#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w1y s VAL 2 N 0.00 4.95 0.49 3.15 1.01 -1.26 -0.52 120.40 128.22 2w1y s VAL 2 Ca 0.00 -0.58 -0.19 0.00 0.00 0.00 0.00 61.98 61.21 2w1y s VAL 2 Cb 0.00 -3.67 -0.08 0.00 0.00 0.00 0.00 36.38 32.63 2w1y s VAL 2 CO 0.00 -0.16 1.01 -0.36 0.00 0.00 0.00 175.10 175.60 2w1y s PHE 3 N 1.64 3.14 0.67 5.22 0.40 -0.14 -4.99 117.98 123.93 2w1y s PHE 3 Ca 0.04 1.56 -0.11 0.00 -0.60 0.00 0.00 56.93 57.82 2w1y s PHE 3 Cb -0.18 -2.96 -0.01 0.00 0.51 0.00 0.00 43.02 40.38 2w1y s PHE 3 CO 0.08 -0.63 1.06 0.20 0.70 0.00 0.00 175.22 176.64 2w1y s GLY 4 N -2.33 1.65 0.08 4.36 0.00 -1.26 -4.84 107.32 104.98 2w1y s GLY 4 Ca 0.64 -0.12 -0.30 0.00 0.00 0.00 0.00 44.72 44.94 2w1y s GLY 4 CO 0.23 0.20 1.66 -0.09 0.00 0.00 0.00 173.10 175.09 2w1y h ARG 5 N -0.56 -0.61 -0.28 2.90 2.43 -1.97 -0.06 114.38 116.23 2w1y h ARG 5 Ca -0.44 0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 58.66 2w1y h ARG 5 Cb 1.22 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.89 2w1y h ARG 5 CO 0.61 -0.40 -0.29 0.00 -1.51 0.00 0.00 179.97 178.37 2w1y h GLU 7 N 0.49 0.38 -0.46 0.00 4.81 -1.91 -0.27 114.58 117.61 2w1y h GLU 7 Ca 0.06 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 2w1y h GLU 7 Cb 0.75 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.03 2w1y h GLU 7 CO 0.06 0.25 0.08 1.25 -0.73 0.00 0.00 179.01 179.92 2w1y h LEU 8 N 0.39 0.72 -0.53 1.64 5.85 -0.87 -1.91 115.31 120.60 2w1y h LEU 8 Ca 0.18 -0.25 0.11 0.00 0.84 0.00 0.00 57.88 58.75 2w1y h LEU 8 Cb 0.11 -0.19 -0.09 0.00 0.37 0.00 0.00 40.66 40.86 2w1y h LEU 8 CO -0.14 0.79 -0.01 0.00 -0.34 0.00 0.00 178.44 178.74 2w1y h ALA 9 N 0.96 0.49 -0.42 1.25 0.00 -0.97 0.17 119.26 120.74 2w1y h ALA 9 Ca 0.14 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2w1y h ALA 9 Cb 0.37 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2w1y h ALA 9 CO 0.01 -0.39 0.21 0.00 0.00 0.00 0.00 179.25 179.08 2w1y h ALA 10 N 1.48 0.53 -0.49 0.00 0.00 -0.83 -1.05 119.26 118.91 2w1y h ALA 10 Ca 0.27 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 2w1y h ALA 10 Cb 0.42 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2w1y h ALA 10 CO -0.46 0.08 0.13 0.00 0.00 0.00 0.00 179.25 179.00 2w1y h ALA 11 N 1.06 0.64 -0.36 0.00 0.00 -0.82 0.03 119.26 119.81 2w1y h ALA 11 Ca 0.14 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2w1y h ALA 11 Cb 0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2w1y h ALA 11 CO -0.02 0.32 0.16 0.52 0.00 0.00 0.00 179.25 180.23 2w1y h MET 12 N 0.66 0.53 -0.48 0.00 2.86 -0.51 -1.32 114.93 116.67 2w1y h MET 12 Ca 0.15 -0.09 0.01 0.00 -2.06 0.00 0.00 59.70 57.72 2w1y h MET 12 Cb 0.31 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.85 2w1y h MET 12 CO -0.00 0.50 0.31 -0.22 1.06 0.00 0.00 176.91 178.56 2w1y h LYS 13 N 0.44 0.61 -0.71 1.72 3.64 -1.11 -0.97 116.57 120.19 2w1y h LYS 13 Ca 0.12 -0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.53 2w1y h LYS 13 Cb 0.15 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 2w1y h LYS 13 CO -0.01 0.40 0.47 -0.09 -2.27 0.00 0.00 179.45 177.95 2w1y h ARG 14 N 0.63 0.73 -0.57 1.90 2.43 -0.64 -0.93 114.38 117.93 2w1y h ARG 14 Ca 0.18 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 2w1y h ARG 14 Cb -0.06 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.33 2w1y h ARG 14 CO -0.05 0.48 0.00 0.72 -1.51 0.00 0.00 179.97 179.61 2w1y n HIS 15 N -4.48 0.84 -1.46 2.20 8.25 -0.53 -4.91 115.22 115.14 2w1y n HIS 15 Ca 0.10 -0.34 -0.04 0.00 -0.26 0.00 0.00 57.72 57.18 2w1y n HIS 15 Cb 0.21 -0.15 -0.01 0.00 1.12 0.00 0.00 29.99 31.16 2w1y n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2w1y n GLY 16 N 0.82 0.54 0.18 -1.41 0.00 -0.35 -4.92 105.19 100.03 2w1y n GLY 16 Ca 0.15 -0.81 0.10 0.00 0.00 0.00 0.00 46.02 45.46 2w1y n GLY 16 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2w1y h LEU 17 N 0.00 0.00 -9.21 0.99 5.85 -1.38 -3.40 115.31 108.16 2w1y h LEU 17 Ca -0.10 0.00 -0.55 0.00 0.84 0.00 0.00 57.88 58.07 2w1y h LEU 17 Cb 0.56 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 2w1y h LEU 17 CO 0.13 0.08 1.05 -0.62 -0.34 0.00 0.00 178.44 178.73 2w1y s ASP 18 N -5.96 6.70 -0.80 1.25 -1.08 -1.26 -1.11 116.67 114.41 2w1y s ASP 18 Ca 0.04 2.05 0.00 0.00 -0.52 0.00 0.00 52.55 54.12 2w1y s ASP 18 Cb 0.07 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.99 2w1y s ASP 18 CO 0.72 -0.92 0.00 0.59 0.52 0.00 0.00 175.17 176.08 2w1y n ASN 19 N 7.14 -5.38 -4.71 -0.34 3.02 -0.34 -4.88 115.26 109.78 2w1y n ASN 19 Ca 0.17 0.19 -0.42 0.00 -0.03 0.00 0.00 54.58 54.48 2w1y n ASN 19 Cb 0.43 -3.54 -0.03 0.00 -0.61 0.00 0.00 39.78 36.03 2w1y n ASN 19 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2w1y s TYR 20 N -1.79 2.68 -1.17 3.10 5.04 -0.27 -0.95 117.35 123.99 2w1y s TYR 20 Ca 0.00 0.29 0.00 0.00 -2.44 0.00 0.00 57.07 54.92 2w1y s TYR 20 Cb 0.00 -4.10 0.00 0.00 0.35 0.00 0.00 41.96 38.21 2w1y s TYR 20 CO 0.00 -4.27 0.00 0.54 -1.34 0.00 0.00 175.55 170.48 2w1y n ARG 21 N 4.59 -1.89 -0.65 4.97 5.12 -1.26 -1.56 116.66 125.98 2w1y n ARG 21 Ca 0.16 0.66 0.00 0.00 -1.93 0.00 0.00 57.85 56.74 2w1y n ARG 21 Cb 0.37 -5.14 0.00 0.00 -1.16 0.00 0.00 32.46 26.54 2w1y n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2w1y n GLY 22 N -0.61 0.72 3.48 -0.13 0.00 -0.12 -5.02 105.19 103.50 2w1y n GLY 22 Ca -0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 2w1y n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2w1y s TYR 23 N -2.39 3.18 0.84 1.61 2.02 -0.60 -4.92 117.35 117.10 2w1y s TYR 23 Ca 0.00 -0.43 -0.13 0.00 -0.37 0.00 0.00 57.07 56.14 2w1y s TYR 23 Cb 0.00 -2.85 0.07 0.00 -0.40 0.00 0.00 41.96 38.79 2w1y s TYR 23 CO 0.00 -0.69 0.99 -1.13 -1.57 0.00 0.00 175.55 173.16 2w1y n SER 24 N 5.52 0.17 -0.34 2.29 3.41 -1.26 -1.20 113.62 122.21 2w1y n SER 24 Ca -0.08 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.17 2w1y n SER 24 Cb 0.47 -1.42 0.31 0.00 -0.26 0.00 0.00 64.21 63.30 2w1y n SER 24 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2w1y h LEU 25 N -1.11 0.71 -1.66 1.04 5.85 -1.90 -1.24 115.31 116.99 2w1y h LEU 25 Ca -0.45 0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.41 2w1y h LEU 25 Cb 1.30 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.28 2w1y h LEU 25 CO 0.43 0.24 0.29 1.23 -0.34 0.00 0.00 178.44 180.29 2w1y h GLY 26 N 0.71 0.51 0.89 3.75 0.00 -1.91 -1.22 103.07 105.81 2w1y h GLY 26 Ca 0.56 -0.17 0.02 0.00 0.00 0.00 0.00 47.33 47.74 2w1y h GLY 26 CO -0.39 0.15 0.33 3.43 0.00 0.00 0.00 176.54 180.05 2w1y h ASN 27 N 0.44 0.54 -0.42 0.19 2.35 -1.45 -0.18 115.58 117.04 2w1y h ASN 27 Ca 0.18 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.83 2w1y h ASN 27 Cb 0.18 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 2w1y h ASN 27 CO -0.04 0.38 -0.14 -0.50 -1.65 0.00 0.00 177.43 175.48 2w1y h TRP 28 N 0.66 0.95 -0.51 1.19 4.06 -1.31 -0.85 115.95 120.14 2w1y h TRP 28 Ca 0.22 -0.22 -0.09 0.00 2.06 0.00 0.00 58.89 60.86 2w1y h TRP 28 Cb 0.01 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 27.93 2w1y h TRP 28 CO -0.06 0.97 -0.02 0.28 -3.56 0.00 0.00 178.44 176.05 2w1y h VAL 29 N 0.65 1.27 -0.21 1.49 2.07 -1.16 -1.49 116.25 118.87 2w1y h VAL 29 Ca 0.10 -1.13 -0.00 0.00 0.82 0.00 0.00 66.70 66.49 2w1y h VAL 29 Cb 0.69 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 2w1y h VAL 29 CO 0.05 0.40 0.12 0.00 0.02 0.00 0.00 177.57 178.16 2w1y h ALA 31 N 1.02 0.27 -0.98 0.00 0.00 -1.05 -2.31 119.26 116.21 2w1y h ALA 31 Ca 0.08 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2w1y h ALA 31 Cb 0.04 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 2w1y h ALA 31 CO -0.01 -0.35 0.64 0.00 0.00 0.00 0.00 179.25 179.53 2w1y h ALA 32 N 1.17 1.24 -0.05 0.00 0.00 -0.99 0.67 119.26 121.30 2w1y h ALA 32 Ca 0.11 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.98 2w1y h ALA 32 Cb 0.10 -0.40 -0.04 0.00 0.00 0.00 0.00 17.79 17.45 2w1y h ALA 32 CO -0.13 0.64 -0.15 -0.22 0.00 0.00 0.00 179.25 179.39 2w1y h LYS 33 N 1.33 -0.22 0.00 0.00 1.63 -0.51 -0.87 116.57 117.93 2w1y h LYS 33 Ca 0.36 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 60.15 2w1y h LYS 33 Cb -0.14 0.05 -0.00 0.00 -0.60 0.00 0.00 32.23 31.53 2w1y h LYS 33 CO -0.08 -0.14 -0.46 0.74 -3.45 0.00 0.00 179.45 176.06 2w1y h PHE 34 N -0.23 0.00 -0.00 1.91 0.04 -1.15 0.13 116.94 117.64 2w1y h PHE 34 Ca 0.07 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.67 2w1y h PHE 34 Cb 0.32 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.48 2w1y h PHE 34 CO -0.23 0.10 -0.66 0.93 -0.60 0.00 0.00 178.31 177.85 2w1y h GLU 35 N 0.00 0.45 0.00 1.51 4.39 -0.76 -3.42 114.58 116.75 2w1y h GLU 35 Ca -0.01 -0.48 0.00 0.00 0.34 0.00 0.00 59.36 59.20 2w1y h GLU 35 Cb 1.09 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 2w1y h GLU 35 CO 0.01 1.13 0.00 -1.13 -1.16 0.00 0.00 179.01 177.87 2w1y n SER 36 N -4.17 0.18 -2.99 1.42 3.41 -0.36 -4.85 113.62 106.27 2w1y n SER 36 Ca -0.10 -0.86 -0.20 0.00 -0.26 0.00 0.00 58.87 57.44 2w1y n SER 36 Cb 0.70 0.03 0.01 0.00 -0.26 0.00 0.00 64.21 64.69 2w1y n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2w1y n ASN 37 N -0.03 -4.69 -0.46 4.04 5.15 0.45 -1.64 115.26 118.08 2w1y n ASN 37 Ca 0.00 -0.20 -0.06 0.00 -0.60 0.00 0.00 54.58 53.72 2w1y n ASN 37 Cb 0.17 -3.86 -0.03 0.00 -0.53 0.00 0.00 39.78 35.53 2w1y n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2w1y n PHE 38 N -4.01 0.00 -3.37 1.20 3.72 -1.19 -4.82 117.46 108.99 2w1y n PHE 38 Ca -0.09 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.90 2w1y n PHE 38 Cb 0.59 -1.53 -0.09 0.00 -0.94 0.00 0.00 39.48 37.51 2w1y n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2w1y s ASN 39 N -2.55 6.21 0.59 4.37 3.84 -0.65 -0.96 114.94 125.78 2w1y s ASN 39 Ca 0.00 -0.19 0.37 0.00 0.21 0.00 0.00 52.86 53.25 2w1y s ASN 39 Cb 0.00 -2.21 1.77 0.00 -0.55 0.00 0.00 41.25 40.26 2w1y s ASN 39 CO 0.00 -0.37 2.14 0.71 -2.79 0.00 0.00 177.10 176.79 2w1y h THR 40 N 5.56 0.09 -0.16 -5.21 1.35 -1.13 -2.66 112.91 110.75 2w1y h THR 40 Ca -0.29 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.23 2w1y h THR 40 Cb 1.14 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.86 2w1y h THR 40 CO 0.71 0.02 0.00 0.00 -0.25 0.00 0.00 175.52 176.00 2w1y n GLN 41 N -3.17 1.87 -1.81 4.72 6.02 -1.26 -4.08 117.38 119.67 2w1y n GLN 41 Ca -0.01 -1.29 -0.42 0.00 -0.01 0.00 0.00 57.00 55.27 2w1y n GLN 41 Cb 0.21 -1.43 -0.02 0.00 1.02 0.00 0.00 30.24 30.02 2w1y n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2w1y s ALA 42 N -1.80 3.79 0.02 -1.58 0.00 -1.00 -4.78 121.76 116.40 2w1y s ALA 42 Ca 0.34 1.53 0.02 0.00 0.00 0.00 0.00 51.96 53.84 2w1y s ALA 42 Cb 0.19 -3.65 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 2w1y s ALA 42 CO 0.29 -0.92 -0.06 0.95 0.00 0.00 0.00 175.76 176.01 2w1y s THR 43 N 0.43 0.48 -0.12 0.00 -4.23 -1.26 -0.25 115.64 110.70 2w1y s THR 43 Ca 0.67 -0.61 -0.06 0.00 -1.18 0.00 0.00 61.69 60.51 2w1y s THR 43 Cb -0.47 -0.47 0.05 0.00 1.34 0.00 0.00 72.50 72.94 2w1y s THR 43 CO 0.41 -0.10 0.27 0.20 -0.54 0.00 0.00 174.62 174.86 2w1y s ASN 44 N -0.78 -0.27 0.21 3.99 0.01 -0.66 -4.98 114.94 112.46 2w1y s ASN 44 Ca -0.03 0.58 -0.30 0.00 -0.71 0.00 0.00 52.86 52.40 2w1y s ASN 44 Cb -0.06 0.47 -0.08 0.00 0.41 0.00 0.00 41.25 41.99 2w1y s ASN 44 CO 0.00 -0.17 0.97 -0.60 -1.51 0.00 0.00 177.10 175.79 2w1y s ARG 45 N 1.34 4.79 0.30 -0.60 6.06 -1.26 -0.78 118.95 128.79 2w1y s ARG 45 Ca -0.09 1.53 -0.05 0.00 -2.50 0.00 0.00 55.73 54.63 2w1y s ARG 45 Cb -0.10 -3.29 -0.05 0.00 0.06 0.00 0.00 34.95 31.57 2w1y s ARG 45 CO -0.09 0.40 0.56 -0.80 -2.50 0.00 0.00 175.30 172.86 2w1y s ASN 46 N -0.84 6.43 0.53 -2.12 0.02 0.12 -4.94 114.94 114.14 2w1y s ASN 46 Ca 0.43 0.70 0.22 0.00 -1.02 0.00 0.00 52.86 53.19 2w1y s ASN 46 Cb -0.26 -2.14 1.37 0.00 0.02 0.00 0.00 41.25 40.24 2w1y s ASN 46 CO 0.33 -0.21 2.08 0.71 0.02 0.00 0.00 177.10 180.02 2w1y h THR 47 N 1.28 0.82 0.00 1.60 1.35 -1.98 -0.15 112.91 115.84 2w1y h THR 47 Ca -0.48 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 2w1y h THR 47 Cb 1.19 0.86 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 2w1y h THR 47 CO 0.66 0.00 0.00 -0.90 -0.25 0.00 0.00 175.52 175.03 2w1y n ASP 48 N -4.39 0.00 0.00 5.36 5.75 -1.26 -4.90 116.55 117.11 2w1y n ASP 48 Ca 0.03 -0.92 0.00 0.00 -0.01 0.00 0.00 54.79 53.89 2w1y n ASP 48 Cb 0.35 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 2w1y n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2w1y n GLY 49 N 1.01 1.10 3.75 6.12 0.00 -0.07 -5.02 105.19 112.08 2w1y n GLY 49 Ca 0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 2w1y n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2w1y s SER 50 N -2.86 2.58 0.02 1.61 1.04 -1.26 -4.74 113.70 110.10 2w1y s SER 50 Ca 0.00 0.76 0.02 0.00 0.48 0.00 0.00 55.95 57.22 2w1y s SER 50 Cb 0.00 -1.15 -0.02 0.00 0.10 0.00 0.00 66.02 64.95 2w1y s SER 50 CO 0.00 -3.11 -0.08 -0.89 0.98 0.00 0.00 173.24 170.14 2w1y s THR 51 N -3.28 0.59 -0.13 2.02 2.01 -1.26 -0.70 115.64 114.89 2w1y s THR 51 Ca 0.68 -0.72 -0.06 0.00 0.31 0.00 0.00 61.69 61.90 2w1y s THR 51 Cb -0.12 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 2w1y s THR 51 CO 0.54 -0.11 0.10 -1.81 -0.69 0.00 0.00 174.62 172.66 2w1y s ASP 52 N -0.90 6.07 -0.07 3.53 1.01 0.04 -1.04 116.67 125.30 2w1y s ASP 52 Ca -0.03 0.35 0.04 0.00 0.71 0.00 0.00 52.55 53.61 2w1y s ASP 52 Cb -0.06 -1.94 0.00 0.00 1.01 0.00 0.00 42.92 41.93 2w1y s ASP 52 CO 0.00 0.36 -0.19 -0.31 0.21 0.00 0.00 175.17 175.25 2w1y s TYR 53 N -0.73 1.98 0.00 4.23 1.51 0.24 -1.66 117.35 122.91 2w1y s TYR 53 Ca 0.13 -0.70 0.00 0.00 -1.01 0.00 0.00 57.07 55.48 2w1y s TYR 53 Cb -0.12 -1.35 0.00 0.00 -0.11 0.00 0.00 41.96 40.38 2w1y s TYR 53 CO 0.03 -0.28 0.00 0.41 -1.11 0.00 0.00 175.55 174.59 2w1y n GLY 54 N 3.44 -2.20 0.32 0.71 0.00 0.66 -1.88 105.19 106.24 2w1y n GLY 54 Ca -0.20 -1.66 0.14 0.00 0.00 0.00 0.00 46.02 44.30 2w1y n GLY 54 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2w1y h ILE 55 N 0.00 0.84 -0.25 -0.61 3.07 -1.71 -0.75 117.51 118.10 2w1y h ILE 55 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 2w1y h ILE 55 Cb 0.00 0.88 0.00 0.00 -0.27 0.00 0.00 36.82 37.43 2w1y h ILE 55 CO 0.00 0.00 0.00 0.18 -1.05 0.00 0.00 178.15 177.28 2w1y n LEU 56 N -4.40 3.05 -3.80 0.16 4.77 -1.26 -4.05 117.00 111.47 2w1y n LEU 56 Ca 0.02 -2.37 -0.24 0.00 -0.03 0.00 0.00 56.01 53.39 2w1y n LEU 56 Cb 0.32 -0.31 0.01 0.00 -2.33 0.00 0.00 43.42 41.11 2w1y n LEU 56 CO 0.35 0.68 -0.14 0.00 -1.33 0.00 0.00 177.39 176.94 2w1y n GLN 57 N -0.05 -3.64 -2.43 3.23 1.13 -0.29 -4.90 117.38 110.43 2w1y n GLN 57 Ca 0.13 0.50 -0.41 0.00 -1.94 0.00 0.00 57.00 55.28 2w1y n GLN 57 Cb 0.56 -4.75 -0.03 0.00 0.11 0.00 0.00 30.24 26.12 2w1y n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2w1y s ILE 58 N -3.77 3.84 -0.05 5.09 1.01 -0.79 -4.41 121.20 122.12 2w1y s ILE 58 Ca 0.07 1.45 -0.16 0.00 0.00 0.00 0.00 60.65 62.00 2w1y s ILE 58 Cb -0.02 -3.92 -0.05 0.00 0.01 0.00 0.00 42.46 38.47 2w1y s ILE 58 CO 0.85 0.18 0.44 0.21 0.00 0.00 0.00 174.94 176.62 2w1y s ASN 59 N 0.48 6.76 0.00 3.58 3.04 -1.26 -0.60 114.94 126.94 2w1y s ASN 59 Ca 0.55 0.90 0.20 0.00 0.04 0.00 0.00 52.86 54.54 2w1y s ASN 59 Cb -0.31 -2.27 0.93 0.00 -1.54 0.00 0.00 41.25 38.06 2w1y s ASN 59 CO 0.33 0.18 1.63 -1.54 -3.04 0.00 0.00 177.10 174.66 2w1y n SER 60 N 2.64 0.00 -0.03 -4.21 3.41 -0.21 -1.71 113.62 113.50 2w1y n SER 60 Ca -0.11 0.24 -0.05 0.00 -0.26 0.00 0.00 58.87 58.69 2w1y n SER 60 Cb 0.52 -0.39 0.15 0.00 -0.26 0.00 0.00 64.21 64.23 2w1y n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2w1y h ARG 61 N 0.00 0.62 0.00 4.33 1.12 -1.83 -3.40 114.38 115.23 2w1y h ARG 61 Ca 0.00 -0.24 0.00 0.00 -1.11 0.00 0.00 59.98 58.63 2w1y h ARG 61 Cb 0.26 -0.04 0.00 0.00 -0.01 0.00 0.00 29.97 30.18 2w1y h ARG 61 CO 0.00 0.80 -0.79 0.91 -3.11 0.00 0.00 179.97 177.78 2w1y n TRP 62 N -4.12 0.00 -0.04 2.20 7.02 -1.19 -1.07 117.44 120.24 2w1y n TRP 62 Ca 0.00 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.46 2w1y n TRP 62 Cb 0.41 0.00 -0.08 0.00 -2.42 0.00 0.00 31.31 29.22 2w1y n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 2w1y n TRP 63 N -1.97 0.00 -4.11 -5.99 7.02 -0.70 -0.75 117.44 110.94 2w1y n TRP 63 Ca 0.00 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.40 2w1y n TRP 63 Cb 0.40 -0.44 -0.10 0.00 -2.42 0.00 0.00 31.31 28.74 2w1y n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2w1y s ASN 65 N -2.96 6.18 0.00 0.00 2.47 0.00 -4.53 114.94 116.10 2w1y s ASN 65 Ca 0.11 0.19 0.06 0.00 0.42 0.00 0.00 52.86 53.64 2w1y s ASN 65 Cb 0.08 -2.14 0.05 0.00 -1.45 0.00 0.00 41.25 37.78 2w1y s ASN 65 CO -0.07 -0.00 0.70 -0.90 -3.72 0.00 0.00 177.10 173.11 2w1y n ASP 66 N 4.53 1.53 0.00 -4.21 5.68 -1.26 -0.57 116.55 122.26 2w1y n ASP 66 Ca -0.13 -1.27 0.00 0.00 -0.50 0.00 0.00 54.79 52.89 2w1y n ASP 66 Cb 0.52 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 2w1y n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2w1y n GLY 67 N 0.35 0.51 0.77 6.12 0.00 -1.26 -4.81 105.19 106.87 2w1y n GLY 67 Ca 0.04 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.08 2w1y n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2w1y n ARG 68 N -1.87 0.14 -3.92 1.61 1.85 -1.26 -4.96 116.66 108.25 2w1y n ARG 68 Ca 0.00 -1.47 -0.29 0.00 -1.00 0.00 0.00 57.85 55.08 2w1y n ARG 68 Cb 0.08 -0.46 -0.13 0.00 -1.05 0.00 0.00 32.46 30.90 2w1y n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2w1y s THR 69 N -0.30 2.79 0.10 8.89 2.01 -1.26 -4.87 115.64 123.00 2w1y s THR 69 Ca 0.13 -3.77 -0.33 0.00 0.31 0.00 0.00 61.69 58.03 2w1y s THR 69 Cb 0.14 -2.88 -0.13 0.00 0.01 0.00 0.00 72.50 69.65 2w1y s THR 69 CO -0.05 -0.90 1.71 -2.65 -0.69 0.00 0.00 174.62 172.04 2w1y n PRO 70 N 2.57 2.36 -0.22 4.92 -0.02 -1.26 -2.09 135.00 141.26 2w1y n PRO 70 Ca 0.12 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 2w1y n PRO 70 Cb 0.34 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.14 2w1y n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2w1y n GLY 71 N 3.86 0.71 3.94 -1.23 0.00 -1.26 -5.03 105.19 106.18 2w1y n GLY 71 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 2w1y n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2w1y s SER 72 N -2.64 4.58 0.51 1.61 1.04 -0.89 -5.07 113.70 112.85 2w1y s SER 72 Ca 0.00 0.35 0.03 0.00 0.48 0.00 0.00 55.95 56.82 2w1y s SER 72 Cb 0.00 -0.91 0.03 0.00 0.10 0.00 0.00 66.02 65.25 2w1y s SER 72 CO 0.00 -1.75 0.28 0.54 0.98 0.00 0.00 173.24 173.29 2w1y n ARG 73 N -3.01 0.75 -3.12 4.02 5.12 -0.23 -4.99 116.66 115.20 2w1y n ARG 73 Ca 0.09 -3.34 -0.18 0.00 -1.93 0.00 0.00 57.85 52.49 2w1y n ARG 73 Cb 0.60 0.51 -0.02 0.00 -1.16 0.00 0.00 32.46 32.39 2w1y n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 2w1y n ASN 74 N -1.69 0.13 0.24 0.55 5.15 -1.11 -3.69 115.26 114.83 2w1y n ASN 74 Ca -0.07 -3.01 0.16 0.00 -0.60 0.00 0.00 54.58 51.06 2w1y n ASN 74 Cb 0.60 -0.23 0.63 0.00 -0.53 0.00 0.00 39.78 40.24 2w1y n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2w1y h LEU 75 N 3.32 0.00 -0.66 1.20 3.38 -0.95 -1.41 115.31 120.19 2w1y h LEU 75 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2w1y h LEU 75 Cb 0.96 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.71 2w1y h LEU 75 CO 0.44 0.00 -0.22 0.00 0.09 0.00 0.00 178.44 178.75 2w1y n ASN 77 N -0.39 -1.80 -3.89 0.00 3.02 -0.53 -4.97 115.26 106.69 2w1y n ASN 77 Ca 0.13 -0.80 -0.11 0.00 -0.03 0.00 0.00 54.58 53.77 2w1y n ASN 77 Cb 0.37 -4.07 -0.10 0.00 -0.61 0.00 0.00 39.78 35.36 2w1y n ASN 77 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2w1y s ILE 78 N -3.60 0.09 0.30 2.41 -4.36 -1.26 -5.07 121.20 109.70 2w1y s ILE 78 Ca 0.11 -0.75 -0.29 0.00 -0.26 0.00 0.00 60.65 59.46 2w1y s ILE 78 Cb -0.05 -0.41 -0.10 0.00 1.25 0.00 0.00 42.46 43.15 2w1y s ILE 78 CO 0.81 -0.41 1.34 -2.16 0.24 0.00 0.00 174.94 174.76 2w1y s PRO 79 N -1.43 4.34 0.50 0.37 0.04 -1.26 -0.82 135.00 136.74 2w1y s PRO 79 Ca -0.15 2.21 0.17 0.00 0.04 0.00 0.00 61.00 63.28 2w1y s PRO 79 Cb -0.08 -3.10 1.22 0.00 0.04 0.00 0.00 34.50 32.59 2w1y s PRO 79 CO 0.01 -0.25 2.06 0.00 0.04 0.00 0.00 177.00 178.87 2w1y h SER 81 N 0.13 0.14 0.17 0.00 4.64 -1.91 -0.24 113.55 116.48 2w1y h SER 81 Ca 0.14 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.46 2w1y h SER 81 Cb 0.39 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2w1y h SER 81 CO -0.02 0.07 -0.03 0.00 -0.87 0.00 0.00 176.83 175.98 2w1y h ALA 82 N 1.67 1.22 -0.00 5.18 0.00 -1.54 -1.69 119.26 124.10 2w1y h ALA 82 Ca 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2w1y h ALA 82 Cb 1.10 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2w1y h ALA 82 CO -0.05 0.03 -0.02 1.28 0.00 0.00 0.00 179.25 180.49 2w1y n LEU 83 N -3.43 0.22 -0.72 0.00 4.77 -0.10 -3.29 117.00 114.44 2w1y n LEU 83 Ca -0.02 0.03 0.08 0.00 -0.03 0.00 0.00 56.01 56.07 2w1y n LEU 83 Cb 0.13 -0.11 0.11 0.00 -2.33 0.00 0.00 43.42 41.22 2w1y n LEU 83 CO 0.25 0.04 0.56 0.18 -1.33 0.00 0.00 177.39 177.08 2w1y n LEU 84 N -0.96 2.62 -4.74 2.23 4.77 -0.63 -3.92 117.00 116.37 2w1y n LEU 84 Ca 0.19 -1.30 -0.36 0.00 -0.03 0.00 0.00 56.01 54.51 2w1y n LEU 84 Cb 0.20 -0.10 0.06 0.00 -2.33 0.00 0.00 43.42 41.25 2w1y n LEU 84 CO 0.20 0.54 0.88 -0.55 -1.33 0.00 0.00 177.39 177.13 2w1y s SER 85 N -1.23 4.76 0.46 -1.43 0.15 -1.21 -4.28 113.70 110.93 2w1y s SER 85 Ca 0.23 2.54 0.18 0.00 0.70 0.00 0.00 55.95 59.60 2w1y s SER 85 Cb 0.14 -2.61 1.10 0.00 -1.71 0.00 0.00 66.02 62.94 2w1y s SER 85 CO 0.21 -1.89 1.99 0.77 1.20 0.00 0.00 173.24 175.52 2w1y h SER 86 N 0.61 0.00 -3.31 5.45 4.64 -1.93 -3.40 113.55 115.61 2w1y h SER 86 Ca -0.51 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.23 2w1y h SER 86 Cb 1.32 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.33 2w1y h SER 86 CO 0.54 0.19 0.39 -0.62 -0.87 0.00 0.00 176.83 176.46 2w1y s ASP 87 N -6.73 6.87 0.00 4.97 -1.08 -1.26 -4.94 116.67 114.50 2w1y s ASP 87 Ca -0.03 1.07 0.15 0.00 -0.52 0.00 0.00 52.55 53.21 2w1y s ASP 87 Cb 0.15 -2.43 0.75 0.00 -1.46 0.00 0.00 42.92 39.92 2w1y s ASP 87 CO 0.67 -0.43 1.50 2.30 0.52 0.00 0.00 175.17 179.72 2w1y n ILE 88 N 4.95 0.08 -0.08 4.11 -5.35 -1.26 -4.40 119.36 117.41 2w1y n ILE 88 Ca 0.04 -0.11 -0.07 0.00 -0.27 0.00 0.00 62.75 62.34 2w1y n ILE 88 Cb 0.48 -0.05 -0.00 0.00 -1.74 0.00 0.00 39.64 38.33 2w1y n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2w1y h THR 89 N 0.64 0.55 -0.53 7.28 2.02 -1.94 -0.29 112.91 120.66 2w1y h THR 89 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2w1y h THR 89 Cb 0.14 0.55 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 2w1y h THR 89 CO 0.00 0.00 0.34 0.00 0.37 0.00 0.00 175.52 176.23 2w1y h ALA 90 N 1.15 0.67 -0.70 6.16 0.00 -1.84 -0.87 119.26 123.82 2w1y h ALA 90 Ca 0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2w1y h ALA 90 Cb 0.33 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2w1y h ALA 90 CO -0.37 0.12 0.40 0.77 0.00 0.00 0.00 179.25 180.17 2w1y h SER 91 N 0.71 0.87 -0.10 0.00 0.02 -1.70 -1.26 113.55 112.09 2w1y h SER 91 Ca 0.19 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.04 2w1y h SER 91 Cb -0.07 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.25 2w1y h SER 91 CO -0.04 0.70 -0.00 0.58 -1.14 0.00 0.00 176.83 176.92 2w1y h VAL 92 N 0.96 1.26 -0.64 2.27 2.07 -0.65 0.12 116.25 121.64 2w1y h VAL 92 Ca 0.25 -0.83 0.03 0.00 0.82 0.00 0.00 66.70 66.97 2w1y h VAL 92 Cb 0.01 1.61 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 2w1y h VAL 92 CO -0.04 0.24 0.39 0.78 0.02 0.00 0.00 177.57 178.95 2w1y h ASN 93 N -0.10 0.62 -0.40 0.57 2.35 -1.10 -0.21 115.58 117.31 2w1y h ASN 93 Ca 0.03 0.01 -0.13 0.00 -0.55 0.00 0.00 56.30 55.65 2w1y h ASN 93 Cb 0.37 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 2w1y h ASN 93 CO 0.01 0.43 -0.27 0.00 -1.65 0.00 0.00 177.43 175.95 2w1y h ALA 95 N 0.80 1.64 -0.87 0.00 0.00 -0.13 -1.09 119.26 119.61 2w1y h ALA 95 Ca 0.08 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2w1y h ALA 95 Cb 0.84 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 2w1y h ALA 95 CO 0.07 0.32 0.54 0.87 0.00 0.00 0.00 179.25 181.05 2w1y h LYS 96 N 0.59 1.17 -0.25 0.00 1.57 -0.86 -0.42 116.57 118.37 2w1y h LYS 96 Ca 0.16 -0.09 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 2w1y h LYS 96 Cb -0.02 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.04 2w1y h LYS 96 CO -0.03 0.81 -0.13 -0.22 -0.57 0.00 0.00 179.45 179.31 2w1y h LYS 97 N 1.19 0.53 -0.08 3.15 3.64 -1.08 -2.84 116.57 121.09 2w1y h LYS 97 Ca 0.31 -0.24 0.03 0.00 -1.27 0.00 0.00 60.65 59.48 2w1y h LYS 97 Cb -0.08 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.70 2w1y h LYS 97 CO -0.06 0.79 -0.08 0.82 -2.27 0.00 0.00 179.45 178.65 2w1y h ILE 98 N 0.26 0.77 0.00 2.00 2.04 -0.96 -2.41 117.51 119.21 2w1y h ILE 98 Ca 0.06 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.92 2w1y h ILE 98 Cb 0.64 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 2w1y h ILE 98 CO 0.04 0.00 0.00 0.55 0.00 0.00 0.00 178.15 178.74 2w1y n VAL 99 N -5.21 0.82 1.32 1.67 3.14 -0.19 -1.53 118.33 118.35 2w1y n VAL 99 Ca -0.04 0.19 0.13 0.00 -2.96 0.00 0.00 64.34 61.66 2w1y n VAL 99 Cb 0.14 -0.98 0.38 0.00 -1.06 0.00 0.00 33.84 32.32 2w1y n VAL 99 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2w1y n SER 100 N -1.78 1.80 0.08 6.55 7.64 -0.92 -3.75 113.62 123.25 2w1y n SER 100 Ca 0.04 -1.53 0.12 0.00 1.01 0.00 0.00 58.87 58.51 2w1y n SER 100 Cb 0.22 0.05 0.46 0.00 -1.01 0.00 0.00 64.21 63.92 2w1y n SER 100 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2w1y n ASP 101 N 0.31 0.53 0.00 6.43 2.03 -0.58 -4.89 116.55 120.38 2w1y n ASP 101 Ca 0.16 0.58 0.00 0.00 0.52 0.00 0.00 54.79 56.05 2w1y n ASP 101 Cb 0.42 -0.71 0.00 0.00 -0.72 0.00 0.00 41.12 40.10 2w1y n ASP 101 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2w1y n GLY 102 N 0.79 1.82 0.87 0.27 0.00 -1.26 -4.97 105.19 102.70 2w1y n GLY 102 Ca 0.05 -0.19 0.07 0.00 0.00 0.00 0.00 46.02 45.94 2w1y n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2w1y n ASN 103 N 0.00 3.45 0.00 1.61 3.02 -1.26 -5.06 115.26 117.02 2w1y n ASN 103 Ca 0.00 -2.28 0.00 0.00 -0.03 0.00 0.00 54.58 52.27 2w1y n ASN 103 Cb 0.00 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.81 2w1y n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2w1y n GLY 104 N 0.45 2.45 0.00 7.41 0.00 -1.25 -2.22 105.19 112.03 2w1y n GLY 104 Ca 0.16 -0.46 0.14 0.00 0.00 0.00 0.00 46.02 45.86 2w1y n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2w1y n MET 105 N 11.95 0.55 0.20 1.61 2.81 -1.26 -3.25 117.12 129.73 2w1y n MET 105 Ca 0.00 0.02 0.14 0.00 -1.81 0.00 0.00 57.70 56.04 2w1y n MET 105 Cb 0.00 -1.50 0.72 0.00 -0.71 0.00 0.00 33.22 31.73 2w1y n MET 105 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 2w1y h ASN 106 N 0.00 0.00 -0.13 7.83 2.35 -1.86 -0.76 115.58 123.02 2w1y h ASN 106 Ca 0.00 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.78 2w1y h ASN 106 Cb 0.18 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 2w1y h ASN 106 CO 0.00 0.00 0.09 0.00 -1.65 0.00 0.00 177.43 175.87 2w1y h ALA 107 N 2.01 2.08 -2.04 -0.83 0.00 -1.73 -3.35 119.26 115.40 2w1y h ALA 107 Ca 0.00 -0.00 -0.69 0.00 0.00 0.00 0.00 54.91 54.21 2w1y h ALA 107 Cb 0.02 -0.00 -0.19 0.00 0.00 0.00 0.00 17.79 17.62 2w1y h ALA 107 CO 0.00 -0.11 0.06 -1.58 0.00 0.00 0.00 179.25 177.62 2w1y s TRP 108 N -5.09 3.04 0.26 0.00 0.51 -0.29 -4.94 118.94 112.43 2w1y s TRP 108 Ca -0.05 -0.67 -0.04 0.00 -2.12 0.00 0.00 56.10 53.22 2w1y s TRP 108 Cb 0.18 -3.67 0.32 0.00 -0.81 0.00 0.00 33.47 29.49 2w1y s TRP 108 CO 0.69 -1.10 1.89 0.28 -0.51 0.00 0.00 176.95 178.19 2w1y h VAL 109 N 5.88 1.24 -0.57 4.03 2.07 -1.83 -1.14 116.25 125.91 2w1y h VAL 109 Ca -0.28 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 2w1y h VAL 109 Cb 1.09 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 2w1y h VAL 109 CO 1.00 0.26 0.33 0.00 0.02 0.00 0.00 177.57 179.19 2w1y h ALA 110 N 1.36 1.50 -0.17 1.67 0.00 -1.93 0.52 119.26 122.22 2w1y h ALA 110 Ca 0.29 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2w1y h ALA 110 Cb 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2w1y h ALA 110 CO -0.05 0.42 0.05 2.35 0.00 0.00 0.00 179.25 182.03 2w1y h TRP 111 N 0.79 0.27 -0.68 0.00 7.01 -1.55 0.15 115.95 121.94 2w1y h TRP 111 Ca 0.21 -0.03 0.02 0.00 2.11 0.00 0.00 58.89 61.20 2w1y h TRP 111 Cb -0.01 -0.08 -0.04 0.00 -2.10 0.00 0.00 29.16 26.93 2w1y h TRP 111 CO 0.00 0.37 0.44 -0.09 -2.79 0.00 0.00 178.44 176.37 2w1y h ARG 112 N 0.10 0.86 0.00 2.65 2.43 -0.51 0.81 114.38 120.72 2w1y h ARG 112 Ca 0.05 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2w1y h ARG 112 Cb 0.22 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.58 2w1y h ARG 112 CO -0.00 0.57 -0.57 -0.91 -1.51 0.00 0.00 179.97 177.54 2w1y h ASN 113 N 0.88 0.00 0.00 -3.80 2.35 -0.78 -3.36 115.58 110.87 2w1y h ASN 113 Ca 0.26 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.01 2w1y h ASN 113 Cb -0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.32 2w1y h ASN 113 CO -0.08 0.09 -0.34 0.54 -1.65 0.00 0.00 177.43 175.99 2w1y n ARG 114 N -2.92 3.24 -0.01 0.81 1.74 0.50 -4.90 116.66 115.11 2w1y n ARG 114 Ca 0.01 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.07 2w1y n ARG 114 Cb 0.58 -0.58 -0.01 0.00 -1.02 0.00 0.00 32.46 31.42 2w1y n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2w1y n LYS 116 N -2.69 1.98 0.00 0.00 4.81 0.10 -1.49 118.16 120.86 2w1y n LYS 116 Ca -0.05 0.72 0.00 0.00 -0.87 0.00 0.00 58.31 58.11 2w1y n LYS 116 Cb 0.55 -2.47 0.00 0.00 0.02 0.00 0.00 35.03 33.12 2w1y n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2w1y n GLY 117 N 3.41 2.45 3.95 3.14 0.00 -1.26 -4.96 105.19 111.91 2w1y n GLY 117 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 2w1y n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2w1y s THR 118 N -2.44 2.14 -1.24 2.61 -4.23 -0.56 -4.94 115.64 106.98 2w1y s THR 118 Ca 0.00 -0.32 -0.18 0.00 -1.18 0.00 0.00 61.69 60.01 2w1y s THR 118 Cb 0.00 -2.83 -0.00 0.00 1.34 0.00 0.00 72.50 71.01 2w1y s THR 118 CO 0.00 0.00 1.95 -0.67 -0.54 0.00 0.00 174.62 175.36 2w1y n ASP 119 N -3.14 3.91 0.27 3.99 2.03 -1.26 -4.74 116.55 117.61 2w1y n ASP 119 Ca 0.13 -2.82 0.17 0.00 0.52 0.00 0.00 54.79 52.79 2w1y n ASP 119 Cb 0.60 -1.62 0.69 0.00 -0.72 0.00 0.00 41.12 40.07 2w1y n ASP 119 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2w1y h VAL 120 N 5.03 0.00 -0.02 5.18 -1.51 -1.90 -2.60 116.25 120.42 2w1y h VAL 120 Ca 0.44 -0.49 0.01 0.00 -1.23 0.00 0.00 66.70 65.43 2w1y h VAL 120 Cb 0.78 1.47 -0.00 0.00 -2.13 0.00 0.00 31.29 31.41 2w1y h VAL 120 CO 1.63 0.00 0.02 -0.61 -1.23 0.00 0.00 177.57 177.37 2w1y h GLN 121 N 0.00 0.00 -0.97 5.19 -0.00 -1.88 -1.54 115.11 115.91 2w1y h GLN 121 Ca 0.00 0.00 0.25 0.00 -0.00 0.00 0.00 58.65 58.90 2w1y h GLN 121 Cb 0.49 0.00 -0.07 0.00 0.00 0.00 0.00 27.48 27.91 2w1y h GLN 121 CO 0.00 0.00 0.65 0.00 0.00 0.00 0.00 178.83 179.48 2w1y h ALA 122 N 1.99 2.44 0.00 3.38 0.00 -1.87 -1.10 119.26 124.10 2w1y h ALA 122 Ca 0.01 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2w1y h ALA 122 Cb 0.04 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2w1y h ALA 122 CO -0.00 -0.76 -0.02 -1.49 0.00 0.00 0.00 179.25 176.98 2w1y h TRP 123 N 0.28 0.00 -0.08 0.00 4.06 -1.49 -2.40 115.95 116.32 2w1y h TRP 123 Ca 0.51 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.46 2w1y h TRP 123 Cb 1.49 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.65 2w1y h TRP 123 CO -0.00 0.02 0.00 0.44 -3.56 0.00 0.00 178.44 175.34 2w1y n ILE 124 N -3.17 0.52 -1.68 1.49 -5.35 -0.46 -4.75 119.36 105.96 2w1y n ILE 124 Ca -0.01 -0.76 -0.45 0.00 -0.27 0.00 0.00 62.75 61.26 2w1y n ILE 124 Cb 0.19 0.79 -0.04 0.00 -1.74 0.00 0.00 39.64 38.84 2w1y n ILE 124 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 2w1y n ARG 125 N 0.09 2.34 -0.72 6.28 0.63 -0.90 -1.79 116.66 122.58 2w1y n ARG 125 Ca 0.04 0.84 0.00 0.00 -0.92 0.00 0.00 57.85 57.81 2w1y n ARG 125 Cb 0.22 -2.65 0.00 0.00 0.45 0.00 0.00 32.46 30.49 2w1y n ARG 125 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2w1y n GLY 126 N 3.70 1.44 3.78 5.14 0.00 -1.26 -5.01 105.19 112.98 2w1y n GLY 126 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 2w1y n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w1y s ARG 128 N -1.39 3.70 0.00 0.00 3.52 -1.26 -5.12 118.95 118.40 2w1y s ARG 128 Ca 0.39 0.49 0.00 0.00 -0.13 0.00 0.00 55.73 56.48 2w1y s ARG 128 Cb -0.22 -3.90 0.00 0.00 -1.56 0.00 0.00 34.95 29.27 2w1y s ARG 128 CO 0.26 -1.30 0.33 1.28 -0.81 0.00 0.00 175.30 175.06