#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mpa n VAL 2 N 0.00 -5.99 -3.64 2.62 0.31 -0.42 -4.96 118.33 106.26 1mpa n VAL 2 Ca 0.00 1.12 -0.10 0.00 -0.01 0.00 0.00 64.34 65.35 1mpa n VAL 2 Cb 0.00 -3.91 -0.07 0.00 -0.91 0.00 0.00 33.84 28.95 1mpa n VAL 2 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1mpa s ASN 3 N -0.20 -0.71 -0.24 4.52 6.03 -0.78 -4.98 114.94 118.58 1mpa s ASN 3 Ca 0.00 1.29 -0.03 0.00 -1.03 0.00 0.00 52.86 53.09 1mpa s ASN 3 Cb 0.00 1.30 0.01 0.00 -3.03 0.00 0.00 41.25 39.53 1mpa s ASN 3 CO 0.00 -0.22 -0.04 -0.76 -2.03 0.00 0.00 177.10 174.05 1mpa s LEU 4 N 0.73 3.14 -0.22 3.54 1.43 -1.26 -2.44 118.68 123.61 1mpa s LEU 4 Ca -0.02 -0.69 -0.08 0.00 -1.03 0.00 0.00 54.13 52.30 1mpa s LEU 4 Cb -0.05 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.42 1mpa s LEU 4 CO -0.07 -0.10 0.10 -1.10 0.23 0.00 0.00 176.35 175.41 1mpa s GLN 5 N 1.39 3.94 0.34 1.70 -1.52 -0.68 -4.11 119.66 120.73 1mpa s GLN 5 Ca 0.02 -0.35 0.08 0.00 -1.95 0.00 0.00 55.36 53.17 1mpa s GLN 5 Cb -0.16 -3.35 -0.04 0.00 -0.22 0.00 0.00 33.01 29.24 1mpa s GLN 5 CO -0.04 0.10 0.12 -0.65 -0.25 0.00 0.00 175.29 174.58 1mpa s GLN 6 N 0.88 2.34 0.54 2.91 -0.21 -1.26 0.05 119.66 124.89 1mpa s GLN 6 Ca 0.05 -1.57 -0.19 0.00 0.02 0.00 0.00 55.36 53.68 1mpa s GLN 6 Cb -0.13 -2.15 -0.06 0.00 1.00 0.00 0.00 33.01 31.67 1mpa s GLN 6 CO 0.03 0.12 1.07 -1.54 -2.12 0.00 0.00 175.29 172.85 1mpa s SER 7 N -3.82 5.98 1.04 5.90 1.04 -0.90 -4.96 113.70 117.98 1mpa s SER 7 Ca 0.37 1.97 -0.15 0.00 0.48 0.00 0.00 55.95 58.62 1mpa s SER 7 Cb -0.02 -2.56 0.21 0.00 0.10 0.00 0.00 66.02 63.75 1mpa s SER 7 CO 0.22 -1.03 1.14 -0.83 0.98 0.00 0.00 173.24 173.72 1mpa s GLY 8 N -2.15 1.60 0.19 7.32 0.00 -1.26 -4.44 107.32 108.57 1mpa s GLY 8 Ca 0.68 -0.72 -0.29 0.00 0.00 0.00 0.00 44.72 44.39 1mpa s GLY 8 CO 0.27 -0.01 0.58 2.41 0.00 0.00 0.00 173.10 176.34 1mpa n THR 9 N -4.19 1.85 -4.45 0.90 -1.04 -1.26 -4.80 114.28 101.29 1mpa n THR 9 Ca 0.09 -0.46 -0.22 0.00 -2.04 0.00 0.00 64.05 61.43 1mpa n THR 9 Cb 0.59 -0.04 -0.16 0.00 -1.82 0.00 0.00 70.33 68.90 1mpa n THR 9 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1mpa s VAL 10 N -0.93 0.89 -0.13 12.58 1.01 -0.53 -5.00 120.40 128.28 1mpa s VAL 10 Ca 0.66 -0.40 -0.04 0.00 0.00 0.00 0.00 61.98 62.20 1mpa s VAL 10 Cb -0.95 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 1mpa s VAL 10 CO 0.56 0.28 0.02 -0.22 0.00 0.00 0.00 175.10 175.74 1mpa s LEU 11 N 0.31 3.65 0.06 3.92 2.96 -1.26 -1.11 118.68 127.21 1mpa s LEU 11 Ca -0.06 0.09 0.01 0.00 -0.22 0.00 0.00 54.13 53.96 1mpa s LEU 11 Cb -0.11 -1.88 -0.03 0.00 0.50 0.00 0.00 46.19 44.67 1mpa s LEU 11 CO 0.01 0.27 -0.06 0.00 -1.32 0.00 0.00 176.35 175.25 1mpa s ALA 12 N -0.22 0.68 -0.15 5.97 0.00 -0.27 -4.95 121.76 122.83 1mpa s ALA 12 Ca 0.06 -1.08 -0.07 0.00 0.00 0.00 0.00 51.96 50.88 1mpa s ALA 12 Cb -0.12 0.15 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 1mpa s ALA 12 CO 0.02 -0.19 0.08 1.03 0.00 0.00 0.00 175.76 176.70 1mpa s ARG 13 N -2.96 3.64 0.16 0.00 3.00 -1.26 -1.17 118.95 120.37 1mpa s ARG 13 Ca 0.02 -0.28 -0.28 0.00 0.00 0.00 0.00 55.73 55.19 1mpa s ARG 13 Cb -0.00 -3.15 -0.17 0.00 0.00 0.00 0.00 34.95 31.63 1mpa s ARG 13 CO -0.04 0.52 0.57 -2.30 0.00 0.00 0.00 175.30 174.05 1mpa n PRO 14 N 2.78 0.00 0.00 3.54 -0.02 -1.26 -0.56 135.00 139.48 1mpa n PRO 14 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 1mpa n PRO 14 Cb 0.53 -1.02 0.00 0.00 -0.02 0.00 0.00 33.50 32.99 1mpa n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mpa n GLY 15 N 1.82 2.73 2.44 -1.23 0.00 -0.19 -4.88 105.19 105.88 1mpa n GLY 15 Ca 0.17 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.00 1mpa n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mpa n ALA 16 N -0.33 -1.20 -3.73 4.61 0.00 0.27 -4.18 120.51 115.96 1mpa n ALA 16 Ca 0.00 -1.10 -0.22 0.00 0.00 0.00 0.00 53.44 52.12 1mpa n ALA 16 Cb 0.00 -0.06 -0.18 0.00 0.00 0.00 0.00 19.45 19.21 1mpa n ALA 16 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1mpa s SER 17 N -4.00 1.47 0.66 0.00 1.04 -1.26 -1.05 113.70 110.56 1mpa s SER 17 Ca 0.48 -0.05 -0.02 0.00 0.48 0.00 0.00 55.95 56.84 1mpa s SER 17 Cb -0.02 -0.33 0.08 0.00 0.10 0.00 0.00 66.02 65.85 1mpa s SER 17 CO 0.34 -0.22 0.93 0.68 0.98 0.00 0.00 173.24 175.95 1mpa s VAL 18 N 2.05 2.38 -0.16 5.02 -7.23 -0.60 -4.94 120.40 116.92 1mpa s VAL 18 Ca 0.05 -0.51 -0.08 0.00 -1.81 0.00 0.00 61.98 59.63 1mpa s VAL 18 Cb -0.12 -2.87 0.06 0.00 0.56 0.00 0.00 36.38 34.01 1mpa s VAL 18 CO -0.05 0.00 0.37 -0.60 -0.31 0.00 0.00 175.10 174.52 1mpa s ARG 19 N -5.05 0.33 0.20 4.82 3.52 -1.26 -2.64 118.95 118.86 1mpa s ARG 19 Ca 0.61 0.80 0.08 0.00 -0.13 0.00 0.00 55.73 57.09 1mpa s ARG 19 Cb -0.09 0.03 -0.05 0.00 -1.56 0.00 0.00 34.95 33.29 1mpa s ARG 19 CO 0.42 -0.19 -0.15 0.00 -0.81 0.00 0.00 175.30 174.58 1mpa s MET 20 N 1.73 1.30 0.32 5.12 0.23 0.14 -4.97 119.30 123.17 1mpa s MET 20 Ca -0.07 -1.55 0.06 0.00 -1.03 0.00 0.00 55.69 53.10 1mpa s MET 20 Cb -0.10 -1.12 -0.06 0.00 -1.53 0.00 0.00 34.83 32.02 1mpa s MET 20 CO -0.12 0.19 -0.01 -1.54 -2.03 0.00 0.00 175.02 171.52 1mpa s SER 21 N -3.21 2.84 -0.25 -1.18 1.04 -1.26 -0.63 113.70 111.04 1mpa s SER 21 Ca 0.21 -1.29 -0.03 0.00 0.48 0.00 0.00 55.95 55.32 1mpa s SER 21 Cb -0.01 -0.18 0.14 0.00 0.10 0.00 0.00 66.02 66.07 1mpa s SER 21 CO 0.06 -0.45 0.44 0.00 0.98 0.00 0.00 173.24 174.28 1mpa s LYS 23 N 2.64 3.99 0.07 0.00 3.01 0.11 -1.41 119.74 128.14 1mpa s LYS 23 Ca 0.12 -0.12 0.01 0.00 -1.01 0.00 0.00 55.97 54.97 1mpa s LYS 23 Cb -0.15 -3.66 -0.04 0.00 -1.01 0.00 0.00 37.83 32.98 1mpa s LYS 23 CO -0.17 -0.23 0.18 0.00 0.51 0.00 0.00 175.35 175.64 1mpa s ALA 24 N 1.92 3.90 -0.21 5.17 0.00 -0.50 -1.68 121.76 130.36 1mpa s ALA 24 Ca 0.11 -0.89 -0.27 0.00 0.00 0.00 0.00 51.96 50.92 1mpa s ALA 24 Cb -0.16 -1.73 0.08 0.00 0.00 0.00 0.00 23.12 21.31 1mpa s ALA 24 CO 0.10 0.81 0.76 -1.54 0.00 0.00 0.00 175.76 175.89 1mpa s SER 25 N -2.49 -0.68 0.00 0.00 1.04 -1.02 -4.86 113.70 105.69 1mpa s SER 25 Ca 0.34 1.16 0.00 0.00 0.48 0.00 0.00 55.95 57.92 1mpa s SER 25 Cb -0.13 1.12 0.00 0.00 0.10 0.00 0.00 66.02 67.11 1mpa s SER 25 CO 0.27 -0.33 0.00 0.61 0.98 0.00 0.00 173.24 174.76 1mpa n GLY 26 N 2.11 0.87 3.63 7.32 0.00 -1.26 -1.30 105.19 116.55 1mpa n GLY 26 Ca -0.15 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 1mpa n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mpa s TYR 27 N -2.00 0.30 -1.03 1.61 -0.85 -1.26 -4.46 117.35 109.66 1mpa s TYR 27 Ca 0.00 -0.68 -0.22 0.00 -0.52 0.00 0.00 57.07 55.65 1mpa s TYR 27 Cb 0.00 0.28 0.06 0.00 0.38 0.00 0.00 41.96 42.67 1mpa s TYR 27 CO 0.00 -1.05 1.44 -1.12 -1.52 0.00 0.00 175.55 173.30 1mpa s SER 28 N -3.01 6.53 0.50 -0.18 0.01 -1.26 -4.84 113.70 111.45 1mpa s SER 28 Ca 0.21 -1.56 0.40 0.00 1.31 0.00 0.00 55.95 56.31 1mpa s SER 28 Cb -0.02 -2.56 1.59 0.00 0.21 0.00 0.00 66.02 65.24 1mpa s SER 28 CO 0.09 -1.45 1.61 0.15 0.41 0.00 0.00 173.24 174.05 1mpa h PHE 29 N 9.58 0.26 0.00 2.43 3.57 -1.94 0.44 116.94 131.28 1mpa h PHE 29 Ca 0.21 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.72 1mpa h PHE 29 Cb 1.00 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.68 1mpa h PHE 29 CO 1.28 -0.12 0.00 1.79 -2.23 0.00 0.00 178.31 179.03 1mpa h THR 30 N 0.03 0.00 0.00 4.41 1.35 -1.94 -3.38 112.91 113.38 1mpa h THR 30 Ca 0.87 -0.84 0.00 0.00 -0.55 0.00 0.00 66.41 65.89 1mpa h THR 30 Cb 3.13 1.84 0.00 0.00 -1.73 0.00 0.00 68.15 71.38 1mpa h THR 30 CO -0.22 0.00 -0.86 0.28 -0.25 0.00 0.00 175.52 174.47 1mpa h SER 31 N 0.00 0.00 -2.55 5.36 0.02 -0.52 -2.87 113.55 112.99 1mpa h SER 31 Ca 0.00 -0.07 -0.54 0.00 -0.84 0.00 0.00 61.79 60.33 1mpa h SER 31 Cb 0.90 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.30 1mpa h SER 31 CO 0.00 0.04 -0.60 -0.31 -1.14 0.00 0.00 176.83 174.81 1mpa s TYR 32 N -3.30 2.21 0.20 3.45 1.51 -1.25 -5.05 117.35 115.12 1mpa s TYR 32 Ca 0.02 -0.83 -0.16 0.00 -1.01 0.00 0.00 57.07 55.08 1mpa s TYR 32 Cb 0.11 -1.50 -0.08 0.00 -0.11 0.00 0.00 41.96 40.38 1mpa s TYR 32 CO 0.77 0.20 0.64 -1.58 -1.11 0.00 0.00 175.55 174.48 1mpa s TRP 33 N -3.04 3.59 -0.11 2.71 0.52 -1.26 -4.26 118.94 117.10 1mpa s TRP 33 Ca 0.36 1.21 0.01 0.00 0.02 0.00 0.00 56.10 57.70 1mpa s TRP 33 Cb 0.09 -2.49 -0.02 0.00 -1.15 0.00 0.00 33.47 29.91 1mpa s TRP 33 CO 0.17 0.35 -0.15 -1.17 0.02 0.00 0.00 176.95 176.16 1mpa s LEU 34 N -2.11 2.62 0.04 2.99 2.96 -0.77 -4.67 118.68 119.75 1mpa s LEU 34 Ca 0.42 -0.33 0.02 0.00 -0.22 0.00 0.00 54.13 54.01 1mpa s LEU 34 Cb -0.15 -1.56 -0.04 0.00 0.50 0.00 0.00 46.19 44.94 1mpa s LEU 34 CO 0.20 0.21 0.08 -1.00 -1.32 0.00 0.00 176.35 174.51 1mpa s HIS 35 N 0.09 3.23 -0.14 5.38 3.76 0.38 -1.40 115.29 126.60 1mpa s HIS 35 Ca -0.07 0.13 0.00 0.00 -0.15 0.00 0.00 55.06 54.98 1mpa s HIS 35 Cb -0.15 -1.67 -0.01 0.00 1.11 0.00 0.00 32.58 31.86 1mpa s HIS 35 CO 0.05 0.53 -0.15 -1.58 -0.85 0.00 0.00 174.74 172.74 1mpa s TRP 36 N -1.30 2.77 0.02 1.40 0.52 -0.30 0.74 118.94 122.79 1mpa s TRP 36 Ca 0.26 -0.82 0.04 0.00 0.02 0.00 0.00 56.10 55.61 1mpa s TRP 36 Cb -0.12 -1.85 -0.02 0.00 -1.15 0.00 0.00 33.47 30.33 1mpa s TRP 36 CO 0.18 -0.33 -0.14 0.42 0.02 0.00 0.00 176.95 177.11 1mpa s ILE 37 N 0.52 1.07 -0.18 2.03 1.01 -0.52 -1.08 121.20 124.06 1mpa s ILE 37 Ca -0.10 -0.82 -0.02 0.00 0.00 0.00 0.00 60.65 59.71 1mpa s ILE 37 Cb -0.16 -0.94 -0.01 0.00 0.01 0.00 0.00 42.46 41.36 1mpa s ILE 37 CO 0.04 0.12 -0.09 -0.75 0.00 0.00 0.00 174.94 174.26 1mpa s LYS 38 N -0.80 3.38 -0.56 2.79 2.20 -0.32 -0.50 119.74 125.93 1mpa s LYS 38 Ca 0.03 -0.65 0.00 0.00 -0.36 0.00 0.00 55.97 54.99 1mpa s LYS 38 Cb -0.07 -2.82 0.14 0.00 -1.51 0.00 0.00 37.83 33.57 1mpa s LYS 38 CO 0.01 -0.00 0.33 -1.14 -0.36 0.00 0.00 175.35 174.19 1mpa s GLN 39 N 0.93 2.24 0.40 4.03 0.74 0.57 -1.71 119.66 126.86 1mpa s GLN 39 Ca -0.02 -2.50 -0.27 0.00 0.05 0.00 0.00 55.36 52.62 1mpa s GLN 39 Cb -0.15 -3.53 -0.10 0.00 1.10 0.00 0.00 33.01 30.33 1mpa s GLN 39 CO -0.00 -1.13 1.47 -2.13 -0.55 0.00 0.00 175.29 172.95 1mpa n ARG 40 N 3.42 2.55 -0.59 1.67 3.00 -1.26 -1.96 116.66 123.50 1mpa n ARG 40 Ca 0.06 0.90 0.44 0.00 -0.00 0.00 0.00 57.85 59.25 1mpa n ARG 40 Cb 0.36 -2.66 0.68 0.00 0.00 0.00 0.00 32.46 30.84 1mpa n ARG 40 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 1mpa n PRO 41 N 0.24 -0.00 -1.51 -0.14 -0.02 -1.26 -2.78 135.00 129.53 1mpa n PRO 41 Ca 0.02 0.90 -0.41 0.00 -2.02 0.00 0.00 63.50 61.99 1mpa n PRO 41 Cb 0.40 -2.07 -0.02 0.00 -0.02 0.00 0.00 33.50 31.79 1mpa n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mpa n GLY 42 N -1.75 4.02 4.51 -1.23 0.00 -1.26 -4.88 105.19 104.60 1mpa n GLY 42 Ca 0.37 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1mpa n GLY 42 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1mpa n GLN 43 N 5.73 0.00 -1.02 1.61 -0.06 -1.12 -4.87 117.38 117.64 1mpa n GLN 43 Ca 0.56 0.00 -0.40 0.00 -2.00 0.00 0.00 57.00 55.16 1mpa n GLN 43 Cb 0.35 0.00 -0.06 0.00 -4.06 0.00 0.00 30.24 26.48 1mpa n GLN 43 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1mpa n GLY 44 N 0.00 -0.07 3.76 1.69 0.00 -1.26 -4.71 105.19 104.59 1mpa n GLY 44 Ca 0.00 0.55 -0.38 0.00 0.00 0.00 0.00 46.02 46.18 1mpa n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mpa s LEU 45 N 0.70 4.38 -0.04 0.99 1.43 -1.26 -3.98 118.68 120.89 1mpa s LEU 45 Ca 0.62 1.01 -0.00 0.00 -1.03 0.00 0.00 54.13 54.73 1mpa s LEU 45 Cb -0.87 -2.79 0.03 0.00 0.03 0.00 0.00 46.19 42.58 1mpa s LEU 45 CO 0.42 0.10 0.00 -1.83 0.23 0.00 0.00 176.35 175.28 1mpa s GLU 46 N -0.06 0.41 0.14 1.70 -1.05 -0.69 -5.00 118.70 114.14 1mpa s GLU 46 Ca 0.28 0.09 -0.31 0.00 -0.15 0.00 0.00 54.97 54.89 1mpa s GLU 46 Cb -0.17 -0.65 -0.08 0.00 -0.44 0.00 0.00 34.13 32.79 1mpa s GLU 46 CO 0.14 -0.19 1.33 -0.46 0.95 0.00 0.00 175.26 177.04 1mpa s TRP 47 N 1.35 3.28 -0.26 4.83 -0.00 -1.26 -1.17 118.94 125.71 1mpa s TRP 47 Ca -0.05 1.10 -0.16 0.00 -0.00 0.00 0.00 56.10 56.99 1mpa s TRP 47 Cb -0.13 -3.62 -0.13 0.00 -0.00 0.00 0.00 33.47 29.59 1mpa s TRP 47 CO -0.02 -2.05 -0.25 -0.89 -0.00 0.00 0.00 176.95 173.74 1mpa n ILE 48 N 3.47 1.53 -4.00 5.86 5.41 -0.24 -4.78 119.36 126.61 1mpa n ILE 48 Ca 0.09 -0.28 0.03 0.00 1.00 0.00 0.00 62.75 63.59 1mpa n ILE 48 Cb 0.43 -1.95 0.01 0.00 -0.71 0.00 0.00 39.64 37.42 1mpa n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1mpa n GLY 49 N 1.30 0.25 3.32 7.39 0.00 -1.21 -1.75 105.19 114.49 1mpa n GLY 49 Ca -0.47 -0.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.49 1mpa n GLY 49 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mpa s GLY 50 N -3.61 0.09 -0.02 -0.02 0.00 -0.03 -1.15 107.32 102.58 1mpa s GLY 50 Ca 0.22 -0.49 -0.02 0.00 0.00 0.00 0.00 44.72 44.43 1mpa s GLY 50 CO -0.01 -0.60 0.06 -1.50 0.00 0.00 0.00 173.10 171.05 1mpa s ILE 51 N -3.88 0.02 -0.52 0.90 2.07 -0.49 -1.75 121.20 117.55 1mpa s ILE 51 Ca 0.09 -0.13 -0.15 0.00 -1.41 0.00 0.00 60.65 59.05 1mpa s ILE 51 Cb 0.03 -0.14 0.11 0.00 0.13 0.00 0.00 42.46 42.59 1mpa s ILE 51 CO -0.07 -0.07 0.46 -0.47 -1.91 0.00 0.00 174.94 172.89 1mpa s TYR 52 N -0.19 3.26 0.16 3.50 5.04 0.12 -1.85 117.35 127.39 1mpa s TYR 52 Ca -0.02 -1.22 -0.21 0.00 -2.44 0.00 0.00 57.07 53.17 1mpa s TYR 52 Cb -0.02 -3.60 0.07 0.00 0.35 0.00 0.00 41.96 38.76 1mpa s TYR 52 CO 0.00 -0.96 1.62 -1.35 -1.34 0.00 0.00 175.55 173.52 1mpa h PRO 53 N 8.83 -0.21 -0.90 4.97 0.11 -1.77 0.51 132.00 143.55 1mpa h PRO 53 Ca -0.29 0.01 0.16 0.00 0.11 0.00 0.00 66.00 65.99 1mpa h PRO 53 Cb 1.10 0.05 -0.16 0.00 0.11 0.00 0.00 31.00 32.10 1mpa h PRO 53 CO 0.98 -0.14 -0.29 0.41 -0.21 0.00 0.00 178.00 178.75 1mpa n GLY 54 N -1.40 -1.69 0.17 -0.55 0.00 -1.08 -1.58 105.19 99.06 1mpa n GLY 54 Ca 0.01 0.98 0.02 0.00 0.00 0.00 0.00 46.02 47.04 1mpa n GLY 54 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1mpa n ASN 55 N -5.39 2.29 -2.00 1.61 0.23 -1.14 -5.00 115.26 105.87 1mpa n ASN 55 Ca 0.12 -2.13 -0.20 0.00 -0.53 0.00 0.00 54.58 51.83 1mpa n ASN 55 Cb 0.40 -0.11 -0.05 0.00 -2.08 0.00 0.00 39.78 37.95 1mpa n ASN 55 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1mpa n ARG 56 N -0.37 -1.59 -2.88 -3.83 3.00 0.18 -4.96 116.66 106.22 1mpa n ARG 56 Ca 0.05 1.09 -0.41 0.00 -0.01 0.00 0.00 57.85 58.57 1mpa n ARG 56 Cb 0.34 -5.61 -0.04 0.00 0.00 0.00 0.00 32.46 27.15 1mpa n ARG 56 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1mpa s ASP 57 N -2.38 7.26 0.46 0.55 2.15 -1.05 -4.82 116.67 118.85 1mpa s ASP 57 Ca 0.00 1.51 0.06 0.00 0.43 0.00 0.00 52.55 54.55 1mpa s ASP 57 Cb 0.00 -2.50 -0.02 0.00 -0.30 0.00 0.00 42.92 40.10 1mpa s ASP 57 CO 0.00 -0.10 0.23 0.42 -0.17 0.00 0.00 175.17 175.55 1mpa s THR 58 N 0.41 1.98 -0.23 1.71 -4.23 -1.26 0.11 115.64 114.13 1mpa s THR 58 Ca 0.43 -1.66 -0.15 0.00 -1.18 0.00 0.00 61.69 59.14 1mpa s THR 58 Cb -0.21 -2.64 0.07 0.00 1.34 0.00 0.00 72.50 71.06 1mpa s THR 58 CO 0.24 0.00 0.57 -0.60 -0.54 0.00 0.00 174.62 174.30 1mpa s ARG 59 N -4.02 0.59 0.02 3.99 6.06 -0.72 -4.99 118.95 119.89 1mpa s ARG 59 Ca 0.34 0.99 -0.00 0.00 -2.50 0.00 0.00 55.73 54.56 1mpa s ARG 59 Cb 0.01 0.12 -0.02 0.00 0.06 0.00 0.00 34.95 35.13 1mpa s ARG 59 CO 0.20 -0.14 -0.03 0.71 -2.50 0.00 0.00 175.30 173.54 1mpa s TYR 60 N 1.28 0.28 0.58 5.12 1.51 -1.26 -0.85 117.35 124.00 1mpa s TYR 60 Ca -0.08 -0.57 -0.14 0.00 -1.01 0.00 0.00 57.07 55.28 1mpa s TYR 60 Cb -0.06 -0.20 -0.05 0.00 -0.11 0.00 0.00 41.96 41.54 1mpa s TYR 60 CO -0.13 -0.20 1.02 0.95 -1.11 0.00 0.00 175.55 176.07 1mpa s THR 61 N -1.63 4.46 0.38 -0.71 -4.23 -0.72 -4.87 115.64 108.33 1mpa s THR 61 Ca -0.14 1.00 0.17 0.00 -1.18 0.00 0.00 61.69 61.54 1mpa s THR 61 Cb -0.09 -3.70 0.38 0.00 1.34 0.00 0.00 72.50 70.43 1mpa s THR 61 CO -0.02 -0.85 1.75 1.56 -0.54 0.00 0.00 174.62 176.53 1mpa h GLN 62 N 0.26 0.41 0.53 3.99 1.08 -1.98 -2.48 115.11 116.92 1mpa h GLN 62 Ca -0.46 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 56.69 1mpa h GLN 62 Cb 1.19 -0.09 0.01 0.00 -0.05 0.00 0.00 27.48 28.54 1mpa h GLN 62 CO 0.61 0.27 -0.25 -0.09 -0.95 0.00 0.00 178.83 178.41 1mpa h ARG 63 N 0.42 -0.68 0.00 1.46 2.43 -1.95 -3.07 114.38 112.98 1mpa h ARG 63 Ca 0.62 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.84 1mpa h ARG 63 Cb 1.50 0.16 0.00 0.00 -0.42 0.00 0.00 29.97 31.21 1mpa h ARG 63 CO -0.35 -0.46 0.00 1.19 -1.51 0.00 0.00 179.97 178.85 1mpa n PHE 64 N -4.23 0.00 -0.28 2.20 3.72 -1.14 -3.85 117.46 113.88 1mpa n PHE 64 Ca -0.09 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.36 1mpa n PHE 64 Cb 0.28 0.00 0.19 0.00 -0.94 0.00 0.00 39.48 39.01 1mpa n PHE 64 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1mpa h LYS 65 N 0.00 0.65 -0.42 -1.08 3.64 -1.34 -0.84 116.57 117.19 1mpa h LYS 65 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1mpa h LYS 65 Cb 0.00 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1mpa h LYS 65 CO 0.00 0.43 0.00 -0.25 -2.27 0.00 0.00 179.45 177.36 1mpa n ASP 66 N -4.83 3.12 -0.04 4.20 9.92 -1.25 -4.43 116.55 123.23 1mpa n ASP 66 Ca 0.15 -1.98 0.04 0.00 -0.53 0.00 0.00 54.79 52.47 1mpa n ASP 66 Cb 0.35 -0.28 -0.03 0.00 -0.64 0.00 0.00 41.12 40.52 1mpa n ASP 66 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1mpa n LYS 67 N 0.78 3.94 -3.92 -1.24 3.00 -0.60 -4.82 118.16 115.30 1mpa n LYS 67 Ca 0.14 -0.13 -0.10 0.00 -0.00 0.00 0.00 58.31 58.22 1mpa n LYS 67 Cb 0.47 -0.90 -0.12 0.00 0.00 0.00 0.00 35.03 34.48 1mpa n LYS 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1mpa s ALA 68 N -1.58 0.01 -0.16 3.14 0.00 -0.42 -2.46 121.76 120.29 1mpa s ALA 68 Ca 0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 51.96 51.71 1mpa s ALA 68 Cb 0.06 0.07 0.05 0.00 0.00 0.00 0.00 23.12 23.29 1mpa s ALA 68 CO 0.28 -0.10 0.02 0.21 0.00 0.00 0.00 175.76 176.17 1mpa s LYS 69 N -0.81 0.74 0.20 0.00 2.20 -0.92 -4.85 119.74 116.30 1mpa s LYS 69 Ca -0.09 -0.29 -0.09 0.00 -0.36 0.00 0.00 55.97 55.14 1mpa s LYS 69 Cb -0.05 -1.80 -0.07 0.00 -1.51 0.00 0.00 37.83 34.40 1mpa s LYS 69 CO -0.00 -0.53 0.51 -0.51 -0.36 0.00 0.00 175.35 174.46 1mpa s LEU 70 N 1.86 4.21 0.04 5.43 1.43 -1.26 -2.45 118.68 127.94 1mpa s LEU 70 Ca 0.01 0.86 -0.26 0.00 -1.03 0.00 0.00 54.13 53.71 1mpa s LEU 70 Cb -0.16 -3.56 0.06 0.00 0.03 0.00 0.00 46.19 42.57 1mpa s LEU 70 CO -0.07 -0.03 0.61 -0.89 0.23 0.00 0.00 176.35 176.20 1mpa s THR 71 N -1.74 0.01 -0.03 5.49 2.01 -0.72 -5.00 115.64 115.66 1mpa s THR 71 Ca 0.45 -0.07 -0.10 0.00 0.31 0.00 0.00 61.69 62.28 1mpa s THR 71 Cb -0.12 -0.99 0.01 0.00 0.01 0.00 0.00 72.50 71.42 1mpa s THR 71 CO 0.21 -0.04 0.22 0.00 -0.69 0.00 0.00 174.62 174.32 1mpa s ALA 72 N -2.32 -0.53 -0.42 7.40 0.00 -1.26 0.70 121.76 125.32 1mpa s ALA 72 Ca -0.06 0.22 -0.00 0.00 0.00 0.00 0.00 51.96 52.12 1mpa s ALA 72 Cb -0.01 -0.03 0.12 0.00 0.00 0.00 0.00 23.12 23.20 1mpa s ALA 72 CO -0.00 -0.20 0.19 0.08 0.00 0.00 0.00 175.76 175.83 1mpa s VAL 73 N -0.96 2.99 0.27 0.00 1.01 0.11 -4.98 120.40 118.83 1mpa s VAL 73 Ca -0.10 -2.36 -0.03 0.00 0.00 0.00 0.00 61.98 59.49 1mpa s VAL 73 Cb -0.05 -3.07 0.18 0.00 0.00 0.00 0.00 36.38 33.43 1mpa s VAL 73 CO 0.02 -0.70 1.85 0.71 0.00 0.00 0.00 175.10 176.98 1mpa h THR 74 N 6.23 1.23 0.00 3.92 1.35 -1.91 0.97 112.91 124.70 1mpa h THR 74 Ca -0.09 -0.72 -0.00 0.00 -0.55 0.00 0.00 66.41 65.05 1mpa h THR 74 Cb 1.01 0.44 -0.00 0.00 -1.73 0.00 0.00 68.15 67.87 1mpa h THR 74 CO 0.65 0.29 -0.00 0.77 -0.25 0.00 0.00 175.52 176.98 1mpa h SER 75 N 0.96 0.00 -0.14 5.36 4.64 -1.96 -2.45 113.55 119.95 1mpa h SER 75 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 1mpa h SER 75 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1mpa h SER 75 CO -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.94 1mpa n ALA 76 N -2.09 2.36 -4.13 5.18 0.00 -0.62 -4.99 120.51 116.21 1mpa n ALA 76 Ca -0.01 -0.80 -0.35 0.00 0.00 0.00 0.00 53.44 52.28 1mpa n ALA 76 Cb 0.22 -0.40 -0.02 0.00 0.00 0.00 0.00 19.45 19.26 1mpa n ALA 76 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1mpa n ASN 77 N 0.58 -3.59 -3.97 0.00 4.13 0.24 -4.83 115.26 107.82 1mpa n ASN 77 Ca 0.08 -0.94 -0.25 0.00 1.68 0.00 0.00 54.58 55.16 1mpa n ASN 77 Cb 0.33 -2.93 -0.17 0.00 -1.54 0.00 0.00 39.78 35.48 1mpa n ASN 77 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1mpa s THR 78 N -3.25 1.02 0.06 3.41 2.01 -0.73 -1.41 115.64 116.75 1mpa s THR 78 Ca 0.72 -0.37 0.02 0.00 0.31 0.00 0.00 61.69 62.38 1mpa s THR 78 Cb -0.39 -0.98 -0.04 0.00 0.01 0.00 0.00 72.50 71.10 1mpa s THR 78 CO 0.89 0.34 0.08 0.00 -0.69 0.00 0.00 174.62 175.25 1mpa s ALA 79 N 1.06 3.59 -0.06 7.40 0.00 -0.50 0.04 121.76 133.28 1mpa s ALA 79 Ca -0.07 -0.97 0.04 0.00 0.00 0.00 0.00 51.96 50.96 1mpa s ALA 79 Cb -0.14 -1.48 -0.00 0.00 0.00 0.00 0.00 23.12 21.49 1mpa s ALA 79 CO -0.01 0.74 -0.19 0.71 0.00 0.00 0.00 175.76 177.01 1mpa s TYR 80 N -1.35 1.98 -0.04 0.00 2.02 0.22 -1.18 117.35 118.99 1mpa s TYR 80 Ca 0.28 -0.66 0.05 0.00 -0.37 0.00 0.00 57.07 56.37 1mpa s TYR 80 Cb -0.12 -1.34 -0.02 0.00 -0.40 0.00 0.00 41.96 40.08 1mpa s TYR 80 CO 0.20 -0.25 -0.19 1.41 -1.57 0.00 0.00 175.55 175.15 1mpa s MET 81 N 0.19 2.41 -0.17 -0.62 -2.45 0.19 -1.75 119.30 117.09 1mpa s MET 81 Ca -0.09 -0.79 -0.01 0.00 -1.25 0.00 0.00 55.69 53.55 1mpa s MET 81 Cb -0.14 -2.26 0.05 0.00 1.25 0.00 0.00 34.83 33.73 1mpa s MET 81 CO 0.04 0.57 -0.02 -2.00 1.05 0.00 0.00 175.02 174.66 1mpa s GLU 82 N -0.60 1.16 -0.19 4.11 2.12 -1.03 0.26 118.70 124.53 1mpa s GLU 82 Ca 0.09 -0.49 -0.17 0.00 0.36 0.00 0.00 54.97 54.77 1mpa s GLU 82 Cb -0.11 -2.01 -0.04 0.00 0.26 0.00 0.00 34.13 32.24 1mpa s GLU 82 CO 0.00 -0.50 0.43 -0.51 -0.54 0.00 0.00 175.26 174.14 1mpa s LEU 83 N 1.70 4.17 0.54 2.70 1.43 -1.08 -2.15 118.68 125.98 1mpa s LEU 83 Ca -0.00 0.58 0.07 0.00 -1.03 0.00 0.00 54.13 53.75 1mpa s LEU 83 Cb -0.16 -2.57 0.06 0.00 0.03 0.00 0.00 46.19 43.55 1mpa s LEU 83 CO -0.07 -0.09 0.74 -0.44 0.23 0.00 0.00 176.35 176.72 1mpa s SER 84 N 1.00 5.22 -0.28 2.29 0.01 -1.03 -1.55 113.70 119.36 1mpa s SER 84 Ca 0.21 -0.56 -0.05 0.00 1.31 0.00 0.00 55.95 56.86 1mpa s SER 84 Cb -0.15 -0.18 0.01 0.00 0.21 0.00 0.00 66.02 65.91 1mpa s SER 84 CO 0.08 -1.19 0.17 -1.20 0.41 0.00 0.00 173.24 171.52 1mpa n SER 85 N -2.19 -1.20 -4.61 2.44 7.64 -1.11 -4.81 113.62 109.78 1mpa n SER 85 Ca 0.12 -0.32 -0.33 0.00 1.01 0.00 0.00 58.87 59.36 1mpa n SER 85 Cb 0.60 -0.43 0.13 0.00 -1.01 0.00 0.00 64.21 63.51 1mpa n SER 85 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1mpa n LEU 86 N -1.59 2.83 0.00 -3.43 4.77 -0.21 -4.63 117.00 114.73 1mpa n LEU 86 Ca -0.06 0.49 -0.04 0.00 -0.03 0.00 0.00 56.01 56.37 1mpa n LEU 86 Cb 0.17 -1.41 -0.01 0.00 -2.33 0.00 0.00 43.42 39.84 1mpa n LEU 86 CO 0.19 -2.36 0.08 0.35 -1.33 0.00 0.00 177.39 174.33 1mpa n THR 87 N -3.54 0.00 -0.10 -5.08 -2.24 -1.26 -1.02 114.28 101.04 1mpa n THR 87 Ca 0.11 -0.52 -0.08 0.00 -2.27 0.00 0.00 64.05 61.29 1mpa n THR 87 Cb 0.51 0.35 0.07 0.00 -2.10 0.00 0.00 70.33 69.17 1mpa n THR 87 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 1mpa h ASN 88 N 0.65 0.83 -0.09 3.42 -0.00 -1.97 -2.83 115.58 115.59 1mpa h ASN 88 Ca -0.09 -0.30 -0.05 0.00 -0.00 0.00 0.00 56.30 55.86 1mpa h ASN 88 Cb 0.39 -0.23 -0.01 0.00 -0.00 0.00 0.00 38.32 38.47 1mpa h ASN 88 CO 0.13 1.03 -0.06 -0.33 -0.00 0.00 0.00 177.43 178.19 1mpa h GLU 89 N 0.70 0.35 0.00 6.67 3.07 -1.97 -1.76 114.58 121.65 1mpa h GLU 89 Ca 0.09 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1mpa h GLU 89 Cb 0.76 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.61 1mpa h GLU 89 CO 0.06 0.43 0.00 -0.25 -1.40 0.00 0.00 179.01 177.85 1mpa n ASP 90 N -4.29 0.00 -4.60 1.42 8.00 -1.07 -4.49 116.55 111.53 1mpa n ASP 90 Ca 0.00 -0.14 -0.42 0.00 0.71 0.00 0.00 54.79 54.94 1mpa n ASP 90 Cb 0.25 -0.03 -0.05 0.00 -0.02 0.00 0.00 41.12 41.27 1mpa n ASP 90 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1mpa s SER 91 N -2.05 6.60 0.04 -2.24 0.01 -0.66 -4.88 113.70 110.52 1mpa s SER 91 Ca 0.08 0.48 -0.06 0.00 1.31 0.00 0.00 55.95 57.77 1mpa s SER 91 Cb 0.04 -2.41 0.02 0.00 0.21 0.00 0.00 66.02 63.88 1mpa s SER 91 CO 0.07 -0.70 0.29 0.00 0.41 0.00 0.00 173.24 173.30 1mpa n ALA 92 N 6.38 -0.77 -3.13 1.44 0.00 -1.26 -4.64 120.51 118.54 1mpa n ALA 92 Ca 0.04 -0.27 -0.33 0.00 0.00 0.00 0.00 53.44 52.88 1mpa n ALA 92 Cb 0.48 0.14 -0.14 0.00 0.00 0.00 0.00 19.45 19.92 1mpa n ALA 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1mpa s VAL 93 N -2.38 3.03 -0.19 0.00 0.11 -0.83 -2.43 120.40 117.71 1mpa s VAL 93 Ca 0.07 -0.66 -0.06 0.00 -2.93 0.00 0.00 61.98 58.39 1mpa s VAL 93 Cb -0.01 -2.28 -0.04 0.00 -1.53 0.00 0.00 36.38 32.53 1mpa s VAL 93 CO 0.01 0.52 0.04 -0.31 -3.33 0.00 0.00 175.10 172.03 1mpa s TYR 94 N 0.44 3.17 0.25 1.54 1.51 -1.21 -0.32 117.35 122.72 1mpa s TYR 94 Ca -0.10 -0.10 0.09 0.00 -1.01 0.00 0.00 57.07 55.95 1mpa s TYR 94 Cb -0.16 -2.08 -0.04 0.00 -0.11 0.00 0.00 41.96 39.57 1mpa s TYR 94 CO 0.05 0.02 0.01 0.71 -1.11 0.00 0.00 175.55 175.23 1mpa s TYR 95 N 0.58 2.75 -0.03 2.71 1.51 0.34 -0.65 117.35 124.56 1mpa s TYR 95 Ca 0.02 -0.20 0.06 0.00 -1.01 0.00 0.00 57.07 55.93 1mpa s TYR 95 Cb -0.13 -1.24 -0.02 0.00 -0.11 0.00 0.00 41.96 40.45 1mpa s TYR 95 CO 0.02 0.59 -0.20 0.00 -1.11 0.00 0.00 175.55 174.85 1mpa s SER 97 N -0.73 0.74 -0.08 0.00 0.15 0.23 -0.39 113.70 113.61 1mpa s SER 97 Ca 0.11 -0.50 -0.01 0.00 0.70 0.00 0.00 55.95 56.26 1mpa s SER 97 Cb -0.10 0.04 0.03 0.00 -1.71 0.00 0.00 66.02 64.27 1mpa s SER 97 CO 0.00 -0.19 -0.04 -0.51 1.20 0.00 0.00 173.24 173.70 1mpa s ILE 98 N -1.27 0.65 0.08 6.45 1.10 -0.51 -0.47 121.20 127.24 1mpa s ILE 98 Ca -0.10 -0.07 0.09 0.00 -0.51 0.00 0.00 60.65 60.06 1mpa s ILE 98 Cb -0.09 -0.74 -0.03 0.00 0.15 0.00 0.00 42.46 41.75 1mpa s ILE 98 CO 0.00 0.30 -0.24 0.27 -2.11 0.00 0.00 174.94 173.16 1mpa s ILE 99 N 1.72 1.94 -0.30 2.00 -4.36 -1.24 -1.34 121.20 119.62 1mpa s ILE 99 Ca 0.03 -1.48 -0.13 0.00 -0.26 0.00 0.00 60.65 58.80 1mpa s ILE 99 Cb -0.13 -1.71 0.17 0.00 1.25 0.00 0.00 42.46 42.05 1mpa s ILE 99 CO -0.05 0.14 0.98 -0.47 0.24 0.00 0.00 174.94 175.78 1mpa s TYR 100 N -0.97 -0.70 -0.20 1.37 5.04 0.76 -4.91 117.35 117.75 1mpa s TYR 100 Ca 0.10 1.00 0.02 0.00 -2.44 0.00 0.00 57.07 55.75 1mpa s TYR 100 Cb -0.10 0.34 0.02 0.00 0.35 0.00 0.00 41.96 42.58 1mpa s TYR 100 CO 0.04 -0.36 0.67 1.19 -1.34 0.00 0.00 175.55 175.74 1mpa n PHE 101 N 5.16 0.02 1.98 4.97 3.72 -1.26 -0.86 117.46 131.17 1mpa n PHE 101 Ca -0.08 -0.12 0.10 0.00 -0.05 0.00 0.00 57.45 57.31 1mpa n PHE 101 Cb 0.53 -0.01 0.61 0.00 -0.94 0.00 0.00 39.48 39.67 1mpa n PHE 101 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1mpa n ASP 102 N -0.00 0.00 -3.68 4.37 8.00 -1.26 -4.68 116.55 119.29 1mpa n ASP 102 Ca 0.01 -1.34 -0.21 0.00 0.71 0.00 0.00 54.79 53.97 1mpa n ASP 102 Cb 0.10 0.00 -0.18 0.00 -0.02 0.00 0.00 41.12 41.02 1mpa n ASP 102 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1mpa s TYR 103 N -2.00 0.16 0.27 1.24 6.14 -1.26 -5.04 117.35 116.86 1mpa s TYR 103 Ca 0.31 0.14 -0.03 0.00 0.64 0.00 0.00 57.07 58.12 1mpa s TYR 103 Cb 0.14 -0.55 0.39 0.00 0.42 0.00 0.00 41.96 42.36 1mpa s TYR 103 CO 0.24 -0.24 1.93 0.00 0.64 0.00 0.00 175.55 178.11 1mpa h ALA 104 N 8.42 1.38 -0.33 3.97 0.00 -1.99 -1.89 119.26 128.82 1mpa h ALA 104 Ca -0.13 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1mpa h ALA 104 Cb 1.12 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1mpa h ALA 104 CO 0.18 0.53 0.00 -0.25 0.00 0.00 0.00 179.25 179.71 1mpa n ASP 105 N -4.43 2.24 -2.95 0.00 8.00 -1.26 -4.28 116.55 113.87 1mpa n ASP 105 Ca 0.12 -2.12 -0.14 0.00 0.71 0.00 0.00 54.79 53.37 1mpa n ASP 105 Cb 0.09 -0.33 0.02 0.00 -0.02 0.00 0.00 41.12 40.88 1mpa n ASP 105 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1mpa n PHE 106 N 0.47 -1.60 -2.96 1.24 7.35 -0.71 -5.12 117.46 116.12 1mpa n PHE 106 Ca 0.12 -2.82 -0.41 0.00 -0.76 0.00 0.00 57.45 53.58 1mpa n PHE 106 Cb 0.40 0.67 -0.04 0.00 0.35 0.00 0.00 39.48 40.86 1mpa n PHE 106 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1mpa s ILE 107 N -0.74 4.96 -0.17 -2.13 -1.09 -1.22 -4.56 121.20 116.25 1mpa s ILE 107 Ca 0.31 1.54 0.01 0.00 -2.23 0.00 0.00 60.65 60.28 1mpa s ILE 107 Cb 0.28 -4.09 0.03 0.00 -1.58 0.00 0.00 42.46 37.10 1mpa s ILE 107 CO -0.10 0.14 -0.13 -0.04 -1.23 0.00 0.00 174.94 173.58 1mpa s MET 108 N 1.47 2.19 -0.35 2.79 -1.94 -0.04 -4.99 119.30 118.43 1mpa s MET 108 Ca 0.38 -0.68 0.01 0.00 -1.71 0.00 0.00 55.69 53.69 1mpa s MET 108 Cb -0.17 -2.24 0.14 0.00 2.01 0.00 0.00 34.83 34.57 1mpa s MET 108 CO 0.16 -0.32 0.30 0.34 -0.01 0.00 0.00 175.02 175.49 1mpa s ASP 109 N 1.45 1.94 0.07 3.03 -1.08 -1.22 -0.17 116.67 120.69 1mpa s ASP 109 Ca 0.02 -1.61 0.06 0.00 -0.52 0.00 0.00 52.55 50.50 1mpa s ASP 109 Cb -0.14 0.21 -0.03 0.00 -1.46 0.00 0.00 42.92 41.50 1mpa s ASP 109 CO -0.10 -0.31 -0.16 -0.31 0.52 0.00 0.00 175.17 174.82 1mpa s TYR 110 N 1.52 1.35 0.14 -5.34 2.02 -0.45 -5.00 117.35 111.59 1mpa s TYR 110 Ca 0.16 -0.44 0.07 0.00 -0.37 0.00 0.00 57.07 56.48 1mpa s TYR 110 Cb -0.17 -0.76 -0.04 0.00 -0.40 0.00 0.00 41.96 40.59 1mpa s TYR 110 CO -0.09 0.09 -0.15 -1.58 -1.57 0.00 0.00 175.55 172.24 1mpa s TRP 111 N -1.20 1.56 0.00 2.71 0.52 -1.26 -1.42 118.94 119.85 1mpa s TRP 111 Ca 0.00 -0.53 0.00 0.00 0.02 0.00 0.00 56.10 55.59 1mpa s TRP 111 Cb -0.10 -0.79 0.00 0.00 -1.15 0.00 0.00 33.47 31.43 1mpa s TRP 111 CO 0.03 0.22 0.00 0.41 0.02 0.00 0.00 176.95 177.62 1mpa n GLY 112 N 0.39 -1.68 0.11 0.98 0.00 0.47 -4.53 105.19 100.92 1mpa n GLY 112 Ca -0.14 -1.58 0.01 0.00 0.00 0.00 0.00 46.02 44.31 1mpa n GLY 112 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1mpa h GLN 113 N 0.00 0.00 0.00 1.61 7.50 -1.91 -3.46 115.11 118.86 1mpa h GLN 113 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1mpa h GLN 113 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.53 1mpa h GLN 113 CO 0.00 0.38 0.00 0.41 -1.50 0.00 0.00 178.83 178.12 1mpa n GLY 114 N 1.33 2.67 3.08 3.46 0.00 -1.26 -5.00 105.19 109.48 1mpa n GLY 114 Ca -0.05 -1.50 -0.36 0.00 0.00 0.00 0.00 46.02 44.11 1mpa n GLY 114 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mpa s THR 115 N -0.73 3.64 0.03 2.61 2.01 0.17 -4.87 115.64 118.51 1mpa s THR 115 Ca 0.00 -3.02 -0.30 0.00 0.31 0.00 0.00 61.69 58.68 1mpa s THR 115 Cb 0.00 -3.38 -0.07 0.00 0.01 0.00 0.00 72.50 69.06 1mpa s THR 115 CO 0.00 -0.88 1.54 0.28 -0.69 0.00 0.00 174.62 174.88 1mpa s THR 116 N -0.12 3.36 0.06 -0.82 -1.32 -1.26 -3.30 115.64 112.24 1mpa s THR 116 Ca 0.17 0.76 0.03 0.00 -1.21 0.00 0.00 61.69 61.44 1mpa s THR 116 Cb -0.20 -3.49 -0.04 0.00 -1.51 0.00 0.00 72.50 67.26 1mpa s THR 116 CO -0.03 -0.01 0.03 -0.69 -2.21 0.00 0.00 174.62 171.71 1mpa s VAL 117 N 2.63 4.28 -0.13 5.08 1.01 -1.02 -1.45 120.40 130.81 1mpa s VAL 117 Ca 0.69 -0.77 -0.02 0.00 0.00 0.00 0.00 61.98 61.88 1mpa s VAL 117 Cb -0.36 -3.01 0.04 0.00 0.00 0.00 0.00 36.38 33.05 1mpa s VAL 117 CO 0.29 0.20 0.02 -0.89 0.00 0.00 0.00 175.10 174.73 1mpa s THR 118 N -1.27 0.42 -0.38 3.92 2.01 -0.26 -4.01 115.64 116.06 1mpa s THR 118 Ca 0.25 -0.17 -0.15 0.00 0.31 0.00 0.00 61.69 61.93 1mpa s THR 118 Cb -0.12 -0.75 0.01 0.00 0.01 0.00 0.00 72.50 71.65 1mpa s THR 118 CO 0.17 0.04 0.33 -0.69 -0.69 0.00 0.00 174.62 173.78 1mpa s VAL 119 N 1.93 5.21 -0.03 3.82 1.01 -1.26 -1.11 120.40 129.97 1mpa s VAL 119 Ca 0.02 -0.35 -0.27 0.00 0.00 0.00 0.00 61.98 61.39 1mpa s VAL 119 Cb -0.14 -3.88 0.06 0.00 0.00 0.00 0.00 36.38 32.41 1mpa s VAL 119 CO -0.07 -0.22 0.59 -0.55 0.00 0.00 0.00 175.10 174.85 1mpa s SER 120 N 1.73 -0.55 0.07 3.32 0.15 -0.32 -4.82 113.70 113.28 1mpa s SER 120 Ca 0.08 0.54 0.24 0.00 0.70 0.00 0.00 55.95 57.51 1mpa s SER 120 Cb -0.18 0.49 0.37 0.00 -1.71 0.00 0.00 66.02 64.99 1mpa s SER 120 CO 0.11 -0.59 1.32 -1.54 1.20 0.00 0.00 173.24 173.74 1mpa n SER 121 N 0.93 0.61 -4.32 5.45 3.41 -1.26 -4.00 113.62 114.43 1mpa n SER 121 Ca -0.19 -0.05 -0.33 0.00 -0.26 0.00 0.00 58.87 58.03 1mpa n SER 121 Cb 0.57 0.28 0.13 0.00 -0.26 0.00 0.00 64.21 64.93 1mpa n SER 121 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mpa n ALA 122 N -1.71 -3.43 -2.59 7.33 0.00 -1.26 -5.01 120.51 113.84 1mpa n ALA 122 Ca 0.04 -0.85 -0.33 0.00 0.00 0.00 0.00 53.44 52.30 1mpa n ALA 122 Cb 0.40 -1.62 -0.13 0.00 0.00 0.00 0.00 19.45 18.10 1mpa n ALA 122 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1mpa s LYS 123 N -3.38 2.68 0.60 0.00 0.00 -1.26 -5.09 119.74 113.28 1mpa s LYS 123 Ca 0.54 -0.67 -0.18 0.00 0.00 0.00 0.00 55.97 55.66 1mpa s LYS 123 Cb -0.17 -2.45 -0.06 0.00 0.00 0.00 0.00 37.83 35.15 1mpa s LYS 123 CO 0.68 0.56 0.77 2.41 0.00 0.00 0.00 175.35 179.77 1mpa n THR 124 N 2.50 3.11 -3.66 3.79 -1.04 -1.26 -4.80 114.28 112.92 1mpa n THR 124 Ca -0.17 -0.50 -0.08 0.00 -2.04 0.00 0.00 64.05 61.26 1mpa n THR 124 Cb 0.52 -0.94 -0.09 0.00 -1.82 0.00 0.00 70.33 68.01 1mpa n THR 124 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1mpa s THR 125 N -1.62 -0.61 0.62 12.58 2.01 -0.39 -4.91 115.64 123.33 1mpa s THR 125 Ca 0.73 0.13 -0.18 0.00 0.31 0.00 0.00 61.69 62.68 1mpa s THR 125 Cb -0.42 -0.71 -0.02 0.00 0.01 0.00 0.00 72.50 71.35 1mpa s THR 125 CO 0.50 0.06 1.24 0.00 -0.69 0.00 0.00 174.62 175.72 1mpa s ALA 126 N 2.49 2.46 0.57 7.40 0.00 -1.26 -2.64 121.76 130.78 1mpa s ALA 126 Ca -0.03 1.07 -0.08 0.00 0.00 0.00 0.00 51.96 52.92 1mpa s ALA 126 Cb -0.11 -3.49 -0.03 0.00 0.00 0.00 0.00 23.12 19.49 1mpa s ALA 126 CO -0.14 -1.37 0.93 -1.25 0.00 0.00 0.00 175.76 173.94 1mpa s PRO 127 N -3.39 3.43 -0.38 0.00 0.04 -1.26 -4.44 135.00 129.01 1mpa s PRO 127 Ca 0.79 0.44 -0.03 0.00 0.04 0.00 0.00 61.00 62.23 1mpa s PRO 127 Cb -0.33 -2.20 0.09 0.00 0.04 0.00 0.00 34.50 32.09 1mpa s PRO 127 CO 0.36 -0.49 0.15 -1.12 0.04 0.00 0.00 177.00 175.94 1mpa s SER 128 N -4.18 5.19 -0.40 6.66 0.01 0.87 -4.88 113.70 116.96 1mpa s SER 128 Ca 0.52 -1.74 -0.19 0.00 1.31 0.00 0.00 55.95 55.85 1mpa s SER 128 Cb -0.11 -1.81 0.01 0.00 0.21 0.00 0.00 66.02 64.33 1mpa s SER 128 CO 0.49 -0.46 0.53 -0.69 0.41 0.00 0.00 173.24 173.52 1mpa s VAL 129 N 1.20 4.98 -0.14 3.43 1.01 -1.26 -0.92 120.40 128.72 1mpa s VAL 129 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.04 1mpa s VAL 129 Cb -0.22 -4.07 -0.01 0.00 0.00 0.00 0.00 36.38 32.09 1mpa s VAL 129 CO -0.03 -0.41 -0.14 -0.31 0.00 0.00 0.00 175.10 174.21 1mpa s TYR 130 N 2.44 2.78 0.72 5.22 2.02 0.09 -4.93 117.35 125.70 1mpa s TYR 130 Ca 0.17 -0.80 -0.11 0.00 -0.37 0.00 0.00 57.07 55.96 1mpa s TYR 130 Cb -0.16 -1.85 0.03 0.00 -0.40 0.00 0.00 41.96 39.58 1mpa s TYR 130 CO 0.15 -0.32 1.08 -1.25 -1.57 0.00 0.00 175.55 173.64 1mpa s PRO 131 N 0.51 2.66 -0.12 -1.71 0.04 -1.26 -1.01 135.00 134.11 1mpa s PRO 131 Ca -0.10 1.07 -0.01 0.00 0.04 0.00 0.00 61.00 62.01 1mpa s PRO 131 Cb -0.16 -1.95 0.03 0.00 0.04 0.00 0.00 34.50 32.46 1mpa s PRO 131 CO 0.04 -1.33 -0.06 -0.51 0.04 0.00 0.00 177.00 175.19 1mpa s LEU 132 N -5.64 1.14 0.08 -3.56 1.43 0.24 -4.80 118.68 107.58 1mpa s LEU 132 Ca 0.60 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 53.38 1mpa s LEU 132 Cb -0.16 -0.77 -0.04 0.00 0.03 0.00 0.00 46.19 45.25 1mpa s LEU 132 CO 0.54 -0.15 -0.06 0.00 0.23 0.00 0.00 176.35 176.91 1mpa s ALA 133 N 1.75 0.85 0.18 4.21 0.00 -1.26 -1.20 121.76 126.29 1mpa s ALA 133 Ca 0.04 -1.27 -0.30 0.00 0.00 0.00 0.00 51.96 50.43 1mpa s ALA 133 Cb -0.13 0.17 -0.08 0.00 0.00 0.00 0.00 23.12 23.09 1mpa s ALA 133 CO -0.08 -0.25 0.99 -1.25 0.00 0.00 0.00 175.76 175.17 1mpa s PRO 134 N -3.67 4.74 0.12 0.00 0.04 -1.26 -5.01 135.00 129.94 1mpa s PRO 134 Ca 0.09 1.53 -0.30 0.00 0.04 0.00 0.00 61.00 62.36 1mpa s PRO 134 Cb 0.05 -3.31 -0.06 0.00 0.04 0.00 0.00 34.50 31.21 1mpa s PRO 134 CO -0.05 0.31 1.15 0.14 0.04 0.00 0.00 177.00 178.58 1mpa s VAL 135 N -0.56 3.96 0.00 -0.36 -7.23 -1.26 -4.23 120.40 110.72 1mpa s VAL 135 Ca 0.45 1.53 0.00 0.00 -1.81 0.00 0.00 61.98 62.15 1mpa s VAL 135 Cb -0.26 -3.98 0.00 0.00 0.56 0.00 0.00 36.38 32.71 1mpa s VAL 135 CO 0.32 0.19 0.00 0.00 -0.31 0.00 0.00 175.10 175.30 1mpa n GLY 137 N 0.00 5.62 3.45 0.00 0.00 -1.26 -4.77 105.19 108.24 1mpa n GLY 137 Ca 0.00 -2.48 -0.44 0.00 0.00 0.00 0.00 46.02 43.10 1mpa n GLY 137 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1mpa s ASP 138 N -1.40 6.68 -0.13 1.61 1.01 -1.26 -5.01 116.67 118.17 1mpa s ASP 138 Ca 0.54 -2.15 -0.02 0.00 0.71 0.00 0.00 52.55 51.63 1mpa s ASP 138 Cb 0.45 -2.40 -0.03 0.00 1.01 0.00 0.00 42.92 41.95 1mpa s ASP 138 CO -0.34 -1.03 -0.06 0.42 0.21 0.00 0.00 175.17 174.38 1mpa s THR 139 N 2.58 3.75 0.59 -1.27 -4.23 -1.26 -4.98 115.64 110.82 1mpa s THR 139 Ca 0.34 -0.42 0.29 0.00 -1.18 0.00 0.00 61.69 60.71 1mpa s THR 139 Cb -0.04 -2.61 0.37 0.00 1.34 0.00 0.00 72.50 71.56 1mpa s THR 139 CO -0.08 0.52 1.96 0.74 -0.54 0.00 0.00 174.62 177.22 1mpa h THR 140 N 4.98 0.41 0.00 3.99 2.02 -1.95 -3.46 112.91 118.89 1mpa h THR 140 Ca -0.34 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.84 1mpa h THR 140 Cb 1.19 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 1mpa h THR 140 CO 0.60 0.00 0.00 0.61 0.37 0.00 0.00 175.52 177.10 1mpa n GLY 141 N -1.48 2.87 5.00 2.16 0.00 -1.26 -4.93 105.19 107.56 1mpa n GLY 141 Ca 0.06 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.68 1mpa n GLY 141 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1mpa n SER 142 N 0.00 0.00 -4.21 1.61 7.64 -1.26 -4.87 113.62 112.54 1mpa n SER 142 Ca 0.00 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.71 1mpa n SER 142 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 1mpa n SER 142 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1mpa s SER 143 N 0.00 1.79 0.28 6.43 1.04 -1.26 -0.39 113.70 121.59 1mpa s SER 143 Ca 0.00 -0.75 0.09 0.00 0.48 0.00 0.00 55.95 55.77 1mpa s SER 143 Cb 0.00 -0.05 -0.05 0.00 0.10 0.00 0.00 66.02 66.02 1mpa s SER 143 CO 0.00 -0.15 -0.13 0.54 0.98 0.00 0.00 173.24 174.48 1mpa s VAL 144 N -1.95 2.07 -0.21 5.02 0.11 0.64 -4.11 120.40 121.98 1mpa s VAL 144 Ca 0.05 -2.25 -0.03 0.00 -2.93 0.00 0.00 61.98 56.81 1mpa s VAL 144 Cb -0.06 -2.36 0.07 0.00 -1.53 0.00 0.00 36.38 32.50 1mpa s VAL 144 CO 0.02 -0.37 0.07 -0.89 -3.33 0.00 0.00 175.10 170.59 1mpa s THR 145 N -2.75 0.32 0.69 5.04 2.01 -1.26 -2.02 115.64 117.66 1mpa s THR 145 Ca 0.29 -0.53 -0.04 0.00 0.31 0.00 0.00 61.69 61.72 1mpa s THR 145 Cb -0.00 -0.94 0.08 0.00 0.01 0.00 0.00 72.50 71.64 1mpa s THR 145 CO 0.13 -0.32 0.97 -0.76 -0.69 0.00 0.00 174.62 173.95 1mpa s LEU 146 N 1.94 2.96 0.30 4.42 2.01 -0.22 -4.77 118.68 125.32 1mpa s LEU 146 Ca 0.02 0.16 -0.12 0.00 0.01 0.00 0.00 54.13 54.20 1mpa s LEU 146 Cb -0.17 -2.77 0.01 0.00 0.01 0.00 0.00 46.19 43.27 1mpa s LEU 146 CO -0.12 -1.61 0.56 -0.83 1.01 0.00 0.00 176.35 175.35 1mpa s GLY 147 N -4.56 0.66 -0.18 -3.19 0.00 -0.34 -1.27 107.32 98.43 1mpa s GLY 147 Ca 0.62 -0.94 -0.09 0.00 0.00 0.00 0.00 44.72 44.30 1mpa s GLY 147 CO 0.44 -0.59 0.43 0.00 0.00 0.00 0.00 173.10 173.37 1mpa s LEU 149 N 1.64 3.17 -0.21 0.00 0.20 -0.18 -1.80 118.68 121.51 1mpa s LEU 149 Ca -0.08 -0.15 0.01 0.00 0.69 0.00 0.00 54.13 54.60 1mpa s LEU 149 Cb -0.09 -1.75 0.04 0.00 -0.43 0.00 0.00 46.19 43.96 1mpa s LEU 149 CO -0.13 0.18 -0.13 -0.69 -0.29 0.00 0.00 176.35 175.30 1mpa s VAL 150 N 0.26 1.84 0.10 1.68 1.01 0.21 -0.73 120.40 124.79 1mpa s VAL 150 Ca -0.04 -1.12 -0.04 0.00 0.00 0.00 0.00 61.98 60.78 1mpa s VAL 150 Cb -0.14 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.35 1mpa s VAL 150 CO 0.03 0.21 0.10 -1.59 0.00 0.00 0.00 175.10 173.86 1mpa s LYS 151 N 1.31 0.86 -0.55 2.72 -2.85 -0.09 -0.27 119.74 120.87 1mpa s LYS 151 Ca -0.01 -1.22 -0.00 0.00 -1.00 0.00 0.00 55.97 53.74 1mpa s LYS 151 Cb -0.16 0.28 0.00 0.00 -2.06 0.00 0.00 37.83 35.89 1mpa s LYS 151 CO -0.09 -0.25 0.46 0.41 0.10 0.00 0.00 175.35 175.98 1mpa n GLY 152 N -0.05 0.08 3.23 0.59 0.00 -0.31 -0.09 105.19 108.64 1mpa n GLY 152 Ca -0.10 -0.22 -0.17 0.00 0.00 0.00 0.00 46.02 45.53 1mpa n GLY 152 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mpa s TYR 153 N -3.16 1.35 -0.27 1.61 -0.85 -1.20 -4.23 117.35 110.59 1mpa s TYR 153 Ca 0.00 -0.57 -0.25 0.00 -0.52 0.00 0.00 57.07 55.74 1mpa s TYR 153 Cb -0.00 -0.71 0.08 0.00 0.38 0.00 0.00 41.96 41.71 1mpa s TYR 153 CO 0.33 0.12 0.79 0.12 -1.52 0.00 0.00 175.55 175.39 1mpa s PHE 154 N -2.19 -0.73 0.78 -3.49 5.36 -1.08 -0.02 117.98 116.61 1mpa s PHE 154 Ca 0.08 1.77 -0.12 0.00 -0.96 0.00 0.00 56.93 57.70 1mpa s PHE 154 Cb -0.05 0.30 0.06 0.00 -0.34 0.00 0.00 43.02 43.00 1mpa s PHE 154 CO 0.03 -0.35 1.15 -2.14 -1.46 0.00 0.00 175.22 172.44 1mpa s PRO 155 N 0.39 2.19 0.58 10.12 0.02 -1.26 -1.26 135.00 145.77 1mpa s PRO 155 Ca 0.00 0.24 0.40 0.00 0.02 0.00 0.00 61.00 61.65 1mpa s PRO 155 Cb -0.05 -1.96 1.43 0.00 0.02 0.00 0.00 34.50 33.93 1mpa s PRO 155 CO -0.01 -1.46 1.53 1.05 -0.33 0.00 0.00 177.00 177.77 1mpa h GLU 156 N -0.96 0.00 -6.15 5.54 9.09 -2.01 -3.44 114.58 116.64 1mpa h GLU 156 Ca -0.46 0.00 -0.57 0.00 0.05 0.00 0.00 59.36 58.38 1mpa h GLU 156 Cb 1.31 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 28.36 1mpa h GLU 156 CO 0.65 0.00 0.89 -1.25 0.05 0.00 0.00 179.01 179.35 1mpa s PRO 157 N -4.72 4.21 -0.01 1.06 0.04 -1.26 -5.02 135.00 129.30 1mpa s PRO 157 Ca -0.04 1.55 0.00 0.00 0.04 0.00 0.00 61.00 62.55 1mpa s PRO 157 Cb 0.21 -3.75 0.02 0.00 0.04 0.00 0.00 34.50 31.03 1mpa s PRO 157 CO 0.72 -0.73 0.02 0.08 0.04 0.00 0.00 177.00 177.13 1mpa s VAL 158 N 3.51 -0.03 -0.75 -0.36 1.01 -1.26 -4.62 120.40 117.90 1mpa s VAL 158 Ca 0.52 0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.57 1mpa s VAL 158 Cb -0.20 -0.07 0.20 0.00 0.00 0.00 0.00 36.38 36.31 1mpa s VAL 158 CO 0.13 0.07 0.64 -0.89 0.00 0.00 0.00 175.10 175.05 1mpa s THR 159 N 0.75 4.71 0.23 3.92 2.01 -0.85 -4.98 115.64 121.44 1mpa s THR 159 Ca -0.06 -2.82 -0.18 0.00 0.31 0.00 0.00 61.69 58.94 1mpa s THR 159 Cb -0.09 -3.96 -0.08 0.00 0.01 0.00 0.00 72.50 68.37 1mpa s THR 159 CO -0.02 -0.97 0.69 -0.22 -0.69 0.00 0.00 174.62 173.41 1mpa s LEU 160 N -0.10 4.29 0.24 4.42 1.98 -1.26 -2.77 118.68 125.48 1mpa s LEU 160 Ca 0.19 1.32 -0.15 0.00 -2.89 0.00 0.00 54.13 52.59 1mpa s LEU 160 Cb -0.14 -3.62 0.01 0.00 0.66 0.00 0.00 46.19 43.09 1mpa s LEU 160 CO -0.07 -0.00 0.54 0.28 -1.89 0.00 0.00 176.35 175.21 1mpa s THR 161 N -1.60 0.01 -0.11 3.68 -1.32 -0.29 -4.99 115.64 111.02 1mpa s THR 161 Ca 0.44 -1.20 0.01 0.00 -1.21 0.00 0.00 61.69 59.73 1mpa s THR 161 Cb -0.15 -2.03 0.02 0.00 -1.51 0.00 0.00 72.50 68.83 1mpa s THR 161 CO 0.20 -0.03 -0.11 0.26 -2.21 0.00 0.00 174.62 172.73 1mpa s TRP 162 N -3.97 1.66 -1.39 9.09 0.52 -1.26 -1.86 118.94 121.73 1mpa s TRP 162 Ca 0.17 -0.79 -0.02 0.00 0.02 0.00 0.00 56.10 55.48 1mpa s TRP 162 Cb -0.02 -1.28 0.01 0.00 -1.15 0.00 0.00 33.47 31.04 1mpa s TRP 162 CO 0.06 -0.47 0.59 0.09 0.02 0.00 0.00 176.95 177.24 1mpa n ASN 163 N 4.50 -1.12 -3.96 2.95 3.02 -0.57 -1.39 115.26 118.70 1mpa n ASN 163 Ca -0.17 -0.92 -0.29 0.00 -0.03 0.00 0.00 54.58 53.17 1mpa n ASN 163 Cb 0.51 -3.49 0.00 0.00 -0.61 0.00 0.00 39.78 36.19 1mpa n ASN 163 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1mpa n SER 164 N -2.99 -2.70 0.00 6.41 7.64 -1.26 -0.63 113.62 120.09 1mpa n SER 164 Ca -0.26 -0.90 0.00 0.00 1.01 0.00 0.00 58.87 58.72 1mpa n SER 164 Cb 0.66 -3.45 0.00 0.00 -1.01 0.00 0.00 64.21 60.41 1mpa n SER 164 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mpa n GLY 165 N -1.68 0.69 0.01 0.23 0.00 -0.48 -4.85 105.19 99.11 1mpa n GLY 165 Ca -0.10 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.06 1mpa n GLY 165 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1mpa n SER 166 N -0.05 0.09 -4.10 1.61 7.64 0.19 -4.41 113.62 114.59 1mpa n SER 166 Ca 0.00 0.51 -0.35 0.00 1.01 0.00 0.00 58.87 60.03 1mpa n SER 166 Cb 0.02 -0.53 -0.12 0.00 -1.01 0.00 0.00 64.21 62.58 1mpa n SER 166 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1mpa s LEU 167 N -3.16 5.17 -0.01 -3.43 1.43 -0.94 -4.88 118.68 112.87 1mpa s LEU 167 Ca 0.13 -2.21 0.10 0.00 -1.03 0.00 0.00 54.13 51.13 1mpa s LEU 167 Cb 0.18 -1.81 -0.13 0.00 0.03 0.00 0.00 46.19 44.46 1mpa s LEU 167 CO 0.53 -0.49 0.36 -1.54 0.23 0.00 0.00 176.35 175.43 1mpa n SER 168 N 4.33 1.28 -4.78 2.29 3.41 -1.26 -4.51 113.62 114.37 1mpa n SER 168 Ca 0.00 -0.46 -0.39 0.00 -0.26 0.00 0.00 58.87 57.76 1mpa n SER 168 Cb 0.41 1.18 -0.06 0.00 -0.26 0.00 0.00 64.21 65.48 1mpa n SER 168 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1mpa s SER 169 N -2.43 7.01 -0.27 4.04 1.04 -1.26 -4.16 113.70 117.67 1mpa s SER 169 Ca 0.01 1.20 0.00 0.00 0.48 0.00 0.00 55.95 57.64 1mpa s SER 169 Cb 0.07 -2.36 0.00 0.00 0.10 0.00 0.00 66.02 63.83 1mpa s SER 169 CO 0.42 0.18 0.00 0.61 0.98 0.00 0.00 173.24 175.44 1mpa n GLY 170 N 2.12 0.54 3.91 7.32 0.00 -1.26 -4.47 105.19 113.36 1mpa n GLY 170 Ca -0.09 -0.26 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 1mpa n GLY 170 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1mpa s VAL 171 N -1.88 5.39 -0.06 1.61 -7.23 -1.26 -1.37 120.40 115.60 1mpa s VAL 171 Ca 0.00 -0.32 -0.02 0.00 -1.81 0.00 0.00 61.98 59.82 1mpa s VAL 171 Cb 0.00 -3.59 0.03 0.00 0.56 0.00 0.00 36.38 33.38 1mpa s VAL 171 CO 0.00 0.20 0.07 -1.00 -0.31 0.00 0.00 175.10 174.06 1mpa s HIS 172 N -1.45 0.07 -0.19 2.82 3.76 0.20 -4.96 115.29 115.55 1mpa s HIS 172 Ca 0.32 0.18 -0.04 0.00 -0.15 0.00 0.00 55.06 55.38 1mpa s HIS 172 Cb -0.13 -0.51 -0.02 0.00 1.11 0.00 0.00 32.58 33.04 1mpa s HIS 172 CO 0.25 -0.24 -0.04 0.99 -0.85 0.00 0.00 174.74 174.85 1mpa s THR 173 N 2.17 3.59 0.00 1.30 2.01 -1.26 -0.49 115.64 122.97 1mpa s THR 173 Ca 0.05 -0.44 -0.08 0.00 0.31 0.00 0.00 61.69 61.52 1mpa s THR 173 Cb -0.13 -2.60 -0.05 0.00 0.01 0.00 0.00 72.50 69.73 1mpa s THR 173 CO -0.04 0.45 0.30 -0.36 -0.69 0.00 0.00 174.62 174.28 1mpa s PHE 174 N 0.96 3.60 0.25 4.92 0.40 -0.93 -5.01 117.98 122.18 1mpa s PHE 174 Ca 0.00 0.67 -0.29 0.00 -0.60 0.00 0.00 56.93 56.71 1mpa s PHE 174 Cb -0.15 -2.06 -0.15 0.00 0.51 0.00 0.00 43.02 41.18 1mpa s PHE 174 CO 0.01 0.62 1.05 -2.30 0.70 0.00 0.00 175.22 175.29 1mpa n PRO 175 N 1.30 1.27 -2.10 0.24 -0.02 -1.26 -4.25 135.00 130.18 1mpa n PRO 175 Ca -0.12 0.45 -0.42 0.00 -2.02 0.00 0.00 63.50 61.39 1mpa n PRO 175 Cb 0.53 -1.85 -0.03 0.00 -0.02 0.00 0.00 33.50 32.13 1mpa n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1mpa s ALA 176 N -0.77 3.62 -0.09 3.55 0.00 -1.26 -4.80 121.76 122.01 1mpa s ALA 176 Ca 0.63 1.21 -0.03 0.00 0.00 0.00 0.00 51.96 53.78 1mpa s ALA 176 Cb -0.75 -3.55 -0.03 0.00 0.00 0.00 0.00 23.12 18.79 1mpa s ALA 176 CO 0.57 -0.66 0.02 0.08 0.00 0.00 0.00 175.76 175.78 1mpa s VAL 177 N 0.69 4.47 -0.20 0.00 1.01 -0.14 -4.85 120.40 121.37 1mpa s VAL 177 Ca 0.63 -0.19 -0.14 0.00 0.00 0.00 0.00 61.98 62.28 1mpa s VAL 177 Cb -0.39 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.06 1mpa s VAL 177 CO 0.35 0.60 0.33 -0.22 0.00 0.00 0.00 175.10 176.16 1mpa s LEU 178 N -0.87 4.17 -0.40 3.92 2.96 -1.26 -1.24 118.68 125.95 1mpa s LEU 178 Ca 0.13 0.44 0.02 0.00 -0.22 0.00 0.00 54.13 54.50 1mpa s LEU 178 Cb -0.11 -2.41 0.12 0.00 0.50 0.00 0.00 46.19 44.28 1mpa s LEU 178 CO 0.02 -0.01 0.17 -1.10 -1.32 0.00 0.00 176.35 174.12 1mpa s GLN 179 N 1.08 1.29 -0.37 1.98 1.11 0.14 -4.93 119.66 119.95 1mpa s GLN 179 Ca 0.16 -1.85 -0.24 0.00 0.01 0.00 0.00 55.36 53.44 1mpa s GLN 179 Cb -0.14 -2.56 0.03 0.00 -1.01 0.00 0.00 33.01 29.34 1mpa s GLN 179 CO 0.06 -1.07 0.51 0.43 0.01 0.00 0.00 175.29 175.23 1mpa n SER 180 N 3.92 -6.59 0.00 5.90 7.64 -1.26 -2.92 113.62 120.31 1mpa n SER 180 Ca 0.05 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.18 1mpa n SER 180 Cb 0.37 -3.09 0.00 0.00 -1.01 0.00 0.00 64.21 60.49 1mpa n SER 180 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1mpa n ASP 181 N 0.04 -1.31 -3.80 6.43 9.92 -1.26 -4.95 116.55 121.63 1mpa n ASP 181 Ca -0.01 0.00 -0.16 0.00 -0.53 0.00 0.00 54.79 54.10 1mpa n ASP 181 Cb 0.54 -2.02 -0.16 0.00 -0.64 0.00 0.00 41.12 38.84 1mpa n ASP 181 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1mpa s LEU 182 N 0.00 1.16 0.87 0.64 1.43 -1.15 -4.74 118.68 116.89 1mpa s LEU 182 Ca 0.00 0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 52.99 1mpa s LEU 182 Cb 0.00 -0.13 0.15 0.00 0.03 0.00 0.00 46.19 46.24 1mpa s LEU 182 CO 0.00 -0.11 1.21 -0.31 0.23 0.00 0.00 176.35 177.37 1mpa s TYR 183 N 0.99 2.01 -0.29 0.29 2.02 0.97 0.24 117.35 123.58 1mpa s TYR 183 Ca -0.09 0.33 -0.14 0.00 -0.37 0.00 0.00 57.07 56.80 1mpa s TYR 183 Cb -0.13 -3.74 0.12 0.00 -0.40 0.00 0.00 41.96 37.82 1mpa s TYR 183 CO -0.02 -2.21 0.79 0.99 -1.57 0.00 0.00 175.55 173.52 1mpa s THR 184 N -3.65 -0.42 0.26 -0.71 2.01 -0.38 -1.16 115.64 111.60 1mpa s THR 184 Ca 0.69 0.00 0.10 0.00 0.31 0.00 0.00 61.69 62.79 1mpa s THR 184 Cb -0.06 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.40 1mpa s THR 184 CO 0.50 0.00 -0.17 -0.22 -0.69 0.00 0.00 174.62 174.04 1mpa s LEU 185 N 2.14 2.58 0.18 4.42 2.96 0.63 -0.97 118.68 130.62 1mpa s LEU 185 Ca -0.07 -1.05 -0.15 0.00 -0.22 0.00 0.00 54.13 52.64 1mpa s LEU 185 Cb -0.07 -0.92 0.02 0.00 0.50 0.00 0.00 46.19 45.72 1mpa s LEU 185 CO -0.18 -0.07 0.46 -0.94 -1.32 0.00 0.00 176.35 174.29 1mpa s SER 186 N -3.45 -0.18 -0.13 3.68 1.04 -1.26 -0.62 113.70 112.78 1mpa s SER 186 Ca 0.28 -0.56 -0.29 0.00 0.48 0.00 0.00 55.95 55.86 1mpa s SER 186 Cb -0.03 0.53 0.08 0.00 0.10 0.00 0.00 66.02 66.71 1mpa s SER 186 CO 0.12 -1.00 0.74 -0.55 0.98 0.00 0.00 173.24 173.54 1mpa s SER 187 N -2.89 -0.64 0.15 7.02 0.15 -0.74 -2.19 113.70 114.56 1mpa s SER 187 Ca 0.10 0.89 0.08 0.00 0.70 0.00 0.00 55.95 57.73 1mpa s SER 187 Cb 0.00 0.78 -0.04 0.00 -1.71 0.00 0.00 66.02 65.06 1mpa s SER 187 CO -0.03 -0.46 -0.19 -0.94 1.20 0.00 0.00 173.24 172.82 1mpa s SER 188 N -0.68 2.67 0.00 5.45 1.04 0.36 -1.41 113.70 121.12 1mpa s SER 188 Ca -0.06 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.54 1mpa s SER 188 Cb -0.02 -0.16 -0.00 0.00 0.10 0.00 0.00 66.02 65.94 1mpa s SER 188 CO 0.06 -0.02 -0.02 0.54 0.98 0.00 0.00 173.24 174.78 1mpa s VAL 189 N -1.89 0.13 -0.28 5.02 0.11 -0.40 -0.63 120.40 122.46 1mpa s VAL 189 Ca 0.14 -0.20 0.02 0.00 -2.93 0.00 0.00 61.98 59.01 1mpa s VAL 189 Cb -0.06 -0.14 0.08 0.00 -1.53 0.00 0.00 36.38 34.72 1mpa s VAL 189 CO 0.06 -0.05 -0.03 -0.89 -3.33 0.00 0.00 175.10 170.87 1mpa s THR 190 N -0.25 1.91 0.43 5.04 2.01 -0.48 -1.06 115.64 123.24 1mpa s THR 190 Ca -0.02 -1.72 0.07 0.00 0.31 0.00 0.00 61.69 60.33 1mpa s THR 190 Cb -0.02 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 70.23 1mpa s THR 190 CO -0.00 -0.28 0.19 0.68 -0.69 0.00 0.00 174.62 174.51 1mpa s VAL 191 N 1.17 2.14 0.35 3.82 -7.23 -0.86 -4.64 120.40 115.15 1mpa s VAL 191 Ca -0.00 -1.71 -0.26 0.00 -1.81 0.00 0.00 61.98 58.20 1mpa s VAL 191 Cb -0.19 -2.85 -0.09 0.00 0.56 0.00 0.00 36.38 33.81 1mpa s VAL 191 CO -0.08 0.00 1.03 0.42 -0.31 0.00 0.00 175.10 176.16 1mpa s THR 192 N -2.64 3.80 -1.21 5.32 -4.23 -1.26 -0.26 115.64 115.16 1mpa s THR 192 Ca 0.38 1.51 0.02 0.00 -1.18 0.00 0.00 61.69 62.41 1mpa s THR 192 Cb 0.03 -3.85 0.02 0.00 1.34 0.00 0.00 72.50 70.05 1mpa s THR 192 CO 0.21 0.14 0.95 -1.54 -0.54 0.00 0.00 174.62 173.84 1mpa n SER 193 N 0.41 0.00 0.10 3.99 3.41 0.48 -1.08 113.62 120.93 1mpa n SER 193 Ca 0.03 0.38 -0.18 0.00 -0.26 0.00 0.00 58.87 58.84 1mpa n SER 193 Cb 0.49 -0.40 -0.14 0.00 -0.26 0.00 0.00 64.21 63.90 1mpa n SER 193 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1mpa h SER 194 N 0.00 0.52 0.00 4.04 0.02 -1.90 -3.39 113.55 112.83 1mpa h SER 194 Ca 0.00 -0.59 -0.00 0.00 -0.84 0.00 0.00 61.79 60.36 1mpa h SER 194 Cb 0.02 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1mpa h SER 194 CO 0.00 1.47 -0.00 0.71 -1.14 0.00 0.00 176.83 177.87 1mpa h THR 195 N 0.09 0.00 -3.88 -2.27 1.35 -1.49 -3.42 112.91 103.29 1mpa h THR 195 Ca -0.19 -0.00 -0.47 0.00 -0.55 0.00 0.00 66.41 65.19 1mpa h THR 195 Cb 2.03 0.00 -0.02 0.00 -1.73 0.00 0.00 68.15 68.43 1mpa h THR 195 CO 0.21 0.00 0.35 0.86 -0.25 0.00 0.00 175.52 176.69 1mpa s TRP 196 N -2.02 3.70 -2.22 4.73 -0.00 -1.21 0.04 118.94 121.96 1mpa s TRP 196 Ca -0.00 1.79 0.19 0.00 -0.00 0.00 0.00 56.10 58.08 1mpa s TRP 196 Cb 0.00 -2.93 0.73 0.00 -0.00 0.00 0.00 33.47 31.28 1mpa s TRP 196 CO 0.00 0.21 1.53 -0.35 -0.00 0.00 0.00 176.95 178.34 1mpa n PRO 197 N 0.58 1.66 0.24 5.86 -0.04 -1.26 -4.70 135.00 137.34 1mpa n PRO 197 Ca 0.02 -1.00 0.12 0.00 -0.04 0.00 0.00 63.50 62.60 1mpa n PRO 197 Cb 0.50 -1.37 0.75 0.00 -0.04 0.00 0.00 33.50 33.34 1mpa n PRO 197 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1mpa h SER 198 N 1.98 0.00 -3.18 3.54 0.02 -1.30 -3.38 113.55 111.23 1mpa h SER 198 Ca 0.00 0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 60.31 1mpa h SER 198 Cb 0.44 0.00 -0.35 0.00 0.14 0.00 0.00 62.40 62.63 1mpa h SER 198 CO 0.00 0.00 -0.85 -1.10 -1.14 0.00 0.00 176.83 173.74 1mpa s GLN 199 N -4.89 2.67 0.53 3.45 -0.21 0.11 -5.09 119.66 116.23 1mpa s GLN 199 Ca -0.05 -0.72 -0.21 0.00 0.02 0.00 0.00 55.36 54.40 1mpa s GLN 199 Cb 0.16 -2.26 -0.07 0.00 1.00 0.00 0.00 33.01 31.85 1mpa s GLN 199 CO 0.63 -0.10 1.07 0.43 -2.12 0.00 0.00 175.29 175.19 1mpa n SER 200 N 4.34 1.39 -3.74 5.90 7.64 -1.26 -4.23 113.62 123.65 1mpa n SER 200 Ca -0.19 0.92 -0.20 0.00 1.01 0.00 0.00 58.87 60.41 1mpa n SER 200 Cb 0.51 -1.42 -0.17 0.00 -1.01 0.00 0.00 64.21 62.11 1mpa n SER 200 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1mpa s ILE 201 N -1.39 0.14 0.14 0.44 -1.09 -1.26 -5.03 121.20 113.15 1mpa s ILE 201 Ca 0.70 0.23 0.09 0.00 -2.23 0.00 0.00 60.65 59.44 1mpa s ILE 201 Cb -0.46 -0.32 -0.04 0.00 -1.58 0.00 0.00 42.46 40.06 1mpa s ILE 201 CO 0.51 0.20 -0.21 -0.89 -1.23 0.00 0.00 174.94 173.32 1mpa s THR 202 N 1.81 1.89 -0.31 2.92 2.01 -1.26 -2.46 115.64 120.24 1mpa s THR 202 Ca 0.01 -1.78 0.00 0.00 0.31 0.00 0.00 61.69 60.24 1mpa s THR 202 Cb -0.12 -1.79 0.07 0.00 0.01 0.00 0.00 72.50 70.67 1mpa s THR 202 CO -0.03 -0.16 0.01 0.00 -0.69 0.00 0.00 174.62 173.74 1mpa s ASN 204 N 1.25 6.28 -0.03 0.00 -0.87 -0.78 -1.76 114.94 119.03 1mpa s ASN 204 Ca -0.02 -0.38 0.07 0.00 -1.57 0.00 0.00 52.86 50.96 1mpa s ASN 204 Cb -0.20 -2.27 -0.02 0.00 -0.02 0.00 0.00 41.25 38.73 1mpa s ASN 204 CO -0.03 -0.64 -0.23 -0.69 -2.57 0.00 0.00 177.10 172.93 1mpa s VAL 205 N 2.49 2.26 -0.02 1.60 1.01 0.51 -1.13 120.40 127.11 1mpa s VAL 205 Ca 0.18 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1mpa s VAL 205 Cb -0.15 -1.81 0.02 0.00 0.00 0.00 0.00 36.38 34.44 1mpa s VAL 205 CO 0.16 0.58 -0.00 0.00 0.00 0.00 0.00 175.10 175.84 1mpa s ALA 206 N -0.56 0.22 -0.54 5.51 0.00 -1.11 0.02 121.76 125.30 1mpa s ALA 206 Ca 0.08 0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.19 1mpa s ALA 206 Cb -0.11 -0.21 0.15 0.00 0.00 0.00 0.00 23.12 22.96 1mpa s ALA 206 CO -0.00 -0.04 0.35 -1.58 0.00 0.00 0.00 175.76 174.49 1mpa s HIS 207 N 0.67 2.51 0.60 0.00 2.46 -0.02 -2.00 115.29 119.51 1mpa s HIS 207 Ca -0.06 -2.82 0.29 0.00 0.47 0.00 0.00 55.06 52.94 1mpa s HIS 207 Cb -0.09 -2.09 1.54 0.00 -0.13 0.00 0.00 32.58 31.81 1mpa s HIS 207 CO -0.01 -0.70 1.95 -1.00 -2.47 0.00 0.00 174.74 172.50 1mpa h PRO 208 N 6.01 0.00 0.00 2.88 0.13 -1.82 -1.98 132.00 137.22 1mpa h PRO 208 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1mpa h PRO 208 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1mpa h PRO 208 CO 0.57 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.34 1mpa n ALA 209 N -2.27 1.31 -2.10 -0.56 0.00 -1.26 -1.97 120.51 113.66 1mpa n ALA 209 Ca 0.05 -0.02 -0.00 0.00 0.00 0.00 0.00 53.44 53.47 1mpa n ALA 209 Cb 0.54 -1.11 -0.01 0.00 0.00 0.00 0.00 19.45 18.88 1mpa n ALA 209 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1mpa n SER 210 N -1.51 0.06 -2.33 0.00 3.41 -0.79 -4.96 113.62 107.51 1mpa n SER 210 Ca 0.02 -1.73 -0.08 0.00 -0.26 0.00 0.00 58.87 56.82 1mpa n SER 210 Cb 0.08 -0.10 -0.01 0.00 -0.26 0.00 0.00 64.21 63.92 1mpa n SER 210 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1mpa n SER 211 N 0.10 -2.82 -4.74 4.04 7.64 -0.83 -4.95 113.62 112.06 1mpa n SER 211 Ca -0.03 0.29 -0.41 0.00 1.01 0.00 0.00 58.87 59.74 1mpa n SER 211 Cb 0.73 -2.49 -0.05 0.00 -1.01 0.00 0.00 64.21 61.39 1mpa n SER 211 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1mpa s THR 212 N -2.32 4.34 -0.41 0.44 2.01 -0.93 -4.93 115.64 113.84 1mpa s THR 212 Ca 0.00 2.06 0.04 0.00 0.31 0.00 0.00 61.69 64.10 1mpa s THR 212 Cb 0.00 -4.32 0.16 0.00 0.01 0.00 0.00 72.50 68.36 1mpa s THR 212 CO 0.00 0.39 0.38 -0.75 -0.69 0.00 0.00 174.62 173.95 1mpa s LYS 213 N -0.47 0.81 -0.02 4.92 2.20 -1.26 -0.84 119.74 125.08 1mpa s LYS 213 Ca 0.44 -1.56 -0.11 0.00 -0.36 0.00 0.00 55.97 54.38 1mpa s LYS 213 Cb -0.24 -1.05 -0.05 0.00 -1.51 0.00 0.00 37.83 34.97 1mpa s LYS 213 CO 0.30 -1.31 0.31 0.08 -0.36 0.00 0.00 175.35 174.37 1mpa s VAL 214 N 0.64 5.21 -0.57 4.02 1.01 0.10 -4.97 120.40 125.84 1mpa s VAL 214 Ca 0.27 0.51 0.06 0.00 0.00 0.00 0.00 61.98 62.81 1mpa s VAL 214 Cb -0.05 -3.59 0.24 0.00 0.00 0.00 0.00 36.38 32.97 1mpa s VAL 214 CO -0.10 0.52 0.65 0.47 0.00 0.00 0.00 175.10 176.63 1mpa n ASP 215 N 1.63 2.61 -4.76 3.32 8.00 -1.26 -0.36 116.55 125.73 1mpa n ASP 215 Ca -0.14 -3.19 -0.37 0.00 0.71 0.00 0.00 54.79 51.79 1mpa n ASP 215 Cb 0.53 -0.67 0.02 0.00 -0.02 0.00 0.00 41.12 40.98 1mpa n ASP 215 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1mpa s LYS 216 N -1.95 3.36 -0.06 -1.24 2.47 -0.72 -4.79 119.74 116.80 1mpa s LYS 216 Ca 0.37 1.98 0.05 0.00 -1.56 0.00 0.00 55.97 56.80 1mpa s LYS 216 Cb 0.13 -2.26 -0.00 0.00 -1.46 0.00 0.00 37.83 34.24 1mpa s LYS 216 CO -0.06 -0.93 -0.21 0.21 0.16 0.00 0.00 175.35 174.51 1mpa s LYS 217 N -2.90 2.36 -0.95 4.03 2.20 -1.26 -0.64 119.74 122.58 1mpa s LYS 217 Ca 0.69 -0.76 -0.21 0.00 -0.36 0.00 0.00 55.97 55.33 1mpa s LYS 217 Cb -0.34 -1.94 0.09 0.00 -1.51 0.00 0.00 37.83 34.13 1mpa s LYS 217 CO 0.40 0.25 1.27 0.42 -0.36 0.00 0.00 175.35 177.33 1mpa s ILE 218 N 0.11 4.31 0.27 5.43 -1.09 -1.03 -4.87 121.20 124.33 1mpa s ILE 218 Ca -0.09 -1.08 -0.10 0.00 -2.23 0.00 0.00 60.65 57.15 1mpa s ILE 218 Cb -0.14 -4.90 -0.07 0.00 -1.58 0.00 0.00 42.46 35.76 1mpa s ILE 218 CO 0.05 -1.71 0.61 -1.61 -1.23 0.00 0.00 174.94 171.04 1mpa s GLU 219 N 3.89 3.83 0.79 2.79 0.41 -1.26 -4.73 118.70 124.41 1mpa s GLU 219 Ca 0.38 0.35 -0.11 0.00 -0.41 0.00 0.00 54.97 55.18 1mpa s GLU 219 Cb -0.03 -2.58 0.07 0.00 -1.78 0.00 0.00 34.13 29.80 1mpa s GLU 219 CO -0.08 0.24 1.09 -2.14 -0.49 0.00 0.00 175.26 173.88 1mpa s PRO 220 N -3.01 2.11 0.13 0.39 0.02 -1.26 -4.85 135.00 128.53 1mpa s PRO 220 Ca 0.49 1.03 -0.01 0.00 0.02 0.00 0.00 61.00 62.53 1mpa s PRO 220 Cb -0.11 -1.89 0.01 0.00 0.02 0.00 0.00 34.50 32.53 1mpa s PRO 220 CO 0.22 -1.70 0.19 2.89 -0.33 0.00 0.00 177.00 178.27 1mpa n ARG 221 N -3.55 0.28 -4.49 5.54 1.85 -1.26 -5.05 116.66 109.98 1mpa n ARG 221 Ca 0.08 -0.98 -0.24 0.00 -1.00 0.00 0.00 57.85 55.72 1mpa n ARG 221 Cb 0.54 0.98 -0.09 0.00 -1.05 0.00 0.00 32.46 32.83 1mpa n ARG 221 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1mpa s GLY 222 N -1.78 2.38 -0.54 2.89 0.00 -1.24 -1.23 107.32 107.81 1mpa s GLY 222 Ca 0.10 -1.54 -0.20 0.00 0.00 0.00 0.00 44.72 43.08 1mpa s GLY 222 CO 0.07 -1.83 1.54 -1.05 0.00 0.00 0.00 173.10 171.83 1mpa n PRO 223 N -0.82 0.00 -3.45 2.90 -0.02 -1.26 -2.75 135.00 129.60 1mpa n PRO 223 Ca -0.05 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.39 1mpa n PRO 223 Cb 0.66 -0.89 -0.00 0.00 -0.02 0.00 0.00 33.50 33.25 1mpa n PRO 223 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1mpa n THR 224 N 4.33 -0.22 -0.18 3.45 -1.04 -1.26 -5.13 114.28 114.22 1mpa n THR 224 Ca 0.38 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.33 1mpa n THR 224 Cb 0.01 -0.19 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 1mpa n THR 224 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43