# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 N C C 123.05 2.63 14.36 17.85 102.67 45.02 -88.41 38.28 99.95 0.05 0.00 99.76 0.17 0.04 0.00 0.00 0.00 0.02 0.01 1 S C C 60.20 7.57 10.05 19.05 116.96 137.20 -102.33 135.21 96.29 3.30 0.41 94.45 1.37 0.82 0.12 0.17 0.00 1.99 1.08 2 P C C 97.68 3.03 14.57 18.73 112.51 -131.89 -76.98 141.65 91.95 6.90 1.15 74.12 13.76 3.97 0.30 0.92 0.00 5.45 1.48 3 L C C 68.94 14.64 9.53 23.80 116.22 -135.28 -91.87 132.44 82.68 15.87 1.45 71.31 8.49 2.21 0.47 1.06 0.00 12.88 3.59 4 H C C 123.81 4.03 17.97 23.46 123.09 -164.65 -116.07 135.89 73.06 25.77 1.17 67.35 3.97 0.96 0.50 0.67 0.00 20.13 6.41 5 T C C 56.98 14.72 11.73 26.15 119.99 -155.21 -103.73 141.48 75.13 23.47 1.40 67.71 5.24 1.30 0.58 0.86 0.00 16.58 7.73 6 V C C 74.43 8.74 15.33 25.07 110.21 -136.74 -87.16 121.75 86.80 9.96 3.24 47.39 20.75 19.48 0.56 2.82 0.00 6.56 2.44 7 G C C 41.55 5.87 17.45 24.09 109.35 -44.64 86.04 -61.06 93.10 4.29 2.62 35.97 33.65 23.70 0.33 2.50 0.00 2.58 1.27 8 F C C 107.21 9.18 13.46 23.59 119.26 47.85 -104.25 136.69 88.76 9.21 2.03 62.69 19.76 5.49 0.52 1.71 0.00 3.79 6.04 9 D C C 55.77 9.99 12.49 23.88 112.25 -153.76 -102.78 115.59 92.56 6.67 0.78 83.98 6.45 1.68 0.26 0.48 0.00 2.71 4.43 10 A C T 74.54 5.18 13.29 19.91 93.76 -158.72 -67.82 -23.68 97.29 0.81 1.90 7.21 26.67 63.41 0.27 1.60 0.00 0.44 0.40 11 R C T 161.56 2.50 14.43 17.32 94.28 61.11 -75.02 -23.23 97.21 0.91 1.88 4.54 33.15 59.66 0.22 1.53 0.00 0.49 0.41 12 F C S 73.29 8.92 10.02 20.43 108.49 32.16 -127.94 68.79 93.23 4.76 2.01 43.74 44.61 4.49 0.57 1.40 0.00 1.67 3.52 13 P C T 78.19 7.14 11.54 20.32 94.74 167.47 -62.58 -25.91 90.68 1.13 8.18 16.06 10.73 63.80 2.19 6.00 0.00 0.58 0.63 14 Q C T 135.41 2.37 14.94 17.83 95.98 48.65 -89.25 3.08 85.38 1.35 13.27 10.47 13.62 60.98 4.34 8.96 0.03 0.69 0.92 15 Q C S 87.05 7.38 14.89 23.45 119.22 90.28 -97.44 141.16 77.99 3.40 18.61 22.36 29.86 26.82 7.97 9.28 0.06 1.36 2.28 16 N C C 76.36 10.91 16.48 27.67 101.39 -117.28 -71.79 71.89 79.24 4.63 16.13 40.72 14.16 24.86 9.66 5.85 0.02 1.94 2.79 17 Q C C 46.22 14.16 17.79 32.41 99.41 157.31 -93.60 1.61 66.86 4.20 28.94 54.04 6.25 5.59 27.33 2.65 0.01 1.58 2.55 18 T H H 29.01 17.84 17.48 34.78 93.87 105.79 -62.14 -42.89 25.69 0.54 73.77 19.05 3.64 3.78 72.10 1.04 0.00 0.18 0.22 19 K H H 110.22 6.05 23.59 30.10 91.90 51.70 -64.38 -40.58 2.89 0.03 97.08 0.89 0.42 1.44 96.76 0.46 0.00 0.01 0.01 20 H H H 76.38 8.75 23.61 32.57 91.86 49.94 -65.31 -41.10 0.96 0.01 99.04 0.21 0.10 0.53 98.83 0.33 0.00 0.00 0.00 21 C H H 7.32 21.78 19.15 40.76 92.16 49.98 -64.34 -43.19 0.58 0.00 99.42 0.11 0.04 0.33 99.29 0.23 0.00 0.00 0.00 22 W H H 55.50 16.15 22.82 38.25 91.57 49.62 -64.06 -42.34 0.23 0.00 99.77 0.03 0.01 0.13 99.76 0.07 0.00 0.00 0.00 23 Q H H 83.91 6.09 26.48 32.97 91.69 50.46 -63.83 -42.17 0.10 0.00 99.90 0.01 0.00 0.07 99.89 0.03 0.00 0.00 0.00 24 S H H 15.74 15.51 22.44 38.17 91.98 50.07 -64.71 -41.94 0.17 0.00 99.83 0.01 0.00 0.12 99.82 0.04 0.00 0.00 0.00 25 Y H H 23.03 20.34 22.23 41.81 91.81 50.17 -64.47 -42.68 0.18 0.00 99.82 0.01 0.00 0.13 99.83 0.03 0.00 0.00 0.00 26 V H H 39.78 10.51 24.57 35.69 91.55 49.33 -64.28 -42.66 0.10 0.00 99.90 0.01 0.00 0.07 99.91 0.01 0.00 0.00 0.00 27 D H H 51.58 8.09 25.16 33.89 91.63 50.36 -64.00 -41.96 0.13 0.00 99.87 0.01 0.00 0.09 99.88 0.02 0.00 0.00 0.00 28 Y H H 23.24 19.05 21.09 39.75 92.05 49.87 -64.09 -42.79 0.10 0.00 99.90 0.00 0.00 0.08 99.90 0.02 0.00 0.00 0.00 29 H H H 44.23 13.86 22.11 35.95 91.77 49.98 -63.80 -42.08 0.05 0.00 99.95 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 30 K H H 95.00 4.25 24.33 28.44 91.72 50.01 -63.89 -42.02 0.09 0.00 99.91 0.00 0.00 0.06 99.91 0.02 0.00 0.00 0.00 31 C H H 15.21 11.22 17.30 30.72 91.49 49.93 -63.84 -42.47 0.29 0.00 99.71 0.01 0.01 0.20 99.72 0.05 0.00 0.00 0.00 32 V H H 24.83 12.94 14.41 28.75 91.83 49.50 -64.09 -42.56 0.52 0.00 99.48 0.04 0.04 0.36 99.48 0.07 0.00 0.00 0.00 33 N H H 106.75 2.57 16.73 19.88 92.82 47.45 -66.49 -39.78 1.86 0.00 98.14 0.09 0.11 1.59 97.98 0.22 0.00 0.00 0.00 34 M H H 127.01 2.09 14.90 17.35 94.48 42.40 -72.18 -36.47 8.94 0.01 91.04 0.20 0.53 8.37 90.40 0.47 0.02 0.00 0.01 35 K H H 121.75 3.57 12.79 17.51 98.30 28.83 -100.68 -7.05 22.90 0.06 77.05 0.93 3.19 18.28 76.97 0.54 0.04 0.01 0.04 36 G C C 58.10 1.41 13.96 15.74 95.49 -119.44 75.84 16.20 98.33 0.17 1.50 46.43 22.18 29.67 0.33 1.21 0.00 0.07 0.11 37 E C C 87.91 8.25 10.31 20.01 120.90 140.97 -85.94 148.22 97.05 0.54 2.41 56.23 26.97 13.50 0.37 2.32 0.00 0.23 0.38 38 D C C 115.24 2.02 16.48 18.88 107.49 -119.48 -87.80 106.44 98.13 0.28 1.59 79.82 9.67 8.47 0.26 1.47 0.00 0.14 0.17 39 F C C 65.76 13.44 10.19 23.81 113.45 168.89 -105.36 127.40 96.22 0.39 3.39 85.16 10.04 0.89 2.94 0.42 0.00 0.08 0.47 40 A H H 72.93 1.96 19.82 20.84 93.20 -120.90 -60.24 -42.29 4.45 0.00 95.55 0.83 0.78 2.47 94.90 1.01 0.00 0.00 0.00 41 P H H 48.75 8.88 17.82 27.94 91.88 49.29 -65.07 -38.29 2.79 0.00 97.21 0.28 0.22 2.05 95.95 1.49 0.00 0.00 0.00 42 C H H 7.56 20.62 13.66 34.66 91.65 51.36 -64.38 -41.21 0.94 0.00 99.05 0.13 0.07 0.60 97.91 1.29 0.00 0.00 0.00 43 K H H 100.60 6.44 21.87 28.83 91.55 52.13 -63.13 -40.91 0.24 0.00 99.76 0.04 0.02 0.13 99.61 0.20 0.00 0.00 0.00 44 V H H 65.36 5.09 23.07 28.24 91.53 50.44 -63.66 -42.67 0.21 0.00 99.79 0.02 0.01 0.14 99.76 0.08 0.00 0.00 0.00 45 F H H 17.69 19.86 19.25 38.96 91.62 49.81 -63.84 -43.33 0.17 0.00 99.83 0.01 0.01 0.12 99.82 0.04 0.00 0.00 0.00 46 W H H 58.39 17.54 20.14 36.75 91.50 51.08 -62.44 -42.29 0.07 0.00 99.93 0.00 0.00 0.05 99.93 0.02 0.00 0.00 0.00 47 K H H 112.84 3.41 24.92 27.95 91.72 50.39 -64.30 -41.48 0.08 0.00 99.92 0.00 0.00 0.06 99.91 0.03 0.00 0.00 0.00 48 T H H 30.62 11.49 21.12 33.45 91.99 49.37 -64.42 -42.87 0.18 0.00 99.82 0.01 0.00 0.14 99.77 0.07 0.00 0.00 0.00 49 Y H H 11.63 23.42 17.00 40.30 92.34 48.95 -65.45 -42.00 0.47 0.00 99.53 0.02 0.02 0.40 99.31 0.25 0.00 0.00 0.00 50 N H H 70.45 12.01 19.43 31.30 91.38 53.42 -66.04 -31.90 3.53 0.00 96.46 0.13 0.15 3.34 94.80 1.59 0.00 0.00 0.00 51 A H H 68.83 3.95 22.40 26.14 91.89 57.31 -71.97 -22.83 17.02 0.00 82.97 0.21 0.44 17.38 80.28 1.67 0.01 0.00 0.00 52 L H H 46.87 14.82 17.74 32.57 99.97 39.38 -98.09 -19.13 30.03 0.02 69.95 0.50 2.10 27.44 68.63 1.28 0.02 0.00 0.02 53 C C S 11.54 21.38 12.18 33.38 130.14 49.37 -124.69 147.47 99.56 0.35 0.08 8.66 90.84 0.21 0.04 0.01 0.00 0.08 0.16 54 P C C 54.84 5.80 18.69 25.69 112.86 -101.17 -63.77 144.59 99.00 0.73 0.27 98.60 0.44 0.14 0.17 0.03 0.00 0.19 0.44 55 L H H 107.59 5.85 13.73 21.42 91.84 -116.30 -57.91 -37.36 2.62 0.00 97.37 0.30 0.29 1.87 95.40 2.13 0.00 0.00 0.00 56 D H H 103.01 1.44 19.06 19.26 91.30 55.86 -64.41 -36.85 1.29 0.00 98.71 0.07 0.06 1.09 96.22 2.56 0.00 0.00 0.00 57 W H H 47.12 13.11 15.51 29.66 92.09 49.99 -66.48 -40.16 0.53 0.00 99.47 0.04 0.03 0.40 97.05 2.47 0.00 0.00 0.00 58 I H H 24.68 16.21 14.12 30.87 91.74 51.86 -63.36 -42.74 0.40 0.00 99.60 0.04 0.02 0.30 98.84 0.80 0.00 0.00 0.00 59 E H H 112.80 1.89 21.53 21.94 91.42 50.76 -63.61 -41.77 1.14 0.00 98.86 0.04 0.04 1.07 98.23 0.61 0.00 0.00 0.00 60 K H H 100.66 3.99 20.44 24.51 91.78 49.68 -64.66 -41.69 1.56 0.00 98.44 0.07 0.07 1.43 97.99 0.44 0.00 0.00 0.00 61 W H H 22.62 18.17 14.55 33.23 91.94 49.81 -64.28 -42.55 0.94 0.00 99.06 0.11 0.06 0.66 98.82 0.34 0.00 0.00 0.00 62 D H H 59.12 6.74 18.37 26.33 91.57 51.01 -63.42 -41.24 0.49 0.00 99.51 0.09 0.03 0.26 99.46 0.16 0.00 0.00 0.00 63 D H H 79.38 1.65 19.54 19.45 91.73 49.91 -64.10 -40.96 0.37 0.00 99.63 0.04 0.02 0.24 99.55 0.16 0.00 0.00 0.00 64 Q H H 45.56 8.30 13.93 24.39 91.98 50.25 -65.06 -40.83 0.41 0.00 99.59 0.04 0.02 0.26 99.39 0.28 0.00 0.00 0.00 65 R H H 87.01 11.26 11.84 23.72 91.93 51.49 -64.07 -41.23 0.68 0.00 99.32 0.06 0.03 0.48 98.83 0.58 0.00 0.00 0.00 66 E H H 150.82 0.99 14.72 15.07 91.21 51.25 -65.37 -32.54 3.97 0.00 96.03 0.10 0.12 3.81 95.40 0.57 0.00 0.00 0.00 67 K C T 142.03 1.41 13.45 14.61 92.84 50.41 -86.16 -3.15 63.11 0.02 36.87 0.30 0.91 62.07 35.87 0.82 0.01 0.00 0.02 68 G C T 52.40 3.52 12.47 17.74 95.44 -113.36 76.88 14.43 99.64 0.02 0.34 1.78 3.11 94.87 0.14 0.08 0.00 0.01 0.01 69 I C C 92.89 5.43 14.98 21.73 100.97 126.11 -94.47 -3.62 97.89 1.54 0.57 56.07 39.20 2.70 0.19 0.34 0.00 0.58 0.91 70 F C C 51.67 17.01 10.38 26.74 117.39 79.96 -106.46 123.49 94.77 4.32 0.91 51.33 39.54 3.94 0.26 0.64 0.00 1.84 2.45 71 A C C 60.88 6.31 17.91 25.09 102.95 -158.57 -76.61 26.86 93.63 3.80 2.57 60.94 19.83 12.54 0.43 2.53 0.00 2.41 1.32 72 G C C 33.23 9.12 14.99 24.72 131.95 36.14 -145.41 173.96 89.78 6.52 3.70 44.11 29.80 15.96 0.50 3.60 0.00 4.04 2.00 73 D C C 97.55 4.37 16.96 22.52 113.37 -98.93 -97.54 123.99 89.38 7.20 3.41 77.18 7.62 4.24 0.72 2.96 0.00 4.71 2.58 74 I C C 70.66 14.82 9.98 24.20 103.69 -162.82 -88.64 7.31 89.33 5.83 4.85 62.25 14.67 12.06 1.10 4.03 0.00 3.85 2.03 75 N C C 114.27 2.81 13.11 17.27 104.59 87.67 -88.84 54.40 92.09 3.75 4.16 61.36 14.95 15.55 0.88 3.53 0.00 2.49 1.25 76 S C C 65.69 6.48 8.45 16.49 111.91 144.51 -92.82 130.21 95.49 1.92 2.59 88.31 2.05 5.59 0.63 1.51 0.00 1.22 0.68 77 D C C 119.20 1.91 12.86 15.80 104.47 -149.11 -89.67 44.61 99.93 0.05 0.02 99.78 0.11 0.07 0.00 0.00 0.00 0.03 0.01