11 1ugq s VAL 144 Cb -0.42 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 1ugq s VAL 144 CO 0.51 0.29 -0.01 0.68 0.00 0.00 0.00 175.10 176.56 1ugq s VAL 145 N 1.18 1.06 -0.10 2.92 -7.23 -0.03 0.51 120.40 118.71 1ugq s VAL 145 Ca 0.16 -2.04 0.04 0.00 -1.81 0.00 0.00 61.98 58.33 1ugq s VAL 145 Cb -0.14 -2.31 0.00 0.00 0.56 0.00 0.00 36.38 34.49 1ugq s VAL 145 CO 0.07 -0.35 -0.23 -0.60 -0.31 0.00 0.00 175.10 173.68 1ugq s ARG 146 N -3.85 2.91 0.17 4.82 3.52 -0.29 -0.76 118.95 125.47 1ugq s ARG 146 Ca 0.28 -0.83 -0.30 0.00 -0.13 0.00 0.00 55.73 54.74 1ugq s ARG 146 Cb 0.05 -2.21 -0.08 0.00 -1.56 0.00 0.00 34.95 31.16 1ugq s ARG 146 CO 0.08 0.16 1.10 0.12 -0.81 0.00 0.00 175.30 175.96 1ugq s PHE 147 N 0.38 3.58 0.64 5.12 5.36 0.28 -2.19 117.98 131.15 1ugq s PHE 147 Ca -0.18 1.59 -0.17 0.00 -0.96 0.00 0.00 56.93 57.20 1ugq s PHE 147 Cb -0.18 -3.28 -0.04 0.00 -0.34 0.00 0.00 43.02 39.18 1ugq s PHE 147 CO 0.08 -0.63 0.82 0.45 -1.46 0.00 0.00 175.22 174.48 1ugq n SER 148 N 2.43 0.10 -1.23 6.13 2.88 0.14 -0.32 113.62 123.75 1ugq n SER 148 Ca 0.03 0.73 0.08 0.00 -1.33 0.00 0.00 58.87 58.38 1ugq n SER 148 Cb 0.46 -1.33 0.30 0.00 -0.75 0.00 0.00 64.21 62.89 1ugq n SER 148 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1ugq n THR 149 N -1.98 2.08 -1.60 2.46 -2.24 -1.26 -3.14 114.28 108.60 1ugq n THR 149 Ca 0.13 -1.48 -0.34 0.00 -2.27 0.00 0.00 64.05 60.09 1ugq n THR 149 Cb 0.48 -0.05 0.07 0.00 -2.10 0.00 0.00 70.33 68.74 1ugq n THR 149 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ugq s ALA 150 N -2.29 2.28 -0.45 6.98 0.00 -1.26 -4.99 121.76 122.04 1ugq s ALA 150 Ca 0.44 0.76 0.08 0.00 0.00 0.00 0.00 51.96 53.23 1ugq s ALA 150 Cb 0.32 -3.41 0.26 0.00 0.00 0.00 0.00 23.12 20.29 1ugq s ALA 150 CO 0.15 -1.59 0.58 -1.13 0.00 0.00 0.00 175.76 173.78 1ugq n SER 151 N -2.52 1.04 -4.68 0.00 3.41 -1.26 -5.09 113.62 104.52 1ugq n SER 151 Ca 0.12 -2.88 -0.43 0.00 -0.26 0.00 0.00 58.87 55.42 1ugq n SER 151 Cb 0.51 -0.64 -0.00 0.00 -0.26 0.00 0.00 64.21 63.81 1ugq n SER 151 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1ugq n PRO 152 N 1.21 1.94 0.14 4.33 -0.04 -1.26 -4.89 135.00 136.44 1ugq n PRO 152 Ca 0.23 0.68 0.12 0.00 -0.04 0.00 0.00 63.50 64.50 1ugq n PRO 152 Cb 0.51 -2.24 0.22 0.00 -0.04 0.00 0.00 33.50 31.95 1ugq n PRO 152 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1ugq h LYS 153 N 2.35 0.00 0.00 0.54 1.57 -1.99 -2.83 116.57 116.21 1ugq h LYS 153 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1ugq h LYS 153 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1ugq h LYS 153 CO 0.62 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.91 1ugq n GLY 154 N 1.21 1.27 3.77 3.86 0.00 -1.26 -4.29 105.19 109.76 1ugq n GLY 154 Ca 0.04 -2.02 -0.39 0.00 0.00 0.00 0.00 46.02 43.64 1ugq n GLY 154 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ugq s HIS 155 N 0.67 2.71 -0.02 1.61 2.46 -1.26 0.33 115.29 121.79 1ugq s HIS 155 Ca 0.00 1.38 -0.30 0.00 0.47 0.00 0.00 55.06 56.62 1ugq s HIS 155 Cb 0.00 -3.72 0.11 0.00 -0.13 0.00 0.00 32.58 28.84 1ugq s HIS 155 CO 0.00 -2.29 1.02 0.00 -2.47 0.00 0.00 174.74 171.00 1ugq s ALA 156 N -1.27 -1.90 -0.69 1.58 0.00 -1.26 -4.10 121.76 114.13 1ugq s ALA 156 Ca 0.59 0.94 0.03 0.00 0.00 0.00 0.00 51.96 53.53 1ugq s ALA 156 Cb -0.39 0.33 0.34 0.00 0.00 0.00 0.00 23.12 23.40 1ugq s ALA 156 CO 0.50 -0.78 1.22 0.54 0.00 0.00 0.00 175.76 177.23 1ugq n ARG 157 N -0.28 3.80 -3.61 0.00 5.12 -1.26 -4.62 116.66 115.81 1ugq n ARG 157 Ca -0.06 -4.75 -0.32 0.00 -1.93 0.00 0.00 57.85 50.79 1ugq n ARG 157 Cb 0.61 -2.30 -0.08 0.00 -1.16 0.00 0.00 32.46 29.53 1ugq n ARG 157 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1ugq n ARG 158 N -0.23 2.54 -1.64 5.56 1.74 -1.26 -5.00 116.66 118.38 1ugq n ARG 158 Ca 0.36 -4.54 -0.49 0.00 -0.77 0.00 0.00 57.85 52.41 1ugq n ARG 158 Cb 0.37 -2.35 -0.05 0.00 -1.02 0.00 0.00 32.46 29.41 1ugq n ARG 158 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ugq n ALA 159 N 1.78 0.18 -0.17 7.54 0.00 -1.26 -4.82 120.51 123.76 1ugq n ALA 159 Ca 0.23 0.47 0.18 0.00 0.00 0.00 0.00 53.44 54.32 1ugq n ALA 159 Cb 0.37 -2.22 0.54 0.00 0.00 0.00 0.00 19.45 18.14 1ugq n ALA 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ugq h ARG 160 N 5.52 0.32 0.00 0.00 3.08 -1.91 -1.65 114.38 119.74 1ugq h ARG 160 Ca -0.46 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.57 1ugq h ARG 160 Cb 1.30 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.27 1ugq h ARG 160 CO 0.84 0.21 0.00 2.48 -1.07 0.00 0.00 179.97 182.44 1ugq n TYR 161 N -4.46 0.50 0.39 3.04 4.11 -1.26 -2.77 117.16 116.71 1ugq n TYR 161 Ca 0.15 0.21 0.06 0.00 -0.00 0.00 0.00 57.90 58.33 1ugq n TYR 161 Cb 0.61 -0.84 -0.09 0.00 -0.00 0.00 0.00 39.34 39.03 1ugq n TYR 161 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.86 178.19 1ugq n VAL 162 N -1.97 0.00 -1.73 -3.48 0.24 -0.63 -4.88 118.33 105.88 1ugq n VAL 162 Ca 0.02 -0.23 -0.42 0.00 -2.04 0.00 0.00 64.34 61.66 1ugq n VAL 162 Cb 0.16 0.70 -0.02 0.00 -1.47 0.00 0.00 33.84 33.22 1ugq n VAL 162 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1ugq n ARG 163 N -1.55 2.63 -0.67 7.34 1.74 -1.12 -1.58 116.66 123.45 1ugq n ARG 163 Ca 0.01 0.94 0.00 0.00 -0.77 0.00 0.00 57.85 58.02 1ugq n ARG 163 Cb 0.26 -2.71 0.00 0.00 -1.02 0.00 0.00 32.46 28.99 1ugq n ARG 163 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ugq n GLY 164 N 2.32 1.16 3.88 -0.13 0.00 0.57 -4.93 105.19 108.05 1ugq n GLY 164 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1ugq n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ugq s LYS 165 N -0.17 3.76 -0.13 1.61 -0.14 -0.62 -4.72 119.74 119.33 1ugq s LYS 165 Ca 0.00 0.36 -0.04 0.00 -1.36 0.00 0.00 55.97 54.93 1ugq s LYS 165 Cb 0.00 -2.47 -0.03 0.00 -1.68 0.00 0.00 37.83 33.64 1ugq s LYS 165 CO 0.00 0.06 0.01 0.99 -0.76 0.00 0.00 175.35 175.65 1ugq s THR 166 N -2.24 4.39 0.16 2.17 2.01 -1.26 -0.56 115.64 120.31 1ugq s THR 166 Ca 0.49 -0.20 0.01 0.00 0.31 0.00 0.00 61.69 62.31 1ugq s THR 166 Cb -0.10 -2.90 -0.00 0.00 0.01 0.00 0.00 72.50 69.50 1ugq s THR 166 CO 0.29 0.54 0.18 0.61 -0.69 0.00 0.00 174.62 175.56 1ugq n GLY 167 N 2.85 3.06 3.22 4.40 0.00 0.06 -4.70 105.19 114.08 1ugq n GLY 167 Ca -0.18 -1.62 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 1ugq n GLY 167 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ugq s THR 168 N -2.62 1.95 0.03 2.61 2.01 -0.13 -0.85 115.64 118.64 1ugq s THR 168 Ca 0.16 -0.99 -0.30 0.00 0.31 0.00 0.00 61.69 60.87 1ugq s THR 168 Cb 0.00 -1.67 -0.07 0.00 0.01 0.00 0.00 72.50 70.77 1ugq s THR 168 CO 0.11 0.54 1.63 -0.69 -0.69 0.00 0.00 174.62 175.52 1ugq s VAL 169 N 0.09 3.24 -0.18 3.82 1.01 -0.03 -0.32 120.40 128.02 1ugq s VAL 169 Ca -0.10 0.59 0.08 0.00 0.00 0.00 0.00 61.98 62.56 1ugq s VAL 169 Cb -0.15 -3.38 -0.22 0.00 0.00 0.00 0.00 36.38 32.62 1ugq s VAL 169 CO 0.06 -0.01 0.11 0.52 0.00 0.00 0.00 175.10 175.77 1ugq n VAL 170 N 4.90 1.52 -3.60 2.92 0.31 0.98 -1.31 118.33 124.05 1ugq n VAL 170 Ca 0.16 -0.72 -0.11 0.00 -0.01 0.00 0.00 64.34 63.65 1ugq n VAL 170 Cb 0.41 -1.06 -0.06 0.00 -0.91 0.00 0.00 33.84 32.23 1ugq n VAL 170 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1ugq s LYS 171 N -2.53 0.65 -0.24 5.55 2.20 -1.16 -4.82 119.74 119.39 1ugq s LYS 171 Ca -0.19 0.40 -0.09 0.00 -0.36 0.00 0.00 55.97 55.74 1ugq s LYS 171 Cb 0.07 0.31 -0.04 0.00 -1.51 0.00 0.00 37.83 36.66 1ugq s LYS 171 CO 0.74 -0.15 0.11 -1.58 -0.36 0.00 0.00 175.35 174.11 1ugq s HIS 172 N -0.50 3.19 -2.14 4.03 5.65 -1.26 -1.03 115.29 123.23 1ugq s HIS 172 Ca -0.01 -0.08 0.23 0.00 0.25 0.00 0.00 55.06 55.45 1ugq s HIS 172 Cb -0.02 -2.23 0.15 0.00 -1.18 0.00 0.00 32.58 29.30 1ugq s HIS 172 CO -0.00 -0.12 1.20 0.72 -0.65 0.00 0.00 174.74 175.89 1ugq n HIS 173 N 4.49 0.00 0.00 3.88 -0.00 0.17 -5.01 115.22 118.75 1ugq n HIS 173 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.56 1ugq n HIS 173 Cb 0.52 -0.02 0.00 0.00 -0.00 0.00 0.00 29.99 30.49 1ugq n HIS 173 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1ugq n GLY 174 N 1.39 -1.98 3.90 -1.41 0.00 -1.25 -4.92 105.19 100.91 1ugq n GLY 174 Ca 0.11 -2.10 -0.31 0.00 0.00 0.00 0.00 46.02 43.71 1ugq n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ugq s ALA 175 N -1.78 3.77 0.13 4.61 0.00 -1.25 -0.36 121.76 126.88 1ugq s ALA 175 Ca 0.00 -0.55 -0.06 0.00 0.00 0.00 0.00 51.96 51.35 1ugq s ALA 175 Cb 0.00 -2.16 -0.02 0.00 0.00 0.00 0.00 23.12 20.95 1ugq s ALA 175 CO 0.00 0.63 0.18 0.71 0.00 0.00 0.00 175.76 177.28 1ugq s TYR 176 N -1.70 0.48 0.25 0.00 1.51 -0.36 -1.20 117.35 116.33 1ugq s TYR 176 Ca 0.42 -0.88 -0.30 0.00 -1.01 0.00 0.00 57.07 55.30 1ugq s TYR 176 Cb -0.12 -0.20 -0.14 0.00 -0.11 0.00 0.00 41.96 41.39 1ugq s TYR 176 CO 0.25 -0.60 1.18 -0.89 -1.11 0.00 0.00 175.55 174.38 1ugq n ILE 177 N -0.12 1.39 -3.30 2.71 5.41 -0.80 -1.18 119.36 123.47 1ugq n ILE 177 Ca -0.09 -0.35 -0.40 0.00 1.00 0.00 0.00 62.75 62.91 1ugq n ILE 177 Cb 0.63 -1.13 -0.08 0.00 -0.71 0.00 0.00 39.64 38.35 1ugq n ILE 177 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 1ugq s TYR 178 N -0.54 3.22 0.23 1.39 5.04 -0.39 -4.77 117.35 121.53 1ugq s TYR 178 Ca 0.65 0.34 -0.07 0.00 -2.44 0.00 0.00 57.07 55.56 1ugq s TYR 178 Cb -0.72 -2.75 0.27 0.00 0.35 0.00 0.00 41.96 39.11 1ugq s TYR 178 CO 0.55 -0.38 1.86 -1.35 -1.34 0.00 0.00 175.55 174.90 1ugq h PRO 179 N 8.26 0.96 -0.12 4.97 0.11 -1.91 -1.12 132.00 143.15 1ugq h PRO 179 Ca -0.29 -0.06 0.04 0.00 0.11 0.00 0.00 66.00 65.79 1ugq h PRO 179 Cb 1.14 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 1ugq h PRO 179 CO 0.71 0.64 0.25 -0.44 -0.21 0.00 0.00 178.00 178.95 1ugq h ASP 180 N 0.99 0.00 0.00 -2.05 3.45 -1.95 0.12 116.42 116.98 1ugq h ASP 180 Ca 0.34 0.00 -0.34 0.00 0.43 0.00 0.00 57.03 57.46 1ugq h ASP 180 Cb 0.07 0.00 -0.05 0.00 -0.56 0.00 0.00 39.33 38.79 1ugq h ASP 180 CO -0.14 0.00 -2.11 0.35 -1.57 0.00 0.00 179.24 175.78 1ugq n THR 181 N -3.34 1.15 -0.12 0.35 -2.24 -1.07 -4.50 114.28 104.51 1ugq n THR 181 Ca 0.00 -0.27 -0.06 0.00 -2.27 0.00 0.00 64.05 61.46 1ugq n THR 181 Cb 0.35 -1.80 0.03 0.00 -2.10 0.00 0.00 70.33 66.81 1ugq n THR 181 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ugq h ALA 182 N -0.74 0.46 0.00 6.98 0.00 0.18 0.34 119.26 126.47 1ugq h ALA 182 Ca -0.51 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1ugq h ALA 182 Cb 1.43 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.25 1ugq h ALA 182 CO -0.31 -0.26 0.00 0.41 0.00 0.00 0.00 179.25 179.09 1ugq n GLY 183 N -1.23 -0.99 0.67 0.00 0.00 0.38 -2.28 105.19 101.74 1ugq n GLY 183 Ca 0.02 -0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.10 1ugq n GLY 183 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ugq n ASN 184 N -1.58 3.41 -1.51 1.61 3.02 -0.63 -4.26 115.26 115.32 1ugq n ASN 184 Ca 0.03 -3.06 -0.15 0.00 -0.03 0.00 0.00 54.58 51.37 1ugq n ASN 184 Cb 0.16 -0.52 -0.03 0.00 -0.61 0.00 0.00 39.78 38.79 1ugq n ASN 184 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ugq n GLY 185 N -0.79 0.35 1.03 7.41 0.00 -0.96 -4.90 105.19 107.33 1ugq n GLY 185 Ca 0.20 -0.28 0.08 0.00 0.00 0.00 0.00 46.02 46.02 1ugq n GLY 185 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ugq n LEU 186 N -1.98 3.76 0.00 0.99 4.77 0.11 -5.00 117.00 119.65 1ugq n LEU 186 Ca -0.17 -2.35 0.00 0.00 -0.03 0.00 0.00 56.01 53.46 1ugq n LEU 186 Cb 0.58 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1ugq n LEU 186 CO 0.21 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 177.65 1ugq n GLY 187 N 0.57 0.19 0.32 -0.72 0.00 -1.24 -4.72 105.19 99.58 1ugq n GLY 187 Ca 0.19 -1.83 -0.08 0.00 0.00 0.00 0.00 46.02 44.30 1ugq n GLY 187 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1ugq h GLU 188 N 0.00 1.11 -7.27 1.61 5.08 -1.90 -0.73 114.58 112.48 1ugq h GLU 188 Ca 0.00 -0.32 -0.18 0.00 -1.00 0.00 0.00 59.36 57.86 1ugq h GLU 188 Cb 0.00 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1ugq h GLU 188 CO 0.00 1.04 -0.30 0.00 -1.00 0.00 0.00 179.01 178.75 1ugq n PRO 190 N -2.17 0.77 -4.07 0.00 -0.02 -1.26 -4.11 135.00 124.14 1ugq n PRO 190 Ca -0.03 0.27 -0.13 0.00 -2.02 0.00 0.00 63.50 61.59 1ugq n PRO 190 Cb 0.17 -1.52 -0.11 0.00 -0.02 0.00 0.00 33.50 32.01 1ugq n PRO 190 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ugq s GLU 191 N -1.42 0.54 0.50 -0.52 0.41 -0.33 -4.88 118.70 113.01 1ugq s GLU 191 Ca 0.61 -0.77 -0.23 0.00 -0.41 0.00 0.00 54.97 54.17 1ugq s GLU 191 Cb -0.73 -0.31 -0.06 0.00 -1.78 0.00 0.00 34.13 31.24 1ugq s GLU 191 CO 0.58 0.05 1.35 -1.01 -0.49 0.00 0.00 175.26 175.75 1ugq s HIS 192 N -1.39 2.44 -0.06 1.61 3.76 -1.26 -1.22 115.29 119.17 1ugq s HIS 192 Ca -0.10 1.36 0.05 0.00 -0.15 0.00 0.00 55.06 56.23 1ugq s HIS 192 Cb -0.10 -3.78 -0.02 0.00 1.11 0.00 0.00 32.58 29.80 1ugq s HIS 192 CO 0.00 -2.69 -0.22 -1.17 -0.85 0.00 0.00 174.74 169.82 1ugq s LEU 193 N -3.15 2.27 0.04 0.89 2.96 0.51 -0.46 118.68 121.75 1ugq s LEU 193 Ca 0.66 -0.42 0.03 0.00 -0.22 0.00 0.00 54.13 54.18 1ugq s LEU 193 Cb -0.40 -1.43 -0.02 0.00 0.50 0.00 0.00 46.19 44.84 1ugq s LEU 193 CO 0.49 0.26 -0.10 -0.31 -1.32 0.00 0.00 176.35 175.37 1ugq s TYR 194 N -0.26 0.83 -0.19 5.38 1.51 -0.13 -0.65 117.35 123.84 1ugq s TYR 194 Ca -0.00 -0.44 -0.12 0.00 -1.01 0.00 0.00 57.07 55.50 1ugq s TYR 194 Cb -0.13 -0.49 -0.05 0.00 -0.11 0.00 0.00 41.96 41.18 1ugq s TYR 194 CO 0.03 -0.03 0.21 0.99 -1.11 0.00 0.00 175.55 175.63 1ugq s THR 195 N -1.19 5.35 -0.02 -0.71 2.01 -0.19 0.77 115.64 121.65 1ugq s THR 195 Ca -0.06 0.35 0.08 0.00 0.31 0.00 0.00 61.69 62.37 1ugq s THR 195 Cb -0.09 -3.55 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 1ugq s THR 195 CO 0.01 0.40 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.40 1ugq s VAL 196 N 0.52 2.00 -0.21 3.82 1.01 0.24 -0.01 120.40 127.76 1ugq s VAL 196 Ca 0.12 -1.08 -0.10 0.00 0.00 0.00 0.00 61.98 60.92 1ugq s VAL 196 Cb -0.12 -1.67 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 1ugq s VAL 196 CO 0.01 0.57 0.15 -0.60 0.00 0.00 0.00 175.10 175.23 1ugq s ARG 197 N -0.53 4.15 -0.10 2.72 3.52 0.56 -1.06 118.95 128.21 1ugq s ARG 197 Ca 0.08 -0.22 0.03 0.00 -0.13 0.00 0.00 55.73 55.49 1ugq s ARG 197 Cb -0.10 -3.47 0.01 0.00 -1.56 0.00 0.00 34.95 29.83 1ugq s ARG 197 CO -0.00 0.20 -0.19 -0.06 -0.81 0.00 0.00 175.30 174.43 1ugq s PHE 198 N 0.65 2.22 0.64 5.12 0.40 0.06 -0.96 117.98 126.11 1ugq s PHE 198 Ca 0.08 -0.95 -0.16 0.00 -0.60 0.00 0.00 56.93 55.31 1ugq s PHE 198 Cb -0.12 -1.52 -0.01 0.00 0.51 0.00 0.00 43.02 41.87 1ugq s PHE 198 CO 0.01 -0.42 1.11 0.95 0.70 0.00 0.00 175.22 177.57 1ugq s THR 199 N 0.58 3.22 0.40 0.64 -4.23 -1.26 0.10 115.64 115.09 1ugq s THR 199 Ca -0.14 0.60 0.10 0.00 -1.18 0.00 0.00 61.69 61.06 1ugq s THR 199 Cb -0.17 -3.13 0.18 0.00 1.34 0.00 0.00 72.50 70.72 1ugq s THR 199 CO 0.05 -0.32 1.94 0.00 -0.54 0.00 0.00 174.62 175.75 1ugq h ALA 200 N 0.24 1.56 -0.71 3.99 0.00 -1.23 -2.15 119.26 120.96 1ugq h ALA 200 Ca -0.47 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.21 1ugq h ALA 200 Cb 1.25 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 1ugq h ALA 200 CO 0.55 0.32 0.25 1.96 0.00 0.00 0.00 179.25 182.33 1ugq h GLN 201 N 0.25 1.08 -0.55 0.00 7.50 -1.78 0.13 115.11 121.74 1ugq h GLN 201 Ca 0.05 -0.22 -0.07 0.00 0.50 0.00 0.00 58.65 58.92 1ugq h GLN 201 Cb 0.31 -0.16 -0.02 0.00 0.05 0.00 0.00 27.48 27.65 1ugq h GLN 201 CO 0.01 0.91 0.08 1.49 -1.50 0.00 0.00 178.83 179.83 1ugq h GLU 202 N 1.03 0.91 -0.02 1.46 4.57 -1.70 0.18 114.58 121.01 1ugq h GLU 202 Ca 0.23 -0.25 -0.13 0.00 -1.18 0.00 0.00 59.36 58.03 1ugq h GLU 202 Cb 0.26 -0.10 0.01 0.00 -0.16 0.00 0.00 28.75 28.76 1ugq h GLU 202 CO -0.01 0.89 -0.50 -0.07 -1.18 0.00 0.00 179.01 178.13 1ugq h LEU 203 N 0.80 0.48 -0.97 1.64 3.38 -1.14 -3.39 115.31 116.11 1ugq h LEU 203 Ca 0.17 -0.73 0.00 0.00 0.09 0.00 0.00 57.88 57.40 1ugq h LEU 203 Cb 0.42 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1ugq h LEU 203 CO 0.01 1.15 -0.15 0.79 0.09 0.00 0.00 178.44 180.33 1ugq n TRP 204 N -4.29 0.00 -4.16 1.13 7.02 0.42 -5.02 117.44 112.53 1ugq n TRP 204 Ca -0.10 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.38 1ugq n TRP 204 Cb 0.62 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.51 1ugq n TRP 204 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1ugq n GLY 205 N 0.82 -0.45 0.31 6.99 0.00 0.64 -3.66 105.19 109.84 1ugq n GLY 205 Ca 0.05 -1.09 0.15 0.00 0.00 0.00 0.00 46.02 45.12 1ugq n GLY 205 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ugq h PRO 206 N 0.00 0.00 0.00 1.61 0.13 -1.93 -1.52 132.00 130.29 1ugq h PRO 206 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1ugq h PRO 206 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1ugq h PRO 206 CO 0.00 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.16 1ugq n GLU 207 N -4.01 0.14 -2.44 0.86 4.71 -1.24 -4.82 120.64 113.84 1ugq n GLU 207 Ca -0.00 0.15 -0.33 0.00 -0.01 0.00 0.00 57.16 56.97 1ugq n GLU 207 Cb 0.21 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.11 1ugq n GLU 207 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1ugq s GLY 208 N -2.76 2.27 0.05 0.62 0.00 -0.57 -4.98 107.32 101.93 1ugq s GLY 208 Ca 0.13 0.39 -0.30 0.00 0.00 0.00 0.00 44.72 44.94 1ugq s GLY 208 CO 0.30 0.69 1.66 -0.35 0.00 0.00 0.00 173.10 175.39 1ugq s ASP 209 N -2.53 6.62 0.66 1.64 -1.08 -1.26 -4.78 116.67 115.94 1ugq s ASP 209 Ca 0.63 2.44 0.44 0.00 -0.52 0.00 0.00 52.55 55.54 1ugq s ASP 209 Cb -0.13 -2.56 2.38 0.00 -1.46 0.00 0.00 42.92 41.16 1ugq s ASP 209 CO 0.26 -0.89 2.34 1.55 0.52 0.00 0.00 175.17 178.95 1ugq h PRO 210 N 8.57 0.00 -1.68 4.34 0.13 -1.93 -3.13 132.00 138.30 1ugq h PRO 210 Ca -0.42 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.18 1ugq h PRO 210 Cb 1.20 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.92 1ugq h PRO 210 CO 0.93 0.00 -0.87 -1.71 -0.23 0.00 0.00 178.00 176.12 1ugq n ASN 211 N -3.04 3.40 -3.80 1.44 5.15 -1.26 -4.99 115.26 112.16 1ugq n ASN 211 Ca -0.03 -3.39 -0.12 0.00 -0.60 0.00 0.00 54.58 50.44 1ugq n ASN 211 Cb 0.08 -0.52 -0.09 0.00 -0.53 0.00 0.00 39.78 38.72 1ugq n ASN 211 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1ugq s SER 212 N -3.28 -0.09 0.02 1.20 0.15 -1.18 -5.09 113.70 105.43 1ugq s SER 212 Ca 0.43 -0.11 -0.03 0.00 0.70 0.00 0.00 55.95 56.94 1ugq s SER 212 Cb 0.37 0.29 -0.02 0.00 -1.71 0.00 0.00 66.02 64.96 1ugq s SER 212 CO -0.11 -0.48 0.03 -0.44 1.20 0.00 0.00 173.24 173.44 1ugq s SER 213 N -1.61 0.20 -0.11 5.45 0.01 -1.26 -0.85 113.70 115.53 1ugq s SER 213 Ca -0.11 -0.48 0.02 0.00 1.31 0.00 0.00 55.95 56.69 1ugq s SER 213 Cb -0.04 0.15 -0.01 0.00 0.21 0.00 0.00 66.02 66.33 1ugq s SER 213 CO 0.01 -0.38 -0.18 -0.69 0.41 0.00 0.00 173.24 172.42 1ugq s VAL 214 N -1.84 2.64 -0.22 3.43 1.01 0.11 -4.90 120.40 120.64 1ugq s VAL 214 Ca -0.12 -0.82 -0.10 0.00 0.00 0.00 0.00 61.98 60.94 1ugq s VAL 214 Cb -0.07 -2.07 -0.05 0.00 0.00 0.00 0.00 36.38 34.20 1ugq s VAL 214 CO -0.02 0.54 0.14 -0.31 0.00 0.00 0.00 175.10 175.46 1ugq s TYR 215 N 0.26 3.35 -0.02 5.22 1.51 -1.26 -0.76 117.35 125.65 1ugq s TYR 215 Ca -0.12 0.26 0.01 0.00 -1.01 0.00 0.00 57.07 56.21 1ugq s TYR 215 Cb -0.16 -2.21 0.01 0.00 -0.11 0.00 0.00 41.96 39.49 1ugq s TYR 215 CO 0.06 0.17 -0.04 -0.47 -1.11 0.00 0.00 175.55 174.16 1ugq s TYR 216 N 0.70 0.51 -0.03 2.71 5.04 -0.23 -4.95 117.35 121.11 1ugq s TYR 216 Ca 0.07 -0.10 -0.27 0.00 -2.44 0.00 0.00 57.07 54.34 1ugq s TYR 216 Cb -0.12 -0.41 -0.03 0.00 0.35 0.00 0.00 41.96 41.75 1ugq s TYR 216 CO 0.01 -0.07 0.83 -0.51 -1.34 0.00 0.00 175.55 174.48 1ugq s ASP 217 N 0.31 7.18 -0.09 4.32 -0.00 -1.26 -0.60 116.67 126.53 1ugq s ASP 217 Ca -0.03 1.42 0.02 0.00 -0.00 0.00 0.00 52.55 53.96 1ugq s ASP 217 Cb -0.07 -2.49 0.01 0.00 -0.00 0.00 0.00 42.92 40.37 1ugq s ASP 217 CO -0.00 -0.17 -0.15 0.00 -0.00 0.00 0.00 175.17 174.84 1ugq s TRP 219 N 0.81 3.12 0.27 0.00 0.51 -1.26 -0.96 118.94 121.44 1ugq s TRP 219 Ca -0.11 1.56 -0.06 0.00 -2.12 0.00 0.00 56.10 55.38 1ugq s TRP 219 Cb -0.16 -2.98 0.51 0.00 -0.81 0.00 0.00 33.47 30.04 1ugq s TRP 219 CO 0.01 -0.66 1.58 1.49 -0.51 0.00 0.00 176.95 178.87 1ugq h GLU 220 N 1.39 0.02 0.00 4.98 4.81 -1.07 0.44 114.58 125.15 1ugq h GLU 220 Ca -0.49 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1ugq h GLU 220 Cb 1.21 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.58 1ugq h GLU 220 CO 0.59 0.01 0.00 -1.35 -0.73 0.00 0.00 179.01 177.54 1ugq h PRO 221 N 0.02 0.00 0.00 0.92 0.11 -1.92 -2.54 132.00 128.59 1ugq h PRO 221 Ca 0.48 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.55 1ugq h PRO 221 Cb 0.84 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.95 1ugq h PRO 221 CO -0.89 0.00 -0.22 1.88 -0.21 0.00 0.00 178.00 178.56 1ugq h TYR 222 N 0.00 0.00 -3.94 0.65 -1.99 -1.26 -3.46 116.97 106.97 1ugq h TYR 222 Ca 0.00 0.00 -0.54 0.00 2.00 0.00 0.00 58.73 60.19 1ugq h TYR 222 Cb 0.13 0.00 -0.22 0.00 2.00 0.00 0.00 36.73 38.64 1ugq h TYR 222 CO 0.00 0.22 -0.82 0.96 -0.00 0.00 0.00 178.16 178.52 1ugq s ILE 223 N -3.70 1.64 0.04 -2.88 -4.36 -0.96 0.25 121.20 111.23 1ugq s ILE 223 Ca 0.00 -1.50 0.05 0.00 -0.26 0.00 0.00 60.65 58.95 1ugq s ILE 223 Cb 0.10 -1.50 -0.02 0.00 1.25 0.00 0.00 42.46 42.30 1ugq s ILE 223 CO 0.63 -0.07 -0.15 -1.61 0.24 0.00 0.00 174.94 173.98 1ugq s GLU 224 N -1.85 1.03 0.38 0.37 0.41 -0.93 -4.95 118.70 113.16 1ugq s GLU 224 Ca 0.05 -0.77 -0.27 0.00 -0.41 0.00 0.00 54.97 53.57 1ugq s GLU 224 Cb -0.10 -1.05 -0.10 0.00 -1.78 0.00 0.00 34.13 31.10 1ugq s GLU 224 CO 0.04 0.26 1.42 -1.17 -0.49 0.00 0.00 175.26 175.33 1ugq s LEU 225 N -1.09 4.29 -0.02 1.80 2.96 -1.26 -1.14 118.68 124.22 1ugq s LEU 225 Ca 0.03 2.92 -0.03 0.00 -0.22 0.00 0.00 54.13 56.83 1ugq s LEU 225 Cb -0.08 -3.74 -0.02 0.00 0.50 0.00 0.00 46.19 42.85 1ugq s LEU 225 CO 0.01 -0.86 -0.07 0.52 -1.32 0.00 0.00 176.35 174.63 1ugq n VAL 226 N 0.37 0.67 -3.72 1.68 0.31 0.18 -4.80 118.33 113.02 1ugq n VAL 226 Ca 0.02 0.08 -0.13 0.00 -0.01 0.00 0.00 64.34 64.30 1ugq n VAL 226 Cb 0.41 -1.64 -0.13 0.00 -0.91 0.00 0.00 33.84 31.56 1ugq n VAL 226 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1ugq s ASP 227 N -5.68 -0.16 0.00 4.52 1.01 -0.62 -4.98 116.67 110.76 1ugq s ASP 227 Ca -0.07 0.48 0.15 0.00 0.71 0.00 0.00 52.55 53.83 1ugq s ASP 227 Cb 0.02 0.39 0.92 0.00 1.01 0.00 0.00 42.92 45.26 1ugq s ASP 227 CO 0.09 -0.17 1.34 1.07 0.21 0.00 0.00 175.17 177.71