#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r1x s ILE 2 N 0.00 2.89 -0.15 2.12 1.01 -1.26 -4.86 121.20 120.94 2r1x s ILE 2 Ca 0.00 -1.45 -0.20 0.00 0.00 0.00 0.00 60.65 58.99 2r1x s ILE 2 Cb 0.00 -2.68 -0.03 0.00 0.01 0.00 0.00 42.46 39.76 2r1x s ILE 2 CO 0.00 -0.12 0.59 -0.69 0.00 0.00 0.00 174.94 174.72 2r1x s VAL 3 N 1.23 5.08 -0.13 2.92 1.01 -1.26 -4.90 120.40 124.34 2r1x s VAL 3 Ca -0.05 1.15 -0.02 0.00 0.00 0.00 0.00 61.98 63.06 2r1x s VAL 3 Cb -0.20 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.24 2r1x s VAL 3 CO -0.02 0.20 -0.07 -0.04 0.00 0.00 0.00 175.10 175.17 2r1x s MET 4 N 1.35 3.38 -0.02 2.72 1.00 -1.26 -1.29 119.30 125.18 2r1x s MET 4 Ca 0.29 -0.57 0.03 0.00 0.00 0.00 0.00 55.69 55.44 2r1x s MET 4 Cb -0.16 -2.77 -0.00 0.00 0.00 0.00 0.00 34.83 31.90 2r1x s MET 4 CO 0.12 0.34 -0.09 -1.12 0.00 0.00 0.00 175.02 174.26 2r1x s SER 5 N 0.08 1.19 0.20 3.03 0.01 -0.17 -4.32 113.70 113.72 2r1x s SER 5 Ca -0.02 -0.18 0.11 0.00 1.31 0.00 0.00 55.95 57.16 2r1x s SER 5 Cb -0.14 -0.23 -0.04 0.00 0.21 0.00 0.00 66.02 65.81 2r1x s SER 5 CO 0.03 0.09 -0.21 -1.10 0.41 0.00 0.00 173.24 172.47 2r1x s GLN 6 N -0.01 1.64 -0.04 12.44 -0.21 -1.26 -0.45 119.66 131.77 2r1x s GLN 6 Ca 0.00 -1.49 -0.07 0.00 0.02 0.00 0.00 55.36 53.82 2r1x s GLN 6 Cb -0.06 -1.91 0.01 0.00 1.00 0.00 0.00 33.01 32.05 2r1x s GLN 6 CO 0.00 0.40 0.18 0.45 -2.12 0.00 0.00 175.29 174.20 2r1x s SER 7 N -2.76 -0.12 0.95 5.90 0.15 -0.62 -4.59 113.70 112.61 2r1x s SER 7 Ca 0.22 0.15 -0.15 0.00 0.70 0.00 0.00 55.95 56.87 2r1x s SER 7 Cb -0.08 0.32 0.17 0.00 -1.71 0.00 0.00 66.02 64.72 2r1x s SER 7 CO 0.11 -0.21 1.24 -2.16 1.20 0.00 0.00 173.24 173.43 2r1x s PRO 8 N -0.55 0.80 0.17 5.44 0.04 -1.26 -0.09 135.00 139.55 2r1x s PRO 8 Ca -0.06 -0.16 -0.10 0.00 0.04 0.00 0.00 61.00 60.72 2r1x s PRO 8 Cb -0.04 -1.84 0.03 0.00 0.04 0.00 0.00 34.50 32.69 2r1x s PRO 8 CO 0.01 -2.35 1.59 0.77 0.04 0.00 0.00 177.00 177.06 2r1x h SER 9 N -1.60 1.05 -5.03 6.66 0.02 -1.84 -3.40 113.55 109.41 2r1x h SER 9 Ca -0.46 -0.36 -0.04 0.00 -0.84 0.00 0.00 61.79 60.09 2r1x h SER 9 Cb 1.28 -0.29 -0.14 0.00 0.14 0.00 0.00 62.40 63.39 2r1x h SER 9 CO 0.47 1.16 0.09 -0.94 -1.14 0.00 0.00 176.83 176.47 2r1x s SER 10 N -6.67 -0.45 0.19 3.07 1.04 -1.26 -1.12 113.70 108.50 2r1x s SER 10 Ca -0.12 -0.01 -0.23 0.00 0.48 0.00 0.00 55.95 56.07 2r1x s SER 10 Cb 0.13 0.53 0.05 0.00 0.10 0.00 0.00 66.02 66.84 2r1x s SER 10 CO 0.87 -0.86 0.74 -1.48 0.98 0.00 0.00 173.24 173.49 2r1x s LEU 11 N -2.50 -0.36 -0.03 2.42 2.34 -0.65 -4.93 118.68 114.97 2r1x s LEU 11 Ca -0.01 -0.30 0.05 0.00 0.06 0.00 0.00 54.13 53.93 2r1x s LEU 11 Cb -0.00 2.52 -0.01 0.00 -0.56 0.00 0.00 46.19 48.14 2r1x s LEU 11 CO -0.09 -1.07 -0.16 0.00 -1.06 0.00 0.00 176.35 173.97 2r1x s ALA 12 N -3.67 1.42 0.02 1.48 0.00 -1.26 -0.66 121.76 119.10 2r1x s ALA 12 Ca 0.07 -0.69 0.02 0.00 0.00 0.00 0.00 51.96 51.37 2r1x s ALA 12 Cb -0.03 -0.42 -0.01 0.00 0.00 0.00 0.00 23.12 22.66 2r1x s ALA 12 CO -0.02 0.30 -0.07 0.54 0.00 0.00 0.00 175.76 176.51 2r1x s VAL 13 N -0.17 0.55 0.43 0.00 0.11 -0.64 -4.76 120.40 115.91 2r1x s VAL 13 Ca 0.02 -0.67 -0.18 0.00 -2.93 0.00 0.00 61.98 58.21 2r1x s VAL 13 Cb -0.09 -0.53 -0.09 0.00 -1.53 0.00 0.00 36.38 34.13 2r1x s VAL 13 CO 0.01 -0.10 0.91 -0.44 -3.33 0.00 0.00 175.10 172.14 2r1x s SER 14 N -0.85 6.79 0.33 3.54 0.01 -1.26 -0.92 113.70 121.34 2r1x s SER 14 Ca -0.03 1.54 -0.28 0.00 1.31 0.00 0.00 55.95 58.49 2r1x s SER 14 Cb -0.06 -2.49 -0.13 0.00 0.21 0.00 0.00 66.02 63.56 2r1x s SER 14 CO 0.00 -0.40 1.25 0.00 0.41 0.00 0.00 173.24 174.50 2r1x n ALA 15 N -0.90 1.04 0.00 1.44 0.00 -1.26 -1.89 120.51 118.94 2r1x n ALA 15 Ca 0.06 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2r1x n ALA 15 Cb 0.54 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.77 2r1x n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r1x n GLY 16 N 0.90 1.86 4.01 0.00 0.00 0.11 -4.92 105.19 107.15 2r1x n GLY 16 Ca 0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.87 2r1x n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2r1x s GLU 17 N -0.52 2.31 0.06 1.61 2.02 -0.79 -4.10 118.70 119.28 2r1x s GLU 17 Ca 0.00 -1.24 -0.07 0.00 0.02 0.00 0.00 54.97 53.68 2r1x s GLU 17 Cb 0.00 -2.56 -0.05 0.00 0.10 0.00 0.00 34.13 31.62 2r1x s GLU 17 CO 0.00 -0.85 0.32 0.21 0.02 0.00 0.00 175.26 174.96 2r1x s LYS 18 N -4.73 3.63 -0.06 1.61 2.20 -1.26 -1.44 119.74 119.68 2r1x s LYS 18 Ca 0.60 -0.04 0.05 0.00 -0.36 0.00 0.00 55.97 56.23 2r1x s LYS 18 Cb -0.08 -3.01 -0.00 0.00 -1.51 0.00 0.00 37.83 33.23 2r1x s LYS 18 CO 0.39 0.59 -0.21 0.08 -0.36 0.00 0.00 175.35 175.84 2r1x s VAL 19 N -1.41 1.76 -0.08 4.02 1.01 0.72 -4.99 120.40 121.43 2r1x s VAL 19 Ca 0.32 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.44 2r1x s VAL 19 Cb -0.13 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.76 2r1x s VAL 19 CO 0.19 0.49 -0.15 -0.89 0.00 0.00 0.00 175.10 174.75 2r1x s THR 20 N 0.06 1.38 0.06 3.92 2.01 -1.26 -0.68 115.64 121.12 2r1x s THR 20 Ca -0.07 -0.61 -0.00 0.00 0.31 0.00 0.00 61.69 61.32 2r1x s THR 20 Cb -0.14 -1.25 -0.04 0.00 0.01 0.00 0.00 72.50 71.09 2r1x s THR 20 CO 0.04 0.41 -0.04 0.00 -0.69 0.00 0.00 174.62 174.34 2r1x s MET 21 N 0.70 0.64 0.16 4.92 0.23 -0.53 -4.79 119.30 120.63 2r1x s MET 21 Ca -0.13 -1.19 0.08 0.00 -1.03 0.00 0.00 55.69 53.41 2r1x s MET 21 Cb -0.16 0.09 -0.04 0.00 -1.53 0.00 0.00 34.83 33.19 2r1x s MET 21 CO 0.03 -0.08 -0.16 -1.54 -2.03 0.00 0.00 175.02 171.24 2r1x s SER 22 N -2.82 2.51 -0.10 -1.18 1.04 0.87 -1.22 113.70 112.81 2r1x s SER 22 Ca 0.06 -0.89 -0.04 0.00 0.48 0.00 0.00 55.95 55.57 2r1x s SER 22 Cb 0.06 -0.13 0.05 0.00 0.10 0.00 0.00 66.02 66.09 2r1x s SER 22 CO -0.08 -0.09 0.20 0.00 0.98 0.00 0.00 173.24 174.25 2r1x s LYS 24 N 2.03 2.62 0.06 0.00 2.20 0.40 -0.48 119.74 126.56 2r1x s LYS 24 Ca -0.01 -0.67 0.05 0.00 -0.36 0.00 0.00 55.97 54.98 2r1x s LYS 24 Cb -0.12 -2.43 -0.04 0.00 -1.51 0.00 0.00 37.83 33.73 2r1x s LYS 24 CO -0.07 0.59 -0.07 0.45 -0.36 0.00 0.00 175.35 175.90 2r1x s SER 25 N -0.64 4.61 0.13 1.43 0.15 -0.08 -1.00 113.70 118.30 2r1x s SER 25 Ca 0.10 -0.24 0.24 0.00 0.70 0.00 0.00 55.95 56.75 2r1x s SER 25 Cb -0.11 -1.01 0.93 0.00 -1.71 0.00 0.00 66.02 64.12 2r1x s SER 25 CO 0.01 0.23 1.75 -1.54 1.20 0.00 0.00 173.24 174.89 2r1x n SER 26 N 1.08 0.43 -3.96 5.45 3.41 -0.41 -4.72 113.62 114.89 2r1x n SER 26 Ca -0.14 0.56 -0.11 0.00 -0.26 0.00 0.00 58.87 58.93 2r1x n SER 26 Cb 0.52 -0.67 -0.12 0.00 -0.26 0.00 0.00 64.21 63.68 2r1x n SER 26 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2r1x s GLN 27 N -3.11 0.27 0.26 4.33 0.74 -1.26 -4.95 119.66 115.94 2r1x s GLN 27 Ca 0.09 -0.46 -0.31 0.00 0.05 0.00 0.00 55.36 54.74 2r1x s GLN 27 Cb 0.13 -0.00 -0.13 0.00 1.10 0.00 0.00 33.01 34.11 2r1x s GLN 27 CO 0.48 -0.01 1.45 0.45 -0.55 0.00 0.00 175.29 177.10 2r1x n SER 28 N 2.02 3.05 -1.21 6.67 2.88 -1.26 -4.67 113.62 121.10 2r1x n SER 28 Ca -0.20 1.15 0.11 0.00 -1.33 0.00 0.00 58.87 58.60 2r1x n SER 28 Cb 0.56 -1.48 0.28 0.00 -0.75 0.00 0.00 64.21 62.83 2r1x n SER 28 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2r1x n LEU 29 N 2.07 3.53 -4.60 2.46 4.77 -0.15 -4.91 117.00 120.18 2r1x n LEU 29 Ca 0.10 -1.70 -0.43 0.00 -0.03 0.00 0.00 56.01 53.96 2r1x n LEU 29 Cb 0.33 -0.39 -0.03 0.00 -2.33 0.00 0.00 43.42 41.00 2r1x n LEU 29 CO 0.63 0.85 0.90 -0.22 -1.33 0.00 0.00 177.39 178.22 2r1x s LEU 30 N -1.15 3.83 -0.24 2.23 2.96 -1.26 -1.05 118.68 124.00 2r1x s LEU 30 Ca 0.43 0.45 -0.29 0.00 -0.22 0.00 0.00 54.13 54.51 2r1x s LEU 30 Cb 0.23 -3.41 0.01 0.00 0.50 0.00 0.00 46.19 43.53 2r1x s LEU 30 CO 0.31 -1.10 1.05 0.21 -1.32 0.00 0.00 176.35 175.51 2r1x s ASN 30 N 2.23 7.08 0.36 3.68 3.84 0.37 -4.92 114.94 127.57 2r1x s ASN 30 Ca 0.43 1.36 0.14 0.00 0.21 0.00 0.00 52.86 55.00 2r1x s ASN 30 Cb -0.09 -2.54 0.70 0.00 -0.55 0.00 0.00 41.25 38.76 2r1x s ASN 30 CO 0.26 -0.69 1.79 0.77 -2.79 0.00 0.00 177.10 176.44 2r1x h SER 30 N 7.54 0.00 -0.05 -4.21 4.64 -1.94 0.20 113.55 119.73 2r1x h SER 30 Ca -0.19 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.04 2r1x h SER 30 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2r1x h SER 30 CO 0.98 0.40 -0.29 -0.09 -0.87 0.00 0.00 176.83 176.97 2r1x h ARG 30 N 0.00 0.29 0.00 4.77 2.43 -1.96 -3.32 114.38 116.58 2r1x h ARG 30 Ca -0.00 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 2r1x h ARG 30 Cb 0.75 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 2r1x h ARG 30 CO 0.05 0.89 -0.88 0.25 -1.51 0.00 0.00 179.97 178.77 2r1x n THR 30 N -4.46 0.06 -2.29 0.20 -2.24 -1.22 -4.98 114.28 99.34 2r1x n THR 30 Ca -0.09 -0.09 -0.18 0.00 -2.27 0.00 0.00 64.05 61.42 2r1x n THR 30 Cb 0.49 0.48 -0.01 0.00 -2.10 0.00 0.00 70.33 69.19 2r1x n THR 30 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2r1x n ARG 30 N -1.67 -1.43 -4.35 -0.78 1.74 0.71 -5.00 116.66 105.86 2r1x n ARG 30 Ca 0.04 0.90 -0.25 0.00 -0.77 0.00 0.00 57.85 57.76 2r1x n ARG 30 Cb 0.37 -5.38 -0.12 0.00 -1.02 0.00 0.00 32.46 26.31 2r1x n ARG 30 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2r1x s LYS 30 N -4.80 1.32 -0.19 5.56 1.02 -1.21 -4.90 119.74 116.54 2r1x s LYS 30 Ca 0.00 -1.36 -0.19 0.00 0.02 0.00 0.00 55.97 54.44 2r1x s LYS 30 Cb 0.00 -1.58 -0.03 0.00 -0.52 0.00 0.00 37.83 35.70 2r1x s LYS 30 CO 0.00 0.35 0.52 -0.80 -0.92 0.00 0.00 175.35 174.50 2r1x s ASN 31 N -2.37 6.59 -1.28 2.83 -0.87 -1.26 -0.48 114.94 118.10 2r1x s ASN 31 Ca 0.14 0.71 -0.11 0.00 -1.57 0.00 0.00 52.86 52.03 2r1x s ASN 31 Cb -0.08 -2.30 0.15 0.00 -0.02 0.00 0.00 41.25 39.01 2r1x s ASN 31 CO 0.07 -0.16 1.80 -1.22 -2.57 0.00 0.00 177.10 175.02 2r1x n TYR 32 N 4.64 3.50 -3.70 2.20 0.53 -0.21 -3.49 117.16 120.63 2r1x n TYR 32 Ca -0.05 -2.93 -0.19 0.00 -1.02 0.00 0.00 57.90 53.71 2r1x n TYR 32 Cb 0.51 -2.07 -0.17 0.00 -1.03 0.00 0.00 39.34 36.57 2r1x n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.02 0.00 0.00 176.86 174.67 2r1x s LEU 33 N 0.58 0.42 0.25 7.72 1.98 -1.26 -1.44 118.68 126.94 2r1x s LEU 33 Ca 0.41 0.06 0.12 0.00 -2.89 0.00 0.00 54.13 51.84 2r1x s LEU 33 Cb 0.07 -0.13 -0.05 0.00 0.66 0.00 0.00 46.19 46.75 2r1x s LEU 33 CO -0.00 -0.21 -0.21 0.00 -1.89 0.00 0.00 176.35 174.04 2r1x s ALA 34 N 1.85 2.66 -0.06 5.97 0.00 -0.32 -0.42 121.76 131.44 2r1x s ALA 34 Ca 0.01 -1.80 0.06 0.00 0.00 0.00 0.00 51.96 50.22 2r1x s ALA 34 Cb -0.12 -0.27 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 2r1x s ALA 34 CO -0.03 0.32 -0.24 -1.58 0.00 0.00 0.00 175.76 174.22 2r1x s TRP 35 N -2.29 2.38 0.05 0.00 0.52 0.44 -0.88 118.94 119.17 2r1x s TRP 35 Ca 0.27 -0.70 0.09 0.00 0.02 0.00 0.00 56.10 55.79 2r1x s TRP 35 Cb -0.06 -1.56 -0.03 0.00 -1.15 0.00 0.00 33.47 30.67 2r1x s TRP 35 CO 0.13 -0.21 -0.26 0.71 0.02 0.00 0.00 176.95 177.34 2r1x s TYR 36 N -0.16 2.33 -0.15 -1.98 1.51 0.66 -0.79 117.35 118.77 2r1x s TYR 36 Ca -0.03 -0.40 -0.02 0.00 -1.01 0.00 0.00 57.07 55.61 2r1x s TYR 36 Cb -0.13 -1.38 -0.02 0.00 -0.11 0.00 0.00 41.96 40.32 2r1x s TYR 36 CO 0.03 0.15 -0.09 -1.14 -1.11 0.00 0.00 175.55 173.40 2r1x s GLN 37 N -1.34 3.47 -0.31 -0.62 0.74 0.26 -0.83 119.66 121.02 2r1x s GLN 37 Ca 0.12 -0.63 0.03 0.00 0.05 0.00 0.00 55.36 54.93 2r1x s GLN 37 Cb -0.10 -2.77 0.09 0.00 1.10 0.00 0.00 33.01 31.33 2r1x s GLN 37 CO 0.03 0.16 0.02 -1.14 -0.55 0.00 0.00 175.29 173.80 2r1x s GLN 38 N 0.52 1.54 0.62 1.67 0.74 0.10 -0.43 119.66 124.43 2r1x s GLN 38 Ca -0.06 -1.60 -0.13 0.00 0.05 0.00 0.00 55.36 53.61 2r1x s GLN 38 Cb -0.15 -2.95 -0.03 0.00 1.10 0.00 0.00 33.01 30.98 2r1x s GLN 38 CO 0.03 -0.84 1.04 0.15 -0.55 0.00 0.00 175.29 175.12 2r1x s LYS 39 N 1.07 3.38 0.22 1.67 1.02 -1.26 -1.24 119.74 124.60 2r1x s LYS 39 Ca 0.06 0.98 -0.32 0.00 0.02 0.00 0.00 55.97 56.70 2r1x s LYS 39 Cb -0.19 -2.05 -0.13 0.00 -0.52 0.00 0.00 37.83 34.94 2r1x s LYS 39 CO -0.09 -0.74 1.60 -2.30 -0.92 0.00 0.00 175.35 172.89 2r1x n PRO 40 N -2.45 2.45 -0.93 -1.68 -0.02 -1.26 -1.37 135.00 129.74 2r1x n PRO 40 Ca 0.07 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 2r1x n PRO 40 Cb 0.54 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 2r1x n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2r1x n GLY 41 N 3.07 0.35 3.77 -1.23 0.00 -1.26 -5.01 105.19 104.87 2r1x n GLY 41 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 2r1x n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2r1x s GLN 42 N -0.79 2.38 0.62 1.61 -0.21 -0.47 -5.13 119.66 117.67 2r1x s GLN 42 Ca 0.00 -1.62 -0.14 0.00 0.02 0.00 0.00 55.36 53.62 2r1x s GLN 42 Cb 0.00 -2.18 -0.02 0.00 1.00 0.00 0.00 33.01 31.81 2r1x s GLN 42 CO 0.00 -0.01 1.05 -1.12 -2.12 0.00 0.00 175.29 173.09 2r1x s SER 43 N -3.93 5.72 0.60 5.90 0.01 -1.26 -4.64 113.70 116.11 2r1x s SER 43 Ca 0.41 1.73 -0.19 0.00 1.31 0.00 0.00 55.95 59.20 2r1x s SER 43 Cb -0.01 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.67 2r1x s SER 43 CO 0.24 -1.21 1.29 -2.84 0.41 0.00 0.00 173.24 171.13 2r1x s PRO 44 N -4.41 2.85 -0.05 12.44 0.02 -1.26 -4.57 135.00 140.03 2r1x s PRO 44 Ca 0.61 2.06 0.04 0.00 0.02 0.00 0.00 61.00 63.74 2r1x s PRO 44 Cb -0.15 -2.01 -0.00 0.00 0.02 0.00 0.00 34.50 32.36 2r1x s PRO 44 CO 0.43 -1.36 -0.18 0.21 -0.33 0.00 0.00 177.00 175.77 2r1x s LYS 45 N -3.20 1.93 0.15 5.54 2.20 0.43 -4.94 119.74 121.86 2r1x s LYS 45 Ca 0.78 -0.63 -0.31 0.00 -0.36 0.00 0.00 55.97 55.44 2r1x s LYS 45 Cb -0.37 -1.64 -0.09 0.00 -1.51 0.00 0.00 37.83 34.22 2r1x s LYS 45 CO 0.41 0.23 1.49 -1.17 -0.36 0.00 0.00 175.35 175.94 2r1x s LEU 46 N 0.11 4.37 -0.14 5.43 2.96 -1.26 -0.58 118.68 129.58 2r1x s LEU 46 Ca -0.06 2.51 -0.07 0.00 -0.22 0.00 0.00 54.13 56.29 2r1x s LEU 46 Cb -0.13 -3.59 -0.06 0.00 0.50 0.00 0.00 46.19 42.91 2r1x s LEU 46 CO 0.03 -0.74 -0.18 0.18 -1.32 0.00 0.00 176.35 174.32 2r1x n LEU 47 N 3.81 0.99 -3.88 -0.68 4.77 0.03 -4.85 117.00 117.19 2r1x n LEU 47 Ca 0.12 0.17 -0.12 0.00 -0.03 0.00 0.00 56.01 56.16 2r1x n LEU 47 Cb 0.40 -0.41 -0.14 0.00 -2.33 0.00 0.00 43.42 40.94 2r1x n LEU 47 CO 0.60 0.26 -0.35 -0.63 -1.33 0.00 0.00 177.39 175.94 2r1x s ILE 48 N -2.26 0.01 0.21 -0.08 -1.09 -1.04 -1.14 121.20 115.80 2r1x s ILE 48 Ca -0.19 -0.08 -0.01 0.00 -2.23 0.00 0.00 60.65 58.13 2r1x s ILE 48 Cb 0.07 -0.04 -0.04 0.00 -1.58 0.00 0.00 42.46 40.87 2r1x s ILE 48 CO 0.24 -0.05 0.15 -0.72 -1.23 0.00 0.00 174.94 173.34 2r1x s TYR 49 N -0.13 1.14 -1.68 3.97 1.13 -0.01 -0.42 117.35 121.35 2r1x s TYR 49 Ca -0.01 -1.36 -0.18 0.00 -1.41 0.00 0.00 57.07 54.11 2r1x s TYR 49 Cb -0.01 -0.53 0.15 0.00 -1.10 0.00 0.00 41.96 40.47 2r1x s TYR 49 CO -0.00 -0.66 0.82 0.91 -2.51 0.00 0.00 175.55 174.11 2r1x n TRP 50 N -0.28 -1.83 0.00 -3.49 8.01 -1.11 -0.70 117.44 118.04 2r1x n TRP 50 Ca 0.02 0.81 0.00 0.00 -1.31 0.00 0.00 57.50 57.02 2r1x n TRP 50 Cb 0.66 -3.08 0.00 0.00 -2.01 0.00 0.00 31.31 26.88 2r1x n TRP 50 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2r1x n ALA 51 N -4.41 0.00 -0.44 6.99 0.00 0.43 -4.17 120.51 118.91 2r1x n ALA 51 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2r1x n ALA 51 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 2r1x n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2r1x n SER 52 N 0.99 0.24 -4.62 0.00 3.41 -1.13 -3.26 113.62 109.25 2r1x n SER 52 Ca 0.00 -0.74 -0.43 0.00 -0.26 0.00 0.00 58.87 57.44 2r1x n SER 52 Cb 0.00 0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 64.03 2r1x n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2r1x s THR 53 N -0.11 4.62 -0.20 6.66 2.01 0.12 -4.61 115.64 124.13 2r1x s THR 53 Ca 0.00 1.42 -0.26 0.00 0.31 0.00 0.00 61.69 63.16 2r1x s THR 53 Cb 0.00 -4.31 -0.01 0.00 0.01 0.00 0.00 72.50 68.20 2r1x s THR 53 CO 0.00 -0.42 0.88 -0.60 -0.69 0.00 0.00 174.62 173.79 2r1x s ARG 54 N 3.37 4.25 0.61 4.92 3.52 -1.26 -0.83 118.95 133.53 2r1x s ARG 54 Ca 0.39 1.07 -0.20 0.00 -0.13 0.00 0.00 55.73 56.87 2r1x s ARG 54 Cb -0.13 -3.61 -0.03 0.00 -1.56 0.00 0.00 34.95 29.62 2r1x s ARG 54 CO 0.15 -0.45 1.32 -2.00 -0.81 0.00 0.00 175.30 173.51 2r1x s GLU 55 N 2.60 2.79 0.18 5.12 2.56 -0.29 -4.89 118.70 126.77 2r1x s GLU 55 Ca 0.39 2.14 -0.33 0.00 0.00 0.00 0.00 54.97 57.16 2r1x s GLU 55 Cb -0.16 -2.01 -0.14 0.00 2.00 0.00 0.00 34.13 33.82 2r1x s GLU 55 CO 0.10 -1.43 1.55 0.43 -0.56 0.00 0.00 175.26 175.35 2r1x n SER 56 N -1.54 3.07 0.00 -1.70 7.64 -1.26 -2.05 113.62 117.77 2r1x n SER 56 Ca 0.14 1.09 0.00 0.00 1.01 0.00 0.00 58.87 61.11 2r1x n SER 56 Cb 0.47 -1.43 0.00 0.00 -1.01 0.00 0.00 64.21 62.23 2r1x n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2r1x n GLY 57 N 3.18 0.62 3.72 0.23 0.00 -1.26 -5.05 105.19 106.63 2r1x n GLY 57 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 2r1x n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r1x s VAL 58 N -2.29 4.97 0.40 1.61 1.01 -0.87 -5.02 120.40 120.21 2r1x s VAL 58 Ca 0.00 1.58 -0.25 0.00 0.00 0.00 0.00 61.98 63.31 2r1x s VAL 58 Cb 0.00 -4.10 -0.11 0.00 0.00 0.00 0.00 36.38 32.17 2r1x s VAL 58 CO 0.00 0.25 1.04 -2.65 0.00 0.00 0.00 175.10 173.74 2r1x n PRO 59 N 3.65 1.43 0.21 2.72 -0.02 -1.26 -4.85 135.00 136.87 2r1x n PRO 59 Ca -0.00 0.51 0.14 0.00 -2.02 0.00 0.00 63.50 62.13 2r1x n PRO 59 Cb 0.51 -2.06 0.74 0.00 -0.02 0.00 0.00 33.50 32.68 2r1x n PRO 59 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2r1x h ASP 60 N 1.68 0.00 0.58 2.55 1.82 -1.98 -2.52 116.42 118.54 2r1x h ASP 60 Ca -0.44 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.20 2r1x h ASP 60 Cb 1.33 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.34 2r1x h ASP 60 CO 0.58 0.00 0.00 0.08 -1.61 0.00 0.00 179.24 178.29 2r1x h ARG 61 N 0.00 0.00 -5.36 0.28 0.11 -1.88 -3.42 114.38 104.11 2r1x h ARG 61 Ca 0.00 0.00 -0.61 0.00 0.10 0.00 0.00 59.98 59.47 2r1x h ARG 61 Cb 0.02 0.00 -0.12 0.00 1.11 0.00 0.00 29.97 30.97 2r1x h ARG 61 CO 0.00 0.00 -0.15 -0.06 0.10 0.00 0.00 179.97 179.86 2r1x s PHE 62 N -3.62 3.32 -0.05 4.08 0.40 -0.95 -1.51 117.98 119.65 2r1x s PHE 62 Ca 0.00 0.59 0.00 0.00 -0.60 0.00 0.00 56.93 56.92 2r1x s PHE 62 Cb 0.09 -2.59 0.02 0.00 0.51 0.00 0.00 43.02 41.06 2r1x s PHE 62 CO 0.41 -0.13 -0.03 0.99 0.70 0.00 0.00 175.22 177.17 2r1x s THR 63 N 1.73 0.46 -0.08 0.64 2.01 -0.20 -4.96 115.64 115.24 2r1x s THR 63 Ca 0.19 -0.04 -0.05 0.00 0.31 0.00 0.00 61.69 62.09 2r1x s THR 63 Cb -0.15 -0.53 -0.04 0.00 0.01 0.00 0.00 72.50 71.79 2r1x s THR 63 CO 0.09 0.22 0.14 -0.83 -0.69 0.00 0.00 174.62 173.56 2r1x s GLY 64 N 1.17 2.15 0.31 4.40 0.00 -1.26 -0.99 107.32 113.10 2r1x s GLY 64 Ca -0.07 -0.69 -0.03 0.00 0.00 0.00 0.00 44.72 43.93 2r1x s GLY 64 CO -0.01 -0.48 0.40 -1.35 0.00 0.00 0.00 173.10 171.66 2r1x s SER 65 N -1.30 0.76 0.00 1.64 1.04 -0.05 -4.20 113.70 111.58 2r1x s SER 65 Ca 0.19 -1.42 0.00 0.00 0.48 0.00 0.00 55.95 55.19 2r1x s SER 65 Cb -0.12 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.60 2r1x s SER 65 CO 0.08 -1.18 0.00 0.61 0.98 0.00 0.00 173.24 173.74 2r1x n GLY 66 N -0.50 1.05 3.52 7.32 0.00 -1.26 -1.26 105.19 114.06 2r1x n GLY 66 Ca 0.02 -2.15 -0.10 0.00 0.00 0.00 0.00 46.02 43.78 2r1x n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2r1x s SER 67 N 0.00 -0.40 1.11 1.61 0.15 -0.58 -4.94 113.70 110.65 2r1x s SER 67 Ca 0.00 0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.80 2r1x s SER 67 Cb 0.00 0.39 0.00 0.00 -1.71 0.00 0.00 66.02 64.70 2r1x s SER 67 CO 0.00 -0.58 0.00 0.61 1.20 0.00 0.00 173.24 174.47 2r1x n GLY 68 N 0.07 1.48 0.44 9.45 0.00 -1.26 -2.39 105.19 112.98 2r1x n GLY 68 Ca -0.10 0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.06 2r1x n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2r1x n THR 69 N 0.00 0.00 -4.05 2.61 -2.24 -1.26 -0.97 114.28 108.37 2r1x n THR 69 Ca 0.00 -0.32 -0.20 0.00 -2.27 0.00 0.00 64.05 61.26 2r1x n THR 69 Cb 0.00 1.23 -0.16 0.00 -2.10 0.00 0.00 70.33 69.29 2r1x n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2r1x s ASP 70 N -2.08 0.93 0.07 3.42 1.01 -1.01 -0.90 116.67 118.11 2r1x s ASP 70 Ca 0.16 -0.10 0.02 0.00 0.71 0.00 0.00 52.55 53.34 2r1x s ASP 70 Cb 0.15 -0.40 -0.03 0.00 1.01 0.00 0.00 42.92 43.65 2r1x s ASP 70 CO 0.45 -0.09 -0.08 -0.36 0.21 0.00 0.00 175.17 175.31 2r1x s PHE 71 N 1.10 0.80 -0.01 4.23 0.40 0.37 -1.52 117.98 123.34 2r1x s PHE 71 Ca -0.08 -0.65 0.01 0.00 -0.60 0.00 0.00 56.93 55.61 2r1x s PHE 71 Cb -0.14 -0.47 0.00 0.00 0.51 0.00 0.00 43.02 42.93 2r1x s PHE 71 CO -0.01 -0.09 -0.03 0.99 0.70 0.00 0.00 175.22 176.77 2r1x s THR 72 N -2.20 0.29 -0.16 0.64 2.01 -0.39 -0.79 115.64 115.03 2r1x s THR 72 Ca -0.01 -0.11 -0.02 0.00 0.31 0.00 0.00 61.69 61.85 2r1x s THR 72 Cb -0.04 -0.27 -0.01 0.00 0.01 0.00 0.00 72.50 72.18 2r1x s THR 72 CO -0.01 0.10 -0.09 -0.22 -0.69 0.00 0.00 174.62 173.71 2r1x s LEU 73 N 0.16 2.86 -0.10 4.42 2.96 -0.36 -0.87 118.68 127.76 2r1x s LEU 73 Ca -0.01 -0.31 0.02 0.00 -0.22 0.00 0.00 54.13 53.60 2r1x s LEU 73 Cb -0.04 -1.68 -0.02 0.00 0.50 0.00 0.00 46.19 44.95 2r1x s LEU 73 CO -0.00 0.11 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.09 2r1x s THR 74 N 0.71 2.88 -0.24 3.68 2.01 -0.16 -1.46 115.64 123.06 2r1x s THR 74 Ca -0.04 -0.75 -0.01 0.00 0.31 0.00 0.00 61.69 61.21 2r1x s THR 74 Cb -0.15 -2.17 0.03 0.00 0.01 0.00 0.00 72.50 70.22 2r1x s THR 74 CO 0.02 0.55 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.78 2r1x s ILE 75 N 0.03 2.64 0.34 1.82 1.01 0.14 -1.03 121.20 126.15 2r1x s ILE 75 Ca -0.05 -1.09 -0.06 0.00 0.00 0.00 0.00 60.65 59.45 2r1x s ILE 75 Cb -0.15 -2.33 -0.05 0.00 0.01 0.00 0.00 42.46 39.94 2r1x s ILE 75 CO 0.04 0.23 0.63 0.42 0.00 0.00 0.00 174.94 176.26 2r1x s THR 76 N 1.29 4.96 -1.35 2.92 -4.23 -0.57 -0.20 115.64 118.45 2r1x s THR 76 Ca -0.00 0.18 -0.10 0.00 -1.18 0.00 0.00 61.69 60.59 2r1x s THR 76 Cb -0.16 -3.75 0.01 0.00 1.34 0.00 0.00 72.50 69.93 2r1x s THR 76 CO -0.06 -0.44 0.44 -1.20 -0.54 0.00 0.00 174.62 172.83 2r1x n SER 77 N -1.21 -1.63 -4.67 3.99 7.64 -1.17 -4.80 113.62 111.77 2r1x n SER 77 Ca -0.01 -1.12 -0.41 0.00 1.01 0.00 0.00 58.87 58.35 2r1x n SER 77 Cb 0.54 -2.58 0.01 0.00 -1.01 0.00 0.00 64.21 61.17 2r1x n SER 77 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 2r1x n VAL 78 N -4.51 2.57 -4.37 0.44 3.14 -0.52 -4.45 118.33 110.63 2r1x n VAL 78 Ca -0.24 -0.50 -0.25 0.00 -2.96 0.00 0.00 64.34 60.39 2r1x n VAL 78 Cb 0.65 -1.43 -0.10 0.00 -1.06 0.00 0.00 33.84 31.90 2r1x n VAL 78 CO 0.00 0.00 0.00 -1.10 -6.46 0.00 0.00 176.83 169.27 2r1x s GLN 79 N -2.16 1.89 0.35 1.45 -0.21 -1.26 0.03 119.66 119.74 2r1x s GLN 79 Ca 0.62 -1.49 0.13 0.00 0.02 0.00 0.00 55.36 54.64 2r1x s GLN 79 Cb -0.52 -1.99 0.96 0.00 1.00 0.00 0.00 33.01 32.46 2r1x s GLN 79 CO 0.57 0.38 1.74 0.00 -2.12 0.00 0.00 175.29 175.87 2r1x h ALA 80 N 2.60 1.95 0.00 6.09 0.00 -1.90 -0.38 119.26 127.61 2r1x h ALA 80 Ca -0.44 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2r1x h ALA 80 Cb 1.23 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2r1x h ALA 80 CO 0.56 -0.40 0.00 -0.85 0.00 0.00 0.00 179.25 178.56 2r1x n GLU 81 N -4.79 0.03 0.00 0.00 0.28 -1.11 -2.83 120.64 112.22 2r1x n GLU 81 Ca 0.26 0.22 0.14 0.00 -0.16 0.00 0.00 57.16 57.63 2r1x n GLU 81 Cb 0.79 -1.50 0.71 0.00 1.43 0.00 0.00 31.44 32.87 2r1x n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2r1x n ASP 82 N -1.47 0.00 -4.68 -1.84 8.00 -0.15 -4.83 116.55 111.57 2r1x n ASP 82 Ca 0.04 -0.12 -0.54 0.00 0.71 0.00 0.00 54.79 54.88 2r1x n ASP 82 Cb 0.17 -0.28 -0.06 0.00 -0.02 0.00 0.00 41.12 40.93 2r1x n ASP 82 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2r1x n LEU 83 N -1.28 2.39 0.00 0.64 7.94 -1.13 -4.87 117.00 120.68 2r1x n LEU 83 Ca 0.13 1.07 0.00 0.00 -1.11 0.00 0.00 56.01 56.11 2r1x n LEU 83 Cb 0.22 -1.20 0.00 0.00 0.53 0.00 0.00 43.42 42.97 2r1x n LEU 83 CO 0.22 -0.52 0.00 0.00 -1.11 0.00 0.00 177.39 175.97 2r1x n ALA 84 N 4.75 0.00 -2.73 1.96 0.00 -1.10 -4.52 120.51 118.87 2r1x n ALA 84 Ca 0.23 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.31 2r1x n ALA 84 Cb 0.18 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.56 2r1x n ALA 84 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2r1x s VAL 85 N -2.00 5.34 -0.15 0.00 1.01 -0.37 -0.86 120.40 123.37 2r1x s VAL 85 Ca 0.00 0.43 -0.02 0.00 0.00 0.00 0.00 61.98 62.39 2r1x s VAL 85 Cb 0.00 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 2r1x s VAL 85 CO 0.00 0.49 -0.08 -0.31 0.00 0.00 0.00 175.10 175.20 2r1x s TYR 86 N -0.19 2.92 -0.07 5.22 2.02 -0.03 0.03 117.35 127.25 2r1x s TYR 86 Ca 0.15 -0.53 0.04 0.00 -0.37 0.00 0.00 57.07 56.36 2r1x s TYR 86 Cb -0.13 -1.93 -0.02 0.00 -0.40 0.00 0.00 41.96 39.49 2r1x s TYR 86 CO 0.04 -0.18 -0.19 0.71 -1.57 0.00 0.00 175.55 174.36 2r1x s TYR 87 N 0.50 2.59 0.32 2.71 1.51 -0.01 -0.94 117.35 124.03 2r1x s TYR 87 Ca -0.06 -0.54 0.02 0.00 -1.01 0.00 0.00 57.07 55.48 2r1x s TYR 87 Cb -0.15 -1.66 -0.03 0.00 -0.11 0.00 0.00 41.96 40.01 2r1x s TYR 87 CO 0.03 -0.10 0.50 0.00 -1.11 0.00 0.00 175.55 174.87 2r1x s LYS 89 N -4.23 0.35 0.22 0.00 2.20 -0.05 -0.67 119.74 117.55 2r1x s LYS 89 Ca 0.39 0.90 -0.12 0.00 -0.36 0.00 0.00 55.97 56.78 2r1x s LYS 89 Cb -0.09 0.14 -0.07 0.00 -1.51 0.00 0.00 37.83 36.29 2r1x s LYS 89 CO 0.34 -0.21 0.59 1.14 -0.36 0.00 0.00 175.35 176.85 2r1x s GLN 90 N 2.01 3.90 -0.07 4.03 1.03 -0.32 -1.17 119.66 129.07 2r1x s GLN 90 Ca -0.05 0.42 0.13 0.00 0.04 0.00 0.00 55.36 55.89 2r1x s GLN 90 Cb -0.10 -2.70 0.24 0.00 0.03 0.00 0.00 33.01 30.48 2r1x s GLN 90 CO -0.13 0.34 1.11 -1.13 -2.54 0.00 0.00 175.29 172.95 2r1x n SER 91 N 0.12 1.11 -0.01 12.60 3.41 -0.52 -2.02 113.62 128.30 2r1x n SER 91 Ca -0.01 -2.59 -0.08 0.00 -0.26 0.00 0.00 58.87 55.93 2r1x n SER 91 Cb 0.52 -0.34 0.08 0.00 -0.26 0.00 0.00 64.21 64.22 2r1x n SER 91 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2r1x h TYR 92 N 0.40 0.72 -2.52 7.33 3.20 -1.91 -3.42 116.97 120.77 2r1x h TYR 92 Ca -0.05 -0.22 -0.40 0.00 3.14 0.00 0.00 58.73 61.20 2r1x h TYR 92 Cb 1.35 -0.15 -0.37 0.00 1.54 0.00 0.00 36.73 39.11 2r1x h TYR 92 CO 0.20 0.93 -0.69 1.21 -1.64 0.00 0.00 178.16 178.18 2r1x s ASN 93 N -6.87 2.20 0.50 -2.11 3.04 -1.26 -5.07 114.94 105.37 2r1x s ASN 93 Ca -0.08 -0.75 0.00 0.00 0.04 0.00 0.00 52.86 52.07 2r1x s ASN 93 Cb 0.12 0.15 0.00 0.00 -1.54 0.00 0.00 41.25 39.98 2r1x s ASN 93 CO 0.83 -0.38 0.00 0.18 -3.04 0.00 0.00 177.10 174.69 2r1x n LEU 94 N 5.29 0.00 -3.93 3.21 4.77 -1.26 -4.74 117.00 120.34 2r1x n LEU 94 Ca -0.05 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.83 2r1x n LEU 94 Cb 0.46 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.45 2r1x n LEU 94 CO 0.04 0.00 -0.27 -0.13 -1.33 0.00 0.00 177.39 175.70 2r1x s ARG 95 N 0.00 0.38 -0.16 3.23 3.00 -1.26 -4.18 118.95 119.96 2r1x s ARG 95 Ca 0.00 -0.50 -0.09 0.00 0.00 0.00 0.00 55.73 55.14 2r1x s ARG 95 Cb 0.00 0.15 0.06 0.00 0.00 0.00 0.00 34.95 35.15 2r1x s ARG 95 CO 0.00 -0.08 0.39 0.99 0.00 0.00 0.00 175.30 176.60 2r1x s THR 96 N -1.39 -0.03 0.12 0.02 2.01 -0.86 -4.99 115.64 110.52 2r1x s THR 96 Ca -0.15 0.10 -0.13 0.00 0.31 0.00 0.00 61.69 61.82 2r1x s THR 96 Cb -0.09 -0.58 -0.06 0.00 0.01 0.00 0.00 72.50 71.78 2r1x s THR 96 CO 0.00 0.04 0.49 -0.36 -0.69 0.00 0.00 174.62 174.10 2r1x s PHE 97 N 1.33 3.60 1.13 4.92 0.08 -1.26 -1.18 117.98 126.61 2r1x s PHE 97 Ca -0.09 0.95 -0.16 0.00 0.12 0.00 0.00 56.93 57.76 2r1x s PHE 97 Cb -0.08 -2.29 0.25 0.00 -0.57 0.00 0.00 43.02 40.33 2r1x s PHE 97 CO -0.12 0.47 1.08 0.20 -0.10 0.00 0.00 175.22 176.75 2r1x s GLY 98 N -1.72 1.55 0.00 4.36 0.00 0.15 -4.69 107.32 106.98 2r1x s GLY 98 Ca 0.36 -0.58 0.30 0.00 0.00 0.00 0.00 44.72 44.79 2r1x s GLY 98 CO 0.19 0.18 1.95 0.61 0.00 0.00 0.00 173.10 176.03 2r1x n GLY 99 N -0.57 -1.01 0.00 0.20 0.00 -1.26 -4.78 105.19 97.76 2r1x n GLY 99 Ca 0.08 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2r1x n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r1x n GLY 100 N 1.24 0.71 3.11 -0.02 0.00 -1.26 -5.01 105.19 103.96 2r1x n GLY 100 Ca 0.16 -1.63 -0.30 0.00 0.00 0.00 0.00 46.02 44.24 2r1x n GLY 100 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r1x s THR 101 N -2.66 1.76 -0.33 2.61 2.01 -0.12 -4.72 115.64 114.19 2r1x s THR 101 Ca 0.00 -0.80 -0.20 0.00 0.31 0.00 0.00 61.69 61.00 2r1x s THR 101 Cb 0.00 -1.58 -0.00 0.00 0.01 0.00 0.00 72.50 70.93 2r1x s THR 101 CO 0.00 0.49 0.63 -0.54 -0.69 0.00 0.00 174.62 174.51 2r1x s LYS 102 N 0.91 3.78 -0.31 4.92 3.01 -0.27 -0.85 119.74 130.92 2r1x s LYS 102 Ca -0.07 0.16 -0.13 0.00 -1.01 0.00 0.00 55.97 54.92 2r1x s LYS 102 Cb -0.15 -3.77 -0.03 0.00 -1.01 0.00 0.00 37.83 32.87 2r1x s LYS 102 CO -0.02 -0.66 0.29 -1.17 0.51 0.00 0.00 175.35 174.29 2r1x s LEU 103 N 2.66 4.29 0.29 3.17 2.96 -0.04 -1.64 118.68 130.39 2r1x s LEU 103 Ca 0.25 -0.15 0.07 0.00 -0.22 0.00 0.00 54.13 54.08 2r1x s LEU 103 Cb -0.15 -2.24 -0.03 0.00 0.50 0.00 0.00 46.19 44.27 2r1x s LEU 103 CO 0.13 -0.21 0.25 -1.61 -1.32 0.00 0.00 176.35 173.60 2r1x s GLU 104 N 1.88 2.84 -0.18 1.98 2.02 0.17 -2.70 118.70 124.71 2r1x s GLU 104 Ca 0.09 -1.17 -0.04 0.00 0.02 0.00 0.00 54.97 53.88 2r1x s GLU 104 Cb -0.17 -2.53 -0.02 0.00 0.10 0.00 0.00 34.13 31.51 2r1x s GLU 104 CO 0.11 0.24 -0.03 0.42 0.02 0.00 0.00 175.26 176.02 2r1x s ILE 105 N -2.22 3.78 0.13 -1.63 -1.09 -1.26 -1.62 121.20 117.29 2r1x s ILE 105 Ca 0.37 -0.38 -0.23 0.00 -2.23 0.00 0.00 60.65 58.17 2r1x s ILE 105 Cb -0.07 -2.68 -0.07 0.00 -1.58 0.00 0.00 42.46 38.06 2r1x s ILE 105 CO 0.26 0.46 0.71 -0.75 -1.23 0.00 0.00 174.94 174.39 2r1x s LYS 106 N 0.71 4.45 0.30 2.79 2.20 -0.10 -4.81 119.74 125.28 2r1x s LYS 106 Ca -0.02 1.02 0.03 0.00 -0.36 0.00 0.00 55.97 56.65 2r1x s LYS 106 Cb -0.14 -3.26 -0.03 0.00 -1.51 0.00 0.00 37.83 32.89 2r1x s LYS 106 CO 0.02 0.58 0.29 -0.98 -0.36 0.00 0.00 175.35 174.89 2r1x s ARG 107 N -1.07 1.65 0.45 4.03 1.70 -1.26 -4.08 118.95 120.37 2r1x s ARG 107 Ca 0.34 -1.86 -0.24 0.00 -0.47 0.00 0.00 55.73 53.50 2r1x s ARG 107 Cb -0.22 0.34 -0.07 0.00 -0.57 0.00 0.00 34.95 34.43 2r1x s ARG 107 CO 0.24 -0.62 1.24 0.00 -1.08 0.00 0.00 175.30 175.09 2r1x s ALA 108 N -3.56 3.05 0.44 7.88 0.00 -1.26 -4.95 121.76 123.36 2r1x s ALA 108 Ca 0.38 1.11 -0.24 0.00 0.00 0.00 0.00 51.96 53.20 2r1x s ALA 108 Cb 0.03 -3.45 -0.10 0.00 0.00 0.00 0.00 23.12 19.60 2r1x s ALA 108 CO 0.22 -0.83 1.15 -0.25 0.00 0.00 0.00 175.76 176.05 2r1x n ASP 109 N -0.34 1.94 -3.80 0.00 10.43 -1.26 -4.79 116.55 118.73 2r1x n ASP 109 Ca 0.06 1.06 -0.13 0.00 2.57 0.00 0.00 54.79 58.35 2r1x n ASP 109 Cb 0.46 -1.44 -0.14 0.00 1.84 0.00 0.00 41.12 41.84 2r1x n ASP 109 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2r1x s ALA 110 N -1.25 -0.21 0.39 2.24 0.00 0.43 -4.91 121.76 118.45 2r1x s ALA 110 Ca 0.63 0.41 -0.24 0.00 0.00 0.00 0.00 51.96 52.77 2r1x s ALA 110 Cb -0.52 -0.27 -0.10 0.00 0.00 0.00 0.00 23.12 22.23 2r1x s ALA 110 CO 0.56 -0.09 0.99 0.00 0.00 0.00 0.00 175.76 177.22 2r1x s ALA 111 N 0.55 3.10 0.52 0.00 0.00 -1.26 -1.23 121.76 123.45 2r1x s ALA 111 Ca -0.04 0.56 -0.19 0.00 0.00 0.00 0.00 51.96 52.29 2r1x s ALA 111 Cb -0.06 -3.21 -0.07 0.00 0.00 0.00 0.00 23.12 19.78 2r1x s ALA 111 CO -0.02 -0.01 1.07 -1.25 0.00 0.00 0.00 175.76 175.55 2r1x s PRO 112 N -2.55 3.56 -0.28 0.00 0.04 -1.26 -4.49 135.00 130.02 2r1x s PRO 112 Ca 0.57 1.43 -0.11 0.00 0.04 0.00 0.00 61.00 62.93 2r1x s PRO 112 Cb -0.17 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.26 2r1x s PRO 112 CO 0.22 -0.64 0.20 0.99 0.04 0.00 0.00 177.00 177.81 2r1x s THR 113 N -1.97 5.31 -0.13 1.26 2.01 -0.30 -4.87 115.64 116.95 2r1x s THR 113 Ca 0.69 0.19 -0.02 0.00 0.31 0.00 0.00 61.69 62.86 2r1x s THR 113 Cb -0.19 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 2r1x s THR 113 CO 0.25 0.25 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.70 2r1x s VAL 114 N 1.71 3.84 -0.03 3.82 1.01 -1.26 -0.81 120.40 128.67 2r1x s VAL 114 Ca 0.07 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 61.68 2r1x s VAL 114 Cb -0.16 -2.64 0.01 0.00 0.00 0.00 0.00 36.38 33.59 2r1x s VAL 114 CO 0.10 0.53 -0.06 -0.44 0.00 0.00 0.00 175.10 175.23 2r1x s SER 115 N -0.05 0.97 0.03 3.32 0.01 -0.15 -4.96 113.70 112.87 2r1x s SER 115 Ca 0.01 -0.14 0.06 0.00 1.31 0.00 0.00 55.95 57.19 2r1x s SER 115 Cb -0.13 -0.33 -0.03 0.00 0.21 0.00 0.00 66.02 65.73 2r1x s SER 115 CO 0.03 0.01 -0.16 -0.51 0.41 0.00 0.00 173.24 173.02 2r1x s ILE 116 N 0.44 2.92 -0.05 1.44 2.07 -1.26 -0.73 121.20 126.02 2r1x s ILE 116 Ca -0.06 -1.12 0.01 0.00 -1.41 0.00 0.00 60.65 58.07 2r1x s ILE 116 Cb -0.10 -2.23 0.02 0.00 0.13 0.00 0.00 42.46 40.28 2r1x s ILE 116 CO 0.00 0.35 -0.06 -0.36 -1.91 0.00 0.00 174.94 172.96 2r1x s PHE 117 N -0.93 0.94 0.81 3.50 0.40 0.24 -5.00 117.98 117.93 2r1x s PHE 117 Ca 0.15 -0.31 -0.12 0.00 -0.60 0.00 0.00 56.93 56.06 2r1x s PHE 117 Cb -0.11 -0.80 0.07 0.00 0.51 0.00 0.00 43.02 42.70 2r1x s PHE 117 CO 0.06 -0.24 1.11 -1.25 0.70 0.00 0.00 175.22 175.60 2r1x s PRO 118 N 0.98 2.01 0.41 0.24 0.04 -1.26 -1.95 135.00 135.48 2r1x s PRO 118 Ca -0.10 0.53 -0.26 0.00 0.04 0.00 0.00 61.00 61.21 2r1x s PRO 118 Cb -0.14 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 2r1x s PRO 118 CO 0.00 -1.65 1.38 -2.30 0.04 0.00 0.00 177.00 174.47 2r1x n PRO 119 N -3.43 2.22 -2.27 0.56 -0.02 -1.15 -4.84 135.00 126.07 2r1x n PRO 119 Ca 0.07 0.79 -0.34 0.00 -2.02 0.00 0.00 63.50 62.00 2r1x n PRO 119 Cb 0.57 -2.53 -0.01 0.00 -0.02 0.00 0.00 33.50 31.52 2r1x n PRO 119 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2r1x s SER 120 N -0.40 5.97 0.35 2.55 1.04 -1.26 -4.94 113.70 117.00 2r1x s SER 120 Ca 0.59 1.93 0.04 0.00 0.48 0.00 0.00 55.95 58.99 2r1x s SER 120 Cb -0.49 -2.55 0.64 0.00 0.10 0.00 0.00 66.02 63.73 2r1x s SER 120 CO 0.60 -1.04 1.92 0.77 0.98 0.00 0.00 173.24 176.46 2r1x h SER 121 N 0.99 0.52 0.42 7.02 4.64 -1.99 -1.20 113.55 123.95 2r1x h SER 121 Ca -0.48 -0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 60.75 2r1x h SER 121 Cb 1.23 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2r1x h SER 121 CO 0.58 0.53 -0.08 1.05 -0.87 0.00 0.00 176.83 178.04 2r1x h GLU 122 N 0.55 0.00 0.10 4.77 9.09 -1.99 -0.38 114.58 126.73 2r1x h GLU 122 Ca 0.13 0.00 -0.23 0.00 0.05 0.00 0.00 59.36 59.31 2r1x h GLU 122 Cb 0.22 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.32 2r1x h GLU 122 CO -0.00 0.08 -1.12 0.37 0.05 0.00 0.00 179.01 178.39 2r1x h GLN 123 N 0.00 0.22 -0.34 1.06 4.15 -1.68 -3.38 115.11 115.14 2r1x h GLN 123 Ca -0.00 -0.38 -0.00 0.00 0.77 0.00 0.00 58.65 59.04 2r1x h GLN 123 Cb 0.31 0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.12 2r1x h GLN 123 CO 0.01 1.18 0.21 -0.07 -1.93 0.00 0.00 178.83 178.23 2r1x h LEU 124 N -0.43 0.40 -2.21 -2.39 3.38 -0.90 -0.82 115.31 112.34 2r1x h LEU 124 Ca -0.24 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.72 2r1x h LEU 124 Cb 1.63 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 42.28 2r1x h LEU 124 CO 0.06 0.31 0.02 0.74 0.09 0.00 0.00 178.44 179.66 2r1x h THR 125 N 0.47 0.77 -0.00 0.22 2.02 -1.25 -1.17 112.91 113.96 2r1x h THR 125 Ca 0.12 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.30 2r1x h THR 125 Cb -0.02 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 2r1x h THR 125 CO -0.02 0.00 -0.22 -0.24 0.37 0.00 0.00 175.52 175.40 2r1x n SER 126 N -4.21 0.70 0.00 4.18 2.88 -0.32 -4.93 113.62 111.92 2r1x n SER 126 Ca -0.02 -0.61 0.00 0.00 -1.33 0.00 0.00 58.87 56.90 2r1x n SER 126 Cb 0.11 0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.62 2r1x n SER 126 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2r1x n GLY 127 N 1.35 0.61 3.59 0.46 0.00 -0.44 -5.07 105.19 105.69 2r1x n GLY 127 Ca 0.12 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.90 2r1x n GLY 127 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2r1x s GLY 128 N -0.94 1.86 -0.25 -0.02 0.00 -1.20 -0.85 107.32 105.92 2r1x s GLY 128 Ca 0.00 -1.82 -0.03 0.00 0.00 0.00 0.00 44.72 42.87 2r1x s GLY 128 CO 0.00 -1.85 0.23 0.00 0.00 0.00 0.00 173.10 171.48 2r1x s ALA 129 N -2.44 -0.16 -0.18 3.20 0.00 -0.01 -3.02 121.76 119.15 2r1x s ALA 129 Ca 0.32 -0.22 -0.07 0.00 0.00 0.00 0.00 51.96 51.99 2r1x s ALA 129 Cb -0.04 -1.50 -0.04 0.00 0.00 0.00 0.00 23.12 21.54 2r1x s ALA 129 CO 0.18 -1.48 0.04 -1.12 0.00 0.00 0.00 175.76 173.39 2r1x s SER 130 N 2.29 5.45 -0.14 0.00 0.01 -1.26 -0.61 113.70 119.44 2r1x s SER 130 Ca 0.08 0.03 -0.03 0.00 1.31 0.00 0.00 55.95 57.34 2r1x s SER 130 Cb -0.15 -1.93 -0.03 0.00 0.21 0.00 0.00 66.02 64.12 2r1x s SER 130 CO -0.24 0.16 -0.04 -0.69 0.41 0.00 0.00 173.24 172.84 2r1x s VAL 131 N 0.43 3.91 -0.05 3.43 1.01 0.89 -2.96 120.40 127.07 2r1x s VAL 131 Ca 0.02 -0.36 0.05 0.00 0.00 0.00 0.00 61.98 61.69 2r1x s VAL 131 Cb -0.13 -2.70 -0.02 0.00 0.00 0.00 0.00 36.38 33.53 2r1x s VAL 131 CO 0.01 0.51 -0.21 -0.69 0.00 0.00 0.00 175.10 174.72 2r1x s VAL 132 N 0.19 2.47 -0.12 2.92 1.01 -0.82 -0.76 120.40 125.29 2r1x s VAL 132 Ca -0.02 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.05 2r1x s VAL 132 Cb -0.14 -1.93 0.02 0.00 0.00 0.00 0.00 36.38 34.33 2r1x s VAL 132 CO 0.03 0.57 -0.15 0.00 0.00 0.00 0.00 175.10 175.55 2r1x s PHE 134 N 1.12 3.47 -0.35 0.00 0.08 0.09 -0.48 117.98 121.90 2r1x s PHE 134 Ca -0.04 0.50 0.02 0.00 0.12 0.00 0.00 56.93 57.53 2r1x s PHE 134 Cb -0.14 -2.23 0.09 0.00 -0.57 0.00 0.00 43.02 40.17 2r1x s PHE 134 CO -0.04 0.32 0.07 -0.51 -0.10 0.00 0.00 175.22 174.96 2r1x s LEU 135 N 0.22 4.67 -0.06 -0.37 2.01 0.41 -0.97 118.68 124.59 2r1x s LEU 135 Ca 0.13 -1.97 0.01 0.00 0.01 0.00 0.00 54.13 52.31 2r1x s LEU 135 Cb -0.12 -1.68 -0.03 0.00 0.01 0.00 0.00 46.19 44.37 2r1x s LEU 135 CO 0.02 -0.39 -0.06 0.20 1.01 0.00 0.00 176.35 177.13 2r1x s ASN 136 N 1.19 4.74 -1.02 2.29 0.02 0.01 0.04 114.94 122.21 2r1x s ASN 136 Ca 0.07 -0.01 -0.04 0.00 -1.02 0.00 0.00 52.86 51.86 2r1x s ASN 136 Cb -0.20 -1.20 -0.04 0.00 0.02 0.00 0.00 41.25 39.82 2r1x s ASN 136 CO -0.06 0.35 0.88 0.59 0.02 0.00 0.00 177.10 178.88 2r1x n ASN 137 N 2.10 -4.97 -4.55 -1.22 4.13 -0.49 -1.16 115.26 109.12 2r1x n ASN 137 Ca -0.18 -0.63 -0.26 0.00 1.68 0.00 0.00 54.58 55.19 2r1x n ASN 137 Cb 0.53 -4.87 -0.11 0.00 -1.54 0.00 0.00 39.78 33.80 2r1x n ASN 137 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 2r1x s PHE 138 N -3.35 2.40 -0.26 3.10 -0.71 0.31 -4.52 117.98 114.95 2r1x s PHE 138 Ca 0.29 -0.51 -0.21 0.00 -1.04 0.00 0.00 56.93 55.47 2r1x s PHE 138 Cb -0.04 -1.39 0.07 0.00 -1.21 0.00 0.00 43.02 40.45 2r1x s PHE 138 CO 0.69 0.58 0.68 -0.47 -1.34 0.00 0.00 175.22 175.36 2r1x s TYR 139 N -2.62 -0.86 0.69 3.49 6.14 -0.36 0.00 117.35 123.83 2r1x s TYR 139 Ca 0.33 1.94 -0.12 0.00 0.64 0.00 0.00 57.07 59.86 2r1x s TYR 139 Cb 0.03 0.39 0.16 0.00 0.42 0.00 0.00 41.96 42.96 2r1x s TYR 139 CO 0.16 -0.42 0.92 -0.35 0.64 0.00 0.00 175.55 176.50 2r1x n PRO 140 N 3.32 -0.99 0.11 4.97 -0.04 -1.26 -0.43 135.00 140.68 2r1x n PRO 140 Ca -0.16 -1.42 0.01 0.00 -0.04 0.00 0.00 63.50 61.89 2r1x n PRO 140 Cb 0.57 -0.96 0.33 0.00 -0.04 0.00 0.00 33.50 33.39 2r1x n PRO 140 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2r1x h LYS 141 N 0.00 0.24 -6.50 0.54 3.64 -1.99 -3.44 116.57 109.06 2r1x h LYS 141 Ca -0.30 -0.07 -0.53 0.00 -1.27 0.00 0.00 60.65 58.48 2r1x h LYS 141 Cb 0.83 -0.02 0.03 0.00 -0.41 0.00 0.00 32.23 32.65 2r1x h LYS 141 CO 0.21 0.46 0.96 -0.51 -2.27 0.00 0.00 179.45 178.29 2r1x s ASP 142 N -6.88 6.60 -0.05 4.20 1.01 -1.26 -4.98 116.67 115.32 2r1x s ASP 142 Ca -0.05 2.52 -0.25 0.00 0.71 0.00 0.00 52.55 55.48 2r1x s ASP 142 Cb 0.15 -2.57 0.05 0.00 1.01 0.00 0.00 42.92 41.56 2r1x s ASP 142 CO 0.75 -0.86 0.56 -0.51 0.21 0.00 0.00 175.17 175.31 2r1x s ILE 143 N 2.15 0.02 -0.10 0.77 2.07 -1.26 -4.68 121.20 120.17 2r1x s ILE 143 Ca 0.72 -0.15 0.01 0.00 -1.41 0.00 0.00 60.65 59.83 2r1x s ILE 143 Cb -0.41 -0.86 -0.02 0.00 0.13 0.00 0.00 42.46 41.30 2r1x s ILE 143 CO 0.32 -0.08 -0.14 0.21 -1.91 0.00 0.00 174.94 173.34 2r1x s ASN 144 N -1.13 3.98 -0.07 4.50 3.84 -0.50 -5.00 114.94 120.56 2r1x s ASN 144 Ca -0.11 -0.29 0.04 0.00 0.21 0.00 0.00 52.86 52.71 2r1x s ASN 144 Cb -0.02 -1.30 0.00 0.00 -0.55 0.00 0.00 41.25 39.38 2r1x s ASN 144 CO 0.08 0.24 -0.18 -0.69 -2.79 0.00 0.00 177.10 173.75 2r1x s VAL 145 N -0.07 1.59 0.02 -5.21 1.01 -1.26 -0.63 120.40 115.84 2r1x s VAL 145 Ca -0.03 -0.76 0.08 0.00 0.00 0.00 0.00 61.98 61.28 2r1x s VAL 145 Cb -0.14 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.82 2r1x s VAL 145 CO 0.04 0.45 -0.25 -1.59 0.00 0.00 0.00 175.10 173.76 2r1x s LYS 146 N 0.37 1.96 -0.16 2.72 0.00 -0.37 -4.97 119.74 119.30 2r1x s LYS 146 Ca -0.13 -1.02 -0.06 0.00 0.00 0.00 0.00 55.97 54.75 2r1x s LYS 146 Cb -0.16 -2.05 -0.04 0.00 0.00 0.00 0.00 37.83 35.59 2r1x s LYS 146 CO 0.05 0.54 0.06 -1.58 0.00 0.00 0.00 175.35 174.42 2r1x s TRP 147 N -0.76 3.28 -0.03 1.78 0.52 -1.26 -0.49 118.94 121.98 2r1x s TRP 147 Ca 0.12 0.15 0.04 0.00 0.02 0.00 0.00 56.10 56.43 2r1x s TRP 147 Cb -0.10 -2.01 -0.01 0.00 -1.15 0.00 0.00 33.47 30.20 2r1x s TRP 147 CO 0.02 0.29 -0.16 0.15 0.02 0.00 0.00 176.95 177.26 2r1x s LYS 148 N -0.04 1.55 -0.16 4.98 1.02 -0.23 -0.73 119.74 126.13 2r1x s LYS 148 Ca 0.06 -0.56 0.00 0.00 0.02 0.00 0.00 55.97 55.49 2r1x s LYS 148 Cb -0.12 -1.39 0.03 0.00 -0.52 0.00 0.00 37.83 35.83 2r1x s LYS 148 CO 0.01 0.26 -0.11 0.42 -0.92 0.00 0.00 175.35 175.01 2r1x s ILE 149 N -0.06 1.45 -1.53 2.17 1.01 0.22 -0.84 121.20 123.62 2r1x s ILE 149 Ca -0.01 -0.68 -0.14 0.00 0.00 0.00 0.00 60.65 59.82 2r1x s ILE 149 Cb -0.10 -1.45 0.11 0.00 0.01 0.00 0.00 42.46 41.03 2r1x s ILE 149 CO 0.01 0.33 0.79 0.47 0.00 0.00 0.00 174.94 176.54 2r1x n ASP 150 N 4.79 -4.11 0.00 3.58 8.00 0.20 -1.56 116.55 127.45 2r1x n ASP 150 Ca -0.15 -0.74 0.00 0.00 0.71 0.00 0.00 54.79 54.61 2r1x n ASP 150 Cb 0.49 -3.33 0.00 0.00 -0.02 0.00 0.00 41.12 38.26 2r1x n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2r1x n GLY 151 N -1.46 1.79 3.67 0.44 0.00 -1.26 -5.02 105.19 103.36 2r1x n GLY 151 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 2r1x n GLY 151 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2r1x s SER 152 N -3.34 5.62 0.29 1.61 0.01 -0.60 -5.00 113.70 112.29 2r1x s SER 152 Ca 0.00 0.14 -0.29 0.00 1.31 0.00 0.00 55.95 57.10 2r1x s SER 152 Cb 0.00 -1.88 -0.10 0.00 0.21 0.00 0.00 66.02 64.25 2r1x s SER 152 CO 0.00 0.24 1.41 -0.70 0.41 0.00 0.00 173.24 174.61 2r1x s GLU 153 N -0.06 4.27 -0.05 12.44 2.12 -1.26 -0.61 118.70 135.55 2r1x s GLU 153 Ca 0.06 2.32 0.05 0.00 0.36 0.00 0.00 54.97 57.76 2r1x s GLU 153 Cb -0.12 -3.08 -0.00 0.00 0.26 0.00 0.00 34.13 31.18 2r1x s GLU 153 CO 0.01 -0.38 -0.20 0.50 -0.54 0.00 0.00 175.26 174.66 2r1x s ARG 154 N -0.94 2.07 -0.02 4.30 3.52 0.09 -4.90 118.95 123.07 2r1x s ARG 154 Ca 0.56 -0.70 0.04 0.00 -0.13 0.00 0.00 55.73 55.50 2r1x s ARG 154 Cb -0.42 -1.76 -0.06 0.00 -1.56 0.00 0.00 34.95 31.14 2r1x s ARG 154 CO 0.48 0.27 0.06 1.04 -0.81 0.00 0.00 175.30 176.34 2r1x n GLN 155 N 3.14 1.66 -2.45 5.12 6.02 -1.26 -4.20 117.38 125.41 2r1x n GLN 155 Ca -0.18 -0.02 -0.39 0.00 -0.01 0.00 0.00 57.00 56.40 2r1x n GLN 155 Cb 0.53 -1.11 -0.04 0.00 1.02 0.00 0.00 30.24 30.64 2r1x n GLN 155 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2r1x s ASN 156 N -3.02 6.96 0.00 1.08 0.02 -1.26 -4.22 114.94 114.50 2r1x s ASN 156 Ca -0.02 2.23 0.00 0.00 -1.02 0.00 0.00 52.86 54.05 2r1x s ASN 156 Cb 0.02 -2.61 0.00 0.00 0.02 0.00 0.00 41.25 38.68 2r1x s ASN 156 CO 0.19 -0.36 0.00 0.61 0.02 0.00 0.00 177.10 177.56 2r1x n GLY 157 N 0.83 0.82 3.47 0.66 0.00 -1.26 -4.90 105.19 104.81 2r1x n GLY 157 Ca 0.02 -0.31 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 2r1x n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r1x s VAL 158 N -2.00 3.87 -0.27 1.61 1.01 -1.26 -0.51 120.40 122.85 2r1x s VAL 158 Ca 0.00 -0.36 -0.07 0.00 0.00 0.00 0.00 61.98 61.55 2r1x s VAL 158 Cb 0.00 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 2r1x s VAL 158 CO 0.00 0.47 0.08 -0.76 0.00 0.00 0.00 175.10 174.89 2r1x s LEU 159 N 0.57 3.60 -0.06 3.92 2.01 0.78 -4.93 118.68 124.57 2r1x s LEU 159 Ca -0.02 -0.41 0.01 0.00 0.01 0.00 0.00 54.13 53.72 2r1x s LEU 159 Cb -0.14 -1.91 -0.03 0.00 0.01 0.00 0.00 46.19 44.12 2r1x s LEU 159 CO 0.02 -0.10 -0.08 0.20 1.01 0.00 0.00 176.35 177.40 2r1x s ASN 160 N 1.57 4.53 -0.11 2.29 0.02 -1.26 -0.46 114.94 121.51 2r1x s ASN 160 Ca 0.05 -0.06 -0.05 0.00 -1.02 0.00 0.00 52.86 51.78 2r1x s ASN 160 Cb -0.16 -1.10 0.05 0.00 0.02 0.00 0.00 41.25 40.06 2r1x s ASN 160 CO 0.03 0.36 0.24 -0.55 0.02 0.00 0.00 177.10 177.20 2r1x s SER 161 N -0.82 0.07 -0.11 -1.22 0.15 -0.30 -4.99 113.70 106.47 2r1x s SER 161 Ca 0.12 0.52 -0.08 0.00 0.70 0.00 0.00 55.95 57.22 2r1x s SER 161 Cb -0.11 0.50 -0.04 0.00 -1.71 0.00 0.00 66.02 64.66 2r1x s SER 161 CO 0.01 -0.20 0.16 0.26 1.20 0.00 0.00 173.24 174.68 2r1x s TRP 162 N 1.79 3.61 0.74 3.44 0.51 -1.26 -0.61 118.94 127.16 2r1x s TRP 162 Ca -0.04 0.57 -0.11 0.00 -2.12 0.00 0.00 56.10 54.40 2r1x s TRP 162 Cb -0.11 -1.97 0.04 0.00 -0.81 0.00 0.00 33.47 30.61 2r1x s TRP 162 CO -0.08 0.73 1.08 0.95 -0.51 0.00 0.00 176.95 179.12 2r1x s THR 163 N -1.04 3.65 0.91 2.01 -4.23 -0.39 -5.00 115.64 111.55 2r1x s THR 163 Ca 0.16 0.54 -0.11 0.00 -1.18 0.00 0.00 61.69 61.10 2r1x s THR 163 Cb -0.12 -3.16 0.14 0.00 1.34 0.00 0.00 72.50 70.69 2r1x s THR 163 CO 0.05 -0.70 1.12 -1.81 -0.54 0.00 0.00 174.62 172.74 2r1x s ASP 164 N -3.62 3.08 0.50 3.99 1.11 -1.26 -4.62 116.67 115.85 2r1x s ASP 164 Ca 0.60 1.98 -0.23 0.00 0.18 0.00 0.00 52.55 55.07 2r1x s ASP 164 Cb -0.15 -2.50 -0.07 0.00 1.07 0.00 0.00 42.92 41.27 2r1x s ASP 164 CO 0.55 -2.96 1.25 1.67 1.18 0.00 0.00 175.17 176.87 2r1x n GLN 165 N -4.13 1.68 -2.47 8.23 7.27 -1.26 -4.73 117.38 121.96 2r1x n GLN 165 Ca 0.10 0.61 -0.41 0.00 0.07 0.00 0.00 57.00 57.37 2r1x n GLN 165 Cb 0.53 -2.42 -0.04 0.00 2.41 0.00 0.00 30.24 30.72 2r1x n GLN 165 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2r1x s ASP 166 N -0.78 7.19 0.12 1.69 2.15 0.46 -4.93 116.67 122.57 2r1x s ASP 166 Ca 0.67 2.07 0.23 0.00 0.43 0.00 0.00 52.55 55.95 2r1x s ASP 166 Cb -0.46 -2.60 0.89 0.00 -0.30 0.00 0.00 42.92 40.46 2r1x s ASP 166 CO 0.53 -0.31 1.70 -1.20 -0.17 0.00 0.00 175.17 175.71 2r1x n SER 167 N 2.88 0.37 -0.12 -0.34 7.64 -1.26 -1.23 113.62 121.55 2r1x n SER 167 Ca 0.05 0.57 -0.25 0.00 1.01 0.00 0.00 58.87 60.25 2r1x n SER 167 Cb 0.46 -0.65 -0.08 0.00 -1.01 0.00 0.00 64.21 62.93 2r1x n SER 167 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2r1x n LYS 168 N -1.88 0.54 0.00 1.43 4.81 -1.26 -2.75 118.16 119.05 2r1x n LYS 168 Ca 0.04 0.23 0.05 0.00 -0.87 0.00 0.00 58.31 57.76 2r1x n LYS 168 Cb 0.27 -1.41 0.04 0.00 0.02 0.00 0.00 35.03 33.95 2r1x n LYS 168 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2r1x n ASP 169 N -4.20 1.76 -1.16 3.14 3.85 -1.25 -4.88 116.55 113.81 2r1x n ASP 169 Ca -0.45 -1.38 -0.15 0.00 -0.71 0.00 0.00 54.79 52.10 2r1x n ASP 169 Cb 0.80 0.04 -0.06 0.00 -1.35 0.00 0.00 41.12 40.55 2r1x n ASP 169 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 2r1x n SER 170 N 0.48 -5.07 -4.92 -1.12 7.64 -0.37 -4.97 113.62 105.29 2r1x n SER 170 Ca 0.06 0.37 -0.21 0.00 1.01 0.00 0.00 58.87 60.10 2r1x n SER 170 Cb 0.24 -3.90 0.05 0.00 -1.01 0.00 0.00 64.21 59.59 2r1x n SER 170 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2r1x s THR 171 N -2.48 2.53 0.23 0.44 -4.23 -1.26 -4.64 115.64 106.24 2r1x s THR 171 Ca 0.00 -0.76 0.09 0.00 -1.18 0.00 0.00 61.69 59.84 2r1x s THR 171 Cb 0.00 -2.78 -0.04 0.00 1.34 0.00 0.00 72.50 71.02 2r1x s THR 171 CO 0.00 0.00 -0.03 -0.31 -0.54 0.00 0.00 174.62 173.74 2r1x s TYR 172 N -2.76 2.69 0.13 3.99 1.51 0.10 -0.40 117.35 122.61 2r1x s TYR 172 Ca 0.60 -0.21 0.03 0.00 -1.01 0.00 0.00 57.07 56.48 2r1x s TYR 172 Cb -0.08 -1.23 -0.04 0.00 -0.11 0.00 0.00 41.96 40.49 2r1x s TYR 172 CO 0.39 0.58 -0.09 -1.12 -1.11 0.00 0.00 175.55 174.20 2r1x s SER 173 N -3.37 1.56 -0.01 2.29 0.01 -1.26 -0.53 113.70 112.38 2r1x s SER 173 Ca 0.29 -1.01 -0.03 0.00 1.31 0.00 0.00 55.95 56.52 2r1x s SER 173 Cb -0.07 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.18 2r1x s SER 173 CO 0.18 -0.38 0.07 -0.32 0.41 0.00 0.00 173.24 173.21 2r1x s MET 174 N -3.76 0.21 -0.06 12.44 0.00 0.11 -1.26 119.30 126.99 2r1x s MET 174 Ca 0.15 -0.13 0.04 0.00 0.00 0.00 0.00 55.69 55.75 2r1x s MET 174 Cb 0.03 0.09 -0.02 0.00 0.00 0.00 0.00 34.83 34.93 2r1x s MET 174 CO -0.01 -0.04 -0.17 0.45 0.00 0.00 0.00 175.02 175.25 2r1x s SER 175 N -0.52 3.75 -0.09 1.11 0.15 0.23 -0.45 113.70 117.88 2r1x s SER 175 Ca -0.06 -0.29 0.02 0.00 0.70 0.00 0.00 55.95 56.32 2r1x s SER 175 Cb -0.04 -0.86 0.01 0.00 -1.71 0.00 0.00 66.02 63.43 2r1x s SER 175 CO 0.00 0.31 -0.14 -0.55 1.20 0.00 0.00 173.24 174.06 2r1x s SER 176 N -0.51 2.22 -0.14 5.45 0.15 0.36 -1.15 113.70 120.07 2r1x s SER 176 Ca 0.07 -0.38 0.01 0.00 0.70 0.00 0.00 55.95 56.34 2r1x s SER 176 Cb -0.12 -1.00 0.02 0.00 -1.71 0.00 0.00 66.02 63.22 2r1x s SER 176 CO 0.01 0.03 -0.15 -0.89 1.20 0.00 0.00 173.24 173.44 2r1x s THR 177 N 0.86 1.62 -0.25 6.45 2.01 0.39 -0.43 115.64 126.29 2r1x s THR 177 Ca -0.10 -0.67 -0.12 0.00 0.31 0.00 0.00 61.69 61.11 2r1x s THR 177 Cb -0.15 -1.51 -0.05 0.00 0.01 0.00 0.00 72.50 70.80 2r1x s THR 177 CO 0.01 0.47 0.23 -0.22 -0.69 0.00 0.00 174.62 174.42 2r1x s LEU 178 N 1.36 4.09 -0.16 4.42 2.96 0.06 -0.15 118.68 131.26 2r1x s LEU 178 Ca 0.03 0.17 -0.00 0.00 -0.22 0.00 0.00 54.13 54.10 2r1x s LEU 178 Cb -0.13 -2.21 -0.01 0.00 0.50 0.00 0.00 46.19 44.34 2r1x s LEU 178 CO -0.09 -0.02 -0.13 -0.89 -1.32 0.00 0.00 176.35 173.90 2r1x s THR 179 N 1.40 2.85 0.32 3.68 2.01 0.34 -0.08 115.64 126.16 2r1x s THR 179 Ca 0.10 -0.71 0.09 0.00 0.31 0.00 0.00 61.69 61.48 2r1x s THR 179 Cb -0.15 -2.22 -0.06 0.00 0.01 0.00 0.00 72.50 70.09 2r1x s THR 179 CO 0.07 0.51 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.65 2r1x s LEU 180 N 0.79 2.66 0.60 4.42 1.43 0.22 -4.74 118.68 124.06 2r1x s LEU 180 Ca -0.05 -1.18 -0.16 0.00 -1.03 0.00 0.00 54.13 51.71 2r1x s LEU 180 Cb -0.15 -0.91 -0.03 0.00 0.03 0.00 0.00 46.19 45.12 2r1x s LEU 180 CO 0.01 -0.22 1.06 0.42 0.23 0.00 0.00 176.35 177.85 2r1x s THR 181 N -2.71 3.77 0.25 5.49 -4.23 -1.26 -0.83 115.64 116.12 2r1x s THR 181 Ca 0.31 0.83 -0.04 0.00 -1.18 0.00 0.00 61.69 61.61 2r1x s THR 181 Cb 0.02 -3.36 0.23 0.00 1.34 0.00 0.00 72.50 70.74 2r1x s THR 181 CO 0.15 -0.50 1.86 0.50 -0.54 0.00 0.00 174.62 176.09 2r1x h LYS 182 N 0.37 0.99 -0.85 3.99 3.64 -1.24 0.21 116.57 123.69 2r1x h LYS 182 Ca -0.47 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 58.86 2r1x h LYS 182 Cb 1.22 -0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 32.78 2r1x h LYS 182 CO 0.57 0.66 0.56 -0.44 -2.27 0.00 0.00 179.45 178.53 2r1x h ASP 183 N 1.02 0.96 0.05 4.20 3.32 -1.93 -0.77 116.42 123.28 2r1x h ASP 183 Ca 0.40 -0.02 -0.26 0.00 0.02 0.00 0.00 57.03 57.17 2r1x h ASP 183 Cb 0.19 -0.24 0.02 0.00 0.22 0.00 0.00 39.33 39.52 2r1x h ASP 183 CO -0.18 0.69 -1.04 -0.08 -1.72 0.00 0.00 179.24 176.91 2r1x h GLU 184 N 1.14 0.61 -0.86 3.56 4.57 -1.85 -3.20 114.58 118.55 2r1x h GLU 184 Ca 0.31 -0.73 0.14 0.00 -1.18 0.00 0.00 59.36 57.91 2r1x h GLU 184 Cb -0.12 0.22 -0.09 0.00 -0.16 0.00 0.00 28.75 28.61 2r1x h GLU 184 CO -0.07 1.31 0.46 -0.92 -1.18 0.00 0.00 179.01 178.61 2r1x h TYR 185 N 0.24 0.81 0.00 0.92 3.20 -0.63 -1.44 116.97 120.06 2r1x h TYR 185 Ca -0.14 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.76 2r1x h TYR 185 Cb 1.72 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 39.76 2r1x h TYR 185 CO 0.12 0.21 0.00 0.39 -1.64 0.00 0.00 178.16 177.24 2r1x n GLU 186 N -4.85 0.58 0.00 1.82 1.02 -0.33 -2.98 120.64 115.91 2r1x n GLU 186 Ca 0.17 0.03 0.13 0.00 -0.02 0.00 0.00 57.16 57.47 2r1x n GLU 186 Cb 0.43 -1.50 0.34 0.00 -0.02 0.00 0.00 31.44 30.69 2r1x n GLU 186 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2r1x n ARG 187 N -1.10 0.96 -4.17 3.49 1.74 -0.54 -4.94 116.66 112.09 2r1x n ARG 187 Ca 0.15 -0.60 -0.10 0.00 -0.77 0.00 0.00 57.85 56.52 2r1x n ARG 187 Cb 0.11 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 29.97 2r1x n ARG 187 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2r1x s HIS 188 N -2.46 0.92 -0.06 -1.55 3.76 -1.16 -5.10 115.29 109.64 2r1x s HIS 188 Ca 0.25 -1.11 -0.05 0.00 -0.15 0.00 0.00 55.06 54.00 2r1x s HIS 188 Cb 0.19 -0.53 -0.03 0.00 1.11 0.00 0.00 32.58 33.32 2r1x s HIS 188 CO 0.51 -0.37 -0.11 -1.71 -0.85 0.00 0.00 174.74 172.21 2r1x n ASN 189 N -0.10 0.83 -4.67 1.40 4.05 -1.26 -4.78 115.26 110.72 2r1x n ASN 189 Ca -0.08 0.13 -0.40 0.00 0.45 0.00 0.00 54.58 54.69 2r1x n ASN 189 Cb 0.63 -0.32 -0.06 0.00 1.23 0.00 0.00 39.78 41.26 2r1x n ASN 189 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 2r1x s SER 190 N -5.84 6.69 -0.14 1.20 0.15 -1.26 -0.32 113.70 114.18 2r1x s SER 190 Ca -0.11 0.84 0.02 0.00 0.70 0.00 0.00 55.95 57.39 2r1x s SER 190 Cb 0.04 -2.34 0.01 0.00 -1.71 0.00 0.00 66.02 62.03 2r1x s SER 190 CO 0.15 -0.20 -0.19 -0.31 1.20 0.00 0.00 173.24 173.89 2r1x s TYR 191 N 1.56 2.46 -0.04 3.44 2.02 -0.18 -0.63 117.35 125.98 2r1x s TYR 191 Ca 0.28 -1.29 0.02 0.00 -0.37 0.00 0.00 57.07 55.71 2r1x s TYR 191 Cb -0.16 -1.72 0.01 0.00 -0.40 0.00 0.00 41.96 39.70 2r1x s TYR 191 CO 0.11 -0.63 -0.08 0.99 -1.57 0.00 0.00 175.55 174.37 2r1x s THR 192 N 1.04 0.80 -0.27 -0.71 2.01 -0.02 -1.33 115.64 117.15 2r1x s THR 192 Ca -0.03 -0.31 -0.10 0.00 0.31 0.00 0.00 61.69 61.56 2r1x s THR 192 Cb -0.15 -0.75 -0.05 0.00 0.01 0.00 0.00 72.50 71.57 2r1x s THR 192 CO -0.05 0.27 0.16 0.00 -0.69 0.00 0.00 174.62 174.31 2r1x s GLU 194 N 1.61 2.92 -0.20 0.00 2.02 0.36 -1.21 118.70 124.19 2r1x s GLU 194 Ca 0.07 -0.89 -0.07 0.00 0.02 0.00 0.00 54.97 54.10 2r1x s GLU 194 Cb -0.15 -2.66 -0.04 0.00 0.10 0.00 0.00 34.13 31.38 2r1x s GLU 194 CO 0.09 -0.26 0.06 0.00 0.02 0.00 0.00 175.26 175.16 2r1x s ALA 195 N 1.28 3.29 -0.18 5.21 0.00 0.24 -1.23 121.76 130.37 2r1x s ALA 195 Ca 0.03 -0.88 -0.01 0.00 0.00 0.00 0.00 51.96 51.10 2r1x s ALA 195 Cb -0.14 -1.94 0.00 0.00 0.00 0.00 0.00 23.12 21.04 2r1x s ALA 195 CO -0.11 -0.04 -0.13 0.99 0.00 0.00 0.00 175.76 176.47 2r1x s THR 196 N 0.79 2.75 0.06 0.00 2.01 0.19 -0.38 115.64 121.06 2r1x s THR 196 Ca 0.03 -0.73 0.03 0.00 0.31 0.00 0.00 61.69 61.33 2r1x s THR 196 Cb -0.14 -2.19 -0.03 0.00 0.01 0.00 0.00 72.50 70.16 2r1x s THR 196 CO 0.02 0.50 -0.09 -2.28 -0.69 0.00 0.00 174.62 172.08 2r1x s HIS 197 N 1.06 0.82 0.51 4.92 2.46 -1.26 -1.41 115.29 122.40 2r1x s HIS 197 Ca -0.00 -0.54 0.36 0.00 0.47 0.00 0.00 55.06 55.35 2r1x s HIS 197 Cb -0.15 -0.48 1.94 0.00 -0.13 0.00 0.00 32.58 33.76 2r1x s HIS 197 CO -0.03 -0.05 2.08 1.57 -2.47 0.00 0.00 174.74 175.84 2r1x h LYS 198 N 4.26 0.00 0.00 2.88 2.10 -1.95 -2.16 116.57 121.71 2r1x h LYS 198 Ca -0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 2r1x h LYS 198 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 2r1x h LYS 198 CO 0.43 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.13 2r1x n THR 199 N -2.85 1.01 -3.65 0.07 -2.24 -1.26 -4.71 114.28 100.66 2r1x n THR 199 Ca -0.02 0.31 -0.15 0.00 -2.27 0.00 0.00 64.05 61.92 2r1x n THR 199 Cb 0.17 -1.18 -0.08 0.00 -2.10 0.00 0.00 70.33 67.14 2r1x n THR 199 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2r1x s SER 200 N -3.65 -0.53 0.21 3.42 0.15 -0.81 -4.99 113.70 107.49 2r1x s SER 200 Ca 0.04 0.81 0.25 0.00 0.70 0.00 0.00 55.95 57.75 2r1x s SER 200 Cb 0.08 0.81 0.90 0.00 -1.71 0.00 0.00 66.02 66.11 2r1x s SER 200 CO 0.29 -0.37 1.74 0.35 1.20 0.00 0.00 173.24 176.45 2r1x n THR 201 N 1.93 0.68 -3.32 6.45 -2.24 -1.26 -4.44 114.28 112.08 2r1x n THR 201 Ca -0.17 -0.01 -0.39 0.00 -2.27 0.00 0.00 64.05 61.22 2r1x n THR 201 Cb 0.56 -0.86 -0.08 0.00 -2.10 0.00 0.00 70.33 67.85 2r1x n THR 201 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2r1x s SER 202 N -4.21 6.42 0.59 3.42 0.01 -1.26 -5.07 113.70 113.59 2r1x s SER 202 Ca 0.08 0.49 -0.19 0.00 1.31 0.00 0.00 55.95 57.64 2r1x s SER 202 Cb 0.11 -2.25 -0.03 0.00 0.21 0.00 0.00 66.02 64.06 2r1x s SER 202 CO 0.48 -0.17 1.24 -2.84 0.41 0.00 0.00 173.24 172.36 2r1x s PRO 203 N 1.80 2.95 -0.18 12.44 0.02 -1.26 -4.85 135.00 145.91 2r1x s PRO 203 Ca 0.20 1.92 -0.21 0.00 0.02 0.00 0.00 61.00 62.92 2r1x s PRO 203 Cb -0.15 -1.97 -0.02 0.00 0.02 0.00 0.00 34.50 32.37 2r1x s PRO 203 CO 0.09 -1.25 0.66 0.42 -0.33 0.00 0.00 177.00 176.59 2r1x s ILE 204 N -1.52 5.01 -0.21 2.83 1.01 0.49 -4.88 121.20 123.92 2r1x s ILE 204 Ca 0.77 1.25 -0.03 0.00 0.00 0.00 0.00 60.65 62.65 2r1x s ILE 204 Cb -0.33 -3.97 0.00 0.00 0.01 0.00 0.00 42.46 38.17 2r1x s ILE 204 CO 0.36 0.11 -0.08 -0.69 0.00 0.00 0.00 174.94 174.64 2r1x s VAL 205 N 1.85 3.06 -0.05 2.92 1.01 -1.26 -0.59 120.40 127.33 2r1x s VAL 205 Ca 0.30 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 61.72 2r1x s VAL 205 Cb -0.16 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.82 2r1x s VAL 205 CO 0.11 0.43 -0.25 -0.54 0.00 0.00 0.00 175.10 174.86 2r1x s LYS 206 N 1.43 2.46 0.05 2.72 -0.14 -0.35 -5.02 119.74 120.89 2r1x s LYS 206 Ca 0.05 -0.90 -0.04 0.00 -1.36 0.00 0.00 55.97 53.72 2r1x s LYS 206 Cb -0.14 -2.15 -0.02 0.00 -1.68 0.00 0.00 37.83 33.84 2r1x s LYS 206 CO -0.06 0.43 0.07 0.45 -0.76 0.00 0.00 175.35 175.49 2r1x s SER 207 N -0.29 0.25 0.05 2.83 0.15 -1.26 -0.34 113.70 115.09 2r1x s SER 207 Ca 0.00 -0.66 -0.02 0.00 0.70 0.00 0.00 55.95 55.98 2r1x s SER 207 Cb -0.13 0.23 -0.04 0.00 -1.71 0.00 0.00 66.02 64.37 2r1x s SER 207 CO 0.02 -0.55 -0.01 0.72 1.20 0.00 0.00 173.24 174.62 2r1x s PHE 208 N -3.01 0.48 -0.11 3.44 -0.71 -0.44 -5.00 117.98 112.63 2r1x s PHE 208 Ca -0.01 -1.01 0.02 0.00 -1.04 0.00 0.00 56.93 54.88 2r1x s PHE 208 Cb 0.01 -0.36 -0.01 0.00 -1.21 0.00 0.00 43.02 41.45 2r1x s PHE 208 CO -0.07 -0.38 -0.16 -0.80 -1.34 0.00 0.00 175.22 172.47 2r1x s ASN 209 N -2.86 3.75 0.33 1.98 0.01 -1.26 -1.01 114.94 115.88 2r1x s ASN 209 Ca 0.06 -0.37 0.02 0.00 -0.71 0.00 0.00 52.86 51.86 2r1x s ASN 209 Cb 0.07 -1.40 0.61 0.00 0.41 0.00 0.00 41.25 40.94 2r1x s ASN 209 CO -0.10 0.20 1.96 -0.09 -1.51 0.00 0.00 177.10 177.56 2r1x h ARG 210 N 6.46 0.89 0.00 -0.60 2.43 -0.97 -1.26 114.38 121.32 2r1x h ARG 210 Ca -0.28 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 2r1x h ARG 210 Cb 1.21 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 2r1x h ARG 210 CO 0.52 0.59 0.00 -2.95 -1.51 0.00 0.00 179.97 176.62 2r1x h ASN 211 N 0.92 0.00 0.10 -3.80 7.08 -1.93 -2.58 115.58 115.36 2r1x h ASN 211 Ca 0.32 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.54 2r1x h ASN 211 Cb 0.10 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.34 2r1x h ASN 211 CO -0.10 0.00 -0.35 -0.62 -2.08 0.00 0.00 177.43 174.28 2r1x n GLU 212 N -2.91 1.09 0.00 4.14 1.02 -0.48 -5.28 120.64 118.23 2r1x n GLU 212 Ca -0.02 -0.79 0.12 0.00 -0.02 0.00 0.00 57.16 56.44 2r1x n GLU 212 Cb 0.07 -1.48 0.73 0.00 -0.02 0.00 0.00 31.44 30.74 2r1x n GLU 212 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31