#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x9r s ARG 3 N 0.00 1.26 0.00 0.00 0.52 -1.25 -4.41 118.95 115.06 2x9r s ARG 3 Ca 0.00 -0.12 0.00 0.00 -0.52 0.00 0.00 55.73 55.09 2x9r s ARG 3 Cb 0.00 -4.91 0.00 0.00 0.52 0.00 0.00 34.95 30.56 2x9r s ARG 3 CO 0.00 -5.24 0.00 -0.89 0.02 0.00 0.00 175.30 169.19 2x9r n ILE 4 N 9.01 0.00 -2.29 1.52 5.41 -1.01 -4.87 119.36 127.13 2x9r n ILE 4 Ca 0.43 0.00 -0.32 0.00 1.00 0.00 0.00 62.75 63.86 2x9r n ILE 4 Cb 0.46 -0.37 -0.02 0.00 -0.71 0.00 0.00 39.64 38.99 2x9r n ILE 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2x9r s ALA 5 N -2.56 2.98 0.00 -1.39 0.00 -1.26 -4.87 121.76 114.66 2x9r s ALA 5 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.19 2x9r s ALA 5 Cb 0.00 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 19.97 2x9r s ALA 5 CO 0.00 -0.39 0.00 0.41 0.00 0.00 0.00 175.76 175.78 2x9r n GLY 6 N -1.45 0.97 3.17 0.00 0.00 -1.26 -2.94 105.19 103.68 2x9r n GLY 6 Ca 0.07 -0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.43 2x9r n GLY 6 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2x9r n VAL 7 N 0.00 3.96 -3.70 1.61 0.31 -1.26 -4.93 118.33 114.32 2x9r n VAL 7 Ca 0.00 -5.34 -0.23 0.00 -0.01 0.00 0.00 64.34 58.76 2x9r n VAL 7 Cb 0.00 -2.43 -0.17 0.00 -0.91 0.00 0.00 33.84 30.33 2x9r n VAL 7 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2x9r s GLU 8 N -1.55 0.29 -0.63 5.55 2.02 -1.15 -5.06 118.70 118.16 2x9r s GLU 8 Ca 0.30 0.07 0.06 0.00 0.02 0.00 0.00 54.97 55.43 2x9r s GLU 8 Cb -0.06 -1.18 0.24 0.00 0.10 0.00 0.00 34.13 33.24 2x9r s GLU 8 CO -0.08 -0.44 0.72 -0.89 0.02 0.00 0.00 175.26 174.60 2x9r n ILE 9 N 5.21 2.17 -2.63 -1.63 -0.00 -1.26 -2.39 119.36 118.82 2x9r n ILE 9 Ca -0.06 -5.14 -0.38 0.00 -0.00 0.00 0.00 62.75 57.17 2x9r n ILE 9 Cb 0.49 -2.10 -0.05 0.00 -0.00 0.00 0.00 39.64 37.98 2x9r n ILE 9 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 2x9r s PRO 10 N -2.35 4.52 0.09 0.38 0.04 -1.26 -4.50 135.00 131.91 2x9r s PRO 10 Ca 0.39 1.52 0.01 0.00 0.04 0.00 0.00 61.00 62.96 2x9r s PRO 10 Cb 0.14 -2.89 -0.00 0.00 0.04 0.00 0.00 34.50 31.78 2x9r s PRO 10 CO -0.03 0.18 0.09 0.54 0.04 0.00 0.00 177.00 177.82 2x9r n ARG 11 N 0.66 0.13 -0.44 4.56 1.74 -1.26 -4.16 116.66 117.90 2x9r n ARG 11 Ca 0.02 -0.79 -0.01 0.00 -0.77 0.00 0.00 57.85 56.30 2x9r n ARG 11 Cb 0.48 0.69 -0.00 0.00 -1.02 0.00 0.00 32.46 32.61 2x9r n ARG 11 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2x9r n ASN 12 N -2.39 -1.67 -4.29 0.55 3.02 -1.26 -4.87 115.26 104.35 2x9r n ASN 12 Ca 0.01 0.03 -0.15 0.00 -0.03 0.00 0.00 54.58 54.43 2x9r n ASN 12 Cb 0.15 -1.42 -0.10 0.00 -0.61 0.00 0.00 39.78 37.80 2x9r n ASN 12 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2x9r s LYS 13 N -0.91 1.19 0.28 3.52 1.02 -1.26 -4.99 119.74 118.59 2x9r s LYS 13 Ca 0.00 -1.56 -0.30 0.00 0.02 0.00 0.00 55.97 54.13 2x9r s LYS 13 Cb 0.00 -0.60 -0.13 0.00 -0.52 0.00 0.00 37.83 36.59 2x9r s LYS 13 CO 0.00 -0.02 1.42 0.54 -0.92 0.00 0.00 175.35 176.37 2x9r n ARG 14 N -0.30 2.23 0.00 1.68 1.74 -1.24 -3.26 116.66 117.52 2x9r n ARG 14 Ca -0.08 0.79 0.00 0.00 -0.77 0.00 0.00 57.85 57.79 2x9r n ARG 14 Cb 0.62 -2.46 0.00 0.00 -1.02 0.00 0.00 32.46 29.60 2x9r n ARG 14 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 2x9r n VAL 15 N 1.48 0.54 0.00 1.55 0.24 -1.23 -2.08 118.33 118.82 2x9r n VAL 15 Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 2x9r n VAL 15 Cb 0.34 -0.75 0.00 0.00 -1.47 0.00 0.00 33.84 31.96 2x9r n VAL 15 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2x9r n ASP 16 N 0.68 4.55 -0.02 -1.34 3.85 -1.26 -4.64 116.55 118.37 2x9r n ASP 16 Ca 0.00 0.00 0.02 0.00 -0.71 0.00 0.00 54.79 54.10 2x9r n ASP 16 Cb 0.28 0.57 -0.13 0.00 -1.35 0.00 0.00 41.12 40.49 2x9r n ASP 16 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.20 176.71 2x9r n VAL 17 N -1.74 0.79 -0.15 2.12 0.31 -0.88 -4.26 118.33 114.52 2x9r n VAL 17 Ca 0.00 -0.67 -0.08 0.00 -0.01 0.00 0.00 64.34 63.59 2x9r n VAL 17 Cb 0.34 -0.37 0.01 0.00 -0.91 0.00 0.00 33.84 32.91 2x9r n VAL 17 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2x9r h ALA 18 N 1.53 0.58 -0.08 3.52 0.00 -1.76 -1.74 119.26 121.31 2x9r h ALA 18 Ca -0.22 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.67 2x9r h ALA 18 Cb 1.55 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 2x9r h ALA 18 CO 0.02 0.05 0.06 -0.07 0.00 0.00 0.00 179.25 179.31 2x9r h LEU 19 N 0.61 0.02 -1.10 0.00 -0.00 -1.83 0.96 115.31 113.97 2x9r h LEU 19 Ca 0.17 -0.00 0.06 0.00 -0.00 0.00 0.00 57.88 58.11 2x9r h LEU 19 Cb -0.04 -0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 40.55 2x9r h LEU 19 CO -0.03 0.01 0.61 0.74 -0.00 0.00 0.00 178.44 179.77 2x9r h THR 20 N 0.02 1.08 0.00 0.22 2.02 -1.48 -0.38 112.91 114.38 2x9r h THR 20 Ca 0.04 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 66.84 2x9r h THR 20 Cb 0.12 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.43 2x9r h THR 20 CO -0.00 0.20 0.00 -1.22 0.37 0.00 0.00 175.52 174.87 2x9r n TYR 21 N -4.49 0.00 -5.09 3.16 0.53 0.33 -4.59 117.16 107.01 2x9r n TYR 21 Ca 0.14 -0.02 -0.32 0.00 -1.02 0.00 0.00 57.90 56.68 2x9r n TYR 21 Cb 0.19 -0.06 -0.16 0.00 -1.03 0.00 0.00 39.34 38.28 2x9r n TYR 21 CO 0.00 0.00 0.00 0.42 -1.02 0.00 0.00 176.86 176.26 2x9r s ILE 22 N -0.85 2.39 -0.24 -0.72 1.09 -0.15 -5.04 121.20 117.68 2x9r s ILE 22 Ca 0.00 -0.92 -0.29 0.00 -1.10 0.00 0.00 60.65 58.35 2x9r s ILE 22 Cb 0.00 -1.93 -0.02 0.00 -1.06 0.00 0.00 42.46 39.44 2x9r s ILE 22 CO 0.00 0.56 1.63 -0.47 -0.10 0.00 0.00 174.94 176.55 2x9r s TYR 23 N 0.14 2.08 0.00 3.97 6.14 -1.26 -1.97 117.35 126.45 2x9r s TYR 23 Ca -0.11 0.56 0.00 0.00 0.64 0.00 0.00 57.07 58.16 2x9r s TYR 23 Cb -0.16 -4.02 0.00 0.00 0.42 0.00 0.00 41.96 38.21 2x9r s TYR 23 CO 0.06 -2.90 0.00 0.41 0.64 0.00 0.00 175.55 173.77 2x9r n GLY 24 N 4.78 1.17 2.86 8.97 0.00 -1.26 -0.81 105.19 120.90 2x9r n GLY 24 Ca 0.19 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 2x9r n GLY 24 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x9r s ILE 25 N -2.00 -0.04 0.17 -0.61 1.01 -0.83 -4.10 121.20 114.79 2x9r s ILE 25 Ca 0.00 0.16 0.03 0.00 0.00 0.00 0.00 60.65 60.84 2x9r s ILE 25 Cb 0.00 -0.14 -0.01 0.00 0.01 0.00 0.00 42.46 42.32 2x9r s ILE 25 CO 0.00 0.07 0.09 0.61 0.00 0.00 0.00 174.94 175.71 2x9r n GLY 26 N 3.97 3.63 0.32 6.18 0.00 -1.26 -4.22 105.19 113.81 2x9r n GLY 26 Ca -0.24 -1.90 0.32 0.00 0.00 0.00 0.00 46.02 44.20 2x9r n GLY 26 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2x9r n LYS 27 N -0.35 -0.06 0.00 1.61 3.00 -1.26 -1.09 118.16 120.00 2x9r n LYS 27 Ca 0.00 1.37 0.00 0.00 -0.00 0.00 0.00 58.31 59.68 2x9r n LYS 27 Cb 0.27 -2.46 0.00 0.00 0.00 0.00 0.00 35.03 32.84 2x9r n LYS 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2x9r n ALA 28 N -2.27 -0.02 0.00 3.14 0.00 -1.26 -2.42 120.51 117.68 2x9r n ALA 28 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.82 2x9r n ALA 28 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.73 2x9r n ALA 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2x9r n ARG 29 N -0.57 0.00 0.00 0.00 1.74 -1.07 -2.13 116.66 114.62 2x9r n ARG 29 Ca 0.00 0.30 0.00 0.00 -0.77 0.00 0.00 57.85 57.38 2x9r n ARG 29 Cb 0.00 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 29.75 2x9r n ARG 29 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2x9r n ALA 30 N -1.30 -0.12 0.32 7.54 0.00 -0.25 -2.28 120.51 124.42 2x9r n ALA 30 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2x9r n ALA 30 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.64 2x9r n ALA 30 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2x9r n LYS 31 N -1.58 0.56 0.05 0.00 5.02 -0.91 -3.05 118.16 118.26 2x9r n LYS 31 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2x9r n LYS 31 Cb 0.00 -1.22 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 2x9r n LYS 31 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2x9r n GLU 32 N 1.00 0.00 0.01 1.97 0.00 -1.13 -4.62 120.64 117.87 2x9r n GLU 32 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 57.16 57.23 2x9r n GLU 32 Cb 0.28 -0.40 0.33 0.00 0.00 0.00 0.00 31.44 31.65 2x9r n GLU 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2x9r n ALA 33 N -3.31 1.67 0.13 4.31 0.00 -0.97 -2.24 120.51 120.11 2x9r n ALA 33 Ca 0.00 -0.04 -0.24 0.00 0.00 0.00 0.00 53.44 53.16 2x9r n ALA 33 Cb 0.13 -1.25 -0.16 0.00 0.00 0.00 0.00 19.45 18.17 2x9r n ALA 33 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2x9r h LEU 34 N 0.00 0.80 -0.21 0.00 3.38 -1.82 -3.26 115.31 114.20 2x9r h LEU 34 Ca 0.00 -0.92 -0.16 0.00 0.09 0.00 0.00 57.88 56.89 2x9r h LEU 34 Cb 0.26 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2x9r h LEU 34 CO 0.00 1.66 -0.49 1.05 0.09 0.00 0.00 178.44 180.76 2x9r h GLU 35 N 0.08 0.71 -0.69 1.13 4.11 -1.73 -0.98 114.58 117.21 2x9r h GLU 35 Ca -0.24 -0.48 0.00 0.00 0.07 0.00 0.00 59.36 58.72 2x9r h GLU 35 Cb 2.08 0.07 0.00 0.00 0.50 0.00 0.00 28.75 31.40 2x9r h GLU 35 CO 0.26 1.10 0.00 1.63 0.07 0.00 0.00 179.01 182.07 2x9r n LYS 36 N -4.15 0.76 -0.32 1.06 4.76 -0.95 -2.48 118.16 116.83 2x9r n LYS 36 Ca -0.06 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.38 2x9r n LYS 36 Cb 0.59 -1.35 0.00 0.00 -1.84 0.00 0.00 35.03 32.43 2x9r n LYS 36 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 2x9r n THR 37 N 0.07 0.00 -2.20 -0.18 -2.24 -1.19 -5.00 114.28 103.54 2x9r n THR 37 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 2x9r n THR 37 Cb 0.17 0.20 -0.01 0.00 -2.10 0.00 0.00 70.33 68.59 2x9r n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x9r n GLY 38 N 0.00 -0.19 3.38 3.38 0.00 -1.04 -4.90 105.19 105.82 2x9r n GLY 38 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 2x9r n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x9r s ILE 39 N -2.34 5.07 -0.16 -0.61 1.01 -0.39 -5.03 121.20 118.75 2x9r s ILE 39 Ca 0.00 -1.05 -0.39 0.00 0.00 0.00 0.00 60.65 59.22 2x9r s ILE 39 Cb 0.00 -4.29 -0.16 0.00 0.01 0.00 0.00 42.46 38.02 2x9r s ILE 39 CO 0.00 -0.81 1.63 -3.20 0.00 0.00 0.00 174.94 172.56 2x9r n ASN 40 N 5.63 2.22 0.11 3.58 5.15 -1.26 -4.62 115.26 126.08 2x9r n ASN 40 Ca -0.11 1.08 -0.00 0.00 -0.60 0.00 0.00 54.58 54.95 2x9r n ASN 40 Cb 0.43 -1.17 0.29 0.00 -0.53 0.00 0.00 39.78 38.80 2x9r n ASN 40 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 2x9r h PRO 41 N 6.50 0.21 -1.97 1.20 0.11 -1.93 -3.27 132.00 132.85 2x9r h PRO 41 Ca -0.47 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.56 2x9r h PRO 41 Cb 1.32 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2x9r h PRO 41 CO 0.91 0.51 0.00 0.00 -0.21 0.00 0.00 178.00 179.21 2x9r n ALA 42 N -2.48 3.78 -2.89 -0.75 0.00 -1.26 -4.00 120.51 112.92 2x9r n ALA 42 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2x9r n ALA 42 Cb 0.40 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.78 2x9r n ALA 42 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2x9r n THR 43 N 1.51 0.00 -3.71 0.00 -2.24 -1.23 -5.04 114.28 103.56 2x9r n THR 43 Ca 0.00 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 2x9r n THR 43 Cb 0.46 -0.07 -0.08 0.00 -2.10 0.00 0.00 70.33 68.55 2x9r n THR 43 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2x9r s ARG 44 N 1.59 0.79 0.55 -0.78 1.81 -1.26 -3.53 118.95 118.12 2x9r s ARG 44 Ca 0.00 -0.25 0.32 0.00 -1.72 0.00 0.00 55.73 54.08 2x9r s ARG 44 Cb 0.00 0.35 1.51 0.00 -0.45 0.00 0.00 34.95 36.36 2x9r s ARG 44 CO 0.00 -0.24 2.05 0.28 -0.68 0.00 0.00 175.30 176.71 2x9r h VAL 45 N 3.45 0.26 -0.68 3.52 2.07 -1.87 -1.89 116.25 121.11 2x9r h VAL 45 Ca -0.30 -0.53 0.18 0.00 0.82 0.00 0.00 66.70 66.87 2x9r h VAL 45 Cb 1.18 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 32.34 2x9r h VAL 45 CO 0.42 0.07 0.48 0.50 0.02 0.00 0.00 177.57 179.06 2x9r h LYS 46 N 0.00 0.08 -2.29 1.57 3.64 -1.91 -3.38 116.57 114.29 2x9r h LYS 46 Ca -0.00 -0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.12 2x9r h LYS 46 Cb 0.41 -0.02 -0.34 0.00 -0.41 0.00 0.00 32.23 31.88 2x9r h LYS 46 CO 0.01 0.05 -0.57 0.16 -2.27 0.00 0.00 179.45 176.83 2x9r s ASP 47 N -6.00 0.94 -0.29 4.20 1.47 -0.71 -5.06 116.67 111.23 2x9r s ASP 47 Ca -0.06 -0.05 -0.17 0.00 1.18 0.00 0.00 52.55 53.45 2x9r s ASP 47 Cb 0.20 0.66 0.13 0.00 -0.34 0.00 0.00 42.92 43.58 2x9r s ASP 47 CO 0.75 -0.32 0.93 -1.48 0.68 0.00 0.00 175.17 175.73 2x9r s LEU 48 N 2.41 -0.58 0.44 2.11 2.34 -1.26 -4.45 118.68 119.70 2x9r s LEU 48 Ca 0.09 0.94 -0.24 0.00 0.06 0.00 0.00 54.13 54.99 2x9r s LEU 48 Cb -0.16 1.87 -0.10 0.00 -0.56 0.00 0.00 46.19 47.25 2x9r s LEU 48 CO -0.13 -0.15 0.99 0.41 -1.06 0.00 0.00 176.35 176.41 2x9r n THR 49 N 3.66 2.55 -0.33 5.48 -1.04 -1.26 -4.73 114.28 118.60 2x9r n THR 49 Ca -0.18 -0.50 0.21 0.00 -2.04 0.00 0.00 64.05 61.54 2x9r n THR 49 Cb 0.58 -1.15 0.46 0.00 -1.82 0.00 0.00 70.33 68.40 2x9r n THR 49 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 2x9r h GLU 50 N 1.41 0.45 0.27 -2.82 4.39 -2.01 0.80 114.58 117.07 2x9r h GLU 50 Ca -0.45 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.22 2x9r h GLU 50 Cb 1.34 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.87 2x9r h GLU 50 CO 0.56 0.30 -0.25 0.00 -1.16 0.00 0.00 179.01 178.46 2x9r h ALA 51 N 1.66 -0.53 -0.48 3.43 0.00 -1.98 0.30 119.26 121.65 2x9r h ALA 51 Ca 0.62 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.50 2x9r h ALA 51 Cb 1.41 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 19.53 2x9r h ALA 51 CO -0.36 -0.83 0.32 0.93 0.00 0.00 0.00 179.25 179.31 2x9r h GLU 52 N -0.55 0.42 0.40 0.00 5.08 -1.23 0.50 114.58 119.20 2x9r h GLU 52 Ca -0.01 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 2x9r h GLU 52 Cb 0.50 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2x9r h GLU 52 CO -0.04 0.28 -0.19 0.28 -1.00 0.00 0.00 179.01 178.33 2x9r h VAL 53 N 0.43 0.00 -0.51 3.13 2.07 -0.30 -1.00 116.25 120.07 2x9r h VAL 53 Ca 0.21 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.51 2x9r h VAL 53 Cb 0.27 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.02 2x9r h VAL 53 CO -0.05 0.00 0.34 0.58 0.02 0.00 0.00 177.57 178.45 2x9r h VAL 54 N -0.77 1.07 -0.47 2.57 2.07 -0.22 -0.80 116.25 119.69 2x9r h VAL 54 Ca -0.05 -0.21 -0.13 0.00 0.82 0.00 0.00 66.70 67.13 2x9r h VAL 54 Cb 0.41 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2x9r h VAL 54 CO 0.09 0.11 -0.23 -0.09 0.02 0.00 0.00 177.57 177.47 2x9r h ARG 55 N 0.60 0.98 -0.24 1.57 2.43 -0.05 -2.67 114.38 117.00 2x9r h ARG 55 Ca 0.20 -0.43 -0.01 0.00 -0.81 0.00 0.00 59.98 58.93 2x9r h ARG 55 Cb 0.06 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 2x9r h ARG 55 CO -0.05 1.10 0.11 1.25 -1.51 0.00 0.00 179.97 180.87 2x9r h LEU 56 N 0.84 0.31 -1.58 3.80 7.12 -0.29 -1.31 115.31 124.21 2x9r h LEU 56 Ca 0.11 -0.14 0.00 0.00 0.13 0.00 0.00 57.88 57.98 2x9r h LEU 56 Cb 0.81 -0.08 0.00 0.00 -0.53 0.00 0.00 40.66 40.86 2x9r h LEU 56 CO 0.07 0.36 0.14 -0.09 -0.13 0.00 0.00 178.44 178.79 2x9r h ARG 57 N 0.24 0.00 0.00 1.25 2.43 -0.96 -3.11 114.38 114.23 2x9r h ARG 57 Ca 0.08 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2x9r h ARG 57 Cb 0.14 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2x9r h ARG 57 CO -0.01 0.00 0.00 0.39 -1.51 0.00 0.00 179.97 178.84 2x9r n GLU 58 N -2.41 0.00 0.00 0.20 -0.58 -0.49 -1.60 120.64 115.75 2x9r n GLU 58 Ca -0.02 0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 2x9r n GLU 58 Cb 0.18 -0.73 0.00 0.00 -0.57 0.00 0.00 31.44 30.31 2x9r n GLU 58 CO 0.00 0.00 0.00 0.98 -0.48 0.00 0.00 177.13 177.63 2x9r n TYR 59 N -0.84 0.00 0.02 -0.32 9.36 -1.22 -1.84 117.16 122.32 2x9r n TYR 59 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 2x9r n TYR 59 Cb 0.00 -0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.71 2x9r n TYR 59 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 2x9r n VAL 60 N -0.05 0.45 1.57 2.97 0.31 -1.18 -4.37 118.33 118.04 2x9r n VAL 60 Ca 0.00 0.15 0.07 0.00 -0.01 0.00 0.00 64.34 64.55 2x9r n VAL 60 Cb 0.01 -1.17 0.44 0.00 -0.91 0.00 0.00 33.84 32.21 2x9r n VAL 60 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2x9r n GLU 61 N -2.89 0.79 -0.02 5.55 2.13 -0.63 -3.18 120.64 122.39 2x9r n GLU 61 Ca 0.00 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.79 2x9r n GLU 61 Cb 0.00 -1.29 -0.02 0.00 0.27 0.00 0.00 31.44 30.39 2x9r n GLU 61 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2x9r n ASN 62 N -0.79 3.74 0.00 4.31 4.13 -0.77 -4.90 115.26 120.98 2x9r n ASN 62 Ca 0.11 -0.02 0.00 0.00 1.68 0.00 0.00 54.58 56.35 2x9r n ASN 62 Cb 0.05 0.07 0.00 0.00 -1.54 0.00 0.00 39.78 38.36 2x9r n ASN 62 CO 0.00 0.00 0.00 0.41 0.28 0.00 0.00 177.26 177.95 2x9r n THR 63 N -2.53 0.00 -3.23 3.41 -1.04 -1.19 -4.74 114.28 104.96 2x9r n THR 63 Ca -0.08 0.43 -0.39 0.00 -2.04 0.00 0.00 64.05 61.97 2x9r n THR 63 Cb 0.59 -1.34 -0.07 0.00 -1.82 0.00 0.00 70.33 67.70 2x9r n THR 63 CO 0.00 0.00 0.00 -1.66 -0.64 0.00 0.00 175.07 172.77 2x9r s TRP 64 N 0.00 3.36 -1.39 -1.42 -2.14 -1.24 -5.06 118.94 111.04 2x9r s TRP 64 Ca 0.00 0.77 0.00 0.00 2.66 0.00 0.00 56.10 59.53 2x9r s TRP 64 Cb 0.00 -2.69 0.01 0.00 -3.10 0.00 0.00 33.47 27.68 2x9r s TRP 64 CO 0.00 -0.13 0.81 0.36 -2.66 0.00 0.00 176.95 175.33 2x9r n LYS 65 N 4.92 0.00 0.00 3.25 2.85 -1.26 -4.72 118.16 123.20 2x9r n LYS 65 Ca -0.04 0.30 0.00 0.00 -1.05 0.00 0.00 58.31 57.52 2x9r n LYS 65 Cb 0.50 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.38 2x9r n LYS 65 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 2x9r n LEU 66 N -1.30 0.00 -4.20 -5.58 4.77 -1.21 -4.16 117.00 105.31 2x9r n LEU 66 Ca 0.00 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.71 2x9r n LEU 66 Cb 0.00 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.29 2x9r n LEU 66 CO 0.00 0.00 -0.06 1.21 -1.33 0.00 0.00 177.39 177.21 2x9r n GLU 67 N 0.15 -2.63 0.00 3.23 4.07 0.01 0.17 120.64 125.65 2x9r n GLU 67 Ca 0.00 -0.77 0.00 0.00 -0.06 0.00 0.00 57.16 56.33 2x9r n GLU 67 Cb 0.00 -1.72 0.00 0.00 -0.06 0.00 0.00 31.44 29.66 2x9r n GLU 67 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2x9r n GLY 68 N 2.02 0.45 0.00 8.31 0.00 -1.26 -1.15 105.19 113.57 2x9r n GLY 68 Ca 0.05 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.34 2x9r n GLY 68 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2x9r n GLU 69 N 0.00 0.00 -0.06 1.61 2.13 -1.26 -0.71 120.64 122.35 2x9r n GLU 69 Ca 0.00 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.69 2x9r n GLU 69 Cb 0.00 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 31.66 2x9r n GLU 69 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2x9r n LEU 70 N 0.00 1.11 -0.35 4.31 4.77 0.44 -4.73 117.00 122.55 2x9r n LEU 70 Ca 0.00 0.13 -0.08 0.00 -0.03 0.00 0.00 56.01 56.03 2x9r n LEU 70 Cb 0.00 -0.37 -0.07 0.00 -2.33 0.00 0.00 43.42 40.65 2x9r n LEU 70 CO 0.00 0.31 0.42 -1.14 -1.33 0.00 0.00 177.39 175.64 2x9r n ARG 71 N -3.49 -0.35 -0.33 3.23 3.00 -0.68 0.83 116.66 118.88 2x9r n ARG 71 Ca -0.24 1.27 0.16 0.00 -0.00 0.00 0.00 57.85 59.04 2x9r n ARG 71 Cb 0.68 -1.88 0.40 0.00 0.00 0.00 0.00 32.46 31.66 2x9r n ARG 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2x9r h ALA 72 N 0.52 1.89 0.06 5.13 0.00 -1.26 -2.14 119.26 123.46 2x9r h ALA 72 Ca 0.16 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2x9r h ALA 72 Cb 0.37 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2x9r h ALA 72 CO -0.80 -0.27 -0.03 1.49 0.00 0.00 0.00 179.25 179.65 2x9r h GLU 73 N 0.61 -0.08 -0.74 0.00 4.81 0.29 -1.40 114.58 118.08 2x9r h GLU 73 Ca 0.57 0.01 0.17 0.00 -0.13 0.00 0.00 59.36 59.98 2x9r h GLU 73 Cb 1.10 0.02 -0.12 0.00 0.63 0.00 0.00 28.75 30.38 2x9r h GLU 73 CO -0.34 0.50 0.11 0.28 -0.73 0.00 0.00 179.01 178.82 2x9r h VAL 74 N -0.73 0.43 -0.30 0.32 2.07 -0.43 0.87 116.25 118.47 2x9r h VAL 74 Ca -0.01 -0.06 -0.13 0.00 0.82 0.00 0.00 66.70 67.31 2x9r h VAL 74 Cb 0.61 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2x9r h VAL 74 CO 0.01 0.03 -0.36 0.00 0.02 0.00 0.00 177.57 177.28 2x9r h ALA 75 N 1.65 0.80 -0.93 1.67 0.00 -1.48 -2.58 119.26 118.40 2x9r h ALA 75 Ca 0.42 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2x9r h ALA 75 Cb 0.74 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 2x9r h ALA 75 CO -0.58 0.65 0.60 0.00 0.00 0.00 0.00 179.25 179.92 2x9r h ALA 76 N 1.03 1.18 0.14 0.00 0.00 0.14 0.10 119.26 121.85 2x9r h ALA 76 Ca 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2x9r h ALA 76 Cb 0.88 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2x9r h ALA 76 CO 0.08 0.60 -0.07 -0.91 0.00 0.00 0.00 179.25 178.94 2x9r h ASN 77 N 1.27 -0.16 -0.65 0.00 2.35 0.62 -1.92 115.58 117.08 2x9r h ASN 77 Ca 0.34 -0.07 0.10 0.00 -0.55 0.00 0.00 56.30 56.12 2x9r h ASN 77 Cb -0.12 0.04 -0.08 0.00 0.05 0.00 0.00 38.32 38.21 2x9r h ASN 77 CO -0.07 -0.03 0.26 0.40 -1.65 0.00 0.00 177.43 176.33 2x9r h ILE 78 N -0.28 0.75 -0.64 2.81 2.04 -1.03 0.25 117.51 121.41 2x9r h ILE 78 Ca -0.02 -0.15 0.10 0.00 1.00 0.00 0.00 64.86 65.79 2x9r h ILE 78 Cb 0.22 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 36.54 2x9r h ILE 78 CO 0.03 0.08 0.43 0.50 0.00 0.00 0.00 178.15 179.19 2x9r h LYS 79 N 0.44 0.47 -0.63 2.37 3.11 -0.47 0.12 116.57 121.98 2x9r h LYS 79 Ca 0.33 -0.03 -0.09 0.00 -2.81 0.00 0.00 60.65 58.06 2x9r h LYS 79 Cb 0.43 -0.11 -0.02 0.00 -1.00 0.00 0.00 32.23 31.53 2x9r h LYS 79 CO -0.32 0.31 0.05 -0.09 -2.81 0.00 0.00 179.45 176.58 2x9r h ARG 80 N 0.48 1.08 0.00 1.90 2.43 0.26 -0.10 114.38 120.43 2x9r h ARG 80 Ca 0.29 -0.32 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2x9r h ARG 80 Cb 0.51 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 2x9r h ARG 80 CO -0.09 1.02 0.00 1.28 -1.51 0.00 0.00 179.97 180.67 2x9r n LEU 81 N -4.21 0.53 -2.23 3.80 4.77 0.40 0.21 117.00 120.27 2x9r n LEU 81 Ca 0.03 0.74 -0.25 0.00 -0.03 0.00 0.00 56.01 56.51 2x9r n LEU 81 Cb 0.32 -0.81 0.17 0.00 -2.33 0.00 0.00 43.42 40.77 2x9r n LEU 81 CO 0.44 -0.91 1.30 0.80 -1.33 0.00 0.00 177.39 177.69 2x9r n MET 82 N -2.21 2.29 0.00 3.23 0.00 -0.05 -3.52 117.12 116.86 2x9r n MET 82 Ca -0.01 -3.04 0.00 0.00 0.00 0.00 0.00 57.70 54.65 2x9r n MET 82 Cb 0.04 -2.19 0.00 0.00 0.00 0.00 0.00 33.22 31.07 2x9r n MET 82 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 175.97 175.57 2x9r n ASP 83 N -1.13 0.00 0.10 6.12 3.85 0.13 -4.68 116.55 120.95 2x9r n ASP 83 Ca 0.60 0.00 0.10 0.00 -0.71 0.00 0.00 54.79 54.78 2x9r n ASP 83 Cb 1.57 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 41.34 2x9r n ASP 83 CO 0.00 0.00 0.00 0.40 -1.01 0.00 0.00 177.20 176.59 2x9r h ILE 84 N 0.00 0.07 -0.56 2.12 1.08 -1.84 -3.49 117.51 114.90 2x9r h ILE 84 Ca 0.00 -1.14 0.00 0.00 -0.39 0.00 0.00 64.86 63.33 2x9r h ILE 84 Cb 0.00 1.61 0.00 0.00 -3.07 0.00 0.00 36.82 35.36 2x9r h ILE 84 CO 0.00 0.04 0.00 0.61 -0.69 0.00 0.00 178.15 178.11 2x9r n GLY 85 N 1.20 0.69 1.73 5.37 0.00 -1.26 -5.11 105.19 107.81 2x9r n GLY 85 Ca -0.01 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.21 2x9r n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x9r h TYR 87 N -1.83 0.85 -0.40 0.00 3.20 -1.92 -2.07 116.97 114.79 2x9r h TYR 87 Ca -0.20 -0.17 -0.05 0.00 3.14 0.00 0.00 58.73 61.44 2x9r h TYR 87 Cb 0.59 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 2x9r h TYR 87 CO 0.00 0.88 0.02 0.00 -1.64 0.00 0.00 178.16 177.42 2x9r h ARG 88 N 0.57 0.64 0.29 1.82 3.08 -1.92 -2.74 114.38 116.12 2x9r h ARG 88 Ca 0.10 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2x9r h ARG 88 Cb 0.59 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.52 2x9r h ARG 88 CO 0.04 0.64 -0.36 0.78 -1.07 0.00 0.00 179.97 179.99 2x9r h GLY 89 N 0.89 -0.81 -0.18 0.04 0.00 -1.49 -3.34 103.07 98.20 2x9r h GLY 89 Ca 0.13 0.42 -0.08 0.00 0.00 0.00 0.00 47.33 47.80 2x9r h GLY 89 CO 0.01 -0.29 0.02 1.04 0.00 0.00 0.00 176.54 177.32 2x9r n LEU 90 N -5.46 0.00 0.00 3.11 4.77 -0.82 -2.76 117.00 115.84 2x9r n LEU 90 Ca -0.09 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.67 2x9r n LEU 90 Cb 0.36 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 2x9r n LEU 90 CO 0.26 -1.26 0.00 0.54 -1.33 0.00 0.00 177.39 175.60 2x9r n ARG 91 N -2.19 0.00 -0.04 3.23 5.12 -1.26 -4.09 116.66 117.44 2x9r n ARG 91 Ca 0.03 0.00 -0.03 0.00 -1.93 0.00 0.00 57.85 55.92 2x9r n ARG 91 Cb 0.11 -3.19 -0.07 0.00 -1.16 0.00 0.00 32.46 28.16 2x9r n ARG 91 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2x9r n HIS 92 N -1.58 0.00 0.08 -1.55 8.25 -1.11 0.25 115.22 119.56 2x9r n HIS 92 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.38 2x9r n HIS 92 Cb 0.00 -0.40 -0.06 0.00 1.12 0.00 0.00 29.99 30.65 2x9r n HIS 92 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2x9r h ARG 93 N 0.00 0.09 -0.02 -0.41 -0.00 -1.67 -3.10 114.38 109.27 2x9r h ARG 93 Ca -0.21 -0.13 0.00 0.00 -0.50 0.00 0.00 59.98 59.15 2x9r h ARG 93 Cb 1.42 0.04 0.00 0.00 0.00 0.00 0.00 29.97 31.44 2x9r h ARG 93 CO 0.01 0.98 -0.21 0.54 0.00 0.00 0.00 179.97 181.29 2x9r n ARG 94 N -3.50 1.55 -3.39 0.04 1.74 -1.26 -5.00 116.66 106.84 2x9r n ARG 94 Ca -0.02 -1.18 -0.17 0.00 -0.77 0.00 0.00 57.85 55.70 2x9r n ARG 94 Cb 0.89 -1.48 0.04 0.00 -1.02 0.00 0.00 32.46 30.89 2x9r n ARG 94 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2x9r n GLY 95 N 1.34 -1.15 3.23 -0.13 0.00 -1.17 -4.94 105.19 102.38 2x9r n GLY 95 Ca 0.13 0.52 -0.12 0.00 0.00 0.00 0.00 46.02 46.54 2x9r n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x9r s LEU 96 N -5.33 1.14 -0.33 0.99 1.43 0.14 -4.48 118.68 112.23 2x9r s LEU 96 Ca 0.30 -1.39 -0.29 0.00 -1.03 0.00 0.00 54.13 51.72 2x9r s LEU 96 Cb -0.07 0.49 0.02 0.00 0.03 0.00 0.00 46.19 46.65 2x9r s LEU 96 CO 0.80 -0.88 1.10 -2.16 0.23 0.00 0.00 176.35 175.44 2x9r s PRO 97 N -4.09 4.03 -1.09 1.29 0.04 -1.26 -4.55 135.00 129.36 2x9r s PRO 97 Ca 0.38 1.05 -0.03 0.00 0.04 0.00 0.00 61.00 62.44 2x9r s PRO 97 Cb 0.06 -3.76 0.29 0.00 0.04 0.00 0.00 34.50 31.13 2x9r s PRO 97 CO 0.13 -0.96 1.74 0.28 0.04 0.00 0.00 177.00 178.23 2x9r n VAL 98 N 5.98 5.66 -2.80 -0.36 0.31 -1.26 -4.72 118.33 121.14 2x9r n VAL 98 Ca 0.12 -5.76 -0.00 0.00 -0.01 0.00 0.00 64.34 58.69 2x9r n VAL 98 Cb 0.47 -1.84 0.06 0.00 -0.91 0.00 0.00 33.84 31.62 2x9r n VAL 98 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2x9r n ARG 99 N 0.83 1.59 -3.03 5.55 1.74 -1.26 -4.98 116.66 117.11 2x9r n ARG 99 Ca 0.39 -3.15 -0.04 0.00 -0.77 0.00 0.00 57.85 54.28 2x9r n ARG 99 Cb 0.29 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.46 2x9r n ARG 99 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2x9r n GLY 100 N -0.66 -1.60 3.16 -0.13 0.00 -1.26 -5.03 105.19 99.67 2x9r n GLY 100 Ca 0.04 0.37 -0.09 0.00 0.00 0.00 0.00 46.02 46.33 2x9r n GLY 100 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2x9r s GLN 101 N -1.48 0.88 -0.51 1.61 -0.21 -1.26 -5.10 119.66 113.59 2x9r s GLN 101 Ca 0.05 -1.36 -0.28 0.00 0.02 0.00 0.00 55.36 53.80 2x9r s GLN 101 Cb -0.01 0.25 -0.00 0.00 1.00 0.00 0.00 33.01 34.25 2x9r s GLN 101 CO 0.42 -0.25 1.63 0.50 -2.12 0.00 0.00 175.29 175.47 2x9r s ARG 102 N -4.01 3.14 0.05 2.91 6.06 -1.26 -4.84 118.95 121.00 2x9r s ARG 102 Ca 0.20 0.75 0.23 0.00 -2.50 0.00 0.00 55.73 54.41 2x9r s ARG 102 Cb 0.07 -4.21 0.05 0.00 0.06 0.00 0.00 34.95 30.92 2x9r s ARG 102 CO -0.01 -2.12 1.03 0.25 -2.50 0.00 0.00 175.30 171.95 2x9r n THR 103 N 7.10 0.17 0.30 4.11 -2.24 -1.26 -4.10 114.28 118.35 2x9r n THR 103 Ca 0.17 -0.24 0.18 0.00 -2.27 0.00 0.00 64.05 61.89 2x9r n THR 103 Cb 0.49 0.21 0.98 0.00 -2.10 0.00 0.00 70.33 69.92 2x9r n THR 103 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2x9r h ARG 104 N 0.00 0.00 0.00 -0.78 2.43 -2.04 -3.45 114.38 110.54 2x9r h ARG 104 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2x9r h ARG 104 Cb 0.73 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.28 2x9r h ARG 104 CO 0.00 0.00 0.00 0.25 -1.51 0.00 0.00 179.97 178.71 2x9r n THR 105 N -3.60 0.00 0.00 0.20 -2.24 -1.26 -5.09 114.28 102.30 2x9r n THR 105 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 2x9r n THR 105 Cb 0.13 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 2x9r n THR 105 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2x9r n ASN 106 N 0.00 0.00 0.00 3.42 3.02 -1.26 -4.71 115.26 115.73 2x9r n ASN 106 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2x9r n ASN 106 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2x9r n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2x9r n ALA 107 N 0.00 0.00 0.22 5.41 0.00 -1.26 -4.68 120.51 120.19 2x9r n ALA 107 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 2x9r n ALA 107 Cb 0.00 0.00 0.57 0.00 0.00 0.00 0.00 19.45 20.02 2x9r n ALA 107 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2x9r h ARG 108 N 0.00 0.00 0.79 0.00 -0.00 -1.84 -2.66 114.38 110.67 2x9r h ARG 108 Ca 0.00 0.00 -0.04 0.00 -0.50 0.00 0.00 59.98 59.44 2x9r h ARG 108 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 29.97 29.98 2x9r h ARG 108 CO 0.00 0.00 -0.39 1.15 0.00 0.00 0.00 179.97 180.73 2x9r h THR 109 N 0.00 0.00 -0.74 2.04 2.02 -1.97 -2.85 112.91 111.41 2x9r h THR 109 Ca 0.00 0.00 -0.39 0.00 0.77 0.00 0.00 66.41 66.79 2x9r h THR 109 Cb 0.45 0.00 -0.23 0.00 -1.74 0.00 0.00 68.15 66.64 2x9r h THR 109 CO 0.00 0.00 0.50 0.54 0.37 0.00 0.00 175.52 176.93 2x9r n ARG 110 N -4.89 1.94 -3.77 6.66 1.74 -1.02 -4.81 116.66 112.53 2x9r n ARG 110 Ca -0.13 -2.23 -0.27 0.00 -0.77 0.00 0.00 57.85 54.44 2x9r n ARG 110 Cb 0.42 -1.88 -0.17 0.00 -1.02 0.00 0.00 32.46 29.82 2x9r n ARG 110 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2x9r s LYS 111 N -2.46 0.77 -0.61 5.56 1.02 -1.08 -4.09 119.74 118.85 2x9r s LYS 111 Ca 0.42 -0.38 -0.18 0.00 0.02 0.00 0.00 55.97 55.85 2x9r s LYS 111 Cb 0.36 -1.95 0.11 0.00 -0.52 0.00 0.00 37.83 35.82 2x9r s LYS 111 CO 0.07 -0.57 0.70 0.20 -0.92 0.00 0.00 175.35 174.84 2x9r s GLY 112 N 1.83 1.85 0.53 -3.33 0.00 -1.26 -4.67 107.32 102.27 2x9r s GLY 112 Ca -0.00 -2.33 0.00 0.00 0.00 0.00 0.00 44.72 42.39 2x9r s GLY 112 CO -0.07 1.54 0.00 -1.55 0.00 0.00 0.00 173.10 173.02 2x9r n PRO 113 N 6.13 -3.72 -4.07 2.90 -0.04 -1.21 -4.63 135.00 130.35 2x9r n PRO 113 Ca -0.08 2.89 -0.36 0.00 -0.04 0.00 0.00 63.50 65.91 2x9r n PRO 113 Cb 0.43 -3.67 -0.07 0.00 -0.04 0.00 0.00 33.50 30.15 2x9r n PRO 113 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2x9r s ARG 114 N -5.23 3.25 -0.72 0.54 0.52 -1.26 -4.96 118.95 111.09 2x9r s ARG 114 Ca 0.00 -0.25 -0.00 0.00 -0.52 0.00 0.00 55.73 54.96 2x9r s ARG 114 Cb 0.00 -3.03 0.18 0.00 0.52 0.00 0.00 34.95 32.62 2x9r s ARG 114 CO 0.00 0.74 0.54 0.15 0.02 0.00 0.00 175.30 176.76 2x9r s LYS 115 N -1.02 2.71 0.00 3.54 3.01 -1.26 -4.94 119.74 121.78 2x9r s LYS 115 Ca 0.15 -2.97 0.00 0.00 -1.01 0.00 0.00 55.97 52.14 2x9r s LYS 115 Cb -0.12 -3.69 0.00 0.00 -1.01 0.00 0.00 37.83 33.01 2x9r s LYS 115 CO 0.04 -1.22 0.02 2.41 0.51 0.00 0.00 175.35 177.11 2x9r n THR 116 N 2.73 0.00 -1.45 2.17 -1.04 -1.26 -4.70 114.28 110.73 2x9r n THR 116 Ca 0.14 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.89 2x9r n THR 116 Cb 0.36 -0.54 -0.20 0.00 -1.82 0.00 0.00 70.33 68.13 2x9r n THR 116 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2x9r n VAL 117 N -0.24 0.00 -4.42 12.58 0.31 -1.26 -4.92 118.33 120.38 2x9r n VAL 117 Ca 0.00 -0.36 -0.21 0.00 -0.01 0.00 0.00 64.34 63.76 2x9r n VAL 117 Cb 0.00 -0.13 -0.06 0.00 -0.91 0.00 0.00 33.84 32.75 2x9r n VAL 117 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2x9r n ALA 118 N 6.59 0.45 0.00 3.52 0.00 -1.26 -5.18 120.51 124.62 2x9r n ALA 118 Ca 0.65 -1.67 0.00 0.00 0.00 0.00 0.00 53.44 52.42 2x9r n ALA 118 Cb 0.11 1.11 0.00 0.00 0.00 0.00 0.00 19.45 20.67 2x9r n ALA 118 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x9r n GLY 119 N -0.14 1.15 3.71 0.00 0.00 -1.26 -5.18 105.19 103.47 2x9r n GLY 119 Ca -0.06 0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 2x9r n GLY 119 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2x9r s LYS 120 N 0.00 2.36 0.30 1.61 2.36 -1.26 -5.15 119.74 119.97 2x9r s LYS 120 Ca 0.00 -1.51 0.03 0.00 -2.55 0.00 0.00 55.97 51.93 2x9r s LYS 120 Cb 0.00 -2.18 -0.04 0.00 -1.05 0.00 0.00 37.83 34.56 2x9r s LYS 120 CO 0.00 0.18 0.12 0.15 1.55 0.00 0.00 175.35 177.34 2x9r s LYS 121 N -3.80 1.57 0.00 4.03 3.01 -1.26 -5.06 119.74 118.23 2x9r s LYS 121 Ca 0.36 -1.89 0.00 0.00 -1.01 0.00 0.00 55.97 53.43 2x9r s LYS 121 Cb -0.03 -0.33 0.00 0.00 -1.01 0.00 0.00 37.83 36.45 2x9r s LYS 121 CO 0.22 -0.36 0.02 1.63 0.51 0.00 0.00 175.35 177.37 2x9r n LYS 122 N -0.59 0.39 -2.72 1.68 4.76 -1.26 -5.05 118.16 115.37 2x9r n LYS 122 Ca -0.01 -0.02 -0.01 0.00 -2.87 0.00 0.00 58.31 55.41 2x9r n LYS 122 Cb 0.66 -0.22 0.02 0.00 -1.84 0.00 0.00 35.03 33.65 2x9r n LYS 122 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2x9r s ALA 123 N -0.06 -4.45 0.00 7.82 0.00 -1.26 -5.15 121.76 118.66 2x9r s ALA 123 Ca 0.00 0.90 0.00 0.00 0.00 0.00 0.00 51.96 52.86 2x9r s ALA 123 Cb 0.00 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 20.12 2x9r s ALA 123 CO 0.00 -2.51 0.00 -2.30 0.00 0.00 0.00 175.76 170.95 2x9r n PRO 124 N 3.10 0.00 -2.27 0.00 -0.02 -1.26 -4.77 135.00 129.78 2x9r n PRO 124 Ca 0.09 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 61.19 2x9r n PRO 124 Cb 0.64 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 34.10 2x9r n PRO 124 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2x9r n ARG 125 N 0.00 2.52 0.00 -0.52 0.63 -1.26 -5.30 116.66 112.73 2x9r n ARG 125 Ca 0.00 -2.88 0.00 0.00 -0.92 0.00 0.00 57.85 54.05 2x9r n ARG 125 Cb 0.00 -3.54 0.00 0.00 0.45 0.00 0.00 32.46 29.37 2x9r n ARG 125 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75