#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sur n LYS 2 N 0.00 2.18 -1.70 4.33 5.02 -1.26 -4.88 118.16 121.85 1sur n LYS 2 Ca 0.00 0.78 -0.43 0.00 -2.02 0.00 0.00 58.31 56.64 1sur n LYS 2 Cb 0.00 -2.49 -0.01 0.00 -0.02 0.00 0.00 35.03 32.51 1sur n LYS 2 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1sur n LEU 3 N 2.62 3.63 -4.32 -0.35 4.77 -1.26 -4.97 117.00 117.11 1sur n LEU 3 Ca 0.13 1.20 -0.41 0.00 -0.03 0.00 0.00 56.01 56.89 1sur n LEU 3 Cb 0.31 -1.49 -0.10 0.00 -2.33 0.00 0.00 43.42 39.81 1sur n LEU 3 CO 0.63 -0.40 -0.09 -0.62 -1.33 0.00 0.00 177.39 175.59 1sur s ASP 4 N -0.15 5.77 0.18 -1.43 -1.08 -1.26 -4.94 116.67 113.76 1sur s ASP 4 Ca 0.58 -1.34 -0.13 0.00 -0.52 0.00 0.00 52.55 51.14 1sur s ASP 4 Cb -0.57 -2.04 0.15 0.00 -1.46 0.00 0.00 42.92 39.00 1sur s ASP 4 CO 0.60 -0.52 1.77 0.25 0.52 0.00 0.00 175.17 177.79 1sur h LEU 5 N 8.49 0.31 -0.59 -1.34 5.85 -1.99 -0.25 115.31 125.79 1sur h LEU 5 Ca -0.25 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 1sur h LEU 5 Cb 1.09 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 42.08 1sur h LEU 5 CO 0.76 0.21 0.37 0.78 -0.34 0.00 0.00 178.44 180.22 1sur h ASN 6 N 0.45 0.71 -0.12 1.25 -0.26 -1.94 0.13 115.58 115.80 1sur h ASN 6 Ca 0.23 -0.05 -0.01 0.00 -0.56 0.00 0.00 56.30 55.91 1sur h ASN 6 Cb 0.18 -0.18 -0.00 0.00 -1.06 0.00 0.00 38.32 37.26 1sur h ASN 6 CO -0.19 0.55 0.03 0.00 -1.06 0.00 0.00 177.43 176.76 1sur h ALA 7 N 1.19 0.16 -0.88 -0.83 0.00 -1.92 -2.91 119.26 114.07 1sur h ALA 7 Ca 0.21 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.04 1sur h ALA 7 Cb -0.03 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.65 1sur h ALA 7 CO -0.04 -0.21 0.55 -0.07 0.00 0.00 0.00 179.25 179.48 1sur h LEU 8 N -0.01 0.88 -2.24 0.00 4.07 -0.73 -1.53 115.31 115.74 1sur h LEU 8 Ca 0.04 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.00 1sur h LEU 8 Cb 0.26 -0.18 -0.00 0.00 1.08 0.00 0.00 40.66 41.82 1sur h LEU 8 CO 0.00 0.58 -0.05 0.78 -1.08 0.00 0.00 178.44 178.66 1sur h ASN 9 N 1.02 0.00 0.77 -0.43 2.35 -0.62 -1.74 115.58 116.93 1sur h ASN 9 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 1sur h ASN 9 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1sur h ASN 9 CO -0.16 0.05 0.00 -0.62 -1.65 0.00 0.00 177.43 175.06 1sur n GLU 10 N -3.70 0.17 -3.80 0.81 -0.58 -0.58 -4.85 120.64 108.12 1sur n GLU 10 Ca -0.02 0.03 -0.29 0.00 -0.42 0.00 0.00 57.16 56.45 1sur n GLU 10 Cb 0.15 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 29.49 1sur n GLU 10 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1sur s LEU 11 N -2.82 4.29 0.62 -4.62 1.43 -0.66 -5.07 118.68 111.86 1sur s LEU 11 Ca 0.19 0.36 -0.19 0.00 -1.03 0.00 0.00 54.13 53.46 1sur s LEU 11 Cb 0.18 -3.09 -0.02 0.00 0.03 0.00 0.00 46.19 43.29 1sur s LEU 11 CO 0.47 0.05 1.27 -2.84 0.23 0.00 0.00 176.35 175.53 1sur s PRO 12 N -2.96 2.71 0.26 1.29 0.02 -1.26 -4.73 135.00 130.32 1sur s PRO 12 Ca 0.37 2.01 -0.06 0.00 0.02 0.00 0.00 61.00 63.35 1sur s PRO 12 Cb -0.12 -1.90 0.48 0.00 0.02 0.00 0.00 34.50 32.99 1sur s PRO 12 CO 0.28 -1.46 1.63 -0.22 -0.33 0.00 0.00 177.00 176.90 1sur h LYS 13 N 0.71 0.10 -1.00 5.54 3.64 -1.95 0.10 116.57 123.70 1sur h LYS 13 Ca -0.51 -0.01 0.12 0.00 -1.27 0.00 0.00 60.65 58.99 1sur h LYS 13 Cb 1.32 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 33.04 1sur h LYS 13 CO 0.54 0.06 0.63 0.28 -2.27 0.00 0.00 179.45 178.70 1sur h VAL 14 N 0.10 0.92 0.00 2.00 2.07 -2.01 -1.82 116.25 117.51 1sur h VAL 14 Ca 0.44 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 67.55 1sur h VAL 14 Cb 0.80 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1sur h VAL 14 CO -0.70 0.18 -0.31 0.44 0.02 0.00 0.00 177.57 177.20 1sur h ASP 15 N 1.00 0.00 -0.50 0.57 3.32 -1.17 -3.09 116.42 116.55 1sur h ASP 15 Ca 0.50 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.44 1sur h ASP 15 Cb 0.48 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 1sur h ASP 15 CO -0.26 0.31 -0.08 0.03 -1.72 0.00 0.00 179.24 177.52 1sur h ARG 16 N 0.00 0.94 -0.52 3.56 3.08 -0.48 -2.31 114.38 118.64 1sur h ARG 16 Ca -0.00 -0.34 0.01 0.00 0.07 0.00 0.00 59.98 59.72 1sur h ARG 16 Cb 1.20 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.15 1sur h ARG 16 CO 0.04 1.00 0.34 0.82 -1.07 0.00 0.00 179.97 181.10 1sur h ILE 17 N 0.80 1.11 -0.64 2.04 2.04 -1.40 -1.99 117.51 119.46 1sur h ILE 17 Ca 0.13 -0.23 -0.04 0.00 1.00 0.00 0.00 64.86 65.71 1sur h ILE 17 Cb 0.63 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.05 1sur h ILE 17 CO 0.04 0.12 0.23 -0.07 0.00 0.00 0.00 178.15 178.48 1sur h LEU 18 N 0.68 0.88 -1.23 1.44 3.38 -1.46 -1.55 115.31 117.45 1sur h LEU 18 Ca 0.20 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1sur h LEU 18 Cb -0.05 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 1sur h LEU 18 CO -0.06 0.80 -0.35 0.00 0.09 0.00 0.00 178.44 178.92 1sur h ALA 19 N 1.32 1.21 -0.01 1.53 0.00 -0.89 -3.04 119.26 119.38 1sur h ALA 19 Ca 0.21 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1sur h ALA 19 Cb 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1sur h ALA 19 CO -0.01 0.44 -0.67 1.28 0.00 0.00 0.00 179.25 180.28 1sur n LEU 20 N -3.82 1.38 -0.20 0.00 4.77 -0.80 -4.54 117.00 113.79 1sur n LEU 20 Ca -0.01 -0.54 0.01 0.00 -0.03 0.00 0.00 56.01 55.43 1sur n LEU 20 Cb 0.43 -0.03 0.11 0.00 -2.33 0.00 0.00 43.42 41.60 1sur n LEU 20 CO 0.37 0.29 0.96 0.00 -1.33 0.00 0.00 177.39 177.68 1sur h ALA 21 N 3.42 0.77 -0.06 -1.18 0.00 -1.17 0.10 119.26 121.16 1sur h ALA 21 Ca 0.00 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1sur h ALA 21 Cb 0.61 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1sur h ALA 21 CO 0.00 -0.24 0.03 1.49 0.00 0.00 0.00 179.25 180.53 1sur h GLU 22 N 0.35 0.08 -0.80 0.00 4.81 -1.80 -1.53 114.58 115.70 1sur h GLU 22 Ca 0.32 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.57 1sur h GLU 22 Cb 0.43 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.74 1sur h GLU 22 CO -0.35 0.16 0.52 1.15 -0.73 0.00 0.00 179.01 179.77 1sur h THR 23 N -0.01 1.11 0.00 0.32 2.02 -1.69 -1.85 112.91 112.81 1sur h THR 23 Ca 0.02 -0.33 -0.07 0.00 0.77 0.00 0.00 66.41 66.80 1sur h THR 23 Cb 0.10 0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 66.56 1sur h THR 23 CO -0.00 0.18 -0.35 0.78 0.37 0.00 0.00 175.52 176.49 1sur h ASN 24 N 0.96 0.00 0.12 4.18 2.35 -0.40 -1.53 115.58 121.26 1sur h ASN 24 Ca 0.32 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.93 1sur h ASN 24 Cb 0.08 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 1sur h ASN 24 CO -0.10 0.35 -0.51 0.00 -1.65 0.00 0.00 177.43 175.52 1sur h ALA 25 N 1.65 0.83 0.20 -0.83 0.00 -0.42 -1.85 119.26 118.83 1sur h ALA 25 Ca -0.00 -0.49 -0.31 0.00 0.00 0.00 0.00 54.91 54.11 1sur h ALA 25 Cb 0.75 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 18.48 1sur h ALA 25 CO 0.05 0.67 -1.37 0.93 0.00 0.00 0.00 179.25 179.53 1sur h GLU 26 N 0.34 0.48 -0.24 0.00 4.39 -1.37 -3.28 114.58 114.91 1sur h GLU 26 Ca 0.01 -0.78 -0.06 0.00 0.34 0.00 0.00 59.36 58.88 1sur h GLU 26 Cb 1.01 0.28 -0.01 0.00 -0.10 0.00 0.00 28.75 29.93 1sur h GLU 26 CO 0.09 1.37 -0.10 -0.07 -1.16 0.00 0.00 179.01 179.14 1sur h LEU 27 N 0.15 0.36 -2.11 1.33 3.38 -1.28 -2.15 115.31 114.99 1sur h LEU 27 Ca -0.21 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1sur h LEU 27 Cb 2.06 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 42.72 1sur h LEU 27 CO 0.25 0.49 -0.06 -0.08 0.09 0.00 0.00 178.44 179.14 1sur h GLU 28 N 0.36 0.00 0.00 1.13 4.57 -1.39 -2.54 114.58 116.71 1sur h GLU 28 Ca 0.07 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 1sur h GLU 28 Cb 0.39 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.98 1sur h GLU 28 CO 0.02 0.06 -0.20 0.87 -1.18 0.00 0.00 179.01 178.58 1sur h LYS 29 N 0.00 0.00 -7.41 1.92 1.57 -1.47 -3.46 116.57 107.72 1sur h LYS 29 Ca -0.00 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.31 1sur h LYS 29 Cb 0.13 0.00 0.08 0.00 0.08 0.00 0.00 32.23 32.52 1sur h LYS 29 CO 0.01 0.00 0.32 -0.51 -0.57 0.00 0.00 179.45 178.69 1sur s LEU 30 N -5.76 2.80 0.53 2.94 1.43 -0.96 -5.10 118.68 114.57 1sur s LEU 30 Ca 0.06 0.74 0.03 0.00 -1.03 0.00 0.00 54.13 53.93 1sur s LEU 30 Cb 0.07 -3.39 0.04 0.00 0.03 0.00 0.00 46.19 42.93 1sur s LEU 30 CO 0.68 -1.56 0.74 1.51 0.23 0.00 0.00 176.35 177.95 1sur s ASP 31 N -4.47 5.30 0.21 2.29 1.47 -1.26 -4.87 116.67 115.34 1sur s ASP 31 Ca 0.59 -0.16 -0.12 0.00 1.18 0.00 0.00 52.55 54.04 1sur s ASP 31 Cb -0.11 -0.73 0.26 0.00 -0.34 0.00 0.00 42.92 42.01 1sur s ASP 31 CO 0.48 -1.10 1.67 0.00 0.68 0.00 0.00 175.17 176.89 1sur h ALA 32 N 0.17 0.56 -0.87 2.11 0.00 -1.96 -0.05 119.26 119.22 1sur h ALA 32 Ca -0.41 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1sur h ALA 32 Cb 1.29 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 19.35 1sur h ALA 32 CO 0.49 -0.39 0.50 0.93 0.00 0.00 0.00 179.25 180.78 1sur h GLU 33 N 0.11 1.20 -0.04 0.00 3.07 -1.95 -1.75 114.58 115.23 1sur h GLU 33 Ca 0.30 -0.13 -0.12 0.00 -0.50 0.00 0.00 59.36 58.92 1sur h GLU 33 Cb 0.48 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 28.13 1sur h GLU 33 CO -0.51 0.86 -0.52 0.78 -1.40 0.00 0.00 179.01 178.23 1sur h GLY 34 N 1.21 0.11 0.96 -3.84 0.00 -1.69 -0.38 103.07 99.43 1sur h GLY 34 Ca 0.31 -0.12 -0.08 0.00 0.00 0.00 0.00 47.33 47.45 1sur h GLY 34 CO -0.05 0.10 -0.05 3.21 0.00 0.00 0.00 176.54 179.75 1sur h ARG 35 N 0.08 0.73 -0.31 4.80 3.08 -0.50 0.21 114.38 122.45 1sur h ARG 35 Ca -0.00 -0.26 -0.02 0.00 0.07 0.00 0.00 59.98 59.77 1sur h ARG 35 Cb 0.95 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.93 1sur h ARG 35 CO 0.07 0.85 0.11 0.28 -1.07 0.00 0.00 179.97 180.21 1sur h VAL 36 N 0.54 1.19 -0.63 2.04 2.07 -1.17 -1.87 116.25 118.43 1sur h VAL 36 Ca 0.10 -0.60 0.04 0.00 0.82 0.00 0.00 66.70 67.06 1sur h VAL 36 Cb 0.55 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 1sur h VAL 36 CO 0.03 0.21 0.37 0.00 0.02 0.00 0.00 177.57 178.20 1sur h ALA 37 N 0.95 0.82 -0.31 1.67 0.00 -0.92 -1.75 119.26 119.72 1sur h ALA 37 Ca 0.10 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1sur h ALA 37 Cb 0.21 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1sur h ALA 37 CO -0.01 0.10 0.19 2.35 0.00 0.00 0.00 179.25 181.88 1sur h TRP 38 N 0.72 0.41 -0.38 0.00 7.01 -0.74 -2.21 115.95 120.76 1sur h TRP 38 Ca 0.26 0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.27 1sur h TRP 38 Cb 0.07 -0.14 -0.02 0.00 -2.10 0.00 0.00 29.16 26.97 1sur h TRP 38 CO -0.06 0.30 0.23 0.00 -2.79 0.00 0.00 178.44 176.11 1sur h ALA 39 N 1.08 0.47 0.00 2.65 0.00 -1.01 0.32 119.26 122.77 1sur h ALA 39 Ca 0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1sur h ALA 39 Cb 0.00 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1sur h ALA 39 CO -0.02 -0.11 -0.01 -0.07 0.00 0.00 0.00 179.25 179.04 1sur h LEU 40 N 0.46 0.00 0.00 0.00 4.07 -1.17 0.25 115.31 118.93 1sur h LEU 40 Ca 0.15 0.00 -0.21 0.00 0.08 0.00 0.00 57.88 57.89 1sur h LEU 40 Cb -0.01 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.69 1sur h LEU 40 CO -0.06 0.01 -1.83 0.47 -1.08 0.00 0.00 178.44 175.95 1sur n ASP 41 N -3.96 0.46 -0.00 -0.43 9.92 -0.55 -4.60 116.55 117.39 1sur n ASP 41 Ca -0.03 0.21 0.00 0.00 -0.53 0.00 0.00 54.79 54.44 1sur n ASP 41 Cb 0.10 0.69 -0.00 0.00 -0.64 0.00 0.00 41.12 41.26 1sur n ASP 41 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1sur n ASN 42 N -2.76 0.09 -4.78 -2.24 3.02 0.10 -5.03 115.26 103.66 1sur n ASN 42 Ca -0.17 -0.54 -0.30 0.00 -0.03 0.00 0.00 54.58 53.53 1sur n ASN 42 Cb 0.91 0.92 -0.06 0.00 -0.61 0.00 0.00 39.78 40.95 1sur n ASN 42 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1sur s LEU 43 N -1.86 3.83 0.00 3.41 1.02 0.86 -4.60 118.68 121.33 1sur s LEU 43 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 54.13 54.15 1sur s LEU 43 Cb 0.00 -2.50 0.00 0.00 0.02 0.00 0.00 46.19 43.71 1sur s LEU 43 CO 0.01 0.17 0.00 -0.81 0.02 0.00 0.00 176.35 175.74 1sur n PRO 44 N 0.46 1.19 0.00 1.29 -0.04 -1.26 -4.76 135.00 131.88 1sur n PRO 44 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1sur n PRO 44 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 1sur n PRO 44 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1sur n GLY 45 N 5.00 0.04 3.78 0.55 0.00 -1.26 -3.97 105.19 109.33 1sur n GLY 45 Ca 0.00 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 1sur n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sur s GLU 46 N 0.00 4.11 -0.14 1.61 0.41 -0.96 -4.63 118.70 119.10 1sur s GLU 46 Ca 0.00 1.60 -0.10 0.00 -0.41 0.00 0.00 54.97 56.06 1sur s GLU 46 Cb 0.00 -2.56 -0.05 0.00 -1.78 0.00 0.00 34.13 29.74 1sur s GLU 46 CO 0.00 -0.21 0.20 0.71 -0.49 0.00 0.00 175.26 175.47 1sur s TYR 47 N -1.59 3.52 0.14 1.61 2.02 -1.26 -1.34 117.35 120.45 1sur s TYR 47 Ca 0.58 0.53 0.04 0.00 -0.37 0.00 0.00 57.07 57.85 1sur s TYR 47 Cb -0.24 -2.13 -0.04 0.00 -0.40 0.00 0.00 41.96 39.14 1sur s TYR 47 CO 0.30 0.48 -0.09 0.14 -1.57 0.00 0.00 175.55 174.81 1sur s VAL 48 N -0.28 1.06 -0.04 0.71 -7.23 -0.48 -4.29 120.40 109.86 1sur s VAL 48 Ca 0.14 -2.04 0.02 0.00 -1.81 0.00 0.00 61.98 58.30 1sur s VAL 48 Cb -0.12 -1.83 0.01 0.00 0.56 0.00 0.00 36.38 35.00 1sur s VAL 48 CO 0.03 -0.76 -0.09 -0.22 -0.31 0.00 0.00 175.10 173.75 1sur s LEU 49 N -3.15 1.61 0.19 1.32 2.96 -0.44 -0.24 118.68 120.92 1sur s LEU 49 Ca 0.16 -0.21 0.09 0.00 -0.22 0.00 0.00 54.13 53.96 1sur s LEU 49 Cb 0.03 -0.61 -0.04 0.00 0.50 0.00 0.00 46.19 46.07 1sur s LEU 49 CO -0.00 0.02 -0.11 -0.94 -1.32 0.00 0.00 176.35 174.00 1sur s SER 50 N 0.55 4.14 -0.11 3.68 1.04 -0.51 -0.21 113.70 122.28 1sur s SER 50 Ca -0.09 -0.63 -0.21 0.00 0.48 0.00 0.00 55.95 55.50 1sur s SER 50 Cb -0.13 -0.65 0.05 0.00 0.10 0.00 0.00 66.02 65.39 1sur s SER 50 CO 0.01 0.10 0.51 -0.55 0.98 0.00 0.00 173.24 174.29 1sur s SER 51 N -2.87 -0.48 0.00 7.02 0.15 -1.06 -4.32 113.70 112.15 1sur s SER 51 Ca 0.25 0.69 0.24 0.00 0.70 0.00 0.00 55.95 57.82 1sur s SER 51 Cb -0.08 0.71 0.39 0.00 -1.71 0.00 0.00 66.02 65.33 1sur s SER 51 CO 0.15 -0.37 1.38 -1.54 1.20 0.00 0.00 173.24 174.05 1sur n SER 52 N 1.85 3.17 -4.05 5.45 3.41 -1.26 -4.53 113.62 117.66 1sur n SER 52 Ca -0.17 -1.97 -0.32 0.00 -0.26 0.00 0.00 58.87 56.15 1sur n SER 52 Cb 0.56 -0.16 -0.00 0.00 -0.26 0.00 0.00 64.21 64.35 1sur n SER 52 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1sur n PHE 53 N 1.35 -1.93 -0.36 7.33 3.01 -1.26 -4.97 117.46 120.63 1sur n PHE 53 Ca 0.18 0.83 0.00 0.00 1.01 0.00 0.00 57.45 59.47 1sur n PHE 53 Cb 0.58 -3.49 0.00 0.00 -0.01 0.00 0.00 39.48 36.56 1sur n PHE 53 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1sur n GLY 54 N -1.60 -0.15 0.24 1.37 0.00 -1.26 -4.86 105.19 98.93 1sur n GLY 54 Ca -0.01 -1.70 -0.01 0.00 0.00 0.00 0.00 46.02 44.30 1sur n GLY 54 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1sur h ILE 55 N 0.00 0.39 -0.34 -0.61 1.08 -1.91 -2.76 117.51 113.35 1sur h ILE 55 Ca 0.00 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.41 1sur h ILE 55 Cb 0.00 0.39 -0.04 0.00 -3.07 0.00 0.00 36.82 34.11 1sur h ILE 55 CO 0.00 0.00 0.02 0.00 -0.69 0.00 0.00 178.15 177.48 1sur n GLN 56 N -5.41 2.85 0.15 2.37 6.02 -1.26 -0.84 117.38 121.25 1sur n GLN 56 Ca 0.07 -2.95 0.09 0.00 -0.01 0.00 0.00 57.00 54.20 1sur n GLN 56 Cb 0.31 -1.90 0.60 0.00 1.02 0.00 0.00 30.24 30.28 1sur n GLN 56 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1sur h ALA 57 N 1.79 2.02 -0.61 -1.58 0.00 -1.82 -2.80 119.26 116.27 1sur h ALA 57 Ca 0.07 -0.01 0.16 0.00 0.00 0.00 0.00 54.91 55.13 1sur h ALA 57 Cb 1.61 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.34 1sur h ALA 57 CO 0.32 -0.06 0.42 0.00 0.00 0.00 0.00 179.25 179.94 1sur h ALA 58 N 1.89 2.40 0.77 0.00 0.00 -1.84 -2.78 119.26 119.70 1sur h ALA 58 Ca 0.08 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1sur h ALA 58 Cb 0.18 0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1sur h ALA 58 CO -0.01 -0.57 -0.37 0.28 0.00 0.00 0.00 179.25 178.58 1sur h VAL 59 N 0.12 0.05 -0.67 0.00 2.07 -1.86 -1.38 116.25 114.58 1sur h VAL 59 Ca 0.29 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.56 1sur h VAL 59 Cb 0.98 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 1sur h VAL 59 CO -0.04 0.01 0.32 -1.28 0.02 0.00 0.00 177.57 176.60 1sur h SER 60 N -1.25 0.85 0.17 0.57 0.87 -1.74 -0.68 113.55 112.35 1sur h SER 60 Ca -0.11 -0.09 -0.01 0.00 -1.23 0.00 0.00 61.79 60.36 1sur h SER 60 Cb 0.80 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.54 1sur h SER 60 CO 0.17 0.72 -0.08 -0.07 -0.53 0.00 0.00 176.83 177.04 1sur h LEU 61 N 0.94 -0.20 -0.35 2.23 3.38 -1.51 -1.88 115.31 117.93 1sur h LEU 61 Ca 0.23 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1sur h LEU 61 Cb 0.09 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1sur h LEU 61 CO -0.03 0.01 0.15 -0.74 0.09 0.00 0.00 178.44 177.92 1sur h HIS 62 N -0.41 0.52 -0.07 1.13 2.76 -1.13 -1.89 115.15 116.06 1sur h HIS 62 Ca -0.02 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.11 1sur h HIS 62 Cb 0.32 -0.16 -0.00 0.00 1.55 0.00 0.00 27.41 29.12 1sur h HIS 62 CO -0.01 0.47 0.04 1.25 -1.30 0.00 0.00 177.93 178.38 1sur h LEU 63 N 0.42 0.08 -0.10 0.26 6.46 -1.10 -0.95 115.31 120.37 1sur h LEU 63 Ca 0.12 -0.03 -0.24 0.00 -0.12 0.00 0.00 57.88 57.61 1sur h LEU 63 Cb 0.16 -0.02 0.01 0.00 -0.73 0.00 0.00 40.66 40.08 1sur h LEU 63 CO -0.01 0.09 -0.89 0.58 -0.62 0.00 0.00 178.44 177.58 1sur h VAL 64 N 0.07 1.28 -0.02 1.05 2.07 -1.40 -3.16 116.25 116.15 1sur h VAL 64 Ca 0.03 -2.11 -0.06 0.00 0.82 0.00 0.00 66.70 65.37 1sur h VAL 64 Cb 0.02 2.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1sur h VAL 64 CO -0.01 0.66 -0.29 -1.13 0.02 0.00 0.00 177.57 176.83 1sur h ASN 65 N 0.46 0.04 -0.47 0.57 -1.24 -1.31 0.68 115.58 114.32 1sur h ASN 65 Ca -0.09 -0.01 -0.09 0.00 0.71 0.00 0.00 56.30 56.82 1sur h ASN 65 Cb 1.53 -0.01 -0.02 0.00 0.73 0.00 0.00 38.32 40.55 1sur h ASN 65 CO 0.18 0.33 -0.04 -0.61 -1.29 0.00 0.00 177.43 176.00 1sur h GLN 66 N 0.04 0.91 0.13 6.67 4.15 -1.16 -2.46 115.11 123.37 1sur h GLN 66 Ca 0.00 -0.28 -0.29 0.00 0.77 0.00 0.00 58.65 58.85 1sur h GLN 66 Cb 0.53 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.13 1sur h GLN 66 CO 0.04 0.92 -1.37 0.82 -1.93 0.00 0.00 178.83 177.31 1sur h ILE 67 N 0.83 1.35 -2.85 2.39 2.04 -1.43 -3.40 117.51 116.44 1sur h ILE 67 Ca 0.15 -2.94 -0.61 0.00 1.00 0.00 0.00 64.86 62.45 1sur h ILE 67 Cb 0.55 2.87 -0.41 0.00 -0.74 0.00 0.00 36.82 39.09 1sur h ILE 67 CO 0.03 0.86 -0.70 -0.60 0.00 0.00 0.00 178.15 177.74 1sur s ARG 68 N -2.64 1.96 0.31 2.37 6.06 0.20 -5.11 118.95 122.11 1sur s ARG 68 Ca -0.06 -2.95 -0.29 0.00 -2.50 0.00 0.00 55.73 49.94 1sur s ARG 68 Cb 0.07 -2.77 -0.13 0.00 0.06 0.00 0.00 34.95 32.18 1sur s ARG 68 CO 0.87 -1.32 1.26 -2.30 -2.50 0.00 0.00 175.30 171.32 1sur n PRO 69 N 2.26 1.98 -1.62 5.12 -0.02 -0.93 -2.45 135.00 139.34 1sur n PRO 69 Ca 0.23 0.69 -0.16 0.00 -2.02 0.00 0.00 63.50 62.24 1sur n PRO 69 Cb 0.39 -2.25 -0.06 0.00 -0.02 0.00 0.00 33.50 31.56 1sur n PRO 69 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1sur n ASP 70 N 1.10 -4.89 -4.74 2.55 8.00 -1.26 -4.96 116.55 112.35 1sur n ASP 70 Ca 0.07 0.32 -0.42 0.00 0.71 0.00 0.00 54.79 55.47 1sur n ASP 70 Cb 0.34 -3.83 -0.03 0.00 -0.02 0.00 0.00 41.12 37.59 1sur n ASP 70 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1sur s ILE 71 N -2.63 2.78 0.09 0.53 2.07 -1.02 -4.73 121.20 118.28 1sur s ILE 71 Ca 0.00 0.62 -0.34 0.00 -1.41 0.00 0.00 60.65 59.52 1sur s ILE 71 Cb 0.00 -3.40 -0.13 0.00 0.13 0.00 0.00 42.46 39.06 1sur s ILE 71 CO 0.00 0.08 1.66 -2.65 -1.91 0.00 0.00 174.94 172.12 1sur n PRO 72 N 2.83 2.13 -3.70 3.50 -0.02 -1.26 -4.17 135.00 134.31 1sur n PRO 72 Ca 0.08 0.77 -0.39 0.00 -2.02 0.00 0.00 63.50 61.95 1sur n PRO 72 Cb 0.40 -2.56 -0.12 0.00 -0.02 0.00 0.00 33.50 31.20 1sur n PRO 72 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1sur s VAL 73 N 1.78 4.06 -0.26 -1.45 1.01 -0.08 -1.33 120.40 124.14 1sur s VAL 73 Ca 0.83 -1.00 -0.25 0.00 0.00 0.00 0.00 61.98 61.55 1sur s VAL 73 Cb -0.69 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 32.42 1sur s VAL 73 CO 0.42 -0.17 0.87 -0.63 0.00 0.00 0.00 175.10 175.59 1sur s ILE 74 N 1.46 4.78 -0.14 2.22 1.01 0.70 0.37 121.20 131.61 1sur s ILE 74 Ca -0.00 1.56 0.00 0.00 0.00 0.00 0.00 60.65 62.22 1sur s ILE 74 Cb -0.19 -4.18 -0.01 0.00 0.01 0.00 0.00 42.46 38.09 1sur s ILE 74 CO 0.04 -0.16 -0.15 -0.22 0.00 0.00 0.00 174.94 174.45 1sur s LEU 75 N 2.99 2.55 -0.66 2.97 2.96 -0.40 -2.55 118.68 126.55 1sur s LEU 75 Ca 0.36 -0.41 -0.14 0.00 -0.22 0.00 0.00 54.13 53.72 1sur s LEU 75 Cb -0.15 -1.57 0.17 0.00 0.50 0.00 0.00 46.19 45.14 1sur s LEU 75 CO 0.09 0.13 0.60 -0.89 -1.32 0.00 0.00 176.35 174.96 1sur s THR 76 N 0.55 5.24 -0.46 3.68 2.01 -1.26 -0.77 115.64 124.62 1sur s THR 76 Ca -0.10 -1.99 -0.29 0.00 0.31 0.00 0.00 61.69 59.62 1sur s THR 76 Cb -0.16 -4.31 0.03 0.00 0.01 0.00 0.00 72.50 68.07 1sur s THR 76 CO 0.04 -0.93 1.13 -0.62 -0.69 0.00 0.00 174.62 173.55 1sur s ASP 77 N 2.80 6.65 0.13 3.53 2.15 -0.28 -4.86 116.67 126.79 1sur s ASP 77 Ca 0.10 0.50 0.26 0.00 0.43 0.00 0.00 52.55 53.85 1sur s ASP 77 Cb -0.21 -2.55 0.97 0.00 -0.30 0.00 0.00 42.92 40.83 1sur s ASP 77 CO -0.03 -1.22 1.81 0.35 -0.17 0.00 0.00 175.17 175.91 1sur n THR 78 N 6.75 0.43 -0.68 1.71 -2.24 -1.26 -4.32 114.28 114.67 1sur n THR 78 Ca 0.12 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1sur n THR 78 Cb 0.49 -0.63 0.00 0.00 -2.10 0.00 0.00 70.33 68.08 1sur n THR 78 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sur n GLY 79 N 1.17 0.81 0.28 3.38 0.00 -1.26 -4.87 105.19 104.70 1sur n GLY 79 Ca 0.06 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.12 1sur n GLY 79 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1sur n TYR 80 N -2.10 0.00 -1.44 1.61 4.01 -1.26 -4.97 117.16 113.01 1sur n TYR 80 Ca 0.00 -0.48 -0.33 0.00 -0.16 0.00 0.00 57.90 56.94 1sur n TYR 80 Cb 0.00 -0.10 0.08 0.00 -0.31 0.00 0.00 39.34 39.02 1sur n TYR 80 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1sur s LEU 81 N -1.37 3.22 0.52 7.72 1.02 -1.26 -0.16 118.68 128.37 1sur s LEU 81 Ca 0.15 2.05 -0.22 0.00 0.02 0.00 0.00 54.13 56.13 1sur s LEU 81 Cb 0.13 -4.55 -0.06 0.00 0.02 0.00 0.00 46.19 41.73 1sur s LEU 81 CO 0.01 -2.04 1.32 -0.36 0.02 0.00 0.00 176.35 175.31 1sur s PHE 82 N -2.45 2.42 0.56 0.29 0.40 -1.22 -4.68 117.98 113.31 1sur s PHE 82 Ca 0.67 1.40 0.24 0.00 -0.60 0.00 0.00 56.93 58.64 1sur s PHE 82 Cb -0.22 -3.72 1.58 0.00 0.51 0.00 0.00 43.02 41.18 1sur s PHE 82 CO 0.48 -2.61 2.19 -1.00 0.70 0.00 0.00 175.22 174.97 1sur h PRO 83 N 1.64 0.00 -0.06 0.24 0.13 -1.97 -1.19 132.00 130.80 1sur h PRO 83 Ca -0.51 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.54 1sur h PRO 83 Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 1sur h PRO 83 CO 0.58 0.00 -0.37 0.93 -0.23 0.00 0.00 178.00 178.91 1sur h GLU 84 N 0.00 0.11 -0.27 0.86 3.07 -2.00 -2.53 114.58 113.83 1sur h GLU 84 Ca 0.02 -0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 58.72 1sur h GLU 84 Cb 0.11 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.01 1sur h GLU 84 CO -0.00 0.48 -0.30 1.15 -1.40 0.00 0.00 179.01 178.94 1sur h THR 85 N 0.10 1.31 -0.23 1.13 2.02 -1.57 -0.34 112.91 115.32 1sur h THR 85 Ca 0.01 -1.47 0.02 0.00 0.77 0.00 0.00 66.41 65.74 1sur h THR 85 Cb 0.71 1.63 -0.02 0.00 -1.74 0.00 0.00 68.15 68.73 1sur h THR 85 CO 0.05 0.47 0.08 1.88 0.37 0.00 0.00 175.52 178.37 1sur h TYR 86 N 0.41 0.15 -0.18 3.16 0.05 -1.26 0.21 116.97 119.52 1sur h TYR 86 Ca 0.04 0.01 -0.06 0.00 0.05 0.00 0.00 58.73 58.77 1sur h TYR 86 Cb 0.87 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 38.57 1sur h TYR 86 CO 0.07 0.07 -0.16 0.00 -1.05 0.00 0.00 178.16 177.09 1sur h ARG 87 N 0.19 0.29 -0.54 4.88 3.08 -1.42 -1.30 114.38 119.56 1sur h ARG 87 Ca 0.10 -0.08 -0.10 0.00 0.07 0.00 0.00 59.98 59.97 1sur h ARG 87 Cb 0.07 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1sur h ARG 87 CO -0.10 0.45 -0.05 0.35 -1.07 0.00 0.00 179.97 179.56 1sur h PHE 88 N 0.27 1.09 -0.41 3.04 3.57 -0.29 0.55 116.94 124.76 1sur h PHE 88 Ca 0.05 -0.21 -0.04 0.00 3.53 0.00 0.00 57.97 61.31 1sur h PHE 88 Cb 0.45 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 1sur h PHE 88 CO 0.01 1.00 0.11 0.82 -2.23 0.00 0.00 178.31 178.02 1sur h ILE 89 N 0.86 1.23 -0.04 1.41 2.04 -0.17 0.65 117.51 123.48 1sur h ILE 89 Ca 0.15 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.24 1sur h ILE 89 Cb 0.60 0.95 -0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1sur h ILE 89 CO 0.04 0.27 0.02 0.44 0.00 0.00 0.00 178.15 178.92 1sur h ASP 90 N 0.52 0.03 0.24 1.72 3.32 -1.03 -0.37 116.42 120.85 1sur h ASP 90 Ca 0.13 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1sur h ASP 90 Cb 0.30 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1sur h ASP 90 CO -0.00 0.03 -0.11 -0.08 -1.72 0.00 0.00 179.24 177.35 1sur h GLU 91 N 0.05 -0.31 -0.68 3.56 4.81 -0.69 -2.28 114.58 119.04 1sur h GLU 91 Ca 0.02 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 1sur h GLU 91 Cb 0.00 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 1sur h GLU 91 CO -0.01 -0.20 0.24 -0.07 -0.73 0.00 0.00 179.01 178.24 1sur h LEU 92 N -0.33 0.94 -0.80 1.64 3.38 -0.86 0.26 115.31 119.54 1sur h LEU 92 Ca -0.03 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 1sur h LEU 92 Cb 0.25 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 1sur h LEU 92 CO 0.05 0.86 0.46 0.74 0.09 0.00 0.00 178.44 180.64 1sur h THR 93 N 0.99 1.23 -0.13 0.22 2.02 -0.95 -0.45 112.91 115.83 1sur h THR 93 Ca 0.22 -0.53 -0.11 0.00 0.77 0.00 0.00 66.41 66.76 1sur h THR 93 Cb 0.24 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.78 1sur h THR 93 CO -0.01 0.25 -0.35 -0.78 0.37 0.00 0.00 175.52 175.00 1sur h ASP 94 N 1.10 0.53 -0.15 4.18 3.58 -1.13 -0.82 116.42 123.70 1sur h ASP 94 Ca 0.28 -0.59 -0.02 0.00 0.42 0.00 0.00 57.03 57.13 1sur h ASP 94 Cb -0.01 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 40.88 1sur h ASP 94 CO -0.05 1.02 0.01 0.50 -2.88 0.00 0.00 179.24 177.85 1sur h LYS 95 N 0.07 0.26 -0.02 0.28 3.64 -0.70 -3.10 116.57 117.00 1sur h LYS 95 Ca -0.01 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1sur h LYS 95 Cb 0.96 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 1sur h LYS 95 CO 0.08 0.46 -0.01 1.28 -2.27 0.00 0.00 179.45 178.99 1sur n LEU 96 N -4.77 1.61 -3.51 5.20 4.77 -0.20 -4.96 117.00 115.14 1sur n LEU 96 Ca -0.05 -0.54 -0.20 0.00 -0.03 0.00 0.00 56.01 55.19 1sur n LEU 96 Cb 0.20 -0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.34 1sur n LEU 96 CO 0.36 0.27 -0.00 1.17 -1.33 0.00 0.00 177.39 177.85 1sur n LYS 97 N 0.25 -3.77 -2.65 3.23 4.81 -0.70 -4.93 118.16 114.42 1sur n LYS 97 Ca 0.18 0.71 -0.41 0.00 -0.87 0.00 0.00 58.31 57.93 1sur n LYS 97 Cb 0.37 -5.32 -0.05 0.00 0.02 0.00 0.00 35.03 30.05 1sur n LYS 97 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1sur s LEU 98 N -6.18 4.55 -1.43 3.14 1.43 -0.40 -4.73 118.68 115.06 1sur s LEU 98 Ca 0.23 1.97 -0.13 0.00 -1.03 0.00 0.00 54.13 55.18 1sur s LEU 98 Cb -0.05 -3.60 0.06 0.00 0.03 0.00 0.00 46.19 42.63 1sur s LEU 98 CO 0.78 -0.05 2.21 -3.20 0.23 0.00 0.00 176.35 176.32 1sur n ASN 99 N 2.12 4.57 -4.73 2.29 5.15 -1.26 -4.94 115.26 118.47 1sur n ASN 99 Ca 0.01 -2.89 -0.42 0.00 -0.60 0.00 0.00 54.58 50.68 1sur n ASN 99 Cb 0.47 -1.61 -0.03 0.00 -0.53 0.00 0.00 39.78 38.09 1sur n ASN 99 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1sur s LEU 100 N 1.45 4.38 -0.33 1.20 2.96 -1.26 -0.90 118.68 126.19 1sur s LEU 100 Ca 0.47 2.54 0.02 0.00 -0.22 0.00 0.00 54.13 56.94 1sur s LEU 100 Cb 0.13 -3.60 0.10 0.00 0.50 0.00 0.00 46.19 43.32 1sur s LEU 100 CO -0.07 -0.72 0.07 -0.54 -1.32 0.00 0.00 176.35 173.77 1sur s LYS 101 N 0.58 1.21 -0.07 1.98 -0.14 0.16 -4.85 119.74 118.61 1sur s LYS 101 Ca 0.64 -1.57 -0.24 0.00 -1.36 0.00 0.00 55.97 53.44 1sur s LYS 101 Cb -0.41 -2.76 -0.04 0.00 -1.68 0.00 0.00 37.83 32.95 1sur s LYS 101 CO 0.35 -0.95 0.72 0.08 -0.76 0.00 0.00 175.35 174.79 1sur s VAL 102 N 1.17 5.03 0.01 3.17 1.01 -1.26 -1.27 120.40 128.26 1sur s VAL 102 Ca 0.10 1.48 0.07 0.00 0.00 0.00 0.00 61.98 63.63 1sur s VAL 102 Cb -0.18 -4.06 -0.02 0.00 0.00 0.00 0.00 36.38 32.12 1sur s VAL 102 CO -0.14 0.24 -0.21 -0.31 0.00 0.00 0.00 175.10 174.67 1sur s TYR 103 N 0.86 1.89 0.26 5.22 1.51 0.05 -4.96 117.35 122.18 1sur s TYR 103 Ca 0.38 -0.37 0.00 0.00 -1.01 0.00 0.00 57.07 56.08 1sur s TYR 103 Cb -0.18 -1.18 -0.03 0.00 -0.11 0.00 0.00 41.96 40.46 1sur s TYR 103 CO 0.18 0.03 0.23 -0.98 -1.11 0.00 0.00 175.55 173.91 1sur s ARG 104 N -0.83 1.46 1.01 -0.62 1.70 -1.26 -1.12 118.95 119.29 1sur s ARG 104 Ca 0.08 -1.73 -0.13 0.00 -0.47 0.00 0.00 55.73 53.48 1sur s ARG 104 Cb -0.09 0.32 0.12 0.00 -0.57 0.00 0.00 34.95 34.73 1sur s ARG 104 CO 0.00 -0.53 0.65 0.00 -1.08 0.00 0.00 175.30 174.35 1sur n ALA 105 N -0.41 -2.40 0.24 7.88 0.00 -1.26 -4.73 120.51 119.83 1sur n ALA 105 Ca 0.03 -0.80 0.09 0.00 0.00 0.00 0.00 53.44 52.76 1sur n ALA 105 Cb 0.64 -1.90 0.64 0.00 0.00 0.00 0.00 19.45 18.83 1sur n ALA 105 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1sur h THR 106 N -1.93 0.99 -4.20 0.00 2.02 -2.00 -3.43 112.91 104.35 1sur h THR 106 Ca -0.48 -0.00 -0.19 0.00 0.77 0.00 0.00 66.41 66.51 1sur h THR 106 Cb 1.30 0.97 -0.15 0.00 -1.74 0.00 0.00 68.15 68.53 1sur h THR 106 CO 0.39 0.00 -0.66 -1.83 0.37 0.00 0.00 175.52 173.79 1sur s GLU 107 N -5.08 0.85 0.98 6.66 1.03 -1.26 -5.15 118.70 116.73 1sur s GLU 107 Ca -0.05 -1.38 -0.11 0.00 0.03 0.00 0.00 54.97 53.46 1sur s GLU 107 Cb 0.17 0.11 0.16 0.00 -0.80 0.00 0.00 34.13 33.76 1sur s GLU 107 CO 0.67 -0.17 0.98 -1.13 -1.33 0.00 0.00 175.26 174.28 1sur n SER 108 N -0.05 -0.47 -0.34 0.83 3.41 -1.26 -4.70 113.62 111.03 1sur n SER 108 Ca -0.09 0.29 -0.04 0.00 -0.26 0.00 0.00 58.87 58.77 1sur n SER 108 Cb 0.63 -1.38 0.09 0.00 -0.26 0.00 0.00 64.21 63.28 1sur n SER 108 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sur h ALA 109 N -2.00 1.17 -0.68 7.33 0.00 -1.93 -0.57 119.26 122.59 1sur h ALA 109 Ca -0.47 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.30 1sur h ALA 109 Cb 1.29 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1sur h ALA 109 CO 0.41 0.66 0.31 0.00 0.00 0.00 0.00 179.25 180.63 1sur h ALA 110 N 1.29 0.87 -0.27 0.00 0.00 -1.98 -0.39 119.26 118.78 1sur h ALA 110 Ca 0.33 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1sur h ALA 110 Cb -0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1sur h ALA 110 CO -0.06 0.45 0.11 2.35 0.00 0.00 0.00 179.25 182.11 1sur h TRP 111 N 0.94 0.40 -0.42 0.00 2.91 -1.77 -1.37 115.95 116.65 1sur h TRP 111 Ca 0.23 -0.03 0.06 0.00 1.13 0.00 0.00 58.89 60.29 1sur h TRP 111 Cb 0.14 -0.12 -0.06 0.00 -0.51 0.00 0.00 29.16 28.62 1sur h TRP 111 CO 0.01 0.40 0.10 1.96 -1.03 0.00 0.00 178.44 179.88 1sur h GLN 112 N 0.28 0.23 -0.03 2.65 4.20 -0.79 -1.67 115.11 119.99 1sur h GLN 112 Ca 0.09 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.73 1sur h GLN 112 Cb 0.17 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1sur h GLN 112 CO -0.01 0.15 -0.26 0.93 -0.67 0.00 0.00 178.83 178.98 1sur h GLU 113 N 0.24 0.06 -0.24 1.46 5.08 -0.87 -0.04 114.58 120.26 1sur h GLU 113 Ca 0.20 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 1sur h GLU 113 Cb 0.24 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1sur h GLU 113 CO -0.25 0.31 -0.25 0.00 -1.00 0.00 0.00 179.01 177.82 1sur h ALA 114 N 1.69 1.12 0.18 3.43 0.00 -0.38 0.42 119.26 125.72 1sur h ALA 114 Ca 0.01 -0.34 -0.34 0.00 0.00 0.00 0.00 54.91 54.24 1sur h ALA 114 Cb 0.48 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.17 1sur h ALA 114 CO 0.03 0.55 -1.63 0.00 0.00 0.00 0.00 179.25 178.20 1sur h ARG 115 N 0.41 0.38 0.00 0.00 3.08 -0.82 -3.42 114.38 114.01 1sur h ARG 115 Ca 0.06 -0.65 0.00 0.00 0.07 0.00 0.00 59.98 59.47 1sur h ARG 115 Cb 0.66 0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.95 1sur h ARG 115 CO 0.05 1.28 0.00 0.66 -1.07 0.00 0.00 179.97 180.89 1sur n TYR 116 N -3.57 0.00 -4.21 3.04 4.01 -0.08 -5.11 117.16 111.24 1sur n TYR 116 Ca -0.21 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.53 1sur n TYR 116 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.10 1sur n TYR 116 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1sur n GLY 117 N 0.06 -1.35 3.47 2.72 0.00 0.14 -4.41 105.19 105.82 1sur n GLY 117 Ca 0.00 -1.26 -0.43 0.00 0.00 0.00 0.00 46.02 44.32 1sur n GLY 117 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sur s LYS 118 N 0.00 3.51 0.42 1.61 1.02 -1.26 -4.31 119.74 120.72 1sur s LYS 118 Ca 0.00 -1.49 0.16 0.00 0.02 0.00 0.00 55.97 54.66 1sur s LYS 118 Cb 0.00 -4.87 1.05 0.00 -0.52 0.00 0.00 37.83 33.49 1sur s LYS 118 CO 0.00 -1.86 1.90 -0.07 -0.92 0.00 0.00 175.35 174.40 1sur h LEU 119 N 10.98 0.41 0.00 3.17 3.38 -1.88 -0.37 115.31 131.01 1sur h LEU 119 Ca 0.08 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1sur h LEU 119 Cb 1.03 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1sur h LEU 119 CO 1.17 0.20 0.00 -2.67 0.09 0.00 0.00 178.44 177.23 1sur n TRP 120 N -4.49 0.00 -0.61 1.13 2.14 -1.26 -1.67 117.44 112.67 1sur n TRP 120 Ca 0.16 0.00 0.07 0.00 2.07 0.00 0.00 57.50 59.80 1sur n TRP 120 Cb 0.58 -0.16 0.21 0.00 -0.81 0.00 0.00 31.31 31.13 1sur n TRP 120 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 1sur n GLU 121 N -1.16 2.93 -2.01 -2.67 1.02 -0.15 -4.69 120.64 113.92 1sur n GLU 121 Ca 0.09 -2.47 -0.26 0.00 -0.02 0.00 0.00 57.16 54.50 1sur n GLU 121 Cb 0.09 -1.58 0.02 0.00 -0.02 0.00 0.00 31.44 29.95 1sur n GLU 121 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1sur n GLN 122 N -0.02 3.49 0.00 3.49 6.02 -0.67 -5.07 117.38 124.63 1sur n GLN 122 Ca 0.17 -4.11 0.00 0.00 -0.01 0.00 0.00 57.00 53.05 1sur n GLN 122 Cb 0.68 -2.28 0.00 0.00 1.02 0.00 0.00 30.24 29.66 1sur n GLN 122 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1sur n GLY 123 N -0.70 -0.45 0.23 1.08 0.00 -1.26 -2.65 105.19 101.44 1sur n GLY 123 Ca 0.45 -1.10 -0.06 0.00 0.00 0.00 0.00 46.02 45.31 1sur n GLY 123 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1sur h VAL 124 N 0.00 1.29 -0.07 1.61 2.07 -1.98 -2.63 116.25 116.55 1sur h VAL 124 Ca 0.00 -1.49 -0.18 0.00 0.82 0.00 0.00 66.70 65.86 1sur h VAL 124 Cb 0.00 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1sur h VAL 124 CO 0.00 0.47 -0.72 -0.33 0.02 0.00 0.00 177.57 177.01 1sur h GLU 125 N 0.46 0.34 -0.01 1.57 4.39 -1.95 -1.64 114.58 117.74 1sur h GLU 125 Ca 0.05 -0.28 -0.00 0.00 0.34 0.00 0.00 59.36 59.47 1sur h GLU 125 Cb 0.84 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.55 1sur h GLU 125 CO 0.07 0.92 -0.00 0.78 -1.16 0.00 0.00 179.01 179.62 1sur h GLY 126 N 1.40 0.02 1.12 -3.84 0.00 -1.48 -1.03 103.07 99.27 1sur h GLY 126 Ca -0.03 -0.02 0.02 0.00 0.00 0.00 0.00 47.33 47.30 1sur h GLY 126 CO 0.12 0.02 0.56 -2.22 0.00 0.00 0.00 176.54 175.01 1sur h ILE 127 N -0.36 1.19 -0.34 2.60 2.04 -1.37 0.15 117.51 121.41 1sur h ILE 127 Ca 0.00 -0.38 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 1sur h ILE 127 Cb 0.39 -0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 1sur h ILE 127 CO 0.00 0.20 0.15 -0.08 0.00 0.00 0.00 178.15 178.42 1sur h GLU 128 N 1.10 0.50 -0.54 2.37 4.81 -1.22 -0.88 114.58 120.72 1sur h GLU 128 Ca 0.32 -0.09 -0.10 0.00 -0.13 0.00 0.00 59.36 59.36 1sur h GLU 128 Cb -0.07 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 1sur h GLU 128 CO -0.08 0.49 -0.06 -0.22 -0.73 0.00 0.00 179.01 178.40 1sur h LYS 129 N 0.41 1.00 -0.26 1.92 3.64 -0.44 -1.80 116.57 121.04 1sur h LYS 129 Ca 0.11 -0.35 0.04 0.00 -1.27 0.00 0.00 60.65 59.18 1sur h LYS 129 Cb 0.16 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 1sur h LYS 129 CO -0.01 1.03 0.05 -0.92 -2.27 0.00 0.00 179.45 177.33 1sur h TYR 130 N 0.88 0.08 -0.26 1.91 5.03 -0.53 -1.26 116.97 122.82 1sur h TYR 130 Ca 0.15 0.02 -0.07 0.00 2.58 0.00 0.00 58.73 61.40 1sur h TYR 130 Cb 0.62 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.89 1sur h TYR 130 CO 0.04 0.02 -0.13 -0.91 -1.32 0.00 0.00 178.16 175.87 1sur h ASN 131 N 0.14 0.42 -0.56 -2.11 2.35 -1.06 0.24 115.58 115.01 1sur h ASN 131 Ca 0.12 -0.10 -0.07 0.00 -0.55 0.00 0.00 56.30 55.70 1sur h ASN 131 Cb 0.12 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 1sur h ASN 131 CO -0.16 0.58 0.09 -0.78 -1.65 0.00 0.00 177.43 175.52 1sur h ASP 132 N 0.41 0.88 -0.06 5.81 3.58 -0.75 0.14 116.42 126.43 1sur h ASP 132 Ca 0.08 -0.26 -0.15 0.00 0.42 0.00 0.00 57.03 57.12 1sur h ASP 132 Cb 0.47 -0.23 0.01 0.00 1.72 0.00 0.00 39.33 41.30 1sur h ASP 132 CO 0.03 0.92 -0.56 0.40 -2.88 0.00 0.00 179.24 177.14 1sur h ILE 133 N 0.81 1.39 0.00 2.25 2.04 -0.80 0.44 117.51 123.63 1sur h ILE 133 Ca 0.17 -1.94 0.00 0.00 1.00 0.00 0.00 64.86 64.09 1sur h ILE 133 Cb 0.41 2.35 0.00 0.00 -0.74 0.00 0.00 36.82 38.84 1sur h ILE 133 CO 0.01 0.58 -1.01 0.59 0.00 0.00 0.00 178.15 178.32 1sur n ASN 134 N -4.21 0.74 0.01 1.72 3.02 0.03 -4.27 115.26 112.31 1sur n ASN 134 Ca -0.09 -0.62 0.00 0.00 -0.03 0.00 0.00 54.58 53.84 1sur n ASN 134 Cb 0.64 0.92 0.00 0.00 -0.61 0.00 0.00 39.78 40.72 1sur n ASN 134 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1sur n LYS 135 N -1.66 0.00 0.06 3.52 5.02 0.24 -4.45 118.16 120.89 1sur n LYS 135 Ca 0.03 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.20 1sur n LYS 135 Cb 0.37 -0.24 -0.09 0.00 -0.02 0.00 0.00 35.03 35.06 1sur n LYS 135 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1sur h VAL 136 N 0.00 1.02 -0.11 -0.18 2.07 -0.97 -2.39 116.25 115.69 1sur h VAL 136 Ca 0.00 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.52 1sur h VAL 136 Cb 0.42 1.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 1sur h VAL 136 CO 0.00 0.22 0.06 -0.08 0.02 0.00 0.00 177.57 177.79 1sur h GLU 137 N -0.70 0.13 -0.42 1.57 4.22 -1.13 -1.83 114.58 116.42 1sur h GLU 137 Ca -0.02 -0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.41 1sur h GLU 137 Cb 0.51 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 1sur h GLU 137 CO 0.03 0.08 0.24 -1.35 -2.18 0.00 0.00 179.01 175.83 1sur h PRO 138 N 0.13 0.58 -0.57 0.92 0.11 -1.77 -2.17 132.00 129.24 1sur h PRO 138 Ca 0.04 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 1sur h PRO 138 Cb 0.00 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 30.97 1sur h PRO 138 CO -0.03 0.46 0.30 1.98 -0.21 0.00 0.00 178.00 180.50 1sur h MET 139 N 0.55 0.80 -0.77 1.05 1.85 -1.31 -0.37 114.93 116.73 1sur h MET 139 Ca 0.15 -0.10 -0.02 0.00 -0.61 0.00 0.00 59.70 59.12 1sur h MET 139 Cb 0.04 -0.15 -0.04 0.00 0.43 0.00 0.00 31.60 31.88 1sur h MET 139 CO -0.03 0.63 0.39 -0.91 -0.40 0.00 0.00 176.91 176.59 1sur h ASN 140 N 0.77 0.98 -0.58 1.39 2.35 -1.24 -0.99 115.58 118.26 1sur h ASN 140 Ca 0.20 -0.10 -0.10 0.00 -0.55 0.00 0.00 56.30 55.75 1sur h ASN 140 Cb 0.07 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 1sur h ASN 140 CO -0.03 0.81 -0.03 -0.09 -1.65 0.00 0.00 177.43 176.44 1sur h ARG 141 N 1.09 1.05 0.17 0.81 2.43 -0.96 -2.50 114.38 116.47 1sur h ARG 141 Ca 0.27 -0.34 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1sur h ARG 141 Cb 0.08 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1sur h ARG 141 CO -0.04 1.04 -0.08 0.00 -1.51 0.00 0.00 179.97 179.38 1sur h ALA 142 N 1.00 -0.22 -0.79 2.80 0.00 -0.49 0.10 119.26 121.66 1sur h ALA 142 Ca 0.16 -0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.11 1sur h ALA 142 Cb 0.59 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.38 1sur h ALA 142 CO 0.04 -0.60 0.41 -0.07 0.00 0.00 0.00 179.25 179.03 1sur h LEU 143 N -0.28 0.54 0.22 0.00 3.38 -1.16 0.45 115.31 118.46 1sur h LEU 143 Ca -0.02 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1sur h LEU 143 Cb 0.22 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1sur h LEU 143 CO 0.04 0.28 -0.10 0.11 0.09 0.00 0.00 178.44 178.85 1sur h LYS 144 N 0.66 -0.28 -0.80 1.13 1.79 -1.21 0.31 116.57 118.17 1sur h LYS 144 Ca 0.40 0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.88 1sur h LYS 144 Cb 0.47 0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 31.14 1sur h LYS 144 CO -0.30 0.01 0.47 0.93 -1.08 0.00 0.00 179.45 179.48 1sur h GLU 145 N -0.57 1.10 -0.00 3.15 5.08 -0.45 -2.21 114.58 120.67 1sur h GLU 145 Ca -0.03 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1sur h GLU 145 Cb 0.42 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1sur h GLU 145 CO 0.05 0.78 -0.04 1.28 -1.00 0.00 0.00 179.01 180.07 1sur n LEU 146 N -4.37 0.32 -3.44 1.33 4.77 0.12 -4.92 117.00 110.81 1sur n LEU 146 Ca 0.09 0.02 -0.24 0.00 -0.03 0.00 0.00 56.01 55.84 1sur n LEU 146 Cb 0.07 -0.13 0.06 0.00 -2.33 0.00 0.00 43.42 41.10 1sur n LEU 146 CO 0.38 0.06 0.17 0.59 -1.33 0.00 0.00 177.39 177.25 1sur n ASN 147 N -0.93 -6.24 -4.76 -1.43 3.02 -0.71 -4.75 115.26 99.46 1sur n ASN 147 Ca 0.18 -0.48 -0.40 0.00 -0.03 0.00 0.00 54.58 53.85 1sur n ASN 147 Cb 0.23 -4.95 -0.04 0.00 -0.61 0.00 0.00 39.78 34.40 1sur n ASN 147 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sur s ALA 148 N -3.28 3.41 0.00 5.41 0.00 0.02 -2.26 121.76 125.07 1sur s ALA 148 Ca 0.51 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.39 1sur s ALA 148 Cb -0.23 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.55 1sur s ALA 148 CO 0.63 -0.21 0.00 1.04 0.00 0.00 0.00 175.76 177.22 1sur n GLN 149 N 1.33 1.88 -4.32 0.00 1.13 -0.45 -4.76 117.38 112.19 1sur n GLN 149 Ca -0.00 0.00 -0.23 0.00 -1.94 0.00 0.00 57.00 54.82 1sur n GLN 149 Cb 0.45 -0.85 -0.17 0.00 0.11 0.00 0.00 30.24 29.78 1sur n GLN 149 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1sur s THR 150 N -1.44 0.91 -0.15 5.09 2.01 -1.08 -1.27 115.64 119.71 1sur s THR 150 Ca 0.00 -0.32 0.00 0.00 0.31 0.00 0.00 61.69 61.68 1sur s THR 150 Cb 0.00 -0.88 0.03 0.00 0.01 0.00 0.00 72.50 71.66 1sur s THR 150 CO 0.00 0.31 -0.10 0.86 -0.69 0.00 0.00 174.62 175.01 1sur s TRP 151 N 0.96 1.90 -0.06 4.92 -0.00 0.56 -1.38 118.94 125.85 1sur s TRP 151 Ca -0.10 -1.11 -0.16 0.00 -0.00 0.00 0.00 56.10 54.73 1sur s TRP 151 Cb -0.15 -1.43 -0.05 0.00 -0.00 0.00 0.00 33.47 31.84 1sur s TRP 151 CO 0.00 -0.62 0.43 -0.06 -0.00 0.00 0.00 176.95 176.70 1sur s PHE 152 N 1.57 3.63 0.09 5.86 0.08 0.67 -0.25 117.98 129.62 1sur s PHE 152 Ca 0.03 0.93 0.03 0.00 0.12 0.00 0.00 56.93 58.04 1sur s PHE 152 Cb -0.14 -2.41 -0.04 0.00 -0.57 0.00 0.00 43.02 39.87 1sur s PHE 152 CO -0.09 0.42 -0.08 0.00 -0.10 0.00 0.00 175.22 175.37 1sur s ALA 153 N -0.29 0.94 -0.41 5.36 0.00 -0.58 -1.42 121.76 125.37 1sur s ALA 153 Ca 0.24 -1.15 0.03 0.00 0.00 0.00 0.00 51.96 51.07 1sur s ALA 153 Cb -0.16 0.08 0.54 0.00 0.00 0.00 0.00 23.12 23.58 1sur s ALA 153 CO 0.12 -0.11 1.81 0.41 0.00 0.00 0.00 175.76 177.99 1sur n GLY 154 N 0.54 4.29 3.76 0.00 0.00 -1.26 -4.23 105.19 108.29 1sur n GLY 154 Ca -0.16 -1.07 -0.36 0.00 0.00 0.00 0.00 46.02 44.43 1sur n GLY 154 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sur s LEU 155 N -2.85 3.79 -0.01 0.99 1.43 -1.26 -4.93 118.68 115.84 1sur s LEU 155 Ca 0.49 2.39 0.03 0.00 -1.03 0.00 0.00 54.13 56.02 1sur s LEU 155 Cb 0.41 -4.46 -0.01 0.00 0.03 0.00 0.00 46.19 42.17 1sur s LEU 155 CO 0.08 -1.36 -0.11 -0.13 0.23 0.00 0.00 176.35 175.06 1sur s ARG 156 N -3.10 0.96 0.36 1.70 0.52 -1.26 -3.38 118.95 114.75 1sur s ARG 156 Ca 0.72 -0.40 0.07 0.00 -0.52 0.00 0.00 55.73 55.60 1sur s ARG 156 Cb -0.30 -0.92 0.76 0.00 0.52 0.00 0.00 34.95 35.01 1sur s ARG 156 CO 0.35 0.22 1.95 0.00 0.02 0.00 0.00 175.30 177.84 1sur h ARG 157 N 5.97 0.71 0.00 3.54 3.08 -1.18 -2.72 114.38 123.78 1sur h ARG 157 Ca -0.33 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.68 1sur h ARG 157 Cb 1.17 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.06 1sur h ARG 157 CO 0.49 0.47 0.00 -0.85 -1.07 0.00 0.00 179.97 179.01 1sur n GLU 158 N -4.49 0.69 -1.97 0.04 0.28 -1.26 -3.46 120.64 110.47 1sur n GLU 158 Ca 0.12 0.01 -0.32 0.00 -0.16 0.00 0.00 57.16 56.81 1sur n GLU 158 Cb 0.27 -1.50 0.01 0.00 1.43 0.00 0.00 31.44 31.65 1sur n GLU 158 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 1sur s GLN 159 N -2.22 3.34 -0.59 3.44 -0.21 -1.03 -4.89 119.66 117.49 1sur s GLN 159 Ca 0.36 1.08 -0.17 0.00 0.02 0.00 0.00 55.36 56.66 1sur s GLN 159 Cb 0.19 -2.04 -0.15 0.00 1.00 0.00 0.00 33.01 32.01 1sur s GLN 159 CO 0.36 -0.79 1.81 0.43 -2.12 0.00 0.00 175.29 174.99 1sur n SER 160 N -2.27 2.61 -3.30 5.90 7.64 -1.26 -4.69 113.62 118.25 1sur n SER 160 Ca 0.08 -2.47 -0.13 0.00 1.01 0.00 0.00 58.87 57.35 1sur n SER 160 Cb 0.53 -0.94 -0.03 0.00 -1.01 0.00 0.00 64.21 62.76 1sur n SER 160 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1sur s GLY 161 N 4.90 1.18 -0.74 0.23 0.00 -1.26 -5.02 107.32 106.61 1sur s GLY 161 Ca 0.48 -1.31 -0.08 0.00 0.00 0.00 0.00 44.72 43.81 1sur s GLY 161 CO 0.10 -0.84 3.28 1.44 0.00 0.00 0.00 173.10 177.08 1sur n SER 162 N -1.26 6.86 -0.33 1.64 7.64 -1.26 -4.15 113.62 122.76 1sur n SER 162 Ca -0.01 -2.57 0.04 0.00 1.01 0.00 0.00 58.87 57.34 1sur n SER 162 Cb 0.61 -1.47 0.05 0.00 -1.01 0.00 0.00 64.21 62.40 1sur n SER 162 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1sur n ARG 163 N 2.86 0.90 0.08 1.43 1.74 -1.26 -4.70 116.66 117.71 1sur n ARG 163 Ca 0.59 -1.22 0.20 0.00 -0.77 0.00 0.00 57.85 56.65 1sur n ARG 163 Cb 0.60 -1.15 0.75 0.00 -1.02 0.00 0.00 32.46 31.64 1sur n ARG 163 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1sur h ALA 164 N 1.39 2.17 -0.13 7.54 0.00 -1.71 -2.04 119.26 126.48 1sur h ALA 164 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1sur h ALA 164 Cb 0.41 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1sur h ALA 164 CO 0.00 -0.59 0.00 0.09 0.00 0.00 0.00 179.25 178.75 1sur n ASN 165 N -3.91 2.77 -4.73 0.00 3.02 -1.26 -4.92 115.26 106.22 1sur n ASN 165 Ca 0.07 -2.63 -0.42 0.00 -0.03 0.00 0.00 54.58 51.57 1sur n ASN 165 Cb 0.57 -0.33 -0.02 0.00 -0.61 0.00 0.00 39.78 39.39 1sur n ASN 165 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1sur s LEU 166 N -2.11 4.36 0.66 3.41 1.43 -0.76 -5.01 118.68 120.65 1sur s LEU 166 Ca 0.26 2.80 -0.04 0.00 -1.03 0.00 0.00 54.13 56.12 1sur s LEU 166 Cb 0.20 -3.61 0.06 0.00 0.03 0.00 0.00 46.19 42.87 1sur s LEU 166 CO 0.06 -0.87 0.94 -2.16 0.23 0.00 0.00 176.35 174.55 1sur s PRO 167 N 0.36 2.28 0.18 1.29 0.04 -1.26 -4.96 135.00 132.92 1sur s PRO 167 Ca 0.67 -0.45 -0.10 0.00 0.04 0.00 0.00 61.00 61.16 1sur s PRO 167 Cb -0.46 -2.27 0.07 0.00 0.04 0.00 0.00 34.50 31.87 1sur s PRO 167 CO 0.39 -1.09 1.65 0.28 0.04 0.00 0.00 177.00 178.28 1sur h VAL 168 N -0.39 1.26 -4.05 -0.36 2.07 -1.87 -3.43 116.25 109.48 1sur h VAL 168 Ca -0.43 -1.09 -0.66 0.00 0.82 0.00 0.00 66.70 65.34 1sur h VAL 168 Cb 1.31 0.76 -0.31 0.00 -1.52 0.00 0.00 31.29 31.53 1sur h VAL 168 CO 0.57 0.40 -0.87 -0.22 0.02 0.00 0.00 177.57 177.46 1sur s LEU 169 N -9.41 2.03 0.29 2.57 2.96 -1.26 -0.18 118.68 115.69 1sur s LEU 169 Ca -0.12 -0.47 -0.12 0.00 -0.22 0.00 0.00 54.13 53.20 1sur s LEU 169 Cb 0.13 -1.27 0.01 0.00 0.50 0.00 0.00 46.19 45.56 1sur s LEU 169 CO 0.85 0.23 0.56 0.00 -1.32 0.00 0.00 176.35 176.67 1sur s ALA 170 N -0.17 -0.24 -0.19 5.97 0.00 -0.62 -4.95 121.76 121.56 1sur s ALA 170 Ca -0.02 -0.92 -0.02 0.00 0.00 0.00 0.00 51.96 51.00 1sur s ALA 170 Cb -0.13 1.00 -0.01 0.00 0.00 0.00 0.00 23.12 23.98 1sur s ALA 170 CO 0.03 -0.89 -0.08 0.42 0.00 0.00 0.00 175.76 175.24 1sur s ILE 171 N -3.54 3.20 -0.07 0.00 1.01 -1.26 0.53 121.20 121.07 1sur s ILE 171 Ca 0.21 -0.57 -0.06 0.00 0.00 0.00 0.00 60.65 60.23 1sur s ILE 171 Cb -0.02 -2.41 0.02 0.00 0.01 0.00 0.00 42.46 40.06 1sur s ILE 171 CO 0.11 0.47 0.18 -1.58 0.00 0.00 0.00 174.94 174.12 1sur s GLN 172 N 1.05 0.19 -1.88 2.79 0.74 0.17 -4.83 119.66 117.89 1sur s GLN 172 Ca 0.00 0.28 0.00 0.00 0.05 0.00 0.00 55.36 55.69 1sur s GLN 172 Cb -0.15 0.05 0.00 0.00 1.10 0.00 0.00 33.01 34.02 1sur s GLN 172 CO -0.01 -0.05 0.00 0.54 -0.55 0.00 0.00 175.29 175.22 1sur n ARG 173 N 3.21 -1.64 -1.00 1.67 5.12 -1.26 -1.66 116.66 121.10 1sur n ARG 173 Ca -0.15 1.06 0.00 0.00 -1.93 0.00 0.00 57.85 56.83 1sur n ARG 173 Cb 0.58 -5.67 0.00 0.00 -1.16 0.00 0.00 32.46 26.21 1sur n ARG 173 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1sur n GLY 174 N -0.87 0.66 3.37 -0.13 0.00 -1.26 -5.03 105.19 101.93 1sur n GLY 174 Ca -0.24 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.59 1sur n GLY 174 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1sur s VAL 175 N -2.66 1.16 0.13 1.61 -7.23 -0.66 -5.00 120.40 107.75 1sur s VAL 175 Ca 0.00 -2.04 -0.30 0.00 -1.81 0.00 0.00 61.98 57.83 1sur s VAL 175 Cb 0.00 -2.47 -0.07 0.00 0.56 0.00 0.00 36.38 34.40 1sur s VAL 175 CO 0.00 -0.23 1.14 -0.36 -0.31 0.00 0.00 175.10 175.33 1sur s PHE 176 N -3.33 3.52 -0.18 2.82 0.08 -0.40 -0.66 117.98 119.83 1sur s PHE 176 Ca 0.31 1.49 -0.01 0.00 0.12 0.00 0.00 56.93 58.83 1sur s PHE 176 Cb 0.06 -3.34 -0.00 0.00 -0.57 0.00 0.00 43.02 39.17 1sur s PHE 176 CO 0.11 -0.87 -0.11 0.21 -0.10 0.00 0.00 175.22 174.46 1sur s LYS 177 N 0.16 3.29 -0.15 0.44 2.20 0.19 -0.32 119.74 125.55 1sur s LYS 177 Ca 0.53 -0.69 -0.01 0.00 -0.36 0.00 0.00 55.97 55.44 1sur s LYS 177 Cb -0.29 -2.77 -0.01 0.00 -1.51 0.00 0.00 37.83 33.24 1sur s LYS 177 CO 0.33 -0.05 -0.12 0.08 -0.36 0.00 0.00 175.35 175.23 1sur s VAL 178 N 1.04 3.07 -0.70 4.02 1.01 0.66 -1.59 120.40 127.90 1sur s VAL 178 Ca -0.01 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.35 1sur s VAL 178 Cb -0.15 -2.31 0.17 0.00 0.00 0.00 0.00 36.38 34.10 1sur s VAL 178 CO -0.02 0.51 0.51 -0.76 0.00 0.00 0.00 175.10 175.34 1sur s LEU 179 N 0.55 4.96 0.36 3.92 1.43 0.75 -1.53 118.68 129.12 1sur s LEU 179 Ca -0.08 -3.53 0.08 0.00 -1.03 0.00 0.00 54.13 49.57 1sur s LEU 179 Cb -0.16 -1.73 0.80 0.00 0.03 0.00 0.00 46.19 45.13 1sur s LEU 179 CO 0.04 -0.17 1.90 -0.65 0.23 0.00 0.00 176.35 177.69 1sur h PRO 180 N 5.98 0.69 -0.45 1.29 0.11 -1.84 -2.57 132.00 135.20 1sur h PRO 180 Ca 0.08 -0.04 -0.20 0.00 0.11 0.00 0.00 66.00 65.96 1sur h PRO 180 Cb 0.82 -0.16 -0.12 0.00 0.11 0.00 0.00 31.00 31.66 1sur h PRO 180 CO 0.74 0.46 0.06 0.44 -0.21 0.00 0.00 178.00 179.49 1sur n ILE 181 N -4.53 2.62 -0.07 4.15 -5.35 -1.26 -3.93 119.36 111.00 1sur n ILE 181 Ca 0.15 -2.40 0.24 0.00 -0.27 0.00 0.00 62.75 60.47 1sur n ILE 181 Cb 0.39 -0.33 0.71 0.00 -1.74 0.00 0.00 39.64 38.67 1sur n ILE 181 CO 0.00 0.00 0.00 -0.29 -1.76 0.00 0.00 176.55 174.50 1sur h ILE 182 N 1.26 0.62 -0.58 7.28 6.09 -1.47 -1.32 117.51 129.39 1sur h ILE 182 Ca 0.24 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.73 1sur h ILE 182 Cb 1.83 0.65 0.00 0.00 0.47 0.00 0.00 36.82 39.77 1sur h ILE 182 CO 0.48 0.00 0.00 -0.90 -3.07 0.00 0.00 178.15 174.66 1sur n ASP 183 N -4.26 3.63 -4.74 2.19 5.75 -1.26 -0.88 116.55 116.97 1sur n ASP 183 Ca 0.13 -2.05 -0.41 0.00 -0.01 0.00 0.00 54.79 52.46 1sur n ASP 183 Cb 0.76 -0.40 -0.04 0.00 -1.03 0.00 0.00 41.12 40.41 1sur n ASP 183 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 1sur s TRP 184 N -1.09 3.71 0.59 2.11 0.52 -0.50 -5.01 118.94 119.28 1sur s TRP 184 Ca 0.40 1.72 0.06 0.00 0.02 0.00 0.00 56.10 58.30 1sur s TRP 184 Cb 0.21 -3.17 0.09 0.00 -1.15 0.00 0.00 33.47 29.44 1sur s TRP 184 CO 0.26 -0.23 0.82 0.16 0.02 0.00 0.00 176.95 177.98 1sur s ASP 185 N -0.39 4.98 0.50 2.95 1.47 -1.26 -4.76 116.67 120.16 1sur s ASP 185 Ca 0.47 -0.63 0.21 0.00 1.18 0.00 0.00 52.55 53.77 1sur s ASP 185 Cb -0.28 0.05 1.31 0.00 -0.34 0.00 0.00 42.92 43.66 1sur s ASP 185 CO 0.34 -1.40 2.08 0.78 0.68 0.00 0.00 175.17 177.65 1sur h ASN 186 N 0.04 0.00 -0.23 2.11 2.35 -1.99 -2.09 115.58 115.77 1sur h ASN 186 Ca -0.33 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.31 1sur h ASN 186 Cb 1.28 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.65 1sur h ASN 186 CO 0.42 0.12 -0.27 0.03 -1.65 0.00 0.00 177.43 176.07 1sur h ARG 187 N 0.00 0.59 -0.65 0.81 -0.00 -1.99 -1.99 114.38 111.15 1sur h ARG 187 Ca -0.00 -0.33 -0.09 0.00 -0.50 0.00 0.00 59.98 59.06 1sur h ARG 187 Cb 0.25 0.02 -0.02 0.00 0.00 0.00 0.00 29.97 30.21 1sur h ARG 187 CO 0.02 0.93 0.06 1.15 0.00 0.00 0.00 179.97 182.12 1sur h THR 188 N 0.28 1.27 0.07 2.04 2.02 -1.87 -1.13 112.91 115.60 1sur h THR 188 Ca 0.03 -1.10 -0.00 0.00 0.77 0.00 0.00 66.41 66.11 1sur h THR 188 Cb 0.84 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.95 1sur h THR 188 CO 0.06 0.41 -0.03 0.40 0.37 0.00 0.00 175.52 176.73 1sur h ILE 189 N 1.02 0.93 -0.41 3.11 1.08 -1.34 -1.35 117.51 120.54 1sur h ILE 189 Ca 0.19 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.68 1sur h ILE 189 Cb 0.50 0.93 -0.03 0.00 -3.07 0.00 0.00 36.82 35.15 1sur h ILE 189 CO 0.02 0.00 0.25 0.22 -0.69 0.00 0.00 178.15 177.95 1sur h TYR 190 N -0.10 0.46 -0.67 1.37 3.20 -1.18 -1.31 116.97 118.75 1sur h TYR 190 Ca -0.01 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1sur h TYR 190 Cb 0.07 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.16 1sur h TYR 190 CO -0.08 0.27 0.42 1.96 -1.64 0.00 0.00 178.16 179.09 1sur h GLN 191 N 0.50 0.90 -0.27 1.82 4.20 -1.07 -0.28 115.11 120.91 1sur h GLN 191 Ca 0.16 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.75 1sur h GLN 191 Cb 0.00 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 1sur h GLN 191 CO -0.07 0.62 -0.02 -0.92 -0.67 0.00 0.00 178.83 177.77 1sur h TYR 192 N 0.92 0.54 0.05 2.96 5.03 -0.66 -0.96 116.97 124.86 1sur h TYR 192 Ca 0.24 -0.10 -0.00 0.00 2.58 0.00 0.00 58.73 61.45 1sur h TYR 192 Cb -0.06 -0.14 0.00 0.00 1.55 0.00 0.00 36.73 38.09 1sur h TYR 192 CO 0.00 0.67 -0.02 -0.07 -1.32 0.00 0.00 178.16 177.41 1sur h LEU 193 N 0.26 -0.06 -0.05 2.82 3.38 -0.70 -1.83 115.31 119.14 1sur h LEU 193 Ca 0.07 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.08 1sur h LEU 193 Cb 0.46 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 1sur h LEU 193 CO 0.02 -0.04 -0.24 1.56 0.09 0.00 0.00 178.44 179.83 1sur h GLN 194 N -0.07 -0.33 -0.89 1.13 1.08 -1.04 0.80 115.11 115.79 1sur h GLN 194 Ca -0.01 0.02 0.04 0.00 -1.45 0.00 0.00 58.65 57.26 1sur h GLN 194 Cb 0.05 0.08 -0.05 0.00 -0.05 0.00 0.00 27.48 27.51 1sur h GLN 194 CO 0.01 -0.22 0.58 -0.22 -0.95 0.00 0.00 178.83 178.03 1sur h LYS 195 N -0.35 1.05 -0.73 1.46 3.64 -1.03 -2.77 116.57 117.86 1sur h LYS 195 Ca 0.08 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1sur h LYS 195 Cb 0.45 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1sur h LYS 195 CO -0.25 0.70 0.00 0.72 -2.27 0.00 0.00 179.45 178.35 1sur n HIS 196 N -4.46 1.14 -2.64 1.91 8.25 -0.70 -4.95 115.22 113.77 1sur n HIS 196 Ca 0.12 -0.53 -0.14 0.00 -0.26 0.00 0.00 57.72 56.92 1sur n HIS 196 Cb 0.13 -0.07 0.02 0.00 1.12 0.00 0.00 29.99 31.19 1sur n HIS 196 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1sur n GLY 197 N 1.55 -0.07 3.87 -1.41 0.00 -0.76 -5.04 105.19 103.33 1sur n GLY 197 Ca 0.25 -0.25 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 1sur n GLY 197 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1sur s LEU 198 N -4.18 3.37 0.16 0.99 1.43 0.20 -5.04 118.68 115.62 1sur s LEU 198 Ca 0.16 -0.77 0.02 0.00 -1.03 0.00 0.00 54.13 52.50 1sur s LEU 198 Cb -0.07 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 1sur s LEU 198 CO 0.19 -0.65 -0.00 -0.54 0.23 0.00 0.00 176.35 175.58 1sur s LYS 199 N -4.12 1.05 0.78 1.70 -0.14 -1.26 -4.42 119.74 113.33 1sur s LYS 199 Ca 0.48 -1.50 -0.11 0.00 -1.36 0.00 0.00 55.97 53.48 1sur s LYS 199 Cb -0.03 -0.22 0.06 0.00 -1.68 0.00 0.00 37.83 35.96 1sur s LYS 199 CO 0.28 -0.12 1.09 0.71 -0.76 0.00 0.00 175.35 176.54 1sur s TYR 200 N -3.68 2.86 0.39 3.18 2.02 -1.26 -4.68 117.35 116.18 1sur s TYR 200 Ca 0.22 1.20 -0.27 0.00 -0.37 0.00 0.00 57.07 57.85 1sur s TYR 200 Cb 0.06 -3.09 -0.11 0.00 -0.40 0.00 0.00 41.96 38.43 1sur s TYR 200 CO 0.02 -1.70 1.35 1.58 -1.57 0.00 0.00 175.55 175.23 1sur n HIS 201 N -3.40 2.44 -0.16 2.71 -0.00 -0.02 -4.87 115.22 111.92 1sur n HIS 201 Ca 0.07 0.50 0.25 0.00 -0.00 0.00 0.00 57.72 58.54 1sur n HIS 201 Cb 0.56 -2.43 0.68 0.00 -0.00 0.00 0.00 29.99 28.79 1sur n HIS 201 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1sur h PRO 202 N 2.46 0.07 0.00 1.57 0.11 -1.92 -0.73 132.00 133.55 1sur h PRO 202 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1sur h PRO 202 Cb 1.28 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1sur h PRO 202 CO 0.62 0.05 0.00 1.28 -0.21 0.00 0.00 178.00 179.73 1sur n LEU 203 N -4.33 0.00 -0.28 2.35 4.77 -1.26 -2.55 117.00 115.69 1sur n LEU 203 Ca 0.17 0.47 -0.05 0.00 -0.03 0.00 0.00 56.01 56.57 1sur n LEU 203 Cb 0.85 -0.47 0.07 0.00 -2.33 0.00 0.00 43.42 41.54 1sur n LEU 203 CO 0.37 -0.17 1.14 -0.25 -1.33 0.00 0.00 177.39 177.15 1sur h TRP 204 N 0.00 1.06 0.00 -1.77 2.91 -1.33 -1.44 115.95 115.38 1sur h TRP 204 Ca 0.00 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.00 1sur h TRP 204 Cb 0.30 -0.34 0.00 0.00 -0.51 0.00 0.00 29.16 28.61 1sur h TRP 204 CO 0.00 0.73 0.00 -0.25 -1.03 0.00 0.00 178.44 177.89 1sur n ASP 205 N -4.45 0.00 -1.03 2.65 8.00 -1.06 -0.84 116.55 119.82 1sur n ASP 205 Ca 0.07 -0.03 0.08 0.00 0.71 0.00 0.00 54.79 55.62 1sur n ASP 205 Cb 0.08 -0.25 0.26 0.00 -0.02 0.00 0.00 41.12 41.19 1sur n ASP 205 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1sur n GLU 206 N -1.25 3.21 -0.75 -1.24 1.02 -0.63 -4.96 120.64 116.04 1sur n GLU 206 Ca 0.09 -2.61 0.00 0.00 -0.02 0.00 0.00 57.16 54.61 1sur n GLU 206 Cb 0.13 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.86 1sur n GLU 206 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1sur n GLY 207 N 0.30 0.62 3.65 0.62 0.00 -0.02 -5.02 105.19 105.33 1sur n GLY 207 Ca 0.20 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1sur n GLY 207 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1sur s TYR 208 N -2.00 3.18 0.19 1.61 1.51 -0.69 -4.90 117.35 116.25 1sur s TYR 208 Ca 0.00 1.28 0.14 0.00 -1.01 0.00 0.00 57.07 57.49 1sur s TYR 208 Cb 0.00 -3.50 0.46 0.00 -0.11 0.00 0.00 41.96 38.81 1sur s TYR 208 CO 0.00 -0.78 1.64 -0.07 -1.11 0.00 0.00 175.55 175.23 1sur h LEU 209 N 9.81 0.00 -7.13 -1.29 3.38 -1.91 -3.39 115.31 114.78 1sur h LEU 209 Ca -0.21 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1sur h LEU 209 Cb 1.07 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.70 1sur h LEU 209 CO 1.00 0.52 0.18 -0.94 0.09 0.00 0.00 178.44 179.29 1sur s SER 210 N -6.62 -0.51 0.01 -0.43 1.04 -1.26 -4.93 113.70 101.00 1sur s SER 210 Ca -0.00 -0.09 -0.01 0.00 0.48 0.00 0.00 55.95 56.33 1sur s SER 210 Cb 0.11 0.59 -0.01 0.00 0.10 0.00 0.00 66.02 66.82 1sur s SER 210 CO 0.73 -0.98 -0.00 0.68 0.98 0.00 0.00 173.24 174.64 1sur s VAL 211 N -3.77 0.07 0.00 5.02 -7.23 -1.26 -5.03 120.40 108.20 1sur s VAL 211 Ca 0.02 -0.56 0.00 0.00 -1.81 0.00 0.00 61.98 59.64 1sur s VAL 211 Cb -0.01 -0.19 0.00 0.00 0.56 0.00 0.00 36.38 36.74 1sur s VAL 211 CO -0.11 -0.31 0.00 0.61 -0.31 0.00 0.00 175.10 174.98 1sur n GLY 212 N 2.14 2.28 3.92 2.32 0.00 -1.26 -4.82 105.19 109.76 1sur n GLY 212 Ca -0.19 -0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 1sur n GLY 212 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1sur s ASP 213 N 1.58 6.42 -0.00 1.61 1.01 -1.26 -3.43 116.67 122.59 1sur s ASP 213 Ca 0.00 0.56 0.05 0.00 0.71 0.00 0.00 52.55 53.87 1sur s ASP 213 Cb 0.00 -2.08 -0.01 0.00 1.01 0.00 0.00 42.92 41.84 1sur s ASP 213 CO 0.00 -0.12 -0.15 0.28 0.21 0.00 0.00 175.17 175.39 1sur s THR 214 N -1.98 1.15 0.00 -1.27 -1.32 0.77 -4.89 115.64 108.10 1sur s THR 214 Ca 0.41 -0.70 0.00 0.00 -1.21 0.00 0.00 61.69 60.19 1sur s THR 214 Cb -0.11 -0.98 0.00 0.00 -1.51 0.00 0.00 72.50 69.91 1sur s THR 214 CO 0.29 0.27 0.28 1.41 -2.21 0.00 0.00 174.62 174.66