#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wwa n ASP 58 N 0.00 2.54 -4.79 1.96 8.00 -1.26 -5.03 116.55 117.97 2wwa n ASP 58 Ca 0.00 -2.46 -0.32 0.00 0.71 0.00 0.00 54.79 52.72 2wwa n ASP 58 Cb 0.00 -0.24 0.04 0.00 -0.02 0.00 0.00 41.12 40.89 2wwa n ASP 58 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2wwa s SER 59 N -1.67 5.40 0.35 -2.24 0.15 -1.26 -5.07 113.70 109.35 2wwa s SER 59 Ca 0.20 1.83 0.03 0.00 0.70 0.00 0.00 55.95 58.71 2wwa s SER 59 Cb 0.15 -2.53 -0.04 0.00 -1.71 0.00 0.00 66.02 61.89 2wwa s SER 59 CO 0.05 -1.43 0.12 -0.72 1.20 0.00 0.00 173.24 172.46 2wwa s TYR 60 N -2.58 1.76 -1.88 3.44 1.13 -1.26 -5.08 117.35 112.88 2wwa s TYR 60 Ca 0.63 -1.22 0.26 0.00 -1.41 0.00 0.00 57.07 55.33 2wwa s TYR 60 Cb -0.17 -1.08 0.63 0.00 -1.10 0.00 0.00 41.96 40.23 2wwa s TYR 60 CO 0.43 -0.29 1.49 1.63 -2.51 0.00 0.00 175.55 176.30 2wwa n LYS 61 N -0.73 0.99 0.00 -3.49 5.02 -1.26 -5.00 118.16 113.70 2wwa n LYS 61 Ca -0.03 -0.64 0.00 0.00 -2.02 0.00 0.00 58.31 55.62 2wwa n LYS 61 Cb 0.65 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 2wwa n LYS 61 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2wwa n VAL 62 N -0.44 0.00 -1.52 -0.18 0.24 -1.26 -4.73 118.33 110.44 2wwa n VAL 62 Ca 0.12 0.00 -0.46 0.00 -2.04 0.00 0.00 64.34 61.96 2wwa n VAL 62 Cb 0.37 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.69 2wwa n VAL 62 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 2wwa n ILE 63 N 0.00 0.23 -0.02 1.34 5.41 -1.26 -1.81 119.36 123.24 2wwa n ILE 63 Ca 0.00 -0.38 -0.18 0.00 1.00 0.00 0.00 62.75 63.18 2wwa n ILE 63 Cb 0.00 -2.11 -0.13 0.00 -0.71 0.00 0.00 39.64 36.69 2wwa n ILE 63 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2wwa h GLU 64 N 14.08 0.14 -1.98 0.38 5.08 -1.75 -3.49 114.58 127.04 2wwa h GLU 64 Ca -0.32 -0.23 -0.01 0.00 -1.00 0.00 0.00 59.36 57.79 2wwa h GLU 64 Cb 1.28 0.09 -0.19 0.00 0.50 0.00 0.00 28.75 30.43 2wwa h GLU 64 CO 1.01 1.11 0.31 1.14 -1.00 0.00 0.00 179.01 181.58 2wwa s GLN 65 N -2.35 0.94 0.29 2.33 0.00 -1.21 -5.08 119.66 114.57 2wwa s GLN 65 Ca -0.19 0.13 -0.28 0.00 -0.00 0.00 0.00 55.36 55.02 2wwa s GLN 65 Cb 0.01 0.44 -0.09 0.00 0.00 0.00 0.00 33.01 33.37 2wwa s GLN 65 CO 0.73 -0.31 0.98 -1.25 0.00 0.00 0.00 175.29 175.43 2wwa s PRO 66 N -1.51 4.66 0.03 9.60 0.04 -1.26 -1.78 135.00 144.78 2wwa s PRO 66 Ca -0.06 1.48 -0.23 0.00 0.04 0.00 0.00 61.00 62.23 2wwa s PRO 66 Cb -0.00 -3.03 -0.05 0.00 0.04 0.00 0.00 34.50 31.46 2wwa s PRO 66 CO 0.05 0.33 0.69 -1.50 0.04 0.00 0.00 177.00 176.60 2wwa s ILE 67 N -1.38 4.80 -0.06 0.56 2.07 -1.18 -4.82 121.20 121.20 2wwa s ILE 67 Ca 0.46 1.46 0.02 0.00 -1.41 0.00 0.00 60.65 61.19 2wwa s ILE 67 Cb -0.24 -4.03 0.01 0.00 0.13 0.00 0.00 42.46 38.33 2wwa s ILE 67 CO 0.30 0.39 -0.13 0.28 -1.91 0.00 0.00 174.94 173.88 2wwa s THR 68 N -0.15 1.15 0.33 4.00 -1.32 -1.26 -4.67 115.64 113.72 2wwa s THR 68 Ca 0.35 -0.50 -0.18 0.00 -1.21 0.00 0.00 61.69 60.15 2wwa s THR 68 Cb -0.20 -1.04 0.05 0.00 -1.51 0.00 0.00 72.50 69.81 2wwa s THR 68 CO 0.20 0.35 0.82 -0.94 -2.21 0.00 0.00 174.62 172.85 2wwa s SER 69 N 0.57 -0.05 0.24 8.08 1.04 -1.26 -4.98 113.70 117.34 2wwa s SER 69 Ca -0.13 -0.96 -0.06 0.00 0.48 0.00 0.00 55.95 55.29 2wwa s SER 69 Cb -0.15 0.77 0.24 0.00 0.10 0.00 0.00 66.02 66.98 2wwa s SER 69 CO 0.03 -1.50 1.82 1.05 0.98 0.00 0.00 173.24 175.62 2wwa h GLU 70 N 2.00 1.14 0.04 4.02 -0.00 -2.00 -2.49 114.58 117.29 2wwa h GLU 70 Ca -0.29 -0.18 -0.22 0.00 -0.00 0.00 0.00 59.36 58.67 2wwa h GLU 70 Cb 1.24 -0.20 -0.02 0.00 -0.00 0.00 0.00 28.75 29.78 2wwa h GLU 70 CO 0.36 0.90 -1.03 0.00 -0.00 0.00 0.00 179.01 179.24 2wwa h THR 71 N 1.12 1.62 -0.53 -1.06 1.03 -2.00 -3.25 112.91 109.85 2wwa h THR 71 Ca 0.27 -3.17 -0.09 0.00 -0.01 0.00 0.00 66.41 63.40 2wwa h THR 71 Cb 0.15 2.80 -0.02 0.00 -1.07 0.00 0.00 68.15 70.01 2wwa h THR 71 CO -0.03 0.91 -0.03 0.00 -0.01 0.00 0.00 175.52 176.37 2wwa h ALA 72 N 0.90 0.72 0.00 0.00 0.00 -1.87 -2.83 119.26 116.18 2wwa h ALA 72 Ca -0.05 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 2wwa h ALA 72 Cb 1.76 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.36 2wwa h ALA 72 CO 0.15 0.56 -0.11 0.52 0.00 0.00 0.00 179.25 180.37 2wwa h MET 73 N 0.82 0.00 -0.42 0.00 2.86 -1.58 -2.88 114.93 113.74 2wwa h MET 73 Ca 0.15 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.67 2wwa h MET 73 Cb 0.57 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.21 2wwa h MET 73 CO 0.03 0.11 -0.20 0.87 1.06 0.00 0.00 176.91 178.79 2wwa h LYS 74 N 0.00 0.82 -0.62 1.72 1.79 -1.55 -3.16 116.57 115.56 2wwa h LYS 74 Ca -0.00 -0.32 -0.03 0.00 -2.18 0.00 0.00 60.65 58.11 2wwa h LYS 74 Cb 0.97 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 31.55 2wwa h LYS 74 CO 0.01 0.95 0.25 0.87 -1.08 0.00 0.00 179.45 180.45 2wwa h LYS 75 N 0.72 0.90 -0.70 3.15 1.57 -1.28 -2.47 116.57 118.47 2wwa h LYS 75 Ca 0.10 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2wwa h LYS 75 Cb 0.71 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.83 2wwa h LYS 75 CO 0.05 0.74 0.38 0.28 -0.57 0.00 0.00 179.45 180.33 2wwa h VAL 76 N 0.89 1.22 -0.54 0.50 2.07 -1.44 -2.73 116.25 116.22 2wwa h VAL 76 Ca 0.21 -0.55 -0.08 0.00 0.82 0.00 0.00 66.70 67.10 2wwa h VAL 76 Cb 0.17 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 2wwa h VAL 76 CO -0.02 0.24 0.00 -0.33 0.02 0.00 0.00 177.57 177.49 2wwa h GLU 77 N 0.96 0.94 -0.23 1.57 5.08 -1.52 -2.62 114.58 118.77 2wwa h GLU 77 Ca 0.24 -0.30 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 2wwa h GLU 77 Cb 0.05 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2wwa h GLU 77 CO -0.04 0.95 0.03 -0.44 -1.00 0.00 0.00 179.01 178.52 2wwa h ASP 78 N 0.82 0.37 0.00 1.42 3.32 -1.14 -3.41 116.42 117.80 2wwa h ASP 78 Ca 0.15 -0.26 -0.12 0.00 0.02 0.00 0.00 57.03 56.82 2wwa h ASP 78 Cb 0.53 -0.10 -0.12 0.00 0.22 0.00 0.00 39.33 39.86 2wwa h ASP 78 CO 0.03 0.54 -0.24 0.61 -1.72 0.00 0.00 179.24 178.46 2wwa n GLY 79 N -0.44 0.85 3.24 2.75 0.00 -1.16 -5.03 105.19 105.39 2wwa n GLY 79 Ca -0.04 -0.06 -0.14 0.00 0.00 0.00 0.00 46.02 45.78 2wwa n GLY 79 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wwa n ASN 80 N -0.54 -6.70 -4.07 1.61 3.02 -0.98 -4.54 115.26 103.05 2wwa n ASN 80 Ca -0.20 -0.68 -0.32 0.00 -0.03 0.00 0.00 54.58 53.35 2wwa n ASN 80 Cb 0.71 -5.21 -0.15 0.00 -0.61 0.00 0.00 39.78 34.51 2wwa n ASN 80 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2wwa s ILE 81 N -3.37 2.07 0.41 2.41 1.01 -1.17 -2.32 121.20 120.24 2wwa s ILE 81 Ca 0.44 -1.39 -0.04 0.00 0.00 0.00 0.00 60.65 59.66 2wwa s ILE 81 Cb -0.06 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.27 2wwa s ILE 81 CO 0.74 0.13 0.69 -0.76 0.00 0.00 0.00 174.94 175.74 2wwa s LEU 82 N 1.18 3.81 -0.03 2.97 1.43 -1.04 -2.38 118.68 124.62 2wwa s LEU 82 Ca -0.05 0.79 -0.02 0.00 -1.03 0.00 0.00 54.13 53.82 2wwa s LEU 82 Cb -0.18 -3.69 0.02 0.00 0.03 0.00 0.00 46.19 42.36 2wwa s LEU 82 CO -0.07 -0.44 0.07 0.54 0.23 0.00 0.00 176.35 176.68 2wwa s VAL 83 N -2.51 -0.02 0.35 -1.59 0.11 -1.26 -2.43 120.40 113.04 2wwa s VAL 83 Ca 0.45 0.07 0.03 0.00 -2.93 0.00 0.00 61.98 59.61 2wwa s VAL 83 Cb -0.10 -0.12 -0.05 0.00 -1.53 0.00 0.00 36.38 34.58 2wwa s VAL 83 CO 0.39 0.03 0.09 -0.36 -3.33 0.00 0.00 175.10 171.92 2wwa s PHE 84 N 0.42 1.84 -0.04 1.54 0.40 -0.37 -3.08 117.98 118.70 2wwa s PHE 84 Ca -0.03 -1.10 0.04 0.00 -0.60 0.00 0.00 56.93 55.24 2wwa s PHE 84 Cb -0.05 -1.19 -0.00 0.00 0.51 0.00 0.00 43.02 42.29 2wwa s PHE 84 CO -0.02 -0.14 -0.14 -0.65 0.70 0.00 0.00 175.22 174.97 2wwa s GLN 85 N -3.85 1.48 0.18 0.44 -0.21 -0.73 -1.26 119.66 115.69 2wwa s GLN 85 Ca 0.32 -0.50 0.02 0.00 0.02 0.00 0.00 55.36 55.22 2wwa s GLN 85 Cb 0.06 -1.31 -0.05 0.00 1.00 0.00 0.00 33.01 32.72 2wwa s GLN 85 CO 0.15 0.20 0.01 0.14 -2.12 0.00 0.00 175.29 173.67 2wwa s VAL 86 N 0.07 0.66 1.00 1.09 -7.23 -0.29 -2.29 120.40 113.41 2wwa s VAL 86 Ca -0.03 -1.98 -0.16 0.00 -1.81 0.00 0.00 61.98 58.00 2wwa s VAL 86 Cb -0.10 -2.14 -0.03 0.00 0.56 0.00 0.00 36.38 34.66 2wwa s VAL 86 CO 0.01 -0.45 -0.22 -1.20 -0.31 0.00 0.00 175.10 172.93 2wwa n SER 87 N -0.25 -3.46 0.18 4.85 7.64 -0.75 -2.00 113.62 119.84 2wwa n SER 87 Ca -0.06 0.18 0.13 0.00 1.01 0.00 0.00 58.87 60.13 2wwa n SER 87 Cb 0.63 -0.96 0.33 0.00 -1.01 0.00 0.00 64.21 63.20 2wwa n SER 87 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 2wwa h MET 88 N -1.41 0.00 -0.03 1.43 4.05 -1.93 -2.94 114.93 114.11 2wwa h MET 88 Ca -0.45 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.97 2wwa h MET 88 Cb 1.31 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.11 2wwa h MET 88 CO 0.30 0.00 -0.02 1.63 0.23 0.00 0.00 176.91 179.05 2wwa n LYS 89 N -2.77 2.23 -1.67 0.39 5.02 -1.26 -5.02 118.16 115.08 2wwa n LYS 89 Ca 0.04 -1.82 -0.38 0.00 -2.02 0.00 0.00 58.31 54.13 2wwa n LYS 89 Cb 0.45 -1.46 0.05 0.00 -0.02 0.00 0.00 35.03 34.05 2wwa n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wwa n ALA 90 N 1.20 0.70 -2.42 7.82 0.00 -1.11 -5.05 120.51 121.66 2wwa n ALA 90 Ca 0.14 0.04 -0.16 0.00 0.00 0.00 0.00 53.44 53.47 2wwa n ALA 90 Cb 0.58 -2.21 -0.11 0.00 0.00 0.00 0.00 19.45 17.71 2wwa n ALA 90 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2wwa s ASN 91 N -1.17 1.76 0.20 0.00 2.47 -1.26 -5.03 114.94 111.90 2wwa s ASN 91 Ca 0.76 -0.87 -0.10 0.00 0.42 0.00 0.00 52.86 53.07 2wwa s ASN 91 Cb -0.42 -0.03 0.14 0.00 -1.45 0.00 0.00 41.25 39.49 2wwa s ASN 91 CO 0.46 -0.24 1.80 0.11 -3.72 0.00 0.00 177.10 175.52 2wwa h LYS 92 N 3.32 1.05 -0.71 0.43 1.79 -1.98 -3.00 116.57 117.47 2wwa h LYS 92 Ca -0.38 -0.15 -0.07 0.00 -2.18 0.00 0.00 60.65 57.87 2wwa h LYS 92 Cb 1.19 -0.19 -0.03 0.00 -1.58 0.00 0.00 32.23 31.62 2wwa h LYS 92 CO 0.55 0.81 0.17 -0.92 -1.08 0.00 0.00 179.45 178.99 2wwa h TYR 93 N 1.03 1.20 0.00 -1.35 3.20 -1.99 -2.78 116.97 116.27 2wwa h TYR 93 Ca 0.25 -0.14 -0.06 0.00 3.14 0.00 0.00 58.73 61.93 2wwa h TYR 93 Cb 0.10 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.02 2wwa h TYR 93 CO 0.01 0.97 -0.27 1.96 -1.64 0.00 0.00 178.16 179.19 2wwa h GLN 94 N 1.08 0.00 -0.19 1.82 4.20 -1.96 -1.84 115.11 118.22 2wwa h GLN 94 Ca 0.22 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.76 2wwa h GLN 94 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2wwa h GLN 94 CO 0.00 0.27 -0.55 0.82 -0.67 0.00 0.00 178.83 178.70 2wwa h ILE 95 N 0.00 1.31 -0.56 2.54 2.04 -1.45 -1.95 117.51 119.43 2wwa h ILE 95 Ca -0.00 -1.78 -0.00 0.00 1.00 0.00 0.00 64.86 64.08 2wwa h ILE 95 Cb 1.11 1.90 -0.03 0.00 -0.74 0.00 0.00 36.82 39.06 2wwa h ILE 95 CO 0.03 0.56 0.35 0.50 0.00 0.00 0.00 178.15 179.59 2wwa h LYS 96 N 0.42 0.76 -0.28 2.37 1.63 -1.31 -2.87 116.57 117.29 2wwa h LYS 96 Ca -0.01 -0.06 -0.19 0.00 -0.85 0.00 0.00 60.65 59.53 2wwa h LYS 96 Cb 1.17 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.64 2wwa h LYS 96 CO 0.12 0.54 -0.56 -0.22 -3.45 0.00 0.00 179.45 175.88 2wwa h LYS 97 N 0.76 0.85 -0.45 1.90 3.64 -1.36 -3.12 116.57 118.80 2wwa h LYS 97 Ca 0.20 -0.55 -0.07 0.00 -1.27 0.00 0.00 60.65 58.96 2wwa h LYS 97 Cb -0.03 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 2wwa h LYS 97 CO -0.04 1.18 -0.01 0.00 -2.27 0.00 0.00 179.45 178.32 2wwa h ALA 98 N 0.70 0.61 0.00 5.00 0.00 -1.27 -2.90 119.26 121.40 2wwa h ALA 98 Ca 0.01 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 2wwa h ALA 98 Cb 1.17 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 2wwa h ALA 98 CO 0.12 0.41 -0.16 0.28 0.00 0.00 0.00 179.25 179.90 2wwa h VAL 99 N 0.64 0.31 -0.62 0.00 2.07 -1.60 -2.61 116.25 114.44 2wwa h VAL 99 Ca 0.13 -1.21 -0.07 0.00 0.82 0.00 0.00 66.70 66.37 2wwa h VAL 99 Cb 0.51 1.96 -0.02 0.00 -1.52 0.00 0.00 31.29 32.21 2wwa h VAL 99 CO 0.02 0.15 0.09 0.50 0.02 0.00 0.00 177.57 178.36 2wwa h LYS 100 N 0.00 1.02 -0.51 1.57 3.11 -1.45 -2.57 116.57 117.75 2wwa h LYS 100 Ca -0.00 -0.28 0.00 0.00 -2.81 0.00 0.00 60.65 57.56 2wwa h LYS 100 Cb 0.95 -0.12 0.00 0.00 -1.00 0.00 0.00 32.23 32.06 2wwa h LYS 100 CO 0.02 0.96 0.00 0.39 -2.81 0.00 0.00 179.45 178.01 2wwa n GLU 101 N -4.28 2.56 0.00 1.90 1.02 -1.06 -1.95 120.64 118.84 2wwa n GLU 101 Ca 0.03 -2.39 0.00 0.00 -0.02 0.00 0.00 57.16 54.79 2wwa n GLU 101 Cb 0.28 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 2wwa n GLU 101 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2wwa n LEU 102 N 1.47 0.39 0.00 -4.62 4.77 -1.01 -4.85 117.00 113.15 2wwa n LEU 102 Ca 0.20 -0.54 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 2wwa n LEU 102 Cb 0.59 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2wwa n LEU 102 CO 0.15 0.10 0.00 -1.22 -1.33 0.00 0.00 177.39 175.09 2wwa n TYR 103 N -0.29 0.00 -2.35 -1.77 4.02 -0.97 -5.05 117.16 110.75 2wwa n TYR 103 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.85 2wwa n TYR 103 Cb 0.05 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.37 2wwa n TYR 103 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 2wwa n GLU 104 N 0.00 -1.40 -4.28 -0.72 4.07 -0.82 -5.02 120.64 112.46 2wwa n GLU 104 Ca 0.00 1.46 -0.16 0.00 -0.06 0.00 0.00 57.16 58.40 2wwa n GLU 104 Cb 0.00 -4.10 -0.10 0.00 -0.06 0.00 0.00 31.44 27.19 2wwa n GLU 104 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 2wwa s VAL 105 N -2.11 0.24 -0.09 6.31 -7.23 -1.25 -5.01 120.40 111.25 2wwa s VAL 105 Ca 0.14 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.34 2wwa s VAL 105 Cb -0.04 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.37 2wwa s VAL 105 CO 0.47 0.00 -0.21 -0.62 -0.31 0.00 0.00 175.10 174.44 2wwa s ASP 106 N -3.29 2.71 -0.05 4.85 3.68 -1.26 -4.74 116.67 118.57 2wwa s ASP 106 Ca 0.38 -0.48 -0.17 0.00 2.13 0.00 0.00 52.55 54.40 2wwa s ASP 106 Cb 0.06 -1.24 -0.05 0.00 -1.45 0.00 0.00 42.92 40.24 2wwa s ASP 106 CO 0.16 0.12 0.47 -0.69 0.13 0.00 0.00 175.17 175.36 2wwa s VAL 107 N 0.43 5.06 -1.41 1.11 1.01 -1.26 -3.22 120.40 122.13 2wwa s VAL 107 Ca -0.18 0.95 0.12 0.00 0.00 0.00 0.00 61.98 62.88 2wwa s VAL 107 Cb -0.17 -3.79 0.15 0.00 0.00 0.00 0.00 36.38 32.56 2wwa s VAL 107 CO 0.07 0.45 0.97 0.18 0.00 0.00 0.00 175.10 176.78 2wwa n LEU 108 N 2.74 2.24 0.00 3.92 4.77 -0.55 -4.97 117.00 125.15 2wwa n LEU 108 Ca -0.10 -1.22 0.00 0.00 -0.03 0.00 0.00 56.01 54.66 2wwa n LEU 108 Cb 0.52 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 2wwa n LEU 108 CO 0.41 0.46 0.00 1.17 -1.33 0.00 0.00 177.39 178.10 2wwa n LYS 109 N 0.67 0.00 -5.11 3.23 4.81 -1.25 -4.93 118.16 115.58 2wwa n LYS 109 Ca 0.08 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.22 2wwa n LYS 109 Cb 0.34 0.00 -0.17 0.00 0.02 0.00 0.00 35.03 35.22 2wwa n LYS 109 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2wwa s VAL 110 N -0.05 1.89 -0.02 3.15 1.01 -1.26 -2.21 120.40 122.91 2wwa s VAL 110 Ca 0.00 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 60.95 2wwa s VAL 110 Cb 0.00 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.76 2wwa s VAL 110 CO 0.00 0.52 0.23 0.54 0.00 0.00 0.00 175.10 176.39 2wwa s ASN 111 N 0.34 -0.11 0.03 3.32 2.20 -1.08 -5.03 114.94 114.61 2wwa s ASN 111 Ca -0.16 0.04 0.00 0.00 -0.94 0.00 0.00 52.86 51.80 2wwa s ASN 111 Cb -0.17 0.30 -0.02 0.00 -2.00 0.00 0.00 41.25 39.36 2wwa s ASN 111 CO 0.07 -0.35 -0.04 0.42 -2.94 0.00 0.00 177.10 174.27 2wwa s THR 112 N -1.08 0.21 0.18 0.54 -4.23 -1.26 -1.25 115.64 108.75 2wwa s THR 112 Ca -0.12 -1.03 -0.15 0.00 -1.18 0.00 0.00 61.69 59.22 2wwa s THR 112 Cb -0.06 -0.45 0.02 0.00 1.34 0.00 0.00 72.50 73.36 2wwa s THR 112 CO 0.02 -0.52 0.44 -0.76 -0.54 0.00 0.00 174.62 173.26 2wwa s LEU 113 N -1.62 0.39 0.34 4.79 1.43 -1.05 -5.03 118.68 117.92 2wwa s LEU 113 Ca -0.13 -0.57 -0.14 0.00 -1.03 0.00 0.00 54.13 52.26 2wwa s LEU 113 Cb -0.08 1.82 -0.08 0.00 0.03 0.00 0.00 46.19 47.87 2wwa s LEU 113 CO -0.01 -0.98 0.74 -0.69 0.23 0.00 0.00 176.35 175.63 2wwa s VAL 114 N -3.89 4.70 0.11 -1.59 1.01 -1.26 -2.02 120.40 117.46 2wwa s VAL 114 Ca 0.11 0.88 0.07 0.00 0.00 0.00 0.00 61.98 63.04 2wwa s VAL 114 Cb 0.01 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 2wwa s VAL 114 CO -0.03 -0.24 -0.18 -0.60 0.00 0.00 0.00 175.10 174.04 2wwa s ARG 115 N -3.13 1.07 0.00 2.72 3.52 -1.26 -4.83 118.95 117.05 2wwa s ARG 115 Ca 0.54 -1.17 0.15 0.00 -0.13 0.00 0.00 55.73 55.12 2wwa s ARG 115 Cb -0.10 -1.22 0.82 0.00 -1.56 0.00 0.00 34.95 32.89 2wwa s ARG 115 CO 0.20 0.27 1.38 -0.35 -0.81 0.00 0.00 175.30 175.99 2wwa n PRO 116 N 0.94 0.32 0.22 5.12 -0.04 -1.26 -1.65 135.00 138.65 2wwa n PRO 116 Ca -0.18 0.09 0.14 0.00 -0.04 0.00 0.00 63.50 63.50 2wwa n PRO 116 Cb 0.55 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.93 2wwa n PRO 116 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 2wwa h ASN 117 N 0.00 0.00 0.00 3.54 -1.24 -2.03 -3.47 115.58 112.37 2wwa h ASN 117 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2wwa h ASN 117 Cb 0.08 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.13 2wwa h ASN 117 CO 0.00 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.75 2wwa n GLY 118 N 0.62 3.06 3.77 1.57 0.00 -0.66 -5.02 105.19 108.53 2wwa n GLY 118 Ca 0.03 -0.84 -0.40 0.00 0.00 0.00 0.00 46.02 44.80 2wwa n GLY 118 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2wwa s THR 119 N -0.18 2.46 -0.23 2.61 -1.32 -1.26 -4.73 115.64 112.99 2wwa s THR 119 Ca 0.00 0.45 -0.23 0.00 -1.21 0.00 0.00 61.69 60.70 2wwa s THR 119 Cb 0.00 -3.28 -0.01 0.00 -1.51 0.00 0.00 72.50 67.70 2wwa s THR 119 CO 0.00 0.10 0.75 -0.75 -2.21 0.00 0.00 174.62 172.51 2wwa s LYS 120 N -2.02 4.18 0.51 7.08 2.20 -0.85 -4.10 119.74 126.74 2wwa s LYS 120 Ca 0.53 0.81 -0.21 0.00 -0.36 0.00 0.00 55.97 56.74 2wwa s LYS 120 Cb -0.42 -3.63 -0.06 0.00 -1.51 0.00 0.00 37.83 32.21 2wwa s LYS 120 CO 0.55 -0.43 1.14 -1.59 -0.36 0.00 0.00 175.35 174.66 2wwa s LYS 121 N 2.56 3.52 -0.06 4.03 -2.85 -0.85 -1.14 119.74 124.94 2wwa s LYS 121 Ca 0.32 1.67 -0.01 0.00 -1.00 0.00 0.00 55.97 56.96 2wwa s LYS 121 Cb -0.16 -2.16 0.03 0.00 -2.06 0.00 0.00 37.83 33.48 2wwa s LYS 121 CO 0.09 -0.72 -0.02 0.00 0.10 0.00 0.00 175.35 174.79 2wwa s ALA 122 N -1.69 0.72 -0.31 0.59 0.00 -0.39 -2.53 121.76 118.15 2wwa s ALA 122 Ca 0.69 -0.12 -0.14 0.00 0.00 0.00 0.00 51.96 52.39 2wwa s ALA 122 Cb -0.26 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 2wwa s ALA 122 CO 0.30 -0.31 0.30 -0.47 0.00 0.00 0.00 175.76 175.57 2wwa s TYR 123 N 1.60 3.22 -0.23 0.00 5.04 -0.38 -1.23 117.35 125.38 2wwa s TYR 123 Ca -0.00 0.04 0.00 0.00 -2.44 0.00 0.00 57.07 54.67 2wwa s TYR 123 Cb -0.13 -2.54 0.06 0.00 0.35 0.00 0.00 41.96 39.70 2wwa s TYR 123 CO -0.04 -0.32 -0.05 0.08 -1.34 0.00 0.00 175.55 173.88 2wwa s VAL 124 N 1.90 1.45 0.16 3.14 1.01 -1.02 -2.62 120.40 124.42 2wwa s VAL 124 Ca 0.10 -1.14 -0.13 0.00 0.00 0.00 0.00 61.98 60.81 2wwa s VAL 124 Cb -0.16 -1.71 -0.07 0.00 0.00 0.00 0.00 36.38 34.43 2wwa s VAL 124 CO 0.11 -0.08 0.54 -0.60 0.00 0.00 0.00 175.10 175.07 2wwa s ARG 125 N 1.44 3.93 0.19 2.72 3.52 -0.94 -2.49 118.95 127.32 2wwa s ARG 125 Ca -0.05 0.43 0.01 0.00 -0.13 0.00 0.00 55.73 55.99 2wwa s ARG 125 Cb -0.18 -2.86 -0.05 0.00 -1.56 0.00 0.00 34.95 30.30 2wwa s ARG 125 CO -0.06 0.44 0.05 -0.51 -0.81 0.00 0.00 175.30 174.41 2wwa s LEU 126 N -2.17 1.82 0.72 -0.88 1.02 -0.98 -1.49 118.68 116.72 2wwa s LEU 126 Ca 0.40 -1.26 -0.16 0.00 0.02 0.00 0.00 54.13 53.13 2wwa s LEU 126 Cb -0.14 0.09 0.03 0.00 0.02 0.00 0.00 46.19 46.18 2wwa s LEU 126 CO 0.20 -0.67 1.22 0.41 0.02 0.00 0.00 176.35 177.52 2wwa n THR 127 N -0.27 3.65 -0.12 5.49 -1.04 -1.20 -4.78 114.28 116.01 2wwa n THR 127 Ca -0.04 -0.38 -0.06 0.00 -2.04 0.00 0.00 64.05 61.54 2wwa n THR 127 Cb 0.64 -1.34 0.13 0.00 -1.82 0.00 0.00 70.33 67.94 2wwa n THR 127 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wwa h ALA 128 N -0.09 1.03 0.00 2.41 0.00 -1.94 -3.20 119.26 117.47 2wwa h ALA 128 Ca -0.49 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.13 2wwa h ALA 128 Cb 1.32 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2wwa h ALA 128 CO 0.50 0.60 0.00 -0.25 0.00 0.00 0.00 179.25 180.09 2wwa n ASP 129 N -4.19 0.46 -0.00 0.00 8.00 -1.26 -3.71 116.55 115.84 2wwa n ASP 129 Ca 0.02 0.54 -0.11 0.00 0.71 0.00 0.00 54.79 55.96 2wwa n ASP 129 Cb 0.33 -0.67 -0.05 0.00 -0.02 0.00 0.00 41.12 40.71 2wwa n ASP 129 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2wwa h TYR 130 N 0.00 0.13 -3.98 1.24 3.20 -1.94 -3.49 116.97 112.13 2wwa h TYR 130 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.88 2wwa h TYR 130 Cb 0.63 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.82 2wwa h TYR 130 CO 0.00 0.08 -0.81 -3.47 -1.64 0.00 0.00 178.16 172.32 2wwa n ASP 131 N -5.02 -4.49 -0.81 -2.11 -0.08 -1.24 -4.97 116.55 97.83 2wwa n ASP 131 Ca -0.05 1.08 0.11 0.00 -1.51 0.00 0.00 54.79 54.42 2wwa n ASP 131 Cb 0.03 -3.77 0.07 0.00 2.34 0.00 0.00 41.12 39.79 2wwa n ASP 131 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2wwa n ALA 132 N 1.16 2.75 -0.02 -1.67 0.00 -1.26 -4.29 120.51 117.18 2wwa n ALA 132 Ca -0.11 -0.67 -0.16 0.00 0.00 0.00 0.00 53.44 52.50 2wwa n ALA 132 Cb 0.18 -0.78 -0.10 0.00 0.00 0.00 0.00 19.45 18.75 2wwa n ALA 132 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2wwa h LEU 133 N 3.96 0.38 -1.32 0.00 6.46 -1.93 -2.88 115.31 119.98 2wwa h LEU 133 Ca 0.00 -0.71 0.00 0.00 -0.12 0.00 0.00 57.88 57.05 2wwa h LEU 133 Cb 0.90 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.72 2wwa h LEU 133 CO 0.00 1.04 -0.22 -0.67 -0.62 0.00 0.00 178.44 177.97 2wwa n ASP 134 N -4.40 2.28 -0.27 1.25 2.03 -1.26 -2.76 116.55 113.42 2wwa n ASP 134 Ca -0.09 -1.65 0.04 0.00 0.52 0.00 0.00 54.79 53.60 2wwa n ASP 134 Cb 0.54 0.21 0.03 0.00 -0.72 0.00 0.00 41.12 41.18 2wwa n ASP 134 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wwa n ILE 135 N 0.49 0.00 0.55 5.18 3.06 -1.26 -3.55 119.36 123.84 2wwa n ILE 135 Ca 0.12 -0.49 0.12 0.00 -2.50 0.00 0.00 62.75 60.00 2wwa n ILE 135 Cb 0.50 1.14 0.17 0.00 0.54 0.00 0.00 39.64 41.99 2wwa n ILE 135 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2wwa n ALA 136 N 0.30 2.43 0.08 1.51 0.00 -1.09 -3.47 120.51 120.27 2wwa n ALA 136 Ca 0.04 -0.89 0.11 0.00 0.00 0.00 0.00 53.44 52.70 2wwa n ALA 136 Cb 0.17 -0.85 -0.16 0.00 0.00 0.00 0.00 19.45 18.61 2wwa n ALA 136 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2wwa n ASN 137 N 1.45 0.11 -0.01 0.00 5.15 -1.11 -4.13 115.26 116.72 2wwa n ASN 137 Ca 0.17 -0.08 -0.18 0.00 -0.60 0.00 0.00 54.58 53.90 2wwa n ASN 137 Cb 0.61 1.88 -0.08 0.00 -0.53 0.00 0.00 39.78 41.65 2wwa n ASN 137 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 2wwa h ARG 138 N 0.00 0.68 -0.02 1.20 2.43 -1.62 -3.51 114.38 113.54 2wwa h ARG 138 Ca 0.00 -0.60 0.00 0.00 -0.81 0.00 0.00 59.98 58.57 2wwa h ARG 138 Cb 0.96 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 2wwa h ARG 138 CO 0.00 1.21 0.00 0.44 -1.51 0.00 0.00 179.97 180.11