#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v62 n SER 2 N 0.00 5.95 -3.08 1.61 2.88 -1.26 -4.66 113.62 115.07 1v62 n SER 2 Ca 0.00 -3.60 -0.08 0.00 -1.33 0.00 0.00 58.87 53.86 1v62 n SER 2 Cb 0.00 -0.92 -0.03 0.00 -0.75 0.00 0.00 64.21 62.52 1v62 n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v62 s SER 3 N -1.35 -0.64 0.00 -3.46 0.15 -1.26 -5.14 113.70 101.99 1v62 s SER 3 Ca 0.57 -1.61 0.00 0.00 0.70 0.00 0.00 55.95 55.61 1v62 s SER 3 Cb 0.46 1.38 0.00 0.00 -1.71 0.00 0.00 66.02 66.15 1v62 s SER 3 CO 0.04 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 174.95 1v62 n GLY 4 N 3.59 1.87 3.73 9.45 0.00 -1.26 -5.07 105.19 117.50 1v62 n GLY 4 Ca 0.16 -1.85 -0.39 0.00 0.00 0.00 0.00 46.02 43.94 1v62 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v62 s SER 5 N -1.00 6.97 -0.03 1.61 0.01 -1.26 -5.01 113.70 115.00 1v62 s SER 5 Ca 0.00 1.17 -0.00 0.00 1.31 0.00 0.00 55.95 58.42 1v62 s SER 5 Cb 0.00 -2.39 -0.00 0.00 0.21 0.00 0.00 66.02 63.84 1v62 s SER 5 CO 0.00 -0.03 0.04 0.28 0.41 0.00 0.00 173.24 173.94 1v62 h SER 6 N 6.33 -0.01 -0.01 2.44 0.02 -2.05 -3.48 113.55 116.79 1v62 h SER 6 Ca -0.42 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.48 1v62 h SER 6 Cb 1.20 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.61 1v62 h SER 6 CO 0.73 0.13 -0.01 0.61 -1.14 0.00 0.00 176.83 177.16 1v62 n GLY 7 N 1.83 -1.91 2.97 -3.77 0.00 -1.26 -5.14 105.19 97.91 1v62 n GLY 7 Ca -0.00 1.11 -0.29 0.00 0.00 0.00 0.00 46.02 46.84 1v62 n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1v62 s ASP 8 N -0.04 2.49 -0.05 1.61 1.11 -1.26 -5.12 116.67 115.41 1v62 s ASP 8 Ca 0.25 -0.42 0.06 0.00 0.18 0.00 0.00 52.55 52.62 1v62 s ASP 8 Cb 0.20 -1.04 -0.01 0.00 1.07 0.00 0.00 42.92 43.14 1v62 s ASP 8 CO -0.07 -0.08 -0.23 0.42 1.18 0.00 0.00 175.17 176.38 1v62 s THR 9 N 1.58 1.89 -0.29 -1.27 -4.23 -1.26 -5.12 115.64 106.95 1v62 s THR 9 Ca 0.05 -0.99 -0.16 0.00 -1.18 0.00 0.00 61.69 59.41 1v62 s THR 9 Cb -0.13 -1.60 0.13 0.00 1.34 0.00 0.00 72.50 72.24 1v62 s THR 9 CO -0.10 0.53 0.89 0.54 -0.54 0.00 0.00 174.62 175.95 1v62 s VAL 10 N -0.20 0.00 -0.18 2.29 0.11 -1.26 -5.15 120.40 116.02 1v62 s VAL 10 Ca -0.01 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 59.00 1v62 s VAL 10 Cb -0.12 -1.00 0.06 0.00 -1.53 0.00 0.00 36.38 33.79 1v62 s VAL 10 CO 0.02 0.00 0.07 0.00 -3.33 0.00 0.00 175.10 171.87 1v62 s ALA 11 N 1.43 0.60 0.37 1.54 0.00 -1.26 -4.96 121.76 119.48 1v62 s ALA 11 Ca -0.09 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.45 1v62 s ALA 11 Cb -0.04 -1.07 0.00 0.00 0.00 0.00 0.00 23.12 22.01 1v62 s ALA 11 CO -0.16 -1.16 0.00 -1.71 0.00 0.00 0.00 175.76 172.73 1v62 n ASN 12 N 5.21 -2.64 -3.73 0.00 2.85 -1.26 -5.00 115.26 110.69 1v62 n ASN 12 Ca -0.08 0.69 -0.35 0.00 -0.11 0.00 0.00 54.58 54.74 1v62 n ASN 12 Cb 0.48 2.55 -0.03 0.00 1.24 0.00 0.00 39.78 44.02 1v62 n ASN 12 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1v62 n ALA 13 N -3.35 4.63 0.27 5.20 0.00 -1.26 -4.87 120.51 121.13 1v62 n ALA 13 Ca 0.00 -4.79 -0.14 0.00 0.00 0.00 0.00 53.44 48.51 1v62 n ALA 13 Cb 0.00 -1.64 -0.07 0.00 0.00 0.00 0.00 19.45 17.73 1v62 n ALA 13 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1v62 h SER 14 N 4.84 -0.61 0.00 0.00 0.87 -1.96 -3.49 113.55 113.21 1v62 h SER 14 Ca 0.20 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1v62 h SER 14 Cb 0.64 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 1v62 h SER 14 CO 1.09 -0.24 0.00 0.61 -0.53 0.00 0.00 176.83 177.75 1v62 n GLY 15 N -0.53 3.04 3.85 5.77 0.00 -1.26 -5.13 105.19 110.93 1v62 n GLY 15 Ca -0.11 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 1v62 n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v62 s PRO 16 N 0.00 3.70 0.31 1.61 0.04 -1.26 -4.38 135.00 135.02 1v62 s PRO 16 Ca 0.00 0.89 0.06 0.00 0.04 0.00 0.00 61.00 62.00 1v62 s PRO 16 Cb 0.00 -2.10 -0.02 0.00 0.04 0.00 0.00 34.50 32.42 1v62 s PRO 16 CO 0.00 -0.48 0.40 -1.17 0.04 0.00 0.00 177.00 175.79 1v62 s LEU 17 N -4.63 3.98 -0.36 -3.56 2.96 0.84 -4.91 118.68 113.00 1v62 s LEU 17 Ca 0.58 -0.18 0.00 0.00 -0.22 0.00 0.00 54.13 54.31 1v62 s LEU 17 Cb -0.11 -2.66 0.09 0.00 0.50 0.00 0.00 46.19 44.01 1v62 s LEU 17 CO 0.42 -0.31 0.09 -0.04 -1.32 0.00 0.00 176.35 175.20 1v62 s MET 18 N -4.08 1.89 -0.91 1.98 -1.94 -1.26 -1.72 119.30 113.26 1v62 s MET 18 Ca 0.41 -1.73 -0.11 0.00 -1.71 0.00 0.00 55.69 52.55 1v62 s MET 18 Cb -0.09 -3.34 0.23 0.00 2.01 0.00 0.00 34.83 33.65 1v62 s MET 18 CO 0.29 -0.92 0.85 0.08 -0.01 0.00 0.00 175.02 175.32 1v62 s VAL 19 N 1.07 5.50 0.43 -6.03 1.01 -0.66 -4.05 120.40 117.67 1v62 s VAL 19 Ca 0.06 -2.92 -0.21 0.00 0.00 0.00 0.00 61.98 58.91 1v62 s VAL 19 Cb -0.21 -4.37 -0.11 0.00 0.00 0.00 0.00 36.38 31.69 1v62 s VAL 19 CO -0.05 -1.07 0.96 -1.61 0.00 0.00 0.00 175.10 173.33 1v62 s GLU 20 N -0.43 4.18 -0.08 2.72 2.02 -1.16 -3.27 118.70 122.68 1v62 s GLU 20 Ca 0.23 1.17 -0.02 0.00 0.02 0.00 0.00 54.97 56.38 1v62 s GLU 20 Cb -0.11 -2.21 0.03 0.00 0.10 0.00 0.00 34.13 31.95 1v62 s GLU 20 CO -0.08 -0.08 0.01 0.42 0.02 0.00 0.00 175.26 175.55 1v62 s ILE 21 N -2.11 0.36 -1.10 -1.63 1.01 -1.15 -4.84 121.20 111.74 1v62 s ILE 21 Ca 0.62 0.09 -0.23 0.00 0.00 0.00 0.00 60.65 61.13 1v62 s ILE 21 Cb -0.11 -0.55 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 1v62 s ILE 21 CO 0.15 0.22 1.85 -0.69 0.00 0.00 0.00 174.94 176.47 1v62 s VAL 22 N 1.98 3.65 0.77 2.92 1.01 -1.26 -1.91 120.40 127.55 1v62 s VAL 22 Ca 0.05 -0.89 -0.08 0.00 0.00 0.00 0.00 61.98 61.05 1v62 s VAL 22 Cb -0.13 -4.55 0.17 0.00 0.00 0.00 0.00 36.38 31.87 1v62 s VAL 22 CO -0.05 -1.25 1.05 2.29 0.00 0.00 0.00 175.10 177.14 1v62 n LYS 23 N 8.54 -0.67 -2.78 2.72 2.85 -0.99 -5.00 118.16 122.83 1v62 n LYS 23 Ca 0.43 -2.06 -0.40 0.00 -1.05 0.00 0.00 58.31 55.23 1v62 n LYS 23 Cb 0.47 -0.94 -0.06 0.00 -0.65 0.00 0.00 35.03 33.85 1v62 n LYS 23 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1v62 s THR 24 N -3.19 4.17 -0.09 0.58 -4.23 -1.26 -4.81 115.64 106.80 1v62 s THR 24 Ca 0.63 2.03 -0.35 0.00 -1.18 0.00 0.00 61.69 62.82 1v62 s THR 24 Cb -0.02 -4.30 -0.13 0.00 1.34 0.00 0.00 72.50 69.39 1v62 s THR 24 CO 0.43 0.48 1.81 -2.65 -0.54 0.00 0.00 174.62 174.16 1v62 n PRO 25 N 1.66 1.98 -2.94 3.99 -0.02 -1.26 -1.26 135.00 137.14 1v62 n PRO 25 Ca -0.02 0.72 -0.22 0.00 -2.02 0.00 0.00 63.50 61.97 1v62 n PRO 25 Cb 0.48 -2.53 0.02 0.00 -0.02 0.00 0.00 33.50 31.44 1v62 n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1v62 n GLY 26 N 4.21 -0.51 3.46 -1.23 0.00 -1.26 -4.98 105.19 104.89 1v62 n GLY 26 Ca 0.23 0.10 -0.27 0.00 0.00 0.00 0.00 46.02 46.07 1v62 n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v62 s SER 27 N -2.56 3.65 -0.26 1.61 0.01 -0.39 -5.12 113.70 110.64 1v62 s SER 27 Ca 0.25 -0.79 -0.07 0.00 1.31 0.00 0.00 55.95 56.65 1v62 s SER 27 Cb -0.12 -0.38 -0.01 0.00 0.21 0.00 0.00 66.02 65.72 1v62 s SER 27 CO 0.31 0.12 0.07 0.00 0.41 0.00 0.00 173.24 174.14 1v62 s ALA 28 N -1.68 3.11 -0.00 1.44 0.00 -1.26 -4.75 121.76 118.61 1v62 s ALA 28 Ca 0.22 -1.25 -0.11 0.00 0.00 0.00 0.00 51.96 50.82 1v62 s ALA 28 Cb -0.08 -2.09 -0.06 0.00 0.00 0.00 0.00 23.12 20.89 1v62 s ALA 28 CO 0.11 -0.64 0.79 -0.07 0.00 0.00 0.00 175.76 175.95 1v62 h LEU 29 N 8.23 -0.35 0.00 0.00 3.38 -1.95 -3.49 115.31 121.13 1v62 h LEU 29 Ca -0.36 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1v62 h LEU 29 Cb 1.16 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1v62 h LEU 29 CO 0.59 -0.15 0.00 0.61 0.09 0.00 0.00 178.44 179.58 1v62 n GLY 30 N -0.09 0.42 3.72 0.83 0.00 -1.26 -4.83 105.19 103.97 1v62 n GLY 30 Ca -0.05 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 45.09 1v62 n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1v62 s ILE 31 N 0.00 5.35 -0.27 -0.61 1.01 -1.26 -2.46 121.20 122.96 1v62 s ILE 31 Ca 0.00 0.36 -0.10 0.00 0.00 0.00 0.00 60.65 60.91 1v62 s ILE 31 Cb 0.00 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.88 1v62 s ILE 31 CO 0.00 0.40 0.15 -0.44 0.00 0.00 0.00 174.94 175.05 1v62 s SER 32 N 0.54 5.70 0.25 3.58 0.01 -0.83 -5.02 113.70 117.94 1v62 s SER 32 Ca 0.12 -0.12 0.00 0.00 1.31 0.00 0.00 55.95 57.26 1v62 s SER 32 Cb -0.12 -2.05 -0.04 0.00 0.21 0.00 0.00 66.02 64.02 1v62 s SER 32 CO 0.02 -0.06 0.44 -0.76 0.41 0.00 0.00 173.24 173.29 1v62 s LEU 33 N 1.70 4.17 -0.17 2.44 1.43 -1.26 0.23 118.68 127.22 1v62 s LEU 33 Ca 0.07 0.39 -0.05 0.00 -1.03 0.00 0.00 54.13 53.51 1v62 s LEU 33 Cb -0.16 -3.19 0.08 0.00 0.03 0.00 0.00 46.19 42.96 1v62 s LEU 33 CO 0.08 -0.13 0.31 0.28 0.23 0.00 0.00 176.35 177.12 1v62 s THR 34 N -2.02 -0.48 0.09 5.49 -1.32 0.18 -4.59 115.64 112.98 1v62 s THR 34 Ca 0.39 0.15 -0.21 0.00 -1.21 0.00 0.00 61.69 60.80 1v62 s THR 34 Cb -0.10 -0.58 -0.07 0.00 -1.51 0.00 0.00 72.50 70.24 1v62 s THR 34 CO 0.31 0.03 0.62 0.28 -2.21 0.00 0.00 174.62 173.65 1v62 s THR 35 N 2.47 4.66 0.43 5.08 -1.32 -1.26 -1.06 115.64 124.64 1v62 s THR 35 Ca 0.03 1.34 0.00 0.00 -1.21 0.00 0.00 61.69 61.86 1v62 s THR 35 Cb -0.13 -3.96 -0.00 0.00 -1.51 0.00 0.00 72.50 66.90 1v62 s THR 35 CO -0.11 0.53 0.01 0.35 -2.21 0.00 0.00 174.62 173.20 1v62 n THR 36 N 1.79 0.00 -4.24 5.08 -2.24 -0.01 -4.94 114.28 109.72 1v62 n THR 36 Ca -0.09 -2.05 -0.27 0.00 -2.27 0.00 0.00 64.05 59.37 1v62 n THR 36 Cb 0.50 0.44 -0.06 0.00 -2.10 0.00 0.00 70.33 69.12 1v62 n THR 36 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1v62 s SER 37 N -3.37 4.38 0.00 3.42 0.01 -1.26 -1.94 113.70 114.94 1v62 s SER 37 Ca 0.02 -1.27 0.00 0.00 1.31 0.00 0.00 55.95 56.01 1v62 s SER 37 Cb 0.00 -0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.21 1v62 s SER 37 CO 0.01 -0.75 0.00 0.18 0.41 0.00 0.00 173.24 173.09 1v62 n LEU 38 N -1.36 0.00 0.00 2.44 4.77 -1.26 -4.85 117.00 116.73 1v62 n LEU 38 Ca -0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1v62 n LEU 38 Cb 0.65 0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.97 1v62 n LEU 38 CO 0.43 -0.32 0.00 -1.14 -1.33 0.00 0.00 177.39 175.03 1v62 n ARG 39 N -2.14 0.00 -1.25 3.23 0.63 -1.26 -4.99 116.66 110.88 1v62 n ARG 39 Ca 0.00 0.00 -0.06 0.00 -0.92 0.00 0.00 57.85 56.87 1v62 n ARG 39 Cb 0.00 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 32.87 1v62 n ARG 39 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1v62 n ASN 40 N -1.91 -1.00 -3.15 6.15 5.03 -1.26 -5.07 115.26 114.05 1v62 n ASN 40 Ca 0.00 -2.03 0.05 0.00 0.87 0.00 0.00 54.58 53.47 1v62 n ASN 40 Cb 0.00 0.33 -0.00 0.00 -1.02 0.00 0.00 39.78 39.09 1v62 n ASN 40 CO 0.00 0.00 0.00 -0.75 -1.83 0.00 0.00 177.26 174.68 1v62 s LYS 41 N 0.00 0.36 -0.00 3.52 2.36 -1.26 -5.12 119.74 119.60 1v62 s LYS 41 Ca 0.02 0.40 -0.30 0.00 -2.55 0.00 0.00 55.97 53.54 1v62 s LYS 41 Cb 0.07 0.19 -0.05 0.00 -1.05 0.00 0.00 37.83 37.00 1v62 s LYS 41 CO -0.02 -0.63 1.35 -1.54 1.55 0.00 0.00 175.35 176.06 1v62 s SER 42 N 2.89 6.90 -0.17 1.43 1.04 -1.26 -4.32 113.70 120.22 1v62 s SER 42 Ca 0.17 2.06 -0.08 0.00 0.48 0.00 0.00 55.95 58.58 1v62 s SER 42 Cb -0.07 -2.56 -0.04 0.00 0.10 0.00 0.00 66.02 63.44 1v62 s SER 42 CO -0.23 -0.68 0.11 0.54 0.98 0.00 0.00 173.24 173.96 1v62 s VAL 43 N 2.25 5.23 -0.24 5.02 0.11 -0.82 -4.34 120.40 127.61 1v62 s VAL 43 Ca 0.62 0.12 -0.23 0.00 -2.93 0.00 0.00 61.98 59.56 1v62 s VAL 43 Cb -0.30 -3.34 -0.01 0.00 -1.53 0.00 0.00 36.38 31.20 1v62 s VAL 43 CO 0.26 0.50 0.73 -0.63 -3.33 0.00 0.00 175.10 172.64 1v62 s ILE 44 N -0.10 4.91 0.41 7.04 1.09 -1.26 -0.83 121.20 132.46 1v62 s ILE 44 Ca 0.09 1.37 0.01 0.00 -1.10 0.00 0.00 60.65 61.02 1v62 s ILE 44 Cb -0.12 -4.03 -0.00 0.00 -1.06 0.00 0.00 42.46 37.25 1v62 s ILE 44 CO 0.00 -0.01 0.04 0.35 -0.10 0.00 0.00 174.94 175.22 1v62 n THR 45 N 5.16 0.00 -3.50 2.92 -2.24 -0.22 -2.32 114.28 114.08 1v62 n THR 45 Ca 0.03 -2.06 -0.37 0.00 -2.27 0.00 0.00 64.05 59.38 1v62 n THR 45 Cb 0.48 0.52 -0.07 0.00 -2.10 0.00 0.00 70.33 69.16 1v62 n THR 45 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1v62 s ILE 46 N -2.67 5.25 -0.05 2.28 1.01 -1.08 0.48 121.20 126.42 1v62 s ILE 46 Ca 0.06 0.67 -0.03 0.00 0.00 0.00 0.00 60.65 61.35 1v62 s ILE 46 Cb 0.00 -3.67 -0.01 0.00 0.01 0.00 0.00 42.46 38.79 1v62 s ILE 46 CO 0.04 0.42 -0.05 -0.78 0.00 0.00 0.00 174.94 174.57 1v62 h ASP 47 N 6.29 0.00 -5.13 3.58 3.58 -0.47 -1.98 116.42 122.29 1v62 h ASP 47 Ca -0.43 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 56.98 1v62 h ASP 47 Cb 1.18 0.00 -0.10 0.00 1.72 0.00 0.00 39.33 42.13 1v62 h ASP 47 CO 0.72 0.26 -0.05 -0.13 -2.88 0.00 0.00 179.24 177.16 1v62 s ARG 48 N -1.40 1.36 0.25 0.28 0.52 -1.14 -4.55 118.95 114.28 1v62 s ARG 48 Ca -0.04 -0.96 0.08 0.00 -0.52 0.00 0.00 55.73 54.29 1v62 s ARG 48 Cb 0.01 0.49 -0.04 0.00 0.52 0.00 0.00 34.95 35.92 1v62 s ARG 48 CO 0.06 -0.56 0.08 0.42 0.02 0.00 0.00 175.30 175.31 1v62 s ILE 49 N -3.91 3.87 0.18 1.52 1.09 -1.26 -1.96 121.20 120.72 1v62 s ILE 49 Ca 0.12 -1.67 -0.23 0.00 -1.10 0.00 0.00 60.65 57.76 1v62 s ILE 49 Cb -0.00 -3.07 -0.08 0.00 -1.06 0.00 0.00 42.46 38.25 1v62 s ILE 49 CO -0.01 -0.34 0.75 -0.54 -0.10 0.00 0.00 174.94 174.69 1v62 s LYS 50 N -3.68 4.45 0.38 2.79 3.01 -1.03 -4.98 119.74 120.68 1v62 s LYS 50 Ca 0.32 1.05 -0.26 0.00 -1.01 0.00 0.00 55.97 56.06 1v62 s LYS 50 Cb -0.07 -3.14 -0.09 0.00 -1.01 0.00 0.00 37.83 33.52 1v62 s LYS 50 CO 0.22 0.52 1.17 -1.25 0.51 0.00 0.00 175.35 176.52 1v62 s PRO 51 N -1.40 4.14 -1.67 -1.68 0.04 -1.26 -3.17 135.00 130.00 1v62 s PRO 51 Ca 0.37 1.85 -0.02 0.00 0.04 0.00 0.00 61.00 63.25 1v62 s PRO 51 Cb -0.21 -2.75 0.00 0.00 0.04 0.00 0.00 34.50 31.58 1v62 s PRO 51 CO 0.24 -0.25 0.22 0.00 0.04 0.00 0.00 177.00 177.25 1v62 n ALA 52 N 0.23 -0.73 -2.36 8.56 0.00 -1.26 -4.99 120.51 119.96 1v62 n ALA 52 Ca 0.03 0.21 -0.22 0.00 0.00 0.00 0.00 53.44 53.47 1v62 n ALA 52 Cb 0.46 -2.79 -0.04 0.00 0.00 0.00 0.00 19.45 17.08 1v62 n ALA 52 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1v62 s SER 53 N -2.31 5.02 0.40 0.00 0.15 -1.19 -4.96 113.70 110.81 1v62 s SER 53 Ca 0.11 -0.71 0.12 0.00 0.70 0.00 0.00 55.95 56.18 1v62 s SER 53 Cb -0.05 -0.70 0.84 0.00 -1.71 0.00 0.00 66.02 64.40 1v62 s SER 53 CO 0.14 -0.51 1.91 0.58 1.20 0.00 0.00 173.24 176.56 1v62 h VAL 54 N 1.19 1.19 0.08 4.45 2.07 -1.88 0.20 116.25 123.54 1v62 h VAL 54 Ca -0.43 -0.88 -0.27 0.00 0.82 0.00 0.00 66.70 65.95 1v62 h VAL 54 Cb 1.26 1.41 0.01 0.00 -1.52 0.00 0.00 31.29 32.45 1v62 h VAL 54 CO 0.59 0.26 -1.14 0.58 0.02 0.00 0.00 177.57 177.89 1v62 h VAL 55 N 0.07 1.39 0.05 2.57 2.07 -1.94 -0.93 116.25 119.54 1v62 h VAL 55 Ca 0.01 -2.63 -0.25 0.00 0.82 0.00 0.00 66.70 64.65 1v62 h VAL 55 Cb 0.45 2.67 0.01 0.00 -1.52 0.00 0.00 31.29 32.89 1v62 h VAL 55 CO 0.03 0.78 -1.06 -0.78 0.02 0.00 0.00 177.57 176.56 1v62 h ASP 56 N 0.20 0.56 0.24 0.57 1.82 -1.68 -0.73 116.42 117.39 1v62 h ASP 56 Ca -0.13 -0.49 -0.26 0.00 -0.39 0.00 0.00 57.03 55.75 1v62 h ASP 56 Cb 1.81 -0.17 0.02 0.00 0.68 0.00 0.00 39.33 41.66 1v62 h ASP 56 CO 0.20 1.32 -1.09 0.03 -1.61 0.00 0.00 179.24 178.09 1v62 h ARG 57 N 0.20 0.52 0.01 0.28 3.08 -0.70 -3.29 114.38 114.50 1v62 h ARG 57 Ca -0.11 -0.63 -0.22 0.00 0.07 0.00 0.00 59.98 59.08 1v62 h ARG 57 Cb 1.73 0.20 -0.00 0.00 0.08 0.00 0.00 29.97 31.97 1v62 h ARG 57 CO 0.19 1.25 -0.95 1.03 -1.07 0.00 0.00 179.97 180.41 1v62 h SER 58 N 0.26 0.44 -2.64 7.04 0.87 -1.24 -3.48 113.55 114.80 1v62 h SER 58 Ca -0.13 -0.37 -0.13 0.00 -1.23 0.00 0.00 61.79 59.93 1v62 h SER 58 Cb 1.75 -0.14 0.05 0.00 -0.44 0.00 0.00 62.40 63.62 1v62 h SER 58 CO 0.20 1.18 -0.22 0.61 -0.53 0.00 0.00 176.83 178.07 1v62 n GLY 59 N 0.99 0.44 0.08 5.77 0.00 -0.29 -4.99 105.19 107.19 1v62 n GLY 59 Ca -0.06 -0.37 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 1v62 n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v62 h ALA 60 N 0.33 0.08 -2.46 4.61 0.00 -1.87 -3.48 119.26 116.47 1v62 h ALA 60 Ca -0.19 -0.68 -0.52 0.00 0.00 0.00 0.00 54.91 53.52 1v62 h ALA 60 Cb 1.12 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 19.41 1v62 h ALA 60 CO 0.18 0.52 0.03 -0.51 0.00 0.00 0.00 179.25 179.47 1v62 s LEU 61 N -8.14 4.21 -0.00 0.00 1.43 -1.26 -4.77 118.68 110.15 1v62 s LEU 61 Ca -0.18 1.22 -0.01 0.00 -1.03 0.00 0.00 54.13 54.13 1v62 s LEU 61 Cb 0.03 -3.72 -0.00 0.00 0.03 0.00 0.00 46.19 42.53 1v62 s LEU 61 CO 0.33 -0.06 0.01 -1.00 0.23 0.00 0.00 176.35 175.86 1v62 s HIS 62 N -1.73 0.01 -0.29 0.29 3.76 -1.26 -4.93 115.29 111.14 1v62 s HIS 62 Ca 0.47 -0.01 -0.33 0.00 -0.15 0.00 0.00 55.06 55.03 1v62 s HIS 62 Cb -0.13 -0.01 -0.10 0.00 1.11 0.00 0.00 32.58 33.45 1v62 s HIS 62 CO 0.19 -0.03 2.17 -2.30 -0.85 0.00 0.00 174.74 173.92 1v62 n PRO 63 N 2.92 1.40 0.00 8.40 -0.02 -1.26 -1.40 135.00 145.04 1v62 n PRO 63 Ca -0.13 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1v62 n PRO 63 Cb 0.59 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 1v62 n PRO 63 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1v62 n GLY 64 N 6.13 1.91 3.67 -1.23 0.00 -0.74 -5.00 105.19 109.93 1v62 n GLY 64 Ca 0.36 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.91 1v62 n GLY 64 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1v62 n ASP 65 N 0.00 3.17 -4.53 1.61 9.92 -0.49 -4.71 116.55 121.51 1v62 n ASP 65 Ca 0.00 1.04 -0.43 0.00 -0.53 0.00 0.00 54.79 54.87 1v62 n ASP 65 Cb 0.00 -1.39 -0.04 0.00 -0.64 0.00 0.00 41.12 39.05 1v62 n ASP 65 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 1v62 s HIS 66 N 2.22 2.73 -0.11 1.24 3.76 -1.26 -2.64 115.29 121.23 1v62 s HIS 66 Ca 0.85 0.06 -0.30 0.00 -0.15 0.00 0.00 55.06 55.52 1v62 s HIS 66 Cb -0.70 -4.20 -0.01 0.00 1.11 0.00 0.00 32.58 28.77 1v62 s HIS 66 CO 0.44 -1.44 1.02 0.42 -0.85 0.00 0.00 174.74 174.33 1v62 s ILE 67 N 4.24 4.74 -0.10 0.60 1.01 -0.98 0.03 121.20 130.74 1v62 s ILE 67 Ca 0.33 2.01 0.15 0.00 0.00 0.00 0.00 60.65 63.15 1v62 s ILE 67 Cb -0.11 -4.29 -0.22 0.00 0.01 0.00 0.00 42.46 37.84 1v62 s ILE 67 CO 0.20 -0.00 0.18 0.18 0.00 0.00 0.00 174.94 175.50 1v62 n LEU 68 N 5.06 0.00 -3.46 2.97 4.77 0.41 -4.53 117.00 122.22 1v62 n LEU 68 Ca 0.09 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.96 1v62 n LEU 68 Cb 0.48 0.23 -0.02 0.00 -2.33 0.00 0.00 43.42 41.79 1v62 n LEU 68 CO 0.52 0.23 0.50 -0.94 -1.33 0.00 0.00 177.39 176.38 1v62 s SER 69 N -4.54 -0.51 -0.15 -1.43 1.04 -0.91 -1.59 113.70 105.61 1v62 s SER 69 Ca -0.07 0.06 -0.04 0.00 0.48 0.00 0.00 55.95 56.38 1v62 s SER 69 Cb 0.07 0.52 0.07 0.00 0.10 0.00 0.00 66.02 66.78 1v62 s SER 69 CO 0.66 -0.82 0.18 -0.63 0.98 0.00 0.00 173.24 173.61 1v62 s ILE 70 N -3.31 -0.27 -1.73 -1.02 1.01 -0.20 0.68 121.20 116.36 1v62 s ILE 70 Ca 0.01 0.09 -0.00 0.00 0.00 0.00 0.00 60.65 60.75 1v62 s ILE 70 Cb -0.01 -0.50 0.00 0.00 0.01 0.00 0.00 42.46 41.97 1v62 s ILE 70 CO -0.10 -0.05 0.03 -0.67 0.00 0.00 0.00 174.94 174.15 1v62 n ASP 71 N 5.32 -5.81 0.00 3.58 2.03 0.11 -0.97 116.55 120.80 1v62 n ASP 71 Ca -0.05 -0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.24 1v62 n ASP 71 Cb 0.50 -4.83 0.00 0.00 -0.72 0.00 0.00 41.12 36.06 1v62 n ASP 71 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1v62 n GLY 72 N -1.03 0.73 3.63 0.27 0.00 -1.26 -5.04 105.19 102.47 1v62 n GLY 72 Ca -0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.41 1v62 n GLY 72 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v62 s THR 73 N -2.13 5.32 0.37 2.61 2.01 -0.14 -5.07 115.64 118.61 1v62 s THR 73 Ca 0.00 0.17 -0.28 0.00 0.31 0.00 0.00 61.69 61.89 1v62 s THR 73 Cb 0.00 -3.51 -0.10 0.00 0.01 0.00 0.00 72.50 68.90 1v62 s THR 73 CO 0.00 0.30 1.36 -0.55 -0.69 0.00 0.00 174.62 175.04 1v62 s SER 74 N 1.38 6.51 -0.50 3.53 0.15 -1.26 -1.03 113.70 122.47 1v62 s SER 74 Ca 0.07 2.79 0.02 0.00 0.70 0.00 0.00 55.95 59.54 1v62 s SER 74 Cb -0.15 -2.65 0.54 0.00 -1.71 0.00 0.00 66.02 62.05 1v62 s SER 74 CO 0.07 -0.73 1.84 0.23 1.20 0.00 0.00 173.24 175.85 1v62 n MET 75 N 0.50 2.49 -3.02 5.44 2.81 -0.62 -4.85 117.12 119.88 1v62 n MET 75 Ca 0.01 -3.26 -0.42 0.00 -1.81 0.00 0.00 57.70 52.22 1v62 n MET 75 Cb 0.41 -2.18 -0.06 0.00 -0.71 0.00 0.00 33.22 30.68 1v62 n MET 75 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1v62 s GLU 76 N -3.54 3.54 -1.65 0.03 2.12 -1.26 -4.01 118.70 113.92 1v62 s GLU 76 Ca 0.58 -0.01 -0.02 0.00 0.36 0.00 0.00 54.97 55.88 1v62 s GLU 76 Cb 0.48 -3.88 0.00 0.00 0.26 0.00 0.00 34.13 30.99 1v62 s GLU 76 CO 0.04 -0.95 0.32 0.72 -0.54 0.00 0.00 175.26 174.85 1v62 n HIS 77 N 6.42 -1.49 -2.68 5.30 8.25 -1.26 -4.98 115.22 124.79 1v62 n HIS 77 Ca 0.01 0.27 -0.27 0.00 -0.26 0.00 0.00 57.72 57.47 1v62 n HIS 77 Cb 0.48 -4.23 0.00 0.00 1.12 0.00 0.00 29.99 27.37 1v62 n HIS 77 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1v62 s SER 79 N -4.14 4.47 -0.12 0.00 0.01 -1.26 -4.87 113.70 107.79 1v62 s SER 79 Ca 0.48 -0.64 -0.28 0.00 1.31 0.00 0.00 55.95 56.82 1v62 s SER 79 Cb -0.10 0.29 -0.26 0.00 0.21 0.00 0.00 66.02 66.16 1v62 s SER 79 CO 0.44 -1.79 0.84 0.25 0.41 0.00 0.00 173.24 173.38 1v62 h LEU 80 N -0.36 0.03 -0.19 2.44 5.85 -1.98 -2.82 115.31 118.29 1v62 h LEU 80 Ca -0.32 -0.94 0.00 0.00 0.84 0.00 0.00 57.88 57.46 1v62 h LEU 80 Cb 1.27 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 1v62 h LEU 80 CO 0.38 0.97 0.12 -0.07 -0.34 0.00 0.00 178.44 179.50 1v62 h LEU 81 N -0.90 0.22 -1.26 2.25 3.38 -1.98 0.10 115.31 117.12 1v62 h LEU 81 Ca -0.01 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1v62 h LEU 81 Cb 0.98 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.64 1v62 h LEU 81 CO 0.01 0.17 0.45 -0.08 0.09 0.00 0.00 178.44 179.09 1v62 h GLU 82 N 0.24 0.95 -0.15 1.13 4.81 -1.98 0.26 114.58 119.84 1v62 h GLU 82 Ca 0.07 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 1v62 h GLU 82 Cb -0.01 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.16 1v62 h GLU 82 CO -0.01 0.65 -0.23 0.00 -0.73 0.00 0.00 179.01 178.68 1v62 h ALA 83 N 1.53 0.23 -0.01 2.92 0.00 -1.18 -3.15 119.26 119.61 1v62 h ALA 83 Ca 0.26 -0.38 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 1v62 h ALA 83 Cb -0.08 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1v62 h ALA 83 CO -0.05 0.20 -0.45 1.15 0.00 0.00 0.00 179.25 180.10 1v62 h THR 84 N 0.05 1.32 -0.94 0.00 2.02 -0.48 -2.96 112.91 111.93 1v62 h THR 84 Ca 0.01 -1.54 0.02 0.00 0.77 0.00 0.00 66.41 65.68 1v62 h THR 84 Cb 0.81 1.82 -0.05 0.00 -1.74 0.00 0.00 68.15 68.99 1v62 h THR 84 CO 0.05 0.44 0.62 0.11 0.37 0.00 0.00 175.52 177.12 1v62 h LYS 85 N 0.02 1.20 -0.35 6.66 1.57 -0.45 -2.42 116.57 122.80 1v62 h LYS 85 Ca -0.00 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1v62 h LYS 85 Cb 0.80 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 1v62 h LYS 85 CO 0.06 0.79 0.20 -0.07 -0.57 0.00 0.00 179.45 179.86 1v62 h LEU 86 N 1.23 0.43 -1.86 2.94 3.38 -1.48 -2.14 115.31 117.81 1v62 h LEU 86 Ca 0.36 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.27 1v62 h LEU 86 Cb -0.07 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1v62 h LEU 86 CO -0.10 0.38 0.14 -0.07 0.09 0.00 0.00 178.44 178.88 1v62 h LEU 87 N 0.44 0.16 -0.77 1.67 3.38 -1.50 -1.03 115.31 117.67 1v62 h LEU 87 Ca 0.12 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 1v62 h LEU 87 Cb 0.04 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1v62 h LEU 87 CO -0.02 0.11 -0.60 0.00 0.09 0.00 0.00 178.44 178.03 1v62 h ALA 88 N 1.88 0.98 -2.50 1.53 0.00 -0.97 -3.36 119.26 116.82 1v62 h ALA 88 Ca 0.08 -0.54 -0.79 0.00 0.00 0.00 0.00 54.91 53.66 1v62 h ALA 88 Cb 0.09 -0.09 -0.27 0.00 0.00 0.00 0.00 17.79 17.52 1v62 h ALA 88 CO -0.01 0.74 0.51 -1.12 0.00 0.00 0.00 179.25 179.37 1v62 s SER 89 N -6.87 7.26 0.02 0.00 0.01 -0.39 -4.95 113.70 108.79 1v62 s SER 89 Ca -0.02 -3.46 0.03 0.00 1.31 0.00 0.00 55.95 53.80 1v62 s SER 89 Cb 0.13 -2.23 -0.02 0.00 0.21 0.00 0.00 66.02 64.11 1v62 s SER 89 CO 0.77 -0.36 -0.09 -0.63 0.41 0.00 0.00 173.24 173.34 1v62 s ILE 90 N -0.87 0.69 -0.01 1.44 -1.09 -1.26 -4.92 121.20 115.18 1v62 s ILE 90 Ca 0.31 -0.75 -0.03 0.00 -2.23 0.00 0.00 60.65 57.95 1v62 s ILE 90 Cb -0.09 -0.65 -0.02 0.00 -1.58 0.00 0.00 42.46 40.12 1v62 s ILE 90 CO -0.07 -0.07 0.36 -1.28 -1.23 0.00 0.00 174.94 172.65 1v62 h SER 91 N 5.19 -0.09 0.00 3.58 0.87 -1.96 -3.40 113.55 117.75 1v62 h SER 91 Ca -0.34 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.23 1v62 h SER 91 Cb 1.19 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.17 1v62 h SER 91 CO 0.45 0.02 0.00 1.21 -0.53 0.00 0.00 176.83 177.98 1v62 n GLU 92 N -2.70 0.00 -3.46 2.24 2.13 -1.26 -4.08 120.64 113.50 1v62 n GLU 92 Ca -0.01 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.43 1v62 n GLU 92 Cb 0.04 -0.08 -0.08 0.00 0.27 0.00 0.00 31.44 31.59 1v62 n GLU 92 CO 0.00 0.00 0.00 -1.59 -0.41 0.00 0.00 177.13 175.13 1v62 s LYS 93 N -1.46 4.17 -0.47 5.31 -2.85 -1.26 -2.36 119.74 120.83 1v62 s LYS 93 Ca 0.00 0.10 -0.28 0.00 -1.00 0.00 0.00 55.97 54.79 1v62 s LYS 93 Cb 0.00 -3.52 0.03 0.00 -2.06 0.00 0.00 37.83 32.28 1v62 s LYS 93 CO 0.00 0.03 1.10 0.54 0.10 0.00 0.00 175.35 177.11 1v62 s VAL 94 N 1.12 4.27 -1.06 1.79 0.11 -0.80 -4.78 120.40 121.05 1v62 s VAL 94 Ca 0.17 1.17 -0.22 0.00 -2.93 0.00 0.00 61.98 60.16 1v62 s VAL 94 Cb -0.14 -4.57 0.03 0.00 -1.53 0.00 0.00 36.38 30.17 1v62 s VAL 94 CO 0.07 -0.96 1.63 -0.13 -3.33 0.00 0.00 175.10 172.38 1v62 s ARG 95 N 4.30 3.39 -0.52 1.54 0.52 -1.26 -2.93 118.95 123.99 1v62 s ARG 95 Ca 0.46 -1.12 -0.17 0.00 -0.52 0.00 0.00 55.73 54.38 1v62 s ARG 95 Cb -0.08 -5.33 0.08 0.00 0.52 0.00 0.00 34.95 30.15 1v62 s ARG 95 CO 0.30 -2.56 0.54 -0.51 0.02 0.00 0.00 175.30 173.10 1v62 s LEU 96 N 6.21 5.44 -0.50 2.53 1.43 -1.20 0.06 118.68 132.65 1v62 s LEU 96 Ca 0.53 -1.27 -0.28 0.00 -1.03 0.00 0.00 54.13 52.08 1v62 s LEU 96 Cb -0.01 -2.30 0.03 0.00 0.03 0.00 0.00 46.19 43.95 1v62 s LEU 96 CO -0.04 -0.85 1.12 -0.70 0.23 0.00 0.00 176.35 176.12 1v62 s GLU 97 N 2.16 3.66 0.15 1.70 2.12 0.21 -1.65 118.70 127.05 1v62 s GLU 97 Ca 0.09 0.45 0.11 0.00 0.36 0.00 0.00 54.97 55.97 1v62 s GLU 97 Cb -0.23 -3.93 -0.04 0.00 0.26 0.00 0.00 34.13 30.18 1v62 s GLU 97 CO 0.08 -1.42 -0.25 0.42 -0.54 0.00 0.00 175.26 173.55 1v62 s ILE 98 N 4.45 2.22 0.38 -3.70 1.01 -0.70 -0.45 121.20 124.42 1v62 s ILE 98 Ca 0.46 -1.85 -0.27 0.00 0.00 0.00 0.00 60.65 58.98 1v62 s ILE 98 Cb -0.08 -2.00 -0.10 0.00 0.01 0.00 0.00 42.46 40.30 1v62 s ILE 98 CO 0.30 -0.02 1.41 -0.22 0.00 0.00 0.00 174.94 176.41 1v62 s LEU 99 N -2.31 4.29 -0.87 2.97 2.96 0.10 -0.11 118.68 125.71 1v62 s LEU 99 Ca 0.16 2.89 -0.19 0.00 -0.22 0.00 0.00 54.13 56.77 1v62 s LEU 99 Cb -0.09 -3.75 -0.22 0.00 0.50 0.00 0.00 46.19 42.63 1v62 s LEU 99 CO 0.07 -0.85 2.32 -2.65 -1.32 0.00 0.00 176.35 173.92 1v62 n PRO 100 N 0.36 0.33 -4.23 0.98 -0.02 -1.26 -4.77 135.00 126.39 1v62 n PRO 100 Ca 0.02 -0.42 -0.27 0.00 -2.02 0.00 0.00 63.50 60.81 1v62 n PRO 100 Cb 0.41 -2.48 -0.08 0.00 -0.02 0.00 0.00 33.50 31.33 1v62 n PRO 100 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1v62 s VAL 101 N 8.36 3.54 0.25 -1.45 -7.23 -1.26 -5.03 120.40 117.58 1v62 s VAL 101 Ca 1.11 -1.44 0.17 0.00 -1.81 0.00 0.00 61.98 60.01 1v62 s VAL 101 Cb -0.48 -2.75 0.11 0.00 0.56 0.00 0.00 36.38 33.82 1v62 s VAL 101 CO 0.31 -0.06 1.76 1.55 -0.31 0.00 0.00 175.10 178.35 1v62 h PRO 102 N 2.94 0.00 -0.46 4.82 0.13 -2.03 -3.04 132.00 134.36 1v62 h PRO 102 Ca -0.47 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.67 1v62 h PRO 102 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1v62 h PRO 102 CO 0.56 0.40 0.31 1.96 -0.23 0.00 0.00 178.00 180.99 1v62 h GLN 103 N 0.00 0.56 -3.02 0.86 7.50 -1.97 -3.42 115.11 115.62 1v62 h GLN 103 Ca -0.00 -0.03 -0.17 0.00 0.50 0.00 0.00 58.65 58.95 1v62 h GLN 103 Cb 0.83 -0.13 -0.27 0.00 0.05 0.00 0.00 27.48 27.97 1v62 h GLN 103 CO 0.05 0.37 -0.42 0.45 -1.50 0.00 0.00 178.83 177.79 1v62 s SER 104 N -6.61 -0.30 -0.29 1.46 0.15 -1.15 -5.00 113.70 101.97 1v62 s SER 104 Ca -0.08 0.57 0.13 0.00 0.70 0.00 0.00 55.95 57.26 1v62 s SER 104 Cb 0.18 0.53 0.37 0.00 -1.71 0.00 0.00 66.02 65.39 1v62 s SER 104 CO 0.74 -0.13 1.43 1.67 1.20 0.00 0.00 173.24 178.15 1v62 n GLN 105 N 3.46 1.23 -3.57 5.44 -0.06 -1.26 -4.00 117.38 118.62 1v62 n GLN 105 Ca -0.18 -1.46 -0.40 0.00 -2.00 0.00 0.00 57.00 52.96 1v62 n GLN 105 Cb 0.56 0.20 -0.09 0.00 -4.06 0.00 0.00 30.24 26.85 1v62 n GLN 105 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 1v62 s ARG 106 N -0.34 2.45 0.13 3.69 3.00 -1.26 -4.98 118.95 121.64 1v62 s ARG 106 Ca 0.10 -1.80 -0.29 0.00 0.00 0.00 0.00 55.73 53.75 1v62 s ARG 106 Cb 0.38 -3.90 -0.05 0.00 0.00 0.00 0.00 34.95 31.38 1v62 s ARG 106 CO -0.11 -1.19 1.58 -1.35 0.00 0.00 0.00 175.30 174.24 1v62 h PRO 107 N 8.38 -0.46 0.00 3.54 0.11 -1.96 -3.40 132.00 138.21 1v62 h PRO 107 Ca -0.20 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.95 1v62 h PRO 107 Cb 1.07 0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1v62 h PRO 107 CO 0.84 -0.31 0.00 1.28 -0.21 0.00 0.00 178.00 179.60 1v62 n LEU 108 N -5.43 0.00 -3.07 2.35 4.32 -1.26 -3.00 117.00 110.91 1v62 n LEU 108 Ca -0.04 0.00 0.02 0.00 -0.02 0.00 0.00 56.01 55.97 1v62 n LEU 108 Cb 0.36 0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 42.16 1v62 n LEU 108 CO 0.12 -0.49 0.25 -0.60 -1.22 0.00 0.00 177.39 175.45 1v62 s ARG 109 N -0.98 0.51 0.00 3.23 3.00 -1.26 -4.83 118.95 118.61 1v62 s ARG 109 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 55.73 54.72 1v62 s ARG 109 Cb 0.00 0.10 0.00 0.00 0.00 0.00 0.00 34.95 35.05 1v62 s ARG 109 CO 0.00 -0.78 0.00 -0.35 0.00 0.00 0.00 175.30 174.17 1v62 n PRO 110 N 4.49 -0.28 -1.17 5.12 -0.04 -1.26 -4.95 135.00 136.91 1v62 n PRO 110 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 1v62 n PRO 110 Cb 0.58 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.04 1v62 n PRO 110 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1v62 n SER 111 N -1.72 -4.69 -2.68 3.54 2.88 -1.26 -5.08 113.62 104.60 1v62 n SER 111 Ca 0.00 0.56 -0.04 0.00 -1.33 0.00 0.00 58.87 58.06 1v62 n SER 111 Cb 0.00 -2.56 0.04 0.00 -0.75 0.00 0.00 64.21 60.95 1v62 n SER 111 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1v62 n SER 112 N 0.72 -1.73 0.02 -3.46 3.41 -1.26 -5.05 113.62 106.28 1v62 n SER 112 Ca 0.00 -1.55 0.00 0.00 -0.26 0.00 0.00 58.87 57.06 1v62 n SER 112 Cb 0.00 0.91 0.00 0.00 -0.26 0.00 0.00 64.21 64.86 1v62 n SER 112 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v62 n GLY 113 N 2.26 -1.60 3.76 5.00 0.00 -1.21 -5.00 105.19 108.40 1v62 n GLY 113 Ca 0.09 0.61 -0.37 0.00 0.00 0.00 0.00 46.02 46.36 1v62 n GLY 113 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v62 s PRO 114 N -1.81 3.31 0.00 1.61 0.04 -1.26 -4.22 135.00 132.67 1v62 s PRO 114 Ca 0.00 1.85 0.00 0.00 0.04 0.00 0.00 61.00 62.89 1v62 s PRO 114 Cb 0.00 -2.15 0.00 0.00 0.04 0.00 0.00 34.50 32.39 1v62 s PRO 114 CO 0.00 -0.94 0.00 0.43 0.04 0.00 0.00 177.00 176.53 1v62 n SER 115 N -1.09 0.00 -4.82 6.66 7.64 -1.26 -4.66 113.62 116.09 1v62 n SER 115 Ca 0.11 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.63 1v62 n SER 115 Cb 0.48 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.61 1v62 n SER 115 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1v62 s SER 116 N -3.10 6.02 0.00 6.43 1.04 -1.26 -5.25 113.70 117.58 1v62 s SER 116 Ca 0.00 0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.79 1v62 s SER 116 Cb 0.00 -1.87 0.00 0.00 0.10 0.00 0.00 66.02 64.25 1v62 s SER 116 CO 0.00 0.39 0.00 0.61 0.98 0.00 0.00 173.24 175.22