#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m6x s PRO 3 N 0.00 4.36 0.29 3.23 0.02 -1.26 -4.92 135.00 136.72 3m6x s PRO 3 Ca 0.00 2.15 -0.00 0.00 0.02 0.00 0.00 61.00 63.17 3m6x s PRO 3 Cb 0.00 -3.14 0.45 0.00 0.02 0.00 0.00 34.50 31.82 3m6x s PRO 3 CO 0.00 -0.27 1.86 1.57 -0.33 0.00 0.00 177.00 179.84 3m6x h LYS 4 N 4.76 0.83 0.00 5.54 2.10 -2.00 -2.14 116.57 125.67 3m6x h LYS 4 Ca -0.46 -0.14 -0.07 0.00 -2.00 0.00 0.00 60.65 57.97 3m6x h LYS 4 Cb 1.22 -0.14 -0.01 0.00 -0.90 0.00 0.00 32.23 32.40 3m6x h LYS 4 CO 0.74 0.71 -0.34 0.00 -2.00 0.00 0.00 179.45 178.56 3m6x h ALA 5 N 1.40 1.12 -0.35 0.07 0.00 -1.99 -0.99 119.26 118.53 3m6x h ALA 5 Ca 0.19 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 3m6x h ALA 5 Cb 0.22 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3m6x h ALA 5 CO -0.01 0.43 -0.02 0.35 0.00 0.00 0.00 179.25 180.00 3m6x h PHE 6 N 0.00 0.69 -0.56 0.00 3.57 -1.79 -1.95 116.94 116.89 3m6x h PHE 6 Ca -0.00 -0.13 -0.08 0.00 3.53 0.00 0.00 57.97 61.29 3m6x h PHE 6 Cb 0.77 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 3m6x h PHE 6 CO 0.00 0.75 0.02 -0.07 -2.23 0.00 0.00 178.31 176.78 3m6x h LEU 7 N 0.43 0.94 -0.79 0.59 3.38 -0.98 -2.80 115.31 116.07 3m6x h LEU 7 Ca 0.10 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 3m6x h LEU 7 Cb 0.49 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 3m6x h LEU 7 CO 0.02 1.00 0.33 0.77 0.09 0.00 0.00 178.44 180.66 3m6x h SER 8 N 0.85 1.08 0.00 -0.43 4.64 -1.20 -0.39 113.55 118.10 3m6x h SER 8 Ca 0.16 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3m6x h SER 8 Cb 0.51 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 3m6x h SER 8 CO 0.02 0.95 0.00 -1.14 -0.87 0.00 0.00 176.83 175.80 3m6x n ARG 9 N -4.30 0.17 0.00 4.77 3.00 -0.74 -2.08 116.66 117.48 3m6x n ARG 9 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.92 3m6x n ARG 9 Cb 0.18 -1.13 0.00 0.00 0.00 0.00 0.00 32.46 31.51 3m6x n ARG 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3m6x n ALA 11 N 0.48 0.00 -0.15 5.13 0.00 -0.16 -1.43 120.51 124.38 3m6x n ALA 11 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 3m6x n ALA 11 Cb 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.49 3m6x n ALA 11 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3m6x h GLU 12 N 0.00 0.78 -0.32 0.00 4.81 -1.68 -2.23 114.58 115.94 3m6x h GLU 12 Ca 0.00 -0.26 -0.16 0.00 -0.13 0.00 0.00 59.36 58.81 3m6x h GLU 12 Cb 0.00 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 3m6x h GLU 12 CO 0.00 0.86 -0.43 -0.07 -0.73 0.00 0.00 179.01 178.64 3m6x h LEU 13 N 0.62 0.89 0.00 1.64 3.38 -1.52 -3.33 115.31 117.00 3m6x h LEU 13 Ca 0.12 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3m6x h LEU 13 Cb 0.52 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3m6x h LEU 13 CO 0.03 1.20 -1.10 0.18 0.09 0.00 0.00 178.44 178.84 3m6x n LEU 14 N -4.03 0.68 0.00 1.67 4.77 -1.22 -5.03 117.00 113.83 3m6x n LEU 14 Ca -0.03 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 3m6x n LEU 14 Cb 0.56 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 3m6x n LEU 14 CO 0.48 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 3m6x n GLY 15 N 1.42 3.38 0.00 -0.72 0.00 -0.84 -1.16 105.19 107.27 3m6x n GLY 15 Ca 0.02 0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.12 3m6x n GLY 15 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3m6x n GLU 16 N 14.00 0.04 0.03 1.61 1.02 -1.26 -1.35 120.64 134.72 3m6x n GLU 16 Ca 0.00 0.26 0.13 0.00 -0.02 0.00 0.00 57.16 57.53 3m6x n GLU 16 Cb 0.00 -1.50 0.35 0.00 -0.02 0.00 0.00 31.44 30.27 3m6x n GLU 16 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 3m6x n GLU 17 N -1.46 0.11 -0.09 3.49 2.13 -0.31 -4.30 120.64 120.21 3m6x n GLU 17 Ca 0.04 0.05 -0.08 0.00 0.66 0.00 0.00 57.16 57.83 3m6x n GLU 17 Cb 0.14 -1.59 -0.00 0.00 0.27 0.00 0.00 31.44 30.26 3m6x n GLU 17 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 3m6x h PHE 18 N 0.00 0.32 -0.78 4.31 3.57 -1.29 -2.85 116.94 120.23 3m6x h PHE 18 Ca 0.00 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.62 3m6x h PHE 18 Cb 0.60 -0.10 -0.08 0.00 2.79 0.00 0.00 35.95 39.16 3m6x h PHE 18 CO 0.00 0.18 0.42 -1.35 -2.23 0.00 0.00 178.31 175.33 3m6x h PRO 19 N 0.36 0.66 -0.61 6.41 0.11 -1.80 0.16 132.00 137.29 3m6x h PRO 19 Ca 0.13 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.13 3m6x h PRO 19 Cb 0.03 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 30.96 3m6x h PRO 19 CO -0.08 0.44 0.11 0.00 -0.21 0.00 0.00 178.00 178.26 3m6x h ALA 20 N 1.47 1.04 -0.12 -0.75 0.00 -1.82 -0.43 119.26 118.66 3m6x h ALA 20 Ca 0.39 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 3m6x h ALA 20 Cb 0.43 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 3m6x h ALA 20 CO -0.28 0.62 -0.00 0.35 0.00 0.00 0.00 179.25 179.94 3m6x h PHE 21 N 0.93 0.22 -0.50 0.00 3.57 -1.01 -1.69 116.94 118.46 3m6x h PHE 21 Ca 0.19 -0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.69 3m6x h PHE 21 Cb 0.39 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.03 3m6x h PHE 21 CO 0.03 0.45 0.27 1.25 -2.23 0.00 0.00 178.31 178.07 3m6x h LEU 22 N -0.07 0.41 -0.92 0.59 5.85 -0.60 -2.00 115.31 118.57 3m6x h LEU 22 Ca 0.03 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.78 3m6x h LEU 22 Cb 0.36 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.28 3m6x h LEU 22 CO 0.01 0.28 0.60 0.50 -0.34 0.00 0.00 178.44 179.49 3m6x h LYS 23 N 0.53 1.21 -0.86 1.25 3.64 -0.97 -0.26 116.57 121.10 3m6x h LYS 23 Ca 0.21 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 3m6x h LYS 23 Cb 0.09 -0.27 -0.04 0.00 -0.41 0.00 0.00 32.23 31.60 3m6x h LYS 23 CO -0.13 0.80 0.50 0.00 -2.27 0.00 0.00 179.45 178.36 3m6x h ALA 24 N 1.33 1.10 -0.30 5.00 0.00 -0.85 0.11 119.26 125.65 3m6x h ALA 24 Ca 0.34 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.98 3m6x h ALA 24 Cb -0.14 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.30 3m6x h ALA 24 CO -0.07 0.58 -0.43 -0.07 0.00 0.00 0.00 179.25 179.26 3m6x h LEU 25 N 1.19 0.83 0.03 0.00 3.38 -0.61 -1.66 115.31 118.48 3m6x h LEU 25 Ca 0.31 -0.39 -0.32 0.00 0.09 0.00 0.00 57.88 57.56 3m6x h LEU 25 Cb -0.02 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.45 3m6x h LEU 25 CO -0.05 1.14 -1.90 0.35 0.09 0.00 0.00 178.44 178.07 3m6x n THR 26 N -4.03 1.62 -0.01 0.22 -2.24 -0.19 -4.57 114.28 105.08 3m6x n THR 26 Ca -0.02 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 61.00 3m6x n THR 26 Cb 0.56 -1.15 -0.02 0.00 -2.10 0.00 0.00 70.33 67.62 3m6x n THR 26 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3m6x n GLU 27 N -3.12 1.87 -1.81 -0.78 1.02 0.32 -5.05 120.64 113.08 3m6x n GLU 27 Ca -0.24 -0.01 -0.39 0.00 -0.02 0.00 0.00 57.16 56.50 3m6x n GLU 27 Cb 1.06 -1.06 0.03 0.00 -0.02 0.00 0.00 31.44 31.45 3m6x n GLU 27 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3m6x s GLY 28 N -2.80 2.89 0.29 0.62 0.00 -0.62 -4.95 107.32 102.75 3m6x s GLY 28 Ca -0.01 1.34 -0.29 0.00 0.00 0.00 0.00 44.72 45.76 3m6x s GLY 28 CO 0.10 1.87 1.22 0.54 0.00 0.00 0.00 173.10 176.84 3m6x s LYS 29 N -2.80 4.47 0.54 2.90 1.02 -1.26 -4.87 119.74 119.73 3m6x s LYS 29 Ca 0.69 2.03 -0.22 0.00 0.02 0.00 0.00 55.97 58.49 3m6x s LYS 29 Cb -0.40 -3.13 -0.05 0.00 -0.52 0.00 0.00 37.83 33.72 3m6x s LYS 29 CO 0.49 -0.04 1.30 1.03 -0.92 0.00 0.00 175.35 177.21 3m6x s ARG 30 N -1.43 3.23 0.12 1.68 0.52 -1.26 -4.98 118.95 116.83 3m6x s ARG 30 Ca 0.48 2.10 0.05 0.00 -0.52 0.00 0.00 55.73 57.84 3m6x s ARG 30 Cb -0.36 -2.24 -0.04 0.00 0.52 0.00 0.00 34.95 32.83 3m6x s ARG 30 CO 0.46 -1.08 0.06 0.95 0.02 0.00 0.00 175.30 175.71 3m6x s THR 31 N -1.38 4.25 -0.06 0.02 -4.23 -1.26 -4.98 115.64 108.00 3m6x s THR 31 Ca 0.71 -1.03 -0.01 0.00 -1.18 0.00 0.00 61.69 60.18 3m6x s THR 31 Cb -0.37 -3.09 0.03 0.00 1.34 0.00 0.00 72.50 70.41 3m6x s THR 31 CO 0.44 0.02 0.02 -0.31 -0.54 0.00 0.00 174.62 174.24 3m6x s TYR 32 N -1.53 0.44 0.07 3.99 2.02 -1.26 -4.86 117.35 116.22 3m6x s TYR 32 Ca 0.28 -0.01 0.06 0.00 -0.37 0.00 0.00 57.07 57.03 3m6x s TYR 32 Cb -0.11 -0.66 -0.03 0.00 -0.40 0.00 0.00 41.96 40.76 3m6x s TYR 32 CO 0.21 -0.27 -0.16 0.20 -1.57 0.00 0.00 175.55 173.96 3m6x s GLY 33 N 1.95 0.94 0.12 0.71 0.00 -1.25 -1.46 107.32 108.33 3m6x s GLY 33 Ca 0.04 -1.01 0.04 0.00 0.00 0.00 0.00 44.72 43.79 3m6x s GLY 33 CO -0.04 -1.01 -0.11 0.48 0.00 0.00 0.00 173.10 172.42 3m6x s LEU 34 N -1.58 2.46 -0.09 0.66 0.05 -0.21 -2.13 118.68 117.84 3m6x s LEU 34 Ca 0.01 -0.90 -0.01 0.00 0.05 0.00 0.00 54.13 53.28 3m6x s LEU 34 Cb -0.09 -0.35 0.03 0.00 -2.05 0.00 0.00 46.19 43.73 3m6x s LEU 34 CO 0.02 -0.28 -0.05 -0.60 -0.55 0.00 0.00 176.35 174.89 3m6x s ARG 35 N -3.21 1.19 0.23 1.48 3.52 0.66 -1.07 118.95 121.75 3m6x s ARG 35 Ca 0.11 -0.13 -0.30 0.00 -0.13 0.00 0.00 55.73 55.28 3m6x s ARG 35 Cb -0.01 -1.34 -0.09 0.00 -1.56 0.00 0.00 34.95 31.95 3m6x s ARG 35 CO 0.00 -0.26 1.29 0.08 -0.81 0.00 0.00 175.30 175.60 3m6x s VAL 36 N 1.73 3.13 -0.88 7.11 1.01 0.19 -0.85 120.40 131.84 3m6x s VAL 36 Ca 0.04 0.99 -0.25 0.00 0.00 0.00 0.00 61.98 62.76 3m6x s VAL 36 Cb -0.13 -3.63 0.02 0.00 0.00 0.00 0.00 36.38 32.64 3m6x s VAL 36 CO -0.06 0.17 1.55 0.21 0.00 0.00 0.00 175.10 176.97 3m6x s ASN 37 N 0.05 6.00 0.00 3.32 3.84 0.30 -4.84 114.94 123.62 3m6x s ASN 37 Ca 0.54 -0.83 0.17 0.00 0.21 0.00 0.00 52.86 52.95 3m6x s ASN 37 Cb -0.37 -2.56 0.81 0.00 -0.55 0.00 0.00 41.25 38.59 3m6x s ASN 37 CO 0.41 -1.94 1.52 0.35 -2.79 0.00 0.00 177.10 174.66 3m6x n THR 38 N 6.99 0.62 0.15 -5.21 -2.24 -1.25 -0.96 114.28 112.38 3m6x n THR 38 Ca 0.25 0.15 0.01 0.00 -2.27 0.00 0.00 64.05 62.19 3m6x n THR 38 Cb 0.50 -0.87 0.29 0.00 -2.10 0.00 0.00 70.33 68.14 3m6x n THR 38 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3m6x h LEU 39 N 0.00 0.07 0.03 3.22 3.38 -1.88 -3.35 115.31 116.77 3m6x h LEU 39 Ca 0.00 -0.03 -0.38 0.00 0.09 0.00 0.00 57.88 57.56 3m6x h LEU 39 Cb 0.20 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.88 3m6x h LEU 39 CO 0.00 0.49 -2.37 0.29 0.09 0.00 0.00 178.44 176.94 3m6x n LYS 40 N -4.02 0.67 -3.50 1.13 5.02 -0.13 -4.36 118.16 112.97 3m6x n LYS 40 Ca -0.02 0.17 -0.15 0.00 -2.02 0.00 0.00 58.31 56.29 3m6x n LYS 40 Cb 0.47 -1.56 -0.05 0.00 -0.02 0.00 0.00 35.03 33.87 3m6x n LYS 40 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 3m6x s LEU 41 N -6.59 -0.59 0.73 -0.35 2.34 -0.75 -4.98 118.68 108.48 3m6x s LEU 41 Ca -0.31 0.46 -0.11 0.00 0.06 0.00 0.00 54.13 54.23 3m6x s LEU 41 Cb 0.08 2.44 0.03 0.00 -0.56 0.00 0.00 46.19 48.18 3m6x s LEU 41 CO 0.65 -0.67 1.07 -2.84 -1.06 0.00 0.00 176.35 173.50 3m6x s PRO 42 N -1.93 2.68 0.27 1.48 0.02 -1.26 -3.75 135.00 132.51 3m6x s PRO 42 Ca -0.06 0.88 -0.01 0.00 0.02 0.00 0.00 61.00 61.83 3m6x s PRO 42 Cb -0.00 -1.97 0.48 0.00 0.02 0.00 0.00 34.50 33.03 3m6x s PRO 42 CO 0.02 -1.26 1.86 -1.35 -0.33 0.00 0.00 177.00 175.94 3m6x h PRO 43 N -0.83 1.06 -0.27 5.54 0.11 -1.91 -1.58 132.00 134.12 3m6x h PRO 43 Ca -0.45 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 65.51 3m6x h PRO 43 Cb 1.23 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 3m6x h PRO 43 CO 0.57 0.70 -0.21 0.93 -0.21 0.00 0.00 178.00 179.78 3m6x h GLU 44 N 1.09 0.50 -0.42 1.05 3.07 -1.94 -0.93 114.58 117.01 3m6x h GLU 44 Ca 0.47 -0.18 -0.07 0.00 -0.50 0.00 0.00 59.36 59.09 3m6x h GLU 44 Cb 0.33 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 3m6x h GLU 44 CO -0.22 0.69 0.00 0.00 -1.40 0.00 0.00 179.01 178.08 3m6x h ALA 45 N 1.33 0.56 -0.64 3.43 0.00 -1.69 -2.06 119.26 120.19 3m6x h ALA 45 Ca 0.07 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 3m6x h ALA 45 Cb 0.62 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 3m6x h ALA 45 CO 0.04 0.34 0.12 0.35 0.00 0.00 0.00 179.25 180.11 3m6x h PHE 46 N 0.57 1.10 -0.44 0.00 3.57 -0.99 -2.72 116.94 118.04 3m6x h PHE 46 Ca 0.12 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.48 3m6x h PHE 46 Cb 0.48 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 3m6x h PHE 46 CO 0.04 0.93 0.29 0.37 -2.23 0.00 0.00 178.31 177.70 3m6x h GLN 47 N 0.96 0.58 -0.11 1.11 4.15 -0.95 0.87 115.11 121.71 3m6x h GLN 47 Ca 0.20 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.53 3m6x h GLN 47 Cb 0.41 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.96 3m6x h GLN 47 CO 0.01 0.39 -0.15 0.00 -1.93 0.00 0.00 178.83 177.14 3m6x h ARG 48 N 0.60 0.18 -0.05 1.69 3.08 -1.06 -3.04 114.38 115.77 3m6x h ARG 48 Ca 0.16 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.17 3m6x h ARG 48 Cb -0.07 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 29.96 3m6x h ARG 48 CO -0.03 0.34 0.00 0.44 -1.07 0.00 0.00 179.97 179.64 3m6x n ILE 49 N -4.28 0.05 -1.87 2.04 -5.35 -0.48 -4.99 119.36 104.48 3m6x n ILE 49 Ca -0.01 -0.52 -0.42 0.00 -0.27 0.00 0.00 62.75 61.53 3m6x n ILE 49 Cb 0.27 1.36 -0.03 0.00 -1.74 0.00 0.00 39.64 39.51 3m6x n ILE 49 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 3m6x s SER 50 N -1.59 6.51 0.24 7.28 0.15 0.18 -4.88 113.70 121.59 3m6x s SER 50 Ca 0.24 2.74 0.23 0.00 0.70 0.00 0.00 55.95 59.85 3m6x s SER 50 Cb 0.16 -2.61 0.96 0.00 -1.71 0.00 0.00 66.02 62.82 3m6x s SER 50 CO 0.24 -0.86 1.70 -2.65 1.20 0.00 0.00 173.24 172.88 3m6x n PRO 51 N 3.47 0.19 -4.49 5.44 -0.02 -1.26 -4.80 135.00 133.53 3m6x n PRO 51 Ca 0.12 0.40 -0.24 0.00 -2.02 0.00 0.00 63.50 61.77 3m6x n PRO 51 Cb 0.38 -1.85 -0.14 0.00 -0.02 0.00 0.00 33.50 31.87 3m6x n PRO 51 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3m6x s TRP 52 N -3.29 1.67 0.28 6.00 0.51 -1.26 -5.11 118.94 117.74 3m6x s TRP 52 Ca 0.05 -0.38 -0.30 0.00 -2.12 0.00 0.00 56.10 53.35 3m6x s TRP 52 Cb 0.09 -0.98 -0.11 0.00 -0.81 0.00 0.00 33.47 31.67 3m6x s TRP 52 CO 0.39 0.10 1.50 -2.14 -0.51 0.00 0.00 176.95 176.29 3m6x s PRO 53 N -1.34 4.20 0.20 4.98 0.02 -1.26 -5.01 135.00 136.79 3m6x s PRO 53 Ca 0.06 2.43 0.11 0.00 0.02 0.00 0.00 61.00 63.62 3m6x s PRO 53 Cb -0.09 -3.06 -0.04 0.00 0.02 0.00 0.00 34.50 31.33 3m6x s PRO 53 CO 0.02 -0.50 -0.23 -0.51 -0.33 0.00 0.00 177.00 175.45 3m6x s LEU 54 N -0.67 2.46 -0.00 -5.54 1.43 -1.26 -4.23 118.68 110.86 3m6x s LEU 54 Ca 0.60 -0.88 0.04 0.00 -1.03 0.00 0.00 54.13 52.86 3m6x s LEU 54 Cb -0.44 -1.17 -0.01 0.00 0.03 0.00 0.00 46.19 44.59 3m6x s LEU 54 CO 0.48 0.11 -0.14 -0.13 0.23 0.00 0.00 176.35 176.89 3m6x s ARG 55 N -2.77 1.14 0.35 1.70 0.52 -0.85 -4.97 118.95 114.07 3m6x s ARG 55 Ca 0.22 -0.55 -0.27 0.00 -0.52 0.00 0.00 55.73 54.61 3m6x s ARG 55 Cb -0.08 -1.11 -0.09 0.00 0.52 0.00 0.00 34.95 34.20 3m6x s ARG 55 CO 0.11 0.30 1.16 -1.25 0.02 0.00 0.00 175.30 175.64 3m6x s PRO 56 N -0.44 4.29 -0.25 3.54 0.04 -1.26 0.28 135.00 141.19 3m6x s PRO 56 Ca 0.05 1.87 -0.23 0.00 0.04 0.00 0.00 61.00 62.73 3m6x s PRO 56 Cb -0.06 -2.89 -0.01 0.00 0.04 0.00 0.00 34.50 31.58 3m6x s PRO 56 CO -0.00 -0.12 0.75 0.42 0.04 0.00 0.00 177.00 178.08 3m6x s ILE 57 N -1.31 4.89 0.44 0.56 1.01 -0.59 -4.72 121.20 121.48 3m6x s ILE 57 Ca 0.52 1.37 0.15 0.00 0.00 0.00 0.00 60.65 62.69 3m6x s ILE 57 Cb -0.32 -4.05 0.33 0.00 0.01 0.00 0.00 42.46 38.44 3m6x s ILE 57 CO 0.41 -0.05 1.97 -0.65 0.00 0.00 0.00 174.94 176.63 3m6x h PRO 58 N 7.79 0.37 -0.37 2.79 0.11 -1.94 -1.81 132.00 138.95 3m6x h PRO 58 Ca -0.25 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3m6x h PRO 58 Cb 1.10 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.13 3m6x h PRO 58 CO 0.84 0.25 0.00 -2.67 -0.21 0.00 0.00 178.00 176.20 3m6x n TRP 59 N -4.47 0.47 -3.51 0.65 2.14 -1.26 -4.78 117.44 106.69 3m6x n TRP 59 Ca 0.10 -0.23 -0.22 0.00 2.07 0.00 0.00 57.50 59.22 3m6x n TRP 59 Cb 0.40 0.00 -0.13 0.00 -0.81 0.00 0.00 31.31 30.77 3m6x n TRP 59 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 3m6x h GLN 61 N 8.35 0.00 -0.31 0.00 1.08 -1.87 -0.35 115.11 122.01 3m6x h GLN 61 Ca -0.17 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.03 3m6x h GLN 61 Cb 1.10 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.53 3m6x h GLN 61 CO 0.33 0.09 0.00 -0.85 -0.95 0.00 0.00 178.83 177.45 3m6x n GLU 62 N -3.89 1.96 -4.22 1.46 0.00 -1.26 -4.89 120.64 109.80 3m6x n GLU 62 Ca -0.02 -1.46 -0.29 0.00 0.00 0.00 0.00 57.16 55.39 3m6x n GLU 62 Cb 0.18 -1.39 -0.09 0.00 0.00 0.00 0.00 31.44 30.14 3m6x n GLU 62 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 3m6x s GLY 63 N -1.31 1.79 -0.00 -1.84 0.00 -0.14 -0.64 107.32 105.18 3m6x s GLY 63 Ca 0.32 -1.27 -0.00 0.00 0.00 0.00 0.00 44.72 43.76 3m6x s GLY 63 CO 0.24 -1.26 0.01 -1.36 0.00 0.00 0.00 173.10 170.73 3m6x s PHE 64 N -1.34 0.01 0.20 1.90 0.08 -0.23 -1.54 117.98 117.07 3m6x s PHE 64 Ca 0.23 -0.02 -0.30 0.00 0.12 0.00 0.00 56.93 56.96 3m6x s PHE 64 Cb -0.11 -0.01 -0.08 0.00 -0.57 0.00 0.00 43.02 42.25 3m6x s PHE 64 CO 0.15 -0.02 1.14 0.71 -0.10 0.00 0.00 175.22 177.09 3m6x s TYR 65 N -0.11 3.53 0.31 0.36 2.02 0.14 -1.04 117.35 122.55 3m6x s TYR 65 Ca -0.01 1.56 0.10 0.00 -0.37 0.00 0.00 57.07 58.35 3m6x s TYR 65 Cb -0.01 -3.33 -0.05 0.00 -0.40 0.00 0.00 41.96 38.17 3m6x s TYR 65 CO -0.00 -0.81 -0.06 1.52 -1.57 0.00 0.00 175.55 174.63 3m6x s TYR 66 N -0.38 2.50 0.36 2.71 -0.85 -0.54 -2.00 117.35 119.15 3m6x s TYR 66 Ca 0.49 -0.36 -0.27 0.00 -0.52 0.00 0.00 57.07 56.41 3m6x s TYR 66 Cb -0.31 -1.28 -0.09 0.00 0.38 0.00 0.00 41.96 40.66 3m6x s TYR 66 CO 0.37 0.59 1.27 -2.14 -1.52 0.00 0.00 175.55 174.11 3m6x s PRO 67 N -3.64 4.20 0.44 -3.49 0.02 -1.26 -4.56 135.00 126.71 3m6x s PRO 67 Ca 0.32 2.10 0.20 0.00 0.02 0.00 0.00 61.00 63.64 3m6x s PRO 67 Cb -0.03 -2.91 1.15 0.00 0.02 0.00 0.00 34.50 32.74 3m6x s PRO 67 CO 0.18 -0.28 1.87 1.49 -0.33 0.00 0.00 177.00 179.94 3m6x h GLU 68 N 3.06 0.32 0.00 5.54 4.81 -1.95 -0.31 114.58 126.05 3m6x h GLU 68 Ca -0.49 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 3m6x h GLU 68 Cb 1.23 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.54 3m6x h GLU 68 CO 0.64 0.21 -0.08 -0.85 -0.73 0.00 0.00 179.01 178.20 3m6x n GLU 69 N -4.47 0.15 -2.17 1.92 0.00 -1.26 -4.89 120.64 109.92 3m6x n GLU 69 Ca 0.18 0.11 -0.32 0.00 0.00 0.00 0.00 57.16 57.12 3m6x n GLU 69 Cb 0.71 -1.66 -0.01 0.00 0.00 0.00 0.00 31.44 30.49 3m6x n GLU 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3m6x s ALA 70 N -3.06 2.86 -0.63 -1.84 0.00 -0.13 -5.03 121.76 113.93 3m6x s ALA 70 Ca 0.12 0.31 0.05 0.00 0.00 0.00 0.00 51.96 52.44 3m6x s ALA 70 Cb 0.15 -3.19 0.18 0.00 0.00 0.00 0.00 23.12 20.26 3m6x s ALA 70 CO 0.59 -0.60 0.49 0.54 0.00 0.00 0.00 175.76 176.78 3m6x n ARG 71 N -1.87 1.53 0.00 0.00 1.74 -1.26 -4.93 116.66 111.86 3m6x n ARG 71 Ca 0.08 -4.20 0.09 0.00 -0.77 0.00 0.00 57.85 53.05 3m6x n ARG 71 Cb 0.53 -2.12 0.40 0.00 -1.02 0.00 0.00 32.46 30.25 3m6x n ARG 71 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 3m6x n PRO 72 N 2.00 0.03 0.16 5.56 -0.02 -1.26 -3.85 135.00 137.62 3m6x n PRO 72 Ca 0.23 0.18 -0.07 0.00 -2.02 0.00 0.00 63.50 61.82 3m6x n PRO 72 Cb 0.39 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.34 3m6x n PRO 72 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3m6x h GLY 73 N 3.13 -0.48 -5.82 -1.23 0.00 -2.02 -3.37 103.07 93.29 3m6x h GLY 73 Ca 0.00 0.18 -0.71 0.00 0.00 0.00 0.00 47.33 46.80 3m6x h GLY 73 CO 0.00 -0.17 3.17 -1.55 0.00 0.00 0.00 176.54 177.98 3m6x n PRO 74 N -4.07 3.16 -3.79 4.80 -0.04 -1.25 -4.67 135.00 129.13 3m6x n PRO 74 Ca -0.06 -2.63 -0.13 0.00 -0.04 0.00 0.00 63.50 60.65 3m6x n PRO 74 Cb 0.18 -3.13 -0.10 0.00 -0.04 0.00 0.00 33.50 30.40 3m6x n PRO 74 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3m6x s HIS 75 N 2.59 -0.20 0.55 0.54 2.46 -1.26 -5.05 115.29 114.92 3m6x s HIS 75 Ca 0.51 0.43 0.24 0.00 0.47 0.00 0.00 55.06 56.71 3m6x s HIS 75 Cb 0.15 0.07 1.45 0.00 -0.13 0.00 0.00 32.58 34.11 3m6x s HIS 75 CO -0.07 -0.25 2.07 -1.35 -2.47 0.00 0.00 174.74 172.67 3m6x h PRO 76 N 4.89 0.00 -0.28 2.88 0.11 -1.88 -1.50 132.00 136.21 3m6x h PRO 76 Ca -0.28 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.78 3m6x h PRO 76 Cb 1.19 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3m6x h PRO 76 CO 0.37 0.00 -0.06 0.74 -0.21 0.00 0.00 178.00 178.84 3m6x h PHE 77 N 0.00 0.46 -0.16 0.65 0.04 -1.94 -0.36 116.94 115.63 3m6x h PHE 77 Ca 0.13 -0.05 -0.02 0.00 2.80 0.00 0.00 57.97 60.83 3m6x h PHE 77 Cb 0.56 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.57 3m6x h PHE 77 CO 0.00 0.51 0.04 0.35 -0.60 0.00 0.00 178.31 178.61 3m6x h PHE 78 N 0.42 0.28 0.00 -0.55 3.57 -1.47 -1.08 116.94 118.11 3m6x h PHE 78 Ca 0.09 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 3m6x h PHE 78 Cb 0.38 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.03 3m6x h PHE 78 CO 0.01 0.40 -0.16 1.88 -2.23 0.00 0.00 178.31 178.21 3m6x h TYR 79 N 0.07 0.00 -0.00 0.41 0.05 -1.41 -1.03 116.97 115.06 3m6x h TYR 79 Ca 0.05 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.83 3m6x h TYR 79 Cb 0.26 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.00 3m6x h TYR 79 CO 0.01 0.16 -0.00 0.00 -1.05 0.00 0.00 178.16 177.28 3m6x n ALA 80 N -2.18 2.68 -2.45 3.88 0.00 -0.18 -4.89 120.51 117.37 3m6x n ALA 80 Ca 0.01 -0.22 -0.14 0.00 0.00 0.00 0.00 53.44 53.09 3m6x n ALA 80 Cb 0.43 -1.49 0.01 0.00 0.00 0.00 0.00 19.45 18.40 3m6x n ALA 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m6x n GLY 81 N 1.02 -0.14 0.24 0.00 0.00 -0.39 -4.89 105.19 101.04 3m6x n GLY 81 Ca 0.23 -0.28 0.14 0.00 0.00 0.00 0.00 46.02 46.12 3m6x n GLY 81 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3m6x h LEU 82 N -0.36 0.00 -7.37 0.99 3.38 -1.40 -3.42 115.31 107.13 3m6x h LEU 82 Ca -0.33 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 3m6x h LEU 82 Cb 1.23 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.86 3m6x h LEU 82 CO 0.37 0.00 -0.03 -0.72 0.09 0.00 0.00 178.44 178.16 3m6x s TYR 83 N -3.38 -0.23 -0.10 1.13 -0.85 -1.26 -0.54 117.35 112.12 3m6x s TYR 83 Ca 0.05 -0.07 -0.02 0.00 -0.52 0.00 0.00 57.07 56.51 3m6x s TYR 83 Cb 0.07 0.31 -0.03 0.00 0.38 0.00 0.00 41.96 42.68 3m6x s TYR 83 CO 0.62 -0.74 -0.03 -0.47 -1.52 0.00 0.00 175.55 173.42 3m6x s TYR 84 N -3.80 3.06 -0.77 -3.49 5.04 -0.03 -4.87 117.35 112.49 3m6x s TYR 84 Ca 0.03 0.03 -0.24 0.00 -2.44 0.00 0.00 57.07 54.45 3m6x s TYR 84 Cb 0.01 -1.81 0.06 0.00 0.35 0.00 0.00 41.96 40.57 3m6x s TYR 84 CO -0.11 0.30 1.17 0.42 -1.34 0.00 0.00 175.55 175.99 3m6x s ILE 85 N -0.54 4.08 -0.07 3.14 1.01 -1.26 -0.25 121.20 127.32 3m6x s ILE 85 Ca 0.09 -0.27 0.04 0.00 0.00 0.00 0.00 60.65 60.51 3m6x s ILE 85 Cb -0.12 -4.84 0.00 0.00 0.01 0.00 0.00 42.46 37.51 3m6x s ILE 85 CO 0.02 -1.68 -0.19 -1.58 0.00 0.00 0.00 174.94 171.51 3m6x s GLN 86 N 4.67 2.23 0.29 2.79 0.74 -0.91 -4.97 119.66 124.51 3m6x s GLN 86 Ca 0.32 -0.67 -0.29 0.00 0.05 0.00 0.00 55.36 54.76 3m6x s GLN 86 Cb -0.10 -1.81 -0.13 0.00 1.10 0.00 0.00 33.01 32.08 3m6x s GLN 86 CO 0.07 0.17 1.33 -1.91 -0.55 0.00 0.00 175.29 174.40 3m6x n GLU 87 N 3.44 2.04 -0.17 1.67 0.00 -1.26 -3.88 120.64 122.48 3m6x n GLU 87 Ca -0.20 0.72 -0.01 0.00 0.00 0.00 0.00 57.16 57.67 3m6x n GLU 87 Cb 0.52 -2.32 0.08 0.00 0.00 0.00 0.00 31.44 29.72 3m6x n GLU 87 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 3m6x h PRO 88 N 3.30 0.25 -0.02 5.31 0.11 -1.89 -1.43 132.00 137.63 3m6x h PRO 88 Ca -0.45 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 3m6x h PRO 88 Cb 1.28 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 3m6x h PRO 88 CO 0.69 0.17 -0.33 0.66 -0.21 0.00 0.00 178.00 178.97 3m6x h SER 89 N 0.26 0.04 0.53 -2.05 4.64 -1.90 -2.00 113.55 113.07 3m6x h SER 89 Ca 0.27 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.55 3m6x h SER 89 Cb 0.37 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.44 3m6x h SER 89 CO -0.34 0.37 -0.11 0.00 -0.87 0.00 0.00 176.83 175.88 3m6x h ALA 90 N 1.63 1.16 0.00 5.18 0.00 -1.60 -2.47 119.26 123.17 3m6x h ALA 90 Ca 0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 3m6x h ALA 90 Cb 0.60 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 3m6x h ALA 90 CO 0.04 0.14 -0.01 1.96 0.00 0.00 0.00 179.25 181.38 3m6x h GLN 91 N 0.00 0.00 0.00 0.00 4.20 -1.11 -2.38 115.11 115.82 3m6x h GLN 91 Ca -0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 3m6x h GLN 91 Cb 0.40 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.18 3m6x h GLN 91 CO 0.01 0.01 -0.15 0.00 -0.67 0.00 0.00 178.83 178.03 3m6x h ALA 92 N 1.99 1.33 0.25 3.87 0.00 -1.57 -3.30 119.26 121.83 3m6x h ALA 92 Ca -0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3m6x h ALA 92 Cb 0.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3m6x h ALA 92 CO 0.00 0.18 -0.12 0.28 0.00 0.00 0.00 179.25 179.59 3m6x h VAL 93 N 0.00 0.81 -0.88 0.00 2.07 -1.63 -0.79 116.25 115.84 3m6x h VAL 93 Ca -0.00 -0.45 0.03 0.00 0.82 0.00 0.00 66.70 67.10 3m6x h VAL 93 Cb 0.37 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 3m6x h VAL 93 CO 0.02 0.10 0.58 1.23 0.02 0.00 0.00 177.57 179.51 3m6x h GLY 94 N -0.57 1.25 1.00 2.17 0.00 -1.76 -1.47 103.07 103.69 3m6x h GLY 94 Ca -0.03 -0.43 -0.04 0.00 0.00 0.00 0.00 47.33 46.83 3m6x h GLY 94 CO 0.06 0.38 0.24 -2.08 0.00 0.00 0.00 176.54 175.13 3m6x h VAL 95 N 1.10 1.23 -0.38 4.60 2.07 -1.59 -1.78 116.25 121.50 3m6x h VAL 95 Ca 0.35 -0.74 -0.07 0.00 0.82 0.00 0.00 66.70 67.06 3m6x h VAL 95 Cb 0.02 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 3m6x h VAL 95 CO -0.10 0.29 -0.03 0.25 0.02 0.00 0.00 177.57 177.99 3m6x h LEU 96 N 0.85 0.68 -0.92 2.57 5.85 -0.61 -2.89 115.31 120.85 3m6x h LEU 96 Ca 0.20 -0.33 -0.04 0.00 0.84 0.00 0.00 57.88 58.56 3m6x h LEU 96 Cb 0.22 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 3m6x h LEU 96 CO -0.01 0.85 0.32 0.25 -0.34 0.00 0.00 178.44 179.50 3m6x h LEU 97 N 0.51 1.01 -1.70 2.25 5.85 -1.23 -3.47 115.31 118.53 3m6x h LEU 97 Ca 0.10 -0.14 -0.39 0.00 0.84 0.00 0.00 57.88 58.30 3m6x h LEU 97 Cb 0.52 -0.26 0.10 0.00 0.37 0.00 0.00 40.66 41.38 3m6x h LEU 97 CO 0.03 0.88 -0.80 -0.67 -0.34 0.00 0.00 178.44 177.54 3m6x n ASP 98 N -4.30 -1.65 -4.76 1.25 2.03 -0.68 -4.94 116.55 103.50 3m6x n ASP 98 Ca 0.07 -0.74 -0.37 0.00 0.52 0.00 0.00 54.79 54.27 3m6x n ASP 98 Cb 0.17 -4.46 0.01 0.00 -0.72 0.00 0.00 41.12 36.12 3m6x n ASP 98 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3m6x s PRO 99 N -5.78 3.35 0.14 -0.67 0.04 -1.26 -5.03 135.00 125.80 3m6x s PRO 99 Ca 0.03 1.83 0.09 0.00 0.04 0.00 0.00 61.00 62.99 3m6x s PRO 99 Cb -0.01 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 3m6x s PRO 99 CO 0.78 -0.90 -0.18 0.15 0.04 0.00 0.00 177.00 176.89 3m6x s LYS 100 N -3.03 1.76 0.16 4.56 -0.14 -1.26 -4.83 119.74 116.97 3m6x s LYS 100 Ca 0.71 -1.25 -0.34 0.00 -1.36 0.00 0.00 55.97 53.74 3m6x s LYS 100 Cb -0.30 -2.07 -0.15 0.00 -1.68 0.00 0.00 37.83 33.63 3m6x s LYS 100 CO 0.35 0.46 1.33 -2.30 -0.76 0.00 0.00 175.35 174.43 3m6x n PRO 101 N 0.63 1.52 0.00 -1.68 -0.02 -1.26 -2.16 135.00 132.03 3m6x n PRO 101 Ca -0.15 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 3m6x n PRO 101 Cb 0.53 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 3m6x n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m6x n GLY 102 N 2.40 1.01 3.90 -1.23 0.00 -0.61 -4.91 105.19 105.75 3m6x n GLY 102 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 3m6x n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m6x s GLU 103 N -0.67 2.20 -0.25 1.61 2.02 -0.92 -4.65 118.70 118.05 3m6x s GLU 103 Ca 0.00 0.20 -0.08 0.00 0.02 0.00 0.00 54.97 55.11 3m6x s GLU 103 Cb 0.00 -1.97 -0.03 0.00 0.10 0.00 0.00 34.13 32.23 3m6x s GLU 103 CO 0.00 -1.44 0.08 1.03 0.02 0.00 0.00 175.26 174.95 3m6x s ARG 104 N -5.52 3.70 -0.01 1.61 0.52 -1.26 -1.08 118.95 116.91 3m6x s ARG 104 Ca 0.61 -0.45 0.04 0.00 -0.52 0.00 0.00 55.73 55.41 3m6x s ARG 104 Cb -0.11 -3.36 -0.01 0.00 0.52 0.00 0.00 34.95 31.99 3m6x s ARG 104 CO 0.50 -0.17 -0.13 0.08 0.02 0.00 0.00 175.30 175.60 3m6x s VAL 105 N 1.58 1.03 -0.12 3.52 1.01 0.55 -0.67 120.40 127.30 3m6x s VAL 105 Ca 0.06 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.51 3m6x s VAL 105 Cb -0.15 -0.86 0.01 0.00 0.00 0.00 0.00 36.38 35.38 3m6x s VAL 105 CO 0.04 0.29 -0.17 -0.22 0.00 0.00 0.00 175.10 175.04 3m6x s LEU 106 N -0.27 1.85 -0.43 3.92 2.96 -0.40 -1.25 118.68 125.06 3m6x s LEU 106 Ca 0.04 -0.49 -0.12 0.00 -0.22 0.00 0.00 54.13 53.35 3m6x s LEU 106 Cb -0.05 -1.21 0.07 0.00 0.50 0.00 0.00 46.19 45.50 3m6x s LEU 106 CO -0.00 0.04 0.30 -0.62 -1.32 0.00 0.00 176.35 174.75 3m6x s ASP 107 N 0.93 5.84 0.23 3.68 -1.08 -0.01 -0.63 116.67 125.64 3m6x s ASP 107 Ca -0.07 -1.37 0.11 0.00 -0.52 0.00 0.00 52.55 50.70 3m6x s ASP 107 Cb -0.15 -2.07 0.18 0.00 -1.46 0.00 0.00 42.92 39.42 3m6x s ASP 107 CO -0.02 -0.56 1.50 0.25 0.52 0.00 0.00 175.17 176.86 3m6x h LEU 108 N 8.54 0.00 -6.60 -1.34 5.85 -1.52 0.14 115.31 120.38 3m6x h LEU 108 Ca -0.25 0.00 -0.60 0.00 0.84 0.00 0.00 57.88 57.87 3m6x h LEU 108 Cb 1.10 0.00 -0.39 0.00 0.37 0.00 0.00 40.66 41.73 3m6x h LEU 108 CO 0.79 0.71 -0.86 0.00 -0.34 0.00 0.00 178.44 178.75 3m6x s ALA 109 N -3.25 1.94 -0.04 1.25 0.00 -1.21 -4.44 121.76 116.00 3m6x s ALA 109 Ca 0.00 -2.71 0.13 0.00 0.00 0.00 0.00 51.96 49.38 3m6x s ALA 109 Cb 0.11 -1.74 -0.19 0.00 0.00 0.00 0.00 23.12 21.30 3m6x s ALA 109 CO 0.77 -2.02 0.84 0.00 0.00 0.00 0.00 175.76 175.35 3m6x h ALA 110 N 5.82 0.68 -2.89 0.00 0.00 -0.72 -3.43 119.26 118.71 3m6x h ALA 110 Ca 0.20 -1.17 -0.53 0.00 0.00 0.00 0.00 54.91 53.40 3m6x h ALA 110 Cb 0.88 0.31 0.10 0.00 0.00 0.00 0.00 17.79 19.08 3m6x h ALA 110 CO 0.45 1.32 0.60 0.00 0.00 0.00 0.00 179.25 181.62 3m6x s ALA 111 N -2.72 3.12 -1.90 0.00 0.00 -1.26 -0.70 121.76 118.29 3m6x s ALA 111 Ca -0.03 1.24 0.28 0.00 0.00 0.00 0.00 51.96 53.45 3m6x s ALA 111 Cb 0.08 -3.50 1.07 0.00 0.00 0.00 0.00 23.12 20.77 3m6x s ALA 111 CO 0.82 -0.97 1.76 -0.35 0.00 0.00 0.00 175.76 177.01 3m6x n PRO 112 N -0.27 0.98 0.00 0.00 -0.04 -1.26 -4.91 135.00 129.50 3m6x n PRO 112 Ca 0.06 -0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.05 3m6x n PRO 112 Cb 0.44 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 3m6x n PRO 112 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3m6x n GLY 113 N 1.26 1.44 0.12 0.55 0.00 0.12 -3.94 105.19 104.74 3m6x n GLY 113 Ca 0.15 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 3m6x n GLY 113 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3m6x h GLY 114 N 0.00 0.30 1.30 -0.02 0.00 -1.91 -0.49 103.07 102.25 3m6x h GLY 114 Ca 0.00 -0.09 -0.20 0.00 0.00 0.00 0.00 47.33 47.04 3m6x h GLY 114 CO 0.00 0.08 -0.70 0.50 0.00 0.00 0.00 176.54 176.42 3m6x h LYS 115 N 0.25 0.70 -0.21 4.80 1.79 -1.94 -2.77 116.57 119.19 3m6x h LYS 115 Ca 0.09 -0.53 0.03 0.00 -2.18 0.00 0.00 60.65 58.06 3m6x h LYS 115 Cb 0.01 0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.73 3m6x h LYS 115 CO -0.06 1.15 0.04 1.15 -1.08 0.00 0.00 179.45 180.65 3m6x h THR 116 N 0.50 0.90 -0.16 -0.16 2.02 -1.78 -0.26 112.91 113.98 3m6x h THR 116 Ca -0.03 -0.04 -0.09 0.00 0.77 0.00 0.00 66.41 67.02 3m6x h THR 116 Cb 1.30 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 68.47 3m6x h THR 116 CO 0.14 0.02 -0.30 0.71 0.37 0.00 0.00 175.52 176.46 3m6x h THR 117 N 0.12 1.27 -0.15 3.16 1.35 -1.15 -1.04 112.91 116.47 3m6x h THR 117 Ca 0.10 -1.27 -0.00 0.00 -0.55 0.00 0.00 66.41 64.68 3m6x h THR 117 Cb 0.09 1.48 -0.01 0.00 -1.73 0.00 0.00 68.15 67.98 3m6x h THR 117 CO -0.13 0.39 0.08 -0.74 -0.25 0.00 0.00 175.52 174.87 3m6x h HIS 118 N 0.27 0.21 -0.50 4.73 6.17 -1.10 -1.16 115.15 123.76 3m6x h HIS 118 Ca 0.04 -0.01 0.02 0.00 0.71 0.00 0.00 60.37 61.13 3m6x h HIS 118 Cb 0.67 -0.07 -0.03 0.00 2.52 0.00 0.00 27.41 30.50 3m6x h HIS 118 CO 0.01 0.21 0.31 -0.07 0.71 0.00 0.00 177.93 179.10 3m6x h LEU 119 N 0.14 0.51 -0.73 0.26 4.07 -0.73 -1.82 115.31 117.01 3m6x h LEU 119 Ca 0.05 -0.00 0.02 0.00 0.08 0.00 0.00 57.88 58.03 3m6x h LEU 119 Cb 0.08 -0.11 -0.04 0.00 1.08 0.00 0.00 40.66 41.66 3m6x h LEU 119 CO -0.01 0.36 0.47 0.00 -1.08 0.00 0.00 178.44 178.18 3m6x h ALA 120 N 1.21 0.95 -0.48 1.53 0.00 -0.94 -2.56 119.26 118.97 3m6x h ALA 120 Ca 0.19 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 3m6x h ALA 120 Cb -0.01 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3m6x h ALA 120 CO -0.07 0.28 0.07 0.00 0.00 0.00 0.00 179.25 179.52 3m6x h ALA 121 N 1.30 0.63 0.00 0.00 0.00 -0.94 -1.55 119.26 118.71 3m6x h ALA 121 Ca 0.29 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3m6x h ALA 121 Cb -0.02 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.59 3m6x h ALA 121 CO -0.09 0.37 0.00 0.54 0.00 0.00 0.00 179.25 180.07 3m6x n ARG 122 N -4.43 0.38 -0.36 0.00 1.74 -0.71 -4.53 116.66 108.75 3m6x n ARG 122 Ca 0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.09 3m6x n ARG 122 Cb 0.26 -1.31 0.00 0.00 -1.02 0.00 0.00 32.46 30.39 3m6x n ARG 122 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3m6x n GLY 124 N 1.57 0.88 2.46 -0.13 0.00 -1.05 -4.25 105.19 104.67 3m6x n GLY 124 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 3m6x n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m6x n GLY 125 N 0.00 0.59 3.76 -0.02 0.00 -0.61 -4.93 105.19 103.98 3m6x n GLY 125 Ca 0.00 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 3m6x n GLY 125 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m6x s LYS 126 N -1.74 3.13 0.00 1.61 1.02 -1.26 -4.61 119.74 117.89 3m6x s LYS 126 Ca 0.00 -0.34 0.00 0.00 0.02 0.00 0.00 55.97 55.65 3m6x s LYS 126 Cb 0.00 -2.92 0.00 0.00 -0.52 0.00 0.00 37.83 34.39 3m6x s LYS 126 CO 0.00 0.72 0.00 0.41 -0.92 0.00 0.00 175.35 175.56 3m6x n GLY 127 N 1.93 -1.62 3.33 -3.33 0.00 -1.26 -1.57 105.19 102.68 3m6x n GLY 127 Ca -0.18 -1.98 -0.34 0.00 0.00 0.00 0.00 46.02 43.51 3m6x n GLY 127 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3m6x s LEU 128 N 0.00 2.86 -0.18 0.99 2.96 -0.24 -4.41 118.68 120.66 3m6x s LEU 128 Ca 0.00 -0.36 0.01 0.00 -0.22 0.00 0.00 54.13 53.56 3m6x s LEU 128 Cb 0.00 -1.71 0.02 0.00 0.50 0.00 0.00 46.19 45.00 3m6x s LEU 128 CO 0.00 0.04 -0.20 -0.22 -1.32 0.00 0.00 176.35 174.65 3m6x s LEU 129 N 1.14 2.16 -0.18 -0.68 2.96 -1.26 -0.33 118.68 122.49 3m6x s LEU 129 Ca 0.02 -0.67 -0.02 0.00 -0.22 0.00 0.00 54.13 53.23 3m6x s LEU 129 Cb -0.14 -1.48 -0.01 0.00 0.50 0.00 0.00 46.19 45.05 3m6x s LEU 129 CO -0.01 -0.00 -0.08 -0.22 -1.32 0.00 0.00 176.35 174.72 3m6x s LEU 130 N 1.29 2.83 -0.26 -0.68 0.20 -0.38 -1.43 118.68 120.25 3m6x s LEU 130 Ca 0.05 -0.36 -0.04 0.00 0.69 0.00 0.00 54.13 54.47 3m6x s LEU 130 Cb -0.13 -1.69 0.01 0.00 -0.43 0.00 0.00 46.19 43.95 3m6x s LEU 130 CO -0.13 0.05 -0.00 0.00 -0.29 0.00 0.00 176.35 175.99 3m6x s ALA 131 N 1.02 2.87 -0.10 5.97 0.00 0.77 -0.83 121.76 131.47 3m6x s ALA 131 Ca -0.00 -1.40 -0.02 0.00 0.00 0.00 0.00 51.96 50.54 3m6x s ALA 131 Cb -0.15 -1.88 -0.03 0.00 0.00 0.00 0.00 23.12 21.07 3m6x s ALA 131 CO -0.01 -0.78 -0.01 1.21 0.00 0.00 0.00 175.76 176.18 3m6x s ASN 132 N 1.43 5.14 -0.16 0.00 2.47 0.48 -1.42 114.94 122.88 3m6x s ASN 132 Ca 0.02 0.08 -0.05 0.00 0.42 0.00 0.00 52.86 53.34 3m6x s ASN 132 Cb -0.16 -1.53 0.06 0.00 -1.45 0.00 0.00 41.25 38.17 3m6x s ASN 132 CO -0.01 0.33 0.09 -0.70 -3.72 0.00 0.00 177.10 173.08 3m6x s GLU 133 N -0.60 0.05 0.39 0.43 2.56 -0.44 -0.18 118.70 120.91 3m6x s GLU 133 Ca 0.10 -0.03 0.21 0.00 0.00 0.00 0.00 54.97 55.24 3m6x s GLU 133 Cb -0.12 -1.68 0.72 0.00 2.00 0.00 0.00 34.13 35.05 3m6x s GLU 133 CO 0.02 -0.63 1.75 -0.24 -0.56 0.00 0.00 175.26 175.60 3m6x h VAL 134 N 6.42 0.73 -3.18 3.70 3.04 -1.84 -3.37 116.25 121.76 3m6x h VAL 134 Ca -0.15 -1.41 -0.65 0.00 -1.01 0.00 0.00 66.70 63.49 3m6x h VAL 134 Cb 1.15 1.90 -0.15 0.00 -2.01 0.00 0.00 31.29 32.18 3m6x h VAL 134 CO 0.27 0.31 0.32 -0.62 -1.01 0.00 0.00 177.57 176.84 3m6x s ASP 135 N -6.34 6.27 0.50 3.17 -1.08 -1.26 -4.73 116.67 113.21 3m6x s ASP 135 Ca 0.01 -0.68 0.25 0.00 -0.52 0.00 0.00 52.55 51.62 3m6x s ASP 135 Cb 0.10 -2.37 1.33 0.00 -1.46 0.00 0.00 42.92 40.53 3m6x s ASP 135 CO 0.67 -1.09 1.91 1.23 0.52 0.00 0.00 175.17 178.41 3m6x h GLY 136 N 10.39 0.28 2.00 2.66 0.00 -1.98 -0.03 103.07 116.39 3m6x h GLY 136 Ca -0.27 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.00 3m6x h GLY 136 CO 1.04 0.00 0.00 0.50 0.00 0.00 0.00 176.54 178.08 3m6x h LYS 137 N 0.13 0.00 -0.01 4.80 1.57 -1.97 -2.76 116.57 118.33 3m6x h LYS 137 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 3m6x h LYS 137 Cb 1.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.66 3m6x h LYS 137 CO -0.06 0.00 -0.44 0.54 -0.57 0.00 0.00 179.45 178.92 3m6x n ARG 138 N -3.08 1.40 -0.20 3.15 1.74 -0.03 -4.52 116.66 115.13 3m6x n ARG 138 Ca -0.00 -0.86 -0.10 0.00 -0.77 0.00 0.00 57.85 56.12 3m6x n ARG 138 Cb 0.24 -1.38 0.03 0.00 -1.02 0.00 0.00 32.46 30.32 3m6x n ARG 138 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3m6x h VAL 139 N 2.01 1.27 -0.30 1.55 2.07 -1.43 -3.04 116.25 118.39 3m6x h VAL 139 Ca 0.00 -1.22 0.05 0.00 0.82 0.00 0.00 66.70 66.35 3m6x h VAL 139 Cb 0.65 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 3m6x h VAL 139 CO 0.00 0.44 0.01 -0.09 0.02 0.00 0.00 177.57 177.95 3m6x h ARG 140 N 0.94 0.10 -0.90 1.57 2.43 -1.79 0.25 114.38 116.98 3m6x h ARG 140 Ca 0.16 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 3m6x h ARG 140 Cb 0.62 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.11 3m6x h ARG 140 CO 0.04 0.07 0.56 0.78 -1.51 0.00 0.00 179.97 179.91 3m6x h GLY 141 N 0.11 1.30 0.95 2.80 0.00 -1.86 -1.14 103.07 105.23 3m6x h GLY 141 Ca 0.14 -0.53 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 3m6x h GLY 141 CO -0.23 0.51 0.13 -2.00 0.00 0.00 0.00 176.54 174.96 3m6x h LEU 142 N 1.23 0.30 -1.06 3.11 5.85 -1.31 -2.71 115.31 120.72 3m6x h LEU 142 Ca 0.32 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.97 3m6x h LEU 142 Cb -0.07 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 40.83 3m6x h LEU 142 CO -0.06 0.30 0.64 -0.07 -0.34 0.00 0.00 178.44 178.90 3m6x h LEU 143 N 0.27 1.10 -1.17 2.25 3.38 -0.50 -0.52 115.31 120.13 3m6x h LEU 143 Ca 0.08 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 3m6x h LEU 143 Cb 0.07 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 3m6x h LEU 143 CO -0.01 0.79 0.20 -0.33 0.09 0.00 0.00 178.44 179.18 3m6x h GLU 144 N 1.30 0.79 -0.16 1.13 5.08 -1.07 0.11 114.58 121.76 3m6x h GLU 144 Ca 0.36 -0.12 -0.15 0.00 -1.00 0.00 0.00 59.36 58.44 3m6x h GLU 144 Cb -0.14 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 28.98 3m6x h GLU 144 CO -0.08 0.66 -0.48 -0.91 -1.00 0.00 0.00 179.01 177.19 3m6x h ASN 145 N 0.77 0.70 -0.91 1.42 2.35 -1.09 -3.00 115.58 115.82 3m6x h ASN 145 Ca 0.18 -0.60 0.05 0.00 -0.55 0.00 0.00 56.30 55.39 3m6x h ASN 145 Cb 0.17 -0.20 -0.06 0.00 0.05 0.00 0.00 38.32 38.28 3m6x h ASN 145 CO -0.02 1.17 0.58 0.58 -1.65 0.00 0.00 177.43 178.09 3m6x h VAL 146 N 0.26 1.09 -0.82 2.81 2.07 -0.82 -2.44 116.25 118.41 3m6x h VAL 146 Ca -0.02 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 3m6x h VAL 146 Cb 1.10 -0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.75 3m6x h VAL 146 CO 0.10 0.20 0.50 -0.08 0.02 0.00 0.00 177.57 178.31 3m6x h GLU 147 N 1.08 1.11 0.00 1.57 4.81 -0.97 -2.76 114.58 119.42 3m6x h GLU 147 Ca 0.38 -0.10 -0.09 0.00 -0.13 0.00 0.00 59.36 59.43 3m6x h GLU 147 Cb 0.11 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 3m6x h GLU 147 CO -0.15 0.78 -0.43 0.00 -0.73 0.00 0.00 179.01 178.48 3m6x h ARG 148 N 1.13 0.00 0.02 1.92 3.08 -1.30 -3.36 114.38 115.87 3m6x h ARG 148 Ca 0.30 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.13 3m6x h ARG 148 Cb -0.05 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 3m6x h ARG 148 CO -0.06 0.43 -1.02 2.35 -1.07 0.00 0.00 179.97 180.60 3m6x h TRP 149 N 0.00 0.10 0.00 3.04 2.91 -1.14 -3.34 115.95 117.52 3m6x h TRP 149 Ca -0.00 -0.07 0.00 0.00 1.13 0.00 0.00 58.89 59.95 3m6x h TRP 149 Cb 0.82 -0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.47 3m6x h TRP 149 CO 0.00 1.03 0.00 0.41 -1.03 0.00 0.00 178.44 178.85 3m6x n GLY 150 N 1.32 0.70 3.40 2.65 0.00 -1.24 -4.93 105.19 107.09 3m6x n GLY 150 Ca -0.02 -0.37 -0.32 0.00 0.00 0.00 0.00 46.02 45.31 3m6x n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m6x s ALA 151 N -2.00 2.52 0.16 4.61 0.00 -1.26 -3.71 121.76 122.08 3m6x s ALA 151 Ca 0.00 -0.98 -0.30 0.00 0.00 0.00 0.00 51.96 50.68 3m6x s ALA 151 Cb 0.00 -0.94 -0.08 0.00 0.00 0.00 0.00 23.12 22.10 3m6x s ALA 151 CO 0.00 0.45 1.31 -1.25 0.00 0.00 0.00 175.76 176.27 3m6x s PRO 152 N -0.35 4.38 0.18 0.00 0.04 -1.26 -4.88 135.00 133.11 3m6x s PRO 152 Ca 0.03 2.02 -0.24 0.00 0.04 0.00 0.00 61.00 62.85 3m6x s PRO 152 Cb -0.12 -3.23 0.05 0.00 0.04 0.00 0.00 34.50 31.24 3m6x s PRO 152 CO 0.02 -0.28 0.79 -0.48 0.04 0.00 0.00 177.00 177.09 3m6x s LEU 153 N 0.29 -0.31 -0.07 -3.56 0.05 -1.26 -4.68 118.68 109.13 3m6x s LEU 153 Ca 0.58 -0.34 0.00 0.00 0.05 0.00 0.00 54.13 54.43 3m6x s LEU 153 Cb -0.36 2.43 -0.03 0.00 -2.05 0.00 0.00 46.19 46.19 3m6x s LEU 153 CO 0.35 -1.03 -0.05 0.00 -0.55 0.00 0.00 176.35 175.07 3m6x s ALA 154 N -3.58 3.05 -0.18 1.48 0.00 -0.52 -3.77 121.76 118.25 3m6x s ALA 154 Ca 0.08 -0.88 -0.01 0.00 0.00 0.00 0.00 51.96 51.15 3m6x s ALA 154 Cb -0.03 -1.28 -0.00 0.00 0.00 0.00 0.00 23.12 21.81 3m6x s ALA 154 CO -0.01 0.58 -0.12 0.08 0.00 0.00 0.00 175.76 176.29 3m6x s VAL 155 N -0.84 2.85 0.31 0.00 1.01 0.11 -0.16 120.40 123.68 3m6x s VAL 155 Ca 0.13 -0.69 0.09 0.00 0.00 0.00 0.00 61.98 61.51 3m6x s VAL 155 Cb -0.11 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 33.98 3m6x s VAL 155 CO 0.02 0.49 0.02 0.42 0.00 0.00 0.00 175.10 176.05 3m6x s THR 156 N 1.08 2.96 -0.46 3.92 -4.23 -0.51 -2.52 115.64 115.89 3m6x s THR 156 Ca 0.00 -1.92 0.04 0.00 -1.18 0.00 0.00 61.69 58.63 3m6x s THR 156 Cb -0.15 -2.82 0.16 0.00 1.34 0.00 0.00 72.50 71.04 3m6x s THR 156 CO -0.03 -0.26 0.35 -1.58 -0.54 0.00 0.00 174.62 172.55 3m6x s GLN 157 N -3.72 1.20 0.06 3.99 0.74 0.27 -1.33 119.66 120.86 3m6x s GLN 157 Ca 0.34 -2.26 -0.11 0.00 0.05 0.00 0.00 55.36 53.39 3m6x s GLN 157 Cb -0.03 -1.88 0.01 0.00 1.10 0.00 0.00 33.01 32.21 3m6x s GLN 157 CO 0.20 -1.33 0.24 0.00 -0.55 0.00 0.00 175.29 173.85 3m6x s ALA 158 N -0.10 -0.45 0.36 1.58 0.00 -1.26 -4.25 121.76 117.64 3m6x s ALA 158 Ca 0.28 -0.26 -0.28 0.00 0.00 0.00 0.00 51.96 51.70 3m6x s ALA 158 Cb -0.03 0.36 -0.11 0.00 0.00 0.00 0.00 23.12 23.34 3m6x s ALA 158 CO -0.15 -0.42 1.45 -2.14 0.00 0.00 0.00 175.76 174.50 3m6x s PRO 159 N -2.90 4.17 0.30 0.00 0.02 -1.26 -4.25 135.00 131.07 3m6x s PRO 159 Ca -0.02 2.49 0.06 0.00 0.02 0.00 0.00 61.00 63.54 3m6x s PRO 159 Cb 0.00 -3.00 0.77 0.00 0.02 0.00 0.00 34.50 32.30 3m6x s PRO 159 CO -0.06 -0.46 1.73 -1.35 -0.33 0.00 0.00 177.00 176.53 3m6x h PRO 160 N 3.26 0.54 -0.96 5.54 0.11 -1.99 0.37 132.00 138.86 3m6x h PRO 160 Ca -0.50 -0.03 0.13 0.00 0.11 0.00 0.00 66.00 65.71 3m6x h PRO 160 Cb 1.23 -0.12 -0.09 0.00 0.11 0.00 0.00 31.00 32.14 3m6x h PRO 160 CO 0.66 0.35 0.58 -0.09 -0.21 0.00 0.00 178.00 179.29 3m6x h ARG 161 N 0.55 0.86 -0.46 1.05 2.43 -1.92 -0.35 114.38 116.54 3m6x h ARG 161 Ca 0.58 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.61 3m6x h ARG 161 Cb 1.05 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.39 3m6x h ARG 161 CO -0.47 0.57 -0.09 0.00 -1.51 0.00 0.00 179.97 178.47 3m6x h ALA 162 N 1.54 0.98 -0.49 2.80 0.00 -1.29 -0.81 119.26 122.00 3m6x h ALA 162 Ca 0.49 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 3m6x h ALA 162 Cb 0.55 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3m6x h ALA 162 CO -0.29 0.61 -0.02 -0.07 0.00 0.00 0.00 179.25 179.48 3m6x h LEU 163 N 0.74 0.87 -0.65 0.00 3.38 -0.99 -1.44 115.31 117.22 3m6x h LEU 163 Ca 0.13 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 3m6x h LEU 163 Cb 0.58 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 3m6x h LEU 163 CO 0.04 0.97 0.38 0.00 0.09 0.00 0.00 178.44 179.92 3m6x h ALA 164 N 0.93 0.83 -0.61 1.53 0.00 -0.82 0.87 119.26 121.99 3m6x h ALA 164 Ca 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3m6x h ALA 164 Cb 0.54 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3m6x h ALA 164 CO 0.03 0.31 0.34 0.93 0.00 0.00 0.00 179.25 180.87 3m6x h GLU 165 N 0.88 0.84 0.02 0.00 4.39 -1.02 -1.01 114.58 118.69 3m6x h GLU 165 Ca 0.23 -0.09 -0.25 0.00 0.34 0.00 0.00 59.36 59.59 3m6x h GLU 165 Cb -0.01 -0.17 0.01 0.00 -0.10 0.00 0.00 28.75 28.48 3m6x h GLU 165 CO -0.04 0.63 -1.02 0.00 -1.16 0.00 0.00 179.01 177.41 3m6x h ALA 166 N 1.17 0.24 0.00 3.43 0.00 -0.85 -3.39 119.26 119.85 3m6x h ALA 166 Ca 0.22 -0.72 -0.26 0.00 0.00 0.00 0.00 54.91 54.14 3m6x h ALA 166 Cb 0.02 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 3m6x h ALA 166 CO -0.04 0.77 -1.98 1.19 0.00 0.00 0.00 179.25 179.20 3m6x n PHE 167 N -3.77 0.00 -4.78 0.00 3.72 0.26 -4.82 117.46 108.07 3m6x n PHE 167 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 3m6x n PHE 167 Cb 0.88 -0.69 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 3m6x n PHE 167 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3m6x n GLY 168 N 2.24 0.60 3.00 1.37 0.00 -0.39 -4.20 105.19 107.81 3m6x n GLY 168 Ca -0.25 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.55 3m6x n GLY 168 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3m6x n THR 169 N 0.00 3.12 -0.00 2.61 -2.24 -1.15 -4.17 114.28 112.45 3m6x n THR 169 Ca 0.00 -2.86 0.06 0.00 -2.27 0.00 0.00 64.05 58.98 3m6x n THR 169 Cb 0.00 -2.48 -0.09 0.00 -2.10 0.00 0.00 70.33 65.66 3m6x n THR 169 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3m6x n TYR 170 N 7.27 0.00 -4.11 4.78 9.36 -1.00 -1.52 117.16 131.93 3m6x n TYR 170 Ca 0.51 0.00 -0.33 0.00 3.32 0.00 0.00 57.90 61.40 3m6x n TYR 170 Cb 0.41 -0.26 -0.07 0.00 -0.63 0.00 0.00 39.34 38.78 3m6x n TYR 170 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 3m6x s PHE 171 N -2.80 3.28 0.17 2.98 0.08 -0.41 -4.78 117.98 116.49 3m6x s PHE 171 Ca -0.04 0.20 -0.01 0.00 0.12 0.00 0.00 56.93 57.20 3m6x s PHE 171 Cb 0.07 -1.74 0.05 0.00 -0.57 0.00 0.00 43.02 40.83 3m6x s PHE 171 CO 0.48 0.55 1.42 0.45 -0.10 0.00 0.00 175.22 178.02 3m6x h HIS 172 N 4.13 0.52 -3.42 0.36 3.86 -1.20 -1.03 115.15 118.38 3m6x h HIS 172 Ca -0.49 -0.24 -0.19 0.00 -1.16 0.00 0.00 60.37 58.29 3m6x h HIS 172 Cb 1.18 -0.08 -0.26 0.00 1.06 0.00 0.00 27.41 29.32 3m6x h HIS 172 CO 0.64 1.00 -0.55 1.03 0.86 0.00 0.00 177.93 180.91 3m6x s ARG 173 N -3.56 0.20 -0.04 2.45 0.52 -1.12 -1.04 118.95 116.36 3m6x s ARG 173 Ca -0.05 0.11 0.01 0.00 -0.52 0.00 0.00 55.73 55.28 3m6x s ARG 173 Cb 0.10 0.09 0.02 0.00 0.52 0.00 0.00 34.95 35.68 3m6x s ARG 173 CO 0.84 -0.03 -0.06 0.08 0.02 0.00 0.00 175.30 176.15 3m6x s VAL 174 N -0.12 0.65 -0.18 3.52 1.01 -0.18 -1.28 120.40 123.82 3m6x s VAL 174 Ca -0.02 -0.21 -0.03 0.00 0.00 0.00 0.00 61.98 61.72 3m6x s VAL 174 Cb -0.02 -0.64 -0.02 0.00 0.00 0.00 0.00 36.38 35.70 3m6x s VAL 174 CO 0.00 0.24 -0.05 -0.22 0.00 0.00 0.00 175.10 175.07 3m6x s LEU 175 N 0.73 3.05 -0.44 3.92 2.96 0.20 -1.40 118.68 127.70 3m6x s LEU 175 Ca -0.11 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 53.56 3m6x s LEU 175 Cb -0.14 -1.74 0.12 0.00 0.50 0.00 0.00 46.19 44.93 3m6x s LEU 175 CO 0.01 0.10 0.20 -0.22 -1.32 0.00 0.00 176.35 175.11 3m6x s LEU 176 N 0.79 4.89 -0.67 -0.68 2.96 0.33 -1.52 118.68 124.78 3m6x s LEU 176 Ca -0.02 -2.41 -0.21 0.00 -0.22 0.00 0.00 54.13 51.27 3m6x s LEU 176 Cb -0.15 -1.72 0.08 0.00 0.50 0.00 0.00 46.19 44.90 3m6x s LEU 176 CO 0.02 -0.39 0.93 -0.62 -1.32 0.00 0.00 176.35 174.96 3m6x s ASP 177 N 0.89 6.22 0.37 3.68 2.15 -1.26 -1.68 116.67 127.04 3m6x s ASP 177 Ca 0.12 -1.20 -0.17 0.00 0.43 0.00 0.00 52.55 51.73 3m6x s ASP 177 Cb -0.22 -2.39 -0.09 0.00 -0.30 0.00 0.00 42.92 39.92 3m6x s ASP 177 CO -0.05 -1.33 0.82 0.00 -0.17 0.00 0.00 175.17 174.44 3m6x s ALA 178 N 3.61 3.22 0.30 3.66 0.00 -0.56 -4.69 121.76 127.29 3m6x s ALA 178 Ca 0.21 0.15 -0.30 0.00 0.00 0.00 0.00 51.96 52.02 3m6x s ALA 178 Cb -0.17 -2.90 -0.11 0.00 0.00 0.00 0.00 23.12 19.93 3m6x s ALA 178 CO 0.07 0.22 1.58 -1.25 0.00 0.00 0.00 175.76 176.38 3m6x s PRO 179 N -3.15 4.12 0.29 0.00 0.04 -1.26 -4.80 135.00 130.24 3m6x s PRO 179 Ca 0.57 2.57 -0.01 0.00 0.04 0.00 0.00 61.00 64.17 3m6x s PRO 179 Cb -0.10 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.43 3m6x s PRO 179 CO 0.17 -0.62 0.39 0.00 0.04 0.00 0.00 177.00 176.98 3m6x n SER 181 N -1.73 0.11 -2.98 0.00 3.41 -1.26 -4.91 113.62 106.26 3m6x n SER 181 Ca 0.01 0.52 -0.22 0.00 -0.26 0.00 0.00 58.87 58.93 3m6x n SER 181 Cb 0.49 -0.55 0.04 0.00 -0.26 0.00 0.00 64.21 63.93 3m6x n SER 181 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3m6x n GLY 182 N 0.46 -0.47 0.28 5.00 0.00 -1.26 -4.87 105.19 104.33 3m6x n GLY 182 Ca 0.04 0.11 0.15 0.00 0.00 0.00 0.00 46.02 46.33 3m6x n GLY 182 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3m6x h GLU 183 N -1.55 0.00 -2.26 1.61 5.08 -1.90 -3.34 114.58 112.21 3m6x h GLU 183 Ca -0.51 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 57.77 3m6x h GLU 183 Cb 1.35 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.57 3m6x h GLU 183 CO 0.54 0.07 -0.02 0.41 -1.00 0.00 0.00 179.01 179.01 3m6x n GLY 184 N -0.75 2.03 4.64 -3.84 0.00 0.68 -4.63 105.19 103.32 3m6x n GLY 184 Ca -0.02 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.53 3m6x n GLY 184 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3m6x n PHE 186 N 2.36 0.00 -0.02 1.61 3.72 -1.26 -4.64 117.46 119.23 3m6x n PHE 186 Ca 0.17 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.50 3m6x n PHE 186 Cb 0.46 0.00 0.12 0.00 -0.94 0.00 0.00 39.48 39.13 3m6x n PHE 186 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 3m6x h ARG 187 N 0.00 0.59 0.00 -1.08 2.43 -1.88 -3.24 114.38 111.19 3m6x h ARG 187 Ca 0.00 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 58.90 3m6x h ARG 187 Cb 0.00 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 3m6x h ARG 187 CO 0.00 0.85 -1.21 1.63 -1.51 0.00 0.00 179.97 179.72 3m6x n LYS 188 N -4.06 0.38 -3.77 0.20 5.02 -1.26 -4.80 118.16 109.86 3m6x n LYS 188 Ca -0.01 -0.02 -0.30 0.00 -2.02 0.00 0.00 58.31 55.96 3m6x n LYS 188 Cb 0.48 -1.60 -0.15 0.00 -0.02 0.00 0.00 35.03 33.73 3m6x n LYS 188 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3m6x s ASP 189 N -4.17 3.87 0.00 4.39 2.15 -1.22 -4.99 116.67 116.70 3m6x s ASP 189 Ca 0.01 -1.48 0.13 0.00 0.43 0.00 0.00 52.55 51.64 3m6x s ASP 189 Cb 0.14 -0.90 0.64 0.00 -0.30 0.00 0.00 42.92 42.49 3m6x s ASP 189 CO 0.83 -0.37 1.36 -2.11 -0.17 0.00 0.00 175.17 174.70 3m6x n ARG 190 N 4.83 0.14 0.00 4.34 1.85 -1.26 -1.56 116.66 125.00 3m6x n ARG 190 Ca -0.04 0.19 0.11 0.00 -1.00 0.00 0.00 57.85 57.11 3m6x n ARG 190 Cb 0.43 -1.50 -0.06 0.00 -1.05 0.00 0.00 32.46 30.28 3m6x n ARG 190 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 3m6x n GLU 191 N -1.34 0.47 0.14 2.89 -0.58 -1.26 -4.43 120.64 116.53 3m6x n GLU 191 Ca 0.05 -0.38 0.00 0.00 -0.42 0.00 0.00 57.16 56.42 3m6x n GLU 191 Cb 0.12 -1.49 0.18 0.00 -0.57 0.00 0.00 31.44 29.68 3m6x n GLU 191 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3m6x h ALA 192 N 3.34 0.91 -0.07 0.62 0.00 -1.64 -3.13 119.26 119.31 3m6x h ALA 192 Ca 0.00 -0.53 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 3m6x h ALA 192 Cb 0.60 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3m6x h ALA 192 CO 0.00 0.72 -0.36 0.00 0.00 0.00 0.00 179.25 179.62 3m6x h ALA 193 N 1.42 1.28 -0.99 0.00 0.00 -1.77 -3.10 119.26 116.10 3m6x h ALA 193 Ca -0.01 -0.35 0.17 0.00 0.00 0.00 0.00 54.91 54.72 3m6x h ALA 193 Cb 1.11 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.73 3m6x h ALA 193 CO 0.08 0.51 0.62 0.00 0.00 0.00 0.00 179.25 180.45 3m6x h ARG 194 N 0.12 0.79 0.00 0.00 3.08 -1.83 -2.36 114.38 114.17 3m6x h ARG 194 Ca 0.01 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3m6x h ARG 194 Cb 0.69 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.56 3m6x h ARG 194 CO 0.05 0.52 -0.57 0.72 -1.07 0.00 0.00 179.97 179.62 3m6x n HIS 195 N -4.70 0.55 -2.56 3.04 8.25 -1.17 -4.88 115.22 113.76 3m6x n HIS 195 Ca 0.22 0.16 -0.35 0.00 -0.26 0.00 0.00 57.72 57.49 3m6x n HIS 195 Cb 0.51 -0.66 -0.04 0.00 1.12 0.00 0.00 29.99 30.93 3m6x n HIS 195 CO 0.00 0.00 0.00 -0.46 0.64 0.00 0.00 176.34 176.52 3m6x s TRP 196 N -3.15 3.10 0.12 4.41 -0.00 -0.89 -5.05 118.94 117.47 3m6x s TRP 196 Ca 0.07 1.60 -0.14 0.00 -0.00 0.00 0.00 56.10 57.63 3m6x s TRP 196 Cb 0.14 -3.07 0.02 0.00 -0.00 0.00 0.00 33.47 30.56 3m6x s TRP 196 CO 0.71 -0.72 0.34 0.20 -0.00 0.00 0.00 176.95 177.47 3m6x s GLY 197 N -1.87 -0.14 0.60 5.86 0.00 -1.26 -5.04 107.32 105.47 3m6x s GLY 197 Ca 0.64 -0.25 0.35 0.00 0.00 0.00 0.00 44.72 45.46 3m6x s GLY 197 CO 0.22 -0.47 2.24 -2.55 0.00 0.00 0.00 173.10 172.53 3m6x h PRO 198 N 2.48 0.00 -0.01 2.90 0.11 -1.97 0.03 132.00 135.54 3m6x h PRO 198 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3m6x h PRO 198 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3m6x h PRO 198 CO 0.49 0.03 -0.30 -1.13 -0.21 0.00 0.00 178.00 176.89 3m6x n SER 199 N -3.45 0.81 -0.06 -2.05 3.41 -1.26 -4.31 113.62 106.71 3m6x n SER 199 Ca -0.02 -0.67 -0.10 0.00 -0.26 0.00 0.00 58.87 57.82 3m6x n SER 199 Cb 0.13 0.13 -0.03 0.00 -0.26 0.00 0.00 64.21 64.18 3m6x n SER 199 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3m6x h ALA 200 N 3.49 0.29 -0.32 7.33 0.00 -1.39 -2.25 119.26 126.40 3m6x h ALA 200 Ca 0.00 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.91 3m6x h ALA 200 Cb 0.49 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 3m6x h ALA 200 CO 0.00 -0.20 0.02 -1.35 0.00 0.00 0.00 179.25 177.72 3m6x h PRO 201 N 0.27 0.12 -0.71 0.00 0.11 -1.75 -2.56 132.00 127.47 3m6x h PRO 201 Ca 0.08 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.13 3m6x h PRO 201 Cb 0.04 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.09 3m6x h PRO 201 CO -0.01 0.08 0.26 0.87 -0.21 0.00 0.00 178.00 178.98 3m6x h LYS 202 N 0.12 1.09 -0.47 1.05 1.57 -1.82 0.07 116.57 118.18 3m6x h LYS 202 Ca 0.15 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3m6x h LYS 202 Cb 0.20 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.34 3m6x h LYS 202 CO -0.24 0.91 0.00 -2.13 -0.57 0.00 0.00 179.45 177.42 3m6x n ARG 203 N -4.33 0.22 0.00 3.15 0.63 -0.86 -2.62 116.66 112.86 3m6x n ARG 203 Ca 0.06 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.99 3m6x n ARG 203 Cb 0.20 -1.15 0.00 0.00 0.45 0.00 0.00 32.46 31.95 3m6x n ARG 203 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3m6x n ALA 205 N 0.47 0.00 -0.35 5.13 0.00 0.01 -3.19 120.51 122.58 3m6x n ALA 205 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 3m6x n ALA 205 Cb 0.06 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.61 3m6x n ALA 205 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3m6x h GLU 206 N 0.00 1.29 -0.45 0.00 4.39 -1.77 0.13 114.58 118.16 3m6x h GLU 206 Ca 0.00 -0.13 -0.07 0.00 0.34 0.00 0.00 59.36 59.50 3m6x h GLU 206 Cb 0.00 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.37 3m6x h GLU 206 CO 0.00 0.91 0.01 0.28 -1.16 0.00 0.00 179.01 179.05 3m6x h VAL 207 N 1.30 1.26 -0.65 3.13 2.07 -1.85 -2.74 116.25 118.77 3m6x h VAL 207 Ca 0.34 -1.03 -0.09 0.00 0.82 0.00 0.00 66.70 66.74 3m6x h VAL 207 Cb -0.03 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 3m6x h VAL 207 CO -0.06 0.36 0.06 1.56 0.02 0.00 0.00 177.57 179.50 3m6x h GLN 208 N 0.64 1.11 -0.65 1.57 4.20 -1.78 -0.81 115.11 119.40 3m6x h GLN 208 Ca 0.13 -0.32 0.04 0.00 0.06 0.00 0.00 58.65 58.56 3m6x h GLN 208 Cb 0.48 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 28.10 3m6x h GLN 208 CO 0.02 1.04 0.39 0.87 -0.67 0.00 0.00 178.83 180.48 3m6x h LYS 209 N 1.02 0.72 -0.49 1.46 1.57 -0.92 0.54 116.57 120.46 3m6x h LYS 209 Ca 0.19 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.80 3m6x h LYS 209 Cb 0.50 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3m6x h LYS 209 CO 0.02 0.48 -0.18 0.00 -0.57 0.00 0.00 179.45 179.19 3m6x h ALA 210 N 1.30 0.69 -0.43 3.86 0.00 -1.16 -1.80 119.26 121.73 3m6x h ALA 210 Ca 0.27 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 3m6x h ALA 210 Cb 0.08 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3m6x h ALA 210 CO -0.13 0.65 0.01 -0.07 0.00 0.00 0.00 179.25 179.71 3m6x h LEU 211 N 0.85 0.73 -0.80 0.00 3.38 -0.85 -2.33 115.31 116.29 3m6x h LEU 211 Ca 0.12 -0.30 -0.08 0.00 0.09 0.00 0.00 57.88 57.71 3m6x h LEU 211 Cb 0.76 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 3m6x h LEU 211 CO 0.06 0.85 0.05 0.25 0.09 0.00 0.00 178.44 179.75 3m6x h LEU 212 N 0.59 0.92 -0.61 1.67 5.85 -0.81 0.41 115.31 123.33 3m6x h LEU 212 Ca 0.12 -0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.67 3m6x h LEU 212 Cb 0.47 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 3m6x h LEU 212 CO 0.02 0.95 0.33 0.00 -0.34 0.00 0.00 178.44 179.40 3m6x h ALA 213 N 1.15 0.80 -0.44 1.25 0.00 -1.20 -1.35 119.26 119.48 3m6x h ALA 213 Ca 0.17 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 3m6x h ALA 213 Cb 0.45 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3m6x h ALA 213 CO 0.02 -0.00 -0.17 1.96 0.00 0.00 0.00 179.25 181.05 3m6x h GLN 214 N 0.62 0.90 -0.89 0.00 1.08 -0.82 -2.98 115.11 113.02 3m6x h GLN 214 Ca 0.27 -0.37 0.09 0.00 -1.45 0.00 0.00 58.65 57.19 3m6x h GLN 214 Cb 0.17 -0.03 -0.07 0.00 -0.05 0.00 0.00 27.48 27.49 3m6x h GLN 214 CO -0.17 1.02 0.53 0.00 -0.95 0.00 0.00 178.83 179.26 3m6x h ALA 215 N 0.85 1.27 0.00 3.87 0.00 -0.55 -1.61 119.26 123.09 3m6x h ALA 215 Ca 0.10 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3m6x h ALA 215 Cb 0.73 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 3m6x h ALA 215 CO 0.06 0.19 -0.03 0.66 0.00 0.00 0.00 179.25 180.13 3m6x h SER 216 N 0.90 0.00 0.71 0.00 4.64 -1.09 -1.60 113.55 117.11 3m6x h SER 216 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 3m6x h SER 216 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3m6x h SER 216 CO -0.23 0.03 0.00 0.54 -0.87 0.00 0.00 176.83 176.29 3m6x n ARG 217 N -3.87 0.18 0.00 4.77 1.74 -0.61 -3.20 116.66 115.67 3m6x n ARG 217 Ca -0.03 0.41 0.12 0.00 -0.77 0.00 0.00 57.85 57.58 3m6x n ARG 217 Cb 0.11 -1.84 0.08 0.00 -1.02 0.00 0.00 32.46 29.79 3m6x n ARG 217 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3m6x n LEU 218 N -2.18 2.36 -4.76 0.55 4.77 -0.60 -2.92 117.00 114.22 3m6x n LEU 218 Ca 0.02 -0.82 -0.37 0.00 -0.03 0.00 0.00 56.01 54.81 3m6x n LEU 218 Cb 0.23 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.24 3m6x n LEU 218 CO 0.19 0.41 -0.02 -0.76 -1.33 0.00 0.00 177.39 175.88 3m6x s LEU 219 N -2.26 4.29 0.00 2.23 1.43 -1.19 -1.29 118.68 121.88 3m6x s LEU 219 Ca 0.23 0.55 -0.07 0.00 -1.03 0.00 0.00 54.13 53.81 3m6x s LEU 219 Cb 0.19 -2.36 0.12 0.00 0.03 0.00 0.00 46.19 44.17 3m6x s LEU 219 CO 0.45 0.16 0.71 0.61 0.23 0.00 0.00 176.35 178.51 3m6x n GLY 220 N 3.05 -0.92 3.74 -3.19 0.00 -0.39 -4.62 105.19 102.87 3m6x n GLY 220 Ca -0.13 -1.76 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 3m6x n GLY 220 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3m6x s PRO 221 N -4.49 4.26 0.00 1.61 0.04 -1.25 -1.17 135.00 133.99 3m6x s PRO 221 Ca 0.42 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.76 3m6x s PRO 221 Cb -0.01 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.40 3m6x s PRO 221 CO 0.29 -0.46 0.00 0.41 0.04 0.00 0.00 177.00 177.28 3m6x n GLY 222 N 2.57 0.51 3.74 0.56 0.00 0.23 -4.98 105.19 107.83 3m6x n GLY 222 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 3m6x n GLY 222 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3m6x s GLY 223 N -2.00 2.48 -0.14 -0.02 0.00 -0.32 -4.63 107.32 102.69 3m6x s GLY 223 Ca 0.00 0.89 -0.02 0.00 0.00 0.00 0.00 44.72 45.60 3m6x s GLY 223 CO 0.00 1.29 -0.09 0.14 0.00 0.00 0.00 173.10 174.43 3m6x s VAL 224 N -1.87 3.35 -0.11 1.40 1.01 -0.20 -1.01 120.40 122.96 3m6x s VAL 224 Ca 0.75 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 62.20 3m6x s VAL 224 Cb -0.29 -2.44 -0.00 0.00 0.00 0.00 0.00 36.38 33.65 3m6x s VAL 224 CO 0.40 0.51 -0.20 -0.22 0.00 0.00 0.00 175.10 175.59 3m6x s LEU 225 N 0.42 2.31 -0.09 3.92 2.96 -0.39 -1.02 118.68 126.80 3m6x s LEU 225 Ca -0.08 -0.48 0.03 0.00 -0.22 0.00 0.00 54.13 53.39 3m6x s LEU 225 Cb -0.15 -1.48 -0.01 0.00 0.50 0.00 0.00 46.19 45.05 3m6x s LEU 225 CO 0.04 0.16 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.34 3m6x s VAL 226 N 0.35 2.48 -0.13 1.68 1.01 -0.49 0.06 120.40 125.35 3m6x s VAL 226 Ca -0.16 -0.89 -0.00 0.00 0.00 0.00 0.00 61.98 60.93 3m6x s VAL 226 Cb -0.17 -1.97 -0.01 0.00 0.00 0.00 0.00 36.38 34.23 3m6x s VAL 226 CO 0.08 0.56 -0.14 -0.47 0.00 0.00 0.00 175.10 175.13 3m6x s TYR 227 N 0.03 2.80 0.02 5.22 5.04 0.16 -0.51 117.35 130.11 3m6x s TYR 227 Ca -0.07 -0.71 0.00 0.00 -2.44 0.00 0.00 57.07 53.85 3m6x s TYR 227 Cb -0.15 -1.85 -0.02 0.00 0.35 0.00 0.00 41.96 40.29 3m6x s TYR 227 CO 0.05 -0.26 -0.04 -1.54 -1.34 0.00 0.00 175.55 172.43 3m6x s SER 228 N 0.43 0.32 0.09 4.32 1.04 -0.68 -0.78 113.70 118.44 3m6x s SER 228 Ca -0.10 -0.46 -0.01 0.00 0.48 0.00 0.00 55.95 55.86 3m6x s SER 228 Cb -0.16 0.08 -0.04 0.00 0.10 0.00 0.00 66.02 66.00 3m6x s SER 228 CO 0.05 -0.26 0.00 0.42 0.98 0.00 0.00 173.24 174.44 3m6x s THR 229 N -1.32 0.21 -0.46 2.02 -4.23 -0.89 -1.50 115.64 109.47 3m6x s THR 229 Ca -0.14 -1.86 0.04 0.00 -1.18 0.00 0.00 61.69 58.55 3m6x s THR 229 Cb -0.09 -1.76 0.44 0.00 1.34 0.00 0.00 72.50 72.43 3m6x s THR 229 CO -0.01 -0.76 1.47 0.00 -0.54 0.00 0.00 174.62 174.79 3m6x s THR 231 N -4.83 1.19 -0.07 0.00 -1.32 -1.26 -0.23 115.64 109.11 3m6x s THR 231 Ca 0.54 -2.07 0.21 0.00 -1.21 0.00 0.00 61.69 59.17 3m6x s THR 231 Cb 0.44 -2.17 -0.30 0.00 -1.51 0.00 0.00 72.50 68.96 3m6x s THR 231 CO -0.04 -0.48 0.44 0.49 -2.21 0.00 0.00 174.62 172.81 3m6x n PHE 232 N -0.36 0.07 -1.67 9.09 3.72 -1.26 -4.53 117.46 122.52 3m6x n PHE 232 Ca -0.07 0.02 -0.47 0.00 -0.05 0.00 0.00 57.45 56.88 3m6x n PHE 232 Cb 0.62 -0.63 -0.04 0.00 -0.94 0.00 0.00 39.48 38.49 3m6x n PHE 232 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3m6x n ALA 233 N -2.35 1.09 -0.15 4.37 0.00 -1.26 -4.88 120.51 117.33 3m6x n ALA 233 Ca -0.09 0.40 0.04 0.00 0.00 0.00 0.00 53.44 53.78 3m6x n ALA 233 Cb 0.69 -2.39 0.34 0.00 0.00 0.00 0.00 19.45 18.09 3m6x n ALA 233 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3m6x h PRO 234 N 6.94 0.77 -0.73 0.00 0.11 -1.94 -2.68 132.00 134.47 3m6x h PRO 234 Ca -0.46 -0.05 0.10 0.00 0.11 0.00 0.00 66.00 65.71 3m6x h PRO 234 Cb 1.26 -0.17 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 3m6x h PRO 234 CO 0.90 0.51 0.48 0.93 -0.21 0.00 0.00 178.00 180.61 3m6x h GLU 235 N 0.79 0.56 -0.00 1.05 3.07 -1.89 -0.47 114.58 117.69 3m6x h GLU 235 Ca 0.26 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 3m6x h GLU 235 Cb 0.06 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 27.85 3m6x h GLU 235 CO -0.07 0.37 -0.54 0.39 -1.40 0.00 0.00 179.01 177.76 3m6x n GLU 236 N -4.49 0.26 0.00 2.33 1.02 -1.02 -2.90 120.64 115.83 3m6x n GLU 236 Ca 0.12 -0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 3m6x n GLU 236 Cb 0.37 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 3m6x n GLU 236 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3m6x n ASN 237 N -1.22 0.00 -0.16 1.62 3.02 -0.60 -4.51 115.26 113.41 3m6x n ASN 237 Ca 0.07 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.75 3m6x n ASN 237 Cb 0.35 0.00 0.47 0.00 -0.61 0.00 0.00 39.78 39.99 3m6x n ASN 237 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3m6x h GLU 238 N 0.00 0.46 -0.39 3.52 3.07 -1.75 -1.59 114.58 117.90 3m6x h GLU 238 Ca 0.00 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.81 3m6x h GLU 238 Cb 0.00 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 27.79 3m6x h GLU 238 CO 0.00 0.31 0.17 0.78 -1.40 0.00 0.00 179.01 178.87 3m6x h GLY 239 N 0.48 0.61 0.87 -3.84 0.00 -1.07 -0.20 103.07 99.92 3m6x h GLY 239 Ca 0.35 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.31 3m6x h GLY 239 CO -0.12 0.30 -0.04 -2.08 0.00 0.00 0.00 176.54 174.61 3m6x h VAL 240 N 0.49 1.27 -0.28 4.60 2.07 -1.31 -2.48 116.25 120.61 3m6x h VAL 240 Ca 0.13 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.62 3m6x h VAL 240 Cb 0.15 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 3m6x h VAL 240 CO -0.01 0.32 0.14 0.58 0.02 0.00 0.00 177.57 178.62 3m6x h VAL 241 N 0.28 1.15 -0.74 2.57 2.07 -1.14 -0.65 116.25 119.78 3m6x h VAL 241 Ca 0.07 -0.43 -0.03 0.00 0.82 0.00 0.00 66.70 67.13 3m6x h VAL 241 Cb 0.49 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3m6x h VAL 241 CO 0.02 0.15 0.34 0.00 0.02 0.00 0.00 177.57 178.10 3m6x h ALA 242 N 0.99 0.96 -0.15 1.67 0.00 -1.06 -0.65 119.26 121.03 3m6x h ALA 242 Ca 0.10 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.85 3m6x h ALA 242 Cb 0.12 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3m6x h ALA 242 CO -0.01 0.55 0.08 1.25 0.00 0.00 0.00 179.25 181.11 3m6x h HIS 243 N 1.05 0.14 -0.51 0.00 6.17 -1.21 -2.59 115.15 118.20 3m6x h HIS 243 Ca 0.25 0.01 0.02 0.00 0.71 0.00 0.00 60.37 61.36 3m6x h HIS 243 Cb 0.15 -0.04 -0.03 0.00 2.52 0.00 0.00 27.41 30.01 3m6x h HIS 243 CO 0.01 0.08 0.32 0.35 0.71 0.00 0.00 177.93 179.40 3m6x h PHE 244 N 0.16 0.59 -0.94 5.26 3.57 -0.67 -2.80 116.94 122.11 3m6x h PHE 244 Ca 0.06 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 3m6x h PHE 244 Cb 0.01 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 38.51 3m6x h PHE 244 CO -0.09 0.36 0.56 -0.07 -2.23 0.00 0.00 178.31 176.84 3m6x h LEU 245 N 0.64 1.13 -0.96 0.59 3.38 -1.00 -1.25 115.31 117.85 3m6x h LEU 245 Ca 0.20 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 3m6x h LEU 245 Cb -0.02 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 3m6x h LEU 245 CO -0.07 0.87 0.11 0.50 0.09 0.00 0.00 178.44 179.94 3m6x h LYS 246 N 1.30 0.87 0.00 1.13 3.64 -1.25 -2.78 116.57 119.49 3m6x h LYS 246 Ca 0.34 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 3m6x h LYS 246 Cb -0.05 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.65 3m6x h LYS 246 CO -0.06 0.80 -0.25 0.00 -2.27 0.00 0.00 179.45 177.66 3m6x h ALA 247 N 1.29 0.83 -2.40 5.00 0.00 -1.16 -3.40 119.26 119.41 3m6x h ALA 247 Ca 0.18 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.50 3m6x h ALA 247 Cb 0.34 0.00 -0.39 0.00 0.00 0.00 0.00 17.79 17.74 3m6x h ALA 247 CO 0.00 0.00 -0.90 0.72 0.00 0.00 0.00 179.25 179.07 3m6x n HIS 248 N -2.26 0.30 0.26 0.00 8.25 -0.53 -4.96 115.22 116.28 3m6x n HIS 248 Ca 0.04 -3.61 0.16 0.00 -0.26 0.00 0.00 57.72 54.05 3m6x n HIS 248 Cb 0.44 -0.09 0.81 0.00 1.12 0.00 0.00 29.99 32.27 3m6x n HIS 248 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3m6x h PRO 249 N 5.12 0.00 0.00 -0.41 0.13 -1.79 -1.19 132.00 133.86 3m6x h PRO 249 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 3m6x h PRO 249 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 3m6x h PRO 249 CO 0.49 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.41 3m6x n GLU 250 N -2.60 0.05 -4.25 0.86 0.00 -1.26 -4.73 120.64 108.70 3m6x n GLU 250 Ca -0.01 0.14 -0.34 0.00 0.00 0.00 0.00 57.16 56.95 3m6x n GLU 250 Cb 0.08 -1.57 -0.08 0.00 0.00 0.00 0.00 31.44 29.87 3m6x n GLU 250 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 3m6x s PHE 251 N -3.04 3.21 0.00 -1.84 0.08 -0.45 -1.18 117.98 114.77 3m6x s PHE 251 Ca 0.10 0.21 0.01 0.00 0.12 0.00 0.00 56.93 57.37 3m6x s PHE 251 Cb 0.14 -1.77 -0.01 0.00 -0.57 0.00 0.00 43.02 40.82 3m6x s PHE 251 CO 0.44 0.51 -0.04 0.50 -0.10 0.00 0.00 175.22 176.53 3m6x s ARG 252 N -1.23 0.29 0.37 0.44 3.52 -0.65 -4.95 118.95 116.74 3m6x s ARG 252 Ca 0.17 -0.23 -0.27 0.00 -0.13 0.00 0.00 55.73 55.27 3m6x s ARG 252 Cb -0.12 -0.22 -0.09 0.00 -1.56 0.00 0.00 34.95 32.96 3m6x s ARG 252 CO 0.07 0.06 1.25 -0.51 -0.81 0.00 0.00 175.30 175.35 3m6x s LEU 253 N -0.36 4.30 0.15 -0.88 1.43 -1.26 -0.65 118.68 121.40 3m6x s LEU 253 Ca -0.01 2.54 0.08 0.00 -1.03 0.00 0.00 54.13 55.71 3m6x s LEU 253 Cb -0.03 -3.84 -0.04 0.00 0.03 0.00 0.00 46.19 42.31 3m6x s LEU 253 CO -0.00 -0.65 -0.09 -1.61 0.23 0.00 0.00 176.35 174.22 3m6x s GLU 254 N -2.06 2.10 0.07 1.70 2.02 0.26 -4.85 118.70 117.93 3m6x s GLU 254 Ca 0.54 -1.15 -0.32 0.00 0.02 0.00 0.00 54.97 54.06 3m6x s GLU 254 Cb -0.36 -2.23 -0.11 0.00 0.10 0.00 0.00 34.13 31.53 3m6x s GLU 254 CO 0.46 0.47 1.86 -3.47 0.02 0.00 0.00 175.26 174.60 3m6x n ASP 255 N 0.33 3.89 -1.02 -0.19 -0.08 -1.26 -4.33 116.55 113.89 3m6x n ASP 255 Ca -0.12 0.97 0.10 0.00 -1.51 0.00 0.00 54.79 54.24 3m6x n ASP 255 Cb 0.54 -1.50 0.19 0.00 2.34 0.00 0.00 41.12 42.69 3m6x n ASP 255 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3m6x n ALA 256 N 6.11 2.40 -2.40 -1.67 0.00 0.35 -4.81 120.51 120.48 3m6x n ALA 256 Ca 0.19 -0.97 -0.43 0.00 0.00 0.00 0.00 53.44 52.24 3m6x n ALA 256 Cb 0.36 -0.76 0.00 0.00 0.00 0.00 0.00 19.45 19.05 3m6x n ALA 256 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3m6x n ARG 257 N 1.29 3.13 0.23 0.00 1.74 -1.26 -4.71 116.66 117.08 3m6x n ARG 257 Ca 0.17 -3.14 0.07 0.00 -0.77 0.00 0.00 57.85 54.17 3m6x n ARG 257 Cb 0.55 -3.44 0.56 0.00 -1.02 0.00 0.00 32.46 29.10 3m6x n ARG 257 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3m6x h LEU 258 N 11.93 0.00 -7.83 0.55 3.38 -1.96 -3.44 115.31 117.96 3m6x h LEU 258 Ca 0.47 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.27 3m6x h LEU 258 Cb 0.82 0.00 -0.23 0.00 0.09 0.00 0.00 40.66 41.34 3m6x h LEU 258 CO 1.55 0.15 -0.62 -2.28 0.09 0.00 0.00 178.44 177.32 3m6x s HIS 259 N -4.65 0.11 0.61 1.13 5.04 -1.26 -5.05 115.29 111.22 3m6x s HIS 259 Ca -0.04 -0.22 0.32 0.00 -1.54 0.00 0.00 55.06 53.57 3m6x s HIS 259 Cb 0.16 -0.09 1.82 0.00 0.04 0.00 0.00 32.58 34.51 3m6x s HIS 259 CO 0.68 -0.18 2.17 -1.35 -2.34 0.00 0.00 174.74 173.72 3m6x h PRO 260 N 4.92 0.00 0.00 2.88 0.11 -2.00 -0.78 132.00 137.12 3m6x h PRO 260 Ca -0.30 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.78 3m6x h PRO 260 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3m6x h PRO 260 CO 0.42 0.00 -0.17 -0.07 -0.21 0.00 0.00 178.00 177.97 3m6x h LEU 261 N 0.00 0.00 -9.75 2.35 3.38 -1.96 -3.44 115.31 105.89 3m6x h LEU 261 Ca 0.04 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.49 3m6x h LEU 261 Cb 0.31 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.10 3m6x h LEU 261 CO -0.00 0.17 0.68 -0.36 0.09 0.00 0.00 178.44 179.03 3m6x s PHE 262 N -3.72 3.13 0.21 1.13 0.40 -0.30 -4.80 117.98 114.03 3m6x s PHE 262 Ca 0.00 1.20 -0.12 0.00 -0.60 0.00 0.00 56.93 57.42 3m6x s PHE 262 Cb 0.10 -3.69 -0.07 0.00 0.51 0.00 0.00 43.02 39.87 3m6x s PHE 262 CO 0.61 -2.13 0.57 0.00 0.70 0.00 0.00 175.22 174.97 3m6x s ALA 263 N -0.24 3.55 0.60 5.36 0.00 0.17 -4.89 121.76 126.30 3m6x s ALA 263 Ca 0.56 -0.20 -0.17 0.00 0.00 0.00 0.00 51.96 52.14 3m6x s ALA 263 Cb -0.39 -2.49 -0.03 0.00 0.00 0.00 0.00 23.12 20.21 3m6x s ALA 263 CO 0.43 0.48 1.12 -1.25 0.00 0.00 0.00 175.76 176.54 3m6x s PRO 264 N -2.57 3.09 1.17 0.00 0.04 -1.26 -0.04 135.00 135.43 3m6x s PRO 264 Ca 0.45 1.48 -0.15 0.00 0.04 0.00 0.00 61.00 62.83 3m6x s PRO 264 Cb -0.12 -1.98 0.28 0.00 0.04 0.00 0.00 34.50 32.71 3m6x s PRO 264 CO 0.20 -1.04 1.04 0.20 0.04 0.00 0.00 177.00 177.44 3m6x s GLY 265 N -2.21 1.53 -0.32 0.56 0.00 -0.20 -4.56 107.32 102.12 3m6x s GLY 265 Ca 0.69 -0.40 -0.00 0.00 0.00 0.00 0.00 44.72 45.01 3m6x s GLY 265 CO 0.34 0.36 0.02 0.14 0.00 0.00 0.00 173.10 173.96 3m6x s VAL 266 N -2.63 2.79 0.36 1.40 1.01 -1.26 -4.21 120.40 117.86 3m6x s VAL 266 Ca 0.68 -1.69 0.10 0.00 0.00 0.00 0.00 61.98 61.07 3m6x s VAL 266 Cb -0.20 -2.73 0.33 0.00 0.00 0.00 0.00 36.38 33.78 3m6x s VAL 266 CO 0.61 -0.27 1.84 -0.65 0.00 0.00 0.00 175.10 176.63 3m6x h PRO 267 N 7.91 0.62 0.00 2.72 0.11 -1.86 -0.34 132.00 141.16 3m6x h PRO 267 Ca -0.17 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.89 3m6x h PRO 267 Cb 1.05 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 3m6x h PRO 267 CO 0.55 0.41 -0.05 1.49 -0.21 0.00 0.00 178.00 180.19 3m6x h GLU 268 N 0.64 0.00 -0.01 1.05 4.81 -1.89 0.17 114.58 119.36 3m6x h GLU 268 Ca 0.50 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.73 3m6x h GLU 268 Cb 0.90 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.28 3m6x h GLU 268 CO -0.25 0.05 -0.09 0.91 -0.73 0.00 0.00 179.01 178.90 3m6x n TRP 269 N -3.83 0.00 -3.17 0.92 8.01 -0.14 -4.20 117.44 115.02 3m6x n TRP 269 Ca -0.03 0.00 -0.21 0.00 -1.31 0.00 0.00 57.50 55.95 3m6x n TRP 269 Cb 0.14 -0.06 -0.05 0.00 -2.01 0.00 0.00 31.31 29.34 3m6x n TRP 269 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3m6x n GLY 270 N 1.22 3.73 2.58 6.99 0.00 -0.31 -3.15 105.19 116.26 3m6x n GLY 270 Ca 0.17 -1.86 -0.20 0.00 0.00 0.00 0.00 46.02 44.13 3m6x n GLY 270 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3m6x n GLU 271 N 0.56 -1.40 -1.07 1.61 1.02 -1.23 -1.96 120.64 118.17 3m6x n GLU 271 Ca 0.25 1.20 -0.02 0.00 -0.02 0.00 0.00 57.16 58.57 3m6x n GLU 271 Cb 0.58 -5.56 -0.01 0.00 -0.02 0.00 0.00 31.44 26.43 3m6x n GLU 271 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3m6x n GLY 272 N -0.51 0.53 3.63 0.62 0.00 0.44 -4.98 105.19 104.92 3m6x n GLY 272 Ca -0.20 -0.25 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 3m6x n GLY 272 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3m6x s ASN 273 N -2.31 6.64 0.51 1.61 3.84 -0.83 -4.83 114.94 119.56 3m6x s ASN 273 Ca 0.00 1.29 0.34 0.00 0.21 0.00 0.00 52.86 54.70 3m6x s ASN 273 Cb 0.00 -2.54 1.58 0.00 -0.55 0.00 0.00 41.25 39.74 3m6x s ASN 273 CO 0.00 -1.10 2.02 -0.65 -2.79 0.00 0.00 177.10 174.58 3m6x h PRO 274 N 9.48 0.00 -0.20 0.43 0.11 -1.90 -1.93 132.00 137.99 3m6x h PRO 274 Ca -0.27 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.89 3m6x h PRO 274 Cb 1.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3m6x h PRO 274 CO 1.03 0.00 0.19 0.93 -0.21 0.00 0.00 178.00 179.93 3m6x h GLU 275 N 0.00 0.00 0.00 1.05 4.39 -1.98 -2.28 114.58 115.76 3m6x h GLU 275 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3m6x h GLU 275 Cb 0.30 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 3m6x h GLU 275 CO 0.00 0.00 0.00 1.28 -1.16 0.00 0.00 179.01 179.13 3m6x n LEU 276 N -4.00 0.60 0.33 1.33 4.77 -0.73 -1.09 117.00 118.21 3m6x n LEU 276 Ca 0.02 0.72 0.22 0.00 -0.03 0.00 0.00 56.01 56.94 3m6x n LEU 276 Cb 0.32 -0.72 1.14 0.00 -2.33 0.00 0.00 43.42 41.83 3m6x n LEU 276 CO 0.30 -0.78 1.16 -0.07 -1.33 0.00 0.00 177.39 176.67 3m6x h LEU 277 N 0.00 0.00 0.00 2.23 3.38 -1.58 -1.83 115.31 117.51 3m6x h LEU 277 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3m6x h LEU 277 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3m6x h LEU 277 CO 0.00 0.00 -0.24 0.29 0.09 0.00 0.00 178.44 178.58 3m6x n LYS 278 N -3.09 0.13 -1.70 1.13 5.02 -0.25 -4.07 118.16 115.33 3m6x n LYS 278 Ca -0.02 0.07 -0.30 0.00 -2.02 0.00 0.00 58.31 56.04 3m6x n LYS 278 Cb 0.11 -1.62 0.07 0.00 -0.02 0.00 0.00 35.03 33.57 3m6x n LYS 278 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3m6x s THR 279 N -3.06 3.25 -0.02 -0.18 -4.23 -0.69 -0.49 115.64 110.21 3m6x s THR 279 Ca 0.11 0.41 0.04 0.00 -1.18 0.00 0.00 61.69 61.06 3m6x s THR 279 Cb 0.16 -3.27 -0.01 0.00 1.34 0.00 0.00 72.50 70.73 3m6x s THR 279 CO 0.63 -0.53 -0.13 0.00 -0.54 0.00 0.00 174.62 174.05 3m6x s ALA 280 N -3.25 1.09 -0.15 3.99 0.00 -0.28 -1.03 121.76 122.12 3m6x s ALA 280 Ca 0.60 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.04 3m6x s ALA 280 Cb -0.13 -0.32 -0.00 0.00 0.00 0.00 0.00 23.12 22.67 3m6x s ALA 280 CO 0.53 0.24 -0.16 1.03 0.00 0.00 0.00 175.76 177.40 3m6x s ARG 281 N -0.13 3.20 -0.36 0.00 0.52 0.95 -0.86 118.95 122.27 3m6x s ARG 281 Ca 0.02 -0.76 -0.12 0.00 -0.52 0.00 0.00 55.73 54.35 3m6x s ARG 281 Cb -0.07 -2.60 0.01 0.00 0.52 0.00 0.00 34.95 32.80 3m6x s ARG 281 CO 0.00 0.02 0.22 -0.51 0.02 0.00 0.00 175.30 175.06 3m6x s LEU 282 N 0.79 4.61 -0.10 2.53 1.02 -0.14 -0.66 118.68 126.73 3m6x s LEU 282 Ca -0.06 -0.72 -0.02 0.00 0.02 0.00 0.00 54.13 53.35 3m6x s LEU 282 Cb -0.15 -2.08 -0.03 0.00 0.02 0.00 0.00 46.19 43.95 3m6x s LEU 282 CO 0.00 -0.32 0.00 0.26 0.02 0.00 0.00 176.35 176.32 3m6x s TRP 283 N 1.64 3.16 -0.01 0.29 0.52 -1.26 -1.99 118.94 121.28 3m6x s TRP 283 Ca 0.04 0.15 0.31 0.00 0.02 0.00 0.00 56.10 56.62 3m6x s TRP 283 Cb -0.18 -1.82 1.41 0.00 -1.15 0.00 0.00 33.47 31.73 3m6x s TRP 283 CO 0.08 0.41 1.94 -1.00 0.02 0.00 0.00 176.95 178.40 3m6x h PRO 284 N 5.37 0.00 -0.02 4.98 0.13 -1.75 -1.28 132.00 139.43 3m6x h PRO 284 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3m6x h PRO 284 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3m6x h PRO 284 CO 0.56 0.00 -0.10 -2.39 -0.23 0.00 0.00 178.00 175.84 3m6x n HIS 285 N -2.75 0.00 0.01 1.56 1.44 -1.26 -4.21 115.22 110.01 3m6x n HIS 285 Ca 0.00 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.74 3m6x n HIS 285 Cb 0.21 -0.02 -0.04 0.00 0.12 0.00 0.00 29.99 30.26 3m6x n HIS 285 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 3m6x n ARG 286 N 0.31 0.47 -3.98 -1.40 5.12 -0.55 -5.00 116.66 111.63 3m6x n ARG 286 Ca 0.15 -0.05 -0.10 0.00 -1.93 0.00 0.00 57.85 55.93 3m6x n ARG 286 Cb 0.43 -1.11 -0.04 0.00 -1.16 0.00 0.00 32.46 30.58 3m6x n ARG 286 CO 0.00 0.00 0.00 -0.48 -1.93 0.00 0.00 177.63 175.22 3m6x s LEU 287 N -3.31 0.33 -0.82 0.55 0.05 -0.81 -4.96 118.68 109.70 3m6x s LEU 287 Ca -0.02 -1.00 -0.21 0.00 0.05 0.00 0.00 54.13 52.96 3m6x s LEU 287 Cb 0.04 1.93 0.10 0.00 -2.05 0.00 0.00 46.19 46.20 3m6x s LEU 287 CO 0.23 -1.24 1.08 -0.70 -0.55 0.00 0.00 176.35 175.17 3m6x s GLU 288 N -3.70 3.39 0.00 1.48 2.12 -1.26 -4.53 118.70 116.20 3m6x s GLU 288 Ca 0.22 -1.32 0.00 0.00 0.36 0.00 0.00 54.97 54.22 3m6x s GLU 288 Cb -0.02 -4.66 0.00 0.00 0.26 0.00 0.00 34.13 29.72 3m6x s GLU 288 CO 0.11 -1.82 0.00 0.41 -0.54 0.00 0.00 175.26 173.42 3m6x n GLY 289 N 5.53 1.16 0.10 -1.50 0.00 -1.26 -4.67 105.19 104.55 3m6x n GLY 289 Ca 0.13 -0.70 -0.14 0.00 0.00 0.00 0.00 46.02 45.30 3m6x n GLY 289 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3m6x h GLU 290 N 0.00 0.23 0.00 1.61 4.39 -1.90 -3.33 114.58 115.58 3m6x h GLU 290 Ca 0.00 -0.39 0.00 0.00 0.34 0.00 0.00 59.36 59.31 3m6x h GLU 290 Cb 0.00 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 3m6x h GLU 290 CO 0.00 1.18 0.00 0.41 -1.16 0.00 0.00 179.01 179.44 3m6x n GLY 291 N 1.49 4.45 3.40 -3.84 0.00 -1.26 -4.33 105.19 105.10 3m6x n GLY 291 Ca -0.07 -0.92 -0.13 0.00 0.00 0.00 0.00 46.02 44.90 3m6x n GLY 291 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3m6x s HIS 292 N -0.46 -0.44 -0.04 1.61 2.46 -0.84 -4.63 115.29 112.96 3m6x s HIS 292 Ca 0.00 0.38 0.06 0.00 0.47 0.00 0.00 55.06 55.96 3m6x s HIS 292 Cb 0.00 0.40 -0.01 0.00 -0.13 0.00 0.00 32.58 32.84 3m6x s HIS 292 CO 0.00 -0.71 -0.20 0.12 -2.47 0.00 0.00 174.74 171.47 3m6x s PHE 293 N -2.98 1.94 -0.04 3.88 5.36 -0.02 -0.97 117.98 125.14 3m6x s PHE 293 Ca -0.02 -0.49 0.03 0.00 -0.96 0.00 0.00 56.93 55.49 3m6x s PHE 293 Cb -0.00 -1.27 0.00 0.00 -0.34 0.00 0.00 43.02 41.41 3m6x s PHE 293 CO -0.06 -0.12 -0.14 -0.51 -1.46 0.00 0.00 175.22 172.93 3m6x s LEU 294 N -0.22 1.82 -0.04 6.12 1.43 -0.04 -2.09 118.68 125.67 3m6x s LEU 294 Ca 0.01 -0.29 0.01 0.00 -1.03 0.00 0.00 54.13 52.83 3m6x s LEU 294 Cb -0.11 -0.82 0.02 0.00 0.03 0.00 0.00 46.19 45.32 3m6x s LEU 294 CO 0.01 0.10 -0.03 0.00 0.23 0.00 0.00 176.35 176.66 3m6x s ALA 295 N 0.21 0.55 -0.10 4.21 0.00 0.04 -1.13 121.76 125.54 3m6x s ALA 295 Ca -0.06 0.01 0.03 0.00 0.00 0.00 0.00 51.96 51.95 3m6x s ALA 295 Cb -0.11 -0.36 -0.01 0.00 0.00 0.00 0.00 23.12 22.64 3m6x s ALA 295 CO 0.02 -0.01 -0.21 0.50 0.00 0.00 0.00 175.76 176.05 3m6x s ARG 296 N 0.86 3.01 0.18 0.00 3.52 -1.26 -0.67 118.95 124.59 3m6x s ARG 296 Ca -0.11 -0.83 0.11 0.00 -0.13 0.00 0.00 55.73 54.78 3m6x s ARG 296 Cb -0.14 -2.36 -0.04 0.00 -1.56 0.00 0.00 34.95 30.86 3m6x s ARG 296 CO -0.00 0.24 -0.25 -0.06 -0.81 0.00 0.00 175.30 174.43 3m6x s PHE 297 N 0.20 2.30 -0.07 5.12 0.08 0.11 -0.57 117.98 125.16 3m6x s PHE 297 Ca -0.13 -0.36 0.05 0.00 0.12 0.00 0.00 56.93 56.61 3m6x s PHE 297 Cb -0.16 -1.16 -0.01 0.00 -0.57 0.00 0.00 43.02 41.11 3m6x s PHE 297 CO 0.07 0.47 -0.24 0.50 -0.10 0.00 0.00 175.22 175.92 3m6x s ARG 298 N -2.54 2.58 -0.13 0.44 6.06 0.18 -1.26 118.95 124.27 3m6x s ARG 298 Ca 0.19 -0.87 -0.14 0.00 -2.50 0.00 0.00 55.73 52.42 3m6x s ARG 298 Cb -0.08 -2.13 -0.05 0.00 0.06 0.00 0.00 34.95 32.75 3m6x s ARG 298 CO 0.09 0.32 0.30 0.21 -2.50 0.00 0.00 175.30 173.72 3m6x s LYS 299 N -0.02 4.15 -0.11 5.12 2.20 -0.18 -1.64 119.74 129.25 3m6x s LYS 299 Ca -0.07 0.13 -0.01 0.00 -0.36 0.00 0.00 55.97 55.66 3m6x s LYS 299 Cb -0.15 -3.38 -0.03 0.00 -1.51 0.00 0.00 37.83 32.77 3m6x s LYS 299 CO 0.05 0.34 -0.06 -2.00 -0.36 0.00 0.00 175.35 173.31 3m6x s GLU 300 N 0.15 3.17 0.00 4.03 2.12 -0.32 -0.60 118.70 127.24 3m6x s GLU 300 Ca 0.18 -0.55 0.00 0.00 0.36 0.00 0.00 54.97 54.95 3m6x s GLU 300 Cb -0.13 -2.72 0.00 0.00 0.26 0.00 0.00 34.13 31.54 3m6x s GLU 300 CO 0.05 0.46 0.00 0.41 -0.54 0.00 0.00 175.26 175.64 3m6x n GLY 301 N 2.85 -0.05 4.25 -1.50 0.00 -1.26 -4.85 105.19 104.63 3m6x n GLY 301 Ca -0.18 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 43.90 3m6x n GLY 301 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m6x n GLY 302 N -0.24 -1.95 3.07 -0.02 0.00 -1.26 -3.96 105.19 100.82 3m6x n GLY 302 Ca 0.00 -1.67 -0.09 0.00 0.00 0.00 0.00 46.02 44.26 3m6x n GLY 302 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m6x s ALA 303 N -1.38 0.06 0.22 4.61 0.00 -1.26 -4.71 121.76 119.30 3m6x s ALA 303 Ca 0.00 -0.62 -0.31 0.00 0.00 0.00 0.00 51.96 51.03 3m6x s ALA 303 Cb 0.00 0.21 -0.10 0.00 0.00 0.00 0.00 23.12 23.22 3m6x s ALA 303 CO 0.00 -0.26 1.50 -1.58 0.00 0.00 0.00 175.76 175.42 3m6x s TRP 304 N -2.31 3.02 0.77 0.00 0.52 -1.26 -4.66 118.94 115.02 3m6x s TRP 304 Ca -0.08 0.84 -0.11 0.00 0.02 0.00 0.00 56.10 56.77 3m6x s TRP 304 Cb -0.03 -3.88 0.05 0.00 -1.15 0.00 0.00 33.47 28.46 3m6x s TRP 304 CO -0.04 -3.05 1.09 -1.54 0.02 0.00 0.00 176.95 173.43 3m6x s SER 305 N 0.70 4.72 -0.49 2.95 1.04 -0.58 -5.01 113.70 117.02 3m6x s SER 305 Ca 0.64 1.41 0.08 0.00 0.48 0.00 0.00 55.95 58.55 3m6x s SER 305 Cb -0.43 -2.18 0.31 0.00 0.10 0.00 0.00 66.02 63.82 3m6x s SER 305 CO 0.39 -1.84 0.77 0.35 0.98 0.00 0.00 173.24 173.89 3m6x n THR 306 N -3.36 1.32 -1.49 2.02 -2.24 -1.26 -4.85 114.28 104.42 3m6x n THR 306 Ca 0.07 -4.95 -0.33 0.00 -2.27 0.00 0.00 64.05 56.57 3m6x n THR 306 Cb 0.55 -1.27 0.08 0.00 -2.10 0.00 0.00 70.33 67.59 3m6x n THR 306 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3m6x s PRO 307 N -2.59 2.36 0.62 -0.78 0.04 -1.26 -4.97 135.00 128.43 3m6x s PRO 307 Ca 0.42 1.48 -0.19 0.00 0.04 0.00 0.00 61.00 62.76 3m6x s PRO 307 Cb 0.26 -1.89 -0.02 0.00 0.04 0.00 0.00 34.50 32.89 3m6x s PRO 307 CO -0.09 -1.61 1.30 1.03 0.04 0.00 0.00 177.00 177.68 3m6x s ARG 308 N -4.20 2.69 0.28 4.56 0.52 -1.26 -4.87 118.95 116.68 3m6x s ARG 308 Ca 0.68 2.09 -0.06 0.00 -0.52 0.00 0.00 55.73 57.92 3m6x s ARG 308 Cb -0.23 -1.93 -0.06 0.00 0.52 0.00 0.00 34.95 33.26 3m6x s ARG 308 CO 0.46 -1.49 0.56 -0.51 0.02 0.00 0.00 175.30 174.34 3m6x s LEU 309 N -4.18 4.07 -0.13 2.53 1.43 -1.26 -0.52 118.68 120.62 3m6x s LEU 309 Ca 0.80 0.77 -0.29 0.00 -1.03 0.00 0.00 54.13 54.38 3m6x s LEU 309 Cb -0.38 -3.58 -0.03 0.00 0.03 0.00 0.00 46.19 42.23 3m6x s LEU 309 CO 0.41 -0.18 1.48 -0.70 0.23 0.00 0.00 176.35 177.59 3m6x s GLU 310 N -3.42 4.15 -0.31 1.70 2.56 -0.35 -4.35 118.70 118.67 3m6x s GLU 310 Ca 0.45 1.88 -0.00 0.00 0.00 0.00 0.00 54.97 57.30 3m6x s GLU 310 Cb -0.11 -3.90 0.10 0.00 2.00 0.00 0.00 34.13 32.22 3m6x s GLU 310 CO 0.28 -0.85 0.10 1.03 -0.56 0.00 0.00 175.26 175.26 3m6x s ARG 311 N 3.90 0.79 0.54 4.30 0.52 -1.26 -4.91 118.95 122.82 3m6x s ARG 311 Ca 0.65 -1.16 -0.22 0.00 -0.52 0.00 0.00 55.73 54.48 3m6x s ARG 311 Cb -0.27 -2.10 -0.05 0.00 0.52 0.00 0.00 34.95 33.05 3m6x s ARG 311 CO 0.23 -0.99 1.37 -2.14 0.02 0.00 0.00 175.30 173.80 3m6x s PRO 312 N 1.53 3.19 0.70 3.54 0.02 -1.26 -5.00 135.00 137.73 3m6x s PRO 312 Ca 0.10 2.26 -0.14 0.00 0.02 0.00 0.00 61.00 63.24 3m6x s PRO 312 Cb -0.17 -2.30 0.02 0.00 0.02 0.00 0.00 34.50 32.07 3m6x s PRO 312 CO -0.23 -1.16 1.12 -1.12 -0.33 0.00 0.00 177.00 175.28 3m6x s SER 313 N -0.90 4.78 0.56 2.53 0.01 -1.26 -4.98 113.70 114.45 3m6x s SER 313 Ca 0.70 2.02 -0.20 0.00 1.31 0.00 0.00 55.95 59.78 3m6x s SER 313 Cb -0.41 -2.55 -0.06 0.00 0.21 0.00 0.00 66.02 63.21 3m6x s SER 313 CO 0.49 -1.85 1.02 -2.65 0.41 0.00 0.00 173.24 170.66 3m6x n PRO 314 N -2.74 1.09 -1.78 12.44 -0.02 -1.26 -4.87 135.00 137.86 3m6x n PRO 314 Ca 0.11 0.41 -0.35 0.00 -2.02 0.00 0.00 63.50 61.65 3m6x n PRO 314 Cb 0.52 -2.20 0.05 0.00 -0.02 0.00 0.00 33.50 31.85 3m6x n PRO 314 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3m6x s LEU 315 N -1.94 3.49 0.86 2.45 1.43 -1.26 -5.01 118.68 118.70 3m6x s LEU 315 Ca 0.73 2.28 -0.10 0.00 -1.03 0.00 0.00 54.13 56.01 3m6x s LEU 315 Cb -0.44 -4.58 0.11 0.00 0.03 0.00 0.00 46.19 41.31 3m6x s LEU 315 CO 0.49 -1.80 1.13 -0.94 0.23 0.00 0.00 176.35 175.45 3m6x s SER 316 N -1.97 3.52 0.29 2.29 1.04 -1.26 -4.75 113.70 112.86 3m6x s SER 316 Ca 0.74 2.05 -0.01 0.00 0.48 0.00 0.00 55.95 59.20 3m6x s SER 316 Cb -0.27 -2.55 0.46 0.00 0.10 0.00 0.00 66.02 63.75 3m6x s SER 316 CO 0.39 -2.70 1.93 1.56 0.98 0.00 0.00 173.24 175.40 3m6x h GLN 317 N -1.59 1.08 0.13 4.02 1.08 -1.98 0.11 115.11 117.96 3m6x h GLN 317 Ca -0.43 -0.07 -0.01 0.00 -1.45 0.00 0.00 58.65 56.70 3m6x h GLN 317 Cb 1.25 -0.24 0.00 0.00 -0.05 0.00 0.00 27.48 28.44 3m6x h GLN 317 CO 0.45 0.72 -0.06 1.49 -0.95 0.00 0.00 178.83 180.48 3m6x h GLU 318 N 1.12 -0.17 -0.47 1.46 4.81 -1.99 0.12 114.58 119.45 3m6x h GLU 318 Ca 0.36 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.56 3m6x h GLU 318 Cb 0.03 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 3m6x h GLU 318 CO -0.11 -0.01 0.15 0.00 -0.73 0.00 0.00 179.01 178.31 3m6x h ALA 319 N 0.56 0.62 -0.09 2.92 0.00 -1.86 -1.13 119.26 120.29 3m6x h ALA 319 Ca -0.02 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.74 3m6x h ALA 319 Cb 0.23 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3m6x h ALA 319 CO 0.03 0.27 -0.06 1.25 0.00 0.00 0.00 179.25 180.74 3m6x h LEU 320 N 0.63 -0.20 -0.61 0.00 5.85 -0.71 -0.05 115.31 120.24 3m6x h LEU 320 Ca 0.15 0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 3m6x h LEU 320 Cb 0.27 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 3m6x h LEU 320 CO -0.01 -0.09 -0.09 0.08 -0.34 0.00 0.00 178.44 177.99 3m6x h ARG 321 N -0.07 1.01 -0.19 1.25 0.11 -0.84 -0.13 114.38 115.52 3m6x h ARG 321 Ca 0.06 -0.36 -0.01 0.00 0.10 0.00 0.00 59.98 59.76 3m6x h ARG 321 Cb 0.15 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 31.15 3m6x h ARG 321 CO -0.13 1.04 0.07 0.00 0.10 0.00 0.00 179.97 181.05 3m6x h ALA 322 N 0.98 0.25 -0.17 0.08 0.00 -1.04 -0.71 119.26 118.66 3m6x h ALA 322 Ca 0.14 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 3m6x h ALA 322 Cb 0.65 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 3m6x h ALA 322 CO 0.04 -0.14 -0.13 0.35 0.00 0.00 0.00 179.25 179.37 3m6x h PHE 323 N 0.15 0.46 -0.55 0.00 3.57 -0.91 -2.42 116.94 117.24 3m6x h PHE 323 Ca 0.06 -0.13 -0.01 0.00 3.53 0.00 0.00 57.97 61.42 3m6x h PHE 323 Cb 0.20 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.81 3m6x h PHE 323 CO -0.01 0.74 0.31 0.00 -2.23 0.00 0.00 178.31 177.12 3m6x h ARG 324 N 0.05 0.74 -0.59 1.11 3.08 -1.05 -0.97 114.38 116.75 3m6x h ARG 324 Ca 0.03 -0.07 0.03 0.00 0.07 0.00 0.00 59.98 60.05 3m6x h ARG 324 Cb 0.65 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.50 3m6x h ARG 324 CO 0.04 0.54 0.35 0.78 -1.07 0.00 0.00 179.97 180.60 3m6x h GLY 325 N 0.82 0.85 0.87 0.04 0.00 -0.94 0.33 103.07 105.03 3m6x h GLY 325 Ca 0.20 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.23 3m6x h GLY 325 CO -0.03 0.20 0.01 -2.75 0.00 0.00 0.00 176.54 173.97 3m6x h PHE 326 N 0.67 0.52 -0.95 5.60 3.57 -0.88 -1.83 116.94 123.65 3m6x h PHE 326 Ca 0.25 -0.09 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 3m6x h PHE 326 Cb 0.07 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 38.62 3m6x h PHE 326 CO -0.07 0.62 0.59 -0.07 -2.23 0.00 0.00 178.31 177.15 3m6x h LEU 327 N 0.28 1.12 -0.37 0.59 3.38 -0.89 0.09 115.31 119.52 3m6x h LEU 327 Ca 0.08 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 3m6x h LEU 327 Cb 0.40 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3m6x h LEU 327 CO 0.01 0.84 0.09 -0.08 0.09 0.00 0.00 178.44 179.40 3m6x h GLU 328 N 1.30 0.59 -0.17 1.13 4.81 -0.83 0.10 114.58 121.51 3m6x h GLU 328 Ca 0.34 -0.14 -0.12 0.00 -0.13 0.00 0.00 59.36 59.31 3m6x h GLU 328 Cb -0.09 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 3m6x h GLU 328 CO -0.07 0.62 -0.42 1.49 -0.73 0.00 0.00 179.01 179.90 3m6x h GLU 329 N 0.45 0.39 0.00 1.92 4.81 -0.96 -2.98 114.58 118.20 3m6x h GLU 329 Ca 0.12 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 3m6x h GLU 329 Cb 0.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.68 3m6x h GLU 329 CO 0.00 0.74 -0.45 0.00 -0.73 0.00 0.00 179.01 178.57 3m6x n ALA 330 N -2.49 2.92 -2.93 2.92 0.00 -0.01 -4.15 120.51 116.78 3m6x n ALA 330 Ca -0.02 -0.23 -0.11 0.00 0.00 0.00 0.00 53.44 53.09 3m6x n ALA 330 Cb 0.50 -1.23 0.05 0.00 0.00 0.00 0.00 19.45 18.77 3m6x n ALA 330 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m6x n GLY 331 N 1.39 0.00 3.33 0.00 0.00 0.09 -0.60 105.19 109.41 3m6x n GLY 331 Ca 0.04 -0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 3m6x n GLY 331 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3m6x s LEU 332 N -4.59 2.15 -0.18 0.99 2.96 0.13 -4.18 118.68 115.97 3m6x s LEU 332 Ca 0.10 -0.43 0.01 0.00 -0.22 0.00 0.00 54.13 53.59 3m6x s LEU 332 Cb -0.04 -1.37 0.03 0.00 0.50 0.00 0.00 46.19 45.30 3m6x s LEU 332 CO 0.43 0.32 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.72 3m6x s THR 333 N -0.61 1.87 -0.06 3.68 2.01 -1.26 -4.63 115.64 116.63 3m6x s THR 333 Ca 0.10 -0.89 -0.01 0.00 0.31 0.00 0.00 61.69 61.20 3m6x s THR 333 Cb -0.10 -1.75 -0.03 0.00 0.01 0.00 0.00 72.50 70.63 3m6x s THR 333 CO -0.01 0.45 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.61 3m6x s LEU 334 N 1.35 3.52 -0.61 4.42 1.43 -1.26 -4.95 118.68 122.58 3m6x s LEU 334 Ca 0.04 0.09 0.04 0.00 -1.03 0.00 0.00 54.13 53.26 3m6x s LEU 334 Cb -0.14 -1.85 0.37 0.00 0.03 0.00 0.00 46.19 44.60 3m6x s LEU 334 CO -0.11 0.35 1.22 -0.62 0.23 0.00 0.00 176.35 177.42 3m6x n GLU 335 N 1.97 3.52 -3.56 1.70 4.71 -1.26 -5.03 120.64 122.69 3m6x n GLU 335 Ca -0.18 -4.57 0.00 0.00 -0.01 0.00 0.00 57.16 52.41 3m6x n GLU 335 Cb 0.53 -2.27 0.01 0.00 -1.01 0.00 0.00 31.44 28.70 3m6x n GLU 335 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3m6x n GLY 336 N -0.34 0.46 3.75 0.62 0.00 -1.26 -5.09 105.19 103.33 3m6x n GLY 336 Ca 0.38 -1.05 -0.41 0.00 0.00 0.00 0.00 46.02 44.94 3m6x n GLY 336 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3m6x s PRO 337 N -2.02 4.41 -0.21 1.61 0.02 -1.26 -4.92 135.00 132.62 3m6x s PRO 337 Ca 0.23 2.08 -0.03 0.00 0.02 0.00 0.00 61.00 63.30 3m6x s PRO 337 Cb -0.01 -3.14 -0.01 0.00 0.02 0.00 0.00 34.50 31.35 3m6x s PRO 337 CO 0.01 -0.16 -0.06 0.08 -0.33 0.00 0.00 177.00 176.55 3m6x s VAL 338 N -0.56 3.28 -0.16 3.83 1.01 -1.26 -1.85 120.40 124.68 3m6x s VAL 338 Ca 0.52 -0.53 -0.15 0.00 0.00 0.00 0.00 61.98 61.82 3m6x s VAL 338 Cb -0.37 -2.47 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 3m6x s VAL 338 CO 0.44 0.44 0.36 -0.22 0.00 0.00 0.00 175.10 176.12 3m6x s LEU 339 N 1.34 4.23 -0.31 3.92 2.96 -0.07 -4.82 118.68 125.93 3m6x s LEU 339 Ca 0.04 0.57 -0.07 0.00 -0.22 0.00 0.00 54.13 54.44 3m6x s LEU 339 Cb -0.14 -2.47 0.01 0.00 0.50 0.00 0.00 46.19 44.09 3m6x s LEU 339 CO -0.03 0.03 0.11 -0.62 -1.32 0.00 0.00 176.35 174.52 3m6x s ASP 340 N 0.66 5.27 -0.37 3.68 -1.08 -1.26 -0.85 116.67 122.72 3m6x s ASP 340 Ca 0.19 -0.79 -0.01 0.00 -0.52 0.00 0.00 52.55 51.42 3m6x s ASP 340 Cb -0.14 -1.91 0.10 0.00 -1.46 0.00 0.00 42.92 39.51 3m6x s ASP 340 CO 0.06 -0.23 0.13 -0.13 0.52 0.00 0.00 175.17 175.51 3m6x s ARG 341 N 1.50 1.95 -1.56 4.34 0.52 -0.03 -4.74 118.95 120.93 3m6x s ARG 341 Ca 0.02 -1.73 -0.13 0.00 -0.52 0.00 0.00 55.73 53.36 3m6x s ARG 341 Cb -0.18 -3.41 0.10 0.00 0.52 0.00 0.00 34.95 31.98 3m6x s ARG 341 CO 0.03 -0.95 0.87 0.00 0.02 0.00 0.00 175.30 175.27 3m6x n ALA 342 N 4.51 -1.38 0.00 2.13 0.00 -1.26 -1.45 120.51 123.06 3m6x n ALA 342 Ca -0.03 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.49 3m6x n ALA 342 Cb 0.42 -3.82 0.00 0.00 0.00 0.00 0.00 19.45 16.05 3m6x n ALA 342 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m6x n GLY 343 N -1.62 2.23 3.66 0.00 0.00 -1.26 -4.95 105.19 103.25 3m6x n GLY 343 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 3m6x n GLY 343 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3m6x s HIS 344 N -2.40 3.38 -0.14 1.61 4.02 -0.53 0.00 115.29 121.24 3m6x s HIS 344 Ca 0.00 0.95 -0.06 0.00 1.02 0.00 0.00 55.06 56.97 3m6x s HIS 344 Cb 0.00 -2.81 -0.04 0.00 -1.02 0.00 0.00 32.58 28.71 3m6x s HIS 344 CO 0.00 -0.17 0.08 -0.51 1.02 0.00 0.00 174.74 175.16 3m6x s LEU 345 N 1.89 3.99 -0.02 0.89 1.43 -0.16 -0.85 118.68 125.85 3m6x s LEU 345 Ca 0.29 0.25 0.05 0.00 -1.03 0.00 0.00 54.13 53.69 3m6x s LEU 345 Cb -0.16 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 44.08 3m6x s LEU 345 CO 0.11 0.31 -0.16 -0.31 0.23 0.00 0.00 176.35 176.53 3m6x s TYR 346 N -0.46 1.46 -0.40 0.29 2.02 -0.03 -0.89 117.35 119.34 3m6x s TYR 346 Ca 0.10 -0.31 -0.21 0.00 -0.37 0.00 0.00 57.07 56.29 3m6x s TYR 346 Cb -0.12 -0.95 0.01 0.00 -0.40 0.00 0.00 41.96 40.50 3m6x s TYR 346 CO 0.02 -0.05 0.64 -1.17 -1.57 0.00 0.00 175.55 173.42 3m6x s LEU 347 N -0.27 4.38 0.13 -1.29 2.96 0.55 -0.90 118.68 124.24 3m6x s LEU 347 Ca 0.04 -0.12 -0.28 0.00 -0.22 0.00 0.00 54.13 53.55 3m6x s LEU 347 Cb -0.07 -2.76 -0.07 0.00 0.50 0.00 0.00 46.19 43.79 3m6x s LEU 347 CO -0.00 -0.70 0.89 -0.76 -1.32 0.00 0.00 176.35 174.46 3m6x s LEU 348 N 2.78 4.53 0.45 -0.68 1.43 -0.77 -1.38 118.68 125.03 3m6x s LEU 348 Ca 0.24 1.73 -0.24 0.00 -1.03 0.00 0.00 54.13 54.82 3m6x s LEU 348 Cb -0.14 -3.48 -0.08 0.00 0.03 0.00 0.00 46.19 42.52 3m6x s LEU 348 CO 0.17 0.03 1.28 -2.84 0.23 0.00 0.00 176.35 175.23 3m6x s PRO 349 N -0.38 3.75 0.23 1.29 0.02 -1.26 -4.54 135.00 134.11 3m6x s PRO 349 Ca 0.43 2.09 -0.32 0.00 0.02 0.00 0.00 61.00 63.22 3m6x s PRO 349 Cb -0.23 -2.58 -0.13 0.00 0.02 0.00 0.00 34.50 31.59 3m6x s PRO 349 CO 0.28 -0.65 1.59 -1.91 -0.33 0.00 0.00 177.00 175.99 3m6x n GLU 350 N -0.24 2.47 -0.63 5.54 2.13 -1.26 -2.50 120.64 126.15 3m6x n GLU 350 Ca 0.06 0.89 0.00 0.00 0.66 0.00 0.00 57.16 58.76 3m6x n GLU 350 Cb 0.45 -2.66 0.00 0.00 0.27 0.00 0.00 31.44 29.50 3m6x n GLU 350 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3m6x n GLY 351 N 2.93 0.76 3.67 8.31 0.00 -1.26 -4.21 105.19 115.39 3m6x n GLY 351 Ca 0.13 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.70 3m6x n GLY 351 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3m6x n LEU 352 N 0.00 3.77 -4.81 0.99 7.94 -1.04 -4.94 117.00 118.91 3m6x n LEU 352 Ca 0.00 0.96 -0.30 0.00 -1.11 0.00 0.00 56.01 55.56 3m6x n LEU 352 Cb 0.00 -1.46 0.10 0.00 0.53 0.00 0.00 43.42 42.59 3m6x n LEU 352 CO 0.00 0.06 0.72 -2.16 -1.11 0.00 0.00 177.39 174.90 3m6x s PRO 353 N 3.80 1.86 0.21 1.96 0.04 -1.26 -1.21 135.00 140.41 3m6x s PRO 353 Ca 0.89 0.48 -0.32 0.00 0.04 0.00 0.00 61.00 62.09 3m6x s PRO 353 Cb -0.57 -1.91 -0.13 0.00 0.04 0.00 0.00 34.50 31.93 3m6x s PRO 353 CO 0.45 -1.74 1.49 -2.37 0.04 0.00 0.00 177.00 174.87 3m6x n THR 354 N -3.49 0.58 0.37 1.26 5.66 0.32 -3.80 114.28 115.19 3m6x n THR 354 Ca 0.07 -0.15 0.10 0.00 -3.05 0.00 0.00 64.05 61.03 3m6x n THR 354 Cb 0.58 -1.55 0.26 0.00 -1.55 0.00 0.00 70.33 68.07 3m6x n THR 354 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 3m6x n LEU 355 N 2.66 2.97 -4.66 1.09 4.77 -1.26 -4.90 117.00 117.67 3m6x n LEU 355 Ca 0.13 -1.40 -0.50 0.00 -0.03 0.00 0.00 56.01 54.22 3m6x n LEU 355 Cb 0.31 -0.30 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 3m6x n LEU 355 CO 0.63 0.70 1.22 -0.11 -1.33 0.00 0.00 177.39 178.49 3m6x n LEU 356 N 1.14 2.69 0.00 2.23 7.94 -1.26 -1.18 117.00 128.56 3m6x n LEU 356 Ca 0.19 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 56.15 3m6x n LEU 356 Cb 0.50 -1.30 0.00 0.00 0.53 0.00 0.00 43.42 43.14 3m6x n LEU 356 CO 0.14 -0.45 0.00 0.61 -1.11 0.00 0.00 177.39 176.58 3m6x n GLY 357 N 3.57 0.77 3.47 -3.96 0.00 -1.26 -5.01 105.19 102.76 3m6x n GLY 357 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 3m6x n GLY 357 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m6x s LEU 358 N 0.00 2.69 -0.05 0.99 1.43 -0.32 -5.09 118.68 118.33 3m6x s LEU 358 Ca 0.00 -0.22 -0.30 0.00 -1.03 0.00 0.00 54.13 52.58 3m6x s LEU 358 Cb 0.00 -1.54 -0.03 0.00 0.03 0.00 0.00 46.19 44.65 3m6x s LEU 358 CO 0.00 0.34 1.14 -0.75 0.23 0.00 0.00 176.35 177.31 3m6x s LYS 359 N -0.74 4.40 -0.40 1.70 2.20 -1.26 -4.99 119.74 120.64 3m6x s LYS 359 Ca 0.11 1.60 0.01 0.00 -0.36 0.00 0.00 55.97 57.34 3m6x s LYS 359 Cb -0.11 -3.52 0.13 0.00 -1.51 0.00 0.00 37.83 32.83 3m6x s LYS 359 CO 0.00 -0.36 0.22 0.00 -0.36 0.00 0.00 175.35 174.85 3m6x s ALA 360 N 1.91 1.75 0.45 3.13 0.00 -1.26 -0.57 121.76 127.16 3m6x s ALA 360 Ca 0.54 -2.30 0.22 0.00 0.00 0.00 0.00 51.96 50.42 3m6x s ALA 360 Cb -0.24 -1.78 1.19 0.00 0.00 0.00 0.00 23.12 22.29 3m6x s ALA 360 CO 0.23 -2.04 1.84 -1.35 0.00 0.00 0.00 175.76 174.44 3m6x h PRO 361 N 6.96 0.29 -2.03 0.00 0.11 -1.82 -3.36 132.00 132.14 3m6x h PRO 361 Ca -0.01 -0.02 -0.30 0.00 0.11 0.00 0.00 66.00 65.79 3m6x h PRO 361 Cb 0.95 -0.07 -0.32 0.00 0.11 0.00 0.00 31.00 31.67 3m6x h PRO 361 CO 0.42 0.19 -0.62 0.00 -0.21 0.00 0.00 178.00 177.79 3m6x s ALA 362 N -5.32 -0.63 0.52 -0.75 0.00 -1.06 -4.69 121.76 109.83 3m6x s ALA 362 Ca -0.07 -0.24 0.38 0.00 0.00 0.00 0.00 51.96 52.02 3m6x s ALA 362 Cb 0.23 -1.89 2.01 0.00 0.00 0.00 0.00 23.12 23.48 3m6x s ALA 362 CO 0.78 -1.75 2.25 -1.35 0.00 0.00 0.00 175.76 175.69 3m6x h PRO 363 N 8.15 0.00 0.00 0.00 0.11 -1.80 0.33 132.00 138.79 3m6x h PRO 363 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 3m6x h PRO 363 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3m6x h PRO 363 CO 0.31 0.02 0.00 0.41 -0.21 0.00 0.00 178.00 178.53 3m6x n GLY 364 N -0.88 1.56 3.68 -0.55 0.00 -1.25 -4.47 105.19 103.28 3m6x n GLY 364 Ca -0.02 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.90 3m6x n GLY 364 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3m6x s LEU 365 N 0.00 4.39 -0.26 0.99 2.96 -0.48 -4.69 118.68 121.59 3m6x s LEU 365 Ca 0.00 2.60 -0.29 0.00 -0.22 0.00 0.00 54.13 56.22 3m6x s LEU 365 Cb 0.00 -3.55 -0.00 0.00 0.50 0.00 0.00 46.19 43.13 3m6x s LEU 365 CO 0.00 -0.97 1.29 -0.47 -1.32 0.00 0.00 176.35 174.89 3m6x s TYR 366 N 3.20 2.73 -0.07 5.38 5.04 -1.26 -0.33 117.35 132.04 3m6x s TYR 366 Ca 0.79 0.91 0.00 0.00 -2.44 0.00 0.00 57.07 56.34 3m6x s TYR 366 Cb -0.42 -3.78 -0.26 0.00 0.35 0.00 0.00 41.96 37.86 3m6x s TYR 366 CO 0.35 -1.72 0.57 -0.07 -1.34 0.00 0.00 175.55 173.34 3m6x h LEU 367 N 10.53 0.29 0.00 6.97 3.38 -1.37 -3.22 115.31 131.89 3m6x h LEU 367 Ca -0.26 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.14 3m6x h LEU 367 Cb 1.10 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.76 3m6x h LEU 367 CO 1.01 1.50 0.00 0.61 0.09 0.00 0.00 178.44 181.66 3m6x n GLY 368 N 1.79 0.34 3.16 0.83 0.00 -1.22 -0.74 105.19 109.34 3m6x n GLY 368 Ca -0.24 -1.68 -0.28 0.00 0.00 0.00 0.00 46.02 43.82 3m6x n GLY 368 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3m6x s LYS 369 N -2.00 2.10 -0.16 1.61 2.20 0.13 -0.98 119.74 122.63 3m6x s LYS 369 Ca 0.00 -0.68 -0.22 0.00 -0.36 0.00 0.00 55.97 54.70 3m6x s LYS 369 Cb 0.00 -1.76 -0.03 0.00 -1.51 0.00 0.00 37.83 34.53 3m6x s LYS 369 CO 0.00 0.24 0.68 0.08 -0.36 0.00 0.00 175.35 175.99 3m6x s VAL 370 N 0.10 5.00 -0.22 4.02 1.01 0.10 0.00 120.40 130.42 3m6x s VAL 370 Ca -0.07 1.32 -0.04 0.00 0.00 0.00 0.00 61.98 63.19 3m6x s VAL 370 Cb -0.13 -4.00 0.08 0.00 0.00 0.00 0.00 36.38 32.33 3m6x s VAL 370 CO 0.04 0.13 0.14 -1.58 0.00 0.00 0.00 175.10 173.83 3m6x s GLN 371 N 1.67 0.14 -1.22 2.72 0.74 0.11 -4.73 119.66 119.09 3m6x s GLN 371 Ca 0.32 -0.16 -0.10 0.00 0.05 0.00 0.00 55.36 55.48 3m6x s GLN 371 Cb -0.16 -1.42 -0.01 0.00 1.10 0.00 0.00 33.01 32.51 3m6x s GLN 371 CO 0.12 -0.80 0.73 1.63 -0.55 0.00 0.00 175.29 176.42 3m6x n LYS 372 N 5.28 -2.77 -0.87 1.67 5.02 -1.26 -1.84 118.16 123.39 3m6x n LYS 372 Ca -0.06 0.55 0.00 0.00 -2.02 0.00 0.00 58.31 56.78 3m6x n LYS 372 Cb 0.47 -4.71 0.00 0.00 -0.02 0.00 0.00 35.03 30.77 3m6x n LYS 372 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3m6x n GLY 373 N -1.64 0.97 3.51 0.72 0.00 -1.26 -5.00 105.19 102.49 3m6x n GLY 373 Ca -0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 3m6x n GLY 373 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3m6x s ARG 374 N -0.13 1.96 -0.21 1.61 1.81 -0.77 -4.59 118.95 118.63 3m6x s ARG 374 Ca 0.00 -1.08 -0.06 0.00 -1.72 0.00 0.00 55.73 52.87 3m6x s ARG 374 Cb 0.00 -2.19 -0.03 0.00 -0.45 0.00 0.00 34.95 32.28 3m6x s ARG 374 CO 0.00 0.50 0.03 0.12 -0.68 0.00 0.00 175.30 175.27 3m6x s PHE 375 N -1.11 3.08 -0.47 -0.53 5.36 -1.26 0.04 117.98 123.10 3m6x s PHE 375 Ca 0.18 -0.34 -0.13 0.00 -0.96 0.00 0.00 56.93 55.68 3m6x s PHE 375 Cb -0.11 -2.11 0.09 0.00 -0.34 0.00 0.00 43.02 40.55 3m6x s PHE 375 CO 0.10 -0.18 0.36 -0.51 -1.46 0.00 0.00 175.22 173.53 3m6x s LEU 376 N 0.99 5.57 0.63 6.12 1.43 0.10 -4.95 118.68 128.56 3m6x s LEU 376 Ca 0.02 -1.54 -0.17 0.00 -1.03 0.00 0.00 54.13 51.42 3m6x s LEU 376 Cb -0.14 -2.10 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 3m6x s LEU 376 CO 0.02 -0.65 1.14 -2.16 0.23 0.00 0.00 176.35 174.93 3m6x s PRO 377 N 1.53 2.90 0.24 1.29 0.04 -1.26 -0.70 135.00 139.04 3m6x s PRO 377 Ca 0.04 1.56 -0.11 0.00 0.04 0.00 0.00 61.00 62.53 3m6x s PRO 377 Cb -0.25 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.27 3m6x s PRO 377 CO 0.04 -1.21 0.59 0.00 0.04 0.00 0.00 177.00 176.46 3m6x s ALA 378 N -2.03 3.52 0.34 8.56 0.00 0.08 -1.44 121.76 130.79 3m6x s ALA 378 Ca 0.71 -0.20 0.04 0.00 0.00 0.00 0.00 51.96 52.51 3m6x s ALA 378 Cb -0.24 -2.51 0.67 0.00 0.00 0.00 0.00 23.12 21.04 3m6x s ALA 378 CO 0.37 0.47 1.95 -0.09 0.00 0.00 0.00 175.76 178.46 3m6x h ARG 379 N 2.56 0.82 -0.69 0.00 2.43 -1.38 -2.10 114.38 116.01 3m6x h ARG 379 Ca -0.47 -0.05 0.04 0.00 -0.81 0.00 0.00 59.98 58.69 3m6x h ARG 379 Cb 1.17 -0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 30.50 3m6x h ARG 379 CO 0.68 0.54 0.45 0.00 -1.51 0.00 0.00 179.97 180.13 3m6x h ALA 380 N 1.58 1.64 -0.36 2.80 0.00 -1.79 -1.23 119.26 121.90 3m6x h ALA 380 Ca 0.32 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 3m6x h ALA 380 Cb 0.21 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3m6x h ALA 380 CO -0.11 0.29 -0.12 1.25 0.00 0.00 0.00 179.25 180.56 3m6x h LEU 381 N 0.80 0.72 -0.50 0.00 5.85 -1.39 -2.52 115.31 118.28 3m6x h LEU 381 Ca 0.28 -0.38 0.04 0.00 0.84 0.00 0.00 57.88 58.65 3m6x h LEU 381 Cb 0.10 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 3m6x h LEU 381 CO -0.08 0.94 0.27 0.00 -0.34 0.00 0.00 178.44 179.23 3m6x h ALA 382 N 0.81 0.64 0.00 1.25 0.00 -1.08 -1.95 119.26 118.92 3m6x h ALA 382 Ca 0.09 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3m6x h ALA 382 Cb 0.64 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3m6x h ALA 382 CO 0.04 -0.07 0.00 -0.07 0.00 0.00 0.00 179.25 179.16 3m6x h LEU 383 N 0.53 0.00 -0.29 0.00 -0.00 -1.13 -2.13 115.31 112.29 3m6x h LEU 383 Ca 0.21 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 58.06 3m6x h LEU 383 Cb 0.10 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.75 3m6x h LEU 383 CO -0.13 0.00 -0.16 0.00 -0.00 0.00 0.00 178.44 178.15 3m6x h ALA 384 N 2.08 0.92 -2.52 1.53 0.00 -0.91 -3.38 119.26 116.98 3m6x h ALA 384 Ca 0.00 -0.14 -0.53 0.00 0.00 0.00 0.00 54.91 54.24 3m6x h ALA 384 Cb 0.37 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.17 3m6x h ALA 384 CO 0.00 0.19 0.96 -0.06 0.00 0.00 0.00 179.25 180.34 3m6x s PHE 385 N -3.25 2.68 0.00 0.00 0.08 -0.80 -1.38 117.98 115.31 3m6x s PHE 385 Ca 0.05 0.42 0.00 0.00 0.12 0.00 0.00 56.93 57.52 3m6x s PHE 385 Cb 0.07 -3.97 0.00 0.00 -0.57 0.00 0.00 43.02 38.55 3m6x s PHE 385 CO 0.67 -3.77 0.00 0.41 -0.10 0.00 0.00 175.22 172.44 3m6x n GLY 386 N 3.91 1.75 0.50 4.36 0.00 0.07 -4.61 105.19 111.18 3m6x n GLY 386 Ca 0.15 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.13 3m6x n GLY 386 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m6x n ALA 387 N -0.21 1.73 -0.05 4.61 0.00 -0.48 -4.66 120.51 121.45 3m6x n ALA 387 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.03 3m6x n ALA 387 Cb 0.00 0.11 0.00 0.00 0.00 0.00 0.00 19.45 19.56 3m6x n ALA 387 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3m6x n THR 388 N -3.81 0.00 -4.32 0.00 -2.24 -0.55 -4.80 114.28 98.55 3m6x n THR 388 Ca -0.07 -0.35 -0.23 0.00 -2.27 0.00 0.00 64.05 61.14 3m6x n THR 388 Cb 0.25 1.05 -0.12 0.00 -2.10 0.00 0.00 70.33 69.41 3m6x n THR 388 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3m6x s LEU 389 N -1.17 2.40 0.73 3.22 1.43 -0.72 -5.04 118.68 119.53 3m6x s LEU 389 Ca 0.00 -0.82 -0.13 0.00 -1.03 0.00 0.00 54.13 52.15 3m6x s LEU 389 Cb 0.00 -0.86 0.03 0.00 0.03 0.00 0.00 46.19 45.40 3m6x s LEU 389 CO 0.00 -0.01 1.11 -2.16 0.23 0.00 0.00 176.35 175.53 3m6x s PRO 390 N -2.57 2.42 0.39 1.29 0.04 -1.26 -0.75 135.00 134.57 3m6x s PRO 390 Ca 0.14 1.34 -0.25 0.00 0.04 0.00 0.00 61.00 62.26 3m6x s PRO 390 Cb -0.07 -1.91 -0.09 0.00 0.04 0.00 0.00 34.50 32.48 3m6x s PRO 390 CO 0.06 -1.54 1.13 -1.58 0.04 0.00 0.00 177.00 175.11 3m6x s TRP 391 N -2.56 3.17 -0.82 0.56 0.52 -1.26 -4.59 118.94 113.96 3m6x s TRP 391 Ca 0.65 1.60 -0.26 0.00 0.02 0.00 0.00 56.10 58.11 3m6x s TRP 391 Cb -0.20 -3.30 0.03 0.00 -1.15 0.00 0.00 33.47 28.85 3m6x s TRP 391 CO 0.49 -1.04 1.37 -1.25 0.02 0.00 0.00 176.95 176.54 3m6x s PRO 392 N -2.28 3.28 0.04 4.98 0.04 -1.26 -4.88 135.00 134.92 3m6x s PRO 392 Ca 0.56 -0.48 0.19 0.00 0.04 0.00 0.00 61.00 61.31 3m6x s PRO 392 Cb -0.28 -4.57 0.79 0.00 0.04 0.00 0.00 34.50 30.48 3m6x s PRO 392 CO 0.35 -2.22 1.60 0.39 0.04 0.00 0.00 177.00 177.16 3m6x n GLU 393 N 9.21 0.03 0.04 4.56 -0.58 -1.09 -2.92 120.64 129.89 3m6x n GLU 393 Ca 0.14 0.22 0.12 0.00 -0.42 0.00 0.00 57.16 57.22 3m6x n GLU 393 Cb 0.50 -1.56 0.25 0.00 -0.57 0.00 0.00 31.44 30.06 3m6x n GLU 393 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3m6x n GLY 394 N 0.34 -1.39 3.87 0.62 0.00 0.23 -4.89 105.19 103.98 3m6x n GLY 394 Ca 0.04 -0.25 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 3m6x n GLY 394 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m6x s LEU 395 N -3.78 4.39 0.39 0.99 1.43 -1.15 -4.71 118.68 116.24 3m6x s LEU 395 Ca 0.09 0.62 -0.27 0.00 -1.03 0.00 0.00 54.13 53.53 3m6x s LEU 395 Cb 0.15 -2.54 -0.11 0.00 0.03 0.00 0.00 46.19 43.72 3m6x s LEU 395 CO 0.69 0.30 1.36 -2.65 0.23 0.00 0.00 176.35 176.27 3m6x n PRO 396 N 1.41 2.25 -4.01 1.29 -0.02 -1.26 -4.77 135.00 129.89 3m6x n PRO 396 Ca -0.13 0.79 -0.34 0.00 -2.02 0.00 0.00 63.50 61.80 3m6x n PRO 396 Cb 0.53 -2.48 -0.15 0.00 -0.02 0.00 0.00 33.50 31.39 3m6x n PRO 396 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3m6x s ARG 397 N -2.10 3.18 -0.16 -0.52 3.52 -1.26 -0.76 118.95 120.85 3m6x s ARG 397 Ca 0.57 -0.73 -0.02 0.00 -0.13 0.00 0.00 55.73 55.42 3m6x s ARG 397 Cb -0.51 -2.79 -0.01 0.00 -1.56 0.00 0.00 34.95 30.07 3m6x s ARG 397 CO 0.61 -0.20 -0.09 -0.51 -0.81 0.00 0.00 175.30 174.30 3m6x s LEU 398 N 1.39 2.85 -0.10 -0.88 1.43 -0.11 -4.98 118.68 118.27 3m6x s LEU 398 Ca 0.05 -0.32 -0.03 0.00 -1.03 0.00 0.00 54.13 52.80 3m6x s LEU 398 Cb -0.14 -1.68 -0.04 0.00 0.03 0.00 0.00 46.19 44.37 3m6x s LEU 398 CO -0.08 0.10 0.04 0.00 0.23 0.00 0.00 176.35 176.64 3m6x s ALA 399 N 0.73 3.44 0.10 4.21 0.00 -1.26 -0.30 121.76 128.68 3m6x s ALA 399 Ca -0.04 -0.76 0.08 0.00 0.00 0.00 0.00 51.96 51.24 3m6x s ALA 399 Cb -0.15 -1.63 -0.03 0.00 0.00 0.00 0.00 23.12 21.31 3m6x s ALA 399 CO 0.02 0.57 -0.21 -0.51 0.00 0.00 0.00 175.76 175.63 3m6x s LEU 400 N -0.84 2.30 0.27 0.00 1.43 -0.17 -4.95 118.68 116.72 3m6x s LEU 400 Ca 0.13 -0.68 -0.02 0.00 -1.03 0.00 0.00 54.13 52.53 3m6x s LEU 400 Cb -0.12 -0.91 -0.04 0.00 0.03 0.00 0.00 46.19 45.15 3m6x s LEU 400 CO 0.03 0.07 0.49 0.42 0.23 0.00 0.00 176.35 177.58 3m6x s THR 401 N -1.14 5.12 0.39 5.49 -4.23 -1.26 -0.82 115.64 119.18 3m6x s THR 401 Ca 0.07 -0.26 0.06 0.00 -1.18 0.00 0.00 61.69 60.37 3m6x s THR 401 Cb -0.10 -3.77 0.27 0.00 1.34 0.00 0.00 72.50 70.24 3m6x s THR 401 CO 0.04 -0.33 2.03 -0.65 -0.54 0.00 0.00 174.62 175.18 3m6x h PRO 402 N 1.54 0.65 0.00 3.99 0.11 -1.97 -2.51 132.00 133.82 3m6x h PRO 402 Ca -0.48 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.54 3m6x h PRO 402 Cb 1.20 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 3m6x h PRO 402 CO 0.65 0.43 -0.23 0.93 -0.21 0.00 0.00 178.00 179.57 3m6x h GLU 403 N 0.67 0.00 -6.20 1.05 3.07 -1.95 -3.43 114.58 107.78 3m6x h GLU 403 Ca 0.20 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.50 3m6x h GLU 403 Cb -0.03 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.86 3m6x h GLU 403 CO -0.05 0.23 0.98 0.34 -1.40 0.00 0.00 179.01 179.11 3m6x s ASP 404 N -6.21 6.83 0.40 1.42 -1.08 -0.95 -4.89 116.67 112.19 3m6x s ASP 404 Ca 0.03 1.93 0.28 0.00 -0.52 0.00 0.00 52.55 54.27 3m6x s ASP 404 Cb 0.08 -2.54 1.38 0.00 -1.46 0.00 0.00 42.92 40.38 3m6x s ASP 404 CO 0.66 -0.83 1.85 1.55 0.52 0.00 0.00 175.17 178.92 3m6x h PRO 405 N 8.75 0.00 -0.04 4.34 0.13 -1.86 -0.71 132.00 142.61 3m6x h PRO 405 Ca -0.32 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.82 3m6x h PRO 405 Cb 1.14 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 3m6x h PRO 405 CO 0.96 0.00 0.03 0.00 -0.23 0.00 0.00 178.00 178.76 3m6x h ARG 406 N 0.00 0.02 0.19 0.86 3.08 -1.91 -2.61 114.38 114.01 3m6x h ARG 406 Ca 0.00 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3m6x h ARG 406 Cb 0.16 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 3m6x h ARG 406 CO 0.00 0.01 -0.09 0.00 -1.07 0.00 0.00 179.97 178.82 3m6x h ALA 407 N 1.98 -0.26 -0.72 0.04 0.00 -1.36 0.16 119.26 119.11 3m6x h ALA 407 Ca 0.02 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 3m6x h ALA 407 Cb 0.05 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3m6x h ALA 407 CO -0.00 -0.60 0.26 1.25 0.00 0.00 0.00 179.25 180.16 3m6x h LEU 408 N -0.35 1.02 0.15 0.00 5.85 -1.68 -0.63 115.31 119.68 3m6x h LEU 408 Ca -0.03 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 3m6x h LEU 408 Cb 0.27 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.03 3m6x h LEU 408 CO 0.04 0.94 -0.07 0.00 -0.34 0.00 0.00 178.44 179.01 3m6x h ALA 409 N 1.12 -0.20 -0.69 1.25 0.00 -1.32 -1.75 119.26 117.67 3m6x h ALA 409 Ca 0.24 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3m6x h ALA 409 Cb 0.26 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 3m6x h ALA 409 CO -0.01 -0.57 0.43 0.35 0.00 0.00 0.00 179.25 179.45 3m6x h PHE 410 N -0.29 0.80 0.00 0.00 3.57 -0.87 -0.45 116.94 119.70 3m6x h PHE 410 Ca -0.02 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3m6x h PHE 410 Cb 0.23 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.71 3m6x h PHE 410 CO -0.04 0.45 0.00 0.00 -2.23 0.00 0.00 178.31 176.49 3m6x h ALA 411 N 1.30 1.00 -0.36 2.41 0.00 -0.90 -2.33 119.26 120.38 3m6x h ALA 411 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3m6x h ALA 411 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3m6x h ALA 411 CO -0.11 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.39 3m6x n THR 412 N -2.76 1.77 0.00 0.00 -2.24 -0.68 -4.97 114.28 105.40 3m6x n THR 412 Ca 0.01 -1.44 0.00 0.00 -2.27 0.00 0.00 64.05 60.35 3m6x n THR 412 Cb 0.24 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 3m6x n THR 412 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3m6x n GLY 413 N 0.16 0.62 3.85 3.38 0.00 -0.88 -5.04 105.19 107.29 3m6x n GLY 413 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 3m6x n GLY 413 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m6x s GLU 414 N -0.77 3.87 0.36 1.61 2.02 -0.23 -4.76 118.70 120.81 3m6x s GLU 414 Ca 0.00 0.34 -0.26 0.00 0.02 0.00 0.00 54.97 55.07 3m6x s GLU 414 Cb 0.00 -2.98 -0.09 0.00 0.10 0.00 0.00 34.13 31.16 3m6x s GLU 414 CO 0.00 0.53 1.09 0.20 0.02 0.00 0.00 175.26 177.09 3m6x s GLY 415 N -1.70 2.86 0.14 -1.39 0.00 -1.26 -3.76 107.32 102.20 3m6x s GLY 415 Ca 0.35 0.81 0.06 0.00 0.00 0.00 0.00 44.72 45.94 3m6x s GLY 415 CO 0.18 1.31 -0.14 -1.34 0.00 0.00 0.00 173.10 173.11 3m6x s VAL 416 N -1.46 1.42 0.46 1.40 -7.23 -0.22 -4.93 120.40 109.85 3m6x s VAL 416 Ca 0.54 -1.82 -0.24 0.00 -1.81 0.00 0.00 61.98 58.65 3m6x s VAL 416 Cb -0.27 -1.65 -0.07 0.00 0.56 0.00 0.00 36.38 34.95 3m6x s VAL 416 CO 0.34 -0.45 1.32 0.00 -0.31 0.00 0.00 175.10 176.00 3m6x s ALA 417 N -2.30 3.08 -0.03 1.32 0.00 -1.26 -0.40 121.76 122.16 3m6x s ALA 417 Ca 0.12 1.25 -0.01 0.00 0.00 0.00 0.00 51.96 53.32 3m6x s ALA 417 Cb -0.04 -3.51 0.03 0.00 0.00 0.00 0.00 23.12 19.60 3m6x s ALA 417 CO 0.04 -1.02 0.04 -0.46 0.00 0.00 0.00 175.76 174.36 3m6x s TRP 418 N -1.31 0.11 -1.80 0.00 -0.11 0.20 -4.70 118.94 111.33 3m6x s TRP 418 Ca 0.63 0.16 0.20 0.00 1.22 0.00 0.00 56.10 58.31 3m6x s TRP 418 Cb -0.38 -0.41 0.54 0.00 -1.50 0.00 0.00 33.47 31.73 3m6x s TRP 418 CO 0.47 -0.16 1.45 0.39 -4.62 0.00 0.00 176.95 174.49 3m6x n GLU 419 N 4.77 2.70 -0.13 5.86 4.71 -1.26 -4.26 120.64 133.03 3m6x n GLU 419 Ca -0.15 -2.47 0.00 0.00 -0.01 0.00 0.00 57.16 54.53 3m6x n GLU 419 Cb 0.50 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.43 3m6x n GLU 419 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3m6x n GLY 420 N 1.38 1.07 3.89 0.62 0.00 -1.26 -5.10 105.19 105.80 3m6x n GLY 420 Ca 0.21 -1.93 -0.29 0.00 0.00 0.00 0.00 46.02 44.01 3m6x n GLY 420 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m6x s GLU 421 N 1.28 3.35 0.49 1.61 0.41 -1.26 -4.87 118.70 119.71 3m6x s GLU 421 Ca 0.00 0.43 -0.23 0.00 -0.41 0.00 0.00 54.97 54.76 3m6x s GLU 421 Cb 0.00 -2.18 -0.06 0.00 -1.78 0.00 0.00 34.13 30.10 3m6x s GLU 421 CO 0.00 -0.57 1.28 -0.51 -0.49 0.00 0.00 175.26 174.98 3m6x s ASP 422 N -4.21 5.75 -0.20 -0.19 1.01 -1.26 -4.83 116.67 112.74 3m6x s ASP 422 Ca 0.53 2.59 -0.04 0.00 0.71 0.00 0.00 52.55 56.35 3m6x s ASP 422 Cb -0.11 -2.62 0.10 0.00 1.01 0.00 0.00 42.92 41.30 3m6x s ASP 422 CO 0.50 -1.23 0.29 -1.00 0.21 0.00 0.00 175.17 173.93 3m6x s HIS 423 N -1.38 -0.50 0.33 4.23 3.76 0.35 -4.95 115.29 117.13 3m6x s HIS 423 Ca 0.66 0.63 0.03 0.00 -0.15 0.00 0.00 55.06 56.23 3m6x s HIS 423 Cb -0.36 -0.14 0.62 0.00 1.11 0.00 0.00 32.58 33.81 3m6x s HIS 423 CO 0.44 -0.58 1.93 -1.35 -0.85 0.00 0.00 174.74 174.33 3m6x h PRO 424 N 8.26 0.89 -2.76 8.40 0.11 -1.90 -0.57 132.00 144.42 3m6x h PRO 424 Ca -0.17 -0.05 -0.17 0.00 0.11 0.00 0.00 66.00 65.71 3m6x h PRO 424 Cb 1.14 -0.20 -0.30 0.00 0.11 0.00 0.00 31.00 31.75 3m6x h PRO 424 CO 0.24 0.59 -0.46 -1.17 -0.21 0.00 0.00 178.00 176.99 3m6x s LEU 425 N -9.87 -0.30 0.10 2.35 2.96 -1.26 -4.55 118.68 108.11 3m6x s LEU 425 Ca -0.11 0.72 0.02 0.00 -0.22 0.00 0.00 54.13 54.55 3m6x s LEU 425 Cb 0.20 0.94 -0.04 0.00 0.50 0.00 0.00 46.19 47.79 3m6x s LEU 425 CO 0.79 -0.22 -0.07 0.00 -1.32 0.00 0.00 176.35 175.52 3m6x s ALA 426 N 2.25 0.98 -0.26 5.97 0.00 0.15 -4.31 121.76 126.54 3m6x s ALA 426 Ca -0.02 -1.30 -0.12 0.00 0.00 0.00 0.00 51.96 50.53 3m6x s ALA 426 Cb -0.11 0.14 -0.05 0.00 0.00 0.00 0.00 23.12 23.09 3m6x s ALA 426 CO -0.10 -0.20 0.22 -1.17 0.00 0.00 0.00 175.76 174.51 3m6x s LEU 427 N -2.90 4.06 -0.18 0.00 2.96 0.06 -0.45 118.68 122.23 3m6x s LEU 427 Ca 0.10 0.09 -0.13 0.00 -0.22 0.00 0.00 54.13 53.97 3m6x s LEU 427 Cb 0.03 -2.18 -0.05 0.00 0.50 0.00 0.00 46.19 44.50 3m6x s LEU 427 CO -0.04 -0.03 0.27 -0.69 -1.32 0.00 0.00 176.35 174.53 3m6x s VAL 428 N 1.57 5.32 0.20 1.68 1.01 -0.15 -0.93 120.40 129.10 3m6x s VAL 428 Ca 0.09 0.48 0.08 0.00 0.00 0.00 0.00 61.98 62.63 3m6x s VAL 428 Cb -0.15 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 3m6x s VAL 428 CO 0.09 0.38 -0.16 0.68 0.00 0.00 0.00 175.10 176.09 3m6x s VAL 429 N 0.57 1.81 -0.23 2.92 -7.23 0.59 -0.61 120.40 118.22 3m6x s VAL 429 Ca 0.15 -2.14 -0.15 0.00 -1.81 0.00 0.00 61.98 58.03 3m6x s VAL 429 Cb -0.13 -2.00 -0.04 0.00 0.56 0.00 0.00 36.38 34.77 3m6x s VAL 429 CO 0.03 -0.51 0.37 -0.22 -0.31 0.00 0.00 175.10 174.46 3m6x s LEU 430 N -3.15 4.11 -0.24 1.32 2.96 0.15 -1.00 118.68 122.83 3m6x s LEU 430 Ca 0.21 0.40 -0.14 0.00 -0.22 0.00 0.00 54.13 54.38 3m6x s LEU 430 Cb -0.02 -2.44 -0.04 0.00 0.50 0.00 0.00 46.19 44.18 3m6x s LEU 430 CO 0.07 -0.10 0.32 -0.75 -1.32 0.00 0.00 176.35 174.57 3m6x s LYS 431 N 1.56 4.08 0.27 1.98 2.20 0.00 -1.11 119.74 128.73 3m6x s LYS 431 Ca 0.16 0.01 0.02 0.00 -0.36 0.00 0.00 55.97 55.80 3m6x s LYS 431 Cb -0.15 -3.59 -0.05 0.00 -1.51 0.00 0.00 37.83 32.54 3m6x s LYS 431 CO 0.08 -0.11 0.12 0.95 -0.36 0.00 0.00 175.35 176.03 3m6x s THR 432 N 1.55 0.48 -0.49 3.43 -4.23 -0.62 -4.38 115.64 111.38 3m6x s THR 432 Ca 0.14 -2.00 0.23 0.00 -1.18 0.00 0.00 61.69 58.89 3m6x s THR 432 Cb -0.15 -2.59 0.24 0.00 1.34 0.00 0.00 72.50 71.34 3m6x s THR 432 CO 0.08 0.00 1.70 0.00 -0.54 0.00 0.00 174.62 175.86 3m6x n ALA 433 N -0.50 1.65 0.81 3.99 0.00 -1.26 -1.60 120.51 123.59 3m6x n ALA 433 Ca 0.00 0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.64 3m6x n ALA 433 Cb 0.66 -1.38 0.29 0.00 0.00 0.00 0.00 19.45 19.01 3m6x n ALA 433 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m6x n ALA 434 N -1.77 2.47 0.00 0.00 0.00 -1.26 -5.06 120.51 114.89 3m6x n ALA 434 Ca 0.02 -0.74 0.00 0.00 0.00 0.00 0.00 53.44 52.72 3m6x n ALA 434 Cb 0.22 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.70 3m6x n ALA 434 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m6x n GLY 435 N 1.31 -0.07 3.81 0.00 0.00 -0.63 -5.04 105.19 104.57 3m6x n GLY 435 Ca 0.17 -2.28 -0.37 0.00 0.00 0.00 0.00 46.02 43.55 3m6x n GLY 435 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3m6x s GLU 436 N -0.55 3.85 -0.06 1.61 2.02 -1.26 -1.58 118.70 122.72 3m6x s GLU 436 Ca 0.00 0.04 0.03 0.00 0.02 0.00 0.00 54.97 55.06 3m6x s GLU 436 Cb 0.00 -3.29 0.01 0.00 0.10 0.00 0.00 34.13 30.95 3m6x s GLU 436 CO 0.00 0.56 -0.14 -0.06 0.02 0.00 0.00 175.26 175.64 3m6x s PHE 437 N -0.48 1.59 0.51 1.61 0.08 -0.27 -4.93 117.98 116.09 3m6x s PHE 437 Ca 0.16 -0.56 -0.22 0.00 0.12 0.00 0.00 56.93 56.44 3m6x s PHE 437 Cb -0.13 -1.13 -0.06 0.00 -0.57 0.00 0.00 43.02 41.13 3m6x s PHE 437 CO 0.05 -0.26 1.22 -1.25 -0.10 0.00 0.00 175.22 174.88 3m6x s PRO 438 N 0.48 3.44 -0.10 0.24 0.04 -1.26 0.31 135.00 138.15 3m6x s PRO 438 Ca -0.12 1.89 -0.01 0.00 0.04 0.00 0.00 61.00 62.80 3m6x s PRO 438 Cb -0.15 -2.26 -0.06 0.00 0.04 0.00 0.00 34.50 32.07 3m6x s PRO 438 CO 0.04 -0.84 -0.10 1.28 0.04 0.00 0.00 177.00 177.42 3m6x n LEU 439 N -0.86 2.52 0.00 -3.56 4.77 0.22 -4.70 117.00 115.39 3m6x n LEU 439 Ca 0.09 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3m6x n LEU 439 Cb 0.48 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 3m6x n LEU 439 CO 0.48 0.57 0.00 -0.67 -1.33 0.00 0.00 177.39 176.44 3m6x n ASP 440 N -2.93 0.00 -4.81 -1.43 -0.08 -1.18 -4.83 116.55 101.29 3m6x n ASP 440 Ca -0.18 0.00 -0.34 0.00 -1.51 0.00 0.00 54.79 52.76 3m6x n ASP 440 Cb 0.67 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 44.08 3m6x n ASP 440 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 3m6x s PHE 441 N -2.00 3.22 0.09 -0.67 0.08 -1.26 -0.97 117.98 116.47 3m6x s PHE 441 Ca 0.00 1.61 0.02 0.00 0.12 0.00 0.00 56.93 58.68 3m6x s PHE 441 Cb 0.00 -2.94 -0.04 0.00 -0.57 0.00 0.00 43.02 39.47 3m6x s PHE 441 CO 0.00 -0.35 -0.07 0.20 -0.10 0.00 0.00 175.22 174.90 3m6x s GLY 442 N -2.06 0.74 -0.11 4.36 0.00 0.40 -1.11 107.32 109.55 3m6x s GLY 442 Ca 0.63 -1.30 0.01 0.00 0.00 0.00 0.00 44.72 44.06 3m6x s GLY 442 CO 0.16 -1.41 -0.13 1.25 0.00 0.00 0.00 173.10 172.98 3m6x s LYS 443 N -3.68 1.99 -0.21 2.90 2.20 -0.24 -0.67 119.74 122.03 3m6x s LYS 443 Ca 0.10 -0.46 -0.06 0.00 -0.36 0.00 0.00 55.97 55.19 3m6x s LYS 443 Cb 0.04 -1.79 -0.03 0.00 -1.51 0.00 0.00 37.83 34.55 3m6x s LYS 443 CO -0.05 -0.14 0.03 0.00 -0.36 0.00 0.00 175.35 174.84 3m6x s ALA 444 N 1.22 3.15 -0.18 3.13 0.00 -0.22 -1.30 121.76 127.56 3m6x s ALA 444 Ca -0.03 -0.97 -0.10 0.00 0.00 0.00 0.00 51.96 50.87 3m6x s ALA 444 Cb -0.14 -1.88 0.06 0.00 0.00 0.00 0.00 23.12 21.16 3m6x s ALA 444 CO -0.04 -0.15 0.43 0.21 0.00 0.00 0.00 175.76 176.20 3m6x s LYS 445 N 1.00 0.41 -1.54 0.00 2.47 -0.39 -0.49 119.74 121.20 3m6x s LYS 445 Ca 0.03 0.84 -0.08 0.00 -1.56 0.00 0.00 55.97 55.20 3m6x s LYS 445 Cb -0.14 0.02 0.07 0.00 -1.46 0.00 0.00 37.83 36.32 3m6x s LYS 445 CO 0.02 -0.17 0.58 0.54 0.16 0.00 0.00 175.35 176.49 3m6x n ARG 446 N 4.36 -3.26 -0.87 4.03 1.74 -1.26 -1.72 116.66 119.68 3m6x n ARG 446 Ca -0.22 0.39 0.00 0.00 -0.77 0.00 0.00 57.85 57.25 3m6x n ARG 446 Cb 0.55 -4.77 0.00 0.00 -1.02 0.00 0.00 32.46 27.22 3m6x n ARG 446 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3m6x n GLY 447 N -1.76 0.58 3.09 -0.13 0.00 -1.26 -5.02 105.19 100.69 3m6x n GLY 447 Ca -0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 3m6x n GLY 447 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m6x s VAL 448 N -2.06 1.45 -0.27 1.61 1.01 -0.70 -0.63 120.40 120.81 3m6x s VAL 448 Ca 0.00 -0.66 -0.07 0.00 0.00 0.00 0.00 61.98 61.24 3m6x s VAL 448 Cb 0.00 -1.29 -0.01 0.00 0.00 0.00 0.00 36.38 35.08 3m6x s VAL 448 CO 0.00 0.42 0.07 -0.22 0.00 0.00 0.00 175.10 175.38 3m6x s LEU 449 N 0.53 3.65 -0.01 3.92 2.96 0.46 -1.26 118.68 128.94 3m6x s LEU 449 Ca -0.16 -0.48 0.06 0.00 -0.22 0.00 0.00 54.13 53.33 3m6x s LEU 449 Cb -0.16 -1.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 3m6x s LEU 449 CO 0.05 -0.12 -0.18 -0.13 -1.32 0.00 0.00 176.35 174.65 3m6x s ARG 450 N 1.55 2.24 0.10 1.98 0.52 -0.42 -1.05 118.95 123.87 3m6x s ARG 450 Ca 0.04 -0.87 -0.30 0.00 -0.52 0.00 0.00 55.73 54.09 3m6x s ARG 450 Cb -0.16 -2.22 -0.06 0.00 0.52 0.00 0.00 34.95 33.02 3m6x s ARG 450 CO 0.03 0.58 1.10 -1.25 0.02 0.00 0.00 175.30 175.78 3m6x s PRO 451 N -1.00 4.54 0.00 3.54 0.04 -1.26 -1.07 135.00 139.79 3m6x s PRO 451 Ca 0.12 1.67 0.00 0.00 0.04 0.00 0.00 61.00 62.83 3m6x s PRO 451 Cb -0.10 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 31.10 3m6x s PRO 451 CO 0.02 -0.05 0.24 1.33 0.04 0.00 0.00 177.00 178.59 3m6x n VAL 452 N 3.17 0.00 -1.72 -0.36 0.24 -0.26 -4.92 118.33 114.48 3m6x n VAL 452 Ca 0.05 -0.34 -0.43 0.00 -2.04 0.00 0.00 64.34 61.58 3m6x n VAL 452 Cb 0.47 1.22 -0.02 0.00 -1.47 0.00 0.00 33.84 34.04 3m6x n VAL 452 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3m6x n GLY 453 N 0.21 1.31 3.77 7.63 0.00 -1.23 -4.87 105.19 112.01 3m6x n GLY 453 Ca 0.00 0.54 -0.38 0.00 0.00 0.00 0.00 46.02 46.18 3m6x n GLY 453 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3m6x s VAL 454 N 0.46 3.38 0.36 1.61 -7.23 -0.52 -4.25 120.40 114.20 3m6x s VAL 454 Ca 0.70 1.17 -0.15 0.00 -1.81 0.00 0.00 61.98 61.88 3m6x s VAL 454 Cb -0.54 -3.66 -0.09 0.00 0.56 0.00 0.00 36.38 32.65 3m6x s VAL 454 CO 0.42 0.12 0.78 -0.83 -0.31 0.00 0.00 175.10 175.28 3m6x s GLY 455 N -1.20 2.28 -0.39 2.32 0.00 -1.26 -1.33 107.32 107.74 3m6x s GLY 455 Ca 0.55 0.07 -0.26 0.00 0.00 0.00 0.00 44.72 45.08 3m6x s GLY 455 CO 0.36 0.28 0.92 -2.27 0.00 0.00 0.00 173.10 172.40 3m6x s LEU 456 N -3.17 4.00 0.11 0.66 2.96 -1.26 -4.98 118.68 117.00 3m6x s LEU 456 Ca 0.55 0.46 -0.03 0.00 -0.22 0.00 0.00 54.13 54.89 3m6x s LEU 456 Cb -0.10 -3.24 -0.03 0.00 0.50 0.00 0.00 46.19 43.32 3m6x s LEU 456 CO 0.19 -0.90 0.09 -0.13 -1.32 0.00 0.00 176.35 174.27 3m6x s ARG 457 N 3.54 0.87 -0.26 1.98 0.52 -1.26 -4.71 118.95 119.62 3m6x s ARG 457 Ca 0.38 -1.28 -0.27 0.00 -0.52 0.00 0.00 55.73 54.04 3m6x s ARG 457 Cb -0.11 0.27 0.01 0.00 0.52 0.00 0.00 34.95 35.63 3m6x s ARG 457 CO 0.21 -0.25 0.95 0.45 0.02 0.00 0.00 175.30 176.67 3m6x s SER 458 N -2.98 6.92 0.67 0.23 0.15 -1.26 -4.91 113.70 112.52 3m6x s SER 458 Ca 0.16 1.10 0.03 0.00 0.70 0.00 0.00 55.95 57.94 3m6x s SER 458 Cb 0.07 -2.49 0.11 0.00 -1.71 0.00 0.00 66.02 62.00 3m6x s SER 458 CO -0.03 -0.66 0.92 -1.00 1.20 0.00 0.00 173.24 173.67 3m6x s HIS 459 N 3.14 1.57 -0.72 3.44 0.09 -1.26 -5.14 115.29 116.41 3m6x s HIS 459 Ca 0.40 -0.41 0.00 0.00 -0.00 0.00 0.00 55.06 55.05 3m6x s HIS 459 Cb -0.14 -2.74 0.00 0.00 -0.00 0.00 0.00 32.58 29.69 3m6x s HIS 459 CO 0.09 -1.51 0.18 0.72 -0.00 0.00 0.00 174.74 174.23