#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3faq n TRP 2 N 0.00 -4.60 -1.46 7.33 -0.00 -1.26 -4.94 117.44 112.51 3faq n TRP 2 Ca 0.00 0.03 -0.36 0.00 -0.00 0.00 0.00 57.50 57.16 3faq n TRP 2 Cb 0.00 -1.49 0.08 0.00 -0.00 0.00 0.00 31.31 29.89 3faq n TRP 2 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 177.69 175.78 3faq n GLU 3 N 1.90 0.65 -0.46 5.87 2.13 -1.26 -4.97 120.64 124.50 3faq n GLU 3 Ca -0.00 0.28 0.07 0.00 0.66 0.00 0.00 57.16 58.16 3faq n GLU 3 Cb 0.55 -2.25 0.17 0.00 0.27 0.00 0.00 31.44 30.18 3faq n GLU 3 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 3faq n VAL 4 N -2.28 1.88 -2.76 6.31 0.24 -1.26 -4.91 118.33 115.55 3faq n VAL 4 Ca 0.14 -2.65 -0.01 0.00 -2.04 0.00 0.00 64.34 59.77 3faq n VAL 4 Cb 0.49 -0.14 0.02 0.00 -1.47 0.00 0.00 33.84 32.74 3faq n VAL 4 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3faq s GLY 5 N -2.96 -1.66 0.44 7.63 0.00 -1.26 -5.17 107.32 104.34 3faq s GLY 5 Ca 0.34 0.70 0.07 0.00 0.00 0.00 0.00 44.72 45.83 3faq s GLY 5 CO -0.04 4.19 0.27 0.00 0.00 0.00 0.00 173.10 177.52 3faq n GLY 7 N -1.41 2.62 2.40 0.00 0.00 -1.26 -4.93 105.19 102.60 3faq n GLY 7 Ca -0.00 -1.58 -0.15 0.00 0.00 0.00 0.00 46.02 44.29 3faq n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3faq n ALA 8 N -1.64 4.05 -1.00 4.61 0.00 -1.20 -4.85 120.51 120.47 3faq n ALA 8 Ca 0.00 -3.42 0.00 0.00 0.00 0.00 0.00 53.44 50.02 3faq n ALA 8 Cb 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 18.87 3faq n ALA 8 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3faq n PRO 9 N -0.61 -1.16 -3.08 0.00 -0.02 -1.26 -4.97 135.00 123.90 3faq n PRO 9 Ca 0.28 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.34 3faq n PRO 9 Cb 0.87 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 34.29 3faq n PRO 9 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3faq s VAL 10 N -0.74 4.86 0.00 -1.45 1.01 -1.26 -5.06 120.40 117.76 3faq s VAL 10 Ca 0.00 0.69 0.00 0.00 0.00 0.00 0.00 61.98 62.67 3faq s VAL 10 Cb 0.00 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.29 3faq s VAL 10 CO 0.00 -0.31 0.00 -2.65 0.00 0.00 0.00 175.10 172.14 3faq n PRO 11 N 6.10 0.00 -0.10 2.72 -0.02 -1.26 -4.65 135.00 137.79 3faq n PRO 11 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 3faq n PRO 11 Cb 0.49 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.97 3faq n PRO 11 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3faq n LEU 12 N 0.00 -0.19 0.09 2.45 4.77 -1.26 -4.87 117.00 117.99 3faq n LEU 12 Ca 0.00 -0.13 -0.05 0.00 -0.03 0.00 0.00 56.01 55.80 3faq n LEU 12 Cb 0.00 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.01 3faq n LEU 12 CO 0.00 -0.15 0.13 0.58 -1.33 0.00 0.00 177.39 176.62 3faq h VAL 13 N 0.67 0.00 -4.49 4.08 2.07 -2.05 -3.50 116.25 113.03 3faq h VAL 13 Ca 0.00 -0.67 -0.09 0.00 0.82 0.00 0.00 66.70 66.76 3faq h VAL 13 Cb 0.10 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.87 3faq h VAL 13 CO 0.10 0.00 -0.67 0.29 0.02 0.00 0.00 177.57 177.31 3faq n LYS 14 N -4.69 -0.53 -2.48 1.57 4.76 -1.26 -4.95 118.16 110.58 3faq n LYS 14 Ca -0.04 0.61 -0.40 0.00 -2.87 0.00 0.00 58.31 55.62 3faq n LYS 14 Cb 0.12 -0.82 -0.04 0.00 -1.84 0.00 0.00 35.03 32.44 3faq n LYS 14 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3faq h ASP 16 N 3.66 0.00 -4.53 0.00 1.82 -1.95 -3.48 116.42 111.94 3faq h ASP 16 Ca -0.47 0.00 -0.11 0.00 -0.39 0.00 0.00 57.03 56.07 3faq h ASP 16 Cb 1.21 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.22 3faq h ASP 16 CO 0.66 0.48 -0.14 -0.62 -1.61 0.00 0.00 179.24 178.02 3faq n GLU 17 N -3.05 -2.68 0.00 0.28 1.02 -1.26 -4.26 120.64 110.69 3faq n GLU 17 Ca -0.03 0.25 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 3faq n GLU 17 Cb 0.76 -4.79 0.00 0.00 -0.02 0.00 0.00 31.44 27.39 3faq n GLU 17 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3faq n ASN 18 N -1.63 0.00 -4.76 1.62 4.13 -1.26 -5.10 115.26 108.25 3faq n ASN 18 Ca -0.06 0.00 -0.41 0.00 1.68 0.00 0.00 54.58 55.79 3faq n ASN 18 Cb 0.55 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.77 3faq n ASN 18 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 3faq s SER 19 N 0.00 6.61 0.00 6.41 0.15 -1.26 -4.86 113.70 120.75 3faq s SER 19 Ca 0.00 2.79 0.13 0.00 0.70 0.00 0.00 55.95 59.57 3faq s SER 19 Cb 0.00 -2.64 0.44 0.00 -1.71 0.00 0.00 66.02 62.11 3faq s SER 19 CO 0.00 -0.69 1.34 -0.81 1.20 0.00 0.00 173.24 174.28 3faq n PRO 20 N 1.28 1.73 -4.83 5.44 -0.04 -1.26 -4.88 135.00 132.44 3faq n PRO 20 Ca 0.03 -1.12 -0.28 0.00 -0.04 0.00 0.00 63.50 62.09 3faq n PRO 20 Cb 0.40 -1.29 -0.15 0.00 -0.04 0.00 0.00 33.50 32.42 3faq n PRO 20 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3faq s TYR 21 N -1.64 2.12 0.74 0.54 2.02 -1.26 -5.11 117.35 114.76 3faq s TYR 21 Ca 0.25 -0.40 -0.13 0.00 -0.37 0.00 0.00 57.07 56.42 3faq s TYR 21 Cb 0.13 -1.27 0.04 0.00 -0.40 0.00 0.00 41.96 40.46 3faq s TYR 21 CO 0.18 0.10 1.13 1.03 -1.57 0.00 0.00 175.55 176.42 3faq s ARG 22 N -1.16 2.28 0.80 -0.62 0.52 -1.26 -5.04 118.95 114.46 3faq s ARG 22 Ca 0.10 1.42 -0.06 0.00 -0.52 0.00 0.00 55.73 56.67 3faq s ARG 22 Cb -0.09 -1.88 0.15 0.00 0.52 0.00 0.00 34.95 33.64 3faq s ARG 22 CO 0.02 -1.66 1.10 0.95 0.02 0.00 0.00 175.30 175.73 3faq s THR 23 N -2.47 2.10 -0.04 0.02 -4.23 -1.26 -5.02 115.64 104.75 3faq s THR 23 Ca 0.67 -0.39 -0.14 0.00 -1.18 0.00 0.00 61.69 60.65 3faq s THR 23 Cb -0.22 -2.72 -0.31 0.00 1.34 0.00 0.00 72.50 70.59 3faq s THR 23 CO 0.48 0.00 0.75 0.40 -0.54 0.00 0.00 174.62 175.71 3faq h ILE 24 N -0.88 1.09 0.00 2.99 1.08 -1.90 -3.34 117.51 116.55 3faq h ILE 24 Ca -0.39 -2.54 0.00 0.00 -0.39 0.00 0.00 64.86 61.54 3faq h ILE 24 Cb 1.26 2.87 0.00 0.00 -3.07 0.00 0.00 36.82 37.88 3faq h ILE 24 CO 0.41 0.81 0.00 0.35 -0.69 0.00 0.00 178.15 179.02 3faq n THR 25 N -3.74 0.75 -0.22 -0.27 -2.24 -1.23 -4.56 114.28 102.78 3faq n THR 25 Ca -0.22 0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 3faq n THR 25 Cb 1.03 -0.89 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 3faq n THR 25 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3faq n GLY 26 N 0.26 1.35 3.76 3.38 0.00 -1.25 -0.14 105.19 112.54 3faq n GLY 26 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 3faq n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3faq s ASP 27 N -3.08 5.02 0.00 1.61 1.01 -1.26 -3.75 116.67 116.22 3faq s ASP 27 Ca 0.00 2.13 0.00 0.00 0.71 0.00 0.00 52.55 55.39 3faq s ASP 27 Cb 0.00 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.36 3faq s ASP 27 CO 0.00 -1.69 0.00 0.00 0.21 0.00 0.00 175.17 173.69 3faq h ASN 29 N 0.00 -0.39 -2.97 0.00 -0.73 -1.75 -3.39 115.58 106.35 3faq h ASN 29 Ca 0.00 0.01 -0.57 0.00 1.87 0.00 0.00 56.30 57.62 3faq h ASN 29 Cb 0.15 0.10 -0.04 0.00 0.27 0.00 0.00 38.32 38.80 3faq h ASN 29 CO 0.00 -0.28 0.93 0.21 -0.37 0.00 0.00 177.43 177.92 3faq s ASN 30 N -2.68 6.85 0.54 1.15 3.84 -1.26 -4.74 114.94 118.64 3faq s ASN 30 Ca -0.07 1.56 0.32 0.00 0.21 0.00 0.00 52.86 54.88 3faq s ASN 30 Cb 0.01 -2.54 1.49 0.00 -0.55 0.00 0.00 41.25 39.66 3faq s ASN 30 CO 0.20 -0.87 2.05 0.03 -2.79 0.00 0.00 177.10 175.73 3faq h ARG 31 N 8.59 0.00 0.00 0.43 3.08 -1.96 -2.61 114.38 121.92 3faq h ARG 31 Ca -0.27 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.67 3faq h ARG 31 Cb 1.10 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.13 3faq h ARG 31 CO 0.99 0.08 -1.98 -2.13 -1.07 0.00 0.00 179.97 175.86 3faq n ARG 32 N -3.33 0.66 -3.17 0.04 0.63 -1.26 -4.62 116.66 105.62 3faq n ARG 32 Ca -0.01 -0.08 -0.19 0.00 -0.92 0.00 0.00 57.85 56.65 3faq n ARG 32 Cb 0.27 -1.57 -0.06 0.00 0.45 0.00 0.00 32.46 31.54 3faq n ARG 32 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3faq n SER 33 N -2.48 -1.53 0.30 6.15 2.88 -1.23 -5.05 113.62 112.66 3faq n SER 33 Ca -0.12 -2.57 0.15 0.00 -1.33 0.00 0.00 58.87 55.00 3faq n SER 33 Cb 0.75 0.26 0.76 0.00 -0.75 0.00 0.00 64.21 65.24 3faq n SER 33 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3faq h PRO 34 N 5.38 0.00 0.00 -1.46 0.13 -1.72 -2.58 132.00 131.74 3faq h PRO 34 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 3faq h PRO 34 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 3faq h PRO 34 CO 0.25 0.00 -0.75 0.00 -0.23 0.00 0.00 178.00 177.27 3faq n ALA 35 N -1.93 3.94 -1.72 -0.56 0.00 -1.26 -0.52 120.51 118.46 3faq n ALA 35 Ca -0.01 -0.44 -0.42 0.00 0.00 0.00 0.00 53.44 52.57 3faq n ALA 35 Cb 0.45 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.89 3faq n ALA 35 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3faq s LEU 36 N -3.14 4.04 0.00 0.00 2.96 -0.97 -1.52 118.68 120.05 3faq s LEU 36 Ca 0.09 2.28 0.00 0.00 -0.22 0.00 0.00 54.13 56.27 3faq s LEU 36 Cb 0.17 -3.52 0.00 0.00 0.50 0.00 0.00 46.19 43.33 3faq s LEU 36 CO 0.77 -1.37 0.00 0.61 -1.32 0.00 0.00 176.35 175.04 3faq n GLY 37 N 4.93 2.45 3.67 7.98 0.00 -1.26 -4.57 105.19 118.38 3faq n GLY 37 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 3faq n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3faq s ALA 38 N -2.62 1.31 0.58 4.61 0.00 -0.58 -1.51 121.76 123.54 3faq s ALA 38 Ca 0.00 0.36 -0.16 0.00 0.00 0.00 0.00 51.96 52.16 3faq s ALA 38 Cb 0.00 -3.36 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 3faq s ALA 38 CO 0.00 -2.72 1.04 0.00 0.00 0.00 0.00 175.76 174.08 3faq s ALA 39 N -2.69 2.82 -0.86 0.00 0.00 0.80 -4.12 121.76 117.71 3faq s ALA 39 Ca 0.66 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.95 3faq s ALA 39 Cb -0.22 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.70 3faq s ALA 39 CO 0.59 -0.67 0.00 0.09 0.00 0.00 0.00 175.76 175.76 3faq n ASN 40 N -1.93 -3.62 -4.85 0.00 3.02 0.63 -4.68 115.26 103.82 3faq n ASN 40 Ca 0.08 0.12 -0.26 0.00 -0.03 0.00 0.00 54.58 54.49 3faq n ASN 40 Cb 0.53 -2.36 -0.03 0.00 -0.61 0.00 0.00 39.78 37.31 3faq n ASN 40 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3faq s ARG 41 N -3.52 2.28 0.46 3.52 1.81 -1.22 -4.41 118.95 117.87 3faq s ARG 41 Ca 0.00 -1.95 -0.22 0.00 -1.72 0.00 0.00 55.73 51.83 3faq s ARG 41 Cb 0.00 -2.06 -0.07 0.00 -0.45 0.00 0.00 34.95 32.36 3faq s ARG 41 CO 0.00 -0.44 1.13 0.00 -0.68 0.00 0.00 175.30 175.31 3faq s ALA 42 N -2.71 2.94 0.89 2.13 0.00 -1.26 -1.35 121.76 122.40 3faq s ALA 42 Ca 0.35 0.85 -0.11 0.00 0.00 0.00 0.00 51.96 53.04 3faq s ALA 42 Cb -0.01 -3.35 0.12 0.00 0.00 0.00 0.00 23.12 19.89 3faq s ALA 42 CO 0.21 -0.57 1.09 -0.51 0.00 0.00 0.00 175.76 175.98 3faq s LEU 43 N -3.12 2.32 0.61 0.00 1.43 -0.22 -4.75 118.68 114.95 3faq s LEU 43 Ca 0.64 1.50 -0.09 0.00 -1.03 0.00 0.00 54.13 55.16 3faq s LEU 43 Cb -0.26 -3.95 -0.01 0.00 0.03 0.00 0.00 46.19 42.00 3faq s LEU 43 CO 0.31 -2.58 0.98 0.00 0.23 0.00 0.00 176.35 175.28 3faq s ALA 44 N -2.94 3.14 -0.32 4.21 0.00 -0.36 -4.79 121.76 120.71 3faq s ALA 44 Ca 0.63 -0.38 0.02 0.00 0.00 0.00 0.00 51.96 52.23 3faq s ALA 44 Cb -0.18 -2.86 0.09 0.00 0.00 0.00 0.00 23.12 20.17 3faq s ALA 44 CO 0.57 -0.79 0.05 1.03 0.00 0.00 0.00 175.76 176.62 3faq s ARG 45 N -5.11 1.29 0.47 0.00 1.81 -1.26 -0.33 118.95 115.82 3faq s ARG 45 Ca 0.54 -1.51 0.26 0.00 -1.72 0.00 0.00 55.73 53.30 3faq s ARG 45 Cb -0.11 -2.75 1.03 0.00 -0.45 0.00 0.00 34.95 32.66 3faq s ARG 45 CO 0.50 -0.90 1.87 -1.49 -0.68 0.00 0.00 175.30 174.59 3faq h TRP 46 N 7.80 0.00 -4.02 -0.53 6.55 -1.97 -3.44 115.95 120.34 3faq h TRP 46 Ca -0.09 0.00 -0.12 0.00 0.95 0.00 0.00 58.89 59.63 3faq h TRP 46 Cb 1.03 0.00 -0.16 0.00 -0.86 0.00 0.00 29.16 29.16 3faq h TRP 46 CO 0.44 0.18 -0.59 -0.51 -1.05 0.00 0.00 178.44 176.91 3faq s LEU 47 N -6.70 2.09 0.40 -4.49 1.43 -1.26 -5.14 118.68 105.01 3faq s LEU 47 Ca 0.00 -0.77 -0.27 0.00 -1.03 0.00 0.00 54.13 52.07 3faq s LEU 47 Cb 0.10 0.45 -0.10 0.00 0.03 0.00 0.00 46.19 46.67 3faq s LEU 47 CO 0.62 -0.57 1.46 -2.84 0.23 0.00 0.00 176.35 175.25 3faq s PRO 48 N -3.32 3.97 0.59 1.29 0.02 -1.26 -4.95 135.00 131.33 3faq s PRO 48 Ca 0.01 2.51 -0.19 0.00 0.02 0.00 0.00 61.00 63.35 3faq s PRO 48 Cb 0.03 -2.86 -0.03 0.00 0.02 0.00 0.00 34.50 31.65 3faq s PRO 48 CO -0.08 -0.62 1.25 0.00 -0.33 0.00 0.00 177.00 177.22 3faq s ALA 49 N -1.15 2.57 -0.30 -1.55 0.00 -1.26 -4.78 121.76 115.29 3faq s ALA 49 Ca 0.55 1.11 0.02 0.00 0.00 0.00 0.00 51.96 53.65 3faq s ALA 49 Cb -0.45 -3.49 0.08 0.00 0.00 0.00 0.00 23.12 19.26 3faq s ALA 49 CO 0.61 -1.28 0.01 -1.21 0.00 0.00 0.00 175.76 173.88 3faq s GLU 50 N -3.24 1.53 0.29 0.00 2.02 0.94 -5.00 118.70 115.25 3faq s GLU 50 Ca 0.77 -1.47 0.11 0.00 0.02 0.00 0.00 54.97 54.40 3faq s GLU 50 Cb -0.34 -2.83 -0.05 0.00 0.10 0.00 0.00 34.13 31.01 3faq s GLU 50 CO 0.37 -0.81 -0.15 0.71 0.02 0.00 0.00 175.26 175.41 3faq s TYR 51 N 1.15 2.37 0.10 1.61 2.02 -1.26 -4.28 117.35 119.06 3faq s TYR 51 Ca 0.04 -0.35 -0.34 0.00 -0.37 0.00 0.00 57.07 56.05 3faq s TYR 51 Cb -0.19 -1.11 -0.14 0.00 -0.40 0.00 0.00 41.96 40.12 3faq s TYR 51 CO -0.10 0.67 1.58 1.49 -1.57 0.00 0.00 175.55 177.62 3faq h GLU 52 N 2.16 -0.81 -0.68 -0.62 4.81 0.82 -0.87 114.58 119.39 3faq h GLU 52 Ca -0.41 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 3faq h GLU 52 Cb 1.26 0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.82 3faq h GLU 52 CO 0.62 -0.54 0.00 -0.40 -0.73 0.00 0.00 179.01 177.96 3faq n ASP 53 N -5.51 2.89 0.00 1.04 5.75 -1.25 -4.86 116.55 114.61 3faq n ASP 53 Ca -0.10 -2.32 0.00 0.00 -0.01 0.00 0.00 54.79 52.36 3faq n ASP 53 Cb 0.42 -0.49 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 3faq n ASP 53 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3faq n GLY 54 N 0.50 0.20 1.01 6.12 0.00 -0.33 -4.71 105.19 107.97 3faq n GLY 54 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3faq n GLY 54 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3faq n LEU 55 N 0.00 0.47 0.00 0.99 4.77 -1.26 -4.72 117.00 117.24 3faq n LEU 55 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3faq n LEU 55 Cb 0.25 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 3faq n LEU 55 CO 0.00 -0.10 0.00 0.00 -1.33 0.00 0.00 177.39 175.96 3faq n ALA 56 N -2.45 0.46 -2.19 -1.18 0.00 -1.26 -0.27 120.51 113.62 3faq n ALA 56 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.01 3faq n ALA 56 Cb 0.22 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.65 3faq n ALA 56 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3faq s LEU 57 N -1.48 4.19 1.14 0.00 1.43 -1.26 -4.88 118.68 117.81 3faq s LEU 57 Ca 0.00 1.91 -0.12 0.00 -1.03 0.00 0.00 54.13 54.88 3faq s LEU 57 Cb 0.00 -3.53 0.27 0.00 0.03 0.00 0.00 46.19 42.95 3faq s LEU 57 CO 0.00 -0.92 1.04 -2.16 0.23 0.00 0.00 176.35 174.54 3faq s PRO 58 N 3.94 -0.71 0.37 1.29 0.04 -1.26 0.12 135.00 138.80 3faq s PRO 58 Ca 0.66 0.95 -0.24 0.00 0.04 0.00 0.00 61.00 62.41 3faq s PRO 58 Cb -0.27 -1.57 -0.10 0.00 0.04 0.00 0.00 34.50 32.60 3faq s PRO 58 CO 0.24 -3.62 0.97 -0.06 0.04 0.00 0.00 177.00 174.57 3faq s PHE 59 N -2.47 3.49 0.00 0.56 0.40 -1.26 -3.29 117.98 115.40 3faq s PHE 59 Ca 0.68 1.71 0.00 0.00 -0.60 0.00 0.00 56.93 58.72 3faq s PHE 59 Cb -0.25 -2.96 0.00 0.00 0.51 0.00 0.00 43.02 40.32 3faq s PHE 59 CO 0.64 -0.09 0.00 0.41 0.70 0.00 0.00 175.22 176.88 3faq n GLY 60 N 0.21 2.47 0.45 4.36 0.00 -1.26 -4.93 105.19 106.49 3faq n GLY 60 Ca 0.04 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.88 3faq n GLY 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 3faq h TRP 61 N 0.00 -1.03 -3.46 1.61 2.91 -1.92 -3.40 115.95 110.66 3faq h TRP 61 Ca 0.00 -0.02 -0.68 0.00 1.13 0.00 0.00 58.89 59.31 3faq h TRP 61 Cb 0.00 0.34 -0.18 0.00 -0.51 0.00 0.00 29.16 28.81 3faq h TRP 61 CO 0.00 -0.63 -0.05 0.99 -1.03 0.00 0.00 178.44 177.72 3faq s THR 62 N -5.55 4.96 0.25 2.65 2.01 -1.26 -4.99 115.64 113.72 3faq s THR 62 Ca -0.17 -0.30 -0.12 0.00 0.31 0.00 0.00 61.69 61.40 3faq s THR 62 Cb 0.02 -4.16 0.34 0.00 0.01 0.00 0.00 72.50 68.71 3faq s THR 62 CO 0.55 -0.59 1.57 1.56 -0.69 0.00 0.00 174.62 177.02 3faq h GLN 63 N 8.85 -0.01 0.00 4.92 7.50 -2.02 -0.80 115.11 133.54 3faq h GLN 63 Ca -0.27 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.89 3faq h GLN 63 Cb 1.10 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.64 3faq h GLN 63 CO 0.87 -0.01 0.00 2.89 -1.50 0.00 0.00 178.83 181.08 3faq n ARG 64 N -5.54 0.17 -3.60 1.46 1.85 -1.26 -4.71 116.66 105.03 3faq n ARG 64 Ca 0.12 0.15 -0.38 0.00 -1.00 0.00 0.00 57.85 56.74 3faq n ARG 64 Cb 0.44 -1.50 -0.11 0.00 -1.05 0.00 0.00 32.46 30.24 3faq n ARG 64 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 3faq s LYS 65 N -2.71 3.89 0.53 2.89 1.02 -0.31 -5.09 119.74 119.97 3faq s LYS 65 Ca 0.14 -0.36 -0.03 0.00 0.02 0.00 0.00 55.97 55.75 3faq s LYS 65 Cb 0.12 -3.64 0.01 0.00 -0.52 0.00 0.00 37.83 33.79 3faq s LYS 65 CO 0.28 -0.20 0.79 0.95 -0.92 0.00 0.00 175.35 176.26 3faq s THR 66 N 1.74 3.65 -0.40 2.17 -4.23 -1.26 -4.75 115.64 112.58 3faq s THR 66 Ca 0.07 -0.29 -0.04 0.00 -1.18 0.00 0.00 61.69 60.25 3faq s THR 66 Cb -0.16 -3.40 0.10 0.00 1.34 0.00 0.00 72.50 70.37 3faq s THR 66 CO 0.10 -0.35 0.19 -0.60 -0.54 0.00 0.00 174.62 173.42 3faq s ARG 67 N -4.79 2.17 -1.06 3.99 3.52 0.93 -4.52 118.95 119.19 3faq s ARG 67 Ca 0.52 -1.68 -0.02 0.00 -0.13 0.00 0.00 55.73 54.42 3faq s ARG 67 Cb -0.10 -3.56 0.00 0.00 -1.56 0.00 0.00 34.95 29.73 3faq s ARG 67 CO 0.41 -0.99 0.29 0.09 -0.81 0.00 0.00 175.30 174.30 3faq n ASN 68 N 4.66 -4.46 0.00 -2.12 3.02 -1.26 -2.98 115.26 112.11 3faq n ASN 68 Ca -0.05 -0.14 0.00 0.00 -0.03 0.00 0.00 54.58 54.36 3faq n ASN 68 Cb 0.42 -3.41 0.00 0.00 -0.61 0.00 0.00 39.78 36.17 3faq n ASN 68 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3faq n GLY 69 N -1.19 1.31 3.41 7.41 0.00 -1.26 -5.04 105.19 109.83 3faq n GLY 69 Ca -0.10 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 3faq n GLY 69 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3faq s PHE 70 N -2.67 2.12 0.14 1.61 2.99 -1.16 -4.94 117.98 116.07 3faq s PHE 70 Ca 0.00 -0.40 -0.29 0.00 0.00 0.00 0.00 56.93 56.24 3faq s PHE 70 Cb 0.00 -1.00 -0.07 0.00 0.00 0.00 0.00 43.02 41.95 3faq s PHE 70 CO 0.00 0.51 0.91 1.03 -0.00 0.00 0.00 175.22 177.67 3faq s ARG 71 N -3.05 4.70 0.05 0.44 0.52 -1.26 -0.05 118.95 120.30 3faq s ARG 71 Ca 0.22 1.38 -0.30 0.00 -0.52 0.00 0.00 55.73 56.52 3faq s ARG 71 Cb -0.06 -3.34 -0.05 0.00 0.52 0.00 0.00 34.95 32.02 3faq s ARG 71 CO 0.10 0.32 1.06 0.14 0.02 0.00 0.00 175.30 176.94 3faq s VAL 72 N -0.37 4.45 0.42 3.52 -7.23 -1.26 -4.88 120.40 115.04 3faq s VAL 72 Ca 0.43 1.82 -0.26 0.00 -1.81 0.00 0.00 61.98 62.17 3faq s VAL 72 Cb -0.24 -4.17 -0.08 0.00 0.56 0.00 0.00 36.38 32.45 3faq s VAL 72 CO 0.29 0.18 1.33 -2.16 -0.31 0.00 0.00 175.10 174.43 3faq s PRO 73 N 0.74 3.88 0.30 4.82 0.04 -1.25 -4.93 135.00 138.60 3faq s PRO 73 Ca 0.53 2.20 -0.29 0.00 0.04 0.00 0.00 61.00 63.48 3faq s PRO 73 Cb -0.25 -2.71 -0.13 0.00 0.04 0.00 0.00 34.50 31.45 3faq s PRO 73 CO 0.29 -0.58 1.35 1.28 0.04 0.00 0.00 177.00 179.38 3faq n LEU 74 N 0.01 3.42 0.05 -3.56 4.77 -1.26 -4.85 117.00 115.57 3faq n LEU 74 Ca 0.04 1.18 -0.11 0.00 -0.03 0.00 0.00 56.01 57.09 3faq n LEU 74 Cb 0.43 -1.47 -0.04 0.00 -2.33 0.00 0.00 43.42 40.01 3faq n LEU 74 CO 0.56 -0.46 0.69 0.00 -1.33 0.00 0.00 177.39 176.86 3faq h ALA 75 N 3.30 -0.32 0.00 -1.18 0.00 -1.91 -1.42 119.26 117.73 3faq h ALA 75 Ca -0.46 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 3faq h ALA 75 Cb 1.28 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 3faq h ALA 75 CO 0.68 -0.75 -0.01 -0.09 0.00 0.00 0.00 179.25 179.09 3faq h ARG 76 N -0.38 0.00 0.11 0.00 9.65 -1.87 -0.51 114.38 121.38 3faq h ARG 76 Ca 0.07 0.00 -0.28 0.00 -1.10 0.00 0.00 59.98 58.67 3faq h ARG 76 Cb 0.47 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.05 3faq h ARG 76 CO -0.24 0.01 -1.31 1.49 2.80 0.00 0.00 179.97 182.72 3faq h GLU 77 N 0.00 0.24 -0.25 0.20 4.81 -1.71 0.44 114.58 118.31 3faq h GLU 77 Ca -0.00 -0.41 -0.06 0.00 -0.13 0.00 0.00 59.36 58.76 3faq h GLU 77 Cb 0.02 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 3faq h GLU 77 CO 0.00 1.16 -0.11 0.28 -0.73 0.00 0.00 179.01 179.61 3faq h VAL 78 N 0.07 1.21 0.20 0.32 2.07 -0.28 -0.24 116.25 119.59 3faq h VAL 78 Ca -0.16 -0.90 -0.01 0.00 0.82 0.00 0.00 66.70 66.45 3faq h VAL 78 Cb 1.97 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 32.88 3faq h VAL 78 CO 0.19 0.29 -0.10 -1.28 0.02 0.00 0.00 177.57 176.69 3faq h SER 79 N 0.38 -0.23 -0.43 0.57 0.87 -0.97 -2.37 113.55 111.36 3faq h SER 79 Ca 0.08 -0.24 -0.09 0.00 -1.23 0.00 0.00 61.79 60.30 3faq h SER 79 Cb 0.43 0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.43 3faq h SER 79 CO 0.02 0.14 -0.05 0.78 -0.53 0.00 0.00 176.83 177.20 3faq h ASN 80 N -0.64 0.85 0.62 6.23 2.35 -0.70 -2.11 115.58 122.18 3faq h ASN 80 Ca -0.03 -0.24 -0.27 0.00 -0.55 0.00 0.00 56.30 55.21 3faq h ASN 80 Cb 0.46 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.61 3faq h ASN 80 CO 0.05 0.94 -1.22 0.11 -1.65 0.00 0.00 177.43 175.66 3faq h LYS 81 N 0.79 0.27 0.00 0.81 1.79 -1.13 -3.41 116.57 115.70 3faq h LYS 81 Ca 0.14 -0.45 -0.13 0.00 -2.18 0.00 0.00 60.65 58.03 3faq h LYS 81 Cb 0.55 0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 31.34 3faq h LYS 81 CO 0.03 1.21 -1.45 -0.89 -1.08 0.00 0.00 179.45 177.27 3faq n ILE 82 N -3.54 0.45 0.11 1.86 5.41 -0.90 -4.88 119.36 117.88 3faq n ILE 82 Ca -0.08 -0.14 -0.01 0.00 1.00 0.00 0.00 62.75 63.51 3faq n ILE 82 Cb 1.01 -1.20 0.01 0.00 -0.71 0.00 0.00 39.64 38.74 3faq n ILE 82 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 3faq h VAL 83 N -0.15 1.25 -3.15 1.39 2.07 -1.39 -3.45 116.25 112.81 3faq h VAL 83 Ca -0.19 -2.64 -0.48 0.00 0.82 0.00 0.00 66.70 64.22 3faq h VAL 83 Cb 1.22 2.53 0.03 0.00 -1.52 0.00 0.00 31.29 33.56 3faq h VAL 83 CO -0.08 0.68 -0.02 -0.83 0.02 0.00 0.00 177.57 177.35 3faq s GLY 84 N -4.55 1.48 0.17 2.17 0.00 -1.00 -2.52 107.32 103.07 3faq s GLY 84 Ca 0.02 -0.78 -0.18 0.00 0.00 0.00 0.00 44.72 43.78 3faq s GLY 84 CO 0.77 -0.63 0.50 -2.52 0.00 0.00 0.00 173.10 171.22 3faq s TYR 85 N -2.60 -0.20 -0.23 1.90 -0.85 -1.26 -4.86 117.35 109.26 3faq s TYR 85 Ca 0.46 -0.12 -0.06 0.00 -0.52 0.00 0.00 57.07 56.83 3faq s TYR 85 Cb -0.10 0.38 -0.12 0.00 0.38 0.00 0.00 41.96 42.50 3faq s TYR 85 CO 0.41 -0.85 -0.25 1.28 -1.52 0.00 0.00 175.55 174.62 3faq n LEU 86 N -0.31 2.20 -4.57 -3.49 4.77 -1.26 -4.66 117.00 109.68 3faq n LEU 86 Ca -0.13 0.11 -0.41 0.00 -0.03 0.00 0.00 56.01 55.56 3faq n LEU 86 Cb 0.63 -0.71 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 3faq n LEU 86 CO 0.16 0.64 1.33 -0.62 -1.33 0.00 0.00 177.39 177.58 3faq s ASP 87 N -6.67 5.97 0.00 -1.43 -1.08 -1.26 -4.86 116.67 107.34 3faq s ASP 87 Ca -0.31 0.35 0.30 0.00 -0.52 0.00 0.00 52.55 52.37 3faq s ASP 87 Cb 0.10 -2.54 1.42 0.00 -1.46 0.00 0.00 42.92 40.44 3faq s ASP 87 CO 0.45 -1.83 1.99 1.21 0.52 0.00 0.00 175.17 177.51 3faq n GLU 88 N 8.76 0.50 -2.65 4.34 4.07 -1.26 -4.82 120.64 129.58 3faq n GLU 88 Ca 0.14 -0.07 -0.42 0.00 -0.06 0.00 0.00 57.16 56.76 3faq n GLU 88 Cb 0.49 -1.50 -0.03 0.00 -0.06 0.00 0.00 31.44 30.34 3faq n GLU 88 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 3faq s GLU 89 N -2.55 4.55 0.00 5.31 -6.30 -1.26 -3.16 118.70 115.29 3faq s GLU 89 Ca 0.28 1.50 0.00 0.00 -2.50 0.00 0.00 54.97 54.26 3faq s GLU 89 Cb 0.20 -3.42 0.00 0.00 0.00 0.00 0.00 34.13 30.91 3faq s GLU 89 CO 0.47 -0.06 0.00 0.41 0.02 0.00 0.00 175.26 176.10 3faq n GLY 90 N 2.87 0.76 0.23 -1.50 0.00 -1.26 -4.94 105.19 101.34 3faq n GLY 90 Ca 0.06 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.22 3faq n GLY 90 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3faq h VAL 91 N 0.00 0.00 -4.04 1.61 3.04 -1.86 -3.47 116.25 111.53 3faq h VAL 91 Ca 0.00 -0.78 -0.50 0.00 -1.01 0.00 0.00 66.70 64.41 3faq h VAL 91 Cb 0.00 1.78 0.06 0.00 -2.01 0.00 0.00 31.29 31.11 3faq h VAL 91 CO 0.00 0.00 0.44 -0.76 -1.01 0.00 0.00 177.57 176.24 3faq s LEU 92 N -6.04 3.91 -0.45 3.16 1.43 -1.26 -0.83 118.68 118.59 3faq s LEU 92 Ca 0.05 2.17 -0.27 0.00 -1.03 0.00 0.00 54.13 55.05 3faq s LEU 92 Cb 0.07 -4.40 0.03 0.00 0.03 0.00 0.00 46.19 41.92 3faq s LEU 92 CO 0.62 -0.95 1.02 -0.62 0.23 0.00 0.00 176.35 176.65 3faq s ASP 93 N -1.62 6.59 0.08 2.29 -1.08 0.59 -4.53 116.67 118.98 3faq s ASP 93 Ca 0.67 0.35 0.07 0.00 -0.52 0.00 0.00 52.55 53.11 3faq s ASP 93 Cb -0.24 -2.50 0.35 0.00 -1.46 0.00 0.00 42.92 39.07 3faq s ASP 93 CO 0.29 -1.12 1.22 0.00 0.52 0.00 0.00 175.17 176.08 3faq n GLN 94 N 7.42 0.04 -2.74 4.34 1.13 -1.26 -3.28 117.38 123.02 3faq n GLN 94 Ca 0.09 0.50 -0.04 0.00 -1.94 0.00 0.00 57.00 55.60 3faq n GLN 94 Cb 0.49 -1.61 0.06 0.00 0.11 0.00 0.00 30.24 29.29 3faq n GLN 94 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 3faq n ASN 95 N -1.68 0.82 -3.48 1.08 5.15 -1.26 -4.66 115.26 111.23 3faq n ASN 95 Ca 0.00 -2.34 -0.07 0.00 -0.60 0.00 0.00 54.58 51.57 3faq n ASN 95 Cb 0.04 -0.21 -0.08 0.00 -0.53 0.00 0.00 39.78 39.00 3faq n ASN 95 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 3faq s ARG 96 N -2.70 0.37 0.98 1.20 1.81 -1.20 -3.97 118.95 115.43 3faq s ARG 96 Ca 0.24 0.84 -0.12 0.00 -1.72 0.00 0.00 55.73 54.97 3faq s ARG 96 Cb 0.39 0.04 0.18 0.00 -0.45 0.00 0.00 34.95 35.11 3faq s ARG 96 CO -0.03 -0.45 1.09 -1.54 -0.68 0.00 0.00 175.30 173.70 3faq s SER 97 N 2.62 2.74 0.33 0.23 1.04 -0.90 -0.52 113.70 119.24 3faq s SER 97 Ca 0.06 1.24 0.25 0.00 0.48 0.00 0.00 55.95 57.98 3faq s SER 97 Cb -0.14 -1.91 1.17 0.00 0.10 0.00 0.00 66.02 65.24 3faq s SER 97 CO -0.15 -3.07 1.75 0.25 0.98 0.00 0.00 173.24 173.00 3faq h LEU 98 N -1.85 0.00 -0.53 2.42 6.46 0.12 -0.92 115.31 121.01 3faq h LEU 98 Ca -0.54 0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.13 3faq h LEU 98 Cb 1.32 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.24 3faq h LEU 98 CO 0.57 0.00 -0.46 0.25 -0.62 0.00 0.00 178.44 178.18 3faq h LEU 99 N 0.00 0.00 -0.41 2.25 5.85 -1.74 -3.03 115.31 118.24 3faq h LEU 99 Ca 0.00 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.76 3faq h LEU 99 Cb 0.21 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 3faq h LEU 99 CO 0.00 0.46 0.16 0.15 -0.34 0.00 0.00 178.44 178.87 3faq h PHE 100 N 0.00 0.29 -0.07 1.25 3.57 -1.40 -2.03 116.94 118.55 3faq h PHE 100 Ca -0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 3faq h PHE 100 Cb 1.13 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.80 3faq h PHE 100 CO 0.00 0.13 -0.01 1.98 -2.23 0.00 0.00 178.31 178.18 3faq h MET 101 N 0.34 0.13 -0.47 1.11 4.05 -1.68 -3.26 114.93 115.15 3faq h MET 101 Ca 0.18 -0.05 -0.03 0.00 -0.28 0.00 0.00 59.70 59.52 3faq h MET 101 Cb 0.14 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.91 3faq h MET 101 CO -0.17 0.44 0.15 0.37 0.23 0.00 0.00 176.91 177.94 3faq h GLN 102 N -0.19 0.69 -0.04 0.39 5.75 -1.41 -2.75 115.11 117.56 3faq h GLN 102 Ca 0.02 -0.11 -0.13 0.00 -0.15 0.00 0.00 58.65 58.28 3faq h GLN 102 Cb 0.39 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.81 3faq h GLN 102 CO 0.01 0.60 -0.56 2.35 -2.65 0.00 0.00 178.83 178.58 3faq h TRP 103 N 0.68 0.13 -0.58 3.99 2.91 -1.47 -2.79 115.95 118.83 3faq h TRP 103 Ca 0.16 -0.05 -0.02 0.00 1.13 0.00 0.00 58.89 60.11 3faq h TRP 103 Cb 0.20 -0.03 -0.03 0.00 -0.51 0.00 0.00 29.16 28.80 3faq h TRP 103 CO 0.01 0.64 0.27 0.78 -1.03 0.00 0.00 178.44 179.11 3faq h GLY 104 N 1.57 0.89 2.00 2.65 0.00 -1.53 -2.27 103.07 106.38 3faq h GLY 104 Ca -0.00 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 3faq h GLY 104 CO 0.08 0.43 -0.07 -1.61 0.00 0.00 0.00 176.54 175.37 3faq h GLN 105 N 0.78 0.00 0.11 4.80 4.15 -1.38 -1.20 115.11 122.37 3faq h GLN 105 Ca 0.20 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.61 3faq h GLN 105 Cb 0.13 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.83 3faq h GLN 105 CO -0.02 0.07 -0.05 0.82 -1.93 0.00 0.00 178.83 177.72 3faq h ILE 106 N 0.00 0.12 -0.94 2.39 2.04 -1.32 -2.68 117.51 117.12 3faq h ILE 106 Ca -0.00 -0.97 0.18 0.00 1.00 0.00 0.00 64.86 65.07 3faq h ILE 106 Cb 0.21 0.22 -0.17 0.00 -0.74 0.00 0.00 36.82 36.33 3faq h ILE 106 CO 0.01 0.04 -0.27 0.58 0.00 0.00 0.00 178.15 178.51 3faq h VAL 107 N -1.03 0.05 -0.17 1.67 2.07 -1.40 0.90 116.25 118.33 3faq h VAL 107 Ca -0.01 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.56 3faq h VAL 107 Cb 0.17 0.05 -0.06 0.00 -1.52 0.00 0.00 31.29 29.93 3faq h VAL 107 CO 0.02 0.00 -0.20 -0.78 0.02 0.00 0.00 177.57 176.63 3faq h ASP 108 N -0.01 -0.63 0.72 0.57 1.82 -1.30 0.32 116.42 117.92 3faq h ASP 108 Ca 0.43 0.11 0.00 0.00 -0.39 0.00 0.00 57.03 57.18 3faq h ASP 108 Cb 0.67 0.30 0.00 0.00 0.68 0.00 0.00 39.33 40.97 3faq h ASP 108 CO -0.97 -0.25 0.00 0.45 -1.61 0.00 0.00 179.24 176.87 3faq h HIS 109 N -0.23 0.00 0.06 0.28 3.86 -0.11 0.24 115.15 119.24 3faq h HIS 109 Ca 0.11 0.00 -0.23 0.00 -1.16 0.00 0.00 60.37 59.09 3faq h HIS 109 Cb 0.40 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.89 3faq h HIS 109 CO -0.33 0.00 -0.94 0.22 0.86 0.00 0.00 177.93 177.74 3faq h ASP 110 N 0.00 0.73 0.19 2.45 1.82 0.42 -3.39 116.42 118.63 3faq h ASP 110 Ca 0.00 -0.80 -0.25 0.00 -0.39 0.00 0.00 57.03 55.60 3faq h ASP 110 Cb 0.36 -0.23 0.03 0.00 0.68 0.00 0.00 39.33 40.17 3faq h ASP 110 CO 0.00 1.45 -1.08 -0.07 -1.61 0.00 0.00 179.24 177.93 3faq h LEU 111 N 0.11 0.63 -7.69 2.28 3.38 0.82 -3.40 115.31 111.43 3faq h LEU 111 Ca -0.13 -0.94 -0.16 0.00 0.09 0.00 0.00 57.88 56.74 3faq h LEU 111 Cb 1.64 -0.20 -0.22 0.00 0.09 0.00 0.00 40.66 41.96 3faq h LEU 111 CO 0.18 1.52 -0.50 1.51 0.09 0.00 0.00 178.44 181.24 3faq s ASP 112 N -7.22 -0.04 -0.21 -0.43 -4.77 -0.09 -4.24 116.67 99.67 3faq s ASP 112 Ca -0.12 -0.03 -0.08 0.00 -3.30 0.00 0.00 52.55 49.02 3faq s ASP 112 Cb 0.02 0.25 0.09 0.00 -1.09 0.00 0.00 42.92 42.19 3faq s ASP 112 CO 0.88 -0.27 0.46 0.12 0.70 0.00 0.00 175.17 177.06 3faq s PHE 113 N -0.92 -0.86 -0.74 2.11 5.36 -1.26 -4.53 117.98 117.14 3faq s PHE 113 Ca -0.10 1.64 0.02 0.00 -0.96 0.00 0.00 56.93 57.53 3faq s PHE 113 Cb -0.06 0.39 0.18 0.00 -0.34 0.00 0.00 43.02 43.19 3faq s PHE 113 CO 0.01 -0.49 0.56 0.00 -1.46 0.00 0.00 175.22 173.84 3faq s ALA 114 N 2.43 3.90 0.53 11.12 0.00 -1.26 -0.44 121.76 138.04 3faq s ALA 114 Ca -0.04 -3.75 -0.19 0.00 0.00 0.00 0.00 51.96 47.98 3faq s ALA 114 Cb -0.11 -2.41 -0.11 0.00 0.00 0.00 0.00 23.12 20.49 3faq s ALA 114 CO -0.14 -2.11 0.43 -2.30 0.00 0.00 0.00 175.76 171.64 3faq n PRO 115 N 2.29 0.45 -1.91 0.00 -0.02 -1.26 -4.63 135.00 129.92 3faq n PRO 115 Ca 0.18 0.17 -0.29 0.00 -2.02 0.00 0.00 63.50 61.54 3faq n PRO 115 Cb 0.36 -1.55 0.15 0.00 -0.02 0.00 0.00 33.50 32.44 3faq n PRO 115 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3faq s GLU 116 N -1.80 1.13 0.62 -0.52 2.02 -1.26 -0.69 118.70 118.20 3faq s GLU 116 Ca 0.66 -0.21 -0.18 0.00 0.02 0.00 0.00 54.97 55.26 3faq s GLU 116 Cb -0.49 -1.88 -0.04 0.00 0.10 0.00 0.00 34.13 31.82 3faq s GLU 116 CO 0.57 -2.11 0.95 0.25 0.02 0.00 0.00 175.26 174.94 3faq n THR 117 N -3.60 3.71 -3.11 3.63 -2.24 -0.64 -4.30 114.28 107.73 3faq n THR 117 Ca 0.12 -0.49 -0.21 0.00 -2.27 0.00 0.00 64.05 61.21 3faq n THR 117 Cb 0.60 -1.13 -0.04 0.00 -2.10 0.00 0.00 70.33 67.65 3faq n THR 117 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3faq n GLU 118 N -1.14 0.74 -0.38 -0.78 4.07 -1.26 -4.79 120.64 117.10 3faq n GLU 118 Ca 0.14 -2.95 0.07 0.00 -0.06 0.00 0.00 57.16 54.35 3faq n GLU 118 Cb 0.48 -1.29 0.12 0.00 -0.06 0.00 0.00 31.44 30.69 3faq n GLU 118 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 3faq n LEU 119 N 1.36 1.85 -3.41 4.31 4.32 -1.26 -4.94 117.00 119.23 3faq n LEU 119 Ca 0.19 -2.76 -0.26 0.00 -0.02 0.00 0.00 56.01 53.16 3faq n LEU 119 Cb 0.56 -0.33 -0.09 0.00 -1.62 0.00 0.00 43.42 41.93 3faq n LEU 119 CO 0.16 0.75 -0.25 0.61 -1.22 0.00 0.00 177.39 177.43 3faq n GLY 120 N -0.93 2.74 2.95 -0.72 0.00 -1.26 -4.99 105.19 102.97 3faq n GLY 120 Ca 0.13 -1.64 -0.28 0.00 0.00 0.00 0.00 46.02 44.23 3faq n GLY 120 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3faq s SER 121 N -0.63 2.48 0.00 1.61 1.04 -1.26 -4.60 113.70 112.34 3faq s SER 121 Ca 0.33 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.33 3faq s SER 121 Cb 0.07 -0.98 0.00 0.00 0.10 0.00 0.00 66.02 65.21 3faq s SER 121 CO -0.16 -0.11 0.00 -3.20 0.98 0.00 0.00 173.24 170.75 3faq n ASN 122 N 4.87 -1.83 -4.23 7.02 5.15 -1.26 -5.08 115.26 119.89 3faq n ASN 122 Ca -0.14 0.00 -0.21 0.00 -0.60 0.00 0.00 54.58 53.63 3faq n ASN 122 Cb 0.50 -0.86 -0.12 0.00 -0.53 0.00 0.00 39.78 38.77 3faq n ASN 122 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 3faq s GLU 123 N -2.92 0.97 0.00 1.20 2.56 -1.26 -4.96 118.70 114.30 3faq s GLU 123 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 54.97 53.90 3faq s GLU 123 Cb 0.00 -1.08 0.00 0.00 2.00 0.00 0.00 34.13 35.05 3faq s GLU 123 CO 0.00 0.24 0.33 1.58 -0.56 0.00 0.00 175.26 176.85 3faq n HIS 124 N 1.13 0.00 0.13 5.30 -0.00 -1.26 -4.59 115.22 115.92 3faq n HIS 124 Ca -0.20 0.00 0.09 0.00 0.46 0.00 0.00 57.72 58.07 3faq n HIS 124 Cb 0.54 0.00 0.03 0.00 -0.12 0.00 0.00 29.99 30.44 3faq n HIS 124 CO 0.00 0.00 0.00 1.03 0.46 0.00 0.00 176.34 177.83 3faq h SER 125 N 0.00 0.00 1.85 0.26 0.87 -1.97 0.30 113.55 114.86 3faq h SER 125 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3faq h SER 125 Cb 0.06 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.02 3faq h SER 125 CO 0.00 0.14 -0.02 0.11 -0.53 0.00 0.00 176.83 176.53 3faq h LYS 126 N 0.00 0.00 0.00 2.24 1.57 -1.94 -2.91 116.57 115.53 3faq h LYS 126 Ca -0.03 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.46 3faq h LYS 126 Cb 1.13 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.38 3faq h LYS 126 CO 0.01 0.02 -2.16 2.41 -0.57 0.00 0.00 179.45 179.17 3faq n THR 127 N -3.11 1.12 0.27 -0.16 -1.04 -1.22 -2.59 114.28 107.55 3faq n THR 127 Ca 0.03 -0.71 0.11 0.00 -2.04 0.00 0.00 64.05 61.44 3faq n THR 127 Cb 0.51 -0.52 0.73 0.00 -1.82 0.00 0.00 70.33 69.24 3faq n THR 127 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 3faq h GLN 128 N 0.00 0.00 0.04 -2.82 5.75 -0.95 -1.41 115.11 115.72 3faq h GLN 128 Ca -0.44 0.00 -0.35 0.00 -0.15 0.00 0.00 58.65 57.71 3faq h GLN 128 Cb 2.00 0.00 -0.04 0.00 1.07 0.00 0.00 27.48 30.51 3faq h GLN 128 CO 0.02 0.05 -1.96 0.00 -2.65 0.00 0.00 178.83 174.30 3faq h GLU 130 N -0.47 -0.19 0.04 0.00 4.39 -1.34 -3.17 114.58 113.84 3faq h GLU 130 Ca -0.48 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.23 3faq h GLU 130 Cb 1.71 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.40 3faq h GLU 130 CO -0.13 -0.13 -0.02 0.93 -1.16 0.00 0.00 179.01 178.50 3faq h GLU 131 N -0.20 -0.06 -0.53 2.33 4.39 -1.50 -3.40 114.58 115.62 3faq h GLU 131 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 3faq h GLU 131 Cb 0.19 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.86 3faq h GLU 131 CO -0.03 0.36 0.00 0.66 -1.16 0.00 0.00 179.01 178.84 3faq n TYR 132 N -4.76 1.69 -3.76 4.33 4.02 -1.26 -4.96 117.16 112.46 3faq n TYR 132 Ca -0.05 -0.73 -0.31 0.00 -0.01 0.00 0.00 57.90 56.80 3faq n TYR 132 Cb 0.21 -0.40 -0.06 0.00 -0.02 0.00 0.00 39.34 39.07 3faq n TYR 132 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3faq s ILE 134 N -2.75 4.65 0.19 0.00 1.01 -1.25 -4.94 121.20 118.11 3faq s ILE 134 Ca 0.58 0.88 -0.30 0.00 0.00 0.00 0.00 60.65 61.82 3faq s ILE 134 Cb -0.34 -4.28 -0.08 0.00 0.01 0.00 0.00 42.46 37.77 3faq s ILE 134 CO 0.76 -0.54 1.26 -1.58 0.00 0.00 0.00 174.94 174.84 3faq s GLN 135 N 3.29 4.43 0.00 2.79 0.74 -1.26 -4.76 119.66 124.89 3faq s GLN 135 Ca 0.33 1.97 0.00 0.00 0.05 0.00 0.00 55.36 57.71 3faq s GLN 135 Cb -0.12 -3.22 0.00 0.00 1.10 0.00 0.00 33.01 30.77 3faq s GLN 135 CO 0.19 -0.19 0.00 0.41 -0.55 0.00 0.00 175.29 175.16 3faq n GLY 136 N 2.32 1.84 7.00 2.59 0.00 -0.74 -5.01 105.19 113.19 3faq n GLY 136 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.74 3faq n GLY 136 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3faq n ASP 137 N 0.00 0.00 -1.66 1.61 8.00 -1.26 -0.71 116.55 122.53 3faq n ASP 137 Ca 0.00 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.41 3faq n ASP 137 Cb 0.00 0.00 0.17 0.00 -0.02 0.00 0.00 41.12 41.27 3faq n ASP 137 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3faq n ASN 138 N 4.09 3.68 -4.30 -2.24 3.02 -1.26 -4.76 115.26 113.49 3faq n ASN 138 Ca 0.00 -2.89 -0.36 0.00 -0.03 0.00 0.00 54.58 51.30 3faq n ASN 138 Cb 0.00 -0.69 -0.13 0.00 -0.61 0.00 0.00 39.78 38.35 3faq n ASN 138 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3faq n PHE 140 N 4.80 1.42 -1.62 0.00 7.35 0.12 -1.80 117.46 127.73 3faq n PHE 140 Ca -0.15 -3.83 -0.41 0.00 -0.76 0.00 0.00 57.45 52.30 3faq n PHE 140 Cb 0.48 -0.37 0.02 0.00 0.35 0.00 0.00 39.48 39.95 3faq n PHE 140 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 3faq n PRO 141 N 1.48 1.35 -3.27 -7.13 -0.02 -1.26 -4.32 135.00 121.85 3faq n PRO 141 Ca 0.25 0.49 -0.46 0.00 -2.02 0.00 0.00 63.50 61.76 3faq n PRO 141 Cb 0.46 -2.09 -0.04 0.00 -0.02 0.00 0.00 33.50 31.80 3faq n PRO 141 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3faq s ILE 142 N -1.30 5.18 0.65 4.25 1.01 -0.91 -4.94 121.20 125.13 3faq s ILE 142 Ca 0.64 -1.53 -0.17 0.00 0.00 0.00 0.00 60.65 59.60 3faq s ILE 142 Cb -0.53 -4.40 -0.00 0.00 0.01 0.00 0.00 42.46 37.54 3faq s ILE 142 CO 0.56 -0.96 1.17 -0.04 0.00 0.00 0.00 174.94 175.67 3faq s MET 143 N 1.65 2.71 -0.10 2.79 -1.94 -1.26 -1.91 119.30 121.23 3faq s MET 143 Ca 0.07 1.66 -0.14 0.00 -1.71 0.00 0.00 55.69 55.57 3faq s MET 143 Cb -0.26 -1.91 -0.05 0.00 2.01 0.00 0.00 34.83 34.62 3faq s MET 143 CO 0.02 -1.37 0.35 -0.06 -0.01 0.00 0.00 175.02 173.95 3faq s PHE 144 N -1.95 3.56 0.85 -0.03 2.99 -0.94 -4.60 117.98 117.87 3faq s PHE 144 Ca 0.73 0.77 -0.12 0.00 0.00 0.00 0.00 56.93 58.31 3faq s PHE 144 Cb -0.26 -2.34 0.10 0.00 0.00 0.00 0.00 43.02 40.52 3faq s PHE 144 CO 0.38 0.38 1.13 -1.25 -0.00 0.00 0.00 175.22 175.86 3faq s PRO 145 N -0.06 1.61 0.34 0.24 0.04 -1.26 -4.99 135.00 130.93 3faq s PRO 145 Ca 0.20 0.38 -0.28 0.00 0.04 0.00 0.00 61.00 61.34 3faq s PRO 145 Cb -0.14 -1.89 -0.10 0.00 0.04 0.00 0.00 34.50 32.41 3faq s PRO 145 CO 0.08 -1.89 1.29 0.21 0.04 0.00 0.00 177.00 176.73 3faq s LYS 146 N -5.28 4.31 0.00 4.56 2.20 -1.26 -3.05 119.74 121.22 3faq s LYS 146 Ca 0.62 2.18 0.00 0.00 -0.36 0.00 0.00 55.97 58.41 3faq s LYS 146 Cb -0.14 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 33.15 3faq s LYS 146 CO 0.53 -0.21 0.00 0.09 -0.36 0.00 0.00 175.35 175.40 3faq n ASN 147 N 0.71 -2.80 -4.64 1.43 5.03 -1.26 -5.03 115.26 108.71 3faq n ASN 147 Ca 0.00 0.00 -0.40 0.00 0.87 0.00 0.00 54.58 55.06 3faq n ASN 147 Cb 0.42 -0.47 -0.07 0.00 -1.02 0.00 0.00 39.78 38.65 3faq n ASN 147 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3faq s ASP 148 N -2.71 6.50 0.57 6.41 -1.08 -1.17 -4.93 116.67 120.26 3faq s ASP 148 Ca 0.00 0.61 0.30 0.00 -0.52 0.00 0.00 52.55 52.94 3faq s ASP 148 Cb 0.00 -2.29 1.45 0.00 -1.46 0.00 0.00 42.92 40.62 3faq s ASP 148 CO 0.00 -0.26 1.86 -0.65 0.52 0.00 0.00 175.17 176.65 3faq h PRO 149 N 7.78 0.00 0.00 4.34 0.11 -1.95 -1.12 132.00 141.15 3faq h PRO 149 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 3faq h PRO 149 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3faq h PRO 149 CO 0.73 0.00 0.00 0.87 -0.21 0.00 0.00 178.00 179.39 3faq h LYS 150 N 0.00 0.00 -0.36 1.05 1.57 -1.94 -2.42 116.57 114.47 3faq h LYS 150 Ca 0.32 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.04 3faq h LYS 150 Cb 1.49 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.79 3faq h LYS 150 CO -0.00 0.00 0.02 -0.07 -0.57 0.00 0.00 179.45 178.82 3faq h LEU 151 N 0.00 0.60 -1.82 2.94 3.38 -1.34 0.27 115.31 119.35 3faq h LEU 151 Ca 0.00 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 3faq h LEU 151 Cb 0.28 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 3faq h LEU 151 CO 0.00 0.75 -0.08 0.11 0.09 0.00 0.00 178.44 179.31 3faq h LYS 152 N 0.44 0.01 0.00 1.13 1.57 -1.59 -3.30 116.57 114.83 3faq h LYS 152 Ca 0.10 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3faq h LYS 152 Cb 0.43 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3faq h LYS 152 CO 0.01 0.09 -0.39 0.25 -0.57 0.00 0.00 179.45 178.85 3faq n THR 153 N -4.44 0.00 -0.08 -0.16 -2.24 -1.16 -4.91 114.28 101.29 3faq n THR 153 Ca -0.03 -0.17 -0.15 0.00 -2.27 0.00 0.00 64.05 61.43 3faq n THR 153 Cb 0.16 0.66 -0.07 0.00 -2.10 0.00 0.00 70.33 68.99 3faq n THR 153 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3faq n GLN 154 N -0.92 0.38 0.00 -0.78 6.02 0.92 -5.10 117.38 117.90 3faq n GLN 154 Ca 0.00 0.13 0.00 0.00 -0.01 0.00 0.00 57.00 57.12 3faq n GLN 154 Cb 0.00 -1.21 0.00 0.00 1.02 0.00 0.00 30.24 30.05 3faq n GLN 154 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3faq n GLY 155 N 2.28 -0.10 0.00 1.08 0.00 -1.00 -4.91 105.19 102.54 3faq n GLY 155 Ca -0.32 -1.03 0.09 0.00 0.00 0.00 0.00 46.02 44.76 3faq n GLY 155 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3faq n LYS 156 N 0.00 0.80 -3.87 1.61 4.76 -1.26 -4.05 118.16 116.14 3faq n LYS 156 Ca 0.00 -0.03 -0.02 0.00 -2.87 0.00 0.00 58.31 55.39 3faq n LYS 156 Cb 0.00 -1.39 0.01 0.00 -1.84 0.00 0.00 35.03 31.81 3faq n LYS 156 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3faq s MET 158 N -2.25 3.03 0.25 0.00 -1.94 -0.80 -4.96 119.30 112.63 3faq s MET 158 Ca 0.22 -0.85 -0.30 0.00 -1.71 0.00 0.00 55.69 53.04 3faq s MET 158 Cb -0.02 -2.43 -0.14 0.00 2.01 0.00 0.00 34.83 34.25 3faq s MET 158 CO 0.04 0.01 1.19 -2.30 -0.01 0.00 0.00 175.02 173.95 3faq n PRO 159 N 4.01 1.58 -3.28 2.03 -0.02 -1.26 -2.15 135.00 135.91 3faq n PRO 159 Ca -0.20 0.56 -0.07 0.00 -2.02 0.00 0.00 63.50 61.77 3faq n PRO 159 Cb 0.52 -2.07 -0.05 0.00 -0.02 0.00 0.00 33.50 31.88 3faq n PRO 159 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3faq s PHE 160 N -0.54 -1.14 -0.04 6.00 2.19 -1.26 -4.84 117.98 118.34 3faq s PHE 160 Ca 0.65 0.39 -0.15 0.00 0.33 0.00 0.00 56.93 58.15 3faq s PHE 160 Cb -0.71 -0.08 -0.05 0.00 -1.31 0.00 0.00 43.02 40.86 3faq s PHE 160 CO 0.55 -1.01 0.41 -0.06 1.83 0.00 0.00 175.22 176.94 3faq s PHE 161 N 2.53 3.66 0.50 10.12 0.40 -1.26 -0.70 117.98 133.22 3faq s PHE 161 Ca 0.10 0.93 -0.23 0.00 -0.60 0.00 0.00 56.93 57.13 3faq s PHE 161 Cb -0.12 -2.35 -0.06 0.00 0.51 0.00 0.00 43.02 41.00 3faq s PHE 161 CO -0.28 0.50 1.39 1.03 0.70 0.00 0.00 175.22 178.57 3faq s ARG 162 N -0.57 3.41 0.92 0.44 0.52 -1.09 -4.64 118.95 117.95 3faq s ARG 162 Ca 0.23 2.32 -0.11 0.00 -0.52 0.00 0.00 55.73 57.66 3faq s ARG 162 Cb -0.16 -2.45 0.15 0.00 0.52 0.00 0.00 34.95 33.00 3faq s ARG 162 CO 0.12 -1.00 1.10 0.00 0.02 0.00 0.00 175.30 175.54 3faq s ALA 163 N -1.25 1.34 0.56 2.13 0.00 -1.26 -1.62 121.76 121.65 3faq s ALA 163 Ca 0.66 0.25 -0.17 0.00 0.00 0.00 0.00 51.96 52.70 3faq s ALA 163 Cb -0.42 -3.32 -0.05 0.00 0.00 0.00 0.00 23.12 19.33 3faq s ALA 163 CO 0.52 -2.63 1.05 0.20 0.00 0.00 0.00 175.76 174.90 3faq s GLY 164 N -2.98 2.26 0.18 0.00 0.00 0.13 -4.55 107.32 102.36 3faq s GLY 164 Ca 0.65 0.47 0.00 0.00 0.00 0.00 0.00 44.72 45.85 3faq s GLY 164 CO 0.58 0.79 0.04 1.97 0.00 0.00 0.00 173.10 176.48 3faq n PHE 165 N -1.67 -0.06 -0.08 1.90 -1.74 -1.26 -2.48 117.46 112.07 3faq n PHE 165 Ca 0.09 -0.83 -0.12 0.00 -0.56 0.00 0.00 57.45 56.03 3faq n PHE 165 Cb 0.53 -0.12 -0.07 0.00 1.52 0.00 0.00 39.48 41.33 3faq n PHE 165 CO 0.00 0.00 0.00 0.28 -0.56 0.00 0.00 176.76 176.48 3faq h VAL 166 N 0.93 0.60 -0.03 1.97 2.07 -1.39 -3.42 116.25 116.99 3faq h VAL 166 Ca -0.14 -1.65 -0.16 0.00 0.82 0.00 0.00 66.70 65.58 3faq h VAL 166 Cb 0.43 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 3faq h VAL 166 CO 0.22 0.20 -0.70 0.00 0.02 0.00 0.00 177.57 177.32 3faq n PRO 168 N -3.77 0.00 0.00 0.00 -0.04 -1.26 -3.67 135.00 126.26 3faq n PRO 168 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 3faq n PRO 168 Cb 0.68 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.14 3faq n PRO 168 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3faq n THR 169 N 0.00 0.00 -3.24 0.52 -1.04 -1.26 -4.75 114.28 104.51 3faq n THR 169 Ca 0.00 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.62 3faq n THR 169 Cb 0.00 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.44 3faq n THR 169 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3faq s PRO 170 N 0.00 4.19 0.00 -2.82 0.02 -1.26 -4.86 135.00 130.27 3faq s PRO 170 Ca 0.00 0.43 0.00 0.00 0.02 0.00 0.00 61.00 61.45 3faq s PRO 170 Cb 0.00 -3.56 0.00 0.00 0.02 0.00 0.00 34.50 30.96 3faq s PRO 170 CO 0.00 -0.16 0.00 -2.30 -0.33 0.00 0.00 177.00 174.21 3faq n PRO 171 N 4.81 0.00 -1.59 5.54 -0.02 -1.26 -4.92 135.00 137.56 3faq n PRO 171 Ca -0.04 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.13 3faq n PRO 171 Cb 0.50 0.00 0.06 0.00 -0.02 0.00 0.00 33.50 34.04 3faq n PRO 171 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3faq s TYR 172 N 0.00 3.08 0.00 6.00 5.04 -1.26 -5.08 117.35 125.13 3faq s TYR 172 Ca 0.00 1.35 0.00 0.00 -2.44 0.00 0.00 57.07 55.98 3faq s TYR 172 Cb 0.00 -2.93 0.00 0.00 0.35 0.00 0.00 41.96 39.38 3faq s TYR 172 CO 0.00 -1.32 0.00 0.00 -1.34 0.00 0.00 175.55 172.89 3faq n GLN 173 N -3.17 0.00 0.00 4.97 10.64 -1.26 -5.06 117.38 123.49 3faq n GLN 173 Ca 0.07 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.24 3faq n GLN 173 Cb 0.54 -0.66 0.00 0.00 -0.86 0.00 0.00 30.24 29.26 3faq n GLN 173 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 3faq n SER 174 N -2.29 0.00 -3.63 2.61 7.64 -1.26 -4.98 113.62 111.72 3faq n SER 174 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 3faq n SER 174 Cb 0.30 0.00 0.26 0.00 -1.01 0.00 0.00 64.21 63.75 3faq n SER 174 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3faq s LEU 175 N 0.00 0.33 0.45 -3.43 0.20 -1.26 -4.96 118.68 110.01 3faq s LEU 175 Ca 0.00 0.57 -0.25 0.00 0.69 0.00 0.00 54.13 55.14 3faq s LEU 175 Cb 0.00 -2.20 -0.08 0.00 -0.43 0.00 0.00 46.19 43.48 3faq s LEU 175 CO 0.00 -4.43 1.41 0.00 -0.29 0.00 0.00 176.35 173.04 3faq s ALA 176 N -2.92 3.22 0.15 5.97 0.00 -1.26 -4.87 121.76 122.05 3faq s ALA 176 Ca 0.71 1.43 -0.31 0.00 0.00 0.00 0.00 51.96 53.80 3faq s ALA 176 Cb -0.09 -3.58 -0.08 0.00 0.00 0.00 0.00 23.12 19.37 3faq s ALA 176 CO 0.56 -1.16 1.34 0.50 0.00 0.00 0.00 175.76 176.99 3faq s ARG 177 N -2.45 4.36 -0.13 0.00 3.52 0.63 -5.03 118.95 119.85 3faq s ARG 177 Ca 0.61 2.04 0.02 0.00 -0.13 0.00 0.00 55.73 58.28 3faq s ARG 177 Cb -0.43 -3.23 0.01 0.00 -1.56 0.00 0.00 34.95 29.74 3faq s ARG 177 CO 0.55 -0.33 -0.21 -1.21 -0.81 0.00 0.00 175.30 173.29 3faq s GLU 178 N 0.47 2.86 0.39 5.12 0.41 -1.26 -4.99 118.70 121.71 3faq s GLU 178 Ca 0.60 -0.80 -0.24 0.00 -0.41 0.00 0.00 54.97 54.12 3faq s GLU 178 Cb -0.36 -2.32 -0.09 0.00 -1.78 0.00 0.00 34.13 29.58 3faq s GLU 178 CO 0.34 -0.01 1.02 -0.65 -0.49 0.00 0.00 175.26 175.47 3faq s GLN 179 N 0.82 4.25 0.26 1.61 1.11 -1.26 -0.99 119.66 125.46 3faq s GLN 179 Ca -0.08 1.44 -0.16 0.00 0.01 0.00 0.00 55.36 56.58 3faq s GLN 179 Cb -0.16 -2.56 -0.08 0.00 -1.01 0.00 0.00 33.01 29.21 3faq s GLN 179 CO -0.01 -0.05 0.69 0.42 0.01 0.00 0.00 175.29 176.34 3faq s ILE 180 N -1.70 4.69 -0.25 1.08 1.01 -1.04 -1.05 121.20 123.95 3faq s ILE 180 Ca 0.57 0.98 -0.05 0.00 0.00 0.00 0.00 60.65 62.15 3faq s ILE 180 Cb -0.20 -3.70 -0.00 0.00 0.01 0.00 0.00 42.46 38.56 3faq s ILE 180 CO 0.25 -0.00 0.01 0.21 0.00 0.00 0.00 174.94 175.41 3faq s ASN 181 N -2.03 4.70 0.00 3.58 3.84 -0.45 -4.21 114.94 120.37 3faq s ASN 181 Ca 0.48 -0.51 0.29 0.00 0.21 0.00 0.00 52.86 53.33 3faq s ASN 181 Cb -0.13 -1.80 1.69 0.00 -0.55 0.00 0.00 41.25 40.46 3faq s ASN 181 CO 0.19 -0.09 2.09 0.00 -2.79 0.00 0.00 177.10 176.51 3faq n ALA 182 N 4.83 2.67 -2.41 1.71 0.00 0.42 -0.27 120.51 127.45 3faq n ALA 182 Ca -0.17 -0.21 -0.20 0.00 0.00 0.00 0.00 53.44 52.86 3faq n ALA 182 Cb 0.50 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.39 3faq n ALA 182 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3faq s VAL 183 N -2.00 1.16 0.37 0.00 -7.23 -1.26 -4.36 120.40 107.09 3faq s VAL 183 Ca 0.44 -2.02 -0.26 0.00 -1.81 0.00 0.00 61.98 58.33 3faq s VAL 183 Cb 0.20 -2.63 -0.09 0.00 0.56 0.00 0.00 36.38 34.42 3faq s VAL 183 CO 0.34 -0.12 1.09 0.42 -0.31 0.00 0.00 175.10 176.52 3faq s THR 184 N -3.32 3.54 0.26 5.32 -4.23 -1.26 -4.20 115.64 111.75 3faq s THR 184 Ca 0.34 1.30 0.05 0.00 -1.18 0.00 0.00 61.69 62.19 3faq s THR 184 Cb 0.07 -3.73 -0.01 0.00 1.34 0.00 0.00 72.50 70.18 3faq s THR 184 CO 0.13 0.12 1.62 0.28 -0.54 0.00 0.00 174.62 176.23 3faq h SER 185 N 2.87 0.29 -4.09 3.99 0.02 -1.45 -3.39 113.55 111.79 3faq h SER 185 Ca -0.48 -0.14 -0.52 0.00 -0.84 0.00 0.00 61.79 59.81 3faq h SER 185 Cb 1.22 -0.08 0.09 0.00 0.14 0.00 0.00 62.40 63.77 3faq h SER 185 CO 0.64 0.75 0.46 -0.36 -1.14 0.00 0.00 176.83 177.17 3faq s PHE 186 N -3.96 2.52 -0.96 3.45 0.08 -1.26 -4.75 117.98 113.10 3faq s PHE 186 Ca -0.04 1.53 -0.23 0.00 0.12 0.00 0.00 56.93 58.30 3faq s PHE 186 Cb 0.13 -3.40 0.06 0.00 -0.57 0.00 0.00 43.02 39.23 3faq s PHE 186 CO 0.79 -1.94 1.36 -1.17 -0.10 0.00 0.00 175.22 174.16 3faq s LEU 187 N -3.91 3.78 -0.07 -0.37 0.20 -1.26 -4.73 118.68 112.31 3faq s LEU 187 Ca 0.75 -1.44 0.21 0.00 0.69 0.00 0.00 54.13 54.34 3faq s LEU 187 Cb -0.28 -2.53 0.43 0.00 -0.43 0.00 0.00 46.19 43.38 3faq s LEU 187 CO 0.31 -1.46 1.18 -0.90 -0.29 0.00 0.00 176.35 175.19 3faq n ASP 188 N 8.48 1.24 -2.03 3.68 5.68 -1.26 -4.74 116.55 127.60 3faq n ASP 188 Ca 0.27 -2.57 -0.16 0.00 -0.50 0.00 0.00 54.79 51.83 3faq n ASP 188 Cb 0.50 -0.37 -0.03 0.00 -1.14 0.00 0.00 41.12 40.08 3faq n ASP 188 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3faq n ALA 189 N -0.00 -0.52 0.09 2.12 0.00 -1.26 -4.77 120.51 116.17 3faq n ALA 189 Ca 0.10 0.18 0.04 0.00 0.00 0.00 0.00 53.44 53.76 3faq n ALA 189 Cb 1.01 -1.73 0.18 0.00 0.00 0.00 0.00 19.45 18.91 3faq n ALA 189 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3faq n SER 190 N -1.46 0.16 0.15 0.00 3.41 -1.26 -0.24 113.62 114.38 3faq n SER 190 Ca -0.18 0.57 0.09 0.00 -0.26 0.00 0.00 58.87 59.09 3faq n SER 190 Cb 0.60 -0.59 0.07 0.00 -0.26 0.00 0.00 64.21 64.02 3faq n SER 190 CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 3faq h LEU 191 N 0.00 0.00 0.00 1.04 -0.00 -1.86 -1.44 115.31 113.05 3faq h LEU 191 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 57.88 57.65 3faq h LEU 191 Cb 0.03 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.65 3faq h LEU 191 CO 0.00 0.15 -1.73 0.52 -0.00 0.00 0.00 178.44 177.38 3faq n VAL 192 N -2.98 1.27 0.57 0.15 0.31 0.66 -2.41 118.33 115.90 3faq n VAL 192 Ca 0.01 -0.74 0.06 0.00 -0.01 0.00 0.00 64.34 63.66 3faq n VAL 192 Cb 0.61 -0.72 -0.01 0.00 -0.91 0.00 0.00 33.84 32.81 3faq n VAL 192 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 3faq n TYR 193 N -2.86 0.00 0.00 3.52 4.01 -0.79 -4.03 117.16 117.00 3faq n TYR 193 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 3faq n TYR 193 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.98 3faq n TYR 193 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3faq n GLY 194 N 1.03 -0.78 0.00 2.72 0.00 -0.54 -3.95 105.19 103.68 3faq n GLY 194 Ca 0.05 -1.50 0.08 0.00 0.00 0.00 0.00 46.02 44.66 3faq n GLY 194 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3faq n SER 195 N -0.94 0.88 -4.63 1.61 7.64 -1.26 -4.79 113.62 112.14 3faq n SER 195 Ca 0.00 -0.59 -0.28 0.00 1.01 0.00 0.00 58.87 59.01 3faq n SER 195 Cb 0.00 1.27 -0.09 0.00 -1.01 0.00 0.00 64.21 64.38 3faq n SER 195 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 3faq s GLU 196 N -2.79 2.29 0.00 1.43 2.02 -1.26 -3.51 118.70 116.88 3faq s GLU 196 Ca 0.02 -1.07 0.00 0.00 0.02 0.00 0.00 54.97 53.94 3faq s GLU 196 Cb 0.12 -2.34 0.00 0.00 0.10 0.00 0.00 34.13 32.01 3faq s GLU 196 CO 0.70 0.48 0.21 -2.30 0.02 0.00 0.00 175.26 174.36 3faq n PRO 197 N 0.26 0.28 0.00 0.39 -0.02 -1.26 -0.98 135.00 133.68 3faq n PRO 197 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 3faq n PRO 197 Cb 0.54 -1.25 0.00 0.00 -0.02 0.00 0.00 33.50 32.77 3faq n PRO 197 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3faq n LEU 199 N 0.60 0.00 0.00 2.45 7.94 -1.26 -2.69 117.00 124.04 3faq n LEU 199 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3faq n LEU 199 Cb 0.10 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.06 3faq n LEU 199 CO 0.00 0.00 0.51 0.00 -1.11 0.00 0.00 177.39 176.79 3faq n ALA 200 N 0.00 0.56 -0.11 1.96 0.00 -0.15 -1.33 120.51 121.45 3faq n ALA 200 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 3faq n ALA 200 Cb 0.00 -0.57 -0.06 0.00 0.00 0.00 0.00 19.45 18.82 3faq n ALA 200 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3faq n SER 201 N -1.30 1.93 -0.34 0.00 2.88 -1.10 -4.29 113.62 111.39 3faq n SER 201 Ca -0.00 0.37 0.16 0.00 -1.33 0.00 0.00 58.87 58.06 3faq n SER 201 Cb 0.22 -0.80 0.36 0.00 -0.75 0.00 0.00 64.21 63.24 3faq n SER 201 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 3faq h ARG 202 N -1.00 0.61 0.00 -1.46 2.43 -1.50 0.26 114.38 113.72 3faq h ARG 202 Ca -0.29 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 58.84 3faq h ARG 202 Cb 1.21 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.62 3faq h ARG 202 CO -0.17 0.41 -0.01 -0.07 -1.51 0.00 0.00 179.97 178.61 3faq h LEU 203 N 0.63 0.00-10.22 3.80 4.07 -1.62 -3.45 115.31 108.52 3faq h LEU 203 Ca 0.62 0.00 -0.50 0.00 0.08 0.00 0.00 57.88 58.08 3faq h LEU 203 Cb 1.10 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.86 3faq h LEU 203 CO -0.45 0.01 0.11 -0.13 -1.08 0.00 0.00 178.44 176.91 3faq s ARG 204 N -3.90 3.66 -0.71 1.13 0.52 0.90 0.14 118.95 120.68 3faq s ARG 204 Ca -0.02 0.34 -0.10 0.00 -0.52 0.00 0.00 55.73 55.43 3faq s ARG 204 Cb 0.11 -2.38 0.19 0.00 0.52 0.00 0.00 34.95 33.38 3faq s ARG 204 CO 0.50 -0.12 0.60 1.21 0.02 0.00 0.00 175.30 177.51 3faq s ASN 205 N -3.63 6.10 0.00 0.23 3.84 -1.10 -4.42 114.94 115.96 3faq s ASN 205 Ca 0.49 -2.66 0.17 0.00 0.21 0.00 0.00 52.86 51.07 3faq s ASN 205 Cb -0.10 -2.06 0.49 0.00 -0.55 0.00 0.00 41.25 39.02 3faq s ASN 205 CO 0.38 -0.52 1.39 0.18 -2.79 0.00 0.00 177.10 175.75 3faq n LEU 206 N 3.92 2.38 0.00 3.21 4.77 -1.26 -3.91 117.00 126.11 3faq n LEU 206 Ca 0.09 -1.13 0.06 0.00 -0.03 0.00 0.00 56.01 55.00 3faq n LEU 206 Cb 0.43 -0.25 0.31 0.00 -2.33 0.00 0.00 43.42 41.57 3faq n LEU 206 CO 0.35 0.57 0.66 -1.20 -1.33 0.00 0.00 177.39 176.43 3faq n SER 207 N 0.79 0.00 -3.53 -1.43 7.64 -1.26 -4.75 113.62 111.08 3faq n SER 207 Ca 0.16 0.16 -0.11 0.00 1.01 0.00 0.00 58.87 60.09 3faq n SER 207 Cb 0.40 -0.31 -0.03 0.00 -1.01 0.00 0.00 64.21 63.25 3faq n SER 207 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3faq s SER 208 N -2.63 -0.40 -0.22 6.43 1.04 -1.25 -5.06 113.70 111.61 3faq s SER 208 Ca 0.11 -0.14 0.01 0.00 0.48 0.00 0.00 55.95 56.40 3faq s SER 208 Cb 0.08 0.53 0.23 0.00 0.10 0.00 0.00 66.02 66.96 3faq s SER 208 CO 0.19 -0.90 1.66 -0.81 0.98 0.00 0.00 173.24 174.36 3faq n PRO 209 N -0.26 1.57 0.00 4.02 -0.04 -1.26 -4.16 135.00 134.88 3faq n PRO 209 Ca -0.17 -1.24 0.11 0.00 -0.04 0.00 0.00 63.50 62.16 3faq n PRO 209 Cb 0.64 -1.49 0.08 0.00 -0.04 0.00 0.00 33.50 32.70 3faq n PRO 209 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3faq n LEU 210 N 0.16 2.74 -3.46 1.53 4.77 -1.26 -3.20 117.00 118.28 3faq n LEU 210 Ca 0.24 -0.99 -0.25 0.00 -0.03 0.00 0.00 56.01 54.98 3faq n LEU 210 Cb 0.79 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.90 3faq n LEU 210 CO 0.28 0.47 0.04 0.61 -1.33 0.00 0.00 177.39 177.45 3faq n GLY 211 N 1.21 -0.50 3.96 -0.72 0.00 -1.25 -4.73 105.19 103.16 3faq n GLY 211 Ca 0.12 0.14 -0.24 0.00 0.00 0.00 0.00 46.02 46.05 3faq n GLY 211 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3faq s LEU 212 N -6.85 2.98 0.20 0.99 1.43 -1.26 -3.83 118.68 112.33 3faq s LEU 212 Ca 0.47 0.04 -0.00 0.00 -1.03 0.00 0.00 54.13 53.60 3faq s LEU 212 Cb -0.23 -2.58 -0.04 0.00 0.03 0.00 0.00 46.19 43.36 3faq s LEU 212 CO 0.58 -1.68 0.38 -0.04 0.23 0.00 0.00 176.35 175.82 3faq s MET 213 N -5.15 3.51 0.11 1.70 -1.94 -1.26 -2.71 119.30 113.56 3faq s MET 213 Ca 0.63 -0.36 -0.30 0.00 -1.71 0.00 0.00 55.69 53.95 3faq s MET 213 Cb -0.08 -2.85 -0.07 0.00 2.01 0.00 0.00 34.83 33.85 3faq s MET 213 CO 0.44 0.41 1.17 0.00 -0.01 0.00 0.00 175.02 177.02 3faq s ALA 214 N -1.86 3.39 0.48 3.03 0.00 0.12 -4.54 121.76 122.37 3faq s ALA 214 Ca 0.38 0.85 0.05 0.00 0.00 0.00 0.00 51.96 53.24 3faq s ALA 214 Cb -0.11 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.58 3faq s ALA 214 CO 0.29 -0.36 0.19 0.14 0.00 0.00 0.00 175.76 176.02 3faq s VAL 215 N 0.51 1.81 0.46 0.00 -7.23 -1.26 -4.30 120.40 110.39 3faq s VAL 215 Ca 0.55 -1.73 -0.08 0.00 -1.81 0.00 0.00 61.98 58.91 3faq s VAL 215 Cb -0.30 -2.54 -0.05 0.00 0.56 0.00 0.00 36.38 34.06 3faq s VAL 215 CO 0.32 0.00 0.80 0.21 -0.31 0.00 0.00 175.10 176.12 3faq s ASN 216 N -4.00 6.37 -0.01 4.85 3.84 -1.09 -4.57 114.94 120.34 3faq s ASN 216 Ca 0.30 1.07 0.08 0.00 0.21 0.00 0.00 52.86 54.52 3faq s ASN 216 Cb 0.02 -2.30 -0.11 0.00 -0.55 0.00 0.00 41.25 38.30 3faq s ASN 216 CO 0.17 -0.53 0.24 0.00 -2.79 0.00 0.00 177.10 174.19 3faq n GLN 217 N -1.89 1.71 0.12 0.43 1.13 -1.26 -4.59 117.38 113.03 3faq n GLN 217 Ca 0.02 -0.05 0.11 0.00 -1.94 0.00 0.00 57.00 55.14 3faq n GLN 217 Cb 0.54 -1.09 0.03 0.00 0.11 0.00 0.00 30.24 29.84 3faq n GLN 217 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 3faq h GLU 218 N 0.00 0.00 -2.77 -1.09 3.07 -1.98 -3.47 114.58 108.34 3faq h GLU 218 Ca 0.00 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.74 3faq h GLU 218 Cb 0.31 0.00 -0.24 0.00 -0.84 0.00 0.00 28.75 27.98 3faq h GLU 218 CO 0.00 0.01 -0.24 0.00 -1.40 0.00 0.00 179.01 177.38 3faq s ALA 219 N -3.33 -0.99 0.12 3.43 0.00 -1.26 -5.17 121.76 114.56 3faq s ALA 219 Ca 0.01 1.10 0.09 0.00 0.00 0.00 0.00 51.96 53.15 3faq s ALA 219 Cb 0.09 -0.62 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 3faq s ALA 219 CO 0.77 -0.19 -0.21 -1.58 0.00 0.00 0.00 175.76 174.55 3faq s TRP 220 N 0.14 1.85 -0.77 0.00 0.52 -1.26 -4.58 118.94 114.83 3faq s TRP 220 Ca -0.01 -0.42 -0.04 0.00 0.02 0.00 0.00 56.10 55.65 3faq s TRP 220 Cb -0.03 -0.99 0.19 0.00 -1.15 0.00 0.00 33.47 31.49 3faq s TRP 220 CO 0.01 0.25 0.63 0.34 0.02 0.00 0.00 176.95 178.19 3faq s ASP 221 N -2.07 5.73 -1.38 2.95 2.15 -0.83 -4.76 116.67 118.45 3faq s ASP 221 Ca 0.09 -3.21 -0.02 0.00 0.43 0.00 0.00 52.55 49.84 3faq s ASP 221 Cb -0.09 -1.92 0.01 0.00 -0.30 0.00 0.00 42.92 40.62 3faq s ASP 221 CO 0.05 -0.31 0.58 1.41 -0.17 0.00 0.00 175.17 176.72 3faq n HIS 222 N 3.04 -1.79 -0.27 -5.34 8.25 -1.26 -0.39 115.22 117.45 3faq n HIS 222 Ca 0.14 0.80 0.00 0.00 -0.26 0.00 0.00 57.72 58.40 3faq n HIS 222 Cb 0.38 -3.99 0.00 0.00 1.12 0.00 0.00 29.99 27.50 3faq n HIS 222 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3faq n GLY 223 N -1.78 2.36 3.96 -1.41 0.00 -1.26 -5.00 105.19 102.06 3faq n GLY 223 Ca -0.27 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.52 3faq n GLY 223 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3faq s LEU 224 N 0.00 4.22 0.52 0.99 1.43 0.47 -5.09 118.68 121.22 3faq s LEU 224 Ca 0.00 0.21 -0.17 0.00 -1.03 0.00 0.00 54.13 53.15 3faq s LEU 224 Cb 0.00 -3.02 -0.08 0.00 0.03 0.00 0.00 46.19 43.12 3faq s LEU 224 CO 0.00 -0.13 0.99 0.00 0.23 0.00 0.00 176.35 177.44 3faq s ALA 225 N -2.07 3.03 0.40 4.21 0.00 -1.26 -1.97 121.76 124.11 3faq s ALA 225 Ca 0.36 0.22 0.07 0.00 0.00 0.00 0.00 51.96 52.60 3faq s ALA 225 Cb -0.09 -3.13 -0.08 0.00 0.00 0.00 0.00 23.12 19.82 3faq s ALA 225 CO 0.31 -0.27 0.02 0.71 0.00 0.00 0.00 175.76 176.53 3faq s TYR 226 N -2.58 2.46 0.46 0.00 4.12 -1.26 -4.78 117.35 115.76 3faq s TYR 226 Ca 0.60 -0.70 -0.14 0.00 0.02 0.00 0.00 57.07 56.84 3faq s TYR 226 Cb -0.10 -1.72 -0.07 0.00 -1.52 0.00 0.00 41.96 38.54 3faq s TYR 226 CO 0.31 0.40 0.88 -0.51 0.02 0.00 0.00 175.55 176.65 3faq s LEU 227 N -3.68 3.73 0.79 -1.29 1.43 -1.26 -2.67 118.68 115.73 3faq s LEU 227 Ca 0.35 1.36 -0.12 0.00 -1.03 0.00 0.00 54.13 54.70 3faq s LEU 227 Cb 0.10 -4.27 0.07 0.00 0.03 0.00 0.00 46.19 42.12 3faq s LEU 227 CO 0.18 -0.49 1.12 -2.84 0.23 0.00 0.00 176.35 174.55 3faq s PRO 228 N -3.94 1.99 0.41 1.29 0.02 -1.26 -4.06 135.00 129.45 3faq s PRO 228 Ca 0.55 1.39 -0.09 0.00 0.02 0.00 0.00 61.00 62.87 3faq s PRO 228 Cb -0.10 -1.85 -0.06 0.00 0.02 0.00 0.00 34.50 32.51 3faq s PRO 228 CO 0.31 -1.88 0.76 -0.06 -0.33 0.00 0.00 177.00 175.80 3faq s PHE 229 N -2.62 3.49 -0.13 6.54 0.08 -1.26 0.04 117.98 124.12 3faq s PHE 229 Ca 0.65 0.98 -0.16 0.00 0.12 0.00 0.00 56.93 58.53 3faq s PHE 229 Cb -0.21 -2.40 -0.05 0.00 -0.57 0.00 0.00 43.02 39.80 3faq s PHE 229 CO 0.53 -0.11 0.38 1.21 -0.10 0.00 0.00 175.22 177.12 3faq s ASN 230 N -3.30 6.57 0.25 1.36 3.84 -0.72 -4.52 114.94 118.42 3faq s ASN 230 Ca 0.50 0.68 0.13 0.00 0.21 0.00 0.00 52.86 54.38 3faq s ASN 230 Cb -0.10 -2.23 0.11 0.00 -0.55 0.00 0.00 41.25 38.47 3faq s ASN 230 CO 0.33 0.08 1.45 -0.55 -2.79 0.00 0.00 177.10 175.63 3faq h ASN 231 N 6.48 0.00 -2.27 -4.21 -0.00 -1.97 -3.43 115.58 110.18 3faq h ASN 231 Ca -0.42 0.00 -0.58 0.00 -0.00 0.00 0.00 56.30 55.29 3faq h ASN 231 Cb 1.18 0.00 0.06 0.00 -0.00 0.00 0.00 38.32 39.55 3faq h ASN 231 CO 0.74 0.64 0.81 1.17 -0.00 0.00 0.00 177.43 180.79 3faq n LYS 232 N -3.35 2.16 -3.97 4.14 4.81 -1.26 -4.92 118.16 115.78 3faq n LYS 232 Ca 0.01 0.78 -0.34 0.00 -0.87 0.00 0.00 58.31 57.89 3faq n LYS 232 Cb 0.75 -2.55 -0.15 0.00 0.02 0.00 0.00 35.03 33.10 3faq n LYS 232 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 3faq s LYS 233 N 1.04 3.04 0.00 1.64 1.02 -1.26 -4.48 119.74 120.74 3faq s LYS 233 Ca 0.79 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.95 3faq s LYS 233 Cb -0.68 -2.92 0.00 0.00 -0.52 0.00 0.00 37.83 33.72 3faq s LYS 233 CO 0.38 -0.30 0.00 -2.30 -0.92 0.00 0.00 175.35 172.21 3faq n PRO 234 N 4.70 0.00 -5.20 -1.68 -0.02 -1.26 -5.18 135.00 126.36 3faq n PRO 234 Ca -0.18 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.00 3faq n PRO 234 Cb 0.49 0.00 -0.16 0.00 -0.02 0.00 0.00 33.50 33.81 3faq n PRO 234 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3faq s SER 235 N 0.00 2.85 0.20 2.55 0.15 -1.26 -4.90 113.70 113.28 3faq s SER 235 Ca 0.00 -0.45 0.02 0.00 0.70 0.00 0.00 55.95 56.21 3faq s SER 235 Cb 0.00 -0.47 0.13 0.00 -1.71 0.00 0.00 66.02 63.96 3faq s SER 235 CO 0.00 0.27 1.48 1.55 1.20 0.00 0.00 173.24 177.74 3faq h PRO 236 N 5.73 0.31 0.00 5.44 0.13 -1.95 -2.81 132.00 138.85 3faq h PRO 236 Ca -0.38 -0.24 -0.05 0.00 -0.87 0.00 0.00 66.00 64.45 3faq h PRO 236 Cb 1.14 0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 3faq h PRO 236 CO 0.47 0.88 -0.25 0.00 -0.23 0.00 0.00 178.00 178.87 3faq h GLU 238 N 0.00 0.60 -0.73 0.00 5.08 -1.62 -3.34 114.58 114.57 3faq h GLU 238 Ca -0.00 -0.63 0.06 0.00 -1.00 0.00 0.00 59.36 57.79 3faq h GLU 238 Cb 0.62 0.17 -0.06 0.00 0.50 0.00 0.00 28.75 29.99 3faq h GLU 238 CO 0.03 1.24 0.42 0.35 -1.00 0.00 0.00 179.01 180.05 3faq h PHE 239 N 0.22 0.76 0.00 4.33 3.57 -1.15 -2.59 116.94 122.08 3faq h PHE 239 Ca -0.10 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.42 3faq h PHE 239 Cb 1.52 -0.24 0.00 0.00 2.79 0.00 0.00 35.95 40.03 3faq h PHE 239 CO 0.12 0.36 0.00 0.44 -2.23 0.00 0.00 178.31 177.00 3faq n ILE 240 N -4.75 0.57 -2.80 1.41 -6.64 -1.09 -4.03 119.36 102.03 3faq n ILE 240 Ca 0.10 0.14 -0.01 0.00 -1.77 0.00 0.00 62.75 61.21 3faq n ILE 240 Cb 0.19 -1.01 0.01 0.00 -1.44 0.00 0.00 39.64 37.39 3faq n ILE 240 CO 0.00 0.00 0.00 0.21 -1.77 0.00 0.00 176.55 174.99 3faq s ASN 241 N -2.39 -0.66 0.00 7.28 3.84 -0.99 -5.03 114.94 116.99 3faq s ASN 241 Ca 0.09 -0.55 0.12 0.00 0.21 0.00 0.00 52.86 52.73 3faq s ASN 241 Cb 0.06 0.86 0.71 0.00 -0.55 0.00 0.00 41.25 42.33 3faq s ASN 241 CO 0.11 -0.05 1.14 0.35 -2.79 0.00 0.00 177.10 175.86 3faq n THR 242 N 3.33 0.00 -0.05 -5.21 -2.24 -1.14 -2.46 114.28 106.50 3faq n THR 242 Ca 0.10 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.78 3faq n THR 242 Cb 0.62 -0.78 -0.15 0.00 -2.10 0.00 0.00 70.33 67.93 3faq n THR 242 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3faq n THR 243 N -0.97 1.54 0.05 4.28 -1.04 -1.26 -4.32 114.28 112.56 3faq n THR 243 Ca 0.09 -0.80 -0.00 0.00 -2.04 0.00 0.00 64.05 61.30 3faq n THR 243 Cb 0.04 -0.91 -0.06 0.00 -1.82 0.00 0.00 70.33 67.58 3faq n THR 243 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3faq h ALA 244 N 0.87 0.65 -6.69 2.41 0.00 -1.84 -3.49 119.26 111.17 3faq h ALA 244 Ca -0.41 -0.80 -0.52 0.00 0.00 0.00 0.00 54.91 53.19 3faq h ALA 244 Cb 2.09 0.19 0.01 0.00 0.00 0.00 0.00 17.79 20.08 3faq h ALA 244 CO 0.05 0.91 -0.98 0.54 0.00 0.00 0.00 179.25 179.77 3faq n ARG 245 N -3.00 -0.79 -4.02 0.00 1.74 -1.16 -4.96 116.66 104.46 3faq n ARG 245 Ca -0.07 0.37 -0.33 0.00 -0.77 0.00 0.00 57.85 57.05 3faq n ARG 245 Cb 0.84 -2.89 -0.15 0.00 -1.02 0.00 0.00 32.46 29.24 3faq n ARG 245 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3faq s VAL 246 N -3.36 2.44 1.08 1.55 1.01 -1.26 -5.03 120.40 116.83 3faq s VAL 246 Ca 0.35 -1.43 -0.13 0.00 0.00 0.00 0.00 61.98 60.78 3faq s VAL 246 Cb -0.17 -2.36 0.24 0.00 0.00 0.00 0.00 36.38 34.08 3faq s VAL 246 CO 0.92 0.04 1.06 -2.16 0.00 0.00 0.00 175.10 174.97 3faq s PRO 247 N 1.19 -0.24 0.77 2.72 0.04 -1.26 -3.65 135.00 134.58 3faq s PRO 247 Ca -0.05 0.67 -0.11 0.00 0.04 0.00 0.00 61.00 61.54 3faq s PRO 247 Cb -0.19 -1.65 0.05 0.00 0.04 0.00 0.00 34.50 32.76 3faq s PRO 247 CO -0.05 -3.22 1.09 0.00 0.04 0.00 0.00 177.00 174.86 3faq s PHE 249 N -3.15 3.32 -0.22 0.00 0.08 -1.26 -1.75 117.98 114.99 3faq s PHE 249 Ca 0.60 1.52 -0.09 0.00 0.12 0.00 0.00 56.93 59.07 3faq s PHE 249 Cb -0.14 -2.86 -0.04 0.00 -0.57 0.00 0.00 43.02 39.41 3faq s PHE 249 CO 0.54 -0.44 0.12 -1.17 -0.10 0.00 0.00 175.22 174.17 3faq s LEU 250 N -3.86 3.95 0.35 -0.37 2.96 0.11 -4.62 118.68 117.20 3faq s LEU 250 Ca 0.61 0.07 -0.08 0.00 -0.22 0.00 0.00 54.13 54.51 3faq s LEU 250 Cb -0.11 -2.04 0.02 0.00 0.50 0.00 0.00 46.19 44.56 3faq s LEU 250 CO 0.27 0.09 0.58 0.00 -1.32 0.00 0.00 176.35 175.96 3faq s ALA 251 N 0.90 0.20 0.55 5.97 0.00 -1.26 -4.22 121.76 123.90 3faq s ALA 251 Ca 0.06 -1.22 0.24 0.00 0.00 0.00 0.00 51.96 51.05 3faq s ALA 251 Cb -0.13 1.00 1.59 0.00 0.00 0.00 0.00 23.12 25.57 3faq s ALA 251 CO 0.03 -0.86 2.20 0.78 0.00 0.00 0.00 175.76 177.91 3faq h GLY 252 N 2.08 0.00 -4.82 0.00 0.00 -1.65 -3.41 103.07 95.27 3faq h GLY 252 Ca -0.29 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.35 3faq h GLY 252 CO 0.39 0.00 -0.86 -0.35 0.00 0.00 0.00 176.54 175.72 3faq s ASP 253 N -6.51 3.31 0.47 0.19 2.15 -1.01 -3.79 116.67 111.49 3faq s ASP 253 Ca -0.05 -0.42 0.31 0.00 0.43 0.00 0.00 52.55 52.83 3faq s ASP 253 Cb 0.16 -0.65 1.34 0.00 -0.30 0.00 0.00 42.92 43.46 3faq s ASP 253 CO 0.60 0.30 1.93 -0.26 -0.17 0.00 0.00 175.17 177.56 3faq h PHE 254 N 5.68 0.00 -0.05 -5.34 0.04 -1.94 -3.11 116.94 112.23 3faq h PHE 254 Ca -0.40 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.37 3faq h PHE 254 Cb 1.15 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.30 3faq h PHE 254 CO 0.43 0.00 0.00 0.54 -0.60 0.00 0.00 178.31 178.68 3faq n ARG 255 N -2.83 1.46 -0.30 1.51 1.74 -1.26 -4.49 116.66 112.49 3faq n ARG 255 Ca 0.01 -0.68 0.13 0.00 -0.77 0.00 0.00 57.85 56.54 3faq n ARG 255 Cb 0.26 -1.44 0.28 0.00 -1.02 0.00 0.00 32.46 30.54 3faq n ARG 255 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3faq h ALA 256 N 4.11 1.26 -0.22 7.54 0.00 -1.91 -1.17 119.26 128.88 3faq h ALA 256 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3faq h ALA 256 Cb 0.33 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3faq h ALA 256 CO 0.00 -0.47 0.00 0.43 0.00 0.00 0.00 179.25 179.21 3faq n SER 257 N -5.23 1.83 0.11 0.00 7.64 -1.26 -2.55 113.62 114.15 3faq n SER 257 Ca 0.21 -2.13 0.15 0.00 1.01 0.00 0.00 58.87 58.10 3faq n SER 257 Cb 0.68 -0.33 0.66 0.00 -1.01 0.00 0.00 64.21 64.20 3faq n SER 257 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 3faq h GLU 258 N 1.36 0.02 -1.66 1.43 4.22 -1.54 -2.61 114.58 115.80 3faq h GLU 258 Ca 0.00 -0.00 0.09 0.00 0.08 0.00 0.00 59.36 59.53 3faq h GLU 258 Cb 0.61 -0.00 -0.24 0.00 0.50 0.00 0.00 28.75 29.61 3faq h GLU 258 CO 0.07 0.01 0.20 -1.14 -2.18 0.00 0.00 179.01 175.97 3faq s GLN 259 N -5.06 0.49 0.47 1.92 -0.44 -1.26 -1.10 119.66 114.68 3faq s GLN 259 Ca -0.05 0.92 0.37 0.00 -2.50 0.00 0.00 55.36 54.10 3faq s GLN 259 Cb 0.19 0.22 1.55 0.00 -1.64 0.00 0.00 33.01 33.33 3faq s GLN 259 CO 0.71 -0.12 1.58 0.97 0.50 0.00 0.00 175.29 178.93 3faq h ILE 260 N 5.16 0.01 0.00 -2.34 2.10 -1.62 1.34 117.51 122.17 3faq h ILE 260 Ca -0.26 -0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.68 3faq h ILE 260 Cb 1.19 0.00 0.00 0.00 -1.09 0.00 0.00 36.82 36.92 3faq h ILE 260 CO 0.16 0.00 -0.05 -0.11 -1.08 0.00 0.00 178.15 177.08 3faq n LEU 261 N -4.55 0.26 -0.09 2.19 7.94 -1.26 -2.51 117.00 118.98 3faq n LEU 261 Ca 0.41 0.48 -0.12 0.00 -1.11 0.00 0.00 56.01 55.68 3faq n LEU 261 Cb 1.67 -0.43 -0.15 0.00 0.53 0.00 0.00 43.42 45.04 3faq n LEU 261 CO 0.24 -0.04 -1.06 -0.11 -1.11 0.00 0.00 177.39 175.31 3faq n LEU 262 N -1.71 0.79 0.10 -1.96 7.94 0.46 -3.85 117.00 118.77 3faq n LEU 262 Ca 0.06 0.06 -0.04 0.00 -1.11 0.00 0.00 56.01 54.99 3faq n LEU 262 Cb 0.37 0.12 0.13 0.00 0.53 0.00 0.00 43.42 44.57 3faq n LEU 262 CO 0.29 0.57 0.47 0.00 -1.11 0.00 0.00 177.39 177.61 3faq h ALA 263 N 0.78 0.88 0.07 1.96 0.00 -1.17 -2.91 119.26 118.88 3faq h ALA 263 Ca -0.50 -0.56 -0.00 0.00 0.00 0.00 0.00 54.91 53.85 3faq h ALA 263 Cb 2.14 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.84 3faq h ALA 263 CO 0.02 0.75 -0.03 1.15 0.00 0.00 0.00 179.25 181.14 3faq h THR 264 N 0.11 1.09 -0.06 0.00 2.02 -1.65 -2.47 112.91 111.96 3faq h THR 264 Ca -0.01 -0.58 0.02 0.00 0.77 0.00 0.00 66.41 66.61 3faq h THR 264 Cb 1.12 1.47 -0.00 0.00 -1.74 0.00 0.00 68.15 69.00 3faq h THR 264 CO 0.09 0.14 0.05 0.00 0.37 0.00 0.00 175.52 176.17 3faq h ALA 265 N 0.55 1.94 -0.37 6.16 0.00 -1.66 0.67 119.26 126.54 3faq h ALA 265 Ca -0.01 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3faq h ALA 265 Cb 0.31 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3faq h ALA 265 CO 0.02 -0.08 -0.05 0.45 0.00 0.00 0.00 179.25 179.59 3faq h HIS 266 N 0.00 0.77 -0.75 0.00 3.86 -1.30 -2.78 115.15 114.95 3faq h HIS 266 Ca 0.03 -0.15 0.07 0.00 -1.16 0.00 0.00 60.37 59.16 3faq h HIS 266 Cb 0.12 -0.19 -0.06 0.00 1.06 0.00 0.00 27.41 28.33 3faq h HIS 266 CO 0.00 0.82 0.43 1.15 0.86 0.00 0.00 177.93 181.19 3faq h THR 267 N 0.50 0.96 -0.56 2.45 2.02 -0.42 -1.06 112.91 116.80 3faq h THR 267 Ca 0.10 -0.26 0.01 0.00 0.77 0.00 0.00 66.41 67.02 3faq h THR 267 Cb 0.55 0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 3faq h THR 267 CO 0.03 0.14 0.37 -0.07 0.37 0.00 0.00 175.52 176.36 3faq h LEU 268 N 0.77 0.64 -1.01 2.58 4.07 -1.28 -1.54 115.31 119.53 3faq h LEU 268 Ca 0.34 -0.02 -0.09 0.00 0.08 0.00 0.00 57.88 58.20 3faq h LEU 268 Cb 0.24 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 41.81 3faq h LEU 268 CO -0.20 0.46 -0.28 -0.07 -1.08 0.00 0.00 178.44 177.27 3faq h LEU 269 N 0.76 0.36 -0.12 1.67 3.38 -1.04 -0.89 115.31 119.44 3faq h LEU 269 Ca 0.20 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3faq h LEU 269 Cb -0.09 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 3faq h LEU 269 CO -0.04 0.64 -0.06 0.25 0.09 0.00 0.00 178.44 179.32 3faq h LEU 270 N 0.32 0.26 -1.08 1.67 5.85 -1.01 -2.51 115.31 118.80 3faq h LEU 270 Ca 0.05 -0.42 0.08 0.00 0.84 0.00 0.00 57.88 58.42 3faq h LEU 270 Cb 0.67 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.56 3faq h LEU 270 CO 0.05 0.62 0.62 0.03 -0.34 0.00 0.00 178.44 179.42 3faq h ARG 271 N -0.10 1.03 -0.20 1.25 3.08 -1.08 -1.19 114.38 117.16 3faq h ARG 271 Ca 0.03 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 59.91 3faq h ARG 271 Cb 0.53 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 3faq h ARG 271 CO 0.02 0.68 -0.32 1.49 -1.07 0.00 0.00 179.97 180.77 3faq h GLU 272 N 1.06 0.41 0.59 0.04 4.57 -1.06 0.62 114.58 120.80 3faq h GLU 272 Ca 0.43 -0.17 -0.03 0.00 -1.18 0.00 0.00 59.36 58.41 3faq h GLU 272 Cb 0.26 -0.02 0.01 0.00 -0.16 0.00 0.00 28.75 28.84 3faq h GLU 272 CO -0.18 0.68 -0.28 1.25 -1.18 0.00 0.00 179.01 179.31 3faq h HIS 273 N 0.35 -0.73 -0.86 0.92 2.76 -0.80 0.70 115.15 117.50 3faq h HIS 273 Ca 0.04 -0.02 0.17 0.00 -2.20 0.00 0.00 60.37 58.37 3faq h HIS 273 Cb 0.74 0.24 -0.06 0.00 1.55 0.00 0.00 27.41 29.88 3faq h HIS 273 CO 0.02 -0.40 0.56 -0.91 -1.30 0.00 0.00 177.93 175.90 3faq h ASN 274 N -1.09 0.48 -0.07 3.26 4.21 -1.34 -0.26 115.58 120.78 3faq h ASN 274 Ca -0.08 0.04 -0.02 0.00 1.21 0.00 0.00 56.30 57.44 3faq h ASN 274 Cb 0.66 -0.05 -0.00 0.00 -1.12 0.00 0.00 38.32 37.80 3faq h ASN 274 CO 0.13 0.22 -0.04 -0.09 -1.29 0.00 0.00 177.43 176.36 3faq h ARG 275 N 0.49 0.16 -0.91 0.81 2.43 -0.71 -2.86 114.38 113.80 3faq h ARG 275 Ca 0.44 -0.07 0.03 0.00 -0.81 0.00 0.00 59.98 59.57 3faq h ARG 275 Cb 0.94 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.44 3faq h ARG 275 CO -0.17 0.55 0.59 -0.07 -1.51 0.00 0.00 179.97 179.35 3faq h LEU 276 N -0.23 0.98 -1.45 3.80 -0.00 0.04 -2.31 115.31 116.14 3faq h LEU 276 Ca 0.02 -0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.86 3faq h LEU 276 Cb 0.50 -0.22 -0.02 0.00 -0.00 0.00 0.00 40.66 40.92 3faq h LEU 276 CO 0.01 0.67 0.11 0.00 -0.00 0.00 0.00 178.44 179.23 3faq h ALA 277 N 1.37 1.57 0.08 1.53 0.00 -1.04 -1.52 119.26 121.25 3faq h ALA 277 Ca 0.36 -0.12 -0.31 0.00 0.00 0.00 0.00 54.91 54.85 3faq h ALA 277 Cb -0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3faq h ALA 277 CO -0.12 0.33 -1.63 0.07 0.00 0.00 0.00 179.25 177.90 3faq h ARG 278 N 0.47 0.17 -0.31 0.00 0.11 -1.26 -2.39 114.38 111.16 3faq h ARG 278 Ca 0.11 -0.29 -0.01 0.00 0.10 0.00 0.00 59.98 59.90 3faq h ARG 278 Cb 0.14 0.11 -0.02 0.00 1.11 0.00 0.00 29.97 31.31 3faq h ARG 278 CO -0.01 0.96 0.16 0.93 0.10 0.00 0.00 179.97 182.11 3faq h GLU 279 N 0.05 0.42 -0.07 0.08 4.39 -1.29 -1.75 114.58 116.41 3faq h GLU 279 Ca -0.27 -0.04 -0.15 0.00 0.34 0.00 0.00 59.36 59.24 3faq h GLU 279 Cb 2.00 -0.09 0.01 0.00 -0.10 0.00 0.00 28.75 30.57 3faq h GLU 279 CO 0.12 0.32 -0.54 -0.07 -1.16 0.00 0.00 179.01 177.68 3faq h LEU 280 N 0.43 0.60 -0.98 1.33 3.38 -1.31 -3.14 115.31 115.61 3faq h LEU 280 Ca 0.11 -0.68 0.01 0.00 0.09 0.00 0.00 57.88 57.42 3faq h LEU 280 Cb 0.02 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.55 3faq h LEU 280 CO -0.02 1.18 0.65 0.50 0.09 0.00 0.00 178.44 180.84 3faq h LYS 281 N 0.06 1.29 0.00 1.13 1.63 -1.16 0.05 116.57 119.56 3faq h LYS 281 Ca -0.05 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.68 3faq h LYS 281 Cb 1.20 -0.29 0.00 0.00 -0.60 0.00 0.00 32.23 32.54 3faq h LYS 281 CO 0.11 0.85 0.00 1.17 -3.45 0.00 0.00 179.45 178.13 3faq n LYS 282 N -4.40 0.14 0.00 1.90 4.81 -0.68 -1.90 118.16 118.04 3faq n LYS 282 Ca 0.12 0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.75 3faq n LYS 282 Cb 0.01 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.56 3faq n LYS 282 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 3faq n LEU 283 N -1.33 0.00 -3.18 3.14 0.00 -0.73 -4.82 117.00 110.09 3faq n LEU 283 Ca 0.05 -0.17 -0.21 0.00 0.00 0.00 0.00 56.01 55.68 3faq n LEU 283 Cb 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 43.42 43.49 3faq n LEU 283 CO 0.10 0.00 -0.20 0.59 0.00 0.00 0.00 177.39 177.88 3faq n ASN 284 N -1.22 1.14 -0.38 1.96 5.03 -0.07 -4.58 115.26 117.14 3faq n ASN 284 Ca 0.00 -3.01 0.31 0.00 0.87 0.00 0.00 54.58 52.76 3faq n ASN 284 Cb 0.00 -0.62 0.58 0.00 -1.02 0.00 0.00 39.78 38.72 3faq n ASN 284 CO 0.00 0.00 0.00 -0.65 -1.83 0.00 0.00 177.26 174.78 3faq h PRO 285 N 3.34 0.15 0.00 3.52 0.11 -1.63 0.79 132.00 138.28 3faq h PRO 285 Ca 0.10 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.20 3faq h PRO 285 Cb 0.88 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.96 3faq h PRO 285 CO 0.54 0.10 -0.02 1.12 -0.21 0.00 0.00 178.00 179.52 3faq h HIS 286 N 0.16 0.00 -3.91 0.65 2.07 -1.94 -3.46 115.15 108.71 3faq h HIS 286 Ca 0.79 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 57.78 3faq h HIS 286 Cb 2.19 0.00 0.09 0.00 2.57 0.00 0.00 27.41 32.26 3faq h HIS 286 CO -0.01 0.02 0.72 -1.58 -3.07 0.00 0.00 177.93 174.02 3faq s TRP 287 N -3.60 2.79 0.70 6.12 0.51 0.27 -5.02 118.94 120.71 3faq s TRP 287 Ca 0.02 1.27 -0.03 0.00 -2.12 0.00 0.00 56.10 55.24 3faq s TRP 287 Cb 0.08 -3.88 0.10 0.00 -0.81 0.00 0.00 33.47 28.96 3faq s TRP 287 CO 0.57 -2.51 0.98 0.54 -0.51 0.00 0.00 176.95 176.03 3faq s ASN 288 N -0.28 4.56 0.18 2.95 2.20 -1.26 -4.89 114.94 118.39 3faq s ASN 288 Ca 0.51 0.00 -0.13 0.00 -0.94 0.00 0.00 52.86 52.31 3faq s ASN 288 Cb -0.44 -0.54 0.18 0.00 -2.00 0.00 0.00 41.25 38.46 3faq s ASN 288 CO 0.59 -1.72 1.73 1.23 -2.94 0.00 0.00 177.10 175.99 3faq h GLY 289 N -0.53 0.62 1.13 0.45 0.00 -1.90 -1.70 103.07 101.14 3faq h GLY 289 Ca -0.41 -0.06 0.05 0.00 0.00 0.00 0.00 47.33 46.92 3faq h GLY 289 CO 0.48 -0.03 0.45 -2.09 0.00 0.00 0.00 176.54 175.35 3faq h GLU 290 N 0.28 0.73 -0.08 4.80 4.57 -1.95 -0.84 114.58 122.10 3faq h GLU 290 Ca 0.24 -0.04 -0.23 0.00 -1.18 0.00 0.00 59.36 58.15 3faq h GLU 290 Cb 0.30 -0.17 0.01 0.00 -0.16 0.00 0.00 28.75 28.73 3faq h GLU 290 CO -0.28 0.48 -0.86 -0.22 -1.18 0.00 0.00 179.01 176.95 3faq h LYS 291 N 0.75 0.64 -0.49 1.92 1.63 -1.72 -0.43 116.57 118.87 3faq h LYS 291 Ca 0.29 -0.58 -0.10 0.00 -0.85 0.00 0.00 60.65 59.41 3faq h LYS 291 Cb 0.19 0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.94 3faq h LYS 291 CO -0.09 1.19 -0.08 -0.07 -3.45 0.00 0.00 179.45 176.95 3faq h LEU 292 N 0.41 0.88 0.51 5.20 -0.00 -1.00 -1.12 115.31 120.19 3faq h LEU 292 Ca -0.07 -0.26 -0.03 0.00 -0.00 0.00 0.00 57.88 57.52 3faq h LEU 292 Cb 1.48 -0.24 0.01 0.00 -0.00 0.00 0.00 40.66 41.91 3faq h LEU 292 CO 0.16 0.99 -0.25 0.22 -0.00 0.00 0.00 178.44 179.57 3faq h TYR 293 N 0.81 -0.64 -0.87 1.13 3.20 -1.06 -1.60 116.97 117.94 3faq h TYR 293 Ca 0.14 -0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.08 3faq h TYR 293 Cb 0.59 0.21 -0.06 0.00 1.54 0.00 0.00 36.73 39.01 3faq h TYR 293 CO 0.03 -0.40 0.57 1.96 -1.64 0.00 0.00 178.16 178.69 3faq h GLN 294 N -0.75 0.88 -0.09 1.82 1.08 -1.10 -0.24 115.11 116.71 3faq h GLN 294 Ca -0.07 -0.05 -0.19 0.00 -1.45 0.00 0.00 58.65 56.89 3faq h GLN 294 Cb 0.53 -0.20 -0.00 0.00 -0.05 0.00 0.00 27.48 27.76 3faq h GLN 294 CO 0.12 0.58 -0.74 0.93 -0.95 0.00 0.00 178.83 178.77 3faq h GLU 295 N 0.91 0.48 -0.28 1.46 4.39 -1.25 -0.57 114.58 119.71 3faq h GLU 295 Ca 0.39 -0.39 -0.18 0.00 0.34 0.00 0.00 59.36 59.52 3faq h GLU 295 Cb 0.33 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 3faq h GLU 295 CO -0.16 1.02 -0.52 0.00 -1.16 0.00 0.00 179.01 178.20 3faq h ALA 296 N 0.87 0.45 -0.07 3.43 0.00 -0.91 -2.57 119.26 120.45 3faq h ALA 296 Ca -0.03 -0.50 -0.05 0.00 0.00 0.00 0.00 54.91 54.32 3faq h ALA 296 Cb 1.33 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 3faq h ALA 296 CO 0.13 0.64 -0.20 -0.09 0.00 0.00 0.00 179.25 179.74 3faq h ARG 297 N 0.63 0.11 0.00 0.00 2.43 -0.98 -1.42 114.38 115.15 3faq h ARG 297 Ca 0.02 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.06 3faq h ARG 297 Cb 1.12 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.65 3faq h ARG 297 CO 0.12 0.30 -0.50 -0.22 -1.51 0.00 0.00 179.97 178.16 3faq h LYS 298 N 0.10 0.00 0.00 0.20 3.64 -1.01 -2.93 116.57 116.58 3faq h LYS 298 Ca 0.02 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.25 3faq h LYS 298 Cb 0.41 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.24 3faq h LYS 298 CO 0.03 0.50 -0.58 0.82 -2.27 0.00 0.00 179.45 177.95 3faq h ILE 299 N 0.00 1.44 -0.06 2.00 2.04 -0.92 -3.00 117.51 119.01 3faq h ILE 299 Ca -0.00 -2.08 -0.04 0.00 1.00 0.00 0.00 64.86 63.73 3faq h ILE 299 Cb 1.24 2.63 -0.01 0.00 -0.74 0.00 0.00 36.82 39.95 3faq h ILE 299 CO 0.06 0.60 -0.14 0.25 0.00 0.00 0.00 178.15 178.93 3faq h LEU 300 N -0.15 0.08 -0.43 1.44 5.85 -1.33 -1.19 115.31 119.58 3faq h LEU 300 Ca -0.07 -0.01 -0.16 0.00 0.84 0.00 0.00 57.88 58.47 3faq h LEU 300 Cb 1.30 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 3faq h LEU 300 CO 0.11 0.23 -0.45 1.23 -0.34 0.00 0.00 178.44 179.23 3faq h GLY 301 N 0.56 0.90 1.01 3.75 0.00 -1.57 -1.30 103.07 106.42 3faq h GLY 301 Ca 0.02 -0.96 0.00 0.00 0.00 0.00 0.00 47.33 46.39 3faq h GLY 301 CO 0.02 0.86 0.56 0.00 0.00 0.00 0.00 176.54 177.99 3faq h ALA 302 N 0.83 1.14 0.45 3.60 0.00 -1.19 -2.53 119.26 121.57 3faq h ALA 302 Ca 0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3faq h ALA 302 Cb 1.02 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3faq h ALA 302 CO 0.10 0.57 -0.32 0.35 0.00 0.00 0.00 179.25 179.95 3faq h PHE 303 N 1.22 -0.88 -0.96 0.00 3.57 -0.83 -1.45 116.94 117.61 3faq h PHE 303 Ca 0.32 -0.00 0.22 0.00 3.53 0.00 0.00 57.97 62.04 3faq h PHE 303 Cb -0.09 0.32 -0.12 0.00 2.79 0.00 0.00 35.95 38.85 3faq h PHE 303 CO -0.00 -0.46 0.53 0.82 -2.23 0.00 0.00 178.31 176.96 3faq h ILE 304 N -0.74 0.56 -0.22 1.41 1.08 -1.13 -0.44 117.51 118.02 3faq h ILE 304 Ca -0.06 -0.19 -0.15 0.00 -0.39 0.00 0.00 64.86 64.07 3faq h ILE 304 Cb 0.61 -0.05 -0.01 0.00 -3.07 0.00 0.00 36.82 34.30 3faq h ILE 304 CO 0.03 0.10 -0.50 1.56 -0.69 0.00 0.00 178.15 178.66 3faq h GLN 305 N 0.56 0.60 -0.16 2.37 4.20 -1.33 -2.58 115.11 118.76 3faq h GLN 305 Ca 0.60 -0.35 -0.07 0.00 0.06 0.00 0.00 58.65 58.88 3faq h GLN 305 Cb 1.09 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.90 3faq h GLN 305 CO -0.47 0.96 -0.19 0.82 -0.67 0.00 0.00 178.83 179.28 3faq h ILE 306 N 0.48 1.35 -0.56 2.54 2.04 0.02 -0.84 117.51 122.53 3faq h ILE 306 Ca 0.02 -1.37 -0.11 0.00 1.00 0.00 0.00 64.86 64.40 3faq h ILE 306 Cb 1.03 1.87 -0.02 0.00 -0.74 0.00 0.00 36.82 38.96 3faq h ILE 306 CO 0.10 0.41 -0.06 0.40 0.00 0.00 0.00 178.15 179.00 3faq h ILE 307 N 0.05 1.27 0.20 -0.67 1.08 -1.49 0.30 117.51 118.24 3faq h ILE 307 Ca 0.02 -1.21 -0.01 0.00 -0.39 0.00 0.00 64.86 63.27 3faq h ILE 307 Cb 0.74 0.91 0.00 0.00 -3.07 0.00 0.00 36.82 35.40 3faq h ILE 307 CO 0.05 0.43 -0.10 0.74 -0.69 0.00 0.00 178.15 178.58 3faq h THR 308 N 0.91 0.86 0.01 -0.27 2.02 -1.46 0.22 112.91 115.20 3faq h THR 308 Ca 0.15 -0.27 -0.22 0.00 0.77 0.00 0.00 66.41 66.84 3faq h THR 308 Cb 0.62 1.02 -0.03 0.00 -1.74 0.00 0.00 68.15 68.03 3faq h THR 308 CO 0.04 0.06 -1.07 -0.26 0.37 0.00 0.00 175.52 174.66 3faq h PHE 309 N -0.40 0.02 0.09 3.16 -1.00 -1.13 0.14 116.94 117.82 3faq h PHE 309 Ca -0.03 -0.01 -0.30 0.00 2.81 0.00 0.00 57.97 60.44 3faq h PHE 309 Cb 0.31 -0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.85 3faq h PHE 309 CO -0.02 1.01 -1.60 -0.09 -1.61 0.00 0.00 178.31 175.99 3faq h ARG 310 N 0.00 0.19 0.00 1.51 2.43 -0.47 -3.40 114.38 114.64 3faq h ARG 310 Ca -0.04 -0.32 -0.34 0.00 -0.81 0.00 0.00 59.98 58.47 3faq h ARG 310 Cb 1.80 0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 31.41 3faq h ARG 310 CO 0.13 1.15 -2.29 -0.25 -1.51 0.00 0.00 179.97 177.20 3faq n ASP 311 N -3.89 2.06 0.00 -3.80 8.00 -0.13 -4.62 116.55 114.18 3faq n ASP 311 Ca -0.30 -0.11 -0.01 0.00 0.71 0.00 0.00 54.79 55.08 3faq n ASP 311 Cb 0.90 -0.22 -0.00 0.00 -0.02 0.00 0.00 41.12 41.77 3faq n ASP 311 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3faq h TYR 312 N 0.00 -0.06 -0.76 1.24 3.20 -0.57 -3.39 116.97 116.63 3faq h TYR 312 Ca -0.51 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 61.50 3faq h TYR 312 Cb 1.82 0.02 -0.09 0.00 1.54 0.00 0.00 36.73 40.02 3faq h TYR 312 CO 0.02 -0.04 0.33 -0.07 -1.64 0.00 0.00 178.16 176.76 3faq h LEU 313 N -0.57 0.35 -2.31 2.82 3.38 -0.96 -1.19 115.31 116.83 3faq h LEU 313 Ca -0.01 0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.08 3faq h LEU 313 Cb 0.05 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3faq h LEU 313 CO 0.01 0.15 0.23 -0.65 0.09 0.00 0.00 178.44 178.27 3faq h PRO 314 N 0.50 0.00 -0.12 1.13 0.11 -1.77 -1.09 132.00 130.75 3faq h PRO 314 Ca 0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.52 3faq h PRO 314 Cb 0.59 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.70 3faq h PRO 314 CO -0.37 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 177.86 3faq n ILE 315 N -3.14 0.18 -0.11 4.15 -5.35 -0.46 -2.48 119.36 112.14 3faq n ILE 315 Ca -0.01 -0.59 -0.20 0.00 -0.27 0.00 0.00 62.75 61.68 3faq n ILE 315 Cb 0.30 1.23 -0.07 0.00 -1.74 0.00 0.00 39.64 39.37 3faq n ILE 315 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 3faq n VAL 316 N 1.08 1.51 0.11 7.28 0.31 -0.49 -3.87 118.33 124.27 3faq n VAL 316 Ca 0.12 -0.13 -0.03 0.00 -0.01 0.00 0.00 64.34 64.30 3faq n VAL 316 Cb 0.48 -2.10 0.15 0.00 -0.91 0.00 0.00 33.84 31.46 3faq n VAL 316 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3faq h LEU 317 N -1.00 0.12 0.00 7.52 4.07 -1.57 0.45 115.31 124.90 3faq h LEU 317 Ca -0.37 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.52 3faq h LEU 317 Cb 1.29 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 43.00 3faq h LEU 317 CO -0.23 0.71 0.00 0.61 -1.08 0.00 0.00 178.44 178.45 3faq n GLY 318 N 0.27 3.25 0.22 0.83 0.00 -1.03 -0.97 105.19 107.75 3faq n GLY 318 Ca -0.02 -0.10 0.15 0.00 0.00 0.00 0.00 46.02 46.05 3faq n GLY 318 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3faq h SER 319 N 0.93 0.00 1.33 1.61 4.64 -1.57 -0.81 113.55 119.68 3faq h SER 319 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3faq h SER 319 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3faq h SER 319 CO 0.00 0.00 -0.13 -0.62 -0.87 0.00 0.00 176.83 175.21 3faq n GLU 320 N -2.52 0.26 -0.28 4.77 -0.58 -0.14 -4.33 120.64 117.80 3faq n GLU 320 Ca -0.02 0.18 0.05 0.00 -0.42 0.00 0.00 57.16 56.95 3faq n GLU 320 Cb 0.06 -1.77 0.15 0.00 -0.57 0.00 0.00 31.44 29.31 3faq n GLU 320 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 3faq h MET 321 N 0.00 0.04 -0.00 3.49 4.05 -1.23 -1.47 114.93 119.80 3faq h MET 321 Ca 0.00 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 3faq h MET 321 Cb 0.73 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.52 3faq h MET 321 CO 0.00 0.02 -0.06 0.00 0.23 0.00 0.00 176.91 177.10 3faq n GLN 322 N -5.46 0.92 0.02 0.39 10.64 -1.26 -1.43 117.38 121.20 3faq n GLN 322 Ca 0.14 -0.30 -0.12 0.00 -1.83 0.00 0.00 57.00 54.90 3faq n GLN 322 Cb 0.48 -1.49 -0.14 0.00 -0.86 0.00 0.00 30.24 28.23 3faq n GLN 322 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.06 175.01 3faq h LYS 323 N 0.73 0.09 0.00 2.61 3.64 -1.53 -3.40 116.57 118.70 3faq h LYS 323 Ca 0.00 -0.15 -0.27 0.00 -1.27 0.00 0.00 60.65 58.95 3faq h LYS 323 Cb 0.30 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.13 3faq h LYS 323 CO 0.00 0.83 -2.03 0.91 -2.27 0.00 0.00 179.45 176.89 3faq n TRP 324 N -3.26 0.00 -3.65 1.91 7.02 -1.17 -4.82 117.44 113.46 3faq n TRP 324 Ca -0.14 0.00 -0.37 0.00 -1.02 0.00 0.00 57.50 55.97 3faq n TRP 324 Cb 1.02 -0.70 -0.07 0.00 -2.42 0.00 0.00 31.31 29.14 3faq n TRP 324 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 3faq s ILE 325 N -2.36 4.18 1.10 -0.99 1.01 -0.52 -4.76 121.20 118.85 3faq s ILE 325 Ca -0.22 -3.46 -0.12 0.00 0.00 0.00 0.00 60.65 56.85 3faq s ILE 325 Cb 0.06 -3.64 0.25 0.00 0.01 0.00 0.00 42.46 39.14 3faq s ILE 325 CO 0.44 -1.01 1.06 -2.84 0.00 0.00 0.00 174.94 172.60 3faq s PRO 326 N -0.79 -0.40 0.43 2.79 0.02 -1.26 -4.53 135.00 131.26 3faq s PRO 326 Ca 0.23 1.08 -0.26 0.00 0.02 0.00 0.00 61.00 62.08 3faq s PRO 326 Cb -0.12 -1.60 -0.09 0.00 0.02 0.00 0.00 34.50 32.71 3faq s PRO 326 CO -0.09 -3.45 1.43 -2.14 -0.33 0.00 0.00 177.00 172.42 3faq s PRO 327 N -4.50 3.79 0.09 5.54 0.02 -1.26 -4.90 135.00 133.78 3faq s PRO 327 Ca 0.68 2.42 -0.31 0.00 0.02 0.00 0.00 61.00 63.82 3faq s PRO 327 Cb -0.25 -2.72 -0.09 0.00 0.02 0.00 0.00 34.50 31.46 3faq s PRO 327 CO 0.63 -0.74 1.64 -0.47 -0.33 0.00 0.00 177.00 177.73 3faq s TYR 328 N -1.19 2.53 -0.41 6.54 5.04 -1.26 -4.92 117.35 123.68 3faq s TYR 328 Ca 0.59 0.37 0.04 0.00 -2.44 0.00 0.00 57.07 55.63 3faq s TYR 328 Cb -0.44 -3.96 0.07 0.00 0.35 0.00 0.00 41.96 37.98 3faq s TYR 328 CO 0.57 -3.81 0.86 1.04 -1.34 0.00 0.00 175.55 172.87 3faq n GLN 329 N 5.30 1.29 0.00 4.97 6.02 -1.26 -5.11 117.38 128.59 3faq n GLN 329 Ca 0.16 -1.23 0.00 0.00 -0.01 0.00 0.00 57.00 55.92 3faq n GLN 329 Cb 0.40 -1.09 0.00 0.00 1.02 0.00 0.00 30.24 30.58 3faq n GLN 329 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3faq n GLY 330 N 0.04 3.15 3.64 1.08 0.00 -1.26 -5.03 105.19 106.81 3faq n GLY 330 Ca 0.03 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 3faq n GLY 330 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3faq s TYR 331 N -2.64 1.55 -0.31 1.61 5.04 -1.26 -4.86 117.35 116.47 3faq s TYR 331 Ca 0.00 0.05 -0.10 0.00 -2.44 0.00 0.00 57.07 54.58 3faq s TYR 331 Cb 0.00 -4.07 -0.01 0.00 0.35 0.00 0.00 41.96 38.23 3faq s TYR 331 CO 0.00 -4.46 0.15 1.21 -1.34 0.00 0.00 175.55 171.11 3faq s ASN 332 N 4.92 5.55 0.09 4.32 3.84 0.64 -4.96 114.94 129.34 3faq s ASN 332 Ca 0.85 -0.52 0.27 0.00 0.21 0.00 0.00 52.86 53.67 3faq s ASN 332 Cb -0.36 -2.00 1.04 0.00 -0.55 0.00 0.00 41.25 39.38 3faq s ASN 332 CO 0.36 -0.19 1.84 -0.46 -2.79 0.00 0.00 177.10 175.85 3faq n ASN 333 N 4.98 0.32 -0.40 -4.21 2.04 -1.26 -2.92 115.26 113.81 3faq n ASN 333 Ca -0.14 0.53 0.12 0.00 -0.44 0.00 0.00 54.58 54.65 3faq n ASN 333 Cb 0.49 -0.62 0.48 0.00 -2.53 0.00 0.00 39.78 37.60 3faq n ASN 333 CO 0.00 0.00 0.00 -1.20 -0.44 0.00 0.00 177.26 175.62 3faq n SER 334 N -1.80 1.22 -4.68 0.53 7.64 -1.26 -4.84 113.62 110.44 3faq n SER 334 Ca 0.06 -1.56 -0.37 0.00 1.01 0.00 0.00 58.87 58.01 3faq n SER 334 Cb 0.36 -0.06 -0.08 0.00 -1.01 0.00 0.00 64.21 63.42 3faq n SER 334 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3faq s VAL 335 N -1.89 5.26 -0.50 0.44 1.01 -1.15 -5.04 120.40 118.54 3faq s VAL 335 Ca 0.34 0.52 -0.28 0.00 0.00 0.00 0.00 61.98 62.56 3faq s VAL 335 Cb 0.18 -3.64 0.02 0.00 0.00 0.00 0.00 36.38 32.93 3faq s VAL 335 CO 0.28 0.30 1.30 -0.62 0.00 0.00 0.00 175.10 176.36 3faq s ASP 336 N 0.97 6.38 0.00 3.32 2.15 -1.26 -4.66 116.67 123.57 3faq s ASP 336 Ca 0.15 0.44 0.25 0.00 0.43 0.00 0.00 52.55 53.82 3faq s ASP 336 Cb -0.14 -2.55 1.29 0.00 -0.30 0.00 0.00 42.92 41.23 3faq s ASP 336 CO 0.06 -1.47 1.85 -0.81 -0.17 0.00 0.00 175.17 174.63 3faq n PRO 337 N 8.25 0.39 -2.05 4.34 -0.04 -1.26 -4.79 135.00 139.84 3faq n PRO 337 Ca 0.13 0.04 -0.39 0.00 -0.04 0.00 0.00 63.50 63.25 3faq n PRO 337 Cb 0.49 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 3faq n PRO 337 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3faq s ARG 338 N -2.53 3.74 0.05 0.54 0.52 -1.26 -4.60 118.95 115.40 3faq s ARG 338 Ca 0.25 2.07 -0.30 0.00 -0.52 0.00 0.00 55.73 57.22 3faq s ARG 338 Cb 0.17 -2.56 -0.05 0.00 0.52 0.00 0.00 34.95 33.02 3faq s ARG 338 CO 0.38 -0.65 1.22 0.42 0.02 0.00 0.00 175.30 176.69 3faq s ILE 339 N -1.35 4.02 0.70 1.52 -1.09 -1.26 -4.80 121.20 118.94 3faq s ILE 339 Ca 0.62 1.43 -0.11 0.00 -2.23 0.00 0.00 60.65 60.36 3faq s ILE 339 Cb -0.36 -3.92 0.01 0.00 -1.58 0.00 0.00 42.46 36.61 3faq s ILE 339 CO 0.45 0.09 1.07 -0.94 -1.23 0.00 0.00 174.94 174.38 3faq s SER 340 N 1.16 5.41 0.27 3.58 1.04 -1.26 -1.22 113.70 122.68 3faq s SER 340 Ca 0.59 1.42 0.01 0.00 0.48 0.00 0.00 55.95 58.45 3faq s SER 340 Cb -0.29 -2.30 0.38 0.00 0.10 0.00 0.00 66.02 63.91 3faq s SER 340 CO 0.28 -1.40 1.72 -1.13 0.98 0.00 0.00 173.24 173.69 3faq h ASN 341 N -0.69 0.55 0.87 7.02 -0.73 -0.99 -3.01 115.58 118.60 3faq h ASN 341 Ca -0.45 -0.18 -0.11 0.00 1.87 0.00 0.00 56.30 57.44 3faq h ASN 341 Cb 1.22 -0.15 -0.02 0.00 0.27 0.00 0.00 38.32 39.65 3faq h ASN 341 CO 0.60 0.76 -0.51 1.62 -0.37 0.00 0.00 177.43 179.53 3faq h VAL 342 N 0.49 1.11 -0.65 2.57 3.04 -1.93 -3.14 116.25 117.74 3faq h VAL 342 Ca 0.08 -1.94 0.11 0.00 -1.01 0.00 0.00 66.70 63.93 3faq h VAL 342 Cb 0.64 2.13 -0.08 0.00 -2.01 0.00 0.00 31.29 31.97 3faq h VAL 342 CO 0.05 0.50 0.24 0.15 -1.01 0.00 0.00 177.57 177.50 3faq h PHE 343 N 0.00 0.42 0.00 3.17 3.57 -1.89 0.12 116.94 122.32 3faq h PHE 343 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3faq h PHE 343 Cb 1.09 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.74 3faq h PHE 343 CO 0.00 0.08 0.00 0.25 -2.23 0.00 0.00 178.31 176.41 3faq n THR 344 N -5.00 1.37 -0.03 4.41 -2.24 -1.18 -0.28 114.28 111.33 3faq n THR 344 Ca 0.10 0.34 -0.01 0.00 -2.27 0.00 0.00 64.05 62.21 3faq n THR 344 Cb 0.31 -1.32 -0.06 0.00 -2.10 0.00 0.00 70.33 67.17 3faq n THR 344 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3faq n PHE 345 N -1.36 0.00 0.05 4.78 3.01 0.17 -4.42 117.46 119.69 3faq n PHE 345 Ca 0.01 0.00 -0.10 0.00 1.01 0.00 0.00 57.45 58.36 3faq n PHE 345 Cb 0.01 -0.30 0.02 0.00 -0.01 0.00 0.00 39.48 39.20 3faq n PHE 345 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3faq h ALA 346 N 0.45 0.59 0.00 4.37 0.00 0.14 -2.76 119.26 122.04 3faq h ALA 346 Ca -0.14 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.17 3faq h ALA 346 Cb 1.14 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3faq h ALA 346 CO 0.01 0.76 0.00 0.34 0.00 0.00 0.00 179.25 180.35 3faq n PHE 347 N -3.85 0.29 0.46 0.00 -0.00 0.62 -2.93 117.46 112.06 3faq n PHE 347 Ca -0.04 0.10 0.05 0.00 -0.00 0.00 0.00 57.45 57.55 3faq n PHE 347 Cb 0.70 -0.66 0.25 0.00 -0.00 0.00 0.00 39.48 39.77 3faq n PHE 347 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 3faq n ARG 348 N -1.75 0.13 0.15 -4.13 1.74 -1.04 -2.77 116.66 108.99 3faq n ARG 348 Ca 0.05 0.20 0.19 0.00 -0.77 0.00 0.00 57.85 57.52 3faq n ARG 348 Cb 0.29 -1.50 0.76 0.00 -1.02 0.00 0.00 32.46 30.99 3faq n ARG 348 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3faq h PHE 349 N 0.00 0.00 0.00 -1.55 -5.15 -1.72 0.19 116.94 108.71 3faq h PHE 349 Ca 0.00 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 57.77 3faq h PHE 349 Cb 0.10 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.27 3faq h PHE 349 CO 0.00 0.00 -0.02 0.78 -2.00 0.00 0.00 178.31 177.07 3faq h GLY 350 N 0.00 0.00 2.00 6.09 0.00 -1.83 -2.22 103.07 107.11 3faq h GLY 350 Ca 0.14 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.45 3faq h GLY 350 CO -0.00 0.00 -0.13 0.45 0.00 0.00 0.00 176.54 176.86 3faq h HIS 351 N 0.00 0.00 -0.13 5.60 3.86 -0.89 0.14 115.15 123.72 3faq h HIS 351 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3faq h HIS 351 Cb 0.09 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.56 3faq h HIS 351 CO 0.00 0.13 0.00 -1.33 0.86 0.00 0.00 177.93 177.59 3faq n MET 352 N -3.97 1.45 -0.00 2.45 2.81 -0.84 -3.32 117.12 115.71 3faq n MET 352 Ca -0.02 -0.69 0.07 0.00 -1.81 0.00 0.00 57.70 55.25 3faq n MET 352 Cb 0.21 -1.29 -0.09 0.00 -0.71 0.00 0.00 33.22 31.34 3faq n MET 352 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3faq n GLU 353 N -0.05 1.80 -2.43 0.03 1.02 0.47 -3.96 120.64 117.52 3faq n GLU 353 Ca 0.13 -0.03 -0.43 0.00 -0.02 0.00 0.00 57.16 56.82 3faq n GLU 353 Cb 0.21 -1.23 -0.02 0.00 -0.02 0.00 0.00 31.44 30.37 3faq n GLU 353 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3faq s VAL 354 N -2.52 4.23 0.67 2.62 1.01 -1.19 -1.21 120.40 124.00 3faq s VAL 354 Ca 0.04 1.53 -0.11 0.00 0.00 0.00 0.00 61.98 63.44 3faq s VAL 354 Cb 0.11 -3.99 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 3faq s VAL 354 CO 0.62 -0.05 1.05 -2.16 0.00 0.00 0.00 175.10 174.56 3faq s PRO 355 N 2.70 3.14 0.46 2.72 0.04 -1.26 -4.59 135.00 138.19 3faq s PRO 355 Ca 0.56 0.92 0.25 0.00 0.04 0.00 0.00 61.00 62.78 3faq s PRO 355 Cb -0.24 -2.02 0.96 0.00 0.04 0.00 0.00 34.50 33.25 3faq s PRO 355 CO 0.20 -0.94 1.84 0.66 0.04 0.00 0.00 177.00 178.80 3faq h SER 356 N -0.52 0.00 -3.94 6.66 4.64 -1.97 -3.45 113.55 114.97 3faq h SER 356 Ca -0.44 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.49 3faq h SER 356 Cb 1.21 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.15 3faq h SER 356 CO 0.58 0.19 -0.63 0.42 -0.87 0.00 0.00 176.83 176.52 3faq s THR 357 N -3.64 0.89 -0.06 2.95 -4.23 -1.26 -0.80 115.64 109.50 3faq s THR 357 Ca 0.01 -2.01 0.02 0.00 -1.18 0.00 0.00 61.69 58.52 3faq s THR 357 Cb 0.10 -2.58 0.02 0.00 1.34 0.00 0.00 72.50 71.38 3faq s THR 357 CO 0.63 -0.12 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.81 3faq s VAL 358 N -3.51 0.86 0.09 2.29 1.01 -0.23 -4.80 120.40 116.10 3faq s VAL 358 Ca 0.34 -0.30 0.05 0.00 0.00 0.00 0.00 61.98 62.06 3faq s VAL 358 Cb 0.07 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 3faq s VAL 358 CO 0.12 0.30 0.01 -0.55 0.00 0.00 0.00 175.10 174.98 3faq s SER 359 N 0.85 5.07 -0.05 3.32 0.15 -1.26 -1.39 113.70 120.39 3faq s SER 359 Ca -0.12 -0.16 0.05 0.00 0.70 0.00 0.00 55.95 56.42 3faq s SER 359 Cb -0.15 -1.22 -0.02 0.00 -1.71 0.00 0.00 66.02 62.92 3faq s SER 359 CO 0.01 0.18 -0.21 -0.13 1.20 0.00 0.00 173.24 174.29 3faq s ARG 360 N -2.31 2.51 0.09 5.44 3.00 -0.81 -4.44 118.95 122.44 3faq s ARG 360 Ca 0.26 -0.82 0.08 0.00 0.00 0.00 0.00 55.73 55.25 3faq s ARG 360 Cb -0.12 -2.25 -0.03 0.00 0.00 0.00 0.00 34.95 32.55 3faq s ARG 360 CO 0.19 0.49 -0.20 -0.51 0.00 0.00 0.00 175.30 175.26 3faq s LEU 361 N -0.40 2.29 0.70 2.53 1.43 -0.69 -1.85 118.68 122.69 3faq s LEU 361 Ca 0.04 -0.67 0.02 0.00 -1.03 0.00 0.00 54.13 52.49 3faq s LEU 361 Cb -0.12 -0.83 0.13 0.00 0.03 0.00 0.00 46.19 45.40 3faq s LEU 361 CO 0.02 0.04 0.97 1.51 0.23 0.00 0.00 176.35 179.12 3faq s ASP 362 N -1.84 4.42 0.40 2.29 -4.77 -0.55 -4.16 116.67 112.46 3faq s ASP 362 Ca 0.05 -0.54 0.25 0.00 -3.30 0.00 0.00 52.55 49.01 3faq s ASP 362 Cb -0.10 0.18 1.40 0.00 -1.09 0.00 0.00 42.92 43.31 3faq s ASP 362 CO 0.04 -1.82 1.58 -0.33 0.70 0.00 0.00 175.17 175.34 3faq h GLU 363 N -0.42 0.02 -0.31 2.11 4.39 -1.99 1.12 114.58 119.50 3faq h GLU 363 Ca -0.34 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.36 3faq h GLU 363 Cb 1.27 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.91 3faq h GLU 363 CO 0.39 0.01 0.00 0.09 -1.16 0.00 0.00 179.01 178.34 3faq n ASN 364 N -5.04 1.83 -0.93 1.42 5.03 -1.26 -4.90 115.26 111.41 3faq n ASN 364 Ca 0.39 -1.94 -0.11 0.00 0.87 0.00 0.00 54.58 53.79 3faq n ASN 364 Cb 1.38 -0.21 -0.04 0.00 -1.02 0.00 0.00 39.78 39.89 3faq n ASN 364 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 3faq n TYR 365 N 0.48 -0.08 -3.50 3.10 4.01 0.39 -5.02 117.16 116.54 3faq n TYR 365 Ca 0.13 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.67 3faq n TYR 365 Cb 0.30 -2.19 -0.01 0.00 -0.31 0.00 0.00 39.34 37.14 3faq n TYR 365 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3faq s GLN 366 N -3.19 3.17 0.14 -0.72 -1.52 -1.25 -4.80 119.66 111.48 3faq s GLN 366 Ca 0.00 -0.92 -0.35 0.00 -1.95 0.00 0.00 55.36 52.14 3faq s GLN 366 Cb 0.00 -2.81 -0.16 0.00 -0.22 0.00 0.00 33.01 29.83 3faq s GLN 366 CO 0.00 0.09 1.34 -2.30 -0.25 0.00 0.00 175.29 174.17 3faq n PRO 367 N -1.64 1.41 -3.10 2.91 -0.02 -1.26 -1.48 135.00 131.82 3faq n PRO 367 Ca -0.01 0.51 -0.45 0.00 -2.02 0.00 0.00 63.50 61.53 3faq n PRO 367 Cb 0.58 -2.14 -0.01 0.00 -0.02 0.00 0.00 33.50 31.91 3faq n PRO 367 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 3faq s TRP 368 N 0.33 3.57 0.00 6.00 -0.00 -0.77 -4.61 118.94 123.46 3faq s TRP 368 Ca 0.79 -1.95 0.00 0.00 -0.00 0.00 0.00 56.10 54.94 3faq s TRP 368 Cb -0.85 -4.11 0.00 0.00 -0.00 0.00 0.00 33.47 28.51 3faq s TRP 368 CO 0.47 -1.26 0.00 0.41 -0.00 0.00 0.00 176.95 176.57 3faq n GLY 369 N 4.31 -3.58 0.20 5.86 0.00 -1.26 -4.22 105.19 106.49 3faq n GLY 369 Ca 0.25 -2.10 0.10 0.00 0.00 0.00 0.00 46.02 44.26 3faq n GLY 369 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3faq h PRO 370 N 0.00 0.00 -1.35 1.61 0.13 -2.02 -3.34 132.00 127.04 3faq h PRO 370 Ca 0.00 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.64 3faq h PRO 370 Cb 0.00 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 30.72 3faq h PRO 370 CO 0.00 0.14 -0.95 0.39 -0.23 0.00 0.00 178.00 177.35 3faq n GLU 371 N -3.14 2.33 -0.14 0.86 1.02 -1.26 -4.90 120.64 115.40 3faq n GLU 371 Ca 0.03 -3.93 -0.08 0.00 -0.02 0.00 0.00 57.16 53.16 3faq n GLU 371 Cb 0.56 -1.79 0.07 0.00 -0.02 0.00 0.00 31.44 30.26 3faq n GLU 371 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3faq h ALA 372 N 2.80 0.87 -2.98 0.62 0.00 -1.73 -3.42 119.26 115.41 3faq h ALA 372 Ca 0.11 -0.34 -0.59 0.00 0.00 0.00 0.00 54.91 54.08 3faq h ALA 372 Cb 1.02 -0.18 -0.11 0.00 0.00 0.00 0.00 17.79 18.52 3faq h ALA 372 CO 0.68 0.64 -0.26 -2.00 0.00 0.00 0.00 179.25 178.31 3faq s GLU 373 N -4.81 4.22 0.05 0.00 2.12 -1.26 -1.93 118.70 117.09 3faq s GLU 373 Ca -0.10 0.15 0.06 0.00 0.36 0.00 0.00 54.97 55.44 3faq s GLU 373 Cb 0.13 -3.48 -0.02 0.00 0.26 0.00 0.00 34.13 31.02 3faq s GLU 373 CO 0.85 0.10 -0.16 -0.51 -0.54 0.00 0.00 175.26 174.99 3faq s LEU 374 N 0.89 2.19 0.25 2.70 1.43 -0.48 -4.95 118.68 120.71 3faq s LEU 374 Ca 0.18 -0.51 -0.30 0.00 -1.03 0.00 0.00 54.13 52.47 3faq s LEU 374 Cb -0.14 -0.69 -0.11 0.00 0.03 0.00 0.00 46.19 45.28 3faq s LEU 374 CO 0.06 0.05 1.52 -2.84 0.23 0.00 0.00 176.35 175.37 3faq s PRO 375 N -1.28 4.21 0.30 1.29 0.02 -1.26 -1.07 135.00 137.21 3faq s PRO 375 Ca 0.03 2.41 0.06 0.00 0.02 0.00 0.00 61.00 63.52 3faq s PRO 375 Cb -0.08 -3.09 0.76 0.00 0.02 0.00 0.00 34.50 32.11 3faq s PRO 375 CO 0.02 -0.53 1.75 1.25 -0.33 0.00 0.00 177.00 179.17 3faq h LEU 376 N 5.26 0.69 -2.33 -5.54 7.12 -1.28 -2.32 115.31 116.91 3faq h LEU 376 Ca -0.46 0.11 -0.01 0.00 0.13 0.00 0.00 57.88 57.66 3faq h LEU 376 Cb 1.22 -0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 41.34 3faq h LEU 376 CO 0.81 0.20 -0.04 1.12 -0.13 0.00 0.00 178.44 180.39 3faq h HIS 377 N 0.67 0.00 0.00 1.25 2.07 -1.83 -1.19 115.15 116.12 3faq h HIS 377 Ca 0.59 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.11 3faq h HIS 377 Cb 0.99 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.97 3faq h HIS 377 CO -0.02 0.04 0.00 0.25 -3.07 0.00 0.00 177.93 175.13 3faq n THR 378 N -3.59 0.04 1.07 6.12 -2.24 -0.87 -3.43 114.28 111.38 3faq n THR 378 Ca -0.02 0.01 0.11 0.00 -2.27 0.00 0.00 64.05 61.88 3faq n THR 378 Cb 0.14 -0.52 0.10 0.00 -2.10 0.00 0.00 70.33 67.95 3faq n THR 378 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3faq n LEU 379 N -1.38 1.62 -4.73 3.22 4.77 -0.45 -4.72 117.00 115.33 3faq n LEU 379 Ca 0.11 -0.58 -0.42 0.00 -0.03 0.00 0.00 56.01 55.10 3faq n LEU 379 Cb 0.28 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.30 3faq n LEU 379 CO 0.24 0.31 1.09 -0.36 -1.33 0.00 0.00 177.39 177.34 3faq s PHE 380 N -2.55 3.15 -1.44 -1.77 0.08 -1.22 -2.06 117.98 112.16 3faq s PHE 380 Ca 0.19 0.95 0.00 0.00 0.12 0.00 0.00 56.93 58.19 3faq s PHE 380 Cb 0.18 -3.75 0.00 0.00 -0.57 0.00 0.00 43.02 38.88 3faq s PHE 380 CO 0.59 -2.58 0.00 1.19 -0.10 0.00 0.00 175.22 174.32 3faq n PHE 381 N 3.30 -0.89 -3.14 0.36 3.72 -0.26 -4.91 117.46 115.64 3faq n PHE 381 Ca 0.10 0.00 -0.45 0.00 -0.05 0.00 0.00 57.45 57.05 3faq n PHE 381 Cb 0.41 -3.07 -0.04 0.00 -0.94 0.00 0.00 39.48 35.84 3faq n PHE 381 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3faq s ASN 382 N -2.14 6.22 -0.13 4.37 3.84 -1.01 -4.06 114.94 122.03 3faq s ASN 382 Ca 0.00 -1.56 0.18 0.00 0.21 0.00 0.00 52.86 51.70 3faq s ASN 382 Cb 0.00 -2.29 -0.26 0.00 -0.55 0.00 0.00 41.25 38.15 3faq s ASN 382 CO 0.00 -1.06 0.27 0.35 -2.79 0.00 0.00 177.10 173.87 3faq n THR 383 N 5.44 1.09 0.29 -5.21 -2.24 -1.26 -4.34 114.28 108.04 3faq n THR 383 Ca -0.08 -0.76 0.15 0.00 -2.27 0.00 0.00 64.05 61.09 3faq n THR 383 Cb 0.42 -0.43 0.86 0.00 -2.10 0.00 0.00 70.33 69.08 3faq n THR 383 CO 0.00 0.00 0.00 4.11 -0.57 0.00 0.00 175.07 178.61 3faq h TRP 384 N 0.00 0.00 -0.07 4.78 5.08 -1.87 -1.57 115.95 122.30 3faq h TRP 384 Ca -0.38 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 59.48 3faq h TRP 384 Cb 1.90 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 28.05 3faq h TRP 384 CO 0.00 0.05 -0.49 0.00 -1.28 0.00 0.00 178.44 176.72 3faq h ARG 385 N 0.00 0.17 0.12 0.12 2.47 -1.95 -1.43 114.38 113.89 3faq h ARG 385 Ca -0.00 -0.10 -0.17 0.00 -1.26 0.00 0.00 59.98 58.46 3faq h ARG 385 Cb 0.16 0.01 0.02 0.00 -1.65 0.00 0.00 29.97 28.50 3faq h ARG 385 CO 0.01 0.63 -0.73 0.82 0.56 0.00 0.00 179.97 181.26 3faq h ILE 386 N 0.14 1.54 -0.04 2.04 2.04 -1.55 -3.23 117.51 118.46 3faq h ILE 386 Ca 0.01 -2.51 -0.12 0.00 1.00 0.00 0.00 64.86 63.24 3faq h ILE 386 Cb 0.92 3.21 0.01 0.00 -0.74 0.00 0.00 36.82 40.21 3faq h ILE 386 CO 0.07 0.70 -0.44 0.40 0.00 0.00 0.00 178.15 178.89 3faq h ILE 387 N -0.43 1.44 -0.58 -0.67 2.04 -1.43 -1.97 117.51 115.91 3faq h ILE 387 Ca -0.13 -1.91 -0.09 0.00 1.00 0.00 0.00 64.86 63.73 3faq h ILE 387 Cb 1.57 2.49 -0.05 0.00 -0.74 0.00 0.00 36.82 40.09 3faq h ILE 387 CO 0.14 0.55 0.10 0.29 0.00 0.00 0.00 178.15 179.23 3faq n LYS 388 N -4.34 4.06 -2.69 2.37 5.02 -0.54 -4.66 118.16 117.38 3faq n LYS 388 Ca -0.09 -3.10 -0.07 0.00 -2.02 0.00 0.00 58.31 53.03 3faq n LYS 388 Cb 0.58 -2.17 0.11 0.00 -0.02 0.00 0.00 35.03 33.52 3faq n LYS 388 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3faq n ASP 389 N 0.09 -1.33 0.00 4.39 2.03 -1.22 -5.00 116.55 115.51 3faq n ASP 389 Ca 0.32 -2.49 0.00 0.00 0.52 0.00 0.00 54.79 53.14 3faq n ASP 389 Cb 1.22 0.75 0.00 0.00 -0.72 0.00 0.00 41.12 42.37 3faq n ASP 389 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3faq n GLY 390 N -0.55 1.75 7.00 0.27 0.00 -1.26 -4.81 105.19 107.60 3faq n GLY 390 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3faq n GLY 390 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3faq n GLY 391 N -0.09 -1.94 0.77 -0.02 0.00 -0.74 -4.25 105.19 98.92 3faq n GLY 391 Ca 0.00 -1.38 0.12 0.00 0.00 0.00 0.00 46.02 44.76 3faq n GLY 391 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3faq n ILE 392 N -0.17 0.17 0.32 -0.61 -6.64 -1.26 -4.51 119.36 106.66 3faq n ILE 392 Ca 0.00 -0.45 -0.15 0.00 -1.77 0.00 0.00 62.75 60.38 3faq n ILE 392 Cb 0.00 0.82 -0.07 0.00 -1.44 0.00 0.00 39.64 38.94 3faq n ILE 392 CO 0.00 0.00 0.00 0.44 -1.77 0.00 0.00 176.55 175.22 3faq h ASP 393 N 3.37 -0.72 -0.50 7.28 5.19 -1.98 -2.21 116.42 126.86 3faq h ASP 393 Ca 0.00 -0.01 0.14 0.00 -0.62 0.00 0.00 57.03 56.54 3faq h ASP 393 Cb 0.73 0.19 -0.02 0.00 0.18 0.00 0.00 39.33 40.40 3faq h ASP 393 CO 0.00 -0.35 0.39 -0.65 -3.12 0.00 0.00 179.24 175.51 3faq h PRO 394 N -1.14 0.00 0.02 3.56 0.11 -1.79 -1.68 132.00 131.09 3faq h PRO 394 Ca -0.09 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.81 3faq h PRO 394 Cb 0.69 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.77 3faq h PRO 394 CO 0.14 0.00 -1.01 -0.07 -0.21 0.00 0.00 178.00 176.85 3faq h LEU 395 N 0.00 0.07 -0.33 2.35 3.38 -1.81 -1.83 115.31 117.14 3faq h LEU 395 Ca 0.24 -0.08 -0.19 0.00 0.09 0.00 0.00 57.88 57.94 3faq h LEU 395 Cb 1.01 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 3faq h LEU 395 CO -0.00 1.04 -0.84 0.74 0.09 0.00 0.00 178.44 179.46 3faq h THR 396 N 0.02 1.49 0.00 0.22 2.02 -0.66 -2.68 112.91 113.32 3faq h THR 396 Ca -0.03 -2.56 -0.07 0.00 0.77 0.00 0.00 66.41 64.52 3faq h THR 396 Cb 1.76 2.42 -0.01 0.00 -1.74 0.00 0.00 68.15 70.58 3faq h THR 396 CO 0.14 0.75 -0.34 0.03 0.37 0.00 0.00 175.52 176.46 3faq h ARG 397 N 0.11 0.00 -0.26 6.66 3.08 -1.56 -2.04 114.38 120.37 3faq h ARG 397 Ca -0.04 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.84 3faq h ARG 397 Cb 1.46 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.50 3faq h ARG 397 CO 0.13 0.34 -0.53 0.78 -1.07 0.00 0.00 179.97 179.62 3faq h GLY 398 N 1.14 0.84 0.37 0.04 0.00 -1.50 -0.15 103.07 103.81 3faq h GLY 398 Ca -0.00 -0.96 0.12 0.00 0.00 0.00 0.00 47.33 46.49 3faq h GLY 398 CO 0.04 0.86 0.49 1.41 0.00 0.00 0.00 176.54 179.35 3faq h LEU 399 N 0.59 0.67 0.14 3.11 3.38 -1.04 -1.17 115.31 121.00 3faq h LEU 399 Ca 0.02 0.07 -0.32 0.00 0.09 0.00 0.00 57.88 57.74 3faq h LEU 399 Cb 1.11 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3faq h LEU 399 CO 0.11 0.33 -1.57 -0.07 0.09 0.00 0.00 178.44 177.34 3faq h LEU 400 N 0.76 0.48 0.00 1.67 3.38 -1.28 -2.70 115.31 117.62 3faq h LEU 400 Ca 0.45 -0.65 -0.15 0.00 0.09 0.00 0.00 57.88 57.62 3faq h LEU 400 Cb 0.53 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3faq h LEU 400 CO -0.30 1.54 -0.85 0.00 0.09 0.00 0.00 178.44 178.92 3faq h ALA 401 N 0.39 0.62 -2.24 1.53 0.00 -0.86 -3.39 119.26 115.30 3faq h ALA 401 Ca -0.26 -0.66 -0.47 0.00 0.00 0.00 0.00 54.91 53.51 3faq h ALA 401 Cb 2.05 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.84 3faq h ALA 401 CO 0.18 0.84 -0.34 0.15 0.00 0.00 0.00 179.25 180.07 3faq s LYS 402 N -2.90 3.46 0.39 0.00 -0.14 -0.46 -4.82 119.74 115.28 3faq s LYS 402 Ca 0.02 -0.58 0.04 0.00 -1.36 0.00 0.00 55.97 54.08 3faq s LYS 402 Cb 0.08 -2.81 -0.01 0.00 -1.68 0.00 0.00 37.83 33.42 3faq s LYS 402 CO 0.78 0.33 0.56 0.15 -0.76 0.00 0.00 175.35 176.41 3faq s LYS 403 N -4.03 3.10 0.72 1.68 1.02 -1.26 0.12 119.74 121.09 3faq s LYS 403 Ca 0.36 -0.77 -0.07 0.00 0.02 0.00 0.00 55.97 55.51 3faq s LYS 403 Cb -0.09 -2.70 0.07 0.00 -0.52 0.00 0.00 37.83 34.58 3faq s LYS 403 CO 0.31 -0.08 1.03 -1.12 -0.92 0.00 0.00 175.35 174.57 3faq s SER 404 N -4.19 4.71 0.09 2.83 0.01 0.33 -4.14 113.70 113.34 3faq s SER 404 Ca 0.46 0.41 -0.20 0.00 1.31 0.00 0.00 55.95 57.94 3faq s SER 404 Cb -0.10 -1.02 -0.07 0.00 0.21 0.00 0.00 66.02 65.04 3faq s SER 404 CO 0.34 -1.67 0.60 -0.75 0.41 0.00 0.00 173.24 172.17 3faq s LYS 405 N -5.28 4.23 -0.09 12.44 2.20 -0.35 -0.30 119.74 132.60 3faq s LYS 405 Ca 0.61 0.78 -0.19 0.00 -0.36 0.00 0.00 55.97 56.81 3faq s LYS 405 Cb -0.10 -3.22 -0.04 0.00 -1.51 0.00 0.00 37.83 32.96 3faq s LYS 405 CO 0.45 0.62 0.53 -1.17 -0.36 0.00 0.00 175.35 175.42 3faq s LEU 406 N -1.17 4.31 0.40 5.43 2.96 -0.01 -4.40 118.68 126.20 3faq s LEU 406 Ca 0.30 0.93 -0.27 0.00 -0.22 0.00 0.00 54.13 54.87 3faq s LEU 406 Cb -0.20 -2.78 -0.10 0.00 0.50 0.00 0.00 46.19 43.61 3faq s LEU 406 CO 0.20 0.01 1.45 -0.32 -1.32 0.00 0.00 176.35 176.37 3faq s MET 407 N 0.48 4.00 -0.08 1.98 1.75 -1.25 -4.89 119.30 121.29 3faq s MET 407 Ca 0.28 2.49 -0.05 0.00 -1.25 0.00 0.00 55.69 57.17 3faq s MET 407 Cb -0.16 -2.88 0.03 0.00 2.84 0.00 0.00 34.83 34.66 3faq s MET 407 CO 0.13 -0.59 0.19 1.21 -0.65 0.00 0.00 175.02 175.31 3faq s ASN 408 N -0.29 -0.18 0.65 1.11 3.84 -1.26 -5.03 114.94 113.79 3faq s ASN 408 Ca 0.55 0.39 0.41 0.00 0.21 0.00 0.00 52.86 54.42 3faq s ASN 408 Cb -0.45 0.32 2.27 0.00 -0.55 0.00 0.00 41.25 42.84 3faq s ASN 408 CO 0.60 -0.12 2.32 1.56 -2.79 0.00 0.00 177.10 178.67 3faq h GLN 409 N 6.74 0.00 -0.02 0.43 4.20 -1.93 -1.33 115.11 123.20 3faq h GLN 409 Ca -0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.35 3faq h GLN 409 Cb 1.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.95 3faq h GLN 409 CO 0.40 0.00 -0.05 -0.25 -0.67 0.00 0.00 178.83 178.26 3faq n ASP 410 N -3.21 2.11 -3.07 1.46 8.00 -1.26 -4.71 116.55 115.87 3faq n ASP 410 Ca -0.03 -1.55 -0.18 0.00 0.71 0.00 0.00 54.79 53.73 3faq n ASP 410 Cb 0.10 0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.25 3faq n ASP 410 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3faq n LYS 411 N 0.67 0.80 0.02 -1.24 5.02 -0.51 -4.73 118.16 118.19 3faq n LYS 411 Ca 0.08 -2.85 -0.01 0.00 -2.02 0.00 0.00 58.31 53.51 3faq n LYS 411 Cb 0.36 -1.35 -0.00 0.00 -0.02 0.00 0.00 35.03 34.01 3faq n LYS 411 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 3faq h MET 412 N 3.73 -0.06 -4.80 1.97 2.86 -1.58 -3.34 114.93 113.70 3faq h MET 412 Ca 0.02 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 57.09 3faq h MET 412 Cb 0.94 0.01 -0.34 0.00 0.06 0.00 0.00 31.60 32.28 3faq h MET 412 CO 0.42 -0.04 -0.84 0.08 1.06 0.00 0.00 176.91 177.59 3faq s VAL 413 N -2.65 1.47 0.35 -2.22 1.01 -1.05 -4.42 120.40 112.88 3faq s VAL 413 Ca -0.01 -0.66 -0.27 0.00 0.00 0.00 0.00 61.98 61.04 3faq s VAL 413 Cb 0.00 -1.31 -0.12 0.00 0.00 0.00 0.00 36.38 34.95 3faq s VAL 413 CO 0.03 0.43 1.19 1.07 0.00 0.00 0.00 175.10 177.82 3faq n THR 414 N 3.82 2.10 -0.22 3.92 5.66 -1.26 -4.53 114.28 123.77 3faq n THR 414 Ca -0.21 -0.50 0.18 0.00 -3.05 0.00 0.00 64.05 60.47 3faq n THR 414 Cb 0.52 -1.40 0.51 0.00 -1.55 0.00 0.00 70.33 68.42 3faq n THR 414 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 3faq h SER 415 N 2.27 0.39 -0.90 1.09 0.02 -1.96 0.28 113.55 114.74 3faq h SER 415 Ca -0.45 0.04 0.24 0.00 -0.84 0.00 0.00 61.79 60.78 3faq h SER 415 Cb 1.30 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.76 3faq h SER 415 CO 0.61 0.17 0.63 -0.33 -1.14 0.00 0.00 176.83 176.77 3faq h GLU 416 N 0.40 0.13 0.00 3.45 4.39 -1.92 0.25 114.58 121.28 3faq h GLU 416 Ca 0.44 -0.01 -0.10 0.00 0.34 0.00 0.00 59.36 60.03 3faq h GLU 416 Cb 1.09 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.69 3faq h GLU 416 CO -0.16 0.08 -1.89 1.28 -1.16 0.00 0.00 179.01 177.17 3faq n LEU 417 N -4.36 0.00 0.07 1.33 4.77 0.74 -3.62 117.00 115.93 3faq n LEU 417 Ca 0.19 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.06 3faq n LEU 417 Cb 0.88 0.13 -0.13 0.00 -2.33 0.00 0.00 43.42 41.98 3faq n LEU 417 CO 0.36 0.13 -0.06 0.03 -1.33 0.00 0.00 177.39 176.52 3faq h ARG 418 N 0.00 0.12 0.00 3.23 2.47 0.61 -0.52 114.38 120.30 3faq h ARG 418 Ca -0.15 -0.21 0.00 0.00 -1.26 0.00 0.00 59.98 58.36 3faq h ARG 418 Cb 1.19 0.08 0.00 0.00 -1.65 0.00 0.00 29.97 29.59 3faq h ARG 418 CO 0.01 1.04 -0.28 0.09 0.56 0.00 0.00 179.97 181.39 3faq n ASN 419 N -3.39 1.40 -1.28 7.04 3.02 0.75 -3.74 115.26 119.06 3faq n ASN 419 Ca -0.07 -0.19 -0.04 0.00 -0.03 0.00 0.00 54.58 54.25 3faq n ASN 419 Cb 0.99 0.65 0.12 0.00 -0.61 0.00 0.00 39.78 40.94 3faq n ASN 419 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3faq n LYS 420 N -0.79 2.13 -2.52 3.52 5.02 -1.13 -3.45 118.16 120.93 3faq n LYS 420 Ca 0.00 -3.49 -0.39 0.00 -2.02 0.00 0.00 58.31 52.41 3faq n LYS 420 Cb 0.00 -1.69 -0.04 0.00 -0.02 0.00 0.00 35.03 33.27 3faq n LYS 420 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3faq s LEU 421 N -3.10 4.46 -0.23 -0.35 2.96 -0.82 -4.44 118.68 117.16 3faq s LEU 421 Ca 0.41 2.17 -0.08 0.00 -0.22 0.00 0.00 54.13 56.42 3faq s LEU 421 Cb 0.38 -3.77 -0.04 0.00 0.50 0.00 0.00 46.19 43.27 3faq s LEU 421 CO -0.04 -0.20 0.10 0.12 -1.32 0.00 0.00 176.35 175.01 3faq s PHE 422 N -1.29 3.18 -0.26 5.38 5.36 -1.26 -1.81 117.98 127.28 3faq s PHE 422 Ca 0.47 -0.10 -0.10 0.00 -0.96 0.00 0.00 56.93 56.24 3faq s PHE 422 Cb -0.29 -2.21 -0.05 0.00 -0.34 0.00 0.00 43.02 40.13 3faq s PHE 422 CO 0.37 -0.11 0.16 -0.65 -1.46 0.00 0.00 175.22 173.52 3faq s GLN 423 N 1.17 3.98 0.66 10.12 -1.52 -1.26 -4.96 119.66 127.84 3faq s GLN 423 Ca 0.05 -0.31 0.14 0.00 -1.95 0.00 0.00 55.36 53.29 3faq s GLN 423 Cb -0.14 -3.56 0.74 0.00 -0.22 0.00 0.00 33.01 29.82 3faq s GLN 423 CO 0.04 -0.06 1.41 -1.00 -0.25 0.00 0.00 175.29 175.43 3faq h PRO 424 N 7.92 0.00 0.02 2.91 0.13 -1.97 -2.18 132.00 138.82 3faq h PRO 424 Ca -0.37 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.58 3faq h PRO 424 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 3faq h PRO 424 CO 0.60 0.00 -0.99 1.15 -0.23 0.00 0.00 178.00 178.53 3faq h THR 425 N 0.00 1.13 -1.39 1.56 2.02 -2.01 -3.43 112.91 110.80 3faq h THR 425 Ca 0.00 -2.25 -0.46 0.00 0.77 0.00 0.00 66.41 64.47 3faq h THR 425 Cb 1.39 2.56 0.04 0.00 -1.74 0.00 0.00 68.15 70.40 3faq h THR 425 CO 0.00 0.44 -0.10 -1.00 0.37 0.00 0.00 175.52 175.23 3faq s HIS 426 N -2.35 1.97 -0.91 3.16 3.76 -0.82 -5.07 115.29 115.04 3faq s HIS 426 Ca -0.25 -0.48 0.25 0.00 -0.15 0.00 0.00 55.06 54.43 3faq s HIS 426 Cb 0.04 -2.45 0.50 0.00 1.11 0.00 0.00 32.58 31.77 3faq s HIS 426 CO 0.64 -1.02 1.41 1.63 -0.85 0.00 0.00 174.74 176.54 3faq n LYS 427 N -2.25 0.07 -4.03 1.40 5.02 -1.26 -4.62 118.16 112.48 3faq n LYS 427 Ca 0.13 0.02 -0.22 0.00 -2.02 0.00 0.00 58.31 56.21 3faq n LYS 427 Cb 0.60 -1.54 -0.05 0.00 -0.02 0.00 0.00 35.03 34.02 3faq n LYS 427 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3faq s ILE 428 N -3.04 3.58 -1.08 -0.18 -4.36 -1.26 -5.02 121.20 109.84 3faq s ILE 428 Ca 0.10 -1.55 -0.04 0.00 -0.26 0.00 0.00 60.65 58.90 3faq s ILE 428 Cb 0.17 -3.13 0.31 0.00 1.25 0.00 0.00 42.46 41.06 3faq s ILE 428 CO 0.70 -0.25 1.49 1.41 0.24 0.00 0.00 174.94 178.53 3faq n HIS 429 N -1.20 2.22 -2.68 1.37 8.25 -1.26 -4.16 115.22 117.76 3faq n HIS 429 Ca -0.04 -2.57 -0.01 0.00 -0.26 0.00 0.00 57.72 54.83 3faq n HIS 429 Cb 0.60 -1.25 0.09 0.00 1.12 0.00 0.00 29.99 30.55 3faq n HIS 429 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3faq n GLY 430 N 1.30 1.83 3.91 -1.41 0.00 -1.02 -4.32 105.19 105.46 3faq n GLY 430 Ca 0.26 -0.49 -0.20 0.00 0.00 0.00 0.00 46.02 45.59 3faq n GLY 430 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3faq s PHE 431 N -1.24 2.95 -0.31 1.61 0.40 -0.75 -4.80 117.98 115.84 3faq s PHE 431 Ca 0.16 -0.29 0.03 0.00 -0.60 0.00 0.00 56.93 56.23 3faq s PHE 431 Cb 0.37 -1.91 0.09 0.00 0.51 0.00 0.00 43.02 42.08 3faq s PHE 431 CO -0.09 0.08 0.00 0.34 0.70 0.00 0.00 175.22 176.25 3faq s ASP 432 N -4.08 4.62 0.39 1.36 -1.08 -1.25 -1.94 116.67 114.70 3faq s ASP 432 Ca 0.43 -1.89 0.12 0.00 -0.52 0.00 0.00 52.55 50.69 3faq s ASP 432 Cb -0.07 -1.56 0.92 0.00 -1.46 0.00 0.00 42.92 40.75 3faq s ASP 432 CO 0.28 -0.32 1.89 0.25 0.52 0.00 0.00 175.17 177.79 3faq h LEU 433 N 7.69 0.54 -0.23 -1.34 5.85 -1.29 -1.18 115.31 125.35 3faq h LEU 433 Ca -0.09 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.59 3faq h LEU 433 Cb 1.03 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.98 3faq h LEU 433 CO 0.50 0.27 -0.12 0.00 -0.34 0.00 0.00 178.44 178.75 3faq h ALA 434 N 1.62 0.32 -0.65 1.25 0.00 -1.88 -0.61 119.26 119.30 3faq h ALA 434 Ca 0.42 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 3faq h ALA 434 Cb 0.79 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 3faq h ALA 434 CO -0.17 0.19 0.12 0.00 0.00 0.00 0.00 179.25 179.39 3faq h ALA 435 N 0.71 0.87 -0.07 0.00 0.00 -1.71 -1.10 119.26 117.96 3faq h ALA 435 Ca 0.05 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.71 3faq h ALA 435 Cb 0.63 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3faq h ALA 435 CO 0.04 0.62 0.01 0.82 0.00 0.00 0.00 179.25 180.73 3faq h ILE 436 N 0.99 0.97 -0.26 0.00 2.04 -1.13 0.28 117.51 120.40 3faq h ILE 436 Ca 0.20 -0.01 0.05 0.00 1.00 0.00 0.00 64.86 66.10 3faq h ILE 436 Cb 0.41 0.93 -0.05 0.00 -0.74 0.00 0.00 36.82 37.37 3faq h ILE 436 CO 0.01 0.01 -0.08 0.78 0.00 0.00 0.00 178.15 178.87 3faq h ASN 437 N 0.04 -0.29 -0.34 1.72 -0.26 -0.85 0.85 115.58 116.45 3faq h ASN 437 Ca 0.03 0.08 0.00 0.00 -0.56 0.00 0.00 56.30 55.86 3faq h ASN 437 Cb 0.02 0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 37.45 3faq h ASN 437 CO -0.04 -0.11 0.22 -0.07 -1.06 0.00 0.00 177.43 176.38 3faq h LEU 438 N -0.03 0.40 -1.86 1.61 3.38 -0.78 -1.60 115.31 116.43 3faq h LEU 438 Ca 0.13 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 3faq h LEU 438 Cb 0.22 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 3faq h LEU 438 CO -0.28 0.30 -0.13 -0.61 0.09 0.00 0.00 178.44 177.80 3faq h GLN 439 N 0.46 0.00 0.00 1.13 5.75 -0.14 -2.53 115.11 119.78 3faq h GLN 439 Ca 0.13 0.00 -0.18 0.00 -0.15 0.00 0.00 58.65 58.45 3faq h GLN 439 Cb -0.04 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.48 3faq h GLN 439 CO -0.03 0.13 -0.84 -0.09 -2.65 0.00 0.00 178.83 175.36 3faq h ARG 440 N 0.00 0.00 -0.48 1.69 9.65 0.08 -2.30 114.38 123.02 3faq h ARG 440 Ca -0.00 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.86 3faq h ARG 440 Cb 0.30 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.85 3faq h ARG 440 CO 0.02 0.84 0.21 0.00 2.80 0.00 0.00 179.97 183.84 3faq h ARG 442 N 0.63 1.01 -0.51 0.00 3.08 -1.50 -1.61 114.38 115.47 3faq h ARG 442 Ca 0.16 -0.22 0.04 0.00 0.07 0.00 0.00 59.98 60.03 3faq h ARG 442 Cb 0.15 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.02 3faq h ARG 442 CO -0.02 0.89 0.27 0.22 -1.07 0.00 0.00 179.97 180.26 3faq h ASP 443 N 0.94 0.40 0.00 7.04 3.58 -1.04 -1.86 116.42 125.47 3faq h ASP 443 Ca 0.21 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.68 3faq h ASP 443 Cb 0.31 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.31 3faq h ASP 443 CO -0.00 0.28 0.00 1.41 -2.88 0.00 0.00 179.24 178.04 3faq n HIS 444 N -4.86 0.00 -2.53 0.28 8.25 -0.56 -4.83 115.22 110.97 3faq n HIS 444 Ca 0.04 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.37 3faq n HIS 444 Cb 0.12 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.24 3faq n HIS 444 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3faq n GLY 445 N 0.70 -0.09 3.77 -1.41 0.00 -0.70 -4.81 105.19 102.64 3faq n GLY 445 Ca 0.18 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 3faq n GLY 445 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3faq s MET 446 N -5.00 4.29 0.67 1.61 -1.94 -0.64 -0.04 119.30 118.24 3faq s MET 446 Ca 0.11 2.31 -0.13 0.00 -1.71 0.00 0.00 55.69 56.27 3faq s MET 446 Cb -0.05 -3.06 0.00 0.00 2.01 0.00 0.00 34.83 33.74 3faq s MET 446 CO 0.14 -0.31 1.08 -2.14 -0.01 0.00 0.00 175.02 173.78 3faq s PRO 447 N -1.60 2.90 1.08 2.03 0.02 -1.26 -4.70 135.00 133.47 3faq s PRO 447 Ca 0.52 1.19 -0.14 0.00 0.02 0.00 0.00 61.00 62.58 3faq s PRO 447 Cb -0.42 -1.98 0.23 0.00 0.02 0.00 0.00 34.50 32.36 3faq s PRO 447 CO 0.53 -1.14 1.09 0.20 -0.33 0.00 0.00 177.00 177.35 3faq s GLY 448 N -3.08 1.56 0.22 0.52 0.00 -1.26 -4.38 107.32 100.90 3faq s GLY 448 Ca 0.63 -0.50 -0.08 0.00 0.00 0.00 0.00 44.72 44.77 3faq s GLY 448 CO 0.46 0.20 1.71 -1.82 0.00 0.00 0.00 173.10 173.65 3faq h TYR 449 N -2.18 0.28 0.00 1.90 3.20 -0.64 -2.26 116.97 117.27 3faq h TYR 449 Ca -0.54 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.37 3faq h TYR 449 Cb 1.33 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.57 3faq h TYR 449 CO -0.30 -0.02 0.00 -0.91 -1.64 0.00 0.00 178.16 175.28 3faq h ASN 450 N 0.30 0.00 -0.20 -2.11 2.35 -1.81 -2.09 115.58 112.03 3faq h ASN 450 Ca 0.36 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.91 3faq h ASN 450 Cb 0.55 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.93 3faq h ASN 450 CO -0.43 0.00 -0.64 0.28 -1.65 0.00 0.00 177.43 174.99 3faq h SER 451 N 0.00 0.93 0.07 5.81 0.02 -1.75 -2.26 113.55 116.38 3faq h SER 451 Ca 0.00 -0.54 -0.19 0.00 -0.84 0.00 0.00 61.79 60.22 3faq h SER 451 Cb 0.47 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.74 3faq h SER 451 CO 0.00 1.34 -0.69 -0.50 -1.14 0.00 0.00 176.83 175.84 3faq h TRP 452 N 0.60 0.75 -0.99 3.45 4.06 -1.48 0.96 115.95 123.30 3faq h TRP 452 Ca -0.01 -0.31 0.01 0.00 2.06 0.00 0.00 58.89 60.64 3faq h TRP 452 Cb 1.25 -0.12 -0.05 0.00 -1.00 0.00 0.00 29.16 29.24 3faq h TRP 452 CO 0.08 1.08 0.66 0.00 -3.56 0.00 0.00 178.44 176.70 3faq h ARG 453 N 0.40 1.31 -0.54 0.49 2.47 -1.38 -0.24 114.38 116.89 3faq h ARG 453 Ca -0.02 -0.08 -0.11 0.00 -1.26 0.00 0.00 59.98 58.51 3faq h ARG 453 Cb 1.27 -0.30 -0.02 0.00 -1.65 0.00 0.00 29.97 29.28 3faq h ARG 453 CO 0.13 0.87 -0.09 0.78 0.56 0.00 0.00 179.97 182.21 3faq h GLY 454 N 1.35 1.10 1.11 0.04 0.00 -1.08 0.12 103.07 105.71 3faq h GLY 454 Ca 0.36 -0.88 0.04 0.00 0.00 0.00 0.00 47.33 46.85 3faq h GLY 454 CO -0.08 0.81 0.51 -2.75 0.00 0.00 0.00 176.54 175.03 3faq h PHE 455 N 0.89 0.90 -0.33 5.60 3.57 0.40 -2.06 116.94 125.92 3faq h PHE 455 Ca 0.14 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.66 3faq h PHE 455 Cb 0.66 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.10 3faq h PHE 455 CO 0.05 0.52 0.00 0.00 -2.23 0.00 0.00 178.31 176.65 3faq n GLY 457 N 1.28 -0.15 3.42 0.00 0.00 -0.77 -5.05 105.19 103.92 3faq n GLY 457 Ca 0.17 -0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 3faq n GLY 457 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3faq s LEU 458 N -5.30 2.56 -0.00 0.99 1.43 0.37 -5.03 118.68 113.71 3faq s LEU 458 Ca 0.10 -1.01 -0.30 0.00 -1.03 0.00 0.00 54.13 51.90 3faq s LEU 458 Cb -0.05 -0.94 -0.07 0.00 0.03 0.00 0.00 46.19 45.16 3faq s LEU 458 CO 0.53 -0.03 1.70 -0.94 0.23 0.00 0.00 176.35 177.84 3faq s SER 459 N -3.35 6.62 -0.60 2.29 1.04 -1.26 -4.31 113.70 114.13 3faq s SER 459 Ca 0.26 2.38 -0.23 0.00 0.48 0.00 0.00 55.95 58.84 3faq s SER 459 Cb -0.04 -2.54 0.05 0.00 0.10 0.00 0.00 66.02 63.59 3faq s SER 459 CO 0.11 -0.93 0.94 -1.10 0.98 0.00 0.00 173.24 173.24 3faq s GLN 460 N 3.65 3.23 -0.03 4.02 -0.21 -1.26 -4.99 119.66 124.06 3faq s GLN 460 Ca 0.76 -0.53 -0.29 0.00 0.02 0.00 0.00 55.36 55.32 3faq s GLN 460 Cb -0.37 -4.13 -0.03 0.00 1.00 0.00 0.00 33.01 29.49 3faq s GLN 460 CO 0.32 -1.62 0.95 -1.25 -2.12 0.00 0.00 175.29 171.58 3faq s PRO 461 N 3.96 4.52 0.00 2.91 0.04 -1.26 -4.94 135.00 140.22 3faq s PRO 461 Ca 0.26 1.35 0.14 0.00 0.04 0.00 0.00 61.00 62.80 3faq s PRO 461 Cb -0.15 -3.48 0.30 0.00 0.04 0.00 0.00 34.50 31.22 3faq s PRO 461 CO 0.15 -0.10 1.20 1.63 0.04 0.00 0.00 177.00 179.92 3faq n LYS 462 N 4.13 2.16 -4.13 4.56 5.02 -1.26 -4.63 118.16 124.01 3faq n LYS 462 Ca 0.06 -1.91 -0.11 0.00 -2.02 0.00 0.00 58.31 54.32 3faq n LYS 462 Cb 0.51 -1.33 -0.11 0.00 -0.02 0.00 0.00 35.03 34.08 3faq n LYS 462 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3faq s THR 463 N -1.09 0.62 0.18 -0.18 -4.23 -1.26 -4.80 115.64 104.88 3faq s THR 463 Ca 0.26 -1.60 -0.24 0.00 -1.18 0.00 0.00 61.69 58.93 3faq s THR 463 Cb 0.15 -1.26 0.07 0.00 1.34 0.00 0.00 72.50 72.80 3faq s THR 463 CO 0.20 -0.69 1.57 0.25 -0.54 0.00 0.00 174.62 175.41 3faq h LEU 464 N 3.57 -1.47 -1.39 4.79 6.46 -1.95 0.52 115.31 125.84 3faq h LEU 464 Ca -0.35 0.25 -0.01 0.00 -0.12 0.00 0.00 57.88 57.65 3faq h LEU 464 Cb 1.18 0.69 -0.02 0.00 -0.73 0.00 0.00 40.66 41.77 3faq h LEU 464 CO 0.55 -0.32 0.25 0.50 -0.62 0.00 0.00 178.44 178.80 3faq h LYS 465 N -0.18 0.66 -0.45 1.25 3.64 -1.98 0.14 116.57 119.65 3faq h LYS 465 Ca 0.21 -0.07 -0.12 0.00 -1.27 0.00 0.00 60.65 59.40 3faq h LYS 465 Cb 0.56 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 3faq h LYS 465 CO -0.74 0.50 -0.17 0.78 -2.27 0.00 0.00 179.45 177.56 3faq h GLY 466 N 0.76 0.99 1.82 5.01 0.00 -0.85 -2.13 103.07 108.67 3faq h GLY 466 Ca 0.17 -0.86 -0.07 0.00 0.00 0.00 0.00 47.33 46.57 3faq h GLY 466 CO -0.03 0.78 -0.23 -2.00 0.00 0.00 0.00 176.54 175.07 3faq h LEU 467 N 0.75 0.21 -0.66 3.11 5.85 0.93 -2.39 115.31 123.10 3faq h LEU 467 Ca 0.11 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.71 3faq h LEU 467 Cb 0.73 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.68 3faq h LEU 467 CO 0.06 0.45 0.20 1.56 -0.34 0.00 0.00 178.44 180.36 3faq h GLN 468 N 0.20 1.04 -0.28 1.25 4.20 -0.36 -1.62 115.11 119.54 3faq h GLN 468 Ca 0.03 -0.23 -0.15 0.00 0.06 0.00 0.00 58.65 58.36 3faq h GLN 468 Cb 0.52 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 3faq h GLN 468 CO 0.04 0.91 -0.43 1.15 -0.67 0.00 0.00 178.83 179.82 3faq h THR 469 N 0.97 1.29 0.21 -0.54 2.02 -1.00 0.25 112.91 116.12 3faq h THR 469 Ca 0.21 -1.62 -0.01 0.00 0.77 0.00 0.00 66.41 65.76 3faq h THR 469 Cb 0.32 1.54 0.00 0.00 -1.74 0.00 0.00 68.15 68.27 3faq h THR 469 CO -0.00 0.52 -0.10 0.58 0.37 0.00 0.00 175.52 176.88 3faq h VAL 470 N 0.57 0.87 0.00 3.16 2.07 -1.30 -3.21 116.25 118.41 3faq h VAL 470 Ca 0.04 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.86 3faq h VAL 470 Cb 0.98 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 3faq h VAL 470 CO 0.09 0.15 0.00 0.18 0.02 0.00 0.00 177.57 178.01 3faq n LEU 471 N -5.06 0.44 -3.88 2.57 4.32 -0.62 -4.68 117.00 110.09 3faq n LEU 471 Ca -0.09 0.55 -0.27 0.00 -0.02 0.00 0.00 56.01 56.18 3faq n LEU 471 Cb 0.24 -0.42 0.02 0.00 -1.62 0.00 0.00 43.42 41.64 3faq n LEU 471 CO 0.31 -0.15 -0.00 0.29 -1.22 0.00 0.00 177.39 176.62 3faq n LYS 472 N -1.92 -4.85 -3.61 3.23 5.02 0.87 -4.48 118.16 112.42 3faq n LYS 472 Ca 0.06 0.56 -0.04 0.00 -2.02 0.00 0.00 58.31 56.87 3faq n LYS 472 Cb 0.36 -5.23 -0.06 0.00 -0.02 0.00 0.00 35.03 30.08 3faq n LYS 472 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3faq s ASN 473 N -3.79 -0.75 -0.07 4.39 3.84 -1.10 -5.05 114.94 112.42 3faq s ASN 473 Ca 0.37 1.25 -0.26 0.00 0.21 0.00 0.00 52.86 54.43 3faq s ASN 473 Cb -0.19 1.87 -0.22 0.00 -0.55 0.00 0.00 41.25 42.17 3faq s ASN 473 CO 0.84 -0.23 1.03 0.11 -2.79 0.00 0.00 177.10 176.06 3faq h LYS 474 N 8.08 -0.03 -0.62 0.43 1.57 -1.93 -2.74 116.57 121.33 3faq h LYS 474 Ca -0.17 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.56 3faq h LYS 474 Cb 1.11 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.40 3faq h LYS 474 CO 0.12 0.63 0.20 0.82 -0.57 0.00 0.00 179.45 180.65 3faq h ILE 475 N -0.72 1.24 0.17 1.86 2.04 -1.98 0.20 117.51 120.32 3faq h ILE 475 Ca -0.00 -0.83 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 3faq h ILE 475 Cb 0.67 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 3faq h ILE 475 CO 0.00 0.32 -0.08 0.25 0.00 0.00 0.00 178.15 178.64 3faq h LEU 476 N 0.89 -0.19 -0.80 1.44 5.85 -1.96 -1.74 115.31 118.79 3faq h LEU 476 Ca 0.20 -0.17 0.16 0.00 0.84 0.00 0.00 57.88 58.91 3faq h LEU 476 Cb 0.28 0.05 -0.10 0.00 0.37 0.00 0.00 40.66 41.26 3faq h LEU 476 CO -0.01 0.07 0.33 0.00 -0.34 0.00 0.00 178.44 178.49 3faq h ALA 477 N 0.33 1.18 -0.71 1.25 0.00 -1.37 -1.65 119.26 118.29 3faq h ALA 477 Ca -0.02 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3faq h ALA 477 Cb 0.35 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3faq h ALA 477 CO 0.04 -0.23 0.25 -0.22 0.00 0.00 0.00 179.25 179.09 3faq h LYS 478 N 0.45 1.06 -0.18 0.00 3.64 -0.70 -2.39 116.57 118.45 3faq h LYS 478 Ca 0.46 -0.20 -0.18 0.00 -1.27 0.00 0.00 60.65 59.45 3faq h LYS 478 Cb 0.74 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.39 3faq h LYS 478 CO -0.44 0.89 -0.63 0.87 -2.27 0.00 0.00 179.45 177.87 3faq h LYS 479 N 1.03 0.65 0.05 1.90 1.57 -0.51 -3.02 116.57 118.25 3faq h LYS 479 Ca 0.23 -0.45 -0.00 0.00 -1.87 0.00 0.00 60.65 58.56 3faq h LYS 479 Cb 0.24 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.62 3faq h LYS 479 CO -0.01 1.07 -0.03 -0.07 -0.57 0.00 0.00 179.45 179.84 3faq h LEU 480 N 0.48 -0.06 -0.87 2.94 4.07 -1.10 -2.76 115.31 118.00 3faq h LEU 480 Ca -0.01 -0.02 0.06 0.00 0.08 0.00 0.00 57.88 58.00 3faq h LEU 480 Cb 1.21 0.02 -0.06 0.00 1.08 0.00 0.00 40.66 42.91 3faq h LEU 480 CO 0.12 -0.02 0.54 0.24 -1.08 0.00 0.00 178.44 178.24 3faq h MET 481 N -0.09 0.95 -0.85 1.13 2.86 -1.48 -0.08 114.93 117.37 3faq h MET 481 Ca -0.01 -0.06 0.05 0.00 -2.06 0.00 0.00 59.70 57.63 3faq h MET 481 Cb 0.08 -0.21 -0.06 0.00 0.06 0.00 0.00 31.60 31.46 3faq h MET 481 CO 0.01 0.63 0.53 -0.44 1.06 0.00 0.00 176.91 178.70 3faq h ASP 482 N 0.98 0.85 0.82 1.22 3.32 -1.36 1.08 116.42 123.32 3faq h ASP 482 Ca 0.38 0.01 -0.19 0.00 0.02 0.00 0.00 57.03 57.25 3faq h ASP 482 Cb 0.18 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 3faq h ASP 482 CO -0.18 0.56 -1.29 -0.07 -1.72 0.00 0.00 179.24 176.54 3faq h LEU 483 N 0.99 0.00 -0.76 1.55 3.38 -1.19 -3.38 115.31 115.90 3faq h LEU 483 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.33 3faq h LEU 483 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3faq h LEU 483 CO -0.16 0.72 -0.28 -1.22 0.09 0.00 0.00 178.44 177.59 3faq n TYR 484 N -3.04 0.00 0.00 1.13 4.01 -0.08 -3.83 117.16 115.35 3faq n TYR 484 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 3faq n TYR 484 Cb 0.89 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.92 3faq n TYR 484 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 3faq n LYS 485 N -0.27 0.00 -3.67 -0.72 4.76 0.37 -4.60 118.16 114.03 3faq n LYS 485 Ca 0.05 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.35 3faq n LYS 485 Cb 0.26 -2.17 -0.08 0.00 -1.84 0.00 0.00 35.03 31.20 3faq n LYS 485 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 3faq s THR 486 N 0.00 0.00 -0.98 -0.18 -1.32 -1.26 -4.99 115.64 106.90 3faq s THR 486 Ca 0.00 -0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.54 3faq s THR 486 Cb 0.00 -0.82 0.06 0.00 -1.51 0.00 0.00 72.50 70.23 3faq s THR 486 CO 0.00 -0.00 1.21 -2.65 -2.21 0.00 0.00 174.62 170.97 3faq n PRO 487 N 2.75 0.00 0.16 7.08 -0.02 -1.26 -1.47 135.00 142.25 3faq n PRO 487 Ca -0.14 0.40 0.01 0.00 -2.02 0.00 0.00 63.50 61.75 3faq n PRO 487 Cb 0.56 -1.51 0.32 0.00 -0.02 0.00 0.00 33.50 32.85 3faq n PRO 487 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3faq h ASP 488 N 0.00 0.05 0.13 2.55 3.32 -1.90 -2.99 116.42 117.58 3faq h ASP 488 Ca 0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3faq h ASP 488 Cb 0.11 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.64 3faq h ASP 488 CO 0.00 0.44 -0.23 0.59 -1.72 0.00 0.00 179.24 178.32 3faq n ASN 489 N -4.06 1.42 -4.67 6.45 4.13 -0.54 -4.09 115.26 113.89 3faq n ASN 489 Ca -0.02 -1.19 -0.42 0.00 1.68 0.00 0.00 54.58 54.64 3faq n ASN 489 Cb 0.43 0.16 -0.03 0.00 -1.54 0.00 0.00 39.78 38.81 3faq n ASN 489 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3faq s ILE 490 N -2.37 3.00 0.26 2.41 1.01 -1.13 -4.82 121.20 119.56 3faq s ILE 490 Ca 0.26 0.26 -0.30 0.00 0.00 0.00 0.00 60.65 60.87 3faq s ILE 490 Cb 0.19 -3.17 -0.11 0.00 0.01 0.00 0.00 42.46 39.39 3faq s ILE 490 CO 0.48 -0.01 1.53 -1.81 0.00 0.00 0.00 174.94 175.13 3faq s ASP 491 N 3.33 6.50 0.31 3.58 1.01 -1.26 -0.08 116.67 130.06 3faq s ASP 491 Ca 0.80 2.81 0.07 0.00 0.71 0.00 0.00 52.55 56.95 3faq s ASP 491 Cb -0.41 -2.63 0.84 0.00 1.01 0.00 0.00 42.92 41.73 3faq s ASP 491 CO 0.36 -0.82 1.70 -0.29 0.21 0.00 0.00 175.17 176.32 3faq h ILE 492 N 3.51 0.45 0.02 0.77 6.09 -1.87 0.50 117.51 126.97 3faq h ILE 492 Ca -0.46 -0.15 -0.00 0.00 -1.37 0.00 0.00 64.86 62.88 3faq h ILE 492 Cb 1.22 -0.02 -0.00 0.00 0.47 0.00 0.00 36.82 38.49 3faq h ILE 492 CO 0.80 0.08 -0.01 -0.25 -3.07 0.00 0.00 178.15 175.70 3faq h TRP 493 N 0.43 -0.03 0.00 2.19 7.01 -1.90 0.71 115.95 124.36 3faq h TRP 493 Ca 0.62 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.61 3faq h TRP 493 Cb 1.22 0.01 -0.00 0.00 -2.10 0.00 0.00 29.16 28.29 3faq h TRP 493 CO -0.08 -0.02 -0.01 0.97 -2.79 0.00 0.00 178.44 176.51 3faq h ILE 494 N -0.03 0.04 0.41 2.65 2.10 -1.94 -2.33 117.51 118.42 3faq h ILE 494 Ca -0.00 -0.26 -0.02 0.00 1.08 0.00 0.00 64.86 65.66 3faq h ILE 494 Cb 0.02 1.25 0.00 0.00 -1.09 0.00 0.00 36.82 37.00 3faq h ILE 494 CO 0.00 0.01 -0.20 1.23 -1.08 0.00 0.00 178.15 178.11 3faq h GLY 495 N 0.96 -0.57 2.00 8.18 0.00 0.48 -2.85 103.07 111.27 3faq h GLY 495 Ca -0.00 0.21 -0.06 0.00 0.00 0.00 0.00 47.33 47.49 3faq h GLY 495 CO 0.00 -0.21 -0.26 -1.33 0.00 0.00 0.00 176.54 174.74 3faq h GLY 496 N -0.89 0.00 1.48 4.60 0.00 0.71 -3.18 103.07 105.78 3faq h GLY 496 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.27 3faq h GLY 496 CO 0.09 0.00 -0.39 3.43 0.00 0.00 0.00 176.54 179.67 3faq h ASN 497 N 0.00 0.00 1.12 0.19 4.21 -1.48 -3.28 115.58 116.35 3faq h ASN 497 Ca -0.00 -0.13 0.00 0.00 1.21 0.00 0.00 56.30 57.38 3faq h ASN 497 Cb 0.51 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.71 3faq h ASN 497 CO 0.03 0.06 -0.16 0.00 -1.29 0.00 0.00 177.43 176.07 3faq n ALA 498 N -1.83 2.54 -1.77 -0.83 0.00 -1.08 -4.84 120.51 112.70 3faq n ALA 498 Ca 0.04 -0.12 -0.37 0.00 0.00 0.00 0.00 53.44 52.99 3faq n ALA 498 Cb 0.44 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.49 3faq n ALA 498 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3faq s GLU 499 N -3.07 4.03 0.58 0.00 2.02 -1.24 -4.88 118.70 116.14 3faq s GLU 499 Ca 0.11 1.71 -0.18 0.00 0.02 0.00 0.00 54.97 56.63 3faq s GLU 499 Cb 0.15 -2.57 -0.04 0.00 0.10 0.00 0.00 34.13 31.77 3faq s GLU 499 CO 0.61 -0.31 1.10 -1.25 0.02 0.00 0.00 175.26 175.44 3faq s PRO 500 N -2.45 3.21 0.53 0.39 0.05 -1.26 -4.39 135.00 131.08 3faq s PRO 500 Ca 0.59 1.46 -0.21 0.00 0.05 0.00 0.00 61.00 62.89 3faq s PRO 500 Cb -0.27 -2.00 -0.06 0.00 0.05 0.00 0.00 34.50 32.22 3faq s PRO 500 CO 0.34 -0.93 1.19 -1.64 0.05 0.00 0.00 177.00 176.01 3faq s MET 501 N -3.65 3.36 0.79 4.56 -1.94 -1.26 -3.88 119.30 117.28 3faq s MET 501 Ca 0.69 1.80 -0.12 0.00 -1.71 0.00 0.00 55.69 56.35 3faq s MET 501 Cb -0.21 -2.15 0.07 0.00 2.01 0.00 0.00 34.83 34.55 3faq s MET 501 CO 0.32 -0.88 1.11 0.14 -0.01 0.00 0.00 175.02 175.70 3faq s VAL 502 N -1.59 2.87 -0.49 -6.03 -7.23 -0.42 -4.88 120.40 102.63 3faq s VAL 502 Ca 0.71 0.28 -0.32 0.00 -1.81 0.00 0.00 61.98 60.84 3faq s VAL 502 Cb -0.29 -3.13 -0.12 0.00 0.56 0.00 0.00 36.38 33.40 3faq s VAL 502 CO 0.34 -0.37 2.33 1.21 -0.31 0.00 0.00 175.10 178.30 3faq n GLU 503 N -3.36 0.88 -0.97 4.82 2.13 -1.26 -1.77 120.64 121.11 3faq n GLU 503 Ca 0.07 0.17 0.00 0.00 0.66 0.00 0.00 57.16 58.06 3faq n GLU 503 Cb 0.58 -2.52 0.00 0.00 0.27 0.00 0.00 31.44 29.77 3faq n GLU 503 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3faq n ARG 504 N 8.44 -0.50 -0.06 5.31 5.12 -1.26 -1.68 116.66 132.03 3faq n ARG 504 Ca 0.45 0.12 0.00 0.00 -1.93 0.00 0.00 57.85 56.49 3faq n ARG 504 Cb 0.27 -3.52 0.00 0.00 -1.16 0.00 0.00 32.46 28.05 3faq n ARG 504 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3faq n GLY 505 N -1.83 4.87 0.28 -0.13 0.00 -0.73 -4.14 105.19 103.52 3faq n GLY 505 Ca 0.00 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.98 3faq n GLY 505 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3faq n ARG 506 N -0.02 0.13 -3.89 1.61 5.12 0.16 -4.75 116.66 115.01 3faq n ARG 506 Ca 0.00 -0.89 -0.09 0.00 -1.93 0.00 0.00 57.85 54.95 3faq n ARG 506 Cb 0.00 -0.55 -0.08 0.00 -1.16 0.00 0.00 32.46 30.67 3faq n ARG 506 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 3faq s VAL 507 N -0.14 0.15 0.61 1.55 -7.23 -1.22 -4.94 120.40 109.18 3faq s VAL 507 Ca 0.01 -1.26 -0.10 0.00 -1.81 0.00 0.00 61.98 58.82 3faq s VAL 507 Cb 0.01 -1.34 0.14 0.00 0.56 0.00 0.00 36.38 35.76 3faq s VAL 507 CO 0.00 -0.69 0.77 0.61 -0.31 0.00 0.00 175.10 175.48 3faq n GLY 508 N 0.02 -1.59 0.28 2.32 0.00 -1.25 -1.31 105.19 103.66 3faq n GLY 508 Ca -0.15 -1.65 -0.05 0.00 0.00 0.00 0.00 46.02 44.16 3faq n GLY 508 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3faq h PRO 509 N 0.00 0.94 0.21 1.61 0.11 -1.93 -1.68 132.00 131.27 3faq h PRO 509 Ca -0.26 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 3faq h PRO 509 Cb 0.72 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.62 3faq h PRO 509 CO 0.18 0.63 -0.10 1.25 -0.21 0.00 0.00 178.00 179.75 3faq h LEU 510 N 0.97 -0.24 -1.08 2.35 5.85 -1.93 -2.91 115.31 118.32 3faq h LEU 510 Ca 0.26 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 3faq h LEU 510 Cb -0.10 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 3faq h LEU 510 CO -0.06 0.06 0.28 -0.07 -0.34 0.00 0.00 178.44 178.32 3faq h LEU 511 N -0.56 0.85 -0.78 2.25 4.07 -1.79 -2.33 115.31 117.02 3faq h LEU 511 Ca -0.03 -0.10 0.07 0.00 0.08 0.00 0.00 57.88 57.90 3faq h LEU 511 Cb 0.41 -0.22 -0.06 0.00 1.08 0.00 0.00 40.66 41.87 3faq h LEU 511 CO 0.05 0.74 0.46 0.00 -1.08 0.00 0.00 178.44 178.61 3faq h ALA 512 N 1.39 1.08 -0.05 1.53 0.00 -1.30 0.28 119.26 122.18 3faq h ALA 512 Ca 0.22 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 3faq h ALA 512 Cb 0.14 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 3faq h ALA 512 CO -0.02 0.14 -0.01 0.00 0.00 0.00 0.00 179.25 179.36 3faq h LEU 514 N -0.24 0.75 0.75 0.00 3.38 -1.24 -0.77 115.31 117.94 3faq h LEU 514 Ca 0.01 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 3faq h LEU 514 Cb 0.39 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.95 3faq h LEU 514 CO 0.00 0.69 -0.36 -0.07 0.09 0.00 0.00 178.44 178.80 3faq h LEU 515 N 0.75 -0.85 -0.77 1.67 3.38 -0.38 -2.87 115.31 116.23 3faq h LEU 515 Ca 0.19 0.03 0.16 0.00 0.09 0.00 0.00 57.88 58.34 3faq h LEU 515 Cb 0.17 0.22 -0.10 0.00 0.09 0.00 0.00 40.66 41.03 3faq h LEU 515 CO -0.02 -0.48 0.29 1.23 0.09 0.00 0.00 178.44 179.55 3faq h GLY 516 N -1.27 1.18 0.86 0.83 0.00 0.12 -1.64 103.07 103.15 3faq h GLY 516 Ca -0.10 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 3faq h GLY 516 CO 0.17 -0.15 -0.36 3.21 0.00 0.00 0.00 176.54 179.41 3faq h ARG 517 N 0.40 -0.87 -0.83 4.80 3.08 -1.18 -0.68 114.38 119.09 3faq h ARG 517 Ca 0.44 0.06 0.13 0.00 0.07 0.00 0.00 59.98 60.68 3faq h ARG 517 Cb 0.71 0.20 -0.09 0.00 0.08 0.00 0.00 29.97 30.87 3faq h ARG 517 CO -0.45 -0.58 0.43 0.37 -1.07 0.00 0.00 179.97 178.67 3faq h GLN 518 N -0.90 0.63 0.00 0.04 5.75 -1.23 -1.50 115.11 117.89 3faq h GLN 518 Ca -0.07 -0.04 -0.05 0.00 -0.15 0.00 0.00 58.65 58.34 3faq h GLN 518 Cb 0.73 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 29.13 3faq h GLN 518 CO 0.08 0.41 -0.25 0.74 -2.65 0.00 0.00 178.83 177.16 3faq h PHE 519 N 0.64 0.00 0.00 3.99 0.04 -1.11 -2.27 116.94 118.23 3faq h PHE 519 Ca 0.44 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 61.11 3faq h PHE 519 Cb 0.58 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.71 3faq h PHE 519 CO -0.09 0.25 -0.48 0.37 -0.60 0.00 0.00 178.31 177.76 3faq h GLN 520 N 0.00 0.00 0.04 1.51 -0.00 -0.15 -3.27 115.11 113.24 3faq h GLN 520 Ca -0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 58.65 58.40 3faq h GLN 520 Cb 0.84 0.00 -0.02 0.00 0.00 0.00 0.00 27.48 28.30 3faq h GLN 520 CO 0.03 0.48 -1.21 1.96 0.00 0.00 0.00 178.83 180.09 3faq h GLN 521 N 0.00 0.08 0.00 1.69 4.20 -1.02 -2.80 115.11 117.26 3faq h GLN 521 Ca -0.00 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.57 3faq h GLN 521 Cb 1.29 0.05 0.00 0.00 0.30 0.00 0.00 27.48 29.13 3faq h GLN 521 CO 0.06 0.98 -0.24 -0.84 -0.67 0.00 0.00 178.83 178.13 3faq h ILE 522 N 0.02 0.00 0.00 2.54 3.07 -1.51 -2.93 117.51 118.71 3faq h ILE 522 Ca -0.10 -0.99 -0.10 0.00 1.55 0.00 0.00 64.86 65.22 3faq h ILE 522 Cb 1.87 1.87 -0.01 0.00 -0.27 0.00 0.00 36.82 40.28 3faq h ILE 522 CO 0.14 0.00 -0.54 -0.09 -1.05 0.00 0.00 178.15 176.61 3faq h ARG 523 N 0.00 0.01 0.00 0.16 1.12 -1.66 -3.21 114.38 110.80 3faq h ARG 523 Ca 0.00 -0.02 -0.09 0.00 -1.11 0.00 0.00 59.98 58.76 3faq h ARG 523 Cb 0.99 0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.95 3faq h ARG 523 CO 0.00 1.01 -0.43 -0.44 -3.11 0.00 0.00 179.97 177.00 3faq h ASP 524 N -0.97 0.00 -0.18 -3.80 3.32 -1.62 -3.00 116.42 110.17 3faq h ASP 524 Ca -0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.90 3faq h ASP 524 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 3faq h ASP 524 CO -0.08 0.43 0.00 0.61 -1.72 0.00 0.00 179.24 178.48 3faq n GLY 525 N -0.27 0.71 3.54 2.75 0.00 -1.10 -0.26 105.19 110.56 3faq n GLY 525 Ca -0.02 -0.54 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 3faq n GLY 525 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3faq s ASP 526 N -1.67 6.38 0.22 1.61 2.15 -1.13 -4.79 116.67 119.43 3faq s ASP 526 Ca 0.34 -0.15 0.19 0.00 0.43 0.00 0.00 52.55 53.36 3faq s ASP 526 Cb 0.20 -2.35 0.89 0.00 -0.30 0.00 0.00 42.92 41.35 3faq s ASP 526 CO 0.29 -0.81 1.57 -1.14 -0.17 0.00 0.00 175.17 174.92 3faq n ARG 527 N 6.42 0.13 -0.40 4.34 0.63 -1.26 -2.04 116.66 124.47 3faq n ARG 527 Ca 0.00 0.49 0.08 0.00 -0.92 0.00 0.00 57.85 57.51 3faq n ARG 527 Cb 0.48 -1.81 0.24 0.00 0.45 0.00 0.00 32.46 31.82 3faq n ARG 527 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 3faq n PHE 528 N -2.07 0.86 -1.61 -0.14 3.01 -1.26 -4.95 117.46 111.31 3faq n PHE 528 Ca 0.01 -0.82 -0.42 0.00 1.01 0.00 0.00 57.45 57.22 3faq n PHE 528 Cb 0.12 -0.27 0.00 0.00 -0.01 0.00 0.00 39.48 39.32 3faq n PHE 528 CO 0.00 0.00 0.00 1.87 1.01 0.00 0.00 176.76 179.64 3faq n TRP 529 N -0.37 1.24 0.28 1.38 -0.00 -0.87 -4.83 117.44 114.26 3faq n TRP 529 Ca 0.20 0.59 0.13 0.00 -0.00 0.00 0.00 57.50 58.41 3faq n TRP 529 Cb 0.82 -2.24 0.80 0.00 -0.00 0.00 0.00 31.31 30.69 3faq n TRP 529 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 177.69 177.80 3faq h TRP 530 N 1.69 0.00 0.00 5.87 5.08 -1.94 -2.62 115.95 124.03 3faq h TRP 530 Ca -0.44 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.53 3faq h TRP 530 Cb 1.34 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.50 3faq h TRP 530 CO 0.45 0.05 -0.83 0.93 -1.28 0.00 0.00 178.44 177.76 3faq h GLU 531 N 0.00 0.00 -6.21 0.12 5.08 -1.99 -3.41 114.58 108.18 3faq h GLU 531 Ca -0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 3faq h GLU 531 Cb 0.12 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.38 3faq h GLU 531 CO 0.01 0.00 1.30 -1.71 -1.00 0.00 0.00 179.01 177.61 3faq n ASN 532 N -2.41 3.64 -4.34 1.42 5.15 -0.99 -4.82 115.26 112.92 3faq n ASN 532 Ca 0.02 0.67 -0.57 0.00 -0.60 0.00 0.00 54.58 54.09 3faq n ASN 532 Cb 0.50 -1.49 -0.08 0.00 -0.53 0.00 0.00 39.78 38.18 3faq n ASN 532 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 3faq n PRO 533 N 7.79 0.00 -0.13 1.20 -0.02 -1.26 -2.27 135.00 140.31 3faq n PRO 533 Ca 0.25 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 3faq n PRO 533 Cb 0.39 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 3faq n PRO 533 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3faq n GLY 534 N 1.64 1.14 0.18 -1.23 0.00 -1.26 -4.92 105.19 100.75 3faq n GLY 534 Ca 0.20 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 3faq n GLY 534 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3faq h VAL 535 N 0.00 1.29 -3.24 1.61 2.07 -1.77 -3.46 116.25 112.74 3faq h VAL 535 Ca 0.00 -2.39 -0.51 0.00 0.82 0.00 0.00 66.70 64.62 3faq h VAL 535 Cb 0.00 2.56 -0.13 0.00 -1.52 0.00 0.00 31.29 32.19 3faq h VAL 535 CO 0.00 0.73 -0.52 -0.36 0.02 0.00 0.00 177.57 177.44 3faq s PHE 536 N -3.13 1.75 0.09 1.57 0.40 -1.26 -5.12 117.98 112.28 3faq s PHE 536 Ca -0.09 -1.35 0.02 0.00 -0.60 0.00 0.00 56.93 54.92 3faq s PHE 536 Cb 0.06 -1.04 -0.04 0.00 0.51 0.00 0.00 43.02 42.52 3faq s PHE 536 CO 0.93 -0.42 0.14 0.95 0.70 0.00 0.00 175.22 177.52 3faq s THR 537 N -3.33 4.83 0.52 0.64 -4.23 -1.26 -4.92 115.64 107.89 3faq s THR 537 Ca 0.29 -0.70 0.42 0.00 -1.18 0.00 0.00 61.69 60.52 3faq s THR 537 Cb 0.03 -3.37 0.63 0.00 1.34 0.00 0.00 72.50 71.14 3faq s THR 537 CO 0.17 0.08 1.61 -0.33 -0.54 0.00 0.00 174.62 175.62 3faq h GLU 538 N 3.03 0.02 0.23 3.99 5.08 -2.01 0.72 114.58 125.64 3faq h GLU 538 Ca -0.46 -0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.56 3faq h GLU 538 Cb 1.17 -0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.44 3faq h GLU 538 CO 0.69 0.01 -1.53 -0.22 -1.00 0.00 0.00 179.01 176.96 3faq h LYS 539 N 0.02 0.48 0.20 2.33 3.64 -1.96 -3.16 116.57 118.13 3faq h LYS 539 Ca 0.86 -0.82 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 3faq h LYS 539 Cb 3.22 0.31 -0.00 0.00 -0.41 0.00 0.00 32.23 35.34 3faq h LYS 539 CO -0.16 1.39 -0.12 1.96 -2.27 0.00 0.00 179.45 180.25 3faq h GLN 540 N 0.13 -0.29 -0.91 1.90 4.20 0.05 -2.29 115.11 117.90 3faq h GLN 540 Ca -0.27 0.02 0.17 0.00 0.06 0.00 0.00 58.65 58.63 3faq h GLN 540 Cb 2.14 0.07 -0.07 0.00 0.30 0.00 0.00 27.48 29.91 3faq h GLN 540 CO 0.25 -0.20 0.59 0.00 -0.67 0.00 0.00 178.83 178.80 3faq h ARG 541 N -0.31 0.58 -0.24 1.46 3.08 -1.06 0.45 114.38 118.35 3faq h ARG 541 Ca -0.02 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3faq h ARG 541 Cb 0.25 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 3faq h ARG 541 CO 0.03 0.39 0.15 -0.44 -1.07 0.00 0.00 179.97 179.02 3faq h ASP 542 N 0.60 0.28 0.03 7.04 3.32 -1.38 0.13 116.42 126.44 3faq h ASP 542 Ca 0.47 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.43 3faq h ASP 542 Cb 0.91 -0.07 0.01 0.00 0.22 0.00 0.00 39.33 40.39 3faq h ASP 542 CO -0.22 0.21 -0.34 0.28 -1.72 0.00 0.00 179.24 177.45 3faq h SER 543 N 0.33 0.26 -0.91 6.45 0.02 0.06 -3.34 113.55 116.41 3faq h SER 543 Ca 0.09 -0.85 -0.01 0.00 -0.84 0.00 0.00 61.79 60.17 3faq h SER 543 Cb -0.02 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.39 3faq h SER 543 CO -0.02 1.08 0.52 -0.07 -1.14 0.00 0.00 176.83 177.20 3faq h LEU 544 N -0.53 1.13 -1.50 5.07 3.38 -0.73 -1.25 115.31 120.88 3faq h LEU 544 Ca -0.05 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.83 3faq h LEU 544 Cb 1.16 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.62 3faq h LEU 544 CO 0.07 0.89 0.33 1.56 0.09 0.00 0.00 178.44 181.38 3faq h GLN 545 N 1.27 0.00 -0.02 1.13 4.20 -0.87 0.62 115.11 121.45 3faq h GLN 545 Ca 0.32 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.03 3faq h GLN 545 Cb -0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3faq h GLN 545 CO -0.05 0.00 -0.17 1.63 -0.67 0.00 0.00 178.83 179.56 3faq n LYS 546 N -2.55 1.47 -1.26 1.46 5.02 -0.47 -4.95 118.16 116.87 3faq n LYS 546 Ca -0.02 -1.03 -0.36 0.00 -2.02 0.00 0.00 58.31 54.89 3faq n LYS 546 Cb 0.37 -1.48 0.08 0.00 -0.02 0.00 0.00 35.03 33.98 3faq n LYS 546 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3faq n PHE 547 N 0.13 -0.35 -3.55 2.13 0.99 0.21 -4.83 117.46 112.19 3faq n PHE 547 Ca 0.14 0.36 -0.17 0.00 -0.00 0.00 0.00 57.45 57.78 3faq n PHE 547 Cb 0.43 -1.96 -0.06 0.00 -1.00 0.00 0.00 39.48 36.88 3faq n PHE 547 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 3faq s SER 548 N -1.56 -0.67 0.42 4.37 1.04 -1.26 -5.02 113.70 111.02 3faq s SER 548 Ca 0.68 0.87 0.21 0.00 0.48 0.00 0.00 55.95 58.19 3faq s SER 548 Cb -0.34 0.75 0.91 0.00 0.10 0.00 0.00 66.02 67.44 3faq s SER 548 CO 0.56 -0.52 1.84 0.15 0.98 0.00 0.00 173.24 176.25 3faq h PHE 549 N 3.51 0.00 -0.07 5.02 3.57 -1.95 -2.79 116.94 124.23 3faq h PHE 549 Ca -0.28 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.23 3faq h PHE 549 Cb 1.15 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.88 3faq h PHE 549 CO 0.39 0.28 0.04 0.77 -2.23 0.00 0.00 178.31 177.56 3faq h SER 550 N 0.00 0.07 -0.55 0.41 0.02 -1.93 -1.89 113.55 109.68 3faq h SER 550 Ca -0.00 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.95 3faq h SER 550 Cb 0.71 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.21 3faq h SER 550 CO 0.04 0.05 0.36 -0.09 -1.14 0.00 0.00 176.83 176.05 3faq h ARG 551 N 0.09 0.71 -0.73 3.45 9.65 -1.80 -0.74 114.38 125.02 3faq h ARG 551 Ca 0.03 -0.04 0.12 0.00 -1.10 0.00 0.00 59.98 58.99 3faq h ARG 551 Cb -0.01 -0.16 -0.09 0.00 -1.39 0.00 0.00 29.97 28.32 3faq h ARG 551 CO -0.01 0.47 0.31 1.25 2.80 0.00 0.00 179.97 184.79 3faq h LEU 552 N 0.74 0.32 -0.42 3.80 5.85 -1.23 1.00 115.31 125.37 3faq h LEU 552 Ca 0.20 0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.95 3faq h LEU 552 Cb -0.08 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 3faq h LEU 552 CO -0.05 0.15 -0.00 0.40 -0.34 0.00 0.00 178.44 178.60 3faq h ILE 553 N 0.48 1.26 -0.50 4.05 2.04 -0.64 -2.63 117.51 121.57 3faq h ILE 553 Ca 0.39 -1.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.21 3faq h ILE 553 Cb 0.53 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 3faq h ILE 553 CO -0.36 0.35 0.28 0.00 0.00 0.00 0.00 178.15 178.42 3faq n ASP 555 N -4.66 0.34 -0.12 0.00 8.00 0.20 -4.15 116.55 116.16 3faq n ASP 555 Ca 0.02 -0.63 0.01 0.00 0.71 0.00 0.00 54.79 54.90 3faq n ASP 555 Cb 0.08 -0.10 0.02 0.00 -0.02 0.00 0.00 41.12 41.09 3faq n ASP 555 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3faq n ASN 556 N -0.96 0.76 -3.68 -2.24 3.02 -0.99 -5.00 115.26 106.16 3faq n ASN 556 Ca 0.17 -1.70 -0.09 0.00 -0.03 0.00 0.00 54.58 52.93 3faq n ASN 556 Cb 0.24 -0.09 -0.02 0.00 -0.61 0.00 0.00 39.78 39.29 3faq n ASN 556 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3faq s THR 557 N -0.58 0.00 -0.34 3.41 -4.23 -1.01 -4.95 115.64 107.94 3faq s THR 557 Ca 0.04 -1.18 0.12 0.00 -1.18 0.00 0.00 61.69 59.49 3faq s THR 557 Cb 0.03 -2.28 0.72 0.00 1.34 0.00 0.00 72.50 72.31 3faq s THR 557 CO 0.00 0.00 1.59 1.41 -0.54 0.00 0.00 174.62 177.08 3faq n HIS 558 N -0.46 1.83 -2.32 3.99 8.25 -1.26 -4.72 115.22 120.52 3faq n HIS 558 Ca -0.04 -0.63 -0.37 0.00 -0.26 0.00 0.00 57.72 56.42 3faq n HIS 558 Cb 0.60 -0.46 -0.02 0.00 1.12 0.00 0.00 29.99 31.23 3faq n HIS 558 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3faq s ILE 559 N -2.54 3.24 0.00 1.59 -1.09 -1.26 -4.92 121.20 116.22 3faq s ILE 559 Ca 0.48 0.97 0.00 0.00 -2.23 0.00 0.00 60.65 59.87 3faq s ILE 559 Cb 0.36 -3.52 0.00 0.00 -1.58 0.00 0.00 42.46 37.73 3faq s ILE 559 CO 0.14 0.03 0.00 0.35 -1.23 0.00 0.00 174.94 174.23 3faq n THR 560 N -0.20 0.00 -4.05 2.92 -2.24 -1.26 -4.71 114.28 104.74 3faq n THR 560 Ca 0.06 -0.20 -0.31 0.00 -2.27 0.00 0.00 64.05 61.32 3faq n THR 560 Cb 0.48 0.70 -0.16 0.00 -2.10 0.00 0.00 70.33 69.24 3faq n THR 560 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3faq s LYS 561 N -1.41 2.48 0.04 -0.78 1.02 -1.26 -0.66 119.74 119.18 3faq s LYS 561 Ca 0.00 -0.78 0.00 0.00 0.02 0.00 0.00 55.97 55.22 3faq s LYS 561 Cb 0.00 -2.40 -0.03 0.00 -0.52 0.00 0.00 37.83 34.88 3faq s LYS 561 CO 0.00 -0.29 -0.04 0.14 -0.92 0.00 0.00 175.35 174.23 3faq s VAL 562 N 1.37 0.29 0.57 3.17 -7.23 -0.85 -4.92 120.40 112.80 3faq s VAL 562 Ca 0.03 -1.39 -0.18 0.00 -1.81 0.00 0.00 61.98 58.63 3faq s VAL 562 Cb -0.14 -0.94 -0.05 0.00 0.56 0.00 0.00 36.38 35.81 3faq s VAL 562 CO -0.11 -0.71 1.09 -2.16 -0.31 0.00 0.00 175.10 172.91 3faq s PRO 563 N -2.65 3.32 0.11 4.82 0.04 -1.26 -2.72 135.00 136.66 3faq s PRO 563 Ca -0.03 1.44 0.26 0.00 0.04 0.00 0.00 61.00 62.70 3faq s PRO 563 Cb -0.02 -2.02 0.74 0.00 0.04 0.00 0.00 34.50 33.24 3faq s PRO 563 CO -0.04 -0.84 1.64 -0.11 0.04 0.00 0.00 177.00 177.68 3faq n LEU 564 N -1.61 0.57 -3.40 -3.56 7.94 -1.26 -4.21 117.00 111.47 3faq n LEU 564 Ca 0.10 0.39 -0.27 0.00 -1.11 0.00 0.00 56.01 55.12 3faq n LEU 564 Cb 0.52 -0.31 -0.10 0.00 0.53 0.00 0.00 43.42 44.05 3faq n LEU 564 CO 0.44 -0.07 -0.32 -1.00 -1.11 0.00 0.00 177.39 175.33 3faq s HIS 565 N -3.08 0.99 0.52 1.96 3.76 -1.26 -4.95 115.29 113.23 3faq s HIS 565 Ca 0.10 -2.18 0.24 0.00 -0.15 0.00 0.00 55.06 53.07 3faq s HIS 565 Cb 0.15 -0.90 1.37 0.00 1.11 0.00 0.00 32.58 34.30 3faq s HIS 565 CO 0.63 -0.83 1.99 0.00 -0.85 0.00 0.00 174.74 175.68 3faq h ALA 566 N 5.90 2.46 0.00 -1.40 0.00 -1.99 -2.85 119.26 121.38 3faq h ALA 566 Ca 0.23 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3faq h ALA 566 Cb 0.92 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3faq h ALA 566 CO 0.35 -0.61 0.00 0.74 0.00 0.00 0.00 179.25 179.72 3faq h PHE 567 N 0.04 0.00 -2.33 0.00 0.04 -1.95 -3.42 116.94 109.32 3faq h PHE 567 Ca 0.26 0.00 -0.44 0.00 2.80 0.00 0.00 57.97 60.59 3faq h PHE 567 Cb 0.98 0.00 0.04 0.00 2.20 0.00 0.00 35.95 39.17 3faq h PHE 567 CO -0.00 0.00 -0.09 1.14 -0.60 0.00 0.00 178.31 178.76 3faq s GLN 568 N -3.42 2.64 -0.13 1.51 -2.07 -1.08 -2.13 119.66 114.99 3faq s GLN 568 Ca 0.04 -0.84 -0.29 0.00 -1.82 0.00 0.00 55.36 52.45 3faq s GLN 568 Cb 0.07 -2.55 -0.04 0.00 -1.09 0.00 0.00 33.01 29.41 3faq s GLN 568 CO 0.60 -0.59 1.59 0.00 -1.32 0.00 0.00 175.29 175.57 3faq s ALA 569 N -2.66 3.50 -0.21 2.60 0.00 -1.25 -3.90 121.76 119.83 3faq s ALA 569 Ca 0.56 0.71 0.01 0.00 0.00 0.00 0.00 51.96 53.24 3faq s ALA 569 Cb -0.10 -3.77 0.03 0.00 0.00 0.00 0.00 23.12 19.28 3faq s ALA 569 CO 0.37 -1.56 -0.15 -0.80 0.00 0.00 0.00 175.76 173.62 3faq s ASN 570 N 3.49 3.66 0.03 0.00 -0.87 -1.26 -4.96 114.94 115.03 3faq s ASN 570 Ca 0.70 -0.83 -0.21 0.00 -1.57 0.00 0.00 52.86 50.95 3faq s ASN 570 Cb -0.29 -1.54 -0.06 0.00 -0.02 0.00 0.00 41.25 39.35 3faq s ASN 570 CO 0.27 -0.06 0.63 0.20 -2.57 0.00 0.00 177.10 175.57 3faq s ASN 571 N 1.26 7.06 -0.08 -1.22 0.01 -1.26 -4.65 114.94 116.06 3faq s ASN 571 Ca 0.01 1.26 -0.12 0.00 -0.71 0.00 0.00 52.86 53.31 3faq s ASN 571 Cb -0.15 -2.39 -0.05 0.00 0.41 0.00 0.00 41.25 39.07 3faq s ASN 571 CO -0.09 0.14 0.28 -0.47 -1.51 0.00 0.00 177.10 175.45 3faq s TYR 572 N -0.46 3.61 -1.87 2.20 5.04 -1.26 -2.04 117.35 122.56 3faq s TYR 572 Ca 0.32 0.73 0.17 0.00 -2.44 0.00 0.00 57.07 55.85 3faq s TYR 572 Cb -0.19 -2.18 0.29 0.00 0.35 0.00 0.00 41.96 40.23 3faq s TYR 572 CO 0.19 0.57 1.21 -0.35 -1.34 0.00 0.00 175.55 175.83 3faq n PRO 573 N 2.34 2.04 0.03 4.97 -0.04 -1.26 -4.98 135.00 138.10 3faq n PRO 573 Ca -0.15 -1.91 -0.15 0.00 -0.04 0.00 0.00 63.50 61.25 3faq n PRO 573 Cb 0.53 -1.38 -0.09 0.00 -0.04 0.00 0.00 33.50 32.52 3faq n PRO 573 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3faq h HIS 574 N 3.34 -1.49 0.00 0.54 2.76 -1.98 -1.86 115.15 116.46 3faq h HIS 574 Ca 0.00 0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 3faq h HIS 574 Cb 0.79 0.66 0.00 0.00 1.55 0.00 0.00 27.41 30.41 3faq h HIS 574 CO 0.16 -0.53 0.00 -0.25 -1.30 0.00 0.00 177.93 176.02 3faq n ASP 575 N -5.24 0.00 -4.66 3.26 8.00 -0.87 -4.71 116.55 112.34 3faq n ASP 575 Ca -0.06 0.34 -0.37 0.00 0.71 0.00 0.00 54.79 55.40 3faq n ASP 575 Cb 0.36 -0.41 -0.09 0.00 -0.02 0.00 0.00 41.12 40.97 3faq n ASP 575 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3faq s PHE 576 N -2.82 3.33 0.49 1.24 0.40 -0.70 -4.23 117.98 115.70 3faq s PHE 576 Ca 0.07 0.39 0.06 0.00 -0.60 0.00 0.00 56.93 56.85 3faq s PHE 576 Cb 0.07 -2.39 0.01 0.00 0.51 0.00 0.00 43.02 41.22 3faq s PHE 576 CO 0.18 0.01 0.36 0.14 0.70 0.00 0.00 175.22 176.62 3faq s VAL 577 N 1.24 2.02 0.13 -0.44 -7.23 -1.10 -4.88 120.40 110.13 3faq s VAL 577 Ca 0.12 -1.48 -0.15 0.00 -1.81 0.00 0.00 61.98 58.66 3faq s VAL 577 Cb -0.14 -2.50 -0.07 0.00 0.56 0.00 0.00 36.38 34.23 3faq s VAL 577 CO 0.06 0.00 0.54 -0.62 -0.31 0.00 0.00 175.10 174.78 3faq s ASP 578 N -4.18 6.85 0.63 4.85 -1.08 -1.26 -2.00 116.67 120.48 3faq s ASP 578 Ca 0.39 1.09 0.19 0.00 -0.52 0.00 0.00 52.55 53.70 3faq s ASP 578 Cb -0.01 -2.29 0.83 0.00 -1.46 0.00 0.00 42.92 39.98 3faq s ASP 578 CO 0.23 0.13 1.40 0.00 0.52 0.00 0.00 175.17 177.46 3faq h SER 580 N 0.00 0.00 -0.62 0.00 4.64 -1.92 -2.66 113.55 112.99 3faq h SER 580 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3faq h SER 580 Cb 1.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.04 3faq h SER 580 CO -0.00 0.10 0.00 0.41 -0.87 0.00 0.00 176.83 176.47 3faq n THR 581 N -3.48 1.46 -4.48 2.95 -1.04 0.17 -4.86 114.28 105.00 3faq n THR 581 Ca -0.01 -1.03 -0.34 0.00 -2.04 0.00 0.00 64.05 60.63 3faq n THR 581 Cb 0.25 0.19 -0.14 0.00 -1.82 0.00 0.00 70.33 68.81 3faq n THR 581 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3faq s VAL 582 N -1.62 3.24 0.08 12.58 1.01 -1.00 -5.02 120.40 129.67 3faq s VAL 582 Ca 0.47 -0.58 -0.36 0.00 0.00 0.00 0.00 61.98 61.50 3faq s VAL 582 Cb 0.28 -2.40 -0.16 0.00 0.00 0.00 0.00 36.38 34.10 3faq s VAL 582 CO 0.25 0.50 1.39 0.47 0.00 0.00 0.00 175.10 177.70 3faq n ASP 583 N 3.86 1.86 -4.90 3.32 9.92 -1.26 -4.95 116.55 124.41 3faq n ASP 583 Ca -0.18 1.11 -0.29 0.00 -0.53 0.00 0.00 54.79 54.91 3faq n ASP 583 Cb 0.52 -1.22 -0.03 0.00 -0.64 0.00 0.00 41.12 39.76 3faq n ASP 583 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 3faq s LYS 584 N 0.66 3.66 -0.62 -1.24 1.02 -1.26 -4.77 119.74 117.19 3faq s LYS 584 Ca 0.84 0.17 -0.27 0.00 0.02 0.00 0.00 55.97 56.73 3faq s LYS 584 Cb -0.92 -2.51 0.03 0.00 -0.52 0.00 0.00 37.83 33.91 3faq s LYS 584 CO 0.46 0.05 1.17 -1.17 -0.92 0.00 0.00 175.35 174.94 3faq s LEU 585 N -3.90 3.52 -0.49 3.17 2.96 -1.26 -4.94 118.68 117.74 3faq s LEU 585 Ca 0.47 -0.13 -0.28 0.00 -0.22 0.00 0.00 54.13 53.96 3faq s LEU 585 Cb -0.10 -2.95 0.00 0.00 0.50 0.00 0.00 46.19 43.64 3faq s LEU 585 CO 0.33 -1.52 1.51 -0.62 -1.32 0.00 0.00 176.35 174.72 3faq s ASP 586 N 3.15 6.08 -0.01 3.68 2.15 -1.26 -4.86 116.67 125.61 3faq s ASP 586 Ca 0.38 0.61 0.11 0.00 0.43 0.00 0.00 52.55 54.09 3faq s ASP 586 Cb -0.09 -2.54 0.34 0.00 -0.30 0.00 0.00 42.92 40.34 3faq s ASP 586 CO 0.21 -1.68 1.27 0.18 -0.17 0.00 0.00 175.17 174.99 3faq n LEU 587 N 9.72 2.12 -0.24 -1.34 4.77 -1.26 -4.37 117.00 126.40 3faq n LEU 587 Ca 0.16 -1.06 -0.05 0.00 -0.03 0.00 0.00 56.01 55.03 3faq n LEU 587 Cb 0.49 -0.27 0.11 0.00 -2.33 0.00 0.00 43.42 41.42 3faq n LEU 587 CO 0.70 0.51 1.04 0.77 -1.33 0.00 0.00 177.39 179.08 3faq h SER 588 N 2.22 1.00 0.03 -1.43 4.64 -2.01 -2.67 113.55 115.33 3faq h SER 588 Ca 0.00 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 3faq h SER 588 Cb 0.55 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 3faq h SER 588 CO 0.01 0.90 0.00 -2.65 -0.87 0.00 0.00 176.83 174.22 3faq n PRO 589 N -4.28 0.05 -0.13 4.77 -0.02 -1.26 -1.20 135.00 132.93 3faq n PRO 589 Ca 0.06 0.18 0.12 0.00 -2.02 0.00 0.00 63.50 61.84 3faq n PRO 589 Cb 0.19 -1.50 0.20 0.00 -0.02 0.00 0.00 33.50 32.37 3faq n PRO 589 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3faq n TRP 590 N -1.20 0.34 -1.67 6.00 8.01 -1.01 -4.78 117.44 123.13 3faq n TRP 590 Ca 0.01 -0.17 -0.33 0.00 -1.31 0.00 0.00 57.50 55.70 3faq n TRP 590 Cb 0.02 0.00 0.06 0.00 -2.01 0.00 0.00 31.31 29.37 3faq n TRP 590 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3faq s ALA 591 N -1.66 2.38 -0.09 6.99 0.00 -0.34 -4.97 121.76 124.06 3faq s ALA 591 Ca 0.36 0.62 -0.05 0.00 0.00 0.00 0.00 51.96 52.88 3faq s ALA 591 Cb 0.22 -3.35 0.04 0.00 0.00 0.00 0.00 23.12 20.03 3faq s ALA 591 CO 0.31 -1.42 0.22 0.45 0.00 0.00 0.00 175.76 175.32 3faq s SER 592 N -2.46 -0.23 -0.07 0.00 0.15 -1.26 -5.13 113.70 104.69 3faq s SER 592 Ca 0.69 0.47 0.03 0.00 0.70 0.00 0.00 55.95 57.83 3faq s SER 592 Cb -0.22 0.38 0.01 0.00 -1.71 0.00 0.00 66.02 64.48 3faq s SER 592 CO 0.42 -0.14 -0.15 -0.13 1.20 0.00 0.00 173.24 174.44 3faq s ARG 593 N 0.97 2.01 -0.01 5.44 0.52 -1.26 -4.97 118.95 121.66 3faq s ARG 593 Ca -0.07 -0.52 -0.23 0.00 -0.52 0.00 0.00 55.73 54.39 3faq s ARG 593 Cb -0.08 -1.61 -0.14 0.00 0.52 0.00 0.00 34.95 33.64 3faq s ARG 593 CO -0.06 0.06 1.00 0.93 0.02 0.00 0.00 175.30 177.25 3faq h GLU 594 N 6.91 -0.60 0.00 3.54 3.07 -2.05 -3.57 114.58 121.88 3faq h GLU 594 Ca -0.28 0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.62 3faq h GLU 594 Cb 1.20 0.14 0.00 0.00 -0.84 0.00 0.00 28.75 29.25 3faq h GLU 594 CO 0.47 -0.31 0.00 0.09 -1.40 0.00 0.00 179.01 177.87