#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 4.12 0.20 3.84 -7.23 -1.26 -4.25 120.40 115.83 2i5y s VAL 2 Ca 0.00 1.10 0.08 0.00 -1.81 0.00 0.00 61.98 61.35 2i5y s VAL 2 Cb 0.00 -4.63 -0.05 0.00 0.56 0.00 0.00 36.38 32.26 2i5y s VAL 2 CO 0.00 -1.12 -0.16 -1.10 -0.31 0.00 0.00 175.10 172.41 2i5y s GLN 3 N 4.66 1.35 -0.09 4.82 -0.21 -0.93 -4.99 119.66 124.27 2i5y s GLN 3 Ca 0.47 -1.57 0.02 0.00 0.02 0.00 0.00 55.36 54.30 2i5y s GLN 3 Cb -0.07 -1.23 0.01 0.00 1.00 0.00 0.00 33.01 32.72 2i5y s GLN 3 CO 0.30 0.22 -0.14 -0.51 -2.12 0.00 0.00 175.29 173.04 2i5y s LEU 4 N -3.19 1.65 -0.11 2.90 1.43 -1.26 -2.50 118.68 117.60 2i5y s LEU 4 Ca 0.22 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 52.97 2i5y s LEU 4 Cb -0.02 -0.99 0.00 0.00 0.03 0.00 0.00 46.19 45.21 2i5y s LEU 4 CO 0.08 0.01 -0.23 -0.69 0.23 0.00 0.00 176.35 175.75 2i5y s VAL 5 N 0.95 2.02 0.22 -1.59 1.01 -0.49 -4.20 120.40 118.32 2i5y s VAL 5 Ca -0.08 -0.98 0.06 0.00 0.00 0.00 0.00 61.98 60.97 2i5y s VAL 5 Cb -0.15 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 2i5y s VAL 5 CO -0.00 0.55 0.21 -1.61 0.00 0.00 0.00 175.10 174.24 2i5y s GLU 6 N 0.52 3.02 0.80 2.72 2.02 -1.26 -0.57 118.70 125.94 2i5y s GLU 6 Ca -0.15 -0.94 -0.11 0.00 0.02 0.00 0.00 54.97 53.80 2i5y s GLU 6 Cb -0.17 -2.66 0.07 0.00 0.10 0.00 0.00 34.13 31.48 2i5y s GLU 6 CO 0.05 0.43 1.09 -1.54 0.02 0.00 0.00 175.26 175.32 2i5y s SER 7 N -3.63 4.29 1.22 -0.19 1.04 -0.95 -4.98 113.70 110.51 2i5y s SER 7 Ca 0.33 1.73 -0.14 0.00 0.48 0.00 0.00 55.95 58.35 2i5y s SER 7 Cb -0.09 -2.43 0.31 0.00 0.10 0.00 0.00 66.02 63.91 2i5y s SER 7 CO 0.25 -2.15 1.01 -0.83 0.98 0.00 0.00 173.24 172.49 2i5y s GLY 8 N -3.42 1.52 0.63 7.32 0.00 -1.26 -4.70 107.32 107.41 2i5y s GLY 8 Ca 0.62 -0.20 -0.18 0.00 0.00 0.00 0.00 44.72 44.96 2i5y s GLY 8 CO 0.56 0.58 1.06 0.00 0.00 0.00 0.00 173.10 175.30 2i5y n ALA 9 N -5.11 0.44 -2.77 3.20 0.00 -1.26 -4.77 120.51 110.24 2i5y n ALA 9 Ca 0.03 -0.02 -0.16 0.00 0.00 0.00 0.00 53.44 53.29 2i5y n ALA 9 Cb 0.54 -2.18 -0.12 0.00 0.00 0.00 0.00 19.45 17.70 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 -3.01 0.69 -0.09 0.00 0.41 0.36 -4.98 118.70 112.08 2i5y s GLU 10 Ca 0.78 -0.82 0.01 0.00 -0.41 0.00 0.00 54.97 54.53 2i5y s GLU 10 Cb -0.40 -0.59 0.02 0.00 -1.78 0.00 0.00 34.13 31.38 2i5y s GLU 10 CO 0.45 0.13 -0.12 0.08 -0.49 0.00 0.00 175.26 175.31 2i5y s VAL 11 N -1.24 1.21 0.21 2.63 1.01 -1.26 -0.99 120.40 121.97 2i5y s VAL 11 Ca -0.05 -0.46 0.04 0.00 0.00 0.00 0.00 61.98 61.51 2i5y s VAL 11 Cb -0.10 -1.14 -0.05 0.00 0.00 0.00 0.00 36.38 35.10 2i5y s VAL 11 CO 0.01 0.38 -0.05 -0.54 0.00 0.00 0.00 175.10 174.91 2i5y s LYS 12 N 1.11 1.29 0.12 2.72 -0.14 0.53 -4.96 119.74 120.40 2i5y s LYS 12 Ca -0.06 -1.62 0.02 0.00 -1.36 0.00 0.00 55.97 52.95 2i5y s LYS 12 Cb -0.14 -0.71 -0.04 0.00 -1.68 0.00 0.00 37.83 35.26 2i5y s LYS 12 CO -0.02 -0.02 0.24 0.15 -0.76 0.00 0.00 175.35 174.94 2i5y s LYS 13 N -3.80 3.36 0.51 1.68 1.02 -1.26 -0.78 119.74 120.47 2i5y s LYS 13 Ca 0.25 -0.59 -0.22 0.00 0.02 0.00 0.00 55.97 55.43 2i5y s LYS 13 Cb 0.04 -2.94 -0.07 0.00 -0.52 0.00 0.00 37.83 34.34 2i5y s LYS 13 CO 0.07 0.54 1.13 -2.30 -0.92 0.00 0.00 175.35 173.87 2i5y n PRO 14 N -0.25 1.40 0.00 -1.68 -0.02 -1.26 -2.22 135.00 130.96 2i5y n PRO 14 Ca -0.07 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2i5y n PRO 14 Cb 0.53 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 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 1.04 2.34 3.76 -1.23 0.00 0.04 -4.92 105.19 106.21 2i5y n GLY 15 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 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 0.51 -4.21 1.61 3.41 -0.94 -4.22 113.62 109.79 2i5y n SER 16 Ca 0.00 -1.69 -0.17 0.00 -0.26 0.00 0.00 58.87 56.75 2i5y n SER 16 Cb 0.00 -0.87 -0.11 0.00 -0.26 0.00 0.00 64.21 62.97 2i5y n SER 16 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2i5y s SER 17 N -5.46 1.79 0.05 4.04 1.04 -1.26 -1.48 113.70 112.42 2i5y s SER 17 Ca 0.70 -0.75 0.04 0.00 0.48 0.00 0.00 55.95 56.42 2i5y s SER 17 Cb -0.03 -0.05 -0.03 0.00 0.10 0.00 0.00 66.02 66.02 2i5y s SER 17 CO 0.48 -0.15 -0.11 0.54 0.98 0.00 0.00 173.24 174.99 2i5y s VAL 18 N -1.93 0.80 -0.21 5.02 0.11 -0.75 -5.01 120.40 118.43 2i5y s VAL 18 Ca 0.05 -1.13 -0.00 0.00 -2.93 0.00 0.00 61.98 57.97 2i5y s VAL 18 Cb -0.06 -0.81 0.05 0.00 -1.53 0.00 0.00 36.38 34.04 2i5y s VAL 18 CO 0.02 -0.27 -0.03 -0.75 -3.33 0.00 0.00 175.10 170.73 2i5y s LYS 19 N -1.55 1.36 -0.05 1.54 2.20 -1.26 -1.93 119.74 120.04 2i5y s LYS 19 Ca -0.06 -0.73 -0.14 0.00 -0.36 0.00 0.00 55.97 54.68 2i5y s LYS 19 Cb -0.10 -2.33 -0.05 0.00 -1.51 0.00 0.00 37.83 33.85 2i5y s LYS 19 CO 0.01 -0.56 0.36 0.08 -0.36 0.00 0.00 175.35 174.88 2i5y s VAL 20 N 1.56 5.15 0.16 4.02 1.01 -0.35 -4.90 120.40 127.05 2i5y s VAL 20 Ca -0.03 0.72 0.07 0.00 0.00 0.00 0.00 61.98 62.74 2i5y s VAL 20 Cb -0.17 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 2i5y s VAL 20 CO -0.07 0.54 0.01 -0.94 0.00 0.00 0.00 175.10 174.64 2i5y s SER 21 N -0.71 4.87 -0.23 3.32 1.04 -1.26 -0.66 113.70 120.07 2i5y s SER 21 Ca 0.22 -0.33 -0.04 0.00 0.48 0.00 0.00 55.95 56.27 2i5y s SER 21 Cb -0.15 -1.08 0.08 0.00 0.10 0.00 0.00 66.02 64.97 2i5y s SER 21 CO 0.10 0.10 0.10 0.00 0.98 0.00 0.00 173.24 174.53 2i5y s LYS 23 N 2.04 4.27 -0.11 0.00 2.36 0.26 -0.58 119.74 127.97 2i5y s LYS 23 Ca 0.05 0.75 -0.02 0.00 -2.55 0.00 0.00 55.97 54.20 2i5y s LYS 23 Cb -0.16 -3.56 -0.03 0.00 -1.05 0.00 0.00 37.83 33.03 2i5y s LYS 23 CO -0.22 -0.21 -0.03 0.00 1.55 0.00 0.00 175.35 176.44 2i5y s ALA 24 N 1.79 3.11 0.06 3.13 0.00 -0.49 -1.39 121.76 127.97 2i5y s ALA 24 Ca 0.32 -0.83 -0.04 0.00 0.00 0.00 0.00 51.96 51.42 2i5y s ALA 24 Cb -0.16 -1.48 -0.02 0.00 0.00 0.00 0.00 23.12 21.46 2i5y s ALA 24 CO 0.12 0.41 0.06 -1.54 0.00 0.00 0.00 175.76 174.81 2i5y s SER 25 N -0.30 0.34 0.00 0.00 1.04 -1.04 -4.83 113.70 108.90 2i5y s SER 25 Ca 0.05 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.64 2i5y s SER 25 Cb -0.12 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.25 2i5y s SER 25 CO 0.02 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.21 2i5y n GLY 26 N 0.10 2.34 3.82 7.32 0.00 -1.26 -2.18 105.19 115.34 2i5y n GLY 26 Ca -0.15 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.60 -0.03 -0.28 1.61 3.68 -1.26 -4.62 116.67 114.17 2i5y s ASP 27 Ca 0.00 -0.98 -0.28 0.00 2.13 0.00 0.00 52.55 53.41 2i5y s ASP 27 Cb 0.00 0.77 -0.03 0.00 -1.45 0.00 0.00 42.92 42.21 2i5y s ASP 27 CO 0.00 -1.51 1.89 -0.89 0.13 0.00 0.00 175.17 174.79 2i5y s THR 28 N -2.50 3.37 0.14 1.71 2.01 -1.26 -4.88 115.64 114.23 2i5y s THR 28 Ca 0.16 0.38 -0.27 0.00 0.31 0.00 0.00 61.69 62.27 2i5y s THR 28 Cb -0.05 -3.48 -0.02 0.00 0.01 0.00 0.00 72.50 68.96 2i5y s THR 28 CO 0.10 -0.29 1.59 0.15 -0.69 0.00 0.00 174.62 175.48 2i5y h PHE 29 N 13.17 -1.05 0.00 4.92 3.57 -1.96 -0.53 116.94 135.06 2i5y h PHE 29 Ca -0.36 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.19 2i5y h PHE 29 Cb 1.19 0.49 0.00 0.00 2.79 0.00 0.00 35.95 40.42 2i5y h PHE 29 CO 0.95 -0.43 0.03 0.44 -2.23 0.00 0.00 178.31 177.07 2i5y n ILE 30 N -5.42 1.24 0.08 1.41 -5.35 -1.26 -1.21 119.36 108.85 2i5y n ILE 30 Ca -0.03 0.34 0.08 0.00 -0.27 0.00 0.00 62.75 62.88 2i5y n ILE 30 Cb 0.35 -1.34 0.26 0.00 -1.74 0.00 0.00 39.64 37.17 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 -1.30 2.60 -4.20 6.28 1.74 -0.21 -4.06 116.66 117.52 2i5y n ARG 31 Ca 0.00 -2.11 -0.18 0.00 -0.77 0.00 0.00 57.85 54.79 2i5y n ARG 31 Cb 0.03 -1.55 -0.11 0.00 -1.02 0.00 0.00 32.46 29.80 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 -1.43 1.27 0.00 -1.55 1.51 -0.35 -0.16 117.35 116.64 2i5y s TYR 32 Ca 0.39 -0.52 0.03 0.00 -1.01 0.00 0.00 57.07 55.96 2i5y s TYR 32 Cb 0.22 -0.69 -0.03 0.00 -0.11 0.00 0.00 41.96 41.34 2i5y s TYR 32 CO 0.24 0.08 -0.08 -1.54 -1.11 0.00 0.00 175.55 173.14 2i5y s SER 33 N -2.10 4.55 0.07 2.29 1.04 -0.72 -4.15 113.70 114.67 2i5y s SER 33 Ca 0.03 -0.17 0.09 0.00 0.48 0.00 0.00 55.95 56.39 2i5y s SER 33 Cb -0.07 -1.04 -0.03 0.00 0.10 0.00 0.00 66.02 64.98 2i5y s SER 33 CO 0.02 0.28 -0.25 -0.36 0.98 0.00 0.00 173.24 173.92 2i5y s PHE 34 N -0.98 2.16 0.10 5.02 0.40 -0.91 -1.85 117.98 121.93 2i5y s PHE 34 Ca 0.17 -0.40 0.06 0.00 -0.60 0.00 0.00 56.93 56.16 2i5y s PHE 34 Cb -0.11 -1.26 -0.03 0.00 0.51 0.00 0.00 43.02 42.13 2i5y s PHE 34 CO 0.07 0.18 -0.16 0.99 0.70 0.00 0.00 175.22 177.00 2i5y s THR 35 N -0.89 1.34 -0.12 0.64 2.01 0.30 -0.34 115.64 118.58 2i5y s THR 35 Ca 0.11 -1.53 0.02 0.00 0.31 0.00 0.00 61.69 60.60 2i5y s THR 35 Cb -0.10 -1.37 -0.00 0.00 0.01 0.00 0.00 72.50 71.04 2i5y s THR 35 CO 0.03 -0.27 -0.19 0.26 -0.69 0.00 0.00 174.62 173.76 2i5y s TRP 36 N -1.62 2.67 -0.02 4.92 0.52 -0.76 0.23 118.94 124.88 2i5y s TRP 36 Ca 0.04 -0.92 0.06 0.00 0.02 0.00 0.00 56.10 55.30 2i5y s TRP 36 Cb -0.08 -1.78 -0.01 0.00 -1.15 0.00 0.00 33.47 30.45 2i5y s TRP 36 CO 0.03 -0.36 -0.20 0.08 0.02 0.00 0.00 176.95 176.52 2i5y s VAL 37 N 0.41 1.58 0.26 4.03 1.01 0.27 -1.35 120.40 126.62 2i5y s VAL 37 Ca -0.14 -0.84 0.11 0.00 0.00 0.00 0.00 61.98 61.11 2i5y s VAL 37 Cb -0.17 -1.33 -0.05 0.00 0.00 0.00 0.00 36.38 34.84 2i5y s VAL 37 CO 0.06 0.45 -0.18 0.00 0.00 0.00 0.00 175.10 175.44 2i5y s ARG 38 N -0.35 1.76 -0.22 2.72 1.70 -0.48 0.24 118.95 124.33 2i5y s ARG 38 Ca 0.05 -1.67 -0.03 0.00 -0.47 0.00 0.00 55.73 53.60 2i5y s ARG 38 Cb -0.09 -1.85 0.11 0.00 -0.57 0.00 0.00 34.95 32.55 2i5y s ARG 38 CO 0.00 0.35 0.30 -1.14 -1.08 0.00 0.00 175.30 173.73 2i5y s GLN 39 N -3.39 0.26 0.63 3.89 0.74 -0.10 -0.80 119.66 120.88 2i5y s GLN 39 Ca 0.29 0.39 -0.15 0.00 0.05 0.00 0.00 55.36 55.94 2i5y s GLN 39 Cb -0.06 -0.81 -0.02 0.00 1.10 0.00 0.00 33.01 33.22 2i5y s GLN 39 CO 0.15 -0.63 1.06 0.00 -0.55 0.00 0.00 175.29 175.33 2i5y s ALA 40 N 2.43 2.68 0.01 1.58 0.00 -1.26 -1.34 121.76 125.87 2i5y s ALA 40 Ca 0.09 0.35 -0.35 0.00 0.00 0.00 0.00 51.96 52.05 2i5y s ALA 40 Cb -0.15 -3.23 -0.14 0.00 0.00 0.00 0.00 23.12 19.59 2i5y s ALA 40 CO -0.14 -0.97 1.64 -0.35 0.00 0.00 0.00 175.76 175.94 2i5y n PRO 41 N -2.33 1.81 -0.88 0.00 -0.04 -1.26 -1.14 135.00 131.16 2i5y n PRO 41 Ca 0.09 0.66 0.00 0.00 -0.04 0.00 0.00 63.50 64.21 2i5y n PRO 41 Cb 0.53 -2.41 0.00 0.00 -0.04 0.00 0.00 33.50 31.58 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 3.62 0.55 3.06 0.55 0.00 -1.26 -5.01 105.19 106.70 2i5y n GLY 42 Ca 0.20 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.88 0.80 -0.63 1.61 1.13 -0.29 -5.14 117.38 112.98 2i5y n GLN 43 Ca 0.00 -2.68 -0.05 0.00 -1.94 0.00 0.00 57.00 52.33 2i5y n GLN 43 Cb 0.05 0.17 0.03 0.00 0.11 0.00 0.00 30.24 30.61 2i5y n GLN 43 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2i5y n GLY 44 N -0.38 -0.36 3.84 1.08 0.00 -1.26 -4.68 105.19 103.42 2i5y n GLY 44 Ca 0.02 -1.80 -0.34 0.00 0.00 0.00 0.00 46.02 43.89 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 4.25 -0.06 0.99 1.43 -1.26 -4.29 118.68 119.73 2i5y s LEU 45 Ca 0.13 1.25 0.01 0.00 -1.03 0.00 0.00 54.13 54.50 2i5y s LEU 45 Cb -0.01 -3.66 0.02 0.00 0.03 0.00 0.00 46.19 42.57 2i5y s LEU 45 CO 0.09 -0.03 -0.06 -1.61 0.23 0.00 0.00 176.35 174.97 2i5y s GLU 46 N -2.34 1.08 -0.04 1.70 2.02 0.02 -4.97 118.70 116.17 2i5y s GLU 46 Ca 0.45 -0.17 -0.30 0.00 0.02 0.00 0.00 54.97 54.97 2i5y s GLU 46 Cb -0.14 -1.06 -0.03 0.00 0.10 0.00 0.00 34.13 33.00 2i5y s GLU 46 CO 0.20 -0.10 1.18 -0.46 0.02 0.00 0.00 175.26 176.10 2i5y s TRP 47 N 1.04 3.26 -0.25 1.61 -0.00 -1.26 -1.38 118.94 121.96 2i5y s TRP 47 Ca -0.09 1.26 -0.14 0.00 -0.00 0.00 0.00 56.10 57.14 2i5y s TRP 47 Cb -0.14 -3.40 -0.11 0.00 -0.00 0.00 0.00 33.47 29.82 2i5y s TRP 47 CO -0.00 -1.20 -0.34 -1.33 -0.00 0.00 0.00 176.95 174.07 2i5y n MET 48 N 4.97 0.55 -3.70 5.86 2.81 -0.46 -4.68 117.12 122.48 2i5y n MET 48 Ca 0.10 0.24 0.02 0.00 -1.81 0.00 0.00 57.70 56.25 2i5y n MET 48 Cb 0.47 -1.44 -0.00 0.00 -0.71 0.00 0.00 33.22 31.54 2i5y n MET 48 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2i5y s GLY 49 N -5.39 -0.34 -0.07 3.03 0.00 -1.21 -0.70 107.32 102.64 2i5y s GLY 49 Ca -0.36 0.53 -0.06 0.00 0.00 0.00 0.00 44.72 44.83 2i5y s GLY 49 CO 0.46 1.20 0.18 -1.60 0.00 0.00 0.00 173.10 173.34 2i5y s ARG 50 N -2.36 0.19 -0.11 2.90 3.52 -0.49 -1.82 118.95 120.77 2i5y s ARG 50 Ca 0.17 0.28 0.00 0.00 -0.13 0.00 0.00 55.73 56.06 2i5y s ARG 50 Cb 0.04 0.04 -0.02 0.00 -1.56 0.00 0.00 34.95 33.45 2i5y s ARG 50 CO -0.03 -0.06 -0.13 -1.50 -0.81 0.00 0.00 175.30 172.78 2i5y s ILE 51 N 0.34 3.10 -0.90 4.11 2.07 0.54 -1.09 121.20 129.37 2i5y s ILE 51 Ca -0.02 -0.66 -0.18 0.00 -1.41 0.00 0.00 60.65 58.39 2i5y s ILE 51 Cb -0.03 -2.29 0.15 0.00 0.13 0.00 0.00 42.46 40.42 2i5y s ILE 51 CO -0.01 0.54 1.03 -0.63 -1.91 0.00 0.00 174.94 173.96 2i5y s ILE 52 N 0.13 4.94 0.00 2.00 1.01 0.75 -2.14 121.20 127.89 2i5y s ILE 52 Ca -0.06 -1.77 0.00 0.00 0.00 0.00 0.00 60.65 58.82 2i5y s ILE 52 Cb -0.15 -4.70 0.00 0.00 0.01 0.00 0.00 42.46 37.62 2i5y s ILE 52 CO 0.05 -1.39 0.87 0.41 0.00 0.00 0.00 174.94 174.88 2i5y n THR 52 N 5.13 0.00 -0.32 2.92 -1.04 -1.26 0.14 114.28 119.85 2i5y n THR 52 Ca 0.21 1.34 0.21 0.00 -2.04 0.00 0.00 64.05 63.78 2i5y n THR 52 Cb 0.48 -1.81 0.43 0.00 -1.82 0.00 0.00 70.33 67.61 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 0.21 0.00 12.58 6.09 -1.83 0.62 117.51 135.18 2i5y h ILE 53 Ca 0.00 -0.07 -0.01 0.00 -1.37 0.00 0.00 64.86 63.41 2i5y h ILE 53 Cb 0.00 0.00 -0.00 0.00 0.47 0.00 0.00 36.82 37.29 2i5y h ILE 53 CO 0.00 0.04 -0.66 -0.07 -3.07 0.00 0.00 178.15 174.38 2i5y h LEU 54 N 0.19 0.00 -1.35 2.19 4.07 -1.66 -3.48 115.31 115.28 2i5y h LEU 54 Ca 0.69 0.00 -0.35 0.00 0.08 0.00 0.00 57.88 58.30 2i5y h LEU 54 Cb 1.58 0.00 0.16 0.00 1.08 0.00 0.00 40.66 43.48 2i5y h LEU 54 CO -0.69 0.05 -0.72 -0.67 -1.08 0.00 0.00 178.44 175.33 2i5y n ASP 55 N -2.85 -3.70 -4.09 -0.43 -0.08 0.37 -5.01 116.55 100.75 2i5y n ASP 55 Ca 0.01 -0.58 -0.27 0.00 -1.51 0.00 0.00 54.79 52.44 2i5y n ASP 55 Cb 0.57 -5.02 -0.17 0.00 2.34 0.00 0.00 41.12 38.84 2i5y n ASP 55 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2i5y s VAL 56 N -3.34 1.47 0.04 5.18 1.01 -1.08 -4.97 120.40 118.71 2i5y s VAL 56 Ca 0.22 -0.67 0.08 0.00 0.00 0.00 0.00 61.98 61.61 2i5y s VAL 56 Cb -0.10 -1.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 2i5y s VAL 56 CO 0.72 0.43 -0.23 0.00 0.00 0.00 0.00 175.10 176.01 2i5y s ALA 57 N 0.57 2.37 0.06 5.51 0.00 -1.26 -0.18 121.76 128.83 2i5y s ALA 57 Ca -0.16 -1.23 0.08 0.00 0.00 0.00 0.00 51.96 50.66 2i5y s ALA 57 Cb -0.17 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.35 2i5y s ALA 57 CO 0.05 0.55 -0.20 -1.01 0.00 0.00 0.00 175.76 175.14 2i5y s HIS 58 N -0.83 2.49 0.34 0.00 3.76 -0.25 -4.98 115.29 115.82 2i5y s HIS 58 Ca 0.12 -0.30 0.05 0.00 -0.15 0.00 0.00 55.06 54.79 2i5y s HIS 58 Cb -0.10 -1.41 -0.07 0.00 1.11 0.00 0.00 32.58 32.11 2i5y s HIS 58 CO 0.03 0.26 0.02 0.71 -0.85 0.00 0.00 174.74 174.90 2i5y s TYR 59 N -0.95 2.13 0.41 1.40 1.51 -1.26 -1.39 117.35 119.20 2i5y s TYR 59 Ca 0.15 -0.82 -0.22 0.00 -1.01 0.00 0.00 57.07 55.17 2i5y s TYR 59 Cb -0.10 -1.39 -0.11 0.00 -0.11 0.00 0.00 41.96 40.25 2i5y s TYR 59 CO 0.05 0.20 0.95 0.00 -1.11 0.00 0.00 175.55 175.64 2i5y s ALA 60 N -3.06 3.07 0.00 3.71 0.00 0.12 -4.94 121.76 120.66 2i5y s ALA 60 Ca 0.35 0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.72 2i5y s ALA 60 Cb 0.08 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 20.05 2i5y s ALA 60 CO 0.16 0.14 0.12 -2.30 0.00 0.00 0.00 175.76 173.88 2i5y n PRO 61 N -0.45 0.00 0.00 0.00 -0.02 -1.26 -3.87 135.00 129.40 2i5y n PRO 61 Ca 0.06 0.09 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 2i5y n PRO 61 Cb 0.53 -0.62 0.00 0.00 -0.02 0.00 0.00 33.50 33.39 2i5y n PRO 61 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2i5y n HIS 62 N -0.22 0.00 -0.02 6.00 8.25 -1.26 -3.50 115.22 124.48 2i5y n HIS 62 Ca 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.47 2i5y n HIS 62 Cb 0.00 -0.28 -0.07 0.00 1.12 0.00 0.00 29.99 30.76 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 2.29 0.00 -3.84 2.41 4.77 -1.25 -5.04 117.00 116.34 2i5y n LEU 63 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.63 2i5y n LEU 63 Cb 0.00 0.08 0.02 0.00 -2.33 0.00 0.00 43.42 41.19 2i5y n LEU 63 CO 0.12 0.08 -0.13 0.00 -1.33 0.00 0.00 177.39 176.13 2i5y n GLN 64 N -2.00 -0.88 -2.07 3.23 10.64 -1.23 -2.15 117.38 122.93 2i5y n GLN 64 Ca -0.06 0.42 -0.03 0.00 -1.83 0.00 0.00 57.00 55.50 2i5y n GLN 64 Cb 0.43 -3.10 -0.01 0.00 -0.86 0.00 0.00 30.24 26.71 2i5y n GLN 64 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2i5y n GLY 65 N -1.86 -0.25 0.50 2.61 0.00 -1.26 -4.74 105.19 100.19 2i5y n GLY 65 Ca -0.15 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.18 1.55 -4.44 1.61 1.74 -0.91 -4.87 116.66 109.17 2i5y n ARG 66 Ca -0.04 -1.01 -0.20 0.00 -0.77 0.00 0.00 57.85 55.82 2i5y n ARG 66 Cb 0.41 -1.48 -0.14 0.00 -1.02 0.00 0.00 32.46 30.23 2i5y n ARG 66 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2i5y s VAL 67 N -2.15 1.05 -0.03 1.55 0.11 -1.26 0.10 120.40 119.77 2i5y s VAL 67 Ca 0.32 -0.81 -0.01 0.00 -2.93 0.00 0.00 61.98 58.55 2i5y s VAL 67 Cb 0.20 -0.93 0.03 0.00 -1.53 0.00 0.00 36.38 34.16 2i5y s VAL 67 CO 0.39 0.11 0.06 -0.89 -3.33 0.00 0.00 175.10 171.44 2i5y s THR 68 N -0.63 -0.06 -0.16 5.04 2.01 0.57 -4.98 115.64 117.42 2i5y s THR 68 Ca 0.03 0.22 -0.02 0.00 0.31 0.00 0.00 61.69 62.23 2i5y s THR 68 Cb -0.07 -0.13 -0.01 0.00 0.01 0.00 0.00 72.50 72.30 2i5y s THR 68 CO 0.01 0.09 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.31 2i5y s ILE 69 N 1.17 3.32 0.22 1.82 1.01 -1.26 0.15 121.20 127.63 2i5y s ILE 69 Ca -0.08 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.05 2i5y s ILE 69 Cb -0.13 -2.45 -0.05 0.00 0.01 0.00 0.00 42.46 39.85 2i5y s ILE 69 CO -0.04 0.49 0.02 0.42 0.00 0.00 0.00 174.94 175.83 2i5y s THR 70 N 0.72 0.79 0.02 2.92 -4.23 -0.92 -4.80 115.64 110.15 2i5y s THR 70 Ca -0.04 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.49 2i5y s THR 70 Cb -0.15 -2.33 -0.01 0.00 1.34 0.00 0.00 72.50 71.35 2i5y s THR 70 CO 0.02 -0.31 -0.08 0.00 -0.54 0.00 0.00 174.62 173.71 2i5y s ALA 71 N -3.59 0.65 -0.39 3.99 0.00 -1.26 -0.85 121.76 120.31 2i5y s ALA 71 Ca 0.29 -0.53 0.01 0.00 0.00 0.00 0.00 51.96 51.73 2i5y s ALA 71 Cb 0.06 -0.08 0.11 0.00 0.00 0.00 0.00 23.12 23.21 2i5y s ALA 71 CO 0.08 0.09 0.14 0.34 0.00 0.00 0.00 175.76 176.41 2i5y s ASP 72 N -0.79 4.93 0.38 0.00 2.15 0.75 -4.98 116.67 119.10 2i5y s ASP 72 Ca -0.02 -2.20 0.08 0.00 0.43 0.00 0.00 52.55 50.84 2i5y s ASP 72 Cb -0.06 -1.71 0.83 0.00 -0.30 0.00 0.00 42.92 41.68 2i5y s ASP 72 CO 0.00 -0.43 1.95 0.11 -0.17 0.00 0.00 175.17 176.63 2i5y h LYS 73 N 7.67 0.64 0.34 4.34 1.57 -1.96 0.25 116.57 129.42 2i5y h LYS 73 Ca -0.07 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2i5y h LYS 73 Cb 1.02 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.17 2i5y h LYS 73 CO 0.60 0.42 -0.29 0.77 -0.57 0.00 0.00 179.45 180.39 2i5y h SER 74 N 0.66 -0.75 -0.09 0.86 0.02 -1.96 -2.77 113.55 109.52 2i5y h SER 74 Ca 0.33 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 2i5y h SER 74 Cb 0.41 0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.20 2i5y h SER 74 CO -0.11 -0.42 0.00 0.35 -1.14 0.00 0.00 176.83 175.50 2i5y n THR 75 N -5.41 0.10 -3.72 -2.27 -2.24 -1.09 -4.94 114.28 94.72 2i5y n THR 75 Ca -0.10 -0.37 -0.22 0.00 -2.27 0.00 0.00 64.05 61.10 2i5y n THR 75 Cb 0.31 0.69 0.03 0.00 -2.10 0.00 0.00 70.33 69.26 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 0.54 -1.18 -4.16 3.42 2.88 0.83 -4.71 113.62 111.24 2i5y n SER 76 Ca 0.17 -0.85 -0.23 0.00 -1.33 0.00 0.00 58.87 56.64 2i5y n SER 76 Cb 0.42 -3.93 -0.15 0.00 -0.75 0.00 0.00 64.21 59.79 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 -3.70 1.29 -0.03 2.46 2.01 -0.82 -1.40 115.64 115.45 2i5y s THR 77 Ca 0.02 -0.85 0.02 0.00 0.31 0.00 0.00 61.69 61.18 2i5y s THR 77 Cb -0.00 -1.11 -0.03 0.00 0.01 0.00 0.00 72.50 71.37 2i5y s THR 77 CO 0.82 0.24 -0.05 -0.69 -0.69 0.00 0.00 174.62 174.25 2i5y s VAL 78 N -0.57 3.79 0.07 3.82 1.01 0.25 -0.18 120.40 128.59 2i5y s VAL 78 Ca 0.05 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.49 2i5y s VAL 78 Cb -0.07 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.67 2i5y s VAL 78 CO 0.00 0.48 -0.17 -0.31 0.00 0.00 0.00 175.10 175.10 2i5y s TYR 79 N -0.93 1.45 -0.18 5.22 2.02 -0.03 0.70 117.35 125.59 2i5y s TYR 79 Ca 0.15 -0.41 0.01 0.00 -0.37 0.00 0.00 57.07 56.46 2i5y s TYR 79 Cb -0.11 -0.83 0.03 0.00 -0.40 0.00 0.00 41.96 40.65 2i5y s TYR 79 CO 0.05 0.09 -0.14 -1.17 -1.57 0.00 0.00 175.55 172.81 2i5y s LEU 80 N -1.54 2.13 -0.17 -1.29 0.20 0.17 -2.15 118.68 116.02 2i5y s LEU 80 Ca 0.02 -0.73 -0.04 0.00 0.69 0.00 0.00 54.13 54.08 2i5y s LEU 80 Cb -0.09 -1.31 -0.03 0.00 -0.43 0.00 0.00 46.19 44.33 2i5y s LEU 80 CO 0.02 -0.08 -0.02 -0.70 -0.29 0.00 0.00 176.35 175.28 2i5y s GLU 81 N 1.37 3.64 -0.11 1.98 2.12 0.12 -1.21 118.70 126.61 2i5y s GLU 81 Ca 0.02 -0.53 0.02 0.00 0.36 0.00 0.00 54.97 54.84 2i5y s GLU 81 Cb -0.14 -2.98 0.01 0.00 0.26 0.00 0.00 34.13 31.28 2i5y s GLU 81 CO -0.10 0.14 -0.17 -1.17 -0.54 0.00 0.00 175.26 173.41 2i5y s LEU 82 N 0.65 1.83 0.36 2.70 2.96 -0.81 -0.32 118.68 126.04 2i5y s LEU 82 Ca -0.02 -0.47 0.08 0.00 -0.22 0.00 0.00 54.13 53.50 2i5y s LEU 82 Cb -0.14 -1.18 -0.03 0.00 0.50 0.00 0.00 46.19 45.33 2i5y s LEU 82 CO 0.02 0.04 0.25 -0.13 -1.32 0.00 0.00 176.35 175.21 2i5y s ARG 82 N 0.90 2.54 -1.47 1.98 0.52 0.28 -1.81 118.95 121.89 2i5y s ARG 82 Ca -0.08 -1.46 -0.05 0.00 -0.52 0.00 0.00 55.73 53.62 2i5y s ARG 82 Cb -0.15 -2.32 0.01 0.00 0.52 0.00 0.00 34.95 33.00 2i5y s ARG 82 CO -0.01 0.04 0.19 -1.71 0.02 0.00 0.00 175.30 173.83 2i5y n ASN 82 N -1.31 -0.11 -4.66 0.23 5.15 -1.11 -4.81 115.26 108.64 2i5y n ASN 82 Ca -0.01 -1.22 -0.43 0.00 -0.60 0.00 0.00 54.58 52.31 2i5y n ASN 82 Cb 0.61 -1.93 -0.01 0.00 -0.53 0.00 0.00 39.78 37.92 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 -4.61 2.88 -4.61 1.20 4.77 -0.55 -4.52 117.00 111.57 2i5y n LEU 82 Ca -0.29 1.20 -0.24 0.00 -0.03 0.00 0.00 56.01 56.64 2i5y n LEU 82 Cb 0.68 -1.41 -0.08 0.00 -2.33 0.00 0.00 43.42 40.28 2i5y n LEU 82 CO 0.81 -0.82 -0.37 -0.13 -1.33 0.00 0.00 177.39 175.55 2i5y s ARG 83 N -1.70 2.16 0.51 3.23 0.52 -1.26 -0.78 118.95 121.63 2i5y s ARG 83 Ca 0.57 -1.41 0.15 0.00 -0.52 0.00 0.00 55.73 54.52 2i5y s ARG 83 Cb -0.62 -2.12 1.23 0.00 0.52 0.00 0.00 34.95 33.95 2i5y s ARG 83 CO 0.61 0.38 2.13 0.66 0.02 0.00 0.00 175.30 179.11 2i5y h SER 84 N 2.22 0.05 -0.09 0.23 4.64 -1.96 0.14 113.55 118.78 2i5y h SER 84 Ca -0.44 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.86 2i5y h SER 84 Cb 1.24 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 2i5y h SER 84 CO 0.59 0.04 0.01 -0.90 -0.87 0.00 0.00 176.83 175.70 2i5y n ASP 85 N -4.53 1.89 -0.00 4.97 5.75 -1.26 -2.06 116.55 121.31 2i5y n ASP 85 Ca -0.02 -2.15 0.10 0.00 -0.01 0.00 0.00 54.79 52.71 2i5y n ASP 85 Cb 0.10 -0.53 -0.13 0.00 -1.03 0.00 0.00 41.12 39.53 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 0.11 0.70 -4.67 -1.12 10.43 0.48 -4.93 116.55 117.54 2i5y n ASP 86 Ca 0.05 -0.69 -0.47 0.00 2.57 0.00 0.00 54.79 56.25 2i5y n ASP 86 Cb 0.43 1.29 -0.04 0.00 1.84 0.00 0.00 41.12 44.64 2i5y n ASP 86 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54 2i5y n THR 87 N -1.73 0.27 0.00 -3.53 -1.04 -0.88 -4.88 114.28 102.50 2i5y n THR 87 Ca 0.02 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 2i5y n THR 87 Cb 0.40 -1.71 0.00 0.00 -1.82 0.00 0.00 70.33 67.20 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 4.93 0.00 -2.71 2.41 0.00 -0.42 -4.47 120.51 120.25 2i5y n ALA 88 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.27 2i5y n ALA 88 Cb 0.29 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.68 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 5.28 -0.17 0.00 1.01 -0.45 -1.01 120.40 123.06 2i5y s VAL 89 Ca 0.00 0.58 -0.04 0.00 0.00 0.00 0.00 61.98 62.51 2i5y s VAL 89 Cb 0.00 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 2i5y s VAL 89 CO 0.00 0.44 -0.02 -0.31 0.00 0.00 0.00 175.10 175.21 2i5y s TYR 90 N 0.09 3.05 -0.08 5.22 2.02 -0.39 -0.93 117.35 126.33 2i5y s TYR 90 Ca 0.18 -0.31 0.00 0.00 -0.37 0.00 0.00 57.07 56.57 2i5y s TYR 90 Cb -0.14 -2.00 -0.03 0.00 -0.40 0.00 0.00 41.96 39.40 2i5y s TYR 90 CO 0.06 -0.07 -0.07 -0.06 -1.57 0.00 0.00 175.55 173.84 2i5y s PHE 91 N 0.52 2.94 -0.17 2.71 0.08 0.66 -1.54 117.98 123.19 2i5y s PHE 91 Ca -0.02 -0.04 -0.07 0.00 0.12 0.00 0.00 56.93 56.92 2i5y s PHE 91 Cb -0.14 -1.75 -0.04 0.00 -0.57 0.00 0.00 43.02 40.52 2i5y s PHE 91 CO 0.02 0.27 0.05 0.00 -0.10 0.00 0.00 175.22 175.46 2i5y s ALA 93 N 0.15 0.10 0.24 0.00 0.00 0.13 -0.20 121.76 122.19 2i5y s ALA 93 Ca 0.04 -0.90 -0.18 0.00 0.00 0.00 0.00 51.96 50.92 2i5y s ALA 93 Cb -0.12 0.56 0.02 0.00 0.00 0.00 0.00 23.12 23.58 2i5y s ALA 93 CO 0.01 -0.51 0.60 0.20 0.00 0.00 0.00 175.76 176.06 2i5y s GLY 94 N -2.92 0.02 0.04 0.00 0.00 -0.27 0.11 107.32 104.30 2i5y s GLY 94 Ca 0.10 -0.37 -0.09 0.00 0.00 0.00 0.00 44.72 44.36 2i5y s GLY 94 CO -0.07 -0.25 0.19 0.54 0.00 0.00 0.00 173.10 173.51 2i5y s VAL 95 N -3.92 0.11 0.20 1.40 0.11 -0.77 -1.82 120.40 115.71 2i5y s VAL 95 Ca 0.13 -0.89 -0.30 0.00 -2.93 0.00 0.00 61.98 57.99 2i5y s VAL 95 Cb -0.03 -0.87 -0.08 0.00 -1.53 0.00 0.00 36.38 33.87 2i5y s VAL 95 CO 0.04 -0.49 1.09 -0.47 -3.33 0.00 0.00 175.10 171.93 2i5y s TYR 96 N -2.46 3.62 -0.74 1.54 5.04 -1.26 -1.76 117.35 121.33 2i5y s TYR 96 Ca -0.06 1.64 0.09 0.00 -2.44 0.00 0.00 57.07 56.30 2i5y s TYR 96 Cb -0.02 -3.25 -0.03 0.00 0.35 0.00 0.00 41.96 39.01 2i5y s TYR 96 CO -0.03 -0.52 0.55 0.39 -1.34 0.00 0.00 175.55 174.59 2i5y n GLU 97 N 2.15 2.67 0.00 4.97 -0.58 0.77 -4.79 120.64 125.82 2i5y n GLU 97 Ca 0.02 -0.42 0.00 0.00 -0.42 0.00 0.00 57.16 56.34 2i5y n GLU 97 Cb 0.46 -1.02 0.00 0.00 -0.57 0.00 0.00 31.44 30.31 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 0.97 -0.67 3.27 0.62 0.00 -1.25 -0.93 105.19 107.20 2i5y n GLY 98 Ca 0.03 -2.17 -0.43 0.00 0.00 0.00 0.00 46.02 43.45 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 0.00 3.25 0.12 1.61 1.02 -1.26 -4.72 120.64 120.66 2i5y n GLU 99 Ca 0.00 -3.36 0.02 0.00 -0.02 0.00 0.00 57.16 53.79 2i5y n GLU 99 Cb 0.00 -3.23 0.36 0.00 -0.02 0.00 0.00 31.44 28.55 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 6.85 1.43 0.00 0.62 0.00 -1.75 0.26 119.26 126.67 2i5y h ALA 100 Ca 0.42 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2i5y h ALA 100 Cb 0.79 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2i5y h ALA 100 CO 1.50 0.40 0.00 0.38 0.00 0.00 0.00 179.25 181.53 2i5y h ASP 100 N 0.20 0.00 -0.37 0.00 2.03 -1.84 -1.29 116.42 115.15 2i5y h ASP 100 Ca 0.04 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.34 2i5y h ASP 100 Cb 0.47 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.97 2i5y h ASP 100 CO 0.03 0.00 0.00 -0.62 -1.03 0.00 0.00 179.24 177.62 2i5y n GLU 100 N -2.81 3.13 -0.71 4.15 -0.58 -0.58 -4.96 120.64 118.29 2i5y n GLU 100 Ca 0.00 -2.59 0.00 0.00 -0.42 0.00 0.00 57.16 54.15 2i5y n GLU 100 Cb 0.22 -1.67 0.00 0.00 -0.57 0.00 0.00 31.44 29.42 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 0.16 0.78 3.85 0.62 0.00 -0.49 -5.06 105.19 105.05 2i5y n GLY 100 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.29 3.81 -0.22 1.61 8.01 -0.02 -4.95 118.70 126.64 2i5y s GLU 100 Ca 0.00 0.28 -0.10 0.00 0.01 0.00 0.00 54.97 55.16 2i5y s GLU 100 Cb 0.00 -3.21 0.08 0.00 -4.31 0.00 0.00 34.13 26.69 2i5y s GLU 100 CO 0.00 0.71 0.51 -0.47 0.01 0.00 0.00 175.26 176.02 2i5y s TYR 100 N -1.06 -0.88 0.00 1.61 6.14 -1.26 -2.31 117.35 119.59 2i5y s TYR 100 Ca 0.22 1.72 0.00 0.00 0.64 0.00 0.00 57.07 59.64 2i5y s TYR 100 Cb -0.16 0.45 0.00 0.00 0.42 0.00 0.00 41.96 42.67 2i5y s TYR 100 CO 0.11 -0.48 0.00 -0.25 0.64 0.00 0.00 175.55 175.57 2i5y n ASP 100 N 4.79 0.00 -3.66 4.32 8.00 -0.11 -5.04 116.55 124.85 2i5y n ASP 100 Ca -0.17 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.22 2i5y n ASP 100 Cb 0.53 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.55 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 -0.72 0.00 -2.24 0.01 -1.26 -5.14 114.94 104.59 2i5y s ASN 100 Ca 0.00 1.28 0.23 0.00 -0.71 0.00 0.00 52.86 53.66 2i5y s ASN 100 Cb 0.00 1.22 0.34 0.00 0.41 0.00 0.00 41.25 43.23 2i5y s ASN 100 CO 0.00 -0.22 1.34 0.61 -1.51 0.00 0.00 177.10 177.32 2i5y n GLY 100 N 3.51 1.48 3.96 0.66 0.00 -1.26 -4.95 105.19 108.58 2i5y n GLY 100 Ca -0.17 -0.71 -0.23 0.00 0.00 0.00 0.00 46.02 44.90 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 -1.63 2.65 -0.27 1.61 -0.71 -1.26 -5.09 117.98 113.29 2i5y s PHE 100 Ca 0.35 0.06 0.02 0.00 -1.04 0.00 0.00 56.93 56.32 2i5y s PHE 100 Cb 0.22 -2.92 0.07 0.00 -1.21 0.00 0.00 43.02 39.18 2i5y s PHE 100 CO 0.31 -1.16 -0.05 -0.51 -1.34 0.00 0.00 175.22 172.46 2i5y s LEU 100 N -4.96 3.38 -0.15 -1.99 1.43 -1.26 -4.58 118.68 110.55 2i5y s LEU 100 Ca 0.60 -1.49 -0.16 0.00 -1.03 0.00 0.00 54.13 52.05 2i5y s LEU 100 Cb -0.10 -1.42 -0.13 0.00 0.03 0.00 0.00 46.19 44.58 2i5y s LEU 100 CO 0.41 -0.25 0.20 0.50 0.23 0.00 0.00 176.35 177.43 2i5y h LYS 101 N 7.81 0.00 -5.79 1.70 1.63 -1.91 -3.47 116.57 116.55 2i5y h LYS 101 Ca -0.15 0.00 -0.64 0.00 -0.85 0.00 0.00 60.65 59.00 2i5y h LYS 101 Cb 1.04 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 32.61 2i5y h LYS 101 CO 0.46 0.54 -0.37 -1.01 -3.45 0.00 0.00 179.45 175.62 2i5y s HIS 102 N -2.14 3.65 0.04 1.91 3.76 -0.75 -4.98 115.29 116.79 2i5y s HIS 102 Ca -0.17 0.72 0.04 0.00 -0.15 0.00 0.00 55.06 55.50 2i5y s HIS 102 Cb 0.02 -2.08 -0.02 0.00 1.11 0.00 0.00 32.58 31.60 2i5y s HIS 102 CO 0.40 0.70 -0.12 -1.58 -0.85 0.00 0.00 174.74 173.29 2i5y s TRP 103 N -1.04 1.04 0.83 1.40 0.52 -1.26 -1.11 118.94 119.33 2i5y s TRP 103 Ca 0.19 -0.37 -0.11 0.00 0.02 0.00 0.00 56.10 55.82 2i5y s TRP 103 Cb -0.14 -0.62 0.12 0.00 -1.15 0.00 0.00 33.47 31.68 2i5y s TRP 103 CO 0.08 0.01 1.18 0.20 0.02 0.00 0.00 176.95 178.44 2i5y s GLY 104 N -1.21 1.69 0.19 0.98 0.00 0.72 -4.52 107.32 105.17 2i5y s GLY 104 Ca -0.01 -0.96 0.26 0.00 0.00 0.00 0.00 44.72 44.00 2i5y s GLY 104 CO 0.01 -0.39 1.78 0.61 0.00 0.00 0.00 173.10 175.11 2i5y n GLN 105 N -3.35 0.23 0.00 2.90 0.00 -1.26 -4.76 117.38 111.14 2i5y n GLN 105 Ca 0.11 0.22 0.00 0.00 0.00 0.00 0.00 57.00 57.33 2i5y n GLN 105 Cb 0.60 -1.78 0.00 0.00 0.00 0.00 0.00 30.24 29.06 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 1.15 1.88 2.80 2.61 0.00 -1.26 -5.03 105.19 107.34 2i5y n GLY 106 Ca 0.05 -1.76 -0.25 0.00 0.00 0.00 0.00 46.02 44.07 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 -2.39 0.59 0.11 2.61 2.01 -0.59 -4.88 115.64 113.10 2i5y s THR 107 Ca 0.00 -0.14 -0.30 0.00 0.31 0.00 0.00 61.69 61.56 2i5y s THR 107 Cb 0.00 -0.79 -0.06 0.00 0.01 0.00 0.00 72.50 71.66 2i5y s THR 107 CO 0.00 0.19 1.11 -0.22 -0.69 0.00 0.00 174.62 175.01 2i5y s LEU 108 N 1.87 4.43 -0.20 4.42 2.96 -1.26 -1.27 118.68 129.63 2i5y s LEU 108 Ca 0.04 1.98 -0.00 0.00 -0.22 0.00 0.00 54.13 55.93 2i5y s LEU 108 Cb -0.13 -3.59 0.05 0.00 0.50 0.00 0.00 46.19 43.02 2i5y s LEU 108 CO -0.07 -0.30 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.92 2i5y s VAL 109 N 0.41 1.29 -0.23 1.68 1.01 -0.18 -0.48 120.40 123.89 2i5y s VAL 109 Ca 0.53 -0.91 -0.06 0.00 0.00 0.00 0.00 61.98 61.53 2i5y s VAL 109 Cb -0.28 -1.52 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 2i5y s VAL 109 CO 0.32 0.00 0.03 -0.89 0.00 0.00 0.00 175.10 174.56 2i5y s THR 110 N 1.53 4.09 -0.29 3.92 2.01 -0.16 -1.30 115.64 125.44 2i5y s THR 110 Ca -0.02 -0.25 -0.07 0.00 0.31 0.00 0.00 61.69 61.66 2i5y s THR 110 Cb -0.17 -2.89 0.00 0.00 0.01 0.00 0.00 72.50 69.46 2i5y s THR 110 CO -0.07 0.38 0.08 -0.69 -0.69 0.00 0.00 174.62 173.63 2i5y s VAL 111 N 1.39 4.01 -0.09 3.82 1.01 -1.26 -0.35 120.40 128.92 2i5y s VAL 111 Ca 0.05 -0.63 -0.30 0.00 0.00 0.00 0.00 61.98 61.10 2i5y s VAL 111 Cb -0.15 -3.04 0.09 0.00 0.00 0.00 0.00 36.38 33.28 2i5y s VAL 111 CO 0.02 0.11 0.77 -0.55 0.00 0.00 0.00 175.10 175.45 2i5y s SER 112 N 1.52 -0.59 0.02 3.32 0.15 0.04 -4.33 113.70 113.82 2i5y s SER 112 Ca 0.03 0.67 0.28 0.00 0.70 0.00 0.00 55.95 57.64 2i5y s SER 112 Cb -0.17 0.53 1.15 0.00 -1.71 0.00 0.00 66.02 65.82 2i5y s SER 112 CO 0.03 -0.52 1.88 -1.54 1.20 0.00 0.00 173.24 174.29 2i5y n SER 113 N 0.96 0.09 -4.76 5.45 3.41 -1.26 -4.14 113.62 113.38 2i5y n SER 113 Ca -0.16 0.45 -0.37 0.00 -0.26 0.00 0.00 58.87 58.52 2i5y n SER 113 Cb 0.57 -0.46 0.02 0.00 -0.26 0.00 0.00 64.21 64.08 2i5y n SER 113 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2i5y s ALA 114 N -3.01 2.82 -0.10 7.33 0.00 -1.26 -5.02 121.76 122.51 2i5y s ALA 114 Ca 0.14 1.09 -0.04 0.00 0.00 0.00 0.00 51.96 53.14 2i5y s ALA 114 Cb 0.18 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 2i5y s ALA 114 CO 0.55 -1.03 0.07 -1.54 0.00 0.00 0.00 175.76 173.81 2i5y s SER 115 N -1.27 5.83 0.19 0.00 1.04 -1.26 -5.04 113.70 113.19 2i5y s SER 115 Ca 0.70 0.31 -0.25 0.00 0.48 0.00 0.00 55.95 57.19 2i5y s SER 115 Cb -0.33 -1.78 -0.15 0.00 0.10 0.00 0.00 66.02 63.85 2i5y s SER 115 CO 0.39 0.39 0.45 0.41 0.98 0.00 0.00 173.24 175.86 2i5y n THR 116 N 2.05 1.76 -3.64 2.02 -1.04 -1.26 -4.83 114.28 109.33 2i5y n THR 116 Ca -0.19 -0.46 -0.07 0.00 -2.04 0.00 0.00 64.05 61.29 2i5y n THR 116 Cb 0.54 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.98 2i5y n THR 116 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 2i5y s LYS 117 N -0.91 0.64 0.83 -2.82 -2.85 0.14 -4.93 119.74 109.84 2i5y s LYS 117 Ca 0.58 1.04 -0.11 0.00 -1.00 0.00 0.00 55.97 56.49 2i5y s LYS 117 Cb -0.83 0.17 0.10 0.00 -2.06 0.00 0.00 37.83 35.20 2i5y s LYS 117 CO 0.52 -0.12 1.12 0.20 0.10 0.00 0.00 175.35 177.16 2i5y s GLY 118 N 1.33 1.72 0.30 0.59 0.00 -1.26 -1.37 107.32 108.63 2i5y s GLY 118 Ca -0.08 0.45 -0.10 0.00 0.00 0.00 0.00 44.72 44.99 2i5y s GLY 118 CO -0.15 0.83 0.63 2.56 0.00 0.00 0.00 173.10 176.97 2i5y s PRO 119 N -4.73 3.80 -0.16 2.90 0.04 -1.26 -4.54 135.00 131.05 2i5y s PRO 119 Ca 0.64 0.34 -0.17 0.00 0.04 0.00 0.00 61.00 61.85 2i5y s PRO 119 Cb -0.20 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 31.75 2i5y s PRO 119 CO 0.56 0.19 0.43 -1.12 0.04 0.00 0.00 177.00 177.10 2i5y s SER 120 N -2.67 6.55 -0.27 6.66 0.01 0.63 -4.87 113.70 119.73 2i5y s SER 120 Ca 0.49 0.65 -0.06 0.00 1.31 0.00 0.00 55.95 58.34 2i5y s SER 120 Cb -0.11 -2.25 -0.00 0.00 0.21 0.00 0.00 66.02 63.87 2i5y s SER 120 CO 0.24 -0.03 0.05 -0.69 0.41 0.00 0.00 173.24 173.22 2i5y s VAL 121 N 0.95 3.86 0.04 3.43 1.01 -1.26 -0.52 120.40 127.91 2i5y s VAL 121 Ca 0.22 -0.55 0.04 0.00 0.00 0.00 0.00 61.98 61.69 2i5y s VAL 121 Cb -0.15 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.30 2i5y s VAL 121 CO 0.08 0.21 -0.07 -0.36 0.00 0.00 0.00 175.10 174.97 2i5y s PHE 122 N 1.51 2.87 0.12 5.22 0.08 -0.32 -4.93 117.98 122.53 2i5y s PHE 122 Ca 0.04 -0.06 -0.28 0.00 0.12 0.00 0.00 56.93 56.74 2i5y s PHE 122 Cb -0.16 -1.56 -0.06 0.00 -0.57 0.00 0.00 43.02 40.66 2i5y s PHE 122 CO 0.01 0.40 0.89 -1.25 -0.10 0.00 0.00 175.22 175.16 2i5y s PRO 123 N -1.70 4.66 -0.93 0.24 0.04 -1.26 -0.34 135.00 135.71 2i5y s PRO 123 Ca 0.19 1.32 -0.09 0.00 0.04 0.00 0.00 61.00 62.47 2i5y s PRO 123 Cb -0.11 -3.34 0.24 0.00 0.04 0.00 0.00 34.50 31.32 2i5y s PRO 123 CO 0.10 0.32 0.86 -0.51 0.04 0.00 0.00 177.00 177.82 2i5y s LEU 124 N -0.33 6.21 0.36 -3.56 1.02 0.21 -4.87 118.68 117.71 2i5y s LEU 124 Ca 0.42 -3.25 -0.26 0.00 0.02 0.00 0.00 54.13 51.06 2i5y s LEU 124 Cb -0.23 -2.11 -0.09 0.00 0.02 0.00 0.00 46.19 43.78 2i5y s LEU 124 CO 0.28 -0.37 1.12 0.00 0.02 0.00 0.00 176.35 177.40 2i5y s ALA 125 N -0.69 3.24 0.10 4.21 0.00 -1.26 -0.43 121.76 126.92 2i5y s ALA 125 Ca 0.24 0.88 -0.31 0.00 0.00 0.00 0.00 51.96 52.78 2i5y s ALA 125 Cb -0.11 -3.34 -0.09 0.00 0.00 0.00 0.00 23.12 19.58 2i5y s ALA 125 CO -0.09 -0.32 1.72 -2.14 0.00 0.00 0.00 175.76 174.93 2i5y s PRO 126 N -2.04 4.17 0.00 0.00 0.02 -1.25 -4.94 135.00 130.96 2i5y s PRO 126 Ca 0.53 2.44 0.23 0.00 0.02 0.00 0.00 61.00 64.22 2i5y s PRO 126 Cb -0.29 -3.56 0.11 0.00 0.02 0.00 0.00 34.50 30.77 2i5y s PRO 126 CO 0.37 -0.77 1.16 0.43 -0.33 0.00 0.00 177.00 177.86 2i5y n SER 127 N 5.50 1.89 -0.15 2.53 7.64 -1.26 -4.87 113.62 124.90 2i5y n SER 127 Ca 0.16 -1.43 0.02 0.00 1.01 0.00 0.00 58.87 58.64 2i5y n SER 127 Cb 0.39 0.43 0.02 0.00 -1.01 0.00 0.00 64.21 64.04 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 133 N 1.41 -1.10 0.48 0.23 0.00 -1.26 -5.13 105.19 99.82 2i5y n GLY 133 Ca 0.10 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2i5y n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i5y n GLY 134 N 0.22 0.02 3.45 -0.02 0.00 -1.26 -4.94 105.19 102.65 2i5y n GLY 134 Ca 0.02 -0.04 -0.33 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 -1.24 3.39 0.08 2.61 2.01 -1.26 0.10 115.64 121.32 2i5y s THR 135 Ca 0.00 -0.56 0.10 0.00 0.31 0.00 0.00 61.69 61.54 2i5y s THR 135 Cb 0.00 -2.43 -0.03 0.00 0.01 0.00 0.00 72.50 70.05 2i5y s THR 135 CO 0.00 0.53 -0.27 0.00 -0.69 0.00 0.00 174.62 174.20 2i5y s ALA 136 N 0.08 2.30 -0.07 7.40 0.00 0.65 -4.79 121.76 127.34 2i5y s ALA 136 Ca -0.04 -1.34 0.02 0.00 0.00 0.00 0.00 51.96 50.61 2i5y s ALA 136 Cb -0.14 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 2i5y s ALA 136 CO 0.04 0.54 -0.12 0.00 0.00 0.00 0.00 175.76 176.21 2i5y s ALA 137 N -0.90 2.74 0.18 0.00 0.00 -1.26 -0.50 121.76 122.02 2i5y s ALA 137 Ca 0.13 -0.94 -0.10 0.00 0.00 0.00 0.00 51.96 51.04 2i5y s ALA 137 Cb -0.10 -1.07 -0.00 0.00 0.00 0.00 0.00 23.12 21.95 2i5y s ALA 137 CO 0.03 0.51 0.34 -0.48 0.00 0.00 0.00 175.76 176.17 2i5y s LEU 138 N -0.59 0.73 0.00 0.00 0.05 -0.75 -3.74 118.68 114.38 2i5y s LEU 138 Ca 0.08 -0.85 0.00 0.00 0.05 0.00 0.00 54.13 53.42 2i5y s LEU 138 Cb -0.11 1.39 0.00 0.00 -2.05 0.00 0.00 46.19 45.41 2i5y s LEU 138 CO 0.01 -0.96 0.00 0.61 -0.55 0.00 0.00 176.35 175.47 2i5y n GLY 139 N -0.26 1.26 2.83 -3.48 0.00 0.43 -1.11 105.19 104.86 2i5y n GLY 139 Ca -0.06 -0.87 -0.16 0.00 0.00 0.00 0.00 46.02 44.92 2i5y n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i5y s LEU 141 N 0.85 4.56 -0.57 0.00 2.96 0.53 -1.26 118.68 125.75 2i5y s LEU 141 Ca -0.08 -0.33 -0.19 0.00 -0.22 0.00 0.00 54.13 53.31 2i5y s LEU 141 Cb -0.12 -2.45 0.09 0.00 0.50 0.00 0.00 46.19 44.21 2i5y s LEU 141 CO -0.01 -0.49 0.68 -0.69 -1.32 0.00 0.00 176.35 174.51 2i5y s VAL 142 N 2.22 4.85 0.13 1.68 1.01 0.98 -1.17 120.40 130.10 2i5y s VAL 142 Ca 0.15 -0.90 0.08 0.00 0.00 0.00 0.00 61.98 61.30 2i5y s VAL 142 Cb -0.16 -4.44 -0.04 0.00 0.00 0.00 0.00 36.38 31.74 2i5y s VAL 142 CO 0.13 -1.04 -0.11 -0.75 0.00 0.00 0.00 175.10 173.33 2i5y s LYS 143 N 2.63 2.03 -0.53 2.72 2.20 0.32 -0.76 119.74 128.35 2i5y s LYS 143 Ca 0.12 -1.14 -0.23 0.00 -0.36 0.00 0.00 55.97 54.36 2i5y s LYS 143 Cb -0.23 -2.22 0.03 0.00 -1.51 0.00 0.00 37.83 33.90 2i5y s LYS 143 CO 0.07 0.48 0.64 -0.25 -0.36 0.00 0.00 175.35 175.93 2i5y n ASP 144 N 0.49 -6.36 -4.20 1.43 8.00 -0.79 -0.27 116.55 114.85 2i5y n ASP 144 Ca -0.13 -0.07 -0.15 0.00 0.71 0.00 0.00 54.79 55.16 2i5y n ASP 144 Cb 0.53 -3.13 -0.11 0.00 -0.02 0.00 0.00 41.12 38.39 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 -2.19 1.15 -0.25 1.24 -0.85 -0.54 -4.30 117.35 111.61 2i5y s TYR 145 Ca 0.25 -0.67 -0.17 0.00 -0.52 0.00 0.00 57.07 55.96 2i5y s TYR 145 Cb -0.04 -0.61 0.07 0.00 0.38 0.00 0.00 41.96 41.76 2i5y s TYR 145 CO 0.84 0.03 0.63 0.12 -1.52 0.00 0.00 175.55 175.65 2i5y s PHE 146 N -2.65 -0.89 0.00 -3.49 5.36 -0.47 -0.09 117.98 115.75 2i5y s PHE 146 Ca 0.09 1.88 0.00 0.00 -0.96 0.00 0.00 56.93 57.94 2i5y s PHE 146 Cb -0.02 0.47 0.00 0.00 -0.34 0.00 0.00 43.02 43.13 2i5y s PHE 146 CO 0.00 -0.45 0.00 -0.35 -1.46 0.00 0.00 175.22 172.97 2i5y n PRO 147 N 3.88 2.59 -1.60 10.12 -0.04 -1.26 0.23 135.00 148.92 2i5y n PRO 147 Ca -0.19 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.95 2i5y n PRO 147 Cb 0.57 0.00 0.06 0.00 -0.04 0.00 0.00 33.50 34.09 2i5y n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2i5y s GLU 148 N 0.60 2.74 0.51 0.54 0.41 -1.26 -4.71 118.70 117.52 2i5y s GLU 148 Ca 0.00 1.19 0.08 0.00 -0.41 0.00 0.00 54.97 55.84 2i5y s GLU 148 Cb 0.00 -1.95 0.05 0.00 -1.78 0.00 0.00 34.13 30.44 2i5y s GLU 148 CO 0.00 -1.27 0.63 -1.25 -0.49 0.00 0.00 175.26 172.87 2i5y s PRO 149 N -4.56 2.46 -0.00 0.39 0.04 -1.26 -4.98 135.00 127.09 2i5y s PRO 149 Ca 0.63 -1.59 0.01 0.00 0.04 0.00 0.00 61.00 60.09 2i5y s PRO 149 Cb -0.17 -2.56 -0.00 0.00 0.04 0.00 0.00 34.50 31.81 2i5y s PRO 149 CO 0.48 -0.60 -0.04 0.54 0.04 0.00 0.00 177.00 177.43 2i5y s VAL 150 N -2.58 0.30 -0.08 -0.36 0.11 -1.26 -4.59 120.40 111.95 2i5y s VAL 150 Ca 0.54 -0.16 0.02 0.00 -2.93 0.00 0.00 61.98 59.45 2i5y s VAL 150 Cb -0.06 -0.26 -0.03 0.00 -1.53 0.00 0.00 36.38 34.50 2i5y s VAL 150 CO 0.33 0.09 -0.11 -0.89 -3.33 0.00 0.00 175.10 171.19 2i5y s THR 151 N -0.05 3.32 -0.03 5.04 2.01 -0.45 -4.99 115.64 120.48 2i5y s THR 151 Ca 0.01 -0.61 0.03 0.00 0.31 0.00 0.00 61.69 61.43 2i5y s THR 151 Cb -0.02 -2.35 0.00 0.00 0.01 0.00 0.00 72.50 70.15 2i5y s THR 151 CO -0.00 0.57 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.69 2i5y s VAL 152 N -0.48 1.03 0.14 3.82 1.01 -1.26 -0.94 120.40 123.72 2i5y s VAL 152 Ca 0.07 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.55 2i5y s VAL 152 Cb -0.12 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 2i5y s VAL 152 CO 0.02 0.31 0.02 -0.55 0.00 0.00 0.00 175.10 174.90 2i5y s SER 153 N 0.12 0.75 -0.14 3.32 0.15 -0.24 -4.97 113.70 112.69 2i5y s SER 153 Ca -0.03 -1.17 0.01 0.00 0.70 0.00 0.00 55.95 55.46 2i5y s SER 153 Cb -0.09 0.20 0.02 0.00 -1.71 0.00 0.00 66.02 64.44 2i5y s SER 153 CO 0.01 -0.64 -0.14 0.26 1.20 0.00 0.00 173.24 173.93 2i5y s TRP 154 N -3.85 2.11 -1.21 3.44 0.52 -1.26 -0.12 118.94 118.57 2i5y s TRP 154 Ca 0.22 -1.14 -0.00 0.00 0.02 0.00 0.00 56.10 55.20 2i5y s TRP 154 Cb 0.07 -1.55 0.00 0.00 -1.15 0.00 0.00 33.47 30.84 2i5y s TRP 154 CO 0.02 -0.62 1.00 0.09 0.02 0.00 0.00 176.95 177.46 2i5y n ASN 155 N 4.63 -2.21 -2.68 2.95 3.02 0.17 -2.14 115.26 118.99 2i5y n ASN 155 Ca -0.17 -0.62 -0.18 0.00 -0.03 0.00 0.00 54.58 53.57 2i5y n ASN 155 Cb 0.50 -5.09 0.00 0.00 -0.61 0.00 0.00 39.78 34.58 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 -3.12 -4.86 0.00 6.41 7.64 -1.26 -1.64 113.62 116.78 2i5y n SER 156 Ca -0.28 -0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.56 2i5y n SER 156 Cb 0.67 -4.04 0.00 0.00 -1.01 0.00 0.00 64.21 59.83 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 -1.06 0.82 0.13 0.23 0.00 -0.91 -4.92 105.19 99.49 2i5y n GLY 157 Ca -0.15 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 0.77 -2.79 4.61 0.00 -1.24 -3.41 119.26 117.21 2i5y h ALA 158 Ca 0.00 -0.58 -0.69 0.00 0.00 0.00 0.00 54.91 53.64 2i5y h ALA 158 Cb 0.00 -0.10 -0.22 0.00 0.00 0.00 0.00 17.79 17.46 2i5y h ALA 158 CO 0.00 0.80 -0.52 -1.17 0.00 0.00 0.00 179.25 178.36 2i5y s LEU 159 N -7.07 4.46 0.00 0.00 2.96 -0.96 -4.88 118.68 113.19 2i5y s LEU 159 Ca 0.00 -0.69 0.00 0.00 -0.22 0.00 0.00 54.13 53.23 2i5y s LEU 159 Cb 0.11 -2.05 0.00 0.00 0.50 0.00 0.00 46.19 44.75 2i5y s LEU 159 CO 0.76 -0.28 0.00 0.35 -1.32 0.00 0.00 176.35 175.85 2i5y n THR 160 N 5.02 0.00 -1.89 3.68 -2.24 -1.26 -4.21 114.28 113.38 2i5y n THR 160 Ca -0.13 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.24 2i5y n THR 160 Cb 0.48 -0.49 -0.02 0.00 -2.10 0.00 0.00 70.33 68.20 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 -3.05 6.50 0.00 3.42 0.01 -1.26 -2.30 113.70 117.02 2i5y s SER 161 Ca 0.00 2.86 0.00 0.00 1.31 0.00 0.00 55.95 60.12 2i5y s SER 161 Cb 0.00 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.59 2i5y s SER 161 CO 0.00 -0.80 0.00 0.61 0.41 0.00 0.00 173.24 173.46 2i5y n GLY 162 N 1.68 2.65 3.76 3.44 0.00 -1.26 -4.72 105.19 110.73 2i5y n GLY 162 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2i5y n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2i5y s VAL 163 N -1.79 2.65 -0.27 1.61 1.01 -0.97 -3.90 120.40 118.74 2i5y s VAL 163 Ca 0.00 0.59 -0.04 0.00 0.00 0.00 0.00 61.98 62.53 2i5y s VAL 163 Cb 0.00 -3.38 0.09 0.00 0.00 0.00 0.00 36.38 33.09 2i5y s VAL 163 CO 0.00 0.11 0.11 -1.00 0.00 0.00 0.00 175.10 174.33 2i5y s HIS 164 N -0.46 0.52 -0.36 5.22 3.76 0.12 -4.99 115.29 119.10 2i5y s HIS 164 Ca 0.55 -0.89 -0.13 0.00 -0.15 0.00 0.00 55.06 54.44 2i5y s HIS 164 Cb -0.41 -0.98 -0.00 0.00 1.11 0.00 0.00 32.58 32.30 2i5y s HIS 164 CO 0.48 -0.77 0.24 0.99 -0.85 0.00 0.00 174.74 174.84 2i5y s THR 165 N 2.03 5.14 0.44 1.30 2.01 -1.26 -1.41 115.64 123.89 2i5y s THR 165 Ca 0.07 -0.42 -0.21 0.00 0.31 0.00 0.00 61.69 61.44 2i5y s THR 165 Cb -0.16 -3.72 -0.10 0.00 0.01 0.00 0.00 72.50 68.53 2i5y s THR 165 CO -0.29 -0.11 0.99 -0.36 -0.69 0.00 0.00 174.62 174.16 2i5y s PHE 166 N 1.68 3.24 0.53 4.92 0.40 -0.77 -5.01 117.98 122.97 2i5y s PHE 166 Ca 0.05 1.62 -0.22 0.00 -0.60 0.00 0.00 56.93 57.78 2i5y s PHE 166 Cb -0.18 -2.95 -0.06 0.00 0.51 0.00 0.00 43.02 40.34 2i5y s PHE 166 CO 0.10 -0.36 1.35 -2.30 0.70 0.00 0.00 175.22 174.70 2i5y n PRO 167 N -0.59 1.74 -1.87 0.24 -0.02 -1.26 -4.59 135.00 128.65 2i5y n PRO 167 Ca 0.07 0.64 -0.33 0.00 -2.02 0.00 0.00 63.50 61.86 2i5y n PRO 167 Cb 0.53 -2.55 0.03 0.00 -0.02 0.00 0.00 33.50 31.49 2i5y n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2i5y s ALA 168 N -1.28 2.61 -0.10 3.55 0.00 -1.26 -4.86 121.76 120.41 2i5y s ALA 168 Ca 0.70 0.44 0.04 0.00 0.00 0.00 0.00 51.96 53.13 2i5y s ALA 168 Cb -0.43 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.43 2i5y s ALA 168 CO 0.51 -1.06 -0.23 0.08 0.00 0.00 0.00 175.76 175.05 2i5y s VAL 169 N -2.45 2.01 -0.11 0.00 1.01 -0.46 -4.95 120.40 115.45 2i5y s VAL 169 Ca 0.65 -0.99 -0.27 0.00 0.00 0.00 0.00 61.98 61.36 2i5y s VAL 169 Cb -0.18 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.44 2i5y s VAL 169 CO 0.40 0.55 0.90 -0.22 0.00 0.00 0.00 175.10 176.74 2i5y s LEU 170 N 0.38 4.25 0.66 3.92 2.96 -1.26 -2.09 118.68 127.50 2i5y s LEU 170 Ca -0.18 1.38 -0.02 0.00 -0.22 0.00 0.00 54.13 55.09 2i5y s LEU 170 Cb -0.18 -3.39 0.08 0.00 0.50 0.00 0.00 46.19 43.20 2i5y s LEU 170 CO 0.08 -0.36 0.93 -1.10 -1.32 0.00 0.00 176.35 174.57 2i5y s GLN 171 N 1.78 2.10 0.60 1.98 -0.21 0.21 -4.96 119.66 121.15 2i5y s GLN 171 Ca 0.44 -0.75 0.37 0.00 0.02 0.00 0.00 55.36 55.43 2i5y s GLN 171 Cb -0.18 -2.33 1.90 0.00 1.00 0.00 0.00 33.01 33.40 2i5y s GLN 171 CO 0.17 -1.15 2.21 0.77 -2.12 0.00 0.00 175.29 175.17 2i5y h SER 172 N -0.35 0.00 0.72 5.90 0.02 -1.96 -0.71 113.55 117.16 2i5y h SER 172 Ca -0.41 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 2i5y h SER 172 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2i5y h SER 172 CO 0.49 0.03 -0.09 -1.54 -1.14 0.00 0.00 176.83 174.59 2i5y n SER 173 N -3.31 0.15 0.00 3.07 3.41 -1.26 -4.89 113.62 110.79 2i5y n SER 173 Ca -0.02 0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 2i5y n SER 173 Cb 0.16 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 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 1.41 0.75 3.94 5.00 0.00 -0.27 -4.99 105.19 111.02 2i5y n GLY 174 Ca 0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 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 4.28 0.39 0.99 1.43 -1.26 -4.83 118.68 119.68 2i5y s LEU 175 Ca 0.00 0.09 0.06 0.00 -1.03 0.00 0.00 54.13 53.25 2i5y s LEU 175 Cb 0.00 -2.83 0.00 0.00 0.03 0.00 0.00 46.19 43.39 2i5y s LEU 175 CO 0.00 -0.00 0.55 -0.31 0.23 0.00 0.00 176.35 176.82 2i5y s TYR 176 N -1.86 3.00 -0.16 0.29 2.02 0.86 -0.62 117.35 120.88 2i5y s TYR 176 Ca 0.34 -0.21 -0.29 0.00 -0.37 0.00 0.00 57.07 56.54 2i5y s TYR 176 Cb -0.10 -2.23 0.11 0.00 -0.40 0.00 0.00 41.96 39.34 2i5y s TYR 176 CO 0.28 -0.26 0.90 0.45 -1.57 0.00 0.00 175.55 175.35 2i5y s SER 177 N -4.26 -0.49 0.24 2.29 0.15 -0.89 -1.47 113.70 109.28 2i5y s SER 177 Ca 0.50 0.66 -0.20 0.00 0.70 0.00 0.00 55.95 57.60 2i5y s SER 177 Cb -0.10 0.56 0.03 0.00 -1.71 0.00 0.00 66.02 64.80 2i5y s SER 177 CO 0.33 -0.37 0.65 -1.48 1.20 0.00 0.00 173.24 173.57 2i5y s LEU 178 N -0.76 -0.20 0.11 3.45 0.05 0.06 -1.35 118.68 120.03 2i5y s LEU 178 Ca -0.03 -0.52 0.08 0.00 0.05 0.00 0.00 54.13 53.71 2i5y s LEU 178 Cb -0.02 2.52 -0.04 0.00 -2.05 0.00 0.00 46.19 46.61 2i5y s LEU 178 CO 0.02 -1.22 -0.19 -0.44 -0.55 0.00 0.00 176.35 173.97 2i5y s SER 179 N -2.89 2.46 -0.07 1.48 0.01 -1.26 -0.02 113.70 113.41 2i5y s SER 179 Ca 0.10 -0.72 0.00 0.00 1.31 0.00 0.00 55.95 56.64 2i5y s SER 179 Cb -0.04 -0.13 0.02 0.00 0.21 0.00 0.00 66.02 66.08 2i5y s SER 179 CO 0.02 0.02 -0.05 -0.55 0.41 0.00 0.00 173.24 173.09 2i5y s SER 180 N -2.08 1.49 0.17 2.44 0.15 -0.39 -1.85 113.70 113.63 2i5y s SER 180 Ca 0.08 -0.18 0.07 0.00 0.70 0.00 0.00 55.95 56.62 2i5y s SER 180 Cb -0.09 -0.59 -0.04 0.00 -1.71 0.00 0.00 66.02 63.59 2i5y s SER 180 CO 0.04 -0.09 -0.15 0.68 1.20 0.00 0.00 173.24 174.93 2i5y s VAL 181 N 1.28 1.61 -0.04 4.45 -7.23 -0.50 -0.44 120.40 119.54 2i5y s VAL 181 Ca -0.05 -2.03 -0.12 0.00 -1.81 0.00 0.00 61.98 57.97 2i5y s VAL 181 Cb -0.14 -1.88 0.02 0.00 0.56 0.00 0.00 36.38 34.95 2i5y s VAL 181 CO -0.02 -0.52 0.28 0.54 -0.31 0.00 0.00 175.10 175.07 2i5y s VAL 182 N -2.65 0.04 -0.18 1.32 0.11 -0.26 0.12 120.40 118.91 2i5y s VAL 182 Ca 0.18 -0.36 -0.05 0.00 -2.93 0.00 0.00 61.98 58.81 2i5y s VAL 182 Cb -0.02 -0.53 -0.03 0.00 -1.53 0.00 0.00 36.38 34.27 2i5y s VAL 182 CO 0.05 -0.20 0.00 -0.89 -3.33 0.00 0.00 175.10 170.74 2i5y s THR 183 N -0.88 4.11 0.32 5.04 2.01 -1.25 -1.81 115.64 123.18 2i5y s THR 183 Ca -0.10 -0.27 0.04 0.00 0.31 0.00 0.00 61.69 61.67 2i5y s THR 183 Cb -0.05 -2.84 -0.06 0.00 0.01 0.00 0.00 72.50 69.56 2i5y s THR 183 CO 0.03 0.45 0.06 0.68 -0.69 0.00 0.00 174.62 175.15 2i5y s VAL 184 N 0.67 1.14 0.13 3.82 -7.23 0.34 -4.81 120.40 114.45 2i5y s VAL 184 Ca -0.00 -2.00 -0.28 0.00 -1.81 0.00 0.00 61.98 57.89 2i5y s VAL 184 Cb -0.14 -2.77 -0.07 0.00 0.56 0.00 0.00 36.38 33.96 2i5y s VAL 184 CO 0.02 -0.01 0.87 -2.16 -0.31 0.00 0.00 175.10 173.51 2i5y s PRO 185 N -3.90 4.65 0.21 4.82 0.04 -1.26 -0.26 135.00 139.30 2i5y s PRO 185 Ca 0.37 1.30 -0.09 0.00 0.04 0.00 0.00 61.00 62.62 2i5y s PRO 185 Cb 0.09 -3.33 0.27 0.00 0.04 0.00 0.00 34.50 31.57 2i5y s PRO 185 CO 0.15 0.36 1.79 0.77 0.04 0.00 0.00 177.00 180.11 2i5y h SER 186 N 5.08 0.48 0.00 6.66 0.02 0.35 -1.10 113.55 125.05 2i5y h SER 186 Ca -0.44 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 2i5y h SER 186 Cb 1.21 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2i5y h SER 186 CO 0.70 0.30 0.27 0.77 -1.14 0.00 0.00 176.83 177.72 2i5y h SER 187 N 0.62 0.00 0.90 3.07 4.64 -1.93 0.14 113.55 120.99 2i5y h SER 187 Ca 0.31 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.55 2i5y h SER 187 Cb 0.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 2i5y h SER 187 CO -0.22 0.00 -1.16 0.77 -0.87 0.00 0.00 176.83 175.35 2i5y h SER 188 N 0.00 0.00 -3.97 4.97 4.64 -1.57 -3.45 113.55 114.18 2i5y h SER 188 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 2i5y h SER 188 Cb 0.53 0.00 0.19 0.00 -0.31 0.00 0.00 62.40 62.81 2i5y h SER 188 CO 0.00 0.31 0.10 0.18 -0.87 0.00 0.00 176.83 176.54 2i5y n LEU 189 N -2.82 3.17 -0.42 5.97 4.77 0.48 -0.59 117.00 127.56 2i5y n LEU 189 Ca -0.05 0.53 -0.05 0.00 -0.03 0.00 0.00 56.01 56.41 2i5y n LEU 189 Cb 0.70 -1.43 -0.02 0.00 -2.33 0.00 0.00 43.42 40.34 2i5y n LEU 189 CO 0.41 -2.21 -0.05 0.61 -1.33 0.00 0.00 177.39 174.82 2i5y n GLY 190 N 0.79 0.51 1.61 -0.72 0.00 -1.26 -4.56 105.19 101.56 2i5y n GLY 190 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2i5y n GLY 190 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2i5y n THR 191 N -2.03 0.42 -4.30 2.61 -1.04 -0.46 -5.08 114.28 104.39 2i5y n THR 191 Ca -0.05 0.14 -0.32 0.00 -2.04 0.00 0.00 64.05 61.78 2i5y n THR 191 Cb 0.53 -0.94 -0.09 0.00 -1.82 0.00 0.00 70.33 68.00 2i5y n THR 191 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2i5y s GLN 192 N -2.00 2.59 0.07 -2.82 -0.21 0.24 -5.11 119.66 112.42 2i5y s GLN 192 Ca 0.00 -0.74 -0.13 0.00 0.02 0.00 0.00 55.36 54.51 2i5y s GLN 192 Cb 0.00 -2.55 -0.06 0.00 1.00 0.00 0.00 33.01 31.40 2i5y s GLN 192 CO 0.00 0.59 0.45 0.99 -2.12 0.00 0.00 175.29 175.20 2i5y s THR 193 N -1.12 4.99 -0.22 -0.19 2.01 -1.26 -4.63 115.64 115.21 2i5y s THR 193 Ca 0.20 0.71 0.01 0.00 0.31 0.00 0.00 61.69 62.93 2i5y s THR 193 Cb -0.11 -3.70 0.04 0.00 0.01 0.00 0.00 72.50 68.73 2i5y s THR 193 CO 0.12 0.38 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.98 2i5y s TYR 194 N -1.30 3.03 -0.06 4.92 2.02 -1.26 -4.99 117.35 119.70 2i5y s TYR 194 Ca 0.31 -1.91 0.05 0.00 -0.37 0.00 0.00 57.07 55.16 2i5y s TYR 194 Cb -0.15 -1.95 -0.01 0.00 -0.40 0.00 0.00 41.96 39.45 2i5y s TYR 194 CO 0.17 -0.82 -0.23 0.42 -1.57 0.00 0.00 175.55 173.52 2i5y s ILE 195 N 1.22 1.86 -0.17 2.71 -1.09 -1.26 -1.07 121.20 123.40 2i5y s ILE 195 Ca -0.02 -0.95 -0.07 0.00 -2.23 0.00 0.00 60.65 57.38 2i5y s ILE 195 Cb -0.16 -1.59 -0.04 0.00 -1.58 0.00 0.00 42.46 39.09 2i5y s ILE 195 CO -0.08 0.52 0.05 0.00 -1.23 0.00 0.00 174.94 174.20 2i5y s ASN 197 N 0.24 5.42 -0.20 0.00 -0.87 0.83 -1.46 114.94 118.90 2i5y s ASN 197 Ca 0.03 -0.09 -0.02 0.00 -1.57 0.00 0.00 52.86 51.21 2i5y s ASN 197 Cb -0.12 -1.97 -0.00 0.00 -0.02 0.00 0.00 41.25 39.14 2i5y s ASN 197 CO 0.01 0.03 -0.10 -0.69 -2.57 0.00 0.00 177.10 173.77 2i5y s VAL 198 N 1.25 2.95 -0.18 1.60 1.01 0.18 -1.08 120.40 126.13 2i5y s VAL 198 Ca 0.05 -0.65 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 2i5y s VAL 198 Cb -0.14 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.93 2i5y s VAL 198 CO 0.04 0.47 -0.13 0.20 0.00 0.00 0.00 175.10 175.68 2i5y s ASN 199 N 1.27 3.75 -0.44 3.32 -0.87 -0.12 -0.84 114.94 121.01 2i5y s ASN 199 Ca 0.03 -0.48 0.03 0.00 -1.57 0.00 0.00 52.86 50.88 2i5y s ASN 199 Cb -0.14 -1.60 0.12 0.00 -0.02 0.00 0.00 41.25 39.61 2i5y s ASN 199 CO -0.05 0.04 0.20 -2.28 -2.57 0.00 0.00 177.10 172.44 2i5y s HIS 200 N 1.08 2.81 0.14 2.20 2.46 -0.41 -1.34 115.29 122.24 2i5y s HIS 200 Ca -0.00 -2.80 -0.21 0.00 0.47 0.00 0.00 55.06 52.51 2i5y s HIS 200 Cb -0.15 -2.47 0.02 0.00 -0.13 0.00 0.00 32.58 29.85 2i5y s HIS 200 CO -0.03 -0.80 1.65 0.87 -2.47 0.00 0.00 174.74 173.96 2i5y h LYS 201 N 6.91 -0.17 -1.13 2.88 1.57 -1.81 -1.82 116.57 123.01 2i5y h LYS 201 Ca -0.06 0.01 0.32 0.00 -1.87 0.00 0.00 60.65 59.06 2i5y h LYS 201 Cb 0.94 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 33.23 2i5y h LYS 201 CO 0.58 -0.11 0.80 -1.35 -0.57 0.00 0.00 179.45 178.80 2i5y h PRO 202 N -0.17 0.04 -0.28 3.15 0.11 -1.92 0.34 132.00 133.27 2i5y h PRO 202 Ca 0.13 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2i5y h PRO 202 Cb 0.37 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.47 2i5y h PRO 202 CO -0.32 0.03 0.00 -1.13 -0.21 0.00 0.00 178.00 176.36 2i5y n SER 203 N -4.24 3.03 -4.27 -2.05 3.41 -1.03 -4.93 113.62 103.54 2i5y n SER 203 Ca 0.24 -2.26 -0.31 0.00 -0.26 0.00 0.00 58.87 56.29 2i5y n SER 203 Cb 1.16 -0.28 -0.09 0.00 -0.26 0.00 0.00 64.21 64.74 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 0.12 0.70 -4.42 4.04 5.15 0.12 -4.87 115.26 116.10 2i5y n ASN 204 Ca 0.13 -1.25 -0.32 0.00 -0.60 0.00 0.00 54.58 52.54 2i5y n ASN 204 Cb 0.52 -1.78 -0.14 0.00 -0.53 0.00 0.00 39.78 37.85 2i5y n ASN 204 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2i5y s THR 205 N -4.32 2.77 -0.14 -0.44 -4.23 -0.79 -5.02 115.64 103.47 2i5y s THR 205 Ca 0.01 -0.83 -0.03 0.00 -1.18 0.00 0.00 61.69 59.67 2i5y s THR 205 Cb -0.01 -2.06 0.05 0.00 1.34 0.00 0.00 72.50 71.82 2i5y s THR 205 CO 0.99 0.58 0.04 -0.75 -0.54 0.00 0.00 174.62 174.93 2i5y s LYS 206 N -0.60 0.47 0.06 3.99 2.20 -1.26 -1.29 119.74 123.31 2i5y s LYS 206 Ca 0.09 -0.12 0.06 0.00 -0.36 0.00 0.00 55.97 55.63 2i5y s LYS 206 Cb -0.11 -1.57 -0.03 0.00 -1.51 0.00 0.00 37.83 34.61 2i5y s LYS 206 CO 0.01 -0.51 -0.17 0.08 -0.36 0.00 0.00 175.35 174.39 2i5y s VAL 207 N 1.97 1.39 -0.13 4.02 1.01 -0.02 -4.98 120.40 123.66 2i5y s VAL 207 Ca 0.02 -1.21 0.01 0.00 0.00 0.00 0.00 61.98 60.80 2i5y s VAL 207 Cb -0.15 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 35.00 2i5y s VAL 207 CO -0.07 0.01 -0.14 -1.81 0.00 0.00 0.00 175.10 173.09 2i5y s ASP 208 N -1.39 2.55 -0.09 3.32 1.01 -1.26 0.48 116.67 121.30 2i5y s ASP 208 Ca 0.04 -0.45 0.02 0.00 0.71 0.00 0.00 52.55 52.87 2i5y s ASP 208 Cb -0.09 -1.12 -0.02 0.00 1.01 0.00 0.00 42.92 42.70 2i5y s ASP 208 CO 0.02 -0.03 -0.16 -0.75 0.21 0.00 0.00 175.17 174.46 2i5y s LYS 209 N 1.29 2.93 -0.04 8.23 2.47 -0.54 -4.94 119.74 129.14 2i5y s LYS 209 Ca 0.00 -0.73 -0.22 0.00 -1.56 0.00 0.00 55.97 53.46 2i5y s LYS 209 Cb -0.14 -2.46 -0.05 0.00 -1.46 0.00 0.00 37.83 33.73 2i5y s LYS 209 CO -0.07 0.38 0.63 0.21 0.16 0.00 0.00 175.35 176.67 2i5y s LYS 210 N -0.11 4.37 -0.39 4.03 2.20 -1.26 -1.49 119.74 127.08 2i5y s LYS 210 Ca -0.02 0.77 -0.09 0.00 -0.36 0.00 0.00 55.97 56.27 2i5y s LYS 210 Cb -0.14 -3.39 0.06 0.00 -1.51 0.00 0.00 37.83 32.85 2i5y s LYS 210 CO 0.04 0.23 0.21 0.08 -0.36 0.00 0.00 175.35 175.55 2i5y s VAL 211 N 0.25 4.18 0.17 4.02 1.01 -0.23 -4.87 120.40 124.94 2i5y s VAL 211 Ca 0.33 -1.25 0.02 0.00 0.00 0.00 0.00 61.98 61.09 2i5y s VAL 211 Cb -0.18 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 2i5y s VAL 211 CO 0.17 -0.39 0.31 -1.61 0.00 0.00 0.00 175.10 173.58 2i5y s GLU 212 N 1.44 3.45 0.29 2.72 0.41 -1.26 -4.48 118.70 121.27 2i5y s GLU 212 Ca 0.02 -0.57 0.06 0.00 -0.41 0.00 0.00 54.97 54.07 2i5y s GLU 212 Cb -0.21 -2.94 0.44 0.00 -1.78 0.00 0.00 34.13 29.64 2i5y s GLU 212 CO 0.03 0.49 1.69 -1.35 -0.49 0.00 0.00 175.26 175.63 2i5y h PRO 213 N 2.02 0.24 0.00 0.39 0.11 -1.97 -3.40 132.00 129.38 2i5y h PRO 213 Ca -0.49 -0.11 0.00 0.00 0.11 0.00 0.00 66.00 65.51 2i5y h PRO 213 Cb 1.20 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2i5y h PRO 213 CO 0.68 0.62 0.00 1.63 -0.21 0.00 0.00 178.00 180.72