#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m1b s SER 6 N 0.00 3.59 -0.22 -1.43 1.04 -1.26 -4.89 113.70 110.52 3m1b s SER 6 Ca 0.00 -1.56 0.01 0.00 0.48 0.00 0.00 55.95 54.87 3m1b s SER 6 Cb 0.00 0.24 0.03 0.00 0.10 0.00 0.00 66.02 66.39 3m1b s SER 6 CO 0.00 -0.75 -0.14 -0.22 0.98 0.00 0.00 173.24 173.11 3m1b s LEU 7 N -3.74 2.73 0.02 2.42 2.96 -1.13 0.26 118.68 122.21 3m1b s LEU 7 Ca 0.20 -0.87 0.07 0.00 -0.22 0.00 0.00 54.13 53.31 3m1b s LEU 7 Cb 0.05 -1.55 -0.02 0.00 0.50 0.00 0.00 46.19 45.16 3m1b s LEU 7 CO 0.10 -0.08 -0.20 -0.76 -1.32 0.00 0.00 176.35 174.09 3m1b s LEU 8 N 1.26 2.12 -0.13 -0.68 1.43 -1.25 -1.81 118.68 119.63 3m1b s LEU 8 Ca 0.01 -0.46 -0.05 0.00 -1.03 0.00 0.00 54.13 52.59 3m1b s LEU 8 Cb -0.16 -0.98 -0.04 0.00 0.03 0.00 0.00 46.19 45.05 3m1b s LEU 8 CO -0.09 0.18 0.06 -0.31 0.23 0.00 0.00 176.35 176.43 3m1b s TYR 9 N -0.68 3.32 -0.71 0.29 1.51 0.56 -2.67 117.35 118.97 3m1b s TYR 9 Ca 0.07 0.26 -0.02 0.00 -1.01 0.00 0.00 57.07 56.37 3m1b s TYR 9 Cb -0.08 -1.93 0.18 0.00 -0.11 0.00 0.00 41.96 40.01 3m1b s TYR 9 CO 0.01 0.45 0.54 -1.01 -1.11 0.00 0.00 175.55 174.42 3m1b s HIS 10 N -0.51 3.54 0.41 2.71 3.76 -0.06 -2.96 115.29 122.17 3m1b s HIS 10 Ca 0.10 -2.85 -0.13 0.00 -0.15 0.00 0.00 55.06 52.04 3m1b s HIS 10 Cb -0.12 -3.18 -0.07 0.00 1.11 0.00 0.00 32.58 30.32 3m1b s HIS 10 CO 0.02 -0.79 0.80 -0.51 -0.85 0.00 0.00 174.74 173.41 3m1b s LEU 11 N -0.52 3.85 -0.27 0.89 1.02 -0.66 -1.30 118.68 121.69 3m1b s LEU 11 Ca 0.20 1.25 -0.25 0.00 0.02 0.00 0.00 54.13 55.36 3m1b s LEU 11 Cb -0.16 -4.13 0.10 0.00 0.02 0.00 0.00 46.19 42.03 3m1b s LEU 11 CO -0.06 -0.39 0.91 -0.89 0.02 0.00 0.00 176.35 175.93 3m1b s THR 12 N -2.32 0.00 -0.09 5.49 2.01 -0.57 -2.81 115.64 117.35 3m1b s THR 12 Ca 0.53 0.00 -0.14 0.00 0.31 0.00 0.00 61.69 62.39 3m1b s THR 12 Cb -0.10 -1.00 0.03 0.00 0.01 0.00 0.00 72.50 71.44 3m1b s THR 12 CO 0.28 0.00 0.36 0.00 -0.69 0.00 0.00 174.62 174.56 3m1b s ALA 13 N 0.25 -0.89 -0.04 7.40 0.00 -0.82 -0.80 121.76 126.86 3m1b s ALA 13 Ca 0.02 0.78 0.03 0.00 0.00 0.00 0.00 51.96 52.79 3m1b s ALA 13 Cb -0.05 -0.33 0.00 0.00 0.00 0.00 0.00 23.12 22.75 3m1b s ALA 13 CO -0.03 -0.21 -0.13 0.14 0.00 0.00 0.00 175.76 175.53 3m1b s VAL 14 N -0.43 1.12 0.36 0.00 -7.23 0.79 -2.20 120.40 112.82 3m1b s VAL 14 Ca -0.06 -0.53 0.04 0.00 -1.81 0.00 0.00 61.98 59.63 3m1b s VAL 14 Cb -0.04 -0.99 0.24 0.00 0.56 0.00 0.00 36.38 36.15 3m1b s VAL 14 CO 0.02 0.34 1.99 0.77 -0.31 0.00 0.00 175.10 177.92 3m1b h SER 15 N 6.52 0.62 -4.08 4.85 4.64 -1.80 -3.33 113.55 120.97 3m1b h SER 15 Ca -0.32 -0.04 -0.66 0.00 -0.47 0.00 0.00 61.79 60.30 3m1b h SER 15 Cb 1.18 -0.16 -0.39 0.00 -0.31 0.00 0.00 62.40 62.72 3m1b h SER 15 CO 0.48 0.49 -0.50 -0.44 -0.87 0.00 0.00 176.83 175.99 3m1b s SER 16 N -6.58 4.78 0.99 4.97 0.01 -1.26 -4.99 113.70 111.61 3m1b s SER 16 Ca -0.09 -3.14 -0.13 0.00 1.31 0.00 0.00 55.95 53.90 3m1b s SER 16 Cb 0.17 -1.72 0.18 0.00 0.21 0.00 0.00 66.02 64.86 3m1b s SER 16 CO 0.76 -0.25 1.12 -2.16 0.41 0.00 0.00 173.24 173.12 3m1b s PRO 17 N -0.47 0.49 0.52 12.44 0.04 -1.25 -5.05 135.00 141.72 3m1b s PRO 17 Ca 0.19 0.34 -0.17 0.00 0.04 0.00 0.00 61.00 61.40 3m1b s PRO 17 Cb -0.20 -1.76 -0.07 0.00 0.04 0.00 0.00 34.50 32.51 3m1b s PRO 17 CO -0.04 -2.65 1.00 0.00 0.04 0.00 0.00 177.00 175.35 3m1b s ALA 18 N -3.11 2.97 -0.15 8.56 0.00 -1.26 -4.92 121.76 123.85 3m1b s ALA 18 Ca 0.66 0.30 -0.31 0.00 0.00 0.00 0.00 51.96 52.60 3m1b s ALA 18 Cb -0.16 -3.16 -0.08 0.00 0.00 0.00 0.00 23.12 19.72 3m1b s ALA 18 CO 0.56 -0.33 2.10 -0.35 0.00 0.00 0.00 175.76 177.74 3m1b n PRO 19 N -1.51 2.11 -2.85 0.00 -0.04 -1.26 0.23 135.00 131.68 3m1b n PRO 19 Ca 0.07 0.68 -0.09 0.00 -0.04 0.00 0.00 63.50 64.12 3m1b n PRO 19 Cb 0.54 -2.97 0.04 0.00 -0.04 0.00 0.00 33.50 31.06 3m1b n PRO 19 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3m1b n GLY 20 N 5.32 0.25 3.44 0.55 0.00 -1.26 -5.07 105.19 108.42 3m1b n GLY 20 Ca 0.28 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 3m1b n GLY 20 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m1b s THR 21 N -3.14 2.82 -0.10 2.61 2.01 0.13 -5.08 115.64 114.90 3m1b s THR 21 Ca 0.17 -0.82 -0.29 0.00 0.31 0.00 0.00 61.69 61.07 3m1b s THR 21 Cb -0.08 -2.08 -0.07 0.00 0.01 0.00 0.00 72.50 70.29 3m1b s THR 21 CO 0.31 0.59 2.09 -2.16 -0.69 0.00 0.00 174.62 174.76 3m1b s PRO 22 N -0.69 3.61 0.00 4.92 0.04 -1.26 -4.67 135.00 136.95 3m1b s PRO 22 Ca 0.11 2.29 0.08 0.00 0.04 0.00 0.00 61.00 63.52 3m1b s PRO 22 Cb -0.11 -4.27 0.50 0.00 0.04 0.00 0.00 34.50 30.66 3m1b s PRO 22 CO 0.00 -1.56 1.21 0.00 0.04 0.00 0.00 177.00 176.69 3m1b n ALA 23 N 9.71 2.42 -3.64 8.56 0.00 -1.26 -4.61 120.51 131.69 3m1b n ALA 23 Ca 0.25 -0.05 -0.09 0.00 0.00 0.00 0.00 53.44 53.55 3m1b n ALA 23 Cb 0.43 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.68 3m1b n ALA 23 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3m1b s PHE 24 N -2.00 -0.96 -0.07 0.00 5.36 -1.26 -0.15 117.98 118.90 3m1b s PHE 24 Ca 0.12 2.03 -0.17 0.00 -0.96 0.00 0.00 56.93 57.96 3m1b s PHE 24 Cb 0.06 0.51 0.04 0.00 -0.34 0.00 0.00 43.02 43.28 3m1b s PHE 24 CO 0.10 -0.47 0.40 1.67 -1.46 0.00 0.00 175.22 175.46 3m1b s TRP 25 N 1.21 -0.35 0.34 10.12 -2.14 0.02 0.33 118.94 128.47 3m1b s TRP 25 Ca -0.07 0.70 0.09 0.00 2.66 0.00 0.00 56.10 59.48 3m1b s TRP 25 Cb -0.05 0.16 -0.05 0.00 -3.10 0.00 0.00 33.47 30.43 3m1b s TRP 25 CO -0.13 -0.36 -0.00 0.08 -2.66 0.00 0.00 176.95 173.88 3m1b s VAL 26 N -0.76 2.61 -0.14 -0.66 1.01 0.12 -1.52 120.40 121.06 3m1b s VAL 26 Ca -0.08 -2.00 -0.05 0.00 0.00 0.00 0.00 61.98 59.84 3m1b s VAL 26 Cb -0.04 -2.78 0.06 0.00 0.00 0.00 0.00 36.38 33.63 3m1b s VAL 26 CO 0.04 -0.21 0.29 -0.94 0.00 0.00 0.00 175.10 174.28 3m1b s SER 27 N -3.70 0.12 -0.18 3.32 1.04 -0.42 -2.69 113.70 111.18 3m1b s SER 27 Ca 0.34 0.66 -0.08 0.00 0.48 0.00 0.00 55.95 57.35 3m1b s SER 27 Cb -0.00 0.75 -0.04 0.00 0.10 0.00 0.00 66.02 66.83 3m1b s SER 27 CO 0.19 -0.22 0.08 -0.83 0.98 0.00 0.00 173.24 173.44 3m1b s GLY 28 N 2.20 1.96 0.29 7.32 0.00 -0.72 -0.89 107.32 117.49 3m1b s GLY 28 Ca -0.02 -0.72 0.11 0.00 0.00 0.00 0.00 44.72 44.09 3m1b s GLY 28 CO -0.09 0.02 -0.15 -0.98 0.00 0.00 0.00 173.10 171.89 3m1b s TRP 29 N 0.21 2.26 -0.71 1.90 0.52 -1.09 -1.12 118.94 120.90 3m1b s TRP 29 Ca 0.06 -0.42 0.05 0.00 0.02 0.00 0.00 56.10 55.80 3m1b s TRP 29 Cb -0.12 -1.10 0.17 0.00 -1.15 0.00 0.00 33.47 31.27 3m1b s TRP 29 CO -0.00 0.62 0.50 -0.51 0.02 0.00 0.00 176.95 177.58 3m1b s LEU 30 N -3.52 4.85 0.00 2.99 2.01 0.27 -3.92 118.68 121.37 3m1b s LEU 30 Ca 0.30 -3.87 0.00 0.00 0.01 0.00 0.00 54.13 50.57 3m1b s LEU 30 Cb -0.02 -1.64 0.00 0.00 0.01 0.00 0.00 46.19 44.54 3m1b s LEU 30 CO 0.15 -0.08 0.00 0.61 1.01 0.00 0.00 176.35 178.03 3m1b n GLY 31 N 1.95 1.31 0.92 -3.19 0.00 0.72 -3.02 105.19 103.89 3m1b n GLY 31 Ca 0.20 0.29 0.11 0.00 0.00 0.00 0.00 46.02 46.62 3m1b n GLY 31 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3m1b n PRO 32 N 0.00 2.21 -4.60 1.61 -0.04 -1.26 -4.87 135.00 128.06 3m1b n PRO 32 Ca 0.00 -1.82 -0.33 0.00 -0.04 0.00 0.00 63.50 61.30 3m1b n PRO 32 Cb 0.00 -1.47 -0.14 0.00 -0.04 0.00 0.00 33.50 31.85 3m1b n PRO 32 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 3m1b s GLN 33 N -1.66 3.37 -0.15 0.54 0.74 -1.17 -5.09 119.66 116.25 3m1b s GLN 33 Ca 0.35 -0.68 -0.25 0.00 0.05 0.00 0.00 55.36 54.83 3m1b s GLN 33 Cb 0.21 -2.69 -0.02 0.00 1.10 0.00 0.00 33.01 31.60 3m1b s GLN 33 CO 0.30 0.13 0.81 -1.14 -0.55 0.00 0.00 175.29 174.83 3m1b s GLN 34 N 0.58 4.32 0.00 1.67 0.74 -1.26 0.97 119.66 126.69 3m1b s GLN 34 Ca -0.07 0.99 0.00 0.00 0.05 0.00 0.00 55.36 56.32 3m1b s GLN 34 Cb -0.15 -3.55 0.00 0.00 1.10 0.00 0.00 33.01 30.40 3m1b s GLN 34 CO 0.03 -0.25 0.16 2.48 -0.55 0.00 0.00 175.29 177.16 3m1b n TYR 35 N 4.95 0.00 -3.74 1.67 4.11 -0.28 -4.36 117.16 119.51 3m1b n TYR 35 Ca 0.03 0.00 -0.12 0.00 -0.00 0.00 0.00 57.90 57.81 3m1b n TYR 35 Cb 0.49 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.72 3m1b n TYR 35 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.86 175.69 3m1b s LEU 36 N -0.90 0.49 0.43 -3.48 0.20 -1.07 -3.12 118.68 111.24 3m1b s LEU 36 Ca 0.00 0.71 0.06 0.00 0.69 0.00 0.00 54.13 55.59 3m1b s LEU 36 Cb 0.00 1.14 -0.05 0.00 -0.43 0.00 0.00 46.19 46.85 3m1b s LEU 36 CO 0.00 -0.14 0.11 -0.55 -0.29 0.00 0.00 176.35 175.48 3m1b s SER 37 N 0.59 4.19 0.00 3.68 0.15 -0.15 -1.76 113.70 120.40 3m1b s SER 37 Ca -0.03 -1.27 0.00 0.00 0.70 0.00 0.00 55.95 55.35 3m1b s SER 37 Cb -0.05 -0.28 0.00 0.00 -1.71 0.00 0.00 66.02 63.98 3m1b s SER 37 CO -0.04 -0.58 0.00 0.00 1.20 0.00 0.00 173.24 173.83 3m1b n TYR 38 N -1.17 0.00 -4.36 3.44 9.36 -1.10 -3.56 117.16 119.77 3m1b n TYR 38 Ca -0.05 0.00 -0.19 0.00 3.32 0.00 0.00 57.90 60.98 3m1b n TYR 38 Cb 0.66 0.00 -0.10 0.00 -0.63 0.00 0.00 39.34 39.27 3m1b n TYR 38 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 3m1b s ASN 39 N 0.00 2.73 0.39 2.98 2.20 -1.26 0.12 114.94 122.11 3m1b s ASN 39 Ca 0.00 -1.01 0.11 0.00 -0.94 0.00 0.00 52.86 51.02 3m1b s ASN 39 Cb 0.00 -0.16 0.80 0.00 -2.00 0.00 0.00 41.25 39.88 3m1b s ASN 39 CO 0.00 -0.13 1.90 0.77 -2.94 0.00 0.00 177.10 176.70 3m1b h SER 40 N 2.56 0.12 -0.80 3.54 4.64 0.52 -2.07 113.55 122.06 3m1b h SER 40 Ca -0.39 -0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 60.86 3m1b h SER 40 Cb 1.23 -0.03 -0.04 0.00 -0.31 0.00 0.00 62.40 63.25 3m1b h SER 40 CO 0.61 0.35 0.32 -0.07 -0.87 0.00 0.00 176.83 177.17 3m1b h LEU 41 N 0.12 1.10 0.07 5.97 4.07 -1.91 -3.25 115.31 121.48 3m1b h LEU 41 Ca 0.02 -0.17 -0.15 0.00 0.08 0.00 0.00 57.88 57.66 3m1b h LEU 41 Cb 0.46 -0.29 0.02 0.00 1.08 0.00 0.00 40.66 41.93 3m1b h LEU 41 CO 0.03 0.97 -0.63 -0.09 -1.08 0.00 0.00 178.44 177.64 3m1b h ARG 42 N 1.16 0.31 0.00 1.13 2.43 -1.83 -3.47 114.38 114.12 3m1b h ARG 42 Ca 0.27 -0.42 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 3m1b h ARG 42 Cb 0.21 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 3m1b h ARG 42 CO -0.02 1.15 0.00 0.41 -1.51 0.00 0.00 179.97 179.99 3m1b n GLY 43 N 1.38 0.81 3.51 2.80 0.00 -0.82 -4.95 105.19 107.92 3m1b n GLY 43 Ca -0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 3m1b n GLY 43 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3m1b s GLU 44 N -0.27 2.95 0.03 1.61 2.56 -1.26 -4.94 118.70 119.37 3m1b s GLU 44 Ca 0.00 -0.60 0.04 0.00 0.00 0.00 0.00 54.97 54.41 3m1b s GLU 44 Cb 0.00 -2.60 -0.04 0.00 2.00 0.00 0.00 34.13 33.49 3m1b s GLU 44 CO 0.00 0.51 -0.05 0.00 -0.56 0.00 0.00 175.26 175.16 3m1b s ALA 45 N -0.41 3.07 0.10 6.30 0.00 -1.26 -4.60 121.76 124.97 3m1b s ALA 45 Ca 0.05 -1.05 -0.09 0.00 0.00 0.00 0.00 51.96 50.87 3m1b s ALA 45 Cb -0.12 -1.13 0.00 0.00 0.00 0.00 0.00 23.12 21.87 3m1b s ALA 45 CO 0.02 0.63 0.22 -1.21 0.00 0.00 0.00 175.76 175.42 3m1b s GLU 46 N -1.64 0.90 0.99 0.00 0.41 -1.23 -4.94 118.70 113.18 3m1b s GLU 46 Ca 0.19 -0.96 -0.17 0.00 -0.41 0.00 0.00 54.97 53.62 3m1b s GLU 46 Cb -0.11 0.36 0.24 0.00 -1.78 0.00 0.00 34.13 32.84 3m1b s GLU 46 CO 0.10 -0.30 0.98 -0.35 -0.49 0.00 0.00 175.26 175.20 3m1b n PRO 47 N -0.09 -2.40 -3.51 0.39 -0.04 -1.24 -0.98 135.00 127.12 3m1b n PRO 47 Ca -0.14 -1.55 -0.20 0.00 -0.04 0.00 0.00 63.50 61.57 3m1b n PRO 47 Cb 0.63 -1.33 -0.14 0.00 -0.04 0.00 0.00 33.50 32.62 3m1b n PRO 47 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3m1b n GLY 49 N 5.31 2.57 0.41 0.00 0.00 -1.26 -3.44 105.19 108.77 3m1b n GLY 49 Ca -0.06 -0.33 0.22 0.00 0.00 0.00 0.00 46.02 45.85 3m1b n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1b h ALA 50 N -0.28 2.22 0.00 4.61 0.00 -1.95 -1.44 119.26 122.41 3m1b h ALA 50 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3m1b h ALA 50 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3m1b h ALA 50 CO 0.00 -0.60 0.00 0.91 0.00 0.00 0.00 179.25 179.56 3m1b n TRP 51 N -4.61 0.00 0.18 0.00 7.02 -1.22 -2.12 117.44 116.69 3m1b n TRP 51 Ca 0.24 0.00 0.05 0.00 -1.02 0.00 0.00 57.50 56.77 3m1b n TRP 51 Cb 0.84 -0.44 0.33 0.00 -2.42 0.00 0.00 31.31 29.62 3m1b n TRP 51 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 3m1b h VAL 52 N 0.00 0.94 -0.02 -0.99 2.07 -1.49 -3.16 116.25 113.59 3m1b h VAL 52 Ca 0.00 -1.54 0.00 0.00 0.82 0.00 0.00 66.70 65.98 3m1b h VAL 52 Cb 0.37 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 3m1b h VAL 52 CO 0.00 0.38 -0.21 0.79 0.02 0.00 0.00 177.57 178.55 3m1b n TRP 53 N -3.58 0.00 -2.68 1.57 7.02 -0.90 -4.95 117.44 113.91 3m1b n TRP 53 Ca -0.00 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.05 3m1b n TRP 53 Cb 0.51 -0.02 -0.03 0.00 -2.42 0.00 0.00 31.31 29.35 3m1b n TRP 53 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 3m1b s GLU 54 N -2.26 4.47 0.02 -0.99 -6.30 -1.20 -4.97 118.70 107.47 3m1b s GLU 54 Ca 0.26 1.42 -0.34 0.00 -2.50 0.00 0.00 54.97 53.81 3m1b s GLU 54 Cb 0.19 -3.51 -0.12 0.00 0.00 0.00 0.00 34.13 30.69 3m1b s GLU 54 CO 0.44 -0.23 1.77 0.09 0.02 0.00 0.00 175.26 177.35 3m1b n ASN 55 N 4.63 3.37 -4.07 -1.70 3.02 -1.26 -4.97 115.26 114.29 3m1b n ASN 55 Ca 0.08 1.01 -0.09 0.00 -0.03 0.00 0.00 54.58 55.55 3m1b n ASN 55 Cb 0.49 -1.41 -0.10 0.00 -0.61 0.00 0.00 39.78 38.15 3m1b n ASN 55 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3m1b s GLN 56 N 2.83 0.54 -0.53 3.52 2.00 -1.26 -4.91 119.66 121.85 3m1b s GLN 56 Ca 0.87 -1.01 -0.04 0.00 -2.00 0.00 0.00 55.36 53.18 3m1b s GLN 56 Cb -0.67 0.07 -0.08 0.00 0.80 0.00 0.00 33.01 33.14 3m1b s GLN 56 CO 0.45 -0.06 2.01 1.55 -0.50 0.00 0.00 175.29 178.74 3m1b n VAL 57 N 0.67 1.93 0.00 1.34 3.14 -1.26 -4.81 118.33 119.34 3m1b n VAL 57 Ca -0.18 -1.10 0.00 0.00 -2.96 0.00 0.00 64.34 60.10 3m1b n VAL 57 Cb 0.59 -1.95 0.00 0.00 -1.06 0.00 0.00 33.84 31.41 3m1b n VAL 57 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 3m1b n SER 58 N 3.77 0.00 -1.92 6.55 3.41 -1.26 -2.52 113.62 121.65 3m1b n SER 58 Ca 0.33 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.82 3m1b n SER 58 Cb 0.23 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.39 3m1b n SER 58 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 3m1b n TRP 59 N 0.00 2.31 -0.07 7.33 4.27 -1.26 -4.70 117.44 125.33 3m1b n TRP 59 Ca 0.00 -1.32 -0.07 0.00 -3.89 0.00 0.00 57.50 52.22 3m1b n TRP 59 Cb 0.00 -0.72 -0.04 0.00 -1.36 0.00 0.00 31.31 29.19 3m1b n TRP 59 CO 0.00 0.00 0.00 -0.92 -2.29 0.00 0.00 177.69 174.48 3m1b h TYR 60 N 1.56 0.00 -0.34 -2.67 5.03 -1.84 -3.17 116.97 115.54 3m1b h TYR 60 Ca 0.37 0.00 -0.09 0.00 2.58 0.00 0.00 58.73 61.59 3m1b h TYR 60 Cb 2.32 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 40.58 3m1b h TYR 60 CO 1.21 0.37 -0.18 -1.49 -1.32 0.00 0.00 178.16 176.75 3m1b h TRP 61 N -1.00 0.70 -0.57 -3.82 4.06 -1.90 0.16 115.95 113.58 3m1b h TRP 61 Ca -0.06 -0.14 -0.02 0.00 2.06 0.00 0.00 58.89 60.73 3m1b h TRP 61 Cb 0.56 -0.18 -0.03 0.00 -1.00 0.00 0.00 29.16 28.52 3m1b h TRP 61 CO -0.05 0.77 0.27 1.05 -3.56 0.00 0.00 178.44 176.92 3m1b h GLU 62 N 0.57 0.81 -0.06 0.49 4.11 -1.91 0.68 114.58 119.26 3m1b h GLU 62 Ca 0.09 -0.10 -0.13 0.00 0.07 0.00 0.00 59.36 59.29 3m1b h GLU 62 Cb 0.62 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 3m1b h GLU 62 CO 0.04 0.63 -0.57 -0.22 0.07 0.00 0.00 179.01 178.96 3m1b h LYS 63 N 0.81 0.19 -0.13 1.06 1.63 -1.10 -2.78 116.57 116.25 3m1b h LYS 63 Ca 0.20 -0.12 -0.18 0.00 -0.85 0.00 0.00 60.65 59.70 3m1b h LYS 63 Cb 0.09 0.02 0.01 0.00 -0.60 0.00 0.00 32.23 31.74 3m1b h LYS 63 CO -0.03 0.71 -0.63 0.93 -3.45 0.00 0.00 179.45 176.98 3m1b h GLU 64 N 0.14 0.65 0.00 1.90 4.39 -0.76 -3.26 114.58 117.65 3m1b h GLU 64 Ca -0.00 -0.53 0.00 0.00 0.34 0.00 0.00 59.36 59.17 3m1b h GLU 64 Cb 1.04 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 3m1b h GLU 64 CO 0.09 1.15 0.00 2.41 -1.16 0.00 0.00 179.01 181.49 3m1b n THR 65 N -4.10 0.00 -0.33 1.13 -1.04 0.21 -0.51 114.28 109.64 3m1b n THR 65 Ca -0.08 1.03 0.19 0.00 -2.04 0.00 0.00 64.05 63.16 3m1b n THR 65 Cb 0.67 -1.85 0.40 0.00 -1.82 0.00 0.00 70.33 67.73 3m1b n THR 65 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 3m1b h THR 66 N 0.00 0.41 -0.43 12.58 1.35 -1.70 0.67 112.91 125.79 3m1b h THR 66 Ca 0.00 -0.14 0.04 0.00 -0.55 0.00 0.00 66.41 65.76 3m1b h THR 66 Cb 0.00 -0.04 -0.04 0.00 -1.73 0.00 0.00 68.15 66.34 3m1b h THR 66 CO 0.00 0.08 0.18 0.44 -0.25 0.00 0.00 175.52 175.97 3m1b h ASP 67 N 0.42 0.24 0.47 5.36 5.19 -1.58 -1.97 116.42 124.54 3m1b h ASP 67 Ca 0.66 0.04 -0.02 0.00 -0.62 0.00 0.00 57.03 57.08 3m1b h ASP 67 Cb 1.37 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.88 3m1b h ASP 67 CO -0.55 0.18 -0.22 -0.07 -3.12 0.00 0.00 179.24 175.45 3m1b h LEU 68 N 0.38 -0.53 -0.61 1.55 3.38 0.24 -3.28 115.31 116.44 3m1b h LEU 68 Ca 0.19 0.02 0.23 0.00 0.09 0.00 0.00 57.88 58.41 3m1b h LEU 68 Cb 0.14 0.14 -0.11 0.00 0.09 0.00 0.00 40.66 40.92 3m1b h LEU 68 CO -0.17 -0.19 0.23 0.54 0.09 0.00 0.00 178.44 178.95 3m1b n ARG 69 N -4.75 -0.04 -0.23 1.13 1.74 0.19 0.31 116.66 115.01 3m1b n ARG 69 Ca -0.08 0.86 -0.02 0.00 -0.77 0.00 0.00 57.85 57.85 3m1b n ARG 69 Cb 0.25 -1.49 0.05 0.00 -1.02 0.00 0.00 32.46 30.25 3m1b n ARG 69 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3m1b h ILE 70 N 0.00 0.22 -0.95 0.55 2.04 -1.41 0.30 117.51 118.26 3m1b h ILE 70 Ca 0.47 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.57 3m1b h ILE 70 Cb 1.18 0.22 -0.13 0.00 -0.74 0.00 0.00 36.82 37.36 3m1b h ILE 70 CO -0.50 0.00 0.49 0.11 0.00 0.00 0.00 178.15 178.25 3m1b h LYS 71 N -0.07 0.45 0.56 2.37 6.56 0.47 -0.40 116.57 126.51 3m1b h LYS 71 Ca 0.30 -0.03 -0.03 0.00 -1.06 0.00 0.00 60.65 59.84 3m1b h LYS 71 Cb 0.54 -0.10 0.00 0.00 -0.57 0.00 0.00 32.23 32.10 3m1b h LYS 71 CO -0.72 0.29 -0.31 1.49 -2.06 0.00 0.00 179.45 178.14 3m1b h GLU 72 N 0.46 -0.78 0.00 3.15 4.81 -0.39 0.71 114.58 122.54 3m1b h GLU 72 Ca 0.62 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.90 3m1b h GLU 72 Cb 1.20 0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.76 3m1b h GLU 72 CO -0.52 -0.52 0.00 1.63 -0.73 0.00 0.00 179.01 178.87 3m1b n LYS 73 N -4.31 0.40 0.04 1.92 4.01 -1.06 -0.31 118.16 118.85 3m1b n LYS 73 Ca -0.10 0.03 -0.19 0.00 -0.51 0.00 0.00 58.31 57.54 3m1b n LYS 73 Cb 0.33 -1.50 -0.14 0.00 -0.51 0.00 0.00 35.03 33.20 3m1b n LYS 73 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 3m1b h LEU 74 N 0.00 0.42 0.01 -0.35 3.38 0.25 -3.26 115.31 115.76 3m1b h LEU 74 Ca 0.00 -0.71 -0.00 0.00 0.09 0.00 0.00 57.88 57.26 3m1b h LEU 74 Cb 0.03 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3m1b h LEU 74 CO 0.00 1.61 -0.01 -0.26 0.09 0.00 0.00 178.44 179.88 3m1b h PHE 75 N 0.07 -0.02 -0.99 1.13 -1.00 0.34 -2.41 116.94 114.08 3m1b h PHE 75 Ca -0.33 -0.00 0.33 0.00 2.81 0.00 0.00 57.97 60.79 3m1b h PHE 75 Cb 2.05 0.01 -0.16 0.00 3.61 0.00 0.00 35.95 41.45 3m1b h PHE 75 CO 0.07 0.75 0.50 -0.07 -1.61 0.00 0.00 178.31 177.95 3m1b h LEU 76 N -0.82 0.36 -0.86 1.54 3.38 -1.27 0.43 115.31 118.06 3m1b h LEU 76 Ca -0.00 0.21 -0.07 0.00 0.09 0.00 0.00 57.88 58.12 3m1b h LEU 76 Cb 0.77 0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.69 3m1b h LEU 76 CO 0.00 -0.22 0.11 -0.08 0.09 0.00 0.00 178.44 178.34 3m1b h GLU 77 N 0.22 0.96 -0.42 1.13 4.57 -1.56 -2.96 114.58 116.52 3m1b h GLU 77 Ca 0.74 -0.23 -0.08 0.00 -1.18 0.00 0.00 59.36 58.61 3m1b h GLU 77 Cb 1.73 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 30.17 3m1b h GLU 77 CO -0.67 0.88 -0.08 0.00 -1.18 0.00 0.00 179.01 177.96 3m1b h ALA 78 N 1.21 1.08 -0.10 2.92 0.00 -0.40 -1.88 119.26 122.09 3m1b h ALA 78 Ca 0.19 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3m1b h ALA 78 Cb 0.37 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3m1b h ALA 78 CO 0.01 0.57 -0.03 0.74 0.00 0.00 0.00 179.25 180.53 3m1b h PHE 79 N 0.66 0.14 0.00 0.00 0.05 -1.33 -1.92 116.94 114.54 3m1b h PHE 79 Ca 0.12 -0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.91 3m1b h PHE 79 Cb 0.53 -0.04 0.00 0.00 2.00 0.00 0.00 35.95 38.43 3m1b h PHE 79 CO 0.03 0.18 -0.11 1.63 -0.18 0.00 0.00 178.31 179.85 3m1b n LYS 80 N -4.42 0.14 0.00 1.51 4.01 -0.74 -2.67 118.16 116.00 3m1b n LYS 80 Ca -0.01 0.10 0.14 0.00 -0.51 0.00 0.00 58.31 58.02 3m1b n LYS 80 Cb 0.16 -1.65 0.55 0.00 -0.51 0.00 0.00 35.03 33.58 3m1b n LYS 80 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3m1b n ALA 81 N -1.66 2.70 -1.94 7.82 0.00 -0.73 -4.95 120.51 121.76 3m1b n ALA 81 Ca 0.06 -0.19 -0.37 0.00 0.00 0.00 0.00 53.44 52.94 3m1b n ALA 81 Cb 0.39 -1.37 -0.06 0.00 0.00 0.00 0.00 19.45 18.41 3m1b n ALA 81 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3m1b s LEU 82 N -2.88 4.39 0.00 0.00 1.02 -1.09 -4.75 118.68 115.37 3m1b s LEU 82 Ca 0.17 1.64 0.00 0.00 0.02 0.00 0.00 54.13 55.96 3m1b s LEU 82 Cb 0.19 -3.73 0.00 0.00 0.02 0.00 0.00 46.19 42.67 3m1b s LEU 82 CO 0.55 0.02 0.00 0.61 0.02 0.00 0.00 176.35 177.55 3m1b n GLY 83 N 0.80 -0.05 3.54 -3.19 0.00 -1.26 -5.04 105.19 99.99 3m1b n GLY 83 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 3m1b n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3m1b s GLY 84 N -1.91 1.60 0.42 -0.02 0.00 -1.26 -4.89 107.32 101.26 3m1b s GLY 84 Ca 0.00 0.16 0.17 0.00 0.00 0.00 0.00 44.72 45.05 3m1b s GLY 84 CO 0.00 0.78 1.87 0.07 0.00 0.00 0.00 173.10 175.82 3m1b h LYS 85 N -2.42 0.41 0.00 2.90 -0.00 -2.05 -3.48 116.57 111.94 3m1b h LYS 85 Ca -0.55 -0.02 0.00 0.00 -0.00 0.00 0.00 60.65 60.07 3m1b h LYS 85 Cb 1.31 -0.09 0.00 0.00 -0.00 0.00 0.00 32.23 33.45 3m1b h LYS 85 CO 0.46 0.27 0.00 0.41 -0.00 0.00 0.00 179.45 180.60 3m1b n GLY 86 N -1.51 0.65 3.93 0.07 0.00 -1.26 -4.86 105.19 102.20 3m1b n GLY 86 Ca 0.18 -0.82 -0.25 0.00 0.00 0.00 0.00 46.02 45.13 3m1b n GLY 86 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3m1b s PRO 87 N 0.00 2.87 0.21 1.61 0.04 -1.26 -5.17 135.00 133.30 3m1b s PRO 87 Ca 0.00 -0.20 0.06 0.00 0.04 0.00 0.00 61.00 60.91 3m1b s PRO 87 Cb 0.00 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 32.15 3m1b s PRO 87 CO 0.00 -0.64 0.16 0.71 0.04 0.00 0.00 177.00 177.27 3m1b s TYR 88 N -2.89 3.12 -0.06 0.56 1.51 -1.26 -4.99 117.35 113.34 3m1b s TYR 88 Ca 0.53 -0.07 -0.01 0.00 -1.01 0.00 0.00 57.07 56.51 3m1b s TYR 88 Cb -0.10 -1.45 0.03 0.00 -0.11 0.00 0.00 41.96 40.32 3m1b s TYR 88 CO 0.43 0.52 0.01 0.99 -1.11 0.00 0.00 175.55 176.39 3m1b s THR 89 N -1.93 0.27 -0.10 -0.71 2.01 -1.26 -2.83 115.64 111.08 3m1b s THR 89 Ca 0.32 0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.51 3m1b s THR 89 Cb -0.09 -0.44 0.02 0.00 0.01 0.00 0.00 72.50 72.00 3m1b s THR 89 CO 0.24 0.24 -0.12 -0.22 -0.69 0.00 0.00 174.62 174.06 3m1b s LEU 90 N 1.97 1.56 0.10 4.42 2.96 -0.93 -0.89 118.68 127.87 3m1b s LEU 90 Ca 0.04 -0.37 0.10 0.00 -0.22 0.00 0.00 54.13 53.68 3m1b s LEU 90 Cb -0.12 -0.97 -0.04 0.00 0.50 0.00 0.00 46.19 45.56 3m1b s LEU 90 CO -0.05 -0.02 -0.24 -1.10 -1.32 0.00 0.00 176.35 173.62 3m1b s GLN 91 N 1.16 1.62 0.00 1.98 -0.21 -0.69 -1.93 119.66 121.59 3m1b s GLN 91 Ca -0.04 -1.23 -0.01 0.00 0.02 0.00 0.00 55.36 54.09 3m1b s GLN 91 Cb -0.14 -1.99 -0.01 0.00 1.00 0.00 0.00 33.01 31.87 3m1b s GLN 91 CO -0.03 0.48 0.02 0.20 -2.12 0.00 0.00 175.29 173.83 3m1b s GLY 92 N -1.87 0.08 -0.46 3.09 0.00 -1.12 -1.48 107.32 105.56 3m1b s GLY 92 Ca 0.14 -0.19 0.04 0.00 0.00 0.00 0.00 44.72 44.72 3m1b s GLY 92 CO 0.06 -0.23 0.36 -2.27 0.00 0.00 0.00 173.10 171.02 3m1b s LEU 93 N -0.65 2.00 0.15 0.66 2.96 -0.84 -1.65 118.68 121.32 3m1b s LEU 93 Ca -0.07 -3.15 0.02 0.00 -0.22 0.00 0.00 54.13 50.70 3m1b s LEU 93 Cb -0.04 -0.65 -0.04 0.00 0.50 0.00 0.00 46.19 45.95 3m1b s LEU 93 CO -0.00 -0.16 0.30 -0.76 -1.32 0.00 0.00 176.35 174.40 3m1b s LEU 94 N -0.15 4.32 0.00 -0.68 1.02 -1.16 -3.54 118.68 118.50 3m1b s LEU 94 Ca 0.30 0.22 0.00 0.00 0.02 0.00 0.00 54.13 54.67 3m1b s LEU 94 Cb 0.00 -2.96 0.00 0.00 0.02 0.00 0.00 46.19 43.26 3m1b s LEU 94 CO -0.18 0.05 0.00 0.61 0.02 0.00 0.00 176.35 176.85 3m1b n GLY 95 N -0.50 -0.55 2.69 -3.19 0.00 0.17 0.21 105.19 104.02 3m1b n GLY 95 Ca -0.06 -0.82 -0.01 0.00 0.00 0.00 0.00 46.02 45.13 3m1b n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1b s GLU 97 N -2.03 0.22 0.33 0.00 -1.05 -1.15 -2.83 118.70 112.19 3m1b s GLU 97 Ca 0.17 0.45 -0.29 0.00 -0.15 0.00 0.00 54.97 55.14 3m1b s GLU 97 Cb -0.02 0.16 -0.11 0.00 -0.44 0.00 0.00 34.13 33.72 3m1b s GLU 97 CO 0.03 -0.06 1.55 1.28 0.95 0.00 0.00 175.26 179.01 3m1b n LEU 98 N 4.05 4.54 0.00 1.83 4.77 -1.26 -1.02 117.00 129.91 3m1b n LEU 98 Ca -0.14 1.18 0.00 0.00 -0.03 0.00 0.00 56.01 57.03 3m1b n LEU 98 Cb 0.56 -1.61 0.00 0.00 -2.33 0.00 0.00 43.42 40.04 3m1b n LEU 98 CO 0.00 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.83 3m1b n GLY 99 N 1.44 1.38 0.13 -0.72 0.00 0.53 -4.91 105.19 103.04 3m1b n GLY 99 Ca 0.05 -1.75 0.15 0.00 0.00 0.00 0.00 46.02 44.47 3m1b n GLY 99 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3m1b n PRO 100 N 0.00 1.18 -1.80 1.61 -0.05 -1.26 -4.03 135.00 130.64 3m1b n PRO 100 Ca 0.00 -0.26 0.01 0.00 -0.05 0.00 0.00 63.50 63.20 3m1b n PRO 100 Cb 0.00 -1.49 0.02 0.00 -0.05 0.00 0.00 33.50 31.98 3m1b n PRO 100 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 175.50 175.20 3m1b n ASP 101 N -0.68 0.69 0.00 3.54 8.00 -1.26 -5.00 116.55 121.83 3m1b n ASP 101 Ca 0.23 -2.02 0.00 0.00 0.71 0.00 0.00 54.79 53.71 3m1b n ASP 101 Cb 0.17 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.08 3m1b n ASP 101 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3m1b n ASN 102 N 0.05 0.00 -4.73 -2.24 6.94 -1.26 -5.01 115.26 109.01 3m1b n ASN 102 Ca -0.00 0.00 -0.40 0.00 -0.02 0.00 0.00 54.58 54.15 3m1b n ASN 102 Cb 0.99 -0.41 -0.05 0.00 -2.36 0.00 0.00 39.78 37.95 3m1b n ASN 102 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 3m1b s THR 103 N -2.83 4.80 0.08 5.53 -4.23 -1.26 -4.75 115.64 112.98 3m1b s THR 103 Ca 0.00 1.71 0.02 0.00 -1.18 0.00 0.00 61.69 62.23 3m1b s THR 103 Cb 0.00 -4.16 -0.04 0.00 1.34 0.00 0.00 72.50 69.65 3m1b s THR 103 CO 0.00 0.30 0.17 -0.94 -0.54 0.00 0.00 174.62 173.60 3m1b s SER 104 N 0.33 6.02 -0.38 3.99 1.04 -1.26 -0.34 113.70 123.10 3m1b s SER 104 Ca 0.42 0.14 0.04 0.00 0.48 0.00 0.00 55.95 57.03 3m1b s SER 104 Cb -0.20 -1.76 0.11 0.00 0.10 0.00 0.00 66.02 64.26 3m1b s SER 104 CO 0.23 0.16 0.10 -0.69 0.98 0.00 0.00 173.24 174.02 3m1b s VAL 105 N -1.50 2.35 0.67 5.02 1.01 -0.19 -4.89 120.40 122.87 3m1b s VAL 105 Ca 0.33 -2.57 -0.11 0.00 0.00 0.00 0.00 61.98 59.63 3m1b s VAL 105 Cb -0.12 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.53 3m1b s VAL 105 CO 0.26 -0.65 1.05 -2.84 0.00 0.00 0.00 175.10 172.92 3m1b s PRO 106 N 0.63 3.20 -0.25 2.72 0.02 -1.26 -2.94 135.00 137.13 3m1b s PRO 106 Ca 0.12 0.85 0.01 0.00 0.02 0.00 0.00 61.00 62.00 3m1b s PRO 106 Cb -0.21 -2.03 0.06 0.00 0.02 0.00 0.00 34.50 32.35 3m1b s PRO 106 CO -0.06 -0.88 -0.04 0.99 -0.33 0.00 0.00 177.00 176.68 3m1b s THR 107 N -3.11 1.55 -0.11 0.99 2.01 -0.17 -4.86 115.64 111.95 3m1b s THR 107 Ca 0.57 -1.31 -0.04 0.00 0.31 0.00 0.00 61.69 61.22 3m1b s THR 107 Cb -0.13 -1.86 0.05 0.00 0.01 0.00 0.00 72.50 70.57 3m1b s THR 107 CO 0.54 -0.16 0.08 0.00 -0.69 0.00 0.00 174.62 174.39 3m1b s ALA 108 N 1.37 0.31 -0.11 7.40 0.00 -1.23 -0.66 121.76 128.85 3m1b s ALA 108 Ca -0.04 -0.05 -0.22 0.00 0.00 0.00 0.00 51.96 51.64 3m1b s ALA 108 Cb -0.19 -0.84 0.05 0.00 0.00 0.00 0.00 23.12 22.14 3m1b s ALA 108 CO -0.07 -0.85 0.54 0.15 0.00 0.00 0.00 175.76 175.53 3m1b s LYS 109 N 2.16 0.80 -0.02 0.00 1.02 -1.24 -4.10 119.74 118.37 3m1b s LYS 109 Ca 0.03 0.36 0.04 0.00 0.02 0.00 0.00 55.97 56.42 3m1b s LYS 109 Cb -0.14 0.38 -0.01 0.00 -0.52 0.00 0.00 37.83 37.54 3m1b s LYS 109 CO -0.06 -0.19 -0.14 -0.06 -0.92 0.00 0.00 175.35 173.98 3m1b s PHE 110 N -0.63 1.28 -0.05 3.18 0.40 0.18 -2.00 117.98 120.34 3m1b s PHE 110 Ca -0.07 -0.28 0.02 0.00 -0.60 0.00 0.00 56.93 55.99 3m1b s PHE 110 Cb -0.03 -0.85 -0.03 0.00 0.51 0.00 0.00 43.02 42.63 3m1b s PHE 110 CO 0.05 -0.07 -0.08 0.00 0.70 0.00 0.00 175.22 175.82 3m1b s ALA 111 N -0.15 2.93 -0.12 5.36 0.00 -0.55 -0.65 121.76 128.58 3m1b s ALA 111 Ca 0.02 -0.94 -0.01 0.00 0.00 0.00 0.00 51.96 51.03 3m1b s ALA 111 Cb -0.07 -1.16 -0.03 0.00 0.00 0.00 0.00 23.12 21.87 3m1b s ALA 111 CO 0.00 0.58 -0.07 -1.17 0.00 0.00 0.00 175.76 175.10 3m1b s LEU 112 N -0.93 3.08 -0.10 0.00 2.96 0.21 -1.71 118.68 122.20 3m1b s LEU 112 Ca 0.13 -0.14 -0.03 0.00 -0.22 0.00 0.00 54.13 53.88 3m1b s LEU 112 Cb -0.11 -1.70 0.00 0.00 0.50 0.00 0.00 46.19 44.88 3m1b s LEU 112 CO 0.02 0.24 0.05 0.59 -1.32 0.00 0.00 176.35 175.94 3m1b n ASN 113 N 3.03 -0.30 0.00 3.68 3.02 -0.07 0.50 115.26 125.13 3m1b n ASN 113 Ca -0.18 -0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.27 3m1b n ASN 113 Cb 0.53 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.57 3m1b n ASN 113 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3m1b n GLY 114 N -1.03 0.58 2.69 7.41 0.00 -1.26 -5.04 105.19 108.53 3m1b n GLY 114 Ca -0.01 -0.42 -0.27 0.00 0.00 0.00 0.00 46.02 45.32 3m1b n GLY 114 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m1b s GLU 115 N -0.89 0.42 0.10 1.61 2.02 0.18 -5.07 118.70 117.07 3m1b s GLU 115 Ca 0.00 -0.25 -0.36 0.00 0.02 0.00 0.00 54.97 54.38 3m1b s GLU 115 Cb 0.00 -1.92 -0.17 0.00 0.10 0.00 0.00 34.13 32.14 3m1b s GLU 115 CO 0.00 -0.63 1.30 -1.91 0.02 0.00 0.00 175.26 174.04 3m1b n GLU 116 N 5.14 1.13 0.00 1.61 2.13 -1.26 -0.62 120.64 128.78 3m1b n GLU 116 Ca -0.08 0.41 0.00 0.00 0.66 0.00 0.00 57.16 58.15 3m1b n GLU 116 Cb 0.48 -2.02 0.00 0.00 0.27 0.00 0.00 31.44 30.17 3m1b n GLU 116 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 3m1b n PHE 117 N 2.30 0.00 -4.44 4.31 -1.74 0.17 -4.87 117.46 113.19 3m1b n PHE 117 Ca 0.18 0.00 -0.30 0.00 -0.56 0.00 0.00 57.45 56.77 3m1b n PHE 117 Cb 0.20 0.00 -0.11 0.00 1.52 0.00 0.00 39.48 41.09 3m1b n PHE 117 CO 0.00 0.00 0.00 -1.64 -0.56 0.00 0.00 176.76 174.56 3m1b s MET 118 N -0.86 2.01 -0.18 3.97 -1.94 -1.03 -4.32 119.30 116.95 3m1b s MET 118 Ca 0.00 -1.04 -0.09 0.00 -1.71 0.00 0.00 55.69 52.84 3m1b s MET 118 Cb 0.00 -2.20 0.06 0.00 2.01 0.00 0.00 34.83 34.70 3m1b s MET 118 CO 0.00 0.52 0.43 0.54 -0.01 0.00 0.00 175.02 176.49 3m1b s ASN 119 N -1.83 -0.52 -0.22 3.03 4.22 -1.09 0.47 114.94 119.00 3m1b s ASN 119 Ca 0.17 0.94 -0.29 0.00 -2.14 0.00 0.00 52.86 51.54 3m1b s ASN 119 Cb -0.11 0.86 -0.01 0.00 1.28 0.00 0.00 41.25 43.27 3m1b s ASN 119 CO 0.09 -0.20 1.33 0.12 -2.04 0.00 0.00 177.10 176.40 3m1b s PHE 120 N 1.52 2.66 -0.41 1.54 5.36 -1.26 -2.40 117.98 125.00 3m1b s PHE 120 Ca -0.09 0.86 -0.25 0.00 -0.96 0.00 0.00 56.93 56.50 3m1b s PHE 120 Cb -0.09 -3.75 0.02 0.00 -0.34 0.00 0.00 43.02 38.87 3m1b s PHE 120 CO -0.13 -1.93 0.88 0.34 -1.46 0.00 0.00 175.22 172.93 3m1b s ASP 121 N 2.62 6.57 0.07 6.13 3.68 0.33 -4.91 116.67 131.17 3m1b s ASP 121 Ca 0.58 0.31 -0.15 0.00 2.13 0.00 0.00 52.55 55.43 3m1b s ASP 121 Cb -0.20 -2.44 -0.20 0.00 -1.45 0.00 0.00 42.92 38.63 3m1b s ASP 121 CO 0.20 -0.91 1.22 -0.07 0.13 0.00 0.00 175.17 175.75 3m1b h LEU 122 N 10.19 0.86 -1.73 -1.34 4.07 -1.93 0.23 115.31 125.66 3m1b h LEU 122 Ca -0.24 -0.69 0.41 0.00 0.08 0.00 0.00 57.88 57.43 3m1b h LEU 122 Cb 1.08 -0.26 -0.08 0.00 1.08 0.00 0.00 40.66 42.48 3m1b h LEU 122 CO 0.98 1.43 0.95 0.11 -1.08 0.00 0.00 178.44 180.84 3m1b h LYS 123 N 0.37 0.09 0.00 1.13 1.57 -1.94 -0.38 116.57 117.41 3m1b h LYS 123 Ca -0.09 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3m1b h LYS 123 Cb 1.51 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.80 3m1b h LYS 123 CO 0.17 0.06 -0.18 0.00 -0.57 0.00 0.00 179.45 178.94 3m1b n GLN 124 N -4.34 0.75 -2.13 3.15 10.64 -1.24 -5.04 117.38 119.17 3m1b n GLN 124 Ca 0.33 -1.26 -0.20 0.00 -1.83 0.00 0.00 57.00 54.04 3m1b n GLN 124 Cb 1.41 -0.78 -0.03 0.00 -0.86 0.00 0.00 30.24 29.97 3m1b n GLN 124 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3m1b n GLY 125 N -0.37 0.29 3.42 2.61 0.00 0.23 -4.97 105.19 106.39 3m1b n GLY 125 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.84 3m1b n GLY 125 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m1b s THR 126 N -2.90 2.00 0.09 2.61 2.01 0.56 -4.91 115.64 115.10 3m1b s THR 126 Ca 0.00 -2.26 -0.24 0.00 0.31 0.00 0.00 61.69 59.50 3m1b s THR 126 Cb 0.00 -2.24 -0.06 0.00 0.01 0.00 0.00 72.50 70.20 3m1b s THR 126 CO 0.00 -0.45 0.74 0.26 -0.69 0.00 0.00 174.62 174.48 3m1b s TRP 127 N -2.80 3.80 0.12 4.92 0.51 -1.26 0.12 118.94 124.35 3m1b s TRP 127 Ca 0.27 1.50 0.08 0.00 -2.12 0.00 0.00 56.10 55.82 3m1b s TRP 127 Cb -0.01 -2.76 -0.04 0.00 -0.81 0.00 0.00 33.47 29.85 3m1b s TRP 127 CO 0.11 0.39 -0.18 0.20 -0.51 0.00 0.00 176.95 176.96 3m1b s GLY 128 N -0.53 1.20 0.00 0.98 0.00 -1.01 -4.86 107.32 103.10 3m1b s GLY 128 Ca 0.36 -1.28 0.00 0.00 0.00 0.00 0.00 44.72 43.80 3m1b s GLY 128 CO 0.23 -1.31 0.00 0.61 0.00 0.00 0.00 173.10 172.64 3m1b n GLY 129 N 0.83 1.23 0.00 0.20 0.00 -1.26 -2.66 105.19 103.53 3m1b n GLY 129 Ca -0.18 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.41 3m1b n GLY 129 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3m1b n ASP 130 N 0.00 0.00 -4.90 1.61 5.68 -1.26 -4.96 116.55 112.72 3m1b n ASP 130 Ca 0.00 0.00 -0.29 0.00 -0.50 0.00 0.00 54.79 54.00 3m1b n ASP 130 Cb 0.00 0.00 0.08 0.00 -1.14 0.00 0.00 41.12 40.06 3m1b n ASP 130 CO 0.00 0.00 0.00 0.26 -1.33 0.00 0.00 177.20 176.13 3m1b s TRP 131 N -1.00 3.03 0.05 2.11 0.51 -1.26 -4.91 118.94 117.47 3m1b s TRP 131 Ca 0.00 0.76 0.16 0.00 -2.12 0.00 0.00 56.10 54.90 3m1b s TRP 131 Cb 0.00 -3.35 0.34 0.00 -0.81 0.00 0.00 33.47 29.66 3m1b s TRP 131 CO 0.00 -1.58 1.57 -1.35 -0.51 0.00 0.00 176.95 175.09 3m1b h PRO 132 N -0.88 0.00 0.19 4.98 0.11 -2.00 -2.25 132.00 132.15 3m1b h PRO 132 Ca -0.46 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.34 3m1b h PRO 132 Cb 1.31 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.44 3m1b h PRO 132 CO 0.65 0.50 -1.48 1.05 -0.21 0.00 0.00 178.00 178.50 3m1b h GLU 133 N 0.00 0.40 -0.86 1.05 9.09 -1.98 -3.13 114.58 119.15 3m1b h GLU 133 Ca -0.00 -0.68 0.15 0.00 0.05 0.00 0.00 59.36 58.87 3m1b h GLU 133 Cb 1.18 0.25 -0.15 0.00 -1.65 0.00 0.00 28.75 28.38 3m1b h GLU 133 CO 0.06 1.33 -0.31 0.00 0.05 0.00 0.00 179.01 180.14 3m1b h ALA 134 N 0.09 0.27 -0.06 1.06 0.00 -1.85 0.23 119.26 119.00 3m1b h ALA 134 Ca -0.29 0.28 -0.21 0.00 0.00 0.00 0.00 54.91 54.70 3m1b h ALA 134 Cb 2.00 0.83 0.00 0.00 0.00 0.00 0.00 17.79 20.62 3m1b h ALA 134 CO 0.18 -0.55 -0.82 -0.07 0.00 0.00 0.00 179.25 177.99 3m1b h LEU 135 N -0.04 0.58 -1.16 0.00 3.38 -1.59 -3.17 115.31 113.31 3m1b h LEU 135 Ca 0.35 -0.41 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 3m1b h LEU 135 Cb 0.61 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3m1b h LEU 135 CO -0.89 1.18 -0.08 0.00 0.09 0.00 0.00 178.44 178.74 3m1b h ALA 136 N 0.80 1.31 0.52 1.53 0.00 -0.56 0.57 119.26 123.43 3m1b h ALA 136 Ca -0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 3m1b h ALA 136 Cb 1.43 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 19.09 3m1b h ALA 136 CO 0.15 0.46 -0.25 0.82 0.00 0.00 0.00 179.25 180.43 3m1b h ILE 137 N 0.46 0.15 -0.94 0.00 2.04 -1.25 -2.94 117.51 115.02 3m1b h ILE 137 Ca 0.09 -0.49 0.39 0.00 1.00 0.00 0.00 64.86 65.84 3m1b h ILE 137 Cb 0.43 0.23 -0.17 0.00 -0.74 0.00 0.00 36.82 36.56 3m1b h ILE 137 CO 0.02 0.03 0.47 -0.24 0.00 0.00 0.00 178.15 178.44 3m1b n SER 138 N -5.25 0.30 0.20 1.72 2.88 -1.02 0.18 113.62 112.63 3m1b n SER 138 Ca -0.10 1.56 0.13 0.00 -1.33 0.00 0.00 58.87 59.14 3m1b n SER 138 Cb 0.30 -0.75 0.36 0.00 -0.75 0.00 0.00 64.21 63.37 3m1b n SER 138 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 3m1b h GLN 139 N 0.00 0.00 0.02 -1.46 4.15 -0.86 -2.25 115.11 114.72 3m1b h GLN 139 Ca 0.78 0.00 -0.26 0.00 0.77 0.00 0.00 58.65 59.95 3m1b h GLN 139 Cb 2.05 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 29.71 3m1b h GLN 139 CO -0.73 0.00 -1.34 -0.09 -1.93 0.00 0.00 178.83 174.74 3m1b h ARG 140 N 0.00 0.05 -0.35 1.69 2.43 0.21 -3.07 114.38 115.33 3m1b h ARG 140 Ca 0.00 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 3m1b h ARG 140 Cb 0.78 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.36 3m1b h ARG 140 CO 0.00 0.85 0.00 0.91 -1.51 0.00 0.00 179.97 180.22 3m1b n TRP 141 N -3.27 0.00 -1.41 2.20 8.01 -0.01 -1.11 117.44 121.86 3m1b n TRP 141 Ca -0.09 0.00 0.05 0.00 -1.31 0.00 0.00 57.50 56.15 3m1b n TRP 141 Cb 1.00 -0.03 0.19 0.00 -2.01 0.00 0.00 31.31 30.46 3m1b n TRP 141 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.69 177.72 3m1b n GLN 142 N -0.32 1.64 -0.02 -0.99 1.13 -0.87 -4.56 117.38 113.39 3m1b n GLN 142 Ca 0.00 -3.08 -0.04 0.00 -1.94 0.00 0.00 57.00 51.95 3m1b n GLN 142 Cb 0.09 -1.64 -0.02 0.00 0.11 0.00 0.00 30.24 28.78 3m1b n GLN 142 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3m1b n GLN 143 N -1.16 0.09 -1.95 -1.09 3.00 -0.27 -5.00 117.38 111.00 3m1b n GLN 143 Ca 0.21 0.03 -0.42 0.00 -0.01 0.00 0.00 57.00 56.81 3m1b n GLN 143 Cb 0.75 -0.83 -0.03 0.00 0.00 0.00 0.00 30.24 30.13 3m1b n GLN 143 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.06 176.41 3m1b s GLN 144 N -2.07 4.21 0.45 -1.09 -1.52 -1.17 -4.95 119.66 113.52 3m1b s GLN 144 Ca -0.05 2.32 -0.25 0.00 -1.95 0.00 0.00 55.36 55.43 3m1b s GLN 144 Cb 0.02 -3.39 -0.08 0.00 -0.22 0.00 0.00 33.01 29.34 3m1b s GLN 144 CO 0.08 -0.66 1.32 0.34 -0.25 0.00 0.00 175.29 176.12 3m1b s ASP 145 N 1.78 6.00 -0.55 5.90 -1.08 -1.26 -2.71 116.67 124.75 3m1b s ASP 145 Ca 0.71 2.69 -0.01 0.00 -0.52 0.00 0.00 52.55 55.43 3m1b s ASP 145 Cb -0.41 -2.64 0.01 0.00 -1.46 0.00 0.00 42.92 38.42 3m1b s ASP 145 CO 0.32 -1.06 0.02 0.29 0.52 0.00 0.00 175.17 175.26 3m1b n LYS 146 N -0.23 -2.63 0.39 4.34 4.01 -1.26 -4.86 118.16 117.92 3m1b n LYS 146 Ca 0.06 0.29 -0.19 0.00 -0.51 0.00 0.00 58.31 57.96 3m1b n LYS 146 Cb 0.44 -4.84 -0.10 0.00 -0.51 0.00 0.00 35.03 30.02 3m1b n LYS 146 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3m1b h ALA 147 N 1.00 -1.19 -0.06 7.82 0.00 -1.81 -3.10 119.26 121.92 3m1b h ALA 147 Ca -0.16 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.48 3m1b h ALA 147 Cb 1.11 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 3m1b h ALA 147 CO 0.19 -1.19 -0.18 0.00 0.00 0.00 0.00 179.25 178.07 3m1b h ALA 148 N -1.00 1.58 0.31 0.00 0.00 -1.85 -3.13 119.26 115.17 3m1b h ALA 148 Ca -0.09 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 3m1b h ALA 148 Cb 0.92 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3m1b h ALA 148 CO 0.07 0.31 -0.15 -0.91 0.00 0.00 0.00 179.25 178.57 3m1b h ASN 149 N 0.10 -0.35 0.00 0.00 4.21 -1.93 -2.75 115.58 114.86 3m1b h ASN 149 Ca 0.02 -0.14 0.00 0.00 1.21 0.00 0.00 56.30 57.38 3m1b h ASN 149 Cb 0.38 0.09 0.00 0.00 -1.12 0.00 0.00 38.32 37.67 3m1b h ASN 149 CO 0.03 -0.04 0.06 0.29 -1.29 0.00 0.00 177.43 176.47 3m1b n LYS 150 N -5.16 0.00 -0.07 0.81 5.02 -1.17 1.00 118.16 118.58 3m1b n LYS 150 Ca -0.10 0.30 -0.22 0.00 -2.02 0.00 0.00 58.31 56.27 3m1b n LYS 150 Cb 0.25 -1.56 -0.12 0.00 -0.02 0.00 0.00 35.03 33.58 3m1b n LYS 150 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3m1b n GLU 151 N -1.28 0.65 -0.05 1.97 -0.58 -1.10 -0.91 120.64 119.33 3m1b n GLU 151 Ca 0.00 0.37 -0.11 0.00 -0.42 0.00 0.00 57.16 57.00 3m1b n GLU 151 Cb 0.06 -1.67 -0.05 0.00 -0.57 0.00 0.00 31.44 29.21 3m1b n GLU 151 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3m1b h LEU 152 N -0.49 0.27 0.35 -4.62 -0.00 -0.11 0.26 115.31 110.96 3m1b h LEU 152 Ca -0.46 -0.18 -0.01 0.00 -0.00 0.00 0.00 57.88 57.23 3m1b h LEU 152 Cb 1.69 -0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 42.26 3m1b h LEU 152 CO -0.12 0.38 -0.36 0.74 -0.00 0.00 0.00 178.44 179.08 3m1b h THR 153 N 0.14 0.00 -0.46 0.22 2.02 0.47 -0.32 112.91 114.99 3m1b h THR 153 Ca 0.06 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.33 3m1b h THR 153 Cb 0.20 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.51 3m1b h THR 153 CO -0.00 0.00 -0.30 0.15 0.37 0.00 0.00 175.52 175.73 3m1b h PHE 154 N -0.71 -0.83 0.10 3.16 3.04 -0.99 0.49 116.94 121.21 3m1b h PHE 154 Ca -0.04 0.06 -0.30 0.00 3.98 0.00 0.00 57.97 61.67 3m1b h PHE 154 Cb 0.62 0.43 -0.01 0.00 2.56 0.00 0.00 35.95 39.55 3m1b h PHE 154 CO -0.21 -0.37 -1.48 -0.07 -2.02 0.00 0.00 178.31 174.17 3m1b h LEU 155 N -0.20 0.34 0.00 0.59 3.38 -0.99 0.13 115.31 118.56 3m1b h LEU 155 Ca 0.20 -0.46 -0.37 0.00 0.09 0.00 0.00 57.88 57.34 3m1b h LEU 155 Cb 0.53 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.10 3m1b h LEU 155 CO -0.57 1.38 -2.32 0.18 0.09 0.00 0.00 178.44 177.20 3m1b n LEU 156 N -3.42 0.83 0.00 1.67 4.77 -0.13 -4.47 117.00 116.25 3m1b n LEU 156 Ca -0.15 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 3m1b n LEU 156 Cb 1.03 0.10 0.00 0.00 -2.33 0.00 0.00 43.42 42.23 3m1b n LEU 156 CO 0.50 0.60 0.00 0.49 -1.33 0.00 0.00 177.39 177.65 3m1b n PHE 157 N -2.92 0.00 0.27 -1.77 0.99 0.16 -4.68 117.46 109.51 3m1b n PHE 157 Ca -0.34 0.00 0.18 0.00 -0.00 0.00 0.00 57.45 57.29 3m1b n PHE 157 Cb 1.11 0.00 0.94 0.00 -1.00 0.00 0.00 39.48 40.52 3m1b n PHE 157 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 3m1b h SER 158 N 0.00 0.00 0.00 4.37 4.64 -1.27 -3.13 113.55 118.17 3m1b h SER 158 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m1b h SER 158 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3m1b h SER 158 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 3m1b n PRO 160 N -1.91 0.05 -0.15 0.00 -0.02 -1.18 -1.13 135.00 130.64 3m1b n PRO 160 Ca 0.00 0.12 -0.07 0.00 -2.02 0.00 0.00 63.50 61.53 3m1b n PRO 160 Cb 0.00 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.00 3m1b n PRO 160 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3m1b h HIS 161 N 0.00 0.56 -0.03 6.00 2.76 -1.58 0.45 115.15 123.31 3m1b h HIS 161 Ca 0.00 0.01 -0.13 0.00 -2.20 0.00 0.00 60.37 58.05 3m1b h HIS 161 Cb 0.35 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 29.11 3m1b h HIS 161 CO 0.00 0.34 -0.60 0.00 -1.30 0.00 0.00 177.93 176.37 3m1b h ARG 162 N 0.60 0.09 -0.04 5.26 3.08 -0.98 -2.22 114.38 120.17 3m1b h ARG 162 Ca 0.18 -0.06 -0.21 0.00 0.07 0.00 0.00 59.98 59.95 3m1b h ARG 162 Cb -0.04 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.02 3m1b h ARG 162 CO -0.06 0.67 -0.85 1.25 -1.07 0.00 0.00 179.97 179.91 3m1b h LEU 163 N 0.07 0.58 -0.61 3.04 5.85 -1.09 -2.34 115.31 120.80 3m1b h LEU 163 Ca -0.01 -0.42 -0.13 0.00 0.84 0.00 0.00 57.88 58.16 3m1b h LEU 163 Cb 1.08 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.92 3m1b h LEU 163 CO 0.08 1.20 -0.61 0.03 -0.34 0.00 0.00 178.44 178.80 3m1b h ARG 164 N 0.29 0.00 0.49 1.25 2.47 -0.17 -2.90 114.38 115.81 3m1b h ARG 164 Ca -0.06 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 58.64 3m1b h ARG 164 Cb 1.47 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.79 3m1b h ARG 164 CO 0.15 0.61 -0.27 0.93 0.56 0.00 0.00 179.97 181.95 3m1b h GLU 165 N 0.00 -0.69 0.00 0.04 5.08 -1.25 -3.26 114.58 114.50 3m1b h GLU 165 Ca -0.01 0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.31 3m1b h GLU 165 Cb 1.19 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 3m1b h GLU 165 CO 0.08 -0.46 -0.42 0.45 -1.00 0.00 0.00 179.01 177.66 3m1b h HIS 166 N -0.71 0.00 0.00 4.33 3.86 -1.51 -3.01 115.15 118.11 3m1b h HIS 166 Ca -0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 3m1b h HIS 166 Cb 0.57 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.04 3m1b h HIS 166 CO -0.07 0.42 0.00 -0.11 0.86 0.00 0.00 177.93 179.03 3m1b n LEU 167 N -3.48 0.00 0.00 2.43 7.94 -1.09 -1.68 117.00 121.12 3m1b n LEU 167 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3m1b n LEU 167 Cb 0.56 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.51 3m1b n LEU 167 CO 0.38 0.00 0.00 -0.62 -1.11 0.00 0.00 177.39 176.04 3m1b n GLU 168 N -0.91 0.00 -0.31 1.96 1.02 -1.14 -4.11 120.64 117.16 3m1b n GLU 168 Ca 0.05 0.00 0.31 0.00 -0.02 0.00 0.00 57.16 57.50 3m1b n GLU 168 Cb 0.02 -0.03 0.67 0.00 -0.02 0.00 0.00 31.44 32.09 3m1b n GLU 168 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3m1b h ARG 169 N 0.00 0.12 -0.37 3.49 3.08 -1.63 0.77 114.38 119.85 3m1b h ARG 169 Ca 0.00 -0.01 -0.27 0.00 0.07 0.00 0.00 59.98 59.77 3m1b h ARG 169 Cb 0.00 -0.03 -0.22 0.00 0.08 0.00 0.00 29.97 29.80 3m1b h ARG 169 CO 0.00 0.08 -0.67 0.41 -1.07 0.00 0.00 179.97 178.72 3m1b n GLY 170 N -1.67 5.62 0.31 0.04 0.00 -0.68 -4.78 105.19 104.03 3m1b n GLY 170 Ca 0.25 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.32 3m1b n GLY 170 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3m1b h ARG 171 N 1.59 0.87 0.00 1.61 1.12 0.59 0.91 114.38 121.07 3m1b h ARG 171 Ca 0.17 -0.05 -0.00 0.00 -1.11 0.00 0.00 59.98 58.99 3m1b h ARG 171 Cb 1.28 -0.20 -0.00 0.00 -0.01 0.00 0.00 29.97 31.04 3m1b h ARG 171 CO 0.37 0.58 -0.01 0.78 -3.11 0.00 0.00 179.97 178.57 3m1b h GLY 172 N 0.90 0.00 0.68 2.80 0.00 -1.87 -3.16 103.07 102.43 3m1b h GLY 172 Ca 0.36 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.67 3m1b h GLY 172 CO -0.18 0.00 -0.15 3.43 0.00 0.00 0.00 176.54 179.64 3m1b h ASN 173 N 0.00 -0.37 -0.28 0.19 -0.26 -1.16 -2.98 115.58 110.72 3m1b h ASN 173 Ca -0.00 -0.16 -0.04 0.00 -0.56 0.00 0.00 56.30 55.54 3m1b h ASN 173 Cb 0.53 0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 37.87 3m1b h ASN 173 CO 0.00 -0.01 0.03 -0.07 -1.06 0.00 0.00 177.43 176.32 3m1b h LEU 174 N -0.75 0.46 0.00 1.61 -0.00 -1.62 -2.50 115.31 112.50 3m1b h LEU 174 Ca -0.04 -0.27 0.00 0.00 -0.00 0.00 0.00 57.88 57.56 3m1b h LEU 174 Cb 0.50 -0.12 0.00 0.00 -0.00 0.00 0.00 40.66 41.04 3m1b h LEU 174 CO 0.07 0.62 0.00 -0.62 -0.00 0.00 0.00 178.44 178.51 3m1b n GLU 175 N -4.63 0.19 -1.65 1.13 1.02 -1.19 -4.75 120.64 110.74 3m1b n GLU 175 Ca -0.03 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.67 3m1b n GLU 175 Cb 0.22 -1.19 -0.02 0.00 -0.02 0.00 0.00 31.44 30.43 3m1b n GLU 175 CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18 3m1b n TRP 176 N -0.69 1.96 -3.42 -0.32 -0.00 -0.95 -4.99 117.44 109.03 3m1b n TRP 176 Ca 0.02 0.54 -0.24 0.00 -0.00 0.00 0.00 57.50 57.81 3m1b n TRP 176 Cb 0.01 -2.39 -0.10 0.00 -0.00 0.00 0.00 31.31 28.82 3m1b n TRP 176 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 3m1b s LYS 177 N -0.98 0.58 -0.42 5.87 1.02 -1.26 -4.53 119.74 120.01 3m1b s LYS 177 Ca 0.64 -1.14 -0.18 0.00 0.02 0.00 0.00 55.97 55.31 3m1b s LYS 177 Cb -0.66 -1.06 0.02 0.00 -0.52 0.00 0.00 37.83 35.61 3m1b s LYS 177 CO 0.55 -1.20 0.48 -2.00 -0.92 0.00 0.00 175.35 172.25 3m1b s GLU 178 N 1.22 3.13 0.85 1.68 2.12 -1.23 -4.80 118.70 121.66 3m1b s GLU 178 Ca 0.18 -0.69 -0.11 0.00 0.36 0.00 0.00 54.97 54.71 3m1b s GLU 178 Cb -0.20 -3.97 0.10 0.00 0.26 0.00 0.00 34.13 30.33 3m1b s GLU 178 CO -0.01 -0.89 1.10 -1.25 -0.54 0.00 0.00 175.26 173.68 3m1b s PRO 179 N 2.27 1.60 0.31 4.30 0.04 -1.26 -0.52 135.00 141.74 3m1b s PRO 179 Ca 0.14 1.20 -0.02 0.00 0.04 0.00 0.00 61.00 62.36 3m1b s PRO 179 Cb -0.16 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.51 3m1b s PRO 179 CO 0.15 -2.11 0.53 -1.25 0.04 0.00 0.00 177.00 174.36 3m1b s PRO 180 N -4.82 3.54 -0.02 0.56 0.04 -1.23 -4.50 135.00 128.57 3m1b s PRO 180 Ca 0.63 -0.19 -0.18 0.00 0.04 0.00 0.00 61.00 61.30 3m1b s PRO 180 Cb -0.19 -2.67 -0.05 0.00 0.04 0.00 0.00 34.50 31.62 3m1b s PRO 180 CO 0.57 0.20 0.51 -1.12 0.04 0.00 0.00 177.00 177.19 3m1b s SER 181 N -3.59 6.87 -0.04 6.66 0.01 0.53 -4.84 113.70 119.30 3m1b s SER 181 Ca 0.41 1.03 0.05 0.00 1.31 0.00 0.00 55.95 58.76 3m1b s SER 181 Cb -0.10 -2.31 -0.02 0.00 0.21 0.00 0.00 66.02 63.80 3m1b s SER 181 CO 0.33 0.17 -0.20 -0.04 0.41 0.00 0.00 173.24 173.91 3m1b s MET 182 N -0.40 2.41 0.23 12.44 -1.94 -1.26 0.11 119.30 130.89 3m1b s MET 182 Ca 0.27 -0.82 0.04 0.00 -1.71 0.00 0.00 55.69 53.47 3m1b s MET 182 Cb -0.17 -2.23 -0.05 0.00 2.01 0.00 0.00 34.83 34.38 3m1b s MET 182 CO 0.15 0.54 -0.01 0.50 -0.01 0.00 0.00 175.02 176.19 3m1b s ARG 183 N -0.53 1.34 -0.30 2.03 6.06 0.45 -4.99 118.95 123.00 3m1b s ARG 183 Ca 0.07 -1.67 0.14 0.00 -2.50 0.00 0.00 55.73 51.77 3m1b s ARG 183 Cb -0.11 -0.63 0.40 0.00 0.06 0.00 0.00 34.95 34.67 3m1b s ARG 183 CO 0.01 -0.09 1.42 -0.11 -2.50 0.00 0.00 175.30 174.03 3m1b n LEU 184 N -0.42 -0.80 -4.76 -0.88 7.94 -1.26 -2.06 117.00 114.77 3m1b n LEU 184 Ca -0.05 -3.08 -0.35 0.00 -1.11 0.00 0.00 56.01 51.42 3m1b n LEU 184 Cb 0.64 0.16 0.03 0.00 0.53 0.00 0.00 43.42 44.78 3m1b n LEU 184 CO 0.37 1.55 0.79 -0.54 -1.11 0.00 0.00 177.39 178.44 3m1b s LYS 185 N -0.66 2.96 -0.53 1.96 3.01 -1.25 -4.44 119.74 120.80 3m1b s LYS 185 Ca 0.12 1.62 0.04 0.00 -1.01 0.00 0.00 55.97 56.74 3m1b s LYS 185 Cb 0.39 -1.95 0.14 0.00 -1.01 0.00 0.00 37.83 35.41 3m1b s LYS 185 CO -0.10 -1.17 0.31 0.00 0.51 0.00 0.00 175.35 174.90 3m1b s ALA 186 N -1.91 2.95 0.34 5.17 0.00 -1.26 -2.98 121.76 124.07 3m1b s ALA 186 Ca 0.72 -3.15 -0.28 0.00 0.00 0.00 0.00 51.96 49.25 3m1b s ALA 186 Cb -0.25 -2.04 -0.10 0.00 0.00 0.00 0.00 23.12 20.73 3m1b s ALA 186 CO 0.35 -2.05 1.28 -0.98 0.00 0.00 0.00 175.76 174.36 3m1b s ARG 187 N -0.34 4.33 -0.33 0.00 1.70 -0.70 -4.87 118.95 118.74 3m1b s ARG 187 Ca 0.20 2.15 -0.23 0.00 -0.47 0.00 0.00 55.73 57.38 3m1b s ARG 187 Cb -0.19 -3.03 0.00 0.00 -0.57 0.00 0.00 34.95 31.17 3m1b s ARG 187 CO -0.05 -0.19 0.76 -1.25 -1.08 0.00 0.00 175.30 173.50 3m1b s PRO 188 N -1.84 3.86 0.00 3.89 0.04 -1.26 -0.58 135.00 139.11 3m1b s PRO 188 Ca 0.50 0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.96 3m1b s PRO 188 Cb -0.38 -3.76 0.00 0.00 0.04 0.00 0.00 34.50 30.39 3m1b s PRO 188 CO 0.51 -0.74 0.00 -1.13 0.04 0.00 0.00 177.00 175.68 3m1b n SER 189 N 6.25 0.00 -4.73 6.66 3.41 -1.13 -4.84 113.62 119.24 3m1b n SER 189 Ca 0.03 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.22 3m1b n SER 189 Cb 0.48 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.41 3m1b n SER 189 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3m1b n SER 190 N 0.00 3.97 -4.68 4.04 3.41 -1.26 -4.84 113.62 114.26 3m1b n SER 190 Ca 0.00 1.10 -0.51 0.00 -0.26 0.00 0.00 58.87 59.20 3m1b n SER 190 Cb 0.00 -1.59 -0.05 0.00 -0.26 0.00 0.00 64.21 62.31 3m1b n SER 190 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 3m1b n PRO 191 N 3.11 1.80 0.00 4.33 -0.02 -1.26 -0.29 135.00 142.67 3m1b n PRO 191 Ca 0.12 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 3m1b n PRO 191 Cb 0.36 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 3m1b n PRO 191 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m1b n GLY 192 N 4.15 3.25 3.86 -1.23 0.00 -1.26 -5.08 105.19 108.89 3m1b n GLY 192 Ca 0.23 -1.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.01 3m1b n GLY 192 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3m1b s PHE 193 N -0.06 2.89 -0.26 1.61 -0.00 0.60 -0.63 117.98 122.14 3m1b s PHE 193 Ca 0.00 -0.32 -0.03 0.00 -0.00 0.00 0.00 56.93 56.58 3m1b s PHE 193 Cb 0.00 -1.85 0.14 0.00 -0.00 0.00 0.00 43.02 41.31 3m1b s PHE 193 CO 0.00 0.14 0.46 -1.54 -0.00 0.00 0.00 175.22 174.27 3m1b s SER 194 N -4.02 -0.35 0.12 1.98 1.04 0.86 -2.84 113.70 110.49 3m1b s SER 194 Ca 0.42 0.56 -0.31 0.00 0.48 0.00 0.00 55.95 57.10 3m1b s SER 194 Cb -0.06 1.50 -0.10 0.00 0.10 0.00 0.00 66.02 67.47 3m1b s SER 194 CO 0.27 -0.28 1.78 0.54 0.98 0.00 0.00 173.24 176.53 3m1b s VAL 195 N 2.66 2.60 -0.52 5.02 0.11 0.25 -1.52 120.40 129.00 3m1b s VAL 195 Ca 0.13 0.14 -0.05 0.00 -2.93 0.00 0.00 61.98 59.27 3m1b s VAL 195 Cb -0.15 -3.09 0.14 0.00 -1.53 0.00 0.00 36.38 31.75 3m1b s VAL 195 CO -0.17 0.00 0.35 -0.76 -3.33 0.00 0.00 175.10 171.19 3m1b s LEU 196 N 2.55 5.47 0.06 2.54 1.43 -1.12 -1.72 118.68 127.90 3m1b s LEU 196 Ca 0.79 -2.29 -0.30 0.00 -1.03 0.00 0.00 54.13 51.29 3m1b s LEU 196 Cb -0.45 -1.91 -0.05 0.00 0.03 0.00 0.00 46.19 43.81 3m1b s LEU 196 CO 0.35 -0.53 1.02 -0.89 0.23 0.00 0.00 176.35 176.53 3m1b s THR 197 N 0.77 4.51 -0.95 5.49 2.01 -1.16 -2.39 115.64 123.92 3m1b s THR 197 Ca 0.11 1.91 -0.03 0.00 0.31 0.00 0.00 61.69 63.99 3m1b s THR 197 Cb -0.22 -4.22 0.25 0.00 0.01 0.00 0.00 72.50 68.31 3m1b s THR 197 CO -0.03 0.21 0.93 0.00 -0.69 0.00 0.00 174.62 175.04 3m1b s SER 199 N -0.21 7.20 -0.05 0.00 0.01 -0.87 -3.37 113.70 116.40 3m1b s SER 199 Ca 0.30 2.30 -0.02 0.00 1.31 0.00 0.00 55.95 59.83 3m1b s SER 199 Cb -0.05 -2.63 0.03 0.00 0.21 0.00 0.00 66.02 63.59 3m1b s SER 199 CO -0.08 -0.19 0.06 0.00 0.41 0.00 0.00 173.24 173.43 3m1b s ALA 200 N -1.18 0.30 -0.16 1.44 0.00 -0.67 -0.41 121.76 121.07 3m1b s ALA 200 Ca 0.45 0.12 -0.03 0.00 0.00 0.00 0.00 51.96 52.51 3m1b s ALA 200 Cb -0.32 -0.66 -0.02 0.00 0.00 0.00 0.00 23.12 22.12 3m1b s ALA 200 CO 0.42 -0.54 -0.07 -0.06 0.00 0.00 0.00 175.76 175.51 3m1b s PHE 201 N 2.15 2.93 0.01 0.00 0.40 0.30 -2.36 117.98 121.40 3m1b s PHE 201 Ca 0.05 -0.57 -0.01 0.00 -0.60 0.00 0.00 56.93 55.80 3m1b s PHE 201 Cb -0.12 -1.96 0.00 0.00 0.51 0.00 0.00 43.02 41.45 3m1b s PHE 201 CO -0.04 -0.22 0.01 0.43 0.70 0.00 0.00 175.22 176.10 3m1b n SER 202 N 3.85 -7.25 -3.79 1.36 7.64 -1.06 -0.35 113.62 114.03 3m1b n SER 202 Ca -0.18 1.68 -0.09 0.00 1.01 0.00 0.00 58.87 61.29 3m1b n SER 202 Cb 0.52 -4.45 -0.03 0.00 -1.01 0.00 0.00 64.21 59.24 3m1b n SER 202 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 3m1b s PHE 203 N -0.48 0.15 -0.28 1.43 -0.71 0.78 -3.52 117.98 115.36 3m1b s PHE 203 Ca -0.01 -0.58 -0.20 0.00 -1.04 0.00 0.00 56.93 55.09 3m1b s PHE 203 Cb 0.00 0.45 0.09 0.00 -1.21 0.00 0.00 43.02 42.35 3m1b s PHE 203 CO 0.04 -1.16 0.76 -0.47 -1.34 0.00 0.00 175.22 173.04 3m1b s TYR 204 N -3.74 -0.86 0.92 3.49 6.14 0.33 0.16 117.35 123.78 3m1b s TYR 204 Ca 0.18 1.89 -0.13 0.00 0.64 0.00 0.00 57.07 59.64 3m1b s TYR 204 Cb -0.03 0.44 0.15 0.00 0.42 0.00 0.00 41.96 42.93 3m1b s TYR 204 CO 0.09 -0.42 1.16 -1.25 0.64 0.00 0.00 175.55 175.77 3m1b s PRO 205 N 0.98 1.06 0.00 4.97 0.04 -1.26 -3.52 135.00 137.26 3m1b s PRO 205 Ca -0.05 0.18 0.06 0.00 0.04 0.00 0.00 61.00 61.23 3m1b s PRO 205 Cb -0.05 -1.84 0.35 0.00 0.04 0.00 0.00 34.50 33.00 3m1b s PRO 205 CO -0.10 -2.23 0.88 -0.35 0.04 0.00 0.00 177.00 175.24 3m1b n PRO 206 N -3.77 0.59 -1.86 0.56 -0.04 -1.26 -4.68 135.00 124.54 3m1b n PRO 206 Ca 0.08 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.11 3m1b n PRO 206 Cb 0.60 -1.15 -0.03 0.00 -0.04 0.00 0.00 33.50 32.87 3m1b n PRO 206 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3m1b s GLU 207 N -2.00 3.62 -0.07 0.54 8.01 -1.26 -4.96 118.70 122.58 3m1b s GLU 207 Ca 0.09 1.95 -0.11 0.00 0.01 0.00 0.00 54.97 56.90 3m1b s GLU 207 Cb 0.04 -4.18 0.02 0.00 -4.31 0.00 0.00 34.13 25.70 3m1b s GLU 207 CO 0.07 -1.52 0.27 -1.17 0.01 0.00 0.00 175.26 172.92 3m1b s LEU 208 N 6.13 0.97 -0.29 1.80 0.20 -1.26 -4.42 118.68 121.81 3m1b s LEU 208 Ca 0.84 0.33 -0.01 0.00 0.69 0.00 0.00 54.13 55.99 3m1b s LEU 208 Cb -0.31 1.03 0.09 0.00 -0.43 0.00 0.00 46.19 46.57 3m1b s LEU 208 CO 0.34 -0.24 0.08 -1.10 -0.29 0.00 0.00 176.35 175.14 3m1b s GLN 209 N -0.49 0.83 -0.20 1.98 1.11 -1.04 -5.00 119.66 116.84 3m1b s GLN 209 Ca -0.06 -1.05 -0.17 0.00 0.01 0.00 0.00 55.36 54.09 3m1b s GLN 209 Cb -0.04 -2.14 -0.04 0.00 -1.01 0.00 0.00 33.01 29.79 3m1b s GLN 209 CO 0.02 -0.92 0.43 -0.51 0.01 0.00 0.00 175.29 174.32 3m1b s LEU 210 N 1.57 4.15 -0.08 2.90 1.43 -1.26 -2.16 118.68 125.24 3m1b s LEU 210 Ca 0.07 0.56 0.01 0.00 -1.03 0.00 0.00 54.13 53.75 3m1b s LEU 210 Cb -0.17 -2.57 0.02 0.00 0.03 0.00 0.00 46.19 43.50 3m1b s LEU 210 CO -0.21 -0.10 -0.08 -0.13 0.23 0.00 0.00 176.35 176.06 3m1b s ARG 211 N 1.39 1.42 0.41 1.70 1.81 0.55 -4.50 118.95 121.72 3m1b s ARG 211 Ca 0.20 -0.27 -0.10 0.00 -1.72 0.00 0.00 55.73 53.85 3m1b s ARG 211 Cb -0.15 -1.34 -0.06 0.00 -0.45 0.00 0.00 34.95 32.95 3m1b s ARG 211 CO 0.08 -0.12 0.77 -0.06 -0.68 0.00 0.00 175.30 175.30 3m1b s PHE 212 N 1.16 3.48 -0.19 -0.53 0.08 -1.26 0.27 117.98 120.99 3m1b s PHE 212 Ca -0.06 1.02 -0.04 0.00 0.12 0.00 0.00 56.93 57.96 3m1b s PHE 212 Cb -0.14 -2.43 0.10 0.00 -0.57 0.00 0.00 43.02 39.98 3m1b s PHE 212 CO -0.02 -0.13 0.31 -0.51 -0.10 0.00 0.00 175.22 174.78 3m1b s LEU 213 N -3.96 -0.42 0.17 -0.37 1.43 0.47 -3.66 118.68 112.34 3m1b s LEU 213 Ca 0.51 0.38 -0.30 0.00 -1.03 0.00 0.00 54.13 53.68 3m1b s LEU 213 Cb -0.10 0.86 -0.08 0.00 0.03 0.00 0.00 46.19 46.90 3m1b s LEU 213 CO 0.33 -0.27 1.16 0.00 0.23 0.00 0.00 176.35 177.80 3m1b s ARG 214 N 2.47 4.52 0.00 1.70 1.04 -0.84 -0.75 118.95 127.08 3m1b s ARG 214 Ca 0.05 1.81 0.00 0.00 -1.04 0.00 0.00 55.73 56.55 3m1b s ARG 214 Cb -0.14 -3.27 0.00 0.00 -2.04 0.00 0.00 34.95 29.51 3m1b s ARG 214 CO -0.12 -0.05 0.00 0.27 -0.04 0.00 0.00 175.30 175.36 3m1b n ASN 215 N 2.62 0.00 0.00 -2.89 2.04 0.30 -0.49 115.26 116.84 3m1b n ASN 215 Ca 0.04 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.18 3m1b n ASN 215 Cb 0.45 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.70 3m1b n ASN 215 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3m1b n GLY 216 N 0.00 2.34 2.78 4.83 0.00 -1.26 -5.00 105.19 108.87 3m1b n GLY 216 Ca 0.00 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.33 3m1b n GLY 216 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 3m1b n LEU 217 N 0.00 0.00 0.00 0.99 -0.00 0.35 -5.04 117.00 113.31 3m1b n LEU 217 Ca 0.00 -0.86 0.00 0.00 -0.00 0.00 0.00 56.01 55.15 3m1b n LEU 217 Cb 0.00 -0.83 0.00 0.00 -0.00 0.00 0.00 43.42 42.59 3m1b n LEU 217 CO 0.00 -2.24 0.00 0.00 -0.00 0.00 0.00 177.39 175.15 3m1b n ALA 218 N -4.89 0.00 0.00 1.47 0.00 -1.26 -2.69 120.51 113.14 3m1b n ALA 218 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3m1b n ALA 218 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 3m1b n ALA 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m1b n ALA 219 N -3.00 0.00 0.00 0.00 0.00 -1.24 -1.99 120.51 114.28 3m1b n ALA 219 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3m1b n ALA 219 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3m1b n ALA 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1b n GLY 220 N -0.41 -1.78 3.69 0.00 0.00 -1.25 -4.96 105.19 100.49 3m1b n GLY 220 Ca 0.00 -1.37 -0.41 0.00 0.00 0.00 0.00 46.02 44.24 3m1b n GLY 220 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3m1b n THR 221 N -0.71 2.56 0.00 2.61 -1.04 -1.26 -4.28 114.28 112.16 3m1b n THR 221 Ca 0.00 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.51 3m1b n THR 221 Cb 0.00 -1.53 0.00 0.00 -1.82 0.00 0.00 70.33 66.98 3m1b n THR 221 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3m1b n GLY 222 N 0.84 0.87 3.06 3.41 0.00 -1.26 -4.98 105.19 107.13 3m1b n GLY 222 Ca 0.07 -0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 3m1b n GLY 222 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3m1b s GLN 223 N 0.00 1.73 0.33 1.61 -0.21 -0.68 -4.88 119.66 117.56 3m1b s GLN 223 Ca 0.00 -1.87 -0.05 0.00 0.02 0.00 0.00 55.36 53.45 3m1b s GLN 223 Cb 0.00 -3.38 0.08 0.00 1.00 0.00 0.00 33.01 30.71 3m1b s GLN 223 CO 0.00 -1.00 0.25 0.41 -2.12 0.00 0.00 175.29 172.83 3m1b n GLY 224 N 4.38 -2.98 0.00 3.09 0.00 -1.26 -2.85 105.19 105.57 3m1b n GLY 224 Ca 0.01 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.65 3m1b n GLY 224 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3m1b n ASP 225 N -3.55 0.00 -4.17 1.61 -0.08 -0.73 -4.85 116.55 104.79 3m1b n ASP 225 Ca 0.04 0.00 -0.16 0.00 -1.51 0.00 0.00 54.79 53.16 3m1b n ASP 225 Cb 0.15 0.00 -0.11 0.00 2.34 0.00 0.00 41.12 43.49 3m1b n ASP 225 CO 0.00 0.00 0.00 0.72 0.12 0.00 0.00 177.20 178.04 3m1b s PHE 226 N -0.14 1.11 -0.01 -0.67 -0.12 -1.26 -0.67 117.98 116.21 3m1b s PHE 226 Ca 0.00 -0.56 -0.28 0.00 -0.05 0.00 0.00 56.93 56.04 3m1b s PHE 226 Cb 0.00 -0.61 0.08 0.00 -0.63 0.00 0.00 43.02 41.86 3m1b s PHE 226 CO 0.00 0.03 0.75 0.20 -0.05 0.00 0.00 175.22 176.14 3m1b s GLY 227 N -2.12 -0.52 0.74 1.99 0.00 0.24 -4.97 107.32 102.68 3m1b s GLY 227 Ca 0.02 1.18 -0.05 0.00 0.00 0.00 0.00 44.72 45.86 3m1b s GLY 227 CO 0.01 0.66 1.01 -1.55 0.00 0.00 0.00 173.10 173.24 3m1b n PRO 228 N 0.36 -0.42 -4.34 2.90 -0.05 -1.26 0.16 135.00 132.34 3m1b n PRO 228 Ca -0.15 -2.29 -0.24 0.00 -0.05 0.00 0.00 63.50 60.77 3m1b n PRO 228 Cb 0.60 -0.82 -0.12 0.00 -0.05 0.00 0.00 33.50 33.11 3m1b n PRO 228 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 175.50 174.65 3m1b s ASN 229 N -4.96 2.84 0.19 3.54 0.02 0.37 -4.69 114.94 112.24 3m1b s ASN 229 Ca 0.63 -0.81 0.08 0.00 -1.02 0.00 0.00 52.86 51.75 3m1b s ASN 229 Cb -0.03 -0.18 0.44 0.00 0.02 0.00 0.00 41.25 41.51 3m1b s ASN 229 CO 0.43 0.04 1.12 -1.54 0.02 0.00 0.00 177.10 177.17 3m1b n SER 230 N 0.54 0.21 -0.12 -1.22 3.41 -1.26 0.16 113.62 115.35 3m1b n SER 230 Ca -0.15 0.47 0.13 0.00 -0.26 0.00 0.00 58.87 59.06 3m1b n SER 230 Cb 0.56 -0.45 0.40 0.00 -0.26 0.00 0.00 64.21 64.45 3m1b n SER 230 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3m1b n ASP 231 N -1.76 0.66 0.00 4.04 5.68 -1.26 -4.93 116.55 118.98 3m1b n ASP 231 Ca -0.01 -0.50 0.00 0.00 -0.50 0.00 0.00 54.79 53.78 3m1b n ASP 231 Cb 0.24 0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.30 3m1b n ASP 231 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3m1b n GLY 232 N 1.40 0.83 3.75 6.12 0.00 0.43 -5.02 105.19 112.69 3m1b n GLY 232 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 3m1b n GLY 232 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3m1b s SER 233 N -2.37 7.44 0.45 1.61 1.04 -1.24 -4.66 113.70 115.98 3m1b s SER 233 Ca 0.00 2.08 0.03 0.00 0.48 0.00 0.00 55.95 58.54 3m1b s SER 233 Cb 0.00 -2.61 0.01 0.00 0.10 0.00 0.00 66.02 63.51 3m1b s SER 233 CO 0.00 -0.02 0.64 -0.36 0.98 0.00 0.00 173.24 174.48 3m1b s PHE 234 N -0.97 3.06 -0.16 5.02 0.40 0.41 0.14 117.98 125.89 3m1b s PHE 234 Ca 0.44 0.01 -0.12 0.00 -0.60 0.00 0.00 56.93 56.65 3m1b s PHE 234 Cb -0.29 -2.37 0.05 0.00 0.51 0.00 0.00 43.02 40.92 3m1b s PHE 234 CO 0.36 -0.42 0.41 -1.58 0.70 0.00 0.00 175.22 174.68 3m1b s HIS 235 N -2.51 -0.50 0.04 0.36 5.65 0.42 -0.16 115.29 118.61 3m1b s HIS 235 Ca 0.51 1.15 -0.07 0.00 0.25 0.00 0.00 55.06 56.89 3m1b s HIS 235 Cb -0.10 0.19 -0.00 0.00 -1.18 0.00 0.00 32.58 31.48 3m1b s HIS 235 CO 0.36 -0.26 0.15 0.00 -0.65 0.00 0.00 174.74 174.34 3m1b s ALA 236 N 0.62 -0.20 0.05 1.58 0.00 -1.00 0.81 121.76 123.62 3m1b s ALA 236 Ca -0.03 -0.45 0.01 0.00 0.00 0.00 0.00 51.96 51.49 3m1b s ALA 236 Cb -0.05 0.29 -0.03 0.00 0.00 0.00 0.00 23.12 23.33 3m1b s ALA 236 CO -0.04 -0.36 -0.05 -1.54 0.00 0.00 0.00 175.76 173.77 3m1b s SER 237 N -2.19 0.66 -0.08 0.00 1.04 0.15 -1.66 113.70 111.61 3m1b s SER 237 Ca -0.04 -0.75 -0.05 0.00 0.48 0.00 0.00 55.95 55.60 3m1b s SER 237 Cb -0.00 0.11 0.04 0.00 0.10 0.00 0.00 66.02 66.26 3m1b s SER 237 CO -0.05 -0.39 0.20 -0.55 0.98 0.00 0.00 173.24 173.43 3m1b s SER 238 N -2.21 -0.19 -0.04 7.02 0.15 -1.22 -1.77 113.70 115.45 3m1b s SER 238 Ca -0.03 0.41 0.06 0.00 0.70 0.00 0.00 55.95 57.10 3m1b s SER 238 Cb -0.02 0.32 -0.02 0.00 -1.71 0.00 0.00 66.02 64.59 3m1b s SER 238 CO -0.04 -0.14 -0.22 -0.44 1.20 0.00 0.00 173.24 173.60 3m1b s SER 239 N 1.00 3.37 -0.22 5.45 0.01 -1.13 -0.14 113.70 122.04 3m1b s SER 239 Ca -0.07 -0.39 -0.04 0.00 1.31 0.00 0.00 55.95 56.76 3m1b s SER 239 Cb -0.09 -0.59 0.10 0.00 0.21 0.00 0.00 66.02 65.65 3m1b s SER 239 CO -0.06 0.31 0.23 -0.22 0.41 0.00 0.00 173.24 173.91 3m1b s LEU 240 N -0.57 -0.10 0.10 2.44 2.96 -1.01 -1.68 118.68 120.83 3m1b s LEU 240 Ca 0.08 -0.31 -0.31 0.00 -0.22 0.00 0.00 54.13 53.37 3m1b s LEU 240 Cb -0.11 0.37 -0.08 0.00 0.50 0.00 0.00 46.19 46.87 3m1b s LEU 240 CO 0.00 -0.34 1.53 -0.89 -1.32 0.00 0.00 176.35 175.33 3m1b s THR 241 N 2.32 3.05 -0.03 3.68 2.01 -1.26 -2.79 115.64 122.62 3m1b s THR 241 Ca 0.07 0.66 0.06 0.00 0.31 0.00 0.00 61.69 62.80 3m1b s THR 241 Cb -0.16 -3.42 -0.02 0.00 0.01 0.00 0.00 72.50 68.91 3m1b s THR 241 CO -0.15 0.03 -0.22 0.68 -0.69 0.00 0.00 174.62 174.27 3m1b s VAL 242 N 1.72 2.39 -0.07 3.82 -7.23 -0.58 -4.80 120.40 115.65 3m1b s VAL 242 Ca 0.69 -0.98 -0.29 0.00 -1.81 0.00 0.00 61.98 59.59 3m1b s VAL 242 Cb -0.39 -1.87 -0.07 0.00 0.56 0.00 0.00 36.38 34.60 3m1b s VAL 242 CO 0.31 0.58 2.09 2.29 -0.31 0.00 0.00 175.10 180.06 3m1b n LYS 243 N 2.45 2.48 -2.22 4.82 0.00 -1.26 -0.10 118.16 124.34 3m1b n LYS 243 Ca -0.17 0.83 -0.41 0.00 -0.00 0.00 0.00 58.31 58.56 3m1b n LYS 243 Cb 0.51 -3.12 -0.03 0.00 -0.00 0.00 0.00 35.03 32.40 3m1b n LYS 243 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 3m1b s SER 244 N 6.17 6.89 0.00 -5.58 0.01 0.20 -3.37 113.70 118.01 3m1b s SER 244 Ca 0.94 2.38 0.00 0.00 1.31 0.00 0.00 55.95 60.58 3m1b s SER 244 Cb -0.39 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.23 3m1b s SER 244 CO 0.39 -0.54 0.00 0.61 0.41 0.00 0.00 173.24 174.11 3m1b n GLY 245 N 2.55 1.49 0.00 3.44 0.00 -1.26 -4.94 105.19 106.47 3m1b n GLY 245 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3m1b n GLY 245 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3m1b n ASP 246 N 0.00 0.00 -0.12 1.61 4.64 -1.22 -4.98 116.55 116.48 3m1b n ASP 246 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 3m1b n ASP 246 Cb 0.00 0.00 0.02 0.00 -1.04 0.00 0.00 41.12 40.10 3m1b n ASP 246 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 3m1b n GLU 247 N 0.00 -0.06 -0.68 -0.67 4.71 -1.26 0.34 120.64 123.02 3m1b n GLU 247 Ca 0.00 0.47 -0.10 0.00 -0.01 0.00 0.00 57.16 57.52 3m1b n GLU 247 Cb 0.00 -0.70 0.03 0.00 -1.01 0.00 0.00 31.44 29.76 3m1b n GLU 247 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 3m1b n HIS 248 N -4.46 1.00 -0.13 -0.32 8.25 -1.26 -1.18 115.22 117.11 3m1b n HIS 248 Ca 0.04 -1.48 -0.22 0.00 -0.26 0.00 0.00 57.72 55.79 3m1b n HIS 248 Cb 0.13 -0.73 -0.11 0.00 1.12 0.00 0.00 29.99 30.41 3m1b n HIS 248 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3m1b n HIS 249 N 0.58 0.00 -1.01 4.41 -0.00 0.15 -4.96 115.22 114.39 3m1b n HIS 249 Ca 0.19 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.63 3m1b n HIS 249 Cb 0.62 -0.96 0.21 0.00 -0.00 0.00 0.00 29.99 29.85 3m1b n HIS 249 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.34 177.05 3m1b s TYR 250 N -2.50 1.71 -0.16 4.41 1.51 -0.33 0.11 117.35 122.11 3m1b s TYR 250 Ca -0.35 0.95 -0.33 0.00 -1.01 0.00 0.00 57.07 56.32 3m1b s TYR 250 Cb 0.11 -3.24 0.13 0.00 -0.11 0.00 0.00 41.96 38.85 3m1b s TYR 250 CO 0.53 -3.30 1.14 0.00 -1.11 0.00 0.00 175.55 172.81 3m1b s ILE 253 N -0.92 3.00 -0.01 0.00 -1.09 0.78 0.13 121.20 123.08 3m1b s ILE 253 Ca 0.19 -1.24 -0.02 0.00 -2.23 0.00 0.00 60.65 57.34 3m1b s ILE 253 Cb -0.14 -2.33 -0.00 0.00 -1.58 0.00 0.00 42.46 38.41 3m1b s ILE 253 CO 0.08 0.24 0.05 0.54 -1.23 0.00 0.00 174.94 174.62 3m1b s VAL 254 N -1.04 0.04 -0.26 2.92 0.11 0.18 -0.33 120.40 122.00 3m1b s VAL 254 Ca 0.17 -0.29 -0.02 0.00 -2.93 0.00 0.00 61.98 58.90 3m1b s VAL 254 Cb -0.11 -0.18 0.09 0.00 -1.53 0.00 0.00 36.38 34.65 3m1b s VAL 254 CO 0.08 -0.16 0.08 -1.10 -3.33 0.00 0.00 175.10 170.68 3m1b s GLN 255 N -0.48 0.55 0.27 1.54 -0.21 -0.92 -0.75 119.66 119.66 3m1b s GLN 255 Ca -0.05 -0.70 0.12 0.00 0.02 0.00 0.00 55.36 54.75 3m1b s GLN 255 Cb -0.03 -1.83 -0.05 0.00 1.00 0.00 0.00 33.01 32.10 3m1b s GLN 255 CO 0.00 -0.87 -0.17 -1.58 -2.12 0.00 0.00 175.29 170.55 3m1b s HIS 256 N 1.83 2.35 -0.71 0.91 5.04 -1.26 -2.51 115.29 120.93 3m1b s HIS 256 Ca 0.06 -0.32 0.01 0.00 -1.54 0.00 0.00 55.06 53.27 3m1b s HIS 256 Cb -0.17 -1.02 0.07 0.00 0.04 0.00 0.00 32.58 31.49 3m1b s HIS 256 CO -0.22 0.70 0.72 0.00 -2.34 0.00 0.00 174.74 173.60 3m1b n ALA 257 N -0.62 2.65 -0.14 1.58 0.00 -1.26 -3.29 120.51 119.43 3m1b n ALA 257 Ca -0.05 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.21 3m1b n ALA 257 Cb 0.60 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 19.03 3m1b n ALA 257 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1b n GLY 258 N 0.13 -0.17 3.74 0.00 0.00 -1.26 -4.92 105.19 102.71 3m1b n GLY 258 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 3m1b n GLY 258 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m1b s LEU 259 N -0.60 3.57 0.09 0.99 1.43 -1.21 -4.61 118.68 118.34 3m1b s LEU 259 Ca 0.00 -0.30 0.22 0.00 -1.03 0.00 0.00 54.13 53.02 3m1b s LEU 259 Cb 0.00 -2.17 0.88 0.00 0.03 0.00 0.00 46.19 44.93 3m1b s LEU 259 CO 0.00 0.05 1.68 0.00 0.23 0.00 0.00 176.35 178.31 3m1b n ALA 260 N -0.48 1.92 -3.58 4.21 0.00 -1.26 -4.88 120.51 116.44 3m1b n ALA 260 Ca -0.08 -0.03 -0.14 0.00 0.00 0.00 0.00 53.44 53.19 3m1b n ALA 260 Cb 0.56 -1.36 -0.06 0.00 0.00 0.00 0.00 19.45 18.58 3m1b n ALA 260 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3m1b s GLN 261 N -3.09 0.80 -0.63 0.00 2.00 -1.26 -5.10 119.66 112.38 3m1b s GLN 261 Ca 0.09 0.42 -0.33 0.00 -2.00 0.00 0.00 55.36 53.54 3m1b s GLN 261 Cb 0.12 0.38 -0.15 0.00 0.80 0.00 0.00 33.01 34.16 3m1b s GLN 261 CO 0.41 -0.20 2.41 -2.30 -0.50 0.00 0.00 175.29 175.11 3m1b n PRO 262 N 1.40 0.54 -3.06 1.67 -0.02 -1.26 -4.86 135.00 129.40 3m1b n PRO 262 Ca -0.15 0.08 -0.31 0.00 -2.02 0.00 0.00 63.50 61.11 3m1b n PRO 262 Cb 0.57 -2.20 -0.05 0.00 -0.02 0.00 0.00 33.50 31.80 3m1b n PRO 262 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3m1b s LEU 263 N 8.78 3.98 -0.13 2.45 2.96 0.07 -4.88 118.68 131.90 3m1b s LEU 263 Ca 1.18 1.15 -0.04 0.00 -0.22 0.00 0.00 54.13 56.20 3m1b s LEU 263 Cb -0.95 -3.99 -0.04 0.00 0.50 0.00 0.00 46.19 41.72 3m1b s LEU 263 CO 0.47 -0.27 0.03 -0.13 -1.32 0.00 0.00 176.35 175.12 3m1b s ARG 264 N -3.34 3.47 0.06 1.98 0.52 -1.26 -0.65 118.95 119.73 3m1b s ARG 264 Ca 0.52 -0.38 0.05 0.00 -0.52 0.00 0.00 55.73 55.40 3m1b s ARG 264 Cb -0.10 -2.99 -0.04 0.00 0.52 0.00 0.00 34.95 32.34 3m1b s ARG 264 CO 0.24 0.49 -0.08 0.08 0.02 0.00 0.00 175.30 176.05 3m1b s VAL 265 N -0.26 3.53 0.28 3.52 1.01 0.34 -4.99 120.40 123.82 3m1b s VAL 265 Ca 0.07 -1.02 0.10 0.00 0.00 0.00 0.00 61.98 61.13 3m1b s VAL 265 Cb -0.12 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 3m1b s VAL 265 CO 0.02 0.24 -0.07 -1.61 0.00 0.00 0.00 175.10 173.68 3m1b s GLU 266 N -1.85 2.05 0.00 2.72 0.41 -1.26 -3.08 118.70 117.70 3m1b s GLU 266 Ca 0.20 -1.58 0.27 0.00 -0.41 0.00 0.00 54.97 53.45 3m1b s GLU 266 Cb -0.11 -2.00 0.85 0.00 -1.78 0.00 0.00 34.13 31.09 3m1b s GLU 266 CO 0.11 0.33 1.63 1.47 -0.49 0.00 0.00 175.26 178.31