#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g8r s GLU 2 N 0.00 4.15 0.74 1.64 2.12 -1.26 -5.00 118.70 121.09 2g8r s GLU 2 Ca 0.00 2.16 -0.11 0.00 0.36 0.00 0.00 54.97 57.38 2g8r s GLU 2 Cb 0.00 -3.99 0.04 0.00 0.26 0.00 0.00 34.13 30.43 2g8r s GLU 2 CO 0.00 -0.89 1.08 0.95 -0.54 0.00 0.00 175.26 175.86 2g8r s THR 3 N 4.15 3.60 0.22 -1.70 -4.23 -1.26 -4.85 115.64 111.58 2g8r s THR 3 Ca 0.74 0.52 -0.08 0.00 -1.18 0.00 0.00 61.69 61.68 2g8r s THR 3 Cb -0.33 -3.11 0.19 0.00 1.34 0.00 0.00 72.50 70.58 2g8r s THR 3 CO 0.30 -0.68 1.86 0.00 -0.54 0.00 0.00 174.62 175.55 2g8r h ALA 4 N -0.97 1.08 -0.27 3.99 0.00 -1.95 0.34 119.26 121.48 2g8r h ALA 4 Ca -0.44 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.37 2g8r h ALA 4 Cb 1.22 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2g8r h ALA 4 CO 0.54 0.56 0.17 0.00 0.00 0.00 0.00 179.25 180.51 2g8r h ALA 5 N 1.26 0.34 -0.83 0.00 0.00 -1.90 0.14 119.26 118.28 2g8r h ALA 5 Ca 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2g8r h ALA 5 Cb -0.02 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2g8r h ALA 5 CO -0.05 -0.20 0.54 0.00 0.00 0.00 0.00 179.25 179.53 2g8r h ALA 6 N 1.11 1.06 -0.41 0.00 0.00 -1.80 -1.57 119.26 117.65 2g8r h ALA 6 Ca 0.10 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2g8r h ALA 6 Cb -0.02 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 2g8r h ALA 6 CO -0.04 0.48 0.24 -0.22 0.00 0.00 0.00 179.25 179.71 2g8r h LYS 7 N 1.13 0.56 -0.32 0.00 3.64 -0.61 0.06 116.57 121.04 2g8r h LYS 7 Ca 0.30 -0.06 0.06 0.00 -1.27 0.00 0.00 60.65 59.68 2g8r h LYS 7 Cb -0.10 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.55 2g8r h LYS 7 CO -0.06 0.43 -0.02 0.35 -2.27 0.00 0.00 179.45 177.88 2g8r h PHE 8 N 0.53 -0.06 -0.54 1.91 3.57 -0.60 0.33 116.94 122.08 2g8r h PHE 8 Ca 0.15 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.71 2g8r h PHE 8 Cb 0.03 0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 2g8r h PHE 8 CO -0.03 -0.08 0.28 0.93 -2.23 0.00 0.00 178.31 177.18 2g8r h GLU 9 N 0.06 0.53 -0.40 1.11 5.08 -0.92 0.20 114.58 120.25 2g8r h GLU 9 Ca 0.15 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2g8r h GLU 9 Cb 0.22 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2g8r h GLU 9 CO -0.28 0.35 0.08 -0.09 -1.00 0.00 0.00 179.01 178.07 2g8r h ARG 10 N 0.55 0.65 0.00 2.33 2.43 -0.39 -1.68 114.38 118.27 2g8r h ARG 10 Ca 0.23 -0.17 -0.15 0.00 -0.81 0.00 0.00 59.98 59.08 2g8r h ARG 10 Cb 0.13 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 2g8r h ARG 10 CO -0.15 0.69 -0.73 1.96 -1.51 0.00 0.00 179.97 180.22 2g8r h GLN 11 N 0.51 0.00 0.00 0.20 4.20 -0.09 -3.41 115.11 116.51 2g8r h GLN 11 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 2g8r h GLN 11 Cb 0.34 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.12 2g8r h GLN 11 CO 0.00 0.73 -0.00 0.72 -0.67 0.00 0.00 178.83 179.62 2g8r n HIS 12 N -3.44 0.00 -4.04 2.96 8.25 0.69 -4.69 115.22 114.95 2g8r n HIS 12 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.12 2g8r n HIS 12 Cb 0.77 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.78 2g8r n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2g8r s MET 13 N -0.41 3.91 -0.41 -0.41 -1.94 -0.63 -0.33 119.30 119.07 2g8r s MET 13 Ca 0.00 -0.38 0.06 0.00 -1.71 0.00 0.00 55.69 53.66 2g8r s MET 13 Cb 0.00 -3.19 0.21 0.00 2.01 0.00 0.00 34.83 33.86 2g8r s MET 13 CO 0.00 0.23 0.47 -3.47 -0.01 0.00 0.00 175.02 172.24 2g8r n ASP 14 N 3.65 -0.58 0.00 3.03 2.03 -0.50 -4.83 116.55 119.35 2g8r n ASP 14 Ca -0.17 -2.59 0.09 0.00 0.52 0.00 0.00 54.79 52.65 2g8r n ASP 14 Cb 0.52 -0.29 0.49 0.00 -0.72 0.00 0.00 41.12 41.13 2g8r n ASP 14 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2g8r n SER 15 N 2.21 0.00 0.21 1.67 7.64 -1.26 -3.85 113.62 120.24 2g8r n SER 15 Ca 0.24 -0.12 0.08 0.00 1.01 0.00 0.00 58.87 60.09 2g8r n SER 15 Cb 0.51 -0.22 0.39 0.00 -1.01 0.00 0.00 64.21 63.88 2g8r n SER 15 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2g8r h SER 16 N 0.00 0.00 -3.66 6.43 0.02 -1.92 -3.46 113.55 110.96 2g8r h SER 16 Ca 0.00 0.00 -0.50 0.00 -0.84 0.00 0.00 61.79 60.45 2g8r h SER 16 Cb 0.14 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 62.50 2g8r h SER 16 CO 0.00 0.29 -0.78 0.28 -1.14 0.00 0.00 176.83 175.48 2g8r s THR 17 N -3.62 1.73 -0.16 -2.27 -1.32 -1.25 -5.08 115.64 103.68 2g8r s THR 17 Ca 0.00 -1.87 -0.27 0.00 -1.21 0.00 0.00 61.69 58.34 2g8r s THR 17 Cb 0.10 -1.78 -0.24 0.00 -1.51 0.00 0.00 72.50 69.07 2g8r s THR 17 CO 0.66 -0.33 0.62 0.28 -2.21 0.00 0.00 174.62 173.65 2g8r h SER 18 N 3.32 0.01 0.00 8.08 0.02 -1.90 -3.44 113.55 119.64 2g8r h SER 18 Ca -0.42 -0.87 0.00 0.00 -0.84 0.00 0.00 61.79 59.66 2g8r h SER 18 Cb 1.20 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 2g8r h SER 18 CO 0.51 1.14 0.00 0.00 -1.14 0.00 0.00 176.83 177.34 2g8r n ALA 19 N -2.83 0.54 -2.38 3.77 0.00 -1.26 -4.89 120.51 113.47 2g8r n ALA 19 Ca -0.16 -0.05 -0.19 0.00 0.00 0.00 0.00 53.44 53.04 2g8r n ALA 19 Cb 0.54 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.01 2g8r n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g8r n ALA 20 N -1.69 4.42 -1.69 0.00 0.00 -1.26 -4.89 120.51 115.39 2g8r n ALA 20 Ca 0.00 -3.69 -0.42 0.00 0.00 0.00 0.00 53.44 49.32 2g8r n ALA 20 Cb 0.00 -0.56 -0.03 0.00 0.00 0.00 0.00 19.45 18.86 2g8r n ALA 20 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2g8r s SER 21 N -3.56 6.06 0.87 0.00 0.01 -1.26 -4.98 113.70 110.84 2g8r s SER 21 Ca 0.43 2.26 -0.11 0.00 1.31 0.00 0.00 55.95 59.84 2g8r s SER 21 Cb 0.40 -2.52 0.12 0.00 0.21 0.00 0.00 66.02 64.23 2g8r s SER 21 CO -0.04 -1.43 1.15 -0.94 0.41 0.00 0.00 173.24 172.39 2g8r s SER 22 N 5.91 3.26 0.24 2.44 1.04 -1.26 -4.85 113.70 120.48 2g8r s SER 22 Ca 0.91 2.17 0.11 0.00 0.48 0.00 0.00 55.95 59.63 2g8r s SER 22 Cb -0.37 -2.57 0.59 0.00 0.10 0.00 0.00 66.02 63.78 2g8r s SER 22 CO 0.38 -2.88 1.23 -1.54 0.98 0.00 0.00 173.24 171.41 2g8r n SER 23 N -3.96 0.28 -0.17 7.02 3.41 -1.26 -1.43 113.62 117.51 2g8r n SER 23 Ca 0.12 0.53 0.09 0.00 -0.26 0.00 0.00 58.87 59.35 2g8r n SER 23 Cb 0.52 -0.51 -0.07 0.00 -0.26 0.00 0.00 64.21 63.89 2g8r n SER 23 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2g8r n ASN 24 N -1.89 1.28 -0.14 4.04 2.85 -1.26 -4.51 115.26 115.63 2g8r n ASN 24 Ca -0.01 -1.14 -0.06 0.00 -0.11 0.00 0.00 54.58 53.26 2g8r n ASN 24 Cb 0.23 0.81 -0.00 0.00 1.24 0.00 0.00 39.78 42.06 2g8r n ASN 24 CO 0.00 0.00 0.00 0.22 -2.11 0.00 0.00 177.26 175.37 2g8r h TYR 25 N 0.83 -0.81 -0.31 1.20 3.20 -1.58 -2.67 116.97 116.83 2g8r h TYR 25 Ca 0.00 0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.90 2g8r h TYR 25 Cb 0.54 0.42 -0.01 0.00 1.54 0.00 0.00 36.73 39.22 2g8r h TYR 25 CO 0.00 -0.36 0.08 0.00 -1.64 0.00 0.00 178.16 176.23 2g8r h ASN 27 N 0.34 -0.06 0.18 0.00 2.35 -1.73 0.22 115.58 116.88 2g8r h ASN 27 Ca 0.10 0.16 -0.30 0.00 -0.55 0.00 0.00 56.30 55.71 2g8r h ASN 27 Cb 0.29 0.23 0.03 0.00 0.05 0.00 0.00 38.32 38.92 2g8r h ASN 27 CO 0.00 -0.07 -1.27 1.56 -1.65 0.00 0.00 177.43 176.00 2g8r h GLN 28 N 0.23 0.54 -0.21 0.81 4.20 -1.30 -3.22 115.11 116.16 2g8r h GLN 28 Ca 0.42 -0.83 -0.20 0.00 0.06 0.00 0.00 58.65 58.10 2g8r h GLN 28 Cb 0.74 0.29 0.01 0.00 0.30 0.00 0.00 27.48 28.81 2g8r h GLN 28 CO -0.55 1.38 -0.67 0.52 -0.67 0.00 0.00 178.83 178.85 2g8r h MET 29 N 0.12 0.82 -0.81 1.46 2.86 -0.69 -1.85 114.93 116.84 2g8r h MET 29 Ca -0.21 -0.60 -0.02 0.00 -2.06 0.00 0.00 59.70 56.81 2g8r h MET 29 Cb 1.97 0.10 -0.04 0.00 0.06 0.00 0.00 31.60 33.70 2g8r h MET 29 CO 0.24 1.22 0.44 0.52 1.06 0.00 0.00 176.91 180.39 2g8r h MET 30 N 0.57 1.12 0.09 1.72 2.86 -0.71 -1.76 114.93 118.83 2g8r h MET 30 Ca -0.02 -0.13 -0.00 0.00 -2.06 0.00 0.00 59.70 57.48 2g8r h MET 30 Cb 1.29 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.73 2g8r h MET 30 CO 0.14 0.82 -0.04 -0.22 1.06 0.00 0.00 176.91 178.67 2g8r h LYS 31 N 1.13 -0.12 -0.09 1.72 3.64 -1.55 0.95 116.57 122.25 2g8r h LYS 31 Ca 0.29 0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.59 2g8r h LYS 31 Cb 0.03 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2g8r h LYS 31 CO -0.05 0.31 -0.35 0.66 -2.27 0.00 0.00 179.45 177.76 2g8r h SER 32 N -0.60 0.17 -0.12 4.20 4.64 -1.27 -0.54 113.55 120.03 2g8r h SER 32 Ca -0.01 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2g8r h SER 32 Cb 0.49 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2g8r h SER 32 CO 0.02 0.52 0.00 0.54 -0.87 0.00 0.00 176.83 177.04 2g8r n ARG 33 N -4.09 1.31 -2.76 4.77 5.12 -0.67 -4.92 116.66 115.43 2g8r n ARG 33 Ca -0.01 -0.48 -0.17 0.00 -1.93 0.00 0.00 57.85 55.26 2g8r n ARG 33 Cb 0.42 -1.16 0.02 0.00 -1.16 0.00 0.00 32.46 30.59 2g8r n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 2g8r n ASN 34 N -0.16 -4.96 -1.07 0.55 4.13 -0.21 -4.80 115.26 108.73 2g8r n ASN 34 Ca 0.07 -0.19 0.11 0.00 1.68 0.00 0.00 54.58 56.25 2g8r n ASN 34 Cb 0.13 -3.85 0.25 0.00 -1.54 0.00 0.00 39.78 34.77 2g8r n ASN 34 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2g8r n LEU 35 N -2.98 3.19 -0.16 3.41 4.77 0.32 -4.00 117.00 121.55 2g8r n LEU 35 Ca -0.10 -1.42 0.09 0.00 -0.03 0.00 0.00 56.01 54.55 2g8r n LEU 35 Cb 0.60 -0.27 0.14 0.00 -2.33 0.00 0.00 43.42 41.56 2g8r n LEU 35 CO 0.34 0.71 0.52 0.35 -1.33 0.00 0.00 177.39 177.98 2g8r n THR 36 N 1.30 1.78 -0.06 -5.08 -2.24 -1.20 -2.02 114.28 106.76 2g8r n THR 36 Ca 0.19 -2.21 -0.14 0.00 -2.27 0.00 0.00 64.05 59.63 2g8r n THR 36 Cb 0.55 -0.18 -0.13 0.00 -2.10 0.00 0.00 70.33 68.47 2g8r n THR 36 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2g8r h LYS 37 N 0.10 -0.00 0.00 -0.78 3.11 -1.91 -3.39 116.57 113.71 2g8r h LYS 37 Ca -0.00 0.00 -0.11 0.00 -2.81 0.00 0.00 60.65 57.73 2g8r h LYS 37 Cb 1.03 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 32.24 2g8r h LYS 37 CO 0.00 0.94 -2.01 -0.25 -2.81 0.00 0.00 179.45 175.33 2g8r n ASP 38 N -4.64 0.53 -3.43 4.20 8.00 -1.26 -5.03 116.55 114.93 2g8r n ASP 38 Ca -0.10 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.35 2g8r n ASP 38 Cb 0.45 1.59 0.00 0.00 -0.02 0.00 0.00 41.12 43.15 2g8r n ASP 38 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2g8r s ARG 39 N -3.06 1.66 -0.50 -1.24 1.70 -1.26 -5.10 118.95 111.15 2g8r s ARG 39 Ca -0.08 -1.01 -0.27 0.00 -0.47 0.00 0.00 55.73 53.91 2g8r s ARG 39 Cb 0.10 0.50 0.03 0.00 -0.57 0.00 0.00 34.95 35.02 2g8r s ARG 39 CO 0.79 -0.77 1.03 0.00 -1.08 0.00 0.00 175.30 175.27 2g8r n LYS 41 N 7.62 2.50 -0.02 0.00 4.81 -0.86 -4.86 118.16 127.35 2g8r n LYS 41 Ca 0.07 0.92 -0.09 0.00 -0.87 0.00 0.00 58.31 58.34 2g8r n LYS 41 Cb 0.49 -2.80 0.07 0.00 0.02 0.00 0.00 35.03 32.80 2g8r n LYS 41 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 2g8r h PRO 42 N 9.42 0.62 -3.92 1.64 0.13 -1.93 -3.44 132.00 134.53 2g8r h PRO 42 Ca -0.49 -0.34 -0.30 0.00 -0.87 0.00 0.00 66.00 64.00 2g8r h PRO 42 Cb 1.25 0.02 -0.30 0.00 0.13 0.00 0.00 31.00 32.10 2g8r h PRO 42 CO 0.94 0.95 -0.74 0.08 -0.23 0.00 0.00 178.00 179.00 2g8r s VAL 43 N -4.17 0.20 -0.20 1.56 1.01 -1.26 -0.67 120.40 116.86 2g8r s VAL 43 Ca -0.08 -0.04 -0.17 0.00 0.00 0.00 0.00 61.98 61.69 2g8r s VAL 43 Cb 0.12 -0.21 0.05 0.00 0.00 0.00 0.00 36.38 36.34 2g8r s VAL 43 CO 0.84 0.09 0.53 0.21 0.00 0.00 0.00 175.10 176.77 2g8r s ASN 44 N 0.32 -0.58 -0.12 3.32 2.47 -0.14 -5.01 114.94 115.19 2g8r s ASN 44 Ca -0.03 1.08 -0.02 0.00 0.42 0.00 0.00 52.86 54.31 2g8r s ASN 44 Cb -0.05 1.07 -0.03 0.00 -1.45 0.00 0.00 41.25 40.79 2g8r s ASN 44 CO -0.01 -0.19 -0.05 -0.89 -3.72 0.00 0.00 177.10 172.24 2g8r s THR 45 N 0.53 3.81 -0.12 -5.21 2.01 -1.26 -0.52 115.64 114.88 2g8r s THR 45 Ca -0.02 -0.41 -0.03 0.00 0.31 0.00 0.00 61.69 61.55 2g8r s THR 45 Cb -0.04 -2.63 -0.03 0.00 0.01 0.00 0.00 72.50 69.81 2g8r s THR 45 CO -0.03 0.54 -0.01 -0.36 -0.69 0.00 0.00 174.62 174.07 2g8r s PHE 46 N -0.08 3.10 -0.22 4.92 0.08 -0.07 -4.40 117.98 121.30 2g8r s PHE 46 Ca 0.01 -0.01 -0.06 0.00 0.12 0.00 0.00 56.93 56.99 2g8r s PHE 46 Cb -0.13 -1.87 -0.03 0.00 -0.57 0.00 0.00 43.02 40.42 2g8r s PHE 46 CO 0.03 0.24 0.03 0.08 -0.10 0.00 0.00 175.22 175.50 2g8r s VAL 47 N -0.30 4.15 -1.08 -0.44 1.01 0.55 -0.26 120.40 124.03 2g8r s VAL 47 Ca 0.06 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 61.77 2g8r s VAL 47 Cb -0.12 -2.90 0.30 0.00 0.00 0.00 0.00 36.38 33.65 2g8r s VAL 47 CO 0.02 0.39 1.68 1.41 0.00 0.00 0.00 175.10 178.61 2g8r n HIS 48 N 4.47 2.49 -4.21 5.22 -0.00 0.10 -1.41 115.22 121.88 2g8r n HIS 48 Ca -0.17 -2.58 -0.12 0.00 -0.00 0.00 0.00 57.72 54.85 2g8r n HIS 48 Cb 0.52 -1.28 -0.10 0.00 -0.00 0.00 0.00 29.99 29.12 2g8r n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 2g8r s GLU 49 N -3.25 1.13 0.60 -0.41 0.41 -1.26 -4.42 118.70 111.49 2g8r s GLU 49 Ca 0.36 -1.57 -0.19 0.00 -0.41 0.00 0.00 54.97 53.16 2g8r s GLU 49 Cb 0.11 0.06 -0.03 0.00 -1.78 0.00 0.00 34.13 32.49 2g8r s GLU 49 CO -0.00 -0.28 1.21 -1.54 -0.49 0.00 0.00 175.26 174.16 2g8r s SER 50 N -3.15 5.15 0.21 -0.19 1.04 -1.26 -4.23 113.70 111.27 2g8r s SER 50 Ca 0.31 2.41 -0.10 0.00 0.48 0.00 0.00 55.95 59.05 2g8r s SER 50 Cb 0.07 -2.60 0.25 0.00 0.10 0.00 0.00 66.02 63.84 2g8r s SER 50 CO 0.07 -1.62 1.78 0.25 0.98 0.00 0.00 173.24 174.70 2g8r h LEU 51 N 0.87 0.39 -0.66 2.42 5.85 -1.98 -1.79 115.31 120.41 2g8r h LEU 51 Ca -0.51 0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.37 2g8r h LEU 51 Cb 1.30 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 42.24 2g8r h LEU 51 CO 0.55 0.25 0.27 0.00 -0.34 0.00 0.00 178.44 179.16 2g8r h ALA 52 N 1.37 0.88 -0.65 1.25 0.00 -1.98 0.13 119.26 120.25 2g8r h ALA 52 Ca 0.30 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.26 2g8r h ALA 52 Cb 0.27 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2g8r h ALA 52 CO -0.23 -0.17 0.29 -0.44 0.00 0.00 0.00 179.25 178.71 2g8r h ASP 53 N 0.45 0.86 -0.16 0.00 5.19 -1.74 -0.59 116.42 120.44 2g8r h ASP 53 Ca 0.34 -0.14 -0.15 0.00 -0.62 0.00 0.00 57.03 56.45 2g8r h ASP 53 Cb 0.43 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 39.72 2g8r h ASP 53 CO -0.32 0.77 -0.50 0.58 -3.12 0.00 0.00 179.24 176.65 2g8r h VAL 54 N 0.90 1.33 -0.79 -1.35 2.07 -0.94 -3.05 116.25 114.42 2g8r h VAL 54 Ca 0.22 -1.76 0.08 0.00 0.82 0.00 0.00 66.70 66.06 2g8r h VAL 54 Cb 0.15 2.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.86 2g8r h VAL 54 CO -0.02 0.54 0.52 1.56 0.02 0.00 0.00 177.57 180.18 2g8r h GLN 55 N 0.28 0.79 -0.02 1.57 4.20 -0.65 -1.67 115.11 119.61 2g8r h GLN 55 Ca -0.02 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.65 2g8r h GLN 55 Cb 1.12 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.72 2g8r h GLN 55 CO 0.11 0.52 0.02 0.00 -0.67 0.00 0.00 178.83 178.81 2g8r h ALA 56 N 1.58 1.52 0.00 3.87 0.00 -0.99 -2.13 119.26 123.11 2g8r h ALA 56 Ca 0.35 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 2g8r h ALA 56 Cb 0.31 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2g8r h ALA 56 CO -0.13 -0.03 -0.03 0.28 0.00 0.00 0.00 179.25 179.34 2g8r h VAL 57 N 0.00 0.76 0.00 0.00 2.07 -1.30 -1.47 116.25 116.31 2g8r h VAL 57 Ca 0.01 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.41 2g8r h VAL 57 Cb 0.05 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 2g8r h VAL 57 CO -0.00 0.03 0.00 0.00 0.02 0.00 0.00 177.57 177.62 2g8r n SER 59 N -1.86 2.76 0.00 0.00 3.41 -0.56 -5.00 113.62 112.37 2g8r n SER 59 Ca -0.00 -2.22 0.00 0.00 -0.26 0.00 0.00 58.87 56.39 2g8r n SER 59 Cb 0.05 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 2g8r n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2g8r n GLN 60 N -0.05 3.04 -2.40 4.33 6.02 -0.21 -4.96 117.38 123.14 2g8r n GLN 60 Ca 0.10 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.66 2g8r n GLN 60 Cb 0.46 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.69 2g8r n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 2g8r s LYS 61 N 4.12 3.63 0.02 -1.09 2.20 -0.86 -4.84 119.74 122.91 2g8r s LYS 61 Ca 0.00 0.90 -0.30 0.00 -0.36 0.00 0.00 55.97 56.20 2g8r s LYS 61 Cb 0.00 -3.99 -0.06 0.00 -1.51 0.00 0.00 37.83 32.27 2g8r s LYS 61 CO 0.00 -1.49 1.50 1.21 -0.36 0.00 0.00 175.35 176.20 2g8r s ASN 62 N 3.56 6.76 0.07 1.43 3.04 -1.26 -0.43 114.94 128.12 2g8r s ASN 62 Ca 0.58 2.23 0.01 0.00 0.04 0.00 0.00 52.86 55.73 2g8r s ASN 62 Cb -0.13 -2.56 -0.04 0.00 -1.54 0.00 0.00 41.25 36.99 2g8r s ASN 62 CO 0.32 -0.79 -0.06 0.68 -3.04 0.00 0.00 177.10 174.21 2g8r s VAL 63 N 2.61 0.54 0.28 -5.21 -7.23 0.16 -4.93 120.40 106.62 2g8r s VAL 63 Ca 0.67 -1.69 -0.30 0.00 -1.81 0.00 0.00 61.98 58.86 2g8r s VAL 63 Cb -0.34 -1.37 -0.10 0.00 0.56 0.00 0.00 36.38 35.13 2g8r s VAL 63 CO 0.28 -0.78 1.42 0.00 -0.31 0.00 0.00 175.10 175.71 2g8r s ALA 64 N -3.13 3.60 0.55 1.32 0.00 -1.26 -3.26 121.76 119.57 2g8r s ALA 64 Ca 0.05 1.35 -0.17 0.00 0.00 0.00 0.00 51.96 53.19 2g8r s ALA 64 Cb 0.02 -3.55 -0.06 0.00 0.00 0.00 0.00 23.12 19.53 2g8r s ALA 64 CO -0.05 -0.76 1.03 0.00 0.00 0.00 0.00 175.76 175.98 2g8r h LYS 66 N 0.80 0.08 -0.06 0.00 1.57 -1.93 -0.88 116.57 116.15 2g8r h LYS 66 Ca -0.47 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 2g8r h LYS 66 Cb 1.21 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.50 2g8r h LYS 66 CO 0.59 0.05 0.00 0.27 -0.57 0.00 0.00 179.45 179.79 2g8r n ASN 67 N -4.43 0.71 0.00 0.86 6.94 -1.26 -4.89 115.26 113.18 2g8r n ASN 67 Ca 0.07 -1.48 0.00 0.00 -0.02 0.00 0.00 54.58 53.15 2g8r n ASN 67 Cb 0.45 -0.04 0.00 0.00 -2.36 0.00 0.00 39.78 37.83 2g8r n ASN 67 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2g8r n GLY 68 N 0.97 0.98 3.79 4.83 0.00 -0.33 -5.06 105.19 110.36 2g8r n GLY 68 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 2g8r n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2g8r s GLN 69 N -0.64 1.43 0.00 1.61 -1.52 -1.26 -4.79 119.66 114.50 2g8r s GLN 69 Ca 0.00 0.42 0.17 0.00 -1.95 0.00 0.00 55.36 54.00 2g8r s GLN 69 Cb 0.00 -1.86 0.18 0.00 -0.22 0.00 0.00 33.01 31.11 2g8r s GLN 69 CO 0.00 -2.02 1.09 0.25 -0.25 0.00 0.00 175.29 174.35 2g8r n THR 70 N -3.67 0.15 -0.85 -0.19 -2.24 -1.26 -0.79 114.28 105.42 2g8r n THR 70 Ca 0.07 -0.57 -0.21 0.00 -2.27 0.00 0.00 64.05 61.06 2g8r n THR 70 Cb 0.58 1.22 0.09 0.00 -2.10 0.00 0.00 70.33 70.13 2g8r n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2g8r n ASN 71 N 0.96 5.35 -4.73 3.42 6.94 -1.26 -4.66 115.26 121.28 2g8r n ASN 71 Ca 0.11 -3.28 -0.28 0.00 -0.02 0.00 0.00 54.58 51.12 2g8r n ASN 71 Cb 0.44 -0.89 -0.07 0.00 -2.36 0.00 0.00 39.78 36.90 2g8r n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2g8r s TYR 73 N -1.60 -0.11 -0.15 0.00 1.51 0.15 -0.66 117.35 116.48 2g8r s TYR 73 Ca 0.28 0.34 -0.06 0.00 -1.01 0.00 0.00 57.07 56.63 2g8r s TYR 73 Cb -0.10 -0.07 -0.04 0.00 -0.11 0.00 0.00 41.96 41.64 2g8r s TYR 73 CO 0.21 -0.11 0.07 -1.14 -1.11 0.00 0.00 175.55 173.46 2g8r s GLN 74 N 0.75 3.67 0.32 -0.62 0.74 0.43 -1.07 119.66 123.88 2g8r s GLN 74 Ca -0.06 -0.31 -0.29 0.00 0.05 0.00 0.00 55.36 54.75 2g8r s GLN 74 Cb -0.08 -3.13 -0.11 0.00 1.10 0.00 0.00 33.01 30.80 2g8r s GLN 74 CO -0.03 0.46 1.48 -1.54 -0.55 0.00 0.00 175.29 175.11 2g8r s SER 75 N -0.17 6.48 0.34 6.67 1.04 -0.22 -2.03 113.70 125.82 2g8r s SER 75 Ca 0.08 2.89 0.08 0.00 0.48 0.00 0.00 55.95 59.47 2g8r s SER 75 Cb -0.12 -2.65 0.63 0.00 0.10 0.00 0.00 66.02 63.98 2g8r s SER 75 CO 0.01 -0.80 1.82 1.88 0.98 0.00 0.00 173.24 177.13 2g8r h TYR 76 N 4.01 0.30 -2.67 5.02 0.05 -1.95 -3.44 116.97 118.30 2g8r h TYR 76 Ca -0.48 -0.05 -0.58 0.00 0.05 0.00 0.00 58.73 57.66 2g8r h TYR 76 Cb 1.23 -0.08 -0.10 0.00 1.01 0.00 0.00 36.73 38.79 2g8r h TYR 76 CO 0.57 0.49 -0.64 -1.12 -1.05 0.00 0.00 178.16 176.41 2g8r s SER 77 N -6.86 4.85 0.60 3.88 0.01 -1.26 -5.08 113.70 109.83 2g8r s SER 77 Ca -0.05 -0.41 -0.18 0.00 1.31 0.00 0.00 55.95 56.62 2g8r s SER 77 Cb 0.15 -1.05 -0.03 0.00 0.21 0.00 0.00 66.02 65.30 2g8r s SER 77 CO 0.75 0.06 1.14 0.42 0.41 0.00 0.00 173.24 176.02 2g8r s THR 78 N -1.88 3.07 0.08 1.44 -4.23 -1.26 -4.54 115.64 108.31 2g8r s THR 78 Ca 0.29 0.60 0.06 0.00 -1.18 0.00 0.00 61.69 61.46 2g8r s THR 78 Cb -0.09 -3.17 -0.03 0.00 1.34 0.00 0.00 72.50 70.55 2g8r s THR 78 CO 0.20 -0.21 -0.16 -0.04 -0.54 0.00 0.00 174.62 173.87 2g8r s MET 79 N -3.60 0.92 -0.06 3.99 -1.94 0.73 -4.85 119.30 114.49 2g8r s MET 79 Ca 0.71 -0.99 -0.30 0.00 -1.71 0.00 0.00 55.69 53.41 2g8r s MET 79 Cb -0.24 -1.00 -0.04 0.00 2.01 0.00 0.00 34.83 35.56 2g8r s MET 79 CO 0.34 0.23 1.36 0.45 -0.01 0.00 0.00 175.02 177.39 2g8r s SER 80 N -1.71 6.89 0.06 3.03 0.15 -1.26 -1.75 113.70 119.11 2g8r s SER 80 Ca 0.01 1.97 0.01 0.00 0.70 0.00 0.00 55.95 58.63 2g8r s SER 80 Cb -0.10 -2.55 -0.03 0.00 -1.71 0.00 0.00 66.02 61.63 2g8r s SER 80 CO 0.03 -0.73 -0.05 0.27 1.20 0.00 0.00 173.24 173.95 2g8r s ILE 81 N 2.87 0.44 -0.18 6.45 -4.36 -0.45 0.03 121.20 126.00 2g8r s ILE 81 Ca 0.61 -1.52 0.01 0.00 -0.26 0.00 0.00 60.65 59.49 2g8r s ILE 81 Cb -0.28 -1.14 0.03 0.00 1.25 0.00 0.00 42.46 42.32 2g8r s ILE 81 CO 0.23 -0.72 -0.16 -0.89 0.24 0.00 0.00 174.94 173.64 2g8r s THR 82 N -2.77 1.87 -0.07 8.37 2.01 0.64 -1.20 115.64 124.49 2g8r s THR 82 Ca 0.01 -0.92 -0.27 0.00 0.31 0.00 0.00 61.69 60.81 2g8r s THR 82 Cb -0.00 -1.76 -0.03 0.00 0.01 0.00 0.00 72.50 70.72 2g8r s THR 82 CO -0.04 0.41 0.88 -0.62 -0.69 0.00 0.00 174.62 174.57 2g8r s ASP 83 N 1.35 7.17 -0.18 3.53 2.15 0.70 -0.89 116.67 130.50 2g8r s ASP 83 Ca 0.03 1.42 -0.01 0.00 0.43 0.00 0.00 52.55 54.42 2g8r s ASP 83 Cb -0.14 -2.50 -0.00 0.00 -0.30 0.00 0.00 42.92 39.97 2g8r s ASP 83 CO -0.11 -0.28 -0.11 0.00 -0.17 0.00 0.00 175.17 174.50 2g8r s ARG 85 N 1.05 0.77 0.28 0.00 3.52 -0.98 -0.96 118.95 122.63 2g8r s ARG 85 Ca -0.00 0.02 -0.30 0.00 -0.13 0.00 0.00 55.73 55.31 2g8r s ARG 85 Cb -0.15 -1.01 -0.12 0.00 -1.56 0.00 0.00 34.95 32.12 2g8r s ARG 85 CO -0.02 -0.25 1.59 -1.91 -0.81 0.00 0.00 175.30 173.90 2g8r n GLU 86 N 4.86 2.66 -1.70 5.12 2.13 0.15 -0.25 120.64 133.60 2g8r n GLU 86 Ca -0.12 0.95 -0.30 0.00 0.66 0.00 0.00 57.16 58.35 2g8r n GLU 86 Cb 0.50 -2.73 0.06 0.00 0.27 0.00 0.00 31.44 29.55 2g8r n GLU 86 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2g8r s THR 87 N 0.08 3.44 0.34 6.31 -4.23 -0.14 -4.80 115.64 116.63 2g8r s THR 87 Ca 0.65 0.47 0.02 0.00 -1.18 0.00 0.00 61.69 61.65 2g8r s THR 87 Cb -0.51 -3.32 0.23 0.00 1.34 0.00 0.00 72.50 70.24 2g8r s THR 87 CO 0.47 -0.61 1.97 1.23 -0.54 0.00 0.00 174.62 177.14 2g8r h GLY 88 N -0.83 0.83 1.94 3.99 0.00 -1.94 -2.75 103.07 104.32 2g8r h GLY 88 Ca -0.46 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.52 2g8r h GLY 88 CO 0.61 0.34 -0.05 1.48 0.00 0.00 0.00 176.54 178.92 2g8r h SER 89 N 0.79 0.00 -2.48 0.19 4.64 -1.94 -3.46 113.55 111.28 2g8r h SER 89 Ca 0.20 -0.01 -0.57 0.00 -0.47 0.00 0.00 61.79 60.95 2g8r h SER 89 Cb 0.02 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.17 2g8r h SER 89 CO -0.03 0.00 0.82 -0.24 -0.87 0.00 0.00 176.83 176.51 2g8r n SER 90 N -2.69 3.27 -3.70 4.97 2.88 -1.04 -4.99 113.62 112.33 2g8r n SER 90 Ca 0.05 1.09 -0.17 0.00 -1.33 0.00 0.00 58.87 58.51 2g8r n SER 90 Cb 0.48 -1.47 -0.16 0.00 -0.75 0.00 0.00 64.21 62.31 2g8r n SER 90 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2g8r s LYS 91 N 0.65 -0.00 0.31 -1.46 2.36 -1.21 -4.91 119.74 115.48 2g8r s LYS 91 Ca 0.75 0.42 -0.29 0.00 -2.55 0.00 0.00 55.97 54.30 2g8r s LYS 91 Cb -0.63 -0.33 -0.12 0.00 -1.05 0.00 0.00 37.83 35.70 2g8r s LYS 91 CO 0.39 -0.27 1.46 0.98 1.55 0.00 0.00 175.35 179.46 2g8r n TYR 92 N 4.98 2.58 0.81 4.03 4.19 -1.26 -0.18 117.16 132.31 2g8r n TYR 92 Ca -0.11 0.40 0.07 0.00 3.31 0.00 0.00 57.90 61.57 2g8r n TYR 92 Cb 0.50 -2.51 0.19 0.00 0.49 0.00 0.00 39.34 38.02 2g8r n TYR 92 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 2g8r n PRO 93 N 1.42 1.88 -2.57 2.98 -0.05 -1.26 -4.97 135.00 132.42 2g8r n PRO 93 Ca 0.07 -1.37 -0.42 0.00 -0.05 0.00 0.00 63.50 61.73 2g8r n PRO 93 Cb 0.36 -1.31 0.01 0.00 -0.05 0.00 0.00 33.50 32.50 2g8r n PRO 93 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 175.50 175.54 2g8r n ASN 94 N 0.61 6.33 -4.73 3.54 4.13 0.75 -5.01 115.26 120.89 2g8r n ASN 94 Ca 0.13 -3.31 -0.42 0.00 1.68 0.00 0.00 54.58 52.67 2g8r n ASN 94 Cb 0.33 -1.34 -0.03 0.00 -1.54 0.00 0.00 39.78 37.20 2g8r n ASN 94 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2g8r s ALA 96 N 0.70 1.34 0.03 0.00 0.00 -1.26 -4.92 121.76 117.65 2g8r s ALA 96 Ca 0.63 -0.64 0.05 0.00 0.00 0.00 0.00 51.96 52.00 2g8r s ALA 96 Cb -0.39 -0.40 -0.02 0.00 0.00 0.00 0.00 23.12 22.31 2g8r s ALA 96 CO 0.35 0.28 -0.14 0.71 0.00 0.00 0.00 175.76 176.96 2g8r s TYR 97 N -0.13 1.19 -0.04 0.00 1.51 -1.26 -0.97 117.35 117.66 2g8r s TYR 97 Ca 0.01 -0.33 -0.23 0.00 -1.01 0.00 0.00 57.07 55.51 2g8r s TYR 97 Cb -0.09 -0.72 -0.04 0.00 -0.11 0.00 0.00 41.96 41.00 2g8r s TYR 97 CO 0.01 0.02 0.70 0.21 -1.11 0.00 0.00 175.55 175.38 2g8r s LYS 98 N -0.97 4.43 -0.27 -0.62 2.20 0.65 -4.60 119.74 120.56 2g8r s LYS 98 Ca 0.02 0.90 -0.11 0.00 -0.36 0.00 0.00 55.97 56.42 2g8r s LYS 98 Cb -0.07 -3.42 -0.05 0.00 -1.51 0.00 0.00 37.83 32.78 2g8r s LYS 98 CO 0.01 0.15 0.17 0.99 -0.36 0.00 0.00 175.35 176.31 2g8r s THR 99 N 0.49 5.26 -0.19 3.43 2.01 -1.26 -2.31 115.64 123.06 2g8r s THR 99 Ca 0.37 0.15 0.00 0.00 0.31 0.00 0.00 61.69 62.52 2g8r s THR 99 Cb -0.18 -3.49 0.05 0.00 0.01 0.00 0.00 72.50 68.89 2g8r s THR 99 CO 0.19 0.28 -0.07 -0.89 -0.69 0.00 0.00 174.62 173.45 2g8r s THR 100 N 1.54 1.35 0.15 -0.82 2.01 -0.37 -4.95 115.64 114.56 2g8r s THR 100 Ca 0.07 -0.88 -0.26 0.00 0.31 0.00 0.00 61.69 60.93 2g8r s THR 100 Cb -0.15 -1.52 -0.08 0.00 0.01 0.00 0.00 72.50 70.76 2g8r s THR 100 CO 0.09 0.08 0.82 -1.58 -0.69 0.00 0.00 174.62 173.33 2g8r s GLN 101 N 1.51 4.62 0.24 4.92 2.00 -1.26 -0.21 119.66 131.47 2g8r s GLN 101 Ca -0.01 1.22 -0.13 0.00 -2.00 0.00 0.00 55.36 54.43 2g8r s GLN 101 Cb -0.16 -3.29 -0.00 0.00 0.80 0.00 0.00 33.01 30.36 2g8r s GLN 101 CO -0.08 0.49 0.48 0.00 -0.50 0.00 0.00 175.29 175.69 2g8r s ALA 102 N -0.89 -0.35 -0.25 1.58 0.00 -0.34 -4.97 121.76 116.54 2g8r s ALA 102 Ca 0.38 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.58 2g8r s ALA 102 Cb -0.23 1.02 0.05 0.00 0.00 0.00 0.00 23.12 23.96 2g8r s ALA 102 CO 0.27 -0.85 -0.12 -0.80 0.00 0.00 0.00 175.76 174.27 2g8r s ASN 103 N -2.99 4.21 0.08 0.00 0.01 -1.26 -1.33 114.94 113.65 2g8r s ASN 103 Ca 0.20 -1.20 -0.06 0.00 -0.71 0.00 0.00 52.86 51.10 2g8r s ASN 103 Cb -0.01 -1.56 -0.02 0.00 0.41 0.00 0.00 41.25 40.08 2g8r s ASN 103 CO 0.07 -0.15 0.11 -0.54 -1.51 0.00 0.00 177.10 175.08 2g8r s LYS 104 N 1.17 0.78 0.29 -0.60 1.02 -0.72 -4.79 119.74 116.90 2g8r s LYS 104 Ca -0.05 -1.09 -0.28 0.00 0.02 0.00 0.00 55.97 54.57 2g8r s LYS 104 Cb -0.18 0.29 -0.09 0.00 -0.52 0.00 0.00 37.83 37.33 2g8r s LYS 104 CO -0.06 -0.22 1.04 -1.01 -0.92 0.00 0.00 175.35 174.18 2g8r s HIS 105 N -3.90 3.64 0.11 3.18 3.76 -0.26 -0.19 115.29 121.62 2g8r s HIS 105 Ca 0.07 1.75 0.03 0.00 -0.15 0.00 0.00 55.06 56.77 2g8r s HIS 105 Cb 0.06 -3.16 -0.04 0.00 1.11 0.00 0.00 32.58 30.55 2g8r s HIS 105 CO -0.09 -0.26 0.12 0.96 -0.85 0.00 0.00 174.74 174.62 2g8r s ILE 106 N -1.28 4.66 -0.15 0.60 -4.36 -1.26 -0.83 121.20 118.58 2g8r s ILE 106 Ca 0.46 -0.81 0.01 0.00 -0.26 0.00 0.00 60.65 60.05 2g8r s ILE 106 Cb -0.28 -3.30 0.02 0.00 1.25 0.00 0.00 42.46 40.15 2g8r s ILE 106 CO 0.35 0.05 -0.16 -0.63 0.24 0.00 0.00 174.94 174.79 2g8r s ILE 107 N -1.52 1.70 0.16 8.37 1.01 0.58 -1.05 121.20 130.44 2g8r s ILE 107 Ca 0.31 -0.72 0.09 0.00 0.00 0.00 0.00 60.65 60.32 2g8r s ILE 107 Cb -0.12 -1.56 -0.04 0.00 0.01 0.00 0.00 42.46 40.75 2g8r s ILE 107 CO 0.23 0.48 -0.20 0.68 0.00 0.00 0.00 174.94 176.13 2g8r s VAL 108 N 1.30 1.94 -0.08 2.92 -7.23 -0.23 -0.29 120.40 118.72 2g8r s VAL 108 Ca 0.02 -1.87 -0.10 0.00 -1.81 0.00 0.00 61.98 58.21 2g8r s VAL 108 Cb -0.13 -1.86 -0.05 0.00 0.56 0.00 0.00 36.38 34.90 2g8r s VAL 108 CO -0.09 -0.21 0.25 0.00 -0.31 0.00 0.00 175.10 174.74 2g8r s ALA 109 N -1.77 3.79 0.09 1.32 0.00 0.20 -0.68 121.76 124.71 2g8r s ALA 109 Ca 0.15 -0.47 0.08 0.00 0.00 0.00 0.00 51.96 51.73 2g8r s ALA 109 Cb -0.07 -2.16 -0.03 0.00 0.00 0.00 0.00 23.12 20.86 2g8r s ALA 109 CO 0.07 0.53 -0.22 0.00 0.00 0.00 0.00 175.76 176.13 2g8r s GLU 111 N -1.71 1.15 0.00 0.00 2.02 -0.74 -4.88 118.70 114.53 2g8r s GLU 111 Ca 0.08 -0.70 0.00 0.00 0.02 0.00 0.00 54.97 54.37 2g8r s GLU 111 Cb -0.10 0.50 0.00 0.00 0.10 0.00 0.00 34.13 34.63 2g8r s GLU 111 CO 0.04 -0.47 0.00 0.41 0.02 0.00 0.00 175.26 175.26 2g8r n GLY 112 N -0.27 0.04 2.77 -1.39 0.00 -1.26 -2.33 105.19 102.75 2g8r n GLY 112 Ca -0.15 -1.95 -0.29 0.00 0.00 0.00 0.00 46.02 43.63 2g8r n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2g8r s ASN 113 N -0.64 3.50 0.68 1.61 2.47 -1.26 -2.72 114.94 118.57 2g8r s ASN 113 Ca 0.00 -1.19 -0.15 0.00 0.42 0.00 0.00 52.86 51.94 2g8r s ASN 113 Cb 0.00 -0.80 0.01 0.00 -1.45 0.00 0.00 41.25 39.01 2g8r s ASN 113 CO 0.00 -0.33 1.15 -2.16 -3.72 0.00 0.00 177.10 172.03 2g8r s PRO 114 N 1.69 2.60 -0.47 0.43 0.04 -1.26 -5.10 135.00 132.92 2g8r s PRO 114 Ca 0.02 1.55 -0.27 0.00 0.04 0.00 0.00 61.00 62.34 2g8r s PRO 114 Cb -0.17 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.48 2g8r s PRO 114 CO -0.14 -1.44 1.05 -0.47 0.04 0.00 0.00 177.00 176.04 2g8r s TYR 115 N -2.16 2.86 0.07 0.56 5.04 -1.10 -4.86 117.35 117.76 2g8r s TYR 115 Ca 0.70 0.56 0.00 0.00 -2.44 0.00 0.00 57.07 55.90 2g8r s TYR 115 Cb -0.24 -4.24 -0.04 0.00 0.35 0.00 0.00 41.96 37.79 2g8r s TYR 115 CO 0.42 -1.20 -0.04 0.14 -1.34 0.00 0.00 175.55 173.52 2g8r s VAL 116 N 4.16 0.40 0.17 3.14 -7.23 -0.98 -4.88 120.40 115.18 2g8r s VAL 116 Ca 0.43 -1.81 -0.31 0.00 -1.81 0.00 0.00 61.98 58.49 2g8r s VAL 116 Cb -0.08 -1.51 -0.09 0.00 0.56 0.00 0.00 36.38 35.25 2g8r s VAL 116 CO 0.30 -0.92 1.42 -2.84 -0.31 0.00 0.00 175.10 172.75 2g8r s PRO 117 N -3.74 4.30 0.00 4.82 0.02 -1.26 -1.79 135.00 137.35 2g8r s PRO 117 Ca 0.08 2.17 0.00 0.00 0.02 0.00 0.00 61.00 63.27 2g8r s PRO 117 Cb 0.06 -3.19 0.00 0.00 0.02 0.00 0.00 34.50 31.39 2g8r s PRO 117 CO -0.07 -0.43 0.04 1.33 -0.33 0.00 0.00 177.00 177.54 2g8r n VAL 118 N 3.34 0.00 -3.68 3.83 0.24 0.38 -4.42 118.33 118.02 2g8r n VAL 118 Ca 0.10 -0.33 -0.12 0.00 -2.04 0.00 0.00 64.34 61.94 2g8r n VAL 118 Cb 0.41 1.04 -0.09 0.00 -1.47 0.00 0.00 33.84 33.74 2g8r n VAL 118 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2g8r s HIS 119 N -0.58 -0.67 -0.34 6.34 5.65 -1.12 -4.68 115.29 119.90 2g8r s HIS 119 Ca 0.00 1.55 -0.17 0.00 0.25 0.00 0.00 55.06 56.69 2g8r s HIS 119 Cb 0.00 0.28 -0.01 0.00 -1.18 0.00 0.00 32.58 31.66 2g8r s HIS 119 CO 0.00 -0.33 0.44 0.12 -0.65 0.00 0.00 174.74 174.32 2g8r s PHE 120 N 0.64 3.20 -0.16 3.88 2.19 -1.26 -0.63 117.98 125.84 2g8r s PHE 120 Ca -0.03 0.14 -0.06 0.00 0.33 0.00 0.00 56.93 57.32 2g8r s PHE 120 Cb -0.05 -2.79 -0.24 0.00 -1.31 0.00 0.00 43.02 38.64 2g8r s PHE 120 CO -0.04 -0.46 0.22 -3.47 1.83 0.00 0.00 175.22 173.31 2g8r n ASP 121 N 5.56 2.08 -3.58 6.13 2.03 0.60 -4.97 116.55 124.41 2g8r n ASP 121 Ca -0.07 0.15 -0.05 0.00 0.52 0.00 0.00 54.79 55.34 2g8r n ASP 121 Cb 0.49 -0.78 -0.02 0.00 -0.72 0.00 0.00 41.12 40.10 2g8r n ASP 121 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2g8r s ALA 122 N -2.54 -1.97 -0.03 -1.67 0.00 -1.04 -4.97 121.76 109.54 2g8r s ALA 122 Ca -0.26 1.20 0.06 0.00 0.00 0.00 0.00 51.96 52.97 2g8r s ALA 122 Cb 0.07 0.17 -0.01 0.00 0.00 0.00 0.00 23.12 23.35 2g8r s ALA 122 CO 0.72 -0.70 -0.23 -1.54 0.00 0.00 0.00 175.76 174.01 2g8r s SER 123 N -2.42 2.74 0.00 0.00 1.04 -1.26 -0.31 113.70 113.50 2g8r s SER 123 Ca 0.09 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.08 2g8r s SER 123 Cb -0.00 -0.49 0.00 0.00 0.10 0.00 0.00 66.02 65.62 2g8r s SER 123 CO -0.06 0.26 0.10 1.33 0.98 0.00 0.00 173.24 175.85