# 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 Q C C 108.75 5.65 20.07 26.59 116.12 -157.90 -100.33 125.82 99.06 0.93 0.01 99.06 0.09 0.02 0.00 0.00 0.00 0.82 0.01 1 V E E 33.88 19.80 11.69 30.58 120.94 -163.35 -109.45 133.00 47.38 52.55 0.07 47.12 0.36 0.10 0.01 0.03 0.00 51.61 0.75 2 Q E E 95.79 5.25 22.14 28.03 121.40 -164.76 -112.74 133.80 15.30 84.57 0.12 13.52 1.25 0.30 0.03 0.09 0.00 84.08 0.73 3 L E E 37.05 20.87 12.46 32.42 121.18 -154.34 -109.02 132.90 12.82 87.04 0.14 11.97 0.68 0.14 0.04 0.07 0.00 86.11 0.99 4 Q E E 90.46 6.76 20.70 28.26 122.66 -167.83 -115.88 137.54 23.68 76.06 0.26 20.27 2.97 0.49 0.07 0.17 0.00 74.80 1.24 5 Q C C 80.87 13.85 13.96 27.56 118.49 -140.46 -103.47 135.21 55.11 44.63 0.26 44.84 8.41 0.92 0.05 0.22 0.00 44.57 0.99 6 S C C 67.42 7.12 16.92 24.86 106.78 -156.49 -91.84 25.35 80.67 19.12 0.22 56.07 22.11 1.98 0.03 0.23 0.00 18.73 0.86 7 G C S 30.69 6.59 18.28 25.67 135.15 -56.41 136.33 -176.21 85.51 14.42 0.08 32.55 51.48 1.32 0.01 0.08 0.00 13.96 0.60 8 P C C 68.79 10.57 16.27 27.37 115.37 -42.20 -71.33 146.01 81.66 18.26 0.08 68.60 10.92 0.58 0.01 0.09 0.00 19.39 0.42 9 E E E 68.65 14.05 17.61 31.52 125.27 -162.12 -120.97 137.17 14.83 85.11 0.06 12.51 2.15 0.13 0.01 0.05 0.00 84.43 0.71 10 L E E 84.39 10.20 21.49 31.81 116.26 -137.02 -99.11 127.77 4.17 95.82 0.01 3.72 0.33 0.01 0.00 0.01 0.00 95.70 0.22 11 V E E 15.69 20.42 14.52 34.82 129.92 -175.84 -128.71 147.55 6.60 93.38 0.02 6.53 0.23 0.01 0.01 0.01 0.00 92.23 0.99 12 K C C 108.57 4.53 23.43 28.06 120.81 -126.40 -87.23 150.30 70.99 28.95 0.06 69.97 1.27 0.12 0.01 0.04 0.00 27.06 1.52 13 L C T 77.24 13.30 14.11 27.63 109.52 -84.58 -58.82 135.28 99.01 0.75 0.24 0.22 2.12 96.97 0.01 0.15 0.00 0.46 0.06 14 G C T 48.39 3.55 19.64 23.91 95.71 23.06 88.74 -6.04 99.54 0.31 0.14 0.30 2.40 96.95 0.01 0.09 0.00 0.23 0.02 15 A C C 35.14 10.70 15.68 27.73 122.85 124.49 -82.51 157.66 94.03 5.89 0.08 74.15 19.60 0.34 0.02 0.08 0.00 5.26 0.55 16 S C C 58.61 9.21 19.90 29.92 125.23 -134.62 -112.94 144.13 58.97 41.01 0.02 58.28 0.84 0.06 0.00 0.02 0.00 39.97 0.83 17 V E E 14.20 22.22 15.45 37.59 127.36 -167.67 -128.13 138.90 2.93 97.06 0.00 2.84 0.06 0.00 0.00 0.00 0.00 97.00 0.10 18 R E E 120.92 6.98 24.72 32.49 117.32 -146.35 -105.56 128.66 0.61 99.39 0.00 0.58 0.01 0.00 0.00 0.00 0.00 99.40 0.01 19 I E E 5.89 25.42 16.17 42.22 122.10 -168.95 -117.09 132.58 1.12 98.88 0.00 1.08 0.03 0.00 0.00 0.00 0.00 98.88 0.02 20 S E E 37.43 9.41 26.58 36.62 126.41 -164.65 -116.97 143.37 5.14 94.86 0.00 4.59 0.19 0.01 0.00 0.00 0.00 95.17 0.04 21 C E E 5.75 25.16 16.44 41.89 131.60 -174.81 -136.21 146.53 6.14 93.85 0.01 5.58 0.26 0.02 0.00 0.00 0.00 94.05 0.09 22 K E E 93.23 7.69 27.01 35.55 122.83 -159.88 -119.03 133.37 3.22 96.75 0.03 2.97 0.19 0.03 0.01 0.01 0.00 96.21 0.58 23 A E E 6.56 24.80 15.09 39.81 117.63 -168.60 -114.15 125.03 25.68 74.07 0.24 24.29 1.20 0.24 0.07 0.17 0.00 72.44 1.58 24 S C C 55.12 7.54 21.99 29.99 120.37 -163.40 -109.84 143.61 67.40 31.91 0.69 34.64 21.97 12.18 0.08 0.73 0.00 29.29 1.11 25 G C S 48.63 3.64 21.49 25.60 96.88 17.35 83.27 -2.04 87.68 11.54 0.78 16.48 52.66 18.54 0.06 0.86 0.00 10.42 0.98 26 Y C C 44.95 20.25 12.12 31.45 120.42 122.57 -96.46 141.65 86.48 12.06 1.45 61.39 18.48 6.52 0.25 1.54 0.00 8.93 2.89 27 R C C 139.48 5.06 22.66 28.38 107.88 -156.58 -102.83 28.72 89.98 8.77 1.26 67.81 14.89 7.05 0.20 1.35 0.00 6.25 2.45 28 F C C 41.11 19.63 14.26 32.91 123.45 125.29 -108.41 141.76 85.05 11.80 3.15 59.83 16.49 8.17 0.50 3.27 0.00 7.46 4.27 29 S C S 64.37 6.68 21.32 28.35 98.86 -153.81 -86.95 -22.87 88.57 9.34 2.09 15.17 46.74 26.77 0.17 2.09 0.00 7.90 1.17 30 Y C S 106.78 8.51 22.21 30.92 116.01 29.97 -123.81 93.66 74.66 23.17 2.17 19.99 30.57 24.89 0.18 2.21 0.00 20.81 1.36 31 S C C 10.32 21.97 17.57 39.01 130.96 130.55 -124.25 152.74 56.78 42.82 0.41 44.46 10.39 1.18 0.06 0.39 0.00 42.48 1.04 32 W E E 48.29 14.68 27.11 41.95 129.75 -158.50 -128.81 144.96 14.01 85.96 0.03 13.03 0.77 0.06 0.01 0.02 0.00 85.62 0.49 33 M E E 2.73 26.91 21.66 49.13 123.51 -158.46 -120.73 134.10 1.97 98.03 0.00 1.85 0.07 0.00 0.00 0.00 0.00 98.01 0.05 34 N E E 23.02 17.02 28.27 44.89 126.43 -171.65 -121.58 142.77 0.82 99.18 0.00 0.73 0.03 0.00 0.00 0.00 0.00 99.23 0.01 35 W E E 6.85 24.95 22.56 47.49 123.46 -155.23 -113.41 137.58 0.72 99.27 0.00 0.63 0.02 0.00 0.00 0.00 0.00 99.33 0.01 36 V E E 12.34 18.36 24.69 42.93 128.89 -170.39 -126.51 143.17 0.44 99.56 0.00 0.38 0.01 0.00 0.00 0.00 0.00 99.60 0.01 37 K E E 43.57 16.29 22.35 38.23 121.64 -155.87 -112.04 134.72 0.60 99.40 0.00 0.50 0.03 0.00 0.00 0.00 0.00 99.47 0.01 38 Q E E 49.65 14.15 17.62 32.28 119.27 -152.12 -103.54 131.32 5.64 94.36 0.01 5.03 0.31 0.02 0.00 0.00 0.00 94.39 0.24 39 R C C 90.32 8.55 16.03 25.89 118.39 -145.67 -91.12 141.99 81.13 18.77 0.10 78.77 1.54 0.20 0.02 0.07 0.00 18.73 0.67 40 P C T 89.24 6.43 12.01 20.20 109.62 -89.55 -58.49 135.54 96.07 0.35 3.58 0.49 3.47 91.80 0.06 3.92 0.00 0.20 0.07 41 G C T 68.78 0.36 13.37 11.47 95.77 16.54 82.04 -4.30 96.03 0.14 3.82 0.55 3.33 91.69 0.07 4.25 0.00 0.09 0.04 42 K C S 129.97 3.32 12.81 17.51 106.16 75.62 -107.05 -4.84 88.18 4.93 6.89 16.65 40.53 30.45 0.33 7.78 0.01 3.22 1.04 43 G C C 30.20 4.78 16.90 23.06 127.77 -117.17 93.21 -168.69 77.75 22.07 0.18 62.66 13.11 1.52 0.03 0.20 0.00 21.36 1.13 44 L E E 49.67 17.84 13.17 30.51 116.67 -28.14 -79.85 137.51 32.10 67.87 0.03 29.42 1.17 0.07 0.00 0.02 0.00 69.09 0.22 45 E E E 79.68 8.88 22.12 31.57 126.37 -169.39 -123.42 139.43 2.01 97.99 0.00 1.69 0.13 0.01 0.00 0.00 0.00 98.13 0.04 46 W E E 96.27 15.49 19.20 34.27 110.41 -113.94 -71.71 127.85 0.36 99.64 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.67 0.01 47 I E E 13.81 20.22 20.66 41.27 100.79 176.08 -102.24 -25.99 2.89 97.10 0.01 1.94 0.65 0.13 0.00 0.01 0.00 97.25 0.02 48 G E E 2.91 18.24 23.33 42.12 145.97 -39.96 171.38 173.78 2.88 97.11 0.01 1.75 0.69 0.11 0.00 0.01 0.00 97.41 0.02 49 R E E 67.82 14.56 25.94 40.33 132.41 -110.71 -135.90 147.04 2.33 97.65 0.01 2.06 0.15 0.01 0.00 0.00 0.00 97.71 0.06 50 I E E 6.14 24.21 18.44 43.35 118.05 -145.35 -109.80 128.26 5.07 94.92 0.02 4.62 0.33 0.02 0.01 0.01 0.00 93.40 1.61 51 Y C C 66.30 10.04 24.15 34.77 113.39 -162.99 -110.94 116.68 64.56 35.37 0.06 60.18 2.98 0.25 0.01 0.05 0.00 35.53 0.99 52 P C T 41.94 17.33 15.11 31.87 106.83 -122.24 -64.58 134.64 93.49 2.98 3.53 6.69 11.82 74.08 0.17 4.20 0.00 2.59 0.45 53 G C T 54.05 3.67 17.90 22.28 98.52 23.98 82.30 -4.89 94.87 1.12 4.01 4.28 12.68 76.92 0.19 4.78 0.00 0.82 0.32 54 D C T 89.40 4.52 15.27 20.75 103.92 62.17 -101.04 9.11 90.20 3.53 6.28 21.20 32.40 35.97 0.42 6.85 0.00 2.09 1.07 55 G C S 43.90 7.65 14.21 22.81 102.18 -121.46 81.36 1.17 91.50 6.30 2.20 30.82 40.88 20.17 0.27 2.09 0.00 4.56 1.21 56 D C C 91.26 4.26 18.41 23.57 115.59 109.81 -86.67 137.64 77.89 20.01 2.10 48.85 22.97 6.57 0.39 1.98 0.00 16.74 2.49 57 T C C 45.47 18.71 11.90 29.34 118.60 -156.76 -106.66 134.28 56.29 41.58 2.13 45.91 6.70 2.58 0.67 1.68 0.00 35.60 6.85 58 K E E 112.42 5.40 22.24 28.34 120.91 -170.92 -118.62 132.21 47.15 50.69 2.16 36.48 8.01 2.92 0.93 1.55 0.02 42.67 7.42 59 Y C C 74.61 18.71 12.56 30.08 118.80 -153.46 -98.96 130.97 60.19 36.75 3.06 42.89 12.60 5.20 1.21 2.16 0.03 29.55 6.36 60 S C C 52.07 7.74 16.46 25.32 120.16 168.21 -119.28 129.18 82.79 12.71 4.49 59.46 15.49 7.62 1.53 3.12 0.00 8.93 3.85 61 G C T 50.99 2.85 18.00 21.39 106.10 -31.34 61.57 -99.74 61.23 2.06 36.71 7.96 15.96 38.60 4.32 30.93 0.04 1.16 1.03 62 K C T 123.11 6.00 18.10 24.98 93.56 24.60 -73.08 -22.91 60.61 1.85 37.54 5.41 10.72 44.49 4.79 32.46 0.05 1.14 0.94 63 F C T 11.59 23.56 10.84 34.12 97.23 50.12 -95.54 2.70 57.75 5.89 36.36 11.03 12.17 36.05 5.51 28.90 0.17 3.55 2.62 64 K C T 118.39 7.25 16.97 26.22 111.88 122.49 -65.02 132.48 79.31 8.15 12.54 19.08 10.37 49.98 5.05 6.86 0.07 4.77 3.82 65 G C T 54.36 2.33 20.25 22.54 97.73 19.00 81.32 -8.13 85.67 4.94 9.39 6.01 15.61 64.74 1.85 6.77 0.02 3.83 1.17 66 K C T 100.56 9.35 20.01 29.40 100.83 63.97 -101.25 -7.29 82.38 11.08 6.54 27.81 18.22 37.02 1.07 5.12 0.00 9.69 1.06 67 A E E 7.23 24.52 12.10 36.15 130.11 75.04 -121.06 148.43 38.84 60.79 0.37 33.97 4.02 0.46 0.09 0.25 0.00 59.67 1.54 68 T E E 63.49 6.59 26.87 34.19 127.62 -166.98 -126.97 141.18 5.12 94.82 0.07 4.66 0.37 0.05 0.03 0.03 0.00 94.32 0.54 69 L E E 15.48 24.82 15.15 39.84 123.56 -161.16 -120.15 132.02 3.08 96.88 0.04 2.81 0.16 0.02 0.01 0.02 0.00 96.86 0.12 70 T E E 63.42 6.08 26.91 33.58 125.12 -174.38 -126.25 138.54 3.89 96.06 0.05 3.35 0.34 0.05 0.01 0.02 0.00 96.08 0.14 71 A E E 22.90 22.22 12.80 34.01 122.95 -159.92 -112.31 137.15 9.57 90.23 0.20 7.92 1.54 0.28 0.06 0.12 0.00 89.33 0.74 72 D E E 62.89 6.91 19.38 27.21 109.22 -147.41 -98.13 111.81 45.96 53.82 0.23 42.41 2.27 0.44 0.06 0.17 0.00 53.32 1.34 73 K C T 123.61 8.79 13.76 24.05 92.77 -157.46 -65.57 -26.73 93.72 1.12 5.16 3.05 10.28 79.52 0.23 5.81 0.00 0.86 0.26 74 S C T 90.19 1.20 17.82 17.93 93.45 55.43 -79.86 -21.29 93.40 0.65 5.96 1.96 9.58 81.03 0.29 6.50 0.00 0.44 0.21 75 S C T 45.10 9.55 16.04 26.25 106.78 38.81 -107.02 12.43 92.30 1.09 6.60 9.94 25.73 55.32 0.35 7.61 0.00 0.73 0.32 76 S C T 39.77 15.03 17.43 32.29 96.84 -140.50 -4.63 20.19 97.72 1.66 0.62 21.10 30.11 46.39 0.06 0.66 0.00 1.48 0.21 77 T E E 32.30 12.40 22.85 36.19 126.08 114.30 -112.83 144.83 34.50 65.43 0.07 27.87 6.10 0.42 0.01 0.08 0.00 63.90 1.62 78 V E E 4.25 25.05 19.12 44.70 124.67 -162.57 -120.71 136.09 4.49 95.50 0.00 4.22 0.17 0.01 0.00 0.00 0.00 95.38 0.21 79 Y E E 48.67 13.86 27.26 41.43 122.88 -160.89 -115.66 135.01 1.67 98.33 0.00 1.42 0.07 0.00 0.00 0.00 0.00 98.48 0.02 80 M E E 3.04 26.37 20.31 47.38 121.19 -163.97 -114.12 130.55 0.36 99.64 0.00 0.34 0.01 0.00 0.00 0.00 0.00 99.64 0.00 81 Q E E 57.77 11.42 27.74 39.66 118.54 -162.41 -111.82 126.27 0.26 99.74 0.00 0.26 0.00 0.00 0.00 0.00 0.00 99.73 0.01 82 L E E 6.09 25.02 17.18 42.77 117.21 -167.34 -110.61 126.03 9.93 90.06 0.01 10.03 0.10 0.01 0.00 0.00 0.00 89.28 0.57 83 S C C 46.25 8.23 23.42 31.77 119.91 -163.82 -101.82 159.53 91.19 8.67 0.14 41.68 40.48 7.74 0.01 0.22 0.00 9.59 0.28 84 S C S 65.00 5.05 24.58 29.75 97.67 10.42 59.93 57.93 97.93 2.00 0.07 17.79 71.72 8.35 0.00 0.11 0.00 1.80 0.23 85 L C C 13.30 24.82 11.12 35.85 112.95 -153.81 -75.81 130.19 98.63 1.35 0.02 97.28 1.49 0.03 0.01 0.01 0.00 0.47 0.71 86 T C C 54.58 5.20 24.48 29.56 134.08 172.70 -127.99 169.31 98.76 1.19 0.05 96.12 2.29 0.02 0.02 0.01 0.00 0.18 1.35 87 S H G 61.62 11.62 16.65 28.55 90.81 -94.75 -60.25 -31.52 10.72 0.07 89.21 0.67 1.09 7.87 1.52 88.79 0.00 0.04 0.01 88 E H G 119.56 4.84 22.16 27.74 91.01 62.00 -70.94 -19.11 9.36 0.11 90.53 0.53 0.84 7.13 1.39 90.02 0.00 0.07 0.01 89 D H G 11.81 21.89 17.08 39.12 95.27 56.36 -90.19 -1.10 9.43 0.21 90.36 2.23 1.58 4.46 1.67 89.88 0.00 0.16 0.03 90 S C C 21.53 18.40 21.75 39.90 115.96 109.43 -76.53 137.88 92.36 5.72 1.92 86.12 5.55 1.00 0.55 1.14 0.00 4.80 0.83 91 A E E 10.05 19.58 24.93 43.62 143.75 149.01 -158.59 171.28 16.96 82.52 0.52 15.11 1.93 0.42 0.26 0.28 0.00 79.55 2.45 92 V E E 20.21 19.47 26.35 45.09 119.16 -103.07 -103.73 132.92 4.80 95.06 0.13 4.54 0.30 0.06 0.06 0.05 0.00 94.76 0.23 93 Y E E 6.26 25.16 24.04 48.84 122.90 -163.56 -113.26 136.51 2.82 96.98 0.20 2.53 0.22 0.07 0.08 0.08 0.00 96.89 0.12 94 F E E 17.11 20.95 27.71 47.66 126.89 -167.41 -119.78 142.56 4.53 95.12 0.35 3.91 0.38 0.12 0.15 0.12 0.00 95.10 0.22 95 C E E 3.82 24.65 24.66 48.80 127.49 -165.18 -122.70 142.04 14.67 84.12 1.21 12.47 1.42 0.47 0.58 0.41 0.00 83.94 0.71 96 A E E 9.34 19.78 24.73 44.01 125.11 -160.27 -115.17 144.35 22.27 74.35 3.38 18.41 3.14 1.42 1.72 1.42 0.00 72.29 1.60 97 R E E 61.00 16.46 22.17 37.82 119.16 -149.35 -102.73 136.99 36.77 55.52 7.70 27.79 7.16 3.96 3.96 3.79 0.05 50.47 2.81 98 S C C 35.24 12.89 18.45 31.59 117.97 -143.29 -104.10 144.17 57.54 32.85 9.60 40.86 10.97 6.83 3.04 6.10 0.02 29.83 2.35 99 A C C 57.86 9.39 16.26 26.16 106.60 -141.02 -86.03 25.81 72.85 14.90 12.26 26.94 24.11 24.13 2.48 8.59 0.05 11.37 2.33 100 Y C T 141.16 5.93 14.07 21.13 108.24 53.42 -91.76 88.83 82.19 6.14 11.67 17.14 25.71 40.34 2.23 8.58 0.03 4.15 1.82 101 G C T 49.92 3.97 14.07 19.37 109.78 -5.19 90.88 -31.19 89.41 3.78 6.80 25.07 30.43 34.45 1.13 5.47 0.00 2.21 1.23 102 S C C 67.69 7.03 12.12 20.32 110.27 82.08 -89.54 118.49 85.98 6.09 7.92 39.66 24.66 22.40 1.74 5.95 0.01 3.50 2.09 103 E C C 129.48 4.47 15.00 20.77 107.74 -143.27 -89.16 90.81 80.58 8.17 11.25 32.85 23.40 25.96 2.96 7.47 0.03 5.05 2.28 104 G C C 33.53 9.61 16.44 26.50 115.90 12.84 100.58 145.87 74.95 12.46 12.59 33.04 21.60 22.25 4.11 7.65 0.06 8.78 2.50 105 F C C 73.42 14.58 16.50 30.70 116.54 -89.76 -99.05 132.39 58.06 26.71 15.22 36.69 11.68 10.41 7.37 8.09 0.12 21.10 4.54 106 A C E 35.90 14.40 19.46 33.63 115.54 -162.78 -102.86 137.42 45.39 34.83 19.79 26.97 11.30 9.12 11.18 8.81 0.25 28.70 3.65 107 M E E 49.75 17.28 19.10 35.48 119.81 -145.42 -104.97 135.46 36.88 40.38 22.74 22.96 8.62 7.93 13.50 9.33 0.23 34.09 3.33 108 D C E 56.50 13.77 21.39 34.53 112.96 -149.70 -93.89 123.84 41.16 37.02 21.82 27.25 7.85 7.91 11.97 9.21 0.10 33.13 2.57 109 Y C E 68.20 16.83 19.90 35.60 111.04 -154.78 -99.59 107.05 44.40 35.63 19.97 21.46 11.88 14.00 11.42 8.11 0.39 29.03 3.70 110 W C E 72.91 16.68 19.11 34.63 107.88 133.20 -100.85 55.31 51.64 34.29 14.07 23.86 13.58 16.70 8.14 5.86 0.41 25.19 6.27 111 G C C 21.30 14.14 18.45 32.08 122.92 -143.06 95.65 -173.70 77.65 17.23 5.12 38.25 22.14 18.36 1.70 3.15 0.02 13.76 2.62 112 Q C T 109.78 7.99 19.06 27.38 105.38 -56.02 -79.18 76.33 81.80 13.55 4.65 25.87 26.19 31.01 1.12 3.18 0.02 10.35 2.27 113 G C C 39.62 8.88 17.83 26.94 102.74 -6.35 86.01 1.89 80.20 17.92 1.88 34.63 22.66 23.40 0.25 1.71 0.00 16.08 1.26 114 T C E 42.93 15.98 13.73 29.41 117.92 128.85 -91.28 137.89 52.77 46.56 0.67 43.68 6.75 1.82 0.15 0.58 0.00 44.91 2.10 115 S E E 63.08 6.63 19.82 27.39 123.25 -156.21 -107.11 141.74 20.51 79.17 0.32 17.04 2.32 0.55 0.16 0.22 0.00 73.11 6.59 116 V E E 48.18 17.87 11.80 28.77 117.85 -151.66 -107.05 126.68 35.50 64.36 0.13 34.25 0.67 0.17 0.07 0.07 0.00 61.46 3.31 117 T C C 77.18 6.09 19.03 25.91 119.29 -169.46 -107.18 143.15 98.65 1.35 0.00 98.77 0.05 0.01 0.00 0.00 0.00 1.15 0.02