#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w5m s GLU 2 N 0.00 4.26 0.64 1.64 2.12 -1.26 -5.02 118.70 121.09 2w5m s GLU 2 Ca 0.00 2.09 -0.11 0.00 0.36 0.00 0.00 54.97 57.31 2w5m s GLU 2 Cb 0.00 -3.53 -0.02 0.00 0.26 0.00 0.00 34.13 30.83 2w5m s GLU 2 CO 0.00 -0.60 1.04 0.95 -0.54 0.00 0.00 175.26 176.11 2w5m s THR 3 N 2.28 4.43 0.32 -1.70 -4.23 -1.26 -4.88 115.64 110.60 2w5m s THR 3 Ca 0.67 0.81 0.01 0.00 -1.18 0.00 0.00 61.69 62.00 2w5m s THR 3 Cb -0.35 -3.68 0.21 0.00 1.34 0.00 0.00 72.50 70.02 2w5m s THR 3 CO 0.29 -1.01 1.91 0.00 -0.54 0.00 0.00 174.62 175.27 2w5m h ALA 4 N -0.40 1.38 -0.70 3.99 0.00 -1.95 -0.85 119.26 120.72 2w5m h ALA 4 Ca -0.44 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.29 2w5m h ALA 4 Cb 1.20 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 2w5m h ALA 4 CO 0.60 0.48 0.24 0.00 0.00 0.00 0.00 179.25 180.57 2w5m h ALA 5 N 1.47 0.92 -0.07 0.00 0.00 -1.88 -1.89 119.26 117.82 2w5m h ALA 5 Ca 0.20 -0.21 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 2w5m h ALA 5 Cb 0.11 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2w5m h ALA 5 CO -0.02 0.58 -0.59 0.00 0.00 0.00 0.00 179.25 179.22 2w5m h ALA 6 N 1.11 0.87 -0.38 0.00 0.00 -1.78 -2.54 119.26 116.54 2w5m h ALA 6 Ca 0.23 -0.53 -0.11 0.00 0.00 0.00 0.00 54.91 54.50 2w5m h ALA 6 Cb 0.28 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2w5m h ALA 6 CO -0.01 0.72 -0.20 -0.22 0.00 0.00 0.00 179.25 179.54 2w5m h LYS 7 N 0.18 0.73 -0.72 0.00 3.64 -1.07 -0.47 116.57 118.87 2w5m h LYS 7 Ca -0.00 -0.28 -0.02 0.00 -1.27 0.00 0.00 60.65 59.07 2w5m h LYS 7 Cb 1.08 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.83 2w5m h LYS 7 CO 0.09 0.88 0.36 0.35 -2.27 0.00 0.00 179.45 178.86 2w5m h PHE 8 N 0.65 1.03 -0.49 1.91 3.57 -1.05 -0.72 116.94 121.84 2w5m h PHE 8 Ca 0.10 -0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 2w5m h PHE 8 Cb 0.69 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 2w5m h PHE 8 CO 0.03 0.76 0.16 0.93 -2.23 0.00 0.00 178.31 177.96 2w5m h GLU 9 N 1.01 0.76 -0.02 1.11 5.08 -1.05 0.58 114.58 122.04 2w5m h GLU 9 Ca 0.25 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2w5m h GLU 9 Cb 0.10 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 2w5m h GLU 9 CO -0.03 0.71 0.01 -0.09 -1.00 0.00 0.00 179.01 178.60 2w5m h ARG 10 N 0.66 0.03 -0.04 2.33 2.43 -0.86 -2.37 114.38 116.57 2w5m h ARG 10 Ca 0.16 -0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 59.16 2w5m h ARG 10 Cb 0.26 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 2w5m h ARG 10 CO -0.01 0.21 -0.70 1.96 -1.51 0.00 0.00 179.97 179.93 2w5m h GLN 11 N -0.15 0.18 0.00 0.20 4.20 -1.10 -3.42 115.11 115.03 2w5m h GLN 11 Ca 0.01 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.57 2w5m h GLN 11 Cb 0.19 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.00 2w5m h GLN 11 CO -0.00 0.80 -0.09 0.72 -0.67 0.00 0.00 178.83 179.59 2w5m n HIS 12 N -3.78 0.00 -3.88 2.96 8.25 0.19 -4.68 115.22 114.27 2w5m n HIS 12 Ca -0.02 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.08 2w5m n HIS 12 Cb 0.68 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.68 2w5m n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2w5m s MET 13 N -0.92 3.78 -0.41 -0.41 -1.94 -0.89 0.42 119.30 118.92 2w5m s MET 13 Ca 0.00 -0.43 0.06 0.00 -1.71 0.00 0.00 55.69 53.61 2w5m s MET 13 Cb 0.00 -3.28 0.20 0.00 2.01 0.00 0.00 34.83 33.76 2w5m s MET 13 CO 0.00 -0.00 0.44 -3.47 -0.01 0.00 0.00 175.02 171.98 2w5m n ASP 14 N 4.37 -0.56 0.00 3.03 2.03 -0.56 -4.85 116.55 120.01 2w5m n ASP 14 Ca -0.16 -2.54 0.06 0.00 0.52 0.00 0.00 54.79 52.66 2w5m n ASP 14 Cb 0.52 -0.34 0.30 0.00 -0.72 0.00 0.00 41.12 40.88 2w5m n ASP 14 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2w5m n SER 15 N 2.34 0.00 -1.39 1.67 7.64 -1.26 -3.92 113.62 118.70 2w5m n SER 15 Ca 0.26 -0.03 -0.03 0.00 1.01 0.00 0.00 58.87 60.08 2w5m n SER 15 Cb 0.51 -0.20 0.16 0.00 -1.01 0.00 0.00 64.21 63.67 2w5m n SER 15 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2w5m n SER 16 N -1.20 3.42 -3.54 6.43 3.41 -1.26 -4.84 113.62 116.04 2w5m n SER 16 Ca 0.06 -2.63 -0.13 0.00 -0.26 0.00 0.00 58.87 55.92 2w5m n SER 16 Cb 0.07 -0.63 -0.05 0.00 -0.26 0.00 0.00 64.21 63.35 2w5m n SER 16 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2w5m s THR 17 N -1.81 0.00 0.10 6.66 -4.23 -1.25 -5.05 115.64 110.06 2w5m s THR 17 Ca 0.29 0.00 0.12 0.00 -1.18 0.00 0.00 61.69 60.91 2w5m s THR 17 Cb 0.23 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 73.02 2w5m s THR 17 CO 0.07 0.00 1.48 -1.28 -0.54 0.00 0.00 174.62 174.35 2w5m h SER 18 N 2.61 0.00 -5.11 3.99 0.87 -1.88 -3.44 113.55 110.59 2w5m h SER 18 Ca -0.22 0.00 0.13 0.00 -1.23 0.00 0.00 61.79 60.46 2w5m h SER 18 Cb 1.17 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 63.04 2w5m h SER 18 CO 0.34 0.69 0.41 0.00 -0.53 0.00 0.00 176.83 177.73 2w5m s ALA 19 N -3.14 -1.58 0.01 6.23 0.00 -1.26 -4.85 121.76 117.18 2w5m s ALA 19 Ca 0.01 0.21 -0.35 0.00 0.00 0.00 0.00 51.96 51.82 2w5m s ALA 19 Cb 0.10 0.67 -0.14 0.00 0.00 0.00 0.00 23.12 23.76 2w5m s ALA 19 CO 0.77 -0.96 1.66 0.00 0.00 0.00 0.00 175.76 177.23 2w5m n ALA 20 N -0.42 0.65 -0.04 0.00 0.00 -1.26 -4.91 120.51 114.52 2w5m n ALA 20 Ca -0.07 0.40 -0.13 0.00 0.00 0.00 0.00 53.44 53.64 2w5m n ALA 20 Cb 0.61 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.72 2w5m n ALA 20 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2w5m h SER 21 N 6.96 0.83 -5.16 0.00 4.64 -2.00 -3.48 113.55 115.35 2w5m h SER 21 Ca -0.47 -0.44 -0.02 0.00 -0.47 0.00 0.00 61.79 60.39 2w5m h SER 21 Cb 1.28 -0.24 -0.08 0.00 -0.31 0.00 0.00 62.40 63.05 2w5m h SER 21 CO 0.90 1.21 -0.01 -0.94 -0.87 0.00 0.00 176.83 177.11 2w5m s SER 22 N -6.94 -0.16 0.65 4.97 1.04 -1.26 -5.01 113.70 107.00 2w5m s SER 22 Ca -0.09 -0.78 0.41 0.00 0.48 0.00 0.00 55.95 55.96 2w5m s SER 22 Cb 0.11 0.62 2.27 0.00 0.10 0.00 0.00 66.02 69.12 2w5m s SER 22 CO 0.87 -1.18 2.33 0.28 0.98 0.00 0.00 173.24 176.52 2w5m h SER 23 N 2.19 0.00 -0.21 7.02 0.02 -1.95 -0.96 113.55 119.67 2w5m h SER 23 Ca -0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2w5m h SER 23 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 2w5m h SER 23 CO 0.33 0.00 0.00 -3.20 -1.14 0.00 0.00 176.83 172.82 2w5m n ASN 24 N -3.22 2.15 -0.08 3.07 5.15 -1.26 -4.45 115.26 116.62 2w5m n ASN 24 Ca -0.03 -1.78 -0.07 0.00 -0.60 0.00 0.00 54.58 52.10 2w5m n ASN 24 Cb 0.10 -0.13 -0.00 0.00 -0.53 0.00 0.00 39.78 39.21 2w5m n ASN 24 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 2w5m h TYR 25 N 2.89 -0.42 -0.38 1.20 3.20 -1.56 -2.18 116.97 119.72 2w5m h TYR 25 Ca 0.00 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 2w5m h TYR 25 Cb 0.63 0.23 -0.02 0.00 1.54 0.00 0.00 36.73 39.12 2w5m h TYR 25 CO 0.13 -0.24 0.16 0.00 -1.64 0.00 0.00 178.16 176.57 2w5m h ASN 27 N 0.48 0.12 -0.01 0.00 2.35 -1.75 0.94 115.58 117.71 2w5m h ASN 27 Ca 0.13 0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2w5m h ASN 27 Cb 0.17 0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.65 2w5m h ASN 27 CO -0.01 0.07 -0.01 1.56 -1.65 0.00 0.00 177.43 177.38 2w5m h GLN 28 N 0.34 0.02 -0.37 0.81 7.50 -1.10 -3.04 115.11 119.28 2w5m h GLN 28 Ca 0.32 -0.01 -0.07 0.00 0.50 0.00 0.00 58.65 59.39 2w5m h GLN 28 Cb 0.45 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.97 2w5m h GLN 28 CO -0.36 0.60 -0.04 0.52 -1.50 0.00 0.00 178.83 178.04 2w5m h MET 29 N -0.56 0.68 -0.68 1.46 2.86 -0.65 -1.15 114.93 116.88 2w5m h MET 29 Ca 0.00 -0.24 0.03 0.00 -2.06 0.00 0.00 59.70 57.43 2w5m h MET 29 Cb 0.60 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.17 2w5m h MET 29 CO 0.00 0.81 0.43 0.52 1.06 0.00 0.00 176.91 179.73 2w5m h MET 30 N 0.48 0.82 -0.19 1.72 2.07 -0.94 -1.15 114.93 117.74 2w5m h MET 30 Ca 0.10 -0.05 -0.01 0.00 -2.07 0.00 0.00 59.70 57.67 2w5m h MET 30 Cb 0.53 -0.18 -0.01 0.00 -1.87 0.00 0.00 31.60 30.07 2w5m h MET 30 CO 0.03 0.54 0.08 -0.22 1.07 0.00 0.00 176.91 178.41 2w5m h LYS 31 N 0.84 0.28 0.00 1.72 3.64 -1.39 -1.54 116.57 120.12 2w5m h LYS 31 Ca 0.27 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 2w5m h LYS 31 Cb 0.01 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.78 2w5m h LYS 31 CO -0.10 0.34 -0.03 0.66 -2.27 0.00 0.00 179.45 178.05 2w5m h SER 32 N 0.16 0.00 -0.49 4.20 4.64 -0.76 -1.76 113.55 119.54 2w5m h SER 32 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2w5m h SER 32 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 2w5m h SER 32 CO -0.01 0.03 0.00 0.54 -0.87 0.00 0.00 176.83 176.52 2w5m n ARG 33 N -3.12 2.17 -1.77 4.77 5.12 -0.47 -4.94 116.66 118.42 2w5m n ARG 33 Ca 0.01 -1.82 -0.09 0.00 -1.93 0.00 0.00 57.85 54.03 2w5m n ARG 33 Cb 0.38 -1.40 -0.02 0.00 -1.16 0.00 0.00 32.46 30.26 2w5m n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2w5m n ASN 34 N 0.98 -3.48 -1.34 0.55 3.02 -0.66 -4.83 115.26 109.49 2w5m n ASN 34 Ca 0.17 0.09 0.10 0.00 -0.03 0.00 0.00 54.58 54.91 2w5m n ASN 34 Cb 0.43 -2.33 0.31 0.00 -0.61 0.00 0.00 39.78 37.59 2w5m n ASN 34 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2w5m n LEU 35 N -1.13 3.92 -0.10 3.41 4.77 -0.58 -3.77 117.00 123.51 2w5m n LEU 35 Ca -0.10 -1.97 0.04 0.00 -0.03 0.00 0.00 56.01 53.96 2w5m n LEU 35 Cb 0.45 -0.49 0.05 0.00 -2.33 0.00 0.00 43.42 41.11 2w5m n LEU 35 CO 0.13 0.86 0.46 0.35 -1.33 0.00 0.00 177.39 177.86 2w5m n THR 36 N 1.35 1.08 0.24 -5.08 -2.24 -1.23 -2.07 114.28 106.33 2w5m n THR 36 Ca 0.23 -1.23 -0.15 0.00 -2.27 0.00 0.00 64.05 60.63 2w5m n THR 36 Cb 0.66 0.27 -0.08 0.00 -2.10 0.00 0.00 70.33 69.08 2w5m n THR 36 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2w5m h LYS 37 N 0.00 -0.59 -0.00 -0.78 3.64 -1.91 -3.37 116.57 113.56 2w5m h LYS 37 Ca 0.00 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2w5m h LYS 37 Cb 0.89 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 2w5m h LYS 37 CO 0.00 -0.30 -0.10 -0.25 -2.27 0.00 0.00 179.45 176.52 2w5m n ASP 38 N -5.28 0.48 -3.54 4.20 8.00 -1.26 -5.04 116.55 114.10 2w5m n ASP 38 Ca -0.11 -0.74 -0.07 0.00 0.71 0.00 0.00 54.79 54.58 2w5m n ASP 38 Cb 0.29 0.71 -0.02 0.00 -0.02 0.00 0.00 41.12 42.09 2w5m n ASP 38 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2w5m s ARG 39 N -1.00 0.77 -0.36 -1.24 1.70 -1.26 -5.10 118.95 112.45 2w5m s ARG 39 Ca 0.02 -0.30 -0.26 0.00 -0.47 0.00 0.00 55.73 54.72 2w5m s ARG 39 Cb 0.03 0.34 0.01 0.00 -0.57 0.00 0.00 34.95 34.76 2w5m s ARG 39 CO 0.10 -0.34 0.92 0.00 -1.08 0.00 0.00 175.30 174.90 2w5m n LYS 41 N 6.74 2.84 -0.23 0.00 4.81 -0.88 -4.88 118.16 126.56 2w5m n LYS 41 Ca 0.07 1.04 -0.07 0.00 -0.87 0.00 0.00 58.31 58.48 2w5m n LYS 41 Cb 0.48 -2.99 0.03 0.00 0.02 0.00 0.00 35.03 32.57 2w5m n LYS 41 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 2w5m h PRO 42 N 10.51 0.99 -3.48 1.64 0.11 -1.94 -3.44 132.00 136.40 2w5m h PRO 42 Ca -0.50 -0.21 -0.26 0.00 0.11 0.00 0.00 66.00 65.14 2w5m h PRO 42 Cb 1.24 -0.14 -0.31 0.00 0.11 0.00 0.00 31.00 31.89 2w5m h PRO 42 CO 0.94 0.87 -0.67 0.08 -0.21 0.00 0.00 178.00 179.01 2w5m s VAL 43 N -5.41 -0.04 -0.19 3.15 1.01 -1.26 -0.89 120.40 116.77 2w5m s VAL 43 Ca -0.13 0.14 -0.16 0.00 0.00 0.00 0.00 61.98 61.83 2w5m s VAL 43 Cb 0.14 -0.12 0.05 0.00 0.00 0.00 0.00 36.38 36.45 2w5m s VAL 43 CO 0.82 0.06 0.50 0.21 0.00 0.00 0.00 175.10 176.68 2w5m s ASN 44 N 0.78 -0.54 -0.10 3.32 2.47 -0.36 -5.01 114.94 115.49 2w5m s ASN 44 Ca -0.06 1.01 -0.01 0.00 0.42 0.00 0.00 52.86 54.23 2w5m s ASN 44 Cb -0.09 1.01 -0.03 0.00 -1.45 0.00 0.00 41.25 40.70 2w5m s ASN 44 CO -0.03 -0.18 -0.07 -0.89 -3.72 0.00 0.00 177.10 172.22 2w5m s THR 45 N 0.43 3.67 -0.10 -5.21 2.01 -1.26 -0.68 115.64 114.51 2w5m s THR 45 Ca -0.01 -0.47 -0.01 0.00 0.31 0.00 0.00 61.69 61.50 2w5m s THR 45 Cb -0.04 -2.54 -0.03 0.00 0.01 0.00 0.00 72.50 69.90 2w5m s THR 45 CO -0.01 0.56 -0.03 -0.36 -0.69 0.00 0.00 174.62 174.08 2w5m s PHE 46 N -0.30 3.04 -0.13 4.92 0.08 0.03 -4.39 117.98 121.23 2w5m s PHE 46 Ca 0.04 -0.01 -0.02 0.00 0.12 0.00 0.00 56.93 57.07 2w5m s PHE 46 Cb -0.13 -1.81 -0.02 0.00 -0.57 0.00 0.00 43.02 40.49 2w5m s PHE 46 CO 0.02 0.27 -0.07 0.08 -0.10 0.00 0.00 175.22 175.43 2w5m s VAL 47 N -0.49 3.64 -0.81 -0.44 1.01 0.17 -0.62 120.40 122.85 2w5m s VAL 47 Ca 0.08 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.62 2w5m s VAL 47 Cb -0.12 -2.55 0.33 0.00 0.00 0.00 0.00 36.38 34.04 2w5m s VAL 47 CO 0.02 0.53 1.41 1.41 0.00 0.00 0.00 175.10 178.47 2w5m n HIS 48 N 3.22 3.39 -4.33 5.22 -0.00 0.56 -1.50 115.22 121.78 2w5m n HIS 48 Ca -0.18 -3.24 -0.17 0.00 -0.00 0.00 0.00 57.72 54.13 2w5m n HIS 48 Cb 0.53 -0.86 -0.10 0.00 -0.00 0.00 0.00 29.99 29.56 2w5m n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 2w5m s GLU 49 N -3.92 1.41 0.65 -0.41 0.41 -1.26 -4.57 118.70 110.99 2w5m s GLU 49 Ca 0.44 -1.75 -0.16 0.00 -0.41 0.00 0.00 54.97 53.09 2w5m s GLU 49 Cb 0.24 -0.43 -0.01 0.00 -1.78 0.00 0.00 34.13 32.15 2w5m s GLU 49 CO -0.14 -0.22 1.14 -1.54 -0.49 0.00 0.00 175.26 174.00 2w5m s SER 50 N -3.33 5.06 0.27 -0.19 1.04 -1.26 -4.33 113.70 110.96 2w5m s SER 50 Ca 0.35 2.11 -0.03 0.00 0.48 0.00 0.00 55.95 58.86 2w5m s SER 50 Cb 0.07 -2.57 0.38 0.00 0.10 0.00 0.00 66.02 64.01 2w5m s SER 50 CO 0.12 -1.67 1.90 0.25 0.98 0.00 0.00 173.24 174.83 2w5m h LEU 51 N 0.23 1.06 -1.03 2.42 5.85 -1.98 -1.83 115.31 120.02 2w5m h LEU 51 Ca -0.48 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.21 2w5m h LEU 51 Cb 1.26 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 2w5m h LEU 51 CO 0.54 0.70 0.35 0.00 -0.34 0.00 0.00 178.44 179.69 2w5m h ALA 52 N 1.44 1.24 -0.31 1.25 0.00 -1.99 -0.31 119.26 120.58 2w5m h ALA 52 Ca 0.41 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 55.03 2w5m h ALA 52 Cb 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2w5m h ALA 52 CO -0.14 0.58 -0.37 -0.44 0.00 0.00 0.00 179.25 178.89 2w5m h ASP 53 N 1.04 0.76 -0.32 0.00 3.32 -1.73 -2.02 116.42 117.47 2w5m h ASP 53 Ca 0.25 -0.33 -0.13 0.00 0.02 0.00 0.00 57.03 56.84 2w5m h ASP 53 Cb 0.10 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 2w5m h ASP 53 CO -0.03 1.05 -0.30 0.58 -1.72 0.00 0.00 179.24 178.82 2w5m h VAL 54 N 0.60 1.29 0.00 -1.35 2.07 -1.04 -3.08 116.25 114.74 2w5m h VAL 54 Ca 0.06 -1.46 -0.02 0.00 0.82 0.00 0.00 66.70 66.09 2w5m h VAL 54 Cb 0.90 1.50 -0.00 0.00 -1.52 0.00 0.00 31.29 32.17 2w5m h VAL 54 CO 0.08 0.48 -0.11 1.56 0.02 0.00 0.00 177.57 179.59 2w5m h GLN 55 N 0.54 0.00 0.00 1.57 4.20 -0.97 -2.12 115.11 118.34 2w5m h GLN 55 Ca 0.05 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 2w5m h GLN 55 Cb 0.87 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.65 2w5m h GLN 55 CO 0.08 0.11 -0.01 0.00 -0.67 0.00 0.00 178.83 178.34 2w5m h ALA 56 N 1.89 1.01 -0.44 3.87 0.00 -1.28 -2.59 119.26 121.73 2w5m h ALA 56 Ca -0.00 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.02 2w5m h ALA 56 Cb 0.20 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2w5m h ALA 56 CO 0.01 0.02 0.34 0.28 0.00 0.00 0.00 179.25 179.90 2w5m h VAL 57 N 0.00 0.68 0.00 0.00 2.07 -1.41 -1.65 116.25 115.94 2w5m h VAL 57 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2w5m h VAL 57 Cb 0.43 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 2w5m h VAL 57 CO 0.00 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.59 2w5m n SER 59 N -1.33 2.93 0.00 0.00 7.64 -0.62 -5.00 113.62 117.23 2w5m n SER 59 Ca 0.05 -2.52 0.00 0.00 1.01 0.00 0.00 58.87 57.41 2w5m n SER 59 Cb 0.10 -0.32 0.00 0.00 -1.01 0.00 0.00 64.21 62.98 2w5m n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2w5m n GLN 60 N -0.37 1.12 -2.57 1.43 6.02 -0.40 -5.01 117.38 117.59 2w5m n GLN 60 Ca 0.13 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.69 2w5m n GLN 60 Cb 0.57 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.81 2w5m n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2w5m s LYS 61 N 4.37 3.93 -0.00 -1.09 2.47 -0.97 -4.87 119.74 123.58 2w5m s LYS 61 Ca 0.00 0.97 -0.30 0.00 -1.56 0.00 0.00 55.97 55.08 2w5m s LYS 61 Cb 0.00 -3.82 -0.04 0.00 -1.46 0.00 0.00 37.83 32.51 2w5m s LYS 61 CO 0.00 -1.09 1.11 1.21 0.16 0.00 0.00 175.35 176.73 2w5m s ASN 62 N 2.17 7.18 0.12 1.43 3.04 -1.26 0.15 114.94 127.78 2w5m s ASN 62 Ca 0.49 1.80 -0.02 0.00 0.04 0.00 0.00 52.86 55.17 2w5m s ASN 62 Cb -0.12 -2.57 -0.04 0.00 -1.54 0.00 0.00 41.25 36.99 2w5m s ASN 62 CO 0.22 -0.43 0.07 0.68 -3.04 0.00 0.00 177.10 174.60 2w5m s VAL 63 N 1.41 0.11 0.46 -5.21 -7.23 -0.03 -4.92 120.40 105.00 2w5m s VAL 63 Ca 0.55 -1.86 -0.21 0.00 -1.81 0.00 0.00 61.98 58.65 2w5m s VAL 63 Cb -0.24 -1.97 -0.09 0.00 0.56 0.00 0.00 36.38 34.63 2w5m s VAL 63 CO 0.26 -0.51 1.02 0.00 -0.31 0.00 0.00 175.10 175.56 2w5m s ALA 64 N -4.03 2.94 0.65 1.32 0.00 -1.26 -2.99 121.76 118.39 2w5m s ALA 64 Ca 0.22 0.59 -0.08 0.00 0.00 0.00 0.00 51.96 52.68 2w5m s ALA 64 Cb 0.07 -3.24 0.02 0.00 0.00 0.00 0.00 23.12 19.98 2w5m s ALA 64 CO 0.00 -0.21 0.99 0.00 0.00 0.00 0.00 175.76 176.55 2w5m h LYS 66 N -0.42 0.50 -0.03 0.00 3.64 -1.93 -0.95 116.57 117.37 2w5m h LYS 66 Ca -0.45 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2w5m h LYS 66 Cb 1.27 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 2w5m h LYS 66 CO 0.62 0.33 0.00 0.27 -2.27 0.00 0.00 179.45 178.40 2w5m n ASN 67 N -4.47 0.44 0.00 4.20 0.23 -1.26 -4.91 115.26 109.48 2w5m n ASN 67 Ca 0.06 -1.41 0.00 0.00 -0.53 0.00 0.00 54.58 52.70 2w5m n ASN 67 Cb 0.19 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.87 2w5m n ASN 67 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2w5m n GLY 68 N 0.92 1.11 3.72 4.83 0.00 -0.36 -5.06 105.19 110.34 2w5m n GLY 68 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 2w5m n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2w5m s GLN 69 N -0.61 2.10 -0.17 1.61 -0.21 -1.26 -4.76 119.66 116.35 2w5m s GLN 69 Ca 0.00 1.78 0.17 0.00 0.02 0.00 0.00 55.36 57.33 2w5m s GLN 69 Cb 0.00 -1.83 0.43 0.00 1.00 0.00 0.00 33.01 32.62 2w5m s GLN 69 CO 0.00 -1.87 1.32 0.25 -2.12 0.00 0.00 175.29 172.87 2w5m n THR 70 N -2.74 2.16 -1.15 -0.19 -2.24 -1.26 -0.72 114.28 108.14 2w5m n THR 70 Ca 0.14 -2.14 -0.25 0.00 -2.27 0.00 0.00 64.05 59.53 2w5m n THR 70 Cb 0.50 -0.26 0.16 0.00 -2.10 0.00 0.00 70.33 68.63 2w5m n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2w5m n ASN 71 N -0.93 4.37 -4.91 3.42 6.94 -1.26 -4.71 115.26 118.18 2w5m n ASN 71 Ca 0.20 -3.56 -0.31 0.00 -0.02 0.00 0.00 54.58 50.89 2w5m n ASN 71 Cb 0.80 -0.85 -0.04 0.00 -2.36 0.00 0.00 39.78 37.33 2w5m n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2w5m s TYR 73 N -1.55 0.48 -0.17 0.00 1.51 0.44 -0.85 117.35 117.21 2w5m s TYR 73 Ca 0.37 -0.09 -0.08 0.00 -1.01 0.00 0.00 57.07 56.26 2w5m s TYR 73 Cb -0.13 -0.40 -0.04 0.00 -0.11 0.00 0.00 41.96 41.28 2w5m s TYR 73 CO 0.26 -0.08 0.10 -1.14 -1.11 0.00 0.00 175.55 173.58 2w5m s GLN 74 N 0.40 3.88 0.32 -0.62 0.74 0.12 -1.05 119.66 123.45 2w5m s GLN 74 Ca -0.04 -0.25 -0.29 0.00 0.05 0.00 0.00 55.36 54.83 2w5m s GLN 74 Cb -0.08 -3.26 -0.10 0.00 1.10 0.00 0.00 33.01 30.67 2w5m s GLN 74 CO -0.00 0.43 1.34 -1.54 -0.55 0.00 0.00 175.29 174.96 2w5m s SER 75 N -0.03 6.73 0.18 6.67 1.04 0.02 -2.30 113.70 126.01 2w5m s SER 75 Ca 0.08 2.71 -0.09 0.00 0.48 0.00 0.00 55.95 59.13 2w5m s SER 75 Cb -0.12 -2.65 0.07 0.00 0.10 0.00 0.00 66.02 63.43 2w5m s SER 75 CO 0.00 -0.58 1.63 1.88 0.98 0.00 0.00 173.24 177.16 2w5m h TYR 76 N 3.59 1.16 -2.71 5.02 0.05 -1.94 -3.43 116.97 118.70 2w5m h TYR 76 Ca -0.49 -0.21 -0.47 0.00 0.05 0.00 0.00 58.73 57.61 2w5m h TYR 76 Cb 1.23 -0.30 0.01 0.00 1.01 0.00 0.00 36.73 38.68 2w5m h TYR 76 CO 0.56 1.04 -0.20 -1.12 -1.05 0.00 0.00 178.16 177.39 2w5m s SER 77 N -6.61 6.22 0.52 3.88 0.01 -1.26 -5.04 113.70 111.43 2w5m s SER 77 Ca -0.12 0.38 -0.16 0.00 1.31 0.00 0.00 55.95 57.36 2w5m s SER 77 Cb 0.13 -1.92 -0.07 0.00 0.21 0.00 0.00 66.02 64.37 2w5m s SER 77 CO 0.86 -0.34 0.99 0.42 0.41 0.00 0.00 173.24 175.58 2w5m s THR 78 N -2.32 4.46 0.06 1.44 -4.23 -1.26 -4.43 115.64 109.36 2w5m s THR 78 Ca 0.41 1.18 0.03 0.00 -1.18 0.00 0.00 61.69 62.13 2w5m s THR 78 Cb -0.10 -3.69 -0.03 0.00 1.34 0.00 0.00 72.50 70.03 2w5m s THR 78 CO 0.36 -0.67 -0.10 -0.04 -0.54 0.00 0.00 174.62 173.62 2w5m s MET 79 N -4.08 0.68 -0.22 3.99 -1.94 0.29 -4.85 119.30 113.17 2w5m s MET 79 Ca 0.59 -0.91 -0.29 0.00 -1.71 0.00 0.00 55.69 53.37 2w5m s MET 79 Cb -0.11 -0.47 -0.01 0.00 2.01 0.00 0.00 34.83 36.25 2w5m s MET 79 CO 0.32 0.09 1.30 0.45 -0.01 0.00 0.00 175.02 177.17 2w5m s SER 80 N -1.84 6.81 0.18 3.03 0.15 -1.26 -1.60 113.70 119.16 2w5m s SER 80 Ca -0.04 1.52 0.06 0.00 0.70 0.00 0.00 55.95 58.18 2w5m s SER 80 Cb -0.08 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.65 2w5m s SER 80 CO 0.01 -0.91 -0.11 0.27 1.20 0.00 0.00 173.24 173.70 2w5m s ILE 81 N 3.93 1.40 -0.13 6.45 -4.36 -0.41 -0.32 121.20 127.76 2w5m s ILE 81 Ca 0.56 -2.12 0.01 0.00 -0.26 0.00 0.00 60.65 58.84 2w5m s ILE 81 Cb -0.20 -1.98 0.02 0.00 1.25 0.00 0.00 42.46 41.55 2w5m s ILE 81 CO 0.19 -0.64 -0.15 -0.89 0.24 0.00 0.00 174.94 173.69 2w5m s THR 82 N -3.18 1.54 -0.04 8.37 2.01 0.21 -1.61 115.64 122.94 2w5m s THR 82 Ca 0.20 -0.64 -0.21 0.00 0.31 0.00 0.00 61.69 61.35 2w5m s THR 82 Cb 0.02 -1.42 -0.05 0.00 0.01 0.00 0.00 72.50 71.05 2w5m s THR 82 CO 0.04 0.45 0.62 -0.62 -0.69 0.00 0.00 174.62 174.42 2w5m s ASP 83 N 1.26 6.95 -0.19 3.53 2.15 0.36 -0.79 116.67 129.93 2w5m s ASP 83 Ca -0.00 1.13 -0.01 0.00 0.43 0.00 0.00 52.55 54.10 2w5m s ASP 83 Cb -0.14 -2.37 0.00 0.00 -0.30 0.00 0.00 42.92 40.11 2w5m s ASP 83 CO -0.06 0.02 -0.14 0.00 -0.17 0.00 0.00 175.17 174.82 2w5m s ARG 85 N 1.20 1.46 0.39 0.00 3.52 -0.96 -1.23 118.95 123.33 2w5m s ARG 85 Ca 0.02 -0.40 -0.27 0.00 -0.13 0.00 0.00 55.73 54.96 2w5m s ARG 85 Cb -0.14 -1.26 -0.11 0.00 -1.56 0.00 0.00 34.95 31.89 2w5m s ARG 85 CO -0.06 0.08 1.38 -1.91 -0.81 0.00 0.00 175.30 173.98 2w5m n GLU 86 N 3.58 2.30 -1.29 5.12 2.13 -0.07 -0.59 120.64 131.82 2w5m n GLU 86 Ca -0.21 0.81 -0.30 0.00 0.66 0.00 0.00 57.16 58.12 2w5m n GLU 86 Cb 0.52 -2.51 0.11 0.00 0.27 0.00 0.00 31.44 29.83 2w5m n GLU 86 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2w5m s THR 87 N -1.14 3.07 0.43 6.31 -4.23 -0.62 -4.79 115.64 114.67 2w5m s THR 87 Ca 0.57 0.35 0.23 0.00 -1.18 0.00 0.00 61.69 61.65 2w5m s THR 87 Cb -0.50 -2.88 0.25 0.00 1.34 0.00 0.00 72.50 70.71 2w5m s THR 87 CO 0.61 -0.46 2.04 1.23 -0.54 0.00 0.00 174.62 177.51 2w5m h GLY 88 N -1.27 0.00 0.74 3.99 0.00 -1.94 -2.99 103.07 101.60 2w5m h GLY 88 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 2w5m h GLY 88 CO 0.54 0.00 -0.53 -1.14 0.00 0.00 0.00 176.54 175.41 2w5m n SER 89 N -3.89 0.66 -4.78 0.19 3.41 -1.26 -4.94 113.62 103.01 2w5m n SER 89 Ca -0.02 -0.45 -0.41 0.00 -0.26 0.00 0.00 58.87 57.73 2w5m n SER 89 Cb 0.24 0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.53 2w5m n SER 89 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2w5m s SER 90 N -2.93 6.28 -0.15 4.04 0.15 -1.13 -5.03 113.70 114.94 2w5m s SER 90 Ca 0.12 3.00 -0.09 0.00 0.70 0.00 0.00 55.95 59.68 2w5m s SER 90 Cb 0.18 -2.66 0.05 0.00 -1.71 0.00 0.00 66.02 61.87 2w5m s SER 90 CO 0.70 -0.91 0.37 -0.54 1.20 0.00 0.00 173.24 174.05 2w5m s LYS 91 N -2.15 0.37 0.33 5.44 -0.14 -1.20 -4.96 119.74 117.43 2w5m s LYS 91 Ca 0.54 0.66 -0.29 0.00 -1.36 0.00 0.00 55.97 55.52 2w5m s LYS 91 Cb -0.45 0.02 -0.11 0.00 -1.68 0.00 0.00 37.83 35.61 2w5m s LYS 91 CO 0.61 -0.13 1.47 -0.47 -0.76 0.00 0.00 175.35 176.07 2w5m s TYR 92 N 1.03 2.78 -2.01 3.18 5.04 -1.26 -0.31 117.35 125.80 2w5m s TYR 92 Ca -0.07 1.10 0.13 0.00 -2.44 0.00 0.00 57.07 55.80 2w5m s TYR 92 Cb -0.07 -3.94 0.38 0.00 0.35 0.00 0.00 41.96 38.68 2w5m s TYR 92 CO -0.08 -2.87 1.32 -0.35 -1.34 0.00 0.00 175.55 172.23 2w5m n PRO 93 N 1.21 1.97 -2.84 4.97 -0.04 -1.26 -4.98 135.00 134.03 2w5m n PRO 93 Ca 0.03 -1.50 -0.43 0.00 -0.04 0.00 0.00 63.50 61.56 2w5m n PRO 93 Cb 0.39 -1.33 0.01 0.00 -0.04 0.00 0.00 33.50 32.53 2w5m n PRO 93 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2w5m n ASN 94 N 0.72 5.76 -4.72 3.54 3.02 0.58 -5.00 115.26 119.16 2w5m n ASN 94 Ca 0.14 -3.22 -0.42 0.00 -0.03 0.00 0.00 54.58 51.05 2w5m n ASN 94 Cb 0.35 -1.38 -0.03 0.00 -0.61 0.00 0.00 39.78 38.11 2w5m n ASN 94 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w5m s ALA 96 N 0.96 1.01 0.02 0.00 0.00 -1.26 -4.98 121.76 117.51 2w5m s ALA 96 Ca 0.63 -0.45 0.03 0.00 0.00 0.00 0.00 51.96 52.18 2w5m s ALA 96 Cb -0.36 -0.33 -0.02 0.00 0.00 0.00 0.00 23.12 22.41 2w5m s ALA 96 CO 0.31 0.19 -0.11 0.71 0.00 0.00 0.00 175.76 176.87 2w5m s TYR 97 N 0.02 0.94 -0.03 0.00 2.02 -1.26 -1.58 117.35 117.46 2w5m s TYR 97 Ca -0.01 -0.30 -0.17 0.00 -0.37 0.00 0.00 57.07 56.23 2w5m s TYR 97 Cb -0.08 -0.57 -0.05 0.00 -0.40 0.00 0.00 41.96 40.85 2w5m s TYR 97 CO 0.00 -0.00 0.46 0.15 -1.57 0.00 0.00 175.55 174.59 2w5m s LYS 98 N -0.84 4.11 -0.21 -0.62 -0.14 0.24 -4.63 119.74 117.65 2w5m s LYS 98 Ca 0.00 0.48 -0.09 0.00 -1.36 0.00 0.00 55.97 55.01 2w5m s LYS 98 Cb -0.06 -3.30 -0.04 0.00 -1.68 0.00 0.00 37.83 32.75 2w5m s LYS 98 CO 0.00 0.51 0.10 0.99 -0.76 0.00 0.00 175.35 176.19 2w5m s THR 99 N -0.52 5.00 -0.15 2.17 2.01 -1.26 -2.26 115.64 120.62 2w5m s THR 99 Ca 0.25 0.05 -0.01 0.00 0.31 0.00 0.00 61.69 62.29 2w5m s THR 99 Cb -0.17 -3.29 0.04 0.00 0.01 0.00 0.00 72.50 69.10 2w5m s THR 99 CO 0.13 0.41 -0.03 -0.89 -0.69 0.00 0.00 174.62 173.56 2w5m s THR 100 N 0.69 0.85 0.15 -0.82 2.01 -0.29 -5.00 115.64 113.24 2w5m s THR 100 Ca 0.05 -0.46 -0.22 0.00 0.31 0.00 0.00 61.69 61.38 2w5m s THR 100 Cb -0.13 -1.08 -0.08 0.00 0.01 0.00 0.00 72.50 71.22 2w5m s THR 100 CO 0.02 0.10 0.69 -1.58 -0.69 0.00 0.00 174.62 173.15 2w5m s GLN 101 N 1.74 4.37 0.19 4.92 2.00 -1.26 -0.49 119.66 131.13 2w5m s GLN 101 Ca 0.01 0.94 -0.16 0.00 -2.00 0.00 0.00 55.36 54.15 2w5m s GLN 101 Cb -0.15 -3.15 0.02 0.00 0.80 0.00 0.00 33.01 30.53 2w5m s GLN 101 CO -0.07 0.55 0.49 0.00 -0.50 0.00 0.00 175.29 175.76 2w5m s ALA 102 N -1.23 -0.79 -0.26 1.58 0.00 -0.63 -4.98 121.76 115.45 2w5m s ALA 102 Ca 0.35 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 52.00 2w5m s ALA 102 Cb -0.20 0.86 0.06 0.00 0.00 0.00 0.00 23.12 23.84 2w5m s ALA 102 CO 0.23 -0.79 -0.10 -0.80 0.00 0.00 0.00 175.76 174.30 2w5m s ASN 103 N -2.89 4.35 0.11 0.00 0.01 -1.26 -1.28 114.94 113.97 2w5m s ASN 103 Ca 0.11 -1.38 -0.05 0.00 -0.71 0.00 0.00 52.86 50.83 2w5m s ASN 103 Cb -0.00 -1.49 -0.02 0.00 0.41 0.00 0.00 41.25 40.15 2w5m s ASN 103 CO -0.02 -0.20 0.12 -0.54 -1.51 0.00 0.00 177.10 174.95 2w5m s LYS 104 N 1.15 0.88 0.42 -0.60 1.02 -0.63 -4.76 119.74 117.22 2w5m s LYS 104 Ca -0.08 -1.21 -0.24 0.00 0.02 0.00 0.00 55.97 54.46 2w5m s LYS 104 Cb -0.20 0.29 -0.08 0.00 -0.52 0.00 0.00 37.83 37.32 2w5m s LYS 104 CO -0.05 -0.26 1.12 -1.01 -0.92 0.00 0.00 175.35 174.23 2w5m s HIS 105 N -3.95 3.08 0.09 3.18 3.76 0.33 -0.55 115.29 121.23 2w5m s HIS 105 Ca 0.14 1.58 0.06 0.00 -0.15 0.00 0.00 55.06 56.68 2w5m s HIS 105 Cb 0.06 -3.29 -0.04 0.00 1.11 0.00 0.00 32.58 30.42 2w5m s HIS 105 CO -0.05 -1.13 -0.05 0.96 -0.85 0.00 0.00 174.74 173.62 2w5m s ILE 106 N -1.55 3.67 -0.15 0.60 -4.36 -1.26 -0.92 121.20 117.23 2w5m s ILE 106 Ca 0.60 -1.11 0.02 0.00 -0.26 0.00 0.00 60.65 59.90 2w5m s ILE 106 Cb -0.27 -2.72 0.01 0.00 1.25 0.00 0.00 42.46 40.73 2w5m s ILE 106 CO 0.33 0.14 -0.21 -0.63 0.24 0.00 0.00 174.94 174.81 2w5m s ILE 107 N -1.24 2.14 0.15 8.37 1.01 0.25 -0.80 121.20 131.07 2w5m s ILE 107 Ca 0.23 -0.95 0.06 0.00 0.00 0.00 0.00 60.65 59.99 2w5m s ILE 107 Cb -0.11 -1.86 -0.04 0.00 0.01 0.00 0.00 42.46 40.45 2w5m s ILE 107 CO 0.15 0.54 -0.14 0.68 0.00 0.00 0.00 174.94 176.18 2w5m s VAL 108 N 0.86 1.43 -0.08 2.92 -7.23 -0.22 -0.47 120.40 117.62 2w5m s VAL 108 Ca -0.06 -1.89 -0.11 0.00 -1.81 0.00 0.00 61.98 58.11 2w5m s VAL 108 Cb -0.15 -1.72 -0.05 0.00 0.56 0.00 0.00 36.38 35.02 2w5m s VAL 108 CO -0.03 -0.50 0.27 0.00 -0.31 0.00 0.00 175.10 174.54 2w5m s ALA 109 N -2.49 3.76 0.03 1.32 0.00 -0.41 -0.42 121.76 123.55 2w5m s ALA 109 Ca 0.14 -0.44 0.09 0.00 0.00 0.00 0.00 51.96 51.74 2w5m s ALA 109 Cb -0.03 -2.20 -0.03 0.00 0.00 0.00 0.00 23.12 20.86 2w5m s ALA 109 CO 0.04 0.48 -0.25 0.00 0.00 0.00 0.00 175.76 176.03 2w5m s GLU 111 N -1.16 1.09 0.00 0.00 2.12 -0.86 -4.91 118.70 114.98 2w5m s GLU 111 Ca 0.12 -0.03 0.00 0.00 0.36 0.00 0.00 54.97 55.42 2w5m s GLU 111 Cb -0.10 0.50 0.00 0.00 0.26 0.00 0.00 34.13 34.79 2w5m s GLU 111 CO 0.02 -0.38 0.00 0.41 -0.54 0.00 0.00 175.26 174.77 2w5m n GLY 112 N 0.53 -0.07 2.84 -1.50 0.00 -1.26 -3.05 105.19 102.67 2w5m n GLY 112 Ca -0.18 -1.93 -0.29 0.00 0.00 0.00 0.00 46.02 43.61 2w5m n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2w5m s ASN 113 N -0.69 3.24 0.77 1.61 2.47 -1.26 -2.22 114.94 118.87 2w5m s ASN 113 Ca 0.00 -0.93 -0.11 0.00 0.42 0.00 0.00 52.86 52.25 2w5m s ASN 113 Cb 0.00 -0.86 0.05 0.00 -1.45 0.00 0.00 41.25 38.99 2w5m s ASN 113 CO 0.00 -0.26 1.09 -2.16 -3.72 0.00 0.00 177.10 172.05 2w5m s PRO 114 N 1.65 2.28 -0.63 0.43 0.04 -1.26 -5.08 135.00 132.43 2w5m s PRO 114 Ca -0.03 1.18 -0.21 0.00 0.04 0.00 0.00 61.00 61.98 2w5m s PRO 114 Cb -0.17 -1.90 0.08 0.00 0.04 0.00 0.00 34.50 32.55 2w5m s PRO 114 CO -0.07 -1.62 0.87 -0.47 0.04 0.00 0.00 177.00 175.74 2w5m s TYR 115 N -2.88 2.79 0.25 0.56 5.04 -0.94 -4.88 117.35 117.29 2w5m s TYR 115 Ca 0.61 -0.68 0.03 0.00 -2.44 0.00 0.00 57.07 54.60 2w5m s TYR 115 Cb -0.17 -4.18 -0.05 0.00 0.35 0.00 0.00 41.96 37.90 2w5m s TYR 115 CO 0.55 -1.51 0.03 0.14 -1.34 0.00 0.00 175.55 173.42 2w5m s VAL 116 N 3.57 0.90 0.31 3.14 -7.23 -1.17 -4.84 120.40 115.08 2w5m s VAL 116 Ca 0.19 -2.01 -0.29 0.00 -1.81 0.00 0.00 61.98 58.05 2w5m s VAL 116 Cb -0.19 -2.47 -0.10 0.00 0.56 0.00 0.00 36.38 34.18 2w5m s VAL 116 CO 0.09 -0.20 1.28 -2.84 -0.31 0.00 0.00 175.10 173.12 2w5m s PRO 117 N -3.92 4.40 0.00 4.82 0.02 -1.26 -2.04 135.00 137.02 2w5m s PRO 117 Ca 0.32 2.15 0.00 0.00 0.02 0.00 0.00 61.00 63.49 2w5m s PRO 117 Cb 0.07 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.49 2w5m s PRO 117 CO 0.11 -0.14 0.17 1.33 -0.33 0.00 0.00 177.00 178.13 2w5m n VAL 118 N 1.04 0.00 -3.65 3.83 0.24 0.89 -4.53 118.33 116.15 2w5m n VAL 118 Ca 0.01 -0.40 -0.11 0.00 -2.04 0.00 0.00 64.34 61.80 2w5m n VAL 118 Cb 0.42 1.09 -0.08 0.00 -1.47 0.00 0.00 33.84 33.80 2w5m n VAL 118 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2w5m s HIS 119 N -0.45 -0.85 -0.31 6.34 5.65 -1.22 -4.64 115.29 119.82 2w5m s HIS 119 Ca 0.00 1.85 -0.17 0.00 0.25 0.00 0.00 55.06 56.99 2w5m s HIS 119 Cb 0.00 0.41 -0.02 0.00 -1.18 0.00 0.00 32.58 31.79 2w5m s HIS 119 CO 0.00 -0.42 0.49 0.12 -0.65 0.00 0.00 174.74 174.28 2w5m s PHE 120 N 1.00 3.22 -0.21 3.88 5.36 -1.26 -1.29 117.98 128.67 2w5m s PHE 120 Ca -0.05 0.37 -0.19 0.00 -0.96 0.00 0.00 56.93 56.09 2w5m s PHE 120 Cb -0.05 -2.80 -0.19 0.00 -0.34 0.00 0.00 43.02 39.64 2w5m s PHE 120 CO -0.09 -0.40 0.15 -3.47 -1.46 0.00 0.00 175.22 169.95 2w5m n ASP 121 N 5.61 1.89 -3.58 6.13 2.03 0.38 -4.98 116.55 124.03 2w5m n ASP 121 Ca -0.05 0.39 -0.06 0.00 0.52 0.00 0.00 54.79 55.59 2w5m n ASP 121 Cb 0.49 -0.94 -0.02 0.00 -0.72 0.00 0.00 41.12 39.94 2w5m n ASP 121 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2w5m s ALA 122 N -2.40 -1.87 0.08 -1.67 0.00 -1.10 -4.96 121.76 109.84 2w5m s ALA 122 Ca -0.30 0.94 0.07 0.00 0.00 0.00 0.00 51.96 52.67 2w5m s ALA 122 Cb 0.07 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.50 2w5m s ALA 122 CO 0.59 -0.76 -0.13 -1.54 0.00 0.00 0.00 175.76 173.92 2w5m s SER 123 N -2.54 4.18 0.00 0.00 1.04 -1.26 -0.58 113.70 114.53 2w5m s SER 123 Ca 0.08 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.12 2w5m s SER 123 Cb -0.01 -0.76 0.00 0.00 0.10 0.00 0.00 66.02 65.35 2w5m s SER 123 CO -0.06 0.21 0.07 0.55 0.98 0.00 0.00 173.24 175.00