# 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 E C C 114.85 5.52 20.74 26.89 114.60 -143.88 -90.46 129.14 99.58 0.42 0.00 99.52 0.11 0.02 0.00 0.00 0.00 0.34 0.01 1 I C C 37.39 19.74 12.37 31.42 117.56 -150.98 -101.48 129.28 55.60 44.29 0.11 54.68 0.53 0.18 0.02 0.06 0.00 43.91 0.63 2 V E E 64.55 7.48 21.36 29.71 118.98 -164.73 -114.21 129.22 13.83 86.01 0.17 12.61 1.06 0.27 0.05 0.12 0.00 85.24 0.65 3 L E E 33.94 20.26 14.15 33.96 118.70 -154.87 -105.04 128.88 8.87 91.02 0.11 8.16 0.67 0.19 0.03 0.08 0.00 90.37 0.51 4 T E E 61.08 8.29 21.36 30.25 124.74 -173.06 -121.98 140.29 15.07 84.78 0.15 13.31 1.37 0.32 0.04 0.11 0.00 83.90 0.94 5 Q E E 67.45 15.41 15.04 30.07 126.65 -164.25 -122.58 139.39 43.57 56.24 0.20 33.85 8.99 0.85 0.03 0.18 0.00 55.03 1.06 6 S C C 58.36 7.85 18.14 26.86 120.53 -139.01 -102.65 144.83 79.78 20.07 0.15 52.37 25.34 1.36 0.02 0.16 0.00 19.97 0.78 7 P C S 67.12 7.45 17.37 25.72 113.54 15.29 -71.00 149.60 89.99 9.70 0.31 39.42 43.96 5.64 0.02 0.37 0.00 10.17 0.41 8 V C E 67.98 13.27 15.15 28.38 99.99 -153.66 -90.79 -10.62 60.98 38.66 0.36 34.25 22.66 3.77 0.03 0.42 0.00 38.21 0.65 9 T E E 70.81 7.31 20.23 28.63 129.65 41.57 -132.27 141.33 16.88 83.02 0.11 14.76 1.62 0.25 0.02 0.09 0.00 82.89 0.39 10 L E E 25.18 20.17 14.78 34.60 128.08 -173.38 -130.57 139.66 3.14 96.86 0.00 2.88 0.17 0.01 0.00 0.00 0.00 96.81 0.13 11 S E E 64.19 6.47 23.85 31.24 121.36 -156.43 -112.92 134.00 2.15 97.85 0.00 1.98 0.10 0.00 0.00 0.00 0.00 97.85 0.07 12 L E E 15.48 21.46 13.81 35.04 132.78 173.93 -136.31 151.64 12.04 87.95 0.01 11.62 0.43 0.02 0.00 0.01 0.00 86.75 1.18 13 S C C 51.00 5.04 23.67 28.47 122.21 -124.72 -85.92 158.32 94.07 5.90 0.02 93.39 0.95 0.08 0.00 0.01 0.00 5.13 0.44 14 P C T 58.41 14.11 14.57 28.76 109.55 -81.36 -59.89 136.06 99.21 0.34 0.45 0.24 2.39 96.84 0.03 0.28 0.00 0.18 0.06 15 G C T 45.82 4.39 19.60 24.83 96.06 22.74 88.70 -6.73 99.30 0.27 0.42 0.44 2.83 96.21 0.03 0.29 0.00 0.18 0.02 16 E C C 81.81 8.43 17.86 27.38 122.37 119.52 -85.68 150.53 92.03 7.67 0.30 74.79 16.75 0.48 0.05 0.26 0.00 6.93 0.74 17 R E E 125.22 9.30 18.84 29.27 123.99 -135.20 -108.59 141.97 45.75 54.20 0.05 44.87 0.82 0.08 0.01 0.03 0.00 53.17 1.01 18 A E E 10.07 21.10 15.66 36.72 131.82 -172.62 -133.08 150.39 2.44 97.56 0.01 2.31 0.08 0.00 0.00 0.00 0.00 97.49 0.12 19 T E E 64.38 8.87 24.55 34.00 121.88 -146.73 -116.46 133.10 1.02 98.98 0.00 0.94 0.04 0.00 0.00 0.00 0.00 98.99 0.03 20 L E E 6.30 25.08 17.02 42.53 122.68 -167.97 -116.41 133.03 5.01 94.99 0.01 4.44 0.36 0.02 0.00 0.00 0.00 95.10 0.07 21 S E E 35.87 10.24 26.60 37.32 126.11 -164.95 -118.34 143.13 13.66 86.32 0.02 12.02 0.92 0.05 0.00 0.01 0.00 86.87 0.13 22 C E E 4.51 25.26 17.14 42.74 132.71 -173.92 -137.41 150.60 11.06 88.91 0.03 10.18 0.56 0.05 0.00 0.02 0.00 88.82 0.36 23 R E E 104.01 7.75 27.01 35.58 123.25 -154.49 -118.21 134.63 5.52 94.45 0.03 5.07 0.30 0.04 0.02 0.02 0.00 92.28 2.28 24 A E E 8.66 23.94 13.80 37.48 120.31 -150.27 -96.57 141.35 36.08 63.55 0.37 33.67 1.81 0.31 0.12 0.24 0.00 62.00 1.85 25 S C C 55.57 6.89 20.87 28.14 105.75 -143.55 -82.32 -19.28 82.55 15.08 2.36 45.58 32.17 4.89 0.40 1.96 0.00 13.99 1.00 26 Q C S 106.11 5.46 19.07 25.08 122.24 -3.28 -116.91 154.75 84.54 7.36 8.10 17.44 50.89 17.45 1.97 5.20 0.01 5.82 1.21 27 S C C 65.89 6.43 19.15 26.14 113.62 -64.91 -83.22 138.76 85.78 7.01 7.21 57.20 14.40 13.79 1.66 6.10 0.00 5.59 1.26 28 V C C 23.42 21.41 11.37 31.84 115.71 -145.19 -103.89 129.08 80.24 12.33 7.43 60.15 11.03 8.11 2.51 5.40 0.01 8.33 4.46 29 R C C 152.28 3.97 21.93 26.41 102.65 -167.31 -94.92 10.79 85.37 9.61 5.02 47.24 22.10 16.25 1.44 3.80 0.00 6.90 2.28 30 N C S 51.80 13.44 17.90 31.31 123.98 67.64 -110.83 147.73 86.51 9.71 3.78 30.13 38.32 18.76 0.64 3.11 0.01 7.65 1.39 31 S C S 42.34 13.71 20.40 33.84 101.02 -140.81 -91.33 -5.45 80.97 18.09 0.93 22.18 49.52 8.19 0.10 0.84 0.00 18.33 0.84 32 L E E 35.72 15.02 23.91 39.06 127.98 56.98 -122.78 143.05 20.30 79.41 0.29 15.67 4.06 0.93 0.04 0.25 0.00 78.47 0.58 33 L E E 4.08 25.77 21.14 47.13 126.45 -169.76 -123.98 139.20 3.09 96.88 0.02 2.73 0.24 0.04 0.00 0.01 0.00 96.84 0.13 34 A E E 10.05 18.71 27.56 45.90 130.04 -169.21 -125.42 145.06 1.00 99.00 0.00 0.91 0.04 0.00 0.00 0.00 0.00 99.02 0.02 35 W E E 9.16 24.26 22.84 46.84 127.08 -156.55 -117.12 141.69 0.97 99.02 0.00 0.87 0.04 0.01 0.00 0.00 0.00 99.07 0.01 36 Y E E 24.71 17.31 23.67 40.96 133.11 -174.19 -132.58 150.39 0.70 99.30 0.00 0.61 0.03 0.00 0.00 0.00 0.00 99.33 0.03 37 Q E E 44.07 14.37 21.61 36.18 120.44 -139.98 -109.71 133.05 2.62 97.37 0.00 2.19 0.21 0.01 0.00 0.00 0.00 97.49 0.09 38 Q E E 51.91 14.30 15.63 30.39 120.43 -154.98 -105.38 136.37 29.63 70.35 0.02 26.90 1.81 0.08 0.00 0.02 0.00 70.10 1.10 39 K C C 99.81 6.18 15.92 23.35 119.17 -139.25 -92.55 147.40 98.28 1.70 0.03 96.14 2.18 0.18 0.00 0.02 0.00 1.21 0.27 40 P C T 101.69 4.30 11.54 17.84 109.67 -85.98 -58.65 133.90 99.67 0.10 0.23 0.38 3.42 95.90 0.01 0.21 0.00 0.06 0.02 41 G C T 68.90 0.30 13.22 10.90 95.08 18.73 83.48 -3.29 99.72 0.07 0.21 0.49 3.34 95.88 0.00 0.22 0.00 0.04 0.01 42 Q C S 87.83 5.75 10.19 18.02 129.07 98.48 -113.39 158.85 94.31 5.36 0.33 38.33 55.17 0.99 0.07 0.26 0.00 1.79 3.40 43 A C C 76.19 2.25 17.86 19.98 116.59 -98.45 -68.47 149.91 97.43 2.54 0.03 87.76 9.68 0.17 0.01 0.03 0.00 2.03 0.33 44 P C C 43.88 18.34 11.49 29.05 114.95 -100.97 -65.25 144.32 91.17 8.79 0.04 89.26 1.88 0.13 0.00 0.03 0.00 8.43 0.27 45 R E E 101.57 8.68 21.54 30.88 125.62 -160.23 -122.62 139.59 8.87 91.07 0.07 7.80 0.93 0.09 0.02 0.04 0.00 90.40 0.72 46 L E E 59.95 16.07 18.85 34.40 110.58 -114.72 -74.68 127.35 1.14 98.85 0.01 1.01 0.05 0.00 0.00 0.00 0.00 98.89 0.04 47 L E E 18.94 19.30 21.40 40.56 101.19 175.04 -95.80 -35.91 2.32 97.65 0.02 1.49 0.66 0.03 0.01 0.00 0.00 97.79 0.01 48 I E E 8.99 21.94 22.23 44.10 137.14 4.64 -149.86 143.88 0.44 99.54 0.01 0.36 0.03 0.00 0.00 0.00 0.00 99.59 0.01 49 Y E E 59.45 17.76 23.95 40.34 129.14 -171.00 -131.22 138.05 2.09 97.87 0.05 1.78 0.12 0.02 0.03 0.01 0.00 97.96 0.08 50 A E E 12.28 20.08 20.92 40.45 124.09 -166.17 -120.41 142.55 24.93 73.69 1.38 19.40 4.64 1.23 0.69 0.64 0.00 72.75 0.64 51 A C C 34.78 13.28 21.70 34.93 116.41 -159.24 -102.12 143.77 56.88 31.27 11.85 32.15 16.58 10.28 4.08 6.94 0.06 28.12 1.79 52 S C C 44.39 12.19 18.88 30.96 110.50 -127.42 -90.03 112.48 68.10 10.09 21.81 30.82 19.87 19.26 8.80 11.86 0.12 7.01 2.27 53 S C C 52.20 10.70 17.31 28.16 105.37 91.90 -90.63 19.93 63.55 6.30 30.15 27.68 17.94 19.61 14.24 14.43 0.17 3.59 2.32 54 R C C 126.36 9.03 15.84 25.35 100.91 69.83 -78.99 -6.19 60.32 7.13 32.54 29.15 15.37 17.22 16.81 14.51 0.21 4.01 2.72 55 A C C 61.26 9.12 14.96 24.70 103.11 82.76 -80.37 10.09 65.28 6.15 28.57 28.12 16.21 22.25 13.77 13.55 0.16 3.52 2.42 56 T C T 78.56 7.39 16.10 24.33 107.31 83.13 -93.44 35.59 72.67 6.00 21.33 21.80 19.13 32.84 10.41 9.73 0.19 3.43 2.46 57 G C C 45.63 5.59 18.50 24.90 103.96 -71.83 86.90 9.49 90.36 5.42 4.21 35.85 26.17 29.16 1.01 2.97 0.00 3.06 1.77 58 I C C 32.99 20.42 11.03 30.46 116.28 133.56 -90.12 131.18 92.15 7.20 0.65 70.35 20.75 1.17 0.30 0.37 0.00 3.46 3.61 59 P C C 53.07 8.95 16.98 27.18 113.27 -110.20 -66.64 150.64 89.43 3.77 6.79 74.63 6.98 7.33 1.60 5.60 0.00 2.63 1.23 60 D C T 112.44 3.98 17.49 22.91 94.48 -108.39 -64.58 -18.37 67.84 3.65 28.51 19.72 18.55 30.75 3.19 24.51 0.02 2.32 0.93 61 R C T 112.20 9.72 18.76 28.65 94.64 65.63 -84.04 -6.73 57.09 12.29 30.61 17.06 16.70 26.35 3.92 24.49 0.08 9.89 1.50 62 F E E 21.71 22.97 13.68 35.85 113.06 72.17 -103.13 109.29 28.90 50.46 20.64 18.65 7.70 6.71 5.47 13.40 0.07 45.40 2.60 63 S E E 50.20 9.72 22.27 32.58 132.66 143.82 -130.03 152.16 27.17 70.62 2.21 21.27 4.82 1.90 1.26 1.18 0.01 66.20 3.37 64 G E E 22.70 16.84 16.78 32.66 140.73 163.22 -160.70 169.14 26.58 72.87 0.55 21.46 4.65 1.29 0.20 0.37 0.00 70.39 1.65 65 S E E 67.57 5.47 21.14 28.23 133.18 -146.63 -138.34 155.03 35.64 63.95 0.41 29.79 4.96 1.15 0.13 0.32 0.00 61.82 1.83 66 G C C 28.49 12.18 15.46 27.93 138.54 145.90 -149.73 173.40 57.88 41.67 0.45 41.37 14.34 3.06 0.08 0.48 0.00 38.50 2.17 67 S C C 75.09 3.92 20.61 25.34 118.48 -107.03 -117.70 125.58 71.24 27.45 1.31 30.63 29.29 13.08 0.18 1.38 0.00 22.03 3.41 68 G C S 31.64 10.54 18.33 28.94 111.87 -40.87 69.54 -135.08 95.68 2.87 1.45 6.81 54.84 34.16 0.06 1.52 0.00 2.13 0.47 69 T C S 63.86 12.39 17.48 29.90 98.41 -12.78 -96.18 -7.16 93.48 5.25 1.26 7.36 56.22 29.93 0.06 1.27 0.00 4.58 0.58 70 D C E 63.85 8.28 22.21 31.50 118.79 83.60 -105.31 128.85 55.01 44.27 0.72 27.67 23.44 5.68 0.10 0.80 0.00 38.80 3.50 71 F E E 9.68 24.51 15.82 40.57 127.23 -173.28 -125.39 141.00 32.85 67.11 0.04 29.81 1.90 0.16 0.01 0.04 0.00 66.94 1.15 72 T E E 38.84 10.35 27.07 38.29 123.17 -166.23 -119.83 134.73 9.94 90.05 0.00 8.86 0.59 0.02 0.00 0.00 0.00 90.27 0.27 73 L E E 3.76 25.89 18.72 45.38 119.94 -161.95 -112.16 129.10 0.82 99.18 0.00 0.80 0.02 0.00 0.00 0.00 0.00 99.17 0.02 74 T E E 42.46 10.01 26.96 37.67 120.61 -165.84 -116.79 129.15 0.28 99.72 0.00 0.29 0.00 0.00 0.00 0.00 0.00 99.69 0.02 75 I E E 8.01 23.98 16.34 40.86 117.89 -167.31 -114.17 125.18 3.33 96.67 0.00 3.48 0.04 0.00 0.00 0.00 0.00 95.89 0.59 76 S C S 45.65 7.44 22.71 30.51 126.15 -170.78 -110.91 156.95 89.25 10.69 0.06 40.31 44.05 3.21 0.00 0.09 0.00 12.06 0.27 77 R C S 148.39 3.58 23.37 27.07 94.61 9.46 57.72 49.47 98.36 1.62 0.01 9.24 86.24 2.78 0.00 0.02 0.00 1.63 0.09 78 L C C 16.81 23.85 10.18 33.41 114.90 -154.87 -75.94 135.89 98.18 1.82 0.01 96.82 1.78 0.02 0.00 0.00 0.00 0.69 0.69 79 E C C 87.17 4.51 24.33 28.53 128.72 -167.79 -119.39 155.02 99.83 0.16 0.01 99.55 0.33 0.00 0.00 0.00 0.00 0.03 0.08 80 P H G 63.81 14.39 14.53 28.83 91.35 -106.83 -58.67 -31.74 3.37 0.01 96.62 0.14 0.18 2.18 0.27 97.23 0.00 0.01 0.00 81 E H G 127.88 3.55 21.10 25.27 90.42 62.47 -71.73 -16.01 2.72 0.02 97.26 0.07 0.12 1.85 0.17 97.77 0.00 0.01 0.00 82 D H G 23.85 18.18 16.91 35.30 94.57 63.01 -88.60 -1.29 3.77 0.04 96.19 0.41 0.36 1.75 0.27 97.18 0.00 0.03 0.00 83 F C C 35.79 19.35 19.12 38.23 116.18 101.88 -86.20 132.81 86.78 12.77 0.45 81.99 4.98 0.19 0.05 0.42 0.00 11.77 0.59 84 V E E 21.14 17.76 23.16 40.27 133.53 -173.10 -133.20 154.48 19.57 80.40 0.03 17.79 1.43 0.06 0.01 0.02 0.00 79.96 0.73 85 V E E 29.98 16.50 25.17 41.31 118.77 -125.26 -103.12 129.67 1.58 98.42 0.00 1.51 0.07 0.00 0.00 0.00 0.00 98.37 0.04 86 Y E E 8.94 24.34 21.23 45.32 124.03 -167.84 -115.74 137.71 0.54 99.46 0.00 0.51 0.02 0.00 0.00 0.00 0.00 99.45 0.02 87 Y E E 32.31 17.06 26.86 43.48 128.64 -168.81 -123.02 143.94 1.23 98.77 0.01 1.05 0.06 0.01 0.00 0.00 0.00 98.86 0.02 88 C E E 4.18 24.57 21.28 45.88 124.17 -161.24 -117.64 137.51 4.78 95.19 0.03 3.86 0.60 0.05 0.00 0.01 0.00 95.40 0.08 89 Q E E 38.98 14.01 25.09 39.17 127.47 -171.92 -125.08 142.32 4.60 95.36 0.04 4.08 0.32 0.04 0.01 0.02 0.00 95.34 0.19 90 Q E E 42.84 16.92 18.23 34.89 119.57 -143.76 -103.29 135.23 12.50 87.40 0.10 11.36 0.88 0.14 0.03 0.05 0.00 86.90 0.63 91 H E E 81.55 10.60 16.79 28.09 118.38 -161.83 -111.33 130.41 44.72 54.90 0.39 34.36 8.86 2.10 0.08 0.37 0.00 52.60 1.63 92 G C S 47.50 3.73 15.21 20.14 117.33 25.25 100.26 -166.44 85.93 13.45 0.61 21.20 42.61 21.80 0.04 0.74 0.00 12.69 0.91 93 S C S 89.24 2.40 13.44 16.85 104.90 -47.15 -91.21 27.31 95.50 3.91 0.59 19.12 54.45 21.99 0.04 0.73 0.00 3.00 0.68 94 S C S 67.17 5.03 11.84 18.74 122.23 82.05 -101.67 143.00 95.70 4.10 0.20 28.54 65.25 2.35 0.03 0.18 0.00 2.53 1.13 95 P C C 84.74 4.36 15.04 20.62 116.14 -72.70 -68.96 151.03 97.23 2.49 0.28 51.80 40.56 4.96 0.04 0.33 0.00 1.87 0.44 96 P C C 75.91 8.43 14.85 24.31 114.12 -95.32 -68.03 146.68 92.45 7.10 0.45 66.23 20.36 5.38 0.05 0.54 0.00 6.86 0.58 97 W E E 75.44 16.19 13.93 29.97 119.36 -136.34 -99.92 136.41 46.21 53.40 0.39 39.86 4.71 1.05 0.08 0.35 0.00 52.37 1.59 98 T E E 66.43 9.21 21.30 31.08 122.90 -159.53 -116.83 135.92 14.53 85.27 0.20 12.95 1.32 0.25 0.09 0.12 0.00 82.47 2.80 99 F E E 48.19 19.67 15.50 34.19 117.95 -157.46 -102.91 133.01 23.35 76.25 0.40 19.44 3.47 0.94 0.17 0.28 0.00 72.93 2.78 100 G C C 22.94 12.01 18.91 30.99 122.30 -136.85 -80.14 -162.77 71.71 27.03 1.26 41.54 21.62 8.64 0.16 1.22 0.00 25.64 1.19 101 Q C T 120.48 5.04 20.87 26.50 106.83 -46.15 -73.78 117.67 75.62 21.53 2.85 15.00 30.55 31.22 0.28 2.49 0.01 18.76 1.68 102 G C C 24.66 13.71 18.42 31.51 113.51 -23.10 91.20 4.46 73.41 24.75 1.84 27.23 22.74 23.39 0.16 1.78 0.00 23.80 0.89 103 T E E 24.47 19.71 16.77 35.86 119.73 -100.28 -103.72 135.75 41.36 58.36 0.28 36.73 3.01 0.52 0.06 0.21 0.00 58.72 0.75 104 K E E 99.32 8.69 24.27 33.39 120.04 -153.42 -107.53 132.69 7.20 92.69 0.10 6.63 0.51 0.09 0.04 0.04 0.00 92.23 0.45 105 V E E 12.22 23.69 15.34 39.03 122.57 -166.81 -115.35 131.56 4.41 95.53 0.07 4.22 0.21 0.04 0.02 0.03 0.00 95.33 0.15 106 E E E 82.20 6.91 25.16 32.48 119.31 -161.63 -112.73 129.10 4.05 95.89 0.06 3.85 0.26 0.06 0.02 0.03 0.00 95.58 0.21 107 F E E 24.38 22.08 13.22 34.94 119.34 -161.05 -105.74 130.31 11.00 88.89 0.11 10.22 0.61 0.12 0.04 0.05 0.00 88.27 0.70 108 K E E 107.69 5.23 19.56 25.67 122.17 -166.22 -111.59 140.41 36.11 63.70 0.19 31.73 2.77 0.46 0.06 0.14 0.00 63.62 1.22 109 R C C 123.15 9.72 11.49 22.08 114.50 -124.95 -84.05 136.53 70.41 29.41 0.18 66.94 1.69 0.48 0.04 0.12 0.00 29.43 1.28 110 T C C 89.27 4.68 14.10 20.24 113.11 -133.92 -88.69 132.10 99.82 0.17 0.01 99.79 0.07 0.02 0.00 0.00 0.00 0.11 0.00