#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4rsd s GLU 2 N 0.00 4.84 0.81 1.64 2.12 -1.26 -5.04 118.70 121.81 4rsd s GLU 2 Ca 0.00 1.48 -0.11 0.00 0.36 0.00 0.00 54.97 56.70 4rsd s GLU 2 Cb 0.00 -3.28 0.08 0.00 0.26 0.00 0.00 34.13 31.18 4rsd s GLU 2 CO 0.00 0.50 1.09 0.95 -0.54 0.00 0.00 175.26 177.26 4rsd s THR 3 N -1.11 3.16 0.21 -1.70 -4.23 -1.26 -4.83 115.64 105.87 4rsd s THR 3 Ca 0.41 0.38 -0.09 0.00 -1.18 0.00 0.00 61.69 61.20 4rsd s THR 3 Cb -0.26 -2.94 0.15 0.00 1.34 0.00 0.00 72.50 70.79 4rsd s THR 3 CO 0.32 -0.49 1.81 0.00 -0.54 0.00 0.00 174.62 175.72 4rsd h ALA 4 N -1.21 0.98 -0.60 3.99 0.00 -1.96 -1.07 119.26 119.39 4rsd h ALA 4 Ca -0.46 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.28 4rsd h ALA 4 Cb 1.25 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 4rsd h ALA 4 CO 0.54 0.51 0.21 0.00 0.00 0.00 0.00 179.25 180.51 4rsd h ALA 5 N 1.21 0.78 -0.37 0.00 0.00 -1.90 -1.97 119.26 117.00 4rsd h ALA 5 Ca 0.27 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 4rsd h ALA 5 Cb 0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 4rsd h ALA 5 CO -0.04 0.43 -0.23 0.00 0.00 0.00 0.00 179.25 179.41 4rsd h ALA 6 N 1.07 0.90 -0.72 0.00 0.00 -1.85 -2.24 119.26 116.43 4rsd h ALA 6 Ca 0.20 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 4rsd h ALA 6 Cb 0.25 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 4rsd h ALA 6 CO -0.01 0.62 0.21 -0.22 0.00 0.00 0.00 179.25 179.85 4rsd h LYS 7 N 0.64 1.12 -0.72 0.00 3.64 -0.99 -0.91 116.57 119.35 4rsd h LYS 7 Ca 0.09 -0.24 -0.01 0.00 -1.27 0.00 0.00 60.65 59.21 4rsd h LYS 7 Cb 0.73 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.36 4rsd h LYS 7 CO 0.06 0.96 0.41 0.35 -2.27 0.00 0.00 179.45 178.95 4rsd h PHE 8 N 1.07 0.98 -0.23 1.91 3.04 -1.19 -0.58 116.94 121.95 4rsd h PHE 8 Ca 0.23 -0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.15 4rsd h PHE 8 Cb 0.32 -0.32 -0.01 0.00 2.56 0.00 0.00 35.95 38.50 4rsd h PHE 8 CO 0.03 0.69 0.10 0.93 -2.02 0.00 0.00 178.31 178.04 4rsd h GLU 9 N 0.99 0.34 -0.59 1.11 5.08 -0.99 -0.17 114.58 120.35 4rsd h GLU 9 Ca 0.26 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 4rsd h GLU 9 Cb 0.02 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 4rsd h GLU 9 CO -0.04 0.37 0.32 -0.09 -1.00 0.00 0.00 179.01 178.56 4rsd h ARG 10 N 0.23 0.83 0.00 2.33 2.43 -0.96 -1.18 114.38 118.06 4rsd h ARG 10 Ca 0.08 -0.10 -0.19 0.00 -0.81 0.00 0.00 59.98 58.95 4rsd h ARG 10 Cb 0.14 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 4rsd h ARG 10 CO -0.01 0.64 -0.92 1.96 -1.51 0.00 0.00 179.97 180.13 4rsd h GLN 11 N 0.80 0.00 0.00 0.20 4.20 -0.99 -3.41 115.11 115.92 4rsd h GLN 11 Ca 0.21 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.92 4rsd h GLN 11 Cb 0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.84 4rsd h GLN 11 CO -0.03 0.92 -0.30 0.72 -0.67 0.00 0.00 178.83 179.47 4rsd n HIS 12 N -3.39 0.00 -3.46 2.96 8.25 -0.09 -4.69 115.22 114.80 4rsd n HIS 12 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.09 4rsd n HIS 12 Cb 0.89 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.93 4rsd n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 4rsd s MET 13 N -1.33 4.14 -0.42 -0.41 -1.94 -0.45 0.16 119.30 119.05 4rsd s MET 13 Ca 0.00 0.32 0.05 0.00 -1.71 0.00 0.00 55.69 54.35 4rsd s MET 13 Cb 0.01 -3.35 0.18 0.00 2.01 0.00 0.00 34.83 33.67 4rsd s MET 13 CO 0.03 0.38 0.40 -3.47 -0.01 0.00 0.00 175.02 172.35 4rsd n ASP 14 N 2.95 -0.71 -0.05 3.03 2.03 -0.37 -4.86 116.55 118.57 4rsd n ASP 14 Ca -0.11 -2.46 0.15 0.00 0.52 0.00 0.00 54.79 52.89 4rsd n ASP 14 Cb 0.52 -0.34 0.70 0.00 -0.72 0.00 0.00 41.12 41.28 4rsd n ASP 14 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 4rsd n SER 15 N 2.69 0.20 0.03 1.67 7.64 -1.26 -3.88 113.62 120.72 4rsd n SER 15 Ca 0.28 -0.37 0.13 0.00 1.01 0.00 0.00 58.87 59.92 4rsd n SER 15 Cb 0.49 -0.18 0.49 0.00 -1.01 0.00 0.00 64.21 64.00 4rsd n SER 15 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 4rsd n SER 16 N -1.14 0.31 -4.20 6.43 3.41 -1.26 -4.83 113.62 112.34 4rsd n SER 16 Ca 0.15 0.38 -0.20 0.00 -0.26 0.00 0.00 58.87 58.93 4rsd n SER 16 Cb 0.25 -0.41 -0.12 0.00 -0.26 0.00 0.00 64.21 63.67 4rsd n SER 16 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 4rsd s THR 17 N -3.03 1.30 -0.21 6.66 -4.23 -1.25 -5.04 115.64 109.83 4rsd s THR 17 Ca 0.12 -1.31 0.17 0.00 -1.18 0.00 0.00 61.69 59.50 4rsd s THR 17 Cb 0.17 -1.21 0.14 0.00 1.34 0.00 0.00 72.50 72.94 4rsd s THR 17 CO 0.58 -0.12 1.50 0.77 -0.54 0.00 0.00 174.62 176.82 4rsd h SER 18 N 4.38 0.00 -4.83 3.99 4.64 -1.88 -3.44 113.55 116.41 4rsd h SER 18 Ca -0.42 0.00 0.22 0.00 -0.47 0.00 0.00 61.79 61.12 4rsd h SER 18 Cb 1.18 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.13 4rsd h SER 18 CO 0.41 0.36 0.69 0.00 -0.87 0.00 0.00 176.83 177.42 4rsd s ALA 19 N -3.05 -1.99 0.22 5.18 0.00 -1.26 -4.84 121.76 116.02 4rsd s ALA 19 Ca 0.05 1.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.75 4rsd s ALA 19 Cb 0.07 0.23 -0.10 0.00 0.00 0.00 0.00 23.12 23.32 4rsd s ALA 19 CO 0.72 -0.78 1.46 0.00 0.00 0.00 0.00 175.76 177.16 4rsd s ALA 20 N -2.72 3.65 -0.99 0.00 0.00 -1.26 -4.91 121.76 115.53 4rsd s ALA 20 Ca 0.10 1.31 0.14 0.00 0.00 0.00 0.00 51.96 53.50 4rsd s ALA 20 Cb 0.00 -3.57 -0.07 0.00 0.00 0.00 0.00 23.12 19.48 4rsd s ALA 20 CO -0.05 -0.73 0.69 -1.13 0.00 0.00 0.00 175.76 174.54 4rsd n SER 21 N 2.86 1.09 -4.04 0.00 3.41 -1.26 -4.99 113.62 110.70 4rsd n SER 21 Ca 0.09 -1.05 -0.08 0.00 -0.26 0.00 0.00 58.87 57.57 4rsd n SER 21 Cb 0.40 0.72 -0.09 0.00 -0.26 0.00 0.00 64.21 64.98 4rsd n SER 21 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 4rsd s SER 22 N -1.99 0.36 0.04 4.04 1.04 -1.26 -5.01 113.70 110.91 4rsd s SER 22 Ca 0.09 -0.94 0.14 0.00 0.48 0.00 0.00 55.95 55.72 4rsd s SER 22 Cb 0.11 0.25 0.61 0.00 0.10 0.00 0.00 66.02 67.09 4rsd s SER 22 CO 0.45 -0.66 1.45 -1.54 0.98 0.00 0.00 173.24 173.93 4rsd n SER 23 N 0.03 0.09 -0.87 7.02 3.41 -1.26 -2.17 113.62 119.87 4rsd n SER 23 Ca -0.13 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.12 4rsd n SER 23 Cb 0.62 -0.54 0.27 0.00 -0.26 0.00 0.00 64.21 64.29 4rsd n SER 23 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 4rsd n ASN 24 N -1.60 2.63 -0.14 4.04 3.02 -1.26 -4.44 115.26 117.51 4rsd n ASN 24 Ca 0.03 -1.86 -0.04 0.00 -0.03 0.00 0.00 54.58 52.68 4rsd n ASN 24 Cb 0.16 -0.12 0.02 0.00 -0.61 0.00 0.00 39.78 39.23 4rsd n ASN 24 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 4rsd h TYR 25 N 3.68 -0.24 -0.49 3.10 5.03 -1.83 -1.93 116.97 124.28 4rsd h TYR 25 Ca 0.00 0.04 -0.02 0.00 2.58 0.00 0.00 58.73 61.33 4rsd h TYR 25 Cb 0.80 0.18 -0.02 0.00 1.55 0.00 0.00 36.73 39.23 4rsd h TYR 25 CO 0.12 -0.20 0.24 0.00 -1.32 0.00 0.00 178.16 177.00 4rsd h ASN 27 N 0.64 0.77 -0.11 0.00 2.35 -1.70 0.24 115.58 117.78 4rsd h ASN 27 Ca 0.17 0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.85 4rsd h ASN 27 Cb 0.10 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.32 4rsd h ASN 27 CO -0.02 0.52 -0.22 -0.61 -1.65 0.00 0.00 177.43 175.44 4rsd h GLN 28 N 0.91 0.34 -0.30 0.81 -0.00 -0.90 -3.08 115.11 112.90 4rsd h GLN 28 Ca 0.32 -0.22 -0.14 0.00 -0.00 0.00 0.00 58.65 58.61 4rsd h GLN 28 Cb 0.08 0.03 -0.01 0.00 0.00 0.00 0.00 27.48 27.58 4rsd h GLN 28 CO -0.14 0.82 -0.37 0.52 0.00 0.00 0.00 178.83 179.66 4rsd h MET 29 N -0.10 0.68 -0.21 1.69 2.86 -0.68 -1.09 114.93 118.08 4rsd h MET 29 Ca 0.00 -0.34 -0.03 0.00 -2.06 0.00 0.00 59.70 57.28 4rsd h MET 29 Cb 0.81 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.46 4rsd h MET 29 CO 0.05 0.94 0.02 0.52 1.06 0.00 0.00 176.91 179.50 4rsd h MET 30 N 0.56 0.30 -0.01 1.72 2.86 -1.02 -1.20 114.93 118.16 4rsd h MET 30 Ca 0.05 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.59 4rsd h MET 30 Cb 0.89 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.50 4rsd h MET 30 CO 0.08 0.32 -0.22 -0.22 1.06 0.00 0.00 176.91 177.92 4rsd h LYS 31 N 0.30 0.16 -0.64 1.72 3.64 -1.38 0.10 116.57 120.48 4rsd h LYS 31 Ca 0.07 -0.17 0.08 0.00 -1.27 0.00 0.00 60.65 59.37 4rsd h LYS 31 Cb 0.18 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.00 4rsd h LYS 31 CO 0.00 0.90 0.42 0.77 -2.27 0.00 0.00 179.45 179.27 4rsd h SER 32 N -0.51 0.47 -0.35 4.20 0.02 -0.96 -0.77 113.55 115.66 4rsd h SER 32 Ca -0.03 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 4rsd h SER 32 Cb 0.97 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.42 4rsd h SER 32 CO 0.04 0.29 0.00 0.54 -1.14 0.00 0.00 176.83 176.57 4rsd n ARG 33 N -4.48 1.90 -2.44 3.45 5.12 -0.47 -4.91 116.66 114.83 4rsd n ARG 33 Ca 0.10 -1.39 -0.14 0.00 -1.93 0.00 0.00 57.85 54.48 4rsd n ARG 33 Cb 0.31 -1.34 0.00 0.00 -1.16 0.00 0.00 32.46 30.28 4rsd n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 4rsd n ASN 34 N 0.62 -4.41 -0.89 0.55 3.02 -0.29 -4.89 115.26 108.96 4rsd n ASN 34 Ca 0.14 -0.08 0.10 0.00 -0.03 0.00 0.00 54.58 54.72 4rsd n ASN 34 Cb 0.35 -3.47 0.27 0.00 -0.61 0.00 0.00 39.78 36.32 4rsd n ASN 34 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 4rsd n LEU 35 N -2.28 2.64 -0.09 3.41 4.77 0.35 -3.87 117.00 121.93 4rsd n LEU 35 Ca -0.13 -1.20 0.05 0.00 -0.03 0.00 0.00 56.01 54.70 4rsd n LEU 35 Cb 0.61 -0.24 0.06 0.00 -2.33 0.00 0.00 43.42 41.53 4rsd n LEU 35 CO 0.24 0.60 0.48 0.35 -1.33 0.00 0.00 177.39 177.72 4rsd n THR 36 N 0.95 1.20 0.30 -5.08 -2.24 -1.22 -2.65 114.28 105.55 4rsd n THR 36 Ca 0.18 -1.38 -0.12 0.00 -2.27 0.00 0.00 64.05 60.46 4rsd n THR 36 Cb 0.46 0.20 -0.06 0.00 -2.10 0.00 0.00 70.33 68.83 4rsd n THR 36 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 4rsd h LYS 37 N 0.00 -0.74 0.00 -0.78 3.64 -1.90 -3.37 116.57 113.42 4rsd h LYS 37 Ca 0.00 0.05 -0.27 0.00 -1.27 0.00 0.00 60.65 59.16 4rsd h LYS 37 Cb 0.89 0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.83 4rsd h LYS 37 CO 0.00 -0.50 -1.54 -0.44 -2.27 0.00 0.00 179.45 174.70 4rsd h ASP 38 N -0.85 0.01 -5.18 4.20 3.32 -1.88 -3.48 116.42 112.55 4rsd h ASP 38 Ca -0.08 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 56.88 4rsd h ASP 38 Cb 0.59 -0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.09 4rsd h ASP 38 CO 0.13 1.02 0.05 0.00 -1.72 0.00 0.00 179.24 178.72 4rsd s ARG 39 N -2.62 1.89 -0.39 3.56 1.70 -1.26 -5.08 118.95 116.75 4rsd s ARG 39 Ca -0.04 -1.37 -0.21 0.00 -0.47 0.00 0.00 55.73 53.64 4rsd s ARG 39 Cb 0.08 0.54 0.01 0.00 -0.57 0.00 0.00 34.95 35.02 4rsd s ARG 39 CO 0.82 -0.84 0.69 0.00 -1.08 0.00 0.00 175.30 174.90 4rsd s LYS 41 N 2.91 4.21 0.18 0.00 2.20 -1.08 -4.90 119.74 123.26 4rsd s LYS 41 Ca 0.26 2.34 -0.09 0.00 -0.36 0.00 0.00 55.97 58.12 4rsd s LYS 41 Cb -0.14 -3.29 0.08 0.00 -1.51 0.00 0.00 37.83 32.97 4rsd s LYS 41 CO 0.17 -0.64 1.66 -1.00 -0.36 0.00 0.00 175.35 175.19 4rsd h PRO 42 N 7.25 1.08 -3.66 4.03 0.13 -1.94 -3.44 132.00 135.45 4rsd h PRO 42 Ca -0.43 -0.32 -0.20 0.00 -0.87 0.00 0.00 66.00 64.18 4rsd h PRO 42 Cb 1.20 -0.11 -0.26 0.00 0.13 0.00 0.00 31.00 31.96 4rsd h PRO 42 CO 0.92 1.02 -0.65 0.08 -0.23 0.00 0.00 178.00 179.14 4rsd s VAL 43 N -5.12 0.02 -0.21 1.56 1.01 -1.26 -1.63 120.40 114.77 4rsd s VAL 43 Ca -0.12 -0.18 -0.25 0.00 0.00 0.00 0.00 61.98 61.43 4rsd s VAL 43 Cb 0.14 -0.13 0.07 0.00 0.00 0.00 0.00 36.38 36.45 4rsd s VAL 43 CO 0.85 -0.10 0.67 0.21 0.00 0.00 0.00 175.10 176.73 4rsd s ASN 44 N -0.29 -0.68 -0.06 3.32 2.47 -0.04 -5.01 114.94 114.64 4rsd s ASN 44 Ca -0.03 1.20 0.04 0.00 0.42 0.00 0.00 52.86 54.49 4rsd s ASN 44 Cb -0.02 1.19 -0.02 0.00 -1.45 0.00 0.00 41.25 40.94 4rsd s ASN 44 CO 0.00 -0.31 -0.17 -0.89 -3.72 0.00 0.00 177.10 172.01 4rsd s THR 45 N 0.01 2.79 -0.03 -5.21 2.01 -1.26 -0.41 115.64 113.55 4rsd s THR 45 Ca -0.02 -0.81 0.02 0.00 0.31 0.00 0.00 61.69 61.18 4rsd s THR 45 Cb -0.04 -2.08 -0.03 0.00 0.01 0.00 0.00 72.50 70.36 4rsd s THR 45 CO 0.03 0.58 -0.04 -0.36 -0.69 0.00 0.00 174.62 174.13 4rsd s PHE 46 N -0.48 2.98 -0.15 4.92 0.08 -0.16 -4.37 117.98 120.81 4rsd s PHE 46 Ca 0.06 0.04 -0.01 0.00 0.12 0.00 0.00 56.93 57.14 4rsd s PHE 46 Cb -0.12 -1.67 -0.01 0.00 -0.57 0.00 0.00 43.02 40.65 4rsd s PHE 46 CO 0.01 0.40 -0.11 0.08 -0.10 0.00 0.00 175.22 175.50 4rsd s VAL 47 N -0.96 3.13 -1.06 -0.44 1.01 0.12 -0.83 120.40 121.38 4rsd s VAL 47 Ca 0.16 -0.62 -0.03 0.00 0.00 0.00 0.00 61.98 61.49 4rsd s VAL 47 Cb -0.11 -2.34 0.31 0.00 0.00 0.00 0.00 36.38 34.24 4rsd s VAL 47 CO 0.06 0.51 1.49 1.41 0.00 0.00 0.00 175.10 178.56 4rsd n HIS 48 N 3.78 2.33 -4.10 5.22 -0.00 0.27 -1.24 115.22 121.48 4rsd n HIS 48 Ca -0.18 -2.63 -0.11 0.00 -0.00 0.00 0.00 57.72 54.80 4rsd n HIS 48 Cb 0.52 -1.21 -0.08 0.00 -0.00 0.00 0.00 29.99 29.22 4rsd n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 4rsd s GLU 49 N -2.95 1.26 0.71 -0.41 0.41 -1.26 -4.50 118.70 111.96 4rsd s GLU 49 Ca 0.32 -1.43 -0.13 0.00 -0.41 0.00 0.00 54.97 53.32 4rsd s GLU 49 Cb 0.07 0.34 0.02 0.00 -1.78 0.00 0.00 34.13 32.78 4rsd s GLU 49 CO 0.08 -0.45 1.10 -1.54 -0.49 0.00 0.00 175.26 173.96 4rsd s SER 50 N -3.08 4.88 0.23 -0.19 1.04 -1.26 -4.21 113.70 111.12 4rsd s SER 50 Ca 0.29 1.90 -0.08 0.00 0.48 0.00 0.00 55.95 58.54 4rsd s SER 50 Cb 0.04 -2.54 0.23 0.00 0.10 0.00 0.00 66.02 63.86 4rsd s SER 50 CO 0.08 -1.78 1.89 0.25 0.98 0.00 0.00 173.24 174.66 4rsd h LEU 51 N -0.49 0.97 -0.97 2.42 5.85 -1.98 -1.68 115.31 119.44 4rsd h LEU 51 Ca -0.45 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 4rsd h LEU 51 Cb 1.24 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.99 4rsd h LEU 51 CO 0.53 0.69 0.56 0.00 -0.34 0.00 0.00 178.44 179.88 4rsd h ALA 52 N 1.34 1.22 -0.24 1.25 0.00 -1.99 0.02 119.26 120.86 4rsd h ALA 52 Ca 0.33 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 4rsd h ALA 52 Cb -0.08 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.32 4rsd h ALA 52 CO -0.09 0.66 -0.16 -0.44 0.00 0.00 0.00 179.25 179.23 4rsd h ASP 53 N 1.30 0.40 -0.11 0.00 5.19 -1.69 -1.33 116.42 120.18 4rsd h ASP 53 Ca 0.34 -0.10 -0.17 0.00 -0.62 0.00 0.00 57.03 56.47 4rsd h ASP 53 Cb -0.05 -0.11 0.01 0.00 0.18 0.00 0.00 39.33 39.36 4rsd h ASP 53 CO -0.06 0.58 -0.61 0.58 -3.12 0.00 0.00 179.24 176.61 4rsd h VAL 54 N 0.38 1.34 -0.31 -1.35 2.07 -0.84 -3.13 116.25 114.42 4rsd h VAL 54 Ca 0.07 -1.90 -0.02 0.00 0.82 0.00 0.00 66.70 65.67 4rsd h VAL 54 Cb 0.50 2.17 -0.02 0.00 -1.52 0.00 0.00 31.29 32.43 4rsd h VAL 54 CO 0.03 0.58 0.09 1.56 0.02 0.00 0.00 177.57 179.85 4rsd h GLN 55 N 0.23 0.43 0.00 1.57 4.20 -0.82 -1.14 115.11 119.58 4rsd h GLN 55 Ca -0.05 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.61 4rsd h GLN 55 Cb 1.25 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.95 4rsd h GLN 55 CO 0.12 0.39 0.00 0.00 -0.67 0.00 0.00 178.83 178.68 4rsd h ALA 56 N 1.67 1.00 0.00 3.87 0.00 -1.19 -2.24 119.26 122.37 4rsd h ALA 56 Ca 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 4rsd h ALA 56 Cb 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 4rsd h ALA 56 CO -0.01 0.00 -0.05 0.28 0.00 0.00 0.00 179.25 179.48 4rsd h VAL 57 N 0.00 0.76 0.00 0.00 2.07 -1.23 -1.23 116.25 116.63 4rsd h VAL 57 Ca 0.00 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.34 4rsd h VAL 57 Cb 0.07 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 4rsd h VAL 57 CO 0.00 0.05 0.00 0.00 0.02 0.00 0.00 177.57 177.64 4rsd n SER 59 N -1.38 2.78 0.00 0.00 7.64 -0.46 -5.01 113.62 117.19 4rsd n SER 59 Ca 0.03 -2.01 0.00 0.00 1.01 0.00 0.00 58.87 57.90 4rsd n SER 59 Cb 0.08 -0.20 0.00 0.00 -1.01 0.00 0.00 64.21 63.08 4rsd n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 4rsd n GLN 60 N 0.33 2.31 -2.61 1.43 6.02 -0.08 -5.00 117.38 119.78 4rsd n GLN 60 Ca 0.10 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.66 4rsd n GLN 60 Cb 0.40 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.64 4rsd n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 4rsd s LYS 61 N 3.94 4.09 -0.09 -1.09 2.47 -1.07 -4.88 119.74 123.10 4rsd s LYS 61 Ca 0.00 1.17 -0.30 0.00 -1.56 0.00 0.00 55.97 55.28 4rsd s LYS 61 Cb 0.00 -3.74 -0.02 0.00 -1.46 0.00 0.00 37.83 32.62 4rsd s LYS 61 CO 0.00 -0.87 1.06 1.21 0.16 0.00 0.00 175.35 176.91 4rsd s ASN 62 N 1.71 7.19 0.15 1.43 3.04 -1.26 -0.37 114.94 126.82 4rsd s ASN 62 Ca 0.47 1.61 0.01 0.00 0.04 0.00 0.00 52.86 54.98 4rsd s ASN 62 Cb -0.14 -2.56 -0.04 0.00 -1.54 0.00 0.00 41.25 36.97 4rsd s ASN 62 CO 0.15 -0.49 0.02 0.68 -3.04 0.00 0.00 177.10 174.41 4rsd s VAL 63 N 2.08 0.47 0.48 -5.21 -7.23 -0.09 -4.93 120.40 105.97 4rsd s VAL 63 Ca 0.50 -1.95 -0.20 0.00 -1.81 0.00 0.00 61.98 58.53 4rsd s VAL 63 Cb -0.20 -2.05 -0.09 0.00 0.56 0.00 0.00 36.38 34.60 4rsd s VAL 63 CO 0.19 -0.51 1.01 0.00 -0.31 0.00 0.00 175.10 175.48 4rsd s ALA 64 N -3.79 2.92 0.28 1.32 0.00 -1.26 -3.33 121.76 117.89 4rsd s ALA 64 Ca 0.23 0.51 -0.11 0.00 0.00 0.00 0.00 51.96 52.59 4rsd s ALA 64 Cb 0.07 -3.22 -0.08 0.00 0.00 0.00 0.00 23.12 19.90 4rsd s ALA 64 CO 0.02 -0.23 0.62 0.00 0.00 0.00 0.00 175.76 176.18 4rsd h LYS 66 N 2.29 0.08 -0.11 0.00 1.57 -1.97 0.21 116.57 118.65 4rsd h LYS 66 Ca -0.47 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 4rsd h LYS 66 Cb 1.17 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.47 4rsd h LYS 66 CO 0.67 0.05 0.00 0.27 -0.57 0.00 0.00 179.45 179.88 4rsd n ASN 67 N -4.37 0.94 0.00 0.86 0.23 -1.26 -4.90 115.26 106.76 4rsd n ASN 67 Ca 0.14 -1.65 0.00 0.00 -0.53 0.00 0.00 54.58 52.53 4rsd n ASN 67 Cb 0.72 -0.07 0.00 0.00 -2.08 0.00 0.00 39.78 38.35 4rsd n ASN 67 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 4rsd n GLY 68 N 0.95 1.39 3.77 4.83 0.00 0.75 -5.03 105.19 111.85 4rsd n GLY 68 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 4rsd n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 4rsd s GLN 69 N -0.43 3.01 -0.13 1.61 -0.21 -1.25 -4.73 119.66 117.54 4rsd s GLN 69 Ca 0.00 1.43 0.15 0.00 0.02 0.00 0.00 55.36 56.96 4rsd s GLN 69 Cb 0.00 -1.97 0.50 0.00 1.00 0.00 0.00 33.01 32.54 4rsd s GLN 69 CO 0.00 -1.09 1.41 0.25 -2.12 0.00 0.00 175.29 173.74 4rsd n THR 70 N -2.07 1.95 -1.35 -0.19 -2.24 -1.26 -0.33 114.28 108.78 4rsd n THR 70 Ca 0.11 -1.57 -0.22 0.00 -2.27 0.00 0.00 64.05 60.09 4rsd n THR 70 Cb 0.52 -0.03 0.15 0.00 -2.10 0.00 0.00 70.33 68.87 4rsd n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 4rsd n ASN 71 N -0.06 4.37 -4.91 3.42 6.94 -1.26 -4.78 115.26 118.97 4rsd n ASN 71 Ca 0.19 -3.70 -0.32 0.00 -0.02 0.00 0.00 54.58 50.73 4rsd n ASN 71 Cb 0.79 -0.79 -0.04 0.00 -2.36 0.00 0.00 39.78 37.37 4rsd n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 4rsd s TYR 73 N -1.40 0.21 -0.13 0.00 1.51 0.84 -0.91 117.35 117.47 4rsd s TYR 73 Ca 0.31 -0.08 -0.03 0.00 -1.01 0.00 0.00 57.07 56.25 4rsd s TYR 73 Cb -0.13 -0.13 -0.03 0.00 -0.11 0.00 0.00 41.96 41.56 4rsd s TYR 73 CO 0.23 -0.02 -0.01 -1.14 -1.11 0.00 0.00 175.55 173.50 4rsd s GLN 74 N -0.19 3.40 0.35 -0.62 0.74 0.50 -1.06 119.66 122.79 4rsd s GLN 74 Ca -0.01 -0.46 -0.28 0.00 0.05 0.00 0.00 55.36 54.66 4rsd s GLN 74 Cb -0.02 -2.89 -0.10 0.00 1.10 0.00 0.00 33.01 31.10 4rsd s GLN 74 CO -0.00 0.44 1.37 -1.54 -0.55 0.00 0.00 175.29 175.01 4rsd s SER 75 N -0.16 6.58 0.25 6.67 1.04 -0.18 -2.61 113.70 125.29 4rsd s SER 75 Ca 0.04 2.82 -0.00 0.00 0.48 0.00 0.00 55.95 59.29 4rsd s SER 75 Cb -0.13 -2.66 0.31 0.00 0.10 0.00 0.00 66.02 63.65 4rsd s SER 75 CO 0.02 -0.69 1.68 1.88 0.98 0.00 0.00 173.24 177.11 4rsd h TYR 76 N 3.18 0.67 -1.23 5.02 0.05 -1.95 -3.43 116.97 119.29 4rsd h TYR 76 Ca -0.50 -0.15 -0.55 0.00 0.05 0.00 0.00 58.73 57.58 4rsd h TYR 76 Cb 1.23 -0.16 -0.06 0.00 1.01 0.00 0.00 36.73 38.75 4rsd h TYR 76 CO 0.55 0.79 -0.40 -1.54 -1.05 0.00 0.00 178.16 176.51 4rsd s SER 77 N -6.79 4.68 0.51 3.88 1.04 -1.26 -5.07 113.70 110.69 4rsd s SER 77 Ca -0.08 -1.04 -0.15 0.00 0.48 0.00 0.00 55.95 55.17 4rsd s SER 77 Cb 0.13 -0.21 -0.07 0.00 0.10 0.00 0.00 66.02 65.97 4rsd s SER 77 CO 0.81 -0.76 0.95 0.42 0.98 0.00 0.00 173.24 175.64 4rsd s THR 78 N -2.62 4.60 0.13 2.02 -4.23 -1.26 -4.43 115.64 109.84 4rsd s THR 78 Ca 0.40 1.07 0.04 0.00 -1.18 0.00 0.00 61.69 62.02 4rsd s THR 78 Cb -0.00 -3.74 -0.04 0.00 1.34 0.00 0.00 72.50 70.06 4rsd s THR 78 CO 0.23 -0.71 -0.11 -0.04 -0.54 0.00 0.00 174.62 173.46 4rsd s MET 79 N -4.15 0.98 -0.16 3.99 -1.94 0.99 -4.82 119.30 114.19 4rsd s MET 79 Ca 0.57 -1.33 -0.29 0.00 -1.71 0.00 0.00 55.69 52.93 4rsd s MET 79 Cb -0.10 -0.62 -0.01 0.00 2.01 0.00 0.00 34.83 36.11 4rsd s MET 79 CO 0.34 0.09 1.17 0.45 -0.01 0.00 0.00 175.02 177.05 4rsd s SER 80 N -2.85 7.03 0.10 3.03 0.15 -1.26 -0.68 113.70 119.23 4rsd s SER 80 Ca 0.12 1.61 0.02 0.00 0.70 0.00 0.00 55.95 58.40 4rsd s SER 80 Cb -0.00 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.73 4rsd s SER 80 CO 0.01 -0.68 -0.07 0.27 1.20 0.00 0.00 173.24 173.96 4rsd s ILE 81 N 3.09 0.76 -0.09 6.45 -4.36 0.35 -0.57 121.20 126.83 4rsd s ILE 81 Ca 0.51 -1.88 0.00 0.00 -0.26 0.00 0.00 60.65 59.03 4rsd s ILE 81 Cb -0.20 -1.61 0.02 0.00 1.25 0.00 0.00 42.46 41.92 4rsd s ILE 81 CO 0.13 -0.80 -0.07 -0.89 0.24 0.00 0.00 174.94 173.55 4rsd s THR 82 N -3.36 0.91 -0.10 8.37 2.01 -0.01 -1.13 115.64 122.33 4rsd s THR 82 Ca 0.11 -0.25 -0.17 0.00 0.31 0.00 0.00 61.69 61.69 4rsd s THR 82 Cb 0.03 -0.92 -0.05 0.00 0.01 0.00 0.00 72.50 71.58 4rsd s THR 82 CO -0.03 0.33 0.42 -0.62 -0.69 0.00 0.00 174.62 174.03 4rsd s ASP 83 N 1.43 6.66 -0.14 3.53 2.15 0.21 -0.99 116.67 129.52 4rsd s ASP 83 Ca -0.01 0.78 0.03 0.00 0.43 0.00 0.00 52.55 53.78 4rsd s ASP 83 Cb -0.13 -2.26 0.01 0.00 -0.30 0.00 0.00 42.92 40.24 4rsd s ASP 83 CO -0.04 0.09 -0.22 0.00 -0.17 0.00 0.00 175.17 174.82 4rsd s ARG 85 N 0.80 0.07 0.52 0.00 0.52 -1.01 -0.86 118.95 118.98 4rsd s ARG 85 Ca -0.07 -0.02 -0.22 0.00 -0.52 0.00 0.00 55.73 54.90 4rsd s ARG 85 Cb -0.16 -0.07 -0.06 0.00 0.52 0.00 0.00 34.95 35.18 4rsd s ARG 85 CO -0.02 0.01 1.26 -1.21 0.02 0.00 0.00 175.30 175.36 4rsd s GLU 86 N 0.03 3.37 0.66 3.54 2.02 -0.65 -0.21 118.70 127.46 4rsd s GLU 86 Ca -0.00 1.98 0.02 0.00 0.02 0.00 0.00 54.97 56.99 4rsd s GLU 86 Cb -0.01 -2.27 0.11 0.00 0.10 0.00 0.00 34.13 32.06 4rsd s GLU 86 CO -0.00 -0.93 0.92 0.95 0.02 0.00 0.00 175.26 176.21 4rsd s THR 87 N -1.45 2.19 -0.40 3.63 -4.23 -0.96 -4.79 115.64 109.64 4rsd s THR 87 Ca 0.69 -0.72 0.27 0.00 -1.18 0.00 0.00 61.69 60.75 4rsd s THR 87 Cb -0.34 -2.48 0.31 0.00 1.34 0.00 0.00 72.50 71.33 4rsd s THR 87 CO 0.40 0.00 1.78 1.23 -0.54 0.00 0.00 174.62 177.49 4rsd h GLY 88 N -0.28 0.00 -3.25 3.99 0.00 -1.96 -2.91 103.07 98.67 4rsd h GLY 88 Ca -0.35 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 46.71 4rsd h GLY 88 CO 0.41 0.00 0.34 1.44 0.00 0.00 0.00 176.54 178.73 4rsd n SER 89 N -2.58 3.74 -4.34 0.19 7.64 -1.26 -4.87 113.62 112.13 4rsd n SER 89 Ca 0.03 -3.01 -0.35 0.00 1.01 0.00 0.00 58.87 56.56 4rsd n SER 89 Cb 0.35 -0.71 -0.14 0.00 -1.01 0.00 0.00 64.21 62.70 4rsd n SER 89 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 4rsd s SER 90 N -0.59 4.36 -0.04 6.43 0.15 -1.10 -4.78 113.70 118.13 4rsd s SER 90 Ca 0.40 -0.35 -0.02 0.00 0.70 0.00 0.00 55.95 56.68 4rsd s SER 90 Cb 0.33 -1.74 0.03 0.00 -1.71 0.00 0.00 66.02 62.93 4rsd s SER 90 CO 0.09 0.02 0.06 -0.54 1.20 0.00 0.00 173.24 174.07 4rsd s LYS 91 N 1.24 -0.07 0.37 5.44 1.02 -1.11 -4.92 119.74 121.70 4rsd s LYS 91 Ca 0.03 0.37 -0.28 0.00 0.02 0.00 0.00 55.97 56.11 4rsd s LYS 91 Cb -0.14 -0.47 -0.11 0.00 -0.52 0.00 0.00 37.83 36.58 4rsd s LYS 91 CO -0.01 -0.31 1.43 0.98 -0.92 0.00 0.00 175.35 176.51 4rsd n TYR 92 N 5.19 2.78 1.13 3.18 4.19 -1.26 0.28 117.16 132.65 4rsd n TYR 92 Ca -0.06 0.48 0.04 0.00 3.31 0.00 0.00 57.90 61.67 4rsd n TYR 92 Cb 0.50 -2.50 0.11 0.00 0.49 0.00 0.00 39.34 37.95 4rsd n TYR 92 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 4rsd n PRO 93 N 0.47 1.64 -3.07 2.98 -0.04 -1.26 -4.97 135.00 130.75 4rsd n PRO 93 Ca 0.02 -0.92 -0.44 0.00 -0.04 0.00 0.00 63.50 62.12 4rsd n PRO 93 Cb 0.38 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.61 4rsd n PRO 93 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 4rsd n ASN 94 N 0.24 5.66 -4.76 3.54 5.03 0.79 -5.00 115.26 120.76 4rsd n ASN 94 Ca 0.09 -3.13 -0.40 0.00 0.87 0.00 0.00 54.58 52.00 4rsd n ASN 94 Cb 0.24 -1.40 -0.04 0.00 -1.02 0.00 0.00 39.78 37.56 4rsd n ASN 94 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 4rsd s ALA 96 N -1.16 0.52 0.07 0.00 0.00 -1.26 -4.97 121.76 114.96 4rsd s ALA 96 Ca 0.46 -0.07 0.06 0.00 0.00 0.00 0.00 51.96 52.41 4rsd s ALA 96 Cb -0.34 -0.28 -0.03 0.00 0.00 0.00 0.00 23.12 22.47 4rsd s ALA 96 CO 0.44 0.03 -0.17 0.71 0.00 0.00 0.00 175.76 176.77 4rsd s TYR 97 N 0.54 1.44 -0.10 0.00 2.02 -1.26 -2.25 117.35 117.73 4rsd s TYR 97 Ca -0.06 -0.43 -0.16 0.00 -0.37 0.00 0.00 57.07 56.05 4rsd s TYR 97 Cb -0.10 -0.81 -0.05 0.00 -0.40 0.00 0.00 41.96 40.61 4rsd s TYR 97 CO -0.00 0.10 0.42 0.21 -1.57 0.00 0.00 175.55 174.71 4rsd s LYS 98 N -1.67 4.22 -0.23 -0.62 2.20 0.70 -4.63 119.74 119.71 4rsd s LYS 98 Ca 0.02 0.36 -0.10 0.00 -0.36 0.00 0.00 55.97 55.89 4rsd s LYS 98 Cb -0.10 -3.38 -0.05 0.00 -1.51 0.00 0.00 37.83 32.80 4rsd s LYS 98 CO 0.03 0.31 0.13 0.99 -0.36 0.00 0.00 175.35 176.45 4rsd s THR 99 N 0.16 5.18 -0.19 3.43 2.01 -1.26 -2.41 115.64 122.56 4rsd s THR 99 Ca 0.23 0.12 -0.01 0.00 0.31 0.00 0.00 61.69 62.34 4rsd s THR 99 Cb -0.15 -3.40 0.05 0.00 0.01 0.00 0.00 72.50 69.01 4rsd s THR 99 CO 0.10 0.37 -0.02 -0.89 -0.69 0.00 0.00 174.62 173.48 4rsd s THR 100 N 0.93 1.03 0.12 -0.82 2.01 -0.55 -4.98 115.64 113.38 4rsd s THR 100 Ca 0.07 -0.76 -0.17 0.00 0.31 0.00 0.00 61.69 61.13 4rsd s THR 100 Cb -0.13 -1.33 -0.07 0.00 0.01 0.00 0.00 72.50 70.97 4rsd s THR 100 CO 0.03 -0.04 0.58 -1.58 -0.69 0.00 0.00 174.62 172.93 4rsd s GLN 101 N 1.64 4.12 0.25 4.92 2.00 -1.26 -0.62 119.66 130.71 4rsd s GLN 101 Ca -0.02 0.66 -0.22 0.00 -2.00 0.00 0.00 55.36 53.79 4rsd s GLN 101 Cb -0.17 -3.07 0.03 0.00 0.80 0.00 0.00 33.01 30.60 4rsd s GLN 101 CO -0.07 0.54 0.72 0.00 -0.50 0.00 0.00 175.29 175.98 4rsd s ALA 102 N -1.30 -1.31 -0.29 1.58 0.00 -0.28 -4.99 121.76 115.16 4rsd s ALA 102 Ca 0.34 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.16 4rsd s ALA 102 Cb -0.17 0.84 0.06 0.00 0.00 0.00 0.00 23.12 23.84 4rsd s ALA 102 CO 0.19 -1.00 -0.04 -0.80 0.00 0.00 0.00 175.76 174.12 4rsd s ASN 103 N -2.89 4.71 0.24 0.00 0.01 -1.26 -0.50 114.94 115.25 4rsd s ASN 103 Ca 0.10 -1.38 -0.11 0.00 -0.71 0.00 0.00 52.86 50.76 4rsd s ASN 103 Cb -0.05 -1.64 -0.01 0.00 0.41 0.00 0.00 41.25 39.96 4rsd s ASN 103 CO 0.04 -0.24 0.42 -1.59 -1.51 0.00 0.00 177.10 174.21 4rsd s LYS 104 N 1.17 1.49 0.40 -0.60 -2.85 0.15 -4.76 119.74 114.74 4rsd s LYS 104 Ca -0.06 -1.32 -0.23 0.00 -1.00 0.00 0.00 55.97 53.36 4rsd s LYS 104 Cb -0.20 0.44 -0.09 0.00 -2.06 0.00 0.00 37.83 35.92 4rsd s LYS 104 CO -0.03 -0.60 1.02 -1.01 0.10 0.00 0.00 175.35 174.83 4rsd s HIS 105 N -4.04 3.30 0.17 1.78 3.76 0.08 -0.00 115.29 120.34 4rsd s HIS 105 Ca 0.25 1.65 0.07 0.00 -0.15 0.00 0.00 55.06 56.88 4rsd s HIS 105 Cb 0.01 -3.05 -0.04 0.00 1.11 0.00 0.00 32.58 30.61 4rsd s HIS 105 CO 0.10 -0.46 0.02 0.96 -0.85 0.00 0.00 174.74 174.51 4rsd s ILE 106 N -1.77 3.83 -0.12 0.60 -4.36 -1.26 -0.86 121.20 117.26 4rsd s ILE 106 Ca 0.58 -1.37 0.02 0.00 -0.26 0.00 0.00 60.65 59.63 4rsd s ILE 106 Cb -0.19 -2.93 0.01 0.00 1.25 0.00 0.00 42.46 40.60 4rsd s ILE 106 CO 0.24 -0.11 -0.19 -0.63 0.24 0.00 0.00 174.94 174.49 4rsd s ILE 107 N -1.73 1.77 0.16 8.37 1.01 0.42 -1.01 121.20 130.20 4rsd s ILE 107 Ca 0.28 -0.81 0.05 0.00 0.00 0.00 0.00 60.65 60.16 4rsd s ILE 107 Cb -0.09 -1.59 -0.05 0.00 0.01 0.00 0.00 42.46 40.74 4rsd s ILE 107 CO 0.19 0.50 -0.10 0.68 0.00 0.00 0.00 174.94 176.21 4rsd s VAL 108 N 0.84 1.24 -0.15 2.92 -7.23 -0.22 -1.30 120.40 116.50 4rsd s VAL 108 Ca -0.08 -2.08 -0.05 0.00 -1.81 0.00 0.00 61.98 57.95 4rsd s VAL 108 Cb -0.15 -1.93 -0.04 0.00 0.56 0.00 0.00 36.38 34.82 4rsd s VAL 108 CO -0.00 -0.68 0.04 0.00 -0.31 0.00 0.00 175.10 174.14 4rsd s ALA 109 N -3.28 3.35 0.16 1.32 0.00 -0.43 -0.11 121.76 122.78 4rsd s ALA 109 Ca 0.19 -0.76 0.09 0.00 0.00 0.00 0.00 51.96 51.48 4rsd s ALA 109 Cb 0.02 -1.76 -0.04 0.00 0.00 0.00 0.00 23.12 21.35 4rsd s ALA 109 CO 0.02 0.33 -0.15 0.00 0.00 0.00 0.00 175.76 175.96 4rsd s GLU 111 N -2.60 1.13 0.27 0.00 2.02 -0.47 -4.89 118.70 114.17 4rsd s GLU 111 Ca 0.22 -0.50 0.00 0.00 0.02 0.00 0.00 54.97 54.71 4rsd s GLU 111 Cb -0.09 0.47 0.00 0.00 0.10 0.00 0.00 34.13 34.61 4rsd s GLU 111 CO 0.13 -0.51 0.00 0.41 0.02 0.00 0.00 175.26 175.31 4rsd n GLY 112 N -0.35 -2.28 2.75 -1.39 0.00 -1.26 -2.22 105.19 100.45 4rsd n GLY 112 Ca -0.10 -1.85 -0.18 0.00 0.00 0.00 0.00 46.02 43.89 4rsd n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 4rsd s ASN 113 N -3.19 1.40 0.83 1.61 3.84 -1.26 -2.19 114.94 115.98 4rsd s ASN 113 Ca 0.00 -0.29 -0.11 0.00 0.21 0.00 0.00 52.86 52.68 4rsd s ASN 113 Cb 0.00 0.42 0.09 0.00 -0.55 0.00 0.00 41.25 41.21 4rsd s ASN 113 CO 0.00 -0.34 1.10 -2.16 -2.79 0.00 0.00 177.10 172.91 4rsd s PRO 114 N 2.34 1.80 -0.61 0.43 0.04 -1.26 -5.08 135.00 132.66 4rsd s PRO 114 Ca 0.08 1.11 -0.26 0.00 0.04 0.00 0.00 61.00 61.97 4rsd s PRO 114 Cb -0.16 -1.85 0.04 0.00 0.04 0.00 0.00 34.50 32.57 4rsd s PRO 114 CO -0.15 -1.95 1.12 -0.47 0.04 0.00 0.00 177.00 175.58 4rsd s TYR 115 N -2.88 2.60 0.30 0.56 5.04 -0.93 -4.86 117.35 117.19 4rsd s TYR 115 Ca 0.62 0.11 0.03 0.00 -2.44 0.00 0.00 57.07 55.39 4rsd s TYR 115 Cb -0.18 -4.39 -0.05 0.00 0.35 0.00 0.00 41.96 37.69 4rsd s TYR 115 CO 0.57 -1.62 0.09 0.14 -1.34 0.00 0.00 175.55 173.39 4rsd s VAL 116 N 4.74 0.78 0.21 3.14 -7.23 -0.94 -4.82 120.40 116.26 4rsd s VAL 116 Ca 0.36 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.23 4rsd s VAL 116 Cb -0.10 -2.65 -0.09 0.00 0.56 0.00 0.00 36.38 34.10 4rsd s VAL 116 CO 0.20 0.00 1.35 -2.84 -0.31 0.00 0.00 175.10 173.50 4rsd s PRO 117 N -3.92 4.35 0.00 4.82 0.02 -1.26 -1.37 135.00 137.64 4rsd s PRO 117 Ca 0.36 2.12 0.00 0.00 0.02 0.00 0.00 61.00 63.49 4rsd s PRO 117 Cb 0.07 -3.18 0.00 0.00 0.02 0.00 0.00 34.50 31.42 4rsd s PRO 117 CO 0.15 -0.31 0.00 1.33 -0.33 0.00 0.00 177.00 177.84 4rsd n VAL 118 N 2.65 0.00 -3.78 3.83 0.24 0.11 -4.62 118.33 116.76 4rsd n VAL 118 Ca 0.07 -0.05 -0.13 0.00 -2.04 0.00 0.00 64.34 62.19 4rsd n VAL 118 Cb 0.42 0.50 -0.12 0.00 -1.47 0.00 0.00 33.84 33.17 4rsd n VAL 118 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 4rsd s HIS 119 N -1.65 -0.26 -0.41 6.34 5.65 -1.07 -4.64 115.29 119.25 4rsd s HIS 119 Ca 0.00 0.64 -0.20 0.00 0.25 0.00 0.00 55.06 55.75 4rsd s HIS 119 Cb 0.00 0.08 0.02 0.00 -1.18 0.00 0.00 32.58 31.49 4rsd s HIS 119 CO 0.00 -0.14 0.62 0.12 -0.65 0.00 0.00 174.74 174.68 4rsd s PHE 120 N 0.35 3.10 -0.18 3.88 2.19 -1.26 -1.31 117.98 124.74 4rsd s PHE 120 Ca -0.02 0.02 -0.20 0.00 0.33 0.00 0.00 56.93 57.06 4rsd s PHE 120 Cb -0.03 -3.24 -0.17 0.00 -1.31 0.00 0.00 43.02 38.26 4rsd s PHE 120 CO -0.01 -0.79 0.23 0.00 1.83 0.00 0.00 175.22 176.48 4rsd h ALA 121 N 8.76 0.18 -2.43 11.12 0.00 -1.55 -3.49 119.26 131.85 4rsd h ALA 121 Ca -0.26 -0.96 0.20 0.00 0.00 0.00 0.00 54.91 53.89 4rsd h ALA 121 Cb 1.10 0.57 -0.04 0.00 0.00 0.00 0.00 17.79 19.43 4rsd h ALA 121 CO 0.87 0.54 0.64 0.00 0.00 0.00 0.00 179.25 181.30 4rsd n ALA 122 N -3.30 -2.82 -2.86 0.00 0.00 -1.13 -5.00 120.51 105.40 4rsd n ALA 122 Ca -0.24 -0.94 -0.13 0.00 0.00 0.00 0.00 53.44 52.13 4rsd n ALA 122 Cb 0.56 0.46 -0.12 0.00 0.00 0.00 0.00 19.45 20.35 4rsd n ALA 122 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 4rsd s SER 123 N -3.46 0.71 0.00 0.00 1.04 -1.26 -0.44 113.70 110.30 4rsd s SER 123 Ca 0.24 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.20 4rsd s SER 123 Cb -0.02 0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.13 4rsd s SER 123 CO 0.04 -0.18 0.18 1.33 0.98 0.00 0.00 173.24 175.59