#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1orb s HIS 2 N 0.00 1.92 0.33 6.34 2.46 -1.26 -4.80 115.29 120.29 1orb s HIS 2 Ca 0.00 -0.88 -0.04 0.00 0.47 0.00 0.00 55.06 54.61 1orb s HIS 2 Cb 0.00 -1.21 0.00 0.00 -0.13 0.00 0.00 32.58 31.25 1orb s HIS 2 CO 0.00 0.08 0.48 -0.65 -2.47 0.00 0.00 174.74 172.18 1orb s GLN 3 N -3.84 1.88 0.11 2.88 1.11 -1.26 -4.77 119.66 115.77 1orb s GLN 3 Ca 0.34 -1.70 -0.15 0.00 0.01 0.00 0.00 55.36 53.86 1orb s GLN 3 Cb 0.07 0.45 -0.05 0.00 -1.01 0.00 0.00 33.01 32.47 1orb s GLN 3 CO 0.14 -0.78 1.50 -0.24 0.01 0.00 0.00 175.29 175.92 1orb h VAL 4 N 2.13 1.28 -2.73 1.09 3.04 -2.02 -3.36 116.25 115.68 1orb h VAL 4 Ca -0.28 -1.22 -0.43 0.00 -1.01 0.00 0.00 66.70 63.76 1orb h VAL 4 Cb 1.24 1.32 -0.39 0.00 -2.01 0.00 0.00 31.29 31.46 1orb h VAL 4 CO 0.39 0.40 -0.72 -0.76 -1.01 0.00 0.00 177.57 175.87 1orb s LEU 5 N -9.22 0.23 0.76 3.16 1.02 -1.26 -5.02 118.68 108.35 1orb s LEU 5 Ca -0.13 -0.76 -0.11 0.00 0.02 0.00 0.00 54.13 53.15 1orb s LEU 5 Cb 0.09 -0.04 0.05 0.00 0.02 0.00 0.00 46.19 46.31 1orb s LEU 5 CO 0.81 -0.38 1.09 -0.47 0.02 0.00 0.00 176.35 177.42 1orb s TYR 6 N 2.20 2.96 -0.64 0.29 5.04 -1.26 -4.94 117.35 121.00 1orb s TYR 6 Ca 0.06 1.19 -0.26 0.00 -2.44 0.00 0.00 57.07 55.62 1orb s TYR 6 Cb -0.16 -3.06 -0.05 0.00 0.35 0.00 0.00 41.96 39.04 1orb s TYR 6 CO -0.22 -1.57 2.09 0.50 -1.34 0.00 0.00 175.55 175.01 1orb s ARG 7 N -5.16 2.36 0.28 4.97 3.52 -1.26 -4.84 118.95 118.81 1orb s ARG 7 Ca 0.60 0.68 0.05 0.00 -0.13 0.00 0.00 55.73 56.93 1orb s ARG 7 Cb -0.14 -4.59 0.40 0.00 -1.56 0.00 0.00 34.95 29.06 1orb s ARG 7 CO 0.54 -3.17 1.67 0.00 -0.81 0.00 0.00 175.30 173.53 1orb h ALA 8 N 15.51 1.04 -3.16 6.12 0.00 -1.92 -3.41 119.26 133.44 1orb h ALA 8 Ca -0.17 -0.42 -0.63 0.00 0.00 0.00 0.00 54.91 53.68 1orb h ALA 8 Cb 1.15 -0.09 -0.35 0.00 0.00 0.00 0.00 17.79 18.50 1orb h ALA 8 CO 1.18 0.61 -0.85 -0.51 0.00 0.00 0.00 179.25 179.68 1orb s LEU 9 N -8.28 1.90 0.30 0.00 1.43 -1.26 -1.93 118.68 110.83 1orb s LEU 9 Ca -0.05 -0.54 0.07 0.00 -1.03 0.00 0.00 54.13 52.58 1orb s LEU 9 Cb 0.13 -1.29 -0.03 0.00 0.03 0.00 0.00 46.19 45.03 1orb s LEU 9 CO 0.78 0.01 0.28 0.68 0.23 0.00 0.00 176.35 178.33 1orb s VAL 10 N 1.15 4.02 0.41 -1.59 -7.23 -1.08 -4.91 120.40 111.16 1orb s VAL 10 Ca -0.01 -1.33 0.08 0.00 -1.81 0.00 0.00 61.98 58.91 1orb s VAL 10 Cb -0.14 -3.32 -0.02 0.00 0.56 0.00 0.00 36.38 33.45 1orb s VAL 10 CO -0.07 -0.25 0.36 -0.94 -0.31 0.00 0.00 175.10 173.90 1orb s SER 11 N -3.95 5.04 0.13 4.85 1.04 -1.26 -1.21 113.70 118.33 1orb s SER 11 Ca 0.38 -0.74 -0.18 0.00 0.48 0.00 0.00 55.95 55.89 1orb s SER 11 Cb -0.07 -0.60 -0.03 0.00 0.10 0.00 0.00 66.02 65.41 1orb s SER 11 CO 0.26 -0.62 1.73 0.71 0.98 0.00 0.00 173.24 176.31 1orb h THR 12 N 1.07 1.12 -0.48 2.02 1.35 -1.96 -1.53 112.91 114.50 1orb h THR 12 Ca -0.42 -0.32 0.10 0.00 -0.55 0.00 0.00 66.41 65.22 1orb h THR 12 Cb 1.26 0.79 -0.09 0.00 -1.73 0.00 0.00 68.15 68.38 1orb h THR 12 CO 0.58 0.13 -0.13 0.50 -0.25 0.00 0.00 175.52 176.35 1orb h LYS 13 N 0.37 -0.01 -0.35 4.72 3.64 -1.97 0.14 116.57 123.12 1orb h LYS 13 Ca 0.11 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.56 1orb h LYS 13 Cb 0.05 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.81 1orb h LYS 13 CO -0.02 -0.00 -0.08 2.35 -2.27 0.00 0.00 179.45 179.43 1orb h TRP 14 N -0.01 -0.17 -0.31 1.91 7.01 -1.87 0.03 115.95 122.54 1orb h TRP 14 Ca 0.23 0.03 -0.04 0.00 2.11 0.00 0.00 58.89 61.22 1orb h TRP 14 Cb 0.36 0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.54 1orb h TRP 14 CO -0.42 -0.14 0.03 1.25 -2.79 0.00 0.00 178.44 176.37 1orb h LEU 15 N 0.01 0.50 0.49 0.65 5.85 -0.67 -2.62 115.31 119.52 1orb h LEU 15 Ca 0.17 -0.28 -0.02 0.00 0.84 0.00 0.00 57.88 58.59 1orb h LEU 15 Cb 0.26 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1orb h LEU 15 CO -0.35 0.65 -0.31 0.00 -0.34 0.00 0.00 178.44 178.09 1orb h ALA 16 N 0.87 -0.76 -0.50 1.25 0.00 -0.38 -2.02 119.26 117.72 1orb h ALA 16 Ca 0.09 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 54.93 1orb h ALA 16 Cb 0.38 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1orb h ALA 16 CO 0.01 -0.94 0.34 0.93 0.00 0.00 0.00 179.25 179.58 1orb h GLU 17 N -0.76 0.32 -0.67 0.00 5.08 -0.99 -0.94 114.58 116.63 1orb h GLU 17 Ca -0.06 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.25 1orb h GLU 17 Cb 0.62 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 1orb h GLU 17 CO 0.05 0.21 0.29 0.77 -1.00 0.00 0.00 179.01 179.34 1orb h SER 18 N 0.33 0.88 0.81 1.42 0.02 -1.00 0.37 113.55 116.39 1orb h SER 18 Ca 0.23 -0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1orb h SER 18 Cb 0.46 -0.23 0.01 0.00 0.14 0.00 0.00 62.40 62.78 1orb h SER 18 CO -0.05 0.77 -0.39 0.58 -1.14 0.00 0.00 176.83 176.60 1orb h VAL 19 N 0.96 0.08 -0.95 2.27 2.07 -0.70 2.07 116.25 122.05 1orb h VAL 19 Ca 0.23 -0.15 0.20 0.00 0.82 0.00 0.00 66.70 67.80 1orb h VAL 19 Cb 0.14 0.10 -0.08 0.00 -1.52 0.00 0.00 31.29 29.94 1orb h VAL 19 CO -0.02 0.01 0.61 0.03 0.02 0.00 0.00 177.57 178.21 1orb h ARG 20 N -1.23 0.51 0.00 1.57 3.08 -0.74 1.57 114.38 119.13 1orb h ARG 20 Ca -0.11 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.91 1orb h ARG 20 Cb 0.85 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.78 1orb h ARG 20 CO 0.18 0.34 0.00 0.00 -1.07 0.00 0.00 179.97 179.42 1orb n ALA 21 N -2.46 2.42 -2.08 0.04 0.00 0.13 -4.79 120.51 113.76 1orb n ALA 21 Ca 0.21 -0.13 -0.08 0.00 0.00 0.00 0.00 53.44 53.44 1orb n ALA 21 Cb 0.67 -1.34 -0.01 0.00 0.00 0.00 0.00 19.45 18.77 1orb n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1orb n GLY 22 N 0.53 0.11 0.11 0.00 0.00 0.53 -4.91 105.19 101.57 1orb n GLY 22 Ca 0.16 -0.57 -0.07 0.00 0.00 0.00 0.00 46.02 45.54 1orb n GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1orb h LYS 23 N 0.00 0.12 -6.32 1.61 1.79 0.33 -3.45 116.57 110.64 1orb h LYS 23 Ca -0.19 -0.14 -0.54 0.00 -2.18 0.00 0.00 60.65 57.61 1orb h LYS 23 Cb 1.09 0.04 0.02 0.00 -1.58 0.00 0.00 32.23 31.80 1orb h LYS 23 CO 0.22 0.93 1.25 0.28 -1.08 0.00 0.00 179.45 181.05 1orb n VAL 24 N -3.59 0.73 -3.27 0.50 0.31 -1.25 -4.31 118.33 107.45 1orb n VAL 24 Ca -0.03 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 1orb n VAL 24 Cb 0.82 -2.31 0.00 0.00 -0.91 0.00 0.00 33.84 31.44 1orb n VAL 24 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1orb n GLY 25 N 4.65 -0.80 0.65 2.92 0.00 0.17 -4.93 105.19 107.84 1orb n GLY 25 Ca 0.21 -0.80 0.47 0.00 0.00 0.00 0.00 46.02 45.90 1orb n GLY 25 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1orb h PRO 26 N 0.00 0.00 0.00 1.61 0.11 -1.87 0.52 132.00 132.36 1orb h PRO 26 Ca 0.00 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.07 1orb h PRO 26 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 1orb h PRO 26 CO 0.00 0.00 -1.15 0.41 -0.21 0.00 0.00 178.00 177.05 1orb n GLY 27 N -1.87 -1.38 2.75 -0.55 0.00 -1.26 -4.24 105.19 98.64 1orb n GLY 27 Ca 0.38 -0.21 -0.19 0.00 0.00 0.00 0.00 46.02 46.00 1orb n GLY 27 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1orb s LEU 28 N -5.44 -0.06 -0.17 0.99 2.96 0.18 0.24 118.68 117.38 1orb s LEU 28 Ca -0.01 -0.19 -0.01 0.00 -0.22 0.00 0.00 54.13 53.70 1orb s LEU 28 Cb 0.09 0.32 -0.00 0.00 0.50 0.00 0.00 46.19 47.10 1orb s LEU 28 CO 0.80 -0.32 -0.13 -0.13 -1.32 0.00 0.00 176.35 175.25 1orb s ARG 29 N 2.31 3.26 -0.11 1.98 1.81 -1.22 0.42 118.95 127.40 1orb s ARG 29 Ca 0.06 -0.72 -0.06 0.00 -1.72 0.00 0.00 55.73 53.29 1orb s ARG 29 Cb -0.15 -2.69 -0.04 0.00 -0.45 0.00 0.00 34.95 31.61 1orb s ARG 29 CO -0.11 -0.01 0.11 0.08 -0.68 0.00 0.00 175.30 174.69 1orb s VAL 30 N 0.91 5.23 -0.00 3.52 1.01 -1.26 -1.55 120.40 128.25 1orb s VAL 30 Ca -0.03 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.06 1orb s VAL 30 Cb -0.15 -3.26 -0.00 0.00 0.00 0.00 0.00 36.38 32.96 1orb s VAL 30 CO -0.01 0.61 -0.04 -0.76 0.00 0.00 0.00 175.10 174.90 1orb s LEU 31 N -1.01 2.02 -0.35 3.92 1.43 0.88 -1.66 118.68 123.90 1orb s LEU 31 Ca 0.15 -0.10 -0.15 0.00 -1.03 0.00 0.00 54.13 52.99 1orb s LEU 31 Cb -0.12 -0.22 -0.01 0.00 0.03 0.00 0.00 46.19 45.88 1orb s LEU 31 CO 0.04 0.04 0.37 -0.62 0.23 0.00 0.00 176.35 176.41 1orb s ASP 32 N -0.18 6.18 -0.34 2.29 -1.08 -0.36 -0.20 116.67 122.97 1orb s ASP 32 Ca 0.01 -0.29 0.06 0.00 -0.52 0.00 0.00 52.55 51.81 1orb s ASP 32 Cb -0.02 -2.20 0.45 0.00 -1.46 0.00 0.00 42.92 39.69 1orb s ASP 32 CO -0.00 -0.36 1.16 0.00 0.52 0.00 0.00 175.17 176.49 1orb n ALA 33 N 5.40 5.02 -1.77 3.66 0.00 0.37 0.14 120.51 133.32 1orb n ALA 33 Ca -0.09 -3.97 -0.38 0.00 0.00 0.00 0.00 53.44 49.01 1orb n ALA 33 Cb 0.49 -0.40 -0.01 0.00 0.00 0.00 0.00 19.45 19.53 1orb n ALA 33 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1orb s SER 34 N -3.58 6.32 -0.17 0.00 0.01 -1.26 -4.58 113.70 110.45 1orb s SER 34 Ca 0.50 2.33 -0.15 0.00 1.31 0.00 0.00 55.95 59.94 1orb s SER 34 Cb 0.41 -2.61 0.05 0.00 0.21 0.00 0.00 66.02 64.08 1orb s SER 34 CO -0.04 -0.81 0.45 0.86 0.41 0.00 0.00 173.24 174.11 1orb s TRP 35 N -1.49 -0.53 0.03 2.43 -0.00 -1.26 -4.79 118.94 113.34 1orb s TRP 35 Ca 0.61 1.26 0.00 0.00 -0.00 0.00 0.00 56.10 57.96 1orb s TRP 35 Cb -0.30 0.20 -0.03 0.00 -0.00 0.00 0.00 33.47 33.35 1orb s TRP 35 CO 0.37 -0.27 -0.04 0.71 -0.00 0.00 0.00 176.95 177.72 1orb s TYR 36 N 0.50 0.41 0.20 5.86 2.02 -1.26 -4.94 117.35 120.15 1orb s TYR 36 Ca -0.02 -0.69 -0.32 0.00 -0.37 0.00 0.00 57.07 55.67 1orb s TYR 36 Cb -0.04 -0.29 -0.14 0.00 -0.40 0.00 0.00 41.96 41.09 1orb s TYR 36 CO -0.02 -0.22 1.42 0.43 -1.57 0.00 0.00 175.55 175.58 1orb n SER 37 N 1.10 2.61 -4.60 2.29 7.64 -1.26 -4.82 113.62 116.59 1orb n SER 37 Ca -0.21 1.13 -0.48 0.00 1.01 0.00 0.00 58.87 60.32 1orb n SER 37 Cb 0.57 -1.39 -0.04 0.00 -1.01 0.00 0.00 64.21 62.34 1orb n SER 37 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1orb n PRO 38 N 2.35 1.34 -0.71 1.43 -0.04 -1.26 -2.17 135.00 135.93 1orb n PRO 38 Ca 0.14 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 1orb n PRO 38 Cb 0.29 -2.00 0.00 0.00 -0.04 0.00 0.00 33.50 31.75 1orb n PRO 38 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1orb n GLY 39 N 2.02 0.69 0.01 0.55 0.00 -1.26 -4.94 105.19 102.27 1orb n GLY 39 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1orb n GLY 39 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1orb n THR 40 N -2.54 0.00 -4.29 2.61 -2.24 -0.92 -5.09 114.28 101.80 1orb n THR 40 Ca 0.00 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.50 1orb n THR 40 Cb 0.00 -0.64 -0.10 0.00 -2.10 0.00 0.00 70.33 67.49 1orb n THR 40 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1orb s ARG 41 N -0.01 1.94 -0.64 -0.78 0.52 -1.26 -5.08 118.95 113.64 1orb s ARG 41 Ca 0.00 -1.22 -0.07 0.00 -0.52 0.00 0.00 55.73 53.91 1orb s ARG 41 Cb 0.00 -2.14 0.17 0.00 0.52 0.00 0.00 34.95 33.49 1orb s ARG 41 CO 0.00 0.46 0.50 -1.83 0.02 0.00 0.00 175.30 174.45 1orb s GLU 42 N -2.51 2.81 0.07 3.54 -1.05 -1.26 -4.59 118.70 115.71 1orb s GLU 42 Ca 0.22 -2.33 -0.32 0.00 -0.15 0.00 0.00 54.97 52.39 1orb s GLU 42 Cb -0.10 -3.96 -0.15 0.00 -0.44 0.00 0.00 34.13 29.49 1orb s GLU 42 CO 0.13 -1.21 1.49 0.00 0.95 0.00 0.00 175.26 176.63 1orb h ALA 43 N 7.56 -1.11 -0.71 -0.84 0.00 -1.93 0.73 119.26 122.96 1orb h ALA 43 Ca -0.03 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 54.80 1orb h ALA 43 Cb 1.00 0.68 -0.05 0.00 0.00 0.00 0.00 17.79 19.43 1orb h ALA 43 CO 0.76 -1.14 0.47 -0.09 0.00 0.00 0.00 179.25 179.24 1orb h ARG 44 N -0.90 0.60 -0.27 0.00 2.43 -1.93 0.13 114.38 114.44 1orb h ARG 44 Ca -0.06 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.03 1orb h ARG 44 Cb 0.78 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 1orb h ARG 44 CO -0.06 0.40 -0.03 -0.22 -1.51 0.00 0.00 179.97 178.55 1orb h LYS 45 N 0.62 0.50 -0.99 0.20 3.64 -1.91 -1.02 116.57 117.62 1orb h LYS 45 Ca 0.32 -0.18 0.12 0.00 -1.27 0.00 0.00 60.65 59.65 1orb h LYS 45 Cb 0.44 -0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 32.14 1orb h LYS 45 CO -0.11 0.69 0.62 0.93 -2.27 0.00 0.00 179.45 179.31 1orb h GLU 46 N 0.27 0.92 -0.04 1.90 5.08 -0.09 -1.95 114.58 120.67 1orb h GLU 46 Ca 0.07 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1orb h GLU 46 Cb 0.48 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1orb h GLU 46 CO 0.02 0.61 -0.01 -0.92 -1.00 0.00 0.00 179.01 177.71 1orb h TYR 47 N 0.95 0.10 -0.09 4.33 3.20 -0.45 -2.40 116.97 122.61 1orb h TYR 47 Ca 0.49 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.37 1orb h TYR 47 Cb 0.52 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.77 1orb h TYR 47 CO -0.00 0.42 0.07 -0.07 -1.64 0.00 0.00 178.16 176.94 1orb h LEU 48 N -0.26 0.00 0.09 2.82 3.38 -0.51 -2.97 115.31 117.86 1orb h LEU 48 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1orb h LEU 48 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1orb h LEU 48 CO 0.00 0.00 -0.04 -0.33 0.09 0.00 0.00 178.44 178.16 1orb h GLU 49 N 0.00 -0.11 -2.91 1.13 5.08 -1.31 -3.41 114.58 113.04 1orb h GLU 49 Ca 0.04 0.01 -0.22 0.00 -1.00 0.00 0.00 59.36 58.20 1orb h GLU 49 Cb 0.18 0.03 -0.32 0.00 0.50 0.00 0.00 28.75 29.13 1orb h GLU 49 CO -0.00 0.42 -0.53 -0.98 -1.00 0.00 0.00 179.01 176.92 1orb s ARG 50 N -3.12 0.15 -0.01 2.33 1.70 -0.91 -3.93 118.95 115.17 1orb s ARG 50 Ca -0.14 0.69 -0.07 0.00 -0.47 0.00 0.00 55.73 55.75 1orb s ARG 50 Cb -0.00 -0.07 0.00 0.00 -0.57 0.00 0.00 34.95 34.31 1orb s ARG 50 CO 0.52 -0.26 0.13 -3.38 -1.08 0.00 0.00 175.30 171.23 1orb s HIS 51 N 2.16 0.02 0.21 5.89 -3.43 -0.68 -4.49 115.29 114.98 1orb s HIS 51 Ca -0.01 -0.07 -0.32 0.00 -0.80 0.00 0.00 55.06 53.86 1orb s HIS 51 Cb -0.12 -0.04 -0.14 0.00 -1.43 0.00 0.00 32.58 30.85 1orb s HIS 51 CO -0.08 -0.25 1.36 0.28 -2.00 0.00 0.00 174.74 174.05 1orb n VAL 52 N 1.71 0.84 -1.59 -5.38 0.31 -1.26 -2.37 118.33 110.58 1orb n VAL 52 Ca -0.21 -0.21 -0.52 0.00 -0.01 0.00 0.00 64.34 63.39 1orb n VAL 52 Cb 0.56 -1.31 -0.06 0.00 -0.91 0.00 0.00 33.84 32.13 1orb n VAL 52 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1orb n PRO 53 N 2.08 1.16 -0.50 5.55 -0.02 -1.26 -0.09 135.00 141.93 1orb n PRO 53 Ca 0.13 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1orb n PRO 53 Cb 0.29 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1orb n PRO 53 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1orb n GLY 54 N 2.47 1.64 3.74 -1.23 0.00 -1.26 -5.01 105.19 105.55 1orb n GLY 54 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1orb n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1orb s ALA 55 N -3.36 2.25 0.32 4.61 0.00 0.88 -4.67 121.76 121.79 1orb s ALA 55 Ca 0.00 0.72 0.10 0.00 0.00 0.00 0.00 51.96 52.78 1orb s ALA 55 Cb 0.00 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.67 1orb s ALA 55 CO 0.00 -1.64 -0.03 -1.12 0.00 0.00 0.00 175.76 172.97 1orb s SER 56 N -2.29 4.11 -0.22 0.00 0.01 -0.66 -4.59 113.70 110.05 1orb s SER 56 Ca 0.71 -0.96 -0.11 0.00 1.31 0.00 0.00 55.95 56.90 1orb s SER 56 Cb -0.25 -0.53 -0.05 0.00 0.21 0.00 0.00 66.02 65.40 1orb s SER 56 CO 0.44 -0.15 0.18 0.12 0.41 0.00 0.00 173.24 174.23 1orb s PHE 57 N -2.49 3.36 -0.27 2.43 5.36 -1.26 -1.23 117.98 123.88 1orb s PHE 57 Ca 0.33 0.32 -0.10 0.00 -0.96 0.00 0.00 56.93 56.52 1orb s PHE 57 Cb -0.02 -2.26 -0.04 0.00 -0.34 0.00 0.00 43.02 40.36 1orb s PHE 57 CO 0.18 0.15 0.16 0.12 -1.46 0.00 0.00 175.22 174.37 1orb s PHE 58 N 0.80 3.19 -0.70 10.12 5.36 0.36 -4.88 117.98 132.22 1orb s PHE 58 Ca 0.09 -0.01 -0.21 0.00 -0.96 0.00 0.00 56.93 55.84 1orb s PHE 58 Cb -0.13 -2.35 0.09 0.00 -0.34 0.00 0.00 43.02 40.30 1orb s PHE 58 CO 0.02 -0.21 0.94 0.34 -1.46 0.00 0.00 175.22 174.86 1orb s ASP 59 N 1.72 6.26 0.36 6.13 -1.08 -1.26 -4.46 116.67 124.34 1orb s ASP 59 Ca 0.07 -1.29 0.10 0.00 -0.52 0.00 0.00 52.55 50.91 1orb s ASP 59 Cb -0.16 -2.39 0.85 0.00 -1.46 0.00 0.00 42.92 39.76 1orb s ASP 59 CO 0.09 -1.30 1.86 0.40 0.52 0.00 0.00 175.17 176.74 1orb h ILE 60 N 5.93 0.80 0.00 4.11 1.08 -1.91 0.33 117.51 127.85 1orb h ILE 60 Ca -0.21 -0.23 -0.05 0.00 -0.39 0.00 0.00 64.86 63.99 1orb h ILE 60 Cb 1.07 0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 34.89 1orb h ILE 60 CO 1.15 0.12 -0.22 -0.33 -0.69 0.00 0.00 178.15 178.18 1orb h GLU 61 N 0.66 0.00 0.11 2.37 5.08 -1.99 -3.08 114.58 117.73 1orb h GLU 61 Ca 0.47 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.47 1orb h GLU 61 Cb 0.81 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.03 1orb h GLU 61 CO -0.22 0.22 -1.98 -1.91 -1.00 0.00 0.00 179.01 174.12 1orb n GLU 62 N -3.68 0.74 -1.90 2.33 4.07 0.98 -4.55 120.64 118.62 1orb n GLU 62 Ca -0.01 0.28 -0.42 0.00 -0.06 0.00 0.00 57.16 56.94 1orb n GLU 62 Cb 0.34 -1.70 -0.00 0.00 -0.06 0.00 0.00 31.44 30.02 1orb n GLU 62 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1orb s ARG 64 N 3.47 1.52 -0.94 0.00 1.70 -1.26 -4.58 118.95 118.87 1orb s ARG 64 Ca 0.49 -0.91 -0.22 0.00 -0.47 0.00 0.00 55.73 54.61 1orb s ARG 64 Cb 0.12 0.47 0.07 0.00 -0.57 0.00 0.00 34.95 35.04 1orb s ARG 64 CO -0.05 -0.71 1.31 0.34 -1.08 0.00 0.00 175.30 175.12 1orb s ASP 65 N -3.09 6.46 0.56 -2.89 -1.08 0.12 -4.60 116.67 112.15 1orb s ASP 65 Ca 0.15 -1.43 0.25 0.00 -0.52 0.00 0.00 52.55 51.00 1orb s ASP 65 Cb -0.03 -2.52 1.55 0.00 -1.46 0.00 0.00 42.92 40.46 1orb s ASP 65 CO 0.06 -1.44 2.12 0.11 0.52 0.00 0.00 175.17 176.54 1orb h LYS 66 N 9.58 0.00 -0.00 4.34 1.57 -1.92 -0.60 116.57 129.55 1orb h LYS 66 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1orb h LYS 66 Cb 1.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.33 1orb h LYS 66 CO 1.31 0.00 -0.05 0.00 -0.57 0.00 0.00 179.45 180.15 1orb n ALA 67 N -2.43 2.65 -2.48 3.86 0.00 -1.26 -4.84 120.51 116.00 1orb n ALA 67 Ca 0.01 -0.22 -0.31 0.00 0.00 0.00 0.00 53.44 52.92 1orb n ALA 67 Cb 0.28 -1.42 -0.05 0.00 0.00 0.00 0.00 19.45 18.26 1orb n ALA 67 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1orb s SER 68 N -2.40 6.57 0.02 0.00 0.15 -0.23 -4.93 113.70 112.88 1orb s SER 68 Ca 0.33 0.82 0.25 0.00 0.70 0.00 0.00 55.95 58.05 1orb s SER 68 Cb 0.21 -2.19 1.06 0.00 -1.71 0.00 0.00 66.02 63.39 1orb s SER 68 CO 0.44 -0.07 1.81 -0.81 1.20 0.00 0.00 173.24 175.81 1orb n PRO 69 N -0.24 0.02 -3.03 5.44 -0.04 -1.26 -4.85 135.00 131.04 1orb n PRO 69 Ca -0.00 0.08 -0.20 0.00 -0.04 0.00 0.00 63.50 63.34 1orb n PRO 69 Cb 0.53 -1.52 0.01 0.00 -0.04 0.00 0.00 33.50 32.47 1orb n PRO 69 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1orb s TYR 70 N -3.01 2.99 0.11 0.54 2.02 -1.26 -5.08 117.35 113.65 1orb s TYR 70 Ca 0.12 -0.13 -0.30 0.00 -0.37 0.00 0.00 57.07 56.39 1orb s TYR 70 Cb 0.16 -2.36 -0.06 0.00 -0.40 0.00 0.00 41.96 39.30 1orb s TYR 70 CO 0.47 -0.42 1.13 -1.21 -1.57 0.00 0.00 175.55 173.95 1orb s GLU 71 N -4.45 4.52 -1.29 -0.62 2.02 -1.26 -4.34 118.70 113.27 1orb s GLU 71 Ca 0.52 1.71 -0.27 0.00 0.02 0.00 0.00 54.97 56.95 1orb s GLU 71 Cb -0.10 -3.33 0.04 0.00 0.10 0.00 0.00 34.13 30.84 1orb s GLU 71 CO 0.35 -0.09 0.54 0.28 0.02 0.00 0.00 175.26 176.36 1orb n VAL 72 N 3.24 -2.44 -2.93 2.63 0.31 -1.26 -4.89 118.33 112.98 1orb n VAL 72 Ca 0.06 -0.59 -0.34 0.00 -0.01 0.00 0.00 64.34 63.45 1orb n VAL 72 Cb 0.47 -2.07 -0.06 0.00 -0.91 0.00 0.00 33.84 31.26 1orb n VAL 72 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1orb s MET 73 N -7.40 4.28 0.25 5.55 -1.94 -1.26 -4.91 119.30 113.87 1orb s MET 73 Ca 0.38 1.03 -0.31 0.00 -1.71 0.00 0.00 55.69 55.08 1orb s MET 73 Cb -0.21 -2.53 -0.12 0.00 2.01 0.00 0.00 34.83 33.98 1orb s MET 73 CO 0.98 0.17 1.61 1.28 -0.01 0.00 0.00 175.02 179.04 1orb n LEU 74 N -0.01 3.99 0.00 -0.03 4.77 -1.26 0.11 117.00 124.56 1orb n LEU 74 Ca 0.03 1.12 -0.23 0.00 -0.03 0.00 0.00 56.01 56.90 1orb n LEU 74 Cb 0.52 -1.55 0.19 0.00 -2.33 0.00 0.00 43.42 40.25 1orb n LEU 74 CO 0.41 0.04 0.48 -0.81 -1.33 0.00 0.00 177.39 176.18 1orb n PRO 75 N 2.74 -2.47 -2.64 3.23 -0.04 -1.26 -4.10 135.00 130.46 1orb n PRO 75 Ca 0.12 -1.34 -0.22 0.00 -0.04 0.00 0.00 63.50 62.01 1orb n PRO 75 Cb 0.35 -1.21 0.08 0.00 -0.04 0.00 0.00 33.50 32.67 1orb n PRO 75 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1orb s SER 76 N -3.82 4.77 0.15 3.54 1.04 -1.26 -4.82 113.70 113.30 1orb s SER 76 Ca 0.54 -0.26 -0.16 0.00 0.48 0.00 0.00 55.95 56.54 1orb s SER 76 Cb -0.05 -0.33 0.05 0.00 0.10 0.00 0.00 66.02 65.80 1orb s SER 76 CO 0.41 -1.54 1.76 -0.33 0.98 0.00 0.00 173.24 174.52 1orb h GLU 77 N -0.24 0.28 -0.81 4.02 5.08 -1.95 0.20 114.58 121.17 1orb h GLU 77 Ca -0.38 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.00 1orb h GLU 77 Cb 1.28 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 30.42 1orb h GLU 77 CO 0.45 0.19 0.51 0.00 -1.00 0.00 0.00 179.01 179.16 1orb h ALA 78 N 1.22 1.06 0.59 3.43 0.00 -1.92 0.27 119.26 123.91 1orb h ALA 78 Ca 0.16 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1orb h ALA 78 Cb 0.12 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.65 1orb h ALA 78 CO -0.15 0.32 -0.28 0.78 0.00 0.00 0.00 179.25 179.92 1orb h GLY 79 N 0.99 -0.82 0.18 0.00 0.00 -1.75 -0.33 103.07 101.33 1orb h GLY 79 Ca 0.32 0.31 0.08 0.00 0.00 0.00 0.00 47.33 48.04 1orb h GLY 79 CO -0.12 -0.30 -0.09 -2.75 0.00 0.00 0.00 176.54 173.28 1orb h PHE 80 N -0.81 -0.19 -0.11 5.60 3.57 -0.14 -2.03 116.94 122.83 1orb h PHE 80 Ca -0.08 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.50 1orb h PHE 80 Cb 0.61 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.45 1orb h PHE 80 CO -0.03 -0.17 -0.21 0.00 -2.23 0.00 0.00 178.31 175.67 1orb h ALA 81 N 1.41 -0.19 -0.81 2.41 0.00 -0.21 -1.49 119.26 120.39 1orb h ALA 81 Ca 0.20 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1orb h ALA 81 Cb 0.31 0.41 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 1orb h ALA 81 CO -0.42 -0.68 0.51 -0.44 0.00 0.00 0.00 179.25 178.22 1orb h ASP 82 N -0.28 0.95 0.32 0.00 3.32 -0.66 -0.36 116.42 119.71 1orb h ASP 82 Ca 0.09 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1orb h ASP 82 Cb 0.42 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1orb h ASP 82 CO -0.27 0.71 -0.18 0.22 -1.72 0.00 0.00 179.24 178.00 1orb h TYR 83 N 1.10 -0.47 -0.61 4.55 3.20 -0.87 -1.35 116.97 122.52 1orb h TYR 83 Ca 0.29 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.21 1orb h TYR 83 Cb -0.08 0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 1orb h TYR 83 CO 0.00 -0.28 0.40 -0.39 -1.64 0.00 0.00 178.16 176.26 1orb h VAL 84 N -0.46 1.03 -0.26 1.81 -1.51 -1.27 -1.68 116.25 113.91 1orb h VAL 84 Ca -0.04 -0.22 0.02 0.00 -1.23 0.00 0.00 66.70 65.22 1orb h VAL 84 Cb 0.36 0.33 -0.02 0.00 -2.13 0.00 0.00 31.29 29.84 1orb h VAL 84 CO 0.06 0.12 0.13 1.23 -1.23 0.00 0.00 177.57 177.87 1orb h GLY 85 N 0.64 0.34 2.00 5.19 0.00 -0.99 -1.47 103.07 108.78 1orb h GLY 85 Ca 0.26 -0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.49 1orb h GLY 85 CO -0.07 0.08 -0.01 1.48 0.00 0.00 0.00 176.54 178.02 1orb h SER 86 N 0.28 0.00 -0.18 0.19 4.64 -0.27 0.25 113.55 118.45 1orb h SER 86 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1orb h SER 86 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1orb h SER 86 CO -0.07 0.01 0.00 0.18 -0.87 0.00 0.00 176.83 176.08 1orb n LEU 87 N -3.34 1.04 -2.80 5.97 4.32 -0.58 -4.63 117.00 116.98 1orb n LEU 87 Ca -0.03 -0.51 -0.15 0.00 -0.02 0.00 0.00 56.01 55.31 1orb n LEU 87 Cb 0.10 -0.12 0.06 0.00 -1.62 0.00 0.00 43.42 41.84 1orb n LEU 87 CO 0.23 0.26 0.12 0.61 -1.22 0.00 0.00 177.39 177.39 1orb n GLY 88 N 0.84 -0.16 3.02 -0.72 0.00 0.79 -4.83 105.19 104.13 1orb n GLY 88 Ca 0.08 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1orb n GLY 88 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1orb s ILE 89 N -3.26 1.59 0.44 -0.61 1.01 -1.02 -4.73 121.20 114.62 1orb s ILE 89 Ca 0.16 -0.69 0.08 0.00 0.00 0.00 0.00 60.65 60.20 1orb s ILE 89 Cb -0.07 -1.52 0.00 0.00 0.01 0.00 0.00 42.46 40.89 1orb s ILE 89 CO 0.54 0.41 0.50 -0.94 0.00 0.00 0.00 174.94 175.45 1orb s SER 90 N 1.47 5.29 0.46 3.58 1.04 -1.26 -4.14 113.70 120.14 1orb s SER 90 Ca 0.04 -0.64 0.31 0.00 0.48 0.00 0.00 55.95 56.14 1orb s SER 90 Cb -0.13 -0.48 1.67 0.00 0.10 0.00 0.00 66.02 67.17 1orb s SER 90 CO -0.10 -0.78 1.94 0.78 0.98 0.00 0.00 173.24 176.06 1orb h ASN 91 N 0.77 0.00 0.41 7.02 -0.26 -1.93 0.46 115.58 122.06 1orb h ASN 91 Ca -0.40 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.34 1orb h ASN 91 Cb 1.28 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.54 1orb h ASN 91 CO 0.51 0.00 -0.64 0.47 -1.06 0.00 0.00 177.43 176.70 1orb n ASP 92 N -2.58 0.61 -4.85 5.81 8.00 -1.26 -4.96 116.55 117.32 1orb n ASP 92 Ca -0.02 -0.38 -0.32 0.00 0.71 0.00 0.00 54.79 54.78 1orb n ASP 92 Cb 0.05 0.44 -0.05 0.00 -0.02 0.00 0.00 41.12 41.53 1orb n ASP 92 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1orb s THR 93 N -3.02 4.69 -0.37 -3.53 -1.32 0.15 -4.88 115.64 107.35 1orb s THR 93 Ca 0.10 0.90 -0.18 0.00 -1.21 0.00 0.00 61.69 61.29 1orb s THR 93 Cb 0.17 -3.65 0.00 0.00 -1.51 0.00 0.00 72.50 67.51 1orb s THR 93 CO 0.74 -0.31 0.51 -2.28 -2.21 0.00 0.00 174.62 171.07 1orb s HIS 94 N -2.14 3.16 -0.26 9.09 2.46 0.14 -4.78 115.29 122.97 1orb s HIS 94 Ca 0.54 0.06 -0.17 0.00 0.47 0.00 0.00 55.06 55.96 1orb s HIS 94 Cb -0.10 -2.96 -0.03 0.00 -0.13 0.00 0.00 32.58 29.36 1orb s HIS 94 CO 0.22 -0.60 0.46 0.08 -2.47 0.00 0.00 174.74 172.43 1orb s VAL 95 N 2.39 5.11 -0.22 0.89 1.01 -0.41 -3.40 120.40 125.77 1orb s VAL 95 Ca 0.18 0.78 -0.07 0.00 0.00 0.00 0.00 61.98 62.87 1orb s VAL 95 Cb -0.16 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 1orb s VAL 95 CO 0.14 0.13 0.05 -0.69 0.00 0.00 0.00 175.10 174.72 1orb s VAL 96 N 2.12 4.28 0.01 2.92 1.01 -0.60 0.83 120.40 130.97 1orb s VAL 96 Ca 0.19 -0.19 0.07 0.00 0.00 0.00 0.00 61.98 62.05 1orb s VAL 96 Cb -0.16 -2.97 -0.03 0.00 0.00 0.00 0.00 36.38 33.23 1orb s VAL 96 CO 0.09 0.38 -0.22 -0.69 0.00 0.00 0.00 175.10 174.67 1orb s VAL 97 N 1.23 2.46 0.14 2.92 1.01 0.82 -0.09 120.40 128.90 1orb s VAL 97 Ca 0.04 -1.14 -0.11 0.00 0.00 0.00 0.00 61.98 60.77 1orb s VAL 97 Cb -0.14 -1.96 0.01 0.00 0.00 0.00 0.00 36.38 34.28 1orb s VAL 97 CO 0.03 0.46 0.31 -0.72 0.00 0.00 0.00 175.10 175.18 1orb s TYR 98 N -0.77 0.14 0.18 5.22 1.13 0.72 -1.30 117.35 122.66 1orb s TYR 98 Ca 0.12 -0.52 -0.00 0.00 -1.41 0.00 0.00 57.07 55.26 1orb s TYR 98 Cb -0.10 0.06 -0.04 0.00 -1.10 0.00 0.00 41.96 40.78 1orb s TYR 98 CO 0.02 -0.69 0.08 0.16 -2.51 0.00 0.00 175.55 172.60 1orb s ASP 99 N -2.89 0.50 0.00 -0.18 1.47 -1.26 0.14 116.67 114.44 1orb s ASP 99 Ca 0.10 -1.28 0.23 0.00 1.18 0.00 0.00 52.55 52.77 1orb s ASP 99 Cb 0.03 0.28 0.49 0.00 -0.34 0.00 0.00 42.92 43.38 1orb s ASP 99 CO -0.06 -0.74 1.43 0.61 0.68 0.00 0.00 175.17 177.09 1orb n GLY 100 N -0.22 1.30 3.49 2.12 0.00 -1.26 -1.93 105.19 108.69 1orb n GLY 100 Ca -0.02 -0.66 -0.43 0.00 0.00 0.00 0.00 46.02 44.91 1orb n GLY 100 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1orb n ASP 101 N 1.19 -0.25 0.26 1.61 2.03 -1.26 -4.69 116.55 115.43 1orb n ASP 101 Ca 0.18 1.00 0.15 0.00 0.52 0.00 0.00 54.79 56.64 1orb n ASP 101 Cb 0.54 -1.16 0.60 0.00 -0.72 0.00 0.00 41.12 40.38 1orb n ASP 101 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1orb h ASP 102 N 1.14 0.00 1.31 1.67 3.32 -1.97 -1.94 116.42 119.95 1orb h ASP 102 Ca -0.39 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.64 1orb h ASP 102 Cb 1.39 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.93 1orb h ASP 102 CO 0.54 0.06 -0.07 -0.07 -1.72 0.00 0.00 179.24 177.99 1orb h LEU 103 N 0.00 0.00 0.00 1.55 3.38 -1.97 -3.47 115.31 114.80 1orb h LEU 103 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1orb h LEU 103 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 1orb h LEU 103 CO 0.01 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.22 1orb n GLY 104 N 0.43 1.61 3.53 0.83 0.00 -0.73 -4.17 105.19 106.68 1orb n GLY 104 Ca 0.02 -0.03 -0.04 0.00 0.00 0.00 0.00 46.02 45.97 1orb n GLY 104 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1orb s SER 105 N -0.10 -0.86 0.10 1.61 0.15 -1.26 -2.94 113.70 110.40 1orb s SER 105 Ca 0.00 1.38 0.00 0.00 0.70 0.00 0.00 55.95 58.03 1orb s SER 105 Cb 0.00 1.86 0.00 0.00 -1.71 0.00 0.00 66.02 66.17 1orb s SER 105 CO 0.00 -0.22 0.00 0.33 1.20 0.00 0.00 173.24 174.55 1orb n PHE 106 N 5.22 -0.62 0.02 3.44 -0.00 -1.26 -4.94 117.46 119.32 1orb n PHE 106 Ca -0.13 0.11 -0.02 0.00 -0.00 0.00 0.00 57.45 57.41 1orb n PHE 106 Cb 0.51 0.25 -0.09 0.00 -0.00 0.00 0.00 39.48 40.14 1orb n PHE 106 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.76 178.64 1orb h TYR 107 N 0.00 0.00 -0.59 -5.13 -1.99 -1.92 -3.41 116.97 103.93 1orb h TYR 107 Ca 0.00 0.00 0.12 0.00 2.00 0.00 0.00 58.73 60.85 1orb h TYR 107 Cb 0.00 0.00 -0.09 0.00 2.00 0.00 0.00 36.73 38.64 1orb h TYR 107 CO 0.00 0.69 0.04 0.00 -0.00 0.00 0.00 178.16 178.89 1orb h ALA 108 N 1.31 0.61 -0.82 3.88 0.00 -1.86 -1.68 119.26 120.70 1orb h ALA 108 Ca -0.18 0.17 0.14 0.00 0.00 0.00 0.00 54.91 55.03 1orb h ALA 108 Cb 1.69 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 19.69 1orb h ALA 108 CO 0.06 -0.37 0.54 -1.35 0.00 0.00 0.00 179.25 178.13 1orb h PRO 109 N 0.15 0.55 -0.21 0.00 0.11 -1.92 -0.17 132.00 130.52 1orb h PRO 109 Ca 0.31 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.40 1orb h PRO 109 Cb 0.48 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.45 1orb h PRO 109 CO -0.47 0.36 0.11 -0.09 -0.21 0.00 0.00 178.00 177.70 1orb h ARG 110 N 0.57 0.23 -0.41 1.05 1.12 -1.52 0.35 114.38 115.77 1orb h ARG 110 Ca 0.41 -0.01 -0.09 0.00 -1.11 0.00 0.00 59.98 59.17 1orb h ARG 110 Cb 0.76 -0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 30.65 1orb h ARG 110 CO -0.16 0.15 -0.10 0.28 -3.11 0.00 0.00 179.97 177.03 1orb h VAL 111 N 0.24 1.27 0.07 0.20 2.07 -1.01 0.63 116.25 119.72 1orb h VAL 111 Ca 0.08 -1.19 0.02 0.00 0.82 0.00 0.00 66.70 66.44 1orb h VAL 111 Cb 0.01 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 30.94 1orb h VAL 111 CO -0.05 0.40 -0.34 -0.25 0.02 0.00 0.00 177.57 177.35 1orb h TRP 112 N 0.61 -0.94 -0.98 1.57 7.01 -0.70 -0.60 115.95 121.91 1orb h TRP 112 Ca 0.10 0.03 0.11 0.00 2.11 0.00 0.00 58.89 61.24 1orb h TRP 112 Cb 0.63 0.41 -0.08 0.00 -2.10 0.00 0.00 29.16 28.01 1orb h TRP 112 CO 0.05 -0.44 0.62 2.35 -2.79 0.00 0.00 178.44 178.23 1orb h TRP 113 N -0.54 1.10 -0.89 2.65 7.01 -0.08 -1.58 115.95 123.62 1orb h TRP 113 Ca 0.04 0.03 0.01 0.00 2.11 0.00 0.00 58.89 61.09 1orb h TRP 113 Cb 0.59 -0.35 -0.05 0.00 -2.10 0.00 0.00 29.16 27.26 1orb h TRP 113 CO -0.33 0.46 0.59 0.52 -2.79 0.00 0.00 178.44 176.89 1orb h MET 114 N 0.98 1.15 -0.23 2.65 2.86 0.52 -1.34 114.93 121.53 1orb h MET 114 Ca 0.47 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 58.02 1orb h MET 114 Cb 0.46 -0.26 -0.01 0.00 0.06 0.00 0.00 31.60 31.85 1orb h MET 114 CO -0.23 0.76 0.05 0.74 1.06 0.00 0.00 176.91 179.29 1orb h PHE 115 N 1.19 0.39 -0.88 -0.22 0.04 -0.14 -2.88 116.94 114.45 1orb h PHE 115 Ca 0.33 -0.05 0.06 0.00 2.80 0.00 0.00 57.97 61.11 1orb h PHE 115 Cb -0.11 -0.11 -0.06 0.00 2.20 0.00 0.00 35.95 37.87 1orb h PHE 115 CO -0.00 0.49 0.55 0.00 -0.60 0.00 0.00 178.31 178.74 1orb h ARG 116 N 0.19 0.97 0.00 1.51 3.08 -1.30 -0.23 114.38 118.60 1orb h ARG 116 Ca 0.07 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1orb h ARG 116 Cb 0.30 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.13 1orb h ARG 116 CO 0.00 0.64 0.00 -0.24 -1.07 0.00 0.00 179.97 179.31 1orb h VAL 117 N 1.00 0.00 -0.22 2.04 3.04 -1.22 -1.49 116.25 119.40 1orb h VAL 117 Ca 0.38 -0.39 0.00 0.00 -1.01 0.00 0.00 66.70 65.68 1orb h VAL 117 Cb 0.16 1.31 0.00 0.00 -2.01 0.00 0.00 31.29 30.75 1orb h VAL 117 CO -0.17 0.00 0.00 0.49 -1.01 0.00 0.00 177.57 176.88 1orb n PHE 118 N -2.86 0.27 0.00 3.17 3.72 -0.16 -0.23 117.46 121.38 1orb n PHE 118 Ca 0.01 -0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.27 1orb n PHE 118 Cb 0.26 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 1orb n PHE 118 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1orb n GLY 119 N 1.38 1.12 3.67 1.37 0.00 -0.56 0.40 105.19 112.56 1orb n GLY 119 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1orb n GLY 119 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1orb s HIS 120 N -2.00 3.25 -0.02 1.61 5.04 -0.86 -4.91 115.29 117.41 1orb s HIS 120 Ca 0.00 0.13 0.11 0.00 -1.54 0.00 0.00 55.06 53.76 1orb s HIS 120 Cb 0.00 -1.97 -0.16 0.00 0.04 0.00 0.00 32.58 30.49 1orb s HIS 120 CO 0.00 0.30 0.22 0.54 -2.34 0.00 0.00 174.74 173.47 1orb n ARG 121 N 2.93 0.42 -2.22 2.88 5.12 -1.26 -3.27 116.66 121.26 1orb n ARG 121 Ca -0.18 -0.09 -0.42 0.00 -1.93 0.00 0.00 57.85 55.23 1orb n ARG 121 Cb 0.53 -1.25 0.00 0.00 -1.16 0.00 0.00 32.46 30.58 1orb n ARG 121 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1orb n THR 122 N -1.89 4.12 -4.13 0.55 -2.24 -1.26 -4.74 114.28 104.68 1orb n THR 122 Ca -0.03 -4.07 -0.15 0.00 -2.27 0.00 0.00 64.05 57.53 1orb n THR 122 Cb 0.30 -2.42 -0.14 0.00 -2.10 0.00 0.00 70.33 65.97 1orb n THR 122 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1orb s VAL 123 N 1.19 0.38 0.09 2.28 0.11 -1.26 -1.29 120.40 121.90 1orb s VAL 123 Ca 0.42 -0.24 -0.09 0.00 -2.93 0.00 0.00 61.98 59.13 1orb s VAL 123 Cb 0.10 -0.33 0.00 0.00 -1.53 0.00 0.00 36.38 34.62 1orb s VAL 123 CO -0.02 0.08 0.20 -0.94 -3.33 0.00 0.00 175.10 171.09 1orb s SER 124 N -0.18 0.10 -0.21 3.54 1.04 0.24 -4.72 113.70 113.52 1orb s SER 124 Ca 0.01 -0.64 -0.11 0.00 0.48 0.00 0.00 55.95 55.70 1orb s SER 124 Cb -0.02 0.35 -0.05 0.00 0.10 0.00 0.00 66.02 66.39 1orb s SER 124 CO -0.00 -0.73 0.16 -0.69 0.98 0.00 0.00 173.24 172.95 1orb s VAL 125 N -3.86 5.39 -0.23 5.02 1.01 -0.81 -0.13 120.40 126.79 1orb s VAL 125 Ca 0.05 0.23 -0.29 0.00 0.00 0.00 0.00 61.98 61.97 1orb s VAL 125 Cb 0.05 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 1orb s VAL 125 CO -0.11 0.41 1.90 -0.22 0.00 0.00 0.00 175.10 177.08 1orb s LEU 126 N 0.54 3.67 -0.01 3.92 0.20 -0.42 -2.64 118.68 123.94 1orb s LEU 126 Ca 0.09 1.70 -0.30 0.00 0.69 0.00 0.00 54.13 56.31 1orb s LEU 126 Cb -0.12 -3.52 -0.06 0.00 -0.43 0.00 0.00 46.19 42.06 1orb s LEU 126 CO 0.00 -1.61 1.54 0.21 -0.29 0.00 0.00 176.35 176.20 1orb s ASN 127 N 6.16 6.73 0.00 3.68 2.47 -0.35 -2.64 114.94 130.99 1orb s ASN 127 Ca 0.85 2.22 0.00 0.00 0.42 0.00 0.00 52.86 56.35 1orb s ASN 127 Cb -0.28 -2.55 0.00 0.00 -1.45 0.00 0.00 41.25 36.97 1orb s ASN 127 CO 0.34 -0.83 0.00 0.61 -3.72 0.00 0.00 177.10 173.50 1orb n GLY 128 N 3.89 0.66 5.08 1.21 0.00 -1.19 -4.46 105.19 110.39 1orb n GLY 128 Ca 0.15 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1orb n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1orb n GLY 129 N -2.59 0.22 0.30 -0.02 0.00 -1.08 0.17 105.19 102.19 1orb n GLY 129 Ca 0.00 -0.39 0.12 0.00 0.00 0.00 0.00 46.02 45.75 1orb n GLY 129 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1orb h PHE 130 N 0.00 0.00 -0.09 1.61 3.57 -1.65 -0.13 116.94 120.26 1orb h PHE 130 Ca 0.00 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.52 1orb h PHE 130 Cb 0.00 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.69 1orb h PHE 130 CO 0.00 0.00 -0.44 -0.09 -2.23 0.00 0.00 178.31 175.55 1orb h ARG 131 N 0.00 -0.48 -0.60 1.11 2.43 -1.79 0.78 114.38 115.84 1orb h ARG 131 Ca 0.07 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 1orb h ARG 131 Cb 0.29 0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 1orb h ARG 131 CO -0.00 -0.32 0.29 -0.91 -1.51 0.00 0.00 179.97 177.53 1orb h ASN 132 N -0.49 0.78 -0.49 -3.80 4.21 0.14 -0.13 115.58 115.81 1orb h ASN 132 Ca 0.02 -0.13 0.09 0.00 1.21 0.00 0.00 56.30 57.50 1orb h ASN 132 Cb 0.56 -0.20 -0.10 0.00 -1.12 0.00 0.00 38.32 37.46 1orb h ASN 132 CO -0.34 0.69 -0.29 -0.25 -1.29 0.00 0.00 177.43 175.94 1orb h TRP 133 N 0.82 -0.78 0.38 1.19 2.91 -0.35 -0.85 115.95 119.27 1orb h TRP 133 Ca 0.21 0.06 -0.02 0.00 1.13 0.00 0.00 58.89 60.27 1orb h TRP 133 Cb 0.11 0.42 0.00 0.00 -0.51 0.00 0.00 29.16 29.18 1orb h TRP 133 CO -0.00 -0.36 -0.18 -0.07 -1.03 0.00 0.00 178.44 176.80 1orb h LEU 134 N -0.18 -0.44 -1.90 0.65 3.38 -0.62 -2.40 115.31 113.81 1orb h LEU 134 Ca 0.21 -0.03 0.25 0.00 0.09 0.00 0.00 57.88 58.40 1orb h LEU 134 Cb 0.52 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 1orb h LEU 134 CO -0.59 -0.25 0.71 0.50 0.09 0.00 0.00 178.44 178.90 1orb h LYS 135 N -0.59 0.00 -0.00 1.13 3.64 -0.36 0.92 116.57 121.30 1orb h LYS 135 Ca -0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1orb h LYS 135 Cb 0.44 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1orb h LYS 135 CO 0.09 0.00 -0.43 0.39 -2.27 0.00 0.00 179.45 177.23 1orb n GLU 136 N -3.96 0.46 -0.69 1.90 1.02 -0.39 -4.97 120.64 114.02 1orb n GLU 136 Ca 0.18 -0.29 0.00 0.00 -0.02 0.00 0.00 57.16 57.03 1orb n GLU 136 Cb 1.01 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.94 1orb n GLU 136 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1orb n GLY 137 N 1.42 0.60 3.71 0.62 0.00 0.32 -5.05 105.19 106.81 1orb n GLY 137 Ca 0.09 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 1orb n GLY 137 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1orb s HIS 138 N -2.00 2.26 0.19 1.61 3.76 -1.05 -4.94 115.29 115.12 1orb s HIS 138 Ca 0.00 1.36 -0.30 0.00 -0.15 0.00 0.00 55.06 55.97 1orb s HIS 138 Cb 0.00 -3.15 -0.09 0.00 1.11 0.00 0.00 32.58 30.45 1orb s HIS 138 CO 0.00 -2.38 1.38 -1.25 -0.85 0.00 0.00 174.74 171.64 1orb s PRO 139 N -4.88 4.33 0.20 8.40 0.04 -1.26 -4.86 135.00 136.97 1orb s PRO 139 Ca 0.63 2.15 0.09 0.00 0.04 0.00 0.00 61.00 63.92 1orb s PRO 139 Cb -0.19 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.13 1orb s PRO 139 CO 0.57 -0.37 -0.19 0.14 0.04 0.00 0.00 177.00 177.20 1orb s VAL 140 N 0.38 2.01 0.19 -0.36 -7.23 -1.26 -4.13 120.40 110.00 1orb s VAL 140 Ca 0.60 -2.08 -0.23 0.00 -1.81 0.00 0.00 61.98 58.47 1orb s VAL 140 Cb -0.39 -2.01 0.06 0.00 0.56 0.00 0.00 36.38 34.60 1orb s VAL 140 CO 0.37 -0.35 0.65 -0.89 -0.31 0.00 0.00 175.10 174.57 1orb s THR 141 N -2.24 0.00 -0.04 5.32 2.01 -1.00 -4.89 115.64 114.80 1orb s THR 141 Ca 0.20 -0.30 0.01 0.00 0.31 0.00 0.00 61.69 61.91 1orb s THR 141 Cb -0.05 -1.30 -0.01 0.00 0.01 0.00 0.00 72.50 71.15 1orb s THR 141 CO 0.09 0.00 0.05 -1.54 -0.69 0.00 0.00 174.62 172.53 1orb n SER 142 N -0.40 0.08 -4.53 3.53 3.41 -1.25 -1.68 113.62 112.78 1orb n SER 142 Ca -0.13 -0.54 -0.39 0.00 -0.26 0.00 0.00 58.87 57.55 1orb n SER 142 Cb 0.63 0.95 0.04 0.00 -0.26 0.00 0.00 64.21 65.57 1orb n SER 142 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1orb n GLU 143 N -0.97 0.74 -2.73 4.33 1.02 -1.26 -4.87 120.64 116.90 1orb n GLU 143 Ca 0.00 0.28 -0.40 0.00 -0.02 0.00 0.00 57.16 57.02 1orb n GLU 143 Cb 0.01 -1.87 -0.05 0.00 -0.02 0.00 0.00 31.44 29.51 1orb n GLU 143 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1orb s PRO 144 N -2.25 4.78 -0.21 3.49 0.04 -1.26 -4.93 135.00 134.66 1orb s PRO 144 Ca 0.70 1.49 -0.15 0.00 0.04 0.00 0.00 61.00 63.08 1orb s PRO 144 Cb -0.46 -3.32 -0.04 0.00 0.04 0.00 0.00 34.50 30.72 1orb s PRO 144 CO 0.53 0.37 0.35 -1.12 0.04 0.00 0.00 177.00 177.17 1orb s SER 145 N -0.64 6.37 -0.53 6.66 0.01 -1.26 -5.02 113.70 119.29 1orb s SER 145 Ca 0.44 0.43 0.07 0.00 1.31 0.00 0.00 55.95 58.19 1orb s SER 145 Cb -0.25 -2.21 0.25 0.00 0.21 0.00 0.00 66.02 64.02 1orb s SER 145 CO 0.31 -0.06 0.63 -1.14 0.41 0.00 0.00 173.24 173.40 1orb n ARG 146 N 4.50 1.66 -1.63 12.44 0.63 -1.26 -4.99 116.66 128.02 1orb n ARG 146 Ca -0.10 -4.00 -0.38 0.00 -0.92 0.00 0.00 57.85 52.46 1orb n ARG 146 Cb 0.51 -1.79 0.05 0.00 0.45 0.00 0.00 32.46 31.69 1orb n ARG 146 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1orb n PRO 147 N 1.17 0.94 -2.66 -0.14 -0.04 -1.26 -4.95 135.00 128.07 1orb n PRO 147 Ca 0.26 0.36 -0.40 0.00 -0.04 0.00 0.00 63.50 63.68 1orb n PRO 147 Cb 0.46 -2.20 -0.05 0.00 -0.04 0.00 0.00 33.50 31.67 1orb n PRO 147 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1orb s GLU 148 N -2.79 4.76 0.45 0.54 2.56 -1.26 -4.72 118.70 118.23 1orb s GLU 148 Ca 0.76 1.58 -0.25 0.00 0.00 0.00 0.00 54.97 57.06 1orb s GLU 148 Cb -0.42 -3.27 -0.08 0.00 2.00 0.00 0.00 34.13 32.36 1orb s GLU 148 CO 0.47 0.36 1.39 -1.25 -0.56 0.00 0.00 175.26 175.66 1orb s PRO 149 N -0.97 3.72 0.35 4.30 0.04 -1.26 -3.80 135.00 137.37 1orb s PRO 149 Ca 0.44 2.33 0.07 0.00 0.04 0.00 0.00 61.00 63.88 1orb s PRO 149 Cb -0.27 -2.65 -0.07 0.00 0.04 0.00 0.00 34.50 31.55 1orb s PRO 149 CO 0.34 -0.76 -0.03 0.00 0.04 0.00 0.00 177.00 176.58 1orb s ALA 150 N -1.23 2.81 -0.15 8.56 0.00 -0.68 -4.89 121.76 126.19 1orb s ALA 150 Ca 0.61 -2.12 -0.05 0.00 0.00 0.00 0.00 51.96 50.40 1orb s ALA 150 Cb -0.42 0.16 -0.03 0.00 0.00 0.00 0.00 23.12 22.83 1orb s ALA 150 CO 0.54 -0.06 0.02 -1.50 0.00 0.00 0.00 175.76 174.75 1orb s ILE 151 N -2.82 4.40 0.14 0.00 -1.16 -1.26 -4.40 121.20 116.10 1orb s ILE 151 Ca 0.33 -0.19 0.05 0.00 -0.51 0.00 0.00 60.65 60.34 1orb s ILE 151 Cb 0.06 -2.93 -0.04 0.00 0.61 0.00 0.00 42.46 40.16 1orb s ILE 151 CO 0.16 0.51 -0.12 0.12 -2.81 0.00 0.00 174.94 172.80 1orb s PHE 152 N -0.01 1.34 -0.00 3.50 2.19 -1.26 -4.13 117.98 119.62 1orb s PHE 152 Ca 0.04 -0.64 0.03 0.00 0.33 0.00 0.00 56.93 56.68 1orb s PHE 152 Cb -0.13 -0.69 -0.01 0.00 -1.31 0.00 0.00 43.02 40.89 1orb s PHE 152 CO 0.02 0.13 -0.09 0.21 1.83 0.00 0.00 175.22 177.31 1orb s LYS 153 N -3.20 0.75 0.16 10.12 2.36 -1.26 -4.86 119.74 123.80 1orb s LYS 153 Ca 0.13 -0.38 0.04 0.00 -2.55 0.00 0.00 55.97 53.20 1orb s LYS 153 Cb -0.01 -0.71 -0.05 0.00 -1.05 0.00 0.00 37.83 36.01 1orb s LYS 153 CO 0.02 0.19 -0.07 0.00 1.55 0.00 0.00 175.35 177.05 1orb s ALA 154 N -0.32 1.48 -0.06 3.13 0.00 -1.26 -4.95 121.76 119.78 1orb s ALA 154 Ca 0.03 -1.55 -0.03 0.00 0.00 0.00 0.00 51.96 50.41 1orb s ALA 154 Cb -0.04 0.21 0.03 0.00 0.00 0.00 0.00 23.12 23.32 1orb s ALA 154 CO -0.00 -0.17 0.14 0.99 0.00 0.00 0.00 175.76 176.72 1orb s THR 155 N -3.41 -0.04 0.21 0.00 2.01 1.30 -4.95 115.64 110.77 1orb s THR 155 Ca 0.20 0.15 -0.30 0.00 0.31 0.00 0.00 61.69 62.04 1orb s THR 155 Cb 0.04 -0.22 -0.09 0.00 0.01 0.00 0.00 72.50 72.24 1orb s THR 155 CO 0.02 0.06 1.20 -0.22 -0.69 0.00 0.00 174.62 174.99 1orb s LEU 156 N 0.94 4.46 -0.74 4.42 2.96 -1.26 -2.00 118.68 127.47 1orb s LEU 156 Ca -0.07 2.29 -0.00 0.00 -0.22 0.00 0.00 54.13 56.12 1orb s LEU 156 Cb -0.09 -3.61 0.18 0.00 0.50 0.00 0.00 46.19 43.17 1orb s LEU 156 CO -0.05 -0.35 0.57 0.21 -1.32 0.00 0.00 176.35 175.41 1orb s ASN 157 N -0.09 5.38 0.65 3.68 3.04 0.68 -4.93 114.94 123.35 1orb s ASN 157 Ca 0.51 -3.40 0.19 0.00 0.04 0.00 0.00 52.86 50.20 1orb s ASN 157 Cb -0.33 -1.82 0.97 0.00 -1.54 0.00 0.00 41.25 38.53 1orb s ASN 157 CO 0.39 -0.23 1.54 0.03 -3.04 0.00 0.00 177.10 175.78 1orb h ARG 158 N 6.27 0.00 0.00 0.43 2.47 -1.92 0.42 114.38 122.05 1orb h ARG 158 Ca 0.08 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 1orb h ARG 158 Cb 0.85 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.17 1orb h ARG 158 CO 0.77 0.00 0.00 0.66 0.56 0.00 0.00 179.97 181.96 1orb h SER 159 N 0.00 0.00 -0.26 7.04 4.64 -1.97 -3.16 113.55 119.85 1orb h SER 159 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1orb h SER 159 Cb 1.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 1orb h SER 159 CO -0.00 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.14 1orb n LEU 160 N -3.05 2.30 -4.16 5.97 4.77 0.14 -4.61 117.00 118.36 1orb n LEU 160 Ca 0.04 -0.99 -0.25 0.00 -0.03 0.00 0.00 56.01 54.77 1orb n LEU 160 Cb 0.49 -0.17 -0.15 0.00 -2.33 0.00 0.00 43.42 41.26 1orb n LEU 160 CO 0.33 0.50 -0.50 -0.22 -1.33 0.00 0.00 177.39 176.16 1orb s LEU 161 N -1.49 2.02 0.02 2.23 2.96 -1.19 -0.98 118.68 122.25 1orb s LEU 161 Ca 0.34 -0.32 0.06 0.00 -0.22 0.00 0.00 54.13 53.99 1orb s LEU 161 Cb 0.19 -0.91 -0.02 0.00 0.50 0.00 0.00 46.19 45.95 1orb s LEU 161 CO 0.27 0.21 -0.17 -0.54 -1.32 0.00 0.00 176.35 174.80 1orb s LYS 162 N -0.37 1.24 0.51 1.98 -0.14 -0.83 -4.84 119.74 117.29 1orb s LYS 162 Ca 0.06 -0.76 0.06 0.00 -1.36 0.00 0.00 55.97 53.97 1orb s LYS 162 Cb -0.07 -1.27 0.02 0.00 -1.68 0.00 0.00 37.83 34.83 1orb s LYS 162 CO -0.00 0.33 0.36 0.95 -0.76 0.00 0.00 175.35 176.23 1orb s THR 163 N -0.66 1.84 0.12 2.17 -4.23 -1.26 -3.74 115.64 109.88 1orb s THR 163 Ca 0.05 -1.51 -0.31 0.00 -1.18 0.00 0.00 61.69 58.74 1orb s THR 163 Cb -0.08 -2.35 -0.11 0.00 1.34 0.00 0.00 72.50 71.31 1orb s THR 163 CO 0.01 0.00 1.51 0.22 -0.54 0.00 0.00 174.62 175.82 1orb h TYR 164 N 0.88 -1.57 -0.63 3.99 3.20 -2.00 0.28 116.97 121.12 1orb h TYR 164 Ca -0.38 0.07 0.11 0.00 3.14 0.00 0.00 58.73 61.66 1orb h TYR 164 Cb 1.29 0.73 -0.08 0.00 1.54 0.00 0.00 36.73 40.21 1orb h TYR 164 CO 0.90 -0.47 0.22 0.93 -1.64 0.00 0.00 178.16 178.09 1orb h GLU 165 N -0.43 0.37 -0.63 1.82 4.39 -1.98 0.39 114.58 118.50 1orb h GLU 165 Ca 0.06 -0.02 -0.07 0.00 0.34 0.00 0.00 59.36 59.67 1orb h GLU 165 Cb 0.58 -0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.12 1orb h GLU 165 CO -0.51 0.24 0.13 1.96 -1.16 0.00 0.00 179.01 179.67 1orb h GLN 166 N 0.38 1.01 0.00 2.33 4.20 -1.63 -0.23 115.11 121.17 1orb h GLN 166 Ca 0.33 -0.24 -0.08 0.00 0.06 0.00 0.00 58.65 58.72 1orb h GLN 166 Cb 0.44 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 1orb h GLN 166 CO -0.34 0.91 -0.36 0.28 -0.67 0.00 0.00 178.83 178.65 1orb h VAL 167 N 0.96 0.71 0.05 -0.54 2.07 0.11 -2.44 116.25 117.18 1orb h VAL 167 Ca 0.20 -1.66 -0.00 0.00 0.82 0.00 0.00 66.70 66.06 1orb h VAL 167 Cb 0.37 2.09 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 1orb h VAL 167 CO 0.00 0.35 -0.03 0.25 0.02 0.00 0.00 177.57 178.17 1orb h LEU 168 N 0.00 -0.06 -0.99 2.57 5.85 0.24 -2.88 115.31 120.03 1orb h LEU 168 Ca -0.00 -0.37 0.14 0.00 0.84 0.00 0.00 57.88 58.49 1orb h LEU 168 Cb 1.06 0.02 -0.09 0.00 0.37 0.00 0.00 40.66 42.02 1orb h LEU 168 CO 0.05 0.35 0.61 -0.33 -0.34 0.00 0.00 178.44 178.78 1orb h GLU 169 N -0.48 0.88 0.00 1.25 5.08 -1.01 0.64 114.58 120.94 1orb h GLU 169 Ca -0.01 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1orb h GLU 169 Cb 0.42 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1orb h GLU 169 CO 0.01 0.58 0.15 -0.97 -1.00 0.00 0.00 179.01 177.78 1orb h ASN 170 N 0.91 0.00 -0.66 1.42 -0.73 -1.25 0.39 115.58 115.67 1orb h ASN 170 Ca 0.52 0.00 -0.05 0.00 1.87 0.00 0.00 56.30 58.64 1orb h ASN 170 Cb 0.61 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.17 1orb h ASN 170 CO -0.30 0.00 0.22 -0.07 -0.37 0.00 0.00 177.43 176.91 1orb h LEU 171 N 0.00 0.97 0.04 0.34 3.38 0.49 -0.06 115.31 120.47 1orb h LEU 171 Ca 0.00 -0.17 -0.30 0.00 0.09 0.00 0.00 57.88 57.50 1orb h LEU 171 Cb 0.29 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1orb h LEU 171 CO 0.00 0.90 -1.68 -0.62 0.09 0.00 0.00 178.44 177.13 1orb n GLU 172 N -4.27 0.64 0.03 1.13 -0.58 0.11 -4.39 120.64 113.31 1orb n GLU 172 Ca 0.06 0.43 -0.04 0.00 -0.42 0.00 0.00 57.16 57.19 1orb n GLU 172 Cb 0.21 -1.70 0.19 0.00 -0.57 0.00 0.00 31.44 29.58 1orb n GLU 172 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1orb h SER 173 N -0.59 0.44 -1.72 1.62 4.64 -0.82 -3.45 113.55 113.66 1orb h SER 173 Ca -0.42 -0.16 -0.36 0.00 -0.47 0.00 0.00 61.79 60.38 1orb h SER 173 Cb 1.61 -0.12 -0.08 0.00 -0.31 0.00 0.00 62.40 63.50 1orb h SER 173 CO -0.12 0.74 -0.40 0.29 -0.87 0.00 0.00 176.83 176.47 1orb n LYS 174 N -4.09 -1.34 0.22 4.77 5.02 -0.04 -4.88 118.16 117.83 1orb n LYS 174 Ca -0.01 1.00 0.13 0.00 -2.02 0.00 0.00 58.31 57.41 1orb n LYS 174 Cb 0.44 -5.38 0.26 0.00 -0.02 0.00 0.00 35.03 30.33 1orb n LYS 174 CO 0.00 0.00 0.00 0.07 -0.52 0.00 0.00 177.40 176.95 1orb h ARG 175 N 0.00 0.00 -6.04 1.97 0.11 -1.89 -3.45 114.38 105.08 1orb h ARG 175 Ca -0.40 0.00 -0.55 0.00 0.10 0.00 0.00 59.98 59.13 1orb h ARG 175 Cb 1.24 0.00 -0.17 0.00 1.11 0.00 0.00 29.97 32.16 1orb h ARG 175 CO 0.52 0.00 -0.78 -0.06 0.10 0.00 0.00 179.97 179.75 1orb s PHE 176 N -3.26 1.98 -0.02 4.08 0.40 -1.26 -4.48 117.98 115.42 1orb s PHE 176 Ca 0.06 -0.44 -0.24 0.00 -0.60 0.00 0.00 56.93 55.72 1orb s PHE 176 Cb 0.06 -0.94 -0.04 0.00 0.51 0.00 0.00 43.02 42.60 1orb s PHE 176 CO 0.64 0.45 0.72 -0.65 0.70 0.00 0.00 175.22 177.09 1orb s GLN 177 N -3.08 4.45 -0.35 0.44 -0.21 0.24 -4.86 119.66 116.28 1orb s GLN 177 Ca 0.21 0.95 -0.13 0.00 0.02 0.00 0.00 55.36 56.41 1orb s GLN 177 Cb -0.05 -3.41 -0.01 0.00 1.00 0.00 0.00 33.01 30.54 1orb s GLN 177 CO 0.09 0.16 0.24 -1.17 -2.12 0.00 0.00 175.29 172.49 1orb s LEU 178 N 0.42 4.57 -0.09 2.90 2.96 -1.26 0.61 118.68 128.79 1orb s LEU 178 Ca 0.38 -0.54 0.05 0.00 -0.22 0.00 0.00 54.13 53.79 1orb s LEU 178 Cb -0.19 -2.12 -0.00 0.00 0.50 0.00 0.00 46.19 44.38 1orb s LEU 178 CO 0.20 -0.27 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.03 1orb s VAL 179 N 1.69 2.02 -0.27 1.68 1.01 0.24 0.13 120.40 126.89 1orb s VAL 179 Ca 0.05 -1.01 -0.12 0.00 0.00 0.00 0.00 61.98 60.91 1orb s VAL 179 Cb -0.18 -1.74 -0.05 0.00 0.00 0.00 0.00 36.38 34.42 1orb s VAL 179 CO 0.10 0.55 0.23 -0.62 0.00 0.00 0.00 175.10 175.36 1orb s ASP 180 N 0.21 6.09 -0.01 3.32 -1.08 0.32 -1.56 116.67 123.97 1orb s ASP 180 Ca -0.15 0.08 0.11 0.00 -0.52 0.00 0.00 52.55 52.08 1orb s ASP 180 Cb -0.17 -2.14 0.32 0.00 -1.46 0.00 0.00 42.92 39.48 1orb s ASP 180 CO 0.07 -0.06 1.26 -1.54 0.52 0.00 0.00 175.17 175.42 1orb n SER 181 N 4.98 2.02 -4.84 -0.34 3.41 -0.73 0.14 113.62 118.26 1orb n SER 181 Ca -0.13 -2.03 -0.30 0.00 -0.26 0.00 0.00 58.87 56.15 1orb n SER 181 Cb 0.52 -0.26 0.07 0.00 -0.26 0.00 0.00 64.21 64.27 1orb n SER 181 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1orb s ARG 182 N -1.54 2.48 0.38 4.33 0.52 -1.26 -1.68 118.95 122.18 1orb s ARG 182 Ca 0.24 0.59 -0.27 0.00 -0.52 0.00 0.00 55.73 55.77 1orb s ARG 182 Cb 0.13 -1.97 -0.11 0.00 0.52 0.00 0.00 34.95 33.52 1orb s ARG 182 CO 0.16 -1.33 1.30 0.00 0.02 0.00 0.00 175.30 175.45 1orb n ALA 183 N -3.23 1.38 -0.25 2.13 0.00 -1.26 -4.10 120.51 115.18 1orb n ALA 183 Ca 0.07 0.32 0.05 0.00 0.00 0.00 0.00 53.44 53.88 1orb n ALA 183 Cb 0.56 -2.27 0.17 0.00 0.00 0.00 0.00 19.45 17.91 1orb n ALA 183 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1orb h GLN 184 N 2.39 0.18 -0.29 0.00 4.15 -1.98 0.02 115.11 119.58 1orb h GLN 184 Ca -0.47 -0.01 0.03 0.00 0.77 0.00 0.00 58.65 58.97 1orb h GLN 184 Cb 1.28 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.90 1orb h GLN 184 CO 0.62 0.12 0.10 0.78 -1.93 0.00 0.00 178.83 178.51 1orb h GLY 185 N 0.19 0.36 1.95 2.39 0.00 -1.94 0.52 103.07 106.53 1orb h GLY 185 Ca 0.41 -0.06 -0.06 0.00 0.00 0.00 0.00 47.33 47.62 1orb h GLY 185 CO -0.57 0.03 -0.28 3.21 0.00 0.00 0.00 176.54 178.93 1orb h ARG 186 N 0.22 0.06 -0.25 4.80 3.08 -1.28 -1.20 114.38 119.80 1orb h ARG 186 Ca 0.13 -0.02 -0.12 0.00 0.07 0.00 0.00 59.98 60.04 1orb h ARG 186 Cb 0.10 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 1orb h ARG 186 CO -0.14 0.34 -0.32 -0.92 -1.07 0.00 0.00 179.97 177.86 1orb h TYR 187 N 0.05 0.81 0.00 3.04 5.03 0.17 -1.92 116.97 124.16 1orb h TYR 187 Ca 0.01 -0.26 0.00 0.00 2.58 0.00 0.00 58.73 61.06 1orb h TYR 187 Cb 0.52 -0.16 0.00 0.00 1.55 0.00 0.00 36.73 38.64 1orb h TYR 187 CO 0.00 1.01 0.00 -0.07 -1.32 0.00 0.00 178.16 177.78 1orb h LEU 188 N 0.38 0.00 0.00 2.82 3.38 0.26 -3.24 115.31 118.92 1orb h LEU 188 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1orb h LEU 188 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1orb h LEU 188 CO 0.08 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.22 1orb n GLY 189 N 0.48 0.50 0.18 0.83 0.00 -0.53 -0.65 105.19 105.99 1orb n GLY 189 Ca 0.02 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.05 1orb n GLY 189 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1orb h THR 190 N 0.00 1.31 -3.21 2.61 2.02 -1.60 -3.41 112.91 110.62 1orb h THR 190 Ca 0.00 -1.48 -0.55 0.00 0.77 0.00 0.00 66.41 65.16 1orb h THR 190 Cb 0.00 1.77 -0.18 0.00 -1.74 0.00 0.00 68.15 68.00 1orb h THR 190 CO 0.00 0.43 -0.79 -1.10 0.37 0.00 0.00 175.52 174.43 1orb s GLN 191 N -4.08 1.34 0.39 6.66 -1.52 -1.11 -4.99 119.66 116.35 1orb s GLN 191 Ca -0.03 -1.45 -0.06 0.00 -1.95 0.00 0.00 55.36 51.87 1orb s GLN 191 Cb 0.14 -1.43 -0.05 0.00 -0.22 0.00 0.00 33.01 31.45 1orb s GLN 191 CO 0.74 0.29 0.69 -1.25 -0.25 0.00 0.00 175.29 175.52 1orb s PRO 192 N -2.84 3.64 0.07 2.91 0.04 -1.26 -4.24 135.00 133.31 1orb s PRO 192 Ca 0.17 0.19 -0.30 0.00 0.04 0.00 0.00 61.00 61.10 1orb s PRO 192 Cb -0.06 -2.48 -0.05 0.00 0.04 0.00 0.00 34.50 31.95 1orb s PRO 192 CO 0.08 -0.00 1.00 -1.21 0.04 0.00 0.00 177.00 176.90 1orb s GLU 193 N -4.08 4.62 0.83 4.56 0.41 -1.26 -4.91 118.70 118.86 1orb s GLU 193 Ca 0.47 1.48 -0.07 0.00 -0.41 0.00 0.00 54.97 56.44 1orb s GLU 193 Cb -0.10 -3.40 0.16 0.00 -1.78 0.00 0.00 34.13 29.00 1orb s GLU 193 CO 0.35 0.06 1.14 -1.25 -0.49 0.00 0.00 175.26 175.08 1orb s PRO 194 N 0.46 1.23 -0.97 0.39 0.04 -1.26 -4.41 135.00 130.49 1orb s PRO 194 Ca 0.50 -0.80 -0.05 0.00 0.04 0.00 0.00 61.00 60.69 1orb s PRO 194 Cb -0.23 -2.12 0.04 0.00 0.04 0.00 0.00 34.50 32.23 1orb s PRO 194 CO 0.29 -1.87 0.22 -0.25 0.04 0.00 0.00 177.00 175.44 1orb n ASP 195 N -3.24 -3.11 -4.07 6.66 8.00 -1.26 -4.96 116.55 114.57 1orb n ASP 195 Ca 0.15 -0.05 -0.10 0.00 0.71 0.00 0.00 54.79 55.50 1orb n ASP 195 Cb 0.60 -2.65 -0.11 0.00 -0.02 0.00 0.00 41.12 38.95 1orb n ASP 195 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1orb s ALA 196 N -2.64 0.51 -0.27 2.24 0.00 -1.26 -5.13 121.76 115.21 1orb s ALA 196 Ca 0.20 -0.94 -0.08 0.00 0.00 0.00 0.00 51.96 51.14 1orb s ALA 196 Cb -0.11 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 1orb s ALA 196 CO 0.25 -0.18 0.10 0.08 0.00 0.00 0.00 175.76 176.01 1orb s VAL 197 N -2.45 4.49 -0.05 0.00 1.01 -1.26 -4.42 120.40 117.73 1orb s VAL 197 Ca -0.03 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 61.75 1orb s VAL 197 Cb -0.03 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.20 1orb s VAL 197 CO -0.03 0.26 0.00 0.61 0.00 0.00 0.00 175.10 175.94 1orb n GLY 198 N 4.95 0.31 3.58 4.51 0.00 -1.26 -4.97 105.19 112.31 1orb n GLY 198 Ca -0.15 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1orb n GLY 198 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1orb s LEU 199 N -0.10 4.13 0.65 0.99 2.96 -1.26 -5.03 118.68 121.02 1orb s LEU 199 Ca 0.00 0.29 -0.11 0.00 -0.22 0.00 0.00 54.13 54.09 1orb s LEU 199 Cb 0.00 -3.04 -0.02 0.00 0.50 0.00 0.00 46.19 43.63 1orb s LEU 199 CO 0.00 -0.79 1.04 -0.62 -1.32 0.00 0.00 176.35 174.67 1orb s ASP 200 N 1.91 5.80 0.40 3.68 -1.08 -1.26 -4.43 116.67 121.69 1orb s ASP 200 Ca 0.32 1.54 0.08 0.00 -0.52 0.00 0.00 52.55 53.96 1orb s ASP 200 Cb -0.13 -2.49 0.00 0.00 -1.46 0.00 0.00 42.92 38.85 1orb s ASP 200 CO 0.18 -1.16 0.53 -0.94 0.52 0.00 0.00 175.17 174.30 1orb s SER 201 N -3.90 5.72 0.00 -0.34 1.04 -1.26 -4.80 113.70 110.16 1orb s SER 201 Ca 0.57 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.63 1orb s SER 201 Cb -0.13 -0.82 0.00 0.00 0.10 0.00 0.00 66.02 65.18 1orb s SER 201 CO 0.53 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.70 1orb n GLY 202 N -1.78 0.85 3.28 7.32 0.00 -0.73 -4.66 105.19 109.48 1orb n GLY 202 Ca 0.06 -1.89 -0.10 0.00 0.00 0.00 0.00 46.02 44.08 1orb n GLY 202 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1orb s HIS 203 N -2.64 -0.09 0.57 1.61 -3.43 -0.80 -4.52 115.29 105.99 1orb s HIS 203 Ca 0.00 -0.26 -0.20 0.00 -0.80 0.00 0.00 55.06 53.80 1orb s HIS 203 Cb 0.00 0.15 -0.04 0.00 -1.43 0.00 0.00 32.58 31.27 1orb s HIS 203 CO 0.00 -0.65 1.30 0.42 -2.00 0.00 0.00 174.74 173.81 1orb s ILE 204 N -3.80 2.23 0.53 -5.38 1.01 -1.26 -2.06 121.20 112.48 1orb s ILE 204 Ca 0.03 0.16 -0.21 0.00 0.00 0.00 0.00 60.65 60.64 1orb s ILE 204 Cb 0.03 -3.07 -0.05 0.00 0.01 0.00 0.00 42.46 39.37 1orb s ILE 204 CO -0.12 -0.02 1.24 -0.13 0.00 0.00 0.00 174.94 175.92 1orb s ARG 205 N -3.09 3.28 -1.41 2.79 0.52 0.30 -2.93 118.95 118.42 1orb s ARG 205 Ca 0.75 1.94 -0.00 0.00 -0.52 0.00 0.00 55.73 57.90 1orb s ARG 205 Cb -0.37 -2.19 0.00 0.00 0.52 0.00 0.00 34.95 32.91 1orb s ARG 205 CO 0.42 -0.99 0.05 0.41 0.02 0.00 0.00 175.30 175.21 1orb n GLY 206 N 0.56 -0.32 3.97 -3.53 0.00 -1.26 -5.03 105.19 99.59 1orb n GLY 206 Ca 0.11 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.75 1orb n GLY 206 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1orb s SER 207 N -2.30 5.91 0.14 1.61 0.01 -1.15 -4.50 113.70 113.42 1orb s SER 207 Ca 0.02 0.02 0.11 0.00 1.31 0.00 0.00 55.95 57.42 1orb s SER 207 Cb -0.01 -1.37 -0.04 0.00 0.21 0.00 0.00 66.02 64.81 1orb s SER 207 CO 0.03 -0.55 -0.26 0.68 0.41 0.00 0.00 173.24 173.55 1orb s VAL 208 N -2.34 2.24 -0.30 3.43 -7.23 0.34 -4.92 120.40 111.61 1orb s VAL 208 Ca 0.46 -1.81 -0.14 0.00 -1.81 0.00 0.00 61.98 58.69 1orb s VAL 208 Cb -0.10 -2.00 -0.03 0.00 0.56 0.00 0.00 36.38 34.81 1orb s VAL 208 CO 0.34 0.03 0.30 0.21 -0.31 0.00 0.00 175.10 175.67 1orb s ASN 209 N -2.19 6.14 -0.47 4.85 2.47 -1.26 0.12 114.94 124.60 1orb s ASN 209 Ca 0.15 -0.01 0.03 0.00 0.42 0.00 0.00 52.86 53.45 1orb s ASN 209 Cb -0.09 -2.17 0.15 0.00 -1.45 0.00 0.00 41.25 37.68 1orb s ASN 209 CO 0.07 -0.19 0.30 -0.04 -3.72 0.00 0.00 177.10 173.52 1orb s MET 210 N 1.93 1.34 -0.32 0.43 -1.94 0.38 -4.91 119.30 116.21 1orb s MET 210 Ca 0.11 -2.20 -0.35 0.00 -1.71 0.00 0.00 55.69 51.55 1orb s MET 210 Cb -0.16 -2.24 -0.11 0.00 2.01 0.00 0.00 34.83 34.33 1orb s MET 210 CO 0.11 -1.23 2.17 -2.30 -0.01 0.00 0.00 175.02 173.75 1orb n PRO 211 N 3.18 1.23 -0.28 2.03 -0.02 -1.26 -3.99 135.00 135.89 1orb n PRO 211 Ca 0.15 0.34 0.02 0.00 -2.02 0.00 0.00 63.50 62.00 1orb n PRO 211 Cb 0.38 -2.54 0.07 0.00 -0.02 0.00 0.00 33.50 31.38 1orb n PRO 211 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 1orb n PHE 212 N 9.77 0.16 0.08 6.00 -1.74 -0.68 -0.06 117.46 130.99 1orb n PHE 212 Ca 0.39 0.91 0.04 0.00 -0.56 0.00 0.00 57.45 58.23 1orb n PHE 212 Cb 0.25 -0.87 0.24 0.00 1.52 0.00 0.00 39.48 40.62 1orb n PHE 212 CO 0.00 0.00 0.00 -1.33 -0.56 0.00 0.00 176.76 174.87 1orb n MET 213 N -5.17 0.06 0.13 3.97 0.00 -1.26 -1.55 117.12 113.30 1orb n MET 213 Ca 0.10 0.51 0.13 0.00 0.00 0.00 0.00 57.70 58.44 1orb n MET 213 Cb 0.34 -1.78 0.46 0.00 0.00 0.00 0.00 33.22 32.25 1orb n MET 213 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 175.97 175.06 1orb h ASN 214 N 0.00 0.00 -0.07 7.83 2.35 -0.84 -2.96 115.58 121.89 1orb h ASN 214 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1orb h ASN 214 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1orb h ASN 214 CO 0.00 0.00 0.00 0.49 -1.65 0.00 0.00 177.43 176.27 1orb n PHE 215 N -2.31 0.08 -4.37 1.19 3.72 -0.60 -4.92 117.46 110.25 1orb n PHE 215 Ca 0.03 -0.04 -0.24 0.00 -0.05 0.00 0.00 57.45 57.15 1orb n PHE 215 Cb 0.31 0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.76 1orb n PHE 215 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1orb s LEU 216 N -1.87 2.93 0.22 4.37 1.43 -1.12 -1.62 118.68 123.03 1orb s LEU 216 Ca 0.35 -0.91 0.06 0.00 -1.03 0.00 0.00 54.13 52.61 1orb s LEU 216 Cb 0.20 -1.38 -0.04 0.00 0.03 0.00 0.00 46.19 45.01 1orb s LEU 216 CO 0.31 -0.10 0.18 0.42 0.23 0.00 0.00 176.35 177.39 1orb s THR 217 N -2.47 4.50 0.35 5.49 -4.23 0.03 -4.82 115.64 114.50 1orb s THR 217 Ca 0.33 -1.27 0.16 0.00 -1.18 0.00 0.00 61.69 59.72 1orb s THR 217 Cb -0.03 -3.38 0.36 0.00 1.34 0.00 0.00 72.50 70.79 1orb s THR 217 CO 0.18 -0.26 1.58 -0.08 -0.54 0.00 0.00 174.62 175.50 1orb h GLU 218 N 1.80 0.03 0.00 3.99 4.81 -1.96 1.74 114.58 124.99 1orb h GLU 218 Ca -0.48 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1orb h GLU 218 Cb 1.22 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1orb h GLU 218 CO 0.62 0.02 0.00 -0.25 -0.73 0.00 0.00 179.01 178.66 1orb n ASP 219 N -5.30 0.00 -0.25 1.04 8.00 -1.26 -4.89 116.55 113.90 1orb n ASP 219 Ca 0.34 0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.97 1orb n ASP 219 Cb 1.14 -0.36 0.00 0.00 -0.02 0.00 0.00 41.12 41.88 1orb n ASP 219 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1orb n GLY 220 N 0.86 0.95 3.41 0.44 0.00 0.59 -4.88 105.19 106.56 1orb n GLY 220 Ca 0.10 -0.51 -0.29 0.00 0.00 0.00 0.00 46.02 45.32 1orb n GLY 220 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1orb s PHE 221 N -2.49 2.35 0.58 1.61 0.08 -1.24 -3.16 117.98 115.71 1orb s PHE 221 Ca 0.00 -0.36 -0.20 0.00 0.12 0.00 0.00 56.93 56.49 1orb s PHE 221 Cb 0.00 -1.26 -0.03 0.00 -0.57 0.00 0.00 43.02 41.15 1orb s PHE 221 CO 0.00 0.36 1.33 -2.00 -0.10 0.00 0.00 175.22 174.81 1orb s GLU 222 N -2.11 2.93 1.04 0.44 2.56 -1.26 -0.79 118.70 121.51 1orb s GLU 222 Ca 0.15 2.17 -0.14 0.00 0.00 0.00 0.00 54.97 57.16 1orb s GLU 222 Cb -0.10 -2.11 0.21 0.00 2.00 0.00 0.00 34.13 34.13 1orb s GLU 222 CO 0.07 -1.34 1.10 0.15 -0.56 0.00 0.00 175.26 174.69 1orb s LYS 223 N -3.08 0.08 0.20 4.30 1.02 -0.64 -4.77 119.74 116.85 1orb s LYS 223 Ca 0.76 0.36 -0.11 0.00 0.02 0.00 0.00 55.97 56.99 1orb s LYS 223 Cb -0.39 -1.71 -0.07 0.00 -0.52 0.00 0.00 37.83 35.13 1orb s LYS 223 CO 0.45 -2.93 0.55 -1.54 -0.92 0.00 0.00 175.35 170.96 1orb s SER 224 N -3.59 6.69 0.35 2.83 1.04 -1.26 -4.82 113.70 114.94 1orb s SER 224 Ca 0.66 0.98 0.20 0.00 0.48 0.00 0.00 55.95 58.28 1orb s SER 224 Cb -0.17 -2.25 1.27 0.00 0.10 0.00 0.00 66.02 64.98 1orb s SER 224 CO 0.57 -0.01 1.47 -2.65 0.98 0.00 0.00 173.24 173.60 1orb n PRO 225 N 0.19 -0.05 -0.17 4.02 -0.02 -1.26 0.24 135.00 137.95 1orb n PRO 225 Ca -0.02 1.28 -0.10 0.00 -2.02 0.00 0.00 63.50 62.65 1orb n PRO 225 Cb 0.52 -2.31 0.01 0.00 -0.02 0.00 0.00 33.50 31.70 1orb n PRO 225 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1orb h GLU 226 N 0.00 0.87 -0.01 -0.52 3.07 -1.96 0.13 114.58 116.15 1orb h GLU 226 Ca 0.80 -0.26 -0.00 0.00 -0.50 0.00 0.00 59.36 59.39 1orb h GLU 226 Cb 2.14 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 29.97 1orb h GLU 226 CO -0.69 0.89 0.00 0.93 -1.40 0.00 0.00 179.01 178.73 1orb h GLU 227 N 0.73 0.02 -0.20 2.33 5.08 0.28 -2.48 114.58 120.34 1orb h GLU 227 Ca 0.15 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.52 1orb h GLU 227 Cb 0.48 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 1orb h GLU 227 CO 0.02 0.32 0.05 -0.07 -1.00 0.00 0.00 179.01 178.34 1orb h LEU 228 N -0.28 0.04 -0.71 1.33 3.38 -0.87 -2.17 115.31 116.02 1orb h LEU 228 Ca 0.00 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.09 1orb h LEU 228 Cb 0.31 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 41.02 1orb h LEU 228 CO 0.00 0.05 0.35 -0.09 0.09 0.00 0.00 178.44 178.84 1orb h ARG 229 N 0.14 0.58 0.00 1.13 2.43 -0.77 0.14 114.38 118.04 1orb h ARG 229 Ca 0.09 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.16 1orb h ARG 229 Cb 0.07 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 1orb h ARG 229 CO -0.11 0.38 -0.31 0.00 -1.51 0.00 0.00 179.97 178.42 1orb h ALA 230 N 1.43 1.21 0.58 2.80 0.00 -1.13 -2.13 119.26 122.01 1orb h ALA 230 Ca 0.35 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1orb h ALA 230 Cb 0.36 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.11 1orb h ALA 230 CO -0.27 0.39 -0.28 0.52 0.00 0.00 0.00 179.25 179.62 1orb h MET 231 N 0.00 -0.75 -0.92 0.00 2.86 -0.39 0.32 114.93 116.05 1orb h MET 231 Ca -0.00 0.05 0.21 0.00 -2.06 0.00 0.00 59.70 57.90 1orb h MET 231 Cb 0.67 0.17 -0.07 0.00 0.06 0.00 0.00 31.60 32.43 1orb h MET 231 CO 0.04 -0.47 0.61 0.74 1.06 0.00 0.00 176.91 178.89 1orb h PHE 232 N -1.17 0.55 0.10 -0.22 0.04 -1.19 -1.41 116.94 113.63 1orb h PHE 232 Ca -0.08 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.70 1orb h PHE 232 Cb 0.62 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.60 1orb h PHE 232 CO 0.00 0.13 -0.05 1.49 -0.60 0.00 0.00 178.31 179.29 1orb h GLU 233 N 0.40 -0.13 -0.16 1.51 4.81 -1.18 0.76 114.58 120.59 1orb h GLU 233 Ca 0.48 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.77 1orb h GLU 233 Cb 1.22 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.62 1orb h GLU 233 CO -0.19 0.19 0.25 0.00 -0.73 0.00 0.00 179.01 178.54 1orb h ALA 234 N 0.38 1.66 -0.02 2.92 0.00 0.71 0.29 119.26 125.21 1orb h ALA 234 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1orb h ALA 234 Cb 0.39 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1orb h ALA 234 CO 0.02 -0.34 -0.02 1.63 0.00 0.00 0.00 179.25 180.55 1orb n LYS 235 N -3.49 1.64 -2.50 0.00 4.76 -0.92 -4.95 118.16 112.70 1orb n LYS 235 Ca 0.01 -0.99 -0.19 0.00 -2.87 0.00 0.00 58.31 54.27 1orb n LYS 235 Cb 0.36 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 32.07 1orb n LYS 235 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1orb n LYS 236 N 0.18 -2.22 -3.63 1.97 4.76 0.10 -4.96 118.16 114.37 1orb n LYS 236 Ca 0.18 0.90 -0.38 0.00 -2.87 0.00 0.00 58.31 56.15 1orb n LYS 236 Cb 0.37 -5.49 -0.11 0.00 -1.84 0.00 0.00 35.03 27.96 1orb n LYS 236 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1orb s VAL 237 N -2.99 5.14 -0.47 -0.18 1.01 0.20 -5.04 120.40 118.08 1orb s VAL 237 Ca 0.07 0.11 -0.18 0.00 0.00 0.00 0.00 61.98 61.98 1orb s VAL 237 Cb -0.03 -3.44 0.05 0.00 0.00 0.00 0.00 36.38 32.96 1orb s VAL 237 CO 0.08 0.27 0.53 -0.62 0.00 0.00 0.00 175.10 175.36 1orb s ASP 238 N 1.67 6.21 0.31 3.32 2.15 -1.26 -4.20 116.67 124.87 1orb s ASP 238 Ca 0.07 -0.87 0.18 0.00 0.43 0.00 0.00 52.55 52.36 1orb s ASP 238 Cb -0.16 -2.25 0.96 0.00 -0.30 0.00 0.00 42.92 41.18 1orb s ASP 238 CO 0.09 -0.74 1.50 0.18 -0.17 0.00 0.00 175.17 176.03 1orb n LEU 239 N 5.82 0.46 0.08 -1.34 4.77 -1.26 -0.66 117.00 124.87 1orb n LEU 239 Ca -0.07 0.67 -0.08 0.00 -0.03 0.00 0.00 56.01 56.50 1orb n LEU 239 Cb 0.46 -0.70 -0.09 0.00 -2.33 0.00 0.00 43.42 40.76 1orb n LEU 239 CO 0.50 -0.83 0.14 0.74 -1.33 0.00 0.00 177.39 176.61 1orb h THR 240 N 0.00 1.64 -2.45 -5.08 2.02 -2.02 -3.46 112.91 103.56 1orb h THR 240 Ca 0.00 -3.21 -0.45 0.00 0.77 0.00 0.00 66.41 63.52 1orb h THR 240 Cb 0.23 2.79 0.03 0.00 -1.74 0.00 0.00 68.15 69.46 1orb h THR 240 CO 0.00 0.92 -0.14 -0.54 0.37 0.00 0.00 175.52 176.13 1orb s LYS 241 N -2.80 2.96 0.44 6.66 1.02 0.16 -5.06 119.74 123.12 1orb s LYS 241 Ca -0.00 -0.69 -0.25 0.00 0.02 0.00 0.00 55.97 55.05 1orb s LYS 241 Cb 0.10 -2.61 -0.08 0.00 -0.52 0.00 0.00 37.83 34.72 1orb s LYS 241 CO 0.83 -0.29 1.34 -1.25 -0.92 0.00 0.00 175.35 175.05 1orb s PRO 242 N -4.51 3.76 -0.01 -1.68 0.05 -1.26 -4.88 135.00 126.47 1orb s PRO 242 Ca 0.50 2.22 -0.00 0.00 0.05 0.00 0.00 61.00 63.77 1orb s PRO 242 Cb -0.10 -2.64 0.01 0.00 0.05 0.00 0.00 34.50 31.82 1orb s PRO 242 CO 0.36 -0.69 0.01 -1.17 0.05 0.00 0.00 177.00 175.57 1orb s LEU 243 N -2.70 1.67 -0.12 -3.56 0.20 -1.26 0.80 118.68 113.70 1orb s LEU 243 Ca 0.60 0.02 0.03 0.00 0.69 0.00 0.00 54.13 55.47 1orb s LEU 243 Cb -0.39 -0.02 0.01 0.00 -0.43 0.00 0.00 46.19 45.35 1orb s LEU 243 CO 0.50 -0.05 -0.22 -0.63 -0.29 0.00 0.00 176.35 175.67 1orb s ILE 244 N 0.39 1.98 -0.08 6.68 1.01 0.20 -1.59 121.20 129.78 1orb s ILE 244 Ca -0.03 -0.94 -0.01 0.00 0.00 0.00 0.00 60.65 59.66 1orb s ILE 244 Cb -0.05 -1.75 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 1orb s ILE 244 CO -0.01 0.54 -0.01 0.00 0.00 0.00 0.00 174.94 175.45 1orb s ALA 245 N 0.70 3.22 0.29 9.38 0.00 -0.55 -0.59 121.76 134.20 1orb s ALA 245 Ca -0.10 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.06 1orb s ALA 245 Cb -0.16 -1.43 -0.04 0.00 0.00 0.00 0.00 23.12 21.48 1orb s ALA 245 CO 0.01 0.57 0.15 0.95 0.00 0.00 0.00 175.76 177.45 1orb s THR 246 N -0.83 0.32 0.00 0.00 -4.23 -0.60 -0.48 115.64 109.81 1orb s THR 246 Ca 0.13 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.64 1orb s THR 246 Cb -0.11 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.20 1orb s THR 246 CO 0.02 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.10 1orb n ARG 248 N 0.00 0.52 -1.25 0.00 3.00 -1.26 -2.16 116.66 115.52 1orb n ARG 248 Ca 0.00 0.23 0.04 0.00 -0.00 0.00 0.00 57.85 58.12 1orb n ARG 248 Cb 0.00 -1.37 0.06 0.00 0.00 0.00 0.00 32.46 31.15 1orb n ARG 248 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 1orb n LYS 249 N -4.11 0.38 -2.89 -0.14 2.85 -1.26 -1.67 118.16 111.32 1orb n LYS 249 Ca -0.48 -2.28 -0.20 0.00 -1.05 0.00 0.00 58.31 54.31 1orb n LYS 249 Cb 0.84 -0.40 0.03 0.00 -0.65 0.00 0.00 35.03 34.84 1orb n LYS 249 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1orb n GLY 250 N 0.09 -0.41 0.08 2.58 0.00 -1.24 -4.82 105.19 101.47 1orb n GLY 250 Ca 0.09 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1orb n GLY 250 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1orb n VAL 251 N -4.37 0.00 1.39 1.61 0.31 -1.26 -4.56 118.33 111.45 1orb n VAL 251 Ca -0.12 0.31 0.02 0.00 -0.01 0.00 0.00 64.34 64.55 1orb n VAL 251 Cb 0.62 -1.30 0.11 0.00 -0.91 0.00 0.00 33.84 32.36 1orb n VAL 251 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1orb n THR 252 N -2.18 0.00 0.18 2.52 -2.24 -1.26 -1.98 114.28 109.31 1orb n THR 252 Ca 0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 1orb n THR 252 Cb 0.00 -0.24 0.23 0.00 -2.10 0.00 0.00 70.33 68.23 1orb n THR 252 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1orb h ALA 253 N 2.56 0.87 0.00 6.98 0.00 -1.81 -2.03 119.26 125.83 1orb h ALA 253 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1orb h ALA 253 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1orb h ALA 253 CO 0.00 0.48 0.00 0.00 0.00 0.00 0.00 179.25 179.73 1orb h HIS 255 N 0.00 0.00 -0.13 0.00 3.86 -1.54 -2.37 115.15 114.97 1orb h HIS 255 Ca 0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 1orb h HIS 255 Cb 0.18 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.65 1orb h HIS 255 CO 0.00 0.34 -0.12 0.82 0.86 0.00 0.00 177.93 179.84 1orb h ILE 256 N 0.00 1.34 -0.70 2.45 1.08 -0.44 -2.45 117.51 118.80 1orb h ILE 256 Ca -0.00 -1.25 0.06 0.00 -0.39 0.00 0.00 64.86 63.28 1orb h ILE 256 Cb 1.04 1.88 -0.06 0.00 -3.07 0.00 0.00 36.82 36.61 1orb h ILE 256 CO 0.04 0.36 0.39 0.00 -0.69 0.00 0.00 178.15 178.26 1orb h ALA 257 N 0.61 0.95 -0.16 1.87 0.00 -1.40 -0.69 119.26 120.44 1orb h ALA 257 Ca 0.02 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.81 1orb h ALA 257 Cb 0.63 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1orb h ALA 257 CO 0.03 0.07 -0.52 1.25 0.00 0.00 0.00 179.25 180.08 1orb h LEU 258 N 0.72 0.49 -0.39 0.00 5.85 -1.46 -1.76 115.31 118.75 1orb h LEU 258 Ca 0.32 -0.25 -0.16 0.00 0.84 0.00 0.00 57.88 58.62 1orb h LEU 258 Cb 0.21 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1orb h LEU 258 CO -0.19 0.92 -0.38 0.00 -0.34 0.00 0.00 178.44 178.45 1orb h ALA 259 N 1.09 0.57 -0.59 1.25 0.00 -0.89 -2.30 119.26 118.39 1orb h ALA 259 Ca 0.01 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 1orb h ALA 259 Cb 1.03 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1orb h ALA 259 CO 0.09 0.68 0.36 0.00 0.00 0.00 0.00 179.25 180.38 1orb h ALA 260 N 0.78 0.76 -0.71 0.00 0.00 -0.88 -2.82 119.26 116.38 1orb h ALA 260 Ca 0.06 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1orb h ALA 260 Cb 0.98 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 1orb h ALA 260 CO 0.09 0.24 0.45 -0.92 0.00 0.00 0.00 179.25 179.11 1orb h TYR 261 N 0.80 0.84 0.00 0.00 3.20 -0.55 0.40 116.97 121.66 1orb h TYR 261 Ca 0.21 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.10 1orb h TYR 261 Cb -0.02 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 37.98 1orb h TYR 261 CO -0.02 0.49 0.00 1.28 -1.64 0.00 0.00 178.16 178.27 1orb n LEU 262 N -4.65 0.12 -0.87 2.82 4.77 -0.87 -1.23 117.00 117.09 1orb n LEU 262 Ca 0.08 0.53 0.12 0.00 -0.03 0.00 0.00 56.01 56.70 1orb n LEU 262 Cb 0.08 -0.51 0.24 0.00 -2.33 0.00 0.00 43.42 40.90 1orb n LEU 262 CO 0.33 -0.28 0.71 0.00 -1.33 0.00 0.00 177.39 176.83 1orb n GLY 264 N 1.33 0.48 3.33 0.00 0.00 -0.36 -5.05 105.19 104.92 1orb n GLY 264 Ca 0.16 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.73 1orb n GLY 264 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1orb s LYS 265 N -0.94 2.96 -0.09 1.61 2.20 0.03 -4.89 119.74 120.63 1orb s LYS 265 Ca 0.00 -1.57 0.13 0.00 -0.36 0.00 0.00 55.97 54.16 1orb s LYS 265 Cb 0.00 -4.21 0.52 0.00 -1.51 0.00 0.00 37.83 32.62 1orb s LYS 265 CO 0.00 -1.20 1.38 -0.35 -0.36 0.00 0.00 175.35 174.81 1orb n PRO 266 N 5.21 2.99 -1.33 4.03 -0.04 -1.26 -1.83 135.00 142.78 1orb n PRO 266 Ca -0.13 -2.04 -0.10 0.00 -0.04 0.00 0.00 63.50 61.19 1orb n PRO 266 Cb 0.41 -1.73 0.11 0.00 -0.04 0.00 0.00 33.50 32.26 1orb n PRO 266 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1orb n ASP 267 N 0.72 3.46 -4.70 3.54 5.75 -1.26 -4.97 116.55 119.09 1orb n ASP 267 Ca 0.18 -3.82 -0.42 0.00 -0.01 0.00 0.00 54.79 50.72 1orb n ASP 267 Cb 0.68 -0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 40.29 1orb n ASP 267 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1orb s VAL 268 N -3.94 3.95 0.36 2.12 1.01 -1.26 -4.77 120.40 117.86 1orb s VAL 268 Ca 0.45 1.34 -0.00 0.00 0.00 0.00 0.00 61.98 63.77 1orb s VAL 268 Cb 0.39 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.88 1orb s VAL 268 CO -0.01 0.03 0.57 0.00 0.00 0.00 0.00 175.10 175.69 1orb s ALA 269 N 1.90 3.67 -0.12 5.51 0.00 -0.62 -4.87 121.76 127.23 1orb s ALA 269 Ca 0.60 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.69 1orb s ALA 269 Cb -0.29 -2.15 -0.01 0.00 0.00 0.00 0.00 23.12 20.66 1orb s ALA 269 CO 0.26 -0.06 -0.15 0.42 0.00 0.00 0.00 175.76 176.22 1orb s ILE 270 N -2.36 2.84 -0.93 0.00 -1.09 -0.15 -1.48 121.20 118.02 1orb s ILE 270 Ca 0.41 -0.74 -0.23 0.00 -2.23 0.00 0.00 60.65 57.85 1orb s ILE 270 Cb -0.10 -2.17 0.05 0.00 -1.58 0.00 0.00 42.46 38.67 1orb s ILE 270 CO 0.37 0.53 1.36 -0.47 -1.23 0.00 0.00 174.94 175.50 1orb s TYR 271 N 0.29 2.54 0.21 3.97 5.04 0.36 -1.96 117.35 127.81 1orb s TYR 271 Ca -0.12 -0.70 -0.09 0.00 -2.44 0.00 0.00 57.07 53.72 1orb s TYR 271 Cb -0.16 -4.63 0.25 0.00 0.35 0.00 0.00 41.96 37.77 1orb s TYR 271 CO 0.06 -1.92 1.80 0.22 -1.34 0.00 0.00 175.55 174.37 1orb h ASP 272 N 9.75 0.51 -0.86 4.32 3.58 -1.87 -2.59 116.42 129.26 1orb h ASP 272 Ca 0.07 0.04 0.02 0.00 0.42 0.00 0.00 57.03 57.58 1orb h ASP 272 Cb 1.02 -0.06 -0.05 0.00 1.72 0.00 0.00 39.33 41.97 1orb h ASP 272 CO 1.35 0.32 0.57 1.23 -2.88 0.00 0.00 179.24 179.83 1orb h GLY 273 N 0.64 1.22 0.00 -0.78 0.00 -1.90 -3.30 103.07 98.95 1orb h GLY 273 Ca 0.30 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.20 1orb h GLY 273 CO -0.20 0.40 0.00 1.44 0.00 0.00 0.00 176.54 178.18 1orb n SER 274 N -4.43 -4.09 0.07 0.19 7.64 -0.98 -2.60 113.62 109.43 1orb n SER 274 Ca 0.11 0.00 0.04 0.00 1.01 0.00 0.00 58.87 60.02 1orb n SER 274 Cb 0.07 0.00 0.43 0.00 -1.01 0.00 0.00 64.21 63.70 1orb n SER 274 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 1orb h TRP 275 N 0.00 0.37 0.66 1.43 2.91 -1.34 -1.93 115.95 118.05 1orb h TRP 275 Ca 0.00 -0.01 -0.03 0.00 1.13 0.00 0.00 58.89 59.98 1orb h TRP 275 Cb 0.00 -0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 28.52 1orb h TRP 275 CO 0.00 0.32 -0.50 0.35 -1.03 0.00 0.00 178.44 177.57 1orb h PHE 276 N 0.38 -1.36 -0.65 2.65 3.04 -1.38 0.21 116.94 119.83 1orb h PHE 276 Ca 0.09 -0.00 -0.07 0.00 3.98 0.00 0.00 57.97 61.97 1orb h PHE 276 Cb 0.12 0.51 -0.03 0.00 2.56 0.00 0.00 35.95 39.11 1orb h PHE 276 CO 0.00 -0.71 0.14 1.49 -2.02 0.00 0.00 178.31 177.21 1orb h GLU 277 N -1.12 1.05 0.31 1.11 4.81 -1.43 -2.99 114.58 116.31 1orb h GLU 277 Ca -0.09 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 1orb h GLU 277 Cb 0.93 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.14 1orb h GLU 277 CO 0.03 0.94 -0.39 2.35 -0.73 0.00 0.00 179.01 181.21 1orb h TRP 278 N 0.99 -1.06 -1.01 0.92 2.91 -1.10 0.19 115.95 117.79 1orb h TRP 278 Ca 0.20 0.01 0.24 0.00 1.13 0.00 0.00 58.89 60.48 1orb h TRP 278 Cb 0.38 0.43 -0.10 0.00 -0.51 0.00 0.00 29.16 29.35 1orb h TRP 278 CO 0.03 -0.52 0.63 0.35 -1.03 0.00 0.00 178.44 177.90 1orb h PHE 279 N -0.74 0.83 0.00 2.65 3.57 -0.55 0.35 116.94 123.04 1orb h PHE 279 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1orb h PHE 279 Cb 0.69 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 39.19 1orb h PHE 279 CO -0.25 0.10 -0.51 0.72 -2.23 0.00 0.00 178.31 176.14 1orb n HIS 280 N -4.72 0.56 -0.03 0.41 8.25 -0.78 -4.51 115.22 114.39 1orb n HIS 280 Ca 0.25 0.16 -0.04 0.00 -0.26 0.00 0.00 57.72 57.84 1orb n HIS 280 Cb 0.77 -0.67 -0.05 0.00 1.12 0.00 0.00 29.99 31.16 1orb n HIS 280 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1orb n ARG 281 N -2.08 2.58 -2.63 -0.41 1.74 0.61 -5.06 116.66 111.41 1orb n ARG 281 Ca 0.04 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.86 1orb n ARG 281 Cb 0.43 -1.17 0.01 0.00 -1.02 0.00 0.00 32.46 30.71 1orb n ARG 281 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1orb s ALA 282 N -2.16 3.43 0.42 7.54 0.00 0.97 -5.02 121.76 126.94 1orb s ALA 282 Ca -0.04 -0.67 -0.25 0.00 0.00 0.00 0.00 51.96 50.99 1orb s ALA 282 Cb 0.02 -2.51 -0.08 0.00 0.00 0.00 0.00 23.12 20.55 1orb s ALA 282 CO 0.26 -0.51 1.26 -2.14 0.00 0.00 0.00 175.76 174.64 1orb s PRO 283 N -4.79 3.89 0.56 0.00 0.02 -1.26 -4.88 135.00 128.54 1orb s PRO 283 Ca 0.50 2.04 0.27 0.00 0.02 0.00 0.00 61.00 63.83 1orb s PRO 283 Cb -0.10 -2.65 1.66 0.00 0.02 0.00 0.00 34.50 33.42 1orb s PRO 283 CO 0.44 -0.52 2.20 -1.00 -0.33 0.00 0.00 177.00 177.78 1orb h PRO 284 N 2.49 0.00 0.00 5.54 0.13 -1.95 -2.04 132.00 136.17 1orb h PRO 284 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1orb h PRO 284 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1orb h PRO 284 CO 0.62 0.03 0.00 0.93 -0.23 0.00 0.00 178.00 179.35 1orb h GLU 285 N 0.00 0.00 -0.02 0.86 3.07 -2.05 -2.25 114.58 114.19 1orb h GLU 285 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1orb h GLU 285 Cb 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 1orb h GLU 285 CO 0.00 0.00 0.00 0.25 -1.40 0.00 0.00 179.01 177.86 1orb n THR 286 N -2.91 0.03 -4.29 1.13 -2.24 -0.77 -4.88 114.28 100.36 1orb n THR 286 Ca -0.02 -0.08 -0.17 0.00 -2.27 0.00 0.00 64.05 61.51 1orb n THR 286 Cb 0.09 -0.16 -0.09 0.00 -2.10 0.00 0.00 70.33 68.06 1orb n THR 286 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1orb s TRP 287 N -1.97 1.51 0.00 4.78 1.48 -0.85 -0.54 118.94 123.35 1orb s TRP 287 Ca 0.38 -1.43 -0.10 0.00 -1.06 0.00 0.00 56.10 53.89 1orb s TRP 287 Cb 0.18 -0.75 0.01 0.00 -1.16 0.00 0.00 33.47 31.75 1orb s TRP 287 CO 0.30 -0.62 0.19 0.14 -4.06 0.00 0.00 176.95 172.90 1orb s VAL 288 N -3.73 0.08 0.06 -0.66 -7.23 -0.87 -4.83 120.40 103.21 1orb s VAL 288 Ca 0.38 -0.65 0.01 0.00 -1.81 0.00 0.00 61.98 59.90 1orb s VAL 288 Cb 0.05 -0.54 -0.03 0.00 0.56 0.00 0.00 36.38 36.42 1orb s VAL 288 CO 0.18 -0.36 -0.05 -0.55 -0.31 0.00 0.00 175.10 174.01 1orb s SER 289 N -1.45 0.74 -0.70 4.85 0.15 -1.26 -1.91 113.70 114.12 1orb s SER 289 Ca -0.13 -0.83 -0.03 0.00 0.70 0.00 0.00 55.95 55.65 1orb s SER 289 Cb -0.06 0.12 0.21 0.00 -1.71 0.00 0.00 66.02 64.57 1orb s SER 289 CO 0.02 -0.43 2.37 1.67 1.20 0.00 0.00 173.24 178.07 1orb n GLN 290 N 0.57 2.78 0.00 5.44 -0.06 0.17 -4.75 117.38 121.53 1orb n GLN 290 Ca -0.17 -3.04 0.00 0.00 -2.00 0.00 0.00 57.00 51.79 1orb n GLN 290 Cb 0.59 -2.24 0.00 0.00 -4.06 0.00 0.00 30.24 24.53 1orb n GLN 290 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1orb n GLY 291 N 0.20 2.34 1.50 1.69 0.00 -1.26 -4.60 105.19 105.06 1orb n GLY 291 Ca 0.52 0.13 -0.25 0.00 0.00 0.00 0.00 46.02 46.41 1orb n GLY 291 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1orb n LYS 292 N 0.00 0.00 0.00 1.61 4.76 -1.26 -5.20 118.16 118.07 1orb n LYS 292 Ca 0.00 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.56 1orb n LYS 292 Cb 0.00 -0.68 0.12 0.00 -1.84 0.00 0.00 35.03 32.63 1orb n LYS 292 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44