# 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 M C C 96.26 8.72 15.52 24.99 115.08 -165.51 -95.48 130.91 99.76 0.23 0.01 99.70 0.11 0.04 0.00 0.00 0.00 0.12 0.02 1 L C C 99.96 6.80 15.33 23.26 113.96 -139.05 -91.06 127.66 89.13 10.55 0.32 86.95 2.22 0.66 0.15 0.12 0.00 5.64 4.25 2 I C C 33.57 16.98 8.99 25.46 118.98 -141.73 -98.76 134.75 93.81 6.11 0.07 71.16 23.34 0.15 0.05 0.03 0.00 3.91 1.37 3 P C C 67.06 3.18 16.49 20.25 114.79 -106.41 -64.58 151.26 97.22 2.62 0.17 97.46 0.42 0.06 0.11 0.02 0.00 1.41 0.52 4 K H H 136.33 4.49 11.97 18.56 91.48 -110.97 -57.06 -39.06 2.07 0.00 97.93 0.43 0.32 1.09 97.28 0.87 0.00 0.00 0.00 5 E H H 133.52 1.15 16.26 16.28 91.66 53.29 -64.47 -39.31 1.10 0.00 98.89 0.14 0.09 0.73 98.02 1.02 0.00 0.00 0.00 6 D H H 50.02 8.92 14.84 25.23 92.78 48.00 -67.53 -38.36 0.63 0.00 99.37 0.14 0.06 0.35 98.42 1.03 0.00 0.00 0.00 7 R H H 56.05 17.33 14.21 30.95 91.63 53.29 -62.53 -42.03 0.34 0.00 99.66 0.08 0.02 0.16 99.61 0.13 0.00 0.00 0.00 8 K H H 110.75 4.52 20.67 25.73 91.47 51.02 -63.74 -41.13 0.29 0.00 99.71 0.04 0.01 0.16 99.74 0.05 0.00 0.00 0.00 9 K H H 101.94 3.78 22.64 26.14 91.66 49.72 -64.58 -41.82 0.24 0.00 99.76 0.03 0.01 0.14 99.77 0.05 0.00 0.00 0.00 10 I H H 9.66 20.89 18.39 39.49 91.51 49.42 -63.91 -43.75 0.20 0.00 99.80 0.02 0.01 0.14 99.77 0.06 0.00 0.00 0.00 11 Y H H 39.33 19.00 20.30 38.40 91.43 50.63 -63.02 -42.69 0.38 0.00 99.62 0.03 0.02 0.29 99.54 0.12 0.00 0.00 0.00 12 Q H H 90.87 4.13 24.06 28.04 91.56 50.95 -64.10 -41.68 0.81 0.00 99.19 0.04 0.04 0.69 99.05 0.18 0.00 0.00 0.00 13 H H H 48.54 10.01 22.03 32.92 91.78 49.20 -64.69 -42.30 1.25 0.00 98.74 0.07 0.08 1.09 98.49 0.27 0.00 0.00 0.00 14 L H H 4.72 24.78 17.26 42.07 91.78 49.08 -64.97 -42.70 1.83 0.01 98.16 0.14 0.17 1.57 97.39 0.70 0.02 0.00 0.01 15 F H H 54.43 17.44 19.31 35.57 93.49 45.57 -69.28 -38.88 3.48 0.02 96.50 0.22 0.27 3.07 94.69 1.67 0.04 0.01 0.01 16 Q H H 115.43 2.91 22.95 25.74 96.55 42.57 -78.03 -37.89 7.97 0.03 92.00 0.35 0.58 7.15 90.27 1.58 0.04 0.01 0.02 17 E H H 84.69 8.42 21.43 30.16 98.76 28.44 -99.24 -15.46 20.83 0.12 79.06 1.46 3.58 15.96 77.71 1.10 0.08 0.03 0.08 18 G C C 7.99 18.61 19.99 38.44 98.87 -121.47 77.89 15.80 94.01 5.30 0.69 41.86 22.90 29.45 0.21 0.41 0.00 4.75 0.42 19 V E E 13.86 20.37 24.08 43.86 125.86 113.56 -118.87 139.48 25.69 74.23 0.08 23.18 1.75 0.13 0.02 0.05 0.00 74.09 0.77 20 L E E 5.93 24.34 24.75 48.51 123.87 -162.77 -114.49 137.29 3.40 96.57 0.03 3.27 0.17 0.02 0.01 0.01 0.00 96.12 0.40 21 V E E 19.99 18.98 27.02 45.17 121.88 -156.90 -112.35 132.65 3.17 96.80 0.03 3.00 0.16 0.02 0.02 0.01 0.00 96.33 0.46 22 A E E 6.49 23.11 18.30 41.31 121.78 -151.38 -102.66 144.25 18.90 81.00 0.10 17.53 1.01 0.11 0.04 0.06 0.00 80.18 1.08 23 K C C 87.28 10.05 21.77 31.77 114.96 -114.58 -74.49 148.87 62.45 36.17 1.38 43.43 16.99 3.09 0.34 1.12 0.00 33.10 1.94 24 K C S 115.09 9.40 18.19 27.79 98.46 -105.05 -69.89 -25.38 91.01 5.08 3.91 14.51 57.47 19.43 0.55 3.03 0.01 3.86 1.15 25 D C C 68.66 7.52 17.74 26.06 106.06 62.78 -99.42 80.77 93.31 2.77 3.92 66.04 12.30 14.25 0.60 4.03 0.00 1.59 1.18 26 F C T 65.63 16.81 12.26 28.59 95.26 168.45 -72.08 -15.61 95.71 1.74 2.55 17.10 16.42 61.87 0.39 2.42 0.00 0.98 0.83 27 N C T 116.33 2.98 18.73 22.40 97.54 58.89 -91.40 12.94 97.20 1.06 1.74 14.08 21.06 61.84 0.20 1.77 0.00 0.64 0.42 28 Q C S 58.71 13.42 11.53 25.53 118.05 121.39 -78.34 144.13 98.17 1.53 0.30 47.17 50.58 0.61 0.08 0.16 0.00 0.51 0.88 29 P C C 75.08 5.04 17.67 23.53 115.27 -102.11 -66.05 151.42 97.07 2.02 0.91 88.72 6.22 2.07 0.23 0.66 0.00 1.10 0.99 30 K C C 125.87 7.22 14.13 23.10 115.73 -105.97 -77.85 140.75 71.85 26.52 1.63 61.07 5.96 1.42 0.77 0.79 0.00 6.88 23.11 31 H C C 38.37 15.70 8.58 24.23 112.74 -122.07 -83.71 132.00 83.79 14.71 1.49 76.70 4.42 1.39 0.73 0.73 0.00 6.39 9.64 32 E C T 163.76 0.72 15.38 14.83 93.18 -136.03 -65.39 -27.85 94.69 0.87 4.44 6.59 16.62 71.42 0.59 3.88 0.00 0.53 0.37 33 E C T 119.00 4.32 13.85 19.47 96.13 49.50 -79.44 -26.68 94.97 0.66 4.37 4.57 17.34 73.14 0.55 3.70 0.00 0.38 0.32 34 I C T 33.62 17.03 9.69 25.92 112.02 41.76 -113.51 83.00 88.25 5.13 6.61 19.25 28.59 40.68 1.32 5.06 0.02 2.36 2.71 35 D C C 118.19 1.89 18.87 20.58 97.14 -138.01 -18.34 37.70 93.95 4.27 1.78 46.67 29.54 18.19 0.72 0.95 0.00 2.78 1.15 36 T C C 32.16 13.93 13.37 28.18 128.42 111.66 -118.62 151.42 76.82 18.44 4.74 52.23 21.63 3.15 3.79 1.41 0.05 9.77 7.97 37 K C C 93.98 7.33 22.34 29.78 111.08 -104.00 -74.00 137.06 57.28 33.00 9.72 50.49 3.69 2.04 9.31 1.35 0.02 13.91 19.18 38 N H H 27.76 21.40 15.57 35.89 96.41 -132.58 -65.83 -30.99 34.61 1.21 64.18 25.84 4.20 4.78 62.81 1.41 0.01 0.60 0.36 39 L H H 71.61 9.12 22.31 31.73 92.47 72.32 -63.67 -33.11 6.60 0.15 93.25 3.07 0.91 2.82 91.89 1.19 0.01 0.08 0.04 40 F H H 72.15 9.21 23.47 33.16 91.88 54.58 -65.03 -40.11 1.25 0.03 98.72 0.48 0.15 0.62 97.91 0.81 0.00 0.02 0.00 41 V H H 3.09 25.11 19.32 44.57 91.74 50.10 -63.98 -43.74 0.31 0.01 99.69 0.09 0.03 0.15 99.47 0.26 0.00 0.00 0.00 42 I H H 23.17 18.82 21.78 39.89 91.42 50.48 -63.13 -42.91 0.19 0.00 99.81 0.03 0.01 0.11 99.68 0.16 0.00 0.00 0.00 43 K H H 108.56 4.04 26.51 30.64 91.56 50.66 -63.92 -41.33 0.39 0.00 99.60 0.04 0.02 0.28 99.33 0.32 0.00 0.00 0.00 44 A H H 15.33 15.45 21.24 37.14 91.53 50.39 -64.35 -41.48 1.50 0.00 98.50 0.09 0.07 1.22 97.98 0.63 0.00 0.00 0.00 45 L H H 4.65 25.36 17.43 42.82 91.76 50.82 -66.51 -37.84 7.12 0.03 92.85 0.62 0.48 5.72 91.14 2.00 0.02 0.01 0.01 46 Q H H 91.43 10.08 21.30 31.49 91.92 61.66 -63.67 -34.59 32.05 0.29 67.67 2.36 2.31 27.28 63.11 4.53 0.11 0.14 0.15 47 S C H 62.31 4.60 21.89 26.45 92.92 54.96 -76.13 -20.02 52.60 0.69 46.71 5.99 5.02 40.35 42.02 5.82 0.10 0.38 0.33 48 L C C 22.71 20.12 13.46 33.03 95.34 66.88 -73.13 -23.49 58.97 6.96 34.07 33.63 15.36 11.11 26.94 6.37 0.18 3.76 2.65 49 T C C 64.67 12.32 15.98 27.99 97.41 73.47 -75.89 -27.47 56.05 19.04 24.91 38.09 8.89 8.75 19.92 5.77 0.16 13.59 4.85 50 S C C 75.26 3.76 16.81 21.39 95.85 68.27 -78.34 -7.69 43.86 34.18 21.96 20.53 12.41 12.58 14.18 7.21 1.56 20.24 11.30 51 K C T 122.92 5.69 15.74 22.57 97.25 53.34 -87.59 14.01 85.80 3.28 10.92 5.30 15.27 65.87 4.12 5.83 0.06 2.04 1.51 52 G C T 44.72 5.50 18.69 25.04 94.72 -103.53 80.03 7.17 96.22 0.53 3.24 3.37 16.77 76.60 0.40 2.34 0.00 0.33 0.19 53 F C S 37.99 16.60 16.50 33.47 97.88 111.18 -89.72 -19.27 66.98 31.36 1.67 15.54 29.18 24.95 0.32 1.35 0.02 26.13 2.51 54 V E E 7.13 23.66 12.87 36.78 131.34 38.70 -130.77 146.02 16.75 83.15 0.10 13.14 3.40 0.26 0.04 0.07 0.00 79.75 3.34 55 K E E 106.03 5.01 24.53 29.77 120.54 -146.97 -106.92 138.26 6.28 93.71 0.01 5.96 0.23 0.02 0.00 0.00 0.00 93.57 0.21 56 T E E 49.89 18.99 13.27 30.98 123.21 -152.99 -114.22 135.76 2.64 97.35 0.00 2.66 0.06 0.00 0.00 0.00 0.00 97.22 0.06 57 Q E E 85.36 5.81 19.05 25.97 124.23 -172.60 -126.72 136.20 1.62 98.37 0.00 1.49 0.09 0.01 0.00 0.00 0.00 98.33 0.07 58 F E E 113.48 9.68 12.52 23.22 117.72 -144.78 -102.85 130.26 8.95 91.04 0.01 7.68 0.72 0.07 0.00 0.01 0.00 91.20 0.32 59 S C C 48.02 6.34 12.54 20.59 125.73 175.62 -125.69 153.11 73.01 26.94 0.05 67.78 3.12 0.25 0.01 0.04 0.00 28.32 0.49 60 W C S 194.66 2.47 13.91 17.02 96.75 -70.42 -53.81 -30.63 99.19 0.54 0.27 5.14 68.81 25.34 0.02 0.23 0.00 0.38 0.09 61 Q C S 114.06 4.96 14.38 20.32 101.96 7.49 -102.69 -10.87 98.82 0.96 0.23 4.05 70.29 24.60 0.01 0.20 0.00 0.76 0.09 62 Y E E 73.12 10.23 15.12 26.72 133.18 40.28 -134.22 152.68 36.91 63.00 0.08 26.83 9.08 0.80 0.01 0.09 0.00 62.65 0.55 63 Y E E 42.42 15.21 16.71 32.95 121.96 -144.76 -113.35 135.32 3.91 96.08 0.00 3.61 0.17 0.01 0.00 0.00 0.00 96.09 0.12 64 Y E E 32.15 14.88 21.33 37.14 126.91 -170.16 -123.92 140.97 0.64 99.36 0.00 0.58 0.02 0.00 0.00 0.00 0.00 99.38 0.02 65 Y E E 17.55 20.70 20.67 41.35 125.37 -162.54 -119.16 139.21 0.46 99.54 0.00 0.41 0.01 0.00 0.00 0.00 0.00 99.56 0.02 66 T E E 23.82 14.83 25.50 40.43 126.34 -164.67 -120.26 141.85 2.06 97.94 0.00 1.88 0.08 0.00 0.00 0.00 0.00 97.95 0.09 67 L E E 8.70 23.91 17.33 41.80 113.38 -119.90 -80.18 133.23 17.75 82.24 0.01 17.39 0.48 0.01 0.00 0.00 0.00 80.84 1.26 68 T C C 30.58 10.86 21.09 32.94 124.40 -138.38 -85.61 167.74 95.75 4.19 0.06 95.17 1.08 0.04 0.03 0.01 0.00 3.43 0.23 69 E H H 122.98 5.45 19.14 25.88 90.92 -98.85 -59.52 -37.02 2.49 0.01 97.50 0.35 0.33 1.68 97.22 0.42 0.00 0.00 0.00 70 E H H 107.69 3.12 22.74 25.44 91.51 52.89 -64.54 -40.03 0.87 0.00 99.13 0.04 0.04 0.73 98.79 0.39 0.00 0.00 0.00 71 G H H 2.85 21.45 16.15 38.10 91.64 50.38 -64.25 -42.33 0.58 0.00 99.42 0.06 0.03 0.40 99.15 0.36 0.00 0.00 0.00 72 V H H 16.08 19.40 18.17 37.43 91.60 50.70 -63.40 -42.61 0.15 0.00 99.85 0.02 0.01 0.07 99.86 0.04 0.00 0.00 0.00 73 V H H 78.53 3.14 24.02 26.32 91.41 50.49 -63.63 -42.28 0.13 0.00 99.87 0.01 0.00 0.08 99.89 0.02 0.00 0.00 0.00 74 Y H H 61.62 9.04 21.18 31.37 91.72 49.22 -64.06 -42.74 0.16 0.00 99.84 0.01 0.00 0.10 99.86 0.02 0.00 0.00 0.00 75 L H H 4.89 24.04 16.07 40.29 91.75 48.98 -64.51 -42.67 0.13 0.00 99.87 0.01 0.00 0.08 99.87 0.03 0.00 0.00 0.00 76 R H H 75.45 12.80 17.32 30.33 91.84 50.41 -63.78 -41.16 0.16 0.00 99.84 0.01 0.00 0.11 99.83 0.05 0.00 0.00 0.00 77 E H H 133.24 1.47 20.54 20.57 92.85 46.90 -67.56 -40.68 0.48 0.00 99.52 0.01 0.01 0.43 99.44 0.10 0.00 0.00 0.00 78 Y H H 90.52 10.53 16.94 27.99 95.66 42.06 -76.29 -37.87 3.39 0.00 96.60 0.06 0.11 3.29 96.36 0.18 0.00 0.00 0.00 79 L H H 28.44 17.44 13.58 31.17 97.31 31.92 -98.18 -4.55 38.58 0.11 61.31 1.23 3.48 32.56 61.90 0.68 0.05 0.03 0.09 80 N C T 122.37 2.16 20.36 22.41 93.83 -124.71 58.91 40.43 99.43 0.08 0.49 26.64 3.50 69.45 0.21 0.13 0.00 0.04 0.04 81 L C C 26.73 19.34 8.82 27.19 119.79 164.99 -88.27 144.85 99.70 0.25 0.05 94.27 5.31 0.11 0.02 0.02 0.00 0.08 0.19 82 P C C 63.42 4.45 17.88 23.15 114.64 -103.60 -65.71 152.07 99.26 0.24 0.50 98.24 0.73 0.47 0.09 0.25 0.00 0.09 0.13 83 E C T 131.85 6.41 13.21 21.38 93.09 -111.58 -63.22 -25.31 90.93 0.47 8.60 3.93 16.20 69.84 0.66 8.85 0.00 0.26 0.25 84 H C T 143.07 2.30 18.05 20.58 96.48 62.93 -85.59 1.36 88.83 1.73 9.44 7.04 10.94 69.62 0.86 9.82 0.00 1.25 0.46 85 I C C 47.87 15.73 12.91 28.68 111.74 109.18 -83.08 122.83 76.88 14.83 8.29 51.02 18.96 6.46 1.80 7.09 0.01 8.81 5.85 86 F C C 70.38 13.03 15.73 29.25 120.26 92.05 -108.52 130.84 80.95 18.23 0.82 55.16 26.34 0.57 0.61 0.26 0.00 13.62 3.44 87 P C C 37.64 11.21 14.93 27.71 113.04 -110.72 -65.19 146.56 78.06 19.87 2.06 74.67 2.51 0.69 1.12 0.71 0.00 15.53 4.78 88 A H G 68.22 6.00 14.98 22.46 92.06 -120.34 -59.79 -31.96 27.78 0.97 71.26 10.43 5.49 11.55 31.93 39.69 0.02 0.58 0.30 89 T H G 84.65 3.61 16.34 20.77 92.59 61.19 -68.84 -25.80 24.06 1.19 74.76 7.52 4.25 11.54 36.04 39.51 0.06 0.74 0.33 90 Y H G 77.44 12.53 12.75 25.61 96.95 53.19 -84.52 -14.30 22.06 2.06 75.89 10.32 4.43 7.59 37.39 38.43 0.04 1.32 0.47 91 L H H 67.23 12.04 11.98 24.23 98.73 70.32 -78.53 -14.92 41.55 4.97 53.48 26.47 9.96 7.84 41.76 9.37 0.10 2.53 1.96 92 A C H 76.65 3.35 13.65 18.32 103.41 69.56 -74.94 26.62 55.38 3.07 41.56 31.00 11.02 14.61 34.17 6.28 0.05 1.65 1.22 93 G C C 52.66 3.18 13.37 17.76 103.51 26.69 1.88 -1.63 67.04 2.03 30.92 35.46 14.03 18.34 24.35 5.85 0.03 0.97 0.98 94 Q C C 105.76 6.57 10.49 18.51 107.95 116.84 -85.25 91.03 72.91 2.00 25.09 48.64 14.87 9.33 20.12 4.98 0.01 0.84 1.22 95 S C C 76.35 4.28 11.25 17.16 108.15 66.52 -85.47 95.55 78.00 1.66 20.34 54.45 10.99 12.59 14.20 5.96 0.00 0.78 1.03 96 G C C 47.15 5.32 10.74 17.45 109.07 -45.45 -77.28 27.31 82.88 1.43 15.69 50.15 17.00 16.12 8.71 6.49 0.00 0.67 0.87 97 D C C 114.87 2.43 11.34 15.17 102.03 51.97 -88.69 12.96 87.78 1.70 10.52 53.65 22.39 11.90 5.60 4.64 0.00 0.77 1.07 98 Q C C 116.62 3.60 10.91 16.39 116.83 113.02 -91.40 140.11 94.26 1.59 4.15 65.12 25.30 3.62 2.81 1.34 0.00 0.62 1.19 99 R C C 142.58 4.79 10.68 17.46 115.77 -109.62 -79.54 140.43 98.08 0.71 1.21 84.25 12.73 1.11 0.77 0.41 0.00 0.28 0.45 100 P C C 78.18 6.86 9.24 17.72 109.69 -105.49 -66.50 146.34 93.89 0.92 5.19 80.47 5.93 7.37 1.53 3.67 0.00 0.44 0.59 101 Q C C 137.46 2.35 10.27 14.23 107.33 -124.94 -83.43 119.36 88.24 1.73 10.03 44.94 18.42 24.53 1.89 8.44 0.00 0.82 0.95 102 G C C 53.10 2.89 9.80 14.31 111.15 -54.57 89.86 153.74 85.37 1.98 12.66 37.60 21.31 25.98 1.73 11.49 0.00 0.98 0.90 103 K C C 144.59 2.98 9.21 13.95 111.41 -90.29 -86.54 126.81 84.14 3.69 12.17 53.92 15.82 13.41 1.82 11.57 0.00 2.16 1.30 104 K C C 150.04 2.51 8.77 13.09 109.70 -147.26 -88.93 116.44 88.59 5.16 6.24 76.01 3.61 9.42 1.55 4.03 0.00 3.22 2.16 105 Y C C 146.51 5.52 9.89 16.91 111.38 -157.68 -94.42 120.18 99.79 0.19 0.02 99.65 0.13 0.08 0.01 0.00 0.00 0.09 0.03