#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h6r s VAL 2 N 0.00 -0.95 -0.20 1.12 1.01 -1.11 -4.84 120.40 115.42 2h6r s VAL 2 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 61.98 61.99 2h6r s VAL 2 Cb 0.00 -1.00 0.04 0.00 0.00 0.00 0.00 36.38 35.42 2h6r s VAL 2 CO 0.00 0.00 -0.11 -0.63 0.00 0.00 0.00 175.10 174.36 2h6r s ILE 3 N 2.86 1.76 -0.17 2.22 1.01 -1.23 0.19 121.20 127.83 2h6r s ILE 3 Ca 0.01 -1.09 0.00 0.00 0.00 0.00 0.00 60.65 59.57 2h6r s ILE 3 Cb -0.12 -1.81 0.01 0.00 0.01 0.00 0.00 42.46 40.55 2h6r s ILE 3 CO -0.19 0.18 -0.17 -0.69 0.00 0.00 0.00 174.94 174.07 2h6r s VAL 4 N 1.34 2.38 -0.39 2.92 1.01 -0.17 0.14 120.40 127.64 2h6r s VAL 4 Ca -0.02 -0.84 -0.13 0.00 0.00 0.00 0.00 61.98 60.99 2h6r s VAL 4 Cb -0.16 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 34.23 2h6r s VAL 4 CO -0.08 0.52 0.25 -0.63 0.00 0.00 0.00 175.10 175.16 2h6r s ILE 5 N 1.15 4.94 -0.07 2.22 1.01 -0.23 -1.85 121.20 128.38 2h6r s ILE 5 Ca 0.01 -0.73 -0.28 0.00 0.00 0.00 0.00 60.65 59.65 2h6r s ILE 5 Cb -0.14 -3.75 -0.02 0.00 0.01 0.00 0.00 42.46 38.56 2h6r s ILE 5 CO -0.07 -0.26 0.90 0.21 0.00 0.00 0.00 174.94 175.72 2h6r s ASN 6 N 1.62 7.18 0.12 3.58 2.47 0.90 -0.41 114.94 130.41 2h6r s ASN 6 Ca 0.04 1.44 0.17 0.00 0.42 0.00 0.00 52.86 54.93 2h6r s ASN 6 Cb -0.19 -2.51 -0.08 0.00 -1.45 0.00 0.00 41.25 37.02 2h6r s ASN 6 CO 0.08 -0.30 0.98 1.88 -3.72 0.00 0.00 177.10 176.02 2h6r h TYR 7 N 6.95 0.00 0.00 0.43 -1.99 -1.61 -3.39 116.97 117.36 2h6r h TYR 7 Ca -0.37 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.36 2h6r h TYR 7 Cb 1.18 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.91 2h6r h TYR 7 CO 0.69 0.48 0.00 1.63 -0.00 0.00 0.00 178.16 180.96 2h6r n LYS 8 N -2.93 0.00 -1.77 4.88 5.02 -1.26 -3.06 118.16 119.05 2h6r n LYS 8 Ca -0.06 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.24 2h6r n LYS 8 Cb 0.78 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.84 2h6r n LYS 8 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2h6r n THR 9 N 0.00 0.81 -2.64 -0.18 -2.24 -1.26 -4.66 114.28 104.11 2h6r n THR 9 Ca 0.00 -2.04 -0.33 0.00 -2.27 0.00 0.00 64.05 59.41 2h6r n THR 9 Cb 0.00 0.76 -0.05 0.00 -2.10 0.00 0.00 70.33 68.94 2h6r n THR 9 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 2h6r s TYR 10 N -1.70 3.21 -0.38 4.78 1.51 -1.17 -4.93 117.35 118.67 2h6r s TYR 10 Ca 0.34 1.58 0.27 0.00 -1.01 0.00 0.00 57.07 58.24 2h6r s TYR 10 Cb 0.37 -2.92 0.99 0.00 -0.11 0.00 0.00 41.96 40.29 2h6r s TYR 10 CO -0.11 -0.42 1.78 -0.91 -1.11 0.00 0.00 175.55 174.78 2h6r h ASN 11 N 1.60 0.00 -0.15 2.29 4.21 -1.99 -2.83 115.58 118.72 2h6r h ASN 11 Ca -0.49 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.02 2h6r h ASN 11 Cb 1.20 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.40 2h6r h ASN 11 CO 0.60 0.00 0.00 -0.62 -1.29 0.00 0.00 177.43 176.12 2h6r n GLU 12 N -2.54 1.61 -0.39 0.81 4.71 -1.26 -3.64 120.64 119.95 2h6r n GLU 12 Ca 0.03 -0.65 0.00 0.00 -0.01 0.00 0.00 57.16 56.53 2h6r n GLU 12 Cb 0.32 -1.38 0.00 0.00 -1.01 0.00 0.00 31.44 29.36 2h6r n GLU 12 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 2h6r n SER 13 N 0.06 0.00 -4.77 1.62 3.41 -1.07 -4.54 113.62 108.33 2h6r n SER 13 Ca 0.06 -1.56 -0.37 0.00 -0.26 0.00 0.00 58.87 56.74 2h6r n SER 13 Cb 0.29 -0.11 -0.07 0.00 -0.26 0.00 0.00 64.21 64.06 2h6r n SER 13 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2h6r s ILE 14 N 0.00 5.25 0.00 -1.33 1.01 -1.24 -3.73 121.20 121.16 2h6r s ILE 14 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 60.65 61.28 2h6r s ILE 14 Cb 0.00 -3.64 0.00 0.00 0.01 0.00 0.00 42.46 38.83 2h6r s ILE 14 CO 0.00 0.46 0.00 0.61 0.00 0.00 0.00 174.94 176.01 2h6r n GLY 15 N 2.82 3.61 0.26 6.18 0.00 -1.26 -2.51 105.19 114.29 2h6r n GLY 15 Ca -0.13 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 45.90 2h6r n GLY 15 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2h6r h ASN 16 N 0.00 0.00 -0.51 1.61 4.21 -1.99 -2.05 115.58 116.85 2h6r h ASN 16 Ca 0.00 0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.44 2h6r h ASN 16 Cb 0.00 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.18 2h6r h ASN 16 CO 0.00 0.08 0.05 0.03 -1.29 0.00 0.00 177.43 176.30 2h6r h ARG 17 N 0.00 0.92 0.00 0.81 3.08 -1.82 -1.14 114.38 116.24 2h6r h ARG 17 Ca -0.00 -0.24 -0.03 0.00 0.07 0.00 0.00 59.98 59.78 2h6r h ARG 17 Cb 0.15 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 2h6r h ARG 17 CO 0.01 0.88 -0.13 0.78 -1.07 0.00 0.00 179.97 180.44 2h6r h GLY 18 N 1.00 0.00 1.45 0.04 0.00 -1.47 -3.07 103.07 101.02 2h6r h GLY 18 Ca 0.17 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.30 2h6r h GLY 18 CO 0.02 0.00 -0.78 -2.00 0.00 0.00 0.00 176.54 173.77 2h6r h LEU 19 N 0.00 0.64 -0.99 3.11 6.46 -0.86 -2.78 115.31 120.89 2h6r h LEU 19 Ca -0.00 -0.44 -0.10 0.00 -0.12 0.00 0.00 57.88 57.22 2h6r h LEU 19 Cb 1.06 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.79 2h6r h LEU 19 CO 0.02 1.20 -0.46 -0.33 -0.62 0.00 0.00 178.44 178.25 2h6r h GLU 20 N 0.35 0.09 0.00 1.25 4.39 -1.19 -2.49 114.58 116.99 2h6r h GLU 20 Ca -0.05 -0.05 -0.11 0.00 0.34 0.00 0.00 59.36 59.49 2h6r h GLU 20 Cb 1.38 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.02 2h6r h GLU 20 CO 0.14 0.54 -0.54 0.82 -1.16 0.00 0.00 179.01 178.81 2h6r h ILE 21 N 0.08 1.22 -0.00 3.13 2.04 -1.46 -2.51 117.51 120.01 2h6r h ILE 21 Ca 0.00 -1.97 -0.00 0.00 1.00 0.00 0.00 64.86 63.89 2h6r h ILE 21 Cb 0.84 2.12 -0.00 0.00 -0.74 0.00 0.00 36.82 39.04 2h6r h ILE 21 CO 0.06 0.53 -0.00 0.00 0.00 0.00 0.00 178.15 178.74 2h6r h ALA 22 N 1.46 0.00 0.00 1.87 0.00 -1.17 -2.23 119.26 119.19 2h6r h ALA 22 Ca -0.01 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 2h6r h ALA 22 Cb 1.07 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2h6r h ALA 22 CO 0.07 -0.23 -0.10 1.57 0.00 0.00 0.00 179.25 180.56 2h6r h LYS 23 N -0.53 0.00 -0.07 0.00 2.10 -1.50 0.18 116.57 116.75 2h6r h LYS 23 Ca 0.00 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 58.42 2h6r h LYS 23 Cb 0.54 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.88 2h6r h LYS 23 CO 0.00 0.10 -0.88 0.82 -2.00 0.00 0.00 179.45 177.50 2h6r h ILE 24 N 0.00 1.32 0.00 0.07 1.08 -1.43 -0.78 117.51 117.76 2h6r h ILE 24 Ca -0.00 -2.17 -0.11 0.00 -0.39 0.00 0.00 64.86 62.19 2h6r h ILE 24 Cb 0.57 2.20 -0.02 0.00 -3.07 0.00 0.00 36.82 36.51 2h6r h ILE 24 CO 0.01 0.67 -0.52 0.00 -0.69 0.00 0.00 178.15 177.62 2h6r h ALA 25 N 0.61 0.88 -0.15 1.87 0.00 -0.82 -2.85 119.26 118.80 2h6r h ALA 25 Ca -0.08 -0.47 -0.19 0.00 0.00 0.00 0.00 54.91 54.17 2h6r h ALA 25 Cb 1.51 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 2h6r h ALA 25 CO 0.17 0.65 -0.67 1.49 0.00 0.00 0.00 179.25 180.89 2h6r h GLU 26 N 0.00 0.60 -0.09 0.00 4.81 -0.48 -2.46 114.58 116.96 2h6r h GLU 26 Ca -0.01 -0.44 -0.01 0.00 -0.13 0.00 0.00 59.36 58.77 2h6r h GLU 26 Cb 1.10 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.56 2h6r h GLU 26 CO 0.07 1.07 0.02 -0.22 -0.73 0.00 0.00 179.01 179.21 2h6r h LYS 27 N 0.44 0.15 0.00 1.92 1.63 -0.96 -2.64 116.57 117.10 2h6r h LYS 27 Ca -0.02 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 2h6r h LYS 27 Cb 1.25 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.86 2h6r h LYS 27 CO 0.13 0.33 0.00 1.33 -3.45 0.00 0.00 179.45 177.79 2h6r n VAL 28 N -4.88 0.52 0.01 2.00 0.24 -1.09 -2.60 118.33 112.52 2h6r n VAL 28 Ca -0.06 0.08 -0.17 0.00 -2.04 0.00 0.00 64.34 62.14 2h6r n VAL 28 Cb 0.15 -0.76 -0.07 0.00 -1.47 0.00 0.00 33.84 31.69 2h6r n VAL 28 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 2h6r h SER 29 N 0.00 0.88 0.55 -1.34 0.87 -1.07 -1.32 113.55 112.12 2h6r h SER 29 Ca 0.00 -0.62 0.00 0.00 -1.23 0.00 0.00 61.79 59.94 2h6r h SER 29 Cb 0.43 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 2h6r h SER 29 CO 0.00 1.42 -0.64 -1.84 -0.53 0.00 0.00 176.83 175.23 2h6r n GLU 30 N -3.89 0.12 0.01 2.24 0.28 -1.12 0.02 120.64 118.30 2h6r n GLU 30 Ca -0.08 0.02 -0.18 0.00 -0.16 0.00 0.00 57.16 56.76 2h6r n GLU 30 Cb 0.79 -1.56 -0.14 0.00 1.43 0.00 0.00 31.44 31.96 2h6r n GLU 30 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2h6r h GLU 31 N 0.00 0.21 0.01 3.44 4.39 -1.54 -3.37 114.58 117.73 2h6r h GLU 31 Ca 0.00 -0.36 -0.28 0.00 0.34 0.00 0.00 59.36 59.06 2h6r h GLU 31 Cb 0.60 0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 29.34 2h6r h GLU 31 CO 0.00 1.04 -1.59 1.03 -1.16 0.00 0.00 179.01 178.33 2h6r h SER 32 N 0.06 0.03 0.00 1.42 0.87 -1.33 -3.48 113.55 111.12 2h6r h SER 32 Ca -0.36 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 2h6r h SER 32 Cb 2.03 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.98 2h6r h SER 32 CO 0.10 1.05 0.00 0.61 -0.53 0.00 0.00 176.83 178.06 2h6r n GLY 33 N 1.54 0.51 3.32 5.77 0.00 0.10 -5.04 105.19 111.39 2h6r n GLY 33 Ca -0.14 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 44.90 2h6r n GLY 33 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h6r s ILE 34 N -2.00 3.08 -0.12 -0.61 1.01 -0.60 -4.99 121.20 116.96 2h6r s ILE 34 Ca 0.00 -0.62 -0.29 0.00 0.00 0.00 0.00 60.65 59.73 2h6r s ILE 34 Cb 0.00 -2.34 -0.04 0.00 0.01 0.00 0.00 42.46 40.09 2h6r s ILE 34 CO 0.00 0.49 1.62 -0.89 0.00 0.00 0.00 174.94 176.15 2h6r s THR 35 N 0.92 3.67 -0.18 2.92 2.01 -1.26 -4.40 115.64 119.32 2h6r s THR 35 Ca -0.02 0.79 0.01 0.00 0.31 0.00 0.00 61.69 62.78 2h6r s THR 35 Cb -0.15 -3.57 0.02 0.00 0.01 0.00 0.00 72.50 68.80 2h6r s THR 35 CO -0.00 -0.14 -0.19 -0.63 -0.69 0.00 0.00 174.62 172.97 2h6r s ILE 36 N 4.46 2.17 0.38 1.82 1.01 -1.26 -3.51 121.20 126.26 2h6r s ILE 36 Ca 0.72 -0.91 0.08 0.00 0.00 0.00 0.00 60.65 60.53 2h6r s ILE 36 Cb -0.30 -1.91 -0.02 0.00 0.01 0.00 0.00 42.46 40.25 2h6r s ILE 36 CO 0.28 0.53 0.38 -0.83 0.00 0.00 0.00 174.94 175.30 2h6r s GLY 37 N 1.22 1.94 0.09 6.18 0.00 0.37 -4.32 107.32 112.80 2h6r s GLY 37 Ca 0.03 -1.74 0.03 0.00 0.00 0.00 0.00 44.72 43.04 2h6r s GLY 37 CO -0.10 -1.60 -0.09 -1.34 0.00 0.00 0.00 173.10 169.96 2h6r s VAL 38 N -2.37 0.89 -0.62 1.40 -7.23 -0.08 -1.07 120.40 111.31 2h6r s VAL 38 Ca 0.46 -1.65 0.05 0.00 -1.81 0.00 0.00 61.98 59.03 2h6r s VAL 38 Cb -0.06 -1.36 0.19 0.00 0.56 0.00 0.00 36.38 35.71 2h6r s VAL 38 CO 0.28 -0.59 0.51 0.00 -0.31 0.00 0.00 175.10 174.99 2h6r n ALA 39 N 0.52 3.36 -1.26 1.32 0.00 0.46 -0.52 120.51 124.39 2h6r n ALA 39 Ca -0.16 -4.22 -0.29 0.00 0.00 0.00 0.00 53.44 48.77 2h6r n ALA 39 Cb 0.58 -0.94 0.19 0.00 0.00 0.00 0.00 19.45 19.27 2h6r n ALA 39 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2h6r s PRO 40 N -1.31 0.14 0.62 0.00 0.02 -1.22 -1.57 135.00 131.68 2h6r s PRO 40 Ca 0.29 0.27 -0.14 0.00 0.02 0.00 0.00 61.00 61.44 2h6r s PRO 40 Cb 0.02 -1.73 -0.03 0.00 0.02 0.00 0.00 34.50 32.78 2h6r s PRO 40 CO -0.15 -2.87 1.05 -0.65 -0.33 0.00 0.00 177.00 174.05 2h6r s GLN 41 N -5.18 3.27 0.36 5.54 -0.21 -1.26 -4.11 119.66 118.06 2h6r s GLN 41 Ca 0.67 1.10 0.13 0.00 0.02 0.00 0.00 55.36 57.28 2h6r s GLN 41 Cb -0.15 -2.03 0.97 0.00 1.00 0.00 0.00 33.01 32.80 2h6r s GLN 41 CO 0.56 -0.84 1.77 0.74 -2.12 0.00 0.00 175.29 175.40 2h6r h PHE 42 N 0.13 0.82 0.00 0.91 -1.00 -1.96 0.33 116.94 116.18 2h6r h PHE 42 Ca -0.46 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.35 2h6r h PHE 42 Cb 1.21 -0.24 0.00 0.00 3.61 0.00 0.00 35.95 40.53 2h6r h PHE 42 CO 0.60 0.11 0.00 -0.39 -1.61 0.00 0.00 178.31 177.02 2h6r h VAL 43 N 0.53 0.00 -0.01 -0.55 -1.51 -2.03 -3.24 116.25 109.43 2h6r h VAL 43 Ca 0.59 -0.64 0.00 0.00 -1.23 0.00 0.00 66.70 65.41 2h6r h VAL 43 Cb 1.26 1.61 0.00 0.00 -2.13 0.00 0.00 31.29 32.04 2h6r h VAL 43 CO -0.34 0.00 -0.38 0.47 -1.23 0.00 0.00 177.57 176.08 2h6r n ASP 44 N -2.66 1.82 0.00 4.19 10.43 0.01 -4.74 116.55 125.60 2h6r n ASP 44 Ca 0.04 -1.41 0.00 0.00 2.57 0.00 0.00 54.79 55.99 2h6r n ASP 44 Cb 0.43 0.46 0.00 0.00 1.84 0.00 0.00 41.12 43.85 2h6r n ASP 44 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 2h6r n LEU 45 N -0.05 0.00 0.00 0.64 4.77 -0.65 -2.57 117.00 119.14 2h6r n LEU 45 Ca 0.08 0.91 0.06 0.00 -0.03 0.00 0.00 56.01 57.03 2h6r n LEU 45 Cb 0.40 -0.41 0.31 0.00 -2.33 0.00 0.00 43.42 41.39 2h6r n LEU 45 CO 0.23 -0.41 0.65 -2.11 -1.33 0.00 0.00 177.39 174.42 2h6r n ARG 46 N -2.15 0.18 0.08 3.23 1.85 -1.26 -2.32 116.66 116.27 2h6r n ARG 46 Ca 0.00 0.16 -0.18 0.00 -1.00 0.00 0.00 57.85 56.83 2h6r n ARG 46 Cb 0.00 -1.50 -0.10 0.00 -1.05 0.00 0.00 32.46 29.81 2h6r n ARG 46 CO 0.00 0.00 0.00 1.98 -0.01 0.00 0.00 177.63 179.60 2h6r h MET 47 N 0.00 0.53 0.11 2.89 4.05 -1.79 -3.21 114.93 117.51 2h6r h MET 47 Ca 0.00 -0.65 -0.29 0.00 -0.28 0.00 0.00 59.70 58.48 2h6r h MET 47 Cb 0.11 0.20 -0.00 0.00 -0.80 0.00 0.00 31.60 31.11 2h6r h MET 47 CO 0.00 1.26 -1.42 0.82 0.23 0.00 0.00 176.91 177.81 2h6r h ILE 48 N 0.26 1.29 -0.90 1.77 5.03 -1.29 -3.26 117.51 120.41 2h6r h ILE 48 Ca -0.14 -2.91 0.03 0.00 -0.12 0.00 0.00 64.86 61.72 2h6r h ILE 48 Cb 1.78 2.82 -0.05 0.00 -3.03 0.00 0.00 36.82 38.34 2h6r h ILE 48 CO 0.20 0.84 0.59 0.58 -0.68 0.00 0.00 178.15 179.68 2h6r h VAL 49 N 0.07 1.17 0.00 1.67 2.07 -1.62 0.63 116.25 120.24 2h6r h VAL 49 Ca -0.20 -0.39 -0.12 0.00 0.82 0.00 0.00 66.70 66.81 2h6r h VAL 49 Cb 1.99 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 2h6r h VAL 49 CO 0.17 0.21 -0.57 -0.33 0.02 0.00 0.00 177.57 177.08 2h6r h GLU 50 N 1.15 0.00 0.00 1.57 5.08 -1.67 -3.37 114.58 117.34 2h6r h GLU 50 Ca 0.35 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.38 2h6r h GLU 50 Cb -0.03 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.16 2h6r h GLU 50 CO -0.10 0.57 -2.24 0.09 -1.00 0.00 0.00 179.01 176.33 2h6r n ASN 51 N -3.39 1.64 -4.68 1.42 3.02 -0.98 -4.99 115.26 107.30 2h6r n ASN 51 Ca 0.01 -0.07 -0.33 0.00 -0.03 0.00 0.00 54.58 54.16 2h6r n ASN 51 Cb 0.69 0.16 -0.09 0.00 -0.61 0.00 0.00 39.78 39.94 2h6r n ASN 51 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2h6r s VAL 52 N -2.44 4.17 -1.02 2.41 1.01 0.22 -5.05 120.40 119.70 2h6r s VAL 52 Ca -0.21 -0.54 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 2h6r s VAL 52 Cb 0.07 -2.84 0.31 0.00 0.00 0.00 0.00 36.38 33.92 2h6r s VAL 52 CO 0.59 0.42 1.46 -3.20 0.00 0.00 0.00 175.10 174.37 2h6r n ASN 53 N 1.54 6.28 -3.92 3.32 5.15 -1.26 -4.48 115.26 121.89 2h6r n ASN 53 Ca -0.15 -3.46 -0.09 0.00 -0.60 0.00 0.00 54.58 50.28 2h6r n ASN 53 Cb 0.53 -1.19 -0.08 0.00 -0.53 0.00 0.00 39.78 38.51 2h6r n ASN 53 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2h6r s ILE 54 N -3.02 0.16 -0.05 -1.44 -5.25 -1.26 -5.01 121.20 105.32 2h6r s ILE 54 Ca 0.33 -1.28 -0.31 0.00 -0.99 0.00 0.00 60.65 58.41 2h6r s ILE 54 Cb 0.08 -1.25 -0.09 0.00 2.95 0.00 0.00 42.46 44.15 2h6r s ILE 54 CO 0.06 -0.71 2.02 -2.65 -1.79 0.00 0.00 174.94 171.87 2h6r n PRO 55 N 0.22 2.51 -4.12 0.37 -0.02 -1.26 -4.90 135.00 127.79 2h6r n PRO 55 Ca -0.16 0.88 -0.35 0.00 -2.02 0.00 0.00 63.50 61.85 2h6r n PRO 55 Cb 0.61 -2.97 -0.12 0.00 -0.02 0.00 0.00 33.50 31.00 2h6r n PRO 55 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2h6r s VAL 56 N 5.25 4.02 0.12 -1.45 1.01 -1.26 -0.91 120.40 127.18 2h6r s VAL 56 Ca 0.93 -0.30 0.11 0.00 0.00 0.00 0.00 61.98 62.72 2h6r s VAL 56 Cb -0.48 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.06 2h6r s VAL 56 CO 0.43 0.44 -0.26 -0.31 0.00 0.00 0.00 175.10 175.40 2h6r s TYR 57 N 0.84 2.35 0.47 5.22 1.51 0.33 -0.61 117.35 127.45 2h6r s TYR 57 Ca 0.01 -0.36 -0.14 0.00 -1.01 0.00 0.00 57.07 55.56 2h6r s TYR 57 Cb -0.14 -1.28 -0.07 0.00 -0.11 0.00 0.00 41.96 40.36 2h6r s TYR 57 CO 0.02 0.33 0.90 0.00 -1.11 0.00 0.00 175.55 175.68 2h6r s ALA 58 N -1.05 3.18 -0.87 3.71 0.00 -0.79 -3.43 121.76 122.51 2h6r s ALA 58 Ca 0.14 0.04 0.26 0.00 0.00 0.00 0.00 51.96 52.40 2h6r s ALA 58 Cb -0.10 -2.95 0.71 0.00 0.00 0.00 0.00 23.12 20.77 2h6r s ALA 58 CO 0.06 -0.13 1.58 1.04 0.00 0.00 0.00 175.76 178.32 2h6r n GLN 59 N -1.42 0.11 -3.62 0.00 6.02 -1.26 0.79 117.38 118.01 2h6r n GLN 59 Ca 0.05 0.05 -0.05 0.00 -0.01 0.00 0.00 57.00 57.05 2h6r n GLN 59 Cb 0.54 -1.59 -0.04 0.00 1.02 0.00 0.00 30.24 30.17 2h6r n GLN 59 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 2h6r s HIS 60 N -3.06 -0.14 -0.14 1.08 5.04 -1.17 -4.51 115.29 112.39 2h6r s HIS 60 Ca 0.11 0.20 -0.04 0.00 -1.54 0.00 0.00 55.06 53.79 2h6r s HIS 60 Cb 0.16 0.49 0.07 0.00 0.04 0.00 0.00 32.58 33.34 2h6r s HIS 60 CO 0.64 -0.14 0.20 0.42 -2.34 0.00 0.00 174.74 173.52 2h6r s ILE 61 N -1.36 -0.31 0.46 0.89 1.01 -1.26 -4.93 121.20 115.70 2h6r s ILE 61 Ca 0.06 0.15 -0.23 0.00 0.00 0.00 0.00 60.65 60.64 2h6r s ILE 61 Cb -0.01 -0.48 -0.08 0.00 0.01 0.00 0.00 42.46 41.91 2h6r s ILE 61 CO -0.05 -0.00 1.14 -1.81 0.00 0.00 0.00 174.94 174.22 2h6r s ASP 62 N 2.33 6.23 -1.18 3.58 -0.00 -0.97 -4.94 116.67 121.73 2h6r s ASP 62 Ca 0.04 2.24 -0.19 0.00 -0.00 0.00 0.00 52.55 54.65 2h6r s ASP 62 Cb -0.13 -2.60 0.08 0.00 -0.00 0.00 0.00 42.92 40.27 2h6r s ASP 62 CO -0.09 -0.87 1.57 0.21 -0.00 0.00 0.00 175.17 175.99 2h6r s ASN 63 N -1.44 6.77 0.04 0.27 2.47 -1.26 -4.65 114.94 117.13 2h6r s ASN 63 Ca 0.63 -2.24 -0.05 0.00 0.42 0.00 0.00 52.86 51.63 2h6r s ASN 63 Cb -0.27 -2.54 -0.01 0.00 -1.45 0.00 0.00 41.25 36.98 2h6r s ASN 63 CO 0.33 -1.19 0.08 0.27 -3.72 0.00 0.00 177.10 172.87 2h6r s ILE 64 N 3.91 0.13 -0.05 -5.21 -4.36 -1.26 -5.08 121.20 109.28 2h6r s ILE 64 Ca 0.48 -1.10 -0.03 0.00 -0.26 0.00 0.00 60.65 59.74 2h6r s ILE 64 Cb 0.01 -0.87 -0.04 0.00 1.25 0.00 0.00 42.46 42.81 2h6r s ILE 64 CO 0.01 -0.61 0.11 0.20 0.24 0.00 0.00 174.94 174.88 2h6r s ASN 65 N -2.10 5.94 -0.42 4.36 0.01 -1.26 -4.71 114.94 116.77 2h6r s ASN 65 Ca -0.05 0.27 -0.40 0.00 -0.71 0.00 0.00 52.86 51.97 2h6r s ASN 65 Cb -0.01 -1.80 -0.15 0.00 0.41 0.00 0.00 41.25 39.69 2h6r s ASN 65 CO -0.04 0.32 2.11 -2.65 -1.51 0.00 0.00 177.10 175.33 2h6r n PRO 66 N 1.47 0.56 0.00 -0.60 -0.02 -1.26 -4.65 135.00 130.50 2h6r n PRO 66 Ca -0.15 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 2h6r n PRO 66 Cb 0.53 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.04 2h6r n PRO 66 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2h6r n GLY 67 N 6.72 0.72 3.35 -1.23 0.00 -1.26 -5.08 105.19 108.41 2h6r n GLY 67 Ca 0.46 0.32 -0.46 0.00 0.00 0.00 0.00 46.02 46.33 2h6r n GLY 67 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2h6r s SER 68 N 2.00 6.77 -0.39 1.61 0.01 -1.26 -4.92 113.70 117.52 2h6r s SER 68 Ca 0.00 -2.63 0.03 0.00 1.31 0.00 0.00 55.95 54.66 2h6r s SER 68 Cb 0.00 -2.24 0.16 0.00 0.21 0.00 0.00 66.02 64.15 2h6r s SER 68 CO 0.00 -0.64 0.35 -1.00 0.41 0.00 0.00 173.24 172.36 2h6r s HIS 69 N 0.49 0.30 0.11 2.43 4.02 -1.26 -5.13 115.29 116.26 2h6r s HIS 69 Ca 0.21 -1.49 -0.31 0.00 1.02 0.00 0.00 55.06 54.49 2h6r s HIS 69 Cb -0.09 -0.64 -0.07 0.00 -1.02 0.00 0.00 32.58 30.76 2h6r s HIS 69 CO -0.09 -0.91 1.25 0.99 1.02 0.00 0.00 174.74 176.99 2h6r s THR 70 N 0.86 3.71 -0.29 1.30 2.01 -1.26 -3.22 115.64 118.75 2h6r s THR 70 Ca 0.23 1.28 0.00 0.00 0.31 0.00 0.00 61.69 63.51 2h6r s THR 70 Cb -0.11 -3.82 0.00 0.00 0.01 0.00 0.00 72.50 68.58 2h6r s THR 70 CO -0.07 0.13 0.00 0.61 -0.69 0.00 0.00 174.62 174.60 2h6r n GLY 71 N 2.97 0.59 3.62 4.40 0.00 -1.26 -5.04 105.19 110.47 2h6r n GLY 71 Ca 0.08 -0.94 -0.25 0.00 0.00 0.00 0.00 46.02 44.91 2h6r n GLY 71 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2h6r s HIS 72 N -2.10 2.70 -0.37 1.61 4.02 -1.20 -5.10 115.29 114.86 2h6r s HIS 72 Ca 0.00 -0.20 -0.18 0.00 1.02 0.00 0.00 55.06 55.70 2h6r s HIS 72 Cb 0.00 -1.27 0.00 0.00 -1.02 0.00 0.00 32.58 30.29 2h6r s HIS 72 CO 0.00 0.56 0.51 0.42 1.02 0.00 0.00 174.74 177.25 2h6r s ILE 73 N -1.95 5.01 -0.03 0.60 1.09 -1.26 -5.02 121.20 119.64 2h6r s ILE 73 Ca 0.28 0.19 -0.20 0.00 -1.10 0.00 0.00 60.65 59.82 2h6r s ILE 73 Cb -0.08 -4.00 -0.05 0.00 -1.06 0.00 0.00 42.46 37.27 2h6r s ILE 73 CO 0.18 -0.29 0.56 -0.22 -0.10 0.00 0.00 174.94 175.07 2h6r s LEU 74 N 2.39 4.38 0.17 2.97 1.98 -1.26 -2.28 118.68 127.03 2h6r s LEU 74 Ca 0.18 1.07 -0.14 0.00 -2.89 0.00 0.00 54.13 52.35 2h6r s LEU 74 Cb -0.16 -2.86 0.12 0.00 0.66 0.00 0.00 46.19 43.96 2h6r s LEU 74 CO 0.14 0.08 1.76 0.00 -1.89 0.00 0.00 176.35 176.44 2h6r h ALA 75 N 5.90 0.55 0.00 5.97 0.00 -1.84 -1.61 119.26 128.22 2h6r h ALA 75 Ca -0.44 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2h6r h ALA 75 Cb 1.20 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2h6r h ALA 75 CO 0.71 -0.19 0.00 0.93 0.00 0.00 0.00 179.25 180.69 2h6r h GLU 76 N 0.37 0.00 0.03 0.00 3.07 -1.95 -2.22 114.58 113.89 2h6r h GLU 76 Ca 0.20 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.85 2h6r h GLU 76 Cb 0.17 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.07 2h6r h GLU 76 CO -0.19 0.00 -0.98 0.00 -1.40 0.00 0.00 179.01 176.44 2h6r h ALA 77 N 2.03 0.40 -0.23 3.43 0.00 -1.71 -2.51 119.26 120.66 2h6r h ALA 77 Ca 0.00 -0.80 -0.08 0.00 0.00 0.00 0.00 54.91 54.03 2h6r h ALA 77 Cb 0.36 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2h6r h ALA 77 CO 0.00 1.01 -0.17 0.82 0.00 0.00 0.00 179.25 180.92 2h6r h ILE 78 N 0.07 1.31 0.00 0.00 1.08 -1.05 -3.01 117.51 115.91 2h6r h ILE 78 Ca -0.05 -1.29 -0.05 0.00 -0.39 0.00 0.00 64.86 63.07 2h6r h ILE 78 Cb 1.66 1.64 -0.01 0.00 -3.07 0.00 0.00 36.82 37.05 2h6r h ILE 78 CO 0.15 0.40 -0.26 0.50 -0.69 0.00 0.00 178.15 178.25 2h6r h LYS 79 N 0.23 0.00 0.00 2.37 3.11 -1.53 -2.41 116.57 118.35 2h6r h LYS 79 Ca 0.05 0.00 -0.05 0.00 -2.81 0.00 0.00 60.65 57.83 2h6r h LYS 79 Cb 0.70 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.92 2h6r h LYS 79 CO 0.05 0.26 -0.25 0.22 -2.81 0.00 0.00 179.45 176.91 2h6r h ASP 80 N 0.00 0.00 0.99 4.20 3.58 -1.31 -2.58 116.42 121.30 2h6r h ASP 80 Ca -0.00 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.33 2h6r h ASP 80 Cb 0.56 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.59 2h6r h ASP 80 CO 0.03 0.25 -0.56 0.00 -2.88 0.00 0.00 179.24 176.09 2h6r n GLY 82 N 0.68 1.17 3.78 0.00 0.00 -0.97 -4.70 105.19 105.14 2h6r n GLY 82 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2h6r n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h6r h LYS 84 N 2.05 0.25 0.00 0.00 3.64 -1.23 -3.45 116.57 117.83 2h6r h LYS 84 Ca -0.49 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 58.53 2h6r h LYS 84 Cb 1.24 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 2h6r h LYS 84 CO 0.60 1.13 0.00 0.41 -2.27 0.00 0.00 179.45 179.32 2h6r n GLY 85 N 1.29 2.92 3.48 5.01 0.00 -1.20 0.14 105.19 116.84 2h6r n GLY 85 Ca -0.06 -0.29 -0.12 0.00 0.00 0.00 0.00 46.02 45.55 2h6r n GLY 85 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2h6r s THR 86 N -0.54 0.00 -0.15 2.61 -1.32 0.18 -1.89 115.64 114.54 2h6r s THR 86 Ca 0.00 0.00 -0.06 0.00 -1.21 0.00 0.00 61.69 60.42 2h6r s THR 86 Cb 0.00 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.95 2h6r s THR 86 CO 0.00 0.00 0.07 -0.76 -2.21 0.00 0.00 174.62 171.72 2h6r s LEU 87 N -2.22 3.94 0.05 9.08 1.02 0.24 -1.53 118.68 129.25 2h6r s LEU 87 Ca 0.00 0.21 0.00 0.00 0.02 0.00 0.00 54.13 54.36 2h6r s LEU 87 Cb -0.01 -1.97 -0.03 0.00 0.02 0.00 0.00 46.19 44.20 2h6r s LEU 87 CO -0.06 0.28 -0.04 0.27 0.02 0.00 0.00 176.35 176.82 2h6r s ILE 88 N -0.28 0.31 -1.38 -0.59 -4.36 -0.98 -3.06 121.20 110.87 2h6r s ILE 88 Ca 0.09 -1.48 -0.08 0.00 -0.26 0.00 0.00 60.65 58.92 2h6r s ILE 88 Cb -0.12 -1.07 0.03 0.00 1.25 0.00 0.00 42.46 42.55 2h6r s ILE 88 CO 0.01 -0.76 1.05 -3.20 0.24 0.00 0.00 174.94 172.28 2h6r n ASN 89 N 0.68 -4.67 -4.79 4.36 4.05 -1.26 -0.16 115.26 113.47 2h6r n ASN 89 Ca -0.18 -0.65 -0.35 0.00 0.45 0.00 0.00 54.58 53.86 2h6r n ASN 89 Cb 0.58 -4.63 -0.04 0.00 1.23 0.00 0.00 39.78 36.93 2h6r n ASN 89 CO 0.00 0.00 0.00 -2.28 -3.05 0.00 0.00 177.26 171.93 2h6r s HIS 90 N -3.36 3.10 -0.30 1.20 2.46 -1.22 -4.06 115.29 113.10 2h6r s HIS 90 Ca 0.45 1.60 0.09 0.00 0.47 0.00 0.00 55.06 57.67 2h6r s HIS 90 Cb -0.21 -3.07 0.51 0.00 -0.13 0.00 0.00 32.58 29.68 2h6r s HIS 90 CO 0.77 -0.71 1.18 -1.13 -2.47 0.00 0.00 174.74 172.37 2h6r n SER 91 N -0.69 0.24 -0.00 9.88 3.41 -1.26 -0.24 113.62 124.96 2h6r n SER 91 Ca 0.08 0.51 0.07 0.00 -0.26 0.00 0.00 58.87 59.27 2h6r n SER 91 Cb 0.52 -0.50 -0.14 0.00 -0.26 0.00 0.00 64.21 63.84 2h6r n SER 91 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2h6r n GLU 92 N -1.81 0.65 -3.06 4.33 1.02 -1.26 -4.70 120.64 115.81 2h6r n GLU 92 Ca -0.01 -0.09 -0.17 0.00 -0.02 0.00 0.00 57.16 56.88 2h6r n GLU 92 Cb 0.21 -1.59 -0.04 0.00 -0.02 0.00 0.00 31.44 30.00 2h6r n GLU 92 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2h6r n LYS 93 N -2.45 0.50 -2.69 3.49 4.81 0.67 -5.13 118.16 117.36 2h6r n LYS 93 Ca -0.08 -2.62 -0.40 0.00 -0.87 0.00 0.00 58.31 54.34 2h6r n LYS 93 Cb 0.68 -1.48 -0.06 0.00 0.02 0.00 0.00 35.03 34.19 2h6r n LYS 93 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 2h6r s ARG 94 N 0.13 4.78 0.46 1.64 0.52 -0.86 -3.40 118.95 122.22 2h6r s ARG 94 Ca 0.32 1.54 0.08 0.00 -0.52 0.00 0.00 55.73 57.16 2h6r s ARG 94 Cb 0.09 -3.21 0.01 0.00 0.52 0.00 0.00 34.95 32.36 2h6r s ARG 94 CO -0.15 0.42 0.51 -1.64 0.02 0.00 0.00 175.30 174.47 2h6r s MET 95 N -1.33 2.55 0.81 3.54 -1.94 -1.26 -4.98 119.30 116.68 2h6r s MET 95 Ca 0.43 -1.53 -0.11 0.00 -1.71 0.00 0.00 55.69 52.77 2h6r s MET 95 Cb -0.27 -2.50 0.08 0.00 2.01 0.00 0.00 34.83 34.15 2h6r s MET 95 CO 0.33 -0.39 1.09 -0.51 -0.01 0.00 0.00 175.02 175.54 2h6r s LEU 96 N -4.31 2.80 0.08 -0.03 1.43 -1.26 -4.87 118.68 112.51 2h6r s LEU 96 Ca 0.51 1.71 -0.21 0.00 -1.03 0.00 0.00 54.13 55.11 2h6r s LEU 96 Cb -0.06 -4.33 -0.11 0.00 0.03 0.00 0.00 46.19 41.72 2h6r s LEU 96 CO 0.31 -2.21 1.62 0.25 0.23 0.00 0.00 176.35 176.55 2h6r h LEU 97 N -1.25 0.19 -1.60 1.79 6.46 -2.01 -2.51 115.31 116.38 2h6r h LEU 97 Ca -0.45 -0.16 -0.02 0.00 -0.12 0.00 0.00 57.88 57.12 2h6r h LEU 97 Cb 1.25 -0.05 -0.00 0.00 -0.73 0.00 0.00 40.66 41.12 2h6r h LEU 97 CO 0.52 0.30 -0.10 0.00 -0.62 0.00 0.00 178.44 178.55 2h6r h ALA 98 N 0.90 1.07 -0.03 1.25 0.00 -2.00 -3.02 119.26 117.42 2h6r h ALA 98 Ca 0.05 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 2h6r h ALA 98 Cb 0.17 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.95 2h6r h ALA 98 CO -0.00 0.12 -0.49 -0.44 0.00 0.00 0.00 179.25 178.44 2h6r h ASP 99 N 0.00 0.48 0.68 0.00 5.19 -1.84 -3.04 116.42 117.89 2h6r h ASP 99 Ca -0.00 -0.72 -0.12 0.00 -0.62 0.00 0.00 57.03 55.57 2h6r h ASP 99 Cb 0.50 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.84 2h6r h ASP 99 CO 0.01 1.13 -0.55 0.16 -3.12 0.00 0.00 179.24 176.88 2h6r h ILE 100 N -0.13 1.29 -0.24 0.35 3.07 -1.43 -1.81 117.51 118.61 2h6r h ILE 100 Ca -0.05 -1.95 -0.14 0.00 1.55 0.00 0.00 64.86 64.27 2h6r h ILE 100 Cb 1.18 2.08 -0.01 0.00 -0.27 0.00 0.00 36.82 39.80 2h6r h ILE 100 CO 0.10 0.54 -0.41 -0.08 -1.05 0.00 0.00 178.15 177.25 2h6r h GLU 101 N 0.00 0.58 0.00 0.16 4.22 -1.61 -1.17 114.58 116.76 2h6r h GLU 101 Ca -0.01 -0.30 -0.18 0.00 0.08 0.00 0.00 59.36 58.96 2h6r h GLU 101 Cb 1.04 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 2h6r h GLU 101 CO 0.07 0.89 -0.84 0.00 -2.18 0.00 0.00 179.01 176.95 2h6r h ALA 102 N 1.07 0.61 -0.28 2.92 0.00 -1.41 -2.72 119.26 119.46 2h6r h ALA 102 Ca 0.04 -0.76 -0.12 0.00 0.00 0.00 0.00 54.91 54.07 2h6r h ALA 102 Cb 0.92 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 2h6r h ALA 102 CO 0.08 1.03 -0.28 0.28 0.00 0.00 0.00 179.25 180.36 2h6r h VAL 103 N 0.01 1.30 -0.71 0.00 2.07 -1.10 -0.60 116.25 117.22 2h6r h VAL 103 Ca -0.01 -1.45 -0.04 0.00 0.82 0.00 0.00 66.70 66.02 2h6r h VAL 103 Cb 1.49 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.83 2h6r h VAL 103 CO 0.11 0.46 0.28 0.40 0.02 0.00 0.00 177.57 178.85 2h6r h ILE 104 N 0.42 1.24 -0.36 4.57 5.03 -1.24 0.10 117.51 127.27 2h6r h ILE 104 Ca 0.04 -0.76 -0.04 0.00 -0.12 0.00 0.00 64.86 63.98 2h6r h ILE 104 Cb 0.85 0.40 -0.01 0.00 -3.03 0.00 0.00 36.82 35.02 2h6r h ILE 104 CO 0.07 0.31 0.05 0.78 -0.68 0.00 0.00 178.15 178.68 2h6r h ASN 105 N 1.02 0.58 -0.61 1.72 -0.26 -1.31 -0.75 115.58 115.97 2h6r h ASN 105 Ca 0.24 -0.26 -0.06 0.00 -0.56 0.00 0.00 56.30 55.65 2h6r h ASN 105 Cb 0.20 -0.15 -0.03 0.00 -1.06 0.00 0.00 38.32 37.27 2h6r h ASN 105 CO -0.02 0.70 0.14 0.11 -1.06 0.00 0.00 177.43 177.30 2h6r h LYS 106 N 0.44 1.02 -0.34 0.81 1.57 -0.74 -2.61 116.57 116.72 2h6r h LYS 106 Ca 0.11 -0.24 -0.15 0.00 -1.87 0.00 0.00 60.65 58.51 2h6r h LYS 106 Cb 0.37 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 2h6r h LYS 106 CO 0.01 0.91 -0.37 0.00 -0.57 0.00 0.00 179.45 179.43 2h6r h LYS 108 N 0.66 0.00 0.00 0.00 2.10 -0.97 0.58 116.57 118.95 2h6r h LYS 108 Ca 0.06 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.71 2h6r h LYS 108 Cb 0.93 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.26 2h6r h LYS 108 CO 0.09 0.00 -0.95 0.09 -2.00 0.00 0.00 179.45 176.68 2h6r n ASN 109 N -2.92 0.64 -0.02 7.07 5.03 -1.00 -3.97 115.26 120.08 2h6r n ASN 109 Ca 0.01 -0.32 0.08 0.00 0.87 0.00 0.00 54.58 55.23 2h6r n ASN 109 Cb 0.32 0.74 -0.16 0.00 -1.02 0.00 0.00 39.78 39.66 2h6r n ASN 109 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2h6r n LEU 110 N -1.83 0.00 0.00 3.41 4.77 -0.58 -4.99 117.00 117.78 2h6r n LEU 110 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 2h6r n LEU 110 Cb 0.41 0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 2h6r n LEU 110 CO 0.40 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 2h6r n GLY 111 N 1.40 0.85 3.75 -0.72 0.00 0.17 -5.05 105.19 105.59 2h6r n GLY 111 Ca -0.07 -0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 2h6r n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2h6r s LEU 112 N 0.00 4.39 0.22 0.99 1.43 0.89 -4.86 118.68 121.74 2h6r s LEU 112 Ca 0.00 1.19 -0.30 0.00 -1.03 0.00 0.00 54.13 53.99 2h6r s LEU 112 Cb 0.00 -2.99 -0.08 0.00 0.03 0.00 0.00 46.19 43.14 2h6r s LEU 112 CO 0.00 0.03 1.09 -0.70 0.23 0.00 0.00 176.35 177.00 2h6r s GLU 113 N 0.09 4.63 -0.25 1.70 2.12 0.12 -4.23 118.70 122.89 2h6r s GLU 113 Ca 0.33 1.73 -0.07 0.00 0.36 0.00 0.00 54.97 57.32 2h6r s GLU 113 Cb -0.18 -3.25 -0.02 0.00 0.26 0.00 0.00 34.13 30.94 2h6r s GLU 113 CO 0.18 0.15 0.06 0.95 -0.54 0.00 0.00 175.26 176.06 2h6r s THR 114 N -0.61 4.21 -0.71 -1.70 -4.23 -1.26 -0.65 115.64 110.69 2h6r s THR 114 Ca 0.47 -0.24 0.02 0.00 -1.18 0.00 0.00 61.69 60.77 2h6r s THR 114 Cb -0.30 -2.98 0.17 0.00 1.34 0.00 0.00 72.50 70.73 2h6r s THR 114 CO 0.37 0.33 0.51 -0.63 -0.54 0.00 0.00 174.62 174.65 2h6r s ILE 115 N 1.60 3.27 -0.22 2.99 1.01 -0.59 -1.28 121.20 127.99 2h6r s ILE 115 Ca 0.06 -3.87 -0.26 0.00 0.00 0.00 0.00 60.65 56.58 2h6r s ILE 115 Cb -0.15 -3.13 -0.00 0.00 0.01 0.00 0.00 42.46 39.19 2h6r s ILE 115 CO 0.03 -0.97 0.88 0.54 0.00 0.00 0.00 174.94 175.42 2h6r s VAL 116 N -1.07 4.81 0.40 2.92 0.11 -0.89 -2.31 120.40 124.38 2h6r s VAL 116 Ca 0.23 1.70 -0.23 0.00 -2.93 0.00 0.00 61.98 60.75 2h6r s VAL 116 Cb -0.11 -4.17 -0.10 0.00 -1.53 0.00 0.00 36.38 30.47 2h6r s VAL 116 CO -0.11 -0.07 0.97 0.00 -3.33 0.00 0.00 175.10 172.56 2h6r s THR 118 N -1.94 0.35 -0.07 0.00 -1.32 0.42 -4.60 115.64 108.49 2h6r s THR 118 Ca 0.59 -1.86 0.04 0.00 -1.21 0.00 0.00 61.69 59.25 2h6r s THR 118 Cb -0.14 -1.66 -0.07 0.00 -1.51 0.00 0.00 72.50 69.11 2h6r s THR 118 CO 0.19 -0.87 -0.01 -0.46 -2.21 0.00 0.00 174.62 171.26 2h6r n ASN 119 N 0.02 3.33 -4.70 8.08 0.23 -1.26 -0.39 115.26 120.58 2h6r n ASN 119 Ca -0.12 -0.02 -0.26 0.00 -0.53 0.00 0.00 54.58 53.66 2h6r n ASN 119 Cb 0.61 0.40 -0.08 0.00 -2.08 0.00 0.00 39.78 38.63 2h6r n ASN 119 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 2h6r s ASN 120 N -4.16 4.25 0.20 0.53 0.02 -1.26 -4.22 114.94 110.30 2h6r s ASN 120 Ca -0.06 -1.16 0.13 0.00 -1.02 0.00 0.00 52.86 50.75 2h6r s ASN 120 Cb 0.02 -0.46 -0.04 0.00 0.02 0.00 0.00 41.25 40.79 2h6r s ASN 120 CO 0.25 -0.51 1.29 0.16 0.02 0.00 0.00 177.10 178.31 2h6r h ILE 121 N 1.54 1.02 -0.07 0.60 -2.65 -1.97 -2.10 117.51 113.87 2h6r h ILE 121 Ca -0.43 -2.50 -0.15 0.00 1.03 0.00 0.00 64.86 62.81 2h6r h ILE 121 Cb 1.25 2.47 -0.01 0.00 -2.05 0.00 0.00 36.82 38.48 2h6r h ILE 121 CO 0.73 0.58 -0.64 0.78 0.03 0.00 0.00 178.15 179.64 2h6r h ASN 122 N 0.00 0.31 1.59 2.16 2.35 -1.99 -2.10 115.58 117.90 2h6r h ASN 122 Ca -0.04 -0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.52 2h6r h ASN 122 Cb 1.53 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.81 2h6r h ASN 122 CO 0.08 0.87 -0.13 0.71 -1.65 0.00 0.00 177.43 177.30 2h6r h THR 123 N 0.20 0.00 -0.02 2.81 1.35 -1.95 -2.77 112.91 112.52 2h6r h THR 123 Ca -0.01 -0.72 -0.05 0.00 -0.55 0.00 0.00 66.41 65.07 2h6r h THR 123 Cb 1.16 1.64 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 2h6r h THR 123 CO 0.10 0.00 -0.20 0.28 -0.25 0.00 0.00 175.52 175.45 2h6r h SER 124 N 0.00 0.21 1.01 5.36 0.02 -0.92 -2.85 113.55 116.37 2h6r h SER 124 Ca 0.00 -0.71 0.00 0.00 -0.84 0.00 0.00 61.79 60.24 2h6r h SER 124 Cb 0.86 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.34 2h6r h SER 124 CO 0.00 0.89 0.00 0.07 -1.14 0.00 0.00 176.83 176.65 2h6r h LYS 125 N -0.45 0.00 -0.03 3.45 2.10 -1.45 -2.38 116.57 117.82 2h6r h LYS 125 Ca -0.02 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.59 2h6r h LYS 125 Cb 0.91 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.24 2h6r h LYS 125 CO 0.04 0.00 -0.13 0.00 -2.00 0.00 0.00 179.45 177.36 2h6r h ALA 126 N 2.16 0.05 0.00 0.07 0.00 -1.42 -3.20 119.26 116.92 2h6r h ALA 126 Ca 0.00 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 2h6r h ALA 126 Cb 0.50 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2h6r h ALA 126 CO 0.00 -0.03 -0.29 0.28 0.00 0.00 0.00 179.25 179.22 2h6r h VAL 127 N -0.46 0.58 -0.01 0.00 2.07 -1.44 -2.95 116.25 114.04 2h6r h VAL 127 Ca -0.01 -1.47 0.00 0.00 0.82 0.00 0.00 66.70 66.05 2h6r h VAL 127 Cb 0.78 2.01 -0.00 0.00 -1.52 0.00 0.00 31.29 32.57 2h6r h VAL 127 CO 0.03 0.28 0.01 0.00 0.02 0.00 0.00 177.57 177.91 2h6r h ALA 128 N 1.71 1.32 0.00 1.67 0.00 -1.42 0.11 119.26 122.65 2h6r h ALA 128 Ca -0.00 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 2h6r h ALA 128 Cb 0.99 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 2h6r h ALA 128 CO 0.04 -0.01 -0.70 0.00 0.00 0.00 0.00 179.25 178.58 2h6r h ALA 129 N 1.98 0.62 0.00 0.00 0.00 -1.56 -3.01 119.26 117.29 2h6r h ALA 129 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2h6r h ALA 129 Cb 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2h6r h ALA 129 CO -0.00 0.87 0.00 1.28 0.00 0.00 0.00 179.25 181.40 2h6r n LEU 130 N -3.37 0.38 -3.03 0.00 4.32 0.37 -4.96 117.00 110.71 2h6r n LEU 130 Ca 0.01 0.56 -0.04 0.00 -0.02 0.00 0.00 56.01 56.52 2h6r n LEU 130 Cb 0.78 -0.47 0.02 0.00 -1.62 0.00 0.00 43.42 42.13 2h6r n LEU 130 CO 0.43 -0.23 0.25 -1.20 -1.22 0.00 0.00 177.39 175.42 2h6r n SER 131 N -1.88 -7.21 -4.94 -1.43 7.64 -1.13 -5.00 113.62 99.67 2h6r n SER 131 Ca 0.05 -0.23 -0.24 0.00 1.01 0.00 0.00 58.87 59.46 2h6r n SER 131 Cb 0.30 -5.06 -0.01 0.00 -1.01 0.00 0.00 64.21 58.43 2h6r n SER 131 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2h6r s PRO 132 N -3.35 3.46 0.08 1.43 0.04 -1.26 -5.03 135.00 130.36 2h6r s PRO 132 Ca 0.12 -0.38 -0.28 0.00 0.04 0.00 0.00 61.00 60.50 2h6r s PRO 132 Cb -0.02 -2.67 -0.16 0.00 0.04 0.00 0.00 34.50 31.69 2h6r s PRO 132 CO 0.71 0.15 1.68 -0.44 0.04 0.00 0.00 177.00 179.14 2h6r h ASP 133 N 0.76 -0.39 -5.26 6.66 3.32 -1.92 -3.44 116.42 116.16 2h6r h ASP 133 Ca -0.50 0.02 -0.11 0.00 0.02 0.00 0.00 57.03 56.46 2h6r h ASP 133 Cb 1.22 0.11 -0.13 0.00 0.22 0.00 0.00 39.33 40.75 2h6r h ASP 133 CO 0.61 -0.27 -0.41 0.00 -1.72 0.00 0.00 179.24 177.46 2h6r s ILE 135 N -3.95 -0.13 -0.22 0.00 2.07 -0.41 -2.09 121.20 116.47 2h6r s ILE 135 Ca 0.14 0.29 -0.12 0.00 -1.41 0.00 0.00 60.65 59.56 2h6r s ILE 135 Cb 0.05 -0.20 -0.05 0.00 0.13 0.00 0.00 42.46 42.39 2h6r s ILE 135 CO -0.03 0.12 0.20 0.00 -1.91 0.00 0.00 174.94 173.32 2h6r s ALA 136 N 1.69 3.62 -0.10 1.50 0.00 -0.57 0.16 121.76 128.06 2h6r s ALA 136 Ca -0.03 -0.75 -0.13 0.00 0.00 0.00 0.00 51.96 51.05 2h6r s ALA 136 Cb -0.12 -2.35 -0.05 0.00 0.00 0.00 0.00 23.12 20.60 2h6r s ALA 136 CO -0.05 -0.11 0.31 0.08 0.00 0.00 0.00 175.76 175.99 2h6r s VAL 137 N 0.90 5.25 -0.19 0.00 1.01 -0.09 0.16 120.40 127.43 2h6r s VAL 137 Ca 0.10 0.60 0.14 0.00 0.00 0.00 0.00 61.98 62.83 2h6r s VAL 137 Cb -0.13 -3.62 0.42 0.00 0.00 0.00 0.00 36.38 33.04 2h6r s VAL 137 CO 0.04 0.49 1.29 -0.62 0.00 0.00 0.00 175.10 176.30 2h6r n GLU 138 N 2.69 1.80 -3.75 2.72 1.02 0.48 -1.30 120.64 124.29 2h6r n GLU 138 Ca -0.14 -2.94 -0.37 0.00 -0.02 0.00 0.00 57.16 53.69 2h6r n GLU 138 Cb 0.53 -1.67 -0.06 0.00 -0.02 0.00 0.00 31.44 30.22 2h6r n GLU 138 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2h6r s PRO 139 N -3.04 3.64 -1.39 3.49 0.04 -1.26 -4.82 135.00 131.67 2h6r s PRO 139 Ca 0.38 0.03 -0.12 0.00 0.04 0.00 0.00 61.00 61.33 2h6r s PRO 139 Cb 0.34 -3.22 0.09 0.00 0.04 0.00 0.00 34.50 31.75 2h6r s PRO 139 CO 0.01 0.71 2.09 -0.35 0.04 0.00 0.00 177.00 179.50 2h6r n PRO 140 N 2.07 3.21 0.00 0.56 -0.04 -1.26 -4.79 135.00 134.75 2h6r n PRO 140 Ca -0.18 -2.99 0.00 0.00 -0.04 0.00 0.00 63.50 60.29 2h6r n PRO 140 Cb 0.54 -3.12 0.00 0.00 -0.04 0.00 0.00 33.50 30.88 2h6r n PRO 140 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2h6r n GLU 155 N 5.06 0.00 -3.58 0.54 1.02 -1.26 -5.10 120.64 117.32 2h6r n GLU 155 Ca 0.47 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 57.46 2h6r n GLU 155 Cb 0.37 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.73 2h6r n GLU 155 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2h6r s VAL 156 N 0.00 0.00 0.00 2.62 0.11 -1.26 -5.04 120.40 116.83 2h6r s VAL 156 Ca 0.00 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 2h6r s VAL 156 Cb 0.00 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 2h6r s VAL 156 CO 0.00 0.00 0.00 0.55 -3.33 0.00 0.00 175.10 172.32 2h6r n VAL 157 N 1.96 0.00 0.01 2.04 3.14 -1.26 -4.74 118.33 119.48 2h6r n VAL 157 Ca -0.16 -0.04 -0.18 0.00 -2.96 0.00 0.00 64.34 60.99 2h6r n VAL 157 Cb 0.56 0.40 -0.10 0.00 -1.06 0.00 0.00 33.84 33.64 2h6r n VAL 157 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 2h6r h GLU 158 N 0.00 0.54 0.00 1.45 4.81 -1.96 -2.90 114.58 116.52 2h6r h GLU 158 Ca 0.00 -0.54 -0.00 0.00 -0.13 0.00 0.00 59.36 58.69 2h6r h GLU 158 Cb 0.00 0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 2h6r h GLU 158 CO 0.00 1.17 -0.01 0.78 -0.73 0.00 0.00 179.01 180.22 2h6r h GLY 159 N 0.11 0.00 1.68 1.92 0.00 -1.91 -1.72 103.07 103.16 2h6r h GLY 159 Ca -0.08 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 46.99 2h6r h GLY 159 CO 0.14 0.00 -1.19 -0.84 0.00 0.00 0.00 176.54 174.65 2h6r h THR 160 N 0.00 1.52 -0.22 4.70 2.02 -1.83 -2.80 112.91 116.31 2h6r h THR 160 Ca -0.00 -3.06 -0.11 0.00 0.77 0.00 0.00 66.41 64.01 2h6r h THR 160 Cb 0.32 2.90 -0.00 0.00 -1.74 0.00 0.00 68.15 69.62 2h6r h THR 160 CO 0.00 0.89 -0.28 0.58 0.37 0.00 0.00 175.52 177.08 2h6r h VAL 161 N 0.07 1.33 0.00 3.16 2.07 -1.13 -2.64 116.25 119.11 2h6r h VAL 161 Ca -0.11 -1.47 -0.08 0.00 0.82 0.00 0.00 66.70 65.86 2h6r h VAL 161 Cb 1.92 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 33.44 2h6r h VAL 161 CO 0.19 0.46 -0.36 0.08 0.02 0.00 0.00 177.57 177.95 2h6r h ARG 162 N 0.26 0.00 -0.15 1.57 0.11 -1.50 -1.74 114.38 112.94 2h6r h ARG 162 Ca 0.03 0.00 -0.21 0.00 0.10 0.00 0.00 59.98 59.90 2h6r h ARG 162 Cb 0.85 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.94 2h6r h ARG 162 CO 0.07 0.36 -0.74 0.00 0.10 0.00 0.00 179.97 179.76 2h6r h ALA 163 N 1.64 0.40 0.03 0.08 0.00 -1.45 -3.10 119.26 116.85 2h6r h ALA 163 Ca -0.00 -0.59 -0.27 0.00 0.00 0.00 0.00 54.91 54.05 2h6r h ALA 163 Cb 0.88 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.66 2h6r h ALA 163 CO 0.05 0.70 -1.07 0.28 0.00 0.00 0.00 179.25 179.20 2h6r h VAL 164 N 0.49 1.31 0.00 0.00 2.07 -1.38 -3.25 116.25 115.49 2h6r h VAL 164 Ca -0.04 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.13 2h6r h VAL 164 Cb 1.36 2.47 0.00 0.00 -1.52 0.00 0.00 31.29 33.59 2h6r h VAL 164 CO 0.15 0.72 0.00 0.29 0.02 0.00 0.00 177.57 178.75 2h6r n LYS 165 N -3.81 0.59 -0.03 1.57 5.02 -0.66 -1.64 118.16 119.19 2h6r n LYS 165 Ca -0.11 0.02 -0.03 0.00 -2.02 0.00 0.00 58.31 56.18 2h6r n LYS 165 Cb 0.90 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 34.28 2h6r n LYS 165 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2h6r n GLU 166 N -1.07 0.65 -0.09 1.97 1.02 -1.17 -3.36 120.64 118.59 2h6r n GLU 166 Ca 0.15 0.08 -0.20 0.00 -0.02 0.00 0.00 57.16 57.17 2h6r n GLU 166 Cb 0.10 -1.66 -0.12 0.00 -0.02 0.00 0.00 31.44 29.74 2h6r n GLU 166 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 2h6r h ILE 167 N 0.00 1.15 -2.42 -3.67 5.03 -1.60 -3.45 117.51 112.55 2h6r h ILE 167 Ca -0.29 -2.24 -0.34 0.00 -0.12 0.00 0.00 64.86 61.88 2h6r h ILE 167 Cb 1.78 2.56 -0.35 0.00 -3.03 0.00 0.00 36.82 37.78 2h6r h ILE 167 CO 0.04 0.42 -0.64 0.21 -0.68 0.00 0.00 178.15 177.49 2h6r s ASN 168 N -6.70 1.63 0.00 1.72 2.47 -0.65 -4.96 114.94 108.44 2h6r s ASN 168 Ca -0.26 -0.46 0.23 0.00 0.42 0.00 0.00 52.86 52.80 2h6r s ASN 168 Cb 0.03 0.37 1.04 0.00 -1.45 0.00 0.00 41.25 41.24 2h6r s ASN 168 CO 0.63 -0.35 1.76 2.29 -3.72 0.00 0.00 177.10 177.70 2h6r n LYS 169 N 5.31 0.07 -0.65 0.43 2.85 -1.21 -3.15 118.16 121.81 2h6r n LYS 169 Ca -0.04 0.09 0.07 0.00 -1.05 0.00 0.00 58.31 57.37 2h6r n LYS 169 Cb 0.48 -1.50 0.32 0.00 -0.65 0.00 0.00 35.03 33.68 2h6r n LYS 169 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2h6r n ASP 170 N -1.46 4.54 -4.57 -5.58 8.00 -1.26 -4.85 116.55 111.37 2h6r n ASP 170 Ca 0.07 -2.60 -0.36 0.00 0.71 0.00 0.00 54.79 52.61 2h6r n ASP 170 Cb 0.26 -0.60 -0.11 0.00 -0.02 0.00 0.00 41.12 40.65 2h6r n ASP 170 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2h6r s VAL 171 N -2.17 4.90 0.11 2.53 1.01 -1.19 -4.97 120.40 120.62 2h6r s VAL 171 Ca 0.44 0.02 -0.30 0.00 0.00 0.00 0.00 61.98 62.14 2h6r s VAL 171 Cb 0.31 -3.28 -0.06 0.00 0.00 0.00 0.00 36.38 33.36 2h6r s VAL 171 CO 0.16 0.35 0.98 -0.54 0.00 0.00 0.00 175.10 176.05 2h6r s LYS 172 N 1.25 4.67 -0.20 2.72 1.02 -1.11 -4.83 119.74 123.26 2h6r s LYS 172 Ca 0.06 1.48 -0.10 0.00 0.02 0.00 0.00 55.97 57.44 2h6r s LYS 172 Cb -0.14 -3.37 -0.05 0.00 -0.52 0.00 0.00 37.83 33.74 2h6r s LYS 172 CO 0.05 0.16 0.13 0.08 -0.92 0.00 0.00 175.35 174.85 2h6r s VAL 173 N 0.09 5.39 0.02 3.17 1.01 -1.26 -1.29 120.40 127.53 2h6r s VAL 173 Ca 0.48 0.18 0.07 0.00 0.00 0.00 0.00 61.98 62.71 2h6r s VAL 173 Cb -0.24 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 2h6r s VAL 173 CO 0.30 0.44 -0.20 -0.76 0.00 0.00 0.00 175.10 174.88 2h6r s LEU 174 N 0.33 2.46 -0.25 3.92 1.43 0.12 -1.41 118.68 125.28 2h6r s LEU 174 Ca 0.08 -0.43 -0.10 0.00 -1.03 0.00 0.00 54.13 52.64 2h6r s LEU 174 Cb -0.11 -1.45 -0.05 0.00 0.03 0.00 0.00 46.19 44.61 2h6r s LEU 174 CO -0.02 0.28 0.16 0.00 0.23 0.00 0.00 176.35 177.00 2h6r n GLY 176 N 4.54 3.56 3.59 0.00 0.00 -0.42 -1.63 105.19 114.83 2h6r n GLY 176 Ca -0.15 -1.88 -0.07 0.00 0.00 0.00 0.00 46.02 43.92 2h6r n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h6r s ALA 177 N -3.42 -1.77 -0.64 4.61 0.00 -1.26 -4.62 121.76 114.66 2h6r s ALA 177 Ca 0.36 2.31 -0.01 0.00 0.00 0.00 0.00 51.96 54.63 2h6r s ALA 177 Cb 0.41 -1.37 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 2h6r s ALA 177 CO -0.04 -0.38 0.54 0.41 0.00 0.00 0.00 175.76 176.29 2h6r n GLY 178 N 4.34 -0.05 2.84 0.00 0.00 -1.26 -4.88 105.19 106.19 2h6r n GLY 178 Ca -0.20 -0.09 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 2h6r n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h6r s ILE 179 N -3.20 0.57 0.00 -0.61 1.01 -1.26 -4.91 121.20 112.80 2h6r s ILE 179 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.65 2h6r s ILE 179 Cb -0.01 -0.65 0.00 0.00 0.01 0.00 0.00 42.46 41.81 2h6r s ILE 179 CO 0.40 0.27 0.00 -0.24 0.00 0.00 0.00 174.94 175.37 2h6r n SER 180 N 4.70 0.00 -4.55 3.58 2.88 -1.26 -4.89 113.62 114.08 2h6r n SER 180 Ca -0.15 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.13 2h6r n SER 180 Cb 0.50 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.87 2h6r n SER 180 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2h6r s LYS 181 N -1.00 1.97 0.55 -1.46 -0.14 -1.26 -4.70 119.74 113.70 2h6r s LYS 181 Ca 0.00 -1.33 0.38 0.00 -1.36 0.00 0.00 55.97 53.66 2h6r s LYS 181 Cb 0.00 -2.10 1.54 0.00 -1.68 0.00 0.00 37.83 35.60 2h6r s LYS 181 CO 0.00 0.42 1.75 0.78 -0.76 0.00 0.00 175.35 177.54 2h6r h GLY 182 N 2.90 0.00 0.86 -3.33 0.00 -1.39 -0.31 103.07 101.80 2h6r h GLY 182 Ca -0.46 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 2h6r h GLY 182 CO 0.53 0.00 -0.02 0.83 0.00 0.00 0.00 176.54 177.89 2h6r h GLU 183 N 0.00 -0.05 -0.33 4.80 4.39 -1.86 -0.02 114.58 121.53 2h6r h GLU 183 Ca 0.59 0.00 0.09 0.00 0.34 0.00 0.00 59.36 60.39 2h6r h GLU 183 Cb 2.45 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 31.10 2h6r h GLU 183 CO -0.01 0.10 0.29 -0.44 -1.16 0.00 0.00 179.01 177.80 2h6r h ASP 184 N -0.18 0.00 0.05 1.42 3.32 -1.40 0.50 116.42 120.12 2h6r h ASP 184 Ca -0.00 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.97 2h6r h ASP 184 Cb 0.17 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.72 2h6r h ASP 184 CO 0.01 0.00 -0.35 0.58 -1.72 0.00 0.00 179.24 177.76 2h6r h VAL 185 N 0.00 1.65 0.72 -1.35 2.07 -1.39 -3.10 116.25 114.86 2h6r h VAL 185 Ca 0.15 -2.40 -0.03 0.00 0.82 0.00 0.00 66.70 65.24 2h6r h VAL 185 Cb 0.73 3.27 -0.01 0.00 -1.52 0.00 0.00 31.29 33.76 2h6r h VAL 185 CO -0.00 0.63 -0.48 0.50 0.02 0.00 0.00 177.57 178.24 2h6r h LYS 186 N -0.79 -1.10 -0.36 1.57 1.63 0.31 -2.50 116.57 115.34 2h6r h LYS 186 Ca -0.07 0.08 0.10 0.00 -0.85 0.00 0.00 60.65 59.91 2h6r h LYS 186 Cb 1.24 0.25 -0.01 0.00 -0.60 0.00 0.00 32.23 33.10 2h6r h LYS 186 CO 0.04 -0.73 0.40 0.00 -3.45 0.00 0.00 179.45 175.70 2h6r h ALA 187 N -1.03 2.05 0.03 5.00 0.00 -0.23 -1.65 119.26 123.43 2h6r h ALA 187 Ca -0.09 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 2h6r h ALA 187 Cb 0.93 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.76 2h6r h ALA 187 CO 0.07 -0.59 -0.50 0.00 0.00 0.00 0.00 179.25 178.24 2h6r h ALA 188 N 1.54 0.02 0.00 0.00 0.00 -1.38 -3.31 119.26 116.14 2h6r h ALA 188 Ca 0.17 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2h6r h ALA 188 Cb 0.97 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2h6r h ALA 188 CO -0.00 0.25 0.00 1.47 0.00 0.00 0.00 179.25 180.97 2h6r n LEU 189 N -4.31 0.72 -0.00 0.00 -0.00 -0.69 -2.48 117.00 110.23 2h6r n LEU 189 Ca -0.11 0.61 0.14 0.00 -0.00 0.00 0.00 56.01 56.65 2h6r n LEU 189 Cb 0.64 -0.42 0.62 0.00 -0.00 0.00 0.00 43.42 44.25 2h6r n LEU 189 CO 0.44 -0.32 0.94 0.47 -0.00 0.00 0.00 177.39 178.93 2h6r n ASP 190 N -2.22 0.03 -0.92 1.45 8.00 -0.79 -3.06 116.55 119.04 2h6r n ASP 190 Ca 0.04 0.40 0.10 0.00 0.71 0.00 0.00 54.79 56.05 2h6r n ASP 190 Cb 0.35 -0.44 0.13 0.00 -0.02 0.00 0.00 41.12 41.14 2h6r n ASP 190 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2h6r n LEU 191 N -1.48 2.96 0.00 0.64 4.77 -1.04 -4.94 117.00 117.92 2h6r n LEU 191 Ca 0.08 -1.21 0.00 0.00 -0.03 0.00 0.00 56.01 54.84 2h6r n LEU 191 Cb 0.33 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 2h6r n LEU 191 CO 0.27 0.57 0.00 0.61 -1.33 0.00 0.00 177.39 177.51 2h6r n GLY 192 N 1.23 1.30 3.76 -0.72 0.00 -1.17 -4.59 105.19 105.00 2h6r n GLY 192 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 2h6r n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h6r s ALA 193 N -2.00 3.34 -0.16 4.61 0.00 -1.15 -4.71 121.76 121.70 2h6r s ALA 193 Ca 0.00 0.91 0.17 0.00 0.00 0.00 0.00 51.96 53.04 2h6r s ALA 193 Cb 0.00 -3.34 0.36 0.00 0.00 0.00 0.00 23.12 20.15 2h6r s ALA 193 CO 0.00 -0.25 1.23 0.39 0.00 0.00 0.00 175.76 177.13 2h6r n GLU 194 N 0.87 1.65 0.00 0.00 1.02 -0.50 -4.22 120.64 119.45 2h6r n GLU 194 Ca 0.00 -2.77 0.00 0.00 -0.02 0.00 0.00 57.16 54.37 2h6r n GLU 194 Cb 0.45 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 2h6r n GLU 194 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2h6r n GLY 195 N -1.21 0.39 2.88 0.62 0.00 -1.24 -1.61 105.19 105.02 2h6r n GLY 195 Ca 0.18 -0.79 -0.13 0.00 0.00 0.00 0.00 46.02 45.28 2h6r n GLY 195 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2h6r s VAL 196 N -2.00 0.08 -0.10 1.61 1.01 0.50 -2.04 120.40 119.45 2h6r s VAL 196 Ca 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.96 2h6r s VAL 196 Cb 0.00 -0.08 0.02 0.00 0.00 0.00 0.00 36.38 36.32 2h6r s VAL 196 CO 0.00 0.03 -0.13 -0.22 0.00 0.00 0.00 175.10 174.78 2h6r s LEU 197 N 0.03 1.59 0.25 3.92 0.20 -0.64 -1.00 118.68 123.03 2h6r s LEU 197 Ca -0.00 -0.38 -0.04 0.00 0.69 0.00 0.00 54.13 54.40 2h6r s LEU 197 Cb -0.01 -0.99 -0.02 0.00 -0.43 0.00 0.00 46.19 44.74 2h6r s LEU 197 CO -0.00 -0.02 0.31 -1.48 -0.29 0.00 0.00 176.35 174.87 2h6r s LEU 198 N 1.11 0.93 0.00 -0.68 0.05 -0.77 -4.14 118.68 115.18 2h6r s LEU 198 Ca -0.05 -1.30 0.00 0.00 0.05 0.00 0.00 54.13 52.83 2h6r s LEU 198 Cb -0.14 1.00 0.00 0.00 -2.05 0.00 0.00 46.19 44.99 2h6r s LEU 198 CO -0.03 -1.03 0.00 0.00 -0.55 0.00 0.00 176.35 174.75 2h6r n ALA 199 N -0.39 1.94 0.27 1.48 0.00 -1.26 -0.07 120.51 122.48 2h6r n ALA 199 Ca 0.01 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.61 2h6r n ALA 199 Cb 0.64 0.00 0.83 0.00 0.00 0.00 0.00 19.45 20.91 2h6r n ALA 199 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2h6r h SER 200 N 0.00 0.00 1.22 0.00 4.64 -1.98 -1.80 113.55 115.62 2h6r h SER 200 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2h6r h SER 200 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2h6r h SER 200 CO 0.00 0.00 0.00 1.23 -0.87 0.00 0.00 176.83 177.19 2h6r h GLY 201 N 0.00 0.00 0.00 -0.77 0.00 -1.91 -3.22 103.07 97.17 2h6r h GLY 201 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 2h6r h GLY 201 CO 0.00 0.00 -1.16 -0.62 0.00 0.00 0.00 176.54 174.76 2h6r n VAL 202 N -2.84 0.16 -0.37 4.60 0.31 -0.72 -4.50 118.33 114.97 2h6r n VAL 202 Ca 0.02 -0.05 -0.02 0.00 -0.01 0.00 0.00 64.34 64.28 2h6r n VAL 202 Cb 0.35 -0.99 0.11 0.00 -0.91 0.00 0.00 33.84 32.40 2h6r n VAL 202 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2h6r h VAL 203 N -0.05 1.24 0.27 2.52 2.07 -1.60 -3.27 116.25 117.44 2h6r h VAL 203 Ca -0.07 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 2h6r h VAL 203 Cb 1.08 -0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2h6r h VAL 203 CO -0.03 0.24 -0.13 0.50 0.02 0.00 0.00 177.57 178.18 2h6r h LYS 204 N 1.34 -0.35 0.00 1.57 3.64 -1.80 -3.47 116.57 117.51 2h6r h LYS 204 Ca 0.37 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 2h6r h LYS 204 Cb -0.14 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.76 2h6r h LYS 204 CO -0.09 -0.23 0.00 0.00 -2.27 0.00 0.00 179.45 176.86 2h6r n ALA 205 N -2.41 -0.54 -0.08 5.00 0.00 -1.23 -4.84 120.51 116.40 2h6r n ALA 205 Ca -0.05 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.29 2h6r n ALA 205 Cb 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.56 2h6r n ALA 205 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2h6r h LYS 206 N 0.00 0.37 -3.64 0.00 1.79 -1.91 -3.30 116.57 109.89 2h6r h LYS 206 Ca 0.00 -0.08 -0.77 0.00 -2.18 0.00 0.00 60.65 57.62 2h6r h LYS 206 Cb 0.00 -0.06 -0.29 0.00 -1.58 0.00 0.00 32.23 30.31 2h6r h LYS 206 CO 0.00 0.45 0.17 1.21 -1.08 0.00 0.00 179.45 180.20 2h6r s ASN 207 N -5.72 6.74 0.30 0.86 3.84 -1.26 -4.91 114.94 114.79 2h6r s ASN 207 Ca -0.14 -3.19 0.04 0.00 0.21 0.00 0.00 52.86 49.78 2h6r s ASN 207 Cb 0.08 -2.14 0.64 0.00 -0.55 0.00 0.00 41.25 39.28 2h6r s ASN 207 CO 0.72 -0.39 1.84 0.58 -2.79 0.00 0.00 177.10 177.06 2h6r h VAL 208 N 4.31 0.88 -0.38 -5.21 2.07 -1.84 -2.30 116.25 113.78 2h6r h VAL 208 Ca 0.13 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 67.26 2h6r h VAL 208 Cb 0.94 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 2h6r h VAL 208 CO 0.86 0.16 -0.08 -0.08 0.02 0.00 0.00 177.57 178.45 2h6r h GLU 209 N 0.89 0.72 0.00 1.57 4.81 -1.93 -2.75 114.58 117.90 2h6r h GLU 209 Ca 0.49 -0.27 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 2h6r h GLU 209 Cb 0.59 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.92 2h6r h GLU 209 CO -0.26 0.86 -0.08 1.49 -0.73 0.00 0.00 179.01 180.29 2h6r h GLU 210 N 0.52 0.00 0.02 1.92 4.57 -1.88 -2.23 114.58 117.51 2h6r h GLU 210 Ca 0.10 0.00 -0.24 0.00 -1.18 0.00 0.00 59.36 58.04 2h6r h GLU 210 Cb 0.59 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.19 2h6r h GLU 210 CO 0.04 0.08 -1.00 0.00 -1.18 0.00 0.00 179.01 176.94 2h6r h ALA 211 N 1.92 0.30 0.05 2.92 0.00 -1.15 -2.79 119.26 120.52 2h6r h ALA 211 Ca -0.00 -0.74 -0.24 0.00 0.00 0.00 0.00 54.91 53.94 2h6r h ALA 211 Cb 0.44 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2h6r h ALA 211 CO 0.01 0.83 -1.05 0.82 0.00 0.00 0.00 179.25 179.86 2h6r h ILE 212 N 0.22 1.48 0.00 0.00 2.04 -1.20 -3.12 117.51 116.92 2h6r h ILE 212 Ca -0.09 -2.79 -0.05 0.00 1.00 0.00 0.00 64.86 62.93 2h6r h ILE 212 Cb 1.65 2.67 -0.01 0.00 -0.74 0.00 0.00 36.82 40.39 2h6r h ILE 212 CO 0.17 0.82 -0.23 0.03 0.00 0.00 0.00 178.15 178.94 2h6r h ARG 213 N 0.12 0.00 -0.22 2.37 3.08 -1.47 -2.27 114.38 115.99 2h6r h ARG 213 Ca -0.09 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.79 2h6r h ARG 213 Cb 1.73 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.77 2h6r h ARG 213 CO 0.17 0.23 -0.56 1.49 -1.07 0.00 0.00 179.97 180.23 2h6r h GLU 214 N 0.00 0.67 -0.03 0.04 4.57 -1.48 -3.29 114.58 115.06 2h6r h GLU 214 Ca -0.00 -0.43 -0.05 0.00 -1.18 0.00 0.00 59.36 57.70 2h6r h GLU 214 Cb 0.79 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.43 2h6r h GLU 214 CO 0.03 1.05 -0.17 -0.07 -1.18 0.00 0.00 179.01 178.67 2h6r h LEU 215 N 0.52 0.20 -4.83 1.64 3.38 -1.43 -1.28 115.31 113.51 2h6r h LEU 215 Ca 0.01 -0.66 -0.31 0.00 0.09 0.00 0.00 57.88 57.00 2h6r h LEU 215 Cb 1.13 -0.06 0.10 0.00 0.09 0.00 0.00 40.66 41.92 2h6r h LEU 215 CO 0.11 0.84 -0.72 2.30 0.09 0.00 0.00 178.44 181.06 2h6r n ILE 216 N -4.59 0.00 0.00 1.22 -5.35 -0.88 -4.19 119.36 105.57 2h6r n ILE 216 Ca -0.09 -0.27 0.00 0.00 -0.27 0.00 0.00 62.75 62.12 2h6r n ILE 216 Cb 0.42 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.32 2h6r n ILE 216 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96