#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d1q s VAL 35 N 0.00 4.73 0.03 2.28 1.01 -1.26 -5.03 120.40 122.16 3d1q s VAL 35 Ca 0.00 -0.06 -0.19 0.00 0.00 0.00 0.00 61.98 61.73 3d1q s VAL 35 Cb 0.00 -3.11 -0.17 0.00 0.00 0.00 0.00 36.38 33.10 3d1q s VAL 35 CO 0.00 0.49 1.25 0.74 0.00 0.00 0.00 175.10 177.57 3d1q h THR 36 N 4.76 1.38 -3.25 3.92 2.02 -2.06 -3.42 112.91 116.25 3d1q h THR 36 Ca -0.39 -1.69 -0.46 0.00 0.77 0.00 0.00 66.41 64.64 3d1q h THR 36 Cb 1.17 2.14 -0.37 0.00 -1.74 0.00 0.00 68.15 69.35 3d1q h THR 36 CO 0.68 0.50 -0.78 -1.61 0.37 0.00 0.00 175.52 174.68 3d1q s GLU 37 N -3.81 0.87 0.78 6.66 0.41 -1.26 -5.08 118.70 117.28 3d1q s GLU 37 Ca -0.13 -0.01 -0.11 0.00 -0.41 0.00 0.00 54.97 54.31 3d1q s GLU 37 Cb 0.05 -1.12 0.06 0.00 -1.78 0.00 0.00 34.13 31.34 3d1q s GLU 37 CO 0.80 -0.27 1.09 -1.25 -0.49 0.00 0.00 175.26 175.13 3d1q s PRO 38 N 1.81 2.21 0.28 0.39 0.04 -1.26 -4.85 135.00 133.62 3d1q s PRO 38 Ca 0.04 0.76 -0.30 0.00 0.04 0.00 0.00 61.00 61.53 3d1q s PRO 38 Cb -0.13 -1.92 -0.13 0.00 0.04 0.00 0.00 34.50 32.36 3d1q s PRO 38 CO -0.06 -1.56 1.31 0.28 0.04 0.00 0.00 177.00 177.02 3d1q n VAL 39 N -3.41 1.45 0.00 -0.36 0.31 -1.26 -1.34 118.33 113.72 3d1q n VAL 39 Ca 0.07 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 3d1q n VAL 39 Cb 0.55 -1.44 0.00 0.00 -0.91 0.00 0.00 33.84 32.04 3d1q n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3d1q n GLY 40 N 1.53 0.24 0.60 2.92 0.00 -1.26 -4.67 105.19 104.56 3d1q n GLY 40 Ca 0.09 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.16 3d1q n GLY 40 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d1q n SER 41 N 0.00 1.23 -0.32 1.61 7.64 -0.45 -4.77 113.62 118.56 3d1q n SER 41 Ca 0.00 -2.69 0.08 0.00 1.01 0.00 0.00 58.87 57.27 3d1q n SER 41 Cb 0.00 -0.35 0.25 0.00 -1.01 0.00 0.00 64.21 63.09 3d1q n SER 41 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 3d1q h TYR 42 N 0.41 0.91 -0.43 1.43 0.05 -1.89 -1.69 116.97 115.76 3d1q h TYR 42 Ca -0.05 0.03 0.12 0.00 0.05 0.00 0.00 58.73 58.89 3d1q h TYR 42 Cb 1.31 -0.27 -0.02 0.00 1.01 0.00 0.00 36.73 38.77 3d1q h TYR 42 CO 0.22 0.25 0.38 0.00 -1.05 0.00 0.00 178.16 177.96 3d1q h ALA 43 N 1.57 2.23 0.00 3.88 0.00 -1.95 -0.86 119.26 124.13 3d1q h ALA 43 Ca 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.39 3d1q h ALA 43 Cb 0.67 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3d1q h ALA 43 CO -0.35 -0.60 0.00 0.00 0.00 0.00 0.00 179.25 178.31 3d1q h ARG 44 N 0.00 0.00 0.00 0.00 3.08 -1.70 -0.89 114.38 114.86 3d1q h ARG 44 Ca 0.20 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.24 3d1q h ARG 44 Cb 0.96 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.01 3d1q h ARG 44 CO -0.00 0.00 -0.07 0.00 -1.07 0.00 0.00 179.97 178.83 3d1q h ALA 45 N 2.01 0.96 -2.42 0.04 0.00 -1.33 -3.46 119.26 115.06 3d1q h ALA 45 Ca 0.00 -0.06 -0.48 0.00 0.00 0.00 0.00 54.91 54.36 3d1q h ALA 45 Cb 0.08 -0.01 0.05 0.00 0.00 0.00 0.00 17.79 17.90 3d1q h ALA 45 CO 0.00 0.09 0.40 -1.21 0.00 0.00 0.00 179.25 178.53 3d1q s GLU 46 N -3.28 3.58 -0.41 0.00 0.41 -0.34 -5.01 118.70 113.65 3d1q s GLU 46 Ca 0.05 1.43 -0.20 0.00 -0.41 0.00 0.00 54.97 55.84 3d1q s GLU 46 Cb 0.06 -2.06 0.02 0.00 -1.78 0.00 0.00 34.13 30.37 3d1q s GLU 46 CO 0.66 -0.62 0.59 1.03 -0.49 0.00 0.00 175.26 176.42 3d1q s ARG 47 N -3.35 3.35 0.37 1.61 0.52 -1.26 -4.96 118.95 115.23 3d1q s ARG 47 Ca 0.69 -0.35 0.10 0.00 -0.52 0.00 0.00 55.73 55.64 3d1q s ARG 47 Cb -0.19 -3.91 0.87 0.00 0.52 0.00 0.00 34.95 32.23 3d1q s ARG 47 CO 0.24 -0.89 1.89 -1.35 0.02 0.00 0.00 175.30 175.21 3d1q h PRO 48 N 8.74 0.61 0.00 3.54 0.11 -1.94 -0.89 132.00 142.17 3d1q h PRO 48 Ca -0.26 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3d1q h PRO 48 Cb 1.10 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3d1q h PRO 48 CO 0.85 0.41 0.00 0.00 -0.21 0.00 0.00 178.00 179.05 3d1q n GLN 49 N -4.54 0.12 -0.15 1.05 0.00 -1.26 -1.42 117.38 111.18 3d1q n GLN 49 Ca 0.16 0.52 0.11 0.00 0.00 0.00 0.00 57.00 57.79 3d1q n GLN 49 Cb 0.47 -1.81 0.28 0.00 0.00 0.00 0.00 30.24 29.18 3d1q n GLN 49 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 3d1q n ASP 50 N -2.04 2.68 -1.80 2.61 8.00 -0.34 -4.23 116.55 121.44 3d1q n ASP 50 Ca 0.00 -1.88 -0.01 0.00 0.71 0.00 0.00 54.79 53.61 3d1q n ASP 50 Cb 0.09 -0.19 0.06 0.00 -0.02 0.00 0.00 41.12 41.07 3d1q n ASP 50 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3d1q n PHE 51 N 0.99 0.74 -2.21 1.24 3.01 -0.51 -4.82 117.46 115.90 3d1q n PHE 51 Ca 0.18 -1.40 -0.35 0.00 1.01 0.00 0.00 57.45 56.89 3d1q n PHE 51 Cb 0.48 -0.22 0.01 0.00 -0.01 0.00 0.00 39.48 39.74 3d1q n PHE 51 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 3d1q s GLU 52 N -2.20 3.34 0.53 -1.08 2.02 -1.24 -3.02 118.70 117.05 3d1q s GLU 52 Ca 0.35 1.67 -0.22 0.00 0.02 0.00 0.00 54.97 56.79 3d1q s GLU 52 Cb 0.37 -2.04 -0.05 0.00 0.10 0.00 0.00 34.13 32.50 3d1q s GLU 52 CO -0.09 -0.88 1.31 0.20 0.02 0.00 0.00 175.26 175.83 3d1q s GLY 53 N -1.68 2.86 0.00 -1.39 0.00 -1.26 -4.30 107.32 101.54 3d1q s GLY 53 Ca 0.73 1.24 0.00 0.00 0.00 0.00 0.00 44.72 46.69 3d1q s GLY 53 CO 0.29 1.75 0.00 1.97 0.00 0.00 0.00 173.10 177.11 3d1q n PHE 54 N -0.90 0.00 -3.51 1.90 1.16 0.58 -4.86 117.46 111.82 3d1q n PHE 54 Ca 0.10 0.00 -0.17 0.00 -1.87 0.00 0.00 57.45 55.50 3d1q n PHE 54 Cb 0.46 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.27 3d1q n PHE 54 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 3d1q s VAL 55 N 0.00 0.00 -0.70 1.97 0.11 -1.14 -5.00 120.40 115.64 3d1q s VAL 55 Ca 0.00 -0.01 -0.25 0.00 -2.93 0.00 0.00 61.98 58.79 3d1q s VAL 55 Cb 0.00 -1.00 0.04 0.00 -1.53 0.00 0.00 36.38 33.90 3d1q s VAL 55 CO 0.00 -0.00 1.16 0.26 -3.33 0.00 0.00 175.10 173.18 3d1q s TRP 56 N -1.42 2.44 0.18 1.54 0.52 -1.25 -0.53 118.94 120.42 3d1q s TRP 56 Ca -0.10 -0.22 -0.30 0.00 0.02 0.00 0.00 56.10 55.50 3d1q s TRP 56 Cb -0.00 -4.49 -0.08 0.00 -1.15 0.00 0.00 33.47 27.75 3d1q s TRP 56 CO 0.08 -1.90 1.11 0.50 0.02 0.00 0.00 176.95 176.76 3d1q s ARG 57 N 5.08 4.59 -0.22 4.98 3.52 0.61 -1.56 118.95 135.94 3d1q s ARG 57 Ca 0.30 1.73 -0.29 0.00 -0.13 0.00 0.00 55.73 57.34 3d1q s ARG 57 Cb -0.11 -3.28 -0.02 0.00 -1.56 0.00 0.00 34.95 29.99 3d1q s ARG 57 CO 0.14 0.06 1.44 -1.17 -0.81 0.00 0.00 175.30 174.95 3d1q s LEU 58 N -0.36 3.98 0.18 -0.88 2.96 0.08 -1.63 118.68 123.01 3d1q s LEU 58 Ca 0.50 1.54 0.10 0.00 -0.22 0.00 0.00 54.13 56.04 3d1q s LEU 58 Cb -0.30 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 42.77 3d1q s LEU 58 CO 0.35 -1.07 1.35 0.44 -1.32 0.00 0.00 176.35 176.10 3d1q h ASP 59 N 9.61 0.00 -3.33 3.68 3.32 -1.12 -3.44 116.42 125.13 3d1q h ASP 59 Ca -0.30 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.76 3d1q h ASP 59 Cb 1.13 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.46 3d1q h ASP 59 CO 1.00 0.83 0.11 0.21 -1.72 0.00 0.00 179.24 179.67 3d1q s ASN 60 N -6.64 -0.82 0.00 6.45 3.84 -1.26 -4.73 114.94 111.79 3d1q s ASN 60 Ca 0.02 1.41 0.26 0.00 0.21 0.00 0.00 52.86 54.76 3d1q s ASN 60 Cb 0.09 1.38 1.42 0.00 -0.55 0.00 0.00 41.25 43.59 3d1q s ASN 60 CO 0.79 -0.23 1.91 -0.90 -2.79 0.00 0.00 177.10 175.88 3d1q n ASP 61 N 3.58 0.00 -0.75 -4.21 5.68 -1.26 -4.69 116.55 114.90 3d1q n ASP 61 Ca -0.17 -0.37 -0.10 0.00 -0.50 0.00 0.00 54.79 53.65 3d1q n ASP 61 Cb 0.57 -0.18 -0.04 0.00 -1.14 0.00 0.00 41.12 40.33 3d1q n ASP 61 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3d1q n GLY 62 N 0.82 1.07 0.09 6.12 0.00 -1.26 -4.91 105.19 107.13 3d1q n GLY 62 Ca 0.15 -0.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 3d1q n GLY 62 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d1q h LYS 63 N 0.10 0.20 -7.03 1.61 1.57 -1.96 -3.46 116.57 107.61 3d1q h LYS 63 Ca -0.20 -0.35 -0.47 0.00 -1.87 0.00 0.00 60.65 57.76 3d1q h LYS 63 Cb 0.83 0.13 0.05 0.00 0.08 0.00 0.00 32.23 33.32 3d1q h LYS 63 CO 0.29 1.15 0.11 -1.21 -0.57 0.00 0.00 179.45 179.23 3d1q s GLU 64 N -2.66 2.89 0.28 3.15 0.41 -1.26 -4.98 118.70 116.52 3d1q s GLU 64 Ca -0.03 -0.16 0.12 0.00 -0.41 0.00 0.00 54.97 54.49 3d1q s GLU 64 Cb 0.08 -2.34 0.37 0.00 -1.78 0.00 0.00 34.13 30.46 3d1q s GLU 64 CO 0.87 -0.65 1.61 0.00 -0.49 0.00 0.00 175.26 176.60 3d1q h ALA 65 N -0.07 0.93 -2.19 5.21 0.00 -1.99 -3.46 119.26 117.69 3d1q h ALA 65 Ca -0.45 -0.55 -0.46 0.00 0.00 0.00 0.00 54.91 53.45 3d1q h ALA 65 Cb 1.26 -0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.81 3d1q h ALA 65 CO 0.59 0.75 -0.72 -0.51 0.00 0.00 0.00 179.25 179.37 3d1q s LEU 66 N -7.43 2.53 1.05 0.00 1.43 -1.26 -4.44 118.68 110.55 3d1q s LEU 66 Ca -0.01 -1.07 -0.13 0.00 -1.03 0.00 0.00 54.13 51.90 3d1q s LEU 66 Cb 0.12 -0.65 0.22 0.00 0.03 0.00 0.00 46.19 45.90 3d1q s LEU 66 CO 0.75 -0.22 1.08 -2.16 0.23 0.00 0.00 176.35 176.03 3d1q s PRO 67 N -3.67 0.01 0.64 1.29 0.04 -1.26 -5.00 135.00 127.04 3d1q s PRO 67 Ca 0.24 0.50 -0.11 0.00 0.04 0.00 0.00 61.00 61.68 3d1q s PRO 67 Cb 0.00 -1.69 -0.03 0.00 0.04 0.00 0.00 34.50 32.82 3d1q s PRO 67 CO 0.08 -3.01 1.04 1.03 0.04 0.00 0.00 177.00 176.18 3d1q s ARG 68 N -4.90 3.47 -1.48 4.56 1.81 -1.26 -3.92 118.95 117.22 3d1q s ARG 68 Ca 0.66 0.75 0.00 0.00 -1.72 0.00 0.00 55.73 55.42 3d1q s ARG 68 Cb -0.19 -2.07 0.00 0.00 -0.45 0.00 0.00 34.95 32.24 3d1q s ARG 68 CO 0.59 -0.67 0.00 0.09 -0.68 0.00 0.00 175.30 174.63 3d1q n ASN 69 N -2.81 -4.71 -4.72 0.23 3.02 -1.26 -0.76 115.26 104.25 3d1q n ASN 69 Ca 0.06 0.18 -0.42 0.00 -0.03 0.00 0.00 54.58 54.37 3d1q n ASN 69 Cb 0.54 -4.03 -0.03 0.00 -0.61 0.00 0.00 39.78 35.65 3d1q n ASN 69 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3d1q s PHE 70 N -2.70 3.00 -0.03 3.10 5.36 -1.25 -4.25 117.98 121.21 3d1q s PHE 70 Ca 0.00 0.58 -0.27 0.00 -0.96 0.00 0.00 56.93 56.29 3d1q s PHE 70 Cb 0.00 -3.98 0.06 0.00 -0.34 0.00 0.00 43.02 38.75 3d1q s PHE 70 CO 0.00 -3.62 0.59 -0.98 -1.46 0.00 0.00 175.22 169.75 3d1q s ARG 71 N 0.98 0.98 0.19 10.12 1.70 -0.74 -4.99 118.95 127.19 3d1q s ARG 71 Ca 0.70 0.11 0.06 0.00 -0.47 0.00 0.00 55.73 56.13 3d1q s ARG 71 Cb -0.45 0.46 -0.05 0.00 -0.57 0.00 0.00 34.95 34.34 3d1q s ARG 71 CO 0.33 -0.31 -0.11 0.95 -1.08 0.00 0.00 175.30 175.08 3d1q s THR 72 N -1.38 1.47 -1.62 4.99 -4.23 -1.26 -1.09 115.64 112.52 3d1q s THR 72 Ca -0.11 -2.14 0.16 0.00 -1.18 0.00 0.00 61.69 58.42 3d1q s THR 72 Cb -0.01 -2.03 0.33 0.00 1.34 0.00 0.00 72.50 72.13 3d1q s THR 72 CO 0.07 -0.61 1.41 -1.54 -0.54 0.00 0.00 174.62 173.42 3d1q n SER 73 N -0.33 0.00 -0.64 3.99 3.41 -0.46 -1.73 113.62 117.86 3d1q n SER 73 Ca -0.08 -0.13 0.13 0.00 -0.26 0.00 0.00 58.87 58.52 3d1q n SER 73 Cb 0.61 -0.19 0.25 0.00 -0.26 0.00 0.00 64.21 64.62 3d1q n SER 73 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d1q n ALA 74 N -1.19 2.77 -1.59 7.33 0.00 -1.26 -4.51 120.51 122.06 3d1q n ALA 74 Ca 0.09 -0.57 -0.32 0.00 0.00 0.00 0.00 53.44 52.64 3d1q n ALA 74 Cb 0.10 -0.96 0.03 0.00 0.00 0.00 0.00 19.45 18.62 3d1q n ALA 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3d1q s ASP 75 N -2.15 5.48 0.45 0.00 1.01 -0.70 -5.02 116.67 115.74 3d1q s ASP 75 Ca 0.29 1.83 -0.22 0.00 0.71 0.00 0.00 52.55 55.15 3d1q s ASP 75 Cb 0.20 -2.53 -0.08 0.00 1.01 0.00 0.00 42.92 41.52 3d1q s ASP 75 CO 0.39 -1.37 1.07 0.00 0.21 0.00 0.00 175.17 175.47 3d1q s ALA 76 N -2.55 2.97 0.10 5.23 0.00 -1.26 -4.95 121.76 121.29 3d1q s ALA 76 Ca 0.63 0.72 -0.30 0.00 0.00 0.00 0.00 51.96 53.01 3d1q s ALA 76 Cb -0.17 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 3d1q s ALA 76 CO 0.42 -0.36 1.06 -0.51 0.00 0.00 0.00 175.76 176.37 3d1q s LEU 77 N -3.07 4.44 0.47 0.00 1.43 -1.26 -4.67 118.68 116.03 3d1q s LEU 77 Ca 0.63 1.91 0.08 0.00 -1.03 0.00 0.00 54.13 55.71 3d1q s LEU 77 Cb -0.21 -3.59 0.02 0.00 0.03 0.00 0.00 46.19 42.44 3d1q s LEU 77 CO 0.26 -0.25 0.53 -0.13 0.23 0.00 0.00 176.35 176.99 3d1q s ARG 78 N 0.36 2.52 0.58 1.70 0.52 0.22 -5.00 118.95 119.85 3d1q s ARG 78 Ca 0.52 -1.56 -0.20 0.00 -0.52 0.00 0.00 55.73 53.97 3d1q s ARG 78 Cb -0.26 -2.50 -0.03 0.00 0.52 0.00 0.00 34.95 32.68 3d1q s ARG 78 CO 0.31 -0.43 1.31 0.00 0.02 0.00 0.00 175.30 176.51 3d1q s ALA 79 N -2.53 2.64 0.53 2.13 0.00 -1.26 -4.74 121.76 118.53 3d1q s ALA 79 Ca 0.51 1.25 -0.19 0.00 0.00 0.00 0.00 51.96 53.53 3d1q s ALA 79 Cb -0.05 -3.55 -0.06 0.00 0.00 0.00 0.00 23.12 19.46 3d1q s ALA 79 CO 0.31 -1.41 1.09 -1.25 0.00 0.00 0.00 175.76 174.50 3d1q s PRO 80 N -3.11 3.47 0.25 0.00 0.04 -1.26 -4.94 135.00 129.45 3d1q s PRO 80 Ca 0.76 1.49 -0.30 0.00 0.04 0.00 0.00 61.00 62.99 3d1q s PRO 80 Cb -0.38 -2.03 -0.10 0.00 0.04 0.00 0.00 34.50 32.03 3d1q s PRO 80 CO 0.43 -0.73 1.33 -1.21 0.04 0.00 0.00 177.00 176.86 3d1q s GLU 81 N -3.36 4.36 0.42 4.56 2.02 -1.26 -4.92 118.70 120.53 3d1q s GLU 81 Ca 0.70 2.14 0.11 0.00 0.02 0.00 0.00 54.97 57.94 3d1q s GLU 81 Cb -0.21 -3.14 0.95 0.00 0.10 0.00 0.00 34.13 31.83 3d1q s GLU 81 CO 0.26 -0.25 2.02 0.87 0.02 0.00 0.00 175.26 178.17 3d1q h LYS 82 N 4.69 0.46 0.00 1.61 1.57 -1.99 -2.27 116.57 120.65 3d1q h LYS 82 Ca -0.46 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 3d1q h LYS 82 Cb 1.22 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.42 3d1q h LYS 82 CO 0.74 0.31 0.00 1.57 -0.57 0.00 0.00 179.45 181.49 3d1q h LYS 83 N 0.48 0.00 -0.01 3.15 2.10 -2.00 -1.06 116.57 119.23 3d1q h LYS 83 Ca 0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.87 3d1q h LYS 83 Cb 0.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.59 3d1q h LYS 83 CO -0.06 0.00 -0.26 1.19 -2.00 0.00 0.00 179.45 178.32 3d1q n PHE 84 N -2.95 0.00 -3.82 0.07 3.01 -0.85 -4.69 117.46 108.23 3d1q n PHE 84 Ca -0.02 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.18 3d1q n PHE 84 Cb 0.09 -0.12 0.01 0.00 -0.01 0.00 0.00 39.48 39.44 3d1q n PHE 84 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 3d1q n HIS 85 N -0.65 -1.78 -2.85 1.38 8.25 -0.40 -4.69 115.22 114.47 3d1q n HIS 85 Ca 0.12 0.72 -0.20 0.00 -0.26 0.00 0.00 57.72 58.09 3d1q n HIS 85 Cb 0.35 -3.88 0.06 0.00 1.12 0.00 0.00 29.99 27.64 3d1q n HIS 85 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3d1q s LEU 86 N -6.77 3.18 -0.60 2.41 1.43 -1.26 -5.03 118.68 112.04 3d1q s LEU 86 Ca 0.10 -0.54 -0.23 0.00 -1.03 0.00 0.00 54.13 52.43 3d1q s LEU 86 Cb -0.03 -2.05 0.05 0.00 0.03 0.00 0.00 46.19 44.19 3d1q s LEU 86 CO 0.86 -1.37 0.94 -0.62 0.23 0.00 0.00 176.35 176.39 3d1q s ASP 87 N -4.60 6.25 0.49 2.29 -1.08 -1.26 -4.90 116.67 113.85 3d1q s ASP 87 Ca 0.61 -0.67 0.33 0.00 -0.52 0.00 0.00 52.55 52.30 3d1q s ASP 87 Cb -0.07 -2.42 1.55 0.00 -1.46 0.00 0.00 42.92 40.52 3d1q s ASP 87 CO 0.39 -1.32 1.99 0.00 0.52 0.00 0.00 175.17 176.75 3d1q h ALA 88 N 9.43 1.00 0.00 3.66 0.00 -1.96 -1.69 119.26 129.70 3d1q h ALA 88 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3d1q h ALA 88 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3d1q h ALA 88 CO 1.13 0.00 -0.48 0.00 0.00 0.00 0.00 179.25 179.90 3d1q n ALA 89 N -1.98 3.22 -2.32 0.00 0.00 -1.26 -4.87 120.51 113.31 3d1q n ALA 89 Ca -0.00 -0.29 -0.42 0.00 0.00 0.00 0.00 53.44 52.73 3d1q n ALA 89 Cb 0.19 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 18.43 3d1q n ALA 89 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3d1q s TYR 90 N -3.05 3.38 -0.39 0.00 5.04 -0.64 -5.00 117.35 116.70 3d1q s TYR 90 Ca 0.10 1.21 -0.05 0.00 -2.44 0.00 0.00 57.07 55.89 3d1q s TYR 90 Cb 0.16 -3.49 0.08 0.00 0.35 0.00 0.00 41.96 39.06 3d1q s TYR 90 CO 0.69 -1.58 0.18 0.08 -1.34 0.00 0.00 175.55 173.58 3d1q s VAL 91 N 0.96 3.58 0.50 3.14 1.01 -1.26 -5.03 120.40 123.30 3d1q s VAL 91 Ca 0.60 -1.66 -0.22 0.00 0.00 0.00 0.00 61.98 60.70 3d1q s VAL 91 Cb -0.32 -3.26 -0.07 0.00 0.00 0.00 0.00 36.38 32.73 3d1q s VAL 91 CO 0.30 -0.49 1.17 -2.16 0.00 0.00 0.00 175.10 173.92 3d1q s PRO 92 N 1.27 3.55 0.41 2.72 0.04 -1.26 -4.97 135.00 136.76 3d1q s PRO 92 Ca 0.03 1.77 -0.27 0.00 0.04 0.00 0.00 61.00 62.58 3d1q s PRO 92 Cb -0.22 -2.26 -0.09 0.00 0.04 0.00 0.00 34.50 31.97 3d1q s PRO 92 CO -0.01 -0.72 1.42 0.45 0.04 0.00 0.00 177.00 178.18 3d1q s SER 93 N -1.45 6.18 -0.05 6.66 0.15 -1.26 -4.91 113.70 119.02 3d1q s SER 93 Ca 0.67 2.91 0.21 0.00 0.70 0.00 0.00 55.95 60.44 3d1q s SER 93 Cb -0.28 -2.66 0.67 0.00 -1.71 0.00 0.00 66.02 62.04 3d1q s SER 93 CO 0.33 -0.97 1.57 0.54 1.20 0.00 0.00 173.24 175.92 3d1q n ARG 94 N 0.17 3.17 -1.68 5.44 1.74 -1.26 -4.92 116.66 119.32 3d1q n ARG 94 Ca 0.03 -2.75 -0.53 0.00 -0.77 0.00 0.00 57.85 53.82 3d1q n ARG 94 Cb 0.41 -1.70 -0.06 0.00 -1.02 0.00 0.00 32.46 30.09 3d1q n ARG 94 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3d1q n GLU 95 N 1.40 1.49 -0.29 5.56 4.07 -1.26 -0.75 120.64 130.86 3d1q n GLU 95 Ca 0.25 0.55 0.00 0.00 -0.06 0.00 0.00 57.16 57.89 3d1q n GLU 95 Cb 0.74 -2.27 0.00 0.00 -0.06 0.00 0.00 31.44 29.84 3d1q n GLU 95 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3d1q n GLY 96 N 3.90 1.54 0.27 8.31 0.00 -1.26 -4.92 105.19 113.03 3d1q n GLY 96 Ca 0.23 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.19 3d1q n GLY 96 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3d1q h MET 97 N 3.06 0.79 0.00 1.61 2.86 -1.26 -1.73 114.93 120.26 3d1q h MET 97 Ca 0.00 -0.27 -0.04 0.00 -2.06 0.00 0.00 59.70 57.33 3d1q h MET 97 Cb 0.00 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 3d1q h MET 97 CO 0.00 0.88 -0.20 -0.44 1.06 0.00 0.00 176.91 178.21 3d1q h ASP 98 N 0.71 0.00 0.01 1.22 3.45 -1.79 -2.24 116.42 117.78 3d1q h ASP 98 Ca 0.12 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.58 3d1q h ASP 98 Cb 0.62 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.39 3d1q h ASP 98 CO 0.04 0.20 -0.26 0.00 -1.57 0.00 0.00 179.24 177.65 3d1q n ALA 99 N -2.49 3.08 0.05 3.45 0.00 -1.09 -4.53 120.51 118.98 3d1q n ALA 99 Ca -0.02 -0.61 -0.12 0.00 0.00 0.00 0.00 53.44 52.68 3d1q n ALA 99 Cb 0.26 -0.87 -0.07 0.00 0.00 0.00 0.00 19.45 18.76 3d1q n ALA 99 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3d1q h LEU 100 N 2.96 -0.04 -1.66 0.00 5.85 -0.67 -3.47 115.31 118.27 3d1q h LEU 100 Ca 0.00 -0.04 -0.25 0.00 0.84 0.00 0.00 57.88 58.43 3d1q h LEU 100 Cb 0.78 0.01 0.12 0.00 0.37 0.00 0.00 40.66 41.94 3d1q h LEU 100 CO 0.00 0.02 -0.56 1.41 -0.34 0.00 0.00 178.44 178.97 3d1q n HIS 101 N -5.09 -1.66 -4.28 1.25 8.25 -1.26 -4.89 115.22 107.54 3d1q n HIS 101 Ca -0.07 0.70 -0.15 0.00 -0.26 0.00 0.00 57.72 57.93 3d1q n HIS 101 Cb 0.07 -4.25 -0.10 0.00 1.12 0.00 0.00 29.99 26.83 3d1q n HIS 101 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 3d1q s ILE 102 N -3.26 1.24 0.24 1.59 -4.36 -1.26 -1.49 121.20 113.89 3d1q s ILE 102 Ca 0.04 -2.08 -0.12 0.00 -0.26 0.00 0.00 60.65 58.23 3d1q s ILE 102 Cb -0.02 -1.96 -0.00 0.00 1.25 0.00 0.00 42.46 41.72 3d1q s ILE 102 CO 0.54 -0.65 0.46 -0.94 0.24 0.00 0.00 174.94 174.58 3d1q s SER 103 N -3.22 -0.08 0.10 4.36 1.04 0.01 -1.35 113.70 114.56 3d1q s SER 103 Ca 0.20 -0.92 -0.11 0.00 0.48 0.00 0.00 55.95 55.60 3d1q s SER 103 Cb 0.03 0.57 0.01 0.00 0.10 0.00 0.00 66.02 66.72 3d1q s SER 103 CO 0.03 -1.11 0.25 -0.83 0.98 0.00 0.00 173.24 172.56 3d1q s GLY 104 N -3.01 -0.02 0.14 7.32 0.00 -0.25 -1.00 107.32 110.50 3d1q s GLY 104 Ca 0.22 -0.45 -0.24 0.00 0.00 0.00 0.00 44.72 44.25 3d1q s GLY 104 CO 0.08 -0.66 1.06 -1.35 0.00 0.00 0.00 173.10 172.24 3d1q s SER 105 N -2.84 -0.06 1.00 1.64 1.04 -0.80 -1.79 113.70 111.90 3d1q s SER 105 Ca 0.04 -0.50 -0.08 0.00 0.48 0.00 0.00 55.95 55.90 3d1q s SER 105 Cb 0.04 0.43 0.11 0.00 0.10 0.00 0.00 66.02 66.70 3d1q s SER 105 CO -0.11 -0.83 0.63 -1.54 0.98 0.00 0.00 173.24 172.37 3d1q n SER 106 N -0.90 0.01 -4.58 7.02 3.41 0.06 -3.25 113.62 115.40 3d1q n SER 106 Ca -0.04 -1.22 -0.29 0.00 -0.26 0.00 0.00 58.87 57.06 3d1q n SER 106 Cb 0.60 -0.49 0.21 0.00 -0.26 0.00 0.00 64.21 64.28 3d1q n SER 106 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d1q s ALA 107 N -3.96 0.24 0.15 7.33 0.00 -0.35 -4.71 121.76 120.47 3d1q s ALA 107 Ca 0.36 -0.20 -0.13 0.00 0.00 0.00 0.00 51.96 51.99 3d1q s ALA 107 Cb -0.01 -3.20 0.02 0.00 0.00 0.00 0.00 23.12 19.93 3d1q s ALA 107 CO 0.25 -3.35 0.37 -0.59 0.00 0.00 0.00 175.76 172.44 3d1q s PHE 108 N -2.69 0.04 0.64 0.00 -0.12 -1.26 -4.48 117.98 110.11 3d1q s PHE 108 Ca 0.67 -0.40 -0.09 0.00 -0.05 0.00 0.00 56.93 57.06 3d1q s PHE 108 Cb -0.22 0.16 0.01 0.00 -0.63 0.00 0.00 43.02 42.34 3d1q s PHE 108 CO 0.61 -0.74 1.00 0.95 -0.05 0.00 0.00 175.22 176.99 3d1q s THR 109 N -3.88 3.61 0.21 -4.49 -4.23 -1.26 -4.68 115.64 100.92 3d1q s THR 109 Ca 0.09 0.25 -0.09 0.00 -1.18 0.00 0.00 61.69 60.75 3d1q s THR 109 Cb 0.02 -3.48 0.14 0.00 1.34 0.00 0.00 72.50 70.53 3d1q s THR 109 CO -0.06 -0.56 1.79 -0.65 -0.54 0.00 0.00 174.62 174.60 3d1q h PRO 110 N -0.40 0.57 -0.92 3.99 0.11 -1.98 -1.66 132.00 131.71 3d1q h PRO 110 Ca -0.45 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 3d1q h PRO 110 Cb 1.25 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 3d1q h PRO 110 CO 0.62 0.38 0.53 0.00 -0.21 0.00 0.00 178.00 179.33 3d1q h ALA 111 N 1.37 1.17 -0.73 -0.75 0.00 -1.94 -1.55 119.26 116.84 3d1q h ALA 111 Ca 0.30 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3d1q h ALA 111 Cb 0.26 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3d1q h ALA 111 CO -0.22 0.64 0.32 1.96 0.00 0.00 0.00 179.25 181.95 3d1q h GLN 112 N 1.27 1.06 -0.60 0.00 4.20 -1.57 -1.60 115.11 117.88 3d1q h GLN 112 Ca 0.33 -0.17 -0.07 0.00 0.06 0.00 0.00 58.65 58.80 3d1q h GLN 112 Cb -0.03 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.54 3d1q h GLN 112 CO -0.06 0.84 0.08 1.25 -0.67 0.00 0.00 178.83 180.28 3d1q h LEU 113 N 1.05 0.93 -1.02 1.46 5.85 -0.57 -0.51 115.31 122.50 3d1q h LEU 113 Ca 0.25 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 3d1q h LEU 113 Cb 0.16 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 3d1q h LEU 113 CO -0.03 0.94 0.29 0.11 -0.34 0.00 0.00 178.44 179.41 3d1q h LYS 114 N 0.91 0.99 -0.56 1.25 1.57 -0.82 0.07 116.57 119.99 3d1q h LYS 114 Ca 0.18 -0.16 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 3d1q h LYS 114 Cb 0.42 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 3d1q h LYS 114 CO 0.01 0.80 0.02 -0.91 -0.57 0.00 0.00 179.45 178.80 3d1q h ASN 115 N 0.98 0.92 -0.15 0.86 2.35 -0.64 -0.96 115.58 118.93 3d1q h ASN 115 Ca 0.23 -0.24 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3d1q h ASN 115 Cb 0.16 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 3d1q h ASN 115 CO -0.02 0.97 0.08 0.58 -1.65 0.00 0.00 177.43 177.38 3d1q h VAL 116 N 0.88 1.11 -0.37 2.81 2.07 -0.39 -1.90 116.25 120.46 3d1q h VAL 116 Ca 0.17 -0.32 0.01 0.00 0.82 0.00 0.00 66.70 67.37 3d1q h VAL 116 Cb 0.49 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 3d1q h VAL 116 CO 0.02 0.11 0.23 0.00 0.02 0.00 0.00 177.57 177.95 3d1q h ALA 117 N 0.96 0.46 -0.42 1.67 0.00 -0.76 0.27 119.26 121.44 3d1q h ALA 117 Ca 0.05 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.98 3d1q h ALA 117 Cb 0.10 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3d1q h ALA 117 CO -0.01 -0.10 0.21 0.00 0.00 0.00 0.00 179.25 179.35 3d1q h ALA 118 N 1.15 0.53 -0.47 0.00 0.00 -1.13 0.22 119.26 119.56 3d1q h ALA 118 Ca 0.14 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 3d1q h ALA 118 Cb -0.03 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3d1q h ALA 118 CO -0.05 -0.15 0.29 -0.22 0.00 0.00 0.00 179.25 179.12 3d1q h LYS 119 N 0.42 0.64 -0.19 0.00 3.64 -0.65 -2.73 116.57 117.69 3d1q h LYS 119 Ca 0.18 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.40 3d1q h LYS 119 Cb 0.10 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 3d1q h LYS 119 CO -0.13 0.46 -0.35 -0.07 -2.27 0.00 0.00 179.45 177.09 3d1q h LEU 120 N 0.63 0.43 -2.17 5.20 3.38 -0.07 -2.71 115.31 120.00 3d1q h LEU 120 Ca 0.17 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3d1q h LEU 120 Cb -0.01 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 3d1q h LEU 120 CO -0.03 0.75 -0.03 -0.09 0.09 0.00 0.00 178.44 179.13 3d1q h ARG 121 N 0.35 0.00 0.00 1.13 9.65 -0.26 0.68 114.38 125.92 3d1q h ARG 121 Ca 0.04 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.92 3d1q h ARG 121 Cb 0.79 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.37 3d1q h ARG 121 CO 0.06 0.03 0.00 0.39 2.80 0.00 0.00 179.97 183.25 3d1q n GLU 122 N -4.13 0.16 0.00 0.20 1.02 -1.02 -2.85 120.64 114.02 3d1q n GLU 122 Ca -0.03 0.39 0.08 0.00 -0.02 0.00 0.00 57.16 57.59 3d1q n GLU 122 Cb 0.11 -1.81 -0.05 0.00 -0.02 0.00 0.00 31.44 29.68 3d1q n GLU 122 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3d1q n LYS 123 N -2.12 1.53 -3.50 3.49 5.02 0.22 -5.02 118.16 117.78 3d1q n LYS 123 Ca 0.02 -0.44 -0.11 0.00 -2.02 0.00 0.00 58.31 55.76 3d1q n LYS 123 Cb 0.22 -1.31 -0.02 0.00 -0.02 0.00 0.00 35.03 33.90 3d1q n LYS 123 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3d1q s THR 124 N -2.30 0.00 -0.44 -0.18 -1.32 -1.13 -5.02 115.64 105.24 3d1q s THR 124 Ca 0.11 -0.16 0.05 0.00 -1.21 0.00 0.00 61.69 60.48 3d1q s THR 124 Cb 0.13 -1.16 0.13 0.00 -1.51 0.00 0.00 72.50 70.09 3d1q s THR 124 CO 0.56 0.00 1.07 0.00 -2.21 0.00 0.00 174.62 174.05 3d1q n ALA 125 N -0.39 2.12 -2.02 11.08 0.00 -1.26 -4.70 120.51 125.34 3d1q n ALA 125 Ca -0.14 -1.02 -0.21 0.00 0.00 0.00 0.00 53.44 52.07 3d1q n ALA 125 Cb 0.64 -0.20 0.08 0.00 0.00 0.00 0.00 19.45 19.97 3d1q n ALA 125 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3d1q s GLY 126 N -0.95 1.74 0.40 0.00 0.00 -1.25 -5.05 107.32 102.22 3d1q s GLY 126 Ca 0.10 -2.00 -0.26 0.00 0.00 0.00 0.00 44.72 42.57 3d1q s GLY 126 CO 0.07 -1.50 1.28 2.56 0.00 0.00 0.00 173.10 175.51 3d1q s PRO 127 N -4.84 3.98 -0.24 2.90 0.04 -1.26 -4.77 135.00 130.80 3d1q s PRO 127 Ca 0.63 2.10 -0.07 0.00 0.04 0.00 0.00 61.00 63.70 3d1q s PRO 127 Cb -0.06 -2.74 -0.03 0.00 0.04 0.00 0.00 34.50 31.72 3d1q s PRO 127 CO 0.41 -0.46 0.06 0.42 0.04 0.00 0.00 177.00 177.47 3d1q s ILE 128 N -1.29 4.28 -0.17 0.56 1.01 -1.26 -1.07 121.20 123.25 3d1q s ILE 128 Ca 0.57 -0.19 -0.08 0.00 0.00 0.00 0.00 60.65 60.96 3d1q s ILE 128 Cb -0.37 -2.99 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 3d1q s ILE 128 CO 0.47 0.35 0.08 -0.31 0.00 0.00 0.00 174.94 175.54 3d1q s TYR 129 N 1.52 3.33 -0.58 3.97 1.51 0.01 -0.24 117.35 126.87 3d1q s TYR 129 Ca 0.06 0.20 -0.22 0.00 -1.01 0.00 0.00 57.07 56.09 3d1q s TYR 129 Cb -0.15 -2.07 0.06 0.00 -0.11 0.00 0.00 41.96 39.69 3d1q s TYR 129 CO 0.03 0.28 0.88 0.34 -1.11 0.00 0.00 175.55 175.97 3d1q s ASP 130 N 0.13 6.25 -0.66 2.29 2.15 0.12 -0.74 116.67 126.22 3d1q s ASP 130 Ca 0.06 -0.71 -0.18 0.00 0.43 0.00 0.00 52.55 52.15 3d1q s ASP 130 Cb -0.12 -2.40 0.13 0.00 -0.30 0.00 0.00 42.92 40.23 3d1q s ASP 130 CO 0.00 -1.24 0.73 -0.69 -0.17 0.00 0.00 175.17 173.81 3d1q s VAL 131 N 3.70 4.98 -0.51 1.11 1.01 0.51 -1.71 120.40 129.49 3d1q s VAL 131 Ca 0.24 -1.35 -0.28 0.00 0.00 0.00 0.00 61.98 60.59 3d1q s VAL 131 Cb -0.16 -4.50 0.03 0.00 0.00 0.00 0.00 36.38 31.75 3d1q s VAL 131 CO 0.14 -1.12 1.13 -0.62 0.00 0.00 0.00 175.10 174.63 3d1q s ASP 132 N 3.41 6.55 -0.15 3.32 -1.08 -0.06 -2.19 116.67 126.47 3d1q s ASP 132 Ca 0.14 0.29 0.13 0.00 -0.52 0.00 0.00 52.55 52.59 3d1q s ASP 132 Cb -0.21 -2.54 0.65 0.00 -1.46 0.00 0.00 42.92 39.37 3d1q s ASP 132 CO 0.02 -1.30 1.52 0.18 0.52 0.00 0.00 175.17 176.11 3d1q n LEU 133 N 7.94 4.54 -4.64 -1.34 4.77 -0.82 -0.64 117.00 126.81 3d1q n LEU 133 Ca 0.10 -2.30 -0.39 0.00 -0.03 0.00 0.00 56.01 53.39 3d1q n LEU 133 Cb 0.49 -0.59 -0.08 0.00 -2.33 0.00 0.00 43.42 40.91 3d1q n LEU 133 CO 0.71 0.63 0.19 -0.13 -1.33 0.00 0.00 177.39 177.46 3d1q s ARG 134 N -2.14 4.11 0.11 3.23 0.52 -1.20 -2.40 118.95 121.17 3d1q s ARG 134 Ca 0.44 0.28 -0.08 0.00 -0.52 0.00 0.00 55.73 55.85 3d1q s ARG 134 Cb 0.31 -3.61 -0.15 0.00 0.52 0.00 0.00 34.95 32.02 3d1q s ARG 134 CO 0.17 -0.24 1.26 0.37 0.02 0.00 0.00 175.30 176.88 3d1q h GLN 135 N 7.79 0.51 -6.83 3.54 4.15 -1.46 -3.41 115.11 119.40 3d1q h GLN 135 Ca -0.32 -0.56 -0.56 0.00 0.77 0.00 0.00 58.65 57.99 3d1q h GLN 135 Cb 1.15 0.16 0.11 0.00 0.21 0.00 0.00 27.48 29.11 3d1q h GLN 135 CO 0.71 1.19 0.63 -0.85 -1.93 0.00 0.00 178.83 178.59 3d1q n GLU 136 N -3.78 2.38 -1.95 1.69 0.00 -1.26 -4.80 120.64 112.92 3d1q n GLU 136 Ca -0.08 0.84 -0.42 0.00 0.00 0.00 0.00 57.16 57.49 3d1q n GLU 136 Cb 0.86 -2.49 -0.03 0.00 0.00 0.00 0.00 31.44 29.78 3d1q n GLU 136 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 3d1q s SER 137 N -0.21 6.60 0.26 -1.84 0.01 -1.26 -4.91 113.70 112.35 3d1q s SER 137 Ca 0.55 2.61 -0.12 0.00 1.31 0.00 0.00 55.95 60.30 3d1q s SER 137 Cb -0.53 -2.60 -0.00 0.00 0.21 0.00 0.00 66.02 63.10 3d1q s SER 137 CO 0.63 -0.81 0.47 -1.38 0.41 0.00 0.00 173.24 172.56 3d1q s HIS 138 N 1.03 0.45 -2.42 2.43 -0.00 -1.26 -0.90 115.29 114.63 3d1q s HIS 138 Ca 0.69 -0.80 0.00 0.00 -0.00 0.00 0.00 55.06 54.95 3d1q s HIS 138 Cb -0.43 0.15 0.00 0.00 -0.00 0.00 0.00 32.58 32.30 3d1q s HIS 138 CO 0.32 -1.00 0.00 0.41 -0.00 0.00 0.00 174.74 174.47 3d1q n GLY 139 N -0.39 -0.58 2.95 -1.38 0.00 -0.50 -4.59 105.19 100.70 3d1q n GLY 139 Ca -0.01 -0.71 -0.23 0.00 0.00 0.00 0.00 46.02 45.06 3d1q n GLY 139 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d1q s TYR 140 N -3.39 1.19 -0.28 1.61 2.02 0.35 -0.94 117.35 117.91 3d1q s TYR 140 Ca 0.00 -0.45 -0.05 0.00 -0.37 0.00 0.00 57.07 56.21 3d1q s TYR 140 Cb 0.00 -0.95 0.02 0.00 -0.40 0.00 0.00 41.96 40.63 3d1q s TYR 140 CO 0.00 -0.29 0.03 -0.51 -1.57 0.00 0.00 175.55 173.21 3d1q s LEU 141 N 0.98 3.64 -1.56 -1.29 1.02 -0.22 -1.43 118.68 119.83 3d1q s LEU 141 Ca -0.09 -0.81 -0.15 0.00 0.02 0.00 0.00 54.13 53.10 3d1q s LEU 141 Cb -0.15 -1.80 0.10 0.00 0.02 0.00 0.00 46.19 44.36 3d1q s LEU 141 CO 0.00 -0.18 0.96 0.47 0.02 0.00 0.00 176.35 177.62 3d1q n ASP 142 N 4.78 -4.63 0.00 2.29 8.00 0.53 -0.22 116.55 127.31 3d1q n ASP 142 Ca -0.15 -0.81 0.00 0.00 0.71 0.00 0.00 54.79 54.54 3d1q n ASP 142 Cb 0.47 -3.70 0.00 0.00 -0.02 0.00 0.00 41.12 37.87 3d1q n ASP 142 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d1q n GLY 143 N -1.64 1.71 3.66 0.44 0.00 -1.26 -4.99 105.19 103.10 3d1q n GLY 143 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3d1q n GLY 143 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d1q s ILE 144 N -3.52 5.07 -0.18 -0.61 1.01 0.69 -4.36 121.20 119.30 3d1q s ILE 144 Ca 0.00 1.04 -0.29 0.00 0.00 0.00 0.00 60.65 61.40 3d1q s ILE 144 Cb 0.00 -3.88 -0.02 0.00 0.01 0.00 0.00 42.46 38.56 3d1q s ILE 144 CO 0.00 0.15 1.46 -2.16 0.00 0.00 0.00 174.94 174.38 3d1q s PRO 145 N 1.77 4.03 0.18 2.79 0.04 -1.26 -1.06 135.00 141.49 3d1q s PRO 145 Ca 0.26 1.69 0.06 0.00 0.04 0.00 0.00 61.00 63.05 3d1q s PRO 145 Cb -0.16 -3.91 -0.05 0.00 0.04 0.00 0.00 34.50 30.42 3d1q s PRO 145 CO 0.10 -0.99 -0.10 0.14 0.04 0.00 0.00 177.00 176.18 3d1q s VAL 146 N 4.29 1.38 0.01 -0.36 -7.23 -0.12 -0.49 120.40 117.87 3d1q s VAL 146 Ca 0.64 -2.11 -0.02 0.00 -1.81 0.00 0.00 61.98 58.68 3d1q s VAL 146 Cb -0.24 -2.00 -0.01 0.00 0.56 0.00 0.00 36.38 34.69 3d1q s VAL 146 CO 0.24 -0.63 0.02 -0.94 -0.31 0.00 0.00 175.10 173.47 3d1q s SER 147 N -3.25 0.13 -0.62 4.85 1.04 -0.65 -1.41 113.70 113.80 3d1q s SER 147 Ca 0.21 -0.29 -0.27 0.00 0.48 0.00 0.00 55.95 56.07 3d1q s SER 147 Cb 0.02 0.11 0.03 0.00 0.10 0.00 0.00 66.02 66.28 3d1q s SER 147 CO 0.04 -0.23 1.16 0.86 0.98 0.00 0.00 173.24 176.05 3d1q s TRP 148 N -1.03 2.56 -0.19 5.02 -0.00 -0.07 -0.28 118.94 124.95 3d1q s TRP 148 Ca -0.11 0.17 -0.12 0.00 -0.00 0.00 0.00 56.10 56.04 3d1q s TRP 148 Cb -0.07 -4.46 -0.05 0.00 -0.00 0.00 0.00 33.47 28.90 3d1q s TRP 148 CO -0.00 -1.67 0.21 -0.47 -0.00 0.00 0.00 176.95 175.01 3d1q s TYR 149 N 4.93 3.42 0.39 5.86 5.04 0.31 -4.56 117.35 132.74 3d1q s TYR 149 Ca 0.38 0.45 0.08 0.00 -2.44 0.00 0.00 57.07 55.53 3d1q s TYR 149 Cb -0.09 -2.26 -0.07 0.00 0.35 0.00 0.00 41.96 39.90 3d1q s TYR 149 CO 0.21 0.24 0.03 0.20 -1.34 0.00 0.00 175.55 174.90 3d1q s GLY 150 N 0.47 2.33 0.26 8.97 0.00 -1.26 -0.31 107.32 117.78 3d1q s GLY 150 Ca 0.12 -2.16 -0.30 0.00 0.00 0.00 0.00 44.72 42.38 3d1q s GLY 150 CO 0.01 -2.01 1.17 1.18 0.00 0.00 0.00 173.10 173.46 3d1q n GLU 151 N -1.00 1.59 -1.10 2.90 1.02 -1.25 0.03 120.64 122.83 3d1q n GLU 151 Ca -0.04 0.56 -0.03 0.00 -0.02 0.00 0.00 57.16 57.63 3d1q n GLU 151 Cb 0.65 -2.06 -0.01 0.00 -0.02 0.00 0.00 31.44 30.00 3d1q n GLU 151 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3d1q n ARG 152 N 1.20 -1.43 -3.06 3.49 1.74 -1.26 -2.05 116.66 115.29 3d1q n ARG 152 Ca 0.10 0.52 -0.19 0.00 -0.77 0.00 0.00 57.85 57.51 3d1q n ARG 152 Cb 0.31 -4.67 0.04 0.00 -1.02 0.00 0.00 32.46 27.13 3d1q n ARG 152 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3d1q n ASP 153 N -0.72 -5.55 -1.83 0.55 4.64 0.10 -4.83 116.55 108.91 3d1q n ASP 153 Ca -0.03 -0.31 -0.20 0.00 -1.38 0.00 0.00 54.79 52.87 3d1q n ASP 153 Cb 0.41 -4.32 0.11 0.00 -1.04 0.00 0.00 41.12 36.27 3d1q n ASP 153 CO 0.00 0.00 0.00 0.79 -0.82 0.00 0.00 177.20 177.17 3d1q n TRP 154 N -4.42 2.34 0.28 -0.67 7.02 -0.87 -4.52 117.44 116.60 3d1q n TRP 154 Ca -0.07 -2.21 0.16 0.00 -1.02 0.00 0.00 57.50 54.36 3d1q n TRP 154 Cb 0.59 -0.74 0.77 0.00 -2.42 0.00 0.00 31.31 29.51 3d1q n TRP 154 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3d1q h ALA 155 N 1.65 1.09 -0.29 6.99 0.00 -1.78 -2.27 119.26 124.64 3d1q h ALA 155 Ca 0.41 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.26 3d1q h ALA 155 Cb 1.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.26 3d1q h ALA 155 CO 0.89 0.08 0.00 0.09 0.00 0.00 0.00 179.25 180.31 3d1q n ASN 156 N -3.29 3.43 -4.64 0.00 3.02 -1.26 -4.52 115.26 107.99 3d1q n ASN 156 Ca -0.01 -2.58 -0.46 0.00 -0.03 0.00 0.00 54.58 51.51 3d1q n ASN 156 Cb 0.26 -0.40 -0.03 0.00 -0.61 0.00 0.00 39.78 39.00 3d1q n ASN 156 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3d1q n LEU 157 N -0.10 2.67 0.00 3.41 7.94 -0.85 -1.45 117.00 128.62 3d1q n LEU 157 Ca 0.17 1.15 0.00 0.00 -1.11 0.00 0.00 56.01 56.22 3d1q n LEU 157 Cb 0.68 -1.37 0.00 0.00 0.53 0.00 0.00 43.42 43.26 3d1q n LEU 157 CO 0.12 -0.74 0.00 0.61 -1.11 0.00 0.00 177.39 176.26 3d1q n GLY 158 N 1.97 2.44 3.81 -3.96 0.00 -1.26 -4.71 105.19 103.49 3d1q n GLY 158 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 3d1q n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d1q s LYS 159 N -0.13 4.28 0.98 1.61 1.02 -0.53 -5.05 119.74 121.93 3d1q s LYS 159 Ca 0.00 0.91 -0.12 0.00 0.02 0.00 0.00 55.97 56.78 3d1q s LYS 159 Cb 0.00 -2.88 0.18 0.00 -0.52 0.00 0.00 37.83 34.61 3d1q s LYS 159 CO 0.00 0.39 1.08 -1.54 -0.92 0.00 0.00 175.35 174.36 3d1q s SER 160 N -1.64 2.67 0.22 2.83 1.04 -1.26 -4.73 113.70 112.84 3d1q s SER 160 Ca 0.43 1.42 -0.08 0.00 0.48 0.00 0.00 55.95 58.20 3d1q s SER 160 Cb -0.17 -2.10 0.27 0.00 0.10 0.00 0.00 66.02 64.12 3d1q s SER 160 CO 0.21 -3.13 1.84 -0.61 0.98 0.00 0.00 173.24 172.52 3d1q h GLN 161 N -1.89 0.82 0.05 4.02 4.15 -1.97 -0.43 115.11 119.87 3d1q h GLN 161 Ca -0.53 -0.05 0.02 0.00 0.77 0.00 0.00 58.65 58.86 3d1q h GLN 161 Cb 1.31 -0.19 -0.03 0.00 0.21 0.00 0.00 27.48 28.78 3d1q h GLN 161 CO 0.54 0.55 -0.20 1.25 -1.93 0.00 0.00 178.83 179.04 3d1q h HIS 162 N 0.85 -0.52 -0.82 3.99 2.76 -1.99 0.39 115.15 119.81 3d1q h HIS 162 Ca 0.33 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.50 3d1q h HIS 162 Cb 0.14 0.22 -0.04 0.00 1.55 0.00 0.00 27.41 29.28 3d1q h HIS 162 CO -0.05 -0.28 0.47 0.93 -1.30 0.00 0.00 177.93 177.70 3d1q h GLU 163 N -0.35 1.13 -0.46 5.26 5.08 -1.79 -0.16 114.58 123.30 3d1q h GLU 163 Ca 0.04 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3d1q h GLU 163 Cb 0.39 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 3d1q h GLU 163 CO -0.15 0.82 0.26 0.00 -1.00 0.00 0.00 179.01 178.94 3d1q h ALA 164 N 1.25 0.59 -0.03 3.43 0.00 -0.79 -0.20 119.26 123.51 3d1q h ALA 164 Ca 0.29 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 3d1q h ALA 164 Cb -0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3d1q h ALA 164 CO -0.05 0.10 -0.56 -0.07 0.00 0.00 0.00 179.25 178.67 3d1q h LEU 165 N 0.61 0.10 -0.33 0.00 4.07 -0.63 -1.99 115.31 117.14 3d1q h LEU 165 Ca 0.16 -0.05 -0.12 0.00 0.08 0.00 0.00 57.88 57.96 3d1q h LEU 165 Cb 0.03 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 3d1q h LEU 165 CO -0.03 0.64 -0.25 0.00 -1.08 0.00 0.00 178.44 177.72 3d1q h ALA 166 N 1.37 0.47 -0.58 1.53 0.00 -0.65 -1.19 119.26 120.20 3d1q h ALA 166 Ca -0.00 -0.39 0.04 0.00 0.00 0.00 0.00 54.91 54.56 3d1q h ALA 166 Cb 1.01 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 3d1q h ALA 166 CO 0.08 0.46 0.32 0.22 0.00 0.00 0.00 179.25 180.33 3d1q h ASP 167 N 0.51 0.49 0.37 0.00 1.82 -0.94 -0.72 116.42 117.95 3d1q h ASP 167 Ca 0.06 0.02 -0.00 0.00 -0.39 0.00 0.00 57.03 56.72 3d1q h ASP 167 Cb 0.81 -0.08 -0.02 0.00 0.68 0.00 0.00 39.33 40.72 3d1q h ASP 167 CO 0.07 0.34 -0.34 -0.08 -1.61 0.00 0.00 179.24 177.62 3d1q h GLU 168 N 0.62 -0.69 -0.67 0.28 4.81 -1.17 0.25 114.58 118.02 3d1q h GLU 168 Ca 0.25 0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.57 3d1q h GLU 168 Cb 0.11 0.16 -0.05 0.00 0.63 0.00 0.00 28.75 29.60 3d1q h GLU 168 CO -0.14 -0.46 0.40 0.00 -0.73 0.00 0.00 179.01 178.07 3d1q h ARG 169 N -0.72 0.73 -0.38 1.92 3.08 -1.07 -1.31 114.38 116.64 3d1q h ARG 169 Ca -0.03 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 3d1q h ARG 169 Cb 0.64 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 3d1q h ARG 169 CO -0.04 0.49 0.07 0.45 -1.07 0.00 0.00 179.97 179.86 3d1q h HIS 170 N 0.76 0.66 -0.36 3.04 3.86 -0.65 -1.93 115.15 120.52 3d1q h HIS 170 Ca 0.28 -0.09 -0.11 0.00 -1.16 0.00 0.00 60.37 59.30 3d1q h HIS 170 Cb 0.10 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 3d1q h HIS 170 CO -0.06 0.66 -0.21 0.00 0.86 0.00 0.00 177.93 179.18 3d1q h ARG 171 N 0.47 0.69 0.03 2.45 3.08 -0.32 -1.60 114.38 119.18 3d1q h ARG 171 Ca 0.12 -0.26 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 3d1q h ARG 171 Cb 0.35 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3d1q h ARG 171 CO 0.01 0.84 -0.02 -0.07 -1.07 0.00 0.00 179.97 179.66 3d1q h LEU 172 N 0.60 -0.04 -0.68 3.04 3.38 -1.13 -2.89 115.31 117.59 3d1q h LEU 172 Ca 0.09 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.83 3d1q h LEU 172 Cb 0.69 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 3d1q h LEU 172 CO 0.05 0.23 0.44 -0.74 0.09 0.00 0.00 178.44 178.51 3d1q h HIS 173 N -0.30 0.83 0.00 1.13 2.76 -1.31 -1.34 115.15 116.91 3d1q h HIS 173 Ca -0.00 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 3d1q h HIS 173 Cb 0.28 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 28.97 3d1q h HIS 173 CO 0.01 0.50 0.00 0.00 -1.30 0.00 0.00 177.93 177.14 3d1q h ALA 174 N 1.27 1.00 0.00 5.26 0.00 -1.25 -1.81 119.26 123.73 3d1q h ALA 174 Ca 0.26 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 3d1q h ALA 174 Cb -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3d1q h ALA 174 CO -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 179.25 178.78 3d1q h ALA 175 N 2.01 0.76 -2.16 0.00 0.00 -1.02 -3.43 119.26 115.41 3d1q h ALA 175 Ca 0.00 -0.35 -0.59 0.00 0.00 0.00 0.00 54.91 53.96 3d1q h ALA 175 Cb 0.12 -0.06 0.04 0.00 0.00 0.00 0.00 17.79 17.88 3d1q h ALA 175 CO 0.00 0.48 0.98 -0.11 0.00 0.00 0.00 179.25 180.61 3d1q n LEU 176 N -3.22 3.36 -0.63 0.00 7.94 -0.68 -1.04 117.00 122.73 3d1q n LEU 176 Ca 0.02 1.02 -0.08 0.00 -1.11 0.00 0.00 56.01 55.86 3d1q n LEU 176 Cb 0.67 -1.41 -0.04 0.00 0.53 0.00 0.00 43.42 43.18 3d1q n LEU 176 CO 0.39 -0.13 -0.08 1.41 -1.11 0.00 0.00 177.39 177.87 3d1q n HIS 177 N 5.30 0.00 -4.43 1.96 8.25 0.17 -4.98 115.22 121.49 3d1q n HIS 177 Ca 0.20 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.41 3d1q n HIS 177 Cb 0.30 -1.80 -0.09 0.00 1.12 0.00 0.00 29.99 29.52 3d1q n HIS 177 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3d1q s LYS 178 N -2.47 1.93 -0.06 -0.41 -0.14 -0.21 -4.81 119.74 113.57 3d1q s LYS 178 Ca 0.00 -1.80 -0.25 0.00 -1.36 0.00 0.00 55.97 52.56 3d1q s LYS 178 Cb 0.00 -1.83 -0.03 0.00 -1.68 0.00 0.00 37.83 34.28 3d1q s LYS 178 CO 0.00 0.19 0.79 0.99 -0.76 0.00 0.00 175.35 176.55 3d1q s THR 179 N -2.54 4.99 0.12 2.17 2.01 -1.26 -1.24 115.64 119.89 3d1q s THR 179 Ca 0.33 1.62 0.06 0.00 0.31 0.00 0.00 61.69 64.01 3d1q s THR 179 Cb -0.00 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.35 3d1q s THR 179 CO 0.18 0.21 -0.14 0.68 -0.69 0.00 0.00 174.62 174.85 3d1q s VAL 180 N 0.97 1.35 -0.24 3.82 -7.23 0.72 -4.96 120.40 114.82 3d1q s VAL 180 Ca 0.41 -1.69 -0.07 0.00 -1.81 0.00 0.00 61.98 58.82 3d1q s VAL 180 Cb -0.18 -1.52 -0.03 0.00 0.56 0.00 0.00 36.38 35.21 3d1q s VAL 180 CO 0.20 -0.39 0.07 -0.47 -0.31 0.00 0.00 175.10 174.20 3d1q s TYR 181 N -2.04 3.10 -0.20 2.82 5.04 -1.26 -1.84 117.35 122.97 3d1q s TYR 181 Ca 0.08 -0.37 -0.01 0.00 -2.44 0.00 0.00 57.07 54.33 3d1q s TYR 181 Cb -0.05 -2.21 0.01 0.00 0.35 0.00 0.00 41.96 40.05 3d1q s TYR 181 CO 0.03 -0.30 -0.14 0.42 -1.34 0.00 0.00 175.55 174.22 3d1q s ILE 182 N 1.46 2.57 0.02 3.14 1.01 0.19 -3.81 121.20 125.78 3d1q s ILE 182 Ca 0.06 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 59.93 3d1q s ILE 182 Cb -0.15 -2.12 -0.02 0.00 0.01 0.00 0.00 42.46 40.18 3d1q s ILE 182 CO 0.03 0.49 -0.01 0.00 0.00 0.00 0.00 174.94 175.46 3d1q s ALA 183 N 1.36 0.07 0.55 9.38 0.00 -0.60 -1.12 121.76 131.40 3d1q s ALA 183 Ca 0.05 -0.55 -0.10 0.00 0.00 0.00 0.00 51.96 51.36 3d1q s ALA 183 Cb -0.13 0.15 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 3d1q s ALA 183 CO -0.09 -0.17 0.93 -1.25 0.00 0.00 0.00 175.76 175.18 3d1q s PRO 184 N -1.55 3.62 0.22 0.00 0.04 -1.26 -0.74 135.00 135.33 3d1q s PRO 184 Ca -0.15 0.58 -0.11 0.00 0.04 0.00 0.00 61.00 61.36 3d1q s PRO 184 Cb -0.09 -2.20 -0.07 0.00 0.04 0.00 0.00 34.50 32.18 3d1q s PRO 184 CO -0.01 -0.40 0.57 -0.51 0.04 0.00 0.00 177.00 176.69 3d1q s LEU 185 N -4.86 4.20 0.00 -3.56 1.43 -1.26 -2.17 118.68 112.45 3d1q s LEU 185 Ca 0.53 0.99 0.00 0.00 -1.03 0.00 0.00 54.13 54.62 3d1q s LEU 185 Cb -0.11 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.48 3d1q s LEU 185 CO 0.48 -0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.62 3d1q n GLY 186 N 0.05 3.12 3.73 -3.19 0.00 -0.44 -4.87 105.19 103.59 3d1q n GLY 186 Ca -0.01 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 3d1q n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d1q s LYS 187 N 2.49 4.17 -1.83 1.61 1.02 -1.26 -2.59 119.74 123.35 3d1q s LYS 187 Ca 0.00 2.48 0.00 0.00 0.02 0.00 0.00 55.97 58.47 3d1q s LYS 187 Cb 0.00 -3.10 0.00 0.00 -0.52 0.00 0.00 37.83 34.21 3d1q s LYS 187 CO 0.00 -0.64 0.00 0.72 -0.92 0.00 0.00 175.35 174.51 3d1q n HIS 188 N 3.42 -0.75 -2.69 3.18 8.25 -1.26 -2.03 115.22 123.34 3d1q n HIS 188 Ca 0.13 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.39 3d1q n HIS 188 Cb 0.37 -3.70 0.01 0.00 1.12 0.00 0.00 29.99 27.80 3d1q n HIS 188 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3d1q n LYS 189 N -2.78 -3.14 -4.38 -0.41 4.76 -1.07 -5.00 118.16 106.14 3d1q n LYS 189 Ca -0.23 0.85 -0.29 0.00 -2.87 0.00 0.00 58.31 55.77 3d1q n LYS 189 Cb 0.67 -5.44 -0.12 0.00 -1.84 0.00 0.00 35.03 28.30 3d1q n LYS 189 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3d1q s LEU 190 N -5.69 2.42 0.46 -0.35 1.43 -0.86 -4.83 118.68 111.25 3d1q s LEU 190 Ca 0.16 -0.73 -0.22 0.00 -1.03 0.00 0.00 54.13 52.31 3d1q s LEU 190 Cb -0.07 -1.28 -0.11 0.00 0.03 0.00 0.00 46.19 44.77 3d1q s LEU 190 CO 0.19 0.17 0.65 -2.65 0.23 0.00 0.00 176.35 174.94 3d1q n PRO 191 N 0.78 0.72 -3.44 1.29 -0.02 -1.26 -1.33 135.00 131.74 3d1q n PRO 191 Ca -0.17 0.26 -0.16 0.00 -2.02 0.00 0.00 63.50 61.42 3d1q n PRO 191 Cb 0.53 -1.68 -0.11 0.00 -0.02 0.00 0.00 33.50 32.22 3d1q n PRO 191 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3d1q s GLU 192 N -1.83 0.26 5.90 -0.52 2.12 -0.92 -4.73 118.70 118.98 3d1q s GLU 192 Ca 0.65 0.22 0.00 0.00 0.36 0.00 0.00 54.97 56.20 3d1q s GLU 192 Cb -0.55 -0.91 0.00 0.00 0.26 0.00 0.00 34.13 32.93 3d1q s GLU 192 CO 0.56 -0.72 0.00 0.41 -0.54 0.00 0.00 175.26 174.97 3d1q n GLY 193 N 5.33 1.85 0.00 -1.50 0.00 -1.26 -4.31 105.19 105.29 3d1q n GLY 193 Ca -0.04 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.45 3d1q n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d1q n GLY 194 N 0.00 0.26 3.55 -0.02 0.00 -1.26 -4.72 105.19 102.99 3d1q n GLY 194 Ca 0.00 -1.79 -0.10 0.00 0.00 0.00 0.00 46.02 44.13 3d1q n GLY 194 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3d1q s GLU 195 N 0.00 1.42 -0.06 1.61 -1.05 -0.28 -5.00 118.70 115.34 3d1q s GLU 195 Ca 0.00 -0.77 0.03 0.00 -0.15 0.00 0.00 54.97 54.08 3d1q s GLU 195 Cb 0.00 0.55 0.00 0.00 -0.44 0.00 0.00 34.13 34.25 3d1q s GLU 195 CO 0.00 -0.61 -0.16 0.08 0.95 0.00 0.00 175.26 175.51 3d1q s VAL 196 N -3.85 1.39 0.14 1.83 1.01 -1.26 -0.63 120.40 119.03 3d1q s VAL 196 Ca 0.07 -0.66 -0.17 0.00 0.00 0.00 0.00 61.98 61.22 3d1q s VAL 196 Cb -0.02 -1.22 0.04 0.00 0.00 0.00 0.00 36.38 35.18 3d1q s VAL 196 CO -0.04 0.41 0.43 0.00 0.00 0.00 0.00 175.10 175.90 3d1q s ARG 197 N 0.30 1.13 -0.43 2.72 1.70 -0.76 -4.98 118.95 118.63 3d1q s ARG 197 Ca -0.10 -0.71 -0.15 0.00 -0.47 0.00 0.00 55.73 54.30 3d1q s ARG 197 Cb -0.14 0.49 0.04 0.00 -0.57 0.00 0.00 34.95 34.77 3d1q s ARG 197 CO 0.04 -0.45 0.33 0.50 -1.08 0.00 0.00 175.30 174.63 3d1q s ARG 198 N -3.81 2.96 0.18 3.89 3.52 -1.26 -0.20 118.95 124.22 3d1q s ARG 198 Ca 0.04 -1.14 -0.31 0.00 -0.13 0.00 0.00 55.73 54.18 3d1q s ARG 198 Cb 0.01 -4.02 -0.10 0.00 -1.56 0.00 0.00 34.95 29.28 3d1q s ARG 198 CO -0.11 -0.85 1.57 0.08 -0.81 0.00 0.00 175.30 175.19 3d1q s VAL 199 N 1.66 2.57 -0.21 7.11 1.01 -0.37 -4.88 120.40 127.29 3d1q s VAL 199 Ca 0.04 0.42 0.12 0.00 0.00 0.00 0.00 61.98 62.56 3d1q s VAL 199 Cb -0.21 -3.27 -0.17 0.00 0.00 0.00 0.00 36.38 32.73 3d1q s VAL 199 CO 0.09 0.04 0.36 0.00 0.00 0.00 0.00 175.10 175.58 3d1q n GLN 200 N 3.81 1.32 -3.76 2.72 1.13 -1.26 0.44 117.38 121.78 3d1q n GLN 200 Ca 0.13 -0.07 -0.13 0.00 -1.94 0.00 0.00 57.00 54.99 3d1q n GLN 200 Cb 0.38 -1.21 -0.14 0.00 0.11 0.00 0.00 30.24 29.38 3d1q n GLN 200 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 3d1q s LYS 201 N -2.60 0.14 -0.05 -1.09 2.47 -1.26 -4.87 119.74 112.48 3d1q s LYS 201 Ca -0.01 0.38 0.04 0.00 -1.56 0.00 0.00 55.97 54.81 3d1q s LYS 201 Cb 0.08 -0.11 0.00 0.00 -1.46 0.00 0.00 37.83 36.34 3d1q s LYS 201 CO 0.51 -0.14 -0.16 0.08 0.16 0.00 0.00 175.35 175.80 3d1q s VAL 202 N 0.97 1.35 0.01 4.02 1.01 -1.26 -0.34 120.40 126.15 3d1q s VAL 202 Ca -0.07 -0.65 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 3d1q s VAL 202 Cb -0.09 -1.18 -0.01 0.00 0.00 0.00 0.00 36.38 35.10 3d1q s VAL 202 CO -0.05 0.40 0.01 -1.10 0.00 0.00 0.00 175.10 174.35 3d1q s GLN 203 N 0.23 0.23 0.68 2.72 -0.21 -0.51 -5.00 119.66 117.80 3d1q s GLN 203 Ca -0.08 -0.35 -0.07 0.00 0.02 0.00 0.00 55.36 54.88 3d1q s GLN 203 Cb -0.13 0.09 0.04 0.00 1.00 0.00 0.00 33.01 34.01 3d1q s GLN 203 CO 0.03 -0.04 1.00 0.95 -2.12 0.00 0.00 175.29 175.11 3d1q s THR 204 N -0.93 2.79 0.33 -0.19 -4.23 -1.26 -0.49 115.64 111.65 3d1q s THR 204 Ca -0.10 -0.09 0.09 0.00 -1.18 0.00 0.00 61.69 60.41 3d1q s THR 204 Cb -0.06 -3.19 0.07 0.00 1.34 0.00 0.00 72.50 70.66 3d1q s THR 204 CO -0.00 -0.21 1.76 -0.08 -0.54 0.00 0.00 174.62 175.55 3d1q h GLU 205 N -0.52 0.17 -0.42 3.99 4.81 -1.92 -2.72 114.58 117.97 3d1q h GLU 205 Ca -0.45 -0.07 0.06 0.00 -0.13 0.00 0.00 59.36 58.77 3d1q h GLU 205 Cb 1.29 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.61 3d1q h GLU 205 CO 0.61 0.52 0.11 0.37 -0.73 0.00 0.00 179.01 179.89 3d1q h GLN 206 N 0.15 0.25 -0.47 1.92 4.15 -1.97 0.24 115.11 119.37 3d1q h GLN 206 Ca 0.02 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3d1q h GLN 206 Cb 0.72 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.33 3d1q h GLN 206 CO 0.05 0.16 0.30 0.93 -1.93 0.00 0.00 178.83 178.35 3d1q h GLU 207 N 0.26 0.62 -0.86 1.69 5.08 -1.90 0.39 114.58 119.86 3d1q h GLU 207 Ca 0.20 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.49 3d1q h GLU 207 Cb 0.23 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 3d1q h GLU 207 CO -0.24 0.42 0.43 0.28 -1.00 0.00 0.00 179.01 178.90 3d1q h VAL 208 N 0.63 1.26 -0.08 3.13 2.07 -1.05 -0.34 116.25 121.87 3d1q h VAL 208 Ca 0.17 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 3d1q h VAL 208 Cb -0.06 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 29.85 3d1q h VAL 208 CO -0.04 0.31 0.02 0.00 0.02 0.00 0.00 177.57 177.88 3d1q h ALA 209 N 1.25 0.10 -0.48 1.67 0.00 -0.08 -2.38 119.26 119.33 3d1q h ALA 209 Ca 0.30 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 3d1q h ALA 209 Cb 0.09 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3d1q h ALA 209 CO -0.04 -0.27 0.19 0.93 0.00 0.00 0.00 179.25 180.05 3d1q h GLU 210 N -0.09 0.69 0.00 0.00 5.08 -0.62 0.30 114.58 119.94 3d1q h GLU 210 Ca 0.02 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3d1q h GLU 210 Cb 0.25 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3d1q h GLU 210 CO 0.00 0.58 0.00 0.00 -1.00 0.00 0.00 179.01 178.59 3d1q h ALA 211 N 1.52 1.00 -0.22 3.43 0.00 -0.95 -0.31 119.26 123.73 3d1q h ALA 211 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3d1q h ALA 211 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3d1q h ALA 211 CO -0.02 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.23 3d1q n ALA 212 N -2.08 2.49 -1.29 0.00 0.00 -0.02 -4.93 120.51 114.68 3d1q n ALA 212 Ca -0.00 -0.67 -0.01 0.00 0.00 0.00 0.00 53.44 52.76 3d1q n ALA 212 Cb 0.25 -1.01 -0.00 0.00 0.00 0.00 0.00 19.45 18.68 3d1q n ALA 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d1q n GLY 213 N 1.25 0.44 3.60 0.00 0.00 -0.13 -4.82 105.19 105.53 3d1q n GLY 213 Ca 0.17 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 3d1q n GLY 213 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3d1q s MET 214 N -2.61 2.32 0.79 1.61 -1.94 -0.52 -4.75 119.30 114.20 3d1q s MET 214 Ca 0.00 -0.91 -0.11 0.00 -1.71 0.00 0.00 55.69 52.96 3d1q s MET 214 Cb 0.00 -2.40 0.06 0.00 2.01 0.00 0.00 34.83 34.51 3d1q s MET 214 CO 0.00 0.54 1.09 1.03 -0.01 0.00 0.00 175.02 177.67 3d1q s ARG 215 N -1.99 2.18 -0.04 2.03 0.52 0.67 -3.51 118.95 118.82 3d1q s ARG 215 Ca 0.21 0.70 0.03 0.00 -0.52 0.00 0.00 55.73 56.15 3d1q s ARG 215 Cb -0.11 -1.92 0.00 0.00 0.52 0.00 0.00 34.95 33.43 3d1q s ARG 215 CO 0.13 -1.57 -0.13 -0.47 0.02 0.00 0.00 175.30 173.28 3d1q s TYR 216 N -3.13 1.35 -0.03 -0.53 5.04 -1.26 0.14 117.35 118.93 3d1q s TYR 216 Ca 0.60 -0.38 -0.01 0.00 -2.44 0.00 0.00 57.07 54.85 3d1q s TYR 216 Cb -0.14 -0.93 0.03 0.00 0.35 0.00 0.00 41.96 41.26 3d1q s TYR 216 CO 0.54 -0.14 0.04 0.12 -1.34 0.00 0.00 175.55 174.77 3d1q s PHE 217 N 0.15 0.05 -0.18 4.97 5.36 -0.69 -4.95 117.98 122.69 3d1q s PHE 217 Ca -0.04 0.18 -0.05 0.00 -0.96 0.00 0.00 56.93 56.06 3d1q s PHE 217 Cb -0.10 -0.35 -0.03 0.00 -0.34 0.00 0.00 43.02 42.20 3d1q s PHE 217 CO 0.01 -0.14 0.01 0.50 -1.46 0.00 0.00 175.22 174.15 3d1q s ARG 218 N 1.56 3.72 -0.24 10.12 6.06 -1.26 -0.88 118.95 138.03 3d1q s ARG 218 Ca -0.03 -0.48 0.01 0.00 -2.50 0.00 0.00 55.73 52.74 3d1q s ARG 218 Cb -0.13 -3.07 0.06 0.00 0.06 0.00 0.00 34.95 31.87 3d1q s ARG 218 CO -0.03 0.13 -0.06 0.42 -2.50 0.00 0.00 175.30 173.26 3d1q s ILE 219 N 0.69 1.69 -1.25 4.11 1.01 0.19 -4.99 121.20 122.65 3d1q s ILE 219 Ca 0.00 -1.35 -0.19 0.00 0.00 0.00 0.00 60.65 59.12 3d1q s ILE 219 Cb -0.14 -1.93 0.06 0.00 0.01 0.00 0.00 42.46 40.46 3d1q s ILE 219 CO 0.02 -0.10 1.71 0.00 0.00 0.00 0.00 174.94 176.57 3d1q s ALA 220 N 1.32 3.16 -0.13 9.38 0.00 -1.26 -3.24 121.76 130.99 3d1q s ALA 220 Ca -0.06 -2.79 -0.10 0.00 0.00 0.00 0.00 51.96 49.02 3d1q s ALA 220 Cb -0.19 -4.63 -0.05 0.00 0.00 0.00 0.00 23.12 18.25 3d1q s ALA 220 CO -0.06 -3.43 0.19 0.00 0.00 0.00 0.00 175.76 172.46 3d1q s ALA 221 N 4.65 3.77 0.21 0.00 0.00 -1.01 -4.55 121.76 124.84 3d1q s ALA 221 Ca 0.54 -0.57 -0.30 0.00 0.00 0.00 0.00 51.96 51.63 3d1q s ALA 221 Cb 0.03 -2.13 -0.08 0.00 0.00 0.00 0.00 23.12 20.94 3d1q s ALA 221 CO 0.06 0.42 1.15 0.99 0.00 0.00 0.00 175.76 178.38 3d1q s THR 222 N -0.50 3.59 0.49 0.00 2.01 -1.26 -1.44 115.64 118.52 3d1q s THR 222 Ca 0.15 1.41 -0.24 0.00 0.31 0.00 0.00 61.69 63.32 3d1q s THR 222 Cb -0.12 -3.90 -0.07 0.00 0.01 0.00 0.00 72.50 68.41 3d1q s THR 222 CO 0.04 0.26 1.41 -0.67 -0.69 0.00 0.00 174.62 174.97 3d1q n ASP 223 N 2.09 3.13 0.00 3.53 4.64 -1.26 -3.39 116.55 125.29 3d1q n ASP 223 Ca 0.02 1.07 0.00 0.00 -1.38 0.00 0.00 54.79 54.51 3d1q n ASP 223 Cb 0.45 -1.60 0.00 0.00 -1.04 0.00 0.00 41.12 38.93 3d1q n ASP 223 CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 3d1q n HIS 224 N -0.50 0.00 -4.40 -0.67 8.25 -1.26 -4.98 115.22 111.66 3d1q n HIS 224 Ca 0.07 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.33 3d1q n HIS 224 Cb 0.42 -0.29 -0.10 0.00 1.12 0.00 0.00 29.99 31.14 3d1q n HIS 224 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 3d1q s VAL 225 N -2.90 1.23 0.23 1.59 -7.23 -1.22 -4.81 120.40 107.30 3d1q s VAL 225 Ca 0.00 -2.04 -0.31 0.00 -1.81 0.00 0.00 61.98 57.82 3d1q s VAL 225 Cb 0.00 -2.56 -0.11 0.00 0.56 0.00 0.00 36.38 34.27 3d1q s VAL 225 CO 0.00 -0.18 1.58 0.86 -0.31 0.00 0.00 175.10 177.05 3d1q s TRP 226 N -3.28 2.92 0.35 2.82 -0.11 -1.26 -4.83 118.94 115.56 3d1q s TRP 226 Ca 0.32 0.70 -0.28 0.00 1.22 0.00 0.00 56.10 58.06 3d1q s TRP 226 Cb 0.07 -3.99 -0.12 0.00 -1.50 0.00 0.00 33.47 27.92 3d1q s TRP 226 CO 0.12 -3.50 1.36 -2.30 -4.62 0.00 0.00 176.95 168.01 3d1q n PRO 227 N 3.06 2.31 -1.08 5.86 -0.02 -1.26 -4.93 135.00 138.94 3d1q n PRO 227 Ca 0.11 0.81 -0.30 0.00 -2.02 0.00 0.00 63.50 62.10 3d1q n PRO 227 Cb 0.38 -2.44 0.14 0.00 -0.02 0.00 0.00 33.50 31.56 3d1q n PRO 227 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3d1q s THR 228 N -1.08 2.67 0.40 3.45 -4.23 -1.26 -4.78 115.64 110.81 3d1q s THR 228 Ca 0.55 0.22 0.06 0.00 -1.18 0.00 0.00 61.69 61.34 3d1q s THR 228 Cb -0.54 -2.59 0.27 0.00 1.34 0.00 0.00 72.50 70.98 3d1q s THR 228 CO 0.63 -0.28 2.04 -0.65 -0.54 0.00 0.00 174.62 175.81 3d1q h PRO 229 N -1.60 0.61 -0.07 3.99 0.11 -1.93 -0.90 132.00 132.21 3d1q h PRO 229 Ca -0.48 -0.04 -0.18 0.00 0.11 0.00 0.00 66.00 65.42 3d1q h PRO 229 Cb 1.27 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3d1q h PRO 229 CO 0.51 0.40 -0.71 1.05 -0.21 0.00 0.00 178.00 179.05 3d1q h GLU 230 N 0.63 0.35 -0.59 1.05 9.09 -1.99 0.17 114.58 123.30 3d1q h GLU 230 Ca 0.18 -0.28 0.00 0.00 0.05 0.00 0.00 59.36 59.31 3d1q h GLU 230 Cb -0.03 0.06 -0.03 0.00 -1.65 0.00 0.00 28.75 27.10 3d1q h GLU 230 CO -0.04 0.92 0.39 -0.91 0.05 0.00 0.00 179.01 179.42 3d1q h ASN 231 N 0.24 0.68 -0.11 3.06 -0.26 -1.57 -1.63 115.58 115.99 3d1q h ASN 231 Ca -0.03 -0.02 -0.17 0.00 -0.56 0.00 0.00 56.30 55.53 3d1q h ASN 231 Cb 1.27 -0.17 0.01 0.00 -1.06 0.00 0.00 38.32 38.37 3d1q h ASN 231 CO 0.12 0.50 -0.58 0.40 -1.06 0.00 0.00 177.43 176.80 3d1q h ILE 232 N 0.80 1.35 -0.51 2.81 2.04 -1.11 -1.58 117.51 121.31 3d1q h ILE 232 Ca 0.21 -1.88 0.07 0.00 1.00 0.00 0.00 64.86 64.26 3d1q h ILE 232 Cb -0.08 2.17 -0.06 0.00 -0.74 0.00 0.00 36.82 38.11 3d1q h ILE 232 CO -0.05 0.57 0.19 0.44 0.00 0.00 0.00 178.15 179.30 3d1q h ASP 233 N 0.21 0.20 -0.80 1.72 3.32 -0.61 -0.35 116.42 120.10 3d1q h ASP 233 Ca -0.04 0.06 0.04 0.00 0.02 0.00 0.00 57.03 57.10 3d1q h ASP 233 Cb 1.23 0.04 -0.05 0.00 0.22 0.00 0.00 39.33 40.76 3d1q h ASP 233 CO 0.12 0.14 0.51 -0.09 -1.72 0.00 0.00 179.24 178.20 3d1q h ARG 234 N 0.37 0.94 -0.43 3.56 2.43 -1.22 -1.31 114.38 118.73 3d1q h ARG 234 Ca 0.24 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.31 3d1q h ARG 234 Cb 0.26 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 3d1q h ARG 234 CO -0.24 0.63 0.09 0.35 -1.51 0.00 0.00 179.97 179.29 3d1q h PHE 235 N 0.97 0.74 -0.26 2.20 3.57 -0.40 -1.82 116.94 121.94 3d1q h PHE 235 Ca 0.33 -0.09 -0.10 0.00 3.53 0.00 0.00 57.97 61.64 3d1q h PHE 235 Cb 0.04 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.56 3d1q h PHE 235 CO -0.03 0.70 -0.25 -0.07 -2.23 0.00 0.00 178.31 176.43 3d1q h LEU 236 N 0.57 0.49 -0.35 0.59 3.38 -0.81 0.33 115.31 119.52 3d1q h LEU 236 Ca 0.13 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.89 3d1q h LEU 236 Cb 0.34 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3d1q h LEU 236 CO 0.00 0.74 0.01 0.00 0.09 0.00 0.00 178.44 179.28 3d1q h ALA 237 N 1.30 0.47 -0.47 1.53 0.00 -1.16 -2.40 119.26 118.53 3d1q h ALA 237 Ca 0.06 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3d1q h ALA 237 Cb 0.66 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 3d1q h ALA 237 CO 0.05 0.22 0.27 0.35 0.00 0.00 0.00 179.25 180.14 3d1q h PHE 238 N 0.42 0.64 -0.97 0.00 3.04 -0.91 -2.84 116.94 116.32 3d1q h PHE 238 Ca 0.10 -0.01 0.07 0.00 3.98 0.00 0.00 57.97 62.11 3d1q h PHE 238 Cb 0.44 -0.21 -0.07 0.00 2.56 0.00 0.00 35.95 38.67 3d1q h PHE 238 CO 0.03 0.47 0.62 -0.92 -2.02 0.00 0.00 178.31 176.50 3d1q h TYR 239 N 0.63 1.15 0.00 0.41 3.20 -0.23 -2.00 116.97 120.12 3d1q h TYR 239 Ca 0.17 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.03 3d1q h TYR 239 Cb 0.03 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 37.92 3d1q h TYR 239 CO -0.02 0.59 -0.18 0.00 -1.64 0.00 0.00 178.16 176.90 3d1q h ARG 240 N 1.12 0.00 -0.00 1.82 2.47 -1.19 -2.47 114.38 116.13 3d1q h ARG 240 Ca 0.42 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.14 3d1q h ARG 240 Cb 0.19 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.51 3d1q h ARG 240 CO -0.18 0.18 -0.16 0.25 0.56 0.00 0.00 179.97 180.62 3d1q n THR 241 N -4.06 0.00 -2.39 2.04 -2.24 -0.76 -4.93 114.28 101.95 3d1q n THR 241 Ca -0.02 -0.03 -0.41 0.00 -2.27 0.00 0.00 64.05 61.32 3d1q n THR 241 Cb 0.26 -0.14 -0.04 0.00 -2.10 0.00 0.00 70.33 68.32 3d1q n THR 241 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3d1q s LEU 242 N -2.72 4.48 0.76 3.22 1.43 -0.93 -5.02 118.68 119.90 3d1q s LEU 242 Ca 0.21 2.27 -0.11 0.00 -1.03 0.00 0.00 54.13 55.47 3d1q s LEU 242 Cb 0.19 -3.61 0.05 0.00 0.03 0.00 0.00 46.19 42.85 3d1q s LEU 242 CO 0.53 -0.32 1.10 -2.16 0.23 0.00 0.00 176.35 175.74 3d1q s PRO 243 N -0.66 2.27 0.36 1.29 0.04 -1.26 -4.91 135.00 132.14 3d1q s PRO 243 Ca 0.50 1.23 0.07 0.00 0.04 0.00 0.00 61.00 62.85 3d1q s PRO 243 Cb -0.33 -1.90 0.78 0.00 0.04 0.00 0.00 34.50 33.10 3d1q s PRO 243 CO 0.39 -1.64 1.92 0.37 0.04 0.00 0.00 177.00 178.08 3d1q h GLN 244 N -0.98 0.70 -0.65 4.56 4.15 -2.00 -1.91 115.11 118.98 3d1q h GLN 244 Ca -0.44 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 58.94 3d1q h GLN 244 Cb 1.24 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.77 3d1q h GLN 244 CO 0.51 0.46 0.00 -0.40 -1.93 0.00 0.00 178.83 177.48 3d1q n ASP 245 N -4.51 3.63 -4.77 -0.69 5.75 -1.26 -4.96 116.55 109.75 3d1q n ASP 245 Ca 0.14 -2.42 -0.41 0.00 -0.01 0.00 0.00 54.79 52.09 3d1q n ASP 245 Cb 0.35 -0.53 -0.02 0.00 -1.03 0.00 0.00 41.12 39.89 3d1q n ASP 245 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3d1q s ALA 246 N -1.91 3.51 -0.17 2.12 0.00 -0.72 -3.84 121.76 120.75 3d1q s ALA 246 Ca 0.35 1.28 -0.03 0.00 0.00 0.00 0.00 51.96 53.55 3d1q s ALA 246 Cb 0.24 -3.49 -0.02 0.00 0.00 0.00 0.00 23.12 19.85 3d1q s ALA 246 CO 0.14 -0.66 -0.06 -0.46 0.00 0.00 0.00 175.76 174.72 3d1q s TRP 247 N -1.05 2.96 -0.27 0.00 -0.11 -0.23 -4.88 118.94 115.35 3d1q s TRP 247 Ca 0.50 -0.52 -0.07 0.00 1.22 0.00 0.00 56.10 57.23 3d1q s TRP 247 Cb -0.40 -1.97 -0.01 0.00 -1.50 0.00 0.00 33.47 29.59 3d1q s TRP 247 CO 0.53 -0.20 0.07 -0.51 -4.62 0.00 0.00 176.95 172.22 3d1q s LEU 248 N 0.63 3.63 -0.48 5.86 1.43 -0.56 -0.81 118.68 128.39 3d1q s LEU 248 Ca -0.03 -0.47 -0.15 0.00 -1.03 0.00 0.00 54.13 52.45 3d1q s LEU 248 Cb -0.15 -1.90 0.08 0.00 0.03 0.00 0.00 46.19 44.26 3d1q s LEU 248 CO 0.02 -0.12 0.40 -2.28 0.23 0.00 0.00 176.35 174.61 3d1q s HIS 249 N 1.55 3.26 0.24 0.29 5.65 0.08 -0.81 115.29 125.56 3d1q s HIS 249 Ca 0.05 -1.07 -0.11 0.00 0.25 0.00 0.00 55.06 54.17 3d1q s HIS 249 Cb -0.16 -3.27 -0.08 0.00 -1.18 0.00 0.00 32.58 27.89 3d1q s HIS 249 CO 0.03 -0.85 0.59 -0.06 -0.65 0.00 0.00 174.74 173.80 3d1q s PHE 250 N 1.61 3.43 -0.01 3.88 0.08 -0.17 -0.37 117.98 126.44 3d1q s PHE 250 Ca 0.04 0.96 -0.28 0.00 0.12 0.00 0.00 56.93 57.76 3d1q s PHE 250 Cb -0.25 -2.33 0.09 0.00 -0.57 0.00 0.00 43.02 39.96 3d1q s PHE 250 CO 0.05 0.25 0.75 -3.38 -0.10 0.00 0.00 175.22 172.79 3d1q s HIS 251 N -1.82 -0.52 0.00 0.36 -3.43 -0.93 -1.90 115.29 107.05 3d1q s HIS 251 Ca 0.48 0.67 0.00 0.00 -0.80 0.00 0.00 55.06 55.41 3d1q s HIS 251 Cb -0.11 0.48 0.00 0.00 -1.43 0.00 0.00 32.58 31.52 3d1q s HIS 251 CO 0.20 -0.62 0.00 0.00 -2.00 0.00 0.00 174.74 172.33 3d1q h GLU 253 N 0.00 0.00 0.00 0.00 4.57 -1.92 -2.77 114.58 114.47 3d1q h GLU 253 Ca 0.00 0.00 -0.23 0.00 -1.18 0.00 0.00 59.36 57.95 3d1q h GLU 253 Cb 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 3d1q h GLU 253 CO 0.00 0.35 -1.32 0.00 -1.18 0.00 0.00 179.01 176.86 3d1q h ALA 254 N -0.78 0.59 0.00 2.92 0.00 -1.93 -0.91 119.26 119.15 3d1q h ALA 254 Ca -0.09 -1.11 0.00 0.00 0.00 0.00 0.00 54.91 53.70 3d1q h ALA 254 Cb 0.67 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3d1q h ALA 254 CO -0.06 1.32 0.00 0.41 0.00 0.00 0.00 179.25 180.92 3d1q n GLY 255 N 1.43 0.67 0.33 0.00 0.00 -1.25 -3.90 105.19 102.46 3d1q n GLY 255 Ca -0.08 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.37 3d1q n GLY 255 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3d1q n VAL 256 N -2.54 0.00 0.00 1.61 0.31 -1.26 -4.61 118.33 111.85 3d1q n VAL 256 Ca 0.00 0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 3d1q n VAL 256 Cb 0.00 -0.90 0.00 0.00 -0.91 0.00 0.00 33.84 32.03 3d1q n VAL 256 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3d1q n GLY 257 N 3.19 -2.77 0.20 2.92 0.00 -1.26 -1.33 105.19 106.14 3d1q n GLY 257 Ca 0.00 0.12 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 3d1q n GLY 257 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3d1q h ARG 258 N 0.00 0.61 -0.12 1.61 3.08 -1.94 -2.27 114.38 115.35 3d1q h ARG 258 Ca 0.00 -0.12 0.04 0.00 0.07 0.00 0.00 59.98 59.97 3d1q h ARG 258 Cb 0.00 -0.09 -0.05 0.00 0.08 0.00 0.00 29.97 29.91 3d1q h ARG 258 CO 0.00 0.59 -0.17 1.15 -1.07 0.00 0.00 179.97 180.47 3d1q h THR 259 N 0.51 0.56 -0.32 2.04 2.02 -1.85 -1.87 112.91 113.99 3d1q h THR 259 Ca 0.13 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.25 3d1q h THR 259 Cb 0.22 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 3d1q h THR 259 CO -0.01 0.00 -0.08 0.74 0.37 0.00 0.00 175.52 176.54 3d1q h THR 260 N -0.22 1.22 -0.41 3.16 2.02 -1.16 -1.33 112.91 116.19 3d1q h THR 260 Ca 0.09 -0.96 0.03 0.00 0.77 0.00 0.00 66.41 66.35 3d1q h THR 260 Cb 0.35 1.07 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 3d1q h THR 260 CO -0.25 0.32 0.20 0.00 0.37 0.00 0.00 175.52 176.16 3d1q h ALA 261 N 1.42 0.51 -0.01 6.16 0.00 -0.75 0.77 119.26 127.36 3d1q h ALA 261 Ca 0.10 0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.86 3d1q h ALA 261 Cb 0.45 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3d1q h ALA 261 CO 0.02 -0.16 -0.76 0.74 0.00 0.00 0.00 179.25 179.09 3d1q h PHE 262 N 0.40 0.11 -0.39 0.00 0.04 -1.21 -1.42 116.94 114.47 3d1q h PHE 262 Ca 0.18 -0.06 -0.02 0.00 2.80 0.00 0.00 57.97 60.87 3d1q h PHE 262 Cb 0.09 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.21 3d1q h PHE 262 CO -0.10 0.81 0.16 0.52 -0.60 0.00 0.00 178.31 179.09 3d1q h MET 263 N 0.05 0.59 -0.32 1.51 2.86 -0.82 -1.06 114.93 117.74 3d1q h MET 263 Ca -0.02 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 3d1q h MET 263 Cb 1.34 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.89 3d1q h MET 263 CO 0.11 0.55 0.20 0.28 1.06 0.00 0.00 176.91 179.11 3d1q h VAL 264 N 0.49 1.10 -0.68 -2.22 2.07 -0.72 -0.73 116.25 115.56 3d1q h VAL 264 Ca 0.13 -0.22 0.04 0.00 0.82 0.00 0.00 66.70 67.47 3d1q h VAL 264 Cb 0.18 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 3d1q h VAL 264 CO -0.01 0.10 0.41 0.24 0.02 0.00 0.00 177.57 178.33 3d1q h MET 265 N 0.42 0.76 -0.74 1.57 2.07 -1.12 0.68 114.93 118.57 3d1q h MET 265 Ca 0.12 -0.05 -0.05 0.00 -2.07 0.00 0.00 59.70 57.65 3d1q h MET 265 Cb -0.01 -0.17 -0.03 0.00 -1.87 0.00 0.00 31.60 29.51 3d1q h MET 265 CO -0.02 0.50 0.25 1.15 1.07 0.00 0.00 176.91 179.86 3d1q h THR 266 N 0.78 1.26 -0.46 2.22 2.02 -0.76 -0.48 112.91 117.49 3d1q h THR 266 Ca 0.29 -0.87 -0.06 0.00 0.77 0.00 0.00 66.41 66.54 3d1q h THR 266 Cb 0.09 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 3d1q h THR 266 CO -0.14 0.35 0.06 -0.78 0.37 0.00 0.00 175.52 175.38 3d1q h ASP 267 N 1.09 0.74 -0.51 4.18 1.82 -0.05 0.11 116.42 123.80 3d1q h ASP 267 Ca 0.24 -0.27 -0.04 0.00 -0.39 0.00 0.00 57.03 56.57 3d1q h ASP 267 Cb 0.28 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 40.07 3d1q h ASP 267 CO -0.01 0.82 0.16 0.24 -1.61 0.00 0.00 179.24 178.84 3d1q h MET 268 N 0.63 0.79 -0.32 0.28 2.86 -0.71 0.36 114.93 118.81 3d1q h MET 268 Ca 0.14 -0.17 -0.04 0.00 -2.06 0.00 0.00 59.70 57.57 3d1q h MET 268 Cb 0.40 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 3d1q h MET 268 CO 0.01 0.73 0.05 -0.07 1.06 0.00 0.00 176.91 178.69 3d1q h LEU 269 N 0.69 0.51 0.00 1.22 3.38 -0.81 -2.46 115.31 117.84 3d1q h LEU 269 Ca 0.16 -0.26 -0.21 0.00 0.09 0.00 0.00 57.88 57.67 3d1q h LEU 269 Cb 0.27 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 3d1q h LEU 269 CO -0.01 0.64 -1.04 0.50 0.09 0.00 0.00 178.44 178.62 3d1q h LYS 270 N 0.36 0.00 -2.23 1.13 3.64 -0.70 -3.36 116.57 115.40 3d1q h LYS 270 Ca 0.10 0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 58.91 3d1q h LYS 270 Cb 0.35 0.00 -0.42 0.00 -0.41 0.00 0.00 32.23 31.75 3d1q h LYS 270 CO 0.01 0.84 -0.75 0.09 -2.27 0.00 0.00 179.45 177.37 3d1q n ASN 271 N -3.28 3.76 0.27 4.20 3.02 0.12 -4.91 115.26 118.44 3d1q n ASN 271 Ca -0.02 -3.55 0.15 0.00 -0.03 0.00 0.00 54.58 51.13 3d1q n ASN 271 Cb 0.92 -0.57 0.81 0.00 -0.61 0.00 0.00 39.78 40.33 3d1q n ASN 271 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3d1q h PRO 272 N 3.02 0.00 0.00 3.52 0.13 -1.60 -1.67 132.00 135.39 3d1q h PRO 272 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3d1q h PRO 272 Cb 0.60 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.73 3d1q h PRO 272 CO 0.76 0.00 -0.46 -1.13 -0.23 0.00 0.00 178.00 176.93 3d1q n SER 273 N -2.66 0.50 -4.76 1.44 3.41 -1.26 -4.87 113.62 105.42 3d1q n SER 273 Ca -0.02 -0.03 -0.40 0.00 -0.26 0.00 0.00 58.87 58.15 3d1q n SER 273 Cb 0.20 0.11 -0.04 0.00 -0.26 0.00 0.00 64.21 64.22 3d1q n SER 273 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3d1q s VAL 274 N -3.05 3.46 0.78 -3.33 1.01 -0.63 -5.00 120.40 113.63 3d1q s VAL 274 Ca 0.10 1.43 -0.12 0.00 0.00 0.00 0.00 61.98 63.39 3d1q s VAL 274 Cb 0.16 -3.91 0.07 0.00 0.00 0.00 0.00 36.38 32.70 3d1q s VAL 274 CO 0.68 0.32 1.13 -0.94 0.00 0.00 0.00 175.10 176.30 3d1q s SER 275 N -0.70 4.14 0.19 3.32 1.04 -1.26 -4.82 113.70 115.61 3d1q s SER 275 Ca 0.46 2.05 -0.12 0.00 0.48 0.00 0.00 55.95 58.82 3d1q s SER 275 Cb -0.32 -2.55 0.16 0.00 0.10 0.00 0.00 66.02 63.40 3d1q s SER 275 CO 0.41 -2.28 1.79 0.25 0.98 0.00 0.00 173.24 174.39 3d1q h LEU 276 N -0.96 0.42 -0.89 2.42 5.85 -1.97 -1.81 115.31 118.39 3d1q h LEU 276 Ca -0.45 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.35 3d1q h LEU 276 Cb 1.26 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.17 3d1q h LEU 276 CO 0.49 0.29 0.56 0.50 -0.34 0.00 0.00 178.44 179.94 3d1q h LYS 277 N 0.56 1.02 -0.39 1.25 3.64 -2.00 -1.37 116.57 119.29 3d1q h LYS 277 Ca 0.24 -0.06 -0.14 0.00 -1.27 0.00 0.00 60.65 59.42 3d1q h LYS 277 Cb 0.14 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 3d1q h LYS 277 CO -0.16 0.68 -0.29 -0.44 -2.27 0.00 0.00 179.45 176.97 3d1q h ASP 278 N 1.05 0.92 -0.32 4.20 3.32 -1.80 -0.60 116.42 123.19 3d1q h ASP 278 Ca 0.37 -0.44 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 3d1q h ASP 278 Cb 0.10 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 3d1q h ASP 278 CO -0.15 1.17 0.19 0.40 -1.72 0.00 0.00 179.24 179.13 3d1q h ILE 279 N 0.69 1.12 -0.26 0.35 1.08 -0.87 -0.20 117.51 119.43 3d1q h ILE 279 Ca 0.07 -0.30 -0.03 0.00 -0.39 0.00 0.00 64.86 64.22 3d1q h ILE 279 Cb 0.87 0.73 -0.01 0.00 -3.07 0.00 0.00 36.82 35.34 3d1q h ILE 279 CO 0.08 0.12 0.05 -0.07 -0.69 0.00 0.00 178.15 177.64 3d1q h LEU 280 N 0.41 0.40 -0.31 1.44 3.38 -1.15 -0.54 115.31 118.95 3d1q h LEU 280 Ca 0.11 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 3d1q h LEU 280 Cb 0.03 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3d1q h LEU 280 CO -0.02 0.55 0.11 1.88 0.09 0.00 0.00 178.44 181.06 3d1q h TYR 281 N 0.24 0.48 -0.26 1.13 0.05 -1.07 -2.40 116.97 115.14 3d1q h TYR 281 Ca 0.08 -0.04 -0.15 0.00 0.05 0.00 0.00 58.73 58.67 3d1q h TYR 281 Cb 0.32 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 37.91 3d1q h TYR 281 CO 0.02 0.48 -0.44 0.07 -1.05 0.00 0.00 178.16 177.24 3d1q h ARG 282 N 0.35 0.64 0.00 4.88 0.11 -0.90 0.42 114.38 119.88 3d1q h ARG 282 Ca 0.10 -0.35 -0.07 0.00 0.10 0.00 0.00 59.98 59.76 3d1q h ARG 282 Cb 0.21 0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.29 3d1q h ARG 282 CO -0.01 0.96 -0.35 1.96 0.10 0.00 0.00 179.97 182.63 3d1q h GLN 283 N 0.52 0.00 -0.03 0.08 1.08 -1.08 -1.97 115.11 113.72 3d1q h GLN 283 Ca 0.04 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.20 3d1q h GLN 283 Cb 0.97 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.40 3d1q h GLN 283 CO 0.09 0.35 -0.13 1.25 -0.95 0.00 0.00 178.83 179.44 3d1q h HIS 284 N 0.00 0.19 0.00 2.96 2.76 -0.97 -1.65 115.15 118.43 3d1q h HIS 284 Ca -0.00 -0.08 0.00 0.00 -2.20 0.00 0.00 60.37 58.08 3d1q h HIS 284 Cb 0.71 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.64 3d1q h HIS 284 CO 0.00 0.78 0.00 0.93 -1.30 0.00 0.00 177.93 178.34 3d1q h GLU 285 N -0.46 0.00 -0.24 5.26 5.08 0.09 0.02 114.58 124.33 3d1q h GLU 285 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3d1q h GLU 285 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 3d1q h GLU 285 CO 0.03 0.00 0.00 0.44 -1.00 0.00 0.00 179.01 178.48 3d1q n ILE 286 N -2.37 0.32 0.00 3.13 -5.35 -0.76 -0.61 119.36 113.72 3d1q n ILE 286 Ca 0.01 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.10 3d1q n ILE 286 Cb 0.21 0.30 0.00 0.00 -1.74 0.00 0.00 39.64 38.41 3d1q n ILE 286 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3d1q n GLY 287 N 1.10 1.32 0.91 3.28 0.00 -0.05 -4.74 105.19 107.00 3d1q n GLY 287 Ca 0.14 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.12 3d1q n GLY 287 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d1q n GLY 288 N -0.38 2.07 3.79 -0.02 0.00 -0.62 -5.01 105.19 105.02 3d1q n GLY 288 Ca 0.00 -2.16 -0.33 0.00 0.00 0.00 0.00 46.02 43.53 3d1q n GLY 288 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3d1q s PHE 289 N 0.06 2.87 -0.36 1.61 2.19 -1.26 -4.43 117.98 118.65 3d1q s PHE 289 Ca 0.13 1.52 -0.16 0.00 0.33 0.00 0.00 56.93 58.75 3d1q s PHE 289 Cb -0.01 -3.06 -0.00 0.00 -1.31 0.00 0.00 43.02 38.64 3d1q s PHE 289 CO 0.08 -1.31 0.40 -0.47 1.83 0.00 0.00 175.22 175.75 3d1q s TYR 290 N -2.44 3.20 -0.39 10.12 6.14 -1.26 -3.83 117.35 128.89 3d1q s TYR 290 Ca 0.64 -0.09 0.11 0.00 0.64 0.00 0.00 57.07 58.37 3d1q s TYR 290 Cb -0.17 -2.76 0.66 0.00 0.42 0.00 0.00 41.96 40.11 3d1q s TYR 290 CO 0.39 -0.51 1.53 0.66 0.64 0.00 0.00 175.55 178.27 3d1q n TYR 291 N 5.48 1.77 -3.16 4.97 4.02 -1.26 -4.91 117.16 124.07 3d1q n TYR 291 Ca -0.08 -0.67 -0.19 0.00 -0.01 0.00 0.00 57.90 56.95 3d1q n TYR 291 Cb 0.49 -0.47 0.05 0.00 -0.02 0.00 0.00 39.34 39.39 3d1q n TYR 291 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3d1q n GLY 292 N 0.40 2.07 3.75 2.72 0.00 -1.26 -4.63 105.19 108.25 3d1q n GLY 292 Ca 0.25 -2.23 -0.41 0.00 0.00 0.00 0.00 46.02 43.62 3d1q n GLY 292 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3d1q s GLU 293 N -4.43 4.31 0.11 1.61 2.56 -1.26 -4.92 118.70 116.68 3d1q s GLU 293 Ca 0.53 2.25 -0.25 0.00 0.00 0.00 0.00 54.97 57.50 3d1q s GLU 293 Cb -0.04 -3.10 0.07 0.00 2.00 0.00 0.00 34.13 33.06 3d1q s GLU 293 CO 0.34 -0.31 0.61 -0.59 -0.56 0.00 0.00 175.26 174.75 3d1q s PHE 294 N -0.47 -0.55 -0.46 5.30 -0.12 -1.26 -5.03 117.98 115.39 3d1q s PHE 294 Ca 0.55 0.51 -0.28 0.00 -0.05 0.00 0.00 56.93 57.66 3d1q s PHE 294 Cb -0.40 0.51 -0.01 0.00 -0.63 0.00 0.00 43.02 42.49 3d1q s PHE 294 CO 0.47 -0.78 1.66 -1.25 -0.05 0.00 0.00 175.22 175.27 3d1q s PRO 295 N -3.11 3.20 0.09 1.99 0.04 -1.26 -4.95 135.00 131.01 3d1q s PRO 295 Ca -0.02 0.94 -0.31 0.00 0.04 0.00 0.00 61.00 61.65 3d1q s PRO 295 Cb -0.01 -4.20 -0.06 0.00 0.04 0.00 0.00 34.50 30.27 3d1q s PRO 295 CO -0.07 -2.03 1.22 0.42 0.04 0.00 0.00 177.00 176.58 3d1q s ILE 296 N 6.99 3.84 -0.16 0.56 1.01 -1.26 -4.97 121.20 127.20 3d1q s ILE 296 Ca 0.68 1.36 -0.04 0.00 0.00 0.00 0.00 60.65 62.65 3d1q s ILE 296 Cb -0.16 -3.87 0.07 0.00 0.01 0.00 0.00 42.46 38.51 3d1q s ILE 296 CO 0.29 0.13 0.19 -0.75 0.00 0.00 0.00 174.94 174.79 3d1q s LYS 297 N 0.80 0.12 0.33 2.79 2.20 -1.26 -5.14 119.74 119.59 3d1q s LYS 297 Ca 0.58 0.29 0.09 0.00 -0.36 0.00 0.00 55.97 56.57 3d1q s LYS 297 Cb -0.31 -0.98 -0.05 0.00 -1.51 0.00 0.00 37.83 34.98 3d1q s LYS 297 CO 0.31 -0.54 0.05 0.95 -0.36 0.00 0.00 175.35 175.76 3d1q s THR 298 N 2.29 2.84 0.64 3.43 -4.23 -1.26 -5.11 115.64 114.24 3d1q s THR 298 Ca 0.05 -1.88 -0.16 0.00 -1.18 0.00 0.00 61.69 58.52 3d1q s THR 298 Cb -0.15 -2.85 -0.01 0.00 1.34 0.00 0.00 72.50 70.83 3d1q s THR 298 CO -0.10 -0.22 1.10 -0.54 -0.54 0.00 0.00 174.62 174.33 3d1q s LYS 299 N -3.75 2.93 0.29 3.99 1.02 -1.26 -4.83 119.74 118.13 3d1q s LYS 299 Ca 0.35 1.39 0.04 0.00 0.02 0.00 0.00 55.97 57.77 3d1q s LYS 299 Cb -0.02 -1.97 0.68 0.00 -0.52 0.00 0.00 37.83 36.00 3d1q s LYS 299 CO 0.20 -1.15 1.79 -0.44 -0.92 0.00 0.00 175.35 174.83 3d1q h ASP 300 N 0.21 0.79 0.59 2.83 3.32 -2.00 0.29 116.42 122.45 3d1q h ASP 300 Ca -0.47 0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.67 3d1q h ASP 300 Cb 1.24 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.74 3d1q h ASP 300 CO 0.55 0.32 0.00 0.07 -1.72 0.00 0.00 179.24 178.45 3d1q h LYS 301 N 0.80 0.00 -0.32 3.56 2.10 -2.06 -2.57 116.57 118.07 3d1q h LYS 301 Ca 0.55 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.20 3d1q h LYS 301 Cb 0.79 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.12 3d1q h LYS 301 CO -0.36 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 176.84 3d1q n ASP 302 N -2.36 3.15 0.30 7.07 8.00 0.99 -4.70 116.55 129.00 3d1q n ASP 302 Ca 0.01 -2.26 0.18 0.00 0.71 0.00 0.00 54.79 53.44 3d1q n ASP 302 Cb 0.19 -0.31 1.00 0.00 -0.02 0.00 0.00 41.12 41.99 3d1q n ASP 302 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3d1q h SER 303 N 1.93 0.00 0.23 -2.24 4.64 -1.01 -0.93 113.55 116.17 3d1q h SER 303 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d1q h SER 303 Cb 0.91 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3d1q h SER 303 CO 0.06 0.00 -0.00 4.11 -0.87 0.00 0.00 176.83 180.12 3d1q h TRP 304 N 0.00 0.00 0.00 4.77 5.08 -1.84 -2.50 115.95 121.45 3d1q h TRP 304 Ca 0.02 0.00 -0.10 0.00 1.08 0.00 0.00 58.89 59.89 3d1q h TRP 304 Cb 0.16 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.30 3d1q h TRP 304 CO 0.00 0.00 -0.48 0.87 -1.28 0.00 0.00 178.44 177.56 3d1q h LYS 305 N 0.00 0.00 -0.33 0.12 1.57 -1.55 -3.37 116.57 113.01 3d1q h LYS 305 Ca -0.00 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.84 3d1q h LYS 305 Cb 0.12 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.34 3d1q h LYS 305 CO 0.00 0.48 -0.42 1.15 -0.57 0.00 0.00 179.45 180.09 3d1q h THR 306 N 0.00 0.13 0.00 -0.16 2.02 -1.61 0.23 112.91 113.52 3d1q h THR 306 Ca -0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.14 3d1q h THR 306 Cb 1.10 0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 3d1q h THR 306 CO 0.06 0.00 -0.15 0.07 0.37 0.00 0.00 175.52 175.87 3d1q h LYS 307 N -0.37 0.00 -0.02 6.66 2.10 -1.79 -2.16 116.57 120.99 3d1q h LYS 307 Ca 0.12 0.00 -0.18 0.00 -2.00 0.00 0.00 60.65 58.59 3d1q h LYS 307 Cb 0.59 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.91 3d1q h LYS 307 CO -0.52 0.15 -0.80 1.88 -2.00 0.00 0.00 179.45 178.16 3d1q h TYR 308 N 0.00 0.30 -0.23 0.07 -1.99 -1.22 -0.98 116.97 112.92 3d1q h TYR 308 Ca -0.00 -0.15 -0.03 0.00 2.00 0.00 0.00 58.73 60.55 3d1q h TYR 308 Cb 0.42 -0.04 -0.01 0.00 2.00 0.00 0.00 36.73 39.10 3d1q h TYR 308 CO 0.00 0.92 0.02 1.88 -0.00 0.00 0.00 178.16 180.98 3d1q h TYR 309 N 0.13 0.42 -0.53 4.88 0.99 -0.67 -1.37 116.97 120.81 3d1q h TYR 309 Ca -0.03 -0.07 0.01 0.00 2.00 0.00 0.00 58.73 60.64 3d1q h TYR 309 Cb 1.39 -0.11 -0.03 0.00 1.00 0.00 0.00 36.73 38.98 3d1q h TYR 309 CO 0.03 0.55 0.34 0.00 -0.00 0.00 0.00 178.16 179.08 3d1q h ARG 310 N 0.17 0.68 -0.44 4.88 3.08 -1.36 -1.97 114.38 119.42 3d1q h ARG 310 Ca 0.07 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.12 3d1q h ARG 310 Cb 0.37 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.22 3d1q h ARG 310 CO 0.01 0.45 0.19 1.49 -1.07 0.00 0.00 179.97 181.04 3d1q h GLU 311 N 0.70 0.38 -0.77 0.04 4.81 -1.08 -2.01 114.58 116.65 3d1q h GLU 311 Ca 0.20 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.43 3d1q h GLU 311 Cb -0.05 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.20 3d1q h GLU 311 CO -0.06 0.25 0.50 0.87 -0.73 0.00 0.00 179.01 179.85 3d1q h LYS 312 N 0.39 0.98 -0.80 1.92 1.57 -0.83 -0.55 116.57 119.25 3d1q h LYS 312 Ca 0.20 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.94 3d1q h LYS 312 Cb 0.15 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 3d1q h LYS 312 CO -0.17 0.65 0.52 0.82 -0.57 0.00 0.00 179.45 180.70 3d1q h ILE 313 N 1.01 1.17 -0.23 1.86 2.04 -0.79 -0.16 117.51 122.41 3d1q h ILE 313 Ca 0.30 -0.36 -0.16 0.00 1.00 0.00 0.00 64.86 65.64 3d1q h ILE 313 Cb -0.06 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.05 3d1q h ILE 313 CO -0.08 0.19 -0.49 0.58 0.00 0.00 0.00 178.15 178.34 3d1q h VAL 314 N 1.04 1.31 -0.13 1.67 2.07 -0.96 -3.14 116.25 118.11 3d1q h VAL 314 Ca 0.30 -1.71 -0.17 0.00 0.82 0.00 0.00 66.70 65.94 3d1q h VAL 314 Cb -0.06 1.66 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 3d1q h VAL 314 CO -0.09 0.54 -0.64 0.24 0.02 0.00 0.00 177.57 177.64 3d1q h MET 315 N 0.49 0.49 -0.57 1.57 2.86 -0.65 -2.10 114.93 117.02 3d1q h MET 315 Ca 0.02 -0.35 0.08 0.00 -2.06 0.00 0.00 59.70 57.39 3d1q h MET 315 Cb 1.04 0.06 -0.07 0.00 0.06 0.00 0.00 31.60 32.69 3d1q h MET 315 CO 0.10 0.97 0.21 0.82 1.06 0.00 0.00 176.91 180.07 3d1q h ILE 316 N 0.36 0.80 -0.54 -1.22 1.08 -1.07 0.21 117.51 117.13 3d1q h ILE 316 Ca -0.01 -0.14 -0.06 0.00 -0.39 0.00 0.00 64.86 64.27 3d1q h ILE 316 Cb 1.20 0.37 -0.02 0.00 -3.07 0.00 0.00 36.82 35.30 3d1q h ILE 316 CO 0.12 0.07 0.12 -0.33 -0.69 0.00 0.00 178.15 177.44 3d1q h GLU 317 N 0.39 0.87 -0.61 2.37 5.08 -1.46 -2.01 114.58 119.21 3d1q h GLU 317 Ca 0.28 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.37 3d1q h GLU 317 Cb 0.32 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 3d1q h GLU 317 CO -0.28 0.83 0.17 0.37 -1.00 0.00 0.00 179.01 179.09 3d1q h GLN 318 N 0.76 0.94 -0.31 2.33 5.75 -0.63 -0.80 115.11 123.15 3d1q h GLN 318 Ca 0.17 -0.19 -0.12 0.00 -0.15 0.00 0.00 58.65 58.35 3d1q h GLN 318 Cb 0.36 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 3d1q h GLN 318 CO 0.00 0.83 -0.31 0.35 -2.65 0.00 0.00 178.83 177.05 3d1q h PHE 319 N 0.90 0.76 -0.48 3.99 3.57 -0.41 -1.12 116.94 124.16 3d1q h PHE 319 Ca 0.20 -0.19 0.00 0.00 3.53 0.00 0.00 57.97 61.51 3d1q h PHE 319 Cb 0.30 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 3d1q h PHE 319 CO 0.02 0.89 0.32 -0.92 -2.23 0.00 0.00 178.31 176.39 3d1q h TYR 320 N 0.56 0.61 -0.78 0.41 5.03 -0.78 -1.53 116.97 120.49 3d1q h TYR 320 Ca 0.07 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.39 3d1q h TYR 320 Cb 0.81 -0.21 -0.04 0.00 1.55 0.00 0.00 36.73 38.84 3d1q h TYR 320 CO 0.04 0.39 0.50 0.00 -1.32 0.00 0.00 178.16 177.77 3d1q h ARG 321 N 0.65 1.03 -0.10 1.82 3.08 -0.83 -0.91 114.38 119.13 3d1q h ARG 321 Ca 0.18 -0.07 0.04 0.00 0.07 0.00 0.00 59.98 60.19 3d1q h ARG 321 Cb -0.07 -0.23 -0.04 0.00 0.08 0.00 0.00 29.97 29.71 3d1q h ARG 321 CO -0.04 0.69 -0.13 -0.92 -1.07 0.00 0.00 179.97 178.50 3d1q h TYR 322 N 1.05 -0.34 -0.73 3.04 3.20 -0.66 0.21 116.97 122.74 3d1q h TYR 322 Ca 0.28 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.20 3d1q h TYR 322 Cb -0.10 0.17 -0.05 0.00 1.54 0.00 0.00 36.73 38.29 3d1q h TYR 322 CO -0.02 -0.20 0.46 0.28 -1.64 0.00 0.00 178.16 177.04 3d1q h VAL 323 N -0.18 1.10 -0.27 1.81 2.07 -1.04 -0.01 116.25 119.73 3d1q h VAL 323 Ca 0.08 -0.31 -0.13 0.00 0.82 0.00 0.00 66.70 67.16 3d1q h VAL 323 Cb 0.29 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 3d1q h VAL 323 CO -0.20 0.16 -0.37 1.56 0.02 0.00 0.00 177.57 178.74 3d1q h GLN 324 N 0.89 0.62 0.00 1.57 1.08 -0.48 -1.79 115.11 117.00 3d1q h GLN 324 Ca 0.29 -0.30 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 3d1q h GLN 324 Cb 0.02 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 3d1q h GLN 324 CO -0.11 0.89 -0.30 0.93 -0.95 0.00 0.00 178.83 179.29 3d1q h GLU 325 N 0.51 0.00 0.00 1.46 5.08 -0.24 -3.38 114.58 118.02 3d1q h GLU 325 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3d1q h GLU 325 Cb 0.87 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.12 3d1q h GLU 325 CO 0.08 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.18 3d1q n ASN 326 N -2.75 0.98 -0.07 1.42 3.02 -0.05 -4.68 115.26 113.13 3d1q n ASN 326 Ca 0.03 -1.00 -0.13 0.00 -0.03 0.00 0.00 54.58 53.45 3d1q n ASN 326 Cb 0.51 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.67 3d1q n ASN 326 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 3d1q h ARG 327 N 0.00 0.83 -0.71 3.52 0.11 -1.50 -1.27 114.38 115.35 3d1q h ARG 327 Ca 0.00 -0.50 0.10 0.00 0.10 0.00 0.00 59.98 59.68 3d1q h ARG 327 Cb 0.01 0.05 -0.05 0.00 1.11 0.00 0.00 29.97 31.09 3d1q h ARG 327 CO 0.00 1.14 0.47 0.00 0.10 0.00 0.00 179.97 181.68 3d1q h ALA 328 N 0.77 1.89 -0.54 0.08 0.00 -1.84 0.65 119.26 120.28 3d1q h ALA 328 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3d1q h ALA 328 Cb 1.11 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3d1q h ALA 328 CO 0.11 -0.05 0.00 -0.40 0.00 0.00 0.00 179.25 178.91 3d1q n ASP 329 N -4.49 2.93 0.00 0.00 3.85 -1.23 -4.92 116.55 112.69 3d1q n ASP 329 Ca 0.12 -1.99 0.00 0.00 -0.71 0.00 0.00 54.79 52.21 3d1q n ASP 329 Cb 0.36 -0.36 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 3d1q n ASP 329 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3d1q n GLY 330 N 1.37 0.38 3.42 6.12 0.00 0.22 -4.09 105.19 112.61 3d1q n GLY 330 Ca 0.18 -1.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.03 3d1q n GLY 330 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3d1q n TYR 331 N -3.46 -2.22 0.26 1.61 4.01 -0.48 -4.89 117.16 111.99 3d1q n TYR 331 Ca 0.00 0.91 0.09 0.00 -0.16 0.00 0.00 57.90 58.75 3d1q n TYR 331 Cb 0.23 -4.86 0.67 0.00 -0.31 0.00 0.00 39.34 35.07 3d1q n TYR 331 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 3d1q h GLN 332 N -1.76 0.00 -5.50 -0.72 1.08 -1.82 -3.40 115.11 102.99 3d1q h GLN 332 Ca -0.60 0.00 -0.67 0.00 -1.45 0.00 0.00 58.65 55.93 3d1q h GLN 332 Cb 1.34 0.00 -0.29 0.00 -0.05 0.00 0.00 27.48 28.47 3d1q h GLN 332 CO 0.49 0.09 -0.82 0.99 -0.95 0.00 0.00 178.83 178.63 3d1q s THR 333 N -4.67 2.57 0.72 -0.54 2.01 -1.26 -5.13 115.64 109.35 3d1q s THR 333 Ca -0.04 -0.85 -0.11 0.00 0.31 0.00 0.00 61.69 61.00 3d1q s THR 333 Cb 0.15 -2.03 0.02 0.00 0.01 0.00 0.00 72.50 70.66 3d1q s THR 333 CO 0.64 0.55 1.07 -2.16 -0.69 0.00 0.00 174.62 174.03 3d1q s PRO 334 N 0.19 2.76 0.20 4.92 0.04 -1.26 -4.84 135.00 137.00 3d1q s PRO 334 Ca -0.11 0.84 -0.13 0.00 0.04 0.00 0.00 61.00 61.64 3d1q s PRO 334 Cb -0.16 -1.98 0.24 0.00 0.04 0.00 0.00 34.50 32.64 3d1q s PRO 334 CO 0.06 -1.19 1.66 2.35 0.04 0.00 0.00 177.00 179.91 3d1q h TRP 335 N -0.78 -0.14 -0.60 0.56 2.91 -1.94 -1.23 115.95 114.72 3d1q h TRP 335 Ca -0.45 0.05 0.03 0.00 1.13 0.00 0.00 58.89 59.65 3d1q h TRP 335 Cb 1.23 0.15 -0.04 0.00 -0.51 0.00 0.00 29.16 29.99 3d1q h TRP 335 CO 0.58 -0.19 0.36 0.66 -1.03 0.00 0.00 178.44 178.82 3d1q h SER 336 N 0.07 0.59 -0.11 2.65 4.64 -1.94 0.26 113.55 119.71 3d1q h SER 336 Ca 0.29 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.59 3d1q h SER 336 Cb 0.45 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3d1q h SER 336 CO -0.53 0.41 -0.01 0.58 -0.87 0.00 0.00 176.83 176.42 3d1q h VAL 337 N 0.71 1.26 -0.60 0.95 2.07 -1.87 -1.76 116.25 117.01 3d1q h VAL 337 Ca 0.24 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.92 3d1q h VAL 337 Cb 0.03 1.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 3d1q h VAL 337 CO -0.11 0.24 0.37 -0.25 0.02 0.00 0.00 177.57 177.85 3d1q h TRP 338 N -0.09 0.79 -0.79 1.57 7.01 -0.93 -2.03 115.95 121.48 3d1q h TRP 338 Ca 0.03 0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.08 3d1q h TRP 338 Cb 0.38 -0.26 -0.05 0.00 -2.10 0.00 0.00 29.16 27.12 3d1q h TRP 338 CO 0.04 0.53 0.49 1.25 -2.79 0.00 0.00 178.44 177.96 3d1q h LEU 339 N 0.82 0.79 -1.21 0.65 5.85 -0.40 0.61 115.31 122.41 3d1q h LEU 339 Ca 0.22 0.01 0.07 0.00 0.84 0.00 0.00 57.88 59.01 3d1q h LEU 339 Cb -0.04 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 40.78 3d1q h LEU 339 CO -0.04 0.53 0.56 0.11 -0.34 0.00 0.00 178.44 179.25 3d1q h LYS 340 N 0.93 0.91 0.00 1.25 1.79 -0.92 -1.56 116.57 118.97 3d1q h LYS 340 Ca 0.33 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.75 3d1q h LYS 340 Cb 0.09 -0.21 0.00 0.00 -1.58 0.00 0.00 32.23 30.54 3d1q h LYS 340 CO -0.14 0.60 -0.20 0.66 -1.08 0.00 0.00 179.45 179.29 3d1q h SER 341 N 0.94 0.00 -2.14 0.86 4.64 -0.38 -3.38 113.55 114.10 3d1q h SER 341 Ca 0.37 -0.02 -0.55 0.00 -0.47 0.00 0.00 61.79 61.12 3d1q h SER 341 Cb 0.23 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 61.91 3d1q h SER 341 CO -0.14 0.01 -0.90 1.41 -0.87 0.00 0.00 176.83 176.35 3d1q n HIS 342 N -2.71 2.10 -1.74 4.77 8.25 0.04 -5.10 115.22 120.82 3d1q n HIS 342 Ca 0.04 -3.90 -0.41 0.00 -0.26 0.00 0.00 57.72 53.18 3d1q n HIS 342 Cb 0.50 -0.46 0.01 0.00 1.12 0.00 0.00 29.99 31.16 3d1q n HIS 342 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3d1q n PRO 343 N 0.23 2.26 -1.74 -0.41 -0.02 -0.66 -4.71 135.00 129.93 3d1q n PRO 343 Ca 0.28 0.80 -0.31 0.00 -2.02 0.00 0.00 63.50 62.24 3d1q n PRO 343 Cb 0.51 -2.52 0.03 0.00 -0.02 0.00 0.00 33.50 31.50 3d1q n PRO 343 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d1q s ALA 344 N -1.16 2.77 0.03 3.55 0.00 -1.26 -5.07 121.76 120.63 3d1q s ALA 344 Ca 0.58 0.12 0.05 0.00 0.00 0.00 0.00 51.96 52.71 3d1q s ALA 344 Cb -0.49 -3.17 -0.02 0.00 0.00 0.00 0.00 23.12 19.44 3d1q s ALA 344 CO 0.60 -1.02 -0.14 -1.59 0.00 0.00 0.00 175.76 173.61 3d1q s LYS 345 N -4.84 0.96 0.00 0.00 -2.85 -1.26 -4.51 119.74 107.24 3d1q s LYS 345 Ca 0.59 -0.74 0.00 0.00 -1.00 0.00 0.00 55.97 54.81 3d1q s LYS 345 Cb -0.14 -0.97 0.00 0.00 -2.06 0.00 0.00 37.83 34.66 3d1q s LYS 345 CO 0.50 0.24 0.37 0.00 0.10 0.00 0.00 175.35 176.57