#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iip s LEU 2 N 0.00 4.00 -0.08 0.00 2.01 -1.26 -5.03 118.68 118.32 3iip s LEU 2 Ca 0.00 2.60 -0.15 0.00 0.01 0.00 0.00 54.13 56.59 3iip s LEU 2 Cb 0.00 -4.16 -0.05 0.00 0.01 0.00 0.00 46.19 41.99 3iip s LEU 2 CO 0.00 -1.17 0.38 0.00 1.01 0.00 0.00 176.35 176.57 3iip s ALA 3 N -1.37 3.61 0.20 4.21 0.00 -1.26 -4.79 121.76 122.36 3iip s ALA 3 Ca 0.65 -0.29 -0.30 0.00 0.00 0.00 0.00 51.96 52.02 3iip s ALA 3 Cb -0.36 -2.44 -0.08 0.00 0.00 0.00 0.00 23.12 20.24 3iip s ALA 3 CO 0.44 0.24 0.97 0.15 0.00 0.00 0.00 175.76 177.57 3iip s LYS 4 N -0.17 4.77 -0.02 0.00 -0.14 0.19 -4.96 119.74 119.41 3iip s LYS 4 Ca 0.22 1.52 0.02 0.00 -1.36 0.00 0.00 55.97 56.38 3iip s LYS 4 Cb -0.15 -3.30 -0.03 0.00 -1.68 0.00 0.00 37.83 32.66 3iip s LYS 4 CO 0.09 0.36 -0.06 1.03 -0.76 0.00 0.00 175.35 176.02 3iip s ARG 5 N -0.77 2.62 -0.27 1.68 0.52 -0.88 -4.33 118.95 117.51 3iip s ARG 5 Ca 0.44 -0.67 -0.06 0.00 -0.52 0.00 0.00 55.73 54.92 3iip s ARG 5 Cb -0.26 -2.54 -0.00 0.00 0.52 0.00 0.00 34.95 32.67 3iip s ARG 5 CO 0.32 0.62 0.05 0.42 0.02 0.00 0.00 175.30 176.73 3iip s ILE 6 N -0.95 3.88 -0.12 1.52 -1.09 -1.26 -1.09 121.20 122.10 3iip s ILE 6 Ca 0.16 -0.57 -0.06 0.00 -2.23 0.00 0.00 60.65 57.95 3iip s ILE 6 Cb -0.11 -2.93 -0.04 0.00 -1.58 0.00 0.00 42.46 37.80 3iip s ILE 6 CO 0.06 0.19 0.10 -1.81 -1.23 0.00 0.00 174.94 172.26 3iip s ASP 7 N 1.51 6.08 -0.22 3.58 1.11 -0.54 -1.48 116.67 126.71 3iip s ASP 7 Ca 0.04 0.37 -0.08 0.00 0.18 0.00 0.00 52.55 53.06 3iip s ASP 7 Cb -0.16 -1.92 -0.04 0.00 1.07 0.00 0.00 42.92 41.87 3iip s ASP 7 CO 0.01 0.39 0.08 0.00 1.18 0.00 0.00 175.17 176.83 3iip s ALA 8 N -0.92 3.31 -0.04 5.23 0.00 -0.65 -2.19 121.76 126.50 3iip s ALA 8 Ca 0.14 -0.95 -0.23 0.00 0.00 0.00 0.00 51.96 50.92 3iip s ALA 8 Cb -0.12 -2.05 -0.04 0.00 0.00 0.00 0.00 23.12 20.91 3iip s ALA 8 CO 0.03 -0.19 0.69 0.00 0.00 0.00 0.00 175.76 176.29 3iip s ALA 9 N 1.07 3.37 -0.10 0.00 0.00 -0.58 -0.67 121.76 124.84 3iip s ALA 9 Ca 0.05 0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.17 3iip s ALA 9 Cb -0.14 -2.92 0.01 0.00 0.00 0.00 0.00 23.12 20.07 3iip s ALA 9 CO 0.03 -0.03 -0.18 -0.51 0.00 0.00 0.00 175.76 175.07 3iip s LEU 10 N 0.50 1.87 -0.21 0.00 1.02 -0.13 -4.52 118.68 117.21 3iip s LEU 10 Ca 0.36 -0.45 -0.15 0.00 0.02 0.00 0.00 54.13 53.91 3iip s LEU 10 Cb -0.18 -1.16 -0.04 0.00 0.02 0.00 0.00 46.19 44.82 3iip s LEU 10 CO 0.19 0.08 0.36 -0.63 0.02 0.00 0.00 176.35 176.36 3iip s ILE 11 N 0.63 5.23 0.11 -0.59 1.01 -1.26 -0.12 121.20 126.22 3iip s ILE 11 Ca -0.14 0.62 0.07 0.00 0.00 0.00 0.00 60.65 61.20 3iip s ILE 11 Cb -0.16 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 3iip s ILE 11 CO 0.04 0.27 -0.16 0.68 0.00 0.00 0.00 174.94 175.77 3iip s VAL 12 N 1.24 1.44 -0.18 2.92 -7.23 0.90 -1.34 120.40 118.14 3iip s VAL 12 Ca 0.17 -1.61 -0.08 0.00 -1.81 0.00 0.00 61.98 58.65 3iip s VAL 12 Cb -0.14 -1.48 0.07 0.00 0.56 0.00 0.00 36.38 35.39 3iip s VAL 12 CO 0.07 -0.28 0.41 -0.75 -0.31 0.00 0.00 175.10 174.25 3iip s LYS 13 N -2.30 0.36 -1.50 4.82 2.20 0.06 -0.92 119.74 122.45 3iip s LYS 13 Ca 0.07 0.91 -0.03 0.00 -0.36 0.00 0.00 55.97 56.55 3iip s LYS 13 Cb -0.07 0.14 0.01 0.00 -1.51 0.00 0.00 37.83 36.40 3iip s LYS 13 CO 0.04 -0.20 0.33 -0.25 -0.36 0.00 0.00 175.35 174.91 3iip n ASP 14 N 4.81 -5.35 -0.02 1.43 8.00 -1.26 -1.63 116.55 122.53 3iip n ASP 14 Ca -0.16 -0.16 -0.00 0.00 0.71 0.00 0.00 54.79 55.18 3iip n ASP 14 Cb 0.52 -4.40 -0.00 0.00 -0.02 0.00 0.00 41.12 37.23 3iip n ASP 14 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3iip n GLY 15 N -1.22 0.43 3.49 0.44 0.00 -1.26 -5.02 105.19 102.04 3iip n GLY 15 Ca -0.14 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 3iip n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3iip s ARG 16 N -0.43 1.78 -0.57 1.61 1.81 -0.65 -4.48 118.95 118.02 3iip s ARG 16 Ca 0.00 -1.19 -0.28 0.00 -1.72 0.00 0.00 55.73 52.54 3iip s ARG 16 Cb 0.00 -2.11 0.02 0.00 -0.45 0.00 0.00 34.95 32.41 3iip s ARG 16 CO 0.00 0.48 1.28 0.08 -0.68 0.00 0.00 175.30 176.46 3iip s VAL 17 N -1.16 3.93 -0.28 3.52 1.01 -0.27 -0.76 120.40 126.38 3iip s VAL 17 Ca 0.18 0.82 -0.32 0.00 0.00 0.00 0.00 61.98 62.66 3iip s VAL 17 Cb -0.11 -4.61 -0.08 0.00 0.00 0.00 0.00 36.38 31.58 3iip s VAL 17 CO 0.10 -1.27 2.20 0.52 0.00 0.00 0.00 175.10 176.66 3iip n VAL 18 N 6.75 0.26 -0.47 2.92 0.31 -0.45 -0.96 118.33 126.69 3iip n VAL 18 Ca 0.10 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 64.08 3iip n VAL 18 Cb 0.49 -2.08 0.00 0.00 -0.91 0.00 0.00 33.84 31.34 3iip n VAL 18 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3iip n GLU 19 N 8.45 0.00 0.00 5.55 4.71 -1.26 -4.83 120.64 133.27 3iip n GLU 19 Ca 0.36 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.51 3iip n GLU 19 Cb 0.33 -1.23 0.00 0.00 -1.01 0.00 0.00 31.44 29.53 3iip n GLU 19 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3iip n GLY 20 N -2.11 0.60 3.82 0.62 0.00 -0.14 -4.95 105.19 103.03 3iip n GLY 20 Ca 0.00 -0.77 -0.07 0.00 0.00 0.00 0.00 46.02 45.18 3iip n GLY 20 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3iip s SER 21 N -4.00 -0.26 -0.32 1.61 1.04 -1.21 -4.89 113.70 105.67 3iip s SER 21 Ca 0.00 -0.55 0.10 0.00 0.48 0.00 0.00 55.95 55.98 3iip s SER 21 Cb 0.00 0.69 0.73 0.00 0.10 0.00 0.00 66.02 67.53 3iip s SER 21 CO 0.00 -1.27 1.78 0.59 0.98 0.00 0.00 173.24 175.32 3iip n ASN 22 N -0.46 4.66 -4.46 7.02 3.02 -0.34 -4.79 115.26 119.92 3iip n ASN 22 Ca -0.05 -3.25 -0.44 0.00 -0.03 0.00 0.00 54.58 50.81 3iip n ASN 22 Cb 0.60 -0.73 -0.00 0.00 -0.61 0.00 0.00 39.78 39.03 3iip n ASN 22 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3iip s PHE 23 N -3.01 3.51 -0.29 3.10 0.08 -1.26 -4.82 117.98 115.29 3iip s PHE 23 Ca 0.54 -2.12 0.28 0.00 0.12 0.00 0.00 56.93 55.75 3iip s PHE 23 Cb 0.44 -4.30 0.92 0.00 -0.57 0.00 0.00 43.02 39.50 3iip s PHE 23 CO 0.13 -1.39 1.80 1.05 -0.10 0.00 0.00 175.22 176.70 3iip h GLU 24 N 7.22 0.00 0.00 0.44 4.11 -1.98 -1.80 114.58 122.57 3iip h GLU 24 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.73 3iip h GLU 24 Cb 0.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 3iip h GLU 24 CO 1.23 0.00 0.07 0.27 0.07 0.00 0.00 179.01 180.65 3iip n ASN 25 N -2.81 0.20 -4.84 3.06 6.94 -1.26 -4.65 115.26 111.90 3iip n ASN 25 Ca 0.03 0.54 -0.35 0.00 -0.02 0.00 0.00 54.58 54.78 3iip n ASN 25 Cb 0.37 -0.56 -0.06 0.00 -2.36 0.00 0.00 39.78 37.18 3iip n ASN 25 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3iip s LEU 26 N -3.48 4.31 0.12 -4.53 1.43 -0.68 -5.01 118.68 110.85 3iip s LEU 26 Ca -0.01 1.15 -0.21 0.00 -1.03 0.00 0.00 54.13 54.03 3iip s LEU 26 Cb 0.02 -3.41 -0.06 0.00 0.03 0.00 0.00 46.19 42.77 3iip s LEU 26 CO 0.07 0.06 1.71 0.03 0.23 0.00 0.00 176.35 178.44 3iip h ARG 27 N 3.38 -0.03 -3.58 1.70 3.08 -1.87 -3.39 114.38 113.66 3iip h ARG 27 Ca -0.48 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.04 3iip h ARG 27 Cb 1.19 0.01 -0.40 0.00 0.08 0.00 0.00 29.97 30.85 3iip h ARG 27 CO 0.66 -0.02 -0.76 0.34 -1.07 0.00 0.00 179.97 179.11 3iip s ASP 28 N -5.17 3.06 0.00 7.04 2.15 -1.26 -5.00 116.67 117.49 3iip s ASP 28 Ca -0.13 -0.91 0.18 0.00 0.43 0.00 0.00 52.55 52.11 3iip s ASP 28 Cb 0.09 -0.65 0.81 0.00 -0.30 0.00 0.00 42.92 42.87 3iip s ASP 28 CO 0.68 -0.31 1.57 -1.54 -0.17 0.00 0.00 175.17 175.39 3iip n SER 29 N 5.02 0.00 -0.81 -0.34 3.41 -1.26 -1.62 113.62 118.01 3iip n SER 29 Ca -0.09 0.38 0.07 0.00 -0.26 0.00 0.00 58.87 58.97 3iip n SER 29 Cb 0.46 -0.44 0.20 0.00 -0.26 0.00 0.00 64.21 64.17 3iip n SER 29 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3iip n GLY 30 N 0.33 2.78 3.55 5.00 0.00 -1.26 -3.32 105.19 112.26 3iip n GLY 30 Ca 0.05 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 45.15 3iip n GLY 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3iip s ASP 31 N -1.04 6.43 0.53 1.61 2.15 -0.64 -1.11 116.67 124.60 3iip s ASP 31 Ca 0.30 -0.04 0.21 0.00 0.43 0.00 0.00 52.55 53.46 3iip s ASP 31 Cb 0.16 -2.38 1.43 0.00 -0.30 0.00 0.00 42.92 41.83 3iip s ASP 31 CO 0.19 -0.87 2.15 1.55 -0.17 0.00 0.00 175.17 178.02 3iip h PRO 32 N 8.88 0.00 0.02 4.34 0.13 -1.88 -0.51 132.00 142.98 3iip h PRO 32 Ca -0.25 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.76 3iip h PRO 32 Cb 1.09 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.23 3iip h PRO 32 CO 0.95 0.04 -0.51 0.28 -0.23 0.00 0.00 178.00 178.53 3iip h VAL 33 N 0.00 1.49 -0.28 1.56 2.07 -1.92 0.09 116.25 119.26 3iip h VAL 33 Ca -0.00 -2.12 -0.17 0.00 0.82 0.00 0.00 66.70 65.23 3iip h VAL 33 Cb 0.09 2.78 -0.00 0.00 -1.52 0.00 0.00 31.29 32.63 3iip h VAL 33 CO 0.01 0.60 -0.50 -0.08 0.02 0.00 0.00 177.57 177.62 3iip h GLU 34 N -0.30 0.77 -0.25 1.57 4.81 -1.81 -0.59 114.58 118.77 3iip h GLU 34 Ca -0.07 -0.46 -0.02 0.00 -0.13 0.00 0.00 59.36 58.69 3iip h GLU 34 Cb 1.26 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.67 3iip h GLU 34 CO 0.10 1.08 0.09 1.25 -0.73 0.00 0.00 179.01 180.80 3iip h LEU 35 N 0.60 0.36 -0.72 1.64 5.85 -1.19 -1.21 115.31 120.65 3iip h LEU 35 Ca 0.03 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.57 3iip h LEU 35 Cb 1.07 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.97 3iip h LEU 35 CO 0.11 0.46 0.46 1.23 -0.34 0.00 0.00 178.44 180.36 3iip h GLY 36 N 0.25 1.02 0.87 3.75 0.00 -0.89 0.13 103.07 108.20 3iip h GLY 36 Ca 0.08 -0.36 -0.05 0.00 0.00 0.00 0.00 47.33 47.00 3iip h GLY 36 CO -0.00 0.33 -0.03 1.70 0.00 0.00 0.00 176.54 178.53 3iip h LYS 37 N 0.93 0.51 0.35 4.80 1.63 -1.03 -1.35 116.57 122.40 3iip h LYS 37 Ca 0.27 -0.18 -0.01 0.00 -0.85 0.00 0.00 60.65 59.88 3iip h LYS 37 Cb -0.05 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 31.54 3iip h LYS 37 CO -0.08 0.69 -0.20 0.35 -3.45 0.00 0.00 179.45 176.76 3iip h PHE 38 N 0.27 -0.53 -1.06 1.91 3.57 -0.90 -2.37 116.94 117.83 3iip h PHE 38 Ca 0.07 -0.01 0.28 0.00 3.53 0.00 0.00 57.97 61.85 3iip h PHE 38 Cb 0.49 0.19 -0.11 0.00 2.79 0.00 0.00 35.95 39.31 3iip h PHE 38 CO 0.04 -0.32 0.67 1.88 -2.23 0.00 0.00 178.31 178.35 3iip h TYR 39 N -0.53 0.73 0.00 0.41 0.05 -0.56 0.92 116.97 117.99 3iip h TYR 39 Ca -0.04 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.77 3iip h TYR 39 Cb 0.43 -0.21 0.00 0.00 1.01 0.00 0.00 36.73 37.96 3iip h TYR 39 CO -0.08 0.02 0.00 -1.13 -1.05 0.00 0.00 178.16 175.91 3iip n SER 40 N -4.71 0.18 -0.02 3.88 3.41 -0.52 -1.56 113.62 114.27 3iip n SER 40 Ca 0.27 0.53 -0.02 0.00 -0.26 0.00 0.00 58.87 59.39 3iip n SER 40 Cb 0.92 -0.57 -0.13 0.00 -0.26 0.00 0.00 64.21 64.17 3iip n SER 40 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3iip n GLU 41 N -1.68 0.65 0.00 4.33 1.02 0.27 -4.20 120.64 121.03 3iip n GLU 41 Ca 0.05 0.08 0.12 0.00 -0.02 0.00 0.00 57.16 57.39 3iip n GLU 41 Cb 0.29 -1.66 0.29 0.00 -0.02 0.00 0.00 31.44 30.34 3iip n GLU 41 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 3iip n ILE 42 N -2.74 0.00 0.00 -3.67 -5.35 -0.92 -4.96 119.36 101.72 3iip n ILE 42 Ca -0.17 -0.06 0.00 0.00 -0.27 0.00 0.00 62.75 62.25 3iip n ILE 42 Cb 0.91 0.36 0.00 0.00 -1.74 0.00 0.00 39.64 39.17 3iip n ILE 42 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3iip n GLY 43 N 1.43 1.18 3.72 3.28 0.00 -1.02 -4.17 105.19 109.61 3iip n GLY 43 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 3iip n GLY 43 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3iip s ILE 44 N -1.50 3.85 0.02 -0.61 -1.09 -0.60 -4.90 121.20 116.36 3iip s ILE 44 Ca 0.00 1.37 0.10 0.00 -2.23 0.00 0.00 60.65 59.89 3iip s ILE 44 Cb 0.00 -3.88 -0.15 0.00 -1.58 0.00 0.00 42.46 36.85 3iip s ILE 44 CO 0.00 0.13 1.19 0.44 -1.23 0.00 0.00 174.94 175.47 3iip h ASP 45 N 6.51 0.00 -5.01 3.58 3.32 -1.59 -3.42 116.42 119.82 3iip h ASP 45 Ca -0.42 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.54 3iip h ASP 45 Cb 1.21 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.58 3iip h ASP 45 CO 0.81 0.86 -0.10 -1.61 -1.72 0.00 0.00 179.24 177.48 3iip s GLU 46 N -2.76 0.85 0.16 3.56 2.02 -1.20 -4.26 118.70 117.07 3iip s GLU 46 Ca 0.01 -0.13 0.10 0.00 0.02 0.00 0.00 54.97 54.97 3iip s GLU 46 Cb 0.09 0.38 -0.04 0.00 0.10 0.00 0.00 34.13 34.66 3iip s GLU 46 CO 0.80 -0.26 -0.19 -0.51 0.02 0.00 0.00 175.26 175.12 3iip s LEU 47 N -1.50 2.63 -0.02 1.80 1.43 -0.86 -1.64 118.68 120.52 3iip s LEU 47 Ca -0.10 -0.70 0.03 0.00 -1.03 0.00 0.00 54.13 52.33 3iip s LEU 47 Cb -0.03 -1.40 -0.00 0.00 0.03 0.00 0.00 46.19 44.80 3iip s LEU 47 CO 0.04 0.14 -0.11 -0.55 0.23 0.00 0.00 176.35 176.10 3iip s SER 48 N -2.51 1.36 -0.05 2.29 0.15 0.15 -1.03 113.70 114.07 3iip s SER 48 Ca 0.20 -0.21 0.03 0.00 0.70 0.00 0.00 55.95 56.67 3iip s SER 48 Cb -0.09 -0.32 0.01 0.00 -1.71 0.00 0.00 66.02 63.90 3iip s SER 48 CO 0.11 0.09 -0.12 -0.36 1.20 0.00 0.00 173.24 174.16 3iip s PHE 49 N 0.08 1.32 -0.18 3.44 0.08 -0.04 -0.96 117.98 121.73 3iip s PHE 49 Ca -0.02 -0.41 0.01 0.00 0.12 0.00 0.00 56.93 56.63 3iip s PHE 49 Cb -0.08 -0.95 0.03 0.00 -0.57 0.00 0.00 43.02 41.45 3iip s PHE 49 CO 0.00 -0.19 -0.13 -0.46 -0.10 0.00 0.00 175.22 174.35 3iip s TRP 50 N 0.38 2.35 -0.15 0.36 -0.11 0.83 -1.21 118.94 121.38 3iip s TRP 50 Ca -0.08 -1.44 -0.08 0.00 1.22 0.00 0.00 56.10 55.72 3iip s TRP 50 Cb -0.12 -1.65 -0.04 0.00 -1.50 0.00 0.00 33.47 30.15 3iip s TRP 50 CO 0.02 -0.72 0.11 0.34 -4.62 0.00 0.00 176.95 172.08 3iip s ASP 51 N 1.42 6.08 -0.09 5.86 2.15 0.26 -0.07 116.67 132.29 3iip s ASP 51 Ca 0.02 0.29 0.13 0.00 0.43 0.00 0.00 52.55 53.42 3iip s ASP 51 Cb -0.14 -2.00 0.26 0.00 -0.30 0.00 0.00 42.92 40.73 3iip s ASP 51 CO -0.10 0.29 1.13 2.30 -0.17 0.00 0.00 175.17 178.62 3iip n ILE 52 N 2.79 1.15 -1.61 4.11 -5.35 -0.10 -3.82 119.36 116.54 3iip n ILE 52 Ca -0.18 -1.65 -0.45 0.00 -0.27 0.00 0.00 62.75 60.20 3iip n ILE 52 Cb 0.53 0.15 -0.02 0.00 -1.74 0.00 0.00 39.64 38.56 3iip n ILE 52 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 3iip n THR 53 N -0.69 1.61 -1.53 7.28 -1.04 -1.26 -4.90 114.28 113.75 3iip n THR 53 Ca 0.11 -0.40 -0.38 0.00 -2.04 0.00 0.00 64.05 61.34 3iip n THR 53 Cb 0.74 -1.07 0.04 0.00 -1.82 0.00 0.00 70.33 68.23 3iip n THR 53 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3iip n ALA 54 N 0.74 -0.57 0.09 2.41 0.00 -1.26 -4.66 120.51 117.26 3iip n ALA 54 Ca 0.11 -0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.60 3iip n ALA 54 Cb 0.31 -1.95 0.51 0.00 0.00 0.00 0.00 19.45 18.32 3iip n ALA 54 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3iip h SER 55 N 0.33 0.28 -0.02 0.00 4.64 -2.00 -2.72 113.55 114.06 3iip h SER 55 Ca -0.47 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 60.84 3iip h SER 55 Cb 1.38 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3iip h SER 55 CO 0.49 0.20 -0.03 0.58 -0.87 0.00 0.00 176.83 177.20 3iip h VAL 56 N 0.33 1.40 -0.00 0.95 2.07 -2.04 -3.05 116.25 115.91 3iip h VAL 56 Ca 0.11 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.39 3iip h VAL 56 Cb 0.03 2.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 3iip h VAL 56 CO -0.02 0.33 -0.17 1.21 0.02 0.00 0.00 177.57 178.94 3iip n GLU 57 N -4.79 0.35 -0.11 1.57 2.13 -1.19 -4.59 120.64 114.01 3iip n GLU 57 Ca -0.08 -0.12 -0.05 0.00 0.66 0.00 0.00 57.16 57.57 3iip n GLU 57 Cb 0.28 -1.50 0.01 0.00 0.27 0.00 0.00 31.44 30.50 3iip n GLU 57 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 3iip h LYS 58 N 0.29 -0.08 -0.22 5.31 3.64 -1.37 -2.33 116.57 121.81 3iip h LYS 58 Ca 0.00 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 3iip h LYS 58 Cb 0.43 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 3iip h LYS 58 CO 0.00 -0.06 0.11 0.00 -2.27 0.00 0.00 179.45 177.23 3iip h ARG 59 N -0.09 0.32 -0.37 1.90 3.08 -1.81 -0.74 114.38 116.67 3iip h ARG 59 Ca 0.19 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 3iip h ARG 59 Cb 0.38 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 3iip h ARG 59 CO -0.44 0.33 0.17 -0.22 -1.07 0.00 0.00 179.97 178.74 3iip h LYS 60 N 0.23 0.52 -0.17 0.04 3.64 -1.87 -1.24 116.57 117.72 3iip h LYS 60 Ca 0.08 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.25 3iip h LYS 60 Cb 0.11 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 3iip h LYS 60 CO -0.01 0.41 -0.53 1.15 -2.27 0.00 0.00 179.45 178.20 3iip h THR 61 N 0.52 1.33 -0.01 1.00 2.02 -0.88 -2.31 112.91 114.58 3iip h THR 61 Ca 0.13 -1.79 -0.16 0.00 0.77 0.00 0.00 66.41 65.37 3iip h THR 61 Cb 0.07 1.78 0.01 0.00 -1.74 0.00 0.00 68.15 68.27 3iip h THR 61 CO -0.02 0.55 -0.61 0.24 0.37 0.00 0.00 175.52 176.05 3iip h MET 62 N 0.38 0.43 -0.48 6.66 2.86 -1.03 -2.52 114.93 121.23 3iip h MET 62 Ca 0.01 -0.45 -0.03 0.00 -2.06 0.00 0.00 59.70 57.17 3iip h MET 62 Cb 1.06 0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.82 3iip h MET 62 CO 0.10 1.11 0.20 1.37 1.06 0.00 0.00 176.91 180.74 3iip h LEU 63 N -0.06 0.63 -0.70 1.22 8.10 -1.22 -2.00 115.31 121.27 3iip h LEU 63 Ca -0.07 -0.07 -0.14 0.00 0.11 0.00 0.00 57.88 57.71 3iip h LEU 63 Cb 1.31 -0.16 -0.01 0.00 -0.44 0.00 0.00 40.66 41.36 3iip h LEU 63 CO 0.12 0.56 -0.54 -0.33 -4.11 0.00 0.00 178.44 174.15 3iip h GLU 64 N 0.69 0.31 0.54 0.17 5.08 -1.42 -2.42 114.58 117.53 3iip h GLU 64 Ca 0.17 -0.19 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 3iip h GLU 64 Cb 0.13 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.41 3iip h GLU 64 CO -0.02 0.77 -0.26 1.25 -1.00 0.00 0.00 179.01 179.75 3iip h LEU 65 N 0.24 -0.62 -0.51 1.33 5.85 -1.00 -1.37 115.31 119.23 3iip h LEU 65 Ca 0.01 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.69 3iip h LEU 65 Cb 1.02 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.18 3iip h LEU 65 CO 0.09 -0.27 0.32 -0.37 -0.34 0.00 0.00 178.44 177.87 3iip h VAL 66 N -1.00 1.09 -0.32 1.05 -1.51 -1.35 0.34 116.25 114.54 3iip h VAL 66 Ca -0.07 -0.22 0.07 0.00 -1.23 0.00 0.00 66.70 65.24 3iip h VAL 66 Cb 0.63 0.38 -0.07 0.00 -2.13 0.00 0.00 31.29 30.11 3iip h VAL 66 CO 0.12 0.12 -0.15 -0.08 -1.23 0.00 0.00 177.57 176.35 3iip h GLU 67 N 0.65 -0.09 0.00 5.19 4.81 -1.50 0.65 114.58 124.28 3iip h GLU 67 Ca 0.20 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.36 3iip h GLU 67 Cb -0.02 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 3iip h GLU 67 CO -0.07 -0.06 -0.34 0.87 -0.73 0.00 0.00 179.01 178.68 3iip h LYS 68 N -0.10 0.00 0.05 1.92 1.57 -0.64 -3.03 116.57 116.35 3iip h LYS 68 Ca 0.16 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.84 3iip h LYS 68 Cb 0.35 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.67 3iip h LYS 68 CO -0.38 0.34 -0.46 0.28 -0.57 0.00 0.00 179.45 178.66 3iip h VAL 69 N 0.00 1.57 -0.13 0.50 2.07 -0.40 -3.09 116.25 116.77 3iip h VAL 69 Ca -0.00 -2.28 0.04 0.00 0.82 0.00 0.00 66.70 65.28 3iip h VAL 69 Cb 0.61 3.05 -0.01 0.00 -1.52 0.00 0.00 31.29 33.42 3iip h VAL 69 CO 0.04 0.63 0.11 0.00 0.02 0.00 0.00 177.57 178.37 3iip h ALA 70 N 0.14 1.99 0.14 1.67 0.00 0.25 0.10 119.26 123.54 3iip h ALA 70 Ca -0.07 -0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.49 3iip h ALA 70 Cb 1.29 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 3iip h ALA 70 CO 0.09 -0.18 -1.79 1.49 0.00 0.00 0.00 179.25 178.86 3iip h GLU 71 N 0.00 0.30 0.00 0.00 4.81 -1.63 -3.39 114.58 114.67 3iip h GLU 71 Ca 0.06 -0.51 -0.13 0.00 -0.13 0.00 0.00 59.36 58.65 3iip h GLU 71 Cb 0.28 0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.83 3iip h GLU 71 CO -0.00 1.24 -1.23 1.96 -0.73 0.00 0.00 179.01 180.25 3iip h GLN 72 N -0.03 0.00 -6.64 1.92 4.20 -1.36 -3.48 115.11 109.73 3iip h GLN 72 Ca -0.37 0.00 -0.66 0.00 0.06 0.00 0.00 58.65 57.68 3iip h GLN 72 Cb 1.98 0.00 -0.18 0.00 0.30 0.00 0.00 27.48 29.58 3iip h GLN 72 CO 0.10 0.26 -0.80 0.96 -0.67 0.00 0.00 178.83 178.68 3iip s ILE 73 N -3.00 2.66 -2.50 2.54 -4.36 -0.02 -4.98 121.20 111.54 3iip s ILE 73 Ca -0.02 -1.78 0.21 0.00 -0.26 0.00 0.00 60.65 58.80 3iip s ILE 73 Cb 0.09 -2.26 0.24 0.00 1.25 0.00 0.00 42.46 41.77 3iip s ILE 73 CO 0.80 -0.04 1.22 -0.90 0.24 0.00 0.00 174.94 176.26 3iip n ASP 74 N 0.42 2.93 -4.83 4.36 5.75 -1.26 -4.77 116.55 119.15 3iip n ASP 74 Ca -0.13 -1.90 -0.22 0.00 -0.01 0.00 0.00 54.79 52.53 3iip n ASP 74 Cb 0.55 -0.07 -0.04 0.00 -1.03 0.00 0.00 41.12 40.52 3iip n ASP 74 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 3iip s ILE 75 N -1.64 3.99 0.43 2.12 -4.36 -1.26 -5.09 121.20 115.40 3iip s ILE 75 Ca 0.28 -1.42 -0.26 0.00 -0.26 0.00 0.00 60.65 58.99 3iip s ILE 75 Cb 0.19 -3.28 -0.08 0.00 1.25 0.00 0.00 42.46 40.53 3iip s ILE 75 CO 0.27 -0.27 1.36 -2.84 0.24 0.00 0.00 174.94 173.70 3iip s PRO 76 N -3.90 3.82 0.04 0.37 0.02 -1.26 -4.89 135.00 129.21 3iip s PRO 76 Ca 0.36 2.27 0.02 0.00 0.02 0.00 0.00 61.00 63.67 3iip s PRO 76 Cb -0.07 -2.70 -0.03 0.00 0.02 0.00 0.00 34.50 31.73 3iip s PRO 76 CO 0.25 -0.65 -0.07 -0.59 -0.33 0.00 0.00 177.00 175.61 3iip s PHE 77 N -1.24 0.64 -0.02 6.54 -0.12 -1.26 -2.02 117.98 120.50 3iip s PHE 77 Ca 0.59 -0.55 0.03 0.00 -0.05 0.00 0.00 56.93 56.94 3iip s PHE 77 Cb -0.41 -0.39 -0.03 0.00 -0.63 0.00 0.00 43.02 41.57 3iip s PHE 77 CO 0.52 -0.11 -0.08 0.99 -0.05 0.00 0.00 175.22 176.50 3iip s THR 78 N -1.64 3.61 -0.06 -4.49 2.01 -0.20 -2.60 115.64 112.27 3iip s THR 78 Ca -0.08 -0.69 0.05 0.00 0.31 0.00 0.00 61.69 61.28 3iip s THR 78 Cb -0.08 -2.53 -0.01 0.00 0.01 0.00 0.00 72.50 69.89 3iip s THR 78 CO -0.00 0.47 -0.23 0.54 -0.69 0.00 0.00 174.62 174.71 3iip s VAL 79 N -0.92 2.25 0.31 3.82 0.11 -0.57 -0.86 120.40 124.55 3iip s VAL 79 Ca 0.15 -1.00 0.07 0.00 -2.93 0.00 0.00 61.98 58.28 3iip s VAL 79 Cb -0.11 -1.83 -0.03 0.00 -1.53 0.00 0.00 36.38 32.88 3iip s VAL 79 CO 0.05 0.57 0.27 0.61 -3.33 0.00 0.00 175.10 173.27 3iip n GLY 80 N 2.90 2.96 0.00 6.54 0.00 -0.35 -0.98 105.19 116.26 3iip n GLY 80 Ca -0.17 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 43.97 3iip n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iip n GLY 81 N -0.59 5.08 2.33 -0.02 0.00 -1.25 -0.57 105.19 110.16 3iip n GLY 81 Ca 0.07 -1.34 -0.07 0.00 0.00 0.00 0.00 46.02 44.68 3iip n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3iip n GLY 82 N 0.00 0.91 3.46 -0.02 0.00 -1.26 -4.68 105.19 103.60 3iip n GLY 82 Ca 0.00 -0.44 -0.43 0.00 0.00 0.00 0.00 46.02 45.15 3iip n GLY 82 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3iip s ILE 83 N -2.15 4.37 -0.45 -0.61 1.01 -1.26 -4.82 121.20 117.29 3iip s ILE 83 Ca 0.00 -0.30 0.11 0.00 0.00 0.00 0.00 60.65 60.46 3iip s ILE 83 Cb 0.00 -4.64 -0.13 0.00 0.01 0.00 0.00 42.46 37.70 3iip s ILE 83 CO 0.00 -1.37 0.43 1.41 0.00 0.00 0.00 174.94 175.42 3iip n HIS 84 N 7.56 0.00 -3.85 3.97 8.25 -1.26 -4.77 115.22 125.12 3iip n HIS 84 Ca -0.03 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.33 3iip n HIS 84 Cb 0.46 -0.03 -0.08 0.00 1.12 0.00 0.00 29.99 31.45 3iip n HIS 84 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 3iip s ASP 85 N -2.19 0.06 0.25 0.41 1.47 -1.26 -5.00 116.67 110.41 3iip s ASP 85 Ca 0.03 -0.45 -0.05 0.00 1.18 0.00 0.00 52.55 53.26 3iip s ASP 85 Cb 0.08 0.30 0.49 0.00 -0.34 0.00 0.00 42.92 43.45 3iip s ASP 85 CO 0.45 -0.60 1.65 0.15 0.68 0.00 0.00 175.17 177.49 3iip h PHE 86 N 3.26 0.08 -0.24 2.11 3.57 -1.94 -2.42 116.94 121.37 3iip h PHE 86 Ca -0.33 0.05 0.06 0.00 3.53 0.00 0.00 57.97 61.29 3iip h PHE 86 Cb 1.19 0.08 -0.07 0.00 2.79 0.00 0.00 35.95 39.94 3iip h PHE 86 CO 0.48 -0.21 -0.30 0.93 -2.23 0.00 0.00 178.31 176.99 3iip h GLU 87 N 0.15 -0.30 -0.74 1.11 5.08 -1.98 0.41 114.58 118.31 3iip h GLU 87 Ca 0.44 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.80 3iip h GLU 87 Cb 0.79 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.08 3iip h GLU 87 CO -0.63 -0.20 0.40 1.15 -1.00 0.00 0.00 179.01 178.73 3iip h THR 88 N -0.31 1.23 0.56 1.13 2.02 -1.94 -1.50 112.91 114.09 3iip h THR 88 Ca 0.13 -0.57 -0.03 0.00 0.77 0.00 0.00 66.41 66.71 3iip h THR 88 Cb 0.52 0.26 0.01 0.00 -1.74 0.00 0.00 68.15 67.19 3iip h THR 88 CO -0.41 0.25 -0.27 0.00 0.37 0.00 0.00 175.52 175.46 3iip h ALA 89 N 1.20 -0.75 -0.90 6.16 0.00 -1.18 -1.88 119.26 121.91 3iip h ALA 89 Ca 0.26 -0.18 0.19 0.00 0.00 0.00 0.00 54.91 55.17 3iip h ALA 89 Cb 0.04 0.29 -0.11 0.00 0.00 0.00 0.00 17.79 18.01 3iip h ALA 89 CO -0.04 -0.87 0.46 1.03 0.00 0.00 0.00 179.25 179.83 3iip h SER 90 N -0.85 0.51 0.18 0.00 0.87 -0.19 -0.86 113.55 113.20 3iip h SER 90 Ca -0.08 0.12 -0.19 0.00 -1.23 0.00 0.00 61.79 60.41 3iip h SER 90 Cb 0.61 0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.62 3iip h SER 90 CO 0.13 0.14 -0.74 -0.08 -0.53 0.00 0.00 176.83 175.75 3iip h GLU 91 N 0.56 0.48 -0.25 2.24 4.57 -1.14 0.00 114.58 121.06 3iip h GLU 91 Ca 0.53 -0.39 -0.06 0.00 -1.18 0.00 0.00 59.36 58.25 3iip h GLU 91 Cb 0.87 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.54 3iip h GLU 91 CO -0.43 1.03 -0.08 -0.07 -1.18 0.00 0.00 179.01 178.28 3iip h LEU 92 N 0.33 0.49 0.32 1.64 3.38 -0.38 0.32 115.31 121.41 3iip h LEU 92 Ca -0.03 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.56 3iip h LEU 92 Cb 1.32 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 3iip h LEU 92 CO 0.13 0.76 -0.43 0.40 0.09 0.00 0.00 178.44 179.40 3iip h ILE 93 N 0.22 0.14 -0.81 1.22 2.04 -1.14 -2.13 117.51 117.05 3iip h ILE 93 Ca 0.06 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.16 3iip h ILE 93 Cb 0.56 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 3iip h ILE 93 CO 0.03 0.00 0.59 -0.07 0.00 0.00 0.00 178.15 178.70 3iip h LEU 94 N -0.80 0.00 -0.16 1.44 3.38 -0.96 0.36 115.31 118.58 3iip h LEU 94 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3iip h LEU 94 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 3iip h LEU 94 CO -0.13 0.00 0.00 -1.14 0.09 0.00 0.00 178.44 177.26 3iip n ARG 95 N -4.27 1.10 0.00 1.13 3.00 0.10 -4.86 116.66 112.86 3iip n ARG 95 Ca 0.17 -0.15 0.00 0.00 -0.00 0.00 0.00 57.85 57.86 3iip n ARG 95 Cb 0.89 -1.41 0.00 0.00 0.00 0.00 0.00 32.46 31.93 3iip n ARG 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3iip n GLY 96 N 0.95 1.28 3.72 5.14 0.00 0.13 -4.03 105.19 112.37 3iip n GLY 96 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3iip n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iip s ALA 97 N -1.92 3.42 0.20 4.61 0.00 -0.85 -4.70 121.76 122.52 3iip s ALA 97 Ca 0.00 0.90 -0.06 0.00 0.00 0.00 0.00 51.96 52.79 3iip s ALA 97 Cb 0.00 -3.45 0.15 0.00 0.00 0.00 0.00 23.12 19.82 3iip s ALA 97 CO 0.00 -0.44 1.65 -0.44 0.00 0.00 0.00 175.76 176.53 3iip h ASP 98 N 6.51 0.92 -5.21 0.00 3.32 -1.83 -3.39 116.42 116.74 3iip h ASP 98 Ca -0.42 -0.28 -0.12 0.00 0.02 0.00 0.00 57.03 56.23 3iip h ASP 98 Cb 1.21 -0.25 -0.15 0.00 0.22 0.00 0.00 39.33 40.36 3iip h ASP 98 CO 0.80 1.03 -0.62 -0.54 -1.72 0.00 0.00 179.24 178.19 3iip s LYS 99 N -4.87 0.64 -0.04 3.56 1.02 -1.08 -4.46 119.74 114.51 3iip s LYS 99 Ca -0.11 -1.13 0.06 0.00 0.02 0.00 0.00 55.97 54.82 3iip s LYS 99 Cb 0.14 0.23 -0.02 0.00 -0.52 0.00 0.00 37.83 37.65 3iip s LYS 99 CO 0.84 -0.14 -0.22 0.14 -0.92 0.00 0.00 175.35 175.06 3iip s VAL 100 N -3.75 2.39 -0.14 3.17 -7.23 -0.59 -1.51 120.40 112.74 3iip s VAL 100 Ca 0.05 -0.97 -0.02 0.00 -1.81 0.00 0.00 61.98 59.23 3iip s VAL 100 Cb 0.06 -1.88 -0.02 0.00 0.56 0.00 0.00 36.38 35.10 3iip s VAL 100 CO -0.10 0.58 -0.08 -0.70 -0.31 0.00 0.00 175.10 174.49 3iip s GLU 101 N -0.50 3.51 0.01 4.82 2.12 -0.15 -1.17 118.70 127.33 3iip s GLU 101 Ca 0.07 -0.60 0.07 0.00 0.36 0.00 0.00 54.97 54.86 3iip s GLU 101 Cb -0.11 -2.77 -0.02 0.00 0.26 0.00 0.00 34.13 31.49 3iip s GLU 101 CO 0.01 0.24 -0.21 0.96 -0.54 0.00 0.00 175.26 175.72 3iip s ILE 102 N 0.31 1.69 0.00 -3.70 -4.36 -0.17 -4.37 121.20 110.61 3iip s ILE 102 Ca -0.07 -1.05 0.00 0.00 -0.26 0.00 0.00 60.65 59.27 3iip s ILE 102 Cb -0.15 -1.44 0.00 0.00 1.25 0.00 0.00 42.46 42.12 3iip s ILE 102 CO 0.04 0.36 0.00 -3.20 0.24 0.00 0.00 174.94 172.38 3iip n ASN 103 N 2.23 0.00 -0.18 4.36 2.85 -1.26 -1.49 115.26 121.77 3iip n ASN 103 Ca -0.16 0.00 -0.01 0.00 -0.11 0.00 0.00 54.58 54.30 3iip n ASN 103 Cb 0.53 0.00 0.07 0.00 1.24 0.00 0.00 39.78 41.62 3iip n ASN 103 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 3iip h THR 104 N 0.00 0.51 -0.90 -0.44 2.02 -1.93 -1.23 112.91 110.93 3iip h THR 104 Ca 0.00 -0.02 0.11 0.00 0.77 0.00 0.00 66.41 67.26 3iip h THR 104 Cb 0.00 0.43 -0.07 0.00 -1.74 0.00 0.00 68.15 66.77 3iip h THR 104 CO 0.00 0.01 0.58 0.00 0.37 0.00 0.00 175.52 176.48 3iip h ALA 105 N 1.52 1.67 -0.32 6.16 0.00 -1.91 0.88 119.26 127.26 3iip h ALA 105 Ca 0.28 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.12 3iip h ALA 105 Cb 0.44 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3iip h ALA 105 CO -0.51 0.13 -0.09 0.00 0.00 0.00 0.00 179.25 178.77 3iip h ALA 106 N 1.56 0.45 -0.36 0.00 0.00 -1.50 0.71 119.26 120.13 3iip h ALA 106 Ca 0.43 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3iip h ALA 106 Cb 0.48 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3iip h ALA 106 CO -0.19 0.30 -0.09 0.28 0.00 0.00 0.00 179.25 179.55 3iip h VAL 107 N 0.41 1.28 0.00 0.00 2.07 -0.72 -2.37 116.25 116.91 3iip h VAL 107 Ca 0.08 -1.15 -0.15 0.00 0.82 0.00 0.00 66.70 66.30 3iip h VAL 107 Cb 0.60 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 3iip h VAL 107 CO 0.04 0.38 -0.71 -0.33 0.02 0.00 0.00 177.57 176.96 3iip h GLU 108 N 0.48 0.00 -2.46 1.57 5.08 -0.83 -3.37 114.58 115.05 3iip h GLU 108 Ca 0.09 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.86 3iip h GLU 108 Cb 0.59 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.45 3iip h GLU 108 CO 0.04 0.71 -0.90 -1.71 -1.00 0.00 0.00 179.01 176.15 3iip n ASN 109 N -3.58 0.46 0.32 1.42 5.15 0.24 -4.99 115.26 114.29 3iip n ASN 109 Ca -0.00 -2.62 0.20 0.00 -0.60 0.00 0.00 54.58 51.55 3iip n ASN 109 Cb 0.72 -0.61 1.07 0.00 -0.53 0.00 0.00 39.78 40.44 3iip n ASN 109 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 3iip h PRO 110 N 5.33 0.00 0.00 1.20 0.11 -1.60 0.24 132.00 137.28 3iip h PRO 110 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 3iip h PRO 110 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 3iip h PRO 110 CO 0.47 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.92 3iip h SER 111 N 0.00 0.00 0.24 -2.05 4.64 -1.93 0.33 113.55 114.78 3iip h SER 111 Ca 0.01 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.30 3iip h SER 111 Cb 0.17 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3iip h SER 111 CO -0.00 0.00 -0.15 0.25 -0.87 0.00 0.00 176.83 176.06 3iip h LEU 112 N 0.00 0.00 0.21 5.97 5.85 -1.29 -0.51 115.31 125.55 3iip h LEU 112 Ca 0.00 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 3iip h LEU 112 Cb 0.48 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.51 3iip h LEU 112 CO 0.00 0.15 -0.10 0.40 -0.34 0.00 0.00 178.44 178.54 3iip h ILE 113 N 0.00 0.86 -0.69 4.05 2.04 -1.10 -2.49 117.51 120.19 3iip h ILE 113 Ca -0.00 -0.75 0.07 0.00 1.00 0.00 0.00 64.86 65.18 3iip h ILE 113 Cb 0.31 1.27 -0.06 0.00 -0.74 0.00 0.00 36.82 37.60 3iip h ILE 113 CO 0.02 0.16 0.38 0.74 0.00 0.00 0.00 178.15 179.44 3iip h THR 114 N -0.68 0.95 0.23 -0.27 2.02 -1.19 -1.52 112.91 112.43 3iip h THR 114 Ca -0.03 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 3iip h THR 114 Cb 0.48 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 3iip h THR 114 CO 0.05 0.12 -0.16 1.56 0.37 0.00 0.00 175.52 177.46 3iip h GLN 115 N 0.68 -0.38 -0.52 6.66 4.20 -1.11 0.50 115.11 125.15 3iip h GLN 115 Ca 0.31 0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.05 3iip h GLN 115 Cb 0.22 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.06 3iip h GLN 115 CO -0.20 -0.25 0.34 0.82 -0.67 0.00 0.00 178.83 178.87 3iip h ILE 116 N -0.39 1.14 -0.67 2.54 2.04 -1.38 -2.97 117.51 117.82 3iip h ILE 116 Ca -0.02 -0.26 0.12 0.00 1.00 0.00 0.00 64.86 65.70 3iip h ILE 116 Cb 0.34 0.38 -0.08 0.00 -0.74 0.00 0.00 36.82 36.72 3iip h ILE 116 CO 0.00 0.13 0.24 0.00 0.00 0.00 0.00 178.15 178.52 3iip h ALA 117 N 1.19 0.88 0.01 1.87 0.00 -0.93 0.57 119.26 122.85 3iip h ALA 117 Ca 0.19 0.10 -0.20 0.00 0.00 0.00 0.00 54.91 55.01 3iip h ALA 117 Cb -0.07 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3iip h ALA 117 CO -0.04 -0.21 -0.93 -0.56 0.00 0.00 0.00 179.25 177.50 3iip h GLN 118 N 0.40 0.04 0.03 0.00 3.07 -0.81 0.50 115.11 118.34 3iip h GLN 118 Ca 0.35 -0.05 -0.20 0.00 0.09 0.00 0.00 58.65 58.83 3iip h GLN 118 Cb 0.49 0.02 0.02 0.00 0.08 0.00 0.00 27.48 28.08 3iip h GLN 118 CO -0.36 0.94 -0.82 1.15 0.09 0.00 0.00 178.83 179.83 3iip h THR 119 N 0.02 1.38 -0.01 1.86 2.02 -1.41 -3.39 112.91 113.37 3iip h THR 119 Ca -0.02 -2.21 0.00 0.00 0.77 0.00 0.00 66.41 64.95 3iip h THR 119 Cb 1.63 2.61 0.00 0.00 -1.74 0.00 0.00 68.15 70.65 3iip h THR 119 CO 0.13 0.66 -0.22 0.49 0.37 0.00 0.00 175.52 176.94 3iip n PHE 120 N -4.06 0.00 0.00 3.16 3.72 0.18 -5.10 117.46 115.36 3iip n PHE 120 Ca -0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 3iip n PHE 120 Cb 0.78 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.32 3iip n PHE 120 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3iip n GLY 121 N 0.97 -1.16 0.48 1.37 0.00 0.18 -4.53 105.19 102.50 3iip n GLY 121 Ca 0.06 -1.42 0.33 0.00 0.00 0.00 0.00 46.02 44.98 3iip n GLY 121 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3iip h SER 122 N 0.00 0.24 0.49 1.61 0.02 -1.75 -1.45 113.55 112.71 3iip h SER 122 Ca 0.00 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 3iip h SER 122 Cb 0.00 0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.58 3iip h SER 122 CO 0.00 -0.03 0.00 1.56 -1.14 0.00 0.00 176.83 177.22 3iip h GLN 123 N 0.17 0.00 -0.01 3.45 7.50 -1.88 -0.52 115.11 123.83 3iip h GLN 123 Ca 0.69 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.84 3iip h GLN 123 Cb 2.21 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.74 3iip h GLN 123 CO -0.24 0.00 -0.41 0.00 -1.50 0.00 0.00 178.83 176.68 3iip n ALA 124 N -1.80 3.40 -3.47 3.87 0.00 -0.54 -4.75 120.51 117.22 3iip n ALA 124 Ca 0.01 -0.42 -0.34 0.00 0.00 0.00 0.00 53.44 52.69 3iip n ALA 124 Cb 0.17 -1.07 -0.14 0.00 0.00 0.00 0.00 19.45 18.40 3iip n ALA 124 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3iip s VAL 125 N -2.70 3.11 -0.15 0.00 1.01 -0.27 -1.55 120.40 119.85 3iip s VAL 125 Ca 0.18 -0.60 -0.00 0.00 0.00 0.00 0.00 61.98 61.56 3iip s VAL 125 Cb 0.18 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 3iip s VAL 125 CO 0.61 0.47 -0.14 -0.69 0.00 0.00 0.00 175.10 175.35 3iip s VAL 126 N 1.12 2.87 -0.30 2.92 1.01 -0.32 -0.44 120.40 127.27 3iip s VAL 126 Ca 0.01 -0.71 -0.11 0.00 0.00 0.00 0.00 61.98 61.17 3iip s VAL 126 Cb -0.14 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.00 3iip s VAL 126 CO -0.02 0.51 0.18 -0.69 0.00 0.00 0.00 175.10 175.08 3iip s VAL 127 N 0.63 4.98 -0.16 2.92 1.01 -0.72 -1.00 120.40 128.07 3iip s VAL 127 Ca -0.08 -0.13 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 3iip s VAL 127 Cb -0.16 -3.46 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 3iip s VAL 127 CO 0.03 0.15 1.17 -0.47 0.00 0.00 0.00 175.10 175.98 3iip s TYR 128 N 1.69 3.08 -0.35 5.22 5.04 -0.55 -1.51 117.35 129.97 3iip s TYR 128 Ca 0.06 1.21 -0.06 0.00 -2.44 0.00 0.00 57.07 55.84 3iip s TYR 128 Cb -0.17 -3.41 0.05 0.00 0.35 0.00 0.00 41.96 38.79 3iip s TYR 128 CO 0.09 -1.21 0.12 0.42 -1.34 0.00 0.00 175.55 173.63 3iip s ILE 129 N 3.13 3.73 -0.22 3.14 1.01 0.43 -4.44 121.20 127.97 3iip s ILE 129 Ca 0.51 -1.24 -0.19 0.00 0.00 0.00 0.00 60.65 59.73 3iip s ILE 129 Cb -0.20 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.08 3iip s ILE 129 CO 0.13 -0.24 0.54 0.00 0.00 0.00 0.00 174.94 175.37 3iip s ALA 130 N 1.37 3.57 0.07 9.38 0.00 -1.26 -0.19 121.76 134.70 3iip s ALA 130 Ca -0.01 -0.46 0.01 0.00 0.00 0.00 0.00 51.96 51.51 3iip s ALA 130 Cb -0.20 -2.88 -0.04 0.00 0.00 0.00 0.00 23.12 20.01 3iip s ALA 130 CO 0.02 -0.59 -0.06 0.00 0.00 0.00 0.00 175.76 175.13 3iip s ALA 131 N 1.97 0.73 -0.17 0.00 0.00 -0.64 -1.74 121.76 121.90 3iip s ALA 131 Ca 0.24 -1.11 -0.19 0.00 0.00 0.00 0.00 51.96 50.89 3iip s ALA 131 Cb -0.16 0.15 0.05 0.00 0.00 0.00 0.00 23.12 23.16 3iip s ALA 131 CO 0.09 -0.19 0.53 0.21 0.00 0.00 0.00 175.76 176.40 3iip s LYS 132 N -3.06 0.67 0.03 0.00 2.20 -0.87 -1.72 119.74 116.99 3iip s LYS 132 Ca 0.03 0.63 -0.30 0.00 -0.36 0.00 0.00 55.97 55.97 3iip s LYS 132 Cb 0.00 0.32 -0.06 0.00 -1.51 0.00 0.00 37.83 36.59 3iip s LYS 132 CO -0.04 -0.11 1.35 1.03 -0.36 0.00 0.00 175.35 177.23 3iip s ARG 133 N 0.03 4.32 -0.15 4.03 0.52 -1.26 -0.92 118.95 125.52 3iip s ARG 133 Ca -0.02 1.94 -0.02 0.00 -0.52 0.00 0.00 55.73 57.11 3iip s ARG 133 Cb -0.04 -3.48 0.04 0.00 0.52 0.00 0.00 34.95 32.00 3iip s ARG 133 CO 0.02 -0.49 -0.00 0.54 0.02 0.00 0.00 175.30 175.38 3iip s VAL 134 N 1.94 0.68 -1.27 3.52 0.11 0.17 -4.83 120.40 120.73 3iip s VAL 134 Ca 0.63 -0.39 -0.01 0.00 -2.93 0.00 0.00 61.98 59.28 3iip s VAL 134 Cb -0.32 -0.98 0.00 0.00 -1.53 0.00 0.00 36.38 33.56 3iip s VAL 134 CO 0.27 0.04 0.86 0.47 -3.33 0.00 0.00 175.10 173.41 3iip n ASP 135 N 5.02 -1.87 -0.93 3.54 8.00 -1.26 -1.81 116.55 127.24 3iip n ASP 135 Ca -0.09 -0.72 -0.12 0.00 0.71 0.00 0.00 54.79 54.56 3iip n ASP 135 Cb 0.48 -4.55 -0.05 0.00 -0.02 0.00 0.00 41.12 36.98 3iip n ASP 135 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3iip n GLY 136 N -1.40 1.23 3.15 0.44 0.00 -1.26 -5.01 105.19 102.34 3iip n GLY 136 Ca -0.27 -0.15 -0.26 0.00 0.00 0.00 0.00 46.02 45.33 3iip n GLY 136 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3iip s GLU 137 N -2.92 1.76 -0.18 1.61 2.02 -0.75 -5.11 118.70 115.13 3iip s GLU 137 Ca 0.00 -0.63 -0.29 0.00 0.02 0.00 0.00 54.97 54.07 3iip s GLU 137 Cb 0.00 -1.55 -0.00 0.00 0.10 0.00 0.00 34.13 32.67 3iip s GLU 137 CO 0.00 0.27 1.14 -0.06 0.02 0.00 0.00 175.26 176.64 3iip s PHE 138 N -0.05 3.13 0.13 1.61 0.08 -1.26 0.45 117.98 122.06 3iip s PHE 138 Ca -0.02 1.26 0.09 0.00 0.12 0.00 0.00 56.93 58.38 3iip s PHE 138 Cb -0.11 -3.38 -0.04 0.00 -0.57 0.00 0.00 43.02 38.92 3iip s PHE 138 CO 0.02 -1.05 -0.16 -1.64 -0.10 0.00 0.00 175.22 172.29 3iip s MET 139 N 3.20 1.85 -0.04 0.44 -1.94 -0.09 -1.03 119.30 121.69 3iip s MET 139 Ca 0.50 -1.20 -0.15 0.00 -1.71 0.00 0.00 55.69 53.12 3iip s MET 139 Cb -0.19 -2.12 -0.05 0.00 2.01 0.00 0.00 34.83 34.48 3iip s MET 139 CO 0.11 0.47 0.41 0.08 -0.01 0.00 0.00 175.02 176.08 3iip s VAL 140 N -1.28 5.09 0.01 -6.03 1.01 0.97 -2.04 120.40 118.13 3iip s VAL 140 Ca 0.20 0.83 0.07 0.00 0.00 0.00 0.00 61.98 63.07 3iip s VAL 140 Cb -0.10 -3.72 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 3iip s VAL 140 CO 0.11 0.51 -0.21 -0.36 0.00 0.00 0.00 175.10 175.16 3iip s PHE 141 N -0.61 1.82 0.48 5.22 2.99 -0.71 -2.13 117.98 125.05 3iip s PHE 141 Ca 0.23 -0.36 0.05 0.00 0.00 0.00 0.00 56.93 56.86 3iip s PHE 141 Cb -0.16 -1.13 0.05 0.00 0.00 0.00 0.00 43.02 41.78 3iip s PHE 141 CO 0.12 0.02 0.42 0.25 -0.00 0.00 0.00 175.22 176.04 3iip n THR 142 N 2.25 0.00 -3.29 0.64 -2.24 0.30 -4.32 114.28 107.62 3iip n THR 142 Ca -0.16 -1.86 -0.11 0.00 -2.27 0.00 0.00 64.05 59.65 3iip n THR 142 Cb 0.53 -0.18 0.02 0.00 -2.10 0.00 0.00 70.33 68.60 3iip n THR 142 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3iip n TYR 143 N -1.72 -2.59 -4.14 4.78 4.01 -1.26 -1.22 117.16 115.02 3iip n TYR 143 Ca 0.01 0.94 -0.31 0.00 -0.16 0.00 0.00 57.90 58.38 3iip n TYR 143 Cb 0.54 -3.82 -0.05 0.00 -0.31 0.00 0.00 39.34 35.69 3iip n TYR 143 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 3iip n SER 144 N -2.31 -0.47 -1.13 7.72 7.64 -1.26 -2.31 113.62 121.49 3iip n SER 144 Ca -0.07 -1.18 -0.13 0.00 1.01 0.00 0.00 58.87 58.49 3iip n SER 144 Cb 0.57 -2.16 -0.05 0.00 -1.01 0.00 0.00 64.21 61.56 3iip n SER 144 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3iip n GLY 145 N -2.28 1.12 0.03 0.23 0.00 -1.12 -4.89 105.19 98.28 3iip n GLY 145 Ca -0.28 -0.38 -0.00 0.00 0.00 0.00 0.00 46.02 45.36 3iip n GLY 145 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3iip n THR 146 N -2.87 0.39 -3.85 2.61 -2.24 -0.84 -4.90 114.28 102.57 3iip n THR 146 Ca -0.14 -0.36 -0.36 0.00 -2.27 0.00 0.00 64.05 60.93 3iip n THR 146 Cb 0.48 -0.28 -0.13 0.00 -2.10 0.00 0.00 70.33 68.29 3iip n THR 146 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3iip s LYS 147 N -2.49 3.40 -0.42 -0.78 2.20 -0.36 -4.96 119.74 116.32 3iip s LYS 147 Ca -0.05 -0.63 -0.29 0.00 -0.36 0.00 0.00 55.97 54.65 3iip s LYS 147 Cb 0.05 -3.14 0.01 0.00 -1.51 0.00 0.00 37.83 33.24 3iip s LYS 147 CO 0.44 -0.23 1.46 1.21 -0.36 0.00 0.00 175.35 177.87 3iip s ASN 148 N 1.51 6.25 0.20 1.43 3.84 -1.26 -0.54 114.94 126.36 3iip s ASN 148 Ca 0.05 0.81 0.22 0.00 0.21 0.00 0.00 52.86 54.15 3iip s ASN 148 Cb -0.15 -2.54 0.90 0.00 -0.55 0.00 0.00 41.25 38.91 3iip s ASN 148 CO -0.01 -1.51 1.67 0.35 -2.79 0.00 0.00 177.10 174.81 3iip n THR 149 N 7.10 0.82 -1.00 -5.21 -2.24 -0.90 -4.89 114.28 107.96 3iip n THR 149 Ca 0.17 0.18 -0.00 0.00 -2.27 0.00 0.00 64.05 62.13 3iip n THR 149 Cb 0.48 -1.06 -0.00 0.00 -2.10 0.00 0.00 70.33 67.65 3iip n THR 149 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3iip n GLY 150 N 0.15 0.22 3.71 3.38 0.00 -1.26 -5.00 105.19 106.39 3iip n GLY 150 Ca 0.03 -0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 3iip n GLY 150 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3iip s ILE 151 N -1.43 5.08 0.18 -0.61 1.01 -1.26 -4.98 121.20 119.18 3iip s ILE 151 Ca 0.00 1.28 -0.31 0.00 0.00 0.00 0.00 60.65 61.63 3iip s ILE 151 Cb 0.00 -3.97 -0.09 0.00 0.01 0.00 0.00 42.46 38.41 3iip s ILE 151 CO 0.00 0.25 1.42 -0.76 0.00 0.00 0.00 174.94 175.85 3iip s LEU 152 N 0.93 4.38 0.30 2.97 1.43 -1.26 -0.02 118.68 127.41 3iip s LEU 152 Ca 0.33 2.48 0.05 0.00 -1.03 0.00 0.00 54.13 55.97 3iip s LEU 152 Cb -0.17 -3.60 0.76 0.00 0.03 0.00 0.00 46.19 43.21 3iip s LEU 152 CO 0.15 -0.67 1.72 0.25 0.23 0.00 0.00 176.35 178.03 3iip h LEU 153 N 6.03 0.50 -1.44 1.79 5.85 -1.37 -0.98 115.31 125.70 3iip h LEU 153 Ca -0.44 0.14 -0.05 0.00 0.84 0.00 0.00 57.88 58.37 3iip h LEU 153 Cb 1.21 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 3iip h LEU 153 CO 0.83 0.08 -0.26 0.08 -0.34 0.00 0.00 178.44 178.83 3iip h ARG 154 N 0.51 0.00 0.09 1.25 0.11 -1.92 -2.03 114.38 112.40 3iip h ARG 154 Ca 0.58 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 60.49 3iip h ARG 154 Cb 1.06 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.15 3iip h ARG 154 CO -0.48 0.26 -0.81 -0.44 0.10 0.00 0.00 179.97 178.59 3iip h ASP 155 N 0.00 0.31 -0.21 0.08 3.32 -1.68 -3.36 116.42 114.88 3iip h ASP 155 Ca -0.00 -0.91 -0.03 0.00 0.02 0.00 0.00 57.03 56.12 3iip h ASP 155 Cb 0.58 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.01 3iip h ASP 155 CO 0.03 1.37 0.06 -0.25 -1.72 0.00 0.00 179.24 178.74 3iip h TRP 156 N -0.54 0.41 -0.54 4.55 -0.00 -0.96 -2.14 115.95 116.73 3iip h TRP 156 Ca -0.17 -0.02 -0.05 0.00 -0.00 0.00 0.00 58.89 58.66 3iip h TRP 156 Cb 1.50 -0.13 -0.02 0.00 -0.00 0.00 0.00 29.16 30.51 3iip h TRP 156 CO 0.19 0.37 0.15 0.28 -0.00 0.00 0.00 178.44 179.43 3iip h VAL 157 N 0.41 1.24 -0.57 2.65 2.07 -1.56 0.29 116.25 120.78 3iip h VAL 157 Ca 0.10 -0.84 -0.11 0.00 0.82 0.00 0.00 66.70 66.66 3iip h VAL 157 Cb 0.17 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 3iip h VAL 157 CO -0.00 0.31 -0.08 0.58 0.02 0.00 0.00 177.57 178.40 3iip h VAL 158 N 0.76 1.27 -0.03 2.57 2.07 -1.66 -2.84 116.25 118.38 3iip h VAL 158 Ca 0.17 -1.24 -0.25 0.00 0.82 0.00 0.00 66.70 66.20 3iip h VAL 158 Cb 0.32 0.91 0.02 0.00 -1.52 0.00 0.00 31.29 31.02 3iip h VAL 158 CO -0.00 0.44 -0.96 -0.08 0.02 0.00 0.00 177.57 176.99 3iip h GLU 159 N 0.94 0.71 -0.92 1.57 4.57 -1.18 -1.35 114.58 118.93 3iip h GLU 159 Ca 0.15 -0.72 0.03 0.00 -1.18 0.00 0.00 59.36 57.64 3iip h GLU 159 Cb 0.65 0.19 -0.05 0.00 -0.16 0.00 0.00 28.75 29.38 3iip h GLU 159 CO 0.04 1.30 0.60 0.28 -1.18 0.00 0.00 179.01 180.06 3iip h VAL 160 N 0.40 1.18 -0.11 0.32 2.07 -0.46 -0.49 116.25 119.16 3iip h VAL 160 Ca -0.11 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 66.96 3iip h VAL 160 Cb 1.61 -0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 31.28 3iip h VAL 160 CO 0.19 0.21 -0.11 -0.08 0.02 0.00 0.00 177.57 177.80 3iip h GLU 161 N 1.17 0.27 -0.71 1.57 4.81 -1.42 -2.60 114.58 117.67 3iip h GLU 161 Ca 0.36 -0.14 0.12 0.00 -0.13 0.00 0.00 59.36 59.56 3iip h GLU 161 Cb -0.02 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 29.28 3iip h GLU 161 CO -0.10 0.68 0.29 -0.22 -0.73 0.00 0.00 179.01 178.93 3iip h LYS 162 N -0.13 0.46 0.00 1.92 3.64 -1.19 -1.41 116.57 119.85 3iip h LYS 162 Ca 0.02 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3iip h LYS 162 Cb 0.63 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 3iip h LYS 162 CO 0.03 0.30 0.00 0.54 -2.27 0.00 0.00 179.45 178.05 3iip n ARG 163 N -4.97 0.04 -0.40 1.90 5.12 -0.20 -4.90 116.66 113.26 3iip n ARG 163 Ca 0.12 0.38 0.00 0.00 -1.93 0.00 0.00 57.85 56.42 3iip n ARG 163 Cb 0.35 -1.60 0.00 0.00 -1.16 0.00 0.00 32.46 30.04 3iip n ARG 163 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3iip n GLY 164 N -0.49 1.52 3.78 -0.13 0.00 -0.53 -2.66 105.19 106.69 3iip n GLY 164 Ca 0.02 -0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 3iip n GLY 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iip s ALA 165 N -2.00 2.48 -0.12 4.61 0.00 -0.99 -4.37 121.76 121.37 3iip s ALA 165 Ca 0.00 0.33 0.20 0.00 0.00 0.00 0.00 51.96 52.49 3iip s ALA 165 Cb 0.00 -3.26 -0.26 0.00 0.00 0.00 0.00 23.12 19.60 3iip s ALA 165 CO 0.00 -1.37 0.39 0.41 0.00 0.00 0.00 175.76 175.19 3iip n GLY 166 N -1.13 -1.04 3.38 0.00 0.00 0.42 -4.84 105.19 101.98 3iip n GLY 166 Ca 0.09 -0.38 -0.14 0.00 0.00 0.00 0.00 46.02 45.59 3iip n GLY 166 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3iip s GLU 167 N -3.03 0.99 -0.07 1.61 2.12 -1.13 -4.29 118.70 114.90 3iip s GLU 167 Ca -0.08 -0.18 0.04 0.00 0.36 0.00 0.00 54.97 55.11 3iip s GLU 167 Cb 0.10 0.45 0.00 0.00 0.26 0.00 0.00 34.13 34.94 3iip s GLU 167 CO 0.86 -0.34 -0.19 0.42 -0.54 0.00 0.00 175.26 175.47 3iip s ILE 168 N -2.18 1.67 -0.10 -3.70 1.01 -0.69 -1.75 121.20 115.46 3iip s ILE 168 Ca -0.07 -0.81 -0.21 0.00 0.00 0.00 0.00 60.65 59.55 3iip s ILE 168 Cb -0.01 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.98 3iip s ILE 168 CO 0.00 0.47 0.62 -0.69 0.00 0.00 0.00 174.94 175.35 3iip s VAL 169 N 0.27 5.09 -0.39 2.92 1.01 -0.57 -0.89 120.40 127.83 3iip s VAL 169 Ca -0.12 1.26 -0.04 0.00 0.00 0.00 0.00 61.98 63.09 3iip s VAL 169 Cb -0.15 -3.96 0.10 0.00 0.00 0.00 0.00 36.38 32.36 3iip s VAL 169 CO 0.05 0.26 0.18 -0.22 0.00 0.00 0.00 175.10 175.37 3iip s LEU 170 N 0.88 5.04 -0.21 3.92 2.96 0.15 -0.43 118.68 130.99 3iip s LEU 170 Ca 0.33 -1.83 -0.08 0.00 -0.22 0.00 0.00 54.13 52.33 3iip s LEU 170 Cb -0.17 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.64 3iip s LEU 170 CO 0.15 -0.50 0.09 -0.83 -1.32 0.00 0.00 176.35 173.93 3iip s GLY 171 N 1.81 1.90 -0.51 7.98 0.00 0.73 -2.11 107.32 117.12 3iip s GLY 171 Ca 0.05 -0.86 -0.19 0.00 0.00 0.00 0.00 44.72 43.73 3iip s GLY 171 CO -0.03 0.24 0.61 -0.45 0.00 0.00 0.00 173.10 173.47 3iip s SER 172 N 0.79 6.22 0.22 1.64 0.15 -1.13 -1.63 113.70 119.96 3iip s SER 172 Ca 0.05 -0.96 -0.08 0.00 0.70 0.00 0.00 55.95 55.66 3iip s SER 172 Cb -0.13 -2.28 0.34 0.00 -1.71 0.00 0.00 66.02 62.24 3iip s SER 172 CO 0.02 -0.88 1.74 0.40 1.20 0.00 0.00 173.24 175.72 3iip h ILE 173 N 5.86 0.73 0.00 6.45 2.04 -1.69 -1.95 117.51 128.94 3iip h ILE 173 Ca -0.28 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.44 3iip h ILE 173 Cb 1.10 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 3iip h ILE 173 CO 0.96 0.08 0.02 -2.24 0.00 0.00 0.00 178.15 176.97 3iip h ASP 174 N 0.42 0.00 -0.02 1.72 3.04 -1.92 -0.60 116.42 119.06 3iip h ASP 174 Ca 0.35 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.14 3iip h ASP 174 Cb 0.46 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.75 3iip h ASP 174 CO -0.34 0.00 -0.01 0.54 -2.04 0.00 0.00 179.24 177.38 3iip n ARG 175 N -2.45 2.03 -1.68 4.15 5.12 -0.73 -4.80 116.66 118.30 3iip n ARG 175 Ca -0.02 -1.52 -0.48 0.00 -1.93 0.00 0.00 57.85 53.90 3iip n ARG 175 Cb 0.06 -1.47 -0.05 0.00 -1.16 0.00 0.00 32.46 29.84 3iip n ARG 175 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 3iip n LEU 176 N 0.84 3.38 0.00 0.55 -0.00 -0.24 -0.94 117.00 120.60 3iip n LEU 176 Ca 0.16 0.99 0.00 0.00 -0.00 0.00 0.00 56.01 57.16 3iip n LEU 176 Cb 0.50 -1.37 0.00 0.00 -0.00 0.00 0.00 43.42 42.55 3iip n LEU 176 CO 0.16 -0.09 0.00 0.61 -0.00 0.00 0.00 177.39 178.07 3iip n GLY 177 N 4.28 0.86 0.14 -3.96 0.00 -1.26 -4.97 105.19 100.27 3iip n GLY 177 Ca 0.22 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.28 3iip n GLY 177 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3iip h THR 178 N 0.00 0.59 0.00 2.61 1.35 -1.35 -3.49 112.91 112.62 3iip h THR 178 Ca 0.00 -1.89 0.00 0.00 -0.55 0.00 0.00 66.41 63.97 3iip h THR 178 Cb 0.00 2.20 0.00 0.00 -1.73 0.00 0.00 68.15 68.62 3iip h THR 178 CO 0.00 0.33 0.00 0.29 -0.25 0.00 0.00 175.52 175.89 3iip n LYS 179 N -3.09 -0.69 -0.30 4.72 4.01 -1.16 -4.86 118.16 116.79 3iip n LYS 179 Ca -0.00 0.17 0.07 0.00 -0.51 0.00 0.00 58.31 58.04 3iip n LYS 179 Cb 0.71 -3.98 0.21 0.00 -0.51 0.00 0.00 35.03 31.47 3iip n LYS 179 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 3iip n SER 180 N -0.35 3.41 0.00 4.39 7.64 -1.06 -3.92 113.62 123.73 3iip n SER 180 Ca 0.00 -2.31 0.00 0.00 1.01 0.00 0.00 58.87 57.57 3iip n SER 180 Cb 0.17 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.01 3iip n SER 180 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3iip n GLY 181 N 0.35 3.76 3.74 0.23 0.00 -0.34 -5.00 105.19 107.93 3iip n GLY 181 Ca 0.16 -1.69 -0.32 0.00 0.00 0.00 0.00 46.02 44.17 3iip n GLY 181 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3iip s TYR 182 N -2.35 2.26 -1.32 1.61 2.02 -1.26 -4.31 117.35 114.00 3iip s TYR 182 Ca 0.00 1.63 -0.16 0.00 -0.37 0.00 0.00 57.07 58.16 3iip s TYR 182 Cb 0.00 -3.19 0.08 0.00 -0.40 0.00 0.00 41.96 38.45 3iip s TYR 182 CO 0.00 -2.15 1.81 -3.47 -1.57 0.00 0.00 175.55 170.17 3iip n ASP 183 N -3.51 4.77 0.04 2.29 -0.08 -1.26 -4.76 116.55 114.04 3iip n ASP 183 Ca 0.10 -2.92 -0.02 0.00 -1.51 0.00 0.00 54.79 50.45 3iip n ASP 183 Cb 0.52 -1.70 0.26 0.00 2.34 0.00 0.00 41.12 42.54 3iip n ASP 183 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 3iip h THR 184 N 5.09 1.24 -0.67 5.18 1.35 -1.92 -0.51 112.91 122.67 3iip h THR 184 Ca 0.46 -1.13 0.06 0.00 -0.55 0.00 0.00 66.41 65.25 3iip h THR 184 Cb 0.82 1.30 -0.05 0.00 -1.73 0.00 0.00 68.15 68.48 3iip h THR 184 CO 1.52 0.36 0.38 -0.08 -0.25 0.00 0.00 175.52 177.45 3iip h GLU 185 N 0.37 0.68 -0.17 4.72 4.81 -1.98 0.39 114.58 123.40 3iip h GLU 185 Ca 0.06 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.22 3iip h GLU 185 Cb 0.57 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 3iip h GLU 185 CO 0.04 0.45 -0.03 1.98 -0.73 0.00 0.00 179.01 180.72 3iip h MET 186 N 0.70 0.31 -0.74 1.92 4.05 -1.78 -1.06 114.93 118.34 3iip h MET 186 Ca 0.30 -0.11 0.08 0.00 -0.28 0.00 0.00 59.70 59.68 3iip h MET 186 Cb 0.17 -0.02 -0.06 0.00 -0.80 0.00 0.00 31.60 30.89 3iip h MET 186 CO -0.18 0.57 0.41 0.82 0.23 0.00 0.00 176.91 178.76 3iip h ILE 187 N 0.03 0.93 -0.35 1.77 2.04 -0.97 -1.89 117.51 119.07 3iip h ILE 187 Ca 0.04 -0.25 -0.05 0.00 1.00 0.00 0.00 64.86 65.60 3iip h ILE 187 Cb 0.45 0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 3iip h ILE 187 CO 0.01 0.13 -0.01 0.03 0.00 0.00 0.00 178.15 178.31 3iip h ARG 188 N 0.72 0.56 0.04 2.37 3.08 -0.04 -1.59 114.38 119.52 3iip h ARG 188 Ca 0.34 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 60.26 3iip h ARG 188 Cb 0.27 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.24 3iip h ARG 188 CO -0.22 0.59 -0.02 0.35 -1.07 0.00 0.00 179.97 179.61 3iip h PHE 189 N 0.53 -0.05 -0.06 3.04 3.57 -0.84 -3.22 116.94 119.92 3iip h PHE 189 Ca 0.11 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.50 3iip h PHE 189 Cb 0.36 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 3iip h PHE 189 CO 0.01 0.03 -0.48 0.28 -2.23 0.00 0.00 178.31 175.93 3iip h VAL 190 N -0.11 1.34 -0.54 1.41 2.07 -1.20 -3.38 116.25 115.83 3iip h VAL 190 Ca -0.01 -1.67 0.11 0.00 0.82 0.00 0.00 66.70 65.95 3iip h VAL 190 Cb 0.10 1.83 -0.09 0.00 -1.52 0.00 0.00 31.29 31.61 3iip h VAL 190 CO 0.01 0.49 -0.02 -0.09 0.02 0.00 0.00 177.57 177.98 3iip h ARG 191 N 0.11 0.09 -0.00 1.57 9.65 -1.29 -0.06 114.38 124.45 3iip h ARG 191 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3iip h ARG 191 Cb 0.89 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.45 3iip h ARG 191 CO 0.07 0.06 -0.01 -0.35 2.80 0.00 0.00 179.97 182.54 3iip n PRO 192 N -5.27 0.51 0.12 0.20 -0.04 -1.26 -3.65 135.00 125.61 3iip n PRO 192 Ca 0.06 -0.03 0.12 0.00 -0.04 0.00 0.00 63.50 63.61 3iip n PRO 192 Cb 0.30 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.31 3iip n PRO 192 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3iip h LEU 193 N 0.07 0.00 -7.71 1.53 3.38 -1.21 -3.47 115.31 107.89 3iip h LEU 193 Ca 0.00 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.79 3iip h LEU 193 Cb 0.27 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 40.80 3iip h LEU 193 CO 0.00 0.01 -0.49 0.28 0.09 0.00 0.00 178.44 178.33 3iip s THR 194 N -3.31 0.07 -2.49 0.22 -1.32 -1.23 -4.66 115.64 102.92 3iip s THR 194 Ca 0.02 -0.56 0.23 0.00 -1.21 0.00 0.00 61.69 60.17 3iip s THR 194 Cb 0.09 -0.40 0.42 0.00 -1.51 0.00 0.00 72.50 71.10 3iip s THR 194 CO 0.76 -0.31 1.42 0.35 -2.21 0.00 0.00 174.62 174.63 3iip n THR 195 N 1.73 0.43 -2.35 5.08 -2.24 -1.26 -4.86 114.28 110.82 3iip n THR 195 Ca -0.21 -0.68 -0.35 0.00 -2.27 0.00 0.00 64.05 60.55 3iip n THR 195 Cb 0.56 0.93 -0.01 0.00 -2.10 0.00 0.00 70.33 69.71 3iip n THR 195 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3iip s LEU 196 N -1.53 3.82 0.24 3.22 1.43 -1.26 -4.96 118.68 119.63 3iip s LEU 196 Ca 0.37 2.12 -0.31 0.00 -1.03 0.00 0.00 54.13 55.28 3iip s LEU 196 Cb 0.22 -4.52 -0.14 0.00 0.03 0.00 0.00 46.19 41.78 3iip s LEU 196 CO 0.31 -1.04 1.33 -2.65 0.23 0.00 0.00 176.35 174.53 3iip n PRO 197 N -1.06 1.83 -4.08 1.29 -0.02 -1.26 -4.85 135.00 126.85 3iip n PRO 197 Ca 0.10 0.65 -0.35 0.00 -2.02 0.00 0.00 63.50 61.89 3iip n PRO 197 Cb 0.51 -2.26 -0.13 0.00 -0.02 0.00 0.00 33.50 31.60 3iip n PRO 197 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3iip s ILE 198 N -0.20 3.72 -0.25 4.25 1.01 -1.26 -1.70 121.20 126.76 3iip s ILE 198 Ca 0.68 -0.39 -0.08 0.00 0.00 0.00 0.00 60.65 60.86 3iip s ILE 198 Cb -0.69 -2.68 -0.03 0.00 0.01 0.00 0.00 42.46 39.07 3iip s ILE 198 CO 0.51 0.43 0.09 -0.63 0.00 0.00 0.00 174.94 175.35 3iip s ILE 199 N 1.10 4.56 0.19 2.92 1.01 -0.07 -0.80 121.20 130.10 3iip s ILE 199 Ca 0.02 -0.09 -0.27 0.00 0.00 0.00 0.00 60.65 60.31 3iip s ILE 199 Cb -0.14 -3.13 -0.08 0.00 0.01 0.00 0.00 42.46 39.11 3iip s ILE 199 CO 0.01 0.33 0.84 0.00 0.00 0.00 0.00 174.94 176.12 3iip s ALA 200 N 1.53 3.40 -0.05 9.38 0.00 -0.71 0.33 121.76 135.65 3iip s ALA 200 Ca 0.06 0.46 -0.06 0.00 0.00 0.00 0.00 51.96 52.42 3iip s ALA 200 Cb -0.15 -3.06 0.01 0.00 0.00 0.00 0.00 23.12 19.93 3iip s ALA 200 CO 0.05 0.25 0.16 -1.58 0.00 0.00 0.00 175.76 174.64 3iip s HIS 201 N -1.11 -0.13 0.00 0.00 5.04 -0.90 0.22 115.29 118.40 3iip s HIS 201 Ca 0.38 0.32 0.00 0.00 -1.54 0.00 0.00 55.06 54.22 3iip s HIS 201 Cb -0.24 0.04 0.00 0.00 0.04 0.00 0.00 32.58 32.42 3iip s HIS 201 CO 0.28 -0.13 0.00 0.54 -2.34 0.00 0.00 174.74 173.09 3iip n ARG 202 N 2.67 0.00 0.00 2.88 5.12 -1.26 -2.85 116.66 123.22 3iip n ARG 202 Ca -0.15 0.37 0.00 0.00 -1.93 0.00 0.00 57.85 56.14 3iip n ARG 202 Cb 0.58 -0.01 0.00 0.00 -1.16 0.00 0.00 32.46 31.87 3iip n ARG 202 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3iip n GLY 203 N 0.78 0.78 3.64 -0.13 0.00 -1.22 -4.11 105.19 104.93 3iip n GLY 203 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.54 3iip n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iip n ALA 204 N 0.00 0.37 0.00 4.61 0.00 -1.26 -1.19 120.51 123.04 3iip n ALA 204 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.91 3iip n ALA 204 Cb 0.00 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.23 3iip n ALA 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3iip n GLY 205 N 2.87 0.00 3.26 0.00 0.00 -1.25 -4.52 105.19 105.54 3iip n GLY 205 Ca 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 3iip n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iip s LYS 206 N -0.32 1.02 0.25 1.61 -2.85 -1.26 -4.90 119.74 113.30 3iip s LYS 206 Ca 0.00 -1.19 -0.03 0.00 -1.00 0.00 0.00 55.97 53.75 3iip s LYS 206 Cb 0.00 0.33 0.45 0.00 -2.06 0.00 0.00 37.83 36.55 3iip s LYS 206 CO 0.00 -0.34 1.81 0.52 0.10 0.00 0.00 175.35 177.44 3iip h MET 207 N 2.69 0.78 -0.61 1.78 2.86 -1.99 -2.11 114.93 118.32 3iip h MET 207 Ca -0.33 -0.05 0.09 0.00 -2.06 0.00 0.00 59.70 57.35 3iip h MET 207 Cb 1.21 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 32.66 3iip h MET 207 CO 0.53 0.51 0.40 0.93 1.06 0.00 0.00 176.91 180.35 3iip h GLU 208 N 0.80 0.47 -0.91 1.72 3.07 -1.99 -1.94 114.58 115.79 3iip h GLU 208 Ca 0.43 -0.03 0.24 0.00 -0.50 0.00 0.00 59.36 59.49 3iip h GLU 208 Cb 0.44 -0.11 -0.06 0.00 -0.84 0.00 0.00 28.75 28.19 3iip h GLU 208 CO -0.27 0.31 0.63 0.45 -1.40 0.00 0.00 179.01 178.72 3iip h HIS 209 N 0.48 0.32 0.17 4.33 3.86 -1.80 -1.49 115.15 121.01 3iip h HIS 209 Ca 0.27 0.01 -0.31 0.00 -1.16 0.00 0.00 60.37 59.18 3iip h HIS 209 Cb 0.45 -0.10 0.03 0.00 1.06 0.00 0.00 27.41 28.85 3iip h HIS 209 CO -0.00 0.07 -1.33 0.74 0.86 0.00 0.00 177.93 178.27 3iip h PHE 210 N 0.23 0.94 -0.13 2.45 0.04 -1.48 -2.49 116.94 116.49 3iip h PHE 210 Ca 0.46 -0.63 -0.00 0.00 2.80 0.00 0.00 57.97 60.60 3iip h PHE 210 Cb 1.45 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 39.53 3iip h PHE 210 CO -0.00 1.48 0.07 1.25 -0.60 0.00 0.00 178.31 180.51 3iip h LEU 211 N 0.21 0.17 -0.73 1.54 5.85 -1.42 -2.37 115.31 118.56 3iip h LEU 211 Ca -0.21 -0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.48 3iip h LEU 211 Cb 2.01 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 42.93 3iip h LEU 211 CO 0.25 0.23 0.40 -0.33 -0.34 0.00 0.00 178.44 178.65 3iip h GLU 212 N 0.10 0.69 -0.36 1.25 5.08 -1.30 -1.55 114.58 118.49 3iip h GLU 212 Ca 0.05 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 3iip h GLU 212 Cb 0.10 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 3iip h GLU 212 CO -0.01 0.46 -0.06 0.00 -1.00 0.00 0.00 179.01 178.39 3iip h ALA 213 N 1.40 1.22 -0.40 3.43 0.00 -1.32 -1.06 119.26 122.54 3iip h ALA 213 Ca 0.34 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 3iip h ALA 213 Cb 0.28 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3iip h ALA 213 CO -0.22 0.51 -0.31 0.74 0.00 0.00 0.00 179.25 179.96 3iip h PHE 214 N 0.56 1.04 -0.88 0.00 0.04 -1.13 -1.57 116.94 115.00 3iip h PHE 214 Ca 0.11 -0.28 0.01 0.00 2.80 0.00 0.00 57.97 60.61 3iip h PHE 214 Cb 0.45 -0.23 -0.05 0.00 2.20 0.00 0.00 35.95 38.33 3iip h PHE 214 CO 0.02 1.08 0.58 -0.07 -0.60 0.00 0.00 178.31 179.32 3iip h LEU 215 N 0.74 0.99 -2.48 1.54 3.38 -1.24 -2.18 115.31 116.07 3iip h LEU 215 Ca 0.08 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3iip h LEU 215 Cb 0.88 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 3iip h LEU 215 CO 0.08 0.71 0.02 0.00 0.09 0.00 0.00 178.44 179.33 3iip h ALA 216 N 1.33 1.52 0.00 1.53 0.00 -1.10 -3.46 119.26 119.08 3iip h ALA 216 Ca 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3iip h ALA 216 Cb -0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3iip h ALA 216 CO -0.08 -0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.56 3iip n GLY 217 N -1.32 1.08 3.76 0.00 0.00 -0.82 -4.13 105.19 103.77 3iip n GLY 217 Ca -0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 3iip n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3iip s ALA 218 N -1.85 2.96 -0.15 4.61 0.00 -0.61 -4.79 121.76 121.93 3iip s ALA 218 Ca 0.00 1.07 0.22 0.00 0.00 0.00 0.00 51.96 53.25 3iip s ALA 218 Cb 0.00 -3.44 -0.15 0.00 0.00 0.00 0.00 23.12 19.53 3iip s ALA 218 CO 0.00 -0.86 0.80 -0.25 0.00 0.00 0.00 175.76 175.45 3iip n ASP 219 N -0.56 0.48 -3.75 0.00 8.00 0.02 -4.58 116.55 116.16 3iip n ASP 219 Ca 0.08 0.19 -0.10 0.00 0.71 0.00 0.00 54.79 55.67 3iip n ASP 219 Cb 0.47 1.12 -0.06 0.00 -0.02 0.00 0.00 41.12 42.63 3iip n ASP 219 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3iip s ALA 220 N -3.43 -0.57 -0.08 2.24 0.00 -0.89 -2.08 121.76 116.95 3iip s ALA 220 Ca -0.04 -0.35 -0.00 0.00 0.00 0.00 0.00 51.96 51.57 3iip s ALA 220 Cb 0.11 0.60 0.02 0.00 0.00 0.00 0.00 23.12 23.86 3iip s ALA 220 CO 0.84 -0.58 -0.04 0.00 0.00 0.00 0.00 175.76 175.98 3iip s ALA 221 N -3.84 0.95 -0.16 0.00 0.00 -0.25 -1.73 121.76 116.73 3iip s ALA 221 Ca 0.04 -0.28 -0.07 0.00 0.00 0.00 0.00 51.96 51.65 3iip s ALA 221 Cb 0.03 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 3iip s ALA 221 CO -0.11 -0.34 0.09 0.21 0.00 0.00 0.00 175.76 175.60 3iip s LYS 222 N 1.65 3.83 0.22 0.00 2.20 0.13 -1.47 119.74 126.30 3iip s LYS 222 Ca 0.01 -0.28 0.00 0.00 -0.36 0.00 0.00 55.97 55.35 3iip s LYS 222 Cb -0.13 -3.22 -0.04 0.00 -1.51 0.00 0.00 37.83 32.94 3iip s LYS 222 CO -0.05 0.42 0.15 0.00 -0.36 0.00 0.00 175.35 175.52 3iip s ALA 223 N -0.03 1.29 0.00 3.13 0.00 -0.93 -4.33 121.76 120.89 3iip s ALA 223 Ca 0.08 -1.76 0.00 0.00 0.00 0.00 0.00 51.96 50.27 3iip s ALA 223 Cb -0.12 1.40 0.00 0.00 0.00 0.00 0.00 23.12 24.41 3iip s ALA 223 CO 0.01 -0.60 0.00 -0.40 0.00 0.00 0.00 175.76 174.76 3iip n ASP 224 N -0.48 0.00 -0.25 0.00 5.75 -1.26 -1.53 116.55 118.77 3iip n ASP 224 Ca 0.03 0.00 0.18 0.00 -0.01 0.00 0.00 54.79 54.99 3iip n ASP 224 Cb 0.65 0.00 0.48 0.00 -1.03 0.00 0.00 41.12 41.23 3iip n ASP 224 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 3iip h SER 225 N 0.00 0.46 0.14 -1.12 4.64 -1.98 0.43 113.55 116.12 3iip h SER 225 Ca 0.00 0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.35 3iip h SER 225 Cb 0.00 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3iip h SER 225 CO 0.00 0.19 -0.06 -0.37 -0.87 0.00 0.00 176.83 175.71 3iip h VAL 226 N 0.46 0.68 0.00 0.95 -1.51 -1.92 -1.43 116.25 113.48 3iip h VAL 226 Ca 0.48 -0.26 -0.16 0.00 -1.23 0.00 0.00 66.70 65.54 3iip h VAL 226 Cb 1.11 1.16 -0.02 0.00 -2.13 0.00 0.00 31.29 31.40 3iip h VAL 226 CO -0.20 0.06 -0.84 -0.26 -1.23 0.00 0.00 177.57 175.10 3iip h PHE 227 N 0.00 0.01 -0.83 5.19 0.04 -0.46 -1.51 116.94 119.38 3iip h PHE 227 Ca -0.00 -0.01 0.09 0.00 2.80 0.00 0.00 57.97 60.86 3iip h PHE 227 Cb 0.15 -0.00 -0.07 0.00 2.20 0.00 0.00 35.95 38.23 3iip h PHE 227 CO 0.00 1.33 0.48 0.45 -0.60 0.00 0.00 178.31 179.97 3iip h HIS 228 N -0.98 0.87 -0.59 -0.55 3.86 -1.05 -0.92 115.15 115.78 3iip h HIS 228 Ca -0.23 0.03 -0.15 0.00 -1.16 0.00 0.00 60.37 58.86 3iip h HIS 228 Cb 1.21 -0.26 -0.09 0.00 1.06 0.00 0.00 27.41 29.33 3iip h HIS 228 CO 0.16 0.36 0.19 1.19 0.86 0.00 0.00 177.93 180.69 3iip n PHE 229 N -4.74 1.97 -2.93 2.45 3.72 -0.55 -1.19 117.46 116.20 3iip n PHE 229 Ca 0.14 -0.95 -0.13 0.00 -0.05 0.00 0.00 57.45 56.46 3iip n PHE 229 Cb 0.27 -0.57 -0.01 0.00 -0.94 0.00 0.00 39.48 38.23 3iip n PHE 229 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3iip n ARG 230 N 0.02 -2.61 -0.27 -1.08 1.74 -0.35 -4.85 116.66 109.27 3iip n ARG 230 Ca 0.32 0.24 -0.07 0.00 -0.77 0.00 0.00 57.85 57.57 3iip n ARG 230 Cb 1.17 -4.81 0.05 0.00 -1.02 0.00 0.00 32.46 27.85 3iip n ARG 230 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3iip h GLU 231 N -0.31 1.16 -5.05 5.56 5.08 -1.55 -3.41 114.58 116.06 3iip h GLU 231 Ca -0.23 -0.26 -0.64 0.00 -1.00 0.00 0.00 59.36 57.23 3iip h GLU 231 Cb 1.15 -0.16 -0.34 0.00 0.50 0.00 0.00 28.75 29.90 3iip h GLU 231 CO 0.30 1.00 -0.86 0.42 -1.00 0.00 0.00 179.01 178.87 3iip s ILE 232 N -5.37 1.87 0.05 3.13 1.01 -0.76 -5.05 121.20 116.07 3iip s ILE 232 Ca -0.12 -0.87 -0.30 0.00 0.00 0.00 0.00 60.65 59.36 3iip s ILE 232 Cb 0.15 -1.67 -0.05 0.00 0.01 0.00 0.00 42.46 40.90 3iip s ILE 232 CO 0.85 0.51 1.13 -0.62 0.00 0.00 0.00 174.94 176.81 3iip s ASP 233 N 0.85 7.17 0.31 3.58 2.15 -1.26 -4.57 116.67 124.91 3iip s ASP 233 Ca -0.07 1.92 0.03 0.00 0.43 0.00 0.00 52.55 54.86 3iip s ASP 233 Cb -0.15 -2.58 0.51 0.00 -0.30 0.00 0.00 42.92 40.40 3iip s ASP 233 CO -0.01 -0.39 1.81 0.58 -0.17 0.00 0.00 175.17 176.98 3iip h VAL 234 N 4.54 1.23 -0.35 1.11 2.07 -1.95 -0.76 116.25 122.14 3iip h VAL 234 Ca -0.42 -1.00 -0.05 0.00 0.82 0.00 0.00 66.70 66.05 3iip h VAL 234 Cb 1.22 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 3iip h VAL 234 CO 0.79 0.33 0.00 -0.09 0.02 0.00 0.00 177.57 178.62 3iip h ARG 235 N 0.47 0.61 -0.27 1.57 1.12 -1.94 -1.60 114.38 114.35 3iip h ARG 235 Ca 0.09 -0.19 -0.03 0.00 -1.11 0.00 0.00 59.98 58.74 3iip h ARG 235 Cb 0.48 -0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.37 3iip h ARG 235 CO 0.03 0.73 0.06 0.93 -3.11 0.00 0.00 179.97 178.60 3iip h GLU 236 N 0.42 0.43 -0.06 0.20 5.08 -1.90 -1.59 114.58 117.16 3iip h GLU 236 Ca 0.10 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.39 3iip h GLU 236 Cb 0.45 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.58 3iip h GLU 236 CO 0.02 0.53 -0.42 1.25 -1.00 0.00 0.00 179.01 179.38 3iip h LEU 237 N 0.26 -1.31 -0.94 1.33 5.85 -1.09 -0.27 115.31 119.14 3iip h LEU 237 Ca 0.08 0.16 0.14 0.00 0.84 0.00 0.00 57.88 59.10 3iip h LEU 237 Cb 0.29 0.52 -0.09 0.00 0.37 0.00 0.00 40.66 41.75 3iip h LEU 237 CO 0.00 -0.44 0.56 0.11 -0.34 0.00 0.00 178.44 178.32 3iip h LYS 238 N -0.54 0.81 -0.24 1.25 1.57 -1.16 -0.30 116.57 117.97 3iip h LYS 238 Ca 0.06 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 3iip h LYS 238 Cb 0.64 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 3iip h LYS 238 CO -0.36 0.53 -0.40 0.93 -0.57 0.00 0.00 179.45 179.58 3iip h GLU 239 N 0.83 0.55 -0.32 3.15 5.08 -1.04 -1.64 114.58 121.19 3iip h GLU 239 Ca 0.49 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 3iip h GLU 239 Cb 0.59 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3iip h GLU 239 CO -0.31 0.86 0.14 -0.92 -1.00 0.00 0.00 179.01 177.79 3iip h TYR 240 N 0.46 0.48 -0.33 4.33 3.20 -0.34 -1.26 116.97 123.50 3iip h TYR 240 Ca 0.04 -0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 3iip h TYR 240 Cb 0.90 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 3iip h TYR 240 CO 0.04 0.44 -0.06 -0.07 -1.64 0.00 0.00 178.16 176.87 3iip h LEU 241 N 0.38 0.62 -1.26 2.82 3.38 -1.00 -2.43 115.31 117.82 3iip h LEU 241 Ca 0.11 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 3iip h LEU 241 Cb 0.15 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3iip h LEU 241 CO -0.01 0.83 0.39 0.50 0.09 0.00 0.00 178.44 180.24 3iip h LYS 242 N 0.41 0.89 -0.45 1.13 1.63 -1.30 -1.00 116.57 117.87 3iip h LYS 242 Ca 0.09 -0.08 -0.03 0.00 -0.85 0.00 0.00 60.65 59.78 3iip h LYS 242 Cb 0.55 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 31.96 3iip h LYS 242 CO 0.03 0.63 0.17 -0.22 -3.45 0.00 0.00 179.45 176.61 3iip h LYS 243 N 0.91 0.65 -0.58 1.90 3.64 -0.85 -2.66 116.57 119.57 3iip h LYS 243 Ca 0.24 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 3iip h LYS 243 Cb -0.03 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.66 3iip h LYS 243 CO -0.04 0.55 0.03 0.72 -2.27 0.00 0.00 179.45 178.43 3iip n HIS 244 N -4.35 2.07 -0.24 1.91 8.25 -0.85 -4.90 115.22 117.10 3iip n HIS 244 Ca 0.03 -0.79 0.00 0.00 -0.26 0.00 0.00 57.72 56.70 3iip n HIS 244 Cb 0.16 -0.52 0.00 0.00 1.12 0.00 0.00 29.99 30.74 3iip n HIS 244 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3iip n GLY 245 N 0.48 0.80 3.72 -1.41 0.00 -0.86 -5.04 105.19 102.88 3iip n GLY 245 Ca 0.29 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.90 3iip n GLY 245 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iip s VAL 246 N -2.14 4.80 -1.30 1.61 1.01 -0.44 -4.97 120.40 118.97 3iip s VAL 246 Ca 0.00 1.89 -0.15 0.00 0.00 0.00 0.00 61.98 63.72 3iip s VAL 246 Cb 0.00 -4.24 0.10 0.00 0.00 0.00 0.00 36.38 32.24 3iip s VAL 246 CO 0.00 0.24 1.76 -3.20 0.00 0.00 0.00 175.10 173.90 3iip n ASN 247 N 3.47 4.85 -4.94 3.32 5.15 -1.26 -3.92 115.26 121.93 3iip n ASN 247 Ca 0.03 -2.94 -0.27 0.00 -0.60 0.00 0.00 54.58 50.80 3iip n ASN 247 Cb 0.51 -1.66 -0.03 0.00 -0.53 0.00 0.00 39.78 38.07 3iip n ASN 247 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3iip s VAL 248 N 2.92 5.26 -0.15 3.44 -7.23 -1.26 0.53 120.40 123.91 3iip s VAL 248 Ca 0.48 -0.54 -0.29 0.00 -1.81 0.00 0.00 61.98 59.82 3iip s VAL 248 Cb 0.04 -3.74 -0.01 0.00 0.56 0.00 0.00 36.38 33.23 3iip s VAL 248 CO 0.02 -0.14 1.15 -0.13 -0.31 0.00 0.00 175.10 175.69 3iip s ARG 249 N -3.32 4.29 0.00 4.82 0.52 -1.26 -4.95 118.95 119.06 3iip s ARG 249 Ca 0.36 1.54 0.00 0.00 -0.52 0.00 0.00 55.73 57.12 3iip s ARG 249 Cb -0.11 -3.66 0.00 0.00 0.52 0.00 0.00 34.95 31.70 3iip s ARG 249 CO 0.29 -0.58 0.12 -0.11 0.02 0.00 0.00 175.30 175.04