#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s5l n PHE 15 N 0.00 0.00 -0.33 -2.67 7.35 -1.26 -3.57 117.46 116.99 1s5l n PHE 15 Ca 0.00 0.00 0.29 0.00 -0.76 0.00 0.00 57.45 56.98 1s5l n PHE 15 Cb 0.00 -0.27 0.55 0.00 0.35 0.00 0.00 39.48 40.11 1s5l n PHE 15 CO 0.00 0.00 0.00 0.22 -0.76 0.00 0.00 176.76 176.22 1s5l h ASP 16 N 0.00 0.39 0.17 -2.13 1.82 -2.05 0.28 116.42 114.90 1s5l h ASP 16 Ca 0.00 0.24 0.01 0.00 -0.39 0.00 0.00 57.03 56.89 1s5l h ASP 16 Cb 0.00 0.22 -0.04 0.00 0.68 0.00 0.00 39.33 40.19 1s5l h ASP 16 CO 0.00 -0.33 -0.39 0.40 -1.61 0.00 0.00 179.24 177.31 1s5l h ILE 17 N 0.12 0.20 -0.68 2.25 2.04 -2.00 0.12 117.51 119.55 1s5l h ILE 17 Ca 0.81 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.78 1s5l h ILE 17 Cb 2.05 0.20 -0.08 0.00 -0.74 0.00 0.00 36.82 38.25 1s5l h ILE 17 CO -0.71 0.00 0.28 0.25 0.00 0.00 0.00 178.15 177.96 1s5l h LEU 18 N -0.66 0.29 -0.55 1.44 5.85 -0.56 0.76 115.31 121.87 1s5l h LEU 18 Ca 0.01 0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.90 1s5l h LEU 18 Cb 0.67 0.05 -0.10 0.00 0.37 0.00 0.00 40.66 41.65 1s5l h LEU 18 CO -0.20 0.15 -0.45 -0.78 -0.34 0.00 0.00 178.44 176.82 1s5l h ASP 19 N 0.46 -1.54 0.19 1.25 1.82 0.24 0.62 116.42 119.45 1s5l h ASP 19 Ca 0.35 0.24 -0.01 0.00 -0.39 0.00 0.00 57.03 57.23 1s5l h ASP 19 Cb 0.46 0.69 0.00 0.00 0.68 0.00 0.00 39.33 41.16 1s5l h ASP 19 CO -0.33 -0.34 -0.09 0.44 -1.61 0.00 0.00 179.24 177.30 1s5l h ASP 20 N -0.25 -0.21 -0.37 2.28 3.32 0.14 0.88 116.42 122.20 1s5l h ASP 20 Ca 0.16 -0.31 0.06 0.00 0.02 0.00 0.00 57.03 56.97 1s5l h ASP 20 Cb 0.57 0.05 -0.09 0.00 0.22 0.00 0.00 39.33 40.08 1s5l h ASP 20 CO -0.67 0.25 -0.45 -0.25 -1.72 0.00 0.00 179.24 176.40 1s5l h TRP 21 N -0.74 -1.31 0.02 4.55 7.01 0.77 1.32 115.95 127.57 1s5l h TRP 21 Ca -0.03 0.07 0.03 0.00 2.11 0.00 0.00 58.89 61.07 1s5l h TRP 21 Cb 0.51 0.62 -0.05 0.00 -2.10 0.00 0.00 29.16 28.14 1s5l h TRP 21 CO 0.06 -0.45 -0.29 1.25 -2.79 0.00 0.00 178.44 176.21 1s5l h LEU 22 N -0.36 -0.87 0.00 0.65 5.85 0.23 -1.78 115.31 119.03 1s5l h LEU 22 Ca 0.12 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.95 1s5l h LEU 22 Cb 0.59 0.35 0.00 0.00 0.37 0.00 0.00 40.66 41.97 1s5l h LEU 22 CO -0.56 -0.36 0.00 0.29 -0.34 0.00 0.00 178.44 177.47 1s5l n LYS 23 N -5.40 1.00 -1.70 1.25 5.02 0.30 -4.29 118.16 114.35 1s5l n LYS 23 Ca -0.05 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.80 1s5l n LYS 23 Cb 0.31 -1.04 -0.03 0.00 -0.02 0.00 0.00 35.03 34.25 1s5l n LYS 23 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1s5l n ARG 24 N -0.54 2.56 -2.26 1.97 0.63 0.44 -4.87 116.66 114.59 1s5l n ARG 24 Ca 0.02 0.93 -0.35 0.00 -0.92 0.00 0.00 57.85 57.52 1s5l n ARG 24 Cb 0.01 -2.75 -0.04 0.00 0.45 0.00 0.00 32.46 30.13 1s5l n ARG 24 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1s5l s ASP 25 N 1.32 5.69 0.00 6.15 1.01 -1.26 -4.69 116.67 124.88 1s5l s ASP 25 Ca 0.77 -0.66 0.00 0.00 0.71 0.00 0.00 52.55 53.37 1s5l s ASP 25 Cb -0.56 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 40.81 1s5l s ASP 25 CO 0.35 -2.20 0.00 0.54 0.21 0.00 0.00 175.17 174.07 1s5l n ARG 26 N 9.01 3.83 0.03 8.23 1.74 -1.26 -5.06 116.66 133.19 1s5l n ARG 26 Ca 0.29 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 57.25 1s5l n ARG 26 Cb 0.49 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.85 1s5l n ARG 26 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1s5l h PHE 27 N 0.00 -0.14 -3.55 -1.55 3.57 -2.05 -3.41 116.94 109.82 1s5l h PHE 27 Ca 0.00 -0.00 -0.69 0.00 3.53 0.00 0.00 57.97 60.80 1s5l h PHE 27 Cb 0.00 0.05 -0.33 0.00 2.79 0.00 0.00 35.95 38.45 1s5l h PHE 27 CO 0.00 0.34 -0.57 0.08 -2.23 0.00 0.00 178.31 175.92 1s5l s VAL 28 N -3.78 3.32 -0.37 1.41 1.01 -1.26 -5.07 120.40 115.67 1s5l s VAL 28 Ca -0.14 -1.84 -0.28 0.00 0.00 0.00 0.00 61.98 59.72 1s5l s VAL 28 Cb 0.01 -3.17 -0.07 0.00 0.00 0.00 0.00 36.38 33.15 1s5l s VAL 28 CO 0.57 -0.54 2.32 0.33 0.00 0.00 0.00 175.10 177.78 1s5l n PHE 29 N 4.63 1.65 -3.39 5.22 -0.00 -1.26 -4.94 117.46 119.37 1s5l n PHE 29 Ca -0.05 0.03 -0.45 0.00 -0.00 0.00 0.00 57.45 56.98 1s5l n PHE 29 Cb 0.42 -2.66 -0.05 0.00 -0.00 0.00 0.00 39.48 37.19 1s5l n PHE 29 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 1s5l s VAL 30 N 9.87 5.05 0.00 -2.13 1.01 -1.26 -4.88 120.40 128.07 1s5l s VAL 30 Ca 1.02 -2.01 0.00 0.00 0.00 0.00 0.00 61.98 60.99 1s5l s VAL 30 Cb -0.36 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 31.81 1s5l s VAL 30 CO 0.33 -0.91 0.00 0.61 0.00 0.00 0.00 175.10 175.13 1s5l n GLY 31 N 4.59 0.16 0.37 4.51 0.00 -1.26 -3.92 105.19 109.65 1s5l n GLY 31 Ca -0.01 -1.81 0.01 0.00 0.00 0.00 0.00 46.02 44.21 1s5l n GLY 31 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1s5l h TRP 32 N -0.23 1.18 0.00 1.61 -0.00 -1.93 0.31 115.95 116.88 1s5l h TRP 32 Ca 0.00 0.03 -0.01 0.00 -0.00 0.00 0.00 58.89 58.91 1s5l h TRP 32 Cb 0.00 -0.39 -0.00 0.00 -0.00 0.00 0.00 29.16 28.77 1s5l h TRP 32 CO 0.00 0.67 -0.06 0.66 -0.00 0.00 0.00 178.44 179.71 1s5l h SER 33 N 1.21 0.00 0.00 -3.49 4.64 -1.91 -3.12 113.55 110.87 1s5l h SER 33 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1s5l h SER 33 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1s5l h SER 33 CO -0.12 0.06 0.34 1.23 -0.87 0.00 0.00 176.83 177.48 1s5l h GLY 34 N 2.71 0.00 1.54 -0.77 0.00 -0.66 -0.45 103.07 105.43 1s5l h GLY 34 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.04 1s5l h GLY 34 CO 0.01 0.00 -1.31 -2.22 0.00 0.00 0.00 176.54 173.02 1s5l h ILE 35 N 0.00 1.43 0.13 2.60 2.04 -1.64 -3.25 117.51 118.82 1s5l h ILE 35 Ca 0.00 -2.99 -0.01 0.00 1.00 0.00 0.00 64.86 62.86 1s5l h ILE 35 Cb 0.69 2.93 0.00 0.00 -0.74 0.00 0.00 36.82 39.70 1s5l h ILE 35 CO 0.00 0.87 -0.06 -0.07 0.00 0.00 0.00 178.15 178.89 1s5l h LEU 36 N 0.08 -0.15 -0.38 1.44 3.38 -1.33 -3.34 115.31 115.02 1s5l h LEU 36 Ca -0.16 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 57.62 1s5l h LEU 36 Cb 2.00 0.04 -0.05 0.00 0.09 0.00 0.00 40.66 42.74 1s5l h LEU 36 CO 0.21 0.42 -0.28 0.25 0.09 0.00 0.00 178.44 179.13 1s5l h LEU 37 N -1.00 -1.00 -0.67 1.67 5.85 -1.63 -2.63 115.31 115.91 1s5l h LEU 37 Ca -0.02 0.14 -0.09 0.00 0.84 0.00 0.00 57.88 58.76 1s5l h LEU 37 Cb 0.36 0.43 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 1s5l h LEU 37 CO 0.03 -0.14 0.06 -0.26 -0.34 0.00 0.00 178.44 177.79 1s5l h PHE 38 N -0.07 1.17 -0.53 1.25 0.05 -1.77 0.55 116.94 117.58 1s5l h PHE 38 Ca 0.06 -0.18 -0.11 0.00 3.82 0.00 0.00 57.97 61.56 1s5l h PHE 38 Cb 0.23 -0.31 -0.02 0.00 2.00 0.00 0.00 35.95 37.85 1s5l h PHE 38 CO -0.86 1.00 -0.10 -1.35 -0.18 0.00 0.00 178.31 176.82 1s5l h PRO 39 N 1.01 0.99 0.03 1.51 0.11 -1.67 -2.50 132.00 131.48 1s5l h PRO 39 Ca 0.19 -0.35 -0.10 0.00 0.11 0.00 0.00 66.00 65.84 1s5l h PRO 39 Cb 0.49 -0.07 0.01 0.00 0.11 0.00 0.00 31.00 31.54 1s5l h PRO 39 CO 0.02 1.03 -0.43 0.00 -0.21 0.00 0.00 178.00 178.41 1s5l n ALA 41 N -2.59 1.69 -0.09 0.00 0.00 0.19 -0.76 120.51 118.95 1s5l n ALA 41 Ca -0.11 0.08 -0.20 0.00 0.00 0.00 0.00 53.44 53.20 1s5l n ALA 41 Cb 0.61 -1.39 -0.12 0.00 0.00 0.00 0.00 19.45 18.56 1s5l n ALA 41 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1s5l h TYR 42 N 0.00 0.03 -0.28 0.00 3.20 -1.50 -3.24 116.97 115.18 1s5l h TYR 42 Ca 0.00 -0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.77 1s5l h TYR 42 Cb 0.37 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 1s5l h TYR 42 CO 0.00 1.41 -0.17 -0.07 -1.64 0.00 0.00 178.16 177.70 1s5l h LEU 43 N -0.95 0.49 -1.71 2.82 3.38 -1.37 0.12 115.31 118.09 1s5l h LEU 43 Ca -0.29 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.51 1s5l h LEU 43 Cb 1.29 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 1s5l h LEU 43 CO -0.16 0.67 -0.16 0.00 0.09 0.00 0.00 178.44 178.88 1s5l h ALA 44 N 1.37 1.26 0.02 1.53 0.00 -1.11 0.64 119.26 122.98 1s5l h ALA 44 Ca 0.08 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 1s5l h ALA 44 Cb 0.55 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1s5l h ALA 44 CO 0.04 0.21 -0.68 1.25 0.00 0.00 0.00 179.25 180.06 1s5l h LEU 45 N 0.00 0.07 -0.80 0.00 5.85 -1.31 -3.20 115.31 115.91 1s5l h LEU 45 Ca -0.00 -0.80 0.00 0.00 0.84 0.00 0.00 57.88 57.93 1s5l h LEU 45 Cb 0.44 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.40 1s5l h LEU 45 CO 0.02 1.28 0.52 1.23 -0.34 0.00 0.00 178.44 181.15 1s5l h GLY 46 N -0.84 1.14 0.24 3.75 0.00 -0.62 -0.84 103.07 105.90 1s5l h GLY 46 Ca -0.17 -0.44 0.12 0.00 0.00 0.00 0.00 47.33 46.84 1s5l h GLY 46 CO -0.06 0.43 0.28 -1.33 0.00 0.00 0.00 176.54 175.85 1s5l h GLY 47 N 1.09 1.04 0.00 4.60 0.00 0.15 0.53 103.07 110.48 1s5l h GLY 47 Ca 0.29 -0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.48 1s5l h GLY 47 CO -0.06 -0.06 -0.00 -0.25 0.00 0.00 0.00 176.54 176.17 1s5l h TRP 48 N 0.44 -0.00 -1.34 5.60 7.01 -1.35 -3.00 115.95 123.31 1s5l h TRP 48 Ca 0.37 -0.00 0.39 0.00 2.11 0.00 0.00 58.89 61.76 1s5l h TRP 48 Cb 0.53 0.00 -0.05 0.00 -2.10 0.00 0.00 29.16 27.53 1s5l h TRP 48 CO -0.17 -0.00 1.02 -0.07 -2.79 0.00 0.00 178.44 176.43 1s5l h LEU 49 N -0.00 0.00 0.22 0.65 3.38 -0.88 0.13 115.31 118.81 1s5l h LEU 49 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1s5l h LEU 49 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1s5l h LEU 49 CO 0.00 0.00 -0.11 0.74 0.09 0.00 0.00 178.44 179.16 1s5l h THR 50 N 0.00 0.66 -0.38 0.22 2.02 0.02 -2.73 112.91 112.72 1s5l h THR 50 Ca 0.64 -0.97 -0.12 0.00 0.77 0.00 0.00 66.41 66.73 1s5l h THR 50 Cb 2.67 1.09 -0.01 0.00 -1.74 0.00 0.00 68.15 70.17 1s5l h THR 50 CO -0.01 0.16 -0.24 1.23 0.37 0.00 0.00 175.52 177.03 1s5l h GLY 51 N -0.91 0.92 -0.14 2.16 0.00 -1.20 0.16 103.07 104.06 1s5l h GLY 51 Ca -0.03 -0.86 0.16 0.00 0.00 0.00 0.00 47.33 46.59 1s5l h GLY 51 CO 0.05 0.78 0.09 -0.84 0.00 0.00 0.00 176.54 176.63 1s5l h THR 52 N 0.65 0.46 0.00 4.70 2.02 -0.87 0.30 112.91 120.16 1s5l h THR 52 Ca 0.08 -0.06 -0.17 0.00 0.77 0.00 0.00 66.41 67.03 1s5l h THR 52 Cb 0.81 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.45 1s5l h THR 52 CO 0.07 0.03 -1.16 0.74 0.37 0.00 0.00 175.52 175.57 1s5l h THR 53 N 0.19 0.75 0.00 3.16 2.02 -1.29 -2.90 112.91 114.84 1s5l h THR 53 Ca 0.39 -2.27 0.00 0.00 0.77 0.00 0.00 66.41 65.30 1s5l h THR 53 Cb 0.68 2.26 0.00 0.00 -1.74 0.00 0.00 68.15 69.35 1s5l h THR 53 CO -0.55 0.43 0.00 0.49 0.37 0.00 0.00 175.52 176.26 1s5l n PHE 54 N -3.04 0.00 -4.24 3.16 0.99 0.56 -3.14 117.46 111.75 1s5l n PHE 54 Ca -0.06 0.00 -0.29 0.00 -0.00 0.00 0.00 57.45 57.09 1s5l n PHE 54 Cb 0.84 0.00 -0.10 0.00 -1.00 0.00 0.00 39.48 39.23 1s5l n PHE 54 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.76 176.84 1s5l s VAL 55 N -0.41 3.30 -0.03 -4.37 1.01 0.96 -4.87 120.40 115.99 1s5l s VAL 55 Ca 0.00 -1.34 0.01 0.00 0.00 0.00 0.00 61.98 60.65 1s5l s VAL 55 Cb 0.00 -2.55 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 1s5l s VAL 55 CO 0.00 0.08 -0.03 0.28 0.00 0.00 0.00 175.10 175.43 1s5l s THR 56 N -1.27 3.95 -0.40 3.92 -1.32 -1.26 -1.78 115.64 117.46 1s5l s THR 56 Ca 0.22 -0.56 0.09 0.00 -1.21 0.00 0.00 61.69 60.22 1s5l s THR 56 Cb -0.11 -2.70 0.43 0.00 -1.51 0.00 0.00 72.50 68.61 1s5l s THR 56 CO 0.14 0.47 1.07 -1.54 -2.21 0.00 0.00 174.62 172.54 1s5l n SER 57 N 1.74 3.77 -0.68 8.08 3.41 -1.26 -4.69 113.62 123.99 1s5l n SER 57 Ca -0.16 -3.43 0.08 0.00 -0.26 0.00 0.00 58.87 55.10 1s5l n SER 57 Cb 0.53 -0.48 0.11 0.00 -0.26 0.00 0.00 64.21 64.11 1s5l n SER 57 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 1s5l n TRP 58 N -0.37 0.19 0.03 7.33 4.27 -1.14 -1.70 117.44 126.06 1s5l n TRP 58 Ca 0.30 -0.15 -0.05 0.00 -3.89 0.00 0.00 57.50 53.71 1s5l n TRP 58 Cb 0.71 -0.01 -0.10 0.00 -1.36 0.00 0.00 31.31 30.55 1s5l n TRP 58 CO 0.00 0.00 0.00 1.88 -2.29 0.00 0.00 177.69 177.28 1s5l h TYR 59 N 2.88 0.00 0.00 -2.67 -1.99 -1.83 -2.76 116.97 110.60 1s5l h TYR 59 Ca 0.00 0.00 -0.31 0.00 2.00 0.00 0.00 58.73 60.42 1s5l h TYR 59 Cb 0.68 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 39.35 1s5l h TYR 59 CO 0.10 0.85 -2.17 -2.37 -0.00 0.00 0.00 178.16 174.56 1s5l n THR 60 N -3.11 1.17 0.00 -2.88 5.66 -1.26 -4.77 114.28 109.09 1s5l n THR 60 Ca -0.09 -0.68 0.00 0.00 -3.05 0.00 0.00 64.05 60.24 1s5l n THR 60 Cb 0.94 -0.66 0.00 0.00 -1.55 0.00 0.00 70.33 69.05 1s5l n THR 60 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 1s5l n HIS 61 N -2.70 0.00 0.00 1.09 8.25 -0.69 -4.47 115.22 116.70 1s5l n HIS 61 Ca -0.29 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.17 1s5l n HIS 61 Cb 1.03 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.14 1s5l n HIS 61 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1s5l n GLY 62 N 2.10 1.75 2.46 -1.41 0.00 -1.04 -4.90 105.19 104.15 1s5l n GLY 62 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1s5l n GLY 62 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s5l n LEU 63 N 0.00 0.00 -4.64 0.99 4.77 -1.25 -4.83 117.00 112.04 1s5l n LEU 63 Ca 0.00 -1.69 -0.38 0.00 -0.03 0.00 0.00 56.01 53.91 1s5l n LEU 63 Cb 0.00 -0.17 -0.08 0.00 -2.33 0.00 0.00 43.42 40.84 1s5l n LEU 63 CO 0.00 -0.56 0.04 0.00 -1.33 0.00 0.00 177.39 175.54 1s5l s ALA 64 N -2.47 3.57 -0.18 -1.18 0.00 -1.26 -2.86 121.76 117.37 1s5l s ALA 64 Ca 0.31 -0.71 -0.23 0.00 0.00 0.00 0.00 51.96 51.33 1s5l s ALA 64 Cb -0.02 -2.62 -0.22 0.00 0.00 0.00 0.00 23.12 20.26 1s5l s ALA 64 CO 0.20 -0.44 0.40 1.03 0.00 0.00 0.00 175.76 176.94 1s5l h SER 65 N 7.75 0.03 -2.05 0.00 0.87 -1.85 -3.45 113.55 114.84 1s5l h SER 65 Ca -0.34 -0.68 0.00 0.00 -1.23 0.00 0.00 61.79 59.54 1s5l h SER 65 Cb 1.16 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1s5l h SER 65 CO 0.67 1.37 0.00 -1.54 -0.53 0.00 0.00 176.83 176.80 1s5l n SER 66 N -4.43 0.71 0.05 6.23 3.41 -0.74 -0.69 113.62 118.16 1s5l n SER 66 Ca -0.25 -0.21 -0.01 0.00 -0.26 0.00 0.00 58.87 58.14 1s5l n SER 66 Cb 0.65 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.52 1s5l n SER 66 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1s5l h TYR 67 N 0.07 0.00 -0.24 7.33 -1.99 -1.58 -1.31 116.97 119.25 1s5l h TYR 67 Ca 0.00 0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.80 1s5l h TYR 67 Cb 0.00 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 1s5l h TYR 67 CO 0.00 0.65 0.20 1.25 -0.00 0.00 0.00 178.16 180.27 1s5l h LEU 68 N 0.00 0.00 -0.34 3.88 5.85 -1.84 0.41 115.31 123.28 1s5l h LEU 68 Ca -0.13 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.59 1s5l h LEU 68 Cb 1.61 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.64 1s5l h LEU 68 CO 0.06 0.00 -0.75 -0.62 -0.34 0.00 0.00 178.44 176.79 1s5l n GLU 69 N -4.14 0.87 -0.20 1.25 1.02 -1.25 -5.00 120.64 113.19 1s5l n GLU 69 Ca 0.03 -0.33 0.00 0.00 -0.02 0.00 0.00 57.16 56.84 1s5l n GLU 69 Cb 0.35 -1.41 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 1s5l n GLU 69 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s5l n GLY 70 N 1.42 1.40 3.82 0.62 0.00 0.15 -5.07 105.19 107.51 1s5l n GLY 70 Ca 0.05 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 1s5l n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s5l s ASN 72 N -3.85 4.46 0.20 0.00 2.20 -1.26 -4.60 114.94 112.09 1s5l s ASN 72 Ca 0.59 0.53 -0.15 0.00 -0.94 0.00 0.00 52.86 52.89 1s5l s ASN 72 Cb -0.14 -1.04 0.19 0.00 -2.00 0.00 0.00 41.25 38.26 1s5l s ASN 72 CO 0.55 -1.87 1.64 0.15 -2.94 0.00 0.00 177.10 174.62 1s5l h PHE 73 N -0.91 -0.33 0.07 1.54 3.57 -1.96 -0.50 116.94 118.42 1s5l h PHE 73 Ca -0.45 0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.13 1s5l h PHE 73 Cb 1.31 0.23 -0.04 0.00 2.79 0.00 0.00 35.95 40.24 1s5l h PHE 73 CO 0.13 -0.25 -0.28 -0.07 -2.23 0.00 0.00 178.31 175.60 1s5l h LEU 74 N -0.01 -0.81 -0.41 0.59 3.38 -2.01 -2.78 115.31 113.26 1s5l h LEU 74 Ca 0.27 0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.36 1s5l h LEU 74 Cb 0.42 0.32 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 1s5l h LEU 74 CO -0.58 -0.36 0.22 0.74 0.09 0.00 0.00 178.44 178.55 1s5l h THR 75 N -0.47 1.01 -3.38 0.22 2.02 -1.77 -2.88 112.91 107.67 1s5l h THR 75 Ca 0.04 -0.15 -0.55 0.00 0.77 0.00 0.00 66.41 66.52 1s5l h THR 75 Cb 0.52 0.52 0.10 0.00 -1.74 0.00 0.00 68.15 67.55 1s5l h THR 75 CO -0.19 0.08 0.71 0.52 0.37 0.00 0.00 175.52 177.00 1s5l n VAL 76 N -4.89 1.56 -3.85 3.16 0.31 -0.25 -4.72 118.33 109.65 1s5l n VAL 76 Ca 0.02 -0.39 -0.05 0.00 -0.01 0.00 0.00 64.34 63.91 1s5l n VAL 76 Cb 0.08 -1.78 0.02 0.00 -0.91 0.00 0.00 33.84 31.25 1s5l n VAL 76 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1s5l s ALA 77 N -0.63 -1.36 -0.37 3.52 0.00 0.13 -4.24 121.76 118.81 1s5l s ALA 77 Ca 0.59 -0.42 -0.05 0.00 0.00 0.00 0.00 51.96 52.08 1s5l s ALA 77 Cb -0.53 0.73 0.08 0.00 0.00 0.00 0.00 23.12 23.39 1s5l s ALA 77 CO 0.57 -1.04 0.15 0.08 0.00 0.00 0.00 175.76 175.51 1s5l s VAL 78 N -2.30 3.49 0.38 0.00 1.01 0.12 -4.47 120.40 118.64 1s5l s VAL 78 Ca 0.19 -1.59 -0.23 0.00 0.00 0.00 0.00 61.98 60.35 1s5l s VAL 78 Cb -0.03 -3.17 -0.10 0.00 0.00 0.00 0.00 36.38 33.07 1s5l s VAL 78 CO 0.07 -0.42 0.95 -0.44 0.00 0.00 0.00 175.10 175.27 1s5l s SER 79 N 1.67 7.09 0.65 3.32 0.01 -1.26 -2.12 113.70 123.06 1s5l s SER 79 Ca 0.02 1.77 -0.17 0.00 1.31 0.00 0.00 55.95 58.88 1s5l s SER 79 Cb -0.22 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.45 1s5l s SER 79 CO -0.01 -0.25 1.24 -0.89 0.41 0.00 0.00 173.24 173.74 1s5l s THR 80 N -1.92 2.31 1.23 1.44 2.01 -1.26 -4.62 115.64 114.83 1s5l s THR 80 Ca 0.57 0.18 -0.18 0.00 0.31 0.00 0.00 61.69 62.57 1s5l s THR 80 Cb -0.14 -2.98 0.26 0.00 0.01 0.00 0.00 72.50 69.65 1s5l s THR 80 CO 0.18 -0.05 0.60 -2.65 -0.69 0.00 0.00 174.62 172.01 1s5l n PRO 81 N -2.03 -3.05 -3.08 4.92 -0.02 -1.26 -4.73 135.00 125.75 1s5l n PRO 81 Ca 0.14 -0.89 -0.39 0.00 -2.02 0.00 0.00 63.50 60.35 1s5l n PRO 81 Cb 0.49 -1.84 -0.06 0.00 -0.02 0.00 0.00 33.50 32.07 1s5l n PRO 81 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s5l s ALA 82 N -2.20 3.49 0.66 3.55 0.00 -1.26 -3.95 121.76 122.05 1s5l s ALA 82 Ca 0.59 0.25 0.31 0.00 0.00 0.00 0.00 51.96 53.11 1s5l s ALA 82 Cb -0.15 -2.85 1.69 0.00 0.00 0.00 0.00 23.12 21.82 1s5l s ALA 82 CO 0.57 0.33 1.96 -0.97 0.00 0.00 0.00 175.76 177.65 1s5l h ASN 83 N 4.34 0.00 0.62 0.00 -0.00 -1.93 -0.15 115.58 118.47 1s5l h ASN 83 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.82 1s5l h ASN 83 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.53 1s5l h ASN 83 CO 0.65 0.00 0.00 0.77 -0.00 0.00 0.00 177.43 178.85 1s5l h SER 84 N 0.00 0.00 0.09 1.15 4.64 -1.96 -3.10 113.55 114.37 1s5l h SER 84 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1s5l h SER 84 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1s5l h SER 84 CO -0.00 0.00 -0.47 0.23 -0.87 0.00 0.00 176.83 175.72 1s5l n MET 85 N -2.42 0.89 0.00 4.77 2.81 -0.07 -5.04 117.12 118.06 1s5l n MET 85 Ca 0.01 -0.67 0.00 0.00 -1.81 0.00 0.00 57.70 55.23 1s5l n MET 85 Cb 0.20 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.23 1s5l n MET 85 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1s5l n GLY 86 N 1.41 4.19 0.09 3.03 0.00 -1.17 -2.78 105.19 109.95 1s5l n GLY 86 Ca 0.09 0.09 0.07 0.00 0.00 0.00 0.00 46.02 46.27 1s5l n GLY 86 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1s5l n HIS 87 N 14.00 0.04 -1.67 1.61 8.25 -1.26 -2.11 115.22 134.09 1s5l n HIS 87 Ca 0.00 -0.82 -0.42 0.00 -0.26 0.00 0.00 57.72 56.21 1s5l n HIS 87 Cb 0.00 -0.12 -0.03 0.00 1.12 0.00 0.00 29.99 30.96 1s5l n HIS 87 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1s5l n SER 88 N -1.07 4.16 -4.55 0.41 7.64 -1.12 -4.86 113.62 114.23 1s5l n SER 88 Ca 0.11 0.91 -0.39 0.00 1.01 0.00 0.00 58.87 60.51 1s5l n SER 88 Cb 0.52 -1.53 -0.03 0.00 -1.01 0.00 0.00 64.21 62.16 1s5l n SER 88 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1s5l s LEU 89 N 4.22 3.25 -0.87 -3.43 1.43 -1.26 -4.90 118.68 117.12 1s5l s LEU 89 Ca 0.88 -0.45 -0.20 0.00 -1.03 0.00 0.00 54.13 53.33 1s5l s LEU 89 Cb -0.44 -2.55 0.10 0.00 0.03 0.00 0.00 46.19 43.33 1s5l s LEU 89 CO 0.41 -2.01 1.13 -0.76 0.23 0.00 0.00 176.35 175.35 1s5l s LEU 90 N 6.89 4.65 0.63 1.79 1.43 -1.26 -4.87 118.68 127.94 1s5l s LEU 90 Ca 0.49 -1.67 -0.09 0.00 -1.03 0.00 0.00 54.13 51.83 1s5l s LEU 90 Cb -0.08 -2.43 -0.00 0.00 0.03 0.00 0.00 46.19 43.71 1s5l s LEU 90 CO 0.11 -1.23 1.00 -0.76 0.23 0.00 0.00 176.35 175.69 1s5l s LEU 91 N 3.39 3.13 0.31 1.79 1.43 -1.26 -4.69 118.68 122.78 1s5l s LEU 91 Ca 0.32 1.03 0.06 0.00 -1.03 0.00 0.00 54.13 54.51 1s5l s LEU 91 Cb -0.07 -3.89 0.85 0.00 0.03 0.00 0.00 46.19 43.10 1s5l s LEU 91 CO -0.04 -1.11 1.62 0.25 0.23 0.00 0.00 176.35 177.31 1s5l h LEU 92 N -0.37 -0.01 -2.06 1.79 5.85 -1.94 1.00 115.31 119.58 1s5l h LEU 92 Ca -0.45 0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.49 1s5l h LEU 92 Cb 1.24 0.30 0.00 0.00 0.37 0.00 0.00 40.66 42.57 1s5l h LEU 92 CO 0.62 -0.24 0.00 -2.67 -0.34 0.00 0.00 178.44 175.82 1s5l n TRP 93 N -5.27 0.92 -2.21 1.25 2.14 -1.26 -0.76 117.44 112.24 1s5l n TRP 93 Ca 0.25 -0.35 -0.42 0.00 2.07 0.00 0.00 57.50 59.06 1s5l n TRP 93 Cb 0.82 -0.21 -0.03 0.00 -0.81 0.00 0.00 31.31 31.08 1s5l n TRP 93 CO 0.00 0.00 0.00 0.20 2.07 0.00 0.00 177.69 179.96 1s5l s GLY 94 N -0.62 2.30 0.64 -1.67 0.00 0.35 -4.81 107.32 103.50 1s5l s GLY 94 Ca 0.28 1.10 0.14 0.00 0.00 0.00 0.00 44.72 46.25 1s5l s GLY 94 CO 0.12 2.16 1.22 -0.56 0.00 0.00 0.00 173.10 176.04 1s5l h PRO 95 N 5.88 0.00 0.08 2.90 0.13 -1.91 0.18 132.00 139.26 1s5l h PRO 95 Ca -0.44 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.41 1s5l h PRO 95 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 1s5l h PRO 95 CO 0.80 0.00 -1.52 1.49 -0.23 0.00 0.00 178.00 178.54 1s5l h GLU 96 N 0.00 0.16 -0.00 0.86 4.81 -1.91 -3.37 114.58 115.13 1s5l h GLU 96 Ca 0.22 -0.27 -0.17 0.00 -0.13 0.00 0.00 59.36 59.01 1s5l h GLU 96 Cb 2.28 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 31.74 1s5l h GLU 96 CO -0.00 1.13 -0.79 0.00 -0.73 0.00 0.00 179.01 178.62 1s5l h ALA 97 N -0.17 0.70 -2.97 2.92 0.00 -1.29 -3.48 119.26 114.97 1s5l h ALA 97 Ca -0.35 -0.71 -0.33 0.00 0.00 0.00 0.00 54.91 53.51 1s5l h ALA 97 Cb 1.67 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 19.36 1s5l h ALA 97 CO -0.03 0.97 -0.46 1.04 0.00 0.00 0.00 179.25 180.78 1s5l n GLN 98 N -3.61 -2.53 0.00 0.00 6.02 -0.47 -2.99 117.38 113.80 1s5l n GLN 98 Ca -0.01 0.78 0.00 0.00 -0.01 0.00 0.00 57.00 57.76 1s5l n GLN 98 Cb 0.76 -5.24 0.00 0.00 1.02 0.00 0.00 30.24 26.78 1s5l n GLN 98 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1s5l n GLY 99 N -1.18 2.74 3.55 1.08 0.00 0.06 -4.96 105.19 106.47 1s5l n GLY 99 Ca -0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 1s5l n GLY 99 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1s5l s ASP 100 N -3.62 6.18 0.00 1.61 -1.08 -1.16 -4.92 116.67 113.69 1s5l s ASP 100 Ca 0.00 -0.74 0.00 0.00 -0.52 0.00 0.00 52.55 51.29 1s5l s ASP 100 Cb 0.00 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 38.90 1s5l s ASP 100 CO 0.00 -1.79 0.88 0.33 0.52 0.00 0.00 175.17 175.11 1s5l n PHE 101 N 9.58 0.00 -0.22 -5.34 7.35 -1.26 -0.94 117.46 126.63 1s5l n PHE 101 Ca 0.15 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.87 1s5l n PHE 101 Cb 0.50 -0.38 0.06 0.00 0.35 0.00 0.00 39.48 40.01 1s5l n PHE 101 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41 1s5l n THR 102 N -2.53 -0.27 -0.08 -2.13 -1.04 -1.26 0.17 114.28 107.15 1s5l n THR 102 Ca 0.00 1.36 -0.14 0.00 -2.04 0.00 0.00 64.05 63.22 1s5l n THR 102 Cb 0.00 -1.85 -0.05 0.00 -1.82 0.00 0.00 70.33 66.61 1s5l n THR 102 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1s5l h ARG 103 N 0.00 0.75 -0.57 -2.82 3.08 -1.75 -1.28 114.38 111.80 1s5l h ARG 103 Ca 0.26 -0.47 0.16 0.00 0.07 0.00 0.00 59.98 60.01 1s5l h ARG 103 Cb 0.41 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 1s5l h ARG 103 CO -0.60 1.09 0.69 2.35 -1.07 0.00 0.00 179.97 182.44 1s5l h TRP 104 N 0.49 0.00 0.13 3.04 7.01 0.36 0.68 115.95 127.65 1s5l h TRP 104 Ca 0.02 0.00 -0.36 0.00 2.11 0.00 0.00 58.89 60.66 1s5l h TRP 104 Cb 1.04 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 28.09 1s5l h TRP 104 CO 0.08 0.00 -1.93 0.00 -2.79 0.00 0.00 178.44 173.80 1s5l h GLN 106 N 0.07 0.95 0.00 0.00 4.20 0.13 -0.37 115.11 120.09 1s5l h GLN 106 Ca -0.40 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.25 1s5l h GLN 106 Cb 2.04 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 29.61 1s5l h GLN 106 CO 0.10 0.63 0.00 1.28 -0.67 0.00 0.00 178.83 180.17 1s5l n LEU 107 N -4.63 0.00 0.00 1.46 4.77 0.65 -4.39 117.00 114.86 1s5l n LEU 107 Ca 0.16 0.45 0.00 0.00 -0.03 0.00 0.00 56.01 56.60 1s5l n LEU 107 Cb 0.29 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 1s5l n LEU 107 CO 0.28 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 1s5l n GLY 108 N 1.14 0.76 0.00 -0.72 0.00 -0.15 -4.25 105.19 101.98 1s5l n GLY 108 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1s5l n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s5l n GLY 109 N -2.14 -0.02 0.10 -0.02 0.00 0.04 -0.88 105.19 102.27 1s5l n GLY 109 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1s5l n GLY 109 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1s5l h LEU 110 N 0.00 -0.09 -0.63 0.99 3.38 -1.86 -3.11 115.31 114.00 1s5l h LEU 110 Ca 0.00 -0.45 0.06 0.00 0.09 0.00 0.00 57.88 57.58 1s5l h LEU 110 Cb 0.06 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 40.76 1s5l h LEU 110 CO 0.00 0.57 -0.37 1.87 0.09 0.00 0.00 178.44 180.61 1s5l n TRP 111 N -4.80 -0.28 -0.29 1.13 -0.00 -0.06 0.19 117.44 113.34 1s5l n TRP 111 Ca -0.06 0.78 0.10 0.00 -0.00 0.00 0.00 57.50 58.32 1s5l n TRP 111 Cb 0.26 -0.53 0.25 0.00 -0.00 0.00 0.00 31.31 31.29 1s5l n TRP 111 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 177.69 178.84 1s5l h THR 112 N 0.00 0.51 0.00 5.87 2.02 -1.73 0.35 112.91 119.92 1s5l h THR 112 Ca 0.10 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1s5l h THR 112 Cb 0.26 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1s5l h THR 112 CO -0.59 0.07 0.00 0.33 0.37 0.00 0.00 175.52 175.70 1s5l n PHE 113 N -5.07 0.00 -0.25 3.16 7.35 0.52 -0.96 117.46 122.21 1s5l n PHE 113 Ca 0.19 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 56.91 1s5l n PHE 113 Cb 0.57 -0.44 0.12 0.00 0.35 0.00 0.00 39.48 40.08 1s5l n PHE 113 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1s5l h ILE 114 N 0.00 0.32 -0.61 -2.13 2.04 -0.22 -0.96 117.51 115.95 1s5l h ILE 114 Ca 0.00 -0.02 -0.07 0.00 1.00 0.00 0.00 64.86 65.77 1s5l h ILE 114 Cb 0.00 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.32 1s5l h ILE 114 CO 0.00 0.01 0.11 0.00 0.00 0.00 0.00 178.15 178.27 1s5l h ALA 115 N 1.71 0.81 0.37 1.87 0.00 -0.82 0.25 119.26 123.45 1s5l h ALA 115 Ca 0.38 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1s5l h ALA 115 Cb 0.63 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1s5l h ALA 115 CO -0.69 0.56 -0.18 -0.07 0.00 0.00 0.00 179.25 178.86 1s5l h LEU 116 N 0.91 -0.43 -0.27 0.00 3.38 -0.26 0.26 115.31 118.91 1s5l h LEU 116 Ca 0.19 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.24 1s5l h LEU 116 Cb 0.41 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.20 1s5l h LEU 116 CO 0.01 -0.11 -0.21 0.45 0.09 0.00 0.00 178.44 178.67 1s5l h HIS 117 N -0.89 -0.53 -0.01 1.13 3.86 -1.30 0.27 115.15 117.68 1s5l h HIS 117 Ca -0.05 0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1s5l h HIS 117 Cb 0.38 0.28 -0.00 0.00 1.06 0.00 0.00 27.41 29.13 1s5l h HIS 117 CO 0.03 -0.28 0.07 0.78 0.86 0.00 0.00 177.93 179.39 1s5l h GLY 118 N -0.19 0.00 1.39 2.45 0.00 -0.54 0.12 103.07 106.30 1s5l h GLY 118 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.22 1s5l h GLY 118 CO -0.39 0.00 -1.05 0.00 0.00 0.00 0.00 176.54 175.10 1s5l h ALA 119 N 1.87 0.21 0.00 3.60 0.00 0.31 -3.11 119.26 122.14 1s5l h ALA 119 Ca 0.01 -0.73 -0.09 0.00 0.00 0.00 0.00 54.91 54.10 1s5l h ALA 119 Cb 0.15 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1s5l h ALA 119 CO -0.00 0.76 -0.43 0.74 0.00 0.00 0.00 179.25 180.33 1s5l h PHE 120 N 0.28 0.00 -0.34 0.00 -1.00 -0.07 -2.55 116.94 113.26 1s5l h PHE 120 Ca -0.12 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.62 1s5l h PHE 120 Cb 1.70 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 41.24 1s5l h PHE 120 CO 0.08 0.43 0.01 0.78 -1.61 0.00 0.00 178.31 178.01 1s5l h GLY 121 N 2.44 0.56 2.00 -1.45 0.00 -1.19 0.57 103.07 106.00 1s5l h GLY 121 Ca -0.00 -0.32 -0.09 0.00 0.00 0.00 0.00 47.33 46.91 1s5l h GLY 121 CO 0.06 0.30 -0.44 1.41 0.00 0.00 0.00 176.54 177.87 1s5l h LEU 122 N 0.50 0.00 -0.07 3.11 3.38 -1.41 0.90 115.31 121.73 1s5l h LEU 122 Ca 0.11 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.84 1s5l h LEU 122 Cb 0.30 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.07 1s5l h LEU 122 CO 0.01 0.44 -0.88 0.40 0.09 0.00 0.00 178.44 178.49 1s5l h ILE 123 N 0.00 1.29 -0.49 1.22 2.04 -0.61 -3.09 117.51 117.87 1s5l h ILE 123 Ca -0.00 -2.10 -0.13 0.00 1.00 0.00 0.00 64.86 63.62 1s5l h ILE 123 Cb 0.96 2.23 -0.01 0.00 -0.74 0.00 0.00 36.82 39.25 1s5l h ILE 123 CO 0.06 0.65 -0.21 1.23 0.00 0.00 0.00 178.15 179.88 1s5l h GLY 124 N 0.41 1.09 2.00 5.37 0.00 0.42 -2.73 103.07 109.63 1s5l h GLY 124 Ca -0.09 -0.97 -0.02 0.00 0.00 0.00 0.00 47.33 46.25 1s5l h GLY 124 CO 0.18 0.88 -0.11 -2.75 0.00 0.00 0.00 176.54 174.74 1s5l h PHE 125 N 0.87 0.00 0.00 5.60 3.57 -0.84 0.26 116.94 126.39 1s5l h PHE 125 Ca 0.11 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.47 1s5l h PHE 125 Cb 0.79 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.51 1s5l h PHE 125 CO 0.05 0.11 -1.14 1.98 -2.23 0.00 0.00 178.31 177.08 1s5l h MET 126 N 0.00 0.00 -0.19 1.11 4.05 -1.47 -3.08 114.93 115.35 1s5l h MET 126 Ca -0.00 0.00 -0.14 0.00 -0.28 0.00 0.00 59.70 59.28 1s5l h MET 126 Cb 0.38 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.18 1s5l h MET 126 CO 0.01 0.36 -0.44 -0.07 0.23 0.00 0.00 176.91 177.00 1s5l h LEU 127 N 0.00 0.72 -2.03 3.39 3.38 -0.97 -2.60 115.31 117.20 1s5l h LEU 127 Ca -0.11 -0.56 -0.01 0.00 0.09 0.00 0.00 57.88 57.29 1s5l h LEU 127 Cb 1.52 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 42.06 1s5l h LEU 127 CO 0.05 1.15 -0.04 -0.09 0.09 0.00 0.00 178.44 179.60 1s5l h ARG 128 N 0.32 0.00 0.00 1.13 2.43 -0.62 -0.53 114.38 117.11 1s5l h ARG 128 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1s5l h ARG 128 Cb 1.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 1s5l h ARG 128 CO 0.10 0.04 -0.25 0.37 -1.51 0.00 0.00 179.97 178.72 1s5l h GLN 129 N 0.00 0.00 0.08 0.20 4.15 -1.38 -3.02 115.11 115.14 1s5l h GLN 129 Ca -0.00 0.00 -0.30 0.00 0.77 0.00 0.00 58.65 59.12 1s5l h GLN 129 Cb 0.32 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.99 1s5l h GLN 129 CO 0.01 0.00 -1.58 0.74 -1.93 0.00 0.00 178.83 176.06 1s5l h PHE 130 N 0.00 0.32 0.00 3.99 0.05 -0.82 -3.33 116.94 117.14 1s5l h PHE 130 Ca 0.00 -0.23 0.00 0.00 3.82 0.00 0.00 57.97 61.56 1s5l h PHE 130 Cb 0.88 -0.01 0.00 0.00 2.00 0.00 0.00 35.95 38.81 1s5l h PHE 130 CO 0.00 1.62 0.00 -1.91 -0.18 0.00 0.00 178.31 177.84 1s5l n GLU 131 N -3.92 0.00 -0.03 1.51 2.13 -0.36 -1.61 120.64 118.36 1s5l n GLU 131 Ca -0.30 0.60 0.19 0.00 0.66 0.00 0.00 57.16 58.31 1s5l n GLU 131 Cb 0.89 -1.34 0.29 0.00 0.27 0.00 0.00 31.44 31.55 1s5l n GLU 131 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 1s5l h ILE 132 N 0.00 0.00 0.00 6.31 2.04 -1.74 0.53 117.51 124.65 1s5l h ILE 132 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1s5l h ILE 132 Cb 0.00 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1s5l h ILE 132 CO 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 178.15 177.65 1s5l h ALA 133 N 0.35 0.73 -0.02 1.87 0.00 -1.41 -2.73 119.26 118.05 1s5l h ALA 133 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1s5l h ALA 133 Cb 2.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.42 1s5l h ALA 133 CO -0.00 0.00 -0.22 -2.13 0.00 0.00 0.00 179.25 176.89 1s5l n ARG 134 N -2.68 1.62 -0.12 0.00 3.00 0.18 -0.60 116.66 118.05 1s5l n ARG 134 Ca 0.02 -1.25 -0.26 0.00 -0.00 0.00 0.00 57.85 56.37 1s5l n ARG 134 Cb 0.51 -1.37 -0.11 0.00 0.00 0.00 0.00 32.46 31.49 1s5l n ARG 134 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1s5l n LEU 135 N 0.46 2.08 0.13 6.15 4.77 -1.10 -4.36 117.00 125.12 1s5l n LEU 135 Ca 0.10 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 1s5l n LEU 135 Cb 0.44 -0.89 0.06 0.00 -2.33 0.00 0.00 43.42 40.71 1s5l n LEU 135 CO 0.19 0.55 0.43 0.58 -1.33 0.00 0.00 177.39 177.81 1s5l h VAL 136 N -0.83 1.12 -0.18 4.08 2.07 -1.67 -3.48 116.25 117.36 1s5l h VAL 136 Ca -0.58 -2.38 0.00 0.00 0.82 0.00 0.00 66.70 64.56 1s5l h VAL 136 Cb 1.59 2.42 0.00 0.00 -1.52 0.00 0.00 31.29 33.77 1s5l h VAL 136 CO -0.30 0.60 0.00 0.61 0.02 0.00 0.00 177.57 178.50 1s5l n GLY 137 N 0.99 0.87 4.02 2.17 0.00 -0.82 -5.07 105.19 107.35 1s5l n GLY 137 Ca 0.01 -0.60 -0.19 0.00 0.00 0.00 0.00 46.02 45.24 1s5l n GLY 137 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s5l s VAL 138 N -2.18 2.46 0.37 1.61 1.01 0.23 -4.99 120.40 118.91 1s5l s VAL 138 Ca 0.00 -0.94 -0.24 0.00 0.00 0.00 0.00 61.98 60.79 1s5l s VAL 138 Cb 0.00 -2.51 -0.10 0.00 0.00 0.00 0.00 36.38 33.77 1s5l s VAL 138 CO 0.00 0.00 0.97 -0.13 0.00 0.00 0.00 175.10 175.94 1s5l s ARG 139 N -4.61 4.40 0.00 2.72 0.52 -1.26 -4.65 118.95 116.07 1s5l s ARG 139 Ca 0.60 1.32 0.20 0.00 -0.52 0.00 0.00 55.73 57.33 1s5l s ARG 139 Cb -0.07 -2.59 0.87 0.00 0.52 0.00 0.00 34.95 33.68 1s5l s ARG 139 CO 0.37 0.11 1.65 -0.35 0.02 0.00 0.00 175.30 177.10 1s5l n PRO 140 N 0.12 0.00 -0.28 3.54 -0.04 -1.26 -4.37 135.00 132.72 1s5l n PRO 140 Ca 0.04 0.15 0.13 0.00 -0.04 0.00 0.00 63.50 63.78 1s5l n PRO 140 Cb 0.51 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.72 1s5l n PRO 140 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1s5l n TYR 141 N -1.50 0.55 -0.02 0.54 0.53 -1.26 0.08 117.16 116.08 1s5l n TYR 141 Ca 0.05 0.98 -0.09 0.00 -1.02 0.00 0.00 57.90 57.81 1s5l n TYR 141 Cb 0.24 -1.13 -0.04 0.00 -1.03 0.00 0.00 39.34 37.38 1s5l n TYR 141 CO 0.00 0.00 0.00 -0.97 -1.02 0.00 0.00 176.86 174.87 1s5l h ASN 142 N 0.00 -0.16 -0.83 7.72 -0.73 -1.94 0.26 115.58 119.90 1s5l h ASN 142 Ca 0.51 0.05 0.24 0.00 1.87 0.00 0.00 56.30 58.97 1s5l h ASN 142 Cb 1.08 0.10 -0.03 0.00 0.27 0.00 0.00 38.32 39.74 1s5l h ASN 142 CO -0.75 -0.06 0.64 0.00 -0.37 0.00 0.00 177.43 176.88 1s5l h ALA 143 N 1.12 2.74 0.15 1.57 0.00 -0.61 0.10 119.26 124.33 1s5l h ALA 143 Ca 0.07 -0.03 -0.30 0.00 0.00 0.00 0.00 54.91 54.65 1s5l h ALA 143 Cb 0.13 0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1s5l h ALA 143 CO -0.16 -1.07 -1.43 0.82 0.00 0.00 0.00 179.25 177.41 1s5l h ILE 144 N 0.00 1.29 -0.22 0.00 2.04 -0.92 -3.24 117.51 116.46 1s5l h ILE 144 Ca 0.39 -2.86 -0.03 0.00 1.00 0.00 0.00 64.86 63.37 1s5l h ILE 144 Cb 1.67 2.88 -0.01 0.00 -0.74 0.00 0.00 36.82 40.61 1s5l h ILE 144 CO -0.00 0.85 0.01 0.00 0.00 0.00 0.00 178.15 179.00 1s5l h ALA 145 N 0.44 1.62 0.00 1.87 0.00 0.68 -2.04 119.26 121.82 1s5l h ALA 145 Ca -0.21 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1s5l h ALA 145 Cb 2.03 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.72 1s5l h ALA 145 CO 0.20 0.29 0.00 0.34 0.00 0.00 0.00 179.25 180.08 1s5l n PHE 146 N -4.37 0.81 -0.25 0.00 7.35 -0.74 -2.89 117.46 117.37 1s5l n PHE 146 Ca 0.00 0.35 -0.05 0.00 -0.76 0.00 0.00 57.45 56.99 1s5l n PHE 146 Cb 0.18 -1.06 0.10 0.00 0.35 0.00 0.00 39.48 39.05 1s5l n PHE 146 CO 0.00 0.00 0.00 0.66 -0.76 0.00 0.00 176.76 176.66 1s5l h SER 147 N 0.00 1.02 -0.28 -2.13 4.64 -1.48 -3.10 113.55 112.22 1s5l h SER 147 Ca 0.00 -0.17 0.03 0.00 -0.47 0.00 0.00 61.79 61.18 1s5l h SER 147 Cb 0.24 -0.27 -0.06 0.00 -0.31 0.00 0.00 62.40 62.01 1s5l h SER 147 CO 0.00 0.93 -0.39 0.00 -0.87 0.00 0.00 176.83 176.50 1s5l h ALA 148 N 1.21 -0.65 -0.90 5.18 0.00 -1.72 0.24 119.26 122.62 1s5l h ALA 148 Ca 0.24 -0.00 0.16 0.00 0.00 0.00 0.00 54.91 55.31 1s5l h ALA 148 Cb 0.25 1.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 1s5l h ALA 148 CO -0.01 -0.83 0.49 -1.35 0.00 0.00 0.00 179.25 177.55 1s5l h PRO 149 N -0.29 0.65 -0.11 0.00 0.11 -1.78 0.19 132.00 130.78 1s5l h PRO 149 Ca 0.05 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.07 1s5l h PRO 149 Cb 0.42 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 31.37 1s5l h PRO 149 CO -0.41 0.43 -0.15 0.82 -0.21 0.00 0.00 178.00 178.48 1s5l h ILE 150 N 0.67 1.17 0.51 4.15 2.04 -1.20 0.45 117.51 125.31 1s5l h ILE 150 Ca 0.50 -0.76 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 1s5l h ILE 150 Cb 0.72 1.26 0.01 0.00 -0.74 0.00 0.00 36.82 38.07 1s5l h ILE 150 CO -0.37 0.23 -0.25 0.00 0.00 0.00 0.00 178.15 177.77 1s5l h ALA 151 N 1.69 -0.69 -0.82 1.87 0.00 0.22 -1.70 119.26 119.84 1s5l h ALA 151 Ca 0.03 -0.16 0.18 0.00 0.00 0.00 0.00 54.91 54.97 1s5l h ALA 151 Cb 0.37 0.27 -0.15 0.00 0.00 0.00 0.00 17.79 18.28 1s5l h ALA 151 CO 0.02 -0.65 -0.08 0.28 0.00 0.00 0.00 179.25 178.82 1s5l h VAL 152 N -1.17 0.22 0.64 0.00 2.07 -0.52 0.46 116.25 117.96 1s5l h VAL 152 Ca -0.07 -0.01 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 1s5l h VAL 152 Cb 0.54 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1s5l h VAL 152 CO 0.12 0.01 -0.40 0.15 0.02 0.00 0.00 177.57 177.47 1s5l h PHE 153 N 0.04 -1.05 -0.07 1.57 3.57 -0.03 0.11 116.94 121.09 1s5l h PHE 153 Ca 0.43 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.92 1s5l h PHE 153 Cb 0.75 0.37 -0.00 0.00 2.79 0.00 0.00 35.95 39.85 1s5l h PHE 153 CO -0.53 -0.60 0.05 0.28 -2.23 0.00 0.00 178.31 175.28 1s5l h VAL 154 N -0.98 1.02 -0.40 1.41 2.07 -0.42 0.11 116.25 119.05 1s5l h VAL 154 Ca -0.08 -0.04 0.04 0.00 0.82 0.00 0.00 66.70 67.44 1s5l h VAL 154 Cb 0.79 0.92 -0.06 0.00 -1.52 0.00 0.00 31.29 31.42 1s5l h VAL 154 CO 0.08 0.02 -0.38 -1.28 0.02 0.00 0.00 177.57 176.03 1s5l h SER 155 N 0.09 -1.30 0.00 0.57 0.87 -0.01 -0.51 113.55 113.26 1s5l h SER 155 Ca 0.03 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 1s5l h SER 155 Cb -0.01 0.55 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 1s5l h SER 155 CO -0.01 -0.23 0.00 0.52 -0.53 0.00 0.00 176.83 176.59 1s5l n VAL 156 N -4.47 0.00 0.72 2.23 0.31 0.38 -2.15 118.33 115.34 1s5l n VAL 156 Ca -0.01 0.89 0.03 0.00 -0.01 0.00 0.00 64.34 65.23 1s5l n VAL 156 Cb 0.21 -1.81 0.17 0.00 -0.91 0.00 0.00 33.84 31.50 1s5l n VAL 156 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1s5l n PHE 157 N -0.45 0.00 0.04 3.52 3.01 0.34 -3.48 117.46 120.45 1s5l n PHE 157 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1s5l n PHE 157 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 1s5l n PHE 157 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1s5l n LEU 158 N -0.75 0.03 -0.15 4.37 4.77 -0.28 -4.73 117.00 120.25 1s5l n LEU 158 Ca 0.04 0.14 -0.06 0.00 -0.03 0.00 0.00 56.01 56.11 1s5l n LEU 158 Cb 0.02 0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1s5l n LEU 158 CO 0.03 -0.60 0.66 0.40 -1.33 0.00 0.00 177.39 176.56 1s5l h ILE 159 N 0.00 0.26 0.21 -0.08 2.04 -1.32 0.83 117.51 119.44 1s5l h ILE 159 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1s5l h ILE 159 Cb 0.00 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 36.33 1s5l h ILE 159 CO 0.00 0.00 -0.11 0.22 0.00 0.00 0.00 178.15 178.26 1s5l h TYR 160 N -0.18 -0.30 -0.16 1.37 3.20 -1.46 -1.11 116.97 118.33 1s5l h TYR 160 Ca 0.21 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.05 1s5l h TYR 160 Cb 0.52 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 1s5l h TYR 160 CO -0.55 -0.18 -0.02 -1.35 -1.64 0.00 0.00 178.16 174.42 1s5l h PRO 161 N -0.30 0.22 0.21 1.82 0.11 -1.61 -2.51 132.00 129.95 1s5l h PRO 161 Ca -0.02 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 1s5l h PRO 161 Cb 0.24 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.32 1s5l h PRO 161 CO 0.03 0.27 -0.10 -0.07 -0.21 0.00 0.00 178.00 177.92 1s5l h LEU 162 N 0.22 -0.24 -1.62 2.35 3.38 -0.14 -2.86 115.31 116.40 1s5l h LEU 162 Ca 0.05 -0.06 0.09 0.00 0.09 0.00 0.00 57.88 58.05 1s5l h LEU 162 Cb 0.19 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 1s5l h LEU 162 CO 0.01 -0.10 0.39 1.23 0.09 0.00 0.00 178.44 180.06 1s5l h GLY 163 N -0.37 0.60 -0.35 0.83 0.00 -0.85 -3.44 103.07 99.50 1s5l h GLY 163 Ca -0.03 -0.18 -0.12 0.00 0.00 0.00 0.00 47.33 47.00 1s5l h GLY 163 CO 0.05 0.12 0.04 -1.06 0.00 0.00 0.00 176.54 175.69 1s5l n GLN 164 N -4.47 0.33 -0.30 4.80 6.02 -0.98 -4.85 117.38 117.93 1s5l n GLN 164 Ca 0.09 -0.71 0.31 0.00 -0.01 0.00 0.00 57.00 56.67 1s5l n GLN 164 Cb 0.33 -0.20 0.68 0.00 1.02 0.00 0.00 30.24 32.06 1s5l n GLN 164 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1s5l h SER 165 N -0.20 0.13 0.00 1.08 0.87 -1.86 -3.47 113.55 110.10 1s5l h SER 165 Ca -0.09 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 1s5l h SER 165 Cb 0.33 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 1s5l h SER 165 CO 0.09 0.02 0.00 -1.54 -0.53 0.00 0.00 176.83 174.88 1s5l n SER 166 N -4.32 0.00 -0.28 6.23 3.41 -1.26 -4.59 113.62 112.81 1s5l n SER 166 Ca 0.24 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.80 1s5l n SER 166 Cb 1.09 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 65.13 1s5l n SER 166 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1s5l h TRP 167 N 0.00 1.19 -0.93 7.33 -0.00 -1.66 -3.27 115.95 118.60 1s5l h TRP 167 Ca 0.00 -0.08 0.12 0.00 -0.00 0.00 0.00 58.89 58.93 1s5l h TRP 167 Cb 0.00 -0.36 -0.13 0.00 -0.00 0.00 0.00 29.16 28.67 1s5l h TRP 167 CO 0.00 0.89 -0.44 0.34 -0.00 0.00 0.00 178.44 179.23 1s5l n PHE 168 N -4.28 -0.15 0.36 0.49 -0.00 -1.25 -1.03 117.46 111.60 1s5l n PHE 168 Ca 0.07 1.15 0.03 0.00 -0.00 0.00 0.00 57.45 58.70 1s5l n PHE 168 Cb 0.18 -0.74 0.17 0.00 -0.00 0.00 0.00 39.48 39.09 1s5l n PHE 168 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 1s5l n PHE 169 N -5.28 0.00 -2.22 -5.13 3.01 -1.23 -4.73 117.46 101.87 1s5l n PHE 169 Ca 0.06 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.21 1s5l n PHE 169 Cb 0.32 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.77 1s5l n PHE 169 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1s5l s ALA 170 N -2.00 3.04 0.75 4.37 0.00 -0.20 -4.90 121.76 122.82 1s5l s ALA 170 Ca 0.08 0.13 -0.16 0.00 0.00 0.00 0.00 51.96 52.02 1s5l s ALA 170 Cb 0.04 -3.12 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 1s5l s ALA 170 CO 0.07 -0.41 0.41 -2.30 0.00 0.00 0.00 175.76 173.52 1s5l n PRO 171 N -1.93 0.21 -3.91 0.00 -0.02 -1.26 -4.90 135.00 123.19 1s5l n PRO 171 Ca 0.07 0.11 -0.34 0.00 -2.02 0.00 0.00 63.50 61.31 1s5l n PRO 171 Cb 0.54 -1.74 -0.05 0.00 -0.02 0.00 0.00 33.50 32.23 1s5l n PRO 171 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1s5l s SER 172 N -1.47 6.35 -1.22 2.55 0.01 -1.26 -4.85 113.70 113.80 1s5l s SER 172 Ca 0.63 0.37 -0.19 0.00 1.31 0.00 0.00 55.95 58.06 1s5l s SER 172 Cb -0.34 -2.00 0.07 0.00 0.21 0.00 0.00 66.02 63.96 1s5l s SER 172 CO 0.61 0.30 1.66 -0.36 0.41 0.00 0.00 173.24 175.85 1s5l s PHE 173 N -1.25 2.72 0.09 2.43 2.99 -0.90 -4.41 117.98 119.65 1s5l s PHE 173 Ca 0.24 -1.43 -0.10 0.00 0.00 0.00 0.00 56.93 55.65 1s5l s PHE 173 Cb -0.12 -4.74 0.03 0.00 0.00 0.00 0.00 43.02 38.19 1s5l s PHE 173 CO 0.15 -1.84 0.46 0.41 -0.00 0.00 0.00 175.22 174.41 1s5l n GLY 174 N 5.78 1.00 0.00 4.36 0.00 -1.26 0.12 105.19 115.19 1s5l n GLY 174 Ca 0.45 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1s5l n GLY 174 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1s5l n VAL 175 N -0.32 0.00 -0.27 1.61 0.31 -1.22 -3.75 118.33 114.69 1s5l n VAL 175 Ca -0.01 0.34 -0.01 0.00 -0.01 0.00 0.00 64.34 64.65 1s5l n VAL 175 Cb 0.26 -1.10 0.11 0.00 -0.91 0.00 0.00 33.84 32.21 1s5l n VAL 175 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1s5l h ALA 176 N -2.00 1.02 0.00 3.52 0.00 -1.81 0.12 119.26 120.11 1s5l h ALA 176 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1s5l h ALA 176 Cb 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1s5l h ALA 176 CO 0.00 0.18 0.26 0.00 0.00 0.00 0.00 179.25 179.69 1s5l n ALA 177 N -2.34 0.66 -0.06 0.00 0.00 -1.26 -0.04 120.51 117.47 1s5l n ALA 177 Ca 0.10 0.12 -0.20 0.00 0.00 0.00 0.00 53.44 53.46 1s5l n ALA 177 Cb 0.16 -0.82 -0.13 0.00 0.00 0.00 0.00 19.45 18.66 1s5l n ALA 177 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1s5l n ILE 178 N -1.99 1.65 -0.33 0.00 2.08 0.38 -3.65 119.36 117.50 1s5l n ILE 178 Ca -0.01 -0.62 -0.02 0.00 0.56 0.00 0.00 62.75 62.66 1s5l n ILE 178 Cb 0.28 -1.59 0.11 0.00 -0.75 0.00 0.00 39.64 37.69 1s5l n ILE 178 CO 0.00 0.00 0.00 -0.26 0.56 0.00 0.00 176.55 176.85 1s5l h PHE 179 N 0.04 1.10 -0.07 1.39 -1.00 -0.20 0.20 116.94 118.41 1s5l h PHE 179 Ca -0.49 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.30 1s5l h PHE 179 Cb 1.97 -0.37 -0.01 0.00 3.61 0.00 0.00 35.95 41.16 1s5l h PHE 179 CO 0.06 0.66 -0.02 -0.09 -1.61 0.00 0.00 178.31 177.30 1s5l h ARG 180 N 1.16 0.09 0.66 1.51 1.12 -1.22 -1.75 114.38 115.96 1s5l h ARG 180 Ca 0.35 -0.01 -0.03 0.00 -1.11 0.00 0.00 59.98 59.17 1s5l h ARG 180 Cb -0.05 -0.02 0.01 0.00 -0.01 0.00 0.00 29.97 29.90 1s5l h ARG 180 CO -0.10 0.13 -0.32 0.35 -3.11 0.00 0.00 179.97 176.92 1s5l h PHE 181 N 0.10 -0.83 0.00 2.20 3.57 -0.73 -1.15 116.94 120.11 1s5l h PHE 181 Ca 0.02 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1s5l h PHE 181 Cb 0.11 0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.12 1s5l h PHE 181 CO 0.00 -0.48 0.00 1.28 -2.23 0.00 0.00 178.31 176.88 1s5l n LEU 182 N -5.41 0.00 -0.27 0.59 4.77 -0.51 -0.97 117.00 115.19 1s5l n LEU 182 Ca -0.13 0.87 0.08 0.00 -0.03 0.00 0.00 56.01 56.80 1s5l n LEU 182 Cb 0.37 -0.41 0.20 0.00 -2.33 0.00 0.00 43.42 41.25 1s5l n LEU 182 CO 0.33 -0.41 0.85 -0.07 -1.33 0.00 0.00 177.39 176.76 1s5l h LEU 183 N 0.00 -0.27 -0.58 2.23 3.38 -1.39 0.26 115.31 118.94 1s5l h LEU 183 Ca 0.00 0.20 0.12 0.00 0.09 0.00 0.00 57.88 58.29 1s5l h LEU 183 Cb 0.00 0.34 -0.11 0.00 0.09 0.00 0.00 40.66 40.97 1s5l h LEU 183 CO 0.00 -0.18 -0.17 0.15 0.09 0.00 0.00 178.44 178.33 1s5l h PHE 184 N 0.13 -0.37 -1.00 1.13 3.57 0.27 0.17 116.94 120.83 1s5l h PHE 184 Ca 0.46 0.05 0.02 0.00 3.53 0.00 0.00 57.97 62.04 1s5l h PHE 184 Cb 0.85 0.25 -0.05 0.00 2.79 0.00 0.00 35.95 39.79 1s5l h PHE 184 CO -0.39 -0.27 0.66 0.74 -2.23 0.00 0.00 178.31 176.82 1s5l h PHE 185 N -0.02 1.24 -0.52 0.41 -1.00 0.49 -2.43 116.94 115.11 1s5l h PHE 185 Ca 0.27 0.03 -0.04 0.00 2.81 0.00 0.00 57.97 61.05 1s5l h PHE 185 Cb 0.44 -0.42 -0.02 0.00 3.61 0.00 0.00 35.95 39.56 1s5l h PHE 185 CO -0.50 0.75 0.16 0.37 -1.61 0.00 0.00 178.31 177.48 1s5l h GLN 186 N 1.31 0.77 0.00 1.51 5.75 -0.33 -0.40 115.11 123.72 1s5l h GLN 186 Ca 0.38 -0.13 -0.01 0.00 -0.15 0.00 0.00 58.65 58.73 1s5l h GLN 186 Cb -0.08 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 28.34 1s5l h GLN 186 CO -0.10 0.67 -0.06 0.78 -2.65 0.00 0.00 178.83 177.47 1s5l h GLY 187 N 0.92 0.03 1.16 2.39 0.00 -0.89 -2.74 103.07 103.93 1s5l h GLY 187 Ca 0.17 -0.07 -0.02 0.00 0.00 0.00 0.00 47.33 47.42 1s5l h GLY 187 CO -0.01 0.06 -0.89 0.74 0.00 0.00 0.00 176.54 176.44 1s5l h PHE 188 N -0.82 0.00 0.00 5.60 -1.00 -1.52 -3.40 116.94 115.81 1s5l h PHE 188 Ca -0.01 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.77 1s5l h PHE 188 Cb 0.92 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.48 1s5l h PHE 188 CO 0.23 0.06 -1.05 0.72 -1.61 0.00 0.00 178.31 176.66 1s5l n HIS 189 N -2.77 0.00 -3.72 -0.55 8.25 -0.27 -5.00 115.22 111.16 1s5l n HIS 189 Ca -0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.23 1s5l n HIS 189 Cb 0.58 -0.03 0.03 0.00 1.12 0.00 0.00 29.99 31.68 1s5l n HIS 189 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1s5l n ASN 190 N -1.56 -1.80 0.16 0.41 2.85 -0.55 -4.36 115.26 110.41 1s5l n ASN 190 Ca -0.00 -0.88 0.16 0.00 -0.11 0.00 0.00 54.58 53.75 1s5l n ASN 190 Cb 0.05 -3.83 0.75 0.00 1.24 0.00 0.00 39.78 37.99 1s5l n ASN 190 CO 0.00 0.00 0.00 -0.25 -2.11 0.00 0.00 177.26 174.90 1s5l h TRP 191 N -1.83 0.00 0.00 1.20 2.91 -1.80 -1.73 115.95 114.71 1s5l h TRP 191 Ca -0.62 0.00 -0.03 0.00 1.13 0.00 0.00 58.89 59.37 1s5l h TRP 191 Cb 1.36 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 30.01 1s5l h TRP 191 CO 0.44 0.00 -0.13 1.15 -1.03 0.00 0.00 178.44 178.87 1s5l h THR 192 N 0.00 1.06 0.00 2.65 2.02 -1.89 -1.36 112.91 115.38 1s5l h THR 192 Ca 0.11 -0.45 -0.02 0.00 0.77 0.00 0.00 66.41 66.82 1s5l h THR 192 Cb 0.52 1.25 -0.00 0.00 -1.74 0.00 0.00 68.15 68.18 1s5l h THR 192 CO -0.00 0.13 -0.09 -0.07 0.37 0.00 0.00 175.52 175.86 1s5l h LEU 193 N 0.00 0.00 -9.92 2.58 3.38 -1.56 -3.44 115.31 106.34 1s5l h LEU 193 Ca -0.00 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 1s5l h LEU 193 Cb 0.24 0.00 0.12 0.00 0.09 0.00 0.00 40.66 41.10 1s5l h LEU 193 CO 0.02 0.09 0.67 -3.20 0.09 0.00 0.00 178.44 176.11 1s5l n ASN 194 N -3.13 3.29 0.07 -0.43 2.85 -0.51 -4.89 115.26 112.50 1s5l n ASN 194 Ca 0.03 1.16 -0.13 0.00 -0.11 0.00 0.00 54.58 55.53 1s5l n ASN 194 Cb 0.52 -1.58 -0.04 0.00 1.24 0.00 0.00 39.78 39.92 1s5l n ASN 194 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1s5l h PRO 195 N 2.47 0.40 -0.52 1.20 0.13 -1.88 -3.21 132.00 130.60 1s5l h PRO 195 Ca -0.50 -0.43 0.07 0.00 -0.87 0.00 0.00 66.00 64.27 1s5l h PRO 195 Cb 1.27 0.12 -0.06 0.00 0.13 0.00 0.00 31.00 32.46 1s5l h PRO 195 CO 0.62 1.10 0.21 0.74 -0.23 0.00 0.00 178.00 180.43 1s5l h PHE 196 N 0.23 0.37 0.00 1.56 0.05 -1.93 0.36 116.94 117.58 1s5l h PHE 196 Ca -0.08 0.02 -0.04 0.00 3.82 0.00 0.00 57.97 61.70 1s5l h PHE 196 Cb 1.57 -0.09 -0.01 0.00 2.00 0.00 0.00 35.95 39.42 1s5l h PHE 196 CO 0.06 0.14 -0.18 1.25 -0.18 0.00 0.00 178.31 179.39 1s5l h HIS 197 N 0.40 0.00 -0.47 -0.55 2.76 -1.83 -1.60 115.15 113.86 1s5l h HIS 197 Ca 0.25 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.35 1s5l h HIS 197 Cb 0.24 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.18 1s5l h HIS 197 CO -0.15 0.18 0.04 0.52 -1.30 0.00 0.00 177.93 177.23 1s5l h MET 198 N 0.00 0.81 -0.20 5.26 2.86 -0.35 0.26 114.93 123.57 1s5l h MET 198 Ca -0.00 -0.24 -0.07 0.00 -2.06 0.00 0.00 59.70 57.33 1s5l h MET 198 Cb 0.40 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 1s5l h MET 198 CO 0.02 0.84 -0.13 0.52 1.06 0.00 0.00 176.91 179.22 1s5l h MET 199 N 0.66 0.44 -0.56 1.72 2.86 -0.96 -0.85 114.93 118.25 1s5l h MET 199 Ca 0.14 -0.21 0.11 0.00 -2.06 0.00 0.00 59.70 57.68 1s5l h MET 199 Cb 0.45 -0.01 -0.09 0.00 0.06 0.00 0.00 31.60 32.02 1s5l h MET 199 CO 0.02 0.75 0.05 0.78 1.06 0.00 0.00 176.91 179.57 1s5l h GLY 200 N 0.13 0.64 2.00 8.32 0.00 -1.06 1.40 103.07 114.50 1s5l h GLY 200 Ca 0.04 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1s5l h GLY 200 CO 0.04 -0.14 0.00 -2.08 0.00 0.00 0.00 176.54 174.35 1s5l h VAL 201 N 0.17 0.00 0.01 4.60 2.07 0.11 -2.46 116.25 120.75 1s5l h VAL 201 Ca 0.29 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.78 1s5l h VAL 201 Cb 0.44 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1s5l h VAL 201 CO -0.43 0.00 -0.00 0.00 0.02 0.00 0.00 177.57 177.15 1s5l h ALA 202 N 2.00 -0.01 -0.49 1.67 0.00 0.33 -3.22 119.26 119.54 1s5l h ALA 202 Ca 0.00 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 1s5l h ALA 202 Cb 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1s5l h ALA 202 CO 0.00 -0.07 0.08 0.78 0.00 0.00 0.00 179.25 180.04 1s5l h GLY 203 N -0.89 0.88 0.99 0.00 0.00 -0.83 0.15 103.07 103.38 1s5l h GLY 203 Ca -0.00 -0.58 0.01 0.00 0.00 0.00 0.00 47.33 46.75 1s5l h GLY 203 CO 0.00 0.54 0.49 -2.08 0.00 0.00 0.00 176.54 175.49 1s5l h VAL 204 N 0.69 1.18 0.00 4.60 2.07 -1.62 0.90 116.25 124.07 1s5l h VAL 204 Ca 0.15 -0.34 -0.07 0.00 0.82 0.00 0.00 66.70 67.26 1s5l h VAL 204 Cb 0.39 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1s5l h VAL 204 CO 0.01 0.18 -0.33 -0.07 0.02 0.00 0.00 177.57 177.38 1s5l h LEU 205 N 0.99 0.00 -0.04 2.57 3.38 -1.55 -2.79 115.31 117.87 1s5l h LEU 205 Ca 0.27 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 58.10 1s5l h LEU 205 Cb -0.10 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1s5l h LEU 205 CO -0.06 0.33 -0.67 1.23 0.09 0.00 0.00 178.44 179.37 1s5l h GLY 206 N 2.94 0.00 1.11 0.83 0.00 0.53 -2.05 103.07 106.44 1s5l h GLY 206 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.18 1s5l h GLY 206 CO 0.04 0.00 -0.29 -1.33 0.00 0.00 0.00 176.54 174.96 1s5l h GLY 207 N 3.26 1.05 2.00 4.60 0.00 0.10 -1.32 103.07 112.76 1s5l h GLY 207 Ca -0.01 -1.00 -0.12 0.00 0.00 0.00 0.00 47.33 46.20 1s5l h GLY 207 CO 0.09 0.91 -0.58 0.00 0.00 0.00 0.00 176.54 176.95 1s5l h ALA 208 N 0.82 0.80 -0.28 3.60 0.00 -1.51 -1.33 119.26 121.37 1s5l h ALA 208 Ca 0.09 -0.53 -0.19 0.00 0.00 0.00 0.00 54.91 54.28 1s5l h ALA 208 Cb 0.88 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1s5l h ALA 208 CO 0.08 0.72 -0.56 1.25 0.00 0.00 0.00 179.25 180.74 1s5l h LEU 209 N 0.00 0.96 0.59 0.00 5.85 -1.09 -2.76 115.31 118.85 1s5l h LEU 209 Ca -0.01 -0.52 -0.03 0.00 0.84 0.00 0.00 57.88 58.17 1s5l h LEU 209 Cb 1.21 -0.27 0.01 0.00 0.37 0.00 0.00 40.66 41.97 1s5l h LEU 209 CO 0.08 1.32 -0.29 -0.07 -0.34 0.00 0.00 178.44 179.14 1s5l h LEU 210 N 0.65 -0.68 -1.71 2.25 3.38 -1.17 -2.44 115.31 115.60 1s5l h LEU 210 Ca 0.01 -0.03 0.41 0.00 0.09 0.00 0.00 57.88 58.35 1s5l h LEU 210 Cb 1.17 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 42.04 1s5l h LEU 210 CO 0.12 -0.33 1.17 0.00 0.09 0.00 0.00 178.44 179.49 1s5l h ALA 212 N 0.98 0.03 -0.51 0.00 0.00 -1.30 -3.13 119.26 115.33 1s5l h ALA 212 Ca 0.67 -0.42 0.05 0.00 0.00 0.00 0.00 54.91 55.21 1s5l h ALA 212 Cb 2.99 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 21.05 1s5l h ALA 212 CO -0.01 0.31 0.25 0.82 0.00 0.00 0.00 179.25 180.62 1s5l h ILE 213 N -1.00 0.93 0.90 0.00 2.04 -0.79 0.36 117.51 119.95 1s5l h ILE 213 Ca -0.04 -0.16 -0.04 0.00 1.00 0.00 0.00 64.86 65.61 1s5l h ILE 213 Cb 0.47 0.41 0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1s5l h ILE 213 CO -0.03 0.09 -0.43 -0.74 0.00 0.00 0.00 178.15 177.04 1s5l h HIS 214 N 0.48 -1.12 -0.55 1.37 2.76 -1.06 0.20 115.15 117.23 1s5l h HIS 214 Ca 0.23 -0.03 0.08 0.00 -2.20 0.00 0.00 60.37 58.46 1s5l h HIS 214 Cb 0.16 0.37 -0.03 0.00 1.55 0.00 0.00 27.41 29.46 1s5l h HIS 214 CO -0.11 -0.69 0.37 0.78 -1.30 0.00 0.00 177.93 176.97 1s5l h GLY 215 N -1.26 0.55 0.90 5.26 0.00 -1.45 -1.34 103.07 105.73 1s5l h GLY 215 Ca -0.12 -0.17 -0.25 0.00 0.00 0.00 0.00 47.33 46.79 1s5l h GLY 215 CO 0.20 0.11 -1.13 0.00 0.00 0.00 0.00 176.54 175.72 1s5l h ALA 216 N 1.71 -0.10 0.38 3.60 0.00 -0.14 -3.05 119.26 121.67 1s5l h ALA 216 Ca 0.25 -0.79 -0.00 0.00 0.00 0.00 0.00 54.91 54.36 1s5l h ALA 216 Cb 0.44 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1s5l h ALA 216 CO -0.07 0.54 -0.43 1.15 0.00 0.00 0.00 179.25 180.45 1s5l h THR 217 N -0.16 0.15 0.00 0.00 2.02 -0.18 -0.60 112.91 114.13 1s5l h THR 217 Ca -0.20 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1s5l h THR 217 Cb 1.87 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.42 1s5l h THR 217 CO 0.20 0.00 0.00 0.52 0.37 0.00 0.00 175.52 176.61 1s5l n VAL 218 N -5.51 0.00 -0.11 3.16 0.31 -0.54 -0.51 118.33 115.13 1s5l n VAL 218 Ca -0.10 0.69 0.09 0.00 -0.01 0.00 0.00 64.34 65.00 1s5l n VAL 218 Cb 0.41 -1.29 0.16 0.00 -0.91 0.00 0.00 33.84 32.21 1s5l n VAL 218 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1s5l n GLU 219 N -0.33 -0.02 0.07 5.55 4.07 -1.15 0.19 120.64 129.02 1s5l n GLU 219 Ca 0.00 0.46 0.12 0.00 -0.06 0.00 0.00 57.16 57.68 1s5l n GLU 219 Cb 0.00 -0.80 0.17 0.00 -0.06 0.00 0.00 31.44 30.75 1s5l n GLU 219 CO 0.00 0.00 0.00 -0.97 -0.06 0.00 0.00 177.13 176.10 1s5l h ASN 220 N 0.00 0.00 -0.44 4.31 -1.24 -0.29 -3.30 115.58 114.62 1s5l h ASN 220 Ca 0.25 -0.17 0.00 0.00 0.71 0.00 0.00 56.30 57.09 1s5l h ASN 220 Cb 0.63 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.68 1s5l h ASN 220 CO -0.27 0.09 0.00 0.41 -1.29 0.00 0.00 177.43 176.37 1s5l n THR 221 N -2.20 0.61 -1.52 -3.57 -1.04 0.52 -5.01 114.28 102.08 1s5l n THR 221 Ca 0.03 -0.81 -0.41 0.00 -2.04 0.00 0.00 64.05 60.82 1s5l n THR 221 Cb 0.45 0.88 0.01 0.00 -1.82 0.00 0.00 70.33 69.85 1s5l n THR 221 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1s5l n LEU 222 N 1.44 1.10 -4.73 -4.42 4.77 -1.04 -3.48 117.00 110.65 1s5l n LEU 222 Ca 0.19 0.94 -0.42 0.00 -0.03 0.00 0.00 56.01 56.70 1s5l n LEU 222 Cb 0.59 -1.21 -0.03 0.00 -2.33 0.00 0.00 43.42 40.44 1s5l n LEU 222 CO 0.15 -2.35 1.29 -0.36 -1.33 0.00 0.00 177.39 174.79 1s5l s PHE 223 N -1.40 2.94 0.14 -1.77 0.40 0.19 -4.93 117.98 113.56 1s5l s PHE 223 Ca 0.64 0.54 -0.31 0.00 -0.60 0.00 0.00 56.93 57.20 1s5l s PHE 223 Cb -0.58 -4.04 -0.08 0.00 0.51 0.00 0.00 43.02 38.83 1s5l s PHE 223 CO 0.57 -3.81 1.39 -0.65 0.70 0.00 0.00 175.22 173.41 1s5l s GLN 224 N 0.83 4.32 0.00 0.44 -0.21 -1.26 -3.18 119.66 120.60 1s5l s GLN 224 Ca 0.71 2.11 0.00 0.00 0.02 0.00 0.00 55.36 58.19 1s5l s GLN 224 Cb -0.47 -3.22 0.00 0.00 1.00 0.00 0.00 33.01 30.32 1s5l s GLN 224 CO 0.35 -0.41 0.00 -0.25 -2.12 0.00 0.00 175.29 172.85 1s5l n ASP 225 N 3.58 -0.72 0.24 5.90 8.00 -1.26 -4.88 116.55 127.41 1s5l n ASP 225 Ca 0.10 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.74 1s5l n ASP 225 Cb 0.42 -0.63 0.59 0.00 -0.02 0.00 0.00 41.12 41.48 1s5l n ASP 225 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1s5l h GLY 226 N 0.00 0.00 -7.05 0.44 0.00 -1.95 -3.32 103.07 91.19 1s5l h GLY 226 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.96 1s5l h GLY 226 CO 0.00 0.00 -0.75 1.85 0.00 0.00 0.00 176.54 177.64 1s5l s GLU 227 N -4.20 0.11 0.07 4.80 2.56 -1.26 -5.05 118.70 115.74 1s5l s GLU 227 Ca -0.03 0.27 -0.28 0.00 0.00 0.00 0.00 54.97 54.93 1s5l s GLU 227 Cb 0.08 -0.57 -0.17 0.00 2.00 0.00 0.00 34.13 35.47 1s5l s GLU 227 CO 0.28 -0.28 1.65 0.78 -0.56 0.00 0.00 175.26 177.13 1s5l h GLY 228 N 8.14 -0.52 0.46 -1.50 0.00 -1.94 -1.89 103.07 105.83 1s5l h GLY 228 Ca -0.21 0.19 0.18 0.00 0.00 0.00 0.00 47.33 47.49 1s5l h GLY 228 CO 0.25 -0.19 0.59 0.00 0.00 0.00 0.00 176.54 177.19 1s5l h ALA 229 N 0.11 2.44 -4.89 3.60 0.00 -1.96 -3.46 119.26 115.10 1s5l h ALA 229 Ca -0.05 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 1s5l h ALA 229 Cb 0.39 0.05 0.08 0.00 0.00 0.00 0.00 17.79 18.31 1s5l h ALA 229 CO 0.08 -0.92 -0.35 0.43 0.00 0.00 0.00 179.25 178.50 1s5l n SER 230 N -3.84 -6.08 -3.25 0.00 7.64 -0.71 -5.07 113.62 102.31 1s5l n SER 230 Ca 0.13 -0.31 -0.18 0.00 1.01 0.00 0.00 58.87 59.51 1s5l n SER 230 Cb 0.83 -4.28 -0.07 0.00 -1.01 0.00 0.00 64.21 59.68 1s5l n SER 230 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1s5l s THR 231 N -3.16 0.00 -0.39 0.44 2.01 -1.26 -5.10 115.64 108.17 1s5l s THR 231 Ca 0.19 -1.87 0.08 0.00 0.31 0.00 0.00 61.69 60.39 1s5l s THR 231 Cb -0.02 -2.56 0.25 0.00 0.01 0.00 0.00 72.50 70.18 1s5l s THR 231 CO 0.58 0.00 0.54 0.49 -0.69 0.00 0.00 174.62 175.55 1s5l n PHE 232 N -0.63 -0.49 -1.27 4.92 3.01 -1.26 -4.72 117.46 117.02 1s5l n PHE 232 Ca 0.06 -3.49 0.02 0.00 1.01 0.00 0.00 57.45 55.05 1s5l n PHE 232 Cb 0.62 -0.27 0.21 0.00 -0.01 0.00 0.00 39.48 40.03 1s5l n PHE 232 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 1s5l n ARG 233 N 1.38 2.10 -4.33 -1.08 3.00 -1.26 -5.05 116.66 111.43 1s5l n ARG 233 Ca 0.21 -3.01 -0.20 0.00 -0.00 0.00 0.00 57.85 54.84 1s5l n ARG 233 Cb 0.54 -1.78 -0.11 0.00 0.00 0.00 0.00 32.46 31.11 1s5l n ARG 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1s5l s ALA 234 N -3.07 1.95 0.13 5.13 0.00 -1.26 -5.13 121.76 119.50 1s5l s ALA 234 Ca 0.42 -1.52 -0.12 0.00 0.00 0.00 0.00 51.96 50.74 1s5l s ALA 234 Cb 0.37 -0.14 0.04 0.00 0.00 0.00 0.00 23.12 23.39 1s5l s ALA 234 CO 0.03 0.16 0.58 1.97 0.00 0.00 0.00 175.76 178.50 1s5l n PHE 235 N 0.09 -1.16 -3.72 0.00 1.16 -1.26 -5.05 117.46 107.52 1s5l n PHE 235 Ca -0.12 -0.80 -0.01 0.00 -1.87 0.00 0.00 57.45 54.66 1s5l n PHE 235 Cb 0.58 0.39 -0.00 0.00 -1.61 0.00 0.00 39.48 38.84 1s5l n PHE 235 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 1s5l s ASN 236 N -2.40 -0.09 0.01 5.98 4.22 -1.26 -5.01 114.94 116.39 1s5l s ASN 236 Ca 0.13 -0.29 -0.25 0.00 -2.14 0.00 0.00 52.86 50.31 1s5l s ASN 236 Cb -0.02 0.31 -0.19 0.00 1.28 0.00 0.00 41.25 42.63 1s5l s ASN 236 CO 0.04 -0.58 1.38 1.55 -2.04 0.00 0.00 177.10 177.45 1s5l h PRO 237 N 2.00 -0.03 0.00 3.55 0.13 -2.03 -3.07 132.00 132.55 1s5l h PRO 237 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1s5l h PRO 237 Cb 1.21 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1s5l h PRO 237 CO 0.28 0.32 0.12 1.15 -0.23 0.00 0.00 178.00 179.64 1s5l h THR 238 N -0.39 0.00 0.00 1.56 2.02 -2.08 -3.29 112.91 110.73 1s5l h THR 238 Ca -0.00 0.00 -0.38 0.00 0.77 0.00 0.00 66.41 66.80 1s5l h THR 238 Cb 0.37 0.81 0.05 0.00 -1.74 0.00 0.00 68.15 67.64 1s5l h THR 238 CO 0.01 0.00 1.78 1.67 0.37 0.00 0.00 175.52 179.35 1s5l n GLN 239 N -2.89 0.86 0.24 6.66 7.27 -1.16 -4.46 117.38 123.90 1s5l n GLN 239 Ca -0.02 -1.16 -0.16 0.00 0.07 0.00 0.00 57.00 55.73 1s5l n GLN 239 Cb 0.17 -2.43 -0.08 0.00 2.41 0.00 0.00 30.24 30.31 1s5l n GLN 239 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1s5l h ALA 240 N 8.01 -0.55 -0.04 1.69 0.00 -1.85 -2.99 119.26 123.53 1s5l h ALA 240 Ca 0.28 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1s5l h ALA 240 Cb 0.35 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1s5l h ALA 240 CO 1.57 -0.81 0.04 1.49 0.00 0.00 0.00 179.25 181.54 1s5l h GLU 241 N -0.55 0.00 -1.58 0.00 4.57 -1.94 -3.49 114.58 111.60 1s5l h GLU 241 Ca -0.05 0.00 0.18 0.00 -1.18 0.00 0.00 59.36 58.30 1s5l h GLU 241 Cb 0.43 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 28.95 1s5l h GLU 241 CO 0.09 0.00 -0.39 -1.91 -1.18 0.00 0.00 179.01 175.61 1s5l n GLU 242 N -3.82 -1.46 -0.05 1.92 4.07 -1.13 -4.53 120.64 115.64 1s5l n GLU 242 Ca -0.02 1.06 0.01 0.00 -0.06 0.00 0.00 57.16 58.15 1s5l n GLU 242 Cb 0.13 -1.75 0.03 0.00 -0.06 0.00 0.00 31.44 29.79 1s5l n GLU 242 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 1s5l n THR 243 N -3.18 0.16 -3.55 6.31 -1.04 -1.26 -4.92 114.28 106.79 1s5l n THR 243 Ca -0.01 -0.09 -0.10 0.00 -2.04 0.00 0.00 64.05 61.80 1s5l n THR 243 Cb 0.32 -0.31 -0.02 0.00 -1.82 0.00 0.00 70.33 68.49 1s5l n THR 243 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 1s5l s TYR 244 N -1.39 -0.42 -0.14 -1.42 -0.85 -1.26 0.55 117.35 112.42 1s5l s TYR 244 Ca 0.04 0.15 -0.18 0.00 -0.52 0.00 0.00 57.07 56.56 1s5l s TYR 244 Cb 0.03 0.60 -0.04 0.00 0.38 0.00 0.00 41.96 42.93 1s5l s TYR 244 CO 0.02 -0.92 0.47 0.45 -1.52 0.00 0.00 175.55 174.05 1s5l s SER 245 N -2.78 6.64 -0.01 -0.18 0.15 -1.23 -4.96 113.70 111.35 1s5l s SER 245 Ca 0.04 0.77 0.01 0.00 0.70 0.00 0.00 55.95 57.47 1s5l s SER 245 Cb -0.02 -2.28 -0.26 0.00 -1.71 0.00 0.00 66.02 61.75 1s5l s SER 245 CO -0.07 -0.03 0.81 0.24 1.20 0.00 0.00 173.24 175.39 1s5l h MET 246 N 6.88 0.16 -0.76 5.44 2.86 -1.99 -3.11 114.93 124.41 1s5l h MET 246 Ca -0.40 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 56.95 1s5l h MET 246 Cb 1.17 0.10 -0.04 0.00 0.06 0.00 0.00 31.60 32.90 1s5l h MET 246 CO 0.75 0.97 0.43 0.28 1.06 0.00 0.00 176.91 180.40 1s5l h VAL 247 N 0.04 1.22 0.18 -2.22 2.07 -2.00 -0.63 116.25 114.92 1s5l h VAL 247 Ca -0.25 -0.52 -0.24 0.00 0.82 0.00 0.00 66.70 66.51 1s5l h VAL 247 Cb 1.99 0.17 0.03 0.00 -1.52 0.00 0.00 31.29 31.96 1s5l h VAL 247 CO 0.13 0.24 -1.05 0.74 0.02 0.00 0.00 177.57 177.65 1s5l h THR 248 N 1.06 1.43 0.13 2.57 2.02 -2.00 -3.02 112.91 115.11 1s5l h THR 248 Ca 0.27 -2.59 0.02 0.00 0.77 0.00 0.00 66.41 64.88 1s5l h THR 248 Cb -0.00 3.15 -0.05 0.00 -1.74 0.00 0.00 68.15 69.51 1s5l h THR 248 CO -0.05 0.75 -0.48 0.00 0.37 0.00 0.00 175.52 176.12 1s5l h ALA 249 N 0.10 -0.88 -0.14 6.16 0.00 -1.45 0.65 119.26 123.71 1s5l h ALA 249 Ca -0.18 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.64 1s5l h ALA 249 Cb 1.82 0.80 -0.02 0.00 0.00 0.00 0.00 17.79 20.39 1s5l h ALA 249 CO 0.19 -1.06 -0.08 -1.71 0.00 0.00 0.00 179.25 176.59 1s5l n ASN 250 N -5.48 -0.15 -0.13 0.00 2.85 -0.26 0.23 115.26 112.33 1s5l n ASN 250 Ca -0.08 0.85 0.09 0.00 -0.11 0.00 0.00 54.58 55.33 1s5l n ASN 250 Cb 0.40 -0.33 0.42 0.00 1.24 0.00 0.00 39.78 41.50 1s5l n ASN 250 CO 0.00 0.00 0.00 -0.09 -2.11 0.00 0.00 177.26 175.06 1s5l h ARG 251 N 0.00 0.58 0.57 1.20 2.43 -1.36 0.43 114.38 118.24 1s5l h ARG 251 Ca 0.02 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1s5l h ARG 251 Cb 0.06 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1s5l h ARG 251 CO -0.13 0.39 -0.37 0.35 -1.51 0.00 0.00 179.97 178.69 1s5l h PHE 252 N 0.60 -0.99 0.64 2.20 3.57 0.22 -0.58 116.94 122.59 1s5l h PHE 252 Ca 0.29 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.76 1s5l h PHE 252 Cb 0.36 0.36 -0.01 0.00 2.79 0.00 0.00 35.95 39.45 1s5l h PHE 252 CO -0.00 -0.55 -0.41 -1.49 -2.23 0.00 0.00 178.31 173.64 1s5l h TRP 253 N -0.89 -1.08 -0.94 0.41 -0.00 -0.14 -0.65 115.95 112.66 1s5l h TRP 253 Ca -0.08 -0.01 0.29 0.00 -0.00 0.00 0.00 58.89 59.09 1s5l h TRP 253 Cb 0.72 0.39 -0.16 0.00 -0.00 0.00 0.00 29.16 30.10 1s5l h TRP 253 CO -0.07 -0.61 0.24 1.03 -0.00 0.00 0.00 178.44 179.04 1s5l h SER 254 N -0.99 -0.07 1.30 -3.49 0.87 -0.15 1.14 113.55 112.17 1s5l h SER 254 Ca -0.08 0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 1s5l h SER 254 Cb 0.80 0.33 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 1s5l h SER 254 CO 0.07 -0.27 -0.42 1.56 -0.53 0.00 0.00 176.83 177.23 1s5l h GLN 255 N 0.11 0.00 0.00 2.24 4.20 -0.87 -2.21 115.11 118.58 1s5l h GLN 255 Ca 0.63 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 59.07 1s5l h GLN 255 Cb 1.39 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 29.13 1s5l h GLN 255 CO -0.76 0.00 -1.81 -0.89 -0.67 0.00 0.00 178.83 174.70 1s5l n ILE 256 N -2.52 1.51 -0.05 2.54 5.41 0.14 -4.71 119.36 121.69 1s5l n ILE 256 Ca 0.03 -0.15 -0.09 0.00 1.00 0.00 0.00 62.75 63.54 1s5l n ILE 256 Cb 0.49 -2.08 -0.15 0.00 -0.71 0.00 0.00 39.64 37.19 1s5l n ILE 256 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 176.55 176.88 1s5l n PHE 257 N -4.36 0.69 0.00 1.39 7.35 0.35 -5.01 117.46 117.87 1s5l n PHE 257 Ca -0.37 0.25 0.00 0.00 -0.76 0.00 0.00 57.45 56.57 1s5l n PHE 257 Cb 0.71 -1.13 0.00 0.00 0.35 0.00 0.00 39.48 39.42 1s5l n PHE 257 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1s5l n GLY 258 N 1.62 2.87 3.18 7.13 0.00 -0.57 -4.98 105.19 114.43 1s5l n GLY 258 Ca -0.22 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.66 1s5l n GLY 258 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1s5l s ILE 259 N -2.59 0.95 -0.31 -0.61 2.07 -1.26 -4.74 121.20 114.71 1s5l s ILE 259 Ca 0.00 -1.70 -0.12 0.00 -1.41 0.00 0.00 60.65 57.42 1s5l s ILE 259 Cb 0.00 -1.43 0.20 0.00 0.13 0.00 0.00 42.46 41.36 1s5l s ILE 259 CO 0.00 -0.60 1.13 0.00 -1.91 0.00 0.00 174.94 173.56 1s5l s ALA 260 N -2.61 -4.83 -0.23 1.50 0.00 -1.26 -4.03 121.76 110.31 1s5l s ALA 260 Ca 0.07 1.30 -0.29 0.00 0.00 0.00 0.00 51.96 53.04 1s5l s ALA 260 Cb -0.02 -3.06 -0.02 0.00 0.00 0.00 0.00 23.12 20.02 1s5l s ALA 260 CO -0.00 -2.55 1.56 0.12 0.00 0.00 0.00 175.76 174.88 1s5l s PHE 261 N 1.75 2.22 -0.65 0.00 5.99 -1.26 -4.93 117.98 121.09 1s5l s PHE 261 Ca 0.16 0.60 -0.11 0.00 0.00 0.00 0.00 56.93 57.58 1s5l s PHE 261 Cb 0.07 -3.96 0.17 0.00 0.00 0.00 0.00 43.02 39.30 1s5l s PHE 261 CO -0.15 -2.73 0.55 -1.54 -0.00 0.00 0.00 175.22 171.36 1s5l s SER 262 N 3.92 6.12 -0.44 6.13 1.04 -1.26 -4.82 113.70 124.38 1s5l s SER 262 Ca 0.68 -2.36 0.05 0.00 0.48 0.00 0.00 55.95 54.81 1s5l s SER 262 Cb -0.24 -2.10 0.30 0.00 0.10 0.00 0.00 66.02 64.09 1s5l s SER 262 CO 0.28 -0.62 1.11 0.59 0.98 0.00 0.00 173.24 175.58 1s5l n ASN 263 N 4.35 -2.26 0.00 7.02 5.03 -1.26 -5.06 115.26 123.08 1s5l n ASN 263 Ca 0.02 -3.24 0.00 0.00 0.87 0.00 0.00 54.58 52.23 1s5l n ASN 263 Cb 0.42 1.73 0.00 0.00 -1.02 0.00 0.00 39.78 40.92 1s5l n ASN 263 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1s5l n LYS 264 N 0.74 0.00 0.07 3.52 4.76 -1.26 0.35 118.16 126.33 1s5l n LYS 264 Ca 0.05 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.48 1s5l n LYS 264 Cb 0.69 0.00 0.28 0.00 -1.84 0.00 0.00 35.03 34.16 1s5l n LYS 264 CO 0.00 0.00 0.00 0.07 -1.37 0.00 0.00 177.40 176.10 1s5l h ARG 265 N 0.00 0.35 0.00 1.97 0.11 -1.99 -2.58 114.38 112.24 1s5l h ARG 265 Ca 0.00 -0.11 -0.07 0.00 0.10 0.00 0.00 59.98 59.90 1s5l h ARG 265 Cb 0.00 -0.03 0.01 0.00 1.11 0.00 0.00 29.97 31.06 1s5l h ARG 265 CO 0.00 0.55 -0.27 2.35 0.10 0.00 0.00 179.97 182.70 1s5l h TRP 266 N 0.31 0.27 -0.58 4.08 -0.00 -0.52 -2.97 115.95 116.55 1s5l h TRP 266 Ca 0.05 -0.15 0.11 0.00 -0.00 0.00 0.00 58.89 58.91 1s5l h TRP 266 Cb 0.56 -0.03 -0.11 0.00 -0.00 0.00 0.00 29.16 29.58 1s5l h TRP 266 CO 0.01 0.96 -0.18 1.25 -0.00 0.00 0.00 178.44 180.48 1s5l h LEU 267 N -0.50 -0.65 -0.36 0.65 5.85 -1.63 0.11 115.31 118.77 1s5l h LEU 267 Ca -0.03 0.18 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 1s5l h LEU 267 Cb 1.04 0.40 -0.01 0.00 0.37 0.00 0.00 40.66 42.46 1s5l h LEU 267 CO 0.05 -0.22 -0.09 0.45 -0.34 0.00 0.00 178.44 178.29 1s5l h HIS 268 N -0.04 0.79 0.08 1.25 3.86 -1.57 -2.81 115.15 116.71 1s5l h HIS 268 Ca 0.27 -0.17 -0.00 0.00 -1.16 0.00 0.00 60.37 59.31 1s5l h HIS 268 Cb 0.46 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 28.74 1s5l h HIS 268 CO -0.51 0.85 -0.04 0.35 0.86 0.00 0.00 177.93 179.45 1s5l h PHE 269 N 0.50 -0.10 -0.76 2.45 -0.00 -1.23 -0.75 116.94 117.04 1s5l h PHE 269 Ca 0.09 -0.00 0.22 0.00 -0.00 0.00 0.00 57.97 58.28 1s5l h PHE 269 Cb 0.60 0.03 -0.03 0.00 -0.00 0.00 0.00 35.95 36.55 1s5l h PHE 269 CO 0.05 0.01 0.70 0.35 -0.00 0.00 0.00 178.31 179.42 1s5l h PHE 270 N -0.18 0.00 0.00 0.41 3.57 -0.82 2.39 116.94 122.31 1s5l h PHE 270 Ca -0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1s5l h PHE 270 Cb 0.15 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.89 1s5l h PHE 270 CO -0.05 0.00 0.00 -1.33 -2.23 0.00 0.00 178.31 174.70 1s5l n MET 271 N -3.80 0.63 -0.13 1.11 2.81 -0.30 -2.28 117.12 115.17 1s5l n MET 271 Ca 0.16 0.01 -0.23 0.00 -1.81 0.00 0.00 57.70 55.83 1s5l n MET 271 Cb 0.97 -1.50 -0.11 0.00 -0.71 0.00 0.00 33.22 31.87 1s5l n MET 271 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 1s5l n LEU 272 N -1.17 2.56 0.15 4.03 7.94 0.79 -4.52 117.00 126.79 1s5l n LEU 272 Ca 0.17 0.06 -0.14 0.00 -1.11 0.00 0.00 56.01 55.00 1s5l n LEU 272 Cb 0.18 -0.88 -0.07 0.00 0.53 0.00 0.00 43.42 43.18 1s5l n LEU 272 CO 0.20 0.79 0.64 0.15 -1.11 0.00 0.00 177.39 178.05 1s5l h PHE 273 N -0.40 -0.94 0.02 1.96 3.57 -1.10 -2.78 116.94 117.28 1s5l h PHE 273 Ca -0.62 0.02 0.00 0.00 3.53 0.00 0.00 57.97 60.90 1s5l h PHE 273 Cb 1.79 0.38 -0.01 0.00 2.79 0.00 0.00 35.95 40.90 1s5l h PHE 273 CO -0.01 -0.46 -0.12 0.28 -2.23 0.00 0.00 178.31 175.76 1s5l h VAL 274 N -0.62 0.00 0.18 1.41 2.07 -1.71 0.35 116.25 117.93 1s5l h VAL 274 Ca 0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 1s5l h VAL 274 Cb 0.62 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1s5l h VAL 274 CO -0.15 0.00 -0.17 -0.65 0.02 0.00 0.00 177.57 176.62 1s5l h PRO 275 N -0.17 -0.33 -0.52 1.57 0.11 -1.73 -2.56 132.00 128.37 1s5l h PRO 275 Ca -0.00 0.02 0.09 0.00 0.11 0.00 0.00 66.00 66.22 1s5l h PRO 275 Cb 0.18 0.08 -0.07 0.00 0.11 0.00 0.00 31.00 31.29 1s5l h PRO 275 CO -0.07 -0.22 0.12 0.28 -0.21 0.00 0.00 178.00 177.90 1s5l h VAL 276 N -0.34 0.71 -0.97 3.15 2.07 -1.57 -0.72 116.25 118.57 1s5l h VAL 276 Ca -0.02 -0.09 0.19 0.00 0.82 0.00 0.00 66.70 67.59 1s5l h VAL 276 Cb 0.29 0.43 -0.09 0.00 -1.52 0.00 0.00 31.29 30.41 1s5l h VAL 276 CO -0.01 0.05 0.61 0.74 0.02 0.00 0.00 177.57 178.98 1s5l h THR 277 N 0.26 0.73 0.62 2.57 2.02 -0.32 -2.80 112.91 115.98 1s5l h THR 277 Ca 0.27 -0.23 -0.03 0.00 0.77 0.00 0.00 66.41 67.18 1s5l h THR 277 Cb 0.36 -0.01 0.01 0.00 -1.74 0.00 0.00 68.15 66.77 1s5l h THR 277 CO -0.34 0.12 -0.30 1.23 0.37 0.00 0.00 175.52 176.61 1s5l h GLY 278 N 0.67 -0.87 0.58 2.16 0.00 -0.69 -3.17 103.07 101.75 1s5l h GLY 278 Ca 0.53 0.32 0.16 0.00 0.00 0.00 0.00 47.33 48.34 1s5l h GLY 278 CO -0.30 -0.32 0.56 1.41 0.00 0.00 0.00 176.54 177.90 1s5l h LEU 279 N -0.91 0.00 -0.46 3.11 3.38 -1.25 0.13 115.31 119.31 1s5l h LEU 279 Ca -0.09 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 1s5l h LEU 279 Cb 0.64 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1s5l h LEU 279 CO 0.14 0.00 -0.12 -0.50 0.09 0.00 0.00 178.44 178.05 1s5l h TRP 280 N 0.00 1.00 0.26 1.13 4.06 -1.49 -1.29 115.95 119.62 1s5l h TRP 280 Ca 0.26 -0.22 -0.01 0.00 2.06 0.00 0.00 58.89 60.98 1s5l h TRP 280 Cb 1.37 -0.24 -0.00 0.00 -1.00 0.00 0.00 29.16 29.29 1s5l h TRP 280 CO 0.00 0.99 -0.16 0.52 -3.56 0.00 0.00 178.44 176.23 1s5l h MET 281 N 0.73 -0.37 -0.88 0.49 2.86 -0.77 -0.43 114.93 116.56 1s5l h MET 281 Ca 0.12 0.03 0.31 0.00 -2.06 0.00 0.00 59.70 58.09 1s5l h MET 281 Cb 0.67 0.08 -0.16 0.00 0.06 0.00 0.00 31.60 32.25 1s5l h MET 281 CO 0.05 -0.25 0.26 0.45 1.06 0.00 0.00 176.91 178.48 1s5l n SER 282 N -3.20 0.12 -0.04 1.22 2.88 -1.03 0.28 113.62 113.85 1s5l n SER 282 Ca -0.05 1.47 -0.08 0.00 -1.33 0.00 0.00 58.87 58.88 1s5l n SER 282 Cb 0.16 -0.63 0.09 0.00 -0.75 0.00 0.00 64.21 63.08 1s5l n SER 282 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1s5l h ALA 283 N 1.75 0.83 0.47 -1.46 0.00 -0.91 -2.45 119.26 117.50 1s5l h ALA 283 Ca 0.65 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1s5l h ALA 283 Cb 1.56 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1s5l h ALA 283 CO -0.74 0.64 -0.23 0.82 0.00 0.00 0.00 179.25 179.74 1s5l h ILE 284 N 0.54 0.52 -1.46 0.00 2.04 0.58 -2.36 117.51 117.38 1s5l h ILE 284 Ca 0.05 -0.17 0.43 0.00 1.00 0.00 0.00 64.86 66.17 1s5l h ILE 284 Cb 0.87 0.60 -0.08 0.00 -0.74 0.00 0.00 36.82 37.48 1s5l h ILE 284 CO 0.08 0.03 1.02 1.23 0.00 0.00 0.00 178.15 180.51 1s5l h GLY 285 N -0.74 0.42 1.78 5.37 0.00 0.02 0.59 103.07 110.50 1s5l h GLY 285 Ca -0.06 -0.05 -0.22 0.00 0.00 0.00 0.00 47.33 47.00 1s5l h GLY 285 CO 0.11 -0.10 -1.14 -2.08 0.00 0.00 0.00 176.54 173.33 1s5l h VAL 286 N 0.06 1.50 0.00 4.60 2.07 -0.99 -3.00 116.25 120.48 1s5l h VAL 286 Ca 0.75 -3.22 -0.00 0.00 0.82 0.00 0.00 66.70 65.04 1s5l h VAL 286 Cb 2.76 2.74 -0.00 0.00 -1.52 0.00 0.00 31.29 35.26 1s5l h VAL 286 CO -0.13 0.85 -0.01 0.58 0.02 0.00 0.00 177.57 178.88 1s5l h VAL 287 N 0.00 0.05 0.00 2.57 2.07 0.67 -1.54 116.25 120.07 1s5l h VAL 287 Ca -0.07 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 1s5l h VAL 287 Cb 1.81 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.87 1s5l h VAL 287 CO 0.12 0.01 -0.00 1.23 0.02 0.00 0.00 177.57 178.95 1s5l h GLY 288 N 1.12 -0.00 2.00 2.17 0.00 -1.34 -3.26 103.07 103.76 1s5l h GLY 288 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1s5l h GLY 288 CO 0.00 -0.00 -0.11 1.41 0.00 0.00 0.00 176.54 177.84 1s5l h LEU 289 N -0.81 0.00 -1.93 3.11 3.38 -1.32 -0.74 115.31 117.00 1s5l h LEU 289 Ca -0.00 0.00 0.24 0.00 0.09 0.00 0.00 57.88 58.21 1s5l h LEU 289 Cb 0.79 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 1s5l h LEU 289 CO 0.00 0.11 0.68 0.00 0.09 0.00 0.00 178.44 179.31 1s5l h ALA 290 N 1.89 2.73 -0.76 1.53 0.00 -1.33 0.92 119.26 124.23 1s5l h ALA 290 Ca -0.00 -0.03 -0.50 0.00 0.00 0.00 0.00 54.91 54.38 1s5l h ALA 290 Cb 0.20 0.06 -0.29 0.00 0.00 0.00 0.00 17.79 17.77 1s5l h ALA 290 CO 0.01 -1.11 0.11 1.28 0.00 0.00 0.00 179.25 179.54 1s5l n LEU 291 N -4.03 5.89 -1.34 0.00 4.77 -0.30 -3.74 117.00 118.25 1s5l n LEU 291 Ca 0.17 -4.23 0.00 0.00 -0.03 0.00 0.00 56.01 51.92 1s5l n LEU 291 Cb 0.97 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 1s5l n LEU 291 CO 0.35 1.57 0.00 0.59 -1.33 0.00 0.00 177.39 178.57 1s5l n ASN 292 N -0.94 -0.24 -4.52 -1.43 3.02 0.32 -4.82 115.26 106.66 1s5l n ASN 292 Ca 0.50 0.12 -0.43 0.00 -0.03 0.00 0.00 54.58 54.73 1s5l n ASN 292 Cb 0.95 -0.61 -0.06 0.00 -0.61 0.00 0.00 39.78 39.45 1s5l n ASN 292 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1s5l s LEU 293 N -2.67 4.47 0.41 3.41 2.96 -1.12 -4.99 118.68 121.15 1s5l s LEU 293 Ca 0.00 -0.35 0.04 0.00 -0.22 0.00 0.00 54.13 53.60 1s5l s LEU 293 Cb 0.00 -2.75 -0.02 0.00 0.50 0.00 0.00 46.19 43.91 1s5l s LEU 293 CO 0.00 -0.84 0.15 -0.13 -1.32 0.00 0.00 176.35 174.20 1s5l s ARG 294 N 2.96 1.93 -0.66 1.98 0.52 -1.26 -3.36 118.95 121.07 1s5l s ARG 294 Ca 0.24 -2.18 0.06 0.00 -0.52 0.00 0.00 55.73 53.32 1s5l s ARG 294 Cb -0.14 -0.50 0.21 0.00 0.52 0.00 0.00 34.95 35.04 1s5l s ARG 294 CO 0.19 -0.51 0.63 0.43 0.02 0.00 0.00 175.30 176.05 1s5l n SER 295 N -1.38 3.29 -0.32 0.23 7.64 -1.26 -4.80 113.62 117.03 1s5l n SER 295 Ca -0.05 -3.31 0.03 0.00 1.01 0.00 0.00 58.87 56.56 1s5l n SER 295 Cb 0.65 -0.71 0.09 0.00 -1.01 0.00 0.00 64.21 63.23 1s5l n SER 295 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1s5l n TYR 296 N 1.37 0.25 -3.53 1.43 9.36 -1.26 -3.96 117.16 120.82 1s5l n TYR 296 Ca 0.25 -0.56 -0.17 0.00 3.32 0.00 0.00 57.90 60.75 1s5l n TYR 296 Cb 0.39 -0.06 -0.06 0.00 -0.63 0.00 0.00 39.34 38.98 1s5l n TYR 296 CO 0.00 0.00 0.00 0.16 0.22 0.00 0.00 176.86 177.24 1s5l s ASP 297 N -1.19 -0.61 -0.61 2.98 -4.77 -1.26 -5.03 116.67 106.18 1s5l s ASP 297 Ca 0.14 0.58 0.06 0.00 -3.30 0.00 0.00 52.55 50.03 1s5l s ASP 297 Cb 0.09 0.53 0.21 0.00 -1.09 0.00 0.00 42.92 42.66 1s5l s ASP 297 CO 0.07 -0.64 0.59 0.49 0.70 0.00 0.00 175.17 176.38 1s5l n PHE 298 N 0.78 2.60 -0.15 2.11 3.01 -1.26 -4.99 117.46 119.57 1s5l n PHE 298 Ca -0.19 -4.06 -0.03 0.00 1.01 0.00 0.00 57.45 54.17 1s5l n PHE 298 Cb 0.58 -0.48 -0.03 0.00 -0.01 0.00 0.00 39.48 39.54 1s5l n PHE 298 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 1s5l n ILE 299 N 1.52 -0.23 -0.37 4.37 5.41 -1.26 0.11 119.36 128.91 1s5l n ILE 299 Ca 0.25 0.84 0.03 0.00 1.00 0.00 0.00 62.75 64.88 1s5l n ILE 299 Cb 0.41 -1.05 0.10 0.00 -0.71 0.00 0.00 39.64 38.39 1s5l n ILE 299 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1s5l n SER 300 N -4.44 -0.47 0.05 4.38 3.41 -1.26 -1.24 113.62 114.04 1s5l n SER 300 Ca 0.01 1.73 -0.12 0.00 -0.26 0.00 0.00 58.87 60.23 1s5l n SER 300 Cb 0.10 -0.47 -0.08 0.00 -0.26 0.00 0.00 64.21 63.49 1s5l n SER 300 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1s5l h GLN 301 N 0.00 -0.19 -0.58 4.33 1.08 0.34 -3.15 115.11 116.95 1s5l h GLN 301 Ca 0.43 0.01 0.09 0.00 -1.45 0.00 0.00 58.65 57.73 1s5l h GLN 301 Cb 0.68 0.04 -0.11 0.00 -0.05 0.00 0.00 27.48 28.04 1s5l h GLN 301 CO -1.02 0.25 -0.44 0.93 -0.95 0.00 0.00 178.83 177.61 1s5l h GLU 302 N -0.75 -0.22 -0.69 1.46 4.39 -0.61 0.73 114.58 118.89 1s5l h GLU 302 Ca -0.02 0.02 0.08 0.00 0.34 0.00 0.00 59.36 59.78 1s5l h GLU 302 Cb 0.53 0.05 -0.11 0.00 -0.10 0.00 0.00 28.75 29.12 1s5l h GLU 302 CO 0.03 -0.15 -0.52 0.82 -1.16 0.00 0.00 179.01 178.04 1s5l h ILE 303 N -0.23 0.03 0.00 3.13 2.04 -1.24 0.91 117.51 122.14 1s5l h ILE 303 Ca 0.18 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.04 1s5l h ILE 303 Cb 0.56 0.03 0.00 0.00 -0.74 0.00 0.00 36.82 36.67 1s5l h ILE 303 CO -0.69 0.00 0.00 -1.14 0.00 0.00 0.00 178.15 176.32 1s5l n ARG 304 N -5.36 0.13 0.15 2.37 0.63 -0.71 -2.12 116.66 111.76 1s5l n ARG 304 Ca 0.01 0.34 0.04 0.00 -0.92 0.00 0.00 57.85 57.31 1s5l n ARG 304 Cb 0.32 -1.73 0.11 0.00 0.45 0.00 0.00 32.46 31.61 1s5l n ARG 304 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1s5l h ALA 305 N 2.38 0.75 0.02 5.13 0.00 0.73 -3.11 119.26 125.16 1s5l h ALA 305 Ca 0.00 -0.41 -0.35 0.00 0.00 0.00 0.00 54.91 54.15 1s5l h ALA 305 Cb 0.35 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 1s5l h ALA 305 CO 0.00 0.56 -2.19 0.00 0.00 0.00 0.00 179.25 177.63 1s5l n ALA 306 N -2.23 1.41 1.01 0.00 0.00 -0.44 -4.14 120.51 116.12 1s5l n ALA 306 Ca 0.02 -1.06 0.13 0.00 0.00 0.00 0.00 53.44 52.52 1s5l n ALA 306 Cb 0.68 -0.40 0.59 0.00 0.00 0.00 0.00 19.45 20.32 1s5l n ALA 306 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1s5l n GLU 307 N -3.01 0.13 -3.69 0.00 1.02 -0.93 -4.75 120.64 109.41 1s5l n GLU 307 Ca -0.31 0.05 -0.15 0.00 -0.02 0.00 0.00 57.16 56.73 1s5l n GLU 307 Cb 1.09 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.86 1s5l n GLU 307 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1s5l s ASP 308 N -2.86 0.37 0.00 1.62 2.15 -1.17 -5.06 116.67 111.72 1s5l s ASP 308 Ca 0.17 0.43 0.26 0.00 0.43 0.00 0.00 52.55 53.84 1s5l s ASP 308 Cb 0.17 0.41 0.67 0.00 -0.30 0.00 0.00 42.92 43.87 1s5l s ASP 308 CO 0.45 -0.22 1.51 -0.81 -0.17 0.00 0.00 175.17 175.93 1s5l n PRO 309 N 5.03 1.02 -0.71 4.34 -0.04 -1.26 -4.15 135.00 139.23 1s5l n PRO 309 Ca -0.11 -0.65 0.08 0.00 -0.04 0.00 0.00 63.50 62.78 1s5l n PRO 309 Cb 0.50 -1.49 0.36 0.00 -0.04 0.00 0.00 33.50 32.84 1s5l n PRO 309 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1s5l n GLU 310 N -0.42 4.13 -4.03 0.54 1.02 -1.26 -4.91 120.64 115.71 1s5l n GLU 310 Ca 0.13 -2.98 -0.31 0.00 -0.02 0.00 0.00 57.16 53.98 1s5l n GLU 310 Cb 0.37 -2.03 -0.16 0.00 -0.02 0.00 0.00 31.44 29.60 1s5l n GLU 310 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1s5l s PHE 311 N -2.30 2.28 -0.09 -0.32 2.19 -1.26 -5.12 117.98 113.36 1s5l s PHE 311 Ca 0.51 -1.31 -0.10 0.00 0.33 0.00 0.00 56.93 56.35 1s5l s PHE 311 Cb 0.36 -1.65 0.03 0.00 -1.31 0.00 0.00 43.02 40.45 1s5l s PHE 311 CO 0.19 -0.70 0.28 -2.00 1.83 0.00 0.00 175.22 174.83 1s5l s GLU 312 N 1.45 0.37 0.18 10.12 2.12 -1.26 -4.92 118.70 126.76 1s5l s GLU 312 Ca 0.05 0.31 0.02 0.00 0.36 0.00 0.00 54.97 55.70 1s5l s GLU 312 Cb -0.13 0.18 -0.05 0.00 0.26 0.00 0.00 34.13 34.39 1s5l s GLU 312 CO -0.11 -0.06 0.01 0.95 -0.54 0.00 0.00 175.26 175.51 1s5l s THR 313 N -0.05 0.68 0.58 -1.70 -4.23 -1.26 -5.02 115.64 104.63 1s5l s THR 313 Ca -0.02 -1.99 0.28 0.00 -1.18 0.00 0.00 61.69 58.78 1s5l s THR 313 Cb -0.03 -2.18 0.36 0.00 1.34 0.00 0.00 72.50 71.99 1s5l s THR 313 CO 0.01 -0.42 2.11 -0.26 -0.54 0.00 0.00 174.62 175.52 1s5l h PHE 314 N 2.66 0.00 -0.12 3.99 -1.00 -2.02 0.17 116.94 120.62 1s5l h PHE 314 Ca -0.37 0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.46 1s5l h PHE 314 Cb 1.21 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.72 1s5l h PHE 314 CO 0.53 0.00 -0.20 -0.92 -1.61 0.00 0.00 178.31 176.11 1s5l h TYR 315 N 0.00 -0.52 0.67 -0.55 3.20 -2.01 -2.50 116.97 115.26 1s5l h TYR 315 Ca 0.08 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.95 1s5l h TYR 315 Cb 0.44 0.25 0.01 0.00 1.54 0.00 0.00 36.73 38.97 1s5l h TYR 315 CO 0.00 -0.28 -0.32 1.15 -1.64 0.00 0.00 178.16 177.07 1s5l h THR 316 N -0.26 0.22 -1.05 1.81 2.02 -1.09 -3.01 112.91 111.55 1s5l h THR 316 Ca 0.10 -0.24 0.39 0.00 0.77 0.00 0.00 66.41 67.43 1s5l h THR 316 Cb 0.40 0.28 -0.16 0.00 -1.74 0.00 0.00 68.15 66.93 1s5l h THR 316 CO -0.27 0.02 0.60 0.11 0.37 0.00 0.00 175.52 176.35 1s5l h LYS 317 N -1.09 0.13 -0.11 6.66 1.57 -1.27 0.14 116.57 122.60 1s5l h LYS 317 Ca -0.09 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1s5l h LYS 317 Cb 0.73 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 1s5l h LYS 317 CO 0.15 0.09 0.00 -0.91 -0.57 0.00 0.00 179.45 178.21 1s5l h ASN 318 N 0.13 0.19 0.00 0.86 2.35 -1.33 -2.70 115.58 115.07 1s5l h ASN 318 Ca 0.80 -0.31 0.00 0.00 -0.55 0.00 0.00 56.30 56.25 1s5l h ASN 318 Cb 2.09 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 40.41 1s5l h ASN 318 CO -0.65 0.45 0.30 -0.07 -1.65 0.00 0.00 177.43 175.81 1s5l h LEU 319 N -0.08 0.00 0.04 1.61 3.38 -0.60 0.56 115.31 120.21 1s5l h LEU 319 Ca 0.03 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1s5l h LEU 319 Cb 0.35 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.11 1s5l h LEU 319 CO 0.01 0.00 -0.33 -0.07 0.09 0.00 0.00 178.44 178.14 1s5l h LEU 320 N 0.00 0.22 -0.68 1.67 3.38 -1.28 -3.19 115.31 115.43 1s5l h LEU 320 Ca 0.00 -0.91 0.09 0.00 0.09 0.00 0.00 57.88 57.16 1s5l h LEU 320 Cb 0.60 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.21 1s5l h LEU 320 CO 0.00 1.10 0.32 -0.07 0.09 0.00 0.00 178.44 179.88 1s5l h LEU 321 N -0.64 0.39 0.13 1.67 3.38 -0.84 -2.73 115.31 116.67 1s5l h LEU 321 Ca -0.05 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1s5l h LEU 321 Cb 1.19 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.90 1s5l h LEU 321 CO 0.06 0.22 -0.51 0.78 0.09 0.00 0.00 178.44 179.08 1s5l h ASN 322 N 0.54 -1.54 -1.05 -0.43 2.35 -1.48 0.24 115.58 114.21 1s5l h ASN 322 Ca 0.34 0.16 0.28 0.00 -0.55 0.00 0.00 56.30 56.53 1s5l h ASN 322 Cb 0.38 0.57 -0.08 0.00 0.05 0.00 0.00 38.32 39.23 1s5l h ASN 322 CO -0.28 -0.56 0.69 -0.08 -1.65 0.00 0.00 177.43 175.55 1s5l h GLU 323 N -0.75 0.31 -0.62 0.81 4.57 -1.48 1.27 114.58 118.69 1s5l h GLU 323 Ca -0.00 -0.02 -0.07 0.00 -1.18 0.00 0.00 59.36 58.09 1s5l h GLU 323 Cb 0.76 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.25 1s5l h GLU 323 CO -0.28 0.21 0.12 0.78 -1.18 0.00 0.00 179.01 178.66 1s5l h GLY 324 N 0.32 1.08 0.79 1.92 0.00 -0.34 0.14 103.07 106.98 1s5l h GLY 324 Ca 0.58 -0.68 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 1s5l h GLY 324 CO -0.24 0.63 -0.04 -2.22 0.00 0.00 0.00 176.54 174.67 1s5l h ILE 325 N 0.95 1.05 -0.03 2.60 2.04 0.31 -2.86 117.51 121.57 1s5l h ILE 325 Ca 0.20 -0.47 0.00 0.00 1.00 0.00 0.00 64.86 65.59 1s5l h ILE 325 Cb 0.39 1.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.82 1s5l h ILE 325 CO 0.01 0.12 0.02 0.03 0.00 0.00 0.00 178.15 178.32 1s5l h ARG 326 N -0.32 0.04 0.24 2.37 3.08 -0.16 -0.96 114.38 118.67 1s5l h ARG 326 Ca -0.01 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1s5l h ARG 326 Cb 0.27 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1s5l h ARG 326 CO 0.02 0.05 -0.18 0.00 -1.07 0.00 0.00 179.97 178.79 1s5l h ALA 327 N 0.98 -0.40 -0.16 0.04 0.00 -0.79 -2.31 119.26 116.62 1s5l h ALA 327 Ca 0.01 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.67 1s5l h ALA 327 Cb 0.02 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1s5l h ALA 327 CO -0.00 -0.74 -0.65 -1.49 0.00 0.00 0.00 179.25 176.37 1s5l h TRP 328 N -0.42 0.78 0.00 0.00 4.06 -1.55 -3.35 115.95 115.47 1s5l h TRP 328 Ca -0.02 -0.31 0.00 0.00 2.06 0.00 0.00 58.89 60.62 1s5l h TRP 328 Cb 0.37 -0.13 0.00 0.00 -1.00 0.00 0.00 29.16 28.40 1s5l h TRP 328 CO -0.11 1.08 -0.54 -0.12 -3.56 0.00 0.00 178.44 175.18 1s5l n MET 329 N -3.92 0.16 0.11 0.49 0.00 -0.37 -4.39 117.12 109.20 1s5l n MET 329 Ca -0.04 0.05 0.12 0.00 -0.00 0.00 0.00 57.70 57.82 1s5l n MET 329 Cb 0.67 -1.60 0.21 0.00 0.00 0.00 0.00 33.22 32.49 1s5l n MET 329 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1s5l h ALA 330 N 2.73 0.75 0.00 -5.12 0.00 -1.54 -2.83 119.26 113.24 1s5l h ALA 330 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1s5l h ALA 330 Cb 0.64 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1s5l h ALA 330 CO 0.00 0.00 -0.89 -1.35 0.00 0.00 0.00 179.25 177.01 1s5l h PRO 331 N 0.00 0.00 0.00 0.00 0.11 -1.79 -2.63 132.00 127.70 1s5l h PRO 331 Ca 0.00 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.78 1s5l h PRO 331 Cb 0.83 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.88 1s5l h PRO 331 CO 0.00 0.37 -2.04 0.94 -0.21 0.00 0.00 178.00 177.05 1s5l n GLN 332 N -3.05 0.66 0.10 1.05 7.27 -1.26 -4.20 117.38 117.96 1s5l n GLN 332 Ca -0.03 0.15 0.13 0.00 0.07 0.00 0.00 57.00 57.32 1s5l n GLN 332 Cb 0.76 -1.66 0.37 0.00 2.41 0.00 0.00 30.24 32.11 1s5l n GLN 332 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1s5l n ASP 333 N -2.91 0.83 -3.37 1.69 -0.08 -1.07 -4.40 116.55 107.25 1s5l n ASP 333 Ca -0.25 0.52 -0.26 0.00 -1.51 0.00 0.00 54.79 53.29 1s5l n ASP 333 Cb 1.10 -0.68 -0.10 0.00 2.34 0.00 0.00 41.12 43.79 1s5l n ASP 333 CO 0.00 0.00 0.00 -1.10 0.12 0.00 0.00 177.20 176.22 1s5l s GLN 334 N -3.11 0.90 0.53 -0.67 -0.21 -0.99 -5.00 119.66 111.11 1s5l s GLN 334 Ca 0.10 -2.06 0.21 0.00 0.02 0.00 0.00 55.36 53.63 1s5l s GLN 334 Cb 0.12 -1.36 1.37 0.00 1.00 0.00 0.00 33.01 34.15 1s5l s GLN 334 CO 0.62 -1.38 2.10 -1.35 -2.12 0.00 0.00 175.29 173.15 1s5l h PRO 335 N 5.63 0.00 -0.48 2.91 0.11 -1.77 -3.29 132.00 135.12 1s5l h PRO 335 Ca 0.26 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.24 1s5l h PRO 335 Cb 0.92 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 1s5l h PRO 335 CO 0.35 0.00 -0.20 1.12 -0.21 0.00 0.00 178.00 179.06 1s5l h HIS 336 N 0.00 1.10 -0.02 0.65 2.07 -1.94 -3.10 115.15 113.91 1s5l h HIS 336 Ca 0.09 -0.26 -0.17 0.00 -2.85 0.00 0.00 60.37 57.18 1s5l h HIS 336 Cb 0.39 -0.26 -0.01 0.00 2.57 0.00 0.00 27.41 30.10 1s5l h HIS 336 CO 0.00 1.07 -0.77 0.93 -3.07 0.00 0.00 177.93 176.09 1s5l h GLU 337 N 0.84 0.16 -4.18 5.12 4.39 -1.97 -3.48 114.58 115.45 1s5l h GLU 337 Ca 0.11 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1s5l h GLU 337 Cb 0.77 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 1s5l h GLU 337 CO 0.06 0.85 -0.09 0.09 -1.16 0.00 0.00 179.01 178.76 1s5l n ASN 338 N -3.71 -4.97 -4.74 1.42 5.03 -1.17 -4.99 115.26 102.12 1s5l n ASN 338 Ca -0.03 0.08 -0.40 0.00 0.87 0.00 0.00 54.58 55.10 1s5l n ASN 338 Cb 0.74 -3.20 -0.05 0.00 -1.02 0.00 0.00 39.78 36.24 1s5l n ASN 338 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1s5l s PHE 339 N -2.56 3.77 -0.24 3.10 0.40 -1.26 -5.03 117.98 116.16 1s5l s PHE 339 Ca 0.05 1.63 0.02 0.00 -0.60 0.00 0.00 56.93 58.03 1s5l s PHE 339 Cb -0.01 -2.93 0.05 0.00 0.51 0.00 0.00 43.02 40.64 1s5l s PHE 339 CO 0.38 0.24 -0.11 0.14 0.70 0.00 0.00 175.22 176.58 1s5l s VAL 340 N -0.04 2.01 -0.28 -0.44 -7.23 -1.26 -4.87 120.40 108.29 1s5l s VAL 340 Ca 0.42 -1.44 0.02 0.00 -1.81 0.00 0.00 61.98 59.18 1s5l s VAL 340 Cb -0.22 -2.11 0.07 0.00 0.56 0.00 0.00 36.38 34.69 1s5l s VAL 340 CO 0.26 0.04 -0.04 -0.36 -0.31 0.00 0.00 175.10 174.69 1s5l s PHE 341 N 1.19 3.05 0.07 2.82 2.99 -1.26 -5.10 117.98 121.74 1s5l s PHE 341 Ca -0.06 -2.30 -0.31 0.00 0.00 0.00 0.00 56.93 54.26 1s5l s PHE 341 Cb -0.19 -2.07 -0.09 0.00 0.00 0.00 0.00 43.02 40.67 1s5l s PHE 341 CO -0.06 -0.87 1.76 -1.25 -0.00 0.00 0.00 175.22 174.80 1s5l s PRO 342 N 1.17 4.17 0.01 0.24 0.04 -1.26 -4.89 135.00 134.47 1s5l s PRO 342 Ca -0.02 2.46 -0.02 0.00 0.04 0.00 0.00 61.00 63.46 1s5l s PRO 342 Cb -0.19 -3.71 0.00 0.00 0.04 0.00 0.00 34.50 30.64 1s5l s PRO 342 CO -0.07 -0.81 0.12 0.39 0.04 0.00 0.00 177.00 176.67 1s5l n GLU 343 N 6.03 -0.03 0.01 4.56 1.02 -1.26 0.42 120.64 131.39 1s5l n GLU 343 Ca 0.17 0.12 -0.13 0.00 -0.02 0.00 0.00 57.16 57.30 1s5l n GLU 343 Cb 0.40 -0.18 -0.07 0.00 -0.02 0.00 0.00 31.44 31.57 1s5l n GLU 343 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 1s5l h GLU 344 N 0.00 -0.51 -1.00 3.49 4.11 -2.02 -2.91 114.58 115.74 1s5l h GLU 344 Ca 0.02 0.04 0.35 0.00 0.07 0.00 0.00 59.36 59.83 1s5l h GLU 344 Cb 0.04 0.12 -0.18 0.00 0.50 0.00 0.00 28.75 29.22 1s5l h GLU 344 CO -0.08 -0.34 0.28 0.28 0.07 0.00 0.00 179.01 179.22 1s5l h VAL 345 N -0.53 0.01 -2.62 -1.06 2.07 -0.40 -3.43 116.25 110.29 1s5l h VAL 345 Ca 0.06 -0.00 -0.58 0.00 0.82 0.00 0.00 66.70 66.99 1s5l h VAL 345 Cb 0.65 0.00 0.08 0.00 -1.52 0.00 0.00 31.29 30.50 1s5l h VAL 345 CO -0.39 0.00 0.62 0.18 0.02 0.00 0.00 177.57 178.01 1s5l n LEU 346 N -5.37 3.07 -4.73 2.57 4.77 -1.10 -4.93 117.00 111.27 1s5l n LEU 346 Ca 0.31 1.14 -0.36 0.00 -0.03 0.00 0.00 56.01 57.07 1s5l n LEU 346 Cb 1.02 -1.42 0.07 0.00 -2.33 0.00 0.00 43.42 40.76 1s5l n LEU 346 CO -0.03 -0.49 0.86 -2.84 -1.33 0.00 0.00 177.39 173.56 1s5l s PRO 347 N -0.30 2.43 -0.30 3.23 0.02 -1.26 -5.00 135.00 133.82 1s5l s PRO 347 Ca 0.69 1.92 -0.16 0.00 0.02 0.00 0.00 61.00 63.48 1s5l s PRO 347 Cb -0.66 -1.85 0.17 0.00 0.02 0.00 0.00 34.50 32.18 1s5l s PRO 347 CO 0.49 -1.66 1.04 0.50 -0.33 0.00 0.00 177.00 177.04 1s5l s ARG 348 N -3.57 0.25 0.61 5.54 3.52 -1.26 -5.01 118.95 119.02 1s5l s ARG 348 Ca 0.79 0.61 -0.17 0.00 -0.13 0.00 0.00 55.73 56.82 1s5l s ARG 348 Cb -0.34 0.33 -0.03 0.00 -1.56 0.00 0.00 34.95 33.36 1s5l s ARG 348 CO 0.41 -0.08 1.13 0.20 -0.81 0.00 0.00 175.30 176.15 1s5l s GLY 349 N 2.24 2.43 0.26 8.12 0.00 -1.26 -4.93 107.32 114.18 1s5l s GLY 349 Ca -0.03 0.73 -0.30 0.00 0.00 0.00 0.00 44.72 45.12 1s5l s GLY 349 CO -0.17 1.10 1.32 -2.01 0.00 0.00 0.00 173.10 173.34 1s5l n ASN 350 N -1.86 2.49 0.00 1.64 4.05 -1.26 -2.83 115.26 117.49 1s5l n ASN 350 Ca 0.11 1.16 0.00 0.00 0.45 0.00 0.00 54.58 56.30 1s5l n ASN 350 Cb 0.51 -1.41 0.00 0.00 1.23 0.00 0.00 39.78 40.11 1s5l n ASN 350 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1s5l n ALA 351 N 1.36 0.00 -0.52 5.20 0.00 -1.26 -5.36 120.51 119.93 1s5l n ALA 351 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1s5l n ALA 351 Cb 0.32 -0.32 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1s5l n ALA 351 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78