#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i5y s VAL 2 N 0.00 3.57 -0.07 6.31 1.01 -1.26 -4.44 120.40 125.53 2i5y s VAL 2 Ca 0.00 1.21 -0.08 0.00 0.00 0.00 0.00 61.98 63.10 2i5y s VAL 2 Cb 0.00 -3.77 0.02 0.00 0.00 0.00 0.00 36.38 32.63 2i5y s VAL 2 CO 0.00 0.14 0.22 -1.10 0.00 0.00 0.00 175.10 174.36 2i5y s GLN 3 N 0.51 0.33 -0.10 2.72 -0.21 -0.84 -5.02 119.66 117.05 2i5y s GLN 3 Ca 0.58 0.19 0.02 0.00 0.02 0.00 0.00 55.36 56.18 2i5y s GLN 3 Cb -0.33 0.15 -0.01 0.00 1.00 0.00 0.00 33.01 33.82 2i5y s GLN 3 CO 0.33 -0.05 -0.18 -0.51 -2.12 0.00 0.00 175.29 172.76 2i5y s LEU 4 N -0.17 2.45 -0.17 2.90 1.43 -1.26 -2.12 118.68 121.73 2i5y s LEU 4 Ca -0.03 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.67 2i5y s LEU 4 Cb -0.03 -1.51 0.04 0.00 0.03 0.00 0.00 46.19 44.72 2i5y s LEU 4 CO 0.01 0.20 -0.09 -0.69 0.23 0.00 0.00 176.35 176.01 2i5y s VAL 5 N 0.14 1.39 0.55 -1.59 1.01 -0.06 -4.23 120.40 117.61 2i5y s VAL 5 Ca -0.09 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.08 2i5y s VAL 5 Cb -0.16 -1.48 0.01 0.00 0.00 0.00 0.00 36.38 34.75 2i5y s VAL 5 CO 0.06 0.20 0.83 -1.61 0.00 0.00 0.00 175.10 174.58 2i5y s GLU 6 N 1.52 2.95 0.60 2.72 2.02 -1.26 -1.44 118.70 125.81 2i5y s GLU 6 Ca 0.01 -0.17 -0.12 0.00 0.02 0.00 0.00 54.97 54.71 2i5y s GLU 6 Cb -0.15 -2.36 -0.04 0.00 0.10 0.00 0.00 34.13 31.68 2i5y s GLU 6 CO -0.08 -0.58 1.02 -1.54 0.02 0.00 0.00 175.26 174.10 2i5y s SER 7 N -4.28 6.24 1.16 -0.19 1.04 -1.03 -4.97 113.70 111.66 2i5y s SER 7 Ca 0.52 1.47 -0.17 0.00 0.48 0.00 0.00 55.95 58.26 2i5y s SER 7 Cb -0.10 -2.48 0.19 0.00 0.10 0.00 0.00 66.02 63.73 2i5y s SER 7 CO 0.43 -0.86 0.39 0.61 0.98 0.00 0.00 173.24 174.79 2i5y n GLY 8 N -2.42 -2.42 3.59 7.32 0.00 -1.26 -4.66 105.19 105.33 2i5y n GLY 8 Ca 0.06 -0.97 -0.33 0.00 0.00 0.00 0.00 46.02 44.78 2i5y n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i5y n ALA 9 N -4.72 -0.99 -3.09 4.61 0.00 -1.26 -4.71 120.51 110.35 2i5y n ALA 9 Ca 0.01 -0.43 -0.13 0.00 0.00 0.00 0.00 53.44 52.90 2i5y n ALA 9 Cb 0.59 -2.08 -0.12 0.00 0.00 0.00 0.00 19.45 17.84 2i5y n ALA 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2i5y s GLU 10 N -3.92 0.24 -0.21 0.00 0.41 -0.19 -4.97 118.70 110.07 2i5y s GLU 10 Ca 0.67 0.28 0.01 0.00 -0.41 0.00 0.00 54.97 55.52 2i5y s GLU 10 Cb -0.27 0.12 0.05 0.00 -1.78 0.00 0.00 34.13 32.24 2i5y s GLU 10 CO 0.57 -0.03 -0.09 0.08 -0.49 0.00 0.00 175.26 175.30 2i5y s VAL 11 N 0.10 1.64 0.27 2.63 1.01 -1.26 -0.04 120.40 124.74 2i5y s VAL 11 Ca -0.00 -1.08 0.11 0.00 0.00 0.00 0.00 61.98 61.01 2i5y s VAL 11 Cb -0.01 -1.75 -0.05 0.00 0.00 0.00 0.00 36.38 34.56 2i5y s VAL 11 CO 0.00 0.11 -0.14 -0.54 0.00 0.00 0.00 175.10 174.53 2i5y s LYS 12 N 1.38 1.88 0.36 2.72 -0.14 0.11 -4.97 119.74 121.08 2i5y s LYS 12 Ca -0.03 -1.64 -0.07 0.00 -1.36 0.00 0.00 55.97 52.87 2i5y s LYS 12 Cb -0.17 -1.90 -0.06 0.00 -1.68 0.00 0.00 37.83 34.02 2i5y s LYS 12 CO -0.08 0.34 0.68 0.15 -0.76 0.00 0.00 175.35 175.69 2i5y s LYS 13 N -3.53 3.69 0.38 1.68 -0.14 -1.25 -1.06 119.74 119.50 2i5y s LYS 13 Ca 0.30 0.23 -0.27 0.00 -1.36 0.00 0.00 55.97 54.87 2i5y s LYS 13 Cb -0.06 -2.50 -0.11 0.00 -1.68 0.00 0.00 37.83 33.48 2i5y s LYS 13 CO 0.16 0.05 1.34 -2.30 -0.76 0.00 0.00 175.35 173.85 2i5y n PRO 14 N -1.26 2.22 0.00 -1.68 -0.02 -1.25 -2.15 135.00 130.85 2i5y n PRO 14 Ca 0.00 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 2i5y n PRO 14 Cb 0.54 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 2i5y n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2i5y n GLY 15 N 0.69 3.08 3.58 -1.23 0.00 0.25 -4.91 105.19 106.66 2i5y n GLY 15 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 2i5y n GLY 15 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2i5y n SER 16 N 0.00 -1.46 -4.56 1.61 3.41 -0.91 -3.75 113.62 107.96 2i5y n SER 16 Ca 0.00 -1.26 -0.26 0.00 -0.26 0.00 0.00 58.87 57.09 2i5y n SER 16 Cb 0.00 -1.00 -0.11 0.00 -0.26 0.00 0.00 64.21 62.84 2i5y n SER 16 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2i5y s SER 17 N -4.84 3.65 -0.01 4.04 0.15 -1.26 -0.76 113.70 114.66 2i5y s SER 17 Ca 0.72 -1.27 -0.19 0.00 0.70 0.00 0.00 55.95 55.90 2i5y s SER 17 Cb -0.05 -0.34 0.04 0.00 -1.71 0.00 0.00 66.02 63.95 2i5y s SER 17 CO 0.54 -0.33 0.42 0.54 1.20 0.00 0.00 173.24 175.61 2i5y s VAL 18 N -2.71 0.04 -0.07 4.45 0.11 -0.70 -5.01 120.40 116.51 2i5y s VAL 18 Ca 0.33 -0.37 -0.01 0.00 -2.93 0.00 0.00 61.98 59.01 2i5y s VAL 18 Cb 0.06 -0.79 0.03 0.00 -1.53 0.00 0.00 36.38 34.15 2i5y s VAL 18 CO 0.17 -0.20 -0.01 -0.75 -3.33 0.00 0.00 175.10 170.98 2i5y s LYS 19 N -1.60 0.67 -0.14 1.54 2.20 -1.26 -1.56 119.74 119.59 2i5y s LYS 19 Ca -0.11 0.07 -0.06 0.00 -0.36 0.00 0.00 55.97 55.51 2i5y s LYS 19 Cb -0.03 -0.98 -0.04 0.00 -1.51 0.00 0.00 37.83 35.27 2i5y s LYS 19 CO 0.04 -0.28 0.08 0.08 -0.36 0.00 0.00 175.35 174.91 2i5y s VAL 20 N 1.86 4.97 0.26 4.02 1.01 -0.49 -4.93 120.40 127.10 2i5y s VAL 20 Ca 0.03 0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.10 2i5y s VAL 20 Cb -0.12 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 2i5y s VAL 20 CO -0.05 0.55 0.23 -0.94 0.00 0.00 0.00 175.10 174.88 2i5y s SER 21 N -0.40 5.56 -0.27 3.32 1.04 -1.26 -1.21 113.70 120.47 2i5y s SER 21 Ca 0.10 -0.26 -0.00 0.00 0.48 0.00 0.00 55.95 56.27 2i5y s SER 21 Cb -0.12 -1.38 0.15 0.00 0.10 0.00 0.00 66.02 64.78 2i5y s SER 21 CO 0.02 -0.09 0.41 0.00 0.98 0.00 0.00 173.24 174.56 2i5y s LYS 23 N 2.58 4.50 -0.17 0.00 2.47 -0.52 -0.90 119.74 127.70 2i5y s LYS 23 Ca 0.12 1.10 0.01 0.00 -1.56 0.00 0.00 55.97 55.63 2i5y s LYS 23 Cb -0.14 -3.40 0.02 0.00 -1.46 0.00 0.00 37.83 32.86 2i5y s LYS 23 CO -0.23 0.17 -0.17 0.00 0.16 0.00 0.00 175.35 175.28 2i5y s ALA 24 N 0.33 2.12 0.13 3.13 0.00 -0.71 -0.88 121.76 125.89 2i5y s ALA 24 Ca 0.41 -1.11 0.05 0.00 0.00 0.00 0.00 51.96 51.31 2i5y s ALA 24 Cb -0.20 -1.15 -0.04 0.00 0.00 0.00 0.00 23.12 21.73 2i5y s ALA 24 CO 0.23 -0.42 -0.11 -1.54 0.00 0.00 0.00 175.76 173.92 2i5y s SER 25 N 1.37 1.78 0.00 0.00 1.04 -0.90 -4.80 113.70 112.20 2i5y s SER 25 Ca 0.04 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.55 2i5y s SER 25 Cb -0.13 -0.02 0.00 0.00 0.10 0.00 0.00 66.02 65.96 2i5y s SER 25 CO -0.12 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.45 2i5y n GLY 26 N 0.13 1.38 3.73 7.32 0.00 -1.26 -1.98 105.19 114.50 2i5y n GLY 26 Ca -0.13 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.85 2i5y n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2i5y s ASP 27 N -1.97 -0.21 -0.16 1.61 -1.08 -1.26 -4.59 116.67 109.00 2i5y s ASP 27 Ca 0.00 -0.37 -0.30 0.00 -0.52 0.00 0.00 52.55 51.36 2i5y s ASP 27 Cb 0.00 0.50 -0.07 0.00 -1.46 0.00 0.00 42.92 41.89 2i5y s ASP 27 CO 0.00 -0.91 2.13 0.41 0.52 0.00 0.00 175.17 177.32 2i5y n THR 28 N -0.44 0.45 0.09 1.71 -1.04 -1.26 -4.88 114.28 108.91 2i5y n THR 28 Ca -0.06 -0.33 -0.13 0.00 -2.04 0.00 0.00 64.05 61.48 2i5y n THR 28 Cb 0.61 -2.34 -0.06 0.00 -1.82 0.00 0.00 70.33 66.71 2i5y n THR 28 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 2i5y h PHE 29 N 13.20 -1.01 0.00 -1.42 3.57 -1.96 -2.07 116.94 127.26 2i5y h PHE 29 Ca -0.42 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.11 2i5y h PHE 29 Cb 1.25 0.43 0.00 0.00 2.79 0.00 0.00 35.95 40.43 2i5y h PHE 29 CO 0.94 -0.46 0.12 0.44 -2.23 0.00 0.00 178.31 177.12 2i5y n ILE 30 N -5.44 1.43 0.99 1.41 -5.35 -1.26 -0.80 119.36 110.34 2i5y n ILE 30 Ca -0.06 0.48 0.12 0.00 -0.27 0.00 0.00 62.75 63.02 2i5y n ILE 30 Cb 0.35 -1.48 0.31 0.00 -1.74 0.00 0.00 39.64 37.08 2i5y n ILE 30 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2i5y n ARG 31 N -1.35 2.04 -4.39 6.28 1.74 -0.78 -3.97 116.66 116.23 2i5y n ARG 31 Ca 0.00 -1.54 -0.25 0.00 -0.77 0.00 0.00 57.85 55.29 2i5y n ARG 31 Cb 0.12 -1.45 -0.11 0.00 -1.02 0.00 0.00 32.46 29.99 2i5y n ARG 31 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2i5y s TYR 32 N -1.79 2.12 0.05 -1.55 1.51 0.02 0.17 117.35 117.88 2i5y s TYR 32 Ca 0.34 -0.40 0.06 0.00 -1.01 0.00 0.00 57.07 56.07 2i5y s TYR 32 Cb 0.20 -1.04 -0.03 0.00 -0.11 0.00 0.00 41.96 40.97 2i5y s TYR 32 CO 0.30 0.45 -0.13 -1.54 -1.11 0.00 0.00 175.55 173.51 2i5y s SER 33 N -2.72 4.14 -0.04 2.29 1.04 -0.91 -4.11 113.70 113.39 2i5y s SER 33 Ca 0.19 -0.36 0.06 0.00 0.48 0.00 0.00 55.95 56.33 2i5y s SER 33 Cb -0.07 -0.77 -0.01 0.00 0.10 0.00 0.00 66.02 65.27 2i5y s SER 33 CO 0.09 0.24 -0.21 -0.36 0.98 0.00 0.00 173.24 173.98 2i5y s PHE 34 N -1.02 2.04 0.25 5.02 0.40 -0.99 -2.09 117.98 121.59 2i5y s PHE 34 Ca 0.17 -0.54 0.11 0.00 -0.60 0.00 0.00 56.93 56.06 2i5y s PHE 34 Cb -0.11 -1.34 -0.05 0.00 0.51 0.00 0.00 43.02 42.03 2i5y s PHE 34 CO 0.08 -0.15 -0.14 0.99 0.70 0.00 0.00 175.22 176.70 2i5y s THR 35 N -0.18 2.83 -0.05 0.64 2.01 0.24 -1.19 115.64 119.94 2i5y s THR 35 Ca -0.01 -2.12 0.05 0.00 0.31 0.00 0.00 61.69 59.92 2i5y s THR 35 Cb -0.11 -2.47 -0.00 0.00 0.01 0.00 0.00 72.50 69.92 2i5y s THR 35 CO 0.02 -0.32 -0.18 0.26 -0.69 0.00 0.00 174.62 173.71 2i5y s TRP 36 N -2.24 1.84 -0.02 4.92 0.52 -0.63 -0.72 118.94 122.61 2i5y s TRP 36 Ca 0.28 -0.54 0.02 0.00 0.02 0.00 0.00 56.10 55.89 2i5y s TRP 36 Cb -0.06 -1.23 0.00 0.00 -1.15 0.00 0.00 33.47 31.03 2i5y s TRP 36 CO 0.16 -0.18 -0.08 0.08 0.02 0.00 0.00 176.95 176.95 2i5y s VAL 37 N 0.02 0.66 0.30 4.03 1.01 -0.55 -0.88 120.40 125.00 2i5y s VAL 37 Ca -0.04 -0.32 0.09 0.00 0.00 0.00 0.00 61.98 61.71 2i5y s VAL 37 Cb -0.12 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.63 2i5y s VAL 37 CO 0.03 0.20 0.05 0.00 0.00 0.00 0.00 175.10 175.38 2i5y s ARG 38 N 0.08 2.31 -0.27 2.72 1.70 -0.60 0.88 118.95 125.77 2i5y s ARG 38 Ca -0.01 -1.49 -0.00 0.00 -0.47 0.00 0.00 55.73 53.76 2i5y s ARG 38 Cb -0.06 -2.15 0.15 0.00 -0.57 0.00 0.00 34.95 32.32 2i5y s ARG 38 CO 0.00 0.25 0.43 -1.14 -1.08 0.00 0.00 175.30 173.77 2i5y s GLN 39 N -3.74 0.42 0.68 3.89 0.74 -0.32 -1.58 119.66 119.75 2i5y s GLN 39 Ca 0.34 0.48 -0.15 0.00 0.05 0.00 0.00 55.36 56.08 2i5y s GLN 39 Cb -0.04 -0.22 0.01 0.00 1.10 0.00 0.00 33.01 33.86 2i5y s GLN 39 CO 0.21 -0.79 1.13 0.00 -0.55 0.00 0.00 175.29 175.29 2i5y s ALA 40 N 2.61 2.36 0.09 1.58 0.00 -1.26 -1.48 121.76 125.67 2i5y s ALA 40 Ca 0.13 0.62 -0.34 0.00 0.00 0.00 0.00 51.96 52.37 2i5y s ALA 40 Cb -0.14 -3.36 -0.13 0.00 0.00 0.00 0.00 23.12 19.49 2i5y s ALA 40 CO -0.22 -1.46 1.66 -0.35 0.00 0.00 0.00 175.76 175.39 2i5y n PRO 41 N -2.54 2.16 -1.11 0.00 -0.04 -1.26 -1.27 135.00 130.94 2i5y n PRO 41 Ca 0.11 0.78 -0.04 0.00 -0.04 0.00 0.00 63.50 64.32 2i5y n PRO 41 Cb 0.52 -2.57 -0.02 0.00 -0.04 0.00 0.00 33.50 31.39 2i5y n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2i5y n GLY 42 N 3.68 0.64 3.21 0.55 0.00 -1.26 -5.02 105.19 106.99 2i5y n GLY 42 Ca 0.18 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 2i5y n GLY 42 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2i5y n GLN 43 N -2.22 0.87 -2.46 1.61 3.00 -0.39 -5.15 117.38 112.63 2i5y n GLN 43 Ca -0.04 -3.11 -0.22 0.00 -0.01 0.00 0.00 57.00 53.63 2i5y n GLN 43 Cb 0.20 0.63 0.11 0.00 0.00 0.00 0.00 30.24 31.19 2i5y n GLN 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2i5y n GLY 44 N -0.46 0.63 3.78 1.08 0.00 -1.26 -4.76 105.19 104.21 2i5y n GLY 44 Ca -0.11 -2.02 -0.35 0.00 0.00 0.00 0.00 46.02 43.53 2i5y n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i5y s LEU 45 N 0.00 3.96 -0.12 0.99 1.43 -1.26 -4.46 118.68 119.22 2i5y s LEU 45 Ca 0.63 2.06 -0.04 0.00 -1.03 0.00 0.00 54.13 55.75 2i5y s LEU 45 Cb -0.04 -4.39 0.05 0.00 0.03 0.00 0.00 46.19 41.84 2i5y s LEU 45 CO 0.42 -0.77 0.08 -0.70 0.23 0.00 0.00 176.35 175.61 2i5y s GLU 46 N -2.91 0.01 0.04 1.70 2.12 -0.62 -4.98 118.70 114.06 2i5y s GLU 46 Ca 0.64 0.11 -0.30 0.00 0.36 0.00 0.00 54.97 55.77 2i5y s GLU 46 Cb -0.21 -1.29 -0.07 0.00 0.26 0.00 0.00 34.13 32.82 2i5y s GLU 46 CO 0.26 -0.53 1.53 -0.46 -0.54 0.00 0.00 175.26 175.52 2i5y s TRP 47 N 2.15 2.65 -0.21 5.30 -0.00 -1.26 -1.55 118.94 126.02 2i5y s TRP 47 Ca 0.03 0.57 0.07 0.00 -0.00 0.00 0.00 56.10 56.78 2i5y s TRP 47 Cb -0.14 -3.82 -0.18 0.00 -0.00 0.00 0.00 33.47 29.33 2i5y s TRP 47 CO -0.07 -3.16 -0.10 -1.33 -0.00 0.00 0.00 176.95 172.29 2i5y n MET 48 N 5.43 0.77 0.00 5.86 2.81 -0.06 -4.67 117.12 127.26 2i5y n MET 48 Ca 0.14 0.08 0.00 0.00 -1.81 0.00 0.00 57.70 56.11 2i5y n MET 48 Cb 0.42 -1.46 0.00 0.00 -0.71 0.00 0.00 33.22 31.47 2i5y n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2i5y n GLY 49 N 2.21 -0.14 3.32 3.03 0.00 -1.19 -1.22 105.19 111.20 2i5y n GLY 49 Ca -0.36 -1.10 -0.13 0.00 0.00 0.00 0.00 46.02 44.43 2i5y n GLY 49 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2i5y s ARG 50 N -2.00 0.49 -0.07 1.61 3.52 -0.80 -1.61 118.95 120.08 2i5y s ARG 50 Ca 0.00 0.62 0.04 0.00 -0.13 0.00 0.00 55.73 56.25 2i5y s ARG 50 Cb 0.00 0.21 -0.02 0.00 -1.56 0.00 0.00 34.95 33.59 2i5y s ARG 50 CO 0.00 -0.07 -0.18 -1.50 -0.81 0.00 0.00 175.30 172.74 2i5y s ILE 51 N 0.35 2.66 -1.08 4.11 2.07 -0.33 -0.59 121.20 128.39 2i5y s ILE 51 Ca -0.01 -0.85 -0.13 0.00 -1.41 0.00 0.00 60.65 58.26 2i5y s ILE 51 Cb -0.04 -2.03 0.21 0.00 0.13 0.00 0.00 42.46 40.74 2i5y s ILE 51 CO -0.01 0.57 1.17 -0.63 -1.91 0.00 0.00 174.94 174.13 2i5y s ILE 52 N -0.28 5.46 0.03 2.00 1.01 0.32 -2.35 121.20 127.38 2i5y s ILE 52 Ca 0.01 -2.78 -0.06 0.00 0.00 0.00 0.00 60.65 57.82 2i5y s ILE 52 Cb -0.13 -4.71 -0.01 0.00 0.01 0.00 0.00 42.46 37.62 2i5y s ILE 52 CO 0.03 -1.35 0.64 0.41 0.00 0.00 0.00 174.94 174.66 2i5y n THR 52 N 3.90 -0.13 -0.32 2.92 -1.04 -1.26 0.22 114.28 118.57 2i5y n THR 52 Ca 0.27 0.97 0.17 0.00 -2.04 0.00 0.00 64.05 63.42 2i5y n THR 52 Cb 0.43 -1.26 0.36 0.00 -1.82 0.00 0.00 70.33 68.04 2i5y n THR 52 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 2i5y h ILE 53 N 0.00 0.42 0.00 12.58 6.09 -1.81 0.23 117.51 135.02 2i5y h ILE 53 Ca 0.03 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 63.39 2i5y h ILE 53 Cb 0.08 -0.00 0.00 0.00 0.47 0.00 0.00 36.82 37.36 2i5y h ILE 53 CO -0.17 0.07 -0.57 0.18 -3.07 0.00 0.00 178.15 174.58 2i5y n LEU 54 N -5.04 0.55 -3.67 2.19 4.32 0.63 -4.96 117.00 111.02 2i5y n LEU 54 Ca 0.25 0.01 -0.22 0.00 -0.02 0.00 0.00 56.01 56.03 2i5y n LEU 54 Cb 0.76 -0.22 0.05 0.00 -1.62 0.00 0.00 43.42 42.38 2i5y n LEU 54 CO 0.12 0.10 0.02 -0.67 -1.22 0.00 0.00 177.39 175.74 2i5y n ASP 55 N -1.61 -2.34 -3.93 -1.43 4.64 0.13 -4.98 116.55 107.03 2i5y n ASP 55 Ca 0.05 -0.75 -0.22 0.00 -1.38 0.00 0.00 54.79 52.49 2i5y n ASP 55 Cb 0.36 -4.33 -0.16 0.00 -1.04 0.00 0.00 41.12 35.94 2i5y n ASP 55 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 2i5y s VAL 56 N -3.52 0.77 -0.01 5.18 1.01 -1.17 -4.96 120.40 117.70 2i5y s VAL 56 Ca 0.15 -0.25 0.07 0.00 0.00 0.00 0.00 61.98 61.96 2i5y s VAL 56 Cb -0.07 -0.76 -0.02 0.00 0.00 0.00 0.00 36.38 35.53 2i5y s VAL 56 CO 0.79 0.28 -0.23 0.00 0.00 0.00 0.00 175.10 175.94 2i5y s ALA 57 N 0.91 2.32 0.24 5.51 0.00 -1.26 0.12 121.76 129.59 2i5y s ALA 57 Ca -0.11 -1.12 0.10 0.00 0.00 0.00 0.00 51.96 50.83 2i5y s ALA 57 Cb -0.15 -0.64 -0.04 0.00 0.00 0.00 0.00 23.12 22.29 2i5y s ALA 57 CO 0.01 0.54 -0.09 -1.01 0.00 0.00 0.00 175.76 175.21 2i5y s HIS 58 N -0.69 2.57 0.23 0.00 3.76 0.24 -4.97 115.29 116.43 2i5y s HIS 58 Ca 0.11 -0.25 0.02 0.00 -0.15 0.00 0.00 55.06 54.79 2i5y s HIS 58 Cb -0.10 -1.18 -0.05 0.00 1.11 0.00 0.00 32.58 32.36 2i5y s HIS 58 CO 0.00 0.60 0.05 0.71 -0.85 0.00 0.00 174.74 175.25 2i5y s TYR 59 N -2.11 1.45 0.71 1.40 1.51 -1.26 -1.91 117.35 117.13 2i5y s TYR 59 Ca 0.28 -1.08 -0.13 0.00 -1.01 0.00 0.00 57.07 55.13 2i5y s TYR 59 Cb -0.07 -0.84 0.03 0.00 -0.11 0.00 0.00 41.96 40.96 2i5y s TYR 59 CO 0.17 -0.24 1.10 0.00 -1.11 0.00 0.00 175.55 175.47 2i5y s ALA 60 N -3.66 2.35 0.29 3.71 0.00 -0.36 -4.92 121.76 119.18 2i5y s ALA 60 Ca 0.32 0.43 0.05 0.00 0.00 0.00 0.00 51.96 52.75 2i5y s ALA 60 Cb 0.07 -3.30 0.71 0.00 0.00 0.00 0.00 23.12 20.60 2i5y s ALA 60 CO 0.10 -1.53 1.75 -1.35 0.00 0.00 0.00 175.76 174.73 2i5y h PRO 61 N -0.52 0.62 -2.21 0.00 0.11 -1.92 -3.35 132.00 124.74 2i5y h PRO 61 Ca -0.45 -0.04 -0.58 0.00 0.11 0.00 0.00 66.00 65.04 2i5y h PRO 61 Cb 1.24 -0.14 -0.42 0.00 0.11 0.00 0.00 31.00 31.79 2i5y h PRO 61 CO 0.53 0.41 -0.71 0.72 -0.21 0.00 0.00 178.00 178.74 2i5y n HIS 62 N -4.86 3.29 0.79 0.65 8.25 -1.26 -4.74 115.22 117.34 2i5y n HIS 62 Ca 0.22 -4.01 0.09 0.00 -0.26 0.00 0.00 57.72 53.76 2i5y n HIS 62 Cb 0.58 -0.50 0.00 0.00 1.12 0.00 0.00 29.99 31.20 2i5y n HIS 62 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2i5y n LEU 63 N 0.26 1.76 -2.14 2.41 4.77 -1.26 -4.96 117.00 117.85 2i5y n LEU 63 Ca 0.29 -0.77 -0.12 0.00 -0.03 0.00 0.00 56.01 55.38 2i5y n LEU 63 Cb 0.43 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.50 2i5y n LEU 63 CO 0.34 0.33 -0.14 0.00 -1.33 0.00 0.00 177.39 176.59 2i5y n GLN 64 N -0.05 -1.97 -1.22 3.23 1.13 -1.26 -0.15 117.38 117.09 2i5y n GLN 64 Ca 0.07 0.62 -0.08 0.00 -1.94 0.00 0.00 57.00 55.68 2i5y n GLN 64 Cb 0.38 -5.11 -0.03 0.00 0.11 0.00 0.00 30.24 25.58 2i5y n GLN 64 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2i5y n GLY 65 N -0.64 0.89 0.16 1.08 0.00 -1.26 -4.85 105.19 100.56 2i5y n GLY 65 Ca -0.14 -0.24 0.15 0.00 0.00 0.00 0.00 46.02 45.79 2i5y n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i5y n ARG 66 N -1.74 0.95 -4.80 1.61 1.74 0.79 -4.81 116.66 110.41 2i5y n ARG 66 Ca -0.08 -0.31 -0.32 0.00 -0.77 0.00 0.00 57.85 56.37 2i5y n ARG 66 Cb 0.38 -1.49 -0.13 0.00 -1.02 0.00 0.00 32.46 30.20 2i5y n ARG 66 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2i5y s VAL 67 N -2.26 2.99 -0.07 1.55 1.01 -1.26 -0.35 120.40 122.00 2i5y s VAL 67 Ca 0.35 -0.89 -0.03 0.00 0.00 0.00 0.00 61.98 61.42 2i5y s VAL 67 Cb 0.21 -2.20 0.04 0.00 0.00 0.00 0.00 36.38 34.42 2i5y s VAL 67 CO 0.42 0.50 0.10 -0.89 0.00 0.00 0.00 175.10 175.23 2i5y s THR 68 N -0.81 -0.16 -0.18 3.92 2.01 -0.53 -4.99 115.64 114.89 2i5y s THR 68 Ca 0.13 0.32 -0.08 0.00 0.31 0.00 0.00 61.69 62.36 2i5y s THR 68 Cb -0.11 -0.26 -0.04 0.00 0.01 0.00 0.00 72.50 72.10 2i5y s THR 68 CO 0.03 0.10 0.10 -0.63 -0.69 0.00 0.00 174.62 173.53 2i5y s ILE 69 N 2.21 5.12 0.18 1.82 1.01 -1.26 -0.65 121.20 129.63 2i5y s ILE 69 Ca 0.04 0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.79 2i5y s ILE 69 Cb -0.13 -3.31 -0.05 0.00 0.01 0.00 0.00 42.46 38.99 2i5y s ILE 69 CO -0.05 0.47 0.01 0.42 0.00 0.00 0.00 174.94 175.79 2i5y s THR 70 N 0.20 0.68 -0.06 2.92 -4.23 -0.89 -4.85 115.64 109.40 2i5y s THR 70 Ca 0.07 -1.98 -0.03 0.00 -1.18 0.00 0.00 61.69 58.56 2i5y s THR 70 Cb -0.12 -2.17 0.04 0.00 1.34 0.00 0.00 72.50 71.59 2i5y s THR 70 CO -0.00 -0.43 0.14 0.00 -0.54 0.00 0.00 174.62 173.79 2i5y s ALA 71 N -3.66 -0.22 -0.52 3.99 0.00 -1.26 -0.89 121.76 119.20 2i5y s ALA 71 Ca 0.25 0.63 -0.08 0.00 0.00 0.00 0.00 51.96 52.76 2i5y s ALA 71 Cb 0.06 -0.48 0.13 0.00 0.00 0.00 0.00 23.12 22.83 2i5y s ALA 71 CO 0.05 -0.20 0.38 0.34 0.00 0.00 0.00 175.76 176.33 2i5y s ASP 72 N 1.31 5.70 0.00 0.00 3.68 -0.40 -4.94 116.67 122.02 2i5y s ASP 72 Ca -0.08 -2.12 0.00 0.00 2.13 0.00 0.00 52.55 52.49 2i5y s ASP 72 Cb -0.12 -1.99 0.00 0.00 -1.45 0.00 0.00 42.92 39.36 2i5y s ASP 72 CO -0.06 -0.63 0.36 0.29 0.13 0.00 0.00 175.17 175.27 2i5y n LYS 73 N 4.62 0.45 -0.08 4.34 5.02 -1.26 -1.67 118.16 129.58 2i5y n LYS 73 Ca -0.04 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.15 2i5y n LYS 73 Cb 0.41 -1.09 -0.09 0.00 -0.02 0.00 0.00 35.03 34.24 2i5y n LYS 73 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2i5y n SER 74 N -0.20 2.31 -0.86 4.39 3.41 -1.26 -4.51 113.62 116.91 2i5y n SER 74 Ca 0.00 -0.06 0.09 0.00 -0.26 0.00 0.00 58.87 58.63 2i5y n SER 74 Cb 0.04 0.09 0.17 0.00 -0.26 0.00 0.00 64.21 64.25 2i5y n SER 74 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2i5y n THR 75 N -2.85 0.58 -3.88 6.66 -2.24 -1.01 -4.97 114.28 106.57 2i5y n THR 75 Ca -0.28 -0.79 -0.25 0.00 -2.27 0.00 0.00 64.05 60.46 2i5y n THR 75 Cb 0.87 0.86 -0.00 0.00 -2.10 0.00 0.00 70.33 69.96 2i5y n THR 75 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2i5y n SER 76 N 1.02 -1.13 -4.30 3.42 2.88 -0.67 -4.80 113.62 110.04 2i5y n SER 76 Ca 0.14 -0.93 -0.24 0.00 -1.33 0.00 0.00 58.87 56.52 2i5y n SER 76 Cb 0.48 -3.43 -0.12 0.00 -0.75 0.00 0.00 64.21 60.38 2i5y n SER 76 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2i5y s THR 77 N -3.77 1.74 0.02 2.46 2.01 -1.10 -1.73 115.64 115.27 2i5y s THR 77 Ca 0.10 -1.60 0.09 0.00 0.31 0.00 0.00 61.69 60.59 2i5y s THR 77 Cb -0.05 -1.61 -0.03 0.00 0.01 0.00 0.00 72.50 70.82 2i5y s THR 77 CO 0.86 -0.09 -0.26 -0.69 -0.69 0.00 0.00 174.62 173.75 2i5y s VAL 78 N -1.29 2.13 0.20 3.82 1.01 -0.07 -1.28 120.40 124.91 2i5y s VAL 78 Ca 0.08 -1.26 0.07 0.00 0.00 0.00 0.00 61.98 60.88 2i5y s VAL 78 Cb -0.09 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.45 2i5y s VAL 78 CO 0.05 0.46 -0.14 -0.31 0.00 0.00 0.00 175.10 175.15 2i5y s TYR 79 N -0.72 1.67 -0.21 5.22 2.02 -0.07 -0.32 117.35 124.92 2i5y s TYR 79 Ca 0.11 -0.59 -0.04 0.00 -0.37 0.00 0.00 57.07 56.19 2i5y s TYR 79 Cb -0.10 -0.78 0.09 0.00 -0.40 0.00 0.00 41.96 40.77 2i5y s TYR 79 CO 0.01 0.33 0.17 -1.17 -1.57 0.00 0.00 175.55 173.32 2i5y s LEU 80 N -3.26 0.13 -0.08 -1.29 1.98 -0.35 -2.10 118.68 113.70 2i5y s LEU 80 Ca 0.21 -0.57 -0.04 0.00 -2.89 0.00 0.00 54.13 50.84 2i5y s LEU 80 Cb -0.01 0.07 -0.04 0.00 0.66 0.00 0.00 46.19 46.88 2i5y s LEU 80 CO 0.06 -0.36 0.12 -0.70 -1.89 0.00 0.00 176.35 173.58 2i5y s GLU 81 N 2.23 3.32 -0.12 1.98 2.12 0.18 -1.39 118.70 127.01 2i5y s GLU 81 Ca 0.06 -0.26 -0.02 0.00 0.36 0.00 0.00 54.97 55.11 2i5y s GLU 81 Cb -0.16 -3.06 0.04 0.00 0.26 0.00 0.00 34.13 31.21 2i5y s GLU 81 CO -0.17 0.73 -0.01 -1.17 -0.54 0.00 0.00 175.26 174.10 2i5y s LEU 82 N -1.29 0.91 0.21 2.70 2.96 -0.60 -1.46 118.68 122.12 2i5y s LEU 82 Ca 0.18 -0.35 0.04 0.00 -0.22 0.00 0.00 54.13 53.78 2i5y s LEU 82 Cb -0.12 -0.58 -0.03 0.00 0.50 0.00 0.00 46.19 45.96 2i5y s LEU 82 CO 0.08 -0.21 0.31 -0.13 -1.32 0.00 0.00 176.35 175.08 2i5y s ARG 82 N 1.88 3.37 -1.17 1.98 0.52 0.52 -1.72 118.95 124.33 2i5y s ARG 82 Ca 0.03 -0.74 -0.21 0.00 -0.52 0.00 0.00 55.73 54.28 2i5y s ARG 82 Cb -0.14 -2.87 -0.00 0.00 0.52 0.00 0.00 34.95 32.46 2i5y s ARG 82 CO -0.07 0.46 0.76 -1.71 0.02 0.00 0.00 175.30 174.76 2i5y n ASN 82 N -1.08 -4.82 -4.71 0.23 5.15 -1.09 -4.88 115.26 104.06 2i5y n ASN 82 Ca -0.08 -1.05 -0.39 0.00 -0.60 0.00 0.00 54.58 52.46 2i5y n ASN 82 Cb 0.56 -3.15 0.04 0.00 -0.53 0.00 0.00 39.78 36.70 2i5y n ASN 82 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2i5y n LEU 82 N -4.31 4.99 -4.32 1.20 4.77 0.06 -4.57 117.00 114.83 2i5y n LEU 82 Ca -0.11 0.95 -0.17 0.00 -0.03 0.00 0.00 56.01 56.65 2i5y n LEU 82 Cb 0.59 -1.53 -0.10 0.00 -2.33 0.00 0.00 43.42 40.06 2i5y n LEU 82 CO 0.69 -0.87 -0.41 -0.13 -1.33 0.00 0.00 177.39 175.34 2i5y s ARG 83 N -2.79 1.26 0.40 3.23 0.52 -1.26 0.87 118.95 121.18 2i5y s ARG 83 Ca 0.72 -1.57 0.09 0.00 -0.52 0.00 0.00 55.73 54.45 2i5y s ARG 83 Cb -0.43 -0.87 0.88 0.00 0.52 0.00 0.00 34.95 35.05 2i5y s ARG 83 CO 0.49 0.09 1.98 0.77 0.02 0.00 0.00 175.30 178.65 2i5y h SER 84 N 2.59 0.51 0.00 0.23 0.02 -1.98 0.24 113.55 115.17 2i5y h SER 84 Ca -0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 2i5y h SER 84 Cb 1.21 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.65 2i5y h SER 84 CO 0.63 0.33 0.00 -0.90 -1.14 0.00 0.00 176.83 175.75 2i5y n ASP 85 N -4.48 0.00 -0.30 3.07 5.75 -1.26 -1.70 116.55 117.63 2i5y n ASP 85 Ca 0.09 -0.87 0.11 0.00 -0.01 0.00 0.00 54.79 54.11 2i5y n ASP 85 Cb 0.27 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.43 2i5y n ASP 85 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2i5y n ASP 86 N -0.80 1.49 -4.67 -1.12 9.92 0.84 -4.91 116.55 117.30 2i5y n ASP 86 Ca 0.09 -1.18 -0.46 0.00 -0.53 0.00 0.00 54.79 52.71 2i5y n ASP 86 Cb 0.04 0.50 -0.04 0.00 -0.64 0.00 0.00 41.12 40.98 2i5y n ASP 86 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 2i5y n THR 87 N -0.58 0.65 0.00 -3.53 -1.04 -0.69 -4.86 114.28 104.23 2i5y n THR 87 Ca 0.08 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 2i5y n THR 87 Cb 0.40 -2.06 0.00 0.00 -1.82 0.00 0.00 70.33 66.85 2i5y n THR 87 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2i5y n ALA 88 N 7.17 0.00 -2.80 2.41 0.00 -0.68 -4.39 120.51 122.21 2i5y n ALA 88 Ca 0.22 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.31 2i5y n ALA 88 Cb 0.34 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.71 2i5y n ALA 88 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2i5y s VAL 89 N -2.00 5.02 -0.16 0.00 1.01 -0.55 -0.94 120.40 122.78 2i5y s VAL 89 Ca 0.00 0.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.98 2i5y s VAL 89 Cb 0.00 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 2i5y s VAL 89 CO 0.00 0.54 -0.04 -0.31 0.00 0.00 0.00 175.10 175.29 2i5y s TYR 90 N -0.35 3.00 0.03 5.22 2.02 0.17 -1.18 117.35 126.27 2i5y s TYR 90 Ca 0.10 -0.37 0.02 0.00 -0.37 0.00 0.00 57.07 56.44 2i5y s TYR 90 Cb -0.12 -1.97 -0.04 0.00 -0.40 0.00 0.00 41.96 39.44 2i5y s TYR 90 CO 0.02 -0.09 0.05 -0.06 -1.57 0.00 0.00 175.55 173.89 2i5y s PHE 91 N 0.47 3.17 -0.16 2.71 0.08 0.25 -0.44 117.98 124.07 2i5y s PHE 91 Ca -0.04 0.11 -0.01 0.00 0.12 0.00 0.00 56.93 57.11 2i5y s PHE 91 Cb -0.14 -1.66 -0.01 0.00 -0.57 0.00 0.00 43.02 40.63 2i5y s PHE 91 CO 0.03 0.51 -0.11 0.00 -0.10 0.00 0.00 175.22 175.55 2i5y s ALA 93 N 0.72 0.74 0.36 0.00 0.00 0.10 0.49 121.76 124.17 2i5y s ALA 93 Ca -0.05 -1.24 -0.11 0.00 0.00 0.00 0.00 51.96 50.56 2i5y s ALA 93 Cb -0.15 0.20 0.03 0.00 0.00 0.00 0.00 23.12 23.20 2i5y s ALA 93 CO 0.02 -0.28 0.65 0.20 0.00 0.00 0.00 175.76 176.35 2i5y s GLY 94 N -2.87 0.78 -0.18 0.00 0.00 -0.20 0.80 107.32 105.64 2i5y s GLY 94 Ca 0.08 -1.03 -0.28 0.00 0.00 0.00 0.00 44.72 43.49 2i5y s GLY 94 CO -0.07 -0.58 0.86 0.54 0.00 0.00 0.00 173.10 173.85 2i5y s VAL 95 N -2.76 0.00 0.14 1.40 0.11 -0.89 -2.16 120.40 116.24 2i5y s VAL 95 Ca 0.21 0.00 -0.31 0.00 -2.93 0.00 0.00 61.98 58.95 2i5y s VAL 95 Cb -0.03 -1.00 -0.09 0.00 -1.53 0.00 0.00 36.38 33.73 2i5y s VAL 95 CO 0.14 0.00 1.47 -0.47 -3.33 0.00 0.00 175.10 172.92 2i5y s TYR 96 N -0.47 3.16 -0.89 1.54 5.04 -1.26 -2.14 117.35 122.34 2i5y s TYR 96 Ca -0.03 0.81 0.14 0.00 -2.44 0.00 0.00 57.07 55.55 2i5y s TYR 96 Cb -0.02 -3.80 -0.10 0.00 0.35 0.00 0.00 41.96 38.39 2i5y s TYR 96 CO 0.02 -2.86 0.66 0.39 -1.34 0.00 0.00 175.55 172.42 2i5y n GLU 97 N 3.91 2.21 0.00 4.97 -0.58 0.13 -4.87 120.64 126.41 2i5y n GLU 97 Ca 0.12 -0.26 0.00 0.00 -0.42 0.00 0.00 57.16 56.60 2i5y n GLU 97 Cb 0.40 -1.18 0.00 0.00 -0.57 0.00 0.00 31.44 30.10 2i5y n GLU 97 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2i5y n GLY 98 N 1.24 -0.12 2.99 0.62 0.00 -1.23 -0.67 105.19 108.02 2i5y n GLY 98 Ca 0.04 -2.27 -0.43 0.00 0.00 0.00 0.00 46.02 43.36 2i5y n GLY 98 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2i5y n GLU 99 N -0.27 1.86 -0.08 1.61 1.02 -1.25 -4.67 120.64 118.86 2i5y n GLU 99 Ca 0.00 -2.03 -0.07 0.00 -0.02 0.00 0.00 57.16 55.05 2i5y n GLU 99 Cb 0.00 -3.00 -0.00 0.00 -0.02 0.00 0.00 31.44 28.41 2i5y n GLU 99 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2i5y h ALA 100 N 7.39 0.24 0.00 0.62 0.00 -1.71 -1.07 119.26 124.72 2i5y h ALA 100 Ca 0.46 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.47 2i5y h ALA 100 Cb 0.65 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2i5y h ALA 100 CO 1.94 -0.44 0.00 0.38 0.00 0.00 0.00 179.25 181.13 2i5y h ASP 100 N 0.05 0.00 -0.14 0.00 2.03 -1.84 0.17 116.42 116.69 2i5y h ASP 100 Ca 0.14 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.44 2i5y h ASP 100 Cb 0.20 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.70 2i5y h ASP 100 CO -0.27 0.00 0.00 -0.62 -1.03 0.00 0.00 179.24 177.32 2i5y n GLU 100 N -2.77 2.28 0.00 4.15 -0.58 -0.47 -4.97 120.64 118.27 2i5y n GLU 100 Ca -0.02 -1.99 0.00 0.00 -0.42 0.00 0.00 57.16 54.73 2i5y n GLU 100 Cb 0.06 -1.46 0.00 0.00 -0.57 0.00 0.00 31.44 29.47 2i5y n GLU 100 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2i5y n GLY 100 N 1.34 3.11 3.77 0.62 0.00 0.61 -5.08 105.19 109.56 2i5y n GLY 100 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 2i5y n GLY 100 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2i5y s GLU 100 N -0.69 4.61 -0.24 1.61 8.01 -0.80 -4.92 118.70 126.28 2i5y s GLU 100 Ca 0.00 1.24 -0.16 0.00 0.01 0.00 0.00 54.97 56.06 2i5y s GLU 100 Cb 0.00 -3.15 0.07 0.00 -4.31 0.00 0.00 34.13 26.73 2i5y s GLU 100 CO 0.00 0.49 0.59 -0.47 0.01 0.00 0.00 175.26 175.89 2i5y s TYR 100 N -1.27 -0.82 0.00 1.61 6.14 -1.26 -2.17 117.35 119.58 2i5y s TYR 100 Ca 0.40 1.76 0.00 0.00 0.64 0.00 0.00 57.07 59.87 2i5y s TYR 100 Cb -0.22 0.41 0.00 0.00 0.42 0.00 0.00 41.96 42.57 2i5y s TYR 100 CO 0.27 -0.41 0.00 -0.25 0.64 0.00 0.00 175.55 175.79 2i5y n ASP 100 N 3.80 0.00 -3.69 4.32 8.00 0.15 -5.03 116.55 124.10 2i5y n ASP 100 Ca -0.19 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.17 2i5y n ASP 100 Cb 0.57 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.58 2i5y n ASP 100 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2i5y s ASN 100 N -1.00 -0.48 0.00 -2.24 0.01 -1.26 -5.13 114.94 104.84 2i5y s ASN 100 Ca 0.00 0.78 0.17 0.00 -0.71 0.00 0.00 52.86 53.11 2i5y s ASN 100 Cb 0.00 0.81 -0.17 0.00 0.41 0.00 0.00 41.25 42.31 2i5y s ASN 100 CO 0.00 -0.30 0.76 0.61 -1.51 0.00 0.00 177.10 176.67 2i5y n GLY 100 N 2.21 -0.56 3.96 0.66 0.00 -1.26 -5.01 105.19 105.20 2i5y n GLY 100 Ca -0.16 -0.50 -0.26 0.00 0.00 0.00 0.00 46.02 45.10 2i5y n GLY 100 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2i5y s PHE 100 N -2.58 1.77 -0.24 1.61 -0.71 -1.26 -5.09 117.98 111.48 2i5y s PHE 100 Ca 0.08 0.02 0.00 0.00 -1.04 0.00 0.00 56.93 55.99 2i5y s PHE 100 Cb 0.13 -3.40 0.07 0.00 -1.21 0.00 0.00 43.02 38.60 2i5y s PHE 100 CO 0.68 -1.99 -0.02 -0.51 -1.34 0.00 0.00 175.22 172.05 2i5y s LEU 100 N -5.41 2.37 -0.18 -1.99 1.43 -1.26 -4.68 118.68 108.95 2i5y s LEU 100 Ca 0.68 -1.19 -0.24 0.00 -1.03 0.00 0.00 54.13 52.34 2i5y s LEU 100 Cb -0.05 -1.06 -0.22 0.00 0.03 0.00 0.00 46.19 44.89 2i5y s LEU 100 CO 0.47 -0.27 0.42 0.50 0.23 0.00 0.00 176.35 177.70 2i5y h LYS 101 N 8.01 0.00 -5.63 1.70 1.63 -1.89 -3.47 116.57 116.93 2i5y h LYS 101 Ca -0.16 -0.01 -0.66 0.00 -0.85 0.00 0.00 60.65 58.97 2i5y h LYS 101 Cb 1.07 0.00 -0.09 0.00 -0.60 0.00 0.00 32.23 32.62 2i5y h LYS 101 CO 0.41 1.00 -0.50 -1.01 -3.45 0.00 0.00 179.45 175.90 2i5y s HIS 102 N -2.31 3.51 0.10 1.91 3.76 -0.92 -4.99 115.29 116.35 2i5y s HIS 102 Ca -0.25 0.45 0.05 0.00 -0.15 0.00 0.00 55.06 55.16 2i5y s HIS 102 Cb 0.03 -1.95 -0.04 0.00 1.11 0.00 0.00 32.58 31.73 2i5y s HIS 102 CO 0.63 0.63 -0.13 -1.58 -0.85 0.00 0.00 174.74 173.44 2i5y s TRP 103 N -0.80 1.29 0.81 1.40 0.52 -1.26 -1.03 118.94 119.86 2i5y s TRP 103 Ca 0.14 -0.55 -0.07 0.00 0.02 0.00 0.00 56.10 55.63 2i5y s TRP 103 Cb -0.12 -0.69 0.15 0.00 -1.15 0.00 0.00 33.47 31.66 2i5y s TRP 103 CO 0.03 0.09 1.12 0.20 0.02 0.00 0.00 176.95 178.42 2i5y s GLY 104 N -2.27 1.76 0.00 0.98 0.00 0.18 -4.43 107.32 103.54 2i5y s GLY 104 Ca 0.05 -1.47 0.31 0.00 0.00 0.00 0.00 44.72 43.61 2i5y s GLY 104 CO 0.02 -0.83 2.09 0.61 0.00 0.00 0.00 173.10 174.99 2i5y n GLN 105 N -3.20 1.18 -0.02 2.90 0.00 -1.26 -4.76 117.38 112.22 2i5y n GLN 105 Ca 0.15 -0.28 0.00 0.00 0.00 0.00 0.00 57.00 56.87 2i5y n GLN 105 Cb 0.60 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.35 2i5y n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2i5y n GLY 106 N 1.05 -2.95 3.21 2.61 0.00 -1.26 -5.01 105.19 102.85 2i5y n GLY 106 Ca 0.22 -1.20 -0.32 0.00 0.00 0.00 0.00 46.02 44.72 2i5y n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2i5y s THR 107 N -2.51 2.14 0.13 2.61 2.01 0.41 -4.92 115.64 115.52 2i5y s THR 107 Ca 0.00 -0.98 -0.24 0.00 0.31 0.00 0.00 61.69 60.79 2i5y s THR 107 Cb 0.00 -1.84 -0.07 0.00 0.01 0.00 0.00 72.50 70.60 2i5y s THR 107 CO 0.00 0.55 0.71 -0.22 -0.69 0.00 0.00 174.62 174.98 2i5y s LEU 108 N 0.52 4.57 -0.20 4.42 2.96 -1.26 0.41 118.68 130.10 2i5y s LEU 108 Ca -0.14 1.52 -0.02 0.00 -0.22 0.00 0.00 54.13 55.27 2i5y s LEU 108 Cb -0.17 -3.17 0.06 0.00 0.50 0.00 0.00 46.19 43.41 2i5y s LEU 108 CO 0.05 0.22 0.02 -0.69 -1.32 0.00 0.00 176.35 174.64 2i5y s VAL 109 N -1.10 0.65 -0.25 1.68 1.01 -0.12 -1.02 120.40 121.26 2i5y s VAL 109 Ca 0.34 -0.65 -0.09 0.00 0.00 0.00 0.00 61.98 61.57 2i5y s VAL 109 Cb -0.22 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 2i5y s VAL 109 CO 0.24 -0.20 0.13 -0.89 0.00 0.00 0.00 175.10 174.38 2i5y s THR 110 N 1.80 4.89 -0.22 3.92 2.01 0.94 -1.69 115.64 127.29 2i5y s THR 110 Ca -0.02 0.02 -0.05 0.00 0.31 0.00 0.00 61.69 61.96 2i5y s THR 110 Cb -0.17 -3.30 -0.02 0.00 0.01 0.00 0.00 72.50 69.02 2i5y s THR 110 CO -0.08 0.32 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.48 2i5y s VAL 111 N 1.47 3.78 0.19 3.82 1.01 -1.26 -0.71 120.40 128.70 2i5y s VAL 111 Ca 0.06 -0.36 -0.23 0.00 0.00 0.00 0.00 61.98 61.45 2i5y s VAL 111 Cb -0.15 -2.73 0.05 0.00 0.00 0.00 0.00 36.38 33.55 2i5y s VAL 111 CO 0.06 0.40 0.75 -0.55 0.00 0.00 0.00 175.10 175.77 2i5y s SER 112 N 1.34 -0.35 -0.01 3.32 0.15 -0.22 -4.47 113.70 113.46 2i5y s SER 112 Ca 0.04 -0.33 0.22 0.00 0.70 0.00 0.00 55.95 56.58 2i5y s SER 112 Cb -0.15 0.61 -0.29 0.00 -1.71 0.00 0.00 66.02 64.48 2i5y s SER 112 CO 0.00 -1.08 0.52 -1.54 1.20 0.00 0.00 173.24 172.34 2i5y n SER 113 N -0.41 0.11 -4.65 5.45 3.41 -1.26 -3.93 113.62 112.34 2i5y n SER 113 Ca -0.09 0.04 -0.35 0.00 -0.26 0.00 0.00 58.87 58.22 2i5y n SER 113 Cb 0.61 1.73 0.10 0.00 -0.26 0.00 0.00 64.21 66.40 2i5y n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2i5y n ALA 114 N -2.29 -0.08 -2.93 7.33 0.00 -1.26 -5.02 120.51 116.26 2i5y n ALA 114 Ca -0.06 -0.24 -0.24 0.00 0.00 0.00 0.00 53.44 52.91 2i5y n ALA 114 Cb 0.61 -2.18 -0.03 0.00 0.00 0.00 0.00 19.45 17.85 2i5y n ALA 114 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2i5y s SER 115 N -1.81 6.19 0.24 0.00 0.01 -1.26 -5.04 113.70 112.03 2i5y s SER 115 Ca 0.74 0.07 -0.31 0.00 1.31 0.00 0.00 55.95 57.75 2i5y s SER 115 Cb -0.32 -1.81 -0.13 0.00 0.21 0.00 0.00 66.02 63.97 2i5y s SER 115 CO 0.50 -0.01 1.52 0.41 0.41 0.00 0.00 173.24 176.07 2i5y n THR 116 N -0.96 0.70 -3.79 1.44 -1.04 -1.26 -4.73 114.28 104.64 2i5y n THR 116 Ca -0.08 -0.17 -0.13 0.00 -2.04 0.00 0.00 64.05 61.63 2i5y n THR 116 Cb 0.56 -1.67 -0.12 0.00 -1.82 0.00 0.00 70.33 67.28 2i5y n THR 116 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2i5y s LYS 117 N -0.04 0.25 0.47 -2.82 2.20 0.19 -4.94 119.74 115.06 2i5y s LYS 117 Ca 0.70 0.32 -0.15 0.00 -0.36 0.00 0.00 55.97 56.48 2i5y s LYS 117 Cb -0.60 0.10 -0.08 0.00 -1.51 0.00 0.00 37.83 35.74 2i5y s LYS 117 CO 0.45 -0.04 0.92 0.20 -0.36 0.00 0.00 175.35 176.52 2i5y s GLY 118 N 0.24 2.08 0.59 5.54 0.00 -1.26 -0.88 107.32 113.62 2i5y s GLY 118 Ca -0.01 0.11 -0.15 0.00 0.00 0.00 0.00 44.72 44.67 2i5y s GLY 118 CO -0.01 0.36 1.04 2.56 0.00 0.00 0.00 173.10 177.05 2i5y s PRO 119 N -3.88 3.44 -0.29 2.90 0.04 -1.26 -4.54 135.00 131.42 2i5y s PRO 119 Ca 0.57 1.08 -0.09 0.00 0.04 0.00 0.00 61.00 62.60 2i5y s PRO 119 Cb -0.10 -2.06 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 2i5y s PRO 119 CO 0.29 -0.70 0.12 -1.12 0.04 0.00 0.00 177.00 175.63 2i5y s SER 120 N -3.09 5.39 -0.26 6.66 0.01 -0.28 -4.94 113.70 117.18 2i5y s SER 120 Ca 0.61 -0.43 -0.10 0.00 1.31 0.00 0.00 55.95 57.33 2i5y s SER 120 Cb -0.14 -1.97 -0.05 0.00 0.21 0.00 0.00 66.02 64.08 2i5y s SER 120 CO 0.39 -0.14 0.17 -0.69 0.41 0.00 0.00 173.24 173.38 2i5y s VAL 121 N 1.60 5.27 0.05 3.43 1.01 -1.26 -2.32 120.40 128.17 2i5y s VAL 121 Ca 0.05 0.15 0.08 0.00 0.00 0.00 0.00 61.98 62.26 2i5y s VAL 121 Cb -0.16 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 2i5y s VAL 121 CO 0.05 0.30 -0.21 -0.36 0.00 0.00 0.00 175.10 174.89 2i5y s PHE 122 N 1.41 2.49 0.38 5.22 0.08 0.03 -4.95 117.98 122.64 2i5y s PHE 122 Ca 0.07 -0.30 -0.20 0.00 0.12 0.00 0.00 56.93 56.62 2i5y s PHE 122 Cb -0.15 -1.44 -0.10 0.00 -0.57 0.00 0.00 43.02 40.76 2i5y s PHE 122 CO 0.08 0.22 0.87 -1.25 -0.10 0.00 0.00 175.22 175.04 2i5y s PRO 123 N -1.41 4.20 -0.73 0.24 0.04 -1.26 -0.06 135.00 136.00 2i5y s PRO 123 Ca 0.14 0.99 -0.01 0.00 0.04 0.00 0.00 61.00 62.16 2i5y s PRO 123 Cb -0.10 -2.35 0.18 0.00 0.04 0.00 0.00 34.50 32.27 2i5y s PRO 123 CO 0.04 0.08 0.57 -0.51 0.04 0.00 0.00 177.00 177.22 2i5y s LEU 124 N -2.95 5.25 0.29 -3.56 1.43 0.41 -4.81 118.68 114.73 2i5y s LEU 124 Ca 0.57 -3.33 -0.29 0.00 -1.03 0.00 0.00 54.13 50.05 2i5y s LEU 124 Cb -0.11 -1.83 -0.10 0.00 0.03 0.00 0.00 46.19 44.18 2i5y s LEU 124 CO 0.16 -0.25 1.33 0.00 0.23 0.00 0.00 176.35 177.82 2i5y s ALA 125 N -0.76 3.53 0.67 4.21 0.00 -1.26 -1.87 121.76 126.28 2i5y s ALA 125 Ca 0.22 1.24 -0.12 0.00 0.00 0.00 0.00 51.96 53.31 2i5y s ALA 125 Cb -0.14 -3.49 -0.00 0.00 0.00 0.00 0.00 23.12 19.49 2i5y s ALA 125 CO -0.08 -0.63 1.05 -2.14 0.00 0.00 0.00 175.76 173.96 2i5y s PRO 126 N -1.17 3.07 0.00 0.00 0.02 -1.25 -4.98 135.00 130.68 2i5y s PRO 126 Ca 0.52 0.97 0.00 0.00 0.02 0.00 0.00 61.00 62.51 2i5y s PRO 126 Cb -0.39 -2.01 0.00 0.00 0.02 0.00 0.00 34.50 32.12 2i5y s PRO 126 CO 0.48 -1.00 0.00 0.43 -0.33 0.00 0.00 177.00 176.58 2i5y n SER 127 N -2.92 0.00 -1.14 2.53 7.64 -1.26 -4.85 113.62 113.63 2i5y n SER 127 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.95 2i5y n SER 127 Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 2i5y n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2i5y n GLY 134 N 0.08 1.37 3.69 0.23 0.00 -1.26 -5.08 105.19 104.21 2i5y n GLY 134 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2i5y n GLY 134 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2i5y s THR 135 N 0.44 4.93 -0.03 2.61 2.01 -1.26 -0.51 115.64 123.83 2i5y s THR 135 Ca 0.00 0.01 0.05 0.00 0.31 0.00 0.00 61.69 62.06 2i5y s THR 135 Cb 0.00 -3.20 -0.01 0.00 0.01 0.00 0.00 72.50 69.30 2i5y s THR 135 CO 0.00 0.49 -0.18 0.00 -0.69 0.00 0.00 174.62 174.24 2i5y s ALA 136 N 0.06 1.53 -0.24 7.40 0.00 0.00 -4.82 121.76 125.70 2i5y s ALA 136 Ca 0.06 -0.75 -0.08 0.00 0.00 0.00 0.00 51.96 51.19 2i5y s ALA 136 Cb -0.12 -0.44 -0.04 0.00 0.00 0.00 0.00 23.12 22.52 2i5y s ALA 136 CO 0.00 0.33 0.10 0.00 0.00 0.00 0.00 175.76 176.20 2i5y s ALA 137 N -0.24 3.34 0.22 0.00 0.00 -1.26 -0.79 121.76 123.03 2i5y s ALA 137 Ca 0.02 -1.00 0.09 0.00 0.00 0.00 0.00 51.96 51.07 2i5y s ALA 137 Cb -0.09 -2.15 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 2i5y s ALA 137 CO 0.01 -0.31 -0.05 -0.51 0.00 0.00 0.00 175.76 174.90 2i5y s LEU 138 N 1.29 3.09 0.36 0.00 1.02 -0.27 -3.89 118.68 120.28 2i5y s LEU 138 Ca 0.06 -0.61 -0.16 0.00 0.02 0.00 0.00 54.13 53.43 2i5y s LEU 138 Cb -0.15 -1.69 0.06 0.00 0.02 0.00 0.00 46.19 44.43 2i5y s LEU 138 CO 0.05 0.06 0.81 -0.83 0.02 0.00 0.00 176.35 176.45 2i5y s GLY 139 N -3.23 0.33 -0.13 -3.19 0.00 -0.78 -1.55 107.32 98.76 2i5y s GLY 139 Ca 0.28 -0.70 -0.06 0.00 0.00 0.00 0.00 44.72 44.24 2i5y s GLY 139 CO 0.18 -0.06 0.28 0.00 0.00 0.00 0.00 173.10 173.50 2i5y s LEU 141 N 1.79 4.20 -0.46 0.00 2.96 0.91 -1.60 118.68 126.48 2i5y s LEU 141 Ca -0.05 0.22 -0.04 0.00 -0.22 0.00 0.00 54.13 54.04 2i5y s LEU 141 Cb -0.11 -2.61 0.12 0.00 0.50 0.00 0.00 46.19 44.09 2i5y s LEU 141 CO -0.09 -0.39 0.28 -0.69 -1.32 0.00 0.00 176.35 174.13 2i5y s VAL 142 N 2.36 3.59 0.35 1.68 1.01 0.43 -0.79 120.40 129.02 2i5y s VAL 142 Ca 0.20 -2.13 0.04 0.00 0.00 0.00 0.00 61.98 60.09 2i5y s VAL 142 Cb -0.15 -3.42 -0.06 0.00 0.00 0.00 0.00 36.38 32.75 2i5y s VAL 142 CO 0.12 -0.74 0.06 -1.59 0.00 0.00 0.00 175.10 172.94 2i5y s LYS 143 N 1.01 1.73 -0.86 2.72 -2.85 -0.98 -0.18 119.74 120.33 2i5y s LYS 143 Ca 0.09 -1.98 -0.04 0.00 -1.00 0.00 0.00 55.97 53.04 2i5y s LYS 143 Cb -0.23 -0.96 -0.01 0.00 -2.06 0.00 0.00 37.83 34.57 2i5y s LYS 143 CO -0.03 -0.20 0.73 -0.25 0.10 0.00 0.00 175.35 175.70 2i5y n ASP 144 N -0.80 -6.76 -4.11 0.03 8.00 -0.81 -1.13 116.55 110.97 2i5y n ASP 144 Ca -0.03 -0.47 -0.10 0.00 0.71 0.00 0.00 54.79 54.90 2i5y n ASP 144 Cb 0.67 -4.40 -0.10 0.00 -0.02 0.00 0.00 41.12 37.26 2i5y n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2i5y s TYR 145 N -3.13 0.69 -0.27 1.24 -0.85 -0.98 -4.21 117.35 109.84 2i5y s TYR 145 Ca 0.15 -0.86 -0.23 0.00 -0.52 0.00 0.00 57.07 55.60 2i5y s TYR 145 Cb -0.04 -0.43 0.09 0.00 0.38 0.00 0.00 41.96 41.96 2i5y s TYR 145 CO 0.79 -0.21 0.79 0.12 -1.52 0.00 0.00 175.55 175.52 2i5y s PHE 146 N -3.18 -0.76 0.00 -3.49 5.36 -0.06 -1.01 117.98 114.83 2i5y s PHE 146 Ca 0.05 1.78 0.00 0.00 -0.96 0.00 0.00 56.93 57.79 2i5y s PHE 146 Cb 0.02 0.35 0.00 0.00 -0.34 0.00 0.00 43.02 43.06 2i5y s PHE 146 CO -0.05 -0.37 0.00 -0.35 -1.46 0.00 0.00 175.22 172.99 2i5y n PRO 147 N 2.91 3.67 -3.12 10.12 -0.04 -1.26 0.57 135.00 147.86 2i5y n PRO 147 Ca -0.15 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.01 2i5y n PRO 147 Cb 0.56 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.99 2i5y n PRO 147 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2i5y s GLU 148 N 3.54 3.72 0.49 0.54 2.56 -1.26 -4.74 118.70 123.54 2i5y s GLU 148 Ca 0.00 0.25 0.07 0.00 0.00 0.00 0.00 54.97 55.30 2i5y s GLU 148 Cb 0.00 -2.52 0.07 0.00 2.00 0.00 0.00 34.13 33.68 2i5y s GLU 148 CO 0.00 0.10 0.60 -0.35 -0.56 0.00 0.00 175.26 175.06 2i5y n PRO 149 N -1.03 0.69 -3.84 4.30 -0.04 -1.26 -5.00 135.00 128.83 2i5y n PRO 149 Ca 0.00 -2.73 -0.13 0.00 -0.04 0.00 0.00 63.50 60.61 2i5y n PRO 149 Cb 0.54 -0.08 -0.14 0.00 -0.04 0.00 0.00 33.50 33.78 2i5y n PRO 149 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2i5y s VAL 150 N -2.13 -0.01 0.00 0.52 0.11 -1.26 -4.52 120.40 113.11 2i5y s VAL 150 Ca 0.46 0.03 0.02 0.00 -2.93 0.00 0.00 61.98 59.56 2i5y s VAL 150 Cb -0.04 -0.10 -0.04 0.00 -1.53 0.00 0.00 36.38 34.68 2i5y s VAL 150 CO 0.29 0.01 -0.02 -0.89 -3.33 0.00 0.00 175.10 171.16 2i5y s THR 151 N 0.22 3.98 -0.01 5.04 2.01 0.25 -4.97 115.64 122.15 2i5y s THR 151 Ca -0.02 -0.67 0.01 0.00 0.31 0.00 0.00 61.69 61.32 2i5y s THR 151 Cb -0.02 -2.76 0.00 0.00 0.01 0.00 0.00 72.50 69.72 2i5y s THR 151 CO -0.01 0.37 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.57 2i5y s VAL 152 N -1.06 0.35 0.25 3.82 1.01 -1.26 -1.15 120.40 122.36 2i5y s VAL 152 Ca 0.19 -0.16 -0.06 0.00 0.00 0.00 0.00 61.98 61.95 2i5y s VAL 152 Cb -0.11 -0.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.93 2i5y s VAL 152 CO 0.10 0.11 0.34 -0.94 0.00 0.00 0.00 175.10 174.71 2i5y s SER 153 N 0.08 0.25 -0.05 3.32 1.04 -0.86 -4.99 113.70 112.49 2i5y s SER 153 Ca -0.00 -1.23 0.04 0.00 0.48 0.00 0.00 55.95 55.24 2i5y s SER 153 Cb -0.04 0.52 -0.00 0.00 0.10 0.00 0.00 66.02 66.60 2i5y s SER 153 CO -0.00 -1.06 -0.17 0.26 0.98 0.00 0.00 173.24 173.25 2i5y s TRP 154 N -3.87 1.76 -1.24 5.02 0.52 -1.26 -1.19 118.94 118.68 2i5y s TRP 154 Ca 0.31 -0.54 -0.15 0.00 0.02 0.00 0.00 56.10 55.74 2i5y s TRP 154 Cb 0.02 -1.19 0.00 0.00 -1.15 0.00 0.00 33.47 31.15 2i5y s TRP 154 CO 0.13 -0.19 0.65 0.09 0.02 0.00 0.00 176.95 177.64 2i5y n ASN 155 N 3.23 -3.38 -2.40 2.95 3.02 -0.31 -1.19 115.26 117.17 2i5y n ASN 155 Ca -0.19 -1.05 -0.10 0.00 -0.03 0.00 0.00 54.58 53.22 2i5y n ASN 155 Cb 0.53 -3.07 -0.01 0.00 -0.61 0.00 0.00 39.78 36.62 2i5y n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2i5y n SER 156 N -2.73 -3.30 0.00 6.41 7.64 -1.26 -0.66 113.62 119.73 2i5y n SER 156 Ca -0.17 0.26 0.00 0.00 1.01 0.00 0.00 58.87 59.96 2i5y n SER 156 Cb 0.62 -2.84 0.00 0.00 -1.01 0.00 0.00 64.21 60.98 2i5y n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2i5y n GLY 157 N -0.72 0.66 0.09 0.23 0.00 -0.34 -4.97 105.19 100.15 2i5y n GLY 157 Ca -0.12 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 2i5y n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i5y h ALA 158 N 0.00 -0.09 -1.91 4.61 0.00 -0.57 -3.42 119.26 117.89 2i5y h ALA 158 Ca 0.00 -0.29 -0.57 0.00 0.00 0.00 0.00 54.91 54.04 2i5y h ALA 158 Cb 0.00 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.75 2i5y h ALA 158 CO 0.00 -0.20 0.80 -1.17 0.00 0.00 0.00 179.25 178.68 2i5y s LEU 159 N -8.85 3.87 0.00 0.00 2.96 -1.04 -4.81 118.68 110.81 2i5y s LEU 159 Ca -0.15 0.76 0.00 0.00 -0.22 0.00 0.00 54.13 54.52 2i5y s LEU 159 Cb -0.00 -3.47 0.00 0.00 0.50 0.00 0.00 46.19 43.22 2i5y s LEU 159 CO 0.57 -0.98 0.00 0.35 -1.32 0.00 0.00 176.35 174.98 2i5y n THR 160 N 6.17 0.00 -2.53 3.68 -2.24 -1.26 -4.01 114.28 114.09 2i5y n THR 160 Ca 0.11 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.48 2i5y n THR 160 Cb 0.48 -0.23 -0.04 0.00 -2.10 0.00 0.00 70.33 68.44 2i5y n THR 160 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2i5y s SER 161 N -1.61 7.30 0.00 3.42 0.01 -1.26 -3.36 113.70 118.20 2i5y s SER 161 Ca 0.00 2.09 0.00 0.00 1.31 0.00 0.00 55.95 59.35 2i5y s SER 161 Cb 0.00 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2i5y s SER 161 CO 0.00 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.08 2i5y n GLY 162 N 1.91 0.70 3.81 3.44 0.00 -1.26 -4.70 105.19 109.08 2i5y n GLY 162 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 2i5y n GLY 162 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2i5y s VAL 163 N -3.00 4.79 -0.17 1.61 -7.23 -1.21 -3.11 120.40 112.07 2i5y s VAL 163 Ca 0.00 1.18 -0.01 0.00 -1.81 0.00 0.00 61.98 61.34 2i5y s VAL 163 Cb 0.00 -3.88 0.04 0.00 0.56 0.00 0.00 36.38 33.10 2i5y s VAL 163 CO 0.00 0.54 -0.04 -1.00 -0.31 0.00 0.00 175.10 174.29 2i5y s HIS 164 N -0.97 1.61 -0.39 2.82 3.76 0.47 -4.96 115.29 117.63 2i5y s HIS 164 Ca 0.29 -1.06 -0.08 0.00 -0.15 0.00 0.00 55.06 54.05 2i5y s HIS 164 Cb -0.19 -1.27 0.06 0.00 1.11 0.00 0.00 32.58 32.29 2i5y s HIS 164 CO 0.18 -0.61 0.20 0.99 -0.85 0.00 0.00 174.74 174.65 2i5y s THR 165 N 1.66 4.10 0.55 1.30 2.01 -1.26 -0.22 115.64 123.79 2i5y s THR 165 Ca 0.00 -1.28 -0.19 0.00 0.31 0.00 0.00 61.69 60.53 2i5y s THR 165 Cb -0.16 -3.44 -0.05 0.00 0.01 0.00 0.00 72.50 68.86 2i5y s THR 165 CO -0.07 -0.38 1.14 -0.36 -0.69 0.00 0.00 174.62 174.25 2i5y s PHE 166 N 1.42 2.63 0.29 4.92 0.40 -0.63 -4.97 117.98 122.05 2i5y s PHE 166 Ca 0.02 1.54 -0.30 0.00 -0.60 0.00 0.00 56.93 57.59 2i5y s PHE 166 Cb -0.21 -3.31 -0.11 0.00 0.51 0.00 0.00 43.02 39.90 2i5y s PHE 166 CO 0.03 -1.65 1.61 -2.14 0.70 0.00 0.00 175.22 173.76 2i5y s PRO 167 N -3.33 4.12 0.60 0.24 0.02 -1.26 -4.54 135.00 130.85 2i5y s PRO 167 Ca 0.73 2.59 -0.19 0.00 0.02 0.00 0.00 61.00 64.14 2i5y s PRO 167 Cb -0.24 -3.03 -0.03 0.00 0.02 0.00 0.00 34.50 31.22 2i5y s PRO 167 CO 0.28 -0.65 1.23 0.00 -0.33 0.00 0.00 177.00 177.53 2i5y n ALA 168 N 2.34 1.02 -2.54 -1.55 0.00 -1.26 -4.88 120.51 113.63 2i5y n ALA 168 Ca 0.09 0.04 -0.33 0.00 0.00 0.00 0.00 53.44 53.24 2i5y n ALA 168 Cb 0.37 -2.28 -0.13 0.00 0.00 0.00 0.00 19.45 17.41 2i5y n ALA 168 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2i5y s VAL 169 N -1.38 3.05 -0.15 0.00 1.01 0.12 -4.92 120.40 118.13 2i5y s VAL 169 Ca 0.78 -0.72 -0.23 0.00 0.00 0.00 0.00 61.98 61.80 2i5y s VAL 169 Cb -0.40 -2.20 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 2i5y s VAL 169 CO 0.45 0.58 0.74 -0.22 0.00 0.00 0.00 175.10 176.65 2i5y s LEU 170 N -0.61 4.20 0.69 3.92 2.96 -1.26 -1.51 118.68 127.07 2i5y s LEU 170 Ca 0.09 1.08 -0.09 0.00 -0.22 0.00 0.00 54.13 54.99 2i5y s LEU 170 Cb -0.11 -3.09 0.04 0.00 0.50 0.00 0.00 46.19 43.52 2i5y s LEU 170 CO 0.01 -0.28 1.03 -1.10 -1.32 0.00 0.00 176.35 174.69 2i5y s GLN 171 N 1.71 2.56 0.00 1.98 -0.21 0.24 -4.94 119.66 121.00 2i5y s GLN 171 Ca 0.35 0.08 0.15 0.00 0.02 0.00 0.00 55.36 55.97 2i5y s GLN 171 Cb -0.17 -2.12 0.79 0.00 1.00 0.00 0.00 33.01 32.51 2i5y s GLN 171 CO 0.13 -1.08 1.41 -1.13 -2.12 0.00 0.00 175.29 172.51 2i5y n SER 172 N -2.91 0.00 -0.83 5.90 3.41 -1.26 -1.77 113.62 116.16 2i5y n SER 172 Ca 0.07 -0.02 0.07 0.00 -0.26 0.00 0.00 58.87 58.73 2i5y n SER 172 Cb 0.59 -0.24 0.20 0.00 -0.26 0.00 0.00 64.21 64.50 2i5y n SER 172 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2i5y n SER 173 N -1.24 3.26 0.00 4.04 3.41 -1.26 -4.96 113.62 116.87 2i5y n SER 173 Ca 0.08 -2.07 0.00 0.00 -0.26 0.00 0.00 58.87 56.62 2i5y n SER 173 Cb 0.11 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 2i5y n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2i5y n GLY 174 N 0.71 0.71 3.58 5.00 0.00 -0.73 -4.99 105.19 109.47 2i5y n GLY 174 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 2i5y n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i5y s LEU 175 N 0.00 3.18 0.70 0.99 1.43 -1.26 -4.86 118.68 118.86 2i5y s LEU 175 Ca 0.00 -0.02 -0.09 0.00 -1.03 0.00 0.00 54.13 52.99 2i5y s LEU 175 Cb 0.00 -1.69 0.04 0.00 0.03 0.00 0.00 46.19 44.57 2i5y s LEU 175 CO 0.00 0.36 1.04 -0.31 0.23 0.00 0.00 176.35 177.67 2i5y s TYR 176 N -0.78 3.11 -0.16 0.29 2.02 -0.18 -0.60 117.35 121.05 2i5y s TYR 176 Ca 0.12 0.71 -0.29 0.00 -0.37 0.00 0.00 57.07 57.24 2i5y s TYR 176 Cb -0.11 -3.11 0.10 0.00 -0.40 0.00 0.00 41.96 38.44 2i5y s TYR 176 CO 0.01 -1.28 0.86 0.45 -1.57 0.00 0.00 175.55 174.03 2i5y s SER 177 N -4.44 -0.53 0.33 2.29 0.15 -0.57 -1.92 113.70 109.01 2i5y s SER 177 Ca 0.58 0.74 -0.14 0.00 0.70 0.00 0.00 55.95 57.83 2i5y s SER 177 Cb -0.11 0.66 0.03 0.00 -1.71 0.00 0.00 66.02 64.89 2i5y s SER 177 CO 0.47 -0.38 0.67 -1.48 1.20 0.00 0.00 173.24 173.73 2i5y s LEU 178 N -0.66 0.15 0.03 3.45 0.05 0.75 -0.70 118.68 121.74 2i5y s LEU 178 Ca -0.03 -1.03 0.02 0.00 0.05 0.00 0.00 54.13 53.14 2i5y s LEU 178 Cb -0.02 2.42 -0.02 0.00 -2.05 0.00 0.00 46.19 46.53 2i5y s LEU 178 CO 0.03 -1.45 -0.08 -0.44 -0.55 0.00 0.00 176.35 173.86 2i5y s SER 179 N -3.05 0.86 -0.11 1.48 0.01 -1.26 -0.43 113.70 111.20 2i5y s SER 179 Ca 0.18 -0.41 0.02 0.00 1.31 0.00 0.00 55.95 57.05 2i5y s SER 179 Cb -0.04 -0.01 0.01 0.00 0.21 0.00 0.00 66.02 66.20 2i5y s SER 179 CO 0.11 -0.10 -0.15 -0.55 0.41 0.00 0.00 173.24 172.96 2i5y s SER 180 N -1.11 2.38 0.18 2.44 0.15 -0.63 -1.60 113.70 115.51 2i5y s SER 180 Ca -0.05 -0.41 0.08 0.00 0.70 0.00 0.00 55.95 56.26 2i5y s SER 180 Cb -0.07 -1.06 -0.04 0.00 -1.71 0.00 0.00 66.02 63.13 2i5y s SER 180 CO 0.00 0.01 -0.15 0.68 1.20 0.00 0.00 173.24 174.98 2i5y s VAL 181 N 0.99 1.68 0.00 4.45 -7.23 0.69 -1.34 120.40 119.66 2i5y s VAL 181 Ca -0.07 -2.06 -0.12 0.00 -1.81 0.00 0.00 61.98 57.92 2i5y s VAL 181 Cb -0.15 -1.91 0.01 0.00 0.56 0.00 0.00 36.38 34.90 2i5y s VAL 181 CO -0.01 -0.50 0.25 0.54 -0.31 0.00 0.00 175.10 175.07 2i5y s VAL 182 N -2.61 0.07 -0.21 1.32 0.11 -0.60 0.18 120.40 118.66 2i5y s VAL 182 Ca 0.18 -0.60 -0.04 0.00 -2.93 0.00 0.00 61.98 58.59 2i5y s VAL 182 Cb -0.03 -0.64 -0.01 0.00 -1.53 0.00 0.00 36.38 34.17 2i5y s VAL 182 CO 0.06 -0.33 -0.03 -0.89 -3.33 0.00 0.00 175.10 170.57 2i5y s THR 183 N -1.63 3.53 0.21 5.04 2.01 -1.18 -1.11 115.64 122.50 2i5y s THR 183 Ca -0.12 -0.45 0.06 0.00 0.31 0.00 0.00 61.69 61.50 2i5y s THR 183 Cb -0.05 -2.60 -0.05 0.00 0.01 0.00 0.00 72.50 69.82 2i5y s THR 183 CO 0.02 0.43 -0.10 0.68 -0.69 0.00 0.00 174.62 174.95 2i5y s VAL 184 N 1.29 1.53 0.11 3.82 -7.23 0.03 -4.85 120.40 115.10 2i5y s VAL 184 Ca 0.04 -2.15 -0.30 0.00 -1.81 0.00 0.00 61.98 57.76 2i5y s VAL 184 Cb -0.14 -2.11 -0.06 0.00 0.56 0.00 0.00 36.38 34.62 2i5y s VAL 184 CO -0.01 -0.54 1.16 -2.16 -0.31 0.00 0.00 175.10 173.24 2i5y s PRO 185 N -3.71 4.50 0.30 4.82 0.04 -1.26 -0.82 135.00 138.88 2i5y s PRO 185 Ca 0.23 1.75 0.06 0.00 0.04 0.00 0.00 61.00 63.08 2i5y s PRO 185 Cb 0.01 -3.32 0.74 0.00 0.04 0.00 0.00 34.50 31.98 2i5y s PRO 185 CO 0.07 -0.12 1.78 0.77 0.04 0.00 0.00 177.00 179.54 2i5y h SER 186 N 6.06 0.79 -0.00 6.66 0.02 -1.12 0.46 113.55 126.42 2i5y h SER 186 Ca -0.43 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 2i5y h SER 186 Cb 1.21 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 63.70 2i5y h SER 186 CO 0.77 0.29 0.00 0.77 -1.14 0.00 0.00 176.83 177.52 2i5y h SER 187 N 0.77 0.00 0.19 3.07 4.64 -1.91 -2.01 113.55 118.30 2i5y h SER 187 Ca 0.57 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.86 2i5y h SER 187 Cb 0.88 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.97 2i5y h SER 187 CO -0.37 0.00 -0.15 0.28 -0.87 0.00 0.00 176.83 175.73 2i5y h SER 188 N 0.00 0.00 -4.26 4.97 0.02 -1.28 -3.44 113.55 109.56 2i5y h SER 188 Ca 0.00 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.44 2i5y h SER 188 Cb 0.01 0.00 0.15 0.00 0.14 0.00 0.00 62.40 62.70 2i5y h SER 188 CO -0.00 0.15 0.28 -0.76 -1.14 0.00 0.00 176.83 175.36 2i5y s LEU 189 N -8.35 2.88 0.00 5.07 1.43 -0.76 -1.47 118.68 117.48 2i5y s LEU 189 Ca -0.04 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 54.96 2i5y s LEU 189 Cb 0.15 -4.47 0.00 0.00 0.03 0.00 0.00 46.19 41.90 2i5y s LEU 189 CO 0.66 -2.45 0.00 0.61 0.23 0.00 0.00 176.35 175.41 2i5y n GLY 190 N -0.74 2.70 0.00 -3.19 0.00 -1.26 -4.53 105.19 98.17 2i5y n GLY 190 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2i5y n GLY 190 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2i5y n THR 191 N -0.15 0.00 -5.26 2.61 5.66 -1.22 -5.05 114.28 110.87 2i5y n THR 191 Ca 0.00 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.69 2i5y n THR 191 Cb 0.00 -0.24 -0.16 0.00 -1.55 0.00 0.00 70.33 68.37 2i5y n THR 191 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 2i5y s GLN 192 N -1.48 2.39 0.14 1.09 -0.21 -0.54 -5.14 119.66 115.91 2i5y s GLN 192 Ca 0.00 -0.90 -0.00 0.00 0.02 0.00 0.00 55.36 54.48 2i5y s GLN 192 Cb 0.00 -2.10 -0.04 0.00 1.00 0.00 0.00 33.01 31.87 2i5y s GLN 192 CO 0.00 0.43 0.32 0.95 -2.12 0.00 0.00 175.29 174.86 2i5y s THR 193 N -0.28 5.27 -0.19 -0.19 -4.23 -1.26 -4.46 115.64 110.30 2i5y s THR 193 Ca 0.00 -0.38 0.01 0.00 -1.18 0.00 0.00 61.69 60.14 2i5y s THR 193 Cb -0.13 -3.69 0.04 0.00 1.34 0.00 0.00 72.50 70.06 2i5y s THR 193 CO 0.02 -0.04 -0.11 -0.31 -0.54 0.00 0.00 174.62 173.64 2i5y s TYR 194 N -1.71 2.42 -0.05 3.99 2.02 -1.26 -4.99 117.35 117.76 2i5y s TYR 194 Ca 0.37 -1.56 0.06 0.00 -0.37 0.00 0.00 57.07 55.57 2i5y s TYR 194 Cb -0.12 -1.65 -0.01 0.00 -0.40 0.00 0.00 41.96 39.78 2i5y s TYR 194 CO 0.28 -0.74 -0.24 0.42 -1.57 0.00 0.00 175.55 173.70 2i5y s ILE 195 N 1.40 1.94 -0.23 2.71 1.01 -1.26 -1.27 121.20 125.48 2i5y s ILE 195 Ca -0.00 -1.01 -0.09 0.00 0.00 0.00 0.00 60.65 59.55 2i5y s ILE 195 Cb -0.16 -1.64 -0.04 0.00 0.01 0.00 0.00 42.46 40.63 2i5y s ILE 195 CO -0.09 0.54 0.12 0.00 0.00 0.00 0.00 174.94 175.52 2i5y s ASN 197 N 1.13 6.22 -0.21 0.00 -0.87 -0.33 -1.70 114.94 119.17 2i5y s ASN 197 Ca 0.06 0.25 -0.02 0.00 -1.57 0.00 0.00 52.86 51.58 2i5y s ASN 197 Cb -0.14 -2.17 0.01 0.00 -0.02 0.00 0.00 41.25 38.93 2i5y s ASN 197 CO 0.04 -0.04 -0.09 -0.69 -2.57 0.00 0.00 177.10 173.75 2i5y s VAL 198 N 1.43 2.87 -0.13 1.60 1.01 0.15 -2.02 120.40 125.31 2i5y s VAL 198 Ca 0.12 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.37 2i5y s VAL 198 Cb -0.15 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.91 2i5y s VAL 198 CO 0.07 0.41 -0.15 0.20 0.00 0.00 0.00 175.10 175.63 2i5y s ASN 199 N 1.39 3.79 -0.39 3.32 -0.87 -0.30 -1.43 114.94 120.45 2i5y s ASN 199 Ca 0.04 -0.40 0.02 0.00 -1.57 0.00 0.00 52.86 50.96 2i5y s ASN 199 Cb -0.14 -1.57 0.12 0.00 -0.02 0.00 0.00 41.25 39.63 2i5y s ASN 199 CO -0.06 0.15 0.16 -2.28 -2.57 0.00 0.00 177.10 172.49 2i5y s HIS 200 N 0.46 2.41 0.40 2.20 2.46 -0.30 -0.58 115.29 122.34 2i5y s HIS 200 Ca -0.11 -2.44 0.06 0.00 0.47 0.00 0.00 55.06 53.05 2i5y s HIS 200 Cb -0.16 -2.16 0.83 0.00 -0.13 0.00 0.00 32.58 30.95 2i5y s HIS 200 CO 0.05 -0.84 2.05 0.87 -2.47 0.00 0.00 174.74 174.40 2i5y h LYS 201 N 7.27 0.58 0.00 2.88 1.57 -1.80 -1.08 116.57 125.99 2i5y h LYS 201 Ca -0.06 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 2i5y h LYS 201 Cb 0.97 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.14 2i5y h LYS 201 CO 0.51 0.39 -0.11 -1.35 -0.57 0.00 0.00 179.45 178.32 2i5y h PRO 202 N 0.60 0.00 -0.27 3.15 0.11 -1.93 -2.59 132.00 131.06 2i5y h PRO 202 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2i5y h PRO 202 Cb -0.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.05 2i5y h PRO 202 CO -0.03 0.11 0.00 -1.13 -0.21 0.00 0.00 178.00 176.73 2i5y n SER 203 N -4.12 2.69 -3.84 -2.05 3.41 -1.04 -4.96 113.62 103.72 2i5y n SER 203 Ca -0.02 -1.89 -0.25 0.00 -0.26 0.00 0.00 58.87 56.45 2i5y n SER 203 Cb 0.19 -0.18 0.01 0.00 -0.26 0.00 0.00 64.21 63.98 2i5y n SER 203 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2i5y n ASN 204 N 0.51 -1.75 -4.63 4.04 5.15 -0.80 -4.95 115.26 112.83 2i5y n ASN 204 Ca 0.10 -0.87 -0.35 0.00 -0.60 0.00 0.00 54.58 52.86 2i5y n ASN 204 Cb 0.39 -3.69 -0.10 0.00 -0.53 0.00 0.00 39.78 35.85 2i5y n ASN 204 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2i5y s THR 205 N -3.66 4.36 -0.29 -0.44 2.01 -0.48 -5.01 115.64 112.14 2i5y s THR 205 Ca 0.17 -0.21 -0.03 0.00 0.31 0.00 0.00 61.69 61.93 2i5y s THR 205 Cb -0.09 -2.89 0.11 0.00 0.01 0.00 0.00 72.50 69.64 2i5y s THR 205 CO 0.84 0.54 0.16 -0.75 -0.69 0.00 0.00 174.62 174.72 2i5y s LYS 206 N -0.27 0.23 -0.11 4.92 2.47 -1.26 -1.14 119.74 124.58 2i5y s LYS 206 Ca 0.06 -0.54 0.03 0.00 -1.56 0.00 0.00 55.97 53.96 2i5y s LYS 206 Cb -0.12 -1.11 0.00 0.00 -1.46 0.00 0.00 37.83 35.14 2i5y s LYS 206 CO 0.02 -1.04 -0.22 0.08 0.16 0.00 0.00 175.35 174.36 2i5y s VAL 207 N 2.06 1.93 -0.14 4.02 1.01 -0.51 -4.99 120.40 123.77 2i5y s VAL 207 Ca 0.10 -0.93 -0.05 0.00 0.00 0.00 0.00 61.98 61.09 2i5y s VAL 207 Cb -0.16 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.49 2i5y s VAL 207 CO -0.34 0.53 0.03 -1.81 0.00 0.00 0.00 175.10 173.52 2i5y s ASP 208 N 0.55 5.44 -0.10 3.32 1.11 -1.26 -0.68 116.67 125.05 2i5y s ASP 208 Ca -0.14 0.10 -0.01 0.00 0.18 0.00 0.00 52.55 52.68 2i5y s ASP 208 Cb -0.17 -1.81 0.03 0.00 1.07 0.00 0.00 42.92 42.04 2i5y s ASP 208 CO 0.05 0.25 -0.05 -0.75 1.18 0.00 0.00 175.17 175.85 2i5y s LYS 209 N -0.11 1.24 0.03 8.23 2.47 -0.69 -4.97 119.74 125.94 2i5y s LYS 209 Ca 0.06 -0.15 -0.27 0.00 -1.56 0.00 0.00 55.97 54.04 2i5y s LYS 209 Cb -0.12 -1.37 -0.04 0.00 -1.46 0.00 0.00 37.83 34.83 2i5y s LYS 209 CO 0.02 -0.26 0.87 0.21 0.16 0.00 0.00 175.35 176.34 2i5y s LYS 210 N 1.71 4.55 -0.27 4.03 2.20 -1.26 -1.48 119.74 129.23 2i5y s LYS 210 Ca 0.04 1.23 -0.05 0.00 -0.36 0.00 0.00 55.97 56.82 2i5y s LYS 210 Cb -0.13 -3.41 0.01 0.00 -1.51 0.00 0.00 37.83 32.79 2i5y s LYS 210 CO -0.07 0.13 0.03 0.08 -0.36 0.00 0.00 175.35 175.16 2i5y s VAL 211 N 0.44 3.68 0.06 4.02 1.01 -0.40 -4.90 120.40 124.31 2i5y s VAL 211 Ca 0.44 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.78 2i5y s VAL 211 Cb -0.21 -2.84 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 2i5y s VAL 211 CO 0.25 0.19 -0.07 -1.83 0.00 0.00 0.00 175.10 173.64 2i5y s GLU 212 N 1.47 0.65 0.18 2.72 -1.05 -1.26 -4.42 118.70 116.99 2i5y s GLU 212 Ca 0.03 -0.97 -0.11 0.00 -0.15 0.00 0.00 54.97 53.77 2i5y s GLU 212 Cb -0.16 -0.27 0.10 0.00 -0.44 0.00 0.00 34.13 33.35 2i5y s GLU 212 CO 0.00 0.03 1.76 -1.35 0.95 0.00 0.00 175.26 176.65 2i5y h PRO 213 N 3.93 0.95 0.00 -4.83 0.11 -1.96 -3.44 132.00 126.75 2i5y h PRO 213 Ca -0.36 -0.15 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2i5y h PRO 213 Cb 1.19 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2i5y h PRO 213 CO 0.49 0.77 0.00 1.17 -0.21 0.00 0.00 178.00 180.23