#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m1x s ASN 2 N 0.00 -0.88 -0.05 5.98 3.84 -1.26 -4.64 114.94 117.92 1m1x s ASN 2 Ca 0.00 1.47 -0.14 0.00 0.21 0.00 0.00 52.86 54.40 1m1x s ASN 2 Cb 0.00 1.40 0.03 0.00 -0.55 0.00 0.00 41.25 42.12 1m1x s ASN 2 CO 0.00 -0.24 0.32 -1.48 -2.79 0.00 0.00 177.10 172.92 1m1x s LEU 3 N 1.31 0.79 0.07 3.21 0.05 -1.26 -3.41 118.68 119.43 1m1x s LEU 3 Ca -0.07 0.28 -0.36 0.00 0.05 0.00 0.00 54.13 54.03 1m1x s LEU 3 Cb -0.05 1.25 -0.16 0.00 -2.05 0.00 0.00 46.19 45.18 1m1x s LEU 3 CO -0.15 -0.34 1.43 -0.67 -0.55 0.00 0.00 176.35 176.07 1m1x n ASP 4 N 1.78 2.04 0.00 1.48 -0.08 -0.34 -4.88 116.55 116.56 1m1x n ASP 4 Ca -0.19 1.10 0.00 0.00 -1.51 0.00 0.00 54.79 54.20 1m1x n ASP 4 Cb 0.56 -1.24 0.00 0.00 2.34 0.00 0.00 41.12 42.78 1m1x n ASP 4 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 1m1x n VAL 5 N 2.93 0.00 0.18 5.18 0.31 -1.26 -4.36 118.33 121.31 1m1x n VAL 5 Ca 0.19 -0.38 -0.10 0.00 -0.01 0.00 0.00 64.34 64.04 1m1x n VAL 5 Cb 0.21 1.06 -0.05 0.00 -0.91 0.00 0.00 33.84 34.14 1m1x n VAL 5 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1m1x h ASP 6 N 0.00 -0.45 -3.19 4.52 5.19 -2.00 -3.41 116.42 117.07 1m1x h ASP 6 Ca 0.00 -0.05 -0.61 0.00 -0.62 0.00 0.00 57.03 55.74 1m1x h ASP 6 Cb 0.03 0.12 -0.41 0.00 0.18 0.00 0.00 39.33 39.25 1m1x h ASP 6 CO 0.00 -0.01 -0.69 -0.55 -3.12 0.00 0.00 179.24 174.87 1m1x s SER 7 N -4.97 3.87 0.50 6.45 0.15 -1.26 -5.11 113.70 113.32 1m1x s SER 7 Ca -0.10 -3.36 0.02 0.00 0.70 0.00 0.00 55.95 53.21 1m1x s SER 7 Cb 0.01 -1.28 0.02 0.00 -1.71 0.00 0.00 66.02 63.05 1m1x s SER 7 CO 0.32 -0.15 0.71 -2.16 1.20 0.00 0.00 173.24 173.16 1m1x s PRO 8 N -0.67 2.77 -0.38 5.44 0.04 -1.26 -4.88 135.00 136.07 1m1x s PRO 8 Ca 0.24 -0.71 -0.20 0.00 0.04 0.00 0.00 61.00 60.37 1m1x s PRO 8 Cb -0.09 -2.54 0.01 0.00 0.04 0.00 0.00 34.50 31.91 1m1x s PRO 8 CO -0.12 -0.50 0.60 0.00 0.04 0.00 0.00 177.00 177.02 1m1x s ALA 9 N -2.64 3.43 -0.05 8.56 0.00 0.11 -4.83 121.76 126.35 1m1x s ALA 9 Ca 0.53 -1.00 -0.18 0.00 0.00 0.00 0.00 51.96 51.31 1m1x s ALA 9 Cb -0.10 -3.16 -0.05 0.00 0.00 0.00 0.00 23.12 19.81 1m1x s ALA 9 CO 0.38 -1.42 0.51 -2.00 0.00 0.00 0.00 175.76 173.22 1m1x s GLU 10 N 2.63 4.24 0.05 0.00 -6.30 -1.26 0.48 118.70 118.54 1m1x s GLU 10 Ca 0.22 0.55 0.04 0.00 -2.50 0.00 0.00 54.97 53.28 1m1x s GLU 10 Cb -0.15 -3.35 -0.02 0.00 0.00 0.00 0.00 34.13 30.61 1m1x s GLU 10 CO 0.15 0.36 -0.12 0.71 0.02 0.00 0.00 175.26 176.38 1m1x s TYR 11 N -0.08 1.04 0.26 5.30 1.51 0.60 -4.98 117.35 121.00 1m1x s TYR 11 Ca 0.27 -0.43 0.02 0.00 -1.01 0.00 0.00 57.07 55.92 1m1x s TYR 11 Cb -0.17 -0.60 -0.05 0.00 -0.11 0.00 0.00 41.96 41.03 1m1x s TYR 11 CO 0.14 0.01 0.09 -1.54 -1.11 0.00 0.00 175.55 173.13 1m1x s SER 12 N -1.47 1.36 0.34 2.29 1.04 -1.26 -1.94 113.70 114.06 1m1x s SER 12 Ca -0.03 -1.37 -0.03 0.00 0.48 0.00 0.00 55.95 55.00 1m1x s SER 12 Cb -0.09 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.16 1m1x s SER 12 CO 0.01 -0.70 0.48 -0.83 0.98 0.00 0.00 173.24 173.18 1m1x s GLY 13 N -3.33 1.44 0.56 7.32 0.00 -1.12 -4.95 107.32 107.25 1m1x s GLY 13 Ca 0.37 -1.49 -0.21 0.00 0.00 0.00 0.00 44.72 43.40 1m1x s GLY 13 CO 0.14 -0.98 1.31 -1.05 0.00 0.00 0.00 173.10 172.52 1m1x n PRO 14 N -0.55 1.54 -1.55 2.90 -0.02 -1.26 -4.87 135.00 131.18 1m1x n PRO 14 Ca 0.01 0.57 -0.38 0.00 -2.02 0.00 0.00 63.50 61.68 1m1x n PRO 14 Cb 0.62 -2.53 -0.04 0.00 -0.02 0.00 0.00 33.50 31.53 1m1x n PRO 14 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1m1x n GLU 15 N -1.13 1.13 -0.29 -0.52 0.28 -1.26 -1.20 120.64 117.65 1m1x n GLU 15 Ca 0.12 0.08 0.00 0.00 -0.16 0.00 0.00 57.16 57.20 1m1x n GLU 15 Cb 0.45 -3.29 0.00 0.00 1.43 0.00 0.00 31.44 30.03 1m1x n GLU 15 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1m1x n GLY 16 N 6.02 0.84 0.03 -1.84 0.00 -1.26 -4.94 105.19 104.03 1m1x n GLY 16 Ca 0.38 -0.16 0.13 0.00 0.00 0.00 0.00 46.02 46.37 1m1x n GLY 16 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1m1x n SER 17 N 0.29 0.27 -1.53 1.61 3.41 -0.34 -4.57 113.62 112.75 1m1x n SER 17 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 1m1x n SER 17 Cb 0.00 -0.16 -0.03 0.00 -0.26 0.00 0.00 64.21 63.77 1m1x n SER 17 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1m1x n TYR 18 N -1.37 -0.48 -1.65 7.33 0.53 -1.26 -0.58 117.16 119.67 1m1x n TYR 18 Ca 0.08 0.00 -0.48 0.00 -1.02 0.00 0.00 57.90 56.48 1m1x n TYR 18 Cb 0.32 -2.98 -0.05 0.00 -1.03 0.00 0.00 39.34 35.61 1m1x n TYR 18 CO 0.00 0.00 0.00 0.34 -1.02 0.00 0.00 176.86 176.18 1m1x n PHE 19 N -3.54 2.09 -0.39 -0.72 -0.00 -1.26 -1.87 117.46 111.77 1m1x n PHE 19 Ca -0.17 0.34 0.00 0.00 -0.00 0.00 0.00 57.45 57.62 1m1x n PHE 19 Cb 0.59 -2.50 0.00 0.00 -0.00 0.00 0.00 39.48 37.57 1m1x n PHE 19 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1m1x n GLY 20 N 3.30 0.77 0.15 7.13 0.00 -0.80 -2.05 105.19 113.68 1m1x n GLY 20 Ca 0.18 -0.35 0.07 0.00 0.00 0.00 0.00 46.02 45.93 1m1x n GLY 20 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1m1x h PHE 21 N 0.00 0.00 -2.63 1.61 3.57 -1.35 -3.37 116.94 114.77 1m1x h PHE 21 Ca 0.00 0.00 -0.32 0.00 3.53 0.00 0.00 57.97 61.18 1m1x h PHE 21 Cb 0.00 0.00 -0.36 0.00 2.79 0.00 0.00 35.95 38.38 1m1x h PHE 21 CO 0.00 0.23 -0.63 0.00 -2.23 0.00 0.00 178.31 175.68 1m1x s ALA 22 N -3.14 -0.25 0.09 2.41 0.00 -1.26 -4.67 121.76 114.95 1m1x s ALA 22 Ca 0.02 0.31 0.07 0.00 0.00 0.00 0.00 51.96 52.37 1m1x s ALA 22 Cb 0.08 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.92 1m1x s ALA 22 CO 0.75 -1.10 -0.14 0.14 0.00 0.00 0.00 175.76 175.41 1m1x s VAL 23 N 2.32 3.12 0.21 0.00 -7.23 -1.26 -1.03 120.40 116.54 1m1x s VAL 23 Ca 0.06 -1.31 -0.22 0.00 -1.81 0.00 0.00 61.98 58.69 1m1x s VAL 23 Cb -0.15 -2.43 0.05 0.00 0.56 0.00 0.00 36.38 34.41 1m1x s VAL 23 CO -0.11 0.15 0.69 -0.62 -0.31 0.00 0.00 175.10 174.91 1m1x s ASP 24 N -2.03 -0.38 -0.12 4.85 -1.08 -0.47 -4.65 116.67 112.79 1m1x s ASP 24 Ca 0.19 -0.33 -0.06 0.00 -0.52 0.00 0.00 52.55 51.83 1m1x s ASP 24 Cb -0.11 0.65 -0.04 0.00 -1.46 0.00 0.00 42.92 41.96 1m1x s ASP 24 CO 0.11 -1.14 0.11 -0.36 0.52 0.00 0.00 175.17 174.41 1m1x s PHE 25 N -3.78 3.49 -0.33 -5.34 0.40 -1.26 -0.45 117.98 110.71 1m1x s PHE 25 Ca 0.07 0.43 -0.03 0.00 -0.60 0.00 0.00 56.93 56.80 1m1x s PHE 25 Cb -0.04 -1.93 0.06 0.00 0.51 0.00 0.00 43.02 41.62 1m1x s PHE 25 CO -0.02 0.63 0.05 0.12 0.70 0.00 0.00 175.22 176.71 1m1x s PHE 26 N -0.86 3.32 -0.54 0.36 5.99 0.29 -4.80 117.98 121.75 1m1x s PHE 26 Ca 0.14 -1.89 0.02 0.00 0.00 0.00 0.00 56.93 55.20 1m1x s PHE 26 Cb -0.12 -2.33 0.14 0.00 0.00 0.00 0.00 43.02 40.71 1m1x s PHE 26 CO 0.03 -0.82 0.30 0.54 -0.00 0.00 0.00 175.22 175.28 1m1x s VAL 27 N 1.26 2.92 0.74 3.12 0.11 -1.26 -0.07 120.40 127.22 1m1x s VAL 27 Ca -0.02 -3.16 -0.14 0.00 -2.93 0.00 0.00 61.98 55.73 1m1x s VAL 27 Cb -0.20 -2.99 0.04 0.00 -1.53 0.00 0.00 36.38 31.70 1m1x s VAL 27 CO -0.01 -0.81 1.14 -2.84 -3.33 0.00 0.00 175.10 169.25 1m1x s PRO 28 N -0.16 2.25 0.09 1.54 0.02 -1.26 -4.19 135.00 133.28 1m1x s PRO 28 Ca 0.17 1.50 0.22 0.00 0.02 0.00 0.00 61.00 62.90 1m1x s PRO 28 Cb -0.24 -1.87 -0.15 0.00 0.02 0.00 0.00 34.50 32.26 1m1x s PRO 28 CO -0.01 -1.70 0.78 -1.13 -0.33 0.00 0.00 177.00 174.61 1m1x n SER 29 N -2.94 0.50 -0.09 2.53 3.41 -1.26 -4.07 113.62 111.70 1m1x n SER 29 Ca 0.11 0.20 0.14 0.00 -0.26 0.00 0.00 58.87 59.07 1m1x n SER 29 Cb 0.52 1.03 0.80 0.00 -0.26 0.00 0.00 64.21 66.30 1m1x n SER 29 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1m1x n ALA 30 N -2.25 2.65 -2.47 7.33 0.00 -1.26 -4.89 120.51 119.62 1m1x n ALA 30 Ca -0.03 -0.23 -0.08 0.00 0.00 0.00 0.00 53.44 53.09 1m1x n ALA 30 Cb 0.60 -1.42 -0.08 0.00 0.00 0.00 0.00 19.45 18.56 1m1x n ALA 30 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1m1x s SER 31 N -1.91 0.19 0.16 0.00 0.15 -1.26 -5.03 113.70 106.00 1m1x s SER 31 Ca 0.43 -0.72 0.08 0.00 0.70 0.00 0.00 55.95 56.43 1m1x s SER 31 Cb 0.20 0.32 -0.04 0.00 -1.71 0.00 0.00 66.02 64.78 1m1x s SER 31 CO 0.34 -0.71 1.37 0.77 1.20 0.00 0.00 173.24 176.21 1m1x h SER 32 N 2.82 0.02 -3.09 5.45 4.64 -1.90 -3.45 113.55 118.04 1m1x h SER 32 Ca -0.34 -0.02 -0.47 0.00 -0.47 0.00 0.00 61.79 60.49 1m1x h SER 32 Cb 1.19 -0.01 0.03 0.00 -0.31 0.00 0.00 62.40 63.31 1m1x h SER 32 CO 0.58 0.90 -0.01 0.00 -0.87 0.00 0.00 176.83 177.42 1m1x s ARG 33 N -2.98 3.18 0.26 4.77 1.70 -1.26 -5.07 118.95 119.54 1m1x s ARG 33 Ca 0.00 -0.24 0.09 0.00 -0.47 0.00 0.00 55.73 55.11 1m1x s ARG 33 Cb 0.11 -2.48 -0.05 0.00 -0.57 0.00 0.00 34.95 31.96 1m1x s ARG 33 CO 0.81 -0.29 -0.15 -1.64 -1.08 0.00 0.00 175.30 172.95 1m1x s MET 34 N -4.65 1.55 0.35 3.89 -1.94 -1.26 -4.32 119.30 112.92 1m1x s MET 34 Ca 0.48 -1.73 0.06 0.00 -1.71 0.00 0.00 55.69 52.80 1m1x s MET 34 Cb -0.10 -1.43 -0.03 0.00 2.01 0.00 0.00 34.83 35.28 1m1x s MET 34 CO 0.40 0.21 0.24 -0.06 -0.01 0.00 0.00 175.02 175.81 1m1x s PHE 35 N -2.76 1.76 -0.03 -0.03 0.40 0.90 -4.26 117.98 113.95 1m1x s PHE 35 Ca 0.28 -1.58 0.03 0.00 -0.60 0.00 0.00 56.93 55.05 1m1x s PHE 35 Cb -0.01 -0.82 -0.03 0.00 0.51 0.00 0.00 43.02 42.66 1m1x s PHE 35 CO 0.12 -0.73 -0.08 -0.51 0.70 0.00 0.00 175.22 174.71 1m1x s LEU 36 N -3.43 3.09 -0.29 -0.37 1.02 -0.25 -0.55 118.68 117.91 1m1x s LEU 36 Ca 0.36 -0.12 0.03 0.00 0.02 0.00 0.00 54.13 54.42 1m1x s LEU 36 Cb 0.02 -1.72 0.08 0.00 0.02 0.00 0.00 46.19 44.59 1m1x s LEU 36 CO 0.24 0.32 -0.04 -0.76 0.02 0.00 0.00 176.35 176.14 1m1x s LEU 37 N -1.09 3.71 -0.13 1.79 1.43 0.40 -0.31 118.68 124.48 1m1x s LEU 37 Ca 0.14 -1.64 0.03 0.00 -1.03 0.00 0.00 54.13 51.63 1m1x s LEU 37 Cb -0.11 -1.49 0.01 0.00 0.03 0.00 0.00 46.19 44.63 1m1x s LEU 37 CO 0.04 -0.27 -0.22 -0.69 0.23 0.00 0.00 176.35 175.43 1m1x s VAL 38 N 1.10 2.06 0.12 -1.59 1.01 0.02 -1.36 120.40 121.75 1m1x s VAL 38 Ca -0.01 -0.99 -0.21 0.00 0.00 0.00 0.00 61.98 60.77 1m1x s VAL 38 Cb -0.19 -1.81 -0.07 0.00 0.00 0.00 0.00 36.38 34.30 1m1x s VAL 38 CO -0.07 0.55 0.65 -0.83 0.00 0.00 0.00 175.10 175.40 1m1x s GLY 39 N 0.74 2.75 -0.57 4.51 0.00 -0.20 0.32 107.32 114.88 1m1x s GLY 39 Ca -0.09 0.16 0.06 0.00 0.00 0.00 0.00 44.72 44.85 1m1x s GLY 39 CO -0.00 0.60 0.77 0.00 0.00 0.00 0.00 173.10 174.47 1m1x n ALA 40 N 1.56 3.84 -0.01 3.20 0.00 -0.32 -1.89 120.51 126.90 1m1x n ALA 40 Ca -0.08 -4.46 0.19 0.00 0.00 0.00 0.00 53.44 49.09 1m1x n ALA 40 Cb 0.50 -0.85 0.37 0.00 0.00 0.00 0.00 19.45 19.48 1m1x n ALA 40 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1m1x h PRO 41 N 3.76 0.00 -0.15 0.00 0.11 -1.58 0.20 132.00 134.34 1m1x h PRO 41 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1m1x h PRO 41 Cb 0.67 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.78 1m1x h PRO 41 CO 0.75 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.17 1m1x n LYS 42 N -3.07 2.56 -2.24 1.05 5.02 0.25 -3.79 118.16 117.94 1m1x n LYS 42 Ca 0.14 -1.65 -0.41 0.00 -2.02 0.00 0.00 58.31 54.37 1m1x n LYS 42 Cb 1.23 -1.13 -0.03 0.00 -0.02 0.00 0.00 35.03 35.09 1m1x n LYS 42 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1m1x s ALA 43 N -0.93 3.49 0.77 7.82 0.00 0.67 -4.55 121.76 129.03 1m1x s ALA 43 Ca 0.11 1.11 -0.11 0.00 0.00 0.00 0.00 51.96 53.07 1m1x s ALA 43 Cb 0.06 -3.45 0.05 0.00 0.00 0.00 0.00 23.12 19.78 1m1x s ALA 43 CO 0.07 -0.49 1.08 -0.80 0.00 0.00 0.00 175.76 175.62 1m1x s ASN 44 N -0.18 4.69 0.23 0.00 0.01 -1.26 -0.82 114.94 117.61 1m1x s ASN 44 Ca 0.52 1.56 -0.02 0.00 -0.71 0.00 0.00 52.86 54.20 1m1x s ASN 44 Cb -0.37 -2.33 -0.03 0.00 0.41 0.00 0.00 41.25 38.94 1m1x s ASN 44 CO 0.44 -1.88 0.23 0.42 -1.51 0.00 0.00 177.10 174.80 1m1x s THR 45 N -3.03 0.00 -0.39 1.60 -4.23 -1.26 -4.81 115.64 103.53 1m1x s THR 45 Ca 0.60 -1.88 0.09 0.00 -1.18 0.00 0.00 61.69 59.32 1m1x s THR 45 Cb -0.15 -2.46 0.62 0.00 1.34 0.00 0.00 72.50 71.85 1m1x s THR 45 CO 0.55 0.00 1.56 0.35 -0.54 0.00 0.00 174.62 176.55 1m1x n THR 46 N -0.36 2.37 -2.96 3.99 -2.24 -1.26 -4.82 114.28 109.00 1m1x n THR 46 Ca 0.02 -1.23 -0.40 0.00 -2.27 0.00 0.00 64.05 60.17 1m1x n THR 46 Cb 0.65 -0.40 -0.04 0.00 -2.10 0.00 0.00 70.33 68.43 1m1x n THR 46 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1m1x s GLN 47 N -2.47 4.48 -0.23 -0.78 -0.21 -1.26 -4.97 119.66 114.23 1m1x s GLN 47 Ca 0.44 1.05 -0.40 0.00 0.02 0.00 0.00 55.36 56.47 1m1x s GLN 47 Cb 0.35 -3.42 -0.16 0.00 1.00 0.00 0.00 33.01 30.78 1m1x s GLN 47 CO 0.12 0.13 1.70 -2.30 -2.12 0.00 0.00 175.29 172.81 1m1x n PRO 48 N 3.43 1.16 -1.57 2.91 -0.02 -1.26 -2.33 135.00 137.32 1m1x n PRO 48 Ca -0.00 0.43 -0.20 0.00 -2.02 0.00 0.00 63.50 61.71 1m1x n PRO 48 Cb 0.51 -2.10 -0.08 0.00 -0.02 0.00 0.00 33.50 31.80 1m1x n PRO 48 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1m1x n GLY 49 N 3.99 1.87 3.33 -1.23 0.00 -1.26 -4.30 105.19 107.60 1m1x n GLY 49 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 1m1x n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1m1x s ILE 50 N -2.66 4.50 -0.25 -0.61 -1.09 -0.98 -4.81 121.20 115.29 1m1x s ILE 50 Ca 0.00 -1.10 -0.20 0.00 -2.23 0.00 0.00 60.65 57.12 1m1x s ILE 50 Cb 0.00 -3.62 -0.02 0.00 -1.58 0.00 0.00 42.46 37.24 1m1x s ILE 50 CO 0.00 -0.38 0.62 -0.69 -1.23 0.00 0.00 174.94 173.26 1m1x s VAL 51 N 1.51 4.99 -1.03 2.92 1.01 -1.26 -4.11 120.40 124.44 1m1x s VAL 51 Ca 0.02 1.12 -0.13 0.00 0.00 0.00 0.00 61.98 62.99 1m1x s VAL 51 Cb -0.21 -3.93 -0.02 0.00 0.00 0.00 0.00 36.38 32.22 1m1x s VAL 51 CO 0.05 0.04 0.79 -0.62 0.00 0.00 0.00 175.10 175.35 1m1x n GLU 52 N 5.67 -1.47 0.11 2.72 1.02 -1.26 -0.86 120.64 126.57 1m1x n GLU 52 Ca -0.01 0.73 0.13 0.00 -0.02 0.00 0.00 57.16 57.99 1m1x n GLU 52 Cb 0.49 -4.55 0.37 0.00 -0.02 0.00 0.00 31.44 27.72 1m1x n GLU 52 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1m1x h GLY 53 N -1.22 0.00 -0.04 0.62 0.00 -1.72 -1.29 103.07 99.41 1m1x h GLY 53 Ca -0.55 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.78 1m1x h GLY 53 CO 0.43 0.00 -0.01 0.61 0.00 0.00 0.00 176.54 177.57 1m1x n GLY 54 N 1.30 -1.79 0.00 4.60 0.00 -0.00 -2.56 105.19 106.74 1m1x n GLY 54 Ca 0.05 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1m1x n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m1x n GLN 55 N -2.17 0.00 -3.82 1.61 10.64 -0.93 -4.79 117.38 117.93 1m1x n GLN 55 Ca -0.00 0.00 -0.12 0.00 -1.83 0.00 0.00 57.00 55.05 1m1x n GLN 55 Cb 0.01 0.00 -0.13 0.00 -0.86 0.00 0.00 30.24 29.26 1m1x n GLN 55 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 1m1x s VAL 56 N -2.97 -0.00 -0.03 -0.39 1.01 -1.26 -1.17 120.40 115.59 1m1x s VAL 56 Ca 0.00 0.01 0.06 0.00 0.00 0.00 0.00 61.98 62.04 1m1x s VAL 56 Cb 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 36.38 36.15 1m1x s VAL 56 CO 0.00 0.00 -0.20 -0.76 0.00 0.00 0.00 175.10 174.14 1m1x s LEU 57 N 0.12 2.01 -0.36 3.92 1.02 0.15 -2.09 118.68 123.46 1m1x s LEU 57 Ca -0.00 -0.38 -0.16 0.00 0.02 0.00 0.00 54.13 53.61 1m1x s LEU 57 Cb -0.01 -1.07 -0.01 0.00 0.02 0.00 0.00 46.19 45.12 1m1x s LEU 57 CO -0.00 0.23 0.38 -0.75 0.02 0.00 0.00 176.35 176.22 1m1x s LYS 58 N -0.33 3.48 0.02 1.70 2.20 -0.90 -0.80 119.74 125.10 1m1x s LYS 58 Ca 0.04 -0.47 -0.01 0.00 -0.36 0.00 0.00 55.97 55.16 1m1x s LYS 58 Cb -0.09 -3.83 -0.04 0.00 -1.51 0.00 0.00 37.83 32.35 1m1x s LYS 58 CO 0.00 -0.58 0.18 0.00 -0.36 0.00 0.00 175.35 174.59 1m1x s ASP 60 N -2.11 6.55 0.28 0.00 1.11 -0.78 -1.08 116.67 120.64 1m1x s ASP 60 Ca 0.29 0.65 0.23 0.00 0.18 0.00 0.00 52.55 53.90 1m1x s ASP 60 Cb -0.13 -2.24 0.26 0.00 1.07 0.00 0.00 42.92 41.88 1m1x s ASP 60 CO 0.21 0.01 1.38 -0.25 1.18 0.00 0.00 175.17 177.70 1m1x h TRP 61 N 6.86 0.00 0.00 4.23 7.01 -1.93 -3.23 115.95 128.89 1m1x h TRP 61 Ca -0.40 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.59 1m1x h TRP 61 Cb 1.17 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 28.23 1m1x h TRP 61 CO 0.63 0.00 0.15 -1.13 -2.79 0.00 0.00 178.44 175.29 1m1x n SER 62 N -2.72 0.70 -2.46 2.65 3.41 -1.26 -4.58 113.62 109.36 1m1x n SER 62 Ca 0.03 -1.36 -0.04 0.00 -0.26 0.00 0.00 58.87 57.24 1m1x n SER 62 Cb 0.51 -0.16 -0.00 0.00 -0.26 0.00 0.00 64.21 64.30 1m1x n SER 62 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1m1x n SER 63 N 2.32 -1.88 -0.09 4.04 7.64 -1.26 -4.72 113.62 119.67 1m1x n SER 63 Ca 0.02 0.40 -0.10 0.00 1.01 0.00 0.00 58.87 60.20 1m1x n SER 63 Cb 0.09 -1.71 -0.13 0.00 -1.01 0.00 0.00 64.21 61.45 1m1x n SER 63 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1m1x n THR 64 N -2.74 1.24 -2.44 0.44 -2.24 -1.26 -5.01 114.28 102.27 1m1x n THR 64 Ca -0.04 -0.71 -0.19 0.00 -2.27 0.00 0.00 64.05 60.83 1m1x n THR 64 Cb 0.53 -0.67 -0.01 0.00 -2.10 0.00 0.00 70.33 68.08 1m1x n THR 64 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1m1x n ARG 65 N -2.76 -1.95 -3.80 -0.78 1.74 -1.22 -4.99 116.66 102.90 1m1x n ARG 65 Ca -0.31 0.92 -0.35 0.00 -0.77 0.00 0.00 57.85 57.33 1m1x n ARG 65 Cb 1.05 -5.58 -0.08 0.00 -1.02 0.00 0.00 32.46 26.83 1m1x n ARG 65 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1m1x s ARG 66 N -5.08 4.05 -0.23 5.56 3.52 -1.26 -4.86 118.95 120.66 1m1x s ARG 66 Ca 0.02 -0.23 0.01 0.00 -0.13 0.00 0.00 55.73 55.39 1m1x s ARG 66 Cb -0.01 -3.35 0.05 0.00 -1.56 0.00 0.00 34.95 30.09 1m1x s ARG 66 CO 0.02 0.36 -0.08 0.00 -0.81 0.00 0.00 175.30 174.79 1m1x s GLN 68 N 1.35 2.69 0.00 0.00 -1.52 -1.11 -4.86 119.66 116.20 1m1x s GLN 68 Ca -0.05 -0.66 0.00 0.00 -1.95 0.00 0.00 55.36 52.70 1m1x s GLN 68 Cb -0.18 -2.60 0.00 0.00 -0.22 0.00 0.00 33.01 30.01 1m1x s GLN 68 CO -0.07 0.61 0.00 -2.30 -0.25 0.00 0.00 175.29 173.29 1m1x n PRO 69 N 1.44 2.37 -3.68 2.91 -0.02 -1.26 -2.12 135.00 134.64 1m1x n PRO 69 Ca -0.15 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.18 1m1x n PRO 69 Cb 0.53 0.00 -0.15 0.00 -0.02 0.00 0.00 33.50 33.86 1m1x n PRO 69 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1m1x s ILE 70 N -0.01 -0.24 -1.05 4.25 1.01 -0.89 -4.10 121.20 120.16 1m1x s ILE 70 Ca 0.00 0.30 -0.24 0.00 0.00 0.00 0.00 60.65 60.71 1m1x s ILE 70 Cb 0.00 -0.32 -0.11 0.00 0.01 0.00 0.00 42.46 42.04 1m1x s ILE 70 CO 0.00 0.13 2.03 -1.61 0.00 0.00 0.00 174.94 175.48 1m1x s GLU 71 N 2.07 2.14 -0.13 2.79 2.02 -1.26 -4.72 118.70 121.60 1m1x s GLU 71 Ca 0.00 -0.63 -0.26 0.00 0.02 0.00 0.00 54.97 54.10 1m1x s GLU 71 Cb -0.12 -5.10 -0.26 0.00 0.10 0.00 0.00 34.13 28.75 1m1x s GLU 71 CO -0.06 -4.21 0.72 0.74 0.02 0.00 0.00 175.26 172.46 1m1x h PHE 72 N 10.81 0.14 -1.78 1.61 -1.00 -1.98 -3.48 116.94 121.25 1m1x h PHE 72 Ca 0.12 -0.10 0.02 0.00 2.81 0.00 0.00 57.97 60.82 1m1x h PHE 72 Cb 0.97 -0.01 -0.24 0.00 3.61 0.00 0.00 35.95 40.29 1m1x h PHE 72 CO 1.17 1.16 0.29 0.34 -1.61 0.00 0.00 178.31 179.65 1m1x s ASP 73 N -6.50 -0.61 0.00 2.17 2.15 -1.26 -4.95 116.67 107.67 1m1x s ASP 73 Ca -0.19 1.14 0.00 0.00 0.43 0.00 0.00 52.55 53.93 1m1x s ASP 73 Cb -0.01 1.17 0.00 0.00 -0.30 0.00 0.00 42.92 43.78 1m1x s ASP 73 CO 0.71 -0.20 0.86 0.00 -0.17 0.00 0.00 175.17 176.38 1m1x n ALA 74 N 2.62 1.84 -1.94 3.66 0.00 -1.26 -4.98 120.51 120.46 1m1x n ALA 74 Ca -0.14 -0.86 -0.31 0.00 0.00 0.00 0.00 53.44 52.13 1m1x n ALA 74 Cb 0.56 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.99 1m1x n ALA 74 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1m1x s THR 75 N -0.75 4.66 0.00 0.00 -4.23 -1.26 -4.27 115.64 109.79 1m1x s THR 75 Ca 0.00 0.93 0.00 0.00 -1.18 0.00 0.00 61.69 61.44 1m1x s THR 75 Cb 0.00 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 70.05 1m1x s THR 75 CO 0.00 -0.84 0.00 0.61 -0.54 0.00 0.00 174.62 173.85 1m1x n GLY 76 N -2.00 0.90 3.66 3.99 0.00 -1.26 -4.65 105.19 105.83 1m1x n GLY 76 Ca 0.05 -1.61 -0.43 0.00 0.00 0.00 0.00 46.02 44.03 1m1x n GLY 76 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1m1x s ASN 77 N -1.00 7.07 0.75 1.61 0.02 -1.26 -4.97 114.94 117.16 1m1x s ASN 77 Ca 0.00 1.33 -0.13 0.00 -1.02 0.00 0.00 52.86 53.04 1m1x s ASN 77 Cb 0.00 -2.53 0.05 0.00 0.02 0.00 0.00 41.25 38.79 1m1x s ASN 77 CO 0.00 -0.66 1.15 -0.13 0.02 0.00 0.00 177.10 177.48 1m1x s ARG 78 N 3.17 2.13 0.28 -0.60 0.52 -1.26 -4.83 118.95 118.36 1m1x s ARG 78 Ca 0.43 1.52 0.07 0.00 -0.52 0.00 0.00 55.73 57.24 1m1x s ARG 78 Cb -0.15 -1.86 -0.03 0.00 0.52 0.00 0.00 34.95 33.43 1m1x s ARG 78 CO 0.06 -1.80 0.21 -0.51 0.02 0.00 0.00 175.30 173.29 1m1x s ASP 79 N -2.52 5.35 0.00 0.23 -0.00 -1.26 -0.03 116.67 118.44 1m1x s ASP 79 Ca 0.69 -0.38 0.00 0.00 -0.00 0.00 0.00 52.55 52.86 1m1x s ASP 79 Cb -0.24 -1.20 0.00 0.00 -0.00 0.00 0.00 42.92 41.48 1m1x s ASP 79 CO 0.48 -0.15 0.00 0.00 -0.00 0.00 0.00 175.17 175.50 1m1x n TYR 80 N -1.22 0.00 -3.10 4.23 9.36 -0.88 -4.55 117.16 120.99 1m1x n TYR 80 Ca -0.06 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.16 1m1x n TYR 80 Cb 0.59 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.30 1m1x n TYR 80 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1m1x n ALA 81 N -1.71 0.00 -1.00 2.98 0.00 -0.98 -5.05 120.51 114.75 1m1x n ALA 81 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1m1x n ALA 81 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.82 1m1x n ALA 81 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1m1x n LYS 82 N 0.00 0.00 -2.05 0.00 4.76 -1.26 -3.58 118.16 116.03 1m1x n LYS 82 Ca 0.00 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.04 1m1x n LYS 82 Cb 0.00 -0.44 0.04 0.00 -1.84 0.00 0.00 35.03 32.79 1m1x n LYS 82 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1m1x n ASP 83 N 0.00 7.41 -3.49 4.39 10.43 -1.26 -4.77 116.55 129.26 1m1x n ASP 83 Ca 0.00 -3.81 -0.29 0.00 2.57 0.00 0.00 54.79 53.26 1m1x n ASP 83 Cb 0.00 -1.06 -0.12 0.00 1.84 0.00 0.00 41.12 41.78 1m1x n ASP 83 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1m1x s ASP 84 N -1.21 2.74 0.72 -2.24 3.68 -1.23 -5.14 116.67 114.00 1m1x s ASP 84 Ca 0.50 -2.50 -0.16 0.00 2.13 0.00 0.00 52.55 52.52 1m1x s ASP 84 Cb 0.40 -0.53 0.03 0.00 -1.45 0.00 0.00 42.92 41.37 1m1x s ASP 84 CO -0.37 -0.26 1.19 -2.65 0.13 0.00 0.00 175.17 173.21 1m1x n PRO 85 N 3.63 0.64 -0.03 4.34 -0.02 -1.26 -2.08 135.00 140.22 1m1x n PRO 85 Ca 0.16 0.28 -0.04 0.00 -2.02 0.00 0.00 63.50 61.88 1m1x n PRO 85 Cb 0.39 -2.44 -0.13 0.00 -0.02 0.00 0.00 33.50 31.31 1m1x n PRO 85 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1m1x n LEU 86 N -2.39 0.49 -3.89 2.45 -0.00 0.96 -4.56 117.00 110.06 1m1x n LEU 86 Ca 0.14 0.22 -0.09 0.00 -0.00 0.00 0.00 56.01 56.28 1m1x n LEU 86 Cb 0.49 0.22 -0.05 0.00 -0.00 0.00 0.00 43.42 44.08 1m1x n LEU 86 CO 0.48 0.29 0.13 -1.83 -0.00 0.00 0.00 177.39 176.46 1m1x s GLU 87 N -2.78 1.31 -0.30 1.96 -1.05 -1.24 -1.94 118.70 114.67 1m1x s GLU 87 Ca -0.06 -1.08 -0.03 0.00 -0.15 0.00 0.00 54.97 53.65 1m1x s GLU 87 Cb 0.08 0.45 0.10 0.00 -0.44 0.00 0.00 34.13 34.32 1m1x s GLU 87 CO 0.83 -0.52 0.13 -0.06 0.95 0.00 0.00 175.26 176.59 1m1x s PHE 88 N -3.94 0.58 0.23 4.83 0.40 -0.68 -4.53 117.98 114.87 1m1x s PHE 88 Ca 0.15 -1.07 0.16 0.00 -0.60 0.00 0.00 56.93 55.58 1m1x s PHE 88 Cb 0.01 -1.05 0.63 0.00 0.51 0.00 0.00 43.02 43.12 1m1x s PHE 88 CO 0.01 -0.84 1.72 0.87 0.70 0.00 0.00 175.22 177.68 1m1x h LYS 89 N 8.29 0.00 -6.83 0.44 1.57 -1.93 -3.31 116.57 114.80 1m1x h LYS 89 Ca -0.18 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.05 1m1x h LYS 89 Cb 1.01 0.00 0.10 0.00 0.08 0.00 0.00 32.23 33.42 1m1x h LYS 89 CO 0.44 0.43 0.72 -1.13 -0.57 0.00 0.00 179.45 179.34 1m1x n SER 90 N -3.67 3.48 -3.57 0.86 3.41 -1.26 -2.56 113.62 110.31 1m1x n SER 90 Ca -0.01 1.20 -0.21 0.00 -0.26 0.00 0.00 58.87 59.59 1m1x n SER 90 Cb 0.52 -1.57 0.07 0.00 -0.26 0.00 0.00 64.21 62.97 1m1x n SER 90 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1m1x n HIS 91 N 0.92 -2.30 1.05 7.33 8.25 -0.04 -4.91 115.22 125.52 1m1x n HIS 91 Ca 0.05 0.93 0.11 0.00 -0.26 0.00 0.00 57.72 58.55 1m1x n HIS 91 Cb 0.37 -4.83 0.07 0.00 1.12 0.00 0.00 29.99 26.72 1m1x n HIS 91 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1m1x n GLN 92 N -4.41 0.57 -3.68 -0.41 10.64 -1.06 -4.73 117.38 114.29 1m1x n GLN 92 Ca -0.19 -0.43 -0.23 0.00 -1.83 0.00 0.00 57.00 54.32 1m1x n GLN 92 Cb 0.63 -1.49 0.05 0.00 -0.86 0.00 0.00 30.24 28.57 1m1x n GLN 92 CO 0.00 0.00 0.00 0.91 -1.83 0.00 0.00 177.06 176.14 1m1x n TRP 93 N -0.84 -2.14 -2.40 2.61 7.02 -1.25 -1.21 117.44 119.23 1m1x n TRP 93 Ca 0.08 0.89 -0.43 0.00 -1.02 0.00 0.00 57.50 57.02 1m1x n TRP 93 Cb 0.38 -4.51 -0.02 0.00 -2.42 0.00 0.00 31.31 24.74 1m1x n TRP 93 CO 0.00 0.00 0.00 0.12 -2.02 0.00 0.00 177.69 175.79 1m1x s PHE 94 N -3.51 2.87 0.00 -5.99 5.36 -1.06 -2.50 117.98 113.15 1m1x s PHE 94 Ca 0.19 1.00 0.00 0.00 -0.96 0.00 0.00 56.93 57.16 1m1x s PHE 94 Cb -0.09 -3.52 0.00 0.00 -0.34 0.00 0.00 43.02 39.07 1m1x s PHE 94 CO 0.79 -1.78 0.00 0.41 -1.46 0.00 0.00 175.22 173.19 1m1x n GLY 95 N 3.59 1.99 0.36 13.12 0.00 -0.46 -2.18 105.19 121.61 1m1x n GLY 95 Ca 0.13 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.33 1m1x n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m1x h ALA 96 N 0.00 1.76 -3.36 4.61 0.00 -1.60 -3.38 119.26 117.29 1m1x h ALA 96 Ca 0.00 -0.01 -0.39 0.00 0.00 0.00 0.00 54.91 54.52 1m1x h ALA 96 Cb 0.00 0.02 -0.37 0.00 0.00 0.00 0.00 17.79 17.44 1m1x h ALA 96 CO 0.00 -0.54 -0.75 -1.54 0.00 0.00 0.00 179.25 176.41 1m1x s SER 97 N -4.73 1.05 -0.07 0.00 1.04 -1.26 -4.71 113.70 105.02 1m1x s SER 97 Ca -0.04 -0.02 -0.03 0.00 0.48 0.00 0.00 55.95 56.35 1m1x s SER 97 Cb 0.12 -0.28 0.04 0.00 0.10 0.00 0.00 66.02 65.99 1m1x s SER 97 CO 0.39 -0.17 0.14 -0.69 0.98 0.00 0.00 173.24 173.89 1m1x s VAL 98 N 1.66 -0.13 0.09 5.02 1.01 -1.26 -2.46 120.40 124.34 1m1x s VAL 98 Ca -0.01 0.26 -0.03 0.00 0.00 0.00 0.00 61.98 62.20 1m1x s VAL 98 Cb -0.13 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.98 1m1x s VAL 98 CO -0.03 0.11 0.07 -0.60 0.00 0.00 0.00 175.10 174.64 1m1x s ARG 99 N 1.60 0.81 0.36 2.72 6.06 -0.69 -4.73 118.95 125.08 1m1x s ARG 99 Ca -0.04 -1.24 -0.14 0.00 -2.50 0.00 0.00 55.73 51.81 1m1x s ARG 99 Cb -0.12 0.26 0.04 0.00 0.06 0.00 0.00 34.95 35.19 1m1x s ARG 99 CO -0.05 -0.22 0.73 -1.54 -2.50 0.00 0.00 175.30 171.72 1m1x s SER 100 N -2.95 0.12 0.00 -2.12 1.04 -1.26 -0.69 113.70 107.83 1m1x s SER 100 Ca 0.13 -1.14 0.00 0.00 0.48 0.00 0.00 55.95 55.42 1m1x s SER 100 Cb 0.07 0.80 0.00 0.00 0.10 0.00 0.00 66.02 66.99 1m1x s SER 100 CO -0.05 -1.58 0.00 0.29 0.98 0.00 0.00 173.24 172.87 1m1x n LYS 101 N -0.53 0.00 -3.88 4.02 5.02 0.26 -4.94 118.16 118.11 1m1x n LYS 101 Ca -0.06 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.88 1m1x n LYS 101 Cb 0.60 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.48 1m1x n LYS 101 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1m1x s GLN 102 N 3.01 2.28 0.00 1.97 0.00 -1.26 -4.12 119.66 121.55 1m1x s GLN 102 Ca 0.00 -1.42 0.00 0.00 -0.00 0.00 0.00 55.36 53.94 1m1x s GLN 102 Cb 0.00 -3.28 0.00 0.00 0.00 0.00 0.00 33.01 29.73 1m1x s GLN 102 CO 0.00 -0.74 0.00 -0.25 0.00 0.00 0.00 175.29 174.30 1m1x n ASP 103 N 4.60 0.00 -4.57 12.60 8.00 -1.26 -4.74 116.55 131.18 1m1x n ASP 103 Ca -0.10 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 54.99 1m1x n ASP 103 Cb 0.43 -0.05 -0.08 0.00 -0.02 0.00 0.00 41.12 41.40 1m1x n ASP 103 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1m1x s LYS 104 N 0.00 3.69 -0.08 -1.24 1.02 -1.26 -4.11 119.74 117.76 1m1x s LYS 104 Ca 0.00 -0.10 0.01 0.00 0.02 0.00 0.00 55.97 55.90 1m1x s LYS 104 Cb 0.00 -3.78 0.02 0.00 -0.52 0.00 0.00 37.83 33.54 1m1x s LYS 104 CO 0.00 -0.59 -0.10 0.96 -0.92 0.00 0.00 175.35 174.70 1m1x s ILE 105 N 2.37 1.05 -0.22 2.17 -4.36 -0.97 0.89 121.20 122.13 1m1x s ILE 105 Ca 0.19 -0.38 -0.08 0.00 -0.26 0.00 0.00 60.65 60.12 1m1x s ILE 105 Cb -0.15 -1.01 -0.04 0.00 1.25 0.00 0.00 42.46 42.51 1m1x s ILE 105 CO 0.13 0.35 0.08 -0.22 0.24 0.00 0.00 174.94 175.52 1m1x s LEU 106 N 1.10 3.71 -0.04 0.37 2.96 0.13 -1.75 118.68 125.18 1m1x s LEU 106 Ca -0.06 -0.03 0.01 0.00 -0.22 0.00 0.00 54.13 53.82 1m1x s LEU 106 Cb -0.14 -1.97 0.02 0.00 0.50 0.00 0.00 46.19 44.60 1m1x s LEU 106 CO -0.01 0.07 -0.03 0.00 -1.32 0.00 0.00 176.35 175.05 1m1x s ALA 107 N 1.01 0.58 0.37 5.97 0.00 -0.55 -1.70 121.76 127.44 1m1x s ALA 107 Ca 0.05 0.00 0.08 0.00 0.00 0.00 0.00 51.96 52.09 1m1x s ALA 107 Cb -0.14 -0.38 -0.06 0.00 0.00 0.00 0.00 23.12 22.54 1m1x s ALA 107 CO 0.03 -0.01 0.04 0.00 0.00 0.00 0.00 175.76 175.82 1m1x n ALA 109 N -1.00 3.47 0.00 0.00 0.00 0.20 -1.35 120.51 121.82 1m1x n ALA 109 Ca -0.04 -4.27 0.00 0.00 0.00 0.00 0.00 53.44 49.13 1m1x n ALA 109 Cb 0.64 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 19.20 1m1x n ALA 109 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1m1x n PRO 110 N 1.38 0.00 -0.49 0.00 -0.04 -1.22 -1.00 135.00 133.63 1m1x n PRO 110 Ca 0.26 0.06 0.05 0.00 -0.04 0.00 0.00 63.50 63.83 1m1x n PRO 110 Cb 0.43 -1.51 0.19 0.00 -0.04 0.00 0.00 33.50 32.57 1m1x n PRO 110 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1m1x n LEU 111 N -0.99 2.93 -4.63 1.53 7.99 -0.35 -4.60 117.00 118.87 1m1x n LEU 111 Ca 0.00 -3.62 -0.43 0.00 -0.01 0.00 0.00 56.01 51.95 1m1x n LEU 111 Cb 0.01 -0.52 -0.02 0.00 -0.11 0.00 0.00 43.42 42.78 1m1x n LEU 111 CO 0.00 1.16 0.95 -0.47 -1.51 0.00 0.00 177.39 177.51 1m1x s TYR 112 N -3.12 3.10 0.06 -1.77 5.04 -0.17 -4.15 117.35 116.35 1m1x s TYR 112 Ca 0.38 1.10 -0.09 0.00 -2.44 0.00 0.00 57.07 56.02 1m1x s TYR 112 Cb 0.35 -3.77 -0.06 0.00 0.35 0.00 0.00 41.96 38.83 1m1x s TYR 112 CO -0.02 -0.83 0.37 -1.01 -1.34 0.00 0.00 175.55 172.72 1m1x s HIS 113 N 3.73 3.58 -0.08 4.97 3.76 -1.25 -1.60 115.29 128.40 1m1x s HIS 113 Ca 0.45 0.74 -0.02 0.00 -0.15 0.00 0.00 55.06 56.08 1m1x s HIS 113 Cb -0.12 -2.12 0.04 0.00 1.11 0.00 0.00 32.58 31.49 1m1x s HIS 113 CO 0.18 0.54 0.05 -0.46 -0.85 0.00 0.00 174.74 174.19 1m1x s TRP 114 N -1.38 0.31 -0.26 1.40 -0.00 0.15 -1.68 118.94 117.49 1m1x s TRP 114 Ca 0.32 -0.04 -0.29 0.00 -0.00 0.00 0.00 56.10 56.09 1m1x s TRP 114 Cb -0.14 -0.64 -0.02 0.00 -0.00 0.00 0.00 33.47 32.67 1m1x s TRP 114 CO 0.18 -0.32 1.64 0.50 -0.00 0.00 0.00 176.95 178.95 1m1x s ARG 115 N 2.09 3.68 0.69 5.86 3.52 -0.82 -2.66 118.95 131.31 1m1x s ARG 115 Ca 0.04 1.55 -0.17 0.00 -0.13 0.00 0.00 55.73 57.02 1m1x s ARG 115 Cb -0.13 -4.07 -0.01 0.00 -1.56 0.00 0.00 34.95 29.18 1m1x s ARG 115 CO -0.05 -1.44 1.04 0.25 -0.81 0.00 0.00 175.30 174.29 1m1x n THR 116 N 6.68 3.43 1.14 4.11 -2.24 -1.25 -4.81 114.28 121.35 1m1x n THR 116 Ca 0.19 -0.42 0.11 0.00 -2.27 0.00 0.00 64.05 61.67 1m1x n THR 116 Cb 0.46 -1.19 0.59 0.00 -2.10 0.00 0.00 70.33 68.09 1m1x n THR 116 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1m1x n GLU 117 N -1.74 0.42 -0.03 -0.78 1.02 -1.26 -3.80 120.64 114.46 1m1x n GLU 117 Ca 0.14 0.06 -0.02 0.00 -0.02 0.00 0.00 57.16 57.32 1m1x n GLU 117 Cb 0.49 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.40 1m1x n GLU 117 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1m1x n MET 118 N -1.21 0.20 -4.17 3.49 2.81 -1.26 -5.02 117.12 111.96 1m1x n MET 118 Ca 0.12 0.37 -0.24 0.00 -1.81 0.00 0.00 57.70 56.14 1m1x n MET 118 Cb 0.15 -1.16 -0.07 0.00 -0.71 0.00 0.00 33.22 31.43 1m1x n MET 118 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 1m1x s LYS 119 N -1.56 2.23 -0.50 0.03 2.47 -1.25 -5.06 119.74 116.10 1m1x s LYS 119 Ca -0.07 -1.73 -0.28 0.00 -1.56 0.00 0.00 55.97 52.33 1m1x s LYS 119 Cb 0.01 -2.03 0.01 0.00 -1.46 0.00 0.00 37.83 34.36 1m1x s LYS 119 CO 0.10 0.02 1.41 -1.14 0.16 0.00 0.00 175.35 175.90 1m1x s GLN 120 N -3.84 3.41 0.36 4.03 2.00 -1.26 -3.80 119.66 120.55 1m1x s GLN 120 Ca 0.38 0.64 0.05 0.00 -2.00 0.00 0.00 55.36 54.43 1m1x s GLN 120 Cb 0.01 -4.08 -0.02 0.00 0.80 0.00 0.00 33.01 29.72 1m1x s GLN 120 CO 0.22 -1.79 0.17 -1.91 -0.50 0.00 0.00 175.29 171.48 1m1x n GLU 121 N 8.42 0.54 -2.90 1.67 4.07 -1.26 -4.96 120.64 126.21 1m1x n GLU 121 Ca 0.14 -3.18 -0.13 0.00 -0.06 0.00 0.00 57.16 53.93 1m1x n GLU 121 Cb 0.49 1.96 0.01 0.00 -0.06 0.00 0.00 31.44 33.84 1m1x n GLU 121 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1m1x n ARG 122 N -0.78 0.80 -3.48 5.31 1.74 -1.26 -3.66 116.66 115.32 1m1x n ARG 122 Ca -0.02 -2.29 -0.37 0.00 -0.77 0.00 0.00 57.85 54.40 1m1x n ARG 122 Cb 0.57 -1.36 -0.07 0.00 -1.02 0.00 0.00 32.46 30.57 1m1x n ARG 122 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1m1x s GLU 123 N -0.08 4.21 -1.14 5.56 2.02 -1.09 -4.71 118.70 123.47 1m1x s GLU 123 Ca 0.32 0.11 -0.21 0.00 0.02 0.00 0.00 54.97 55.21 1m1x s GLU 123 Cb 0.23 -3.48 0.01 0.00 0.10 0.00 0.00 34.13 30.99 1m1x s GLU 123 CO -0.18 0.11 1.73 -1.25 0.02 0.00 0.00 175.26 175.69 1m1x s PRO 124 N 0.87 3.34 -0.11 0.39 0.04 -1.19 0.33 135.00 138.66 1m1x s PRO 124 Ca 0.17 -1.32 0.10 0.00 0.04 0.00 0.00 61.00 59.99 1m1x s PRO 124 Cb -0.14 -5.35 -0.24 0.00 0.04 0.00 0.00 34.50 28.81 1m1x s PRO 124 CO 0.06 -2.79 0.42 1.55 0.04 0.00 0.00 177.00 176.28 1m1x n VAL 125 N 7.06 1.58 -0.55 -0.36 3.14 -0.73 -1.87 118.33 126.60 1m1x n VAL 125 Ca 0.42 -0.78 0.00 0.00 -2.96 0.00 0.00 64.34 61.03 1m1x n VAL 125 Cb 0.48 -1.02 0.00 0.00 -1.06 0.00 0.00 33.84 32.23 1m1x n VAL 125 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1m1x n GLY 126 N 1.71 -3.48 3.22 7.55 0.00 -0.63 -1.90 105.19 111.67 1m1x n GLY 126 Ca -0.25 -1.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.61 1m1x n GLY 126 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m1x s THR 127 N -3.00 0.63 0.34 2.61 -4.23 -1.24 -4.56 115.64 106.19 1m1x s THR 127 Ca 0.00 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 58.55 1m1x s THR 127 Cb 0.00 -2.01 -0.00 0.00 1.34 0.00 0.00 72.50 71.83 1m1x s THR 127 CO 0.00 -0.57 0.01 0.00 -0.54 0.00 0.00 174.62 173.53 1m1x s PHE 129 N -2.30 -0.93 -0.39 0.00 2.99 0.67 -2.42 117.98 115.60 1m1x s PHE 129 Ca 0.02 1.45 -0.08 0.00 0.00 0.00 0.00 56.93 58.32 1m1x s PHE 129 Cb 0.00 0.31 0.07 0.00 0.00 0.00 0.00 43.02 43.39 1m1x s PHE 129 CO 0.01 -0.60 0.20 -1.17 -0.00 0.00 0.00 175.22 173.67 1m1x s LEU 130 N 2.65 4.87 0.26 -0.37 2.96 -0.02 -1.48 118.68 127.56 1m1x s LEU 130 Ca 0.04 -1.40 0.00 0.00 -0.22 0.00 0.00 54.13 52.54 1m1x s LEU 130 Cb -0.13 -1.94 -0.04 0.00 0.50 0.00 0.00 46.19 44.58 1m1x s LEU 130 CO -0.15 -0.46 0.45 -1.58 -1.32 0.00 0.00 176.35 173.29 1m1x s GLN 131 N 1.40 3.51 -0.50 1.98 0.74 -0.72 -1.89 119.66 124.18 1m1x s GLN 131 Ca 0.02 -0.36 0.07 0.00 0.05 0.00 0.00 55.36 55.14 1m1x s GLN 131 Cb -0.22 -2.77 0.19 0.00 1.10 0.00 0.00 33.01 31.31 1m1x s GLN 131 CO 0.02 0.30 0.70 0.34 -0.55 0.00 0.00 175.29 176.10 1m1x s ASP 132 N -3.56 -1.27 0.08 6.67 -1.08 -0.42 -2.28 116.67 114.82 1m1x s ASP 132 Ca 0.39 -1.75 0.00 0.00 -0.52 0.00 0.00 52.55 50.67 1m1x s ASP 132 Cb -0.10 1.76 0.00 0.00 -1.46 0.00 0.00 42.92 43.11 1m1x s ASP 132 CO 0.31 -0.07 0.00 0.61 0.52 0.00 0.00 175.17 176.55 1m1x n GLY 133 N 3.06 1.19 0.14 2.66 0.00 -1.26 -2.72 105.19 108.26 1m1x n GLY 133 Ca 0.18 0.33 -0.28 0.00 0.00 0.00 0.00 46.02 46.25 1m1x n GLY 133 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1m1x n THR 134 N 0.00 1.53 -1.88 2.61 -2.24 -1.26 -4.94 114.28 108.10 1m1x n THR 134 Ca 0.00 -0.34 -0.43 0.00 -2.27 0.00 0.00 64.05 61.01 1m1x n THR 134 Cb 0.00 -1.92 -0.03 0.00 -2.10 0.00 0.00 70.33 66.28 1m1x n THR 134 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1m1x s LYS 135 N -2.54 3.79 -0.11 -0.78 -0.14 -1.10 -4.99 119.74 113.86 1m1x s LYS 135 Ca -0.38 2.05 0.02 0.00 -1.36 0.00 0.00 55.97 56.30 1m1x s LYS 135 Cb 0.14 -4.13 0.01 0.00 -1.68 0.00 0.00 37.83 32.17 1m1x s LYS 135 CO 0.49 -1.32 -0.18 0.99 -0.76 0.00 0.00 175.35 174.57 1m1x s THR 136 N 5.51 1.69 -0.01 2.17 2.01 -1.26 -1.30 115.64 124.45 1m1x s THR 136 Ca 0.82 -0.77 0.04 0.00 0.31 0.00 0.00 61.69 62.10 1m1x s THR 136 Cb -0.32 -1.52 -0.01 0.00 0.01 0.00 0.00 72.50 70.66 1m1x s THR 136 CO 0.34 0.48 -0.14 0.68 -0.69 0.00 0.00 174.62 175.28 1m1x s VAL 137 N 0.85 1.15 0.06 3.82 -7.23 -0.79 -4.99 120.40 113.26 1m1x s VAL 137 Ca -0.09 -0.62 -0.30 0.00 -1.81 0.00 0.00 61.98 59.17 1m1x s VAL 137 Cb -0.15 -0.96 -0.05 0.00 0.56 0.00 0.00 36.38 35.78 1m1x s VAL 137 CO -0.00 0.33 0.96 -0.70 -0.31 0.00 0.00 175.10 175.37 1m1x s GLU 138 N -0.31 4.63 -0.29 4.82 2.12 -1.26 -0.84 118.70 127.57 1m1x s GLU 138 Ca 0.05 1.41 0.03 0.00 0.36 0.00 0.00 54.97 56.82 1m1x s GLU 138 Cb -0.06 -3.41 0.08 0.00 0.26 0.00 0.00 34.13 31.00 1m1x s GLU 138 CO -0.00 0.12 -0.03 -0.47 -0.54 0.00 0.00 175.26 174.33 1m1x s TYR 139 N 0.39 3.33 -0.54 5.30 5.04 -1.02 -4.93 117.35 124.91 1m1x s TYR 139 Ca 0.48 -2.52 0.06 0.00 -2.44 0.00 0.00 57.07 52.65 1m1x s TYR 139 Cb -0.22 -2.29 0.24 0.00 0.35 0.00 0.00 41.96 40.03 1m1x s TYR 139 CO 0.29 -0.90 0.61 0.00 -1.34 0.00 0.00 175.55 174.21 1m1x n ALA 140 N 4.40 3.34 0.34 3.97 0.00 -1.26 -0.85 120.51 130.45 1m1x n ALA 140 Ca -0.06 -4.14 0.19 0.00 0.00 0.00 0.00 53.44 49.42 1m1x n ALA 140 Cb 0.42 -0.87 1.00 0.00 0.00 0.00 0.00 19.45 20.00 1m1x n ALA 140 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1m1x h PRO 141 N 4.35 0.00 -0.01 0.00 0.13 -1.90 -0.62 132.00 133.95 1m1x h PRO 141 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1m1x h PRO 141 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1m1x h PRO 141 CO 0.66 0.00 -0.49 0.00 -0.23 0.00 0.00 178.00 177.94 1m1x n ARG 143 N -0.60 3.68 -3.08 0.00 0.63 -0.24 -4.80 116.66 112.25 1m1x n ARG 143 Ca 0.09 -3.19 -0.20 0.00 -0.92 0.00 0.00 57.85 53.63 1m1x n ARG 143 Cb 0.40 -2.92 0.07 0.00 0.45 0.00 0.00 32.46 30.45 1m1x n ARG 143 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 1m1x s SER 144 N 1.35 4.99 0.30 6.15 0.01 -1.26 -3.90 113.70 121.35 1m1x s SER 144 Ca 0.47 -0.94 0.13 0.00 1.31 0.00 0.00 55.95 56.92 1m1x s SER 144 Cb 0.13 0.46 0.43 0.00 0.21 0.00 0.00 66.02 67.26 1m1x s SER 144 CO -0.04 -1.43 1.64 -0.61 0.41 0.00 0.00 173.24 173.21 1m1x h GLN 145 N 0.13 0.00 -6.36 12.44 5.75 -1.92 -3.41 115.11 121.73 1m1x h GLN 145 Ca -0.28 0.00 -0.57 0.00 -0.15 0.00 0.00 58.65 57.65 1m1x h GLN 145 Cb 1.29 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.79 1m1x h GLN 145 CO 0.41 0.55 0.96 0.34 -2.65 0.00 0.00 178.83 178.44 1m1x s ASP 146 N -6.72 6.70 0.00 -0.69 2.15 -1.26 -4.99 116.67 111.86 1m1x s ASP 146 Ca -0.01 1.16 0.00 0.00 0.43 0.00 0.00 52.55 54.13 1m1x s ASP 146 Cb 0.12 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 1m1x s ASP 146 CO 0.74 -1.07 0.00 2.30 -0.17 0.00 0.00 175.17 176.98 1m1x n ILE 147 N 6.20 0.00 -1.12 4.11 -6.64 -1.26 -3.71 119.36 116.94 1m1x n ILE 147 Ca 0.14 0.00 0.15 0.00 -1.77 0.00 0.00 62.75 61.27 1m1x n ILE 147 Cb 0.47 0.00 -0.05 0.00 -1.44 0.00 0.00 39.64 38.62 1m1x n ILE 147 CO 0.00 0.00 0.00 0.47 -1.77 0.00 0.00 176.55 175.25 1m1x n ASP 148 N -0.45 -6.68 -0.22 7.28 10.43 -1.26 -2.74 116.55 122.91 1m1x n ASP 148 Ca 0.00 0.61 0.00 0.00 2.57 0.00 0.00 54.79 57.98 1m1x n ASP 148 Cb 0.00 -3.49 0.12 0.00 1.84 0.00 0.00 41.12 39.59 1m1x n ASP 148 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1m1x h ALA 149 N -1.05 0.86 -0.06 2.24 0.00 -1.91 0.39 119.26 119.73 1m1x h ALA 149 Ca -0.02 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1m1x h ALA 149 Cb 1.03 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1m1x h ALA 149 CO 0.02 -0.14 0.22 0.38 0.00 0.00 0.00 179.25 179.74 1m1x h ASP 150 N 0.48 0.00 0.00 0.00 3.04 -1.76 -3.30 116.42 114.88 1m1x h ASP 150 Ca 0.32 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.11 1m1x h ASP 150 Cb 0.37 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.66 1m1x h ASP 150 CO -0.29 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.52 1m1x n GLY 151 N -1.24 0.81 0.07 7.15 0.00 -0.61 -4.35 105.19 107.03 1m1x n GLY 151 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.05 1m1x n GLY 151 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1m1x n GLN 152 N 0.00 1.76 -0.23 1.61 6.02 -1.20 0.27 117.38 125.61 1m1x n GLN 152 Ca 0.00 -1.82 0.16 0.00 -0.01 0.00 0.00 57.00 55.33 1m1x n GLN 152 Cb 0.00 -1.12 0.46 0.00 1.02 0.00 0.00 30.24 30.60 1m1x n GLN 152 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1m1x h GLY 153 N 0.00 0.95 -2.00 1.08 0.00 -1.17 -2.14 103.07 99.79 1m1x h GLY 153 Ca 0.00 -0.22 -0.19 0.00 0.00 0.00 0.00 47.33 46.91 1m1x h GLY 153 CO 0.00 0.04 -0.41 0.69 0.00 0.00 0.00 176.54 176.86 1m1x n PHE 154 N -4.53 1.02 -0.36 5.60 3.01 -1.26 -3.19 117.46 117.76 1m1x n PHE 154 Ca 0.18 -1.74 -0.01 0.00 1.01 0.00 0.00 57.45 56.88 1m1x n PHE 154 Cb 0.58 -0.38 0.13 0.00 -0.01 0.00 0.00 39.48 39.80 1m1x n PHE 154 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1m1x n GLN 156 N -4.46 -4.22 -1.77 0.00 6.02 -0.78 -2.29 117.38 109.87 1m1x n GLN 156 Ca 0.12 0.48 -0.41 0.00 -0.01 0.00 0.00 57.00 57.18 1m1x n GLN 156 Cb 0.08 -5.29 -0.02 0.00 1.02 0.00 0.00 30.24 26.03 1m1x n GLN 156 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1m1x s GLY 157 N -3.21 2.11 0.00 1.08 0.00 -0.80 -2.67 107.32 103.83 1m1x s GLY 157 Ca 0.67 1.58 0.00 0.00 0.00 0.00 0.00 44.72 46.98 1m1x s GLY 157 CO 0.83 2.56 0.00 0.61 0.00 0.00 0.00 173.10 177.10 1m1x n GLY 158 N 2.15 0.96 0.35 0.20 0.00 -0.88 -4.12 105.19 103.85 1m1x n GLY 158 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.09 1m1x n GLY 158 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1m1x h PHE 159 N 0.00 1.15 -3.12 1.61 3.57 -1.21 -3.41 116.94 115.53 1m1x h PHE 159 Ca 0.00 0.03 -0.22 0.00 3.53 0.00 0.00 57.97 61.31 1m1x h PHE 159 Cb 0.00 -0.38 -0.31 0.00 2.79 0.00 0.00 35.95 38.05 1m1x h PHE 159 CO 0.00 0.67 -0.55 -1.54 -2.23 0.00 0.00 178.31 174.66 1m1x s SER 160 N -5.96 -0.10 0.31 0.41 1.04 -1.24 -4.75 113.70 103.41 1m1x s SER 160 Ca -0.13 0.42 0.05 0.00 0.48 0.00 0.00 55.95 56.77 1m1x s SER 160 Cb 0.18 0.32 -0.06 0.00 0.10 0.00 0.00 66.02 66.56 1m1x s SER 160 CO 0.81 -0.17 0.01 0.27 0.98 0.00 0.00 173.24 175.14 1m1x s ILE 161 N 1.35 1.40 -0.29 -1.02 -4.36 -1.26 -1.35 121.20 115.67 1m1x s ILE 161 Ca -0.08 -2.04 -0.28 0.00 -0.26 0.00 0.00 60.65 58.00 1m1x s ILE 161 Cb -0.11 -2.69 0.20 0.00 1.25 0.00 0.00 42.46 41.11 1m1x s ILE 161 CO -0.07 -0.11 1.41 -0.62 0.24 0.00 0.00 174.94 175.79 1m1x s ASP 162 N -3.49 -0.03 0.12 4.36 3.68 -0.90 -4.91 116.67 115.51 1m1x s ASP 162 Ca 0.34 0.04 0.02 0.00 2.13 0.00 0.00 52.55 55.08 1m1x s ASP 162 Cb 0.07 0.03 -0.04 0.00 -1.45 0.00 0.00 42.92 41.54 1m1x s ASP 162 CO 0.14 -0.02 0.22 -0.36 0.13 0.00 0.00 175.17 175.28 1m1x s PHE 163 N -0.62 3.41 0.35 -5.34 0.40 -1.26 -0.13 117.98 114.79 1m1x s PHE 163 Ca 0.09 0.13 0.07 0.00 -0.60 0.00 0.00 56.93 56.62 1m1x s PHE 163 Cb -0.03 -1.66 -0.01 0.00 0.51 0.00 0.00 43.02 41.83 1m1x s PHE 163 CO -0.11 0.54 0.44 0.95 0.70 0.00 0.00 175.22 177.73 1m1x s THR 164 N -1.64 3.71 0.43 0.64 -4.23 -0.18 -4.91 115.64 109.46 1m1x s THR 164 Ca 0.34 -1.10 0.17 0.00 -1.18 0.00 0.00 61.69 59.91 1m1x s THR 164 Cb -0.12 -3.27 0.20 0.00 1.34 0.00 0.00 72.50 70.65 1m1x s THR 164 CO 0.27 -0.13 1.99 0.07 -0.54 0.00 0.00 174.62 176.28 1m1x h LYS 165 N 0.95 0.00 -1.00 3.99 2.10 -1.97 -1.60 116.57 119.03 1m1x h LYS 165 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 1m1x h LYS 165 Cb 1.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 1m1x h LYS 165 CO 0.53 0.19 0.00 0.00 -2.00 0.00 0.00 179.45 178.17 1m1x n ALA 166 N -2.45 2.49 -3.25 0.07 0.00 -1.26 -4.88 120.51 111.23 1m1x n ALA 166 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.16 1m1x n ALA 166 Cb 0.26 -1.00 0.03 0.00 0.00 0.00 0.00 19.45 18.74 1m1x n ALA 166 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1m1x n ASP 167 N 0.15 -6.52 -3.69 0.00 2.03 -0.60 -4.95 116.55 102.98 1m1x n ASP 167 Ca 0.00 0.09 -0.10 0.00 0.52 0.00 0.00 54.79 55.30 1m1x n ASP 167 Cb 0.32 -3.24 -0.10 0.00 -0.72 0.00 0.00 41.12 37.38 1m1x n ASP 167 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 1m1x s ARG 168 N -2.63 0.41 0.06 -0.67 3.52 -1.25 -3.50 118.95 114.89 1m1x s ARG 168 Ca 0.31 0.84 -0.19 0.00 -0.13 0.00 0.00 55.73 56.56 1m1x s ARG 168 Cb -0.05 0.01 -0.06 0.00 -1.56 0.00 0.00 34.95 33.29 1m1x s ARG 168 CO 0.83 -0.16 0.54 0.14 -0.81 0.00 0.00 175.30 175.84 1m1x s VAL 169 N 1.49 4.80 -0.13 7.11 -7.23 0.17 -1.01 120.40 125.60 1m1x s VAL 169 Ca -0.09 1.16 -0.02 0.00 -1.81 0.00 0.00 61.98 61.21 1m1x s VAL 169 Cb -0.08 -3.87 -0.02 0.00 0.56 0.00 0.00 36.38 32.96 1m1x s VAL 169 CO -0.13 0.55 -0.07 -0.22 -0.31 0.00 0.00 175.10 174.92 1m1x s LEU 170 N -1.04 3.08 0.19 1.32 0.20 0.81 -1.10 118.68 122.14 1m1x s LEU 170 Ca 0.28 -0.17 0.08 0.00 0.69 0.00 0.00 54.13 55.01 1m1x s LEU 170 Cb -0.19 -1.72 -0.04 0.00 -0.43 0.00 0.00 46.19 43.81 1m1x s LEU 170 CO 0.18 0.20 -0.15 -0.22 -0.29 0.00 0.00 176.35 176.06 1m1x s LEU 171 N 0.19 2.52 -0.11 -0.68 0.20 -0.60 -2.12 118.68 118.07 1m1x s LEU 171 Ca -0.04 -0.97 -0.01 0.00 0.69 0.00 0.00 54.13 53.81 1m1x s LEU 171 Cb -0.14 -0.70 0.03 0.00 -0.43 0.00 0.00 46.19 44.95 1m1x s LEU 171 CO 0.04 -0.14 -0.05 -0.83 -0.29 0.00 0.00 176.35 175.08 1m1x s GLY 172 N -3.09 0.75 -0.31 7.98 0.00 -0.45 -2.45 107.32 109.74 1m1x s GLY 172 Ca 0.20 -0.48 0.03 0.00 0.00 0.00 0.00 44.72 44.47 1m1x s GLY 172 CO 0.06 0.95 0.01 -0.32 0.00 0.00 0.00 173.10 173.80 1m1x s GLY 173 N 1.78 1.73 0.11 0.20 0.00 -0.90 -2.06 107.32 108.17 1m1x s GLY 173 Ca 0.04 -2.17 -0.19 0.00 0.00 0.00 0.00 44.72 42.40 1m1x s GLY 173 CO -0.07 0.94 1.67 -2.55 0.00 0.00 0.00 173.10 173.09 1m1x h PRO 174 N 7.73 0.35 -0.04 2.90 0.11 -1.49 -1.29 132.00 140.26 1m1x h PRO 174 Ca -0.09 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.96 1m1x h PRO 174 Cb 1.03 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1m1x h PRO 174 CO 0.49 0.36 0.00 0.41 -0.21 0.00 0.00 178.00 179.05 1m1x n GLY 175 N -0.82 -0.72 3.75 -0.55 0.00 -1.13 -1.37 105.19 104.36 1m1x n GLY 175 Ca -0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 1m1x n GLY 175 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1m1x s SER 176 N -1.13 6.74 1.09 1.61 0.01 -1.22 -3.53 113.70 117.27 1m1x s SER 176 Ca 0.00 2.63 0.00 0.00 1.31 0.00 0.00 55.95 59.89 1m1x s SER 176 Cb 0.00 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.60 1m1x s SER 176 CO 0.00 -0.61 0.00 0.49 0.41 0.00 0.00 173.24 173.53 1m1x n PHE 177 N 1.79 0.00 -3.10 2.43 0.99 0.77 -2.40 117.46 117.94 1m1x n PHE 177 Ca 0.04 0.00 -0.44 0.00 -0.00 0.00 0.00 57.45 57.05 1m1x n PHE 177 Cb 0.41 0.02 0.00 0.00 -1.00 0.00 0.00 39.48 38.91 1m1x n PHE 177 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 1m1x n TYR 178 N 13.34 4.30 -1.91 1.38 4.01 -1.26 -4.31 117.16 132.72 1m1x n TYR 178 Ca 0.00 -3.40 -0.04 0.00 -0.16 0.00 0.00 57.90 54.31 1m1x n TYR 178 Cb 0.00 -1.71 -0.01 0.00 -0.31 0.00 0.00 39.34 37.31 1m1x n TYR 178 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 1m1x n TRP 179 N 3.00 -1.41 0.01 -0.72 7.02 -1.18 -0.69 117.44 123.46 1m1x n TRP 179 Ca 0.28 0.00 -0.18 0.00 -1.02 0.00 0.00 57.50 56.59 1m1x n TRP 179 Cb 0.38 -1.49 -0.12 0.00 -2.42 0.00 0.00 31.31 27.67 1m1x n TRP 179 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 1m1x h GLN 180 N 0.00 0.37 0.00 -0.99 4.20 -1.58 -1.21 115.11 115.90 1m1x h GLN 180 Ca -0.08 -0.43 0.00 0.00 0.06 0.00 0.00 58.65 58.20 1m1x h GLN 180 Cb 0.72 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.63 1m1x h GLN 180 CO 0.11 1.11 0.00 0.41 -0.67 0.00 0.00 178.83 179.78 1m1x n GLY 181 N 1.16 0.31 3.63 3.46 0.00 -0.47 0.43 105.19 113.71 1m1x n GLY 181 Ca -0.11 -2.31 -0.04 0.00 0.00 0.00 0.00 46.02 43.57 1m1x n GLY 181 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1m1x s GLN 182 N -0.44 0.19 0.01 1.61 0.74 -0.49 -4.57 119.66 116.71 1m1x s GLN 182 Ca 0.00 0.04 0.08 0.00 0.05 0.00 0.00 55.36 55.53 1m1x s GLN 182 Cb 0.00 0.09 -0.02 0.00 1.10 0.00 0.00 33.01 34.17 1m1x s GLN 182 CO 0.00 -0.06 -0.25 -0.51 -0.55 0.00 0.00 175.29 173.92 1m1x s LEU 183 N -1.11 2.18 -0.21 3.68 1.43 -1.26 -2.12 118.68 121.26 1m1x s LEU 183 Ca 0.07 -0.50 -0.04 0.00 -1.03 0.00 0.00 54.13 52.63 1m1x s LEU 183 Cb -0.01 -1.34 0.09 0.00 0.03 0.00 0.00 46.19 44.95 1m1x s LEU 183 CO -0.06 0.29 0.17 -0.63 0.23 0.00 0.00 176.35 176.36 1m1x s ILE 184 N -0.72 -0.21 -0.21 -0.59 1.01 -1.02 -2.51 121.20 116.94 1m1x s ILE 184 Ca 0.11 -0.25 -0.08 0.00 0.00 0.00 0.00 60.65 60.43 1m1x s ILE 184 Cb -0.10 -0.71 -0.04 0.00 0.01 0.00 0.00 42.46 41.62 1m1x s ILE 184 CO 0.01 -0.32 0.08 -0.55 0.00 0.00 0.00 174.94 174.16 1m1x s SER 185 N 2.23 5.61 -0.02 3.58 0.15 -0.80 -1.56 113.70 122.90 1m1x s SER 185 Ca 0.06 0.02 0.02 0.00 0.70 0.00 0.00 55.95 56.75 1m1x s SER 185 Cb -0.16 -1.98 0.00 0.00 -1.71 0.00 0.00 66.02 62.17 1m1x s SER 185 CO -0.16 0.11 -0.08 -1.81 1.20 0.00 0.00 173.24 172.49 1m1x s ASP 186 N 0.78 1.08 0.20 5.45 1.01 -0.26 -1.10 116.67 123.83 1m1x s ASP 186 Ca 0.04 -0.16 -0.30 0.00 0.71 0.00 0.00 52.55 52.84 1m1x s ASP 186 Cb -0.13 -0.24 -0.08 0.00 1.01 0.00 0.00 42.92 43.48 1m1x s ASP 186 CO 0.02 0.07 0.97 0.00 0.21 0.00 0.00 175.17 176.44 1m1x s GLN 187 N 0.09 4.79 1.30 8.23 -2.07 -1.26 -0.65 119.66 130.09 1m1x s GLN 187 Ca -0.01 1.51 -0.17 0.00 -1.82 0.00 0.00 55.36 54.87 1m1x s GLN 187 Cb -0.07 -3.30 0.33 0.00 -1.09 0.00 0.00 33.01 28.89 1m1x s GLN 187 CO 0.00 0.39 0.97 0.08 -1.32 0.00 0.00 175.29 175.41 1m1x s VAL 188 N -0.81 1.64 0.00 3.63 1.01 -1.23 -2.37 120.40 122.27 1m1x s VAL 188 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.41 1m1x s VAL 188 Cb -0.26 -2.03 0.00 0.00 0.00 0.00 0.00 36.38 34.09 1m1x s VAL 188 CO 0.32 0.00 0.00 0.00 0.00 0.00 0.00 175.10 175.42 1m1x n ALA 189 N -5.33 0.00 0.08 5.51 0.00 -1.26 -4.08 120.51 115.42 1m1x n ALA 189 Ca 0.07 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.62 1m1x n ALA 189 Cb 0.57 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.97 1m1x n ALA 189 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1m1x n GLU 190 N -0.49 0.61 -0.02 0.00 2.13 -1.00 0.21 120.64 122.09 1m1x n GLU 190 Ca 0.00 0.02 -0.22 0.00 0.66 0.00 0.00 57.16 57.63 1m1x n GLU 190 Cb 0.00 -1.73 -0.13 0.00 0.27 0.00 0.00 31.44 29.84 1m1x n GLU 190 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1m1x n ILE 191 N -2.54 1.74 0.08 6.31 5.41 -1.08 -4.20 119.36 125.08 1m1x n ILE 191 Ca -0.01 -0.55 -0.10 0.00 1.00 0.00 0.00 62.75 63.09 1m1x n ILE 191 Cb 0.55 -1.78 -0.07 0.00 -0.71 0.00 0.00 39.64 37.64 1m1x n ILE 191 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1m1x h VAL 192 N -0.11 0.63 -1.00 1.39 2.07 -1.85 -3.29 116.25 114.10 1m1x h VAL 192 Ca -0.42 -1.00 -0.74 0.00 0.82 0.00 0.00 66.70 65.36 1m1x h VAL 192 Cb 1.91 1.06 -0.12 0.00 -1.52 0.00 0.00 31.29 32.62 1m1x h VAL 192 CO 0.03 0.16 2.41 -1.54 0.02 0.00 0.00 177.57 178.65 1m1x n SER 193 N -4.97 5.46 0.00 0.57 3.41 0.13 -2.97 113.62 115.25 1m1x n SER 193 Ca -0.07 -3.03 0.00 0.00 -0.26 0.00 0.00 58.87 55.50 1m1x n SER 193 Cb 0.25 -1.50 0.00 0.00 -0.26 0.00 0.00 64.21 62.69 1m1x n SER 193 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1m1x n LYS 194 N 3.98 0.00 -2.17 4.33 3.00 -1.26 -4.65 118.16 121.40 1m1x n LYS 194 Ca 0.47 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 58.36 1m1x n LYS 194 Cb 0.34 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.35 1m1x n LYS 194 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.40 176.93 1m1x s TYR 195 N 0.00 2.91 -0.17 5.64 6.04 -1.16 -4.97 117.35 125.64 1m1x s TYR 195 Ca 0.00 0.79 -0.01 0.00 0.04 0.00 0.00 57.07 57.89 1m1x s TYR 195 Cb 0.00 -3.71 0.04 0.00 -1.04 0.00 0.00 41.96 37.26 1m1x s TYR 195 CO 0.00 -2.62 -0.04 0.34 -1.54 0.00 0.00 175.55 171.70 1m1x s ASP 196 N 1.73 2.83 0.00 4.32 2.15 -1.26 -5.01 116.67 121.43 1m1x s ASP 196 Ca 0.65 -0.68 0.00 0.00 0.43 0.00 0.00 52.55 52.95 1m1x s ASP 196 Cb -0.34 -0.86 0.00 0.00 -0.30 0.00 0.00 42.92 41.42 1m1x s ASP 196 CO 0.28 -0.20 0.80 -0.81 -0.17 0.00 0.00 175.17 175.07 1m1x n PRO 197 N 4.90 0.00 -0.82 4.34 -0.04 -1.26 -2.63 135.00 139.49 1m1x n PRO 197 Ca -0.11 0.32 -0.04 0.00 -0.04 0.00 0.00 63.50 63.62 1m1x n PRO 197 Cb 0.48 -1.54 0.24 0.00 -0.04 0.00 0.00 33.50 32.64 1m1x n PRO 197 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1m1x n ASN 198 N -1.30 3.55 -3.66 3.54 3.02 -1.26 -4.90 115.26 114.25 1m1x n ASN 198 Ca 0.00 -3.43 -0.10 0.00 -0.03 0.00 0.00 54.58 51.02 1m1x n ASN 198 Cb 0.04 -0.67 -0.10 0.00 -0.61 0.00 0.00 39.78 38.44 1m1x n ASN 198 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1m1x s VAL 199 N -3.09 -0.55 -1.10 2.41 0.11 -1.08 -5.06 120.40 112.04 1m1x s VAL 199 Ca 0.48 0.19 -0.04 0.00 -2.93 0.00 0.00 61.98 59.68 1m1x s VAL 199 Cb 0.41 -0.61 0.29 0.00 -1.53 0.00 0.00 36.38 34.93 1m1x s VAL 199 CO 0.07 0.08 1.67 -1.22 -3.33 0.00 0.00 175.10 172.36 1m1x n TYR 200 N 5.30 2.45 0.00 1.54 4.01 -1.26 -4.49 117.16 124.70 1m1x n TYR 200 Ca -0.09 -2.60 0.00 0.00 -0.16 0.00 0.00 57.90 55.05 1m1x n TYR 200 Cb 0.50 -1.35 0.00 0.00 -0.31 0.00 0.00 39.34 38.18 1m1x n TYR 200 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1m1x n SER 201 N 1.27 0.00 -2.27 7.72 7.64 -1.25 -4.74 113.62 121.98 1m1x n SER 201 Ca 0.35 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.23 1m1x n SER 201 Cb 0.31 0.19 0.00 0.00 -1.01 0.00 0.00 64.21 63.70 1m1x n SER 201 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1m1x n ILE 202 N -1.58-10.31 -3.25 0.44 5.41 -1.26 -4.82 119.36 103.98 1m1x n ILE 202 Ca 0.00 2.44 -0.39 0.00 1.00 0.00 0.00 62.75 65.81 1m1x n ILE 202 Cb 0.00 -4.99 -0.06 0.00 -0.71 0.00 0.00 39.64 33.88 1m1x n ILE 202 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1m1x s LYS 203 N -0.46 4.26 -0.13 0.38 3.01 -1.26 -5.00 119.74 120.54 1m1x s LYS 203 Ca 0.00 0.70 -0.04 0.00 -1.01 0.00 0.00 55.97 55.62 1m1x s LYS 203 Cb 0.00 -3.31 -0.03 0.00 -1.01 0.00 0.00 37.83 33.48 1m1x s LYS 203 CO 0.00 0.46 0.01 0.71 0.51 0.00 0.00 175.35 177.05 1m1x s TYR 204 N -0.49 3.17 0.00 3.18 1.51 -1.26 -5.06 117.35 118.39 1m1x s TYR 204 Ca 0.30 0.05 -0.03 0.00 -1.01 0.00 0.00 57.07 56.38 1m1x s TYR 204 Cb -0.18 -1.92 -0.01 0.00 -0.11 0.00 0.00 41.96 39.74 1m1x s TYR 204 CO 0.17 0.27 1.04 -0.91 -1.11 0.00 0.00 175.55 175.01 1m1x h ASN 205 N 5.96 -0.09 -0.19 2.29 2.35 -1.97 -3.28 115.58 120.65 1m1x h ASN 205 Ca -0.42 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.26 1m1x h ASN 205 Cb 1.19 0.02 -0.05 0.00 0.05 0.00 0.00 38.32 39.53 1m1x h ASN 205 CO 0.61 -0.06 0.10 0.59 -1.65 0.00 0.00 177.43 177.02 1m1x n ASN 206 N -2.31 2.80 -4.76 5.81 5.03 -1.26 -4.95 115.26 115.62 1m1x n ASN 206 Ca -0.01 -2.31 -0.38 0.00 0.87 0.00 0.00 54.58 52.74 1m1x n ASN 206 Cb 0.04 -0.56 0.02 0.00 -1.02 0.00 0.00 39.78 38.25 1m1x n ASN 206 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 1m1x s GLN 207 N -0.96 3.55 0.01 3.52 0.74 -1.24 -4.76 119.66 120.52 1m1x s GLN 207 Ca 0.13 2.12 0.09 0.00 0.05 0.00 0.00 55.36 57.74 1m1x s GLN 207 Cb 0.10 -2.45 -0.02 0.00 1.10 0.00 0.00 33.01 31.74 1m1x s GLN 207 CO 0.03 -0.83 -0.26 -0.51 -0.55 0.00 0.00 175.29 173.17 1m1x s LEU 208 N -3.06 2.11 -0.22 3.68 1.43 -0.26 -5.02 118.68 117.35 1m1x s LEU 208 Ca 0.65 -0.53 -0.27 0.00 -1.03 0.00 0.00 54.13 52.96 1m1x s LEU 208 Cb -0.37 -1.30 0.09 0.00 0.03 0.00 0.00 46.19 44.64 1m1x s LEU 208 CO 0.46 0.28 0.83 0.00 0.23 0.00 0.00 176.35 178.15 1m1x s ALA 209 N -0.70 -1.85 0.36 4.21 0.00 -1.26 -1.90 121.76 120.61 1m1x s ALA 209 Ca 0.11 1.80 -0.25 0.00 0.00 0.00 0.00 51.96 53.62 1m1x s ALA 209 Cb -0.10 -0.97 -0.10 0.00 0.00 0.00 0.00 23.12 21.96 1m1x s ALA 209 CO 0.01 -0.31 1.00 0.95 0.00 0.00 0.00 175.76 177.40 1m1x s THR 210 N -0.14 3.97 0.43 0.00 -4.23 -1.05 -5.01 115.64 109.62 1m1x s THR 210 Ca -0.01 1.57 0.07 0.00 -1.18 0.00 0.00 61.69 62.13 1m1x s THR 210 Cb -0.04 -3.84 0.01 0.00 1.34 0.00 0.00 72.50 69.97 1m1x s THR 210 CO 0.01 0.07 0.59 -0.13 -0.54 0.00 0.00 174.62 174.62 1m1x s ARG 211 N -2.28 2.84 0.19 3.99 0.52 -1.26 -4.76 118.95 118.20 1m1x s ARG 211 Ca 0.54 -1.11 -0.31 0.00 -0.52 0.00 0.00 55.73 54.32 1m1x s ARG 211 Cb -0.20 -2.72 -0.11 0.00 0.52 0.00 0.00 34.95 32.44 1m1x s ARG 211 CO 0.26 -0.29 1.61 0.99 0.02 0.00 0.00 175.30 177.89 1m1x s THR 212 N -2.39 2.41 0.37 0.02 2.01 -1.26 -5.01 115.64 111.79 1m1x s THR 212 Ca 0.54 0.30 0.05 0.00 0.31 0.00 0.00 61.69 62.89 1m1x s THR 212 Cb -0.10 -3.19 0.05 0.00 0.01 0.00 0.00 72.50 69.27 1m1x s THR 212 CO 0.34 0.03 0.42 0.00 -0.69 0.00 0.00 174.62 174.72 1m1x n ALA 213 N 3.76 0.71 -0.54 7.40 0.00 -1.26 -5.10 120.51 125.47 1m1x n ALA 213 Ca 0.14 -1.42 -0.28 0.00 0.00 0.00 0.00 53.44 51.88 1m1x n ALA 213 Cb 0.38 0.47 0.25 0.00 0.00 0.00 0.00 19.45 20.55 1m1x n ALA 213 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1m1x s GLN 214 N -3.63 -0.88 0.37 0.00 1.11 -1.26 -4.89 119.66 110.47 1m1x s GLN 214 Ca 0.32 0.88 0.07 0.00 0.01 0.00 0.00 55.36 56.64 1m1x s GLN 214 Cb -0.03 -1.55 0.72 0.00 -1.01 0.00 0.00 33.01 31.14 1m1x s GLN 214 CO 0.20 -3.71 1.92 0.00 0.01 0.00 0.00 175.29 173.72 1m1x h ALA 215 N -2.61 1.48 -0.22 6.09 0.00 -2.00 -2.73 119.26 119.27 1m1x h ALA 215 Ca -0.61 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.18 1m1x h ALA 215 Cb 1.33 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1m1x h ALA 215 CO 0.50 0.37 0.15 0.97 0.00 0.00 0.00 179.25 181.24 1m1x h ILE 216 N 0.40 0.92 -0.00 0.00 6.09 -2.01 -1.74 117.51 121.17 1m1x h ILE 216 Ca 0.09 -0.02 0.00 0.00 -1.37 0.00 0.00 64.86 63.56 1m1x h ILE 216 Cb 0.28 0.86 0.00 0.00 0.47 0.00 0.00 36.82 38.43 1m1x h ILE 216 CO 0.01 0.01 -0.01 0.49 -3.07 0.00 0.00 178.15 175.58 1m1x n PHE 217 N -4.48 0.00 -1.72 2.19 3.72 -1.03 -4.91 117.46 111.23 1m1x n PHE 217 Ca 0.02 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.05 1m1x n PHE 217 Cb 0.26 -0.06 0.07 0.00 -0.94 0.00 0.00 39.48 38.81 1m1x n PHE 217 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1m1x n ASP 218 N -0.91 2.03 -1.70 4.37 10.43 -0.66 -3.36 116.55 126.74 1m1x n ASP 218 Ca 0.21 0.83 -0.15 0.00 2.57 0.00 0.00 54.79 58.25 1m1x n ASP 218 Cb 0.17 -1.55 -0.01 0.00 1.84 0.00 0.00 41.12 41.57 1m1x n ASP 218 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 1m1x n ASP 219 N -1.81 -4.62 0.06 -2.24 8.00 0.13 -4.81 116.55 111.25 1m1x n ASP 219 Ca 0.16 0.01 -0.03 0.00 0.71 0.00 0.00 54.79 55.64 1m1x n ASP 219 Cb 0.48 -3.74 -0.07 0.00 -0.02 0.00 0.00 41.12 37.77 1m1x n ASP 219 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1m1x h SER 220 N 0.00 0.00 -0.29 -2.24 0.02 -1.27 -3.44 113.55 106.33 1m1x h SER 220 Ca -0.36 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.51 1m1x h SER 220 Cb 1.25 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.76 1m1x h SER 220 CO 0.43 0.74 -0.08 -1.22 -1.14 0.00 0.00 176.83 175.56 1m1x n TYR 221 N -3.11 -0.05 -1.64 3.45 0.53 -0.60 -1.84 117.16 113.90 1m1x n TYR 221 Ca -0.06 0.00 -0.49 0.00 -1.02 0.00 0.00 57.90 56.33 1m1x n TYR 221 Cb 0.88 -1.20 -0.05 0.00 -1.03 0.00 0.00 39.34 37.94 1m1x n TYR 221 CO 0.00 0.00 0.00 -0.11 -1.02 0.00 0.00 176.86 175.73 1m1x n LEU 222 N -0.48 2.46 0.00 7.72 7.94 0.17 -0.92 117.00 133.89 1m1x n LEU 222 Ca -0.04 1.09 0.00 0.00 -1.11 0.00 0.00 56.01 55.95 1m1x n LEU 222 Cb 0.24 -1.31 0.00 0.00 0.53 0.00 0.00 43.42 42.88 1m1x n LEU 222 CO 0.06 -0.60 0.00 0.61 -1.11 0.00 0.00 177.39 176.35 1m1x n GLY 223 N 3.15 0.74 0.37 -3.96 0.00 -1.25 -2.33 105.19 101.91 1m1x n GLY 223 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.19 1m1x n GLY 223 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1m1x h TYR 224 N 0.00 1.18 -3.85 1.61 3.20 -1.06 -3.37 116.97 114.67 1m1x h TYR 224 Ca 0.00 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.73 1m1x h TYR 224 Cb 0.00 -0.39 -0.20 0.00 1.54 0.00 0.00 36.73 37.68 1m1x h TYR 224 CO 0.00 0.77 -0.61 0.45 -1.64 0.00 0.00 178.16 177.13 1m1x s SER 225 N -6.21 0.20 -0.12 -2.11 0.15 -1.24 -4.65 113.70 99.71 1m1x s SER 225 Ca -0.12 -0.49 -0.09 0.00 0.70 0.00 0.00 55.95 55.95 1m1x s SER 225 Cb 0.18 0.16 0.04 0.00 -1.71 0.00 0.00 66.02 64.69 1m1x s SER 225 CO 0.81 -0.40 0.31 0.54 1.20 0.00 0.00 173.24 175.71 1m1x s VAL 226 N -1.96 -0.01 0.05 4.45 0.11 -1.26 -1.60 120.40 120.18 1m1x s VAL 226 Ca -0.11 0.05 -0.04 0.00 -2.93 0.00 0.00 61.98 58.95 1m1x s VAL 226 Cb -0.06 -0.45 -0.02 0.00 -1.53 0.00 0.00 36.38 34.32 1m1x s VAL 226 CO -0.02 0.02 0.07 0.00 -3.33 0.00 0.00 175.10 171.84 1m1x s ALA 227 N 0.65 0.11 -0.01 1.54 0.00 0.25 -4.87 121.76 119.44 1m1x s ALA 227 Ca -0.04 -0.81 0.02 0.00 0.00 0.00 0.00 51.96 51.12 1m1x s ALA 227 Cb -0.05 0.31 0.00 0.00 0.00 0.00 0.00 23.12 23.38 1m1x s ALA 227 CO -0.04 -0.38 -0.05 0.54 0.00 0.00 0.00 175.76 175.83 1m1x s VAL 228 N -3.35 0.43 0.09 0.00 0.11 -1.26 -1.74 120.40 114.68 1m1x s VAL 228 Ca 0.01 -0.20 -0.26 0.00 -2.93 0.00 0.00 61.98 58.61 1m1x s VAL 228 Cb 0.03 -0.39 0.08 0.00 -1.53 0.00 0.00 36.38 34.57 1m1x s VAL 228 CO -0.08 0.14 0.87 -0.83 -3.33 0.00 0.00 175.10 171.87 1m1x s GLY 229 N 0.09 -0.37 -0.40 6.54 0.00 -1.12 -4.78 107.32 107.28 1m1x s GLY 229 Ca -0.01 0.52 -0.23 0.00 0.00 0.00 0.00 44.72 45.00 1m1x s GLY 229 CO -0.00 0.16 0.80 -0.35 0.00 0.00 0.00 173.10 173.70 1m1x s ASP 230 N -2.72 6.51 0.06 1.64 3.68 -1.26 0.45 116.67 125.02 1m1x s ASP 230 Ca 0.08 0.19 -0.02 0.00 2.13 0.00 0.00 52.55 54.93 1m1x s ASP 230 Cb -0.01 -2.40 -0.01 0.00 -1.45 0.00 0.00 42.92 39.05 1m1x s ASP 230 CO -0.04 -0.82 -0.05 0.49 0.13 0.00 0.00 175.17 174.88 1m1x n PHE 231 N 6.58 0.00 -1.75 -5.34 3.72 -1.26 -4.26 117.46 115.15 1m1x n PHE 231 Ca 0.03 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.01 1m1x n PHE 231 Cb 0.48 -0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 38.93 1m1x n PHE 231 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1m1x s ASN 232 N -5.93 6.46 0.00 4.37 3.84 -1.26 -4.81 114.94 117.61 1m1x s ASN 232 Ca -0.04 2.70 0.00 0.00 0.21 0.00 0.00 52.86 55.73 1m1x s ASN 232 Cb 0.01 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 38.14 1m1x s ASN 232 CO 0.06 -0.99 0.00 0.61 -2.79 0.00 0.00 177.10 173.99 1m1x n GLY 233 N 4.23 1.97 3.61 1.21 0.00 -1.26 -4.74 105.19 110.22 1m1x n GLY 233 Ca 0.18 0.13 -0.29 0.00 0.00 0.00 0.00 46.02 46.03 1m1x n GLY 233 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1m1x s ASP 234 N -3.35 3.33 0.00 1.61 2.15 -1.26 -5.04 116.67 114.12 1m1x s ASP 234 Ca 0.00 -1.73 0.00 0.00 0.43 0.00 0.00 52.55 51.25 1m1x s ASP 234 Cb 0.00 0.64 0.00 0.00 -0.30 0.00 0.00 42.92 43.26 1m1x s ASP 234 CO 0.00 -0.98 0.00 0.61 -0.17 0.00 0.00 175.17 174.63 1m1x n GLY 235 N -1.08 0.84 3.43 2.66 0.00 -1.26 -5.02 105.19 104.76 1m1x n GLY 235 Ca -0.11 -1.09 -0.25 0.00 0.00 0.00 0.00 46.02 44.57 1m1x n GLY 235 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1m1x n ILE 236 N 0.00 0.00 -2.08 -0.61 -6.64 -1.26 -5.02 119.36 103.75 1m1x n ILE 236 Ca 0.00 -2.03 -0.41 0.00 -1.77 0.00 0.00 62.75 58.54 1m1x n ILE 236 Cb 0.00 0.05 -0.02 0.00 -1.44 0.00 0.00 39.64 38.22 1m1x n ILE 236 CO 0.00 0.00 0.00 -1.81 -1.77 0.00 0.00 176.55 172.97 1m1x s ASP 237 N -3.85 6.73 0.30 7.28 1.11 -1.26 -4.30 116.67 122.69 1m1x s ASP 237 Ca 0.22 2.63 0.07 0.00 0.18 0.00 0.00 52.55 55.65 1m1x s ASP 237 Cb -0.02 -2.63 -0.03 0.00 1.07 0.00 0.00 42.92 41.31 1m1x s ASP 237 CO 0.14 -0.62 0.27 -1.81 1.18 0.00 0.00 175.17 174.33 1m1x s ASP 238 N 0.09 5.44 -0.15 0.27 1.11 0.17 -3.95 116.67 119.66 1m1x s ASP 238 Ca 0.55 -0.37 -0.17 0.00 0.18 0.00 0.00 52.55 52.74 1m1x s ASP 238 Cb -0.40 -1.17 -0.04 0.00 1.07 0.00 0.00 42.92 42.38 1m1x s ASP 238 CO 0.45 -0.24 0.42 -0.36 1.18 0.00 0.00 175.17 176.62 1m1x s PHE 239 N -2.23 3.47 -0.17 4.23 2.99 0.12 -2.81 117.98 123.58 1m1x s PHE 239 Ca 0.38 0.76 0.01 0.00 0.00 0.00 0.00 56.93 58.08 1m1x s PHE 239 Cb -0.07 -2.50 0.02 0.00 0.00 0.00 0.00 43.02 40.47 1m1x s PHE 239 CO 0.26 0.14 -0.19 0.08 -0.00 0.00 0.00 175.22 175.51 1m1x s VAL 240 N 0.77 1.94 -0.01 -0.44 1.01 -0.71 0.20 120.40 123.15 1m1x s VAL 240 Ca 0.22 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.34 1m1x s VAL 240 Cb -0.14 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.48 1m1x s VAL 240 CO 0.08 0.52 -0.03 -0.55 0.00 0.00 0.00 175.10 175.12 1m1x s SER 241 N 1.31 0.36 -0.14 3.32 0.15 -0.57 -0.58 113.70 117.54 1m1x s SER 241 Ca 0.04 -0.05 -0.20 0.00 0.70 0.00 0.00 55.95 56.44 1m1x s SER 241 Cb -0.13 -0.06 -0.03 0.00 -1.71 0.00 0.00 66.02 64.08 1m1x s SER 241 CO -0.12 0.02 0.58 -0.83 1.20 0.00 0.00 173.24 174.10 1m1x s GLY 242 N 0.06 2.29 -0.89 9.45 0.00 -0.63 -1.19 107.32 116.42 1m1x s GLY 242 Ca -0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 44.72 44.54 1m1x s GLY 242 CO -0.00 1.09 0.95 -0.62 0.00 0.00 0.00 173.10 174.51 1m1x n VAL 243 N 4.15 3.45 0.17 1.40 0.31 0.24 -3.50 118.33 124.55 1m1x n VAL 243 Ca -0.03 -5.34 0.17 0.00 -0.01 0.00 0.00 64.34 59.13 1m1x n VAL 243 Cb 0.51 -2.25 0.67 0.00 -0.91 0.00 0.00 33.84 31.86 1m1x n VAL 243 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1m1x h PRO 244 N 5.44 0.00 -0.16 5.55 0.13 -1.67 0.11 132.00 141.40 1m1x h PRO 244 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1m1x h PRO 244 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1m1x h PRO 244 CO 0.97 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.28 1m1x n ARG 245 N -3.23 1.54 -0.63 0.86 1.74 -0.77 -3.94 116.66 112.24 1m1x n ARG 245 Ca 0.05 -1.57 -0.31 0.00 -0.77 0.00 0.00 57.85 55.25 1m1x n ARG 245 Cb 0.67 -1.26 0.19 0.00 -1.02 0.00 0.00 32.46 31.05 1m1x n ARG 245 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1m1x n ALA 246 N 0.65 -3.78 -0.97 7.54 0.00 0.32 -3.06 120.51 121.22 1m1x n ALA 246 Ca 0.09 -1.23 0.00 0.00 0.00 0.00 0.00 53.44 52.30 1m1x n ALA 246 Cb 0.36 -1.65 0.00 0.00 0.00 0.00 0.00 19.45 18.15 1m1x n ALA 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m1x n ALA 247 N -4.54 0.00 -3.04 0.00 0.00 -1.26 -2.06 120.51 109.60 1m1x n ALA 247 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.18 1m1x n ALA 247 Cb 0.60 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.00 1m1x n ALA 247 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1m1x n ARG 248 N 14.00 3.16 -1.03 0.00 3.00 -1.26 -4.74 116.66 129.79 1m1x n ARG 248 Ca 0.00 -4.82 -0.01 0.00 -0.01 0.00 0.00 57.85 53.01 1m1x n ARG 248 Cb 0.00 -2.25 -0.00 0.00 0.00 0.00 0.00 32.46 30.20 1m1x n ARG 248 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1m1x n THR 249 N 0.03 0.00 0.04 0.55 -1.04 -0.88 -4.57 114.28 108.41 1m1x n THR 249 Ca 0.31 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 62.19 1m1x n THR 249 Cb 0.39 -0.69 -0.09 0.00 -1.82 0.00 0.00 70.33 68.12 1m1x n THR 249 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1m1x h LEU 250 N 0.00 -0.10 0.00 -4.42 3.38 -1.66 1.26 115.31 113.77 1m1x h LEU 250 Ca -0.02 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1m1x h LEU 250 Cb 0.65 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1m1x h LEU 250 CO 0.03 0.30 0.00 0.61 0.09 0.00 0.00 178.44 179.46 1m1x n GLY 251 N -0.08 2.93 3.59 0.83 0.00 -0.90 -4.11 105.19 107.46 1m1x n GLY 251 Ca -0.08 -1.94 -0.12 0.00 0.00 0.00 0.00 46.02 43.88 1m1x n GLY 251 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1m1x s MET 252 N -3.08 0.69 -0.11 1.61 -1.94 -0.80 -2.05 119.30 113.63 1m1x s MET 252 Ca 0.00 0.43 0.02 0.00 -1.71 0.00 0.00 55.69 54.43 1m1x s MET 252 Cb 0.00 0.33 0.01 0.00 2.01 0.00 0.00 34.83 37.18 1m1x s MET 252 CO 0.00 -0.16 -0.17 0.08 -0.01 0.00 0.00 175.02 174.76 1m1x s VAL 253 N -0.49 1.61 -0.12 -6.03 1.01 0.10 0.83 120.40 117.30 1m1x s VAL 253 Ca -0.02 -0.72 -0.07 0.00 0.00 0.00 0.00 61.98 61.17 1m1x s VAL 253 Cb -0.02 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 1m1x s VAL 253 CO 0.01 0.46 0.13 -0.31 0.00 0.00 0.00 175.10 175.38 1m1x s TYR 254 N 0.82 3.55 -0.11 5.22 2.02 -0.33 -1.10 117.35 127.42 1m1x s TYR 254 Ca -0.10 0.49 0.02 0.00 -0.37 0.00 0.00 57.07 57.11 1m1x s TYR 254 Cb -0.16 -1.94 -0.01 0.00 -0.40 0.00 0.00 41.96 39.45 1m1x s TYR 254 CO 0.01 0.69 -0.17 0.42 -1.57 0.00 0.00 175.55 174.92 1m1x s ILE 255 N -0.93 2.70 0.19 2.71 -1.09 -0.63 -1.51 121.20 122.65 1m1x s ILE 255 Ca 0.14 -0.80 0.09 0.00 -2.23 0.00 0.00 60.65 57.85 1m1x s ILE 255 Cb -0.12 -2.09 -0.04 0.00 -1.58 0.00 0.00 42.46 38.63 1m1x s ILE 255 CO 0.03 0.55 -0.18 -0.31 -1.23 0.00 0.00 174.94 173.80 1m1x s TYR 256 N 0.18 1.86 0.20 3.97 1.51 0.52 0.18 117.35 125.77 1m1x s TYR 256 Ca -0.10 -0.48 -0.31 0.00 -1.01 0.00 0.00 57.07 55.17 1m1x s TYR 256 Cb -0.16 -0.89 -0.10 0.00 -0.11 0.00 0.00 41.96 40.70 1m1x s TYR 256 CO 0.06 0.39 1.54 0.34 -1.11 0.00 0.00 175.55 176.76 1m1x s ASP 257 N -2.95 6.58 0.00 2.29 3.68 0.92 0.13 116.67 127.33 1m1x s ASP 257 Ca 0.19 2.66 0.10 0.00 2.13 0.00 0.00 52.55 57.63 1m1x s ASP 257 Cb -0.04 -2.61 0.42 0.00 -1.45 0.00 0.00 42.92 39.25 1m1x s ASP 257 CO 0.08 -0.80 1.29 0.61 0.13 0.00 0.00 175.17 176.47 1m1x n GLY 258 N 3.20 -0.79 0.30 2.66 0.00 -1.25 -2.42 105.19 106.89 1m1x n GLY 258 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1m1x n GLY 258 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1m1x n LYS 259 N -1.46 0.00 0.07 1.61 4.76 -1.26 -4.85 118.16 117.03 1m1x n LYS 259 Ca 0.03 0.00 -0.21 0.00 -2.87 0.00 0.00 58.31 55.25 1m1x n LYS 259 Cb 0.11 -0.64 -0.13 0.00 -1.84 0.00 0.00 35.03 32.53 1m1x n LYS 259 CO 0.00 0.00 0.00 -0.91 -1.37 0.00 0.00 177.40 175.12 1m1x h ASN 260 N 0.00 0.83 0.00 4.39 4.21 -1.98 -3.48 115.58 119.55 1m1x h ASN 260 Ca 0.00 -0.81 0.00 0.00 1.21 0.00 0.00 56.30 56.70 1m1x h ASN 260 Cb 0.47 -0.26 0.00 0.00 -1.12 0.00 0.00 38.32 37.41 1m1x h ASN 260 CO 0.00 1.55 0.00 0.80 -1.29 0.00 0.00 177.43 178.49 1m1x n MET 261 N -3.87 0.00 -3.36 0.81 0.00 -1.02 -4.92 117.12 104.77 1m1x n MET 261 Ca -0.13 0.21 -0.33 0.00 -0.00 0.00 0.00 57.70 57.45 1m1x n MET 261 Cb 0.93 -3.50 -0.06 0.00 0.00 0.00 0.00 33.22 30.59 1m1x n MET 261 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 1m1x s SER 262 N -2.94 6.74 0.03 6.12 1.04 -1.26 -4.64 113.70 118.78 1m1x s SER 262 Ca 0.00 1.04 -0.30 0.00 0.48 0.00 0.00 55.95 57.16 1m1x s SER 262 Cb 0.00 -2.27 -0.07 0.00 0.10 0.00 0.00 66.02 63.78 1m1x s SER 262 CO 0.00 -0.01 1.60 -0.55 0.98 0.00 0.00 173.24 175.26 1m1x s SER 263 N -2.06 6.67 0.00 7.02 0.15 -1.26 -0.05 113.70 124.17 1m1x s SER 263 Ca 0.44 2.35 0.00 0.00 0.70 0.00 0.00 55.95 59.44 1m1x s SER 263 Cb -0.13 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 1m1x s SER 263 CO 0.20 -0.86 0.00 0.18 1.20 0.00 0.00 173.24 173.96 1m1x n LEU 264 N 5.91 0.85 -4.78 3.45 7.99 0.13 -4.89 117.00 125.66 1m1x n LEU 264 Ca 0.16 0.09 -0.31 0.00 -0.01 0.00 0.00 56.01 55.94 1m1x n LEU 264 Cb 0.42 -0.20 -0.07 0.00 -0.11 0.00 0.00 43.42 43.46 1m1x n LEU 264 CO 0.62 -0.20 -0.21 -0.31 -1.51 0.00 0.00 177.39 175.78 1m1x s TYR 265 N -0.40 1.88 -0.01 -1.77 2.02 -1.18 -4.97 117.35 112.92 1m1x s TYR 265 Ca 0.00 -0.91 -0.16 0.00 -0.37 0.00 0.00 57.07 55.63 1m1x s TYR 265 Cb 0.00 -1.68 0.03 0.00 -0.40 0.00 0.00 41.96 39.91 1m1x s TYR 265 CO 0.00 0.13 0.34 -0.80 -1.57 0.00 0.00 175.55 173.64 1m1x s ASN 266 N -3.94 -0.21 -0.00 2.29 -0.87 -1.26 -1.60 114.94 109.35 1m1x s ASN 266 Ca 0.13 0.08 0.01 0.00 -1.57 0.00 0.00 52.86 51.51 1m1x s ASN 266 Cb 0.01 0.34 -0.00 0.00 -0.02 0.00 0.00 41.25 41.58 1m1x s ASN 266 CO 0.07 -0.49 -0.05 -0.36 -2.57 0.00 0.00 177.10 173.70 1m1x s PHE 267 N -1.55 0.42 0.07 2.20 0.40 -0.26 -4.93 117.98 114.32 1m1x s PHE 267 Ca -0.12 -0.10 0.07 0.00 -0.60 0.00 0.00 56.93 56.18 1m1x s PHE 267 Cb -0.04 -0.27 -0.03 0.00 0.51 0.00 0.00 43.02 43.19 1m1x s PHE 267 CO 0.03 -0.01 -0.18 0.99 0.70 0.00 0.00 175.22 176.75 1m1x s THR 268 N -0.18 1.43 0.67 0.64 2.01 -1.26 -0.72 115.64 118.22 1m1x s THR 268 Ca 0.01 -1.30 -0.11 0.00 0.31 0.00 0.00 61.69 60.60 1m1x s THR 268 Cb -0.02 -1.30 -0.01 0.00 0.01 0.00 0.00 72.50 71.18 1m1x s THR 268 CO -0.00 -0.03 1.05 -0.83 -0.69 0.00 0.00 174.62 174.12 1m1x s GLY 269 N -1.56 1.68 -0.16 4.40 0.00 -0.87 -4.94 107.32 105.88 1m1x s GLY 269 Ca 0.04 0.05 0.02 0.00 0.00 0.00 0.00 44.72 44.82 1m1x s GLY 269 CO 0.03 0.35 0.19 -2.21 0.00 0.00 0.00 173.10 171.45 1m1x n GLU 270 N -2.98 0.70 -4.06 2.90 4.07 -1.26 -4.83 120.64 115.17 1m1x n GLU 270 Ca 0.07 0.20 -0.31 0.00 -0.06 0.00 0.00 57.16 57.06 1m1x n GLU 270 Cb 0.54 -1.64 -0.16 0.00 -0.06 0.00 0.00 31.44 30.11 1m1x n GLU 270 CO 0.00 0.00 0.00 -1.14 -0.06 0.00 0.00 177.13 175.93 1m1x s GLN 271 N -2.54 2.58 0.78 5.31 0.74 -1.26 -5.11 119.66 120.15 1m1x s GLN 271 Ca -0.22 -0.71 -0.13 0.00 0.05 0.00 0.00 55.36 54.34 1m1x s GLN 271 Cb 0.07 -2.35 0.06 0.00 1.10 0.00 0.00 33.01 31.90 1m1x s GLN 271 CO 0.73 -0.25 1.18 0.00 -0.55 0.00 0.00 175.29 176.41 1m1x s MET 272 N 1.39 1.90 -0.78 1.67 0.00 -1.26 -3.31 119.30 118.91 1m1x s MET 272 Ca 0.04 1.65 0.00 0.00 0.00 0.00 0.00 55.69 57.38 1m1x s MET 272 Cb -0.13 -1.82 0.00 0.00 0.00 0.00 0.00 34.83 32.88 1m1x s MET 272 CO -0.11 -1.99 0.00 0.00 0.00 0.00 0.00 175.02 172.91 1m1x n ALA 273 N -3.14 -0.11 1.09 3.16 0.00 0.43 -4.84 120.51 117.11 1m1x n ALA 273 Ca 0.13 0.12 0.12 0.00 0.00 0.00 0.00 53.44 53.81 1m1x n ALA 273 Cb 0.51 -1.29 0.31 0.00 0.00 0.00 0.00 19.45 18.98 1m1x n ALA 273 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m1x n ALA 274 N 1.14 3.34 -3.31 0.00 0.00 -1.21 -4.89 120.51 115.58 1m1x n ALA 274 Ca -0.07 -0.36 -0.18 0.00 0.00 0.00 0.00 53.44 52.83 1m1x n ALA 274 Cb 0.40 -1.14 0.06 0.00 0.00 0.00 0.00 19.45 18.77 1m1x n ALA 274 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1m1x n TYR 275 N -1.21 -2.15 -1.68 0.00 4.02 -1.26 -2.38 117.16 112.50 1m1x n TYR 275 Ca 0.08 0.79 -0.25 0.00 -0.01 0.00 0.00 57.90 58.51 1m1x n TYR 275 Cb 0.34 -4.25 -0.05 0.00 -0.02 0.00 0.00 39.34 35.36 1m1x n TYR 275 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 176.86 175.97 1m1x s PHE 276 N -3.26 1.26 0.00 -0.72 5.36 -1.26 -1.56 117.98 117.80 1m1x s PHE 276 Ca 0.35 1.55 0.00 0.00 -0.96 0.00 0.00 56.93 57.87 1m1x s PHE 276 Cb -0.16 -3.63 0.00 0.00 -0.34 0.00 0.00 43.02 38.89 1m1x s PHE 276 CO 0.58 -1.98 0.00 0.41 -1.46 0.00 0.00 175.22 172.76 1m1x n GLY 277 N 6.44 0.09 0.45 13.12 0.00 -0.31 -3.34 105.19 121.63 1m1x n GLY 277 Ca 0.40 0.00 0.27 0.00 0.00 0.00 0.00 46.02 46.69 1m1x n GLY 277 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1m1x h PHE 278 N 0.00 0.40 -3.30 1.61 3.57 -1.04 -3.39 116.94 114.79 1m1x h PHE 278 Ca 0.00 0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.36 1m1x h PHE 278 Cb 0.00 -0.12 -0.23 0.00 2.79 0.00 0.00 35.95 38.39 1m1x h PHE 278 CO 0.00 0.04 -0.45 -1.54 -2.23 0.00 0.00 178.31 174.13 1m1x s SER 279 N -5.29 -0.12 0.11 0.41 1.04 -1.25 -4.62 113.70 103.98 1m1x s SER 279 Ca -0.07 0.14 0.01 0.00 0.48 0.00 0.00 55.95 56.51 1m1x s SER 279 Cb 0.24 0.33 -0.04 0.00 0.10 0.00 0.00 66.02 66.65 1m1x s SER 279 CO 0.80 -0.24 -0.03 0.68 0.98 0.00 0.00 173.24 175.43 1m1x s VAL 280 N -0.66 0.53 -0.29 5.02 -7.23 -1.26 -1.55 120.40 114.97 1m1x s VAL 280 Ca -0.07 -1.92 -0.19 0.00 -1.81 0.00 0.00 61.98 57.99 1m1x s VAL 280 Cb -0.04 -1.79 0.14 0.00 0.56 0.00 0.00 36.38 35.25 1m1x s VAL 280 CO 0.01 -0.76 1.00 0.00 -0.31 0.00 0.00 175.10 175.04 1m1x s ALA 281 N -3.74 -2.19 -0.12 1.32 0.00 -0.92 -4.67 121.76 111.44 1m1x s ALA 281 Ca 0.15 2.11 0.03 0.00 0.00 0.00 0.00 51.96 54.25 1m1x s ALA 281 Cb 0.06 -1.64 0.01 0.00 0.00 0.00 0.00 23.12 21.55 1m1x s ALA 281 CO -0.03 -0.31 -0.23 0.00 0.00 0.00 0.00 175.76 175.19 1m1x s ALA 282 N 1.02 2.21 0.04 0.00 0.00 -1.26 -0.76 121.76 123.02 1m1x s ALA 282 Ca -0.05 -1.04 -0.19 0.00 0.00 0.00 0.00 51.96 50.67 1m1x s ALA 282 Cb -0.04 -0.92 0.04 0.00 0.00 0.00 0.00 23.12 22.20 1m1x s ALA 282 CO -0.13 0.09 0.44 0.99 0.00 0.00 0.00 175.76 177.15 1m1x s THR 283 N 0.64 0.05 -0.73 0.00 2.01 -0.62 -4.86 115.64 112.13 1m1x s THR 283 Ca -0.11 -0.41 -0.18 0.00 0.31 0.00 0.00 61.69 61.30 1m1x s THR 283 Cb -0.16 -0.95 0.14 0.00 0.01 0.00 0.00 72.50 71.53 1m1x s THR 283 CO 0.02 -0.22 0.83 -0.62 -0.69 0.00 0.00 174.62 173.94 1m1x s ASP 284 N -1.99 6.43 0.00 3.53 3.68 -1.26 0.14 116.67 127.20 1m1x s ASP 284 Ca -0.05 -1.86 0.29 0.00 2.13 0.00 0.00 52.55 53.06 1m1x s ASP 284 Cb -0.01 -2.31 1.65 0.00 -1.45 0.00 0.00 42.92 40.80 1m1x s ASP 284 CO -0.02 -0.99 2.07 0.00 0.13 0.00 0.00 175.17 176.36 1m1x n ILE 285 N 5.19 0.01 -2.72 4.11 0.13 -1.26 -4.17 119.36 120.65 1m1x n ILE 285 Ca 0.04 -0.05 -0.06 0.00 -1.10 0.00 0.00 62.75 61.59 1m1x n ILE 285 Cb 0.45 -0.30 0.05 0.00 -0.84 0.00 0.00 39.64 39.00 1m1x n ILE 285 CO 0.00 0.00 0.00 -0.46 2.80 0.00 0.00 176.55 178.89 1m1x n ASN 286 N -0.76 1.07 -3.61 9.51 2.04 -1.26 -3.66 115.26 118.58 1m1x n ASN 286 Ca 0.22 -2.45 -0.07 0.00 -0.44 0.00 0.00 54.58 51.83 1m1x n ASN 286 Cb 0.15 -0.33 0.00 0.00 -2.53 0.00 0.00 39.78 37.07 1m1x n ASN 286 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1m1x n GLY 287 N -0.34 -0.15 0.53 4.83 0.00 -1.26 -4.75 105.19 104.05 1m1x n GLY 287 Ca 0.06 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1m1x n GLY 287 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1m1x n ASP 288 N 0.36 0.03 -3.55 1.61 3.85 -1.26 -5.04 116.55 112.54 1m1x n ASP 288 Ca -0.02 -1.90 -0.21 0.00 -0.71 0.00 0.00 54.79 51.95 1m1x n ASP 288 Cb 0.10 -0.18 0.00 0.00 -1.35 0.00 0.00 41.12 39.68 1m1x n ASP 288 CO 0.00 0.00 0.00 -0.67 -1.01 0.00 0.00 177.20 175.52 1m1x n ASP 289 N 0.01 -3.89 -3.59 -1.12 2.03 -1.26 -5.00 116.55 103.73 1m1x n ASP 289 Ca 0.00 -0.79 -0.12 0.00 0.52 0.00 0.00 54.79 54.41 1m1x n ASP 289 Cb 0.69 -1.29 -0.11 0.00 -0.72 0.00 0.00 41.12 39.69 1m1x n ASP 289 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1m1x s TYR 290 N -2.77 -0.59 0.23 -0.67 4.12 -1.26 -5.12 117.35 111.29 1m1x s TYR 290 Ca 0.01 1.05 -0.31 0.00 0.02 0.00 0.00 57.07 57.83 1m1x s TYR 290 Cb -0.00 0.05 -0.11 0.00 -1.52 0.00 0.00 41.96 40.37 1m1x s TYR 290 CO 0.73 -0.48 1.63 0.00 0.02 0.00 0.00 175.55 177.45 1m1x s ALA 291 N 2.49 3.82 -0.07 3.71 0.00 -1.26 -4.06 121.76 126.39 1m1x s ALA 291 Ca 0.03 1.52 0.01 0.00 0.00 0.00 0.00 51.96 53.51 1m1x s ALA 291 Cb -0.13 -3.65 -0.03 0.00 0.00 0.00 0.00 23.12 19.31 1m1x s ALA 291 CO -0.11 -0.90 -0.07 -0.51 0.00 0.00 0.00 175.76 174.17 1m1x s ASP 292 N 0.88 4.66 -0.05 0.00 1.11 0.36 -4.31 116.67 119.32 1m1x s ASP 292 Ca 0.69 -0.02 -0.19 0.00 0.18 0.00 0.00 52.55 53.21 1m1x s ASP 292 Cb -0.47 -1.20 -0.05 0.00 1.07 0.00 0.00 42.92 42.26 1m1x s ASP 292 CO 0.38 0.35 0.52 -0.69 1.18 0.00 0.00 175.17 176.92 1m1x s VAL 293 N -0.75 5.04 -0.06 -1.27 1.01 0.67 -1.58 120.40 123.45 1m1x s VAL 293 Ca 0.12 1.07 0.05 0.00 0.00 0.00 0.00 61.98 63.22 1m1x s VAL 293 Cb -0.11 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 1m1x s VAL 293 CO 0.02 0.40 -0.21 -0.36 0.00 0.00 0.00 175.10 174.95 1m1x s PHE 294 N 0.01 2.10 -0.03 5.22 0.40 0.06 0.57 117.98 126.31 1m1x s PHE 294 Ca 0.28 -0.66 0.01 0.00 -0.60 0.00 0.00 56.93 55.96 1m1x s PHE 294 Cb -0.17 -1.40 0.02 0.00 0.51 0.00 0.00 43.02 41.98 1m1x s PHE 294 CO 0.14 -0.22 -0.03 0.42 0.70 0.00 0.00 175.22 176.22 1m1x s ILE 295 N 0.02 0.39 -0.14 0.64 1.01 0.36 -2.16 121.20 121.33 1m1x s ILE 295 Ca -0.06 -0.08 -0.04 0.00 0.00 0.00 0.00 60.65 60.47 1m1x s ILE 295 Cb -0.13 -0.42 -0.03 0.00 0.01 0.00 0.00 42.46 41.88 1m1x s ILE 295 CO 0.04 0.17 -0.01 -0.83 0.00 0.00 0.00 174.94 174.31 1m1x s GLY 296 N 0.70 1.78 -0.52 6.18 0.00 -0.59 -0.46 107.32 114.41 1m1x s GLY 296 Ca -0.08 -0.81 0.06 0.00 0.00 0.00 0.00 44.72 43.89 1m1x s GLY 296 CO -0.00 -0.22 0.52 0.00 0.00 0.00 0.00 173.10 173.40 1m1x n ALA 297 N 3.08 3.12 0.23 3.20 0.00 -0.99 -1.17 120.51 127.97 1m1x n ALA 297 Ca -0.18 -3.86 0.08 0.00 0.00 0.00 0.00 53.44 49.48 1m1x n ALA 297 Cb 0.53 -0.86 0.40 0.00 0.00 0.00 0.00 19.45 19.52 1m1x n ALA 297 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1m1x h PRO 298 N 4.74 0.00 -0.35 0.00 0.13 -1.79 -1.85 132.00 132.88 1m1x h PRO 298 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1m1x h PRO 298 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1m1x h PRO 298 CO 0.57 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.62 1m1x n LEU 299 N -2.29 4.33 -4.74 1.56 4.32 -1.00 -3.55 117.00 115.63 1m1x n LEU 299 Ca -0.01 -2.96 -0.41 0.00 -0.02 0.00 0.00 56.01 52.61 1m1x n LEU 299 Cb 0.46 -0.57 -0.03 0.00 -1.62 0.00 0.00 43.42 41.66 1m1x n LEU 299 CO 0.07 0.67 0.98 0.12 -1.22 0.00 0.00 177.39 178.00 1m1x s PHE 300 N -2.74 3.24 -0.40 -1.77 5.36 -0.71 -4.59 117.98 116.37 1m1x s PHE 300 Ca 0.45 1.26 -0.11 0.00 -0.96 0.00 0.00 56.93 57.57 1m1x s PHE 300 Cb 0.35 -3.60 0.05 0.00 -0.34 0.00 0.00 43.02 39.48 1m1x s PHE 300 CO 0.11 -1.83 0.25 -1.64 -1.46 0.00 0.00 175.22 170.65 1m1x s MET 301 N -0.37 2.78 0.40 10.12 -1.94 -1.26 -0.53 119.30 128.49 1m1x s MET 301 Ca 0.55 -1.23 0.01 0.00 -1.71 0.00 0.00 55.69 53.31 1m1x s MET 301 Cb -0.37 -3.81 -0.02 0.00 2.01 0.00 0.00 34.83 32.65 1m1x s MET 301 CO 0.40 -0.82 0.60 0.16 -0.01 0.00 0.00 175.02 175.35 1m1x s ASP 302 N 1.85 6.06 -0.41 3.03 -4.77 -0.58 -4.67 116.67 117.17 1m1x s ASP 302 Ca 0.03 0.34 -0.25 0.00 -3.30 0.00 0.00 52.55 49.37 1m1x s ASP 302 Cb -0.21 -1.75 0.02 0.00 -1.09 0.00 0.00 42.92 39.89 1m1x s ASP 302 CO 0.05 -0.49 0.86 -0.13 0.70 0.00 0.00 175.17 176.16 1m1x s ARG 303 N -4.42 3.65 0.87 2.11 1.81 -1.26 -1.50 118.95 120.20 1m1x s ARG 303 Ca 0.44 0.26 -0.12 0.00 -1.72 0.00 0.00 55.73 54.59 1m1x s ARG 303 Cb -0.10 -3.87 0.11 0.00 -0.45 0.00 0.00 34.95 30.65 1m1x s ARG 303 CO 0.37 -1.04 1.11 0.20 -0.68 0.00 0.00 175.30 175.26 1m1x s GLY 304 N 2.04 1.60 0.15 -3.53 0.00 -0.66 -4.84 107.32 102.08 1m1x s GLY 304 Ca 0.35 -0.35 -0.20 0.00 0.00 0.00 0.00 44.72 44.52 1m1x s GLY 304 CO 0.21 0.16 1.23 -1.26 0.00 0.00 0.00 173.10 173.45 1m1x n SER 305 N -3.68 -0.72 0.00 1.64 2.88 -1.26 0.93 113.62 113.41 1m1x n SER 305 Ca 0.07 1.41 0.03 0.00 -1.33 0.00 0.00 58.87 59.05 1m1x n SER 305 Cb 0.58 -0.24 0.15 0.00 -0.75 0.00 0.00 64.21 63.95 1m1x n SER 305 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1m1x n ASP 306 N -5.07 0.00 0.00 -3.46 5.75 -1.26 -4.84 116.55 107.67 1m1x n ASP 306 Ca 0.04 0.28 0.00 0.00 -0.01 0.00 0.00 54.79 55.11 1m1x n ASP 306 Cb 0.25 -0.35 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 1m1x n ASP 306 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1m1x n GLY 307 N -0.80 0.73 3.79 6.12 0.00 0.26 -5.07 105.19 110.22 1m1x n GLY 307 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1m1x n GLY 307 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1m1x s LYS 308 N -0.74 4.36 0.23 1.61 1.02 -1.26 -4.69 119.74 120.28 1m1x s LYS 308 Ca 0.00 1.38 -0.30 0.00 0.02 0.00 0.00 55.97 57.07 1m1x s LYS 308 Cb 0.00 -2.61 -0.09 0.00 -0.52 0.00 0.00 37.83 34.61 1m1x s LYS 308 CO 0.00 0.06 1.23 -0.51 -0.92 0.00 0.00 175.35 175.22 1m1x s LEU 309 N -2.44 4.45 -0.09 3.17 1.43 -1.26 -1.65 118.68 122.29 1m1x s LEU 309 Ca 0.55 2.37 -0.04 0.00 -1.03 0.00 0.00 54.13 55.98 1m1x s LEU 309 Cb -0.19 -3.62 0.05 0.00 0.03 0.00 0.00 46.19 42.46 1m1x s LEU 309 CO 0.24 -0.41 0.18 0.00 0.23 0.00 0.00 176.35 176.59 1m1x s GLN 310 N -0.66 0.09 -0.30 1.70 -2.07 -0.56 -4.93 119.66 112.94 1m1x s GLN 310 Ca 0.52 0.51 -0.29 0.00 -1.82 0.00 0.00 55.36 54.29 1m1x s GLN 310 Cb -0.35 -0.19 -0.01 0.00 -1.09 0.00 0.00 33.01 31.37 1m1x s GLN 310 CO 0.40 -0.23 1.59 -2.00 -1.32 0.00 0.00 175.29 173.73 1m1x s GLU 311 N 1.76 3.64 0.00 9.60 2.12 -1.26 -1.53 118.70 133.03 1m1x s GLU 311 Ca -0.03 1.40 0.00 0.00 0.36 0.00 0.00 54.97 56.70 1m1x s GLU 311 Cb -0.12 -4.06 0.00 0.00 0.26 0.00 0.00 34.13 30.21 1m1x s GLU 311 CO -0.07 -1.48 0.00 1.33 -0.54 0.00 0.00 175.26 174.50 1m1x n VAL 312 N 6.80 0.00 0.00 3.70 0.24 -0.33 -1.59 118.33 127.16 1m1x n VAL 312 Ca 0.19 -0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.49 1m1x n VAL 312 Cb 0.46 0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.91 1m1x n VAL 312 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1m1x n GLY 313 N 0.09 0.56 3.42 7.63 0.00 0.31 -4.08 105.19 113.12 1m1x n GLY 313 Ca 0.00 -1.76 -0.15 0.00 0.00 0.00 0.00 46.02 44.12 1m1x n GLY 313 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1m1x s GLN 314 N -2.91 0.75 -0.22 1.61 0.74 -1.15 -0.80 119.66 117.68 1m1x s GLN 314 Ca 0.00 0.42 -0.02 0.00 0.05 0.00 0.00 55.36 55.81 1m1x s GLN 314 Cb 0.00 0.35 0.01 0.00 1.10 0.00 0.00 33.01 34.47 1m1x s GLN 314 CO 0.00 -0.16 -0.09 0.08 -0.55 0.00 0.00 175.29 174.56 1m1x s VAL 315 N -0.44 2.85 -0.43 1.34 1.01 0.60 -2.35 120.40 122.97 1m1x s VAL 315 Ca -0.06 -0.78 -0.27 0.00 0.00 0.00 0.00 61.98 60.88 1m1x s VAL 315 Cb -0.03 -2.32 0.02 0.00 0.00 0.00 0.00 36.38 34.05 1m1x s VAL 315 CO 0.04 0.39 0.98 -0.55 0.00 0.00 0.00 175.10 175.96 1m1x s SER 316 N 1.38 6.61 -0.86 3.32 0.15 0.39 -1.97 113.70 122.71 1m1x s SER 316 Ca 0.04 0.39 -0.09 0.00 0.70 0.00 0.00 55.95 56.99 1m1x s SER 316 Cb -0.15 -2.48 0.22 0.00 -1.71 0.00 0.00 66.02 61.90 1m1x s SER 316 CO -0.06 -1.03 0.79 -0.69 1.20 0.00 0.00 173.24 173.44 1m1x s VAL 317 N 3.83 5.21 -0.40 4.45 1.01 -1.18 -0.49 120.40 132.83 1m1x s VAL 317 Ca 0.40 -2.95 -0.27 0.00 0.00 0.00 0.00 61.98 59.17 1m1x s VAL 317 Cb -0.10 -4.22 0.02 0.00 0.00 0.00 0.00 36.38 32.08 1m1x s VAL 317 CO 0.25 -1.04 0.98 -0.44 0.00 0.00 0.00 175.10 174.85 1m1x s SER 318 N 1.42 6.67 -0.12 3.32 0.01 0.19 -2.64 113.70 122.55 1m1x s SER 318 Ca 0.22 0.54 -0.19 0.00 1.31 0.00 0.00 55.95 57.83 1m1x s SER 318 Cb -0.12 -2.49 -0.04 0.00 0.21 0.00 0.00 66.02 63.59 1m1x s SER 318 CO -0.08 -0.97 0.50 -0.76 0.41 0.00 0.00 173.24 172.34 1m1x s LEU 319 N 3.73 4.27 -0.30 2.44 1.43 -1.19 -0.24 118.68 128.82 1m1x s LEU 319 Ca 0.41 0.84 -0.27 0.00 -1.03 0.00 0.00 54.13 54.09 1m1x s LEU 319 Cb -0.11 -2.73 0.01 0.00 0.03 0.00 0.00 46.19 43.39 1m1x s LEU 319 CO 0.22 -0.02 0.94 -1.58 0.23 0.00 0.00 176.35 176.15 1m1x s GLN 320 N 0.69 4.05 1.07 1.70 0.74 -1.26 -1.22 119.66 125.42 1m1x s GLN 320 Ca 0.27 0.90 -0.16 0.00 0.05 0.00 0.00 55.36 56.41 1m1x s GLN 320 Cb -0.15 -3.72 0.23 0.00 1.10 0.00 0.00 33.01 30.46 1m1x s GLN 320 CO 0.11 -0.77 1.17 1.03 -0.55 0.00 0.00 175.29 176.28 1m1x s ARG 321 N 3.29 -0.14 0.25 1.67 3.00 0.15 -4.95 118.95 122.22 1m1x s ARG 321 Ca 0.39 -0.04 0.15 0.00 0.00 0.00 0.00 55.73 56.24 1m1x s ARG 321 Cb -0.13 -1.72 0.03 0.00 0.00 0.00 0.00 34.95 33.13 1m1x s ARG 321 CO 0.13 -3.00 1.35 0.00 0.00 0.00 0.00 175.30 173.78 1m1x h ALA 322 N -2.07 0.66 0.00 2.13 0.00 -1.97 -3.26 119.26 114.76 1m1x h ALA 322 Ca -0.47 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 53.94 1m1x h ALA 322 Cb 1.29 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1m1x h ALA 322 CO 0.43 0.66 0.00 -1.13 0.00 0.00 0.00 179.25 179.21 1m1x n SER 323 N -3.17 0.23 0.00 0.00 3.41 -1.26 -4.88 113.62 107.95 1m1x n SER 323 Ca 0.00 0.53 0.00 0.00 -0.26 0.00 0.00 58.87 59.14 1m1x n SER 323 Cb 0.75 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 1m1x n SER 323 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1m1x n GLY 324 N 1.19 0.59 3.98 5.00 0.00 -1.23 -5.08 105.19 109.64 1m1x n GLY 324 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.85 1m1x n GLY 324 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1m1x s ASP 325 N -2.69 4.69 0.10 1.61 -0.00 -1.26 -4.86 116.67 114.26 1m1x s ASP 325 Ca 0.00 -0.23 0.06 0.00 -0.00 0.00 0.00 52.55 52.38 1m1x s ASP 325 Cb 0.00 -0.33 -0.03 0.00 -0.00 0.00 0.00 42.92 42.56 1m1x s ASP 325 CO 0.00 -1.60 -0.16 -0.36 -0.00 0.00 0.00 175.17 173.05 1m1x s PHE 326 N -3.01 1.45 -0.70 4.23 0.40 -1.26 -0.67 117.98 118.42 1m1x s PHE 326 Ca 0.63 -0.49 0.05 0.00 -0.60 0.00 0.00 56.93 56.52 1m1x s PHE 326 Cb -0.07 -0.78 0.24 0.00 0.51 0.00 0.00 43.02 42.91 1m1x s PHE 326 CO 0.42 0.14 0.75 0.94 0.70 0.00 0.00 175.22 178.17 1m1x n GLN 327 N 0.89 2.52 -2.65 0.44 0.00 -0.36 -4.95 117.38 113.27 1m1x n GLN 327 Ca -0.18 -4.62 -0.42 0.00 -0.00 0.00 0.00 57.00 51.77 1m1x n GLN 327 Cb 0.55 -2.29 -0.03 0.00 0.00 0.00 0.00 30.24 28.47 1m1x n GLN 327 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1m1x s THR 328 N -2.24 4.71 0.00 1.69 2.01 -1.26 -3.20 115.64 117.35 1m1x s THR 328 Ca 0.36 1.96 0.00 0.00 0.31 0.00 0.00 61.69 64.32 1m1x s THR 328 Cb 0.09 -4.26 0.00 0.00 0.01 0.00 0.00 72.50 68.34 1m1x s THR 328 CO -0.04 0.08 0.00 0.35 -0.69 0.00 0.00 174.62 174.32 1m1x n THR 329 N 4.22 0.00 -3.93 -0.82 -2.24 -1.08 -4.97 114.28 105.46 1m1x n THR 329 Ca 0.08 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.76 1m1x n THR 329 Cb 0.49 -0.39 -0.10 0.00 -2.10 0.00 0.00 70.33 68.23 1m1x n THR 329 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1m1x s LYS 330 N -1.93 0.46 -0.21 -0.78 3.01 -1.26 -3.09 119.74 115.95 1m1x s LYS 330 Ca 0.00 -0.60 -0.04 0.00 -1.01 0.00 0.00 55.97 54.32 1m1x s LYS 330 Cb 0.00 0.18 0.10 0.00 -1.01 0.00 0.00 37.83 37.10 1m1x s LYS 330 CO 0.00 -0.10 0.23 -1.17 0.51 0.00 0.00 175.35 174.82 1m1x s LEU 331 N -1.69 -0.15 0.47 3.17 2.96 -0.83 -4.98 118.68 117.63 1m1x s LEU 331 Ca -0.11 -0.19 -0.06 0.00 -0.22 0.00 0.00 54.13 53.55 1m1x s LEU 331 Cb -0.06 0.44 -0.04 0.00 0.50 0.00 0.00 46.19 47.03 1m1x s LEU 331 CO -0.01 -0.32 0.78 0.20 -1.32 0.00 0.00 176.35 175.67 1m1x s ASN 332 N 2.34 6.31 1.01 3.68 -0.87 -1.26 -0.29 114.94 125.86 1m1x s ASN 332 Ca 0.07 0.97 -0.16 0.00 -1.57 0.00 0.00 52.86 52.18 1m1x s ASN 332 Cb -0.16 -2.26 0.20 0.00 -0.02 0.00 0.00 41.25 39.01 1m1x s ASN 332 CO -0.12 -0.54 1.19 -0.83 -2.57 0.00 0.00 177.10 174.23 1m1x s GLY 333 N -3.91 1.65 -0.13 0.66 0.00 0.02 -4.94 107.32 100.66 1m1x s GLY 333 Ca 0.48 -0.88 0.06 0.00 0.00 0.00 0.00 44.72 44.38 1m1x s GLY 333 CO 0.42 -0.16 -0.04 0.69 0.00 0.00 0.00 173.10 174.01 1m1x n PHE 334 N -4.05 0.00 -4.29 1.90 3.01 -1.26 -4.94 117.46 107.83 1m1x n PHE 334 Ca 0.11 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.34 1m1x n PHE 334 Cb 0.59 -0.59 -0.08 0.00 -0.01 0.00 0.00 39.48 39.40 1m1x n PHE 334 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 1m1x s GLU 335 N -2.30 2.18 0.00 -1.08 2.02 -1.26 -5.09 118.70 113.17 1m1x s GLU 335 Ca -0.13 -1.58 -0.20 0.00 0.02 0.00 0.00 54.97 53.09 1m1x s GLU 335 Cb 0.04 -2.05 -0.06 0.00 0.10 0.00 0.00 34.13 32.16 1m1x s GLU 335 CO 0.43 0.25 0.56 0.08 0.02 0.00 0.00 175.26 176.60 1m1x s VAL 336 N -2.42 4.90 0.00 2.63 1.01 -1.26 -4.14 120.40 121.12 1m1x s VAL 336 Ca 0.33 1.18 0.00 0.00 0.00 0.00 0.00 61.98 63.49 1m1x s VAL 336 Cb -0.04 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.45 1m1x s VAL 336 CO 0.20 0.45 0.00 0.49 0.00 0.00 0.00 175.10 176.24 1m1x n PHE 337 N 2.50 0.00 -2.63 5.22 3.01 -0.62 -4.97 117.46 119.97 1m1x n PHE 337 Ca -0.08 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.95 1m1x n PHE 337 Cb 0.51 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.95 1m1x n PHE 337 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1m1x s ALA 338 N -1.37 3.34 0.66 4.37 0.00 -1.26 -4.81 121.76 122.68 1m1x s ALA 338 Ca 0.00 0.51 -0.12 0.00 0.00 0.00 0.00 51.96 52.35 1m1x s ALA 338 Cb 0.00 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.69 1m1x s ALA 338 CO 0.00 -0.50 1.05 1.03 0.00 0.00 0.00 175.76 177.35 1m1x s ARG 339 N 1.64 3.15 0.11 0.00 0.52 -1.26 -4.71 118.95 118.40 1m1x s ARG 339 Ca 0.52 0.97 0.00 0.00 -0.52 0.00 0.00 55.73 56.69 1m1x s ARG 339 Cb -0.21 -2.02 0.00 0.00 0.52 0.00 0.00 34.95 33.24 1m1x s ARG 339 CO 0.23 -0.93 0.00 0.34 0.02 0.00 0.00 175.30 174.96 1m1x n PHE 340 N -2.81 -0.19 0.76 -0.53 7.35 -1.26 -3.37 117.46 117.42 1m1x n PHE 340 Ca 0.07 0.03 -0.02 0.00 -0.76 0.00 0.00 57.45 56.78 1m1x n PHE 340 Cb 0.53 0.04 0.02 0.00 0.35 0.00 0.00 39.48 40.43 1m1x n PHE 340 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1m1x n GLY 341 N 3.35 2.17 0.29 7.13 0.00 -1.26 -2.65 105.19 114.21 1m1x n GLY 341 Ca 0.00 -0.12 0.16 0.00 0.00 0.00 0.00 46.02 46.06 1m1x n GLY 341 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1m1x h SER 342 N 0.16 0.00 -0.78 1.61 0.87 -1.83 -3.38 113.55 110.20 1m1x h SER 342 Ca 0.06 0.00 0.09 0.00 -1.23 0.00 0.00 61.79 60.71 1m1x h SER 342 Cb 1.12 0.00 -0.20 0.00 -0.44 0.00 0.00 62.40 62.87 1m1x h SER 342 CO 0.11 0.06 -0.25 0.00 -0.53 0.00 0.00 176.83 176.22 1m1x s ALA 343 N -4.19 -2.85 -0.31 6.23 0.00 -1.25 -4.76 121.76 114.62 1m1x s ALA 343 Ca -0.03 1.24 -0.15 0.00 0.00 0.00 0.00 51.96 53.02 1m1x s ALA 343 Cb 0.13 -2.57 -0.03 0.00 0.00 0.00 0.00 23.12 20.65 1m1x s ALA 343 CO 0.54 -1.83 0.35 0.42 0.00 0.00 0.00 175.76 175.24 1m1x s ILE 344 N 2.87 5.18 -0.44 0.00 1.01 -1.26 -1.45 121.20 127.11 1m1x s ILE 344 Ca 0.15 0.25 0.03 0.00 0.00 0.00 0.00 60.65 61.08 1m1x s ILE 344 Cb -0.08 -3.75 0.12 0.00 0.01 0.00 0.00 42.46 38.76 1m1x s ILE 344 CO -0.24 0.03 0.20 0.00 0.00 0.00 0.00 174.94 174.93 1m1x s ALA 345 N 2.01 2.70 0.05 9.38 0.00 -0.60 -4.81 121.76 130.50 1m1x s ALA 345 Ca 0.12 -2.76 -0.33 0.00 0.00 0.00 0.00 51.96 48.99 1m1x s ALA 345 Cb -0.16 -1.99 -0.12 0.00 0.00 0.00 0.00 23.12 20.85 1m1x s ALA 345 CO 0.11 -1.93 1.79 -0.35 0.00 0.00 0.00 175.76 175.38 1m1x n PRO 346 N 3.64 2.38 -2.67 0.00 -0.04 -1.26 -1.91 135.00 135.14 1m1x n PRO 346 Ca 0.05 0.87 -0.21 0.00 -0.04 0.00 0.00 63.50 64.17 1m1x n PRO 346 Cb 0.36 -2.71 0.04 0.00 -0.04 0.00 0.00 33.50 31.15 1m1x n PRO 346 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1m1x s LEU 347 N 2.83 3.27 0.00 1.53 1.43 -1.16 -4.50 118.68 122.08 1m1x s LEU 347 Ca 0.86 -0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.87 1m1x s LEU 347 Cb -0.62 -2.76 0.00 0.00 0.03 0.00 0.00 46.19 42.84 1m1x s LEU 347 CO 0.43 -1.17 0.06 0.61 0.23 0.00 0.00 176.35 176.51 1m1x n GLY 348 N -2.34 -1.94 2.70 -3.19 0.00 -1.26 -3.76 105.19 95.41 1m1x n GLY 348 Ca 0.09 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 1m1x n GLY 348 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1m1x n ASP 349 N -0.07 -2.46 -0.15 1.61 -0.08 -1.26 -3.04 116.55 111.10 1m1x n ASP 349 Ca 0.00 -3.42 -0.04 0.00 -1.51 0.00 0.00 54.79 49.82 1m1x n ASP 349 Cb 0.00 1.69 -0.03 0.00 2.34 0.00 0.00 41.12 45.12 1m1x n ASP 349 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1m1x n LEU 350 N 1.13 -0.37 0.14 -2.67 4.77 -1.26 0.93 117.00 119.67 1m1x n LEU 350 Ca 0.09 0.65 0.02 0.00 -0.03 0.00 0.00 56.01 56.74 1m1x n LEU 350 Cb 0.65 -0.10 0.11 0.00 -2.33 0.00 0.00 43.42 41.75 1m1x n LEU 350 CO 0.05 -0.52 0.49 -2.24 -1.33 0.00 0.00 177.39 173.84 1m1x h ASP 351 N 0.00 0.00 -4.85 -1.43 -0.00 -1.92 -3.41 116.42 104.81 1m1x h ASP 351 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.09 1m1x h ASP 351 Cb 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.47 1m1x h ASP 351 CO -0.33 0.55 -0.67 1.67 -0.00 0.00 0.00 179.24 180.47 1m1x n GLN 352 N -3.37 -2.57 -0.23 4.15 7.27 0.27 -4.79 117.38 118.11 1m1x n GLN 352 Ca 0.01 2.21 0.00 0.00 0.07 0.00 0.00 57.00 59.29 1m1x n GLN 352 Cb 0.69 -4.84 0.00 0.00 2.41 0.00 0.00 30.24 28.50 1m1x n GLN 352 CO 0.00 0.00 0.00 -0.40 0.07 0.00 0.00 177.06 176.73 1m1x n ASP 353 N 0.21 0.00 0.00 1.69 3.85 -1.26 -4.99 116.55 116.04 1m1x n ASP 353 Ca 0.04 -1.45 0.00 0.00 -0.71 0.00 0.00 54.79 52.68 1m1x n ASP 353 Cb 0.16 -0.09 0.00 0.00 -1.35 0.00 0.00 41.12 39.84 1m1x n ASP 353 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1m1x n GLY 354 N 0.00 0.60 2.82 6.12 0.00 -1.26 -5.05 105.19 108.42 1m1x n GLY 354 Ca 0.00 -0.43 -0.15 0.00 0.00 0.00 0.00 46.02 45.45 1m1x n GLY 354 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1m1x s PHE 355 N -2.00 0.10 0.63 1.61 0.08 -1.26 -4.39 117.98 112.75 1m1x s PHE 355 Ca 0.00 0.06 -0.13 0.00 0.12 0.00 0.00 56.93 56.98 1m1x s PHE 355 Cb 0.00 -0.21 -0.02 0.00 -0.57 0.00 0.00 43.02 42.21 1m1x s PHE 355 CO 0.00 -0.07 1.04 -0.80 -0.10 0.00 0.00 175.22 175.29 1m1x s ASN 356 N 0.72 5.80 0.02 1.36 0.01 -1.26 -4.65 114.94 116.94 1m1x s ASN 356 Ca -0.06 1.61 0.00 0.00 -0.71 0.00 0.00 52.86 53.70 1m1x s ASN 356 Cb -0.09 -2.50 0.00 0.00 0.41 0.00 0.00 41.25 39.07 1m1x s ASN 356 CO -0.02 -1.16 0.01 0.47 -1.51 0.00 0.00 177.10 174.90 1m1x n ASP 357 N -2.61 1.23 -3.62 -1.22 9.92 -1.17 -2.26 116.55 116.81 1m1x n ASP 357 Ca 0.07 -1.08 -0.07 0.00 -0.53 0.00 0.00 54.79 53.18 1m1x n ASP 357 Cb 0.54 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.96 1m1x n ASP 357 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1m1x s ILE 358 N -0.27 0.00 -0.29 0.53 2.07 -0.99 -2.99 121.20 119.27 1m1x s ILE 358 Ca 0.01 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.26 1m1x s ILE 358 Cb -0.00 -1.00 0.09 0.00 0.13 0.00 0.00 42.46 41.67 1m1x s ILE 358 CO 0.01 0.00 0.03 0.00 -1.91 0.00 0.00 174.94 173.07 1m1x s ALA 359 N -0.47 2.08 0.41 1.50 0.00 -0.80 -0.21 121.76 124.26 1m1x s ALA 359 Ca 0.03 -1.79 -0.22 0.00 0.00 0.00 0.00 51.96 49.98 1m1x s ALA 359 Cb -0.03 -1.65 -0.11 0.00 0.00 0.00 0.00 23.12 21.34 1m1x s ALA 359 CO -0.06 -1.50 0.96 0.42 0.00 0.00 0.00 175.76 175.58 1m1x s ILE 360 N 1.33 4.30 -0.03 0.00 1.01 -0.45 -1.55 121.20 125.81 1m1x s ILE 360 Ca 0.04 1.52 0.03 0.00 0.00 0.00 0.00 60.65 62.24 1m1x s ILE 360 Cb -0.18 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.62 1m1x s ILE 360 CO -0.13 -0.22 -0.10 0.00 0.00 0.00 0.00 174.94 174.49 1m1x s ALA 361 N -2.05 0.91 -0.64 9.38 0.00 -0.53 -1.23 121.76 127.60 1m1x s ALA 361 Ca 0.60 -0.36 -0.02 0.00 0.00 0.00 0.00 51.96 52.19 1m1x s ALA 361 Cb -0.12 -0.34 0.16 0.00 0.00 0.00 0.00 23.12 22.83 1m1x s ALA 361 CO 0.16 0.15 0.45 0.00 0.00 0.00 0.00 175.76 176.52 1m1x s ALA 362 N 0.19 3.62 0.56 0.00 0.00 -0.56 -3.47 121.76 122.11 1m1x s ALA 362 Ca -0.03 -3.35 0.25 0.00 0.00 0.00 0.00 51.96 48.83 1m1x s ALA 362 Cb -0.09 -2.61 1.57 0.00 0.00 0.00 0.00 23.12 22.00 1m1x s ALA 362 CO 0.01 -2.11 2.14 -1.35 0.00 0.00 0.00 175.76 174.45 1m1x h PRO 363 N 6.80 0.00 -0.17 0.00 0.11 -1.67 0.31 132.00 137.38 1m1x h PRO 363 Ca -0.00 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.03 1m1x h PRO 363 Cb 0.92 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.99 1m1x h PRO 363 CO 0.72 0.00 -0.24 0.66 -0.21 0.00 0.00 178.00 178.93 1m1x n TYR 364 N -4.07 0.54 -0.54 0.65 4.02 -1.26 -2.66 117.16 113.84 1m1x n TYR 364 Ca 0.00 -1.47 0.00 0.00 -0.01 0.00 0.00 57.90 56.43 1m1x n TYR 364 Cb 0.24 -0.35 0.00 0.00 -0.02 0.00 0.00 39.34 39.21 1m1x n TYR 364 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1m1x n GLY 365 N -1.11 1.03 7.00 2.72 0.00 -1.11 -4.21 105.19 109.51 1m1x n GLY 365 Ca 0.25 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1m1x n GLY 365 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m1x n GLY 366 N 5.00 0.01 3.75 -0.02 0.00 -1.26 -2.24 105.19 110.43 1m1x n GLY 366 Ca 0.00 -0.77 -0.39 0.00 0.00 0.00 0.00 46.02 44.86 1m1x n GLY 366 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1m1x s GLU 367 N 0.00 4.43 -1.30 1.61 1.03 -1.26 -3.97 118.70 119.23 1m1x s GLU 367 Ca 0.00 0.94 -0.08 0.00 0.03 0.00 0.00 54.97 55.86 1m1x s GLU 367 Cb 0.00 -3.35 0.01 0.00 -0.80 0.00 0.00 34.13 29.99 1m1x s GLU 367 CO 0.00 0.34 1.13 -0.25 -1.33 0.00 0.00 175.26 175.15 1m1x n ASP 368 N 2.69 -5.82 -4.44 0.83 8.00 -1.26 -3.28 116.55 113.27 1m1x n ASP 368 Ca -0.04 -0.53 -0.39 0.00 0.71 0.00 0.00 54.79 54.53 1m1x n ASP 368 Cb 0.50 -4.89 -0.07 0.00 -0.02 0.00 0.00 41.12 36.64 1m1x n ASP 368 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1m1x n LYS 369 N -4.77 -1.23 -0.01 -1.24 5.02 -1.20 -4.82 118.16 109.90 1m1x n LYS 369 Ca -0.02 0.18 0.13 0.00 -2.02 0.00 0.00 58.31 56.58 1m1x n LYS 369 Cb 0.57 -4.57 0.68 0.00 -0.02 0.00 0.00 35.03 31.68 1m1x n LYS 369 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1m1x n LYS 370 N -4.22 1.26 -1.62 1.97 5.02 -0.96 -4.43 118.16 115.19 1m1x n LYS 370 Ca 0.02 -0.39 0.00 0.00 -2.02 0.00 0.00 58.31 55.92 1m1x n LYS 370 Cb 0.51 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 34.08 1m1x n LYS 370 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1m1x n GLY 371 N 1.01 -4.08 3.30 0.72 0.00 -0.95 -3.17 105.19 102.03 1m1x n GLY 371 Ca 0.19 -0.73 -0.17 0.00 0.00 0.00 0.00 46.02 45.32 1m1x n GLY 371 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1m1x s ILE 372 N -4.79 1.48 -0.10 -0.61 -0.00 0.11 -0.86 121.20 116.42 1m1x s ILE 372 Ca 0.00 -2.12 0.02 0.00 -0.00 0.00 0.00 60.65 58.56 1m1x s ILE 372 Cb 0.00 -1.93 0.01 0.00 -0.00 0.00 0.00 42.46 40.54 1m1x s ILE 372 CO 0.00 -0.65 -0.18 -0.69 -0.00 0.00 0.00 174.94 173.43 1m1x s VAL 373 N -3.06 1.64 -0.21 8.37 1.01 0.40 -1.49 120.40 127.06 1m1x s VAL 373 Ca 0.19 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.36 1m1x s VAL 373 Cb 0.00 -1.47 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 1m1x s VAL 373 CO 0.04 0.47 0.03 -0.31 0.00 0.00 0.00 175.10 175.33 1m1x s TYR 374 N 0.76 3.10 -0.36 5.22 2.02 -0.36 0.75 117.35 128.48 1m1x s TYR 374 Ca -0.11 -0.30 -0.15 0.00 -0.37 0.00 0.00 57.07 56.15 1m1x s TYR 374 Cb -0.16 -2.12 -0.00 0.00 -0.40 0.00 0.00 41.96 39.28 1m1x s TYR 374 CO 0.02 -0.16 0.32 0.96 -1.57 0.00 0.00 175.55 175.11 1m1x s ILE 375 N 0.98 5.22 -0.23 2.71 -4.36 -0.79 -1.34 121.20 123.38 1m1x s ILE 375 Ca 0.03 -0.23 -0.07 0.00 -0.26 0.00 0.00 60.65 60.11 1m1x s ILE 375 Cb -0.14 -3.83 -0.03 0.00 1.25 0.00 0.00 42.46 39.70 1m1x s ILE 375 CO 0.02 -0.15 0.06 -0.36 0.24 0.00 0.00 174.94 174.76 1m1x s PHE 376 N 1.86 3.11 0.48 1.37 0.40 0.71 -0.95 117.98 124.96 1m1x s PHE 376 Ca 0.08 -0.33 -0.13 0.00 -0.60 0.00 0.00 56.93 55.96 1m1x s PHE 376 Cb -0.17 -2.19 -0.07 0.00 0.51 0.00 0.00 43.02 41.10 1m1x s PHE 376 CO 0.11 -0.25 0.90 -0.80 0.70 0.00 0.00 175.22 175.87 1m1x s ASN 377 N 1.33 6.52 0.49 1.36 0.02 -1.26 -2.34 114.94 121.06 1m1x s ASN 377 Ca 0.05 1.35 0.03 0.00 -1.02 0.00 0.00 52.86 53.27 1m1x s ASN 377 Cb -0.15 -2.42 0.02 0.00 0.02 0.00 0.00 41.25 38.72 1m1x s ASN 377 CO 0.03 -0.54 0.69 -0.83 0.02 0.00 0.00 177.10 176.47 1m1x s GLY 378 N -3.28 1.80 0.18 0.66 0.00 -0.96 -1.63 107.32 104.10 1m1x s GLY 378 Ca 0.55 -1.38 -0.23 0.00 0.00 0.00 0.00 44.72 43.66 1m1x s GLY 378 CO 0.34 -1.15 0.74 1.09 0.00 0.00 0.00 173.10 174.12 1m1x s ARG 379 N -4.59 1.39 0.47 2.90 1.70 -0.33 -4.79 118.95 115.70 1m1x s ARG 379 Ca 0.54 -0.67 0.22 0.00 -0.47 0.00 0.00 55.73 55.36 1m1x s ARG 379 Cb -0.10 0.54 1.23 0.00 -0.57 0.00 0.00 34.95 36.05 1m1x s ARG 379 CO 0.36 -0.63 1.90 0.66 -1.08 0.00 0.00 175.30 176.52 1m1x h SER 380 N 2.00 0.23 0.24 -2.89 4.64 -1.90 -1.93 113.55 113.94 1m1x h SER 380 Ca -0.25 0.02 -0.22 0.00 -0.47 0.00 0.00 61.79 60.87 1m1x h SER 380 Cb 1.27 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1m1x h SER 380 CO 0.30 0.10 -0.87 0.71 -0.87 0.00 0.00 176.83 176.20 1m1x h THR 381 N 0.24 1.37 0.00 2.95 1.35 -1.96 -3.49 112.91 113.37 1m1x h THR 381 Ca 0.41 -2.29 0.00 0.00 -0.55 0.00 0.00 66.41 63.97 1m1x h THR 381 Cb 1.23 2.28 0.00 0.00 -1.73 0.00 0.00 68.15 69.93 1m1x h THR 381 CO -0.10 0.69 0.00 0.61 -0.25 0.00 0.00 175.52 176.48 1m1x n GLY 382 N 0.82 -0.41 3.71 5.82 0.00 -0.73 -5.10 105.19 109.31 1m1x n GLY 382 Ca -0.06 -0.44 -0.35 0.00 0.00 0.00 0.00 46.02 45.16 1m1x n GLY 382 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1m1x s LEU 383 N 0.00 4.12 -0.63 0.99 2.96 -1.26 -1.18 118.68 123.68 1m1x s LEU 383 Ca 0.00 0.21 -0.26 0.00 -0.22 0.00 0.00 54.13 53.85 1m1x s LEU 383 Cb 0.00 -2.06 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 1m1x s LEU 383 CO 0.00 0.19 1.95 0.21 -1.32 0.00 0.00 176.35 177.38 1m1x s ASN 384 N 0.30 5.12 0.00 3.68 3.04 -0.64 -4.83 114.94 121.61 1m1x s ASN 384 Ca 0.07 0.34 0.00 0.00 0.04 0.00 0.00 52.86 53.31 1m1x s ASN 384 Cb -0.11 -2.53 0.00 0.00 -1.54 0.00 0.00 41.25 37.07 1m1x s ASN 384 CO -0.01 -2.51 0.58 0.00 -3.04 0.00 0.00 177.10 172.12 1m1x n ALA 385 N 13.40 0.98 -2.81 1.71 0.00 -1.26 -4.37 120.51 128.16 1m1x n ALA 385 Ca 0.25 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.32 1m1x n ALA 385 Cb 0.52 -0.76 -0.11 0.00 0.00 0.00 0.00 19.45 19.10 1m1x n ALA 385 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1m1x s VAL 386 N -2.17 4.85 0.15 0.00 -7.23 -1.26 -5.05 120.40 109.69 1m1x s VAL 386 Ca 0.00 0.01 -0.34 0.00 -1.81 0.00 0.00 61.98 59.84 1m1x s VAL 386 Cb 0.00 -3.27 -0.16 0.00 0.56 0.00 0.00 36.38 33.51 1m1x s VAL 386 CO 0.00 0.33 1.18 -2.65 -0.31 0.00 0.00 175.10 173.65 1m1x n PRO 387 N 4.69 1.10 0.00 4.82 -0.02 -1.26 -4.71 135.00 139.63 1m1x n PRO 387 Ca -0.15 0.39 0.12 0.00 -2.02 0.00 0.00 63.50 61.84 1m1x n PRO 387 Cb 0.52 -1.91 0.15 0.00 -0.02 0.00 0.00 33.50 32.24 1m1x n PRO 387 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1m1x n SER 388 N 2.09 1.74 0.00 2.55 7.64 -0.12 -4.98 113.62 122.55 1m1x n SER 388 Ca 0.16 -1.34 0.00 0.00 1.01 0.00 0.00 58.87 58.70 1m1x n SER 388 Cb 0.23 0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 1m1x n SER 388 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1m1x n GLN 389 N -0.13 0.00 -4.00 1.43 7.27 -1.24 -4.78 117.38 115.93 1m1x n GLN 389 Ca 0.11 0.00 -0.24 0.00 0.07 0.00 0.00 57.00 56.94 1m1x n GLN 389 Cb 0.43 0.00 -0.17 0.00 2.41 0.00 0.00 30.24 32.91 1m1x n GLN 389 CO 0.00 0.00 0.00 0.96 0.07 0.00 0.00 177.06 178.09 1m1x s ILE 390 N -2.00 0.76 -0.22 1.69 -4.36 -1.26 -1.89 121.20 113.92 1m1x s ILE 390 Ca 0.00 -0.16 -0.15 0.00 -0.26 0.00 0.00 60.65 60.08 1m1x s ILE 390 Cb 0.00 -0.81 -0.04 0.00 1.25 0.00 0.00 42.46 42.86 1m1x s ILE 390 CO 0.00 0.31 0.35 -0.76 0.24 0.00 0.00 174.94 175.08 1m1x s LEU 391 N 1.51 4.12 -0.11 0.37 2.01 0.23 -4.87 118.68 121.94 1m1x s LEU 391 Ca -0.00 0.39 -0.02 0.00 0.01 0.00 0.00 54.13 54.51 1m1x s LEU 391 Cb -0.13 -2.42 -0.03 0.00 0.01 0.00 0.00 46.19 43.62 1m1x s LEU 391 CO -0.04 -0.08 -0.04 -1.61 1.01 0.00 0.00 176.35 175.59 1m1x s GLU 392 N 1.45 3.19 0.79 1.70 2.02 -1.26 0.15 118.70 126.74 1m1x s GLU 392 Ca 0.16 -0.50 -0.13 0.00 0.02 0.00 0.00 54.97 54.52 1m1x s GLU 392 Cb -0.15 -2.77 0.07 0.00 0.10 0.00 0.00 34.13 31.38 1m1x s GLU 392 CO 0.08 0.50 1.17 0.20 0.02 0.00 0.00 175.26 177.22 1m1x s GLY 393 N -0.33 2.04 0.00 -1.39 0.00 -0.04 -4.96 107.32 102.63 1m1x s GLY 393 Ca 0.06 0.68 0.00 0.00 0.00 0.00 0.00 44.72 45.46 1m1x s GLY 393 CO 0.02 1.08 0.71 -1.06 0.00 0.00 0.00 173.10 173.86 1m1x n GLN 394 N -3.29 1.35 -4.37 2.90 3.00 -1.26 -4.91 117.38 110.80 1m1x n GLN 394 Ca 0.12 -0.96 -0.35 0.00 -0.01 0.00 0.00 57.00 55.80 1m1x n GLN 394 Cb 0.51 -0.82 -0.10 0.00 0.00 0.00 0.00 30.24 29.83 1m1x n GLN 394 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 1m1x s TRP 395 N -0.50 3.15 0.42 1.08 0.52 -1.26 -5.11 118.94 117.24 1m1x s TRP 395 Ca 0.00 0.15 -0.12 0.00 0.02 0.00 0.00 56.10 56.16 1m1x s TRP 395 Cb 0.00 -1.81 -0.07 0.00 -1.15 0.00 0.00 33.47 30.45 1m1x s TRP 395 CO 0.00 0.42 0.81 0.00 0.02 0.00 0.00 176.95 178.20 1m1x s ALA 396 N -0.76 3.29 0.44 0.98 0.00 -1.26 -4.77 121.76 119.68 1m1x s ALA 396 Ca 0.12 -0.12 -0.25 0.00 0.00 0.00 0.00 51.96 51.70 1m1x s ALA 396 Cb -0.12 -2.78 -0.08 0.00 0.00 0.00 0.00 23.12 20.14 1m1x s ALA 396 CO 0.02 -0.05 1.33 0.00 0.00 0.00 0.00 175.76 177.07 1m1x s ALA 397 N -2.41 3.18 -0.26 0.00 0.00 -1.26 -4.81 121.76 116.19 1m1x s ALA 397 Ca 0.53 1.28 -0.14 0.00 0.00 0.00 0.00 51.96 53.63 1m1x s ALA 397 Cb -0.10 -3.52 -0.11 0.00 0.00 0.00 0.00 23.12 19.39 1m1x s ALA 397 CO 0.31 -0.98 -0.35 0.54 0.00 0.00 0.00 175.76 175.29 1m1x n ARG 398 N -0.15 0.56 0.00 0.00 3.00 -1.26 -4.87 116.66 113.95 1m1x n ARG 398 Ca 0.05 0.25 0.00 0.00 -0.01 0.00 0.00 57.85 58.14 1m1x n ARG 398 Cb 0.44 -1.45 0.00 0.00 0.00 0.00 0.00 32.46 31.45 1m1x n ARG 398 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 1m1x n SER 399 N -4.23 0.00 -3.72 0.55 3.41 -1.26 -5.11 113.62 103.26 1m1x n SER 399 Ca -0.49 -0.25 -0.06 0.00 -0.26 0.00 0.00 58.87 57.81 1m1x n SER 399 Cb 0.84 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.77 1m1x n SER 399 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1m1x s MET 400 N 0.00 1.34 0.20 4.33 0.23 -1.26 -5.14 119.30 119.00 1m1x s MET 400 Ca 0.00 -0.69 -0.32 0.00 -1.03 0.00 0.00 55.69 53.64 1m1x s MET 400 Cb 0.00 0.49 -0.14 0.00 -1.53 0.00 0.00 34.83 33.65 1m1x s MET 400 CO 0.00 -0.61 1.47 -0.35 -2.03 0.00 0.00 175.02 173.50 1m1x n PRO 401 N -0.43 2.05 -0.27 3.16 -0.04 -1.26 -4.67 135.00 133.54 1m1x n PRO 401 Ca -0.07 0.73 0.33 0.00 -0.04 0.00 0.00 63.50 64.45 1m1x n PRO 401 Cb 0.61 -2.43 0.73 0.00 -0.04 0.00 0.00 33.50 32.37 1m1x n PRO 401 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1m1x h PRO 402 N 4.87 0.00 -2.87 0.54 0.13 -1.77 -3.32 132.00 129.57 1m1x h PRO 402 Ca -0.45 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.29 1m1x h PRO 402 Cb 1.27 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.36 1m1x h PRO 402 CO 0.81 0.00 -0.48 0.43 -0.23 0.00 0.00 178.00 178.53 1m1x n SER 403 N -4.08 -5.50 -4.64 1.44 7.64 -1.26 -0.09 113.62 107.13 1m1x n SER 403 Ca 0.23 0.09 -0.49 0.00 1.01 0.00 0.00 58.87 59.70 1m1x n SER 403 Cb 1.18 -4.63 -0.05 0.00 -1.01 0.00 0.00 64.21 59.70 1m1x n SER 403 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1m1x n PHE 404 N -3.67 2.16 0.00 1.43 7.35 -1.24 -1.16 117.46 122.32 1m1x n PHE 404 Ca -0.23 0.09 0.00 0.00 -0.76 0.00 0.00 57.45 56.56 1m1x n PHE 404 Cb 0.67 -2.63 0.00 0.00 0.35 0.00 0.00 39.48 37.87 1m1x n PHE 404 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1m1x n GLY 405 N 4.82 0.52 0.34 7.13 0.00 -1.25 -3.87 105.19 112.88 1m1x n GLY 405 Ca 0.27 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.25 1m1x n GLY 405 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1m1x h TYR 406 N 0.00 1.13 -3.31 1.61 3.20 -1.23 -3.40 116.97 114.97 1m1x h TYR 406 Ca 0.00 0.02 -0.44 0.00 3.14 0.00 0.00 58.73 61.45 1m1x h TYR 406 Cb 0.00 -0.38 -0.37 0.00 1.54 0.00 0.00 36.73 37.52 1m1x h TYR 406 CO 0.00 0.72 -0.77 -1.54 -1.64 0.00 0.00 178.16 174.93 1m1x s SER 407 N -6.03 1.45 0.04 -2.11 1.04 -1.25 -4.67 113.70 102.17 1m1x s SER 407 Ca -0.13 -0.12 -0.01 0.00 0.48 0.00 0.00 55.95 56.17 1m1x s SER 407 Cb 0.17 -0.49 -0.03 0.00 0.10 0.00 0.00 66.02 65.76 1m1x s SER 407 CO 0.80 -0.14 -0.03 0.00 0.98 0.00 0.00 173.24 174.85 1m1x s MET 408 N 1.60 0.54 -0.16 4.02 0.23 -1.26 0.26 119.30 124.52 1m1x s MET 408 Ca -0.00 -1.05 -0.08 0.00 -1.03 0.00 0.00 55.69 53.53 1m1x s MET 408 Cb -0.13 0.16 0.06 0.00 -1.53 0.00 0.00 34.83 33.39 1m1x s MET 408 CO -0.04 -0.09 0.37 0.21 -2.03 0.00 0.00 175.02 173.44 1m1x s LYS 409 N -3.21 0.33 -0.25 3.16 2.47 0.38 -4.84 119.74 117.78 1m1x s LYS 409 Ca 0.01 0.78 -0.15 0.00 -1.56 0.00 0.00 55.97 55.05 1m1x s LYS 409 Cb 0.03 0.02 0.07 0.00 -1.46 0.00 0.00 37.83 36.49 1m1x s LYS 409 CO -0.07 -0.19 0.62 0.20 0.16 0.00 0.00 175.35 176.07 1m1x s GLY 410 N 1.67 -0.55 0.00 5.54 0.00 -1.26 0.18 107.32 112.89 1m1x s GLY 410 Ca -0.07 2.17 0.00 0.00 0.00 0.00 0.00 44.72 46.82 1m1x s GLY 410 CO -0.12 2.18 0.00 0.00 0.00 0.00 0.00 173.10 175.17 1m1x n ALA 411 N 4.22 0.00 -2.85 3.20 0.00 -1.13 -3.64 120.51 120.32 1m1x n ALA 411 Ca -0.21 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 52.87 1m1x n ALA 411 Cb 0.58 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.96 1m1x n ALA 411 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1m1x s THR 412 N 0.00 5.33 -1.46 0.00 -4.23 -1.26 -4.46 115.64 109.57 1m1x s THR 412 Ca 0.00 0.12 -0.14 0.00 -1.18 0.00 0.00 61.69 60.50 1m1x s THR 412 Cb 0.00 -3.32 0.04 0.00 1.34 0.00 0.00 72.50 70.56 1m1x s THR 412 CO 0.00 0.60 2.24 -0.67 -0.54 0.00 0.00 174.62 176.25 1m1x n ASP 413 N 1.94 4.12 -0.31 3.99 -0.08 -1.26 -3.19 116.55 121.76 1m1x n ASP 413 Ca -0.19 -2.85 0.27 0.00 -1.51 0.00 0.00 54.79 50.51 1m1x n ASP 413 Cb 0.55 -1.65 0.60 0.00 2.34 0.00 0.00 41.12 42.96 1m1x n ASP 413 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1m1x h ILE 414 N 3.95 0.50 -5.42 5.18 2.10 -1.85 -3.42 117.51 118.53 1m1x h ILE 414 Ca 0.57 -0.08 -0.29 0.00 1.08 0.00 0.00 64.86 66.14 1m1x h ILE 414 Cb 0.63 0.23 0.02 0.00 -1.09 0.00 0.00 36.82 36.61 1m1x h ILE 414 CO 1.87 0.04 -0.02 -0.90 -1.08 0.00 0.00 178.15 178.06 1m1x n ASP 415 N -4.47 1.21 0.51 2.19 3.85 -1.26 -4.80 116.55 113.78 1m1x n ASP 415 Ca 0.25 -1.89 -0.21 0.00 -0.71 0.00 0.00 54.79 52.23 1m1x n ASP 415 Cb 0.99 -0.28 -0.10 0.00 -1.35 0.00 0.00 41.12 40.38 1m1x n ASP 415 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.20 176.26 1m1x h LYS 416 N 0.00 -1.26 -6.03 0.11 -0.00 -1.96 -3.46 116.57 103.97 1m1x h LYS 416 Ca -0.17 0.09 -0.62 0.00 -0.00 0.00 0.00 60.65 59.95 1m1x h LYS 416 Cb 0.76 0.29 0.16 0.00 -0.00 0.00 0.00 32.23 33.43 1m1x h LYS 416 CO 0.23 -0.84 -0.92 0.27 -0.00 0.00 0.00 179.45 178.19 1m1x n ASN 417 N -5.66 -2.78 0.00 7.07 0.23 -1.26 -4.83 115.26 108.03 1m1x n ASN 417 Ca -0.16 0.80 0.02 0.00 -0.53 0.00 0.00 54.58 54.71 1m1x n ASN 417 Cb 0.52 -0.90 0.10 0.00 -2.08 0.00 0.00 39.78 37.43 1m1x n ASN 417 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1m1x n GLY 418 N 2.31 -0.38 3.61 4.83 0.00 -1.26 -4.80 105.19 109.50 1m1x n GLY 418 Ca 0.11 -0.02 -0.26 0.00 0.00 0.00 0.00 46.02 45.84 1m1x n GLY 418 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1m1x s TYR 419 N -2.00 2.72 0.00 1.61 1.51 -1.26 -5.00 117.35 114.92 1m1x s TYR 419 Ca 0.05 -0.19 0.00 0.00 -1.01 0.00 0.00 57.07 55.92 1m1x s TYR 419 Cb 0.02 -1.31 0.00 0.00 -0.11 0.00 0.00 41.96 40.56 1m1x s TYR 419 CO 0.04 0.52 0.00 -2.30 -1.11 0.00 0.00 175.55 172.70 1m1x n PRO 420 N -0.08 1.70 -3.61 -1.71 -0.02 -1.26 -4.57 135.00 125.45 1m1x n PRO 420 Ca -0.10 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.33 1m1x n PRO 420 Cb 0.56 0.00 0.02 0.00 -0.02 0.00 0.00 33.50 34.06 1m1x n PRO 420 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1m1x n ASP 421 N 0.00 -1.85 -3.72 2.55 9.92 -1.19 -3.53 116.55 118.73 1m1x n ASP 421 Ca 0.00 -2.14 -0.13 0.00 -0.53 0.00 0.00 54.79 51.99 1m1x n ASP 421 Cb 0.00 3.05 -0.09 0.00 -0.64 0.00 0.00 41.12 43.43 1m1x n ASP 421 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1m1x s LEU 422 N 0.00 0.31 -0.13 0.64 2.96 -1.00 -2.82 118.68 118.64 1m1x s LEU 422 Ca 0.18 0.84 0.03 0.00 -0.22 0.00 0.00 54.13 54.96 1m1x s LEU 422 Cb -0.04 1.54 0.01 0.00 0.50 0.00 0.00 46.19 48.20 1m1x s LEU 422 CO 0.08 -0.19 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.07 1m1x s ILE 423 N 0.10 2.12 0.15 6.68 1.01 0.48 -1.40 121.20 130.33 1m1x s ILE 423 Ca -0.01 -0.97 0.10 0.00 0.00 0.00 0.00 60.65 59.76 1m1x s ILE 423 Cb -0.03 -1.84 -0.04 0.00 0.01 0.00 0.00 42.46 40.56 1m1x s ILE 423 CO 0.01 0.55 -0.19 -0.69 0.00 0.00 0.00 174.94 174.62 1m1x s VAL 424 N 0.66 2.70 -0.25 2.92 1.01 -0.91 0.15 120.40 126.67 1m1x s VAL 424 Ca -0.11 -1.70 -0.01 0.00 0.00 0.00 0.00 61.98 60.16 1m1x s VAL 424 Cb -0.16 -2.26 0.08 0.00 0.00 0.00 0.00 36.38 34.03 1m1x s VAL 424 CO 0.02 0.01 0.04 -0.83 0.00 0.00 0.00 175.10 174.33 1m1x s GLY 425 N -2.38 1.00 -0.59 4.51 0.00 0.14 -1.56 107.32 108.45 1m1x s GLY 425 Ca 0.19 -1.24 -0.21 0.00 0.00 0.00 0.00 44.72 43.46 1m1x s GLY 425 CO 0.10 1.37 0.78 0.00 0.00 0.00 0.00 173.10 175.35 1m1x s ALA 426 N 1.64 3.30 -1.65 3.20 0.00 -0.44 -3.76 121.76 124.05 1m1x s ALA 426 Ca 0.02 -1.91 0.26 0.00 0.00 0.00 0.00 51.96 50.33 1m1x s ALA 426 Cb -0.18 -3.60 0.62 0.00 0.00 0.00 0.00 23.12 19.96 1m1x s ALA 426 CO -0.14 -2.40 1.48 1.97 0.00 0.00 0.00 175.76 176.68 1m1x n PHE 427 N 6.80 0.00 1.99 0.00 1.16 -0.92 -0.41 117.46 126.08 1m1x n PHE 427 Ca -0.06 0.00 0.15 0.00 -1.87 0.00 0.00 57.45 55.67 1m1x n PHE 427 Cb 0.44 -0.13 0.89 0.00 -1.61 0.00 0.00 39.48 39.08 1m1x n PHE 427 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1m1x n GLY 428 N 1.38 -0.97 0.00 4.97 0.00 0.88 -2.80 105.19 108.64 1m1x n GLY 428 Ca 0.11 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1m1x n GLY 428 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1m1x n VAL 429 N -0.94 0.00 -2.82 1.61 0.24 -1.24 -4.12 118.33 111.06 1m1x n VAL 429 Ca 0.23 -0.03 -0.06 0.00 -2.04 0.00 0.00 64.34 62.43 1m1x n VAL 429 Cb 0.11 1.62 0.01 0.00 -1.47 0.00 0.00 33.84 34.11 1m1x n VAL 429 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1m1x n ASP 430 N -0.02 -7.67 -3.47 -1.34 9.92 -0.97 -4.82 116.55 108.18 1m1x n ASP 430 Ca 0.00 0.42 -0.12 0.00 -0.53 0.00 0.00 54.79 54.57 1m1x n ASP 430 Cb 0.16 -5.19 -0.03 0.00 -0.64 0.00 0.00 41.12 35.42 1m1x n ASP 430 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1m1x s ARG 431 N -2.61 1.23 -0.03 -1.24 0.52 0.46 -2.77 118.95 114.50 1m1x s ARG 431 Ca 0.20 -0.52 -0.03 0.00 -0.52 0.00 0.00 55.73 54.86 1m1x s ARG 431 Cb -0.06 0.56 0.01 0.00 0.52 0.00 0.00 34.95 35.99 1m1x s ARG 431 CO 0.73 -0.52 0.09 0.00 0.02 0.00 0.00 175.30 175.61 1m1x s ALA 432 N -3.74 -0.18 -0.05 2.13 0.00 -0.82 -1.32 121.76 117.78 1m1x s ALA 432 Ca 0.01 0.30 0.03 0.00 0.00 0.00 0.00 51.96 52.31 1m1x s ALA 432 Cb -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.93 1m1x s ALA 432 CO -0.13 -0.06 -0.14 0.42 0.00 0.00 0.00 175.76 175.85 1m1x s ILE 433 N 0.31 1.23 -0.36 0.00 1.01 -0.60 -0.29 121.20 122.50 1m1x s ILE 433 Ca -0.02 -0.58 -0.15 0.00 0.00 0.00 0.00 60.65 59.89 1m1x s ILE 433 Cb -0.03 -1.08 -0.01 0.00 0.01 0.00 0.00 42.46 41.35 1m1x s ILE 433 CO -0.01 0.37 0.36 -0.22 0.00 0.00 0.00 174.94 175.43 1m1x s LEU 434 N 0.26 4.54 -0.45 2.97 1.98 0.18 -2.15 118.68 126.01 1m1x s LEU 434 Ca -0.07 -0.35 -0.12 0.00 -2.89 0.00 0.00 54.13 50.69 1m1x s LEU 434 Cb -0.12 -2.31 0.08 0.00 0.66 0.00 0.00 46.19 44.49 1m1x s LEU 434 CO 0.02 -0.37 0.34 -0.31 -1.89 0.00 0.00 176.35 174.14 1m1x s TYR 435 N 1.98 3.30 -0.06 5.38 4.12 -0.49 0.09 117.35 131.67 1m1x s TYR 435 Ca 0.11 -1.26 -0.28 0.00 0.02 0.00 0.00 57.07 55.66 1m1x s TYR 435 Cb -0.17 -3.12 -0.02 0.00 -1.52 0.00 0.00 41.96 37.13 1m1x s TYR 435 CO 0.12 -0.84 0.92 1.03 0.02 0.00 0.00 175.55 176.80 1m1x s ARG 436 N 1.53 4.47 0.27 -0.62 0.52 -1.26 -2.39 118.95 121.47 1m1x s ARG 436 Ca 0.04 1.26 -0.29 0.00 -0.52 0.00 0.00 55.73 56.22 1m1x s ARG 436 Cb -0.24 -3.49 -0.10 0.00 0.52 0.00 0.00 34.95 31.64 1m1x s ARG 436 CO 0.04 -0.13 1.25 0.00 0.02 0.00 0.00 175.30 176.47 1m1x s ALA 437 N 1.38 3.48 0.16 2.13 0.00 -1.23 -1.20 121.76 126.47 1m1x s ALA 437 Ca 0.47 1.10 0.03 0.00 0.00 0.00 0.00 51.96 53.56 1m1x s ALA 437 Cb -0.19 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 1m1x s ALA 437 CO 0.22 -0.47 0.27 1.03 0.00 0.00 0.00 175.76 176.81 1m1x s ARG 438 N -1.16 3.38 0.34 0.00 0.52 -1.22 -4.80 118.95 116.00 1m1x s ARG 438 Ca 0.50 -0.64 -0.29 0.00 -0.52 0.00 0.00 55.73 54.78 1m1x s ARG 438 Cb -0.36 -2.92 -0.11 0.00 0.52 0.00 0.00 34.95 32.07 1m1x s ARG 438 CO 0.45 0.51 1.51 -2.30 0.02 0.00 0.00 175.30 175.49 1m1x n PRO 439 N -0.58 2.62 -4.05 3.54 -0.02 -1.26 -4.84 135.00 130.41 1m1x n PRO 439 Ca -0.07 0.93 -0.35 0.00 -2.02 0.00 0.00 63.50 61.98 1m1x n PRO 439 Cb 0.54 -2.66 -0.14 0.00 -0.02 0.00 0.00 33.50 31.23 1m1x n PRO 439 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1m1x s VAL 440 N -0.70 3.53 -0.07 -1.45 1.01 -1.26 -1.01 120.40 120.45 1m1x s VAL 440 Ca 0.57 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 62.11 1m1x s VAL 440 Cb -0.49 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 1m1x s VAL 440 CO 0.58 0.43 -0.07 -0.63 0.00 0.00 0.00 175.10 175.42 1m1x s ILE 441 N 1.22 3.71 -0.19 2.22 1.01 0.50 -4.07 121.20 125.59 1m1x s ILE 441 Ca 0.03 -0.48 -0.03 0.00 0.00 0.00 0.00 60.65 60.18 1m1x s ILE 441 Cb -0.14 -2.52 -0.01 0.00 0.01 0.00 0.00 42.46 39.80 1m1x s ILE 441 CO -0.01 0.59 -0.07 0.42 0.00 0.00 0.00 174.94 175.87 1m1x s THR 442 N -0.75 3.22 0.00 2.92 -4.23 -1.26 -0.03 115.64 115.51 1m1x s THR 442 Ca 0.11 -0.56 0.06 0.00 -1.18 0.00 0.00 61.69 60.12 1m1x s THR 442 Cb -0.11 -2.43 -0.03 0.00 1.34 0.00 0.00 72.50 71.27 1m1x s THR 442 CO 0.02 0.46 -0.17 0.54 -0.54 0.00 0.00 174.62 174.93 1m1x s VAL 443 N 1.17 2.87 -0.18 2.29 0.11 -1.26 -2.88 120.40 122.53 1m1x s VAL 443 Ca 0.02 -0.99 0.01 0.00 -2.93 0.00 0.00 61.98 58.09 1m1x s VAL 443 Cb -0.14 -2.16 0.03 0.00 -1.53 0.00 0.00 36.38 32.57 1m1x s VAL 443 CO -0.02 0.46 -0.16 0.20 -3.33 0.00 0.00 175.10 172.24 1m1x s ASN 444 N -1.11 3.08 0.22 3.54 0.02 0.32 -4.99 114.94 116.03 1m1x s ASN 444 Ca 0.13 -0.66 0.06 0.00 -1.02 0.00 0.00 52.86 51.37 1m1x s ASN 444 Cb -0.11 -1.35 -0.04 0.00 0.02 0.00 0.00 41.25 39.78 1m1x s ASN 444 CO 0.03 -0.05 0.22 0.00 0.02 0.00 0.00 177.10 177.32 1m1x s ALA 445 N 1.36 3.66 -0.07 0.60 0.00 -1.26 0.27 121.76 126.32 1m1x s ALA 445 Ca 0.03 -1.32 -0.05 0.00 0.00 0.00 0.00 51.96 50.62 1m1x s ALA 445 Cb -0.14 -1.41 0.03 0.00 0.00 0.00 0.00 23.12 21.59 1m1x s ALA 445 CO -0.11 0.32 0.18 0.20 0.00 0.00 0.00 175.76 176.34 1m1x s GLY 446 N -3.67 -0.11 -0.04 0.00 0.00 0.57 -4.95 107.32 99.12 1m1x s GLY 446 Ca 0.33 0.59 -0.01 0.00 0.00 0.00 0.00 44.72 45.63 1m1x s GLY 446 CO 0.25 0.65 0.07 -2.27 0.00 0.00 0.00 173.10 171.80 1m1x s LEU 447 N 0.48 0.50 -0.17 0.66 2.96 -1.26 -1.56 118.68 120.29 1m1x s LEU 447 Ca -0.03 0.11 -0.07 0.00 -0.22 0.00 0.00 54.13 53.92 1m1x s LEU 447 Cb -0.05 -0.03 0.07 0.00 0.50 0.00 0.00 46.19 46.69 1m1x s LEU 447 CO -0.02 -0.20 0.39 -0.70 -1.32 0.00 0.00 176.35 174.50 1m1x s GLU 448 N 1.70 0.32 -0.10 1.98 2.56 -1.01 -4.83 118.70 119.32 1m1x s GLU 448 Ca -0.01 0.89 -0.14 0.00 0.00 0.00 0.00 54.97 55.70 1m1x s GLU 448 Cb -0.12 0.14 -0.05 0.00 2.00 0.00 0.00 34.13 36.09 1m1x s GLU 448 CO -0.04 -0.22 0.35 0.54 -0.56 0.00 0.00 175.26 175.34 1m1x s VAL 449 N 2.09 5.22 0.00 3.70 0.11 -1.26 -2.23 120.40 128.02 1m1x s VAL 449 Ca -0.05 0.69 0.00 0.00 -2.93 0.00 0.00 61.98 59.69 1m1x s VAL 449 Cb -0.11 -3.67 0.00 0.00 -1.53 0.00 0.00 36.38 31.07 1m1x s VAL 449 CO -0.12 0.45 0.00 -1.22 -3.33 0.00 0.00 175.10 170.88 1m1x n TYR 450 N 2.95 0.00 -1.84 1.54 0.53 0.17 -4.27 117.16 116.23 1m1x n TYR 450 Ca -0.12 0.00 -0.42 0.00 -1.02 0.00 0.00 57.90 56.34 1m1x n TYR 450 Cb 0.52 0.00 -0.03 0.00 -1.03 0.00 0.00 39.34 38.80 1m1x n TYR 450 CO 0.00 0.00 0.00 -2.14 -1.02 0.00 0.00 176.86 173.70 1m1x s PRO 451 N 0.00 4.17 -0.04 -0.72 0.02 -1.26 -4.79 135.00 132.38 1m1x s PRO 451 Ca 0.00 2.44 -0.04 0.00 0.02 0.00 0.00 61.00 63.42 1m1x s PRO 451 Cb 0.00 -3.56 -0.28 0.00 0.02 0.00 0.00 34.50 30.69 1m1x s PRO 451 CO 0.00 -0.77 0.70 1.03 -0.33 0.00 0.00 177.00 177.63 1m1x h SER 452 N 8.29 0.42 -3.68 2.53 0.87 -1.94 -3.43 113.55 116.61 1m1x h SER 452 Ca -0.44 -0.68 -0.77 0.00 -1.23 0.00 0.00 61.79 58.68 1m1x h SER 452 Cb 1.21 -0.14 -0.27 0.00 -0.44 0.00 0.00 62.40 62.76 1m1x h SER 452 CO 0.94 1.58 -0.06 -0.63 -0.53 0.00 0.00 176.83 178.13 1m1x s ILE 453 N -2.59 5.19 0.27 2.23 1.01 -1.26 -1.25 121.20 124.80 1m1x s ILE 453 Ca -0.13 -2.29 -0.30 0.00 0.00 0.00 0.00 60.65 57.92 1m1x s ILE 453 Cb 0.06 -4.26 -0.11 0.00 0.01 0.00 0.00 42.46 38.16 1m1x s ILE 453 CO 0.84 -0.96 1.58 -0.76 0.00 0.00 0.00 174.94 175.63 1m1x s LEU 454 N 0.50 4.36 -0.21 2.97 1.43 -0.46 -4.61 118.68 122.66 1m1x s LEU 454 Ca 0.14 2.87 -0.03 0.00 -1.03 0.00 0.00 54.13 56.08 1m1x s LEU 454 Cb -0.16 -3.63 -0.00 0.00 0.03 0.00 0.00 46.19 42.42 1m1x s LEU 454 CO -0.05 -0.87 -0.07 0.21 0.23 0.00 0.00 176.35 175.79 1m1x s ASN 455 N 0.57 4.08 0.09 2.29 3.04 -1.26 0.25 114.94 123.99 1m1x s ASN 455 Ca 0.64 -0.43 -0.27 0.00 0.04 0.00 0.00 52.86 52.84 1m1x s ASN 455 Cb -0.47 -1.69 -0.14 0.00 -1.54 0.00 0.00 41.25 37.41 1m1x s ASN 455 CO 0.45 -0.01 1.69 1.56 -3.04 0.00 0.00 177.10 177.74 1m1x h GLN 456 N 8.03 -0.35 -1.81 0.43 1.08 -1.95 -3.08 115.11 117.45 1m1x h GLN 456 Ca -0.42 0.02 -0.18 0.00 -1.45 0.00 0.00 58.65 56.63 1m1x h GLN 456 Cb 1.16 0.08 -0.07 0.00 -0.05 0.00 0.00 27.48 28.60 1m1x h GLN 456 CO 0.61 -0.23 0.15 -0.25 -0.95 0.00 0.00 178.83 178.16 1m1x n ASP 457 N -5.27 5.86 -4.60 1.46 9.92 -1.26 -4.66 116.55 118.00 1m1x n ASP 457 Ca -0.09 -2.73 -0.34 0.00 -0.53 0.00 0.00 54.79 51.10 1m1x n ASP 457 Cb 0.18 -1.14 -0.11 0.00 -0.64 0.00 0.00 41.12 39.42 1m1x n ASP 457 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 1m1x s ASN 458 N 1.17 5.20 -0.50 -2.24 3.84 -1.17 -5.08 114.94 116.17 1m1x s ASN 458 Ca 0.22 0.02 -0.10 0.00 0.21 0.00 0.00 52.86 53.21 1m1x s ASN 458 Cb 0.15 -1.76 0.13 0.00 -0.55 0.00 0.00 41.25 39.21 1m1x s ASN 458 CO -0.02 0.23 0.39 -0.75 -2.79 0.00 0.00 177.10 174.16 1m1x s LYS 459 N 0.01 2.61 0.06 0.43 2.20 -1.26 -3.02 119.74 120.77 1m1x s LYS 459 Ca 0.03 -1.81 0.00 0.00 -0.36 0.00 0.00 55.97 53.83 1m1x s LYS 459 Cb -0.13 -4.00 0.00 0.00 -1.51 0.00 0.00 37.83 32.19 1m1x s LYS 459 CO 0.02 -1.22 0.00 2.41 -0.36 0.00 0.00 175.35 176.20 1m1x n THR 460 N 4.89 0.31 0.00 3.43 -1.04 -1.00 -4.93 114.28 115.95 1m1x n THR 460 Ca -0.08 0.10 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1m1x n THR 460 Cb 0.41 -1.21 0.00 0.00 -1.82 0.00 0.00 70.33 67.71 1m1x n THR 460 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1m1x n SER 462 N 0.00 0.00 -4.67 0.00 3.41 -1.25 -3.95 113.62 107.16 1m1x n SER 462 Ca 0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.28 1m1x n SER 462 Cb 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.08 1m1x n SER 462 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1m1x n LEU 463 N 0.00 3.88 0.32 1.04 4.77 -0.59 -4.87 117.00 121.55 1m1x n LEU 463 Ca 0.00 0.54 -0.14 0.00 -0.03 0.00 0.00 56.01 56.38 1m1x n LEU 463 Cb 0.00 -1.48 -0.07 0.00 -2.33 0.00 0.00 43.42 39.54 1m1x n LEU 463 CO 0.00 -1.92 0.52 1.55 -1.33 0.00 0.00 177.39 176.21 1m1x h PRO 464 N -1.10 -0.85 0.00 3.23 0.13 -1.93 -3.38 132.00 128.10 1m1x h PRO 464 Ca -0.45 0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1m1x h PRO 464 Cb 1.29 0.19 0.00 0.00 0.13 0.00 0.00 31.00 32.62 1m1x h PRO 464 CO 0.44 -0.57 0.00 0.41 -0.23 0.00 0.00 178.00 178.06 1m1x n GLY 465 N -1.45 -1.78 3.75 1.56 0.00 -1.26 -4.72 105.19 101.29 1m1x n GLY 465 Ca -0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 1m1x n GLY 465 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1m1x s THR 466 N -0.60 3.12 -0.03 2.61 -4.23 -1.26 -4.90 115.64 110.34 1m1x s THR 466 Ca 0.00 1.03 0.00 0.00 -1.18 0.00 0.00 61.69 61.54 1m1x s THR 466 Cb 0.00 -3.66 0.05 0.00 1.34 0.00 0.00 72.50 70.23 1m1x s THR 466 CO 0.00 0.21 1.11 0.00 -0.54 0.00 0.00 174.62 175.40 1m1x n ALA 467 N 1.63 2.79 -2.22 3.99 0.00 -1.26 -2.52 120.51 122.93 1m1x n ALA 467 Ca 0.02 -0.20 -0.42 0.00 0.00 0.00 0.00 53.44 52.84 1m1x n ALA 467 Cb 0.43 -1.03 -0.03 0.00 0.00 0.00 0.00 19.45 18.82 1m1x n ALA 467 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1m1x s LEU 468 N -0.23 4.27 0.48 0.00 1.43 -1.26 -4.64 118.68 118.73 1m1x s LEU 468 Ca 0.04 2.00 -0.24 0.00 -1.03 0.00 0.00 54.13 54.90 1m1x s LEU 468 Cb 0.03 -3.54 -0.07 0.00 0.03 0.00 0.00 46.19 42.64 1m1x s LEU 468 CO 0.01 -0.82 1.40 -0.54 0.23 0.00 0.00 176.35 176.63 1m1x s LYS 469 N 3.47 3.53 0.09 1.70 3.01 -1.25 -1.54 119.74 128.75 1m1x s LYS 469 Ca 0.64 2.36 -0.07 0.00 -1.01 0.00 0.00 55.97 57.88 1m1x s LYS 469 Cb -0.28 -2.54 -0.01 0.00 -1.01 0.00 0.00 37.83 33.99 1m1x s LYS 469 CO 0.23 -0.92 0.16 0.54 0.51 0.00 0.00 175.35 175.87 1m1x s VAL 470 N -1.23 0.15 -0.38 3.17 0.11 -1.26 -4.84 120.40 116.12 1m1x s VAL 470 Ca 0.64 -1.29 -0.28 0.00 -2.93 0.00 0.00 61.98 58.12 1m1x s VAL 470 Cb -0.43 -1.39 -0.02 0.00 -1.53 0.00 0.00 36.38 33.02 1m1x s VAL 470 CO 0.54 -0.69 1.79 -0.55 -3.33 0.00 0.00 175.10 172.85 1m1x s SER 471 N -2.88 5.81 0.45 3.54 0.15 -1.17 -2.23 113.70 117.37 1m1x s SER 471 Ca 0.06 1.12 -0.01 0.00 0.70 0.00 0.00 55.95 57.82 1m1x s SER 471 Cb 0.05 -2.53 -0.01 0.00 -1.71 0.00 0.00 66.02 61.82 1m1x s SER 471 CO -0.10 -1.81 0.69 0.00 1.20 0.00 0.00 173.24 173.22 1m1x s PHE 473 N -2.58 -0.58 0.25 0.00 -0.12 -0.52 -4.80 117.98 109.63 1m1x s PHE 473 Ca 0.47 1.11 0.00 0.00 -0.05 0.00 0.00 56.93 58.46 1m1x s PHE 473 Cb -0.10 0.35 -0.04 0.00 -0.63 0.00 0.00 43.02 42.60 1m1x s PHE 473 CO 0.39 -0.29 0.43 -0.80 -0.05 0.00 0.00 175.22 174.91 1m1x s ASN 474 N 1.59 6.36 -0.07 1.98 0.02 -1.26 -0.56 114.94 123.00 1m1x s ASN 474 Ca -0.07 0.39 -0.03 0.00 -1.02 0.00 0.00 52.86 52.13 1m1x s ASN 474 Cb -0.04 -2.00 0.04 0.00 0.02 0.00 0.00 41.25 39.27 1m1x s ASN 474 CO -0.15 -0.11 0.14 0.54 0.02 0.00 0.00 177.10 177.53 1m1x s VAL 475 N -2.00 -0.15 0.30 1.60 0.11 -0.76 0.41 120.40 119.92 1m1x s VAL 475 Ca 0.39 0.28 0.11 0.00 -2.93 0.00 0.00 61.98 59.82 1m1x s VAL 475 Cb -0.10 -0.25 -0.05 0.00 -1.53 0.00 0.00 36.38 34.45 1m1x s VAL 475 CO 0.31 0.12 -0.11 0.00 -3.33 0.00 0.00 175.10 172.08 1m1x s ARG 476 N 1.74 1.88 -0.29 1.54 1.70 -0.95 -0.39 118.95 124.18 1m1x s ARG 476 Ca -0.03 -1.74 0.02 0.00 -0.47 0.00 0.00 55.73 53.51 1m1x s ARG 476 Cb -0.12 -1.85 0.16 0.00 -0.57 0.00 0.00 34.95 32.58 1m1x s ARG 476 CO -0.05 0.26 0.42 -0.59 -1.08 0.00 0.00 175.30 174.26 1m1x s PHE 477 N -2.50 -1.05 0.58 5.89 -0.12 -0.36 -2.41 117.98 118.00 1m1x s PHE 477 Ca 0.32 0.36 -0.14 0.00 -0.05 0.00 0.00 56.93 57.42 1m1x s PHE 477 Cb -0.03 -0.13 -0.05 0.00 -0.63 0.00 0.00 43.02 42.18 1m1x s PHE 477 CO 0.17 -0.99 1.02 0.00 -0.05 0.00 0.00 175.22 175.37 1m1x s LEU 479 N -4.64 -0.35 -0.06 0.00 2.96 -1.00 -0.32 118.68 115.27 1m1x s LEU 479 Ca 0.59 0.74 0.02 0.00 -0.22 0.00 0.00 54.13 55.26 1m1x s LEU 479 Cb -0.12 0.97 0.02 0.00 0.50 0.00 0.00 46.19 47.55 1m1x s LEU 479 CO 0.42 -0.23 -0.09 -0.75 -1.32 0.00 0.00 176.35 174.38 1m1x s LYS 480 N 2.32 1.34 -0.07 1.98 2.20 0.14 -3.42 119.74 124.24 1m1x s LYS 480 Ca -0.01 -0.28 -0.09 0.00 -0.36 0.00 0.00 55.97 55.23 1m1x s LYS 480 Cb -0.12 -1.20 0.02 0.00 -1.51 0.00 0.00 37.83 35.03 1m1x s LYS 480 CO -0.10 -0.04 0.23 0.00 -0.36 0.00 0.00 175.35 175.08 1m1x s ALA 481 N 0.84 -0.56 -0.29 3.13 0.00 -1.26 0.12 121.76 123.74 1m1x s ALA 481 Ca -0.12 0.52 -0.14 0.00 0.00 0.00 0.00 51.96 52.23 1m1x s ALA 481 Cb -0.15 -0.28 0.10 0.00 0.00 0.00 0.00 23.12 22.80 1m1x s ALA 481 CO 0.01 -0.14 0.69 0.34 0.00 0.00 0.00 175.76 176.67 1m1x s ASP 482 N -0.21 -1.00 0.23 0.00 3.68 -1.14 -4.19 116.67 114.05 1m1x s ASP 482 Ca -0.03 1.50 0.07 0.00 2.13 0.00 0.00 52.55 56.22 1m1x s ASP 482 Cb -0.03 1.74 -0.04 0.00 -1.45 0.00 0.00 42.92 43.14 1m1x s ASP 482 CO 0.01 -0.23 0.17 -0.83 0.13 0.00 0.00 175.17 174.42 1m1x s GLY 483 N 2.12 1.50 -1.15 2.66 0.00 -1.26 -4.18 107.32 107.02 1m1x s GLY 483 Ca -0.08 -1.38 -0.10 0.00 0.00 0.00 0.00 44.72 43.15 1m1x s GLY 483 CO -0.19 -1.42 1.29 1.17 0.00 0.00 0.00 173.10 173.94 1m1x n LYS 484 N -0.94 3.59 -1.39 2.90 4.81 -1.26 -4.88 118.16 120.99 1m1x n LYS 484 Ca -0.08 -4.24 0.00 0.00 -0.87 0.00 0.00 58.31 53.12 1m1x n LYS 484 Cb 0.57 -2.71 0.00 0.00 0.02 0.00 0.00 35.03 32.91 1m1x n LYS 484 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1m1x n GLY 485 N 2.97 -0.59 3.38 3.14 0.00 -1.26 -4.88 105.19 107.94 1m1x n GLY 485 Ca 0.29 -0.67 -0.45 0.00 0.00 0.00 0.00 46.02 45.18 1m1x n GLY 485 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m1x s VAL 486 N -3.61 5.17 0.00 1.61 1.01 -1.26 -4.67 120.40 118.65 1m1x s VAL 486 Ca 0.00 -1.91 0.00 0.00 0.00 0.00 0.00 61.98 60.07 1m1x s VAL 486 Cb 0.00 -4.58 0.00 0.00 0.00 0.00 0.00 36.38 31.80 1m1x s VAL 486 CO 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 175.10 173.88 1m1x n LEU 487 N 5.28 0.00 0.00 3.92 -0.00 -1.26 -4.82 117.00 120.12 1m1x n LEU 487 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.15 1m1x n LEU 487 Cb 0.47 0.16 0.00 0.00 -0.00 0.00 0.00 43.42 44.05 1m1x n LEU 487 CO 0.43 -0.16 0.00 -2.65 -0.00 0.00 0.00 177.39 175.01 1m1x n PRO 488 N -1.77 2.05 0.00 1.47 -0.02 -1.26 -4.59 135.00 130.88 1m1x n PRO 488 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1m1x n PRO 488 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1m1x n PRO 488 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1m1x n ARG 489 N 0.00 0.00 -2.74 -0.52 5.12 -1.26 -4.61 116.66 112.64 1m1x n ARG 489 Ca 0.00 0.00 -0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1m1x n ARG 489 Cb 0.00 -0.09 0.06 0.00 -1.16 0.00 0.00 32.46 31.27 1m1x n ARG 489 CO 0.00 0.00 0.00 0.36 -1.93 0.00 0.00 177.63 176.06 1m1x n LYS 490 N 0.00 1.59 -1.65 5.56 2.85 -1.26 -4.80 118.16 120.45 1m1x n LYS 490 Ca 0.00 -3.08 -0.16 0.00 -1.05 0.00 0.00 58.31 54.02 1m1x n LYS 490 Cb 0.00 -1.22 -0.07 0.00 -0.65 0.00 0.00 35.03 33.08 1m1x n LYS 490 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1m1x s LEU 491 N -3.67 2.83 0.22 -5.58 1.43 -1.18 -4.89 118.68 107.84 1m1x s LEU 491 Ca 0.24 -0.25 -0.16 0.00 -1.03 0.00 0.00 54.13 52.94 1m1x s LEU 491 Cb 0.34 -2.56 -0.08 0.00 0.03 0.00 0.00 46.19 43.92 1m1x s LEU 491 CO -0.06 -3.86 0.65 0.54 0.23 0.00 0.00 176.35 173.86 1m1x s ASN 492 N 10.04 6.88 0.07 2.29 2.20 -1.26 -2.43 114.94 132.72 1m1x s ASN 492 Ca 0.87 1.23 0.02 0.00 -0.94 0.00 0.00 52.86 54.04 1m1x s ASN 492 Cb -0.11 -2.35 -0.03 0.00 -2.00 0.00 0.00 41.25 36.76 1m1x s ASN 492 CO 0.08 -0.01 -0.07 -0.36 -2.94 0.00 0.00 177.10 173.81 1m1x s PHE 493 N -1.63 0.76 -0.39 1.54 0.40 -1.05 -4.15 117.98 113.45 1m1x s PHE 493 Ca 0.44 -0.70 -0.05 0.00 -0.60 0.00 0.00 56.93 56.03 1m1x s PHE 493 Cb -0.14 -0.45 0.09 0.00 0.51 0.00 0.00 43.02 43.03 1m1x s PHE 493 CO 0.20 -0.12 0.19 -0.65 0.70 0.00 0.00 175.22 175.54 1m1x s GLN 494 N -2.62 2.30 0.13 0.44 -1.52 -0.92 -2.77 119.66 114.70 1m1x s GLN 494 Ca -0.00 -1.60 -0.05 0.00 -1.95 0.00 0.00 55.36 51.76 1m1x s GLN 494 Cb -0.03 -3.59 -0.05 0.00 -0.22 0.00 0.00 33.01 29.12 1m1x s GLN 494 CO -0.02 -0.95 0.37 0.08 -0.25 0.00 0.00 175.29 174.51 1m1x s VAL 495 N 1.26 5.18 -0.09 1.09 1.01 -0.72 -2.51 120.40 125.62 1m1x s VAL 495 Ca 0.04 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 62.05 1m1x s VAL 495 Cb -0.22 -3.62 0.04 0.00 0.00 0.00 0.00 36.38 32.57 1m1x s VAL 495 CO -0.01 0.08 0.05 -0.70 0.00 0.00 0.00 175.10 174.51 1m1x s GLU 496 N -2.55 0.24 0.15 2.72 2.56 -0.74 -2.62 118.70 118.45 1m1x s GLU 496 Ca 0.40 0.11 -0.02 0.00 0.00 0.00 0.00 54.97 55.46 1m1x s GLU 496 Cb -0.12 -1.11 -0.05 0.00 2.00 0.00 0.00 34.13 34.85 1m1x s GLU 496 CO 0.24 -0.43 0.35 -0.51 -0.56 0.00 0.00 175.26 174.35 1m1x s LEU 497 N 2.07 4.27 -0.09 2.70 1.43 -1.03 -1.39 118.68 126.64 1m1x s LEU 497 Ca 0.04 0.44 -0.04 0.00 -1.03 0.00 0.00 54.13 53.54 1m1x s LEU 497 Cb -0.13 -3.18 0.05 0.00 0.03 0.00 0.00 46.19 42.95 1m1x s LEU 497 CO -0.05 0.04 0.18 -0.22 0.23 0.00 0.00 176.35 176.52 1m1x s LEU 498 N -2.91 0.09 -0.16 1.79 2.96 0.20 -3.35 118.68 117.30 1m1x s LEU 498 Ca 0.39 0.39 -0.13 0.00 -0.22 0.00 0.00 54.13 54.56 1m1x s LEU 498 Cb -0.12 0.41 -0.05 0.00 0.50 0.00 0.00 46.19 46.93 1m1x s LEU 498 CO 0.27 -0.22 0.25 -0.76 -1.32 0.00 0.00 176.35 174.57 1m1x s LEU 499 N 1.99 4.26 -0.42 -0.68 1.43 -0.52 0.14 118.68 124.88 1m1x s LEU 499 Ca -0.01 0.46 -0.17 0.00 -1.03 0.00 0.00 54.13 53.38 1m1x s LEU 499 Cb -0.12 -2.30 0.02 0.00 0.03 0.00 0.00 46.19 43.83 1m1x s LEU 499 CO -0.07 0.15 0.57 -0.67 0.23 0.00 0.00 176.35 176.56 1m1x n ASP 500 N 3.38 -7.71 0.09 2.29 4.64 0.26 -4.86 116.55 114.64 1m1x n ASP 500 Ca -0.13 0.52 -0.14 0.00 -1.38 0.00 0.00 54.79 53.66 1m1x n ASP 500 Cb 0.52 -4.99 -0.14 0.00 -1.04 0.00 0.00 41.12 35.47 1m1x n ASP 500 CO 0.00 0.00 0.00 0.50 -0.82 0.00 0.00 177.20 176.88 1m1x h LYS 501 N 2.08 0.20 -0.42 -0.67 1.63 -1.45 -3.30 116.57 114.64 1m1x h LYS 501 Ca -0.06 -0.34 0.12 0.00 -0.85 0.00 0.00 60.65 59.52 1m1x h LYS 501 Cb 0.99 0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 32.73 1m1x h LYS 501 CO 0.20 1.15 0.38 -0.07 -3.45 0.00 0.00 179.45 177.65 1m1x h LEU 502 N 0.05 0.00 -8.61 5.20 3.38 -1.87 -3.38 115.31 110.09 1m1x h LEU 502 Ca -0.12 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.30 1m1x h LEU 502 Cb 1.93 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.61 1m1x h LEU 502 CO 0.18 0.00 0.97 -0.54 0.09 0.00 0.00 178.44 179.14 1m1x s LYS 503 N -4.78 3.55 0.00 1.13 -0.14 -1.24 -5.01 119.74 113.24 1m1x s LYS 503 Ca -0.05 0.31 0.00 0.00 -1.36 0.00 0.00 55.97 54.87 1m1x s LYS 503 Cb 0.17 -4.00 0.00 0.00 -1.68 0.00 0.00 37.83 32.32 1m1x s LYS 503 CO 0.62 -1.63 0.00 0.94 -0.76 0.00 0.00 175.35 174.52 1m1x n GLN 504 N 8.34 2.92 -0.01 1.68 7.27 -1.26 -4.79 117.38 131.53 1m1x n GLN 504 Ca 0.09 0.00 0.10 0.00 0.07 0.00 0.00 57.00 57.26 1m1x n GLN 504 Cb 0.49 0.00 0.56 0.00 2.41 0.00 0.00 30.24 33.70 1m1x n GLN 504 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 1m1x n LYS 505 N 0.00 1.09 0.25 3.69 4.76 -1.26 -3.74 118.16 122.95 1m1x n LYS 505 Ca 0.00 -0.14 0.11 0.00 -2.87 0.00 0.00 58.31 55.41 1m1x n LYS 505 Cb 0.00 -1.32 0.66 0.00 -1.84 0.00 0.00 35.03 32.53 1m1x n LYS 505 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 1m1x h GLY 506 N 5.33 0.00 0.00 0.72 0.00 -1.99 -3.47 103.07 103.65 1m1x h GLY 506 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1m1x h GLY 506 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 1m1x n ALA 507 N -2.30 0.00 -1.68 3.60 0.00 -1.25 -4.97 120.51 113.92 1m1x n ALA 507 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.00 1m1x n ALA 507 Cb 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.71 1m1x n ALA 507 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1m1x n ILE 508 N -2.30 3.26 -2.61 0.00 5.41 -1.26 -4.86 119.36 117.00 1m1x n ILE 508 Ca 0.00 -2.86 -0.41 0.00 1.00 0.00 0.00 62.75 60.48 1m1x n ILE 508 Cb 0.00 -2.57 -0.03 0.00 -0.71 0.00 0.00 39.64 36.33 1m1x n ILE 508 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1m1x s ARG 509 N 3.44 3.46 0.64 0.38 1.81 -1.26 -4.85 118.95 122.56 1m1x s ARG 509 Ca 0.48 -0.94 0.40 0.00 -1.72 0.00 0.00 55.73 53.95 1m1x s ARG 509 Cb 0.14 -4.95 2.18 0.00 -0.45 0.00 0.00 34.95 31.87 1m1x s ARG 509 CO -0.06 -2.13 2.30 0.00 -0.68 0.00 0.00 175.30 174.73 1m1x h ARG 510 N 9.75 0.00 -5.23 3.54 3.08 -1.92 -3.43 114.38 120.17 1m1x h ARG 510 Ca 0.04 0.00 -0.42 0.00 0.07 0.00 0.00 59.98 59.68 1m1x h ARG 510 Cb 1.03 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 30.84 1m1x h ARG 510 CO 1.34 0.01 -0.78 0.00 -1.07 0.00 0.00 179.97 179.47 1m1x s ALA 511 N -4.20 1.10 0.03 0.04 0.00 -1.26 -2.64 121.76 114.82 1m1x s ALA 511 Ca -0.04 -0.85 -0.03 0.00 0.00 0.00 0.00 51.96 51.03 1m1x s ALA 511 Cb 0.13 -0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.10 1m1x s ALA 511 CO 0.46 0.18 0.04 -0.51 0.00 0.00 0.00 175.76 175.93 1m1x s LEU 512 N -1.33 2.05 1.00 0.00 1.43 -1.04 -4.34 118.68 116.45 1m1x s LEU 512 Ca -0.01 -0.60 -0.13 0.00 -1.03 0.00 0.00 54.13 52.37 1m1x s LEU 512 Cb -0.08 0.38 0.19 0.00 0.03 0.00 0.00 46.19 46.71 1m1x s LEU 512 CO 0.01 -0.46 1.12 -0.36 0.23 0.00 0.00 176.35 176.89 1m1x s PHE 513 N -2.46 2.03 0.00 0.29 0.40 -0.59 -0.94 117.98 116.70 1m1x s PHE 513 Ca -0.06 0.86 0.00 0.00 -0.60 0.00 0.00 56.93 57.12 1m1x s PHE 513 Cb -0.02 -3.35 0.00 0.00 0.51 0.00 0.00 43.02 40.15 1m1x s PHE 513 CO -0.04 -2.87 0.00 -0.11 0.70 0.00 0.00 175.22 172.90 1m1x n LEU 514 N -4.12 0.00 0.20 -0.37 -0.00 -0.28 -3.99 117.00 108.44 1m1x n LEU 514 Ca 0.07 0.00 0.05 0.00 -0.00 0.00 0.00 56.01 56.12 1m1x n LEU 514 Cb 0.58 0.00 0.26 0.00 -0.00 0.00 0.00 43.42 44.26 1m1x n LEU 514 CO 0.56 0.00 0.83 1.88 -0.00 0.00 0.00 177.39 180.66 1m1x h TYR 515 N 0.00 0.00 -2.80 1.96 -1.99 -1.96 -3.07 116.97 109.11 1m1x h TYR 515 Ca 0.00 0.00 -0.60 0.00 2.00 0.00 0.00 58.73 60.13 1m1x h TYR 515 Cb 0.00 0.00 -0.40 0.00 2.00 0.00 0.00 36.73 38.33 1m1x h TYR 515 CO 0.00 0.00 -0.79 -1.54 -0.00 0.00 0.00 178.16 175.83 1m1x s SER 516 N -3.19 3.23 -0.75 3.88 1.04 -1.26 -4.97 113.70 111.68 1m1x s SER 516 Ca -0.01 -2.73 -0.26 0.00 0.48 0.00 0.00 55.95 53.43 1m1x s SER 516 Cb 0.03 -0.85 -0.13 0.00 0.10 0.00 0.00 66.02 65.16 1m1x s SER 516 CO 0.09 -0.24 2.42 0.54 0.98 0.00 0.00 173.24 177.02 1m1x n ARG 517 N 3.37 0.61 -3.58 4.02 1.74 -1.16 -4.11 116.66 117.55 1m1x n ARG 517 Ca 0.14 -0.74 -0.08 0.00 -0.77 0.00 0.00 57.85 56.40 1m1x n ARG 517 Cb 0.37 -3.65 -0.04 0.00 -1.02 0.00 0.00 32.46 28.13 1m1x n ARG 517 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1m1x s SER 518 N 11.01 -0.26 0.05 0.55 0.15 -1.26 -4.95 113.70 118.98 1m1x s SER 518 Ca 0.94 0.21 0.27 0.00 0.70 0.00 0.00 55.95 58.08 1m1x s SER 518 Cb -0.14 0.23 0.95 0.00 -1.71 0.00 0.00 66.02 65.35 1m1x s SER 518 CO 0.11 -0.30 1.75 -0.81 1.20 0.00 0.00 173.24 175.19 1m1x n PRO 519 N 0.42 0.08 -3.79 5.44 -0.04 -1.26 -1.54 135.00 134.31 1m1x n PRO 519 Ca -0.06 0.05 -0.37 0.00 -0.04 0.00 0.00 63.50 63.08 1m1x n PRO 519 Cb 0.59 -1.57 -0.13 0.00 -0.04 0.00 0.00 33.50 32.34 1m1x n PRO 519 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1m1x s SER 520 N -3.40 5.08 -0.04 3.54 0.01 -1.26 -1.44 113.70 116.20 1m1x s SER 520 Ca 0.12 -0.90 0.07 0.00 1.31 0.00 0.00 55.95 56.56 1m1x s SER 520 Cb 0.17 -1.84 -0.02 0.00 0.21 0.00 0.00 66.02 64.54 1m1x s SER 520 CO 0.59 -0.23 -0.25 -2.28 0.41 0.00 0.00 173.24 171.48 1m1x s HIS 521 N 1.44 2.39 0.06 2.43 2.46 -1.21 -5.06 115.29 117.79 1m1x s HIS 521 Ca 0.01 -0.56 0.05 0.00 0.47 0.00 0.00 55.06 55.02 1m1x s HIS 521 Cb -0.18 -1.55 -0.04 0.00 -0.13 0.00 0.00 32.58 30.68 1m1x s HIS 521 CO 0.02 -0.11 -0.05 -1.12 -2.47 0.00 0.00 174.74 171.00 1m1x s SER 522 N -0.41 4.73 0.26 9.88 0.01 -1.26 -2.47 113.70 124.44 1m1x s SER 522 Ca 0.04 -0.21 -0.20 0.00 1.31 0.00 0.00 55.95 56.89 1m1x s SER 522 Cb -0.12 -1.07 0.02 0.00 0.21 0.00 0.00 66.02 65.06 1m1x s SER 522 CO 0.01 0.22 0.67 -0.75 0.41 0.00 0.00 173.24 173.81 1m1x s LYS 523 N -1.91 1.71 -0.40 12.44 2.47 -1.08 -5.03 119.74 127.94 1m1x s LYS 523 Ca 0.21 -0.98 0.06 0.00 -1.56 0.00 0.00 55.97 53.70 1m1x s LYS 523 Cb -0.11 0.59 0.17 0.00 -1.46 0.00 0.00 37.83 37.02 1m1x s LYS 523 CO 0.13 -0.77 0.55 0.54 0.16 0.00 0.00 175.35 175.95 1m1x s ASN 524 N -2.92 -0.64 0.20 1.43 6.03 -1.26 -1.75 114.94 116.03 1m1x s ASN 524 Ca 0.12 -1.06 0.00 0.00 -1.03 0.00 0.00 52.86 50.89 1m1x s ASN 524 Cb -0.05 1.50 0.00 0.00 -3.03 0.00 0.00 41.25 39.67 1m1x s ASN 524 CO 0.05 -0.20 0.00 1.15 -2.03 0.00 0.00 177.10 176.08 1m1x n MET 525 N 4.35 1.32 -3.87 3.55 0.00 -1.11 -4.88 117.12 116.48 1m1x n MET 525 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 57.70 57.73 1m1x n MET 525 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 33.22 33.72 1m1x n MET 525 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 1m1x s THR 526 N 0.43 0.01 0.00 3.17 2.01 -1.26 -2.54 115.64 117.46 1m1x s THR 526 Ca 0.00 -1.05 0.00 0.00 0.31 0.00 0.00 61.69 60.95 1m1x s THR 526 Cb 0.00 -1.94 0.00 0.00 0.01 0.00 0.00 72.50 70.57 1m1x s THR 526 CO 0.00 -0.03 0.00 2.30 -0.69 0.00 0.00 174.62 176.20 1m1x n ILE 527 N -0.41 0.00 0.00 1.82 -5.35 -1.02 -4.71 119.36 109.69 1m1x n ILE 527 Ca -0.05 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 1m1x n ILE 527 Cb 0.61 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.51 1m1x n ILE 527 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 1m1x n SER 528 N 0.00 0.00 -4.78 7.28 2.88 -1.26 -3.09 113.62 114.65 1m1x n SER 528 Ca 0.00 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.21 1m1x n SER 528 Cb 0.00 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 63.50 1m1x n SER 528 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1m1x s ARG 529 N 0.00 2.86 0.00 -1.46 0.52 -1.26 -4.48 118.95 115.13 1m1x s ARG 529 Ca 0.00 1.32 0.22 0.00 -0.52 0.00 0.00 55.73 56.75 1m1x s ARG 529 Cb 0.00 -1.96 1.28 0.00 0.52 0.00 0.00 34.95 34.78 1m1x s ARG 529 CO 0.00 -1.19 1.83 0.41 0.02 0.00 0.00 175.30 176.37 1m1x n GLY 530 N -0.73 -0.88 0.00 -3.53 0.00 -1.26 -3.77 105.19 95.02 1m1x n GLY 530 Ca 0.10 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1m1x n GLY 530 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m1x n GLY 531 N 0.88 0.19 2.61 -0.02 0.00 -1.26 -4.89 105.19 102.70 1m1x n GLY 531 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1m1x n GLY 531 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1m1x n LEU 532 N 0.00 7.50 -4.56 0.99 -0.00 -1.25 -4.97 117.00 114.71 1m1x n LEU 532 Ca 0.00 -5.29 -0.20 0.00 -0.00 0.00 0.00 56.01 50.52 1m1x n LEU 532 Cb 0.33 -1.21 -0.06 0.00 -0.00 0.00 0.00 43.42 42.48 1m1x n LEU 532 CO 0.00 2.05 1.28 0.00 -0.00 0.00 0.00 177.39 180.72 1m1x s MET 533 N -3.71 2.05 0.30 1.96 0.23 -1.26 -4.77 119.30 114.10 1m1x s MET 533 Ca 0.42 -0.00 -0.29 0.00 -1.03 0.00 0.00 55.69 54.78 1m1x s MET 533 Cb 0.19 -4.95 -0.12 0.00 -1.53 0.00 0.00 34.83 28.42 1m1x s MET 533 CO -0.12 -4.01 1.40 0.94 -2.03 0.00 0.00 175.02 171.20 1m1x n GLN 534 N 8.77 2.25 -4.59 3.16 7.27 -1.22 -4.53 117.38 128.49 1m1x n GLN 534 Ca 0.43 0.79 -0.25 0.00 0.07 0.00 0.00 57.00 58.05 1m1x n GLN 534 Cb 0.45 -2.45 -0.17 0.00 2.41 0.00 0.00 30.24 30.49 1m1x n GLN 534 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1m1x s GLU 536 N 0.67 3.04 0.15 0.00 2.56 -1.24 -4.95 118.70 118.92 1m1x s GLU 536 Ca -0.15 -0.68 0.05 0.00 0.00 0.00 0.00 54.97 54.19 1m1x s GLU 536 Cb -0.16 -2.78 -0.04 0.00 2.00 0.00 0.00 34.13 33.14 1m1x s GLU 536 CO 0.04 0.55 -0.11 -2.00 -0.56 0.00 0.00 175.26 173.17 1m1x s GLU 537 N -2.68 1.09 0.28 4.30 2.12 -1.26 -1.23 118.70 121.33 1m1x s GLU 537 Ca 0.31 -1.45 -0.06 0.00 0.36 0.00 0.00 54.97 54.13 1m1x s GLU 537 Cb -0.12 -0.72 -0.01 0.00 0.26 0.00 0.00 34.13 33.55 1m1x s GLU 537 CO 0.24 0.10 0.42 -0.51 -0.54 0.00 0.00 175.26 174.97 1m1x s LEU 538 N -3.11 0.77 -0.03 2.70 1.43 0.48 -4.97 118.68 115.95 1m1x s LEU 538 Ca 0.17 -1.26 0.03 0.00 -1.03 0.00 0.00 54.13 52.04 1m1x s LEU 538 Cb 0.01 1.39 0.00 0.00 0.03 0.00 0.00 46.19 47.62 1m1x s LEU 538 CO 0.02 -1.16 -0.11 -0.63 0.23 0.00 0.00 176.35 174.70 1m1x s ILE 539 N -3.62 0.95 0.01 -0.59 1.09 -1.26 -1.82 121.20 115.96 1m1x s ILE 539 Ca 0.29 -0.46 0.01 0.00 -1.10 0.00 0.00 60.65 59.40 1m1x s ILE 539 Cb 0.01 -0.83 -0.01 0.00 -1.06 0.00 0.00 42.46 40.57 1m1x s ILE 539 CO 0.15 0.29 -0.04 0.00 -0.10 0.00 0.00 174.94 175.23 1m1x s ALA 540 N 0.13 0.34 0.47 9.38 0.00 0.27 -1.13 121.76 131.23 1m1x s ALA 540 Ca -0.03 -0.33 0.06 0.00 0.00 0.00 0.00 51.96 51.67 1m1x s ALA 540 Cb -0.09 -0.03 -0.00 0.00 0.00 0.00 0.00 23.12 23.00 1m1x s ALA 540 CO 0.01 0.03 0.32 1.52 0.00 0.00 0.00 175.76 177.64 1m1x s TYR 541 N -0.49 2.18 -0.02 0.00 1.13 -0.12 -1.44 117.35 118.58 1m1x s TYR 541 Ca -0.03 -0.69 0.07 0.00 -1.41 0.00 0.00 57.07 55.01 1m1x s TYR 541 Cb -0.04 -1.98 -0.02 0.00 -1.10 0.00 0.00 41.96 38.82 1m1x s TYR 541 CO -0.00 -0.18 -0.22 -1.17 -2.51 0.00 0.00 175.55 171.47 1m1x s LEU 542 N -4.13 2.03 0.56 -3.49 2.96 -0.88 -2.51 118.68 113.22 1m1x s LEU 542 Ca 0.39 -0.41 -0.21 0.00 -0.22 0.00 0.00 54.13 53.67 1m1x s LEU 542 Cb -0.01 -1.17 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 1m1x s LEU 542 CO 0.23 0.26 1.27 -0.13 -1.32 0.00 0.00 176.35 176.65 1m1x s ARG 543 N -0.43 3.13 0.62 1.98 0.52 -1.08 -4.47 118.95 119.22 1m1x s ARG 543 Ca 0.06 2.00 -0.18 0.00 -0.52 0.00 0.00 55.73 57.09 1m1x s ARG 543 Cb -0.10 -2.13 -0.02 0.00 0.52 0.00 0.00 34.95 33.22 1m1x s ARG 543 CO -0.00 -1.12 1.23 0.34 0.02 0.00 0.00 175.30 175.76 1m1x s ASP 544 N -1.29 4.94 0.40 0.23 3.68 -1.26 -4.88 116.67 118.49 1m1x s ASP 544 Ca 0.73 2.43 0.22 0.00 2.13 0.00 0.00 52.55 58.07 1m1x s ASP 544 Cb -0.35 -2.60 1.25 0.00 -1.45 0.00 0.00 42.92 39.77 1m1x s ASP 544 CO 0.40 -1.76 1.66 -0.33 0.13 0.00 0.00 175.17 175.27 1m1x h GLU 545 N 0.66 0.21 -1.51 4.34 3.07 -1.92 -1.89 114.58 117.54 1m1x h GLU 545 Ca -0.50 -0.01 -0.18 0.00 -0.50 0.00 0.00 59.36 58.17 1m1x h GLU 545 Cb 1.31 -0.05 -0.08 0.00 -0.84 0.00 0.00 28.75 29.08 1m1x h GLU 545 CO 0.54 0.14 0.23 -1.13 -1.40 0.00 0.00 179.01 177.39 1m1x n SER 546 N -4.82 5.22 0.00 1.42 3.41 -1.26 -3.73 113.62 113.86 1m1x n SER 546 Ca 0.33 -2.70 0.00 0.00 -0.26 0.00 0.00 58.87 56.24 1m1x n SER 546 Cb 1.17 -0.95 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 1m1x n SER 546 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1m1x n GLU 547 N 0.59 3.53 -3.67 4.33 1.02 -0.71 -5.12 120.64 120.61 1m1x n GLU 547 Ca 0.18 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.24 1m1x n GLU 547 Cb 0.63 -0.53 -0.02 0.00 -0.02 0.00 0.00 31.44 31.50 1m1x n GLU 547 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 1m1x s PHE 548 N -0.58 -0.30 -0.05 -0.32 -0.12 -1.24 -5.08 117.98 110.28 1m1x s PHE 548 Ca 0.00 -0.02 0.06 0.00 -0.05 0.00 0.00 56.93 56.92 1m1x s PHE 548 Cb 0.00 0.63 -0.02 0.00 -0.63 0.00 0.00 43.02 43.01 1m1x s PHE 548 CO 0.00 -0.98 -0.22 0.50 -0.05 0.00 0.00 175.22 174.47 1m1x s ARG 549 N -3.68 2.47 0.07 1.99 6.06 -1.26 -4.93 118.95 119.66 1m1x s ARG 549 Ca 0.07 -0.86 -0.01 0.00 -2.50 0.00 0.00 55.73 52.44 1m1x s ARG 549 Cb -0.03 -2.20 -0.01 0.00 0.06 0.00 0.00 34.95 32.77 1m1x s ARG 549 CO -0.02 0.47 -0.03 -0.40 -2.50 0.00 0.00 175.30 172.83 1m1x n ASP 550 N 2.71 1.06 -0.55 -2.12 5.68 -1.26 -5.03 116.55 117.04 1m1x n ASP 550 Ca -0.17 0.14 -0.07 0.00 -0.50 0.00 0.00 54.79 54.19 1m1x n ASP 550 Cb 0.52 -0.33 -0.03 0.00 -1.14 0.00 0.00 41.12 40.13 1m1x n ASP 550 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1m1x n LYS 551 N -3.52 -0.75 -2.28 0.11 4.76 -1.26 -3.92 118.16 111.31 1m1x n LYS 551 Ca -0.01 0.68 -0.03 0.00 -2.87 0.00 0.00 58.31 56.07 1m1x n LYS 551 Cb 0.10 -4.54 0.02 0.00 -1.84 0.00 0.00 35.03 28.77 1m1x n LYS 551 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1m1x n LEU 552 N -0.81 -4.00 -4.20 -0.35 7.99 -1.26 -5.01 117.00 109.36 1m1x n LEU 552 Ca -0.07 -0.18 -0.40 0.00 -0.01 0.00 0.00 56.01 55.35 1m1x n LEU 552 Cb 0.30 -1.94 -0.04 0.00 -0.11 0.00 0.00 43.42 41.63 1m1x n LEU 552 CO 0.11 -0.25 0.50 -0.89 -1.51 0.00 0.00 177.39 175.35 1m1x s THR 553 N -3.09 5.01 0.00 -5.08 2.01 -1.25 -4.75 115.64 108.49 1m1x s THR 553 Ca 0.11 -3.61 0.00 0.00 0.31 0.00 0.00 61.69 58.49 1m1x s THR 553 Cb -0.01 -4.07 0.00 0.00 0.01 0.00 0.00 72.50 68.43 1m1x s THR 553 CO 0.35 -1.12 0.00 -2.65 -0.69 0.00 0.00 174.62 170.52 1m1x n PRO 554 N 2.58 0.00 -2.63 4.92 -0.02 -1.26 -4.76 135.00 133.82 1m1x n PRO 554 Ca 0.22 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.28 1m1x n PRO 554 Cb 0.38 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.83 1m1x n PRO 554 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1m1x s ILE 555 N 0.00 3.92 -0.17 4.25 1.09 -0.82 -4.78 121.20 124.68 1m1x s ILE 555 Ca 0.00 -0.05 -0.21 0.00 -1.10 0.00 0.00 60.65 59.29 1m1x s ILE 555 Cb 0.00 -4.90 -0.03 0.00 -1.06 0.00 0.00 42.46 36.47 1m1x s ILE 555 CO 0.00 -1.79 0.63 0.42 -0.10 0.00 0.00 174.94 174.10 1m1x s THR 556 N 5.14 5.04 -0.02 2.92 -4.23 -1.26 0.10 115.64 123.33 1m1x s THR 556 Ca 0.35 1.20 -0.14 0.00 -1.18 0.00 0.00 61.69 61.92 1m1x s THR 556 Cb -0.08 -3.95 -0.05 0.00 1.34 0.00 0.00 72.50 69.76 1m1x s THR 556 CO 0.08 0.15 0.38 -0.63 -0.54 0.00 0.00 174.62 174.06 1m1x s ILE 557 N 1.63 5.10 0.13 2.99 1.09 0.90 -0.57 121.20 132.47 1m1x s ILE 557 Ca 0.30 0.76 0.09 0.00 -1.10 0.00 0.00 60.65 60.70 1m1x s ILE 557 Cb -0.16 -3.68 -0.04 0.00 -1.06 0.00 0.00 42.46 37.52 1m1x s ILE 557 CO 0.11 0.57 -0.19 0.12 -0.10 0.00 0.00 174.94 175.45 1m1x s PHE 558 N -0.95 2.51 -0.04 3.97 5.36 0.38 -1.50 117.98 127.71 1m1x s PHE 558 Ca 0.23 -0.28 0.01 0.00 -0.96 0.00 0.00 56.93 55.93 1m1x s PHE 558 Cb -0.16 -1.32 0.02 0.00 -0.34 0.00 0.00 43.02 41.22 1m1x s PHE 558 CO 0.12 0.40 -0.04 1.41 -1.46 0.00 0.00 175.22 175.64 1m1x s MET 559 N -2.22 0.76 0.29 10.12 -2.45 0.15 -0.63 119.30 125.33 1m1x s MET 559 Ca 0.18 -0.10 0.05 0.00 -1.25 0.00 0.00 55.69 54.57 1m1x s MET 559 Cb -0.10 -0.77 -0.06 0.00 1.25 0.00 0.00 34.83 35.15 1m1x s MET 559 CO 0.10 -0.06 -0.01 -1.21 1.05 0.00 0.00 175.02 174.89 1m1x s GLU 560 N 0.80 1.57 -0.22 4.11 2.02 -0.48 -1.95 118.70 124.55 1m1x s GLU 560 Ca -0.10 -1.83 -0.32 0.00 0.02 0.00 0.00 54.97 52.74 1m1x s GLU 560 Cb -0.13 -1.02 0.16 0.00 0.10 0.00 0.00 34.13 33.23 1m1x s GLU 560 CO 0.00 -0.05 1.22 1.52 0.02 0.00 0.00 175.26 177.97 1m1x s TYR 561 N -3.14 -0.15 0.15 1.61 -0.85 -1.22 -1.80 117.35 111.95 1m1x s TYR 561 Ca 0.32 0.19 -0.22 0.00 -0.52 0.00 0.00 57.07 56.83 1m1x s TYR 561 Cb 0.06 0.49 0.07 0.00 0.38 0.00 0.00 41.96 42.96 1m1x s TYR 561 CO 0.13 -0.17 0.58 0.50 -1.52 0.00 0.00 175.55 175.06 1m1x s ARG 562 N -1.66 1.24 1.12 -3.49 3.52 -1.04 -4.88 118.95 113.76 1m1x s ARG 562 Ca 0.07 -0.48 -0.19 0.00 -0.13 0.00 0.00 55.73 55.00 1m1x s ARG 562 Cb -0.01 0.57 0.27 0.00 -1.56 0.00 0.00 34.95 34.22 1m1x s ARG 562 CO -0.05 -0.53 1.22 -0.11 -0.81 0.00 0.00 175.30 175.02 1m1x n LEU 563 N -0.31 0.00 -3.63 -0.88 -0.00 -1.26 -2.16 117.00 108.76 1m1x n LEU 563 Ca -0.17 -1.32 -0.12 0.00 -0.00 0.00 0.00 56.01 54.40 1m1x n LEU 563 Cb 0.65 -1.02 -0.05 0.00 -0.00 0.00 0.00 43.42 42.99 1m1x n LEU 563 CO 0.13 -1.83 0.19 -1.81 -0.00 0.00 0.00 177.39 174.07 1m1x s ASP 564 N -5.18 -0.32 1.03 1.96 1.01 -1.26 -4.81 116.67 109.10 1m1x s ASP 564 Ca 0.74 -0.04 -0.16 0.00 0.71 0.00 0.00 52.55 53.80 1m1x s ASP 564 Cb -0.05 0.46 0.22 0.00 1.01 0.00 0.00 42.92 44.56 1m1x s ASP 564 CO 0.54 -0.74 1.22 0.00 0.21 0.00 0.00 175.17 176.40 1m1x n TYR 565 N 0.26 -3.98 -3.07 4.23 4.11 -1.26 -4.39 117.16 113.06 1m1x n TYR 565 Ca -0.18 -1.08 -0.13 0.00 -0.00 0.00 0.00 57.90 56.51 1m1x n TYR 565 Cb 0.61 -0.97 0.06 0.00 -0.00 0.00 0.00 39.34 39.04 1m1x n TYR 565 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.86 174.73 1m1x n ARG 566 N -3.74 -4.88 0.00 -3.48 3.00 -1.26 -4.83 116.66 101.46 1m1x n ARG 566 Ca 0.15 0.59 0.00 0.00 -0.00 0.00 0.00 57.85 58.59 1m1x n ARG 566 Cb 0.54 -4.85 0.00 0.00 0.00 0.00 0.00 32.46 28.15 1m1x n ARG 566 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1m1x n THR 567 N -3.47 0.00 -2.35 5.15 -1.04 -1.26 -5.03 114.28 106.28 1m1x n THR 567 Ca -0.14 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.61 1m1x n THR 567 Cb 0.60 1.18 0.05 0.00 -1.82 0.00 0.00 70.33 70.33 1m1x n THR 567 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1m1x s ALA 568 N 0.00 3.30 0.09 2.41 0.00 -1.26 -4.84 121.76 121.45 1m1x s ALA 568 Ca 0.00 -0.84 -0.26 0.00 0.00 0.00 0.00 51.96 50.86 1m1x s ALA 568 Cb 0.00 -2.56 -0.06 0.00 0.00 0.00 0.00 23.12 20.50 1m1x s ALA 568 CO 0.00 -0.99 0.80 0.00 0.00 0.00 0.00 175.76 175.58 1m1x s ALA 569 N -3.07 3.37 0.00 0.00 0.00 -1.25 -4.78 121.76 116.03 1m1x s ALA 569 Ca 0.56 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.88 1m1x s ALA 569 Cb -0.11 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 19.98 1m1x s ALA 569 CO 0.44 0.11 0.07 -3.47 0.00 0.00 0.00 175.76 172.91 1m1x n ASP 570 N 2.46 0.00 -4.53 0.00 -0.08 -1.26 -3.23 116.55 109.91 1m1x n ASP 570 Ca -0.02 0.07 -0.38 0.00 -1.51 0.00 0.00 54.79 52.95 1m1x n ASP 570 Cb 0.50 -0.03 -0.09 0.00 2.34 0.00 0.00 41.12 43.84 1m1x n ASP 570 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 1m1x n THR 571 N -1.55 -0.05 -3.20 5.18 -1.04 -1.26 -3.10 114.28 109.26 1m1x n THR 571 Ca 0.00 -0.44 -0.03 0.00 -2.04 0.00 0.00 64.05 61.54 1m1x n THR 571 Cb 0.00 -1.73 0.00 0.00 -1.82 0.00 0.00 70.33 66.78 1m1x n THR 571 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1m1x n THR 572 N 7.76 -2.53 0.00 12.58 -1.04 -1.26 -4.06 114.28 125.73 1m1x n THR 572 Ca 0.51 0.52 0.00 0.00 -2.04 0.00 0.00 64.05 63.03 1m1x n THR 572 Cb 0.31 -3.19 0.00 0.00 -1.82 0.00 0.00 70.33 65.63 1m1x n THR 572 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1m1x n GLY 573 N 1.15 0.00 3.54 3.41 0.00 -1.18 -4.74 105.19 107.37 1m1x n GLY 573 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1m1x n GLY 573 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1m1x s LEU 574 N 0.00 3.74 0.34 0.99 2.96 -1.20 -4.85 118.68 120.67 1m1x s LEU 574 Ca 0.00 -1.57 -0.29 0.00 -0.22 0.00 0.00 54.13 52.05 1m1x s LEU 574 Cb 0.00 -2.55 -0.11 0.00 0.50 0.00 0.00 46.19 44.04 1m1x s LEU 574 CO 0.00 -1.43 1.44 -1.10 -1.32 0.00 0.00 176.35 173.93 1m1x s GLN 575 N 4.62 4.20 0.24 1.98 -0.21 -1.26 -3.94 119.66 125.29 1m1x s GLN 575 Ca 0.44 2.44 -0.03 0.00 0.02 0.00 0.00 55.36 58.23 1m1x s GLN 575 Cb -0.01 -3.02 0.05 0.00 1.00 0.00 0.00 33.01 31.04 1m1x s GLN 575 CO -0.09 -0.43 0.32 -0.35 -2.12 0.00 0.00 175.29 172.62 1m1x n PRO 576 N 0.89 -0.16 -3.71 2.91 -0.04 -1.26 -4.40 135.00 129.23 1m1x n PRO 576 Ca 0.02 -0.56 -0.14 0.00 -0.04 0.00 0.00 63.50 62.78 1m1x n PRO 576 Cb 0.40 -0.31 -0.09 0.00 -0.04 0.00 0.00 33.50 33.46 1m1x n PRO 576 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1m1x s ILE 577 N -1.49 0.02 0.55 0.52 1.10 -0.18 -4.93 121.20 116.79 1m1x s ILE 577 Ca 0.19 -0.15 -0.18 0.00 -0.51 0.00 0.00 60.65 60.00 1m1x s ILE 577 Cb -0.01 -0.66 -0.05 0.00 0.15 0.00 0.00 42.46 41.89 1m1x s ILE 577 CO 0.13 -0.08 1.06 -0.76 -2.11 0.00 0.00 174.94 173.17 1m1x s LEU 578 N -0.44 3.64 0.51 8.50 2.01 -1.26 -0.37 118.68 131.26 1m1x s LEU 578 Ca -0.06 1.90 -0.21 0.00 0.01 0.00 0.00 54.13 55.77 1m1x s LEU 578 Cb -0.03 -4.55 -0.09 0.00 0.01 0.00 0.00 46.19 41.53 1m1x s LEU 578 CO 0.03 -1.05 0.87 -3.20 1.01 0.00 0.00 176.35 174.01 1m1x n ASN 579 N -1.60 0.52 -0.01 2.29 2.85 0.96 -4.77 115.26 115.50 1m1x n ASN 579 Ca 0.09 0.90 -0.11 0.00 -0.11 0.00 0.00 54.58 55.35 1m1x n ASN 579 Cb 0.52 -1.31 -0.05 0.00 1.24 0.00 0.00 39.78 40.18 1m1x n ASN 579 CO 0.00 0.00 0.00 0.06 -2.11 0.00 0.00 177.26 175.21 1m1x h GLN 580 N 0.91 0.15 -1.68 1.20 3.07 -1.93 -3.22 115.11 113.61 1m1x h GLN 580 Ca -0.46 -0.01 -0.56 0.00 0.09 0.00 0.00 58.65 57.72 1m1x h GLN 580 Cb 1.36 -0.03 -0.21 0.00 0.08 0.00 0.00 27.48 28.68 1m1x h GLN 580 CO 0.53 0.10 0.66 1.19 0.09 0.00 0.00 178.83 181.39 1m1x n PHE 581 N -5.02 2.24 -3.88 0.06 0.99 -1.26 -4.84 117.46 105.75 1m1x n PHE 581 Ca -0.05 -2.26 -0.27 0.00 -0.00 0.00 0.00 57.45 54.87 1m1x n PHE 581 Cb 0.04 -1.26 -0.17 0.00 -1.00 0.00 0.00 39.48 37.09 1m1x n PHE 581 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 1m1x s THR 582 N -3.45 0.99 0.32 4.37 -4.23 -1.22 -5.13 115.64 107.29 1m1x s THR 582 Ca 0.52 -0.41 -0.28 0.00 -1.18 0.00 0.00 61.69 60.34 1m1x s THR 582 Cb 0.39 -1.10 -0.09 0.00 1.34 0.00 0.00 72.50 73.03 1m1x s THR 582 CO -0.17 0.23 1.16 -2.16 -0.54 0.00 0.00 174.62 173.15 1m1x s PRO 583 N 1.71 4.43 0.00 3.99 0.04 -1.26 -4.91 135.00 138.99 1m1x s PRO 583 Ca 0.03 1.90 0.19 0.00 0.04 0.00 0.00 61.00 63.17 1m1x s PRO 583 Cb -0.14 -3.02 0.57 0.00 0.04 0.00 0.00 34.50 31.95 1m1x s PRO 583 CO -0.08 -0.02 1.45 0.00 0.04 0.00 0.00 177.00 178.40 1m1x n ALA 584 N 0.80 2.47 -3.27 8.56 0.00 -1.26 -4.86 120.51 122.95 1m1x n ALA 584 Ca 0.01 -0.71 -0.30 0.00 0.00 0.00 0.00 53.44 52.43 1m1x n ALA 584 Cb 0.45 -1.00 -0.17 0.00 0.00 0.00 0.00 19.45 18.73 1m1x n ALA 584 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1m1x s ASN 585 N -1.39 2.76 -0.00 0.00 0.01 -1.26 -3.44 114.94 111.62 1m1x s ASN 585 Ca 0.33 -0.49 0.01 0.00 -0.71 0.00 0.00 52.86 52.00 1m1x s ASN 585 Cb 0.18 -1.25 -0.00 0.00 0.41 0.00 0.00 41.25 40.59 1m1x s ASN 585 CO 0.26 0.13 -0.03 -0.51 -1.51 0.00 0.00 177.10 175.44 1m1x s ILE 586 N 0.41 0.26 -0.18 0.60 1.10 -0.82 -5.00 121.20 117.56 1m1x s ILE 586 Ca -0.18 -0.13 -0.12 0.00 -0.51 0.00 0.00 60.65 59.71 1m1x s ILE 586 Cb -0.17 -0.23 0.06 0.00 0.15 0.00 0.00 42.46 42.26 1m1x s ILE 586 CO 0.08 0.08 0.45 -0.94 -2.11 0.00 0.00 174.94 172.49 1m1x s SER 587 N -0.03 -0.54 0.39 4.50 1.04 -1.26 0.33 113.70 118.13 1m1x s SER 587 Ca 0.01 0.95 0.08 0.00 0.48 0.00 0.00 55.95 57.47 1m1x s SER 587 Cb -0.02 0.87 -0.05 0.00 0.10 0.00 0.00 66.02 66.93 1m1x s SER 587 CO -0.00 -0.19 0.18 -0.13 0.98 0.00 0.00 173.24 174.08 1m1x s ARG 588 N 1.09 2.28 0.03 4.02 1.81 -0.56 -4.93 118.95 122.68 1m1x s ARG 588 Ca -0.07 -1.74 0.08 0.00 -1.72 0.00 0.00 55.73 52.29 1m1x s ARG 588 Cb -0.07 -2.07 -0.03 0.00 -0.45 0.00 0.00 34.95 32.34 1m1x s ARG 588 CO -0.10 -0.06 -0.24 -0.65 -0.68 0.00 0.00 175.30 173.58 1m1x s GLN 589 N -3.90 1.95 0.27 3.54 -0.21 -1.26 -0.07 119.66 119.98 1m1x s GLN 589 Ca 0.41 -1.03 0.09 0.00 0.02 0.00 0.00 55.36 54.85 1m1x s GLN 589 Cb 0.01 -2.06 -0.04 0.00 1.00 0.00 0.00 33.01 31.92 1m1x s GLN 589 CO 0.23 0.53 0.05 0.00 -2.12 0.00 0.00 175.29 173.98 1m1x s ALA 590 N -0.80 3.28 -0.26 6.09 0.00 0.11 -4.92 121.76 125.27 1m1x s ALA 590 Ca 0.12 -1.61 -0.02 0.00 0.00 0.00 0.00 51.96 50.45 1m1x s ALA 590 Cb -0.10 -0.89 0.12 0.00 0.00 0.00 0.00 23.12 22.24 1m1x s ALA 590 CO 0.02 0.25 0.26 -1.01 0.00 0.00 0.00 175.76 175.28 1m1x s HIS 591 N -2.29 -0.36 0.14 0.00 3.76 -0.38 -1.95 115.29 114.21 1m1x s HIS 591 Ca 0.32 -0.04 -0.35 0.00 -0.15 0.00 0.00 55.06 54.84 1m1x s HIS 591 Cb -0.07 -0.44 -0.15 0.00 1.11 0.00 0.00 32.58 33.04 1m1x s HIS 591 CO 0.21 -0.80 1.45 -0.89 -0.85 0.00 0.00 174.74 173.86 1m1x n ILE 592 N 5.31 0.15 -1.91 0.60 5.41 -1.26 -1.35 119.36 126.32 1m1x n ILE 592 Ca -0.04 -0.04 -0.42 0.00 1.00 0.00 0.00 62.75 63.26 1m1x n ILE 592 Cb 0.47 -1.23 -0.03 0.00 -0.71 0.00 0.00 39.64 38.15 1m1x n ILE 592 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 1m1x s LEU 593 N 0.66 4.37 -0.30 1.39 0.20 0.68 -4.81 118.68 120.87 1m1x s LEU 593 Ca 0.79 2.65 -0.08 0.00 0.69 0.00 0.00 54.13 58.19 1m1x s LEU 593 Cb -0.79 -3.59 0.15 0.00 -0.43 0.00 0.00 46.19 41.53 1m1x s LEU 593 CO 0.43 -0.85 0.64 -0.22 -0.29 0.00 0.00 176.35 176.07 1m1x s LEU 594 N 1.18 -1.20 0.00 -0.68 2.96 -1.26 -4.82 118.68 114.85 1m1x s LEU 594 Ca 0.71 1.37 0.00 0.00 -0.22 0.00 0.00 54.13 55.99 1m1x s LEU 594 Cb -0.44 2.26 0.00 0.00 0.50 0.00 0.00 46.19 48.50 1m1x s LEU 594 CO 0.31 -0.23 0.00 0.47 -1.32 0.00 0.00 176.35 175.58 1m1x n ASP 595 N 5.44 0.00 -2.96 3.68 9.92 -1.26 -4.90 116.55 126.47 1m1x n ASP 595 Ca -0.09 0.00 -0.31 0.00 -0.53 0.00 0.00 54.79 53.86 1m1x n ASP 595 Cb 0.50 -0.08 -0.07 0.00 -0.64 0.00 0.00 41.12 40.83 1m1x n ASP 595 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1m1x n GLY 597 N 3.29 0.02 4.92 0.00 0.00 -1.26 -2.96 105.19 109.19 1m1x n GLY 597 Ca 0.68 0.64 0.00 0.00 0.00 0.00 0.00 46.02 47.35 1m1x n GLY 597 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1m1x n GLU 598 N 3.42 0.00 0.01 1.61 0.28 -1.26 -4.14 120.64 120.56 1m1x n GLU 598 Ca 0.26 0.00 0.13 0.00 -0.16 0.00 0.00 57.16 57.38 1m1x n GLU 598 Cb -0.03 -0.27 0.55 0.00 1.43 0.00 0.00 31.44 33.12 1m1x n GLU 598 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1m1x n ASP 599 N 0.00 0.05 0.00 -1.84 5.75 -1.26 -4.84 116.55 114.41 1m1x n ASP 599 Ca 0.00 0.51 0.00 0.00 -0.01 0.00 0.00 54.79 55.29 1m1x n ASP 599 Cb 0.00 -0.52 0.00 0.00 -1.03 0.00 0.00 41.12 39.57 1m1x n ASP 599 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1m1x n ASN 600 N -1.55 0.00 -4.86 -1.12 3.02 -1.16 -4.97 115.26 104.63 1m1x n ASN 600 Ca 0.06 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.24 1m1x n ASN 600 Cb 0.31 -0.59 -0.06 0.00 -0.61 0.00 0.00 39.78 38.83 1m1x n ASN 600 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1m1x s VAL 601 N -2.62 5.20 -1.08 2.41 1.01 -1.25 -4.86 120.40 119.20 1m1x s VAL 601 Ca 0.00 0.57 -0.07 0.00 0.00 0.00 0.00 61.98 62.48 1m1x s VAL 601 Cb 0.00 -3.60 0.28 0.00 0.00 0.00 0.00 36.38 33.06 1m1x s VAL 601 CO 0.00 0.55 1.19 0.00 0.00 0.00 0.00 175.10 176.85 1m1x s LYS 603 N -1.77 3.10 0.94 0.00 -2.85 -1.26 -4.50 119.74 113.40 1m1x s LYS 603 Ca 0.31 -1.01 -0.14 0.00 -1.00 0.00 0.00 55.97 54.13 1m1x s LYS 603 Cb -0.05 -4.15 0.19 0.00 -2.06 0.00 0.00 37.83 31.77 1m1x s LYS 603 CO -0.03 -1.31 1.29 -1.25 0.10 0.00 0.00 175.35 174.15 1m1x s PRO 604 N 2.66 0.74 -0.30 1.78 0.04 -1.26 -3.42 135.00 135.24 1m1x s PRO 604 Ca 0.14 -0.50 -0.01 0.00 0.04 0.00 0.00 61.00 60.67 1m1x s PRO 604 Cb -0.21 -1.90 0.10 0.00 0.04 0.00 0.00 34.50 32.53 1m1x s PRO 604 CO 0.10 -2.32 0.09 0.21 0.04 0.00 0.00 177.00 175.13 1m1x s LYS 605 N -5.81 0.66 -0.03 4.56 2.20 -1.26 -4.63 119.74 115.42 1m1x s LYS 605 Ca 0.73 -0.95 -0.03 0.00 -0.36 0.00 0.00 55.97 55.36 1m1x s LYS 605 Cb -0.04 -1.91 -0.04 0.00 -1.51 0.00 0.00 37.83 34.33 1m1x s LYS 605 CO 0.52 -0.96 0.14 -0.51 -0.36 0.00 0.00 175.35 174.18 1m1x s LEU 606 N 1.69 4.22 -0.25 5.43 1.43 -1.26 0.89 118.68 130.84 1m1x s LEU 606 Ca 0.09 0.31 -0.12 0.00 -1.03 0.00 0.00 54.13 53.38 1m1x s LEU 606 Cb -0.17 -2.38 0.09 0.00 0.03 0.00 0.00 46.19 43.75 1m1x s LEU 606 CO -0.25 0.30 0.58 -1.83 0.23 0.00 0.00 176.35 175.38 1m1x s GLU 607 N -1.66 0.55 0.53 1.70 1.03 -1.11 -4.23 118.70 115.51 1m1x s GLU 607 Ca 0.23 1.15 0.09 0.00 0.03 0.00 0.00 54.97 56.46 1m1x s GLU 607 Cb -0.12 0.29 0.06 0.00 -0.80 0.00 0.00 34.13 33.56 1m1x s GLU 607 CO 0.14 -0.18 0.73 0.14 -1.33 0.00 0.00 175.26 174.76 1m1x s VAL 608 N 2.00 2.44 -0.30 1.83 -7.23 -1.26 -2.56 120.40 115.32 1m1x s VAL 608 Ca -0.08 -0.98 -0.24 0.00 -1.81 0.00 0.00 61.98 58.87 1m1x s VAL 608 Cb -0.08 -2.46 0.20 0.00 0.56 0.00 0.00 36.38 34.60 1m1x s VAL 608 CO -0.17 0.00 1.46 -0.55 -0.31 0.00 0.00 175.10 175.53 1m1x s SER 609 N -4.56 -0.02 -0.04 4.85 0.15 -1.22 -4.88 113.70 107.98 1m1x s SER 609 Ca 0.60 0.03 0.00 0.00 0.70 0.00 0.00 55.95 57.28 1m1x s SER 609 Cb -0.07 0.16 0.03 0.00 -1.71 0.00 0.00 66.02 64.42 1m1x s SER 609 CO 0.37 -0.01 -0.01 0.54 1.20 0.00 0.00 173.24 175.34 1m1x s VAL 610 N 0.14 0.31 -1.36 4.45 0.11 -1.26 -0.73 120.40 122.05 1m1x s VAL 610 Ca 0.06 0.04 0.06 0.00 -2.93 0.00 0.00 61.98 59.21 1m1x s VAL 610 Cb -0.05 -0.40 0.10 0.00 -1.53 0.00 0.00 36.38 34.50 1m1x s VAL 610 CO -0.16 0.19 1.08 0.47 -3.33 0.00 0.00 175.10 173.35 1m1x n ASP 611 N 4.33 0.00 -1.25 3.54 8.00 -1.24 -4.89 116.55 125.05 1m1x n ASP 611 Ca -0.22 0.24 -0.16 0.00 0.71 0.00 0.00 54.79 55.37 1m1x n ASP 611 Cb 0.50 -0.32 -0.06 0.00 -0.02 0.00 0.00 41.12 41.22 1m1x n ASP 611 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1m1x n SER 612 N -1.32 -4.87 -4.69 -2.24 2.88 -1.26 -4.96 113.62 97.17 1m1x n SER 612 Ca 0.03 0.36 -0.43 0.00 -1.33 0.00 0.00 58.87 57.50 1m1x n SER 612 Cb 0.05 -3.77 -0.01 0.00 -0.75 0.00 0.00 64.21 59.74 1m1x n SER 612 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1m1x n ASP 613 N -0.56 2.59 -2.79 -3.46 2.03 -1.26 -3.84 116.55 109.26 1m1x n ASP 613 Ca -0.16 1.20 -0.05 0.00 0.52 0.00 0.00 54.79 56.30 1m1x n ASP 613 Cb 0.52 -1.46 0.01 0.00 -0.72 0.00 0.00 41.12 39.47 1m1x n ASP 613 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1m1x n GLN 614 N 0.61 -2.76 0.00 -0.67 -0.06 -1.26 -4.86 117.38 108.37 1m1x n GLN 614 Ca 0.05 2.35 0.06 0.00 -2.00 0.00 0.00 57.00 57.47 1m1x n GLN 614 Cb 0.35 -5.54 0.37 0.00 -4.06 0.00 0.00 30.24 21.36 1m1x n GLN 614 CO 0.00 0.00 0.00 1.63 -0.20 0.00 0.00 177.06 178.49 1m1x n LYS 615 N 0.05 0.35 -3.88 3.69 5.02 -1.25 -4.83 118.16 117.31 1m1x n LYS 615 Ca 0.08 0.04 -0.11 0.00 -2.02 0.00 0.00 58.31 56.30 1m1x n LYS 615 Cb 0.29 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.70 1m1x n LYS 615 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1m1x s LYS 616 N -2.14 0.43 -0.02 1.97 0.00 -1.26 -3.02 119.74 115.69 1m1x s LYS 616 Ca 0.17 -0.35 0.02 0.00 0.00 0.00 0.00 55.97 55.81 1m1x s LYS 616 Cb 0.09 0.18 0.01 0.00 0.00 0.00 0.00 37.83 38.10 1m1x s LYS 616 CO 0.16 -0.10 -0.07 0.96 0.00 0.00 0.00 175.35 176.30 1m1x s ILE 617 N -1.22 0.63 0.46 3.79 -4.36 -0.99 -5.01 121.20 114.50 1m1x s ILE 617 Ca -0.13 -0.26 -0.04 0.00 -0.26 0.00 0.00 60.65 59.95 1m1x s ILE 617 Cb -0.07 -0.58 -0.03 0.00 1.25 0.00 0.00 42.46 43.03 1m1x s ILE 617 CO 0.01 0.21 0.75 -0.31 0.24 0.00 0.00 174.94 175.84 1m1x s TYR 618 N 0.30 3.54 -0.30 1.37 1.51 -1.26 -0.21 117.35 122.31 1m1x s TYR 618 Ca -0.04 0.73 -0.18 0.00 -1.01 0.00 0.00 57.07 56.57 1m1x s TYR 618 Cb -0.09 -2.25 -0.02 0.00 -0.11 0.00 0.00 41.96 39.50 1m1x s TYR 618 CO 0.00 -0.23 0.52 0.42 -1.11 0.00 0.00 175.55 175.14 1m1x s ILE 619 N -2.68 5.04 0.00 2.71 1.01 -0.50 -4.51 121.20 122.27 1m1x s ILE 619 Ca 0.46 0.66 0.00 0.00 0.00 0.00 0.00 60.65 61.77 1m1x s ILE 619 Cb -0.10 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.48 1m1x s ILE 619 CO 0.43 -0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.94 1m1x n GLY 620 N 4.57 3.32 4.02 6.18 0.00 -1.26 -0.39 105.19 121.63 1m1x n GLY 620 Ca -0.04 -0.53 -0.21 0.00 0.00 0.00 0.00 46.02 45.23 1m1x n GLY 620 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1m1x s ASP 621 N 0.00 4.95 -0.32 1.61 3.84 -1.26 -4.85 116.67 120.64 1m1x s ASP 621 Ca 0.00 -0.98 -0.27 0.00 -0.00 0.00 0.00 52.55 51.30 1m1x s ASP 621 Cb 0.00 0.47 0.01 0.00 -1.38 0.00 0.00 42.92 42.03 1m1x s ASP 621 CO 0.00 -1.40 0.99 -1.81 -0.00 0.00 0.00 175.17 172.95 1m1x s ASP 622 N -4.66 6.83 -0.42 2.11 -0.00 -1.26 -4.53 116.67 114.74 1m1x s ASP 622 Ca 0.58 0.89 -0.20 0.00 -0.00 0.00 0.00 52.55 53.83 1m1x s ASP 622 Cb -0.05 -2.50 0.02 0.00 -0.00 0.00 0.00 42.92 40.39 1m1x s ASP 622 CO 0.37 -0.82 0.58 0.20 -0.00 0.00 0.00 175.17 175.50 1m1x s ASN 623 N 1.68 6.29 0.01 0.27 0.01 -0.53 -4.89 114.94 117.79 1m1x s ASN 623 Ca 0.41 -0.38 -0.30 0.00 -0.71 0.00 0.00 52.86 51.88 1m1x s ASN 623 Cb -0.13 -2.29 -0.07 0.00 0.41 0.00 0.00 41.25 39.17 1m1x s ASN 623 CO 0.15 -0.70 1.61 -2.84 -1.51 0.00 0.00 177.10 173.81 1m1x s PRO 624 N 2.62 4.21 -0.11 -0.60 0.02 -1.26 -0.69 135.00 139.18 1m1x s PRO 624 Ca 0.20 2.21 -0.01 0.00 0.02 0.00 0.00 61.00 63.42 1m1x s PRO 624 Cb -0.15 -3.74 0.03 0.00 0.02 0.00 0.00 34.50 30.66 1m1x s PRO 624 CO 0.17 -0.74 -0.06 -1.17 -0.33 0.00 0.00 177.00 174.86 1m1x s LEU 625 N 3.11 1.11 -0.12 -5.54 0.20 -0.60 -4.95 118.68 111.89 1m1x s LEU 625 Ca 0.72 -0.28 -0.03 0.00 0.69 0.00 0.00 54.13 55.23 1m1x s LEU 625 Cb -0.36 -0.78 -0.03 0.00 -0.43 0.00 0.00 46.19 44.59 1m1x s LEU 625 CO 0.30 -0.13 0.00 0.42 -0.29 0.00 0.00 176.35 176.65 1m1x s THR 626 N 1.75 4.28 -0.13 3.68 -4.23 -1.26 0.22 115.64 119.94 1m1x s THR 626 Ca 0.05 -0.24 -0.02 0.00 -1.18 0.00 0.00 61.69 60.30 1m1x s THR 626 Cb -0.13 -2.83 -0.02 0.00 1.34 0.00 0.00 72.50 70.86 1m1x s THR 626 CO -0.08 0.56 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.72 1m1x s LEU 627 N -0.40 3.02 -0.64 4.79 1.43 0.12 -4.91 118.68 122.09 1m1x s LEU 627 Ca 0.08 -0.20 -0.10 0.00 -1.03 0.00 0.00 54.13 52.87 1m1x s LEU 627 Cb -0.12 -1.70 0.17 0.00 0.03 0.00 0.00 46.19 44.56 1m1x s LEU 627 CO 0.02 0.19 0.54 -0.63 0.23 0.00 0.00 176.35 176.70 1m1x s ILE 628 N 0.21 4.72 0.16 -0.59 -1.09 -1.26 -0.52 121.20 122.83 1m1x s ILE 628 Ca -0.05 -2.25 -0.21 0.00 -2.23 0.00 0.00 60.65 55.91 1m1x s ILE 628 Cb -0.14 -4.01 -0.08 0.00 -1.58 0.00 0.00 42.46 36.64 1m1x s ILE 628 CO 0.04 -0.90 0.69 0.68 -1.23 0.00 0.00 174.94 174.22 1m1x s VAL 629 N 0.65 4.56 -0.62 2.92 -7.23 -0.36 -3.68 120.40 116.64 1m1x s VAL 629 Ca 0.12 1.39 0.05 0.00 -1.81 0.00 0.00 61.98 61.72 1m1x s VAL 629 Cb -0.20 -3.96 0.17 0.00 0.56 0.00 0.00 36.38 32.95 1m1x s VAL 629 CO -0.04 0.41 0.44 -0.75 -0.31 0.00 0.00 175.10 174.86 1m1x s LYS 630 N -1.45 2.02 -0.00 4.82 2.20 0.09 -1.34 119.74 126.08 1m1x s LYS 630 Ca 0.36 -2.97 -0.13 0.00 -0.36 0.00 0.00 55.97 52.87 1m1x s LYS 630 Cb -0.20 -2.88 -0.06 0.00 -1.51 0.00 0.00 37.83 33.19 1m1x s LYS 630 CO 0.22 -1.30 0.38 0.00 -0.36 0.00 0.00 175.35 174.29 1m1x s ALA 631 N -0.98 3.72 0.22 3.13 0.00 -0.04 -3.39 121.76 124.42 1m1x s ALA 631 Ca 0.26 -0.27 -0.16 0.00 0.00 0.00 0.00 51.96 51.79 1m1x s ALA 631 Cb -0.04 -2.33 0.01 0.00 0.00 0.00 0.00 23.12 20.76 1m1x s ALA 631 CO -0.16 0.50 0.51 1.14 0.00 0.00 0.00 175.76 177.75 1m1x s GLN 632 N -1.16 1.45 -0.16 0.00 -2.07 -1.06 0.28 119.66 116.94 1m1x s GLN 632 Ca 0.24 -1.01 0.01 0.00 -1.82 0.00 0.00 55.36 52.77 1m1x s GLN 632 Cb -0.16 0.50 0.02 0.00 -1.09 0.00 0.00 33.01 32.28 1m1x s GLN 632 CO 0.13 -0.61 -0.16 1.21 -1.32 0.00 0.00 175.29 174.54 1m1x s ASN 633 N -2.93 2.86 0.00 12.60 3.04 -0.20 -2.76 114.94 127.55 1m1x s ASN 633 Ca 0.14 -0.56 0.08 0.00 0.04 0.00 0.00 52.86 52.56 1m1x s ASN 633 Cb -0.01 -1.29 0.06 0.00 -1.54 0.00 0.00 41.25 38.47 1m1x s ASN 633 CO 0.02 -0.04 0.75 1.67 -3.04 0.00 0.00 177.10 176.46 1m1x n GLN 634 N 4.71 0.25 0.00 0.43 -0.06 0.26 0.11 117.38 123.08 1m1x n GLN 634 Ca -0.18 -0.96 0.00 0.00 -2.00 0.00 0.00 57.00 53.85 1m1x n GLN 634 Cb 0.50 -1.15 0.00 0.00 -4.06 0.00 0.00 30.24 25.53 1m1x n GLN 634 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1m1x n GLY 635 N 0.48 3.29 0.00 1.69 0.00 -1.23 -4.59 105.19 104.82 1m1x n GLY 635 Ca 0.05 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.05 1m1x n GLY 635 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1m1x n GLU 636 N 0.00 3.36 -1.53 1.61 0.28 -1.22 -4.27 120.64 118.87 1m1x n GLU 636 Ca 0.00 0.00 -0.47 0.00 -0.16 0.00 0.00 57.16 56.53 1m1x n GLU 636 Cb 0.00 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 32.84 1m1x n GLU 636 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1m1x n GLY 637 N 5.00 -0.65 2.72 -1.84 0.00 -1.26 -4.36 105.19 104.80 1m1x n GLY 637 Ca 0.00 0.38 -0.29 0.00 0.00 0.00 0.00 46.02 46.11 1m1x n GLY 637 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m1x s ALA 638 N -0.87 2.51 0.28 4.61 0.00 -1.25 -4.17 121.76 122.87 1m1x s ALA 638 Ca 0.63 -2.93 -0.30 0.00 0.00 0.00 0.00 51.96 49.37 1m1x s ALA 638 Cb -0.81 -1.93 -0.11 0.00 0.00 0.00 0.00 23.12 20.28 1m1x s ALA 638 CO 0.57 -2.05 1.53 0.71 0.00 0.00 0.00 175.76 176.52 1m1x s TYR 639 N -0.19 2.86 -0.97 0.00 2.02 -1.26 -1.90 117.35 117.91 1m1x s TYR 639 Ca 0.22 0.89 -0.13 0.00 -0.37 0.00 0.00 57.07 57.68 1m1x s TYR 639 Cb -0.15 -3.96 0.01 0.00 -0.40 0.00 0.00 41.96 37.46 1m1x s TYR 639 CO -0.07 -3.20 0.68 0.39 -1.57 0.00 0.00 175.55 171.78 1m1x n GLU 640 N 2.21 -1.14 -2.82 -0.62 1.02 -1.07 -1.39 120.64 116.83 1m1x n GLU 640 Ca 0.07 0.63 -0.33 0.00 -0.02 0.00 0.00 57.16 57.52 1m1x n GLU 640 Cb 0.39 -3.19 -0.06 0.00 -0.02 0.00 0.00 31.44 28.55 1m1x n GLU 640 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1m1x s ALA 641 N -3.22 3.10 -0.24 0.62 0.00 -1.19 -4.12 121.76 116.72 1m1x s ALA 641 Ca 0.22 0.30 -0.27 0.00 0.00 0.00 0.00 51.96 52.21 1m1x s ALA 641 Cb -0.10 -3.07 0.12 0.00 0.00 0.00 0.00 23.12 20.07 1m1x s ALA 641 CO 0.89 0.12 1.00 -1.83 0.00 0.00 0.00 175.76 175.93 1m1x s GLU 642 N -3.27 0.56 0.10 0.00 -1.05 -1.17 -2.68 118.70 111.19 1m1x s GLU 642 Ca 0.60 0.47 -0.20 0.00 -0.15 0.00 0.00 54.97 55.69 1m1x s GLU 642 Cb -0.09 0.27 -0.07 0.00 -0.44 0.00 0.00 34.13 33.80 1m1x s GLU 642 CO 0.16 -0.11 0.61 -1.17 0.95 0.00 0.00 175.26 175.71 1m1x s LEU 643 N -0.20 4.53 -0.41 1.83 2.96 -0.67 -1.15 118.68 125.57 1m1x s LEU 643 Ca 0.01 1.34 0.02 0.00 -0.22 0.00 0.00 54.13 55.28 1m1x s LEU 643 Cb -0.04 -3.02 0.12 0.00 0.50 0.00 0.00 46.19 43.76 1m1x s LEU 643 CO -0.03 0.25 0.17 -0.63 -1.32 0.00 0.00 176.35 174.79 1m1x s ILE 644 N -1.15 1.76 -0.22 6.68 -1.09 0.21 -2.32 121.20 125.07 1m1x s ILE 644 Ca 0.31 -2.44 -0.18 0.00 -2.23 0.00 0.00 60.65 56.11 1m1x s ILE 644 Cb -0.20 -2.26 -0.03 0.00 -1.58 0.00 0.00 42.46 38.39 1m1x s ILE 644 CO 0.21 -0.76 0.53 -0.69 -1.23 0.00 0.00 174.94 172.99 1m1x s VAL 645 N 0.60 5.09 -0.09 2.92 1.01 0.34 -3.10 120.40 127.16 1m1x s VAL 645 Ca 0.14 0.96 -0.16 0.00 0.00 0.00 0.00 61.98 62.92 1m1x s VAL 645 Cb -0.22 -3.85 -0.05 0.00 0.00 0.00 0.00 36.38 32.26 1m1x s VAL 645 CO -0.07 0.15 0.41 -0.44 0.00 0.00 0.00 175.10 175.14 1m1x s SER 646 N 1.26 6.66 0.11 3.32 0.01 -0.30 -0.53 113.70 124.23 1m1x s SER 646 Ca 0.24 0.78 0.05 0.00 1.31 0.00 0.00 55.95 58.33 1m1x s SER 646 Cb -0.15 -2.25 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 1m1x s SER 646 CO 0.09 0.12 -0.13 0.27 0.41 0.00 0.00 173.24 174.01 1m1x s ILE 647 N 0.07 1.21 0.32 1.44 -4.36 -1.16 -2.56 121.20 116.16 1m1x s ILE 647 Ca 0.23 -1.69 -0.05 0.00 -0.26 0.00 0.00 60.65 58.87 1m1x s ILE 647 Cb -0.15 -1.47 0.07 0.00 1.25 0.00 0.00 42.46 42.16 1m1x s ILE 647 CO 0.09 -0.46 0.39 -0.81 0.24 0.00 0.00 174.94 174.40 1m1x n PRO 648 N 0.55 -0.70 0.00 0.37 -0.04 -1.26 -4.50 135.00 129.42 1m1x n PRO 648 Ca -0.16 -0.61 0.08 0.00 -0.04 0.00 0.00 63.50 62.78 1m1x n PRO 648 Cb 0.57 -0.44 0.41 0.00 -0.04 0.00 0.00 33.50 34.00 1m1x n PRO 648 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1m1x n LEU 649 N 0.00 0.00 -1.34 1.53 4.32 -1.26 -3.22 117.00 117.03 1m1x n LEU 649 Ca 0.05 0.33 0.04 0.00 -0.02 0.00 0.00 56.01 56.42 1m1x n LEU 649 Cb 0.18 -0.33 0.06 0.00 -1.62 0.00 0.00 43.42 41.70 1m1x n LEU 649 CO 0.13 -0.14 0.12 0.00 -1.22 0.00 0.00 177.39 176.27 1m1x n GLN 650 N -1.33 0.34 0.00 3.23 0.00 -1.26 -4.93 117.38 113.42 1m1x n GLN 650 Ca 0.07 -2.28 0.00 0.00 0.00 0.00 0.00 57.00 54.79 1m1x n GLN 650 Cb 0.15 -0.34 0.00 0.00 0.00 0.00 0.00 30.24 30.05 1m1x n GLN 650 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1m1x n ALA 651 N 0.17 0.00 -2.06 2.61 0.00 -1.20 -1.71 120.51 118.32 1m1x n ALA 651 Ca 0.09 -0.01 -0.02 0.00 0.00 0.00 0.00 53.44 53.49 1m1x n ALA 651 Cb 1.06 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.49 1m1x n ALA 651 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1m1x n ASP 652 N -1.51 -3.18 -4.69 0.00 9.92 -1.26 -2.99 116.55 112.83 1m1x n ASP 652 Ca 0.00 0.98 -0.42 0.00 -0.53 0.00 0.00 54.79 54.82 1m1x n ASP 652 Cb 0.00 -3.69 -0.03 0.00 -0.64 0.00 0.00 41.12 36.76 1m1x n ASP 652 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1m1x s PHE 653 N -0.40 3.15 -0.04 1.24 5.36 -1.26 -2.94 117.98 123.09 1m1x s PHE 653 Ca -0.11 1.11 -0.01 0.00 -0.96 0.00 0.00 56.93 56.96 1m1x s PHE 653 Cb 0.01 -3.50 -0.00 0.00 -0.34 0.00 0.00 43.02 39.18 1m1x s PHE 653 CO 0.31 -1.67 -0.01 0.82 -1.46 0.00 0.00 175.22 173.20 1m1x h ILE 654 N 4.84 0.00 -0.97 3.12 2.04 -1.66 -3.49 117.51 121.39 1m1x h ILE 654 Ca -0.37 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.13 1m1x h ILE 654 Cb 1.18 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1m1x h ILE 654 CO 0.87 0.00 0.00 0.61 0.00 0.00 0.00 178.15 179.63 1m1x n GLY 655 N 1.87 0.58 0.00 5.37 0.00 -1.25 -5.07 105.19 106.69 1m1x n GLY 655 Ca -0.01 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1m1x n GLY 655 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1m1x n VAL 656 N 0.00 0.00 -3.32 1.61 0.31 -1.26 -2.95 118.33 112.71 1m1x n VAL 656 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1m1x n VAL 656 Cb 0.00 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 1m1x n VAL 656 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1m1x s VAL 657 N 0.00 -0.91 -0.13 2.52 0.11 -1.20 -4.25 120.40 116.54 1m1x s VAL 657 Ca 0.00 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 59.13 1m1x s VAL 657 Cb 0.00 -0.94 -0.13 0.00 -1.53 0.00 0.00 36.38 33.78 1m1x s VAL 657 CO 0.00 -0.02 -0.02 0.54 -3.33 0.00 0.00 175.10 172.28 1m1x n ARG 658 N 5.42 1.52 -0.16 1.54 1.74 -1.26 -4.50 116.66 120.96 1m1x n ARG 658 Ca -0.04 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1m1x n ARG 658 Cb 0.50 -1.30 0.00 0.00 -1.02 0.00 0.00 32.46 30.64 1m1x n ARG 658 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1m1x n ASN 659 N -2.60 1.84 -3.65 0.55 0.23 -1.26 -4.65 115.26 105.71 1m1x n ASN 659 Ca -0.22 -1.44 -0.07 0.00 -0.53 0.00 0.00 54.58 52.32 1m1x n ASN 659 Cb 0.85 -0.38 -0.08 0.00 -2.08 0.00 0.00 39.78 38.09 1m1x n ASN 659 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 1m1x s ASN 660 N 1.92 -0.84 0.22 0.53 3.84 -1.26 -5.04 114.94 114.30 1m1x s ASN 660 Ca 0.00 1.36 0.25 0.00 0.21 0.00 0.00 52.86 54.68 1m1x s ASN 660 Cb 0.00 1.33 0.89 0.00 -0.55 0.00 0.00 41.25 42.92 1m1x s ASN 660 CO 0.00 -0.23 1.75 -0.62 -2.79 0.00 0.00 177.10 175.21 1m1x n GLU 661 N 4.45 0.22 -0.04 0.43 -0.58 -1.26 -3.31 120.64 120.55 1m1x n GLU 661 Ca -0.20 0.29 -0.06 0.00 -0.42 0.00 0.00 57.16 56.77 1m1x n GLU 661 Cb 0.57 -1.81 -0.14 0.00 -0.57 0.00 0.00 31.44 29.49 1m1x n GLU 661 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1m1x n ALA 662 N -1.76 1.67 -2.33 0.62 0.00 -1.26 -4.98 120.51 112.46 1m1x n ALA 662 Ca 0.04 -0.94 -0.30 0.00 0.00 0.00 0.00 53.44 52.25 1m1x n ALA 662 Cb 0.34 -0.60 -0.03 0.00 0.00 0.00 0.00 19.45 19.16 1m1x n ALA 662 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1m1x s LEU 663 N -5.69 3.93 0.11 0.00 1.43 -1.21 -4.93 118.68 112.32 1m1x s LEU 663 Ca -0.07 0.95 -0.05 0.00 -1.03 0.00 0.00 54.13 53.94 1m1x s LEU 663 Cb 0.08 -3.80 -0.05 0.00 0.03 0.00 0.00 46.19 42.44 1m1x s LEU 663 CO 0.83 -0.31 0.34 0.00 0.23 0.00 0.00 176.35 177.44 1m1x s ALA 664 N -2.24 3.82 -1.12 4.21 0.00 -1.20 -4.89 121.76 120.34 1m1x s ALA 664 Ca 0.48 -0.58 -0.09 0.00 0.00 0.00 0.00 51.96 51.77 1m1x s ALA 664 Cb -0.10 -2.09 0.28 0.00 0.00 0.00 0.00 23.12 21.20 1m1x s ALA 664 CO 0.30 0.68 1.16 0.54 0.00 0.00 0.00 175.76 178.44 1m1x n ARG 665 N 0.34 3.61 -2.04 0.00 1.74 -1.26 -4.54 116.66 114.50 1m1x n ARG 665 Ca -0.05 -4.45 -0.33 0.00 -0.77 0.00 0.00 57.85 52.26 1m1x n ARG 665 Cb 0.52 -2.56 0.01 0.00 -1.02 0.00 0.00 32.46 29.41 1m1x n ARG 665 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1m1x s LEU 666 N -1.33 3.51 -0.02 0.55 1.43 -1.26 -4.93 118.68 116.63 1m1x s LEU 666 Ca 0.31 1.86 -0.03 0.00 -1.03 0.00 0.00 54.13 55.24 1m1x s LEU 666 Cb -0.09 -4.54 -0.10 0.00 0.03 0.00 0.00 46.19 41.49 1m1x s LEU 666 CO -0.06 -1.21 2.70 -1.20 0.23 0.00 0.00 176.35 176.81 1m1x n SER 667 N -2.00 5.37 -4.77 2.29 7.64 -1.26 -4.91 113.62 115.98 1m1x n SER 667 Ca 0.09 -2.48 -0.41 0.00 1.01 0.00 0.00 58.87 57.08 1m1x n SER 667 Cb 0.53 -1.25 -0.01 0.00 -1.01 0.00 0.00 64.21 62.46 1m1x n SER 667 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1m1x s ALA 669 N -0.80 -0.28 0.35 0.00 0.00 0.41 -4.96 121.76 116.49 1m1x s ALA 669 Ca 0.54 0.05 -0.22 0.00 0.00 0.00 0.00 51.96 52.34 1m1x s ALA 669 Cb -0.44 -0.04 -0.10 0.00 0.00 0.00 0.00 23.12 22.54 1m1x s ALA 669 CO 0.56 -0.14 0.89 0.12 0.00 0.00 0.00 175.76 177.18 1m1x s PHE 670 N -0.72 3.49 -0.14 0.00 2.19 -1.26 -1.21 117.98 120.32 1m1x s PHE 670 Ca -0.08 1.58 -0.29 0.00 0.33 0.00 0.00 56.93 58.47 1m1x s PHE 670 Cb -0.05 -2.80 0.09 0.00 -1.31 0.00 0.00 43.02 38.95 1m1x s PHE 670 CO 0.01 0.09 0.78 0.21 1.83 0.00 0.00 175.22 178.14 1m1x s LYS 671 N -2.62 0.87 -0.07 10.12 2.20 0.08 -4.95 119.74 125.36 1m1x s LYS 671 Ca 0.54 0.44 -0.03 0.00 -0.36 0.00 0.00 55.97 56.57 1m1x s LYS 671 Cb -0.13 0.41 0.04 0.00 -1.51 0.00 0.00 37.83 36.64 1m1x s LYS 671 CO 0.18 -0.22 0.14 0.95 -0.36 0.00 0.00 175.35 176.04 1m1x s THR 672 N -0.67 -0.14 0.00 3.43 -4.23 -1.26 -0.42 115.64 112.35 1m1x s THR 672 Ca -0.05 0.27 0.00 0.00 -1.18 0.00 0.00 61.69 60.73 1m1x s THR 672 Cb -0.02 -0.25 0.00 0.00 1.34 0.00 0.00 72.50 73.57 1m1x s THR 672 CO 0.05 0.11 0.00 1.21 -0.54 0.00 0.00 174.62 175.45 1m1x n GLU 673 N 4.73 1.85 -1.56 3.99 4.07 -1.24 -5.04 120.64 127.43 1m1x n GLU 673 Ca -0.16 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.94 1m1x n GLU 673 Cb 0.51 -0.81 0.00 0.00 -0.06 0.00 0.00 31.44 31.08 1m1x n GLU 673 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1m1x n ASN 674 N -1.59 1.64 -2.10 4.31 5.15 -1.26 -4.94 115.26 116.47 1m1x n ASN 674 Ca 0.00 -0.85 -0.07 0.00 -0.60 0.00 0.00 54.58 53.05 1m1x n ASN 674 Cb 0.31 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.45 1m1x n ASN 674 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1m1x n GLN 675 N -0.15 1.31 -3.71 1.20 3.00 -1.26 -4.64 117.38 113.12 1m1x n GLN 675 Ca 0.00 -0.61 -0.13 0.00 -0.01 0.00 0.00 57.00 56.25 1m1x n GLN 675 Cb 0.00 -1.77 -0.10 0.00 0.00 0.00 0.00 30.24 28.38 1m1x n GLN 675 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.06 176.98 1m1x s THR 676 N 1.50 -0.00 -0.09 5.09 -1.32 -1.26 -5.16 115.64 114.40 1m1x s THR 676 Ca 0.41 0.01 -0.01 0.00 -1.21 0.00 0.00 61.69 60.89 1m1x s THR 676 Cb 0.20 -0.64 -0.03 0.00 -1.51 0.00 0.00 72.50 70.51 1m1x s THR 676 CO 0.00 0.00 -0.03 -0.13 -2.21 0.00 0.00 174.62 172.25 1m1x s ARG 677 N 0.41 3.03 -0.10 7.08 0.52 -1.26 -3.66 118.95 124.96 1m1x s ARG 677 Ca -0.01 -0.48 -0.30 0.00 -0.52 0.00 0.00 55.73 54.41 1m1x s ARG 677 Cb -0.04 -2.74 0.12 0.00 0.52 0.00 0.00 34.95 32.81 1m1x s ARG 677 CO -0.01 0.60 0.98 1.14 0.02 0.00 0.00 175.30 178.03 1m1x s GLN 678 N -0.62 0.65 -0.11 3.54 -2.07 0.44 -2.98 119.66 118.51 1m1x s GLN 678 Ca 0.10 -0.07 -0.04 0.00 -1.82 0.00 0.00 55.36 53.53 1m1x s GLN 678 Cb -0.12 0.30 -0.04 0.00 -1.09 0.00 0.00 33.01 32.07 1m1x s GLN 678 CO 0.02 -0.25 0.03 0.08 -1.32 0.00 0.00 175.29 173.85 1m1x s VAL 679 N -2.11 4.56 0.21 3.63 1.01 0.31 -0.75 120.40 127.27 1m1x s VAL 679 Ca 0.03 -0.14 0.11 0.00 0.00 0.00 0.00 61.98 61.97 1m1x s VAL 679 Cb -0.01 -2.96 -0.05 0.00 0.00 0.00 0.00 36.38 33.37 1m1x s VAL 679 CO -0.04 0.58 -0.22 0.68 0.00 0.00 0.00 175.10 176.09 1m1x s VAL 680 N -0.60 2.34 -0.12 2.92 -7.23 -0.35 -0.51 120.40 116.85 1m1x s VAL 680 Ca 0.10 -2.12 -0.08 0.00 -1.81 0.00 0.00 61.98 58.07 1m1x s VAL 680 Cb -0.12 -2.15 0.04 0.00 0.56 0.00 0.00 36.38 34.71 1m1x s VAL 680 CO 0.02 -0.21 0.29 0.00 -0.31 0.00 0.00 175.10 174.90 1m1x s ASP 682 N 0.71 6.97 -0.36 0.00 1.11 -1.26 -1.68 116.67 122.16 1m1x s ASP 682 Ca -0.05 2.05 0.07 0.00 0.18 0.00 0.00 52.55 54.80 1m1x s ASP 682 Cb -0.06 -2.57 0.55 0.00 1.07 0.00 0.00 42.92 41.91 1m1x s ASP 682 CO -0.05 -0.59 1.61 0.18 1.18 0.00 0.00 175.17 177.50 1m1x n LEU 683 N 4.63 5.06 0.00 1.23 4.32 -1.09 -4.25 117.00 126.90 1m1x n LEU 683 Ca 0.11 -3.81 0.00 0.00 -0.02 0.00 0.00 56.01 52.29 1m1x n LEU 683 Cb 0.45 -0.70 0.00 0.00 -1.62 0.00 0.00 43.42 41.55 1m1x n LEU 683 CO 0.57 1.26 0.00 0.61 -1.22 0.00 0.00 177.39 178.60 1m1x n GLY 684 N -1.11 -2.69 0.00 -0.72 0.00 -1.26 -4.39 105.19 95.01 1m1x n GLY 684 Ca 0.43 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1m1x n GLY 684 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1m1x n ASN 685 N -0.51 0.00 -4.56 1.61 5.15 -1.26 -2.90 115.26 112.79 1m1x n ASN 685 Ca 0.00 0.40 -0.41 0.00 -0.60 0.00 0.00 54.58 53.98 1m1x n ASN 685 Cb 0.00 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.22 1m1x n ASN 685 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1m1x s PRO 686 N -0.80 3.41 -1.04 1.20 0.02 -1.26 -2.59 135.00 133.94 1m1x s PRO 686 Ca 0.00 -0.77 -0.24 0.00 0.02 0.00 0.00 61.00 60.02 1m1x s PRO 686 Cb 0.00 -4.93 -0.06 0.00 0.02 0.00 0.00 34.50 29.53 1m1x s PRO 686 CO 0.00 -2.23 1.93 1.41 -0.33 0.00 0.00 177.00 177.78 1m1x s MET 687 N 5.33 2.56 1.00 5.54 1.75 -0.80 -4.82 119.30 129.86 1m1x s MET 687 Ca 0.43 -0.72 -0.19 0.00 -1.25 0.00 0.00 55.69 53.97 1m1x s MET 687 Cb -0.03 -5.15 -0.15 0.00 2.84 0.00 0.00 34.83 32.34 1m1x s MET 687 CO -0.01 -3.63 -0.88 1.63 -0.65 0.00 0.00 175.02 171.49 1m1x n LYS 688 N 8.59 -0.04 -1.97 4.11 4.76 -1.26 -3.80 118.16 128.56 1m1x n LYS 688 Ca 0.42 -0.01 -0.37 0.00 -2.87 0.00 0.00 58.31 55.48 1m1x n LYS 688 Cb 0.47 -1.05 0.03 0.00 -1.84 0.00 0.00 35.03 32.63 1m1x n LYS 688 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1m1x s ALA 689 N -2.02 2.77 0.00 7.82 0.00 -1.26 -2.64 121.76 126.43 1m1x s ALA 689 Ca 0.40 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.50 1m1x s ALA 689 Cb -0.13 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.50 1m1x s ALA 689 CO 0.79 -1.14 0.00 0.41 0.00 0.00 0.00 175.76 175.82 1m1x n GLY 690 N 0.61 0.47 3.58 0.00 0.00 0.31 -4.89 105.19 105.26 1m1x n GLY 690 Ca 0.11 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.68 1m1x n GLY 690 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1m1x n THR 691 N -2.00 0.36 -4.53 2.61 -1.04 -1.08 -4.71 114.28 103.88 1m1x n THR 691 Ca 0.00 -0.39 -0.34 0.00 -2.04 0.00 0.00 64.05 61.28 1m1x n THR 691 Cb 0.00 -2.36 -0.12 0.00 -1.82 0.00 0.00 70.33 66.03 1m1x n THR 691 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1m1x s GLN 692 N 6.11 3.41 0.05 -2.82 0.74 -1.26 -1.04 119.66 124.86 1m1x s GLN 692 Ca 1.01 -0.56 0.06 0.00 0.05 0.00 0.00 55.36 55.92 1m1x s GLN 692 Cb -0.45 -2.78 -0.03 0.00 1.10 0.00 0.00 33.01 30.85 1m1x s GLN 692 CO 0.39 0.33 -0.17 -0.51 -0.55 0.00 0.00 175.29 174.78 1m1x s LEU 693 N 0.10 2.20 -0.27 3.68 1.43 0.14 -5.00 118.68 120.98 1m1x s LEU 693 Ca -0.02 -0.53 -0.01 0.00 -1.03 0.00 0.00 54.13 52.53 1m1x s LEU 693 Cb -0.14 -0.74 0.13 0.00 0.03 0.00 0.00 46.19 45.47 1m1x s LEU 693 CO 0.03 0.06 0.30 -0.22 0.23 0.00 0.00 176.35 176.76 1m1x s LEU 694 N -1.35 -0.32 0.00 1.79 2.96 -1.25 -0.86 118.68 119.64 1m1x s LEU 694 Ca 0.04 -0.47 0.01 0.00 -0.22 0.00 0.00 54.13 53.49 1m1x s LEU 694 Cb -0.09 0.63 -0.00 0.00 0.50 0.00 0.00 46.19 47.23 1m1x s LEU 694 CO 0.02 -0.36 0.03 0.00 -1.32 0.00 0.00 176.35 174.72 1m1x n ALA 695 N 5.32 0.29 -3.84 5.97 0.00 -0.45 -3.25 120.51 124.56 1m1x n ALA 695 Ca -0.03 -1.36 -0.26 0.00 0.00 0.00 0.00 53.44 51.79 1m1x n ALA 695 Cb 0.48 0.79 -0.17 0.00 0.00 0.00 0.00 19.45 20.55 1m1x n ALA 695 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1m1x s GLY 696 N -2.65 0.80 -0.35 0.00 0.00 -1.25 -1.23 107.32 102.64 1m1x s GLY 696 Ca 0.04 -0.50 -0.05 0.00 0.00 0.00 0.00 44.72 44.21 1m1x s GLY 696 CO 0.03 0.72 0.11 1.08 0.00 0.00 0.00 173.10 175.04 1m1x s LEU 697 N 1.56 4.43 0.17 0.66 2.01 0.32 -3.25 118.68 124.59 1m1x s LEU 697 Ca 0.02 -1.33 -0.09 0.00 0.01 0.00 0.00 54.13 52.73 1m1x s LEU 697 Cb -0.13 -1.84 -0.07 0.00 0.01 0.00 0.00 46.19 44.17 1m1x s LEU 697 CO -0.06 -0.36 0.49 0.00 1.01 0.00 0.00 176.35 177.42 1m1x s ARG 698 N 1.33 3.79 0.04 1.70 1.70 -1.15 0.11 118.95 126.46 1m1x s ARG 698 Ca -0.01 0.22 0.01 0.00 -0.47 0.00 0.00 55.73 55.48 1m1x s ARG 698 Cb -0.20 -2.79 -0.00 0.00 -0.57 0.00 0.00 34.95 31.39 1m1x s ARG 698 CO 0.01 0.41 0.02 1.19 -1.08 0.00 0.00 175.30 175.85 1m1x n PHE 699 N 0.22 -0.05 -3.29 5.89 3.72 0.60 -1.73 117.46 122.82 1m1x n PHE 699 Ca -0.02 -0.27 -0.08 0.00 -0.05 0.00 0.00 57.45 57.02 1m1x n PHE 699 Cb 0.52 0.02 -0.05 0.00 -0.94 0.00 0.00 39.48 39.03 1m1x n PHE 699 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1m1x s SER 700 N -1.24 0.13 -0.05 4.37 0.15 -1.15 -1.55 113.70 114.36 1m1x s SER 700 Ca 0.03 -0.60 -0.30 0.00 0.70 0.00 0.00 55.95 55.78 1m1x s SER 700 Cb 0.00 1.19 -0.05 0.00 -1.71 0.00 0.00 66.02 65.45 1m1x s SER 700 CO 0.02 -0.31 1.46 -0.69 1.20 0.00 0.00 173.24 174.92 1m1x s VAL 701 N 2.28 3.78 0.40 4.45 1.01 0.13 -4.56 120.40 127.90 1m1x s VAL 701 Ca 0.12 1.05 -0.05 0.00 0.00 0.00 0.00 61.98 63.10 1m1x s VAL 701 Cb -0.12 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1m1x s VAL 701 CO -0.22 -0.05 0.69 -1.00 0.00 0.00 0.00 175.10 174.52 1m1x s HIS 702 N 3.20 3.52 -0.01 5.22 3.76 -0.70 -1.45 115.29 128.83 1m1x s HIS 702 Ca 0.65 0.73 -0.01 0.00 -0.15 0.00 0.00 55.06 56.28 1m1x s HIS 702 Cb -0.30 -2.21 -0.01 0.00 1.11 0.00 0.00 32.58 31.17 1m1x s HIS 702 CO 0.25 -0.08 0.17 -0.56 -0.85 0.00 0.00 174.74 173.66 1m1x h GLN 703 N 0.79 -0.04 -0.39 1.40 -0.00 -1.89 -3.46 115.11 111.52 1m1x h GLN 703 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.18 1m1x h GLN 703 Cb 1.20 0.01 0.00 0.00 -0.00 0.00 0.00 27.48 28.69 1m1x h GLN 703 CO 0.63 -0.02 0.00 1.04 -0.00 0.00 0.00 178.83 180.47 1m1x n GLN 704 N -2.53 0.00 0.00 0.06 6.02 -1.26 -4.94 117.38 114.73 1m1x n GLN 704 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1m1x n GLN 704 Cb 0.01 -3.02 0.00 0.00 1.02 0.00 0.00 30.24 28.26 1m1x n GLN 704 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1m1x n SER 705 N 1.75 0.00 0.00 1.08 2.88 -1.26 -3.58 113.62 114.50 1m1x n SER 705 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1m1x n SER 705 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 1m1x n SER 705 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1m1x n GLU 706 N 14.00 0.00 -3.70 -1.46 0.00 -1.26 -4.83 120.64 123.39 1m1x n GLU 706 Ca 0.00 0.60 -0.13 0.00 0.00 0.00 0.00 57.16 57.63 1m1x n GLU 706 Cb 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 31.44 30.06 1m1x n GLU 706 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.13 177.01 1m1x n MET 707 N -2.04 -0.76 0.00 5.31 0.00 -1.23 -4.42 117.12 113.97 1m1x n MET 707 Ca 0.00 -0.28 0.00 0.00 -0.00 0.00 0.00 57.70 57.42 1m1x n MET 707 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 33.22 33.11 1m1x n MET 707 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1m1x n ASP 708 N -0.01 0.00 0.00 6.12 8.00 -1.26 -4.76 116.55 124.63 1m1x n ASP 708 Ca -0.04 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.46 1m1x n ASP 708 Cb 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.27 1m1x n ASP 708 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 1m1x n THR 709 N 0.00 0.00 -4.30 -3.53 5.66 -1.26 -4.84 114.28 106.01 1m1x n THR 709 Ca 0.00 0.00 -0.16 0.00 -3.05 0.00 0.00 64.05 60.84 1m1x n THR 709 Cb 0.00 0.02 -0.10 0.00 -1.55 0.00 0.00 70.33 68.70 1m1x n THR 709 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1m1x s SER 710 N -0.09 1.05 -0.11 1.09 1.04 -1.26 0.15 113.70 115.56 1m1x s SER 710 Ca 0.00 -1.41 -0.01 0.00 0.48 0.00 0.00 55.95 55.01 1m1x s SER 710 Cb 0.00 0.23 0.03 0.00 0.10 0.00 0.00 66.02 66.39 1m1x s SER 710 CO 0.00 -0.77 -0.02 0.68 0.98 0.00 0.00 173.24 174.11 1m1x s VAL 711 N -3.81 0.67 0.34 5.02 -7.23 -0.46 -4.93 120.40 110.00 1m1x s VAL 711 Ca 0.38 -0.19 -0.09 0.00 -1.81 0.00 0.00 61.98 60.27 1m1x s VAL 711 Cb 0.07 -0.84 -0.06 0.00 0.56 0.00 0.00 36.38 36.11 1m1x s VAL 711 CO 0.14 0.20 0.67 -1.59 -0.31 0.00 0.00 175.10 174.21 1m1x s LYS 712 N 1.84 3.75 0.04 4.82 -2.85 -1.26 -2.10 119.74 123.98 1m1x s LYS 712 Ca 0.04 0.31 0.03 0.00 -1.00 0.00 0.00 55.97 55.35 1m1x s LYS 712 Cb -0.13 -2.51 -0.02 0.00 -2.06 0.00 0.00 37.83 33.10 1m1x s LYS 712 CO -0.07 0.11 -0.10 -0.06 0.10 0.00 0.00 175.35 175.33 1m1x s PHE 713 N -2.17 0.89 -0.23 1.78 0.40 0.64 -4.42 117.98 114.88 1m1x s PHE 713 Ca 0.49 -0.42 0.00 0.00 -0.60 0.00 0.00 56.93 56.40 1m1x s PHE 713 Cb -0.11 -0.52 0.06 0.00 0.51 0.00 0.00 43.02 42.96 1m1x s PHE 713 CO 0.28 -0.02 -0.03 -0.51 0.70 0.00 0.00 175.22 175.64 1m1x s ASP 714 N -1.39 3.71 0.10 1.36 1.11 -1.06 -0.19 116.67 120.31 1m1x s ASP 714 Ca -0.05 -1.14 -0.08 0.00 0.18 0.00 0.00 52.55 51.46 1m1x s ASP 714 Cb -0.09 -1.08 -0.06 0.00 1.07 0.00 0.00 42.92 42.77 1m1x s ASP 714 CO 0.01 -0.25 0.39 -0.76 1.18 0.00 0.00 175.17 175.74 1m1x s LEU 715 N 1.47 4.32 0.00 1.23 1.43 0.19 -1.15 118.68 126.17 1m1x s LEU 715 Ca -0.04 0.73 0.00 0.00 -1.03 0.00 0.00 54.13 53.78 1m1x s LEU 715 Cb -0.19 -3.09 0.00 0.00 0.03 0.00 0.00 46.19 42.94 1m1x s LEU 715 CO -0.07 0.13 0.00 1.67 0.23 0.00 0.00 176.35 178.31 1m1x n GLN 716 N 0.64 0.00 -4.13 1.70 7.27 -1.18 -0.02 117.38 121.67 1m1x n GLN 716 Ca -0.06 0.00 -0.32 0.00 0.07 0.00 0.00 57.00 56.69 1m1x n GLN 716 Cb 0.52 0.00 -0.07 0.00 2.41 0.00 0.00 30.24 33.10 1m1x n GLN 716 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 1m1x s ILE 717 N -1.25 4.56 -0.06 1.69 1.09 -1.26 0.66 121.20 126.64 1m1x s ILE 717 Ca 0.00 -0.54 -0.04 0.00 -1.10 0.00 0.00 60.65 58.97 1m1x s ILE 717 Cb 0.00 -3.10 0.02 0.00 -1.06 0.00 0.00 42.46 38.32 1m1x s ILE 717 CO 0.00 0.30 0.14 0.00 -0.10 0.00 0.00 174.94 175.28 1m1x s GLN 718 N -1.86 0.14 0.26 2.79 -2.07 -0.30 -0.79 119.66 117.83 1m1x s GLN 718 Ca 0.24 0.27 0.01 0.00 -1.82 0.00 0.00 55.36 54.05 1m1x s GLN 718 Cb -0.12 -0.02 -0.00 0.00 -1.09 0.00 0.00 33.01 31.77 1m1x s GLN 718 CO 0.15 -0.08 0.03 -1.13 -1.32 0.00 0.00 175.29 172.94 1m1x n SER 719 N 3.49 2.21 -0.62 12.60 3.41 0.24 -3.06 113.62 131.88 1m1x n SER 719 Ca -0.18 -2.20 0.12 0.00 -0.26 0.00 0.00 58.87 56.35 1m1x n SER 719 Cb 0.56 0.32 0.22 0.00 -0.26 0.00 0.00 64.21 65.04 1m1x n SER 719 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1m1x n SER 720 N -1.37 2.11 -4.74 4.04 7.64 -0.49 -4.81 113.62 116.00 1m1x n SER 720 Ca -0.09 -1.59 -0.41 0.00 1.01 0.00 0.00 58.87 57.79 1m1x n SER 720 Cb 0.34 0.14 -0.04 0.00 -1.01 0.00 0.00 64.21 63.64 1m1x n SER 720 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 1m1x s ASN 721 N -2.20 7.23 0.63 6.43 2.47 -1.26 -4.89 114.94 123.36 1m1x s ASN 721 Ca 0.27 2.17 0.31 0.00 0.42 0.00 0.00 52.86 56.03 1m1x s ASN 721 Cb 0.20 -2.61 1.67 0.00 -1.45 0.00 0.00 41.25 39.05 1m1x s ASN 721 CO 0.41 -0.23 1.98 -0.07 -3.72 0.00 0.00 177.10 175.48 1m1x h LEU 722 N 4.75 0.00 -8.47 3.21 3.38 -1.93 -3.31 115.31 112.94 1m1x h LEU 722 Ca -0.45 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 56.89 1m1x h LEU 722 Cb 1.21 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.67 1m1x h LEU 722 CO 0.71 0.00 -0.86 -0.36 0.09 0.00 0.00 178.44 178.02 1m1x s PHE 723 N -4.32 1.96 -1.00 1.13 2.99 -1.26 -4.78 117.98 112.70 1m1x s PHE 723 Ca -0.04 -0.37 0.00 0.00 0.00 0.00 0.00 56.93 56.52 1m1x s PHE 723 Cb 0.12 -1.26 0.00 0.00 0.00 0.00 0.00 43.02 41.87 1m1x s PHE 723 CO 0.40 -0.03 0.00 -0.25 -0.00 0.00 0.00 175.22 175.34 1m1x n ASP 724 N 2.54 -3.28 0.22 1.36 8.00 -1.26 -4.33 116.55 119.80 1m1x n ASP 724 Ca -0.15 0.25 0.17 0.00 0.71 0.00 0.00 54.79 55.76 1m1x n ASP 724 Cb 0.52 -2.92 0.73 0.00 -0.02 0.00 0.00 41.12 39.43 1m1x n ASP 724 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 1m1x h LYS 725 N 0.00 0.00 -5.82 -1.24 2.10 -1.87 -3.43 116.57 106.32 1m1x h LYS 725 Ca -0.24 0.00 -0.61 0.00 -2.00 0.00 0.00 60.65 57.80 1m1x h LYS 725 Cb 1.01 0.00 -0.13 0.00 -0.90 0.00 0.00 32.23 32.20 1m1x h LYS 725 CO 0.31 0.00 -0.66 0.14 -2.00 0.00 0.00 179.45 177.24 1m1x s VAL 726 N -4.30 2.11 0.29 0.07 -7.23 -1.26 0.79 120.40 110.87 1m1x s VAL 726 Ca -0.03 -2.15 0.08 0.00 -1.81 0.00 0.00 61.98 58.06 1m1x s VAL 726 Cb 0.11 -2.71 -0.03 0.00 0.56 0.00 0.00 36.38 34.31 1m1x s VAL 726 CO 0.37 -0.16 0.22 -0.94 -0.31 0.00 0.00 175.10 174.27 1m1x s SER 727 N -3.61 5.28 0.22 4.85 1.04 0.03 -4.62 113.70 116.89 1m1x s SER 727 Ca 0.33 -0.42 -0.30 0.00 0.48 0.00 0.00 55.95 56.03 1m1x s SER 727 Cb 0.04 -1.13 -0.10 0.00 0.10 0.00 0.00 66.02 64.93 1m1x s SER 727 CO 0.16 -0.18 1.45 -2.84 0.98 0.00 0.00 173.24 172.82 1m1x s PRO 728 N -3.89 4.27 -0.30 4.02 0.02 -1.26 -4.62 135.00 133.23 1m1x s PRO 728 Ca 0.36 2.28 -0.29 0.00 0.02 0.00 0.00 61.00 63.38 1m1x s PRO 728 Cb -0.06 -3.14 -0.02 0.00 0.02 0.00 0.00 34.50 31.30 1m1x s PRO 728 CO 0.25 -0.45 1.66 0.08 -0.33 0.00 0.00 177.00 178.21 1m1x s VAL 729 N 0.35 3.64 -0.28 3.83 1.01 -1.26 -4.63 120.40 123.06 1m1x s VAL 729 Ca 0.62 0.68 -0.12 0.00 0.00 0.00 0.00 61.98 63.16 1m1x s VAL 729 Cb -0.41 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 1m1x s VAL 729 CO 0.39 -0.43 0.21 -0.69 0.00 0.00 0.00 175.10 174.58 1m1x s VAL 730 N 5.98 5.29 0.03 2.92 1.01 0.98 -4.90 120.40 131.70 1m1x s VAL 730 Ca 0.73 0.18 -0.10 0.00 0.00 0.00 0.00 61.98 62.80 1m1x s VAL 730 Cb -0.22 -3.56 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 1m1x s VAL 730 CO 0.32 0.22 0.35 -0.55 0.00 0.00 0.00 175.10 175.44 1m1x s SER 731 N 1.75 6.62 -0.05 3.32 0.15 -1.26 0.57 113.70 124.79 1m1x s SER 731 Ca 0.08 0.74 -0.02 0.00 0.70 0.00 0.00 55.95 57.45 1m1x s SER 731 Cb -0.16 -2.16 0.03 0.00 -1.71 0.00 0.00 66.02 62.02 1m1x s SER 731 CO 0.11 0.24 0.04 -2.28 1.20 0.00 0.00 173.24 172.55 1m1x s HIS 732 N -1.28 0.23 0.00 3.44 5.04 0.74 -4.94 115.29 118.51 1m1x s HIS 732 Ca 0.28 0.14 0.07 0.00 -1.54 0.00 0.00 55.06 54.01 1m1x s HIS 732 Cb -0.14 -0.56 -0.03 0.00 0.04 0.00 0.00 32.58 31.89 1m1x s HIS 732 CO 0.16 -0.22 -0.21 -1.59 -2.34 0.00 0.00 174.74 170.54 1m1x s LYS 733 N 2.07 2.15 -0.05 2.88 -2.85 -1.26 -0.26 119.74 122.43 1m1x s LYS 733 Ca 0.04 -0.91 0.07 0.00 -1.00 0.00 0.00 55.97 54.17 1m1x s LYS 733 Cb -0.12 -2.16 -0.01 0.00 -2.06 0.00 0.00 37.83 33.47 1m1x s LYS 733 CO -0.04 0.56 -0.25 0.14 0.10 0.00 0.00 175.35 175.86 1m1x s VAL 734 N -0.77 2.05 0.17 1.79 -7.23 -0.89 -4.87 120.40 110.65 1m1x s VAL 734 Ca 0.12 -1.08 -0.30 0.00 -1.81 0.00 0.00 61.98 58.92 1m1x s VAL 734 Cb -0.10 -1.73 -0.07 0.00 0.56 0.00 0.00 36.38 35.04 1m1x s VAL 734 CO 0.02 0.57 0.94 -1.81 -0.31 0.00 0.00 175.10 174.51 1m1x s ASP 735 N -0.28 7.55 0.52 4.85 1.11 -1.17 -1.36 116.67 127.90 1m1x s ASP 735 Ca -0.00 1.85 -0.18 0.00 0.18 0.00 0.00 52.55 54.39 1m1x s ASP 735 Cb -0.13 -2.59 -0.07 0.00 1.07 0.00 0.00 42.92 41.20 1m1x s ASP 735 CO 0.02 0.04 1.04 -0.76 1.18 0.00 0.00 175.17 176.70 1m1x s LEU 736 N -0.56 3.71 0.05 1.23 1.43 0.12 -2.34 118.68 122.33 1m1x s LEU 736 Ca 0.44 1.85 -0.01 0.00 -1.03 0.00 0.00 54.13 55.38 1m1x s LEU 736 Cb -0.24 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.39 1m1x s LEU 736 CO 0.30 -0.88 -0.02 0.00 0.23 0.00 0.00 176.35 175.98 1m1x s ALA 737 N -2.20 0.44 -0.22 4.21 0.00 0.71 -4.85 121.76 119.86 1m1x s ALA 737 Ca 0.65 -1.12 -0.06 0.00 0.00 0.00 0.00 51.96 51.43 1m1x s ALA 737 Cb -0.15 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.20 1m1x s ALA 737 CO 0.26 -0.35 0.04 0.08 0.00 0.00 0.00 175.76 175.79 1m1x s VAL 738 N -3.65 4.22 -0.05 0.00 1.01 -1.26 -1.41 120.40 119.25 1m1x s VAL 738 Ca 0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 61.98 61.79 1m1x s VAL 738 Cb 0.06 -2.93 0.04 0.00 0.00 0.00 0.00 36.38 33.54 1m1x s VAL 738 CO -0.09 0.40 0.10 -0.22 0.00 0.00 0.00 175.10 175.28 1m1x s LEU 739 N 1.13 0.40 -0.37 3.92 2.96 -1.26 -4.98 118.68 120.48 1m1x s LEU 739 Ca 0.03 0.18 0.03 0.00 -0.22 0.00 0.00 54.13 54.15 1m1x s LEU 739 Cb -0.14 0.08 0.15 0.00 0.50 0.00 0.00 46.19 46.78 1m1x s LEU 739 CO 0.02 -0.20 0.36 0.00 -1.32 0.00 0.00 176.35 175.21 1m1x s ALA 740 N 1.77 -0.30 -0.42 5.97 0.00 -1.26 0.75 121.76 128.27 1m1x s ALA 740 Ca -0.01 -1.07 -0.28 0.00 0.00 0.00 0.00 51.96 50.60 1m1x s ALA 740 Cb -0.12 -2.01 -0.02 0.00 0.00 0.00 0.00 23.12 20.97 1m1x s ALA 740 CO -0.04 -2.14 1.86 0.00 0.00 0.00 0.00 175.76 175.44 1m1x s ALA 741 N 1.39 2.57 0.05 0.00 0.00 -1.26 -4.71 121.76 119.80 1m1x s ALA 741 Ca 0.17 -0.02 0.03 0.00 0.00 0.00 0.00 51.96 52.14 1m1x s ALA 741 Cb -0.16 -4.12 -0.04 0.00 0.00 0.00 0.00 23.12 18.80 1m1x s ALA 741 CO -0.03 -3.14 0.00 0.08 0.00 0.00 0.00 175.76 172.67 1m1x s VAL 742 N 7.93 4.09 0.14 0.00 1.01 -1.26 -1.38 120.40 130.92 1m1x s VAL 742 Ca 0.77 -0.80 -0.10 0.00 0.00 0.00 0.00 61.98 61.85 1m1x s VAL 742 Cb -0.19 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.30 1m1x s VAL 742 CO 0.29 0.24 0.28 -1.83 0.00 0.00 0.00 175.10 174.09 1m1x s GLU 743 N -1.95 1.06 -0.28 2.72 -1.05 -0.45 -4.99 118.70 113.76 1m1x s GLU 743 Ca 0.23 -1.03 -0.00 0.00 -0.15 0.00 0.00 54.97 54.01 1m1x s GLU 743 Cb -0.12 0.39 0.09 0.00 -0.44 0.00 0.00 34.13 34.05 1m1x s GLU 743 CO 0.15 -0.38 0.06 -1.50 0.95 0.00 0.00 175.26 174.53 1m1x s ILE 744 N -3.91 1.04 0.18 1.83 2.07 -1.26 -1.29 121.20 119.85 1m1x s ILE 744 Ca 0.11 -1.30 -0.12 0.00 -1.41 0.00 0.00 60.65 57.93 1m1x s ILE 744 Cb 0.03 -1.66 -0.07 0.00 0.13 0.00 0.00 42.46 40.89 1m1x s ILE 744 CO -0.05 -0.49 0.54 -0.13 -1.91 0.00 0.00 174.94 172.89 1m1x s ARG 745 N 1.56 3.89 0.07 3.50 0.52 -0.61 -4.66 118.95 123.21 1m1x s ARG 745 Ca 0.05 0.37 0.01 0.00 -0.52 0.00 0.00 55.73 55.64 1m1x s ARG 745 Cb -0.18 -2.82 -0.04 0.00 0.52 0.00 0.00 34.95 32.44 1m1x s ARG 745 CO -0.18 0.42 -0.05 0.20 0.02 0.00 0.00 175.30 175.71 1m1x s GLY 746 N -1.99 0.58 0.15 -3.53 0.00 -1.26 0.20 107.32 101.47 1m1x s GLY 746 Ca 0.41 -1.17 -0.23 0.00 0.00 0.00 0.00 44.72 43.73 1m1x s GLY 746 CO 0.20 -1.27 0.60 0.54 0.00 0.00 0.00 173.10 173.17 1m1x s VAL 747 N -3.32 0.00 -0.10 1.40 0.11 -0.28 -4.99 120.40 113.22 1m1x s VAL 747 Ca 0.05 -0.01 0.03 0.00 -2.93 0.00 0.00 61.98 59.13 1m1x s VAL 747 Cb 0.03 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.89 1m1x s VAL 747 CO -0.06 -0.00 -0.21 -0.55 -3.33 0.00 0.00 175.10 170.95 1m1x s SER 748 N -2.67 2.78 0.00 3.54 0.15 -1.26 -1.34 113.70 114.90 1m1x s SER 748 Ca 0.00 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.15 1m1x s SER 748 Cb -0.01 -1.27 0.00 0.00 -1.71 0.00 0.00 66.02 63.03 1m1x s SER 748 CO -0.12 0.11 0.37 -0.24 1.20 0.00 0.00 173.24 174.57 1m1x n SER 749 N 3.70 0.00 -4.48 5.45 2.88 0.15 -3.06 113.62 118.26 1m1x n SER 749 Ca -0.20 0.37 -0.43 0.00 -1.33 0.00 0.00 58.87 57.28 1m1x n SER 749 Cb 0.52 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.97 1m1x n SER 749 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1m1x s PRO 750 N -0.74 3.83 0.66 -1.46 0.04 -1.26 -4.74 135.00 131.32 1m1x s PRO 750 Ca 0.00 -2.02 0.28 0.00 0.04 0.00 0.00 61.00 59.30 1m1x s PRO 750 Cb 0.00 -5.10 1.52 0.00 0.04 0.00 0.00 34.50 30.96 1m1x s PRO 750 CO 0.00 -1.88 1.85 0.38 0.04 0.00 0.00 177.00 177.39 1m1x h ASP 751 N 8.18 0.00 -3.19 6.66 3.04 -1.85 -3.37 116.42 125.88 1m1x h ASP 751 Ca 0.26 0.00 -0.42 0.00 -3.24 0.00 0.00 57.03 53.63 1m1x h ASP 751 Cb 0.95 0.00 -0.40 0.00 -1.04 0.00 0.00 39.33 38.84 1m1x h ASP 751 CO 1.24 0.00 -0.75 -2.28 -2.04 0.00 0.00 179.24 175.41 1m1x s HIS 752 N -4.07 0.19 -0.19 4.15 2.46 -1.26 -2.45 115.29 114.11 1m1x s HIS 752 Ca -0.03 -0.06 0.01 0.00 0.47 0.00 0.00 55.06 55.45 1m1x s HIS 752 Cb 0.08 -0.61 0.02 0.00 -0.13 0.00 0.00 32.58 31.94 1m1x s HIS 752 CO 0.25 -0.35 -0.18 0.14 -2.47 0.00 0.00 174.74 172.13 1m1x s VAL 753 N 2.13 2.18 -0.34 0.89 -7.23 -0.86 -5.02 120.40 112.17 1m1x s VAL 753 Ca 0.03 -0.99 -0.28 0.00 -1.81 0.00 0.00 61.98 58.94 1m1x s VAL 753 Cb -0.14 -1.97 0.01 0.00 0.56 0.00 0.00 36.38 34.85 1m1x s VAL 753 CO -0.06 0.46 1.01 -0.36 -0.31 0.00 0.00 175.10 175.84 1m1x s PHE 754 N 1.28 3.13 0.66 2.82 0.40 -1.26 -2.96 117.98 122.04 1m1x s PHE 754 Ca 0.03 1.03 0.42 0.00 -0.60 0.00 0.00 56.93 57.81 1m1x s PHE 754 Cb -0.14 -3.65 2.29 0.00 0.51 0.00 0.00 43.02 42.03 1m1x s PHE 754 CO -0.11 -0.78 2.32 1.25 0.70 0.00 0.00 175.22 178.60 1m1x h LEU 755 N 10.05 0.00 -1.12 -0.37 5.85 0.06 -2.97 115.31 126.81 1m1x h LEU 755 Ca -0.22 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.50 1m1x h LEU 755 Cb 1.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.10 1m1x h LEU 755 CO 1.01 0.00 0.35 -0.65 -0.34 0.00 0.00 178.44 178.80 1m1x h PRO 756 N 0.00 0.00 -6.30 5.25 0.11 -1.76 -3.46 132.00 125.85 1m1x h PRO 756 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1m1x h PRO 756 Cb 0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.18 1m1x h PRO 756 CO -0.00 0.00 -0.67 1.51 -0.21 0.00 0.00 178.00 178.63 1m1x n ILE 757 N -2.29 -1.67 -1.82 4.15 0.13 -1.12 -4.87 119.36 111.87 1m1x n ILE 757 Ca -0.01 0.34 -0.42 0.00 -1.10 0.00 0.00 62.75 61.56 1m1x n ILE 757 Cb 0.37 -2.83 -0.03 0.00 -0.84 0.00 0.00 39.64 36.31 1m1x n ILE 757 CO 0.00 0.00 0.00 -2.16 2.80 0.00 0.00 176.55 177.19 1m1x s PRO 758 N -0.67 4.17 -0.07 9.51 0.04 -1.26 -4.30 135.00 142.41 1m1x s PRO 758 Ca 0.00 2.49 -0.05 0.00 0.04 0.00 0.00 61.00 63.48 1m1x s PRO 758 Cb 0.00 -3.29 0.02 0.00 0.04 0.00 0.00 34.50 31.26 1m1x s PRO 758 CO 0.00 -0.73 0.09 0.09 0.04 0.00 0.00 177.00 176.50 1m1x n ASN 759 N 4.61 -4.23 -3.64 6.66 5.03 -1.26 -5.07 115.26 117.36 1m1x n ASN 759 Ca 0.16 1.22 -0.10 0.00 0.87 0.00 0.00 54.58 56.73 1m1x n ASN 759 Cb 0.38 -3.33 -0.07 0.00 -1.02 0.00 0.00 39.78 35.74 1m1x n ASN 759 CO 0.00 0.00 0.00 0.86 -1.83 0.00 0.00 177.26 176.29 1m1x s TRP 760 N -0.31 -0.94 -0.11 3.10 -0.00 -1.26 -5.11 118.94 114.31 1m1x s TRP 760 Ca -0.11 2.01 0.03 0.00 -0.00 0.00 0.00 56.10 58.04 1m1x s TRP 760 Cb 0.01 0.49 0.01 0.00 -0.00 0.00 0.00 33.47 33.97 1m1x s TRP 760 CO 0.29 -0.46 -0.20 -1.21 -0.00 0.00 0.00 176.95 175.37 1m1x s GLU 761 N 1.13 2.72 -0.60 5.86 2.02 -1.26 -5.08 118.70 123.49 1m1x s GLU 761 Ca -0.06 -0.76 -0.27 0.00 0.02 0.00 0.00 54.97 53.91 1m1x s GLU 761 Cb -0.05 -2.16 -0.02 0.00 0.10 0.00 0.00 34.13 32.01 1m1x s GLU 761 CO -0.12 0.06 1.83 -1.58 0.02 0.00 0.00 175.26 175.47 1m1x s HIS 762 N 0.64 1.70 0.44 1.61 5.65 -1.26 -4.93 115.29 119.14 1m1x s HIS 762 Ca -0.13 0.75 -0.16 0.00 0.25 0.00 0.00 55.06 55.77 1m1x s HIS 762 Cb -0.16 -4.11 -0.09 0.00 -1.18 0.00 0.00 32.58 27.04 1m1x s HIS 762 CO 0.03 -2.32 0.89 0.15 -0.65 0.00 0.00 174.74 172.84 1m1x s LYS 763 N 6.90 4.00 0.14 2.88 -0.14 -1.26 -4.99 119.74 127.28 1m1x s LYS 763 Ca 0.67 0.86 -0.14 0.00 -1.36 0.00 0.00 55.97 56.00 1m1x s LYS 763 Cb -0.13 -2.25 0.01 0.00 -1.68 0.00 0.00 37.83 33.79 1m1x s LYS 763 CO 0.21 -0.09 1.64 1.49 -0.76 0.00 0.00 175.35 177.84 1m1x h GLU 764 N 1.47 0.75 -2.89 1.68 4.22 -1.99 -3.42 114.58 114.41 1m1x h GLU 764 Ca -0.48 -0.19 -0.20 0.00 0.08 0.00 0.00 59.36 58.57 1m1x h GLU 764 Cb 1.18 -0.09 -0.31 0.00 0.50 0.00 0.00 28.75 30.02 1m1x h GLU 764 CO 0.62 0.75 -0.51 -0.80 -2.18 0.00 0.00 179.01 176.90 1m1x s ASN 765 N -6.12 0.15 0.49 1.04 0.01 -1.26 -5.15 114.94 104.09 1m1x s ASN 765 Ca -0.13 0.59 -0.21 0.00 -0.71 0.00 0.00 52.86 52.41 1m1x s ASN 765 Cb 0.11 0.64 -0.07 0.00 0.41 0.00 0.00 41.25 42.34 1m1x s ASN 765 CO 0.79 -0.22 1.11 -2.16 -1.51 0.00 0.00 177.10 175.11 1m1x s PRO 766 N 2.08 3.65 0.00 -0.60 0.04 -1.26 -4.96 135.00 133.96 1m1x s PRO 766 Ca -0.02 1.59 0.00 0.00 0.04 0.00 0.00 61.00 62.61 1m1x s PRO 766 Cb -0.11 -2.19 0.00 0.00 0.04 0.00 0.00 34.50 32.23 1m1x s PRO 766 CO -0.09 -0.60 0.00 0.39 0.04 0.00 0.00 177.00 176.74 1m1x n GLU 767 N -0.87 3.22 -4.19 4.56 4.71 -1.26 -4.95 120.64 121.86 1m1x n GLU 767 Ca 0.09 0.00 -0.11 0.00 -0.01 0.00 0.00 57.16 57.13 1m1x n GLU 767 Cb 0.50 -0.72 -0.10 0.00 -1.01 0.00 0.00 31.44 30.12 1m1x n GLU 767 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 1m1x s THR 768 N -0.93 0.56 0.28 2.62 -4.23 -1.26 -3.60 115.64 109.09 1m1x s THR 768 Ca 0.00 -1.94 -0.00 0.00 -1.18 0.00 0.00 61.69 58.57 1m1x s THR 768 Cb 0.00 -1.91 0.28 0.00 1.34 0.00 0.00 72.50 72.21 1m1x s THR 768 CO 0.00 -0.65 1.88 -0.33 -0.54 0.00 0.00 174.62 174.98 1m1x h GLU 769 N 2.85 1.05 0.00 3.99 5.08 -1.72 -1.37 114.58 124.45 1m1x h GLU 769 Ca -0.36 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 57.92 1m1x h GLU 769 Cb 1.18 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 30.20 1m1x h GLU 769 CO 0.63 0.69 -0.08 0.93 -1.00 0.00 0.00 179.01 180.18 1m1x h GLU 770 N 1.08 0.00 0.00 2.33 3.07 -1.91 0.30 114.58 119.45 1m1x h GLU 770 Ca 0.43 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.29 1m1x h GLU 770 Cb 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 1m1x h GLU 770 CO -0.18 0.08 -0.13 -0.25 -1.40 0.00 0.00 179.01 177.13 1m1x n ASP 771 N -3.95 0.79 -0.07 1.42 10.43 -0.53 -4.35 116.55 120.29 1m1x n ASP 771 Ca -0.02 0.48 -0.07 0.00 2.57 0.00 0.00 54.79 57.74 1m1x n ASP 771 Cb 0.17 -0.60 -0.02 0.00 1.84 0.00 0.00 41.12 42.50 1m1x n ASP 771 CO 0.00 0.00 0.00 0.52 -1.07 0.00 0.00 177.20 176.65 1m1x n VAL 772 N -2.23 1.27 -3.50 2.53 0.31 0.17 -4.62 118.33 112.26 1m1x n VAL 772 Ca 0.05 0.20 0.00 0.00 -0.01 0.00 0.00 64.34 64.58 1m1x n VAL 772 Cb 0.43 -2.21 0.00 0.00 -0.91 0.00 0.00 33.84 31.16 1m1x n VAL 772 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1m1x n GLY 773 N 1.50 -0.68 3.81 2.92 0.00 0.81 -3.07 105.19 110.49 1m1x n GLY 773 Ca -0.12 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 44.73 1m1x n GLY 773 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1m1x s PRO 774 N -0.99 1.68 -0.68 1.61 0.02 -1.26 -4.46 135.00 130.93 1m1x s PRO 774 Ca 0.00 0.44 -0.10 0.00 0.02 0.00 0.00 61.00 61.36 1m1x s PRO 774 Cb 0.00 -1.89 0.18 0.00 0.02 0.00 0.00 34.50 32.81 1m1x s PRO 774 CO 0.00 -1.85 0.57 0.08 -0.33 0.00 0.00 177.00 175.47 1m1x s VAL 775 N -3.24 4.77 -0.13 3.83 1.01 -1.26 -1.64 120.40 123.73 1m1x s VAL 775 Ca 0.62 -2.43 -0.28 0.00 0.00 0.00 0.00 61.98 59.90 1m1x s VAL 775 Cb -0.14 -4.02 -0.01 0.00 0.00 0.00 0.00 36.38 32.20 1m1x s VAL 775 CO 0.53 -0.93 0.94 -0.69 0.00 0.00 0.00 175.10 174.95 1m1x s VAL 776 N 0.41 4.82 -0.19 2.92 1.01 -1.26 -4.48 120.40 123.64 1m1x s VAL 776 Ca 0.14 1.88 0.01 0.00 0.00 0.00 0.00 61.98 64.02 1m1x s VAL 776 Cb -0.18 -4.24 0.03 0.00 0.00 0.00 0.00 36.38 31.99 1m1x s VAL 776 CO -0.05 0.02 -0.16 -1.58 0.00 0.00 0.00 175.10 173.33 1m1x s GLN 777 N 2.03 2.55 0.15 2.72 0.74 -1.26 -1.02 119.66 125.58 1m1x s GLN 777 Ca 0.44 -0.85 -0.07 0.00 0.05 0.00 0.00 55.36 54.93 1m1x s GLN 777 Cb -0.18 -2.49 -0.06 0.00 1.10 0.00 0.00 33.01 31.38 1m1x s GLN 777 CO 0.16 -0.31 0.42 -1.01 -0.55 0.00 0.00 175.29 174.00 1m1x s HIS 778 N 1.32 3.48 -0.09 1.67 3.76 -0.61 0.33 115.29 125.15 1m1x s HIS 778 Ca 0.02 0.68 -0.04 0.00 -0.15 0.00 0.00 55.06 55.57 1m1x s HIS 778 Cb -0.15 -2.10 0.05 0.00 1.11 0.00 0.00 32.58 31.50 1m1x s HIS 778 CO -0.10 0.41 0.19 0.42 -0.85 0.00 0.00 174.74 174.80 1m1x s ILE 779 N -1.66 -0.28 -0.04 0.60 1.01 -0.45 -0.54 121.20 119.85 1m1x s ILE 779 Ca 0.41 0.32 0.04 0.00 0.00 0.00 0.00 60.65 61.42 1m1x s ILE 779 Cb -0.12 -0.33 -0.03 0.00 0.01 0.00 0.00 42.46 41.99 1m1x s ILE 779 CO 0.23 0.13 -0.14 -0.31 0.00 0.00 0.00 174.94 174.85 1m1x s TYR 780 N 2.20 2.70 -0.17 3.97 1.51 -0.60 -1.13 117.35 125.83 1m1x s TYR 780 Ca 0.01 -0.15 -0.01 0.00 -1.01 0.00 0.00 57.07 55.90 1m1x s TYR 780 Cb -0.12 -1.62 0.05 0.00 -0.11 0.00 0.00 41.96 40.16 1m1x s TYR 780 CO -0.07 0.20 -0.01 -2.00 -1.11 0.00 0.00 175.55 172.57 1m1x s GLU 781 N -0.81 1.03 -0.32 -0.62 2.12 0.13 -0.08 118.70 120.16 1m1x s GLU 781 Ca 0.12 -0.45 -0.20 0.00 0.36 0.00 0.00 54.97 54.80 1m1x s GLU 781 Cb -0.11 -1.97 -0.01 0.00 0.26 0.00 0.00 34.13 32.31 1m1x s GLU 781 CO 0.01 -0.51 0.64 -1.17 -0.54 0.00 0.00 175.26 173.68 1m1x s LEU 782 N 1.74 4.18 -0.02 2.70 2.96 0.16 -1.58 118.68 128.81 1m1x s LEU 782 Ca -0.00 0.35 0.04 0.00 -0.22 0.00 0.00 54.13 54.30 1m1x s LEU 782 Cb -0.16 -2.82 -0.01 0.00 0.50 0.00 0.00 46.19 43.71 1m1x s LEU 782 CO -0.07 -0.52 -0.13 -0.60 -1.32 0.00 0.00 176.35 173.70 1m1x s ARG 783 N 2.65 1.20 -0.24 1.98 3.52 -0.42 0.13 118.95 127.78 1m1x s ARG 783 Ca 0.25 -0.47 -0.06 0.00 -0.13 0.00 0.00 55.73 55.33 1m1x s ARG 783 Cb -0.15 -1.12 -0.01 0.00 -1.56 0.00 0.00 34.95 32.11 1m1x s ARG 783 CO 0.13 0.24 0.02 1.21 -0.81 0.00 0.00 175.30 176.09 1m1x s ASN 784 N -0.14 4.73 -0.01 -2.12 2.47 -0.79 -1.34 114.94 117.73 1m1x s ASN 784 Ca 0.02 -0.38 0.09 0.00 0.42 0.00 0.00 52.86 53.01 1m1x s ASN 784 Cb -0.07 -1.83 -0.14 0.00 -1.45 0.00 0.00 41.25 37.76 1m1x s ASN 784 CO 0.00 -0.05 0.22 0.59 -3.72 0.00 0.00 177.10 174.14 1m1x n ASN 785 N 4.85 2.63 -4.44 -4.21 3.02 -0.48 -3.11 115.26 113.53 1m1x n ASN 785 Ca -0.17 -0.07 -0.32 0.00 -0.03 0.00 0.00 54.58 53.99 1m1x n ASN 785 Cb 0.51 1.38 0.16 0.00 -0.61 0.00 0.00 39.78 41.22 1m1x n ASN 785 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1m1x n GLY 786 N 1.90 -1.83 0.36 7.41 0.00 -1.06 -4.80 105.19 107.17 1m1x n GLY 786 Ca -0.01 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 45.06 1m1x n GLY 786 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1m1x h PRO 787 N -1.91 -0.87 -6.97 1.61 0.11 -1.72 -3.39 132.00 118.85 1m1x h PRO 787 Ca -0.48 0.06 -0.51 0.00 0.11 0.00 0.00 66.00 65.18 1m1x h PRO 787 Cb 1.31 0.20 0.06 0.00 0.11 0.00 0.00 31.00 32.67 1m1x h PRO 787 CO 0.39 -0.58 0.50 -1.12 -0.21 0.00 0.00 178.00 176.97 1m1x s SER 788 N -3.40 6.40 0.35 -2.05 0.01 0.23 -4.25 113.70 110.98 1m1x s SER 788 Ca -0.13 2.33 0.02 0.00 1.31 0.00 0.00 55.95 59.47 1m1x s SER 788 Cb 0.01 -2.61 -0.02 0.00 0.21 0.00 0.00 66.02 63.61 1m1x s SER 788 CO 0.40 -0.76 0.54 -0.94 0.41 0.00 0.00 173.24 172.88 1m1x s SER 789 N -1.23 6.18 0.29 2.44 1.04 -1.26 -4.24 113.70 116.92 1m1x s SER 789 Ca 0.59 0.31 0.10 0.00 0.48 0.00 0.00 55.95 57.43 1m1x s SER 789 Cb -0.30 -1.84 -0.05 0.00 0.10 0.00 0.00 66.02 63.94 1m1x s SER 789 CO 0.37 -0.35 -0.03 0.72 0.98 0.00 0.00 173.24 174.92 1m1x s PHE 790 N -2.30 2.57 -0.12 5.02 -0.12 -1.10 -4.61 117.98 117.32 1m1x s PHE 790 Ca 0.41 -0.32 0.17 0.00 -0.05 0.00 0.00 56.93 57.15 1m1x s PHE 790 Cb -0.10 -1.26 -0.25 0.00 -0.63 0.00 0.00 43.02 40.79 1m1x s PHE 790 CO 0.35 0.59 0.19 -1.13 -0.05 0.00 0.00 175.22 175.16 1m1x n SER 791 N -0.87 0.65 -3.58 1.98 3.41 0.15 -3.11 113.62 112.26 1m1x n SER 791 Ca -0.05 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.42 1m1x n SER 791 Cb 0.60 1.27 -0.06 0.00 -0.26 0.00 0.00 64.21 65.77 1m1x n SER 791 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1m1x s LYS 792 N -2.75 1.02 0.29 4.33 1.02 -0.08 -2.11 119.74 121.46 1m1x s LYS 792 Ca -0.08 -0.19 -0.20 0.00 0.02 0.00 0.00 55.97 55.52 1m1x s LYS 792 Cb 0.08 0.47 0.02 0.00 -0.52 0.00 0.00 37.83 37.87 1m1x s LYS 792 CO 0.75 -0.36 0.71 0.00 -0.92 0.00 0.00 175.35 175.52 1m1x s ALA 793 N -2.28 -1.09 0.00 5.17 0.00 -0.95 -1.90 121.76 120.71 1m1x s ALA 793 Ca -0.06 -0.40 0.07 0.00 0.00 0.00 0.00 51.96 51.57 1m1x s ALA 793 Cb -0.01 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 23.94 1m1x s ALA 793 CO -0.00 -1.02 -0.23 -1.64 0.00 0.00 0.00 175.76 172.87 1m1x s MET 794 N -3.76 1.77 -0.06 0.00 -1.94 0.20 -1.43 119.30 114.08 1m1x s MET 794 Ca 0.12 -0.87 0.03 0.00 -1.71 0.00 0.00 55.69 53.26 1m1x s MET 794 Cb -0.05 -1.77 0.01 0.00 2.01 0.00 0.00 34.83 35.02 1m1x s MET 794 CO 0.08 0.48 -0.15 -1.17 -0.01 0.00 0.00 175.02 174.24 1m1x s LEU 795 N -0.73 1.80 -0.14 -0.03 0.20 0.89 -0.37 118.68 120.30 1m1x s LEU 795 Ca 0.09 -0.35 -0.00 0.00 0.69 0.00 0.00 54.13 54.56 1m1x s LEU 795 Cb -0.09 -0.94 0.03 0.00 -0.43 0.00 0.00 46.19 44.76 1m1x s LEU 795 CO -0.00 0.09 -0.07 -1.00 -0.29 0.00 0.00 176.35 175.08 1m1x s HIS 796 N 0.40 1.64 -0.11 5.38 3.76 0.20 0.01 115.29 126.57 1m1x s HIS 796 Ca -0.11 -0.94 -0.01 0.00 -0.15 0.00 0.00 55.06 53.84 1m1x s HIS 796 Cb -0.14 -1.30 -0.03 0.00 1.11 0.00 0.00 32.58 32.22 1m1x s HIS 796 CO 0.04 -0.57 -0.07 -1.17 -0.85 0.00 0.00 174.74 172.11 1m1x s LEU 797 N 1.66 3.11 -0.18 0.89 2.96 0.55 0.14 118.68 127.81 1m1x s LEU 797 Ca 0.03 -0.12 -0.04 0.00 -0.22 0.00 0.00 54.13 53.79 1m1x s LEU 797 Cb -0.14 -1.71 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 1m1x s LEU 797 CO -0.08 0.26 -0.04 -1.10 -1.32 0.00 0.00 176.35 174.06 1m1x s GLN 798 N -0.17 3.56 -0.12 1.98 -0.21 -0.44 -1.50 119.66 122.75 1m1x s GLN 798 Ca 0.02 -0.57 -0.02 0.00 0.02 0.00 0.00 55.36 54.81 1m1x s GLN 798 Cb -0.13 -2.94 -0.03 0.00 1.00 0.00 0.00 33.01 30.91 1m1x s GLN 798 CO 0.03 0.09 -0.04 -0.46 -2.12 0.00 0.00 175.29 172.78 1m1x s TRP 799 N 0.76 3.02 -1.30 0.91 -0.11 0.01 -2.85 118.94 119.38 1m1x s TRP 799 Ca -0.02 -0.16 -0.17 0.00 1.22 0.00 0.00 56.10 56.97 1m1x s TRP 799 Cb -0.15 -1.87 0.02 0.00 -1.50 0.00 0.00 33.47 29.97 1m1x s TRP 799 CO 0.02 0.12 1.97 -0.35 -4.62 0.00 0.00 176.95 174.09 1m1x n PRO 800 N 3.02 2.73 0.37 5.86 -0.04 -1.26 -2.52 135.00 143.16 1m1x n PRO 800 Ca -0.18 -2.79 -0.16 0.00 -0.04 0.00 0.00 63.50 60.33 1m1x n PRO 800 Cb 0.53 -3.38 -0.08 0.00 -0.04 0.00 0.00 33.50 30.52 1m1x n PRO 800 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 1m1x h TYR 801 N 7.21 -0.89 -3.49 0.54 3.20 -1.77 -3.43 116.97 118.35 1m1x h TYR 801 Ca 0.47 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.27 1m1x h TYR 801 Cb 0.77 0.30 -0.11 0.00 1.54 0.00 0.00 36.73 39.22 1m1x h TYR 801 CO 1.40 -0.53 -0.10 -1.59 -1.64 0.00 0.00 178.16 175.70 1m1x s LYS 802 N -5.21 1.23 -0.15 1.82 -2.85 -1.21 -1.53 119.74 111.84 1m1x s LYS 802 Ca -0.16 -0.91 -0.00 0.00 -1.00 0.00 0.00 55.97 53.90 1m1x s LYS 802 Cb 0.02 0.47 0.03 0.00 -2.06 0.00 0.00 37.83 36.29 1m1x s LYS 802 CO 0.51 -0.49 -0.08 -0.47 0.10 0.00 0.00 175.35 174.92 1m1x s TYR 803 N -3.88 1.82 -1.03 1.78 6.14 0.14 -1.68 117.35 120.64 1m1x s TYR 803 Ca 0.09 -1.09 -0.12 0.00 0.64 0.00 0.00 57.07 56.60 1m1x s TYR 803 Cb 0.01 -1.39 -0.02 0.00 0.42 0.00 0.00 41.96 40.98 1m1x s TYR 803 CO -0.05 -0.62 0.80 0.09 0.64 0.00 0.00 175.55 176.42 1m1x n ASN 804 N 4.85 -6.07 0.00 4.32 3.02 -1.26 -1.85 115.26 118.27 1m1x n ASN 804 Ca -0.13 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.64 1m1x n ASN 804 Cb 0.49 -4.07 0.00 0.00 -0.61 0.00 0.00 39.78 35.58 1m1x n ASN 804 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1m1x n ASN 805 N -2.69 0.00 -4.45 6.41 5.03 -1.26 -4.93 115.26 113.37 1m1x n ASN 805 Ca -0.09 0.00 -0.36 0.00 0.87 0.00 0.00 54.58 55.00 1m1x n ASN 805 Cb 0.59 -1.15 -0.12 0.00 -1.02 0.00 0.00 39.78 38.07 1m1x n ASN 805 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 1m1x s ASN 806 N -2.60 5.04 0.77 6.41 0.02 -0.77 -5.09 114.94 118.72 1m1x s ASN 806 Ca 0.00 -0.19 -0.14 0.00 -1.02 0.00 0.00 52.86 51.51 1m1x s ASN 806 Cb 0.00 -1.89 0.06 0.00 0.02 0.00 0.00 41.25 39.44 1m1x s ASN 806 CO 0.00 0.01 1.20 -0.89 0.02 0.00 0.00 177.10 177.44 1m1x s THR 807 N 1.35 2.26 -0.30 1.60 2.01 -1.26 -0.69 115.64 120.62 1m1x s THR 807 Ca 0.05 0.12 -0.01 0.00 0.31 0.00 0.00 61.69 62.16 1m1x s THR 807 Cb -0.15 -2.60 0.19 0.00 0.01 0.00 0.00 72.50 69.95 1m1x s THR 807 CO 0.03 -0.08 0.72 -1.48 -0.69 0.00 0.00 174.62 173.12 1m1x s LEU 808 N -5.44 -1.23 0.00 4.42 0.05 -0.58 -4.73 118.68 111.18 1m1x s LEU 808 Ca 0.73 0.37 0.00 0.00 0.05 0.00 0.00 54.13 55.28 1m1x s LEU 808 Cb -0.28 1.87 0.00 0.00 -2.05 0.00 0.00 46.19 45.73 1m1x s LEU 808 CO 0.48 -0.23 0.00 0.18 -0.55 0.00 0.00 176.35 176.23 1m1x n LEU 809 N 5.38 -1.80 -4.59 1.48 4.77 -1.21 -4.46 117.00 116.56 1m1x n LEU 809 Ca 0.03 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.59 1m1x n LEU 809 Cb 0.54 -0.45 -0.03 0.00 -2.33 0.00 0.00 43.42 41.15 1m1x n LEU 809 CO -0.06 0.00 1.63 -0.47 -1.33 0.00 0.00 177.39 177.16 1m1x s TYR 810 N -2.88 1.63 0.10 -1.77 5.04 -0.95 -4.61 117.35 113.92 1m1x s TYR 810 Ca 0.00 0.68 -0.31 0.00 -2.44 0.00 0.00 57.07 55.00 1m1x s TYR 810 Cb 0.00 -4.06 -0.08 0.00 0.35 0.00 0.00 41.96 38.18 1m1x s TYR 810 CO 0.00 -3.06 1.39 0.42 -1.34 0.00 0.00 175.55 172.96 1m1x s ILE 811 N 7.68 3.37 -0.15 3.14 1.01 -1.26 -2.95 121.20 132.03 1m1x s ILE 811 Ca 0.83 0.96 -0.26 0.00 0.00 0.00 0.00 60.65 62.18 1m1x s ILE 811 Cb -0.23 -3.62 -0.24 0.00 0.01 0.00 0.00 42.46 38.38 1m1x s ILE 811 CO 0.32 0.07 0.63 -0.07 0.00 0.00 0.00 174.94 175.88 1m1x h LEU 812 N 7.00 0.03 -7.19 2.97 3.38 -1.33 -2.79 115.31 117.38 1m1x h LEU 812 Ca -0.42 -0.87 0.32 0.00 0.09 0.00 0.00 57.88 57.00 1m1x h LEU 812 Cb 1.21 -0.01 -0.13 0.00 0.09 0.00 0.00 40.66 41.82 1m1x h LEU 812 CO 0.87 1.16 0.83 -1.38 0.09 0.00 0.00 178.44 180.01 1m1x s HIS 813 N -2.27 -0.05 0.10 1.13 -3.43 -1.24 -3.95 115.29 105.58 1m1x s HIS 813 Ca -0.21 -0.04 0.05 0.00 -0.80 0.00 0.00 55.06 54.06 1m1x s HIS 813 Cb -0.00 0.54 -0.03 0.00 -1.43 0.00 0.00 32.58 31.65 1m1x s HIS 813 CO 0.67 -0.26 -0.14 1.52 -2.00 0.00 0.00 174.74 174.54 1m1x s TYR 814 N -2.41 1.30 0.05 0.38 1.13 -1.26 -2.20 117.35 114.33 1m1x s TYR 814 Ca 0.13 -0.54 0.07 0.00 -1.41 0.00 0.00 57.07 55.32 1m1x s TYR 814 Cb 0.04 -0.70 -0.02 0.00 -1.10 0.00 0.00 41.96 40.18 1m1x s TYR 814 CO -0.04 0.10 -0.19 -0.51 -2.51 0.00 0.00 175.55 172.40 1m1x s ASP 815 N -2.26 2.27 -0.03 -0.18 1.11 -0.67 -4.95 116.67 111.96 1m1x s ASP 815 Ca 0.05 -0.51 0.05 0.00 0.18 0.00 0.00 52.55 52.33 1m1x s ASP 815 Cb -0.06 -0.18 -0.01 0.00 1.07 0.00 0.00 42.92 43.74 1m1x s ASP 815 CO 0.02 0.12 -0.19 -0.63 1.18 0.00 0.00 175.17 175.68 1m1x s ILE 816 N -0.83 1.53 -0.11 0.77 1.01 -1.26 0.16 121.20 122.48 1m1x s ILE 816 Ca 0.06 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 59.92 1m1x s ILE 816 Cb -0.09 -1.29 0.02 0.00 0.01 0.00 0.00 42.46 41.11 1m1x s ILE 816 CO 0.02 0.44 -0.14 -1.81 0.00 0.00 0.00 174.94 173.45 1m1x s ASP 817 N -0.26 2.33 0.00 3.58 1.01 -1.01 -5.01 116.67 117.31 1m1x s ASP 817 Ca 0.03 -0.40 0.00 0.00 0.71 0.00 0.00 52.55 52.89 1m1x s ASP 817 Cb -0.09 -1.03 0.00 0.00 1.01 0.00 0.00 42.92 42.81 1m1x s ASP 817 CO 0.01 -0.01 0.00 0.61 0.21 0.00 0.00 175.17 175.99 1m1x n GLY 818 N 4.30 -0.80 3.49 0.21 0.00 -1.26 -1.79 105.19 109.34 1m1x n GLY 818 Ca -0.18 -2.15 -0.43 0.00 0.00 0.00 0.00 46.02 43.25 1m1x n GLY 818 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1m1x s PRO 819 N 0.00 3.75 -0.28 1.61 0.02 -1.26 -4.95 135.00 133.89 1m1x s PRO 819 Ca 0.00 -1.86 -0.25 0.00 0.02 0.00 0.00 61.00 58.91 1m1x s PRO 819 Cb 0.00 -5.09 0.10 0.00 0.02 0.00 0.00 34.50 29.54 1m1x s PRO 819 CO 0.00 -1.89 0.92 1.41 -0.33 0.00 0.00 177.00 177.11 1m1x s MET 820 N 2.98 0.62 0.00 5.54 0.00 -1.26 -2.76 119.30 124.43 1m1x s MET 820 Ca 0.39 0.74 0.07 0.00 0.00 0.00 0.00 55.69 56.89 1m1x s MET 820 Cb -0.03 0.30 -0.02 0.00 0.00 0.00 0.00 34.83 35.09 1m1x s MET 820 CO -0.06 -0.08 -0.21 -0.80 0.00 0.00 0.00 175.02 173.88 1m1x s ASN 821 N 0.27 2.44 0.47 1.11 0.02 -0.74 -4.95 114.94 113.56 1m1x s ASN 821 Ca 0.02 -0.42 0.02 0.00 -1.02 0.00 0.00 52.86 51.46 1m1x s ASN 821 Cb -0.05 -0.25 -0.02 0.00 0.02 0.00 0.00 41.25 40.95 1m1x s ASN 821 CO -0.04 0.22 0.04 0.00 0.02 0.00 0.00 177.10 177.35 1m1x s THR 823 N -2.98 -0.20 -0.15 0.00 2.01 0.01 -4.97 115.64 109.37 1m1x s THR 823 Ca 0.13 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 62.01 1m1x s THR 823 Cb 0.02 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.49 1m1x s THR 823 CO 0.07 0.00 0.22 -0.94 -0.69 0.00 0.00 174.62 173.28 1m1x s SER 824 N 1.81 6.39 0.39 3.53 1.04 -1.26 -1.08 113.70 124.53 1m1x s SER 824 Ca -0.08 0.46 0.28 0.00 0.48 0.00 0.00 55.95 57.08 1m1x s SER 824 Cb -0.06 -2.14 1.36 0.00 0.10 0.00 0.00 66.02 65.29 1m1x s SER 824 CO -0.18 0.21 1.84 -2.24 0.98 0.00 0.00 173.24 173.86 1m1x h ASP 825 N 6.11 0.00 -4.20 7.02 2.03 -1.65 -3.42 116.42 122.31 1m1x h ASP 825 Ca -0.45 0.00 -0.56 0.00 -0.73 0.00 0.00 57.03 55.29 1m1x h ASP 825 Cb 1.18 0.00 -0.22 0.00 -0.83 0.00 0.00 39.33 39.46 1m1x h ASP 825 CO 0.70 0.00 -0.83 -0.04 -1.03 0.00 0.00 179.24 178.05 1m1x s MET 826 N -3.60 1.16 -0.03 4.15 -1.94 -1.26 -5.02 119.30 112.76 1m1x s MET 826 Ca -0.00 -1.13 -0.30 0.00 -1.71 0.00 0.00 55.69 52.55 1m1x s MET 826 Cb 0.09 -1.40 -0.06 0.00 2.01 0.00 0.00 34.83 35.47 1m1x s MET 826 CO 0.33 0.33 1.59 -2.00 -0.01 0.00 0.00 175.02 175.27 1m1x s GLU 827 N -1.80 4.20 -0.07 2.03 2.12 -1.26 -4.98 118.70 118.95 1m1x s GLU 827 Ca 0.06 2.14 -0.29 0.00 0.36 0.00 0.00 54.97 57.25 1m1x s GLU 827 Cb -0.10 -3.85 -0.02 0.00 0.26 0.00 0.00 34.13 30.42 1m1x s GLU 827 CO 0.04 -0.78 0.95 0.96 -0.54 0.00 0.00 175.26 175.89 1m1x s ILE 828 N 3.55 4.85 -0.43 -3.70 -5.25 -1.26 -4.06 121.20 114.90 1m1x s ILE 828 Ca 0.71 1.95 -0.02 0.00 -0.99 0.00 0.00 60.65 62.30 1m1x s ILE 828 Cb -0.33 -4.27 -0.02 0.00 2.95 0.00 0.00 42.46 40.78 1m1x s ILE 828 CO 0.28 0.08 0.38 -3.20 -1.79 0.00 0.00 174.94 170.70 1m1x n ASN 829 N 4.53 -4.27 -0.06 4.36 5.15 -1.06 -4.89 115.26 119.03 1m1x n ASN 829 Ca 0.06 -0.22 -0.13 0.00 -0.60 0.00 0.00 54.58 53.69 1m1x n ASN 829 Cb 0.50 -2.73 -0.07 0.00 -0.53 0.00 0.00 39.78 36.95 1m1x n ASN 829 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1m1x h PRO 830 N -0.25 0.38 -0.18 1.20 0.13 -1.88 -3.17 132.00 128.23 1m1x h PRO 830 Ca -0.18 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1m1x h PRO 830 Cb 1.09 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1m1x h PRO 830 CO 0.18 0.78 0.00 1.28 -0.23 0.00 0.00 178.00 180.00 1m1x n LEU 831 N -4.52 0.18 -3.30 1.56 4.77 -1.26 -4.80 117.00 109.63 1m1x n LEU 831 Ca -0.06 -0.09 -0.20 0.00 -0.03 0.00 0.00 56.01 55.63 1m1x n LEU 831 Cb 0.38 -0.09 -0.02 0.00 -2.33 0.00 0.00 43.42 41.36 1m1x n LEU 831 CO 0.40 0.05 -0.06 0.54 -1.33 0.00 0.00 177.39 176.98 1m1x n ARG 832 N -0.12 -2.53 -2.01 3.23 5.12 -1.20 -4.90 116.66 114.26 1m1x n ARG 832 Ca 0.00 0.25 -0.41 0.00 -1.93 0.00 0.00 57.85 55.76 1m1x n ARG 832 Cb 0.05 -4.85 -0.02 0.00 -1.16 0.00 0.00 32.46 26.47 1m1x n ARG 832 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1m1x s ILE 833 N -2.68 2.56 0.46 0.55 -1.09 -1.26 -5.03 121.20 114.70 1m1x s ILE 833 Ca 0.35 0.51 0.00 0.00 -2.23 0.00 0.00 60.65 59.28 1m1x s ILE 833 Cb -0.19 -3.33 -0.00 0.00 -1.58 0.00 0.00 42.46 37.36 1m1x s ILE 833 CO 0.42 0.10 0.01 0.29 -1.23 0.00 0.00 174.94 174.53 1m1x n LYS 834 N 1.43 0.87 0.00 2.79 4.76 -1.24 -4.99 118.16 121.78 1m1x n LYS 834 Ca 0.03 -3.38 0.00 0.00 -2.87 0.00 0.00 58.31 52.10 1m1x n LYS 834 Cb 0.41 0.94 0.00 0.00 -1.84 0.00 0.00 35.03 34.53 1m1x n LYS 834 CO 0.00 0.00 0.00 1.51 -1.37 0.00 0.00 177.40 177.54 1m1x n ILE 835 N -1.14 0.00 -0.16 -0.18 3.06 -1.26 -3.06 119.36 116.61 1m1x n ILE 835 Ca -0.19 0.00 -0.11 0.00 -2.50 0.00 0.00 62.75 59.95 1m1x n ILE 835 Cb 0.59 -0.16 -0.07 0.00 0.54 0.00 0.00 39.64 40.53 1m1x n ILE 835 CO 0.00 0.00 0.00 -1.28 -2.50 0.00 0.00 176.55 172.77 1m1x h SER 836 N 0.00 -1.68 0.00 9.51 0.87 -1.99 -3.38 113.55 116.88 1m1x h SER 836 Ca 0.00 0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 1m1x h SER 836 Cb 0.00 0.72 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 1m1x h SER 836 CO 0.00 -0.37 0.00 -0.24 -0.53 0.00 0.00 176.83 175.69 1m1x n SER 837 N -5.39 0.00 0.00 6.23 2.88 -1.26 -4.91 113.62 111.16 1m1x n SER 837 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 1m1x n SER 837 Cb 0.34 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.80 1m1x n SER 837 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1m1x n LEU 838 N 0.00 1.24 -0.01 2.46 0.00 -1.26 -5.26 117.00 114.18 1m1x n LEU 838 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 56.01 56.01 1m1x n LEU 838 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 43.42 43.42 1m1x n LEU 838 CO 0.00 0.15 0.02 0.44 0.00 0.00 0.00 177.39 178.00 1m1x h ASP 868 N 0.00 -0.01 0.21 1.96 5.19 -1.77 -3.56 116.42 118.44 1m1x h ASP 868 Ca 0.00 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 1m1x h ASP 868 Cb 0.59 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.10 1m1x h ASP 868 CO 0.00 0.10 -0.08 -0.29 -3.12 0.00 0.00 179.24 175.86 1m1x h ILE 869 N -0.24 0.58 0.00 0.35 6.09 -1.94 -3.44 117.51 118.92 1m1x h ILE 869 Ca -0.00 -0.33 0.00 0.00 -1.37 0.00 0.00 64.86 63.16 1m1x h ILE 869 Cb 0.01 1.21 0.00 0.00 0.47 0.00 0.00 36.82 38.51 1m1x h ILE 869 CO 0.00 0.07 0.00 1.41 -3.07 0.00 0.00 178.15 176.57 1m1x n HIS 870 N -3.76 0.00 -1.65 2.19 8.25 -1.26 -4.72 115.22 114.26 1m1x n HIS 870 Ca -0.02 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.01 1m1x n HIS 870 Cb 0.18 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.28 1m1x n HIS 870 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1m1x n THR 871 N -0.45 2.04 0.00 1.59 5.66 -1.26 -0.99 114.28 120.87 1m1x n THR 871 Ca 0.00 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.50 1m1x n THR 871 Cb 0.00 -1.34 0.00 0.00 -1.55 0.00 0.00 70.33 67.44 1m1x n THR 871 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1m1x n LEU 872 N 0.90 0.00 0.00 1.09 4.77 0.16 -1.88 117.00 122.03 1m1x n LEU 872 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1m1x n LEU 872 Cb 0.35 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1m1x n LEU 872 CO 0.61 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 1m1x n GLY 873 N 3.01 -0.47 3.41 -0.72 0.00 -1.25 -4.35 105.19 104.81 1m1x n GLY 873 Ca 0.00 -1.05 -0.29 0.00 0.00 0.00 0.00 46.02 44.68 1m1x n GLY 873 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m1x n GLY 875 N 0.93 1.42 0.43 0.00 0.00 -1.26 -4.30 105.19 102.42 1m1x n GLY 875 Ca 0.08 -0.14 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 1m1x n GLY 875 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1m1x n VAL 876 N 0.00 1.17 -2.52 1.61 0.31 -1.21 -5.02 118.33 112.67 1m1x n VAL 876 Ca 0.00 -0.05 -0.28 0.00 -0.01 0.00 0.00 64.34 64.00 1m1x n VAL 876 Cb 0.00 -1.89 -0.00 0.00 -0.91 0.00 0.00 33.84 31.04 1m1x n VAL 876 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1m1x s ALA 877 N -2.44 3.36 -0.16 3.52 0.00 -0.03 -4.93 121.76 121.06 1m1x s ALA 877 Ca -0.23 -0.43 -0.27 0.00 0.00 0.00 0.00 51.96 51.02 1m1x s ALA 877 Cb 0.07 -2.67 -0.01 0.00 0.00 0.00 0.00 23.12 20.51 1m1x s ALA 877 CO 0.30 -0.39 0.93 -0.65 0.00 0.00 0.00 175.76 175.95 1m1x s GLN 878 N -4.79 4.32 0.60 0.00 -1.52 -0.68 -4.39 119.66 113.21 1m1x s GLN 878 Ca 0.49 1.21 -0.13 0.00 -1.95 0.00 0.00 55.36 54.97 1m1x s GLN 878 Cb -0.10 -3.58 -0.04 0.00 -0.22 0.00 0.00 33.01 29.06 1m1x s GLN 878 CO 0.46 -0.40 1.02 0.00 -0.25 0.00 0.00 175.29 176.13 1m1x s LEU 880 N -4.79 1.36 -0.07 0.00 2.96 -1.05 -4.89 118.68 112.20 1m1x s LEU 880 Ca 0.58 -0.36 0.02 0.00 -0.22 0.00 0.00 54.13 54.15 1m1x s LEU 880 Cb -0.12 -0.94 -0.03 0.00 0.50 0.00 0.00 46.19 45.60 1m1x s LEU 880 CO 0.44 -0.09 -0.10 -0.54 -1.32 0.00 0.00 176.35 174.74 1m1x s LYS 881 N 1.59 2.75 -0.19 1.98 1.02 -1.26 -0.81 119.74 124.82 1m1x s LYS 881 Ca 0.04 -0.62 -0.04 0.00 0.02 0.00 0.00 55.97 55.37 1m1x s LYS 881 Cb -0.13 -2.52 -0.02 0.00 -0.52 0.00 0.00 37.83 34.64 1m1x s LYS 881 CO -0.08 0.58 -0.04 0.42 -0.92 0.00 0.00 175.35 175.31 1m1x s ILE 882 N -0.61 3.58 -0.14 2.17 1.09 -0.56 -1.51 121.20 125.22 1m1x s ILE 882 Ca 0.09 -0.45 -0.01 0.00 -1.10 0.00 0.00 60.65 59.18 1m1x s ILE 882 Cb -0.11 -2.60 -0.02 0.00 -1.06 0.00 0.00 42.46 38.67 1m1x s ILE 882 CO 0.01 0.45 -0.09 0.54 -0.10 0.00 0.00 174.94 175.75 1m1x s VAL 883 N 0.98 3.39 -0.03 2.92 0.11 -0.24 -0.33 120.40 127.19 1m1x s VAL 883 Ca 0.00 -0.54 0.05 0.00 -2.93 0.00 0.00 61.98 58.56 1m1x s VAL 883 Cb -0.15 -2.45 -0.01 0.00 -1.53 0.00 0.00 36.38 32.25 1m1x s VAL 883 CO 0.01 0.51 -0.17 0.00 -3.33 0.00 0.00 175.10 172.12 1m1x s GLN 885 N -0.14 3.84 0.36 0.00 1.11 0.08 -0.08 119.66 124.83 1m1x s GLN 885 Ca 0.01 -0.29 0.08 0.00 0.01 0.00 0.00 55.36 55.16 1m1x s GLN 885 Cb -0.09 -3.70 -0.03 0.00 -1.01 0.00 0.00 33.01 28.18 1m1x s GLN 885 CO 0.01 -0.30 0.31 0.08 0.01 0.00 0.00 175.29 175.40 1m1x s VAL 886 N 1.87 3.25 0.00 1.09 1.01 -0.51 -1.80 120.40 125.31 1m1x s VAL 886 Ca 0.10 -1.38 0.00 0.00 0.00 0.00 0.00 61.98 60.69 1m1x s VAL 886 Cb -0.16 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.10 1m1x s VAL 886 CO 0.11 -0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.69 1m1x n GLY 887 N -1.41 0.51 0.00 4.51 0.00 -1.11 -2.24 105.19 105.45 1m1x n GLY 887 Ca -0.00 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.66 1m1x n GLY 887 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1m1x n ARG 888 N 0.00 0.00 -3.77 1.61 3.00 -0.90 -4.75 116.66 111.86 1m1x n ARG 888 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.85 57.48 1m1x n ARG 888 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 32.46 32.34 1m1x n ARG 888 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1m1x s LEU 889 N 0.00 4.66 0.00 6.15 1.43 -1.18 -4.82 118.68 124.92 1m1x s LEU 889 Ca 0.00 -1.53 0.00 0.00 -1.03 0.00 0.00 54.13 51.57 1m1x s LEU 889 Cb 0.00 -1.84 0.00 0.00 0.03 0.00 0.00 46.19 44.38 1m1x s LEU 889 CO 0.00 -0.42 0.00 0.47 0.23 0.00 0.00 176.35 176.63 1m1x n ASP 890 N 4.71 -0.25 0.17 2.29 8.00 -1.26 -2.70 116.55 127.51 1m1x n ASP 890 Ca -0.09 -0.30 0.15 0.00 0.71 0.00 0.00 54.79 55.26 1m1x n ASP 890 Cb 0.43 0.00 0.73 0.00 -0.02 0.00 0.00 41.12 42.25 1m1x n ASP 890 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 1m1x h ARG 891 N 0.00 0.00 -1.51 -1.24 0.11 -1.76 -3.26 114.38 106.72 1m1x h ARG 891 Ca 0.00 0.00 -0.42 0.00 0.10 0.00 0.00 59.98 59.66 1m1x h ARG 891 Cb 0.00 0.00 -0.37 0.00 1.11 0.00 0.00 29.97 30.71 1m1x h ARG 891 CO 0.00 0.00 -1.10 0.41 0.10 0.00 0.00 179.97 179.38 1m1x n GLY 892 N -1.52 2.75 3.03 0.08 0.00 -1.22 -3.65 105.19 104.66 1m1x n GLY 892 Ca 0.02 -1.38 -0.17 0.00 0.00 0.00 0.00 46.02 44.48 1m1x n GLY 892 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1m1x s LYS 893 N -2.25 0.66 0.33 1.61 3.01 -1.18 -5.01 119.74 116.91 1m1x s LYS 893 Ca 0.35 -0.41 0.05 0.00 -1.01 0.00 0.00 55.97 54.94 1m1x s LYS 893 Cb 0.37 -0.61 -0.07 0.00 -1.01 0.00 0.00 37.83 36.52 1m1x s LYS 893 CO -0.05 0.16 0.04 -1.54 0.51 0.00 0.00 175.35 174.47 1m1x s SER 894 N -0.51 2.67 -0.07 2.83 1.04 -1.26 -1.88 113.70 116.51 1m1x s SER 894 Ca 0.01 -1.35 0.03 0.00 0.48 0.00 0.00 55.95 55.11 1m1x s SER 894 Cb -0.05 -0.15 0.01 0.00 0.10 0.00 0.00 66.02 65.94 1m1x s SER 894 CO 0.00 -0.55 -0.15 0.00 0.98 0.00 0.00 173.24 173.53 1m1x s ALA 895 N -3.16 1.44 -0.02 5.32 0.00 0.34 -4.64 121.76 121.04 1m1x s ALA 895 Ca 0.35 -0.52 0.08 0.00 0.00 0.00 0.00 51.96 51.87 1m1x s ALA 895 Cb 0.08 -0.61 -0.02 0.00 0.00 0.00 0.00 23.12 22.57 1m1x s ALA 895 CO 0.15 0.15 -0.25 0.42 0.00 0.00 0.00 175.76 176.23 1m1x s ILE 896 N 0.59 2.00 -0.19 0.00 -1.09 -0.74 0.36 121.20 122.13 1m1x s ILE 896 Ca -0.15 -1.08 0.01 0.00 -2.23 0.00 0.00 60.65 57.20 1m1x s ILE 896 Cb -0.16 -1.66 0.03 0.00 -1.58 0.00 0.00 42.46 39.08 1m1x s ILE 896 CO 0.05 0.57 -0.18 -0.22 -1.23 0.00 0.00 174.94 173.92 1m1x s LEU 897 N -0.58 2.36 -0.55 2.97 0.20 0.89 -2.40 118.68 121.57 1m1x s LEU 897 Ca 0.09 -0.77 -0.11 0.00 0.69 0.00 0.00 54.13 54.04 1m1x s LEU 897 Cb -0.10 -1.50 0.14 0.00 -0.43 0.00 0.00 46.19 44.31 1m1x s LEU 897 CO -0.01 -0.03 0.45 -0.31 -0.29 0.00 0.00 176.35 176.16 1m1x s TYR 898 N 1.26 3.44 -0.11 5.38 1.51 0.12 -1.56 117.35 127.39 1m1x s TYR 898 Ca 0.03 -1.85 -0.25 0.00 -1.01 0.00 0.00 57.07 53.98 1m1x s TYR 898 Cb -0.14 -3.58 -0.02 0.00 -0.11 0.00 0.00 41.96 38.10 1m1x s TYR 898 CO -0.12 -0.98 0.81 0.08 -1.11 0.00 0.00 175.55 174.23 1m1x s VAL 899 N 1.09 4.94 -0.39 0.71 1.01 0.30 -1.67 120.40 126.40 1m1x s VAL 899 Ca 0.08 1.63 -0.04 0.00 0.00 0.00 0.00 61.98 63.65 1m1x s VAL 899 Cb -0.24 -4.13 0.09 0.00 0.00 0.00 0.00 36.38 32.10 1m1x s VAL 899 CO -0.01 0.12 0.17 -0.75 0.00 0.00 0.00 175.10 174.63 1m1x s LYS 900 N 1.51 2.25 0.00 2.72 2.20 -0.93 -1.57 119.74 125.92 1m1x s LYS 900 Ca 0.40 -1.60 0.00 0.00 -0.36 0.00 0.00 55.97 54.41 1m1x s LYS 900 Cb -0.18 -3.54 0.00 0.00 -1.51 0.00 0.00 37.83 32.60 1m1x s LYS 900 CO 0.17 -0.94 0.00 0.43 -0.36 0.00 0.00 175.35 174.65 1m1x n SER 901 N 4.68 0.00 -3.15 1.43 7.64 -0.18 -1.01 113.62 123.02 1m1x n SER 901 Ca -0.07 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.87 1m1x n SER 901 Cb 0.42 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.61 1m1x n SER 901 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1m1x s LEU 902 N 0.00 -0.53 -0.35 -3.43 1.43 -1.15 -4.31 118.68 110.33 1m1x s LEU 902 Ca 0.00 0.31 -0.27 0.00 -1.03 0.00 0.00 54.13 53.13 1m1x s LEU 902 Cb 0.00 1.43 -0.05 0.00 0.03 0.00 0.00 46.19 47.60 1m1x s LEU 902 CO 0.00 -0.10 2.21 -0.22 0.23 0.00 0.00 176.35 178.47 1m1x s LEU 903 N 2.95 3.42 -0.30 1.79 1.98 -0.65 -2.25 118.68 125.62 1m1x s LEU 903 Ca 0.03 1.44 -0.29 0.00 -2.89 0.00 0.00 54.13 52.42 1m1x s LEU 903 Cb -0.10 -3.11 -0.02 0.00 0.66 0.00 0.00 46.19 43.62 1m1x s LEU 903 CO -0.13 -2.27 1.66 0.86 -1.89 0.00 0.00 176.35 174.58 1m1x s TRP 904 N 9.50 2.02 0.00 5.38 -0.00 -1.26 -3.88 118.94 130.71 1m1x s TRP 904 Ca 0.95 0.60 0.00 0.00 -0.00 0.00 0.00 56.10 57.65 1m1x s TRP 904 Cb -0.25 -4.10 0.00 0.00 -0.00 0.00 0.00 33.47 29.12 1m1x s TRP 904 CO 0.31 -2.78 0.53 2.41 -0.00 0.00 0.00 176.95 177.42 1m1x n THR 905 N 6.97 0.53 -0.06 5.86 -1.04 -1.17 -3.49 114.28 121.88 1m1x n THR 905 Ca 0.20 -0.06 0.11 0.00 -2.04 0.00 0.00 64.05 62.26 1m1x n THR 905 Cb 0.46 -0.86 0.29 0.00 -1.82 0.00 0.00 70.33 68.40 1m1x n THR 905 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1m1x n GLU 906 N 1.12 2.55 0.00 -2.82 4.71 -1.26 -3.93 120.64 121.01 1m1x n GLU 906 Ca 0.00 -2.40 0.00 0.00 -0.01 0.00 0.00 57.16 54.75 1m1x n GLU 906 Cb 0.20 -1.53 0.00 0.00 -1.01 0.00 0.00 31.44 29.11 1m1x n GLU 906 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 1m1x n THR 907 N 1.48 0.00 0.00 2.62 -1.04 -1.23 -4.31 114.28 111.80 1m1x n THR 907 Ca 0.22 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 1m1x n THR 907 Cb 0.58 -0.19 0.00 0.00 -1.82 0.00 0.00 70.33 68.89 1m1x n THR 907 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1m1x n PHE 908 N -0.34 0.00 -3.97 -1.42 3.01 -1.25 -4.86 117.46 108.63 1m1x n PHE 908 Ca 0.00 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.14 1m1x n PHE 908 Cb 0.04 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.51 1m1x n PHE 908 CO 0.00 0.00 0.00 -0.12 1.01 0.00 0.00 176.76 177.65 1m1x n MET 909 N 0.00 -4.13 0.00 -1.08 1.56 -1.26 -4.78 117.12 107.42 1m1x n MET 909 Ca 0.00 0.48 0.00 0.00 -0.27 0.00 0.00 57.70 57.91 1m1x n MET 909 Cb 0.00 -5.28 0.00 0.00 2.15 0.00 0.00 33.22 30.09 1m1x n MET 909 CO 0.00 0.00 0.00 0.27 -0.73 0.00 0.00 175.97 175.51 1m1x n ASN 910 N -2.66 0.26 0.00 6.12 0.23 -1.26 -4.04 115.26 113.90 1m1x n ASN 910 Ca 0.05 -0.62 0.00 0.00 -0.53 0.00 0.00 54.58 53.48 1m1x n ASN 910 Cb 0.51 -0.13 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 1m1x n ASN 910 CO 0.00 0.00 0.00 1.17 -0.93 0.00 0.00 177.26 177.50 1m1x n LYS 911 N 0.20 0.00 -0.02 -3.83 4.81 -1.26 -4.98 118.16 113.07 1m1x n LYS 911 Ca 0.00 0.06 -0.13 0.00 -0.87 0.00 0.00 58.31 57.37 1m1x n LYS 911 Cb 0.06 -0.35 -0.10 0.00 0.02 0.00 0.00 35.03 34.66 1m1x n LYS 911 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1m1x h GLU 912 N 0.00 0.03 0.00 1.64 4.39 -2.00 -3.49 114.58 115.15 1m1x h GLU 912 Ca 0.00 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1m1x h GLU 912 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1m1x h GLU 912 CO 0.00 0.59 0.00 -1.71 -1.16 0.00 0.00 179.01 176.73 1m1x n ASN 913 N -4.79 0.00 -3.32 1.42 5.15 -1.26 -5.03 115.26 107.43 1m1x n ASN 913 Ca -0.09 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 53.59 1m1x n ASN 913 Cb 0.30 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.50 1m1x n ASN 913 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1m1x n GLN 914 N 0.00 3.36 0.00 1.20 1.13 -1.26 -4.67 117.38 117.13 1m1x n GLN 914 Ca 0.00 -4.74 0.15 0.00 -1.94 0.00 0.00 57.00 50.47 1m1x n GLN 914 Cb 0.00 -2.30 0.73 0.00 0.11 0.00 0.00 30.24 28.78 1m1x n GLN 914 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 1m1x n ASN 915 N 0.36 0.71 -0.34 1.08 0.23 -1.26 -4.30 115.26 111.74 1m1x n ASN 915 Ca 0.32 -1.20 0.21 0.00 -0.53 0.00 0.00 54.58 53.38 1m1x n ASN 915 Cb 0.38 -0.00 0.46 0.00 -2.08 0.00 0.00 39.78 38.53 1m1x n ASN 915 CO 0.00 0.00 0.00 1.12 -0.93 0.00 0.00 177.26 177.45 1m1x h HIS 916 N 1.11 0.81 -1.70 -2.53 2.07 -1.91 -3.43 115.15 109.56 1m1x h HIS 916 Ca 0.00 0.03 0.08 0.00 -2.85 0.00 0.00 60.37 57.63 1m1x h HIS 916 Cb 0.25 -0.23 -0.23 0.00 2.57 0.00 0.00 27.41 29.77 1m1x h HIS 916 CO 0.00 0.05 0.13 -1.54 -3.07 0.00 0.00 177.93 173.50 1m1x s SER 917 N -5.21 -0.80 0.11 3.10 1.04 -1.26 -3.20 113.70 107.48 1m1x s SER 917 Ca -0.10 1.20 0.08 0.00 0.48 0.00 0.00 55.95 57.62 1m1x s SER 917 Cb 0.26 1.56 -0.04 0.00 0.10 0.00 0.00 66.02 67.91 1m1x s SER 917 CO 0.80 -0.18 -0.20 -0.31 0.98 0.00 0.00 173.24 174.33 1m1x s TYR 918 N 1.92 1.76 -0.31 5.02 2.02 -1.23 -4.08 117.35 122.45 1m1x s TYR 918 Ca -0.08 -0.43 0.01 0.00 -0.37 0.00 0.00 57.07 56.21 1m1x s TYR 918 Cb -0.06 -0.95 0.09 0.00 -0.40 0.00 0.00 41.96 40.64 1m1x s TYR 918 CO -0.18 0.21 0.06 0.45 -1.57 0.00 0.00 175.55 174.52 1m1x s SER 919 N -2.01 4.32 -0.54 2.29 0.15 -0.16 -2.13 113.70 115.62 1m1x s SER 919 Ca 0.07 -1.79 -0.28 0.00 0.70 0.00 0.00 55.95 54.65 1m1x s SER 919 Cb -0.09 -1.23 0.00 0.00 -1.71 0.00 0.00 66.02 62.99 1m1x s SER 919 CO 0.04 -0.38 1.53 -0.76 1.20 0.00 0.00 173.24 174.88 1m1x s LEU 920 N 1.28 3.40 0.03 3.45 1.43 -0.33 0.38 118.68 128.33 1m1x s LEU 920 Ca 0.08 0.41 -0.17 0.00 -1.03 0.00 0.00 54.13 53.42 1m1x s LEU 920 Cb -0.18 -3.03 -0.06 0.00 0.03 0.00 0.00 46.19 42.95 1m1x s LEU 920 CO -0.15 -1.81 0.50 -0.75 0.23 0.00 0.00 176.35 174.37 1m1x s LYS 921 N 5.76 4.09 -0.01 1.70 2.20 -1.26 -1.89 119.74 130.33 1m1x s LYS 921 Ca 0.58 0.59 0.02 0.00 -0.36 0.00 0.00 55.97 56.80 1m1x s LYS 921 Cb -0.12 -3.24 -0.00 0.00 -1.51 0.00 0.00 37.83 32.95 1m1x s LYS 921 CO 0.25 0.64 -0.06 0.45 -0.36 0.00 0.00 175.35 176.27 1m1x s SER 922 N -1.01 0.79 -0.11 1.43 0.15 -0.30 -3.83 113.70 110.82 1m1x s SER 922 Ca 0.27 -0.12 -0.05 0.00 0.70 0.00 0.00 55.95 56.75 1m1x s SER 922 Cb -0.18 -0.14 0.05 0.00 -1.71 0.00 0.00 66.02 64.04 1m1x s SER 922 CO 0.16 0.06 0.25 -0.94 1.20 0.00 0.00 173.24 173.97 1m1x s SER 923 N 0.02 -0.09 0.09 5.45 1.04 -1.13 0.81 113.70 119.88 1m1x s SER 923 Ca 0.00 0.53 0.08 0.00 0.48 0.00 0.00 55.95 57.04 1m1x s SER 923 Cb -0.05 0.47 -0.04 0.00 0.10 0.00 0.00 66.02 66.50 1m1x s SER 923 CO -0.00 -0.18 -0.18 0.00 0.98 0.00 0.00 173.24 173.86 1m1x s ALA 924 N 1.55 2.66 0.20 5.32 0.00 -0.79 -1.33 121.76 129.37 1m1x s ALA 924 Ca -0.07 -1.28 0.01 0.00 0.00 0.00 0.00 51.96 50.63 1m1x s ALA 924 Cb -0.11 -0.70 -0.05 0.00 0.00 0.00 0.00 23.12 22.27 1m1x s ALA 924 CO -0.08 0.59 0.04 -1.54 0.00 0.00 0.00 175.76 174.76 1m1x s SER 925 N -1.86 1.14 0.12 0.00 1.04 0.12 -1.53 113.70 112.73 1m1x s SER 925 Ca 0.17 -1.25 -0.08 0.00 0.48 0.00 0.00 55.95 55.26 1m1x s SER 925 Cb -0.11 0.15 -0.01 0.00 0.10 0.00 0.00 66.02 66.15 1m1x s SER 925 CO 0.08 -0.64 0.22 0.72 0.98 0.00 0.00 173.24 174.60 1m1x s PHE 926 N -3.72 0.29 -0.22 5.02 -0.12 -0.88 0.62 117.98 118.97 1m1x s PHE 926 Ca 0.29 -0.69 -0.04 0.00 -0.05 0.00 0.00 56.93 56.44 1m1x s PHE 926 Cb 0.07 -0.09 0.11 0.00 -0.63 0.00 0.00 43.02 42.48 1m1x s PHE 926 CO 0.07 -0.61 0.34 1.21 -0.05 0.00 0.00 175.22 176.19 1m1x s ASN 927 N -2.91 0.37 -0.45 1.98 2.47 0.50 -3.26 114.94 113.64 1m1x s ASN 927 Ca 0.11 0.31 -0.29 0.00 0.42 0.00 0.00 52.86 53.41 1m1x s ASN 927 Cb 0.04 0.97 0.02 0.00 -1.45 0.00 0.00 41.25 40.84 1m1x s ASN 927 CO -0.06 -0.29 1.22 -0.69 -3.72 0.00 0.00 177.10 173.56 1m1x s VAL 928 N 2.50 4.13 -0.14 -5.21 1.01 0.12 0.59 120.40 123.41 1m1x s VAL 928 Ca 0.08 1.17 0.20 0.00 0.00 0.00 0.00 61.98 63.42 1m1x s VAL 928 Cb -0.15 -4.47 -0.15 0.00 0.00 0.00 0.00 36.38 31.61 1m1x s VAL 928 CO -0.14 -0.90 0.73 2.30 0.00 0.00 0.00 175.10 177.09 1m1x n ILE 929 N 6.84 0.81 -3.75 2.22 -5.35 -0.82 -3.79 119.36 115.52 1m1x n ILE 929 Ca 0.13 -0.63 -0.13 0.00 -0.27 0.00 0.00 62.75 61.85 1m1x n ILE 929 Cb 0.49 -0.44 -0.09 0.00 -1.74 0.00 0.00 39.64 37.85 1m1x n ILE 929 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1m1x s GLU 930 N -3.12 0.64 0.20 6.28 2.12 -0.80 -4.99 118.70 119.03 1m1x s GLU 930 Ca -0.04 -0.04 0.06 0.00 0.36 0.00 0.00 54.97 55.31 1m1x s GLU 930 Cb 0.10 0.29 -0.05 0.00 0.26 0.00 0.00 34.13 34.73 1m1x s GLU 930 CO 0.83 -0.17 -0.10 -0.06 -0.54 0.00 0.00 175.26 175.23 1m1x s PHE 931 N -1.03 1.60 0.11 5.30 2.99 -1.26 0.35 117.98 126.04 1m1x s PHE 931 Ca -0.11 -0.70 0.20 0.00 0.00 0.00 0.00 56.93 56.32 1m1x s PHE 931 Cb -0.04 -0.82 0.68 0.00 0.00 0.00 0.00 43.02 42.84 1m1x s PHE 931 CO 0.04 0.21 1.73 -1.35 -0.00 0.00 0.00 175.22 175.84 1m1x h PRO 932 N 2.56 0.00 -5.95 0.24 0.11 -1.89 -3.43 132.00 123.64 1m1x h PRO 932 Ca -0.38 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.16 1m1x h PRO 932 Cb 1.21 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.26 1m1x h PRO 932 CO 0.64 0.34 -0.06 0.71 -0.21 0.00 0.00 178.00 179.41 1m1x s TYR 933 N -3.54 3.62 -0.01 0.65 1.51 -1.26 -4.91 117.35 113.40 1m1x s TYR 933 Ca 0.01 1.08 0.03 0.00 -1.01 0.00 0.00 57.07 57.18 1m1x s TYR 933 Cb 0.10 -2.58 -0.05 0.00 -0.11 0.00 0.00 41.96 39.32 1m1x s TYR 933 CO 0.68 0.29 0.06 1.17 -1.11 0.00 0.00 175.55 176.64 1m1x n LYS 934 N 3.07 0.93 -0.23 -0.62 0.00 -1.26 -4.65 118.16 115.40 1m1x n LYS 934 Ca -0.07 -0.02 -0.06 0.00 0.00 0.00 0.00 58.31 58.15 1m1x n LYS 934 Cb 0.51 -1.08 0.04 0.00 0.00 0.00 0.00 35.03 34.50 1m1x n LYS 934 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.40 176.49 1m1x h ASN 935 N 0.00 0.80 -3.77 3.14 -0.26 -1.91 -3.44 115.58 110.14 1m1x h ASN 935 Ca -0.02 -0.08 -0.49 0.00 -0.56 0.00 0.00 56.30 55.15 1m1x h ASN 935 Cb 0.42 -0.20 -0.03 0.00 -1.06 0.00 0.00 38.32 37.45 1m1x h ASN 935 CO 0.00 0.65 0.17 -0.76 -1.06 0.00 0.00 177.43 176.43 1m1x s LEU 936 N -9.99 4.13 -0.96 1.61 2.01 -1.26 -4.97 118.68 109.25 1m1x s LEU 936 Ca -0.13 1.44 -0.24 0.00 0.01 0.00 0.00 54.13 55.21 1m1x s LEU 936 Cb 0.14 -4.05 -0.07 0.00 0.01 0.00 0.00 46.19 42.21 1m1x s LEU 936 CO 0.78 -0.17 2.01 -2.16 1.01 0.00 0.00 176.35 177.82 1m1x s PRO 937 N -2.70 2.36 -0.07 1.29 0.04 -1.26 -4.95 135.00 129.71 1m1x s PRO 937 Ca 0.53 -0.39 -0.24 0.00 0.04 0.00 0.00 61.00 60.93 1m1x s PRO 937 Cb -0.12 -5.06 -0.03 0.00 0.04 0.00 0.00 34.50 29.32 1m1x s PRO 937 CO 0.18 -3.74 0.74 0.96 0.04 0.00 0.00 177.00 175.18 1m1x s ILE 938 N 11.17 5.02 0.18 0.56 -5.25 -1.26 -4.88 121.20 126.74 1m1x s ILE 938 Ca 0.73 1.52 0.07 0.00 -0.99 0.00 0.00 60.65 61.98 1m1x s ILE 938 Cb -0.06 -4.08 -0.04 0.00 2.95 0.00 0.00 42.46 41.23 1m1x s ILE 938 CO 0.04 0.22 0.04 -1.83 -1.79 0.00 0.00 174.94 171.62 1m1x s GLU 939 N 0.94 2.52 0.18 0.37 1.03 -1.26 -5.10 118.70 117.39 1m1x s GLU 939 Ca 0.39 -1.08 -0.30 0.00 0.03 0.00 0.00 54.97 54.01 1m1x s GLU 939 Cb -0.18 -2.41 -0.08 0.00 -0.80 0.00 0.00 34.13 30.66 1m1x s GLU 939 CO 0.19 0.45 1.12 -0.51 -1.33 0.00 0.00 175.26 175.18 1m1x s ASP 940 N -3.07 7.23 -0.18 0.83 1.11 -1.26 -5.04 116.67 116.29 1m1x s ASP 940 Ca 0.29 2.12 -0.07 0.00 0.18 0.00 0.00 52.55 55.07 1m1x s ASP 940 Cb -0.09 -2.61 -0.04 0.00 1.07 0.00 0.00 42.92 41.25 1m1x s ASP 940 CO 0.20 -0.25 0.06 -0.63 1.18 0.00 0.00 175.17 175.74 1m1x s ILE 941 N -0.24 4.82 0.00 0.77 1.01 -1.25 -4.99 121.20 121.31 1m1x s ILE 941 Ca 0.50 -0.03 -0.21 0.00 0.00 0.00 0.00 60.65 60.91 1m1x s ILE 941 Cb -0.30 -3.16 0.04 0.00 0.01 0.00 0.00 42.46 39.05 1m1x s ILE 941 CO 0.35 0.47 0.46 -0.89 0.00 0.00 0.00 174.94 175.34 1m1x s THR 942 N 0.29 0.04 0.00 2.92 2.01 -1.26 -0.70 115.64 118.94 1m1x s THR 942 Ca 0.04 -0.32 0.00 0.00 0.31 0.00 0.00 61.69 61.72 1m1x s THR 942 Cb -0.12 -0.86 0.00 0.00 0.01 0.00 0.00 72.50 71.53 1m1x s THR 942 CO 0.00 -0.17 0.00 -3.20 -0.69 0.00 0.00 174.62 170.56 1m1x n ASN 943 N 0.84 0.00 -3.38 3.53 2.85 -1.20 -5.04 115.26 112.85 1m1x n ASN 943 Ca -0.20 0.00 -0.15 0.00 -0.11 0.00 0.00 54.58 54.13 1m1x n ASN 943 Cb 0.58 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 41.55 1m1x n ASN 943 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1m1x s SER 944 N 0.00 0.88 0.25 1.20 1.04 -1.26 -2.07 113.70 113.74 1m1x s SER 944 Ca 0.00 -1.47 -0.22 0.00 0.48 0.00 0.00 55.95 54.74 1m1x s SER 944 Cb 0.00 0.62 0.03 0.00 0.10 0.00 0.00 66.02 66.78 1m1x s SER 944 CO 0.00 -1.22 0.78 0.28 0.98 0.00 0.00 173.24 174.06 1m1x s THR 945 N -3.26 0.00 0.33 2.02 -1.32 -0.58 -4.90 115.64 107.93 1m1x s THR 945 Ca 0.32 -0.92 0.03 0.00 -1.21 0.00 0.00 61.69 59.91 1m1x s THR 945 Cb 0.00 -2.04 -0.04 0.00 -1.51 0.00 0.00 72.50 68.92 1m1x s THR 945 CO 0.20 0.00 0.14 -1.48 -2.21 0.00 0.00 174.62 171.26 1m1x s LEU 946 N -2.94 1.83 -0.22 9.08 2.34 -1.26 -1.89 118.68 125.62 1m1x s LEU 946 Ca 0.12 -1.56 -0.08 0.00 0.06 0.00 0.00 54.13 52.67 1m1x s LEU 946 Cb -0.05 0.03 0.10 0.00 -0.56 0.00 0.00 46.19 45.70 1m1x s LEU 946 CO 0.06 -0.85 0.47 -0.69 -1.06 0.00 0.00 176.35 174.28 1m1x s VAL 947 N -3.46 -0.66 0.13 1.48 1.01 0.24 -4.71 120.40 114.43 1m1x s VAL 947 Ca 0.33 0.13 0.05 0.00 0.00 0.00 0.00 61.98 62.48 1m1x s VAL 947 Cb 0.05 -0.73 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 1m1x s VAL 947 CO 0.16 0.05 0.08 0.42 0.00 0.00 0.00 175.10 175.82 1m1x s THR 948 N 2.56 4.34 -0.22 3.92 -4.23 -1.26 -1.15 115.64 119.60 1m1x s THR 948 Ca -0.03 -1.01 -0.04 0.00 -1.18 0.00 0.00 61.69 59.43 1m1x s THR 948 Cb -0.12 -3.15 0.07 0.00 1.34 0.00 0.00 72.50 70.65 1m1x s THR 948 CO -0.14 -0.00 0.09 -0.89 -0.54 0.00 0.00 174.62 173.13 1m1x s THR 949 N -1.57 0.17 -0.25 3.99 2.01 -0.79 -4.76 115.64 114.44 1m1x s THR 949 Ca 0.29 -0.52 -0.15 0.00 0.31 0.00 0.00 61.69 61.62 1m1x s THR 949 Cb -0.11 -0.89 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 1m1x s THR 949 CO 0.22 -0.40 0.38 0.20 -0.69 0.00 0.00 174.62 174.32 1m1x s ASN 950 N 2.01 6.30 -0.57 3.53 0.01 -1.03 -1.18 114.94 124.01 1m1x s ASN 950 Ca 0.04 0.35 -0.07 0.00 -0.71 0.00 0.00 52.86 52.47 1m1x s ASN 950 Cb -0.16 -2.22 0.15 0.00 0.41 0.00 0.00 41.25 39.43 1m1x s ASN 950 CO -0.17 -0.15 0.42 0.68 -1.51 0.00 0.00 177.10 176.37 1m1x s VAL 951 N 1.86 4.09 0.43 1.60 -7.23 -0.90 -2.03 120.40 118.22 1m1x s VAL 951 Ca 0.16 -2.34 0.08 0.00 -1.81 0.00 0.00 61.98 58.07 1m1x s VAL 951 Cb -0.15 -3.67 0.01 0.00 0.56 0.00 0.00 36.38 33.12 1m1x s VAL 951 CO 0.09 -0.84 0.53 0.42 -0.31 0.00 0.00 175.10 174.99 1m1x s THR 952 N 0.65 2.84 -1.76 5.32 -4.23 -1.16 -3.57 115.64 113.75 1m1x s THR 952 Ca 0.12 -1.10 0.27 0.00 -1.18 0.00 0.00 61.69 59.80 1m1x s THR 952 Cb -0.21 -2.95 0.36 0.00 1.34 0.00 0.00 72.50 71.05 1m1x s THR 952 CO -0.03 0.00 1.70 0.79 -0.54 0.00 0.00 174.62 176.53 1m1x n TRP 953 N -1.79 0.00 0.00 3.99 7.02 -1.19 0.77 117.44 126.24 1m1x n TRP 953 Ca 0.07 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.55 1m1x n TRP 953 Cb 0.60 -0.14 0.00 0.00 -2.42 0.00 0.00 31.31 29.35 1m1x n TRP 953 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1m1x n GLY 954 N 1.30 0.14 0.06 6.99 0.00 -1.26 -3.49 105.19 108.93 1m1x n GLY 954 Ca 0.14 0.55 -0.05 0.00 0.00 0.00 0.00 46.02 46.66 1m1x n GLY 954 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1m1x h ILE 955 N 0.00 0.27 0.00 -0.61 1.08 -2.01 -3.53 117.51 112.71 1m1x h ILE 955 Ca 0.00 -1.24 0.00 0.00 -0.39 0.00 0.00 64.86 63.23 1m1x h ILE 955 Cb 0.00 0.55 0.00 0.00 -3.07 0.00 0.00 36.82 34.30 1m1x h ILE 955 CO 0.00 0.09 0.00 0.00 -0.69 0.00 0.00 178.15 177.55