#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v62 s SER 2 N 0.00 -0.36 0.37 1.61 1.04 -1.26 -5.16 113.70 109.94 1v62 s SER 2 Ca 0.00 0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.58 1v62 s SER 2 Cb 0.00 0.35 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1v62 s SER 2 CO 0.00 -0.51 0.00 -0.24 0.98 0.00 0.00 173.24 173.47 1v62 n SER 3 N 0.11 -8.44 0.00 7.02 2.88 -1.26 -5.05 113.62 108.89 1v62 n SER 3 Ca -0.09 1.47 0.00 0.00 -1.33 0.00 0.00 58.87 58.92 1v62 n SER 3 Cb 0.60 -4.14 0.00 0.00 -0.75 0.00 0.00 64.21 59.92 1v62 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v62 n GLY 4 N -4.02 0.67 2.86 0.46 0.00 -1.26 -5.07 105.19 98.83 1v62 n GLY 4 Ca 0.01 -0.57 -0.07 0.00 0.00 0.00 0.00 46.02 45.39 1v62 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v62 n SER 5 N 0.00 -7.84 -4.17 1.61 7.64 -1.26 -4.97 113.62 104.63 1v62 n SER 5 Ca 0.00 0.43 -0.39 0.00 1.01 0.00 0.00 58.87 59.92 1v62 n SER 5 Cb 0.00 -5.32 -0.08 0.00 -1.01 0.00 0.00 64.21 57.80 1v62 n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1v62 s SER 6 N -2.65 5.61 0.06 6.43 0.15 -1.26 -4.80 113.70 117.23 1v62 s SER 6 Ca 0.21 -2.47 0.00 0.00 0.70 0.00 0.00 55.95 54.38 1v62 s SER 6 Cb -0.06 -1.95 0.00 0.00 -1.71 0.00 0.00 66.02 62.30 1v62 s SER 6 CO 0.75 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 175.29 1v62 n GLY 7 N 4.09 -0.79 3.64 9.45 0.00 -1.26 -5.16 105.19 115.15 1v62 n GLY 7 Ca 0.03 0.15 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 1v62 n GLY 7 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1v62 s ASP 8 N -3.09 -0.46 -1.17 1.61 -4.77 -1.26 -5.09 116.67 102.44 1v62 s ASP 8 Ca 0.00 0.87 -0.12 0.00 -3.30 0.00 0.00 52.55 50.00 1v62 s ASP 8 Cb 0.00 0.90 0.22 0.00 -1.09 0.00 0.00 42.92 42.95 1v62 s ASP 8 CO 0.00 -0.15 1.30 0.41 0.70 0.00 0.00 175.17 177.43 1v62 n THR 9 N 2.32 4.40 -2.30 2.11 -1.04 -1.26 -4.79 114.28 113.72 1v62 n THR 9 Ca -0.13 -5.03 -0.02 0.00 -2.04 0.00 0.00 64.05 56.83 1v62 n THR 9 Cb 0.56 -2.52 -0.02 0.00 -1.82 0.00 0.00 70.33 66.53 1v62 n THR 9 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1v62 n VAL 10 N 3.71-11.92 -3.27 12.58 0.31 -1.26 -5.07 118.33 113.42 1v62 n VAL 10 Ca 0.31 2.64 -0.04 0.00 -0.01 0.00 0.00 64.34 67.24 1v62 n VAL 10 Cb 0.41 -5.94 -0.05 0.00 -0.91 0.00 0.00 33.84 27.35 1v62 n VAL 10 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1v62 s ALA 11 N -0.55 -1.58 0.05 3.52 0.00 -1.26 -5.05 121.76 116.89 1v62 s ALA 11 Ca -0.12 1.20 -0.00 0.00 0.00 0.00 0.00 51.96 53.04 1v62 s ALA 11 Cb 0.01 -1.92 -0.00 0.00 0.00 0.00 0.00 23.12 21.21 1v62 s ALA 11 CO 0.31 -1.35 -0.01 0.09 0.00 0.00 0.00 175.76 174.81 1v62 n ASN 12 N 5.39 0.64 -2.72 0.00 3.02 -1.26 -5.02 115.26 115.30 1v62 n ASN 12 Ca -0.02 0.08 -0.22 0.00 -0.03 0.00 0.00 54.58 54.39 1v62 n ASN 12 Cb 0.51 -0.21 0.01 0.00 -0.61 0.00 0.00 39.78 39.48 1v62 n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1v62 n ALA 13 N -3.08 -0.81 0.00 5.41 0.00 -1.26 -4.79 120.51 115.98 1v62 n ALA 13 Ca -0.00 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1v62 n ALA 13 Cb 0.01 -3.10 0.00 0.00 0.00 0.00 0.00 19.45 16.37 1v62 n ALA 13 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1v62 n SER 14 N -2.29 0.12 0.00 0.00 2.88 -1.26 -5.03 113.62 108.04 1v62 n SER 14 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 1v62 n SER 14 Cb 0.65 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.11 1v62 n SER 14 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v62 n GLY 15 N 1.92 -0.48 3.48 0.46 0.00 -1.26 -4.88 105.19 104.43 1v62 n GLY 15 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1v62 n GLY 15 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1v62 n PRO 16 N 0.00 -0.08 -4.78 1.61 -0.02 -1.26 -4.62 135.00 125.85 1v62 n PRO 16 Ca 0.00 0.03 -0.33 0.00 -2.02 0.00 0.00 63.50 61.18 1v62 n PRO 16 Cb 0.00 -1.96 -0.14 0.00 -0.02 0.00 0.00 33.50 31.38 1v62 n PRO 16 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1v62 s LEU 17 N -1.82 2.73 -0.65 2.45 2.96 0.72 -4.87 118.68 120.19 1v62 s LEU 17 Ca 0.62 -0.31 -0.22 0.00 -0.22 0.00 0.00 54.13 53.99 1v62 s LEU 17 Cb -0.26 -1.61 0.07 0.00 0.50 0.00 0.00 46.19 44.89 1v62 s LEU 17 CO 0.62 0.18 0.95 -0.04 -1.32 0.00 0.00 176.35 176.74 1v62 s MET 18 N 0.27 3.11 -1.03 1.98 -1.94 -1.26 0.16 119.30 120.59 1v62 s MET 18 Ca -0.09 -0.86 -0.14 0.00 -1.71 0.00 0.00 55.69 52.89 1v62 s MET 18 Cb -0.16 -4.23 0.20 0.00 2.01 0.00 0.00 34.83 32.65 1v62 s MET 18 CO 0.05 -1.80 1.13 0.08 -0.01 0.00 0.00 175.02 174.48 1v62 s VAL 19 N 3.98 5.31 0.46 -6.03 1.01 0.22 -4.69 120.40 120.66 1v62 s VAL 19 Ca 0.21 -2.52 -0.20 0.00 0.00 0.00 0.00 61.98 59.48 1v62 s VAL 19 Cb -0.17 -4.71 -0.10 0.00 0.00 0.00 0.00 36.38 31.40 1v62 s VAL 19 CO 0.10 -1.36 0.98 -1.61 0.00 0.00 0.00 175.10 173.21 1v62 s GLU 20 N 0.88 4.03 -0.15 2.72 2.02 -1.26 -3.53 118.70 123.41 1v62 s GLU 20 Ca 0.32 1.17 -0.04 0.00 0.02 0.00 0.00 54.97 56.43 1v62 s GLU 20 Cb -0.07 -2.14 0.05 0.00 0.10 0.00 0.00 34.13 32.08 1v62 s GLU 20 CO -0.06 -0.21 0.08 0.42 0.02 0.00 0.00 175.26 175.51 1v62 s ILE 21 N -2.20 -0.05 -1.00 -1.63 1.01 -1.17 -4.93 121.20 111.22 1v62 s ILE 21 Ca 0.63 -0.08 -0.24 0.00 0.00 0.00 0.00 60.65 60.96 1v62 s ILE 21 Cb -0.11 -0.53 -0.06 0.00 0.01 0.00 0.00 42.46 41.77 1v62 s ILE 21 CO 0.19 -0.19 1.93 -0.69 0.00 0.00 0.00 174.94 176.18 1v62 s VAL 22 N 2.13 3.49 0.72 2.92 1.01 -1.26 -2.30 120.40 127.11 1v62 s VAL 22 Ca 0.02 -0.58 -0.04 0.00 0.00 0.00 0.00 61.98 61.38 1v62 s VAL 22 Cb -0.15 -4.22 0.15 0.00 0.00 0.00 0.00 36.38 32.15 1v62 s VAL 22 CO -0.08 -0.98 0.99 2.29 0.00 0.00 0.00 175.10 177.32 1v62 n LYS 23 N 8.66 -0.35 -1.72 2.72 2.85 -0.08 -4.98 118.16 125.25 1v62 n LYS 23 Ca 0.42 -2.32 -0.31 0.00 -1.05 0.00 0.00 58.31 55.05 1v62 n LYS 23 Cb 0.47 -0.78 0.04 0.00 -0.65 0.00 0.00 35.03 34.11 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 -3.02 4.10 -0.27 0.58 -4.23 -1.26 -4.71 115.64 106.83 1v62 s THR 24 Ca 0.63 0.74 -0.29 0.00 -1.18 0.00 0.00 61.69 61.59 1v62 s THR 24 Cb -0.03 -3.47 -0.02 0.00 1.34 0.00 0.00 72.50 70.32 1v62 s THR 24 CO 0.42 -0.83 1.60 -2.16 -0.54 0.00 0.00 174.62 173.11 1v62 s PRO 25 N -4.86 3.69 -1.64 3.99 0.04 -1.26 -3.04 135.00 131.92 1v62 s PRO 25 Ca 0.59 1.48 -0.02 0.00 0.04 0.00 0.00 61.00 63.09 1v62 s PRO 25 Cb -0.14 -4.05 0.00 0.00 0.04 0.00 0.00 34.50 30.35 1v62 s PRO 25 CO 0.51 -1.42 0.26 0.41 0.04 0.00 0.00 177.00 176.80 1v62 n GLY 26 N 4.83 -0.47 3.46 0.56 0.00 -1.25 -4.99 105.19 107.33 1v62 n GLY 26 Ca 0.19 0.03 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.36 3.75 -0.16 1.61 0.01 -1.17 -5.13 113.70 110.26 1v62 s SER 27 Ca 0.13 -0.56 -0.10 0.00 1.31 0.00 0.00 55.95 56.73 1v62 s SER 27 Cb -0.06 -0.50 -0.05 0.00 0.21 0.00 0.00 66.02 65.63 1v62 s SER 27 CO 0.16 0.20 0.17 0.00 0.41 0.00 0.00 173.24 174.18 1v62 s ALA 28 N -1.07 3.74 -0.05 1.44 0.00 -1.26 -4.69 121.76 119.87 1v62 s ALA 28 Ca 0.16 -0.62 -0.02 0.00 0.00 0.00 0.00 51.96 51.49 1v62 s ALA 28 Cb -0.10 -2.14 -0.01 0.00 0.00 0.00 0.00 23.12 20.86 1v62 s ALA 28 CO 0.08 0.33 -0.05 -0.07 0.00 0.00 0.00 175.76 176.05 1v62 h LEU 29 N 5.98 0.00 0.00 0.00 3.38 -1.98 -3.50 115.31 119.19 1v62 h LEU 29 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1v62 h LEU 29 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1v62 h LEU 29 CO 0.69 0.28 0.00 0.61 0.09 0.00 0.00 178.44 180.11 1v62 n GLY 30 N 1.78 0.25 3.71 0.83 0.00 -1.26 -4.83 105.19 105.66 1v62 n GLY 30 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.29 4.94 -0.22 -0.61 1.01 -1.26 -2.60 121.20 122.17 1v62 s ILE 31 Ca 0.00 1.75 -0.04 0.00 0.00 0.00 0.00 60.65 62.37 1v62 s ILE 31 Cb 0.00 -4.18 -0.01 0.00 0.01 0.00 0.00 42.46 38.28 1v62 s ILE 31 CO 0.00 0.17 -0.04 -0.44 0.00 0.00 0.00 174.94 174.63 1v62 s SER 32 N 0.95 4.33 0.28 3.58 0.01 -0.54 -5.04 113.70 117.27 1v62 s SER 32 Ca 0.44 -0.38 0.06 0.00 1.31 0.00 0.00 55.95 57.38 1v62 s SER 32 Cb -0.19 -1.74 -0.02 0.00 0.21 0.00 0.00 66.02 64.27 1v62 s SER 32 CO 0.21 -0.02 0.38 -0.76 0.41 0.00 0.00 173.24 173.46 1v62 s LEU 33 N 1.48 4.08 -0.25 2.44 1.43 -1.26 0.85 118.68 127.44 1v62 s LEU 33 Ca 0.06 -0.11 -0.02 0.00 -1.03 0.00 0.00 54.13 53.03 1v62 s LEU 33 Cb -0.14 -2.71 0.14 0.00 0.03 0.00 0.00 46.19 43.50 1v62 s LEU 33 CO -0.03 -0.22 0.38 0.28 0.23 0.00 0.00 176.35 176.98 1v62 s THR 34 N -2.10 -0.60 0.40 5.49 -1.32 0.84 -4.42 115.64 113.93 1v62 s THR 34 Ca 0.39 -0.09 -0.18 0.00 -1.21 0.00 0.00 61.69 60.59 1v62 s THR 34 Cb -0.09 -0.83 -0.10 0.00 -1.51 0.00 0.00 72.50 69.97 1v62 s THR 34 CO 0.29 -0.14 0.88 0.42 -2.21 0.00 0.00 174.62 173.86 1v62 s THR 35 N 2.54 4.51 0.28 5.08 -4.23 -1.26 -2.53 115.64 120.04 1v62 s THR 35 Ca 0.12 1.25 0.04 0.00 -1.18 0.00 0.00 61.69 61.92 1v62 s THR 35 Cb -0.15 -3.62 -0.03 0.00 1.34 0.00 0.00 72.50 70.03 1v62 s THR 35 CO -0.17 -0.32 0.21 0.42 -0.54 0.00 0.00 174.62 174.22 1v62 s THR 36 N -2.17 0.04 0.39 3.99 -4.23 -0.70 -4.96 115.64 108.01 1v62 s THR 36 Ca 0.59 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 59.16 1v62 s THR 36 Cb -0.10 -2.50 0.06 0.00 1.34 0.00 0.00 72.50 71.31 1v62 s THR 36 CO 0.17 0.00 0.51 -1.20 -0.54 0.00 0.00 174.62 173.56 1v62 n SER 37 N -1.02 1.54 0.00 3.99 7.64 -1.26 -1.78 113.62 122.73 1v62 n SER 37 Ca 0.05 -2.08 0.00 0.00 1.01 0.00 0.00 58.87 57.84 1v62 n SER 37 Cb 0.64 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 1v62 n SER 37 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1v62 n LEU 38 N 0.00 0.00 0.17 -3.43 4.77 -1.09 -4.77 117.00 112.65 1v62 n LEU 38 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1v62 n LEU 38 Cb 0.41 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1v62 n LEU 38 CO 0.26 -0.22 0.00 0.54 -1.33 0.00 0.00 177.39 176.65 1v62 n ARG 39 N -1.65 0.00 -0.04 3.23 1.74 -1.26 -4.98 116.66 113.71 1v62 n ARG 39 Ca 0.00 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.05 1v62 n ARG 39 Cb 0.00 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.37 1v62 n ARG 39 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1v62 n ASN 40 N -3.30 2.81 -2.45 0.55 3.02 -1.26 -5.07 115.26 109.56 1v62 n ASN 40 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.43 1v62 n ASN 40 Cb 0.00 0.82 -0.05 0.00 -0.61 0.00 0.00 39.78 39.94 1v62 n ASN 40 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1v62 n LYS 41 N -2.26 0.32 -4.71 3.52 5.02 -1.26 -5.18 118.16 113.61 1v62 n LYS 41 Ca -0.13 -2.05 -0.31 0.00 -2.02 0.00 0.00 58.31 53.80 1v62 n LYS 41 Cb 0.71 1.59 -0.09 0.00 -0.02 0.00 0.00 35.03 37.23 1v62 n LYS 41 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1v62 s SER 42 N -2.44 4.00 -0.06 4.39 1.04 -1.26 -2.68 113.70 116.69 1v62 s SER 42 Ca 0.23 -1.56 -0.05 0.00 0.48 0.00 0.00 55.95 55.05 1v62 s SER 42 Cb 0.01 0.21 0.02 0.00 0.10 0.00 0.00 66.02 66.36 1v62 s SER 42 CO 0.16 -0.72 0.16 -0.69 0.98 0.00 0.00 173.24 173.13 1v62 s VAL 43 N -2.84 -0.00 -0.16 5.02 1.01 -0.73 -4.91 120.40 117.79 1v62 s VAL 43 Ca 0.16 0.02 -0.20 0.00 0.00 0.00 0.00 61.98 61.96 1v62 s VAL 43 Cb 0.04 -0.23 -0.03 0.00 0.00 0.00 0.00 36.38 36.16 1v62 s VAL 43 CO 0.08 0.01 0.57 -0.63 0.00 0.00 0.00 175.10 175.13 1v62 s ILE 44 N 0.20 5.09 0.39 2.22 1.09 -1.26 -1.72 121.20 127.21 1v62 s ILE 44 Ca -0.01 1.11 0.03 0.00 -1.10 0.00 0.00 60.65 60.68 1v62 s ILE 44 Cb -0.02 -3.90 -0.01 0.00 -1.06 0.00 0.00 42.46 37.47 1v62 s ILE 44 CO -0.01 0.21 0.10 0.35 -0.10 0.00 0.00 174.94 175.49 1v62 n THR 45 N 4.24 0.00 -3.73 2.92 -2.24 -1.05 -2.90 114.28 111.52 1v62 n THR 45 Ca -0.04 -2.17 -0.36 0.00 -2.27 0.00 0.00 64.05 59.22 1v62 n THR 45 Cb 0.51 0.69 -0.10 0.00 -2.10 0.00 0.00 70.33 69.33 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 -2.88 5.19 -0.08 2.28 1.01 -1.20 -0.11 121.20 125.41 1v62 s ILE 46 Ca 0.14 0.12 -0.02 0.00 0.00 0.00 0.00 60.65 60.89 1v62 s ILE 46 Cb 0.01 -3.40 -0.01 0.00 0.01 0.00 0.00 42.46 39.07 1v62 s ILE 46 CO 0.10 0.37 0.08 -0.78 0.00 0.00 0.00 174.94 174.71 1v62 h ASP 47 N 7.36 -0.05 -5.00 3.58 1.82 0.24 0.25 116.42 124.62 1v62 h ASP 47 Ca -0.38 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.23 1v62 h ASP 47 Cb 1.17 0.01 -0.14 0.00 0.68 0.00 0.00 39.33 41.05 1v62 h ASP 47 CO 0.67 0.36 0.20 -0.13 -1.61 0.00 0.00 179.24 178.73 1v62 s ARG 48 N -1.68 1.22 0.25 0.28 0.52 -0.92 -4.57 118.95 114.05 1v62 s ARG 48 Ca -0.01 -0.28 0.06 0.00 -0.52 0.00 0.00 55.73 54.98 1v62 s ARG 48 Cb 0.00 0.57 -0.03 0.00 0.52 0.00 0.00 34.95 36.00 1v62 s ARG 48 CO 0.03 -0.50 0.25 0.42 0.02 0.00 0.00 175.30 175.52 1v62 s ILE 49 N -3.09 4.67 0.26 1.52 1.01 -1.26 -1.47 121.20 122.83 1v62 s ILE 49 Ca -0.02 -1.28 -0.26 0.00 0.00 0.00 0.00 60.65 59.09 1v62 s ILE 49 Cb -0.01 -3.53 -0.09 0.00 0.01 0.00 0.00 42.46 38.84 1v62 s ILE 49 CO -0.07 -0.34 0.88 -0.75 0.00 0.00 0.00 174.94 174.66 1v62 s LYS 50 N -3.89 4.59 0.36 2.79 2.20 -1.07 -4.97 119.74 119.76 1v62 s LYS 50 Ca 0.33 1.26 -0.26 0.00 -0.36 0.00 0.00 55.97 56.94 1v62 s LYS 50 Cb -0.08 -3.01 -0.09 0.00 -1.51 0.00 0.00 37.83 33.14 1v62 s LYS 50 CO 0.26 0.41 1.10 -1.25 -0.36 0.00 0.00 175.35 175.51 1v62 s PRO 51 N -1.67 4.31 -1.65 4.03 0.04 -1.26 -3.34 135.00 135.46 1v62 s PRO 51 Ca 0.44 1.71 -0.02 0.00 0.04 0.00 0.00 61.00 63.17 1v62 s PRO 51 Cb -0.21 -2.81 0.00 0.00 0.04 0.00 0.00 34.50 31.52 1v62 s PRO 51 CO 0.26 -0.06 0.29 0.00 0.04 0.00 0.00 177.00 177.52 1v62 n ALA 52 N 0.43 -0.80 -2.15 8.56 0.00 -1.26 -4.99 120.51 120.31 1v62 n ALA 52 Ca 0.03 0.22 -0.21 0.00 0.00 0.00 0.00 53.44 53.48 1v62 n ALA 52 Cb 0.47 -2.97 0.01 0.00 0.00 0.00 0.00 19.45 16.97 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 -2.36 5.11 0.31 0.00 0.15 -1.21 -4.89 113.70 110.80 1v62 s SER 53 Ca 0.15 -0.82 0.09 0.00 0.70 0.00 0.00 55.95 56.07 1v62 s SER 53 Cb -0.07 -0.08 0.49 0.00 -1.71 0.00 0.00 66.02 64.65 1v62 s SER 53 CO 0.18 -1.01 1.70 0.58 1.20 0.00 0.00 173.24 175.89 1v62 h VAL 54 N 0.59 1.34 0.16 4.45 2.07 -1.92 0.25 116.25 123.20 1v62 h VAL 54 Ca -0.36 -1.65 -0.29 0.00 0.82 0.00 0.00 66.70 65.21 1v62 h VAL 54 Cb 1.28 1.84 0.01 0.00 -1.52 0.00 0.00 31.29 32.91 1v62 h VAL 54 CO 0.49 0.48 -1.34 0.58 0.02 0.00 0.00 177.57 177.80 1v62 h VAL 55 N 0.08 1.41 0.03 2.57 2.07 -1.95 -2.55 116.25 117.91 1v62 h VAL 55 Ca 0.00 -2.94 -0.06 0.00 0.82 0.00 0.00 66.70 64.52 1v62 h VAL 55 Cb 0.87 2.96 0.01 0.00 -1.52 0.00 0.00 31.29 33.61 1v62 h VAL 55 CO 0.07 0.87 -0.26 -0.78 0.02 0.00 0.00 177.57 177.48 1v62 h ASP 56 N 0.09 0.18 -0.23 0.57 3.58 -1.74 0.11 116.42 118.99 1v62 h ASP 56 Ca -0.18 -0.89 -0.05 0.00 0.42 0.00 0.00 57.03 56.33 1v62 h ASP 56 Cb 2.03 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 43.01 1v62 h ASP 56 CO 0.22 1.05 0.01 0.03 -2.88 0.00 0.00 179.24 177.67 1v62 h ARG 57 N -0.67 0.52 0.17 0.28 3.08 -0.65 -2.94 114.38 114.16 1v62 h ARG 57 Ca -0.04 -0.11 -0.33 0.00 0.07 0.00 0.00 59.98 59.58 1v62 h ARG 57 Cb 1.12 -0.08 0.01 0.00 0.08 0.00 0.00 29.97 31.10 1v62 h ARG 57 CO 0.05 0.54 -1.58 1.03 -1.07 0.00 0.00 179.97 178.94 1v62 h SER 58 N 0.50 0.55 -1.34 7.04 0.87 -1.54 -3.49 113.55 116.13 1v62 h SER 58 Ca 0.11 -0.73 0.00 0.00 -1.23 0.00 0.00 61.79 59.94 1v62 h SER 58 Cb 0.31 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1v62 h SER 58 CO 0.01 1.60 0.00 0.61 -0.53 0.00 0.00 176.83 178.52 1v62 n GLY 59 N 1.73 0.74 0.09 5.77 0.00 0.37 -5.02 105.19 108.87 1v62 n GLY 59 Ca -0.19 -0.56 -0.16 0.00 0.00 0.00 0.00 46.02 45.12 1v62 n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v62 n ALA 60 N -1.73 0.68 -2.31 4.61 0.00 -1.00 -4.97 120.51 115.78 1v62 n ALA 60 Ca 0.00 -0.49 -0.21 0.00 0.00 0.00 0.00 53.44 52.74 1v62 n ALA 60 Cb 0.47 -0.33 0.01 0.00 0.00 0.00 0.00 19.45 19.59 1v62 n ALA 60 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1v62 s LEU 61 N -7.98 3.70 -0.04 0.00 1.43 -1.26 -4.95 118.68 109.57 1v62 s LEU 61 Ca -0.24 0.09 -0.21 0.00 -1.03 0.00 0.00 54.13 52.73 1v62 s LEU 61 Cb 0.05 -2.99 0.04 0.00 0.03 0.00 0.00 46.19 43.32 1v62 s LEU 61 CO 0.46 -0.68 0.47 -1.00 0.23 0.00 0.00 176.35 175.83 1v62 s HIS 62 N -2.46 -0.40 -0.35 0.29 3.76 -1.26 -4.90 115.29 109.97 1v62 s HIS 62 Ca 0.49 0.70 -0.28 0.00 -0.15 0.00 0.00 55.06 55.81 1v62 s HIS 62 Cb -0.10 0.23 -0.01 0.00 1.11 0.00 0.00 32.58 33.80 1v62 s HIS 62 CO 0.36 -0.46 1.72 -1.25 -0.85 0.00 0.00 174.74 174.26 1v62 s PRO 63 N -1.13 3.38 0.00 8.40 0.04 -1.26 -2.61 135.00 141.82 1v62 s PRO 63 Ca -0.11 1.33 0.00 0.00 0.04 0.00 0.00 61.00 62.25 1v62 s PRO 63 Cb -0.03 -4.17 0.00 0.00 0.04 0.00 0.00 34.50 30.34 1v62 s PRO 63 CO 0.06 -1.80 0.00 0.41 0.04 0.00 0.00 177.00 175.71 1v62 n GLY 64 N 5.36 1.85 3.64 0.56 0.00 0.08 -4.98 105.19 111.70 1v62 n GLY 64 Ca 0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 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 1.28 -4.32 1.61 9.92 -1.07 -4.74 116.55 119.23 1v62 n ASP 65 Ca 0.00 0.88 -0.46 0.00 -0.53 0.00 0.00 54.79 54.68 1v62 n ASP 65 Cb 0.00 -1.43 -0.05 0.00 -0.64 0.00 0.00 41.12 39.00 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 -1.43 3.23 -0.11 1.24 3.76 -1.26 -3.23 115.29 117.50 1v62 s HIS 66 Ca 0.73 -1.24 -0.29 0.00 -0.15 0.00 0.00 55.06 54.11 1v62 s HIS 66 Cb -0.44 -3.77 -0.04 0.00 1.11 0.00 0.00 32.58 29.45 1v62 s HIS 66 CO 0.49 -1.02 1.50 0.42 -0.85 0.00 0.00 174.74 175.27 1v62 s ILE 67 N 1.68 3.86 -0.07 0.60 1.01 -1.14 -1.27 121.20 125.88 1v62 s ILE 67 Ca 0.04 1.03 0.11 0.00 0.00 0.00 0.00 60.65 61.83 1v62 s ILE 67 Cb -0.29 -3.68 -0.23 0.00 0.01 0.00 0.00 42.46 38.26 1v62 s ILE 67 CO 0.04 -0.11 0.58 0.18 0.00 0.00 0.00 174.94 175.63 1v62 n LEU 68 N 7.01 0.99 -3.55 2.97 4.77 0.14 -4.67 117.00 124.66 1v62 n LEU 68 Ca 0.16 0.36 -0.08 0.00 -0.03 0.00 0.00 56.01 56.42 1v62 n LEU 68 Cb 0.44 0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 1v62 n LEU 68 CO 0.60 0.45 0.68 -0.94 -1.33 0.00 0.00 177.39 176.84 1v62 s SER 69 N -6.14 -0.34 -0.19 -1.43 1.04 -0.76 -1.82 113.70 104.07 1v62 s SER 69 Ca -0.07 -0.08 -0.04 0.00 0.48 0.00 0.00 55.95 56.24 1v62 s SER 69 Cb 0.08 0.42 0.09 0.00 0.10 0.00 0.00 66.02 66.70 1v62 s SER 69 CO 0.82 -0.69 0.26 -0.63 0.98 0.00 0.00 173.24 173.97 1v62 s ILE 70 N -3.19 -0.39 -1.70 -1.02 1.01 -0.45 0.83 121.20 116.28 1v62 s ILE 70 Ca 0.06 0.02 -0.01 0.00 0.00 0.00 0.00 60.65 60.72 1v62 s ILE 70 Cb -0.01 -0.62 0.00 0.00 0.01 0.00 0.00 42.46 41.84 1v62 s ILE 70 CO -0.07 -0.09 0.15 -0.67 0.00 0.00 0.00 174.94 174.26 1v62 n ASP 71 N 5.34 -5.91 0.00 3.58 -0.08 0.22 -1.22 116.55 118.48 1v62 n ASP 71 Ca -0.05 -0.09 0.00 0.00 -1.51 0.00 0.00 54.79 53.14 1v62 n ASP 71 Cb 0.50 -4.87 0.00 0.00 2.34 0.00 0.00 41.12 39.09 1v62 n ASP 71 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1v62 n GLY 72 N -1.14 0.70 3.53 0.27 0.00 -1.26 -5.04 105.19 102.24 1v62 n GLY 72 Ca -0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.04 5.28 0.23 2.61 2.01 -0.35 -5.05 115.64 118.32 1v62 s THR 73 Ca 0.00 -0.23 -0.31 0.00 0.31 0.00 0.00 61.69 61.46 1v62 s THR 73 Cb 0.00 -3.72 -0.11 0.00 0.01 0.00 0.00 72.50 68.69 1v62 s THR 73 CO 0.00 -0.02 1.55 -0.44 -0.69 0.00 0.00 174.62 175.02 1v62 s SER 74 N 1.72 6.53 -0.55 3.53 0.01 -1.26 -1.35 113.70 122.33 1v62 s SER 74 Ca 0.06 2.75 -0.00 0.00 1.31 0.00 0.00 55.95 60.06 1v62 s SER 74 Cb -0.17 -2.61 0.45 0.00 0.21 0.00 0.00 66.02 63.89 1v62 s SER 74 CO 0.10 -0.83 1.98 0.23 0.41 0.00 0.00 173.24 175.14 1v62 n MET 75 N 2.99 2.40 -0.10 12.44 2.81 -0.75 -4.25 117.12 132.67 1v62 n MET 75 Ca 0.10 -2.85 -0.10 0.00 -1.81 0.00 0.00 57.70 53.04 1v62 n MET 75 Cb 0.38 -2.12 -0.15 0.00 -0.71 0.00 0.00 33.22 30.63 1v62 n MET 75 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1v62 n GLU 76 N -0.72 0.86 -1.91 0.03 2.13 -1.26 -4.44 120.64 115.33 1v62 n GLU 76 Ca 0.55 0.01 -0.03 0.00 0.66 0.00 0.00 57.16 58.35 1v62 n GLU 76 Cb 0.86 -1.49 0.06 0.00 0.27 0.00 0.00 31.44 31.15 1v62 n GLU 76 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1v62 n HIS 77 N -2.77 1.04 -3.87 4.31 8.25 -1.26 -4.78 115.22 116.14 1v62 n HIS 77 Ca -0.33 -1.61 -0.24 0.00 -0.26 0.00 0.00 57.72 55.28 1v62 n HIS 77 Cb 1.10 -0.24 -0.04 0.00 1.12 0.00 0.00 29.99 31.93 1v62 n HIS 77 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1v62 n SER 79 N -1.50 1.85 0.07 0.00 7.64 -1.26 -4.89 113.62 115.52 1v62 n SER 79 Ca 0.00 -1.19 -0.15 0.00 1.01 0.00 0.00 58.87 58.54 1v62 n SER 79 Cb 0.63 0.04 -0.06 0.00 -1.01 0.00 0.00 64.21 63.81 1v62 n SER 79 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1v62 h LEU 80 N 0.00 0.61 -0.11 -3.43 6.46 -1.99 -2.61 115.31 114.24 1v62 h LEU 80 Ca -0.03 -0.50 -0.02 0.00 -0.12 0.00 0.00 57.88 57.21 1v62 h LEU 80 Cb 0.11 -0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 39.85 1v62 h LEU 80 CO 0.06 1.30 -0.00 -0.07 -0.62 0.00 0.00 178.44 179.11 1v62 h LEU 81 N 0.25 0.20 -0.34 2.25 3.38 -1.98 -0.76 115.31 118.30 1v62 h LEU 81 Ca -0.10 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 1v62 h LEU 81 Cb 1.64 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 42.32 1v62 h LEU 81 CO 0.18 0.47 0.18 -0.08 0.09 0.00 0.00 178.44 179.27 1v62 h GLU 82 N -0.08 0.48 -0.31 1.13 4.81 -1.97 -1.13 114.58 117.51 1v62 h GLU 82 Ca 0.03 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1v62 h GLU 82 Cb 0.37 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1v62 h GLU 82 CO 0.01 0.41 0.17 0.00 -0.73 0.00 0.00 179.01 178.87 1v62 h ALA 83 N 1.05 0.40 -0.13 2.92 0.00 -1.45 -2.08 119.26 119.97 1v62 h ALA 83 Ca 0.12 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1v62 h ALA 83 Cb 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1v62 h ALA 83 CO -0.02 -0.08 -0.03 1.15 0.00 0.00 0.00 179.25 180.27 1v62 h THR 84 N 0.38 1.10 -0.05 0.00 2.02 -0.98 -1.79 112.91 113.60 1v62 h THR 84 Ca 0.11 -0.41 -0.13 0.00 0.77 0.00 0.00 66.41 66.76 1v62 h THR 84 Cb 0.05 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1v62 h THR 84 CO -0.02 0.13 -0.55 0.11 0.37 0.00 0.00 175.52 175.57 1v62 h LYS 85 N 0.18 0.15 -0.39 6.66 1.57 -0.66 -3.05 116.57 121.03 1v62 h LYS 85 Ca 0.04 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.65 1v62 h LYS 85 Cb 0.17 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 1v62 h LYS 85 CO 0.01 0.66 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.44 1v62 h LEU 86 N 0.12 0.72 -1.70 2.94 3.38 -0.67 -2.05 115.31 118.06 1v62 h LEU 86 Ca -0.00 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 1v62 h LEU 86 Cb 1.00 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1v62 h LEU 86 CO 0.08 0.88 -0.05 -0.07 0.09 0.00 0.00 178.44 179.37 1v62 h LEU 87 N 0.54 0.11 -0.27 1.67 3.38 -1.46 -1.96 115.31 117.33 1v62 h LEU 87 Ca 0.11 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.88 1v62 h LEU 87 Cb 0.54 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1v62 h LEU 87 CO 0.03 0.19 -0.87 0.00 0.09 0.00 0.00 178.44 177.87 1v62 h ALA 88 N 1.83 0.56 -0.56 1.53 0.00 -1.39 -3.36 119.26 117.87 1v62 h ALA 88 Ca 0.03 -0.78 -0.74 0.00 0.00 0.00 0.00 54.91 53.42 1v62 h ALA 88 Cb 0.17 -0.13 -0.11 0.00 0.00 0.00 0.00 17.79 17.73 1v62 h ALA 88 CO 0.01 1.06 2.49 0.43 0.00 0.00 0.00 179.25 183.24 1v62 n SER 89 N -3.53 5.00 -4.05 0.00 7.64 -0.74 -4.91 113.62 113.04 1v62 n SER 89 Ca -0.01 -3.00 -0.21 0.00 1.01 0.00 0.00 58.87 56.66 1v62 n SER 89 Cb 0.83 -1.53 -0.15 0.00 -1.01 0.00 0.00 64.21 62.34 1v62 n SER 89 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1v62 s ILE 90 N 1.28 0.90 -0.16 0.44 -1.09 -1.26 -4.96 121.20 116.35 1v62 s ILE 90 Ca 0.44 -0.46 -0.24 0.00 -2.23 0.00 0.00 60.65 58.15 1v62 s ILE 90 Cb 0.12 -0.77 -0.24 0.00 -1.58 0.00 0.00 42.46 40.00 1v62 s ILE 90 CO -0.03 0.26 0.53 -1.28 -1.23 0.00 0.00 174.94 173.18 1v62 h SER 91 N 6.04 0.06 0.00 3.58 0.87 -1.92 -3.37 113.55 118.81 1v62 h SER 91 Ca -0.33 -0.78 0.00 0.00 -1.23 0.00 0.00 61.79 59.45 1v62 h SER 91 Cb 1.17 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1v62 h SER 91 CO 0.49 1.28 0.00 1.21 -0.53 0.00 0.00 176.83 179.28 1v62 n GLU 92 N -4.44 0.00 -4.43 2.24 2.13 -1.26 -3.76 120.64 111.12 1v62 n GLU 92 Ca -0.21 0.00 -0.34 0.00 0.66 0.00 0.00 57.16 57.27 1v62 n GLU 92 Cb 0.62 0.00 -0.11 0.00 0.27 0.00 0.00 31.44 32.22 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 -2.00 3.21 -0.26 5.31 -2.85 -1.26 -0.90 119.74 120.99 1v62 s LYS 93 Ca 0.00 -0.48 -0.20 0.00 -1.00 0.00 0.00 55.97 54.29 1v62 s LYS 93 Cb 0.00 -2.80 -0.02 0.00 -2.06 0.00 0.00 37.83 32.95 1v62 s LYS 93 CO 0.00 0.52 0.63 0.54 0.10 0.00 0.00 175.35 177.13 1v62 s VAL 94 N -0.38 4.99 -1.14 1.79 0.11 -0.97 -4.87 120.40 119.93 1v62 s VAL 94 Ca 0.07 1.12 -0.19 0.00 -2.93 0.00 0.00 61.98 60.05 1v62 s VAL 94 Cb -0.12 -3.93 0.09 0.00 -1.53 0.00 0.00 36.38 30.89 1v62 s VAL 94 CO 0.02 0.03 1.49 -0.60 -3.33 0.00 0.00 175.10 172.71 1v62 s ARG 95 N 2.50 3.83 -0.30 1.54 3.52 -1.26 -3.07 118.95 125.70 1v62 s ARG 95 Ca 0.26 -1.81 -0.10 0.00 -0.13 0.00 0.00 55.73 53.94 1v62 s ARG 95 Cb -0.15 -5.29 -0.02 0.00 -1.56 0.00 0.00 34.95 27.93 1v62 s ARG 95 CO 0.09 -2.06 0.17 -0.51 -0.81 0.00 0.00 175.30 172.17 1v62 s LEU 96 N 3.66 4.07 -0.52 -0.88 1.43 -1.23 0.70 118.68 125.92 1v62 s LEU 96 Ca 0.46 -0.34 -0.18 0.00 -1.03 0.00 0.00 54.13 53.03 1v62 s LEU 96 Cb -0.00 -2.04 0.07 0.00 0.03 0.00 0.00 46.19 44.25 1v62 s LEU 96 CO -0.02 -0.15 0.59 -0.70 0.23 0.00 0.00 176.35 176.30 1v62 s GLU 97 N 1.67 3.07 0.11 1.70 2.12 0.24 0.69 118.70 128.30 1v62 s GLU 97 Ca 0.06 -1.12 0.04 0.00 0.36 0.00 0.00 54.97 54.30 1v62 s GLU 97 Cb -0.17 -4.15 -0.04 0.00 0.26 0.00 0.00 34.13 30.03 1v62 s GLU 97 CO 0.08 -1.25 0.07 0.42 -0.54 0.00 0.00 175.26 174.03 1v62 s ILE 98 N 2.37 4.34 0.29 -3.70 1.01 0.12 0.27 121.20 125.91 1v62 s ILE 98 Ca 0.11 -0.94 -0.29 0.00 0.00 0.00 0.00 60.65 59.53 1v62 s ILE 98 Cb -0.22 -3.12 -0.09 0.00 0.01 0.00 0.00 42.46 39.03 1v62 s ILE 98 CO 0.09 0.05 1.08 -0.22 0.00 0.00 0.00 174.94 175.94 1v62 s LEU 99 N -2.58 4.50 -0.87 2.97 2.96 -0.40 -0.20 118.68 125.07 1v62 s LEU 99 Ca 0.29 2.20 -0.19 0.00 -0.22 0.00 0.00 54.13 56.21 1v62 s LEU 99 Cb -0.11 -3.71 -0.22 0.00 0.50 0.00 0.00 46.19 42.64 1v62 s LEU 99 CO 0.21 -0.17 2.33 -2.65 -1.32 0.00 0.00 176.35 174.76 1v62 n PRO 100 N 1.03 0.32 -4.03 0.98 -0.02 -1.26 -4.74 135.00 127.28 1v62 n PRO 100 Ca -0.00 -0.38 -0.26 0.00 -2.02 0.00 0.00 63.50 60.84 1v62 n PRO 100 Cb 0.46 -2.41 -0.04 0.00 -0.02 0.00 0.00 33.50 31.48 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 8.13 4.80 0.48 -1.45 -7.23 -1.13 -5.01 120.40 118.99 1v62 s VAL 101 Ca 1.13 -0.96 0.22 0.00 -1.81 0.00 0.00 61.98 60.55 1v62 s VAL 101 Cb -0.51 -3.48 0.26 0.00 0.56 0.00 0.00 36.38 33.22 1v62 s VAL 101 CO 0.33 -0.13 2.10 1.55 -0.31 0.00 0.00 175.10 178.64 1v62 h PRO 102 N 2.21 0.00 -0.09 4.82 0.13 -2.02 -2.11 132.00 134.94 1v62 h PRO 102 Ca -0.48 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.51 1v62 h PRO 102 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1v62 h PRO 102 CO 0.65 0.10 -0.57 1.96 -0.23 0.00 0.00 178.00 179.90 1v62 h GLN 103 N 0.00 0.28 -2.21 0.86 4.20 -1.97 -3.43 115.11 112.83 1v62 h GLN 103 Ca -0.00 -0.18 -0.07 0.00 0.06 0.00 0.00 58.65 58.46 1v62 h GLN 103 Cb 0.21 0.02 -0.26 0.00 0.30 0.00 0.00 27.48 27.75 1v62 h GLN 103 CO 0.01 0.77 -0.35 -1.12 -0.67 0.00 0.00 178.83 177.48 1v62 s SER 104 N -6.90 -0.37 -0.07 1.46 0.01 -0.80 -5.03 113.70 102.01 1v62 s SER 104 Ca -0.04 0.92 0.24 0.00 1.31 0.00 0.00 55.95 58.37 1v62 s SER 104 Cb 0.12 1.50 0.44 0.00 0.21 0.00 0.00 66.02 68.30 1v62 s SER 104 CO 0.80 -0.25 1.16 1.67 0.41 0.00 0.00 173.24 177.04 1v62 n GLN 105 N 5.40 0.50 -3.66 12.44 7.27 -1.21 -2.85 117.38 135.27 1v62 n GLN 105 Ca -0.07 -2.41 -0.12 0.00 0.07 0.00 0.00 57.00 54.47 1v62 n GLN 105 Cb 0.50 -0.46 -0.08 0.00 2.41 0.00 0.00 30.24 32.61 1v62 n GLN 105 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1v62 s ARG 106 N -0.99 0.68 0.17 3.69 0.52 -1.26 -5.04 118.95 116.72 1v62 s ARG 106 Ca 0.34 0.95 0.00 0.00 -0.52 0.00 0.00 55.73 56.49 1v62 s ARG 106 Cb 0.38 0.25 0.01 0.00 0.52 0.00 0.00 34.95 36.11 1v62 s ARG 106 CO -0.14 -0.11 1.39 -1.00 0.02 0.00 0.00 175.30 175.46 1v62 h PRO 107 N 5.87 0.30 -2.24 3.54 0.13 -1.98 -3.40 132.00 134.22 1v62 h PRO 107 Ca -0.30 -0.29 -0.53 0.00 -0.87 0.00 0.00 66.00 64.01 1v62 h PRO 107 Cb 1.18 0.08 -0.35 0.00 0.13 0.00 0.00 31.00 32.04 1v62 h PRO 107 CO 0.15 0.98 -0.88 -0.51 -0.23 0.00 0.00 178.00 177.50 1v62 s LEU 108 N -7.67 0.91 0.14 1.56 1.43 -1.26 -4.86 118.68 108.93 1v62 s LEU 108 Ca -0.04 -2.65 0.02 0.00 -1.03 0.00 0.00 54.13 50.43 1v62 s LEU 108 Cb 0.10 -0.11 -0.04 0.00 0.03 0.00 0.00 46.19 46.17 1v62 s LEU 108 CO 0.84 -0.19 0.28 0.00 0.23 0.00 0.00 176.35 177.50 1v62 s ARG 109 N 0.45 3.44 0.72 1.70 1.70 -1.26 -5.10 118.95 120.60 1v62 s ARG 109 Ca 0.28 -0.58 -0.13 0.00 -0.47 0.00 0.00 55.73 54.83 1v62 s ARG 109 Cb -0.03 -2.97 0.03 0.00 -0.57 0.00 0.00 34.95 31.41 1v62 s ARG 109 CO -0.13 0.53 1.11 -1.25 -1.08 0.00 0.00 175.30 174.48 1v62 s PRO 110 N -3.16 2.47 -0.36 3.89 0.04 -1.26 -5.04 135.00 131.58 1v62 s PRO 110 Ca 0.35 1.35 0.00 0.00 0.04 0.00 0.00 61.00 62.74 1v62 s PRO 110 Cb -0.11 -1.91 0.14 0.00 0.04 0.00 0.00 34.50 32.66 1v62 s PRO 110 CO 0.28 -1.50 0.22 0.45 0.04 0.00 0.00 177.00 176.50 1v62 s SER 111 N -2.82 2.90 0.31 6.66 0.15 -1.26 -5.13 113.70 114.51 1v62 s SER 111 Ca 0.66 -2.26 0.05 0.00 0.70 0.00 0.00 55.95 55.09 1v62 s SER 111 Cb -0.20 -0.43 -0.02 0.00 -1.71 0.00 0.00 66.02 63.66 1v62 s SER 111 CO 0.47 -0.30 0.45 -0.44 1.20 0.00 0.00 173.24 174.63 1v62 s SER 112 N 0.98 6.14 0.00 5.45 0.01 -1.26 -5.08 113.70 119.94 1v62 s SER 112 Ca 0.19 0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.49 1v62 s SER 112 Cb -0.21 -1.61 0.00 0.00 0.21 0.00 0.00 66.02 64.41 1v62 s SER 112 CO -0.00 -0.29 0.00 0.61 0.41 0.00 0.00 173.24 173.96 1v62 n GLY 113 N -1.60 4.61 0.39 3.44 0.00 -1.26 -5.00 105.19 105.76 1v62 n GLY 113 Ca -0.04 -1.20 -0.14 0.00 0.00 0.00 0.00 46.02 44.64 1v62 n GLY 113 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1v62 h PRO 114 N 0.00 -0.69 -6.31 1.61 0.11 -2.08 -3.43 132.00 121.21 1v62 h PRO 114 Ca 0.00 0.05 -0.50 0.00 0.11 0.00 0.00 66.00 65.65 1v62 h PRO 114 Cb 0.00 0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 1v62 h PRO 114 CO 0.00 -0.46 -0.30 -1.12 -0.21 0.00 0.00 178.00 175.90 1v62 s SER 115 N -4.00 6.35 0.00 -2.05 0.01 -1.26 -4.96 113.70 107.78 1v62 s SER 115 Ca -0.14 0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.49 1v62 s SER 115 Cb 0.04 -1.99 0.00 0.00 0.21 0.00 0.00 66.02 64.28 1v62 s SER 115 CO 0.47 -0.12 0.00 -0.24 0.41 0.00 0.00 173.24 173.76 1v62 n SER 116 N -1.13 0.00 0.00 2.44 2.88 -1.26 -5.08 113.62 111.47 1v62 n SER 116 Ca -0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 1v62 n SER 116 Cb 0.55 0.38 0.00 0.00 -0.75 0.00 0.00 64.21 64.39 1v62 n SER 116 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42