#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wun s ASN 2 N 0.00 4.34 0.28 0.00 0.01 -1.26 -5.04 114.94 113.28 1wun s ASN 2 Ca 0.00 -0.20 0.07 0.00 -0.71 0.00 0.00 52.86 52.02 1wun s ASN 2 Cb 0.00 -1.46 -0.06 0.00 0.41 0.00 0.00 41.25 40.15 1wun s ASN 2 CO 0.00 0.23 -0.06 0.00 -1.51 0.00 0.00 177.10 175.76 1wun s ALA 3 N -0.04 2.38 -0.43 0.60 0.00 -1.26 -5.06 121.76 117.96 1wun s ALA 3 Ca -0.01 -1.91 -0.42 0.00 0.00 0.00 0.00 51.96 49.61 1wun s ALA 3 Cb -0.14 0.17 -0.17 0.00 0.00 0.00 0.00 23.12 22.99 1wun s ALA 3 CO 0.03 -0.06 1.93 0.34 0.00 0.00 0.00 175.76 178.01 1wun n PHE 4 N -0.60 1.58 -0.82 0.00 7.35 -1.26 -5.01 117.46 118.70 1wun n PHE 4 Ca -0.05 0.72 0.00 0.00 -0.76 0.00 0.00 57.45 57.36 1wun n PHE 4 Cb 0.63 -2.35 0.00 0.00 0.35 0.00 0.00 39.48 38.11 1wun n PHE 4 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 1wun n LEU 5 N 6.63 -3.90 0.00 -2.13 4.77 -1.26 -5.17 117.00 115.94 1wun n LEU 5 Ca 0.41 1.40 0.00 0.00 -0.03 0.00 0.00 56.01 57.79 1wun n LEU 5 Cb 0.04 -0.84 0.00 0.00 -2.33 0.00 0.00 43.42 40.29 1wun n LEU 5 CO 0.85 -0.30 0.00 0.18 -1.33 0.00 0.00 177.39 176.79 1wun n LEU 8 N -0.02 0.00 -4.82 2.23 4.32 -1.26 -5.13 117.00 112.32 1wun n LEU 8 Ca 0.00 0.00 -0.34 0.00 -0.02 0.00 0.00 56.01 55.65 1wun n LEU 8 Cb 0.00 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 41.74 1wun n LEU 8 CO 0.00 0.00 0.53 -0.13 -1.22 0.00 0.00 177.39 176.57 1wun s ARG 9 N -0.08 4.21 0.91 3.23 0.52 -1.26 -5.04 118.95 121.44 1wun s ARG 9 Ca 0.00 0.96 -0.11 0.00 -0.52 0.00 0.00 55.73 56.06 1wun s ARG 9 Cb 0.00 -2.46 0.12 0.00 0.52 0.00 0.00 34.95 33.12 1wun s ARG 9 CO 0.00 0.14 1.01 -2.30 0.02 0.00 0.00 175.30 174.18 1wun n PRO 10 N -0.16 -0.34 -1.99 3.54 -0.02 -1.26 -4.91 135.00 129.86 1wun n PRO 10 Ca 0.04 -0.03 -0.38 0.00 -2.02 0.00 0.00 63.50 61.11 1wun n PRO 10 Cb 0.53 -2.29 0.02 0.00 -0.02 0.00 0.00 33.50 31.74 1wun n PRO 10 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1wun s GLY 11 N -2.44 2.83 -0.09 -1.23 0.00 -1.26 -5.03 107.32 100.10 1wun s GLY 11 Ca 0.66 1.15 -0.03 0.00 0.00 0.00 0.00 44.72 46.50 1wun s GLY 11 CO 0.59 1.64 0.16 -0.45 0.00 0.00 0.00 173.10 175.03 1wun s SER 12 N -1.17 0.85 0.00 1.64 0.15 -1.26 -4.96 113.70 108.95 1wun s SER 12 Ca 0.69 0.26 0.00 0.00 0.70 0.00 0.00 55.95 57.60 1wun s SER 12 Cb -0.35 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.21 1wun s SER 12 CO 0.41 -0.25 0.03 -0.11 1.20 0.00 0.00 173.24 174.52 1wun n LEU 13 N 5.32 0.06 0.00 3.45 7.94 -1.26 -4.10 117.00 128.41 1wun n LEU 13 Ca -0.05 -0.03 0.00 0.00 -1.11 0.00 0.00 56.01 54.83 1wun n LEU 13 Cb 0.50 -0.03 0.00 0.00 0.53 0.00 0.00 43.42 44.42 1wun n LEU 13 CO 0.05 0.01 0.00 -1.14 -1.11 0.00 0.00 177.39 175.20 1wun n ARG 15 N 0.38 0.00 0.01 1.96 0.63 -1.26 -1.89 116.66 116.49 1wun n ARG 15 Ca 0.00 0.00 0.06 0.00 -0.92 0.00 0.00 57.85 56.99 1wun n ARG 15 Cb 0.01 0.00 0.10 0.00 0.45 0.00 0.00 32.46 33.02 1wun n ARG 15 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1wun n LYS 18 N -1.75 1.91 -4.09 0.00 4.01 -0.79 -4.60 118.16 112.85 1wun n LYS 18 Ca 0.05 -1.82 -0.35 0.00 -0.51 0.00 0.00 58.31 55.69 1wun n LYS 18 Cb 0.53 -1.71 -0.12 0.00 -0.51 0.00 0.00 35.03 33.22 1wun n LYS 18 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 1wun s GLN 21 N -2.10 3.70 -0.09 1.97 -0.21 -1.26 -5.23 119.66 116.43 1wun s GLN 21 Ca 0.36 -0.48 -0.01 0.00 0.02 0.00 0.00 55.36 55.25 1wun s GLN 21 Cb 0.28 -3.10 -0.03 0.00 1.00 0.00 0.00 33.01 31.16 1wun s GLN 21 CO 0.00 0.08 -0.05 0.00 -2.12 0.00 0.00 175.29 173.21 1wun s SER 23 N -0.59 2.26 -0.84 0.00 1.04 -1.26 -4.79 113.70 109.52 1wun s SER 23 Ca 0.09 0.78 -0.27 0.00 0.48 0.00 0.00 55.95 57.03 1wun s SER 23 Cb -0.12 -1.18 -0.25 0.00 0.10 0.00 0.00 66.02 64.57 1wun s SER 23 CO 0.02 -3.31 1.97 0.33 0.98 0.00 0.00 173.24 173.23 1wun n PHE 24 N -4.24 0.93 0.00 5.02 7.35 -1.26 -4.64 117.46 120.62 1wun n PHE 24 Ca 0.10 -0.44 0.00 0.00 -0.76 0.00 0.00 57.45 56.35 1wun n PHE 24 Cb 0.59 -2.15 0.00 0.00 0.35 0.00 0.00 39.48 38.27 1wun n PHE 24 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1wun n ALA 27 N 16.47 0.00 0.05 3.13 0.00 -1.26 -5.02 120.51 133.89 1wun n ALA 27 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1wun n ALA 27 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1wun n ALA 27 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1wun n ARG 28 N 0.00 0.10 0.00 0.00 0.00 -1.26 -1.55 116.66 113.96 1wun n ARG 28 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1wun n ARG 28 Cb 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 32.46 31.01 1wun n ARG 28 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 1wun n ILE 30 N 1.28 0.00 0.25 5.15 5.41 -1.26 0.44 119.36 130.63 1wun n ILE 30 Ca 0.00 0.00 0.12 0.00 1.00 0.00 0.00 62.75 63.87 1wun n ILE 30 Cb 0.05 0.00 0.15 0.00 -0.71 0.00 0.00 39.64 39.13 1wun n ILE 30 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 1wun h PHE 31 N 0.00 0.00 0.00 1.39 0.04 -1.69 -3.48 116.94 113.20 1wun h PHE 31 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1wun h PHE 31 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1wun h PHE 31 CO 0.00 0.00 0.00 1.63 -0.60 0.00 0.00 178.31 179.34 1wun n LYS 32 N -2.85 0.00 -1.49 1.51 5.02 0.17 -4.76 118.16 115.76 1wun n LYS 32 Ca 0.03 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.94 1wun n LYS 32 Cb 0.52 0.00 0.04 0.00 -0.02 0.00 0.00 35.03 35.57 1wun n LYS 32 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1wun n ASP 33 N 1.43 -0.66 -0.16 4.39 2.03 -1.26 -4.87 116.55 117.44 1wun n ASP 33 Ca 0.00 0.78 0.00 0.00 0.52 0.00 0.00 54.79 56.09 1wun n ASP 33 Cb 0.00 -1.21 0.00 0.00 -0.72 0.00 0.00 41.12 39.19 1wun n ASP 33 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1wun n ALA 34 N -1.57 1.87 0.00 -1.67 0.00 -1.26 -2.22 120.51 115.65 1wun n ALA 34 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1wun n ALA 34 Cb 0.46 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.91 1wun n ALA 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1wun n ARG 36 N -0.25 0.00 -0.36 0.00 1.74 -1.26 -1.42 116.66 115.11 1wun n ARG 36 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1wun n ARG 36 Cb 0.04 0.00 0.14 0.00 -1.02 0.00 0.00 32.46 31.62 1wun n ARG 36 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1wun h THR 37 N 0.00 1.14 -0.42 0.55 2.02 -1.74 -1.68 112.91 112.78 1wun h THR 37 Ca 0.00 -0.41 -0.11 0.00 0.77 0.00 0.00 66.41 66.66 1wun h THR 37 Cb 0.00 -0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.24 1wun h THR 37 CO 0.00 0.22 -0.16 0.11 0.37 0.00 0.00 175.52 176.06 1wun h LYS 38 N 1.20 0.85 -0.42 6.66 1.57 -1.51 0.73 116.57 125.65 1wun h LYS 38 Ca 0.39 -0.35 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1wun h LYS 38 Cb 0.05 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1wun h LYS 38 CO -0.14 0.99 0.26 1.25 -0.57 0.00 0.00 179.45 181.24 1wun h LEU 39 N 0.67 0.49 0.11 2.94 5.85 -1.68 -1.95 115.31 121.74 1wun h LEU 39 Ca 0.10 -0.02 -0.17 0.00 0.84 0.00 0.00 57.88 58.62 1wun h LEU 39 Cb 0.71 -0.12 0.02 0.00 0.37 0.00 0.00 40.66 41.64 1wun h LEU 39 CO 0.05 0.38 -0.75 0.15 -0.34 0.00 0.00 178.44 177.93 1wun h PHE 40 N 0.58 0.55 -0.23 1.25 3.57 -1.11 -3.36 116.94 118.18 1wun h PHE 40 Ca 0.15 -0.38 -0.06 0.00 3.53 0.00 0.00 57.97 61.22 1wun h PHE 40 Cb -0.03 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 1wun h PHE 40 CO 0.00 1.27 -0.11 2.35 -2.23 0.00 0.00 178.31 179.59 1wun h TRP 41 N -0.33 0.38 -0.73 0.41 2.91 -0.58 -2.23 115.95 115.80 1wun h TRP 41 Ca -0.12 -0.05 0.09 0.00 1.13 0.00 0.00 58.89 59.94 1wun h TRP 41 Cb 1.56 -0.11 -0.07 0.00 -0.51 0.00 0.00 29.16 30.03 1wun h TRP 41 CO 0.19 0.47 0.38 -0.84 -1.03 0.00 0.00 178.44 177.61 1wun h ILE 42 N 0.34 0.87 0.12 2.65 3.07 -1.51 -1.53 117.51 121.52 1wun h ILE 42 Ca 0.07 -0.22 -0.24 0.00 1.55 0.00 0.00 64.86 66.01 1wun h ILE 42 Cb 0.41 0.17 0.00 0.00 -0.27 0.00 0.00 36.82 37.13 1wun h ILE 42 CO 0.02 0.12 -1.21 0.28 -1.05 0.00 0.00 178.15 176.31 1wun h SER 43 N 0.64 0.39 -0.84 2.16 0.02 -1.74 -3.11 113.55 111.07 1wun h SER 43 Ca 0.36 -0.87 0.09 0.00 -0.84 0.00 0.00 61.79 60.52 1wun h SER 43 Cb 0.35 -0.13 -0.07 0.00 0.14 0.00 0.00 62.40 62.69 1wun h SER 43 CO -0.26 1.54 0.49 0.22 -1.14 0.00 0.00 176.83 177.69 1wun h TYR 44 N -0.35 0.90 -0.37 3.45 3.20 -1.32 -2.70 116.97 119.78 1wun h TYR 44 Ca -0.25 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.65 1wun h TYR 44 Cb 1.70 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.70 1wun h TYR 44 CO 0.15 0.38 0.00 -1.13 -1.64 0.00 0.00 178.16 175.91 1wun n SER 45 N -4.72 3.23 -0.07 -2.11 3.41 -0.58 -4.47 113.62 108.31 1wun n SER 45 Ca 0.14 -1.96 -0.04 0.00 -0.26 0.00 0.00 58.87 56.75 1wun n SER 45 Cb 0.27 -0.24 0.17 0.00 -0.26 0.00 0.00 64.21 64.16 1wun n SER 45 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1wun h ASP 46 N 4.17 0.68 -3.03 4.04 3.58 -1.40 -3.49 116.42 120.98 1wun h ASP 46 Ca 0.00 -0.18 0.00 0.00 0.42 0.00 0.00 57.03 57.27 1wun h ASP 46 Cb 0.92 -0.18 0.00 0.00 1.72 0.00 0.00 39.33 41.79 1wun h ASP 46 CO 0.00 0.80 0.00 0.61 -2.88 0.00 0.00 179.24 177.77 1wun n GLY 47 N -0.57 -1.92 3.57 -0.78 0.00 -1.26 -4.72 105.19 99.51 1wun n GLY 47 Ca 0.02 -1.17 -0.41 0.00 0.00 0.00 0.00 46.02 44.46 1wun n GLY 47 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1wun s ASP 48 N -1.12 6.03 0.00 1.61 2.15 -1.26 -4.75 116.67 119.33 1wun s ASP 48 Ca 0.00 0.22 0.08 0.00 0.43 0.00 0.00 52.55 53.28 1wun s ASP 48 Cb 0.00 -2.55 0.37 0.00 -0.30 0.00 0.00 42.92 40.45 1wun s ASP 48 CO 0.00 -1.80 1.24 0.00 -0.17 0.00 0.00 175.17 174.43 1wun n GLN 49 N 8.81 0.03 0.00 4.34 3.00 -1.26 -1.69 117.38 130.61 1wun n GLN 49 Ca 0.12 0.32 0.14 0.00 -0.01 0.00 0.00 57.00 57.58 1wun n GLN 49 Cb 0.49 -1.50 0.62 0.00 0.00 0.00 0.00 30.24 29.85 1wun n GLN 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1wun h ALA 51 N 3.82 1.94 0.00 0.00 0.00 -1.74 -1.20 119.26 122.09 1wun h ALA 51 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1wun h ALA 51 Cb 0.35 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1wun h ALA 51 CO 0.00 0.05 0.00 0.43 0.00 0.00 0.00 179.25 179.73 1wun n SER 52 N -4.52 0.57 -3.38 0.00 7.64 -1.26 -4.90 113.62 107.77 1wun n SER 52 Ca -0.01 0.61 -0.17 0.00 1.01 0.00 0.00 58.87 60.32 1wun n SER 52 Cb 0.10 -0.74 0.08 0.00 -1.01 0.00 0.00 64.21 62.64 1wun n SER 52 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1wun n SER 53 N -2.10 -3.46 0.24 6.43 7.64 -0.45 -4.91 113.62 117.01 1wun n SER 53 Ca 0.03 -0.66 0.12 0.00 1.01 0.00 0.00 58.87 59.38 1wun n SER 53 Cb 0.27 -5.12 0.54 0.00 -1.01 0.00 0.00 64.21 58.88 1wun n SER 53 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1wun h PRO 54 N -1.65 0.00 -6.51 1.43 0.13 -1.87 -3.43 132.00 120.10 1wun h PRO 54 Ca -0.60 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 63.98 1wun h PRO 54 Cb 1.33 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.40 1wun h PRO 54 CO 0.48 0.15 1.05 0.00 -0.23 0.00 0.00 178.00 179.45 1wun s GLN 56 N 5.16 1.48 -1.49 0.00 -0.21 -0.21 -4.01 119.66 120.38 1wun s GLN 56 Ca 0.52 0.16 -0.05 0.00 0.02 0.00 0.00 55.36 56.01 1wun s GLN 56 Cb -0.10 -1.89 0.04 0.00 1.00 0.00 0.00 33.01 32.06 1wun s GLN 56 CO 0.27 -1.94 0.47 0.09 -2.12 0.00 0.00 175.29 172.07 1wun n ASN 57 N -3.56 -0.95 -0.80 5.90 3.02 -1.26 -1.88 115.26 115.73 1wun n ASN 57 Ca 0.08 -1.03 -0.10 0.00 -0.03 0.00 0.00 54.58 53.50 1wun n ASN 57 Cb 0.60 -2.86 -0.03 0.00 -0.61 0.00 0.00 39.78 36.88 1wun n ASN 57 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1wun n GLY 58 N -1.90 0.91 3.91 7.41 0.00 -1.26 -4.63 105.19 109.63 1wun n GLY 58 Ca -0.22 -0.58 -0.29 0.00 0.00 0.00 0.00 46.02 44.93 1wun n GLY 58 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1wun s GLY 59 N -2.84 1.66 -0.11 -0.02 0.00 -0.79 -4.66 107.32 100.56 1wun s GLY 59 Ca 0.00 -0.85 0.03 0.00 0.00 0.00 0.00 44.72 43.90 1wun s GLY 59 CO 0.00 -0.28 -0.23 -0.56 0.00 0.00 0.00 173.10 172.04 1wun s SER 60 N -4.68 3.15 -0.05 1.64 0.01 0.57 -4.85 113.70 109.48 1wun s SER 60 Ca 0.66 -0.56 -0.20 0.00 1.31 0.00 0.00 55.95 57.16 1wun s SER 60 Cb -0.09 -1.43 -0.05 0.00 0.21 0.00 0.00 66.02 64.67 1wun s SER 60 CO 0.50 0.14 0.55 0.00 0.41 0.00 0.00 173.24 174.84 1wun s LYS 62 N 0.17 2.42 0.44 0.00 2.36 0.23 -4.96 119.74 120.39 1wun s LYS 62 Ca 0.30 -1.07 -0.24 0.00 -2.55 0.00 0.00 55.97 52.41 1wun s LYS 62 Cb -0.17 -2.68 -0.08 0.00 -1.05 0.00 0.00 37.83 33.85 1wun s LYS 62 CO 0.15 -0.43 1.19 0.34 1.55 0.00 0.00 175.35 178.15 1wun s ASP 63 N 1.23 6.26 0.21 1.43 2.15 -1.26 -1.15 116.67 125.54 1wun s ASP 63 Ca -0.03 2.37 -0.04 0.00 0.43 0.00 0.00 52.55 55.28 1wun s ASP 63 Cb -0.17 -2.61 -0.03 0.00 -0.30 0.00 0.00 42.92 39.81 1wun s ASP 63 CO -0.08 -0.86 0.23 -1.10 -0.17 0.00 0.00 175.17 173.18 1wun s GLN 64 N -2.53 1.30 -0.32 4.34 -1.52 -0.17 -4.91 119.66 115.86 1wun s GLN 64 Ca 0.61 -1.52 -0.28 0.00 -1.95 0.00 0.00 55.36 52.22 1wun s GLN 64 Cb -0.31 0.33 -0.04 0.00 -0.22 0.00 0.00 33.01 32.77 1wun s GLN 64 CO 0.38 -0.46 2.09 -0.51 -0.25 0.00 0.00 175.29 176.53 1wun s LEU 65 N -3.12 3.44 -1.35 2.90 1.43 -1.26 -2.60 118.68 118.12 1wun s LEU 65 Ca 0.34 1.48 -0.09 0.00 -1.03 0.00 0.00 54.13 54.84 1wun s LEU 65 Cb 0.05 -3.31 0.01 0.00 0.03 0.00 0.00 46.19 42.97 1wun s LEU 65 CO 0.11 -2.04 1.18 0.00 0.23 0.00 0.00 176.35 175.84 1wun n GLN 66 N 8.72 -7.94 0.00 1.70 1.13 -1.26 -4.94 117.38 114.79 1wun n GLN 66 Ca 0.28 0.83 0.00 0.00 -1.94 0.00 0.00 57.00 56.17 1wun n GLN 66 Cb 0.47 -5.88 0.00 0.00 0.11 0.00 0.00 30.24 24.94 1wun n GLN 66 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 1wun n SER 67 N -3.01 0.00 -3.64 1.08 3.41 -1.07 -5.10 113.62 105.29 1wun n SER 67 Ca -0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 1wun n SER 67 Cb 0.56 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.44 1wun n SER 67 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1wun s TYR 68 N -2.00 1.29 -0.04 7.33 1.13 -1.26 -0.99 117.35 122.80 1wun s TYR 68 Ca 0.00 -1.41 -0.01 0.00 -1.41 0.00 0.00 57.07 54.24 1wun s TYR 68 Cb 0.00 -0.44 0.03 0.00 -1.10 0.00 0.00 41.96 40.46 1wun s TYR 68 CO 0.00 -0.88 0.08 0.42 -2.51 0.00 0.00 175.55 172.66 1wun s ILE 69 N -3.61 -0.09 -0.21 -3.49 1.01 -0.30 -4.91 121.20 109.61 1wun s ILE 69 Ca 0.36 0.27 -0.10 0.00 0.00 0.00 0.00 60.65 61.18 1wun s ILE 69 Cb 0.03 -0.16 -0.05 0.00 0.01 0.00 0.00 42.46 42.29 1wun s ILE 69 CO 0.20 0.11 0.15 0.00 0.00 0.00 0.00 174.94 175.40 1wun s PHE 71 N 0.52 3.25 0.31 0.00 0.40 0.01 -4.93 117.98 117.54 1wun s PHE 71 Ca 0.09 0.07 0.07 0.00 -0.60 0.00 0.00 56.93 56.55 1wun s PHE 71 Cb -0.12 -2.22 -0.02 0.00 0.51 0.00 0.00 43.02 41.17 1wun s PHE 71 CO -0.00 0.01 0.34 0.00 0.70 0.00 0.00 175.22 176.26 1wun s LEU 73 N -4.02 3.96 0.18 0.00 1.43 -1.26 -4.90 118.68 114.07 1wun s LEU 73 Ca 0.40 1.93 -0.07 0.00 -1.03 0.00 0.00 54.13 55.35 1wun s LEU 73 Cb -0.08 -4.44 0.28 0.00 0.03 0.00 0.00 46.19 41.99 1wun s LEU 73 CO 0.28 -0.62 1.06 -2.65 0.23 0.00 0.00 176.35 174.65 1wun n PRO 74 N -0.62 -0.08 0.00 1.29 -0.02 -1.26 0.21 135.00 134.51 1wun n PRO 74 Ca 0.08 1.06 0.00 0.00 -2.02 0.00 0.00 63.50 62.61 1wun n PRO 74 Cb 0.52 -1.58 0.00 0.00 -0.02 0.00 0.00 33.50 32.42 1wun n PRO 74 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1wun n ALA 75 N -3.72 2.37 -2.23 3.55 0.00 -1.26 -4.84 120.51 114.38 1wun n ALA 75 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.41 1wun n ALA 75 Cb 0.32 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.67 1wun n ALA 75 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1wun s PHE 76 N -1.66 1.17 0.35 0.00 0.08 0.13 -2.35 117.98 115.71 1wun s PHE 76 Ca 0.00 -0.91 -0.16 0.00 0.12 0.00 0.00 56.93 55.98 1wun s PHE 76 Cb 0.00 -0.65 0.06 0.00 -0.57 0.00 0.00 43.02 41.86 1wun s PHE 76 CO 0.00 -0.10 0.85 -0.85 -0.10 0.00 0.00 175.22 175.02 1wun n GLU 77 N -0.19 1.03 0.00 0.44 0.28 -1.08 -4.62 120.64 116.50 1wun n GLU 77 Ca -0.09 -2.06 0.00 0.00 -0.16 0.00 0.00 57.16 54.85 1wun n GLU 77 Cb 0.62 2.60 0.00 0.00 1.43 0.00 0.00 31.44 36.09 1wun n GLU 77 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1wun n GLY 78 N -0.58 2.63 0.29 -1.84 0.00 -1.26 -1.45 105.19 102.98 1wun n GLY 78 Ca -0.07 -1.88 0.10 0.00 0.00 0.00 0.00 46.02 44.17 1wun n GLY 78 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1wun h ARG 79 N 0.00 0.24 -0.19 1.61 2.43 -2.01 -0.67 114.38 115.79 1wun h ARG 79 Ca 0.00 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.05 1wun h ARG 79 Cb 0.00 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.43 1wun h ARG 79 CO 0.00 0.16 -0.30 0.09 -1.51 0.00 0.00 179.97 178.41 1wun n ASN 80 N -5.19 2.14 -3.16 -3.80 4.13 -1.26 -4.24 115.26 103.89 1wun n ASN 80 Ca 0.18 -3.85 -0.22 0.00 1.68 0.00 0.00 54.58 52.37 1wun n ASN 80 Cb 0.59 -0.58 0.01 0.00 -1.54 0.00 0.00 39.78 38.25 1wun n ASN 80 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1wun h GLU 82 N -0.98 0.00 -6.06 0.00 9.09 -1.74 -3.40 114.58 111.49 1wun h GLU 82 Ca -0.44 0.00 -0.57 0.00 0.05 0.00 0.00 59.36 58.40 1wun h GLU 82 Cb 1.30 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 28.35 1wun h GLU 82 CO 0.52 0.00 0.39 0.99 0.05 0.00 0.00 179.01 180.96 1wun s THR 83 N -3.16 4.88 -0.53 -1.06 2.01 -0.53 -4.98 115.64 112.27 1wun s THR 83 Ca 0.07 1.73 -0.22 0.00 0.31 0.00 0.00 61.69 63.59 1wun s THR 83 Cb 0.13 -4.18 0.05 0.00 0.01 0.00 0.00 72.50 68.51 1wun s THR 83 CO 0.69 0.06 0.79 -1.00 -0.69 0.00 0.00 174.62 174.47 1wun s HIS 84 N 1.85 2.92 0.57 4.92 3.76 -1.26 -2.63 115.29 125.42 1wun s HIS 84 Ca 0.41 -0.27 0.26 0.00 -0.15 0.00 0.00 55.06 55.32 1wun s HIS 84 Cb -0.17 -3.81 1.63 0.00 1.11 0.00 0.00 32.58 31.33 1wun s HIS 84 CO 0.15 -1.20 2.17 0.87 -0.85 0.00 0.00 174.74 175.88 1wun h LYS 85 N 9.16 0.00 -0.01 1.40 1.57 -1.83 -0.19 116.57 126.66 1wun h LYS 85 Ca -0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1wun h LYS 85 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.39 1wun h LYS 85 CO 1.03 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 179.66 1wun n ASP 86 N -4.01 0.43 -1.23 0.86 8.00 -1.26 -3.59 116.55 115.75 1wun n ASP 86 Ca -0.01 -1.22 -0.06 0.00 0.71 0.00 0.00 54.79 54.21 1wun n ASP 86 Cb 0.20 -0.01 0.18 0.00 -0.02 0.00 0.00 41.12 41.47 1wun n ASP 86 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1wun n ASP 87 N -0.62 2.74 -0.16 -2.24 10.43 -0.08 -4.56 116.55 122.06 1wun n ASP 87 Ca 0.21 -3.81 0.09 0.00 2.57 0.00 0.00 54.79 53.85 1wun n ASP 87 Cb 0.17 -0.62 0.15 0.00 1.84 0.00 0.00 41.12 42.66 1wun n ASP 87 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1wun n GLN 88 N -1.09 1.38 -1.16 -1.24 1.13 -1.24 -4.90 117.38 110.26 1wun n GLN 88 Ca 0.34 -2.67 -0.35 0.00 -1.94 0.00 0.00 57.00 52.39 1wun n GLN 88 Cb 0.99 -1.53 -0.03 0.00 0.11 0.00 0.00 30.24 29.79 1wun n GLN 88 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 1wun n LEU 89 N -1.37 6.10 -4.52 1.08 7.94 -1.26 -4.73 117.00 120.24 1wun n LEU 89 Ca 0.17 -3.50 -0.24 0.00 -1.11 0.00 0.00 56.01 51.32 1wun n LEU 89 Cb 0.66 -1.32 -0.09 0.00 0.53 0.00 0.00 43.42 43.19 1wun n LEU 89 CO 0.01 0.87 -0.44 0.27 -1.11 0.00 0.00 177.39 176.99 1wun s ILE 90 N 3.40 2.77 0.33 1.96 -4.36 -1.26 -4.38 121.20 119.66 1wun s ILE 90 Ca 0.52 -2.18 0.02 0.00 -0.26 0.00 0.00 60.65 58.75 1wun s ILE 90 Cb 0.14 -2.44 0.27 0.00 1.25 0.00 0.00 42.46 41.68 1wun s ILE 90 CO -0.02 -0.34 1.98 0.00 0.24 0.00 0.00 174.94 176.81 1wun n VAL 92 N -4.44 0.84 -3.14 0.00 0.24 -1.26 -2.42 118.33 108.14 1wun n VAL 92 Ca 0.09 0.22 -0.45 0.00 -2.04 0.00 0.00 64.34 62.16 1wun n VAL 92 Cb 0.09 -1.14 -0.03 0.00 -1.47 0.00 0.00 33.84 31.28 1wun n VAL 92 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1wun s ASN 93 N -4.16 6.48 -1.42 -1.34 2.47 -0.76 -4.42 114.94 111.79 1wun s ASN 93 Ca 0.04 -2.00 -0.10 0.00 0.42 0.00 0.00 52.86 51.22 1wun s ASN 93 Cb 0.09 -2.29 0.04 0.00 -1.45 0.00 0.00 41.25 37.64 1wun s ASN 93 CO 0.39 -0.92 1.06 -0.62 -3.72 0.00 0.00 177.10 173.29 1wun n GLU 94 N 5.60 -6.71 -2.02 0.43 -0.58 -1.26 -1.04 120.64 115.05 1wun n GLU 94 Ca 0.06 0.72 -0.15 0.00 -0.42 0.00 0.00 57.16 57.38 1wun n GLU 94 Cb 0.45 -5.68 -0.03 0.00 -0.57 0.00 0.00 31.44 25.62 1wun n GLU 94 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1wun n ASN 95 N -2.95 -4.27 -1.62 1.62 5.15 -1.01 -1.30 115.26 110.88 1wun n ASN 95 Ca -0.01 0.23 -0.20 0.00 -0.60 0.00 0.00 54.58 53.99 1wun n ASN 95 Cb 0.56 -3.72 -0.08 0.00 -0.53 0.00 0.00 39.78 36.01 1wun n ASN 95 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1wun n GLY 96 N -0.63 1.73 3.04 8.20 0.00 -0.21 -1.72 105.19 115.61 1wun n GLY 96 Ca -0.17 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.82 1wun n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wun n GLY 97 N -0.53 1.87 3.77 -0.02 0.00 -0.42 -4.91 105.19 104.95 1wun n GLY 97 Ca -0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.42 1wun n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wun h GLU 99 N 3.31 0.49 0.00 0.00 4.81 -1.04 -3.45 114.58 118.70 1wun h GLU 99 Ca -0.48 -0.34 0.00 0.00 -0.13 0.00 0.00 59.36 58.41 1wun h GLU 99 Cb 1.22 0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.65 1wun h GLU 99 CO 0.65 0.95 0.00 1.04 -0.73 0.00 0.00 179.01 180.92 1wun n GLN 100 N -3.91 0.00 -3.65 1.92 6.02 -1.26 -5.00 117.38 111.49 1wun n GLN 100 Ca -0.04 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.62 1wun n GLN 100 Cb 0.64 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.85 1wun n GLN 100 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1wun s TYR 101 N 0.14 3.52 -0.05 1.08 2.02 -0.68 -4.95 117.35 118.43 1wun s TYR 101 Ca 0.00 0.63 0.04 0.00 -0.37 0.00 0.00 57.07 57.37 1wun s TYR 101 Cb 0.00 -2.05 0.00 0.00 -0.40 0.00 0.00 41.96 39.51 1wun s TYR 101 CO 0.00 0.48 -0.16 0.00 -1.57 0.00 0.00 175.55 174.31 1wun s SER 103 N 0.18 2.33 0.71 0.00 0.01 -0.25 -5.00 113.70 111.68 1wun s SER 103 Ca -0.06 -0.38 -0.11 0.00 1.31 0.00 0.00 55.95 56.71 1wun s SER 103 Cb -0.12 -0.99 0.01 0.00 0.21 0.00 0.00 66.02 65.13 1wun s SER 103 CO 0.02 -0.05 1.07 -1.81 0.41 0.00 0.00 173.24 172.88 1wun s ASP 104 N 1.36 5.33 -0.30 2.44 1.01 -1.26 -1.02 116.67 124.23 1wun s ASP 104 Ca 0.00 1.45 0.03 0.00 0.71 0.00 0.00 52.55 54.74 1wun s ASP 104 Cb -0.14 -2.32 0.16 0.00 1.01 0.00 0.00 42.92 41.64 1wun s ASP 104 CO -0.06 -1.45 0.43 -1.00 0.21 0.00 0.00 175.17 173.30 1wun s HIS 105 N -3.13 -1.08 0.16 4.23 3.76 -1.26 -4.83 115.29 113.14 1wun s HIS 105 Ca 0.58 0.32 -0.32 0.00 -0.15 0.00 0.00 55.06 55.49 1wun s HIS 105 Cb -0.13 -0.11 -0.12 0.00 1.11 0.00 0.00 32.58 33.33 1wun s HIS 105 CO 0.54 -1.00 1.73 0.25 -0.85 0.00 0.00 174.74 175.40 1wun n THR 106 N 5.26 0.12 0.00 1.30 -2.24 -1.26 -1.99 114.28 115.47 1wun n THR 106 Ca 0.02 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1wun n THR 106 Cb 0.50 -1.90 0.00 0.00 -2.10 0.00 0.00 70.33 66.82 1wun n THR 106 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1wun n GLY 107 N 3.92 3.05 0.00 3.38 0.00 -1.26 -4.96 105.19 109.32 1wun n GLY 107 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1wun n GLY 107 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1wun n THR 108 N -0.40 0.00 -4.37 2.61 -2.24 -0.84 -5.16 114.28 103.88 1wun n THR 108 Ca 0.00 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.53 1wun n THR 108 Cb 0.00 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.11 1wun n THR 108 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1wun s LYS 109 N 4.94 1.38 0.70 -0.78 -2.85 -1.26 -4.86 119.74 117.01 1wun s LYS 109 Ca 0.00 -1.42 -0.16 0.00 -1.00 0.00 0.00 55.97 53.40 1wun s LYS 109 Cb 0.00 -1.64 0.02 0.00 -2.06 0.00 0.00 37.83 34.15 1wun s LYS 109 CO 0.00 0.36 1.19 -0.98 0.10 0.00 0.00 175.35 176.02 1wun s ARG 110 N -2.52 2.40 0.13 1.78 1.04 -1.26 -4.47 118.95 116.05 1wun s ARG 110 Ca 0.16 1.70 0.10 0.00 -1.04 0.00 0.00 55.73 56.66 1wun s ARG 110 Cb -0.08 -1.87 -0.04 0.00 -2.04 0.00 0.00 34.95 30.92 1wun s ARG 110 CO 0.08 -1.62 -0.24 -1.54 -0.04 0.00 0.00 175.30 171.93 1wun s SER 111 N -2.07 3.52 0.14 -2.89 1.04 -0.19 -4.97 113.70 108.28 1wun s SER 111 Ca 0.73 -0.70 0.04 0.00 0.48 0.00 0.00 55.95 56.50 1wun s SER 111 Cb -0.28 -0.33 -0.04 0.00 0.10 0.00 0.00 66.02 65.48 1wun s SER 111 CO 0.43 0.17 0.16 0.00 0.98 0.00 0.00 173.24 174.98 1wun s ARG 113 N -2.97 1.58 0.10 0.00 0.52 0.10 -4.96 118.95 113.32 1wun s ARG 113 Ca 0.32 -1.90 0.02 0.00 -0.52 0.00 0.00 55.73 53.65 1wun s ARG 113 Cb -0.11 0.28 -0.04 0.00 0.52 0.00 0.00 34.95 35.61 1wun s ARG 113 CO 0.24 -0.56 -0.07 0.00 0.02 0.00 0.00 175.30 174.93 1wun s HIS 115 N -3.43 3.26 0.39 0.00 2.46 -1.26 -4.92 115.29 111.79 1wun s HIS 115 Ca 0.12 1.43 -0.25 0.00 0.47 0.00 0.00 55.06 56.82 1wun s HIS 115 Cb 0.04 -2.86 -0.11 0.00 -0.13 0.00 0.00 32.58 29.51 1wun s HIS 115 CO -0.03 -0.90 1.04 -1.91 -2.47 0.00 0.00 174.74 170.46 1wun n GLU 116 N -2.44 1.44 -0.43 2.88 2.13 -1.26 -1.62 120.64 121.34 1wun n GLU 116 Ca 0.07 0.51 0.00 0.00 0.66 0.00 0.00 57.16 58.40 1wun n GLU 116 Cb 0.54 -2.04 0.00 0.00 0.27 0.00 0.00 31.44 30.21 1wun n GLU 116 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1wun n GLY 117 N 1.15 0.75 3.07 8.31 0.00 -1.26 -4.76 105.19 112.45 1wun n GLY 117 Ca 0.09 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.03 1wun n GLY 117 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wun s TYR 118 N -2.42 0.44 0.04 1.61 1.51 -0.64 -0.75 117.35 117.14 1wun s TYR 118 Ca 0.00 -0.91 0.04 0.00 -1.01 0.00 0.00 57.07 55.19 1wun s TYR 118 Cb 0.00 -0.32 -0.02 0.00 -0.11 0.00 0.00 41.96 41.50 1wun s TYR 118 CO 0.00 -0.34 -0.11 -1.12 -1.11 0.00 0.00 175.55 172.86 1wun s SER 119 N -2.57 1.32 -0.08 2.29 0.01 0.70 -4.71 113.70 110.65 1wun s SER 119 Ca 0.01 -0.48 -0.30 0.00 1.31 0.00 0.00 55.95 56.50 1wun s SER 119 Cb 0.04 -0.05 -0.03 0.00 0.21 0.00 0.00 66.02 66.19 1wun s SER 119 CO -0.08 -0.06 1.16 -0.22 0.41 0.00 0.00 173.24 174.45 1wun s LEU 120 N -1.28 4.26 1.02 2.44 2.96 -1.26 -1.24 118.68 125.58 1wun s LEU 120 Ca -0.03 1.74 -0.14 0.00 -0.22 0.00 0.00 54.13 55.48 1wun s LEU 120 Cb -0.08 -3.56 0.20 0.00 0.50 0.00 0.00 46.19 43.25 1wun s LEU 120 CO 0.01 -0.57 1.12 -0.76 -1.32 0.00 0.00 176.35 174.84 1wun s LEU 121 N 2.26 1.56 0.57 -0.68 1.43 0.14 -4.89 118.68 119.08 1wun s LEU 121 Ca 0.54 0.94 0.29 0.00 -1.03 0.00 0.00 54.13 54.87 1wun s LEU 121 Cb -0.23 -3.05 1.74 0.00 0.03 0.00 0.00 46.19 44.68 1wun s LEU 121 CO 0.20 -3.17 2.22 0.00 0.23 0.00 0.00 176.35 175.83 1wun h ALA 122 N -1.92 1.49 0.00 4.21 0.00 -1.96 -1.28 119.26 119.80 1wun h ALA 122 Ca -0.51 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1wun h ALA 122 Cb 1.32 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1wun h ALA 122 CO 0.53 0.03 0.00 -0.40 0.00 0.00 0.00 179.25 179.41 1wun n ASP 123 N -3.82 0.00 0.00 0.00 5.68 -1.26 -4.86 116.55 112.29 1wun n ASP 123 Ca -0.03 0.45 0.00 0.00 -0.50 0.00 0.00 54.79 54.71 1wun n ASP 123 Cb 0.11 -0.47 0.00 0.00 -1.14 0.00 0.00 41.12 39.62 1wun n ASP 123 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1wun n GLY 124 N -0.17 0.39 0.00 6.12 0.00 -0.48 -4.77 105.19 106.28 1wun n GLY 124 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1wun n GLY 124 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1wun n VAL 125 N -2.50 0.00 -3.31 1.61 0.24 -1.26 -4.05 118.33 109.07 1wun n VAL 125 Ca 0.00 0.00 -0.28 0.00 -2.04 0.00 0.00 64.34 62.02 1wun n VAL 125 Cb 0.14 -0.39 -0.03 0.00 -1.47 0.00 0.00 33.84 32.09 1wun n VAL 125 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1wun s SER 126 N -1.83 6.41 -0.04 -1.34 0.01 -1.26 -0.38 113.70 115.27 1wun s SER 126 Ca 0.00 0.69 0.05 0.00 1.31 0.00 0.00 55.95 58.00 1wun s SER 126 Cb 0.00 -2.13 -0.01 0.00 0.21 0.00 0.00 66.02 64.09 1wun s SER 126 CO 0.00 -0.23 -0.19 0.00 0.41 0.00 0.00 173.24 173.23 1wun s THR 128 N -0.12 1.61 0.34 0.00 -1.32 -0.37 -4.89 115.64 110.88 1wun s THR 128 Ca -0.01 -1.13 -0.29 0.00 -1.21 0.00 0.00 61.69 59.06 1wun s THR 128 Cb -0.11 -1.39 -0.11 0.00 -1.51 0.00 0.00 72.50 69.38 1wun s THR 128 CO 0.02 0.23 1.46 -2.84 -2.21 0.00 0.00 174.62 171.28 1wun s PRO 129 N -1.06 4.18 -0.09 7.08 0.02 -1.26 -0.22 135.00 143.66 1wun s PRO 129 Ca 0.07 2.47 0.12 0.00 0.02 0.00 0.00 61.00 63.69 1wun s PRO 129 Cb -0.09 -3.01 0.28 0.00 0.02 0.00 0.00 34.50 31.70 1wun s PRO 129 CO 0.01 -0.47 1.20 0.25 -0.33 0.00 0.00 177.00 177.67 1wun n THR 130 N 1.03 1.61 -4.11 0.99 -2.24 0.07 -4.83 114.28 106.81 1wun n THR 130 Ca 0.03 -1.63 -0.10 0.00 -2.27 0.00 0.00 64.05 60.08 1wun n THR 130 Cb 0.39 0.07 -0.09 0.00 -2.10 0.00 0.00 70.33 68.60 1wun n THR 130 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1wun s VAL 131 N -2.07 0.10 0.24 2.28 -7.23 -1.26 -4.98 120.40 107.48 1wun s VAL 131 Ca 0.25 -1.81 0.04 0.00 -1.81 0.00 0.00 61.98 58.65 1wun s VAL 131 Cb 0.20 -1.98 -0.03 0.00 0.56 0.00 0.00 36.38 35.13 1wun s VAL 131 CO 0.06 -0.46 1.58 -0.08 -0.31 0.00 0.00 175.10 175.89 1wun h GLU 132 N 2.82 0.28 -2.29 4.82 4.81 -1.96 -3.36 114.58 119.70 1wun h GLU 132 Ca -0.34 -0.18 -0.59 0.00 -0.13 0.00 0.00 59.36 58.12 1wun h GLU 132 Cb 1.20 0.02 -0.41 0.00 0.63 0.00 0.00 28.75 30.20 1wun h GLU 132 CO 0.57 0.77 -0.78 0.66 -0.73 0.00 0.00 179.01 179.50 1wun n TYR 133 N -3.91 1.94 -1.42 0.92 4.01 -1.26 -5.09 117.16 112.35 1wun n TYR 133 Ca -0.02 -3.92 -0.33 0.00 -0.16 0.00 0.00 57.90 53.47 1wun n TYR 133 Cb 0.59 -0.42 0.09 0.00 -0.31 0.00 0.00 39.34 39.28 1wun n TYR 133 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1wun s PRO 134 N -1.69 2.25 0.66 -0.72 0.04 -1.26 -4.99 135.00 129.29 1wun s PRO 134 Ca 0.36 1.50 -0.15 0.00 0.04 0.00 0.00 61.00 62.75 1wun s PRO 134 Cb 0.12 -1.87 -0.00 0.00 0.04 0.00 0.00 34.50 32.78 1wun s PRO 134 CO -0.08 -1.70 1.10 0.00 0.04 0.00 0.00 177.00 176.35 1wun n GLY 136 N -0.70 0.48 3.53 0.00 0.00 -1.26 -5.01 105.19 102.23 1wun n GLY 136 Ca 0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 1wun n GLY 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wun s LYS 137 N -0.55 2.42 -0.53 1.61 -0.14 -1.24 -5.09 119.74 116.22 1wun s LYS 137 Ca 0.00 -0.78 -0.09 0.00 -1.36 0.00 0.00 55.97 53.74 1wun s LYS 137 Cb 0.00 -2.39 0.14 0.00 -1.68 0.00 0.00 37.83 33.90 1wun s LYS 137 CO 0.00 0.59 0.41 0.42 -0.76 0.00 0.00 175.35 176.01 1wun s ILE 138 N -0.90 4.34 0.20 2.17 1.01 -1.26 -4.96 121.20 121.80 1wun s ILE 138 Ca 0.15 -1.99 -0.20 0.00 0.00 0.00 0.00 60.65 58.61 1wun s ILE 138 Cb -0.11 -3.83 0.15 0.00 0.01 0.00 0.00 42.46 38.68 1wun s ILE 138 CO 0.05 -0.82 1.47 -2.65 0.00 0.00 0.00 174.94 172.99 1wun n PRO 139 N 4.66 -0.27 0.00 2.79 -0.02 -1.26 -0.92 135.00 139.98 1wun n PRO 139 Ca -0.04 1.45 0.05 0.00 -2.02 0.00 0.00 63.50 62.94 1wun n PRO 139 Cb 0.41 -2.15 0.28 0.00 -0.02 0.00 0.00 33.50 32.02 1wun n PRO 139 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 1wun n ILE 140 N -5.34 0.37 0.21 4.25 -5.35 -1.26 -1.55 119.36 110.69 1wun n ILE 140 Ca 0.08 0.09 0.03 0.00 -0.27 0.00 0.00 62.75 62.68 1wun n ILE 140 Cb 0.35 -0.93 -0.05 0.00 -1.74 0.00 0.00 39.64 37.27 1wun n ILE 140 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1wun n LEU 141 N -1.14 0.21 -0.41 7.28 4.77 -0.09 -5.34 117.00 122.28 1wun n LEU 141 Ca 0.06 -0.32 0.14 0.00 -0.03 0.00 0.00 56.01 55.87 1wun n LEU 141 Cb 0.06 0.00 0.58 0.00 -2.33 0.00 0.00 43.42 41.73 1wun n LEU 141 CO 0.07 0.05 0.90 -0.62 -1.33 0.00 0.00 177.39 176.46