# 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 81.35 11.44 16.05 27.75 118.97 -166.85 -102.91 134.86 99.78 0.22 0.00 99.81 0.04 0.00 0.00 0.00 0.00 0.14 0.00 1 E E E 103.38 8.23 17.43 26.62 119.89 -154.38 -106.23 134.03 42.25 57.71 0.04 40.50 0.91 0.12 0.01 0.03 0.00 57.95 0.50 2 V E E 26.95 17.97 14.60 32.64 127.36 -169.55 -123.60 141.44 8.46 91.53 0.01 7.70 0.44 0.03 0.00 0.00 0.00 91.70 0.13 3 T E E 54.18 10.74 22.41 33.45 128.97 -167.95 -127.22 142.68 1.31 98.68 0.00 1.24 0.04 0.00 0.00 0.00 0.00 98.68 0.03 4 A E E 11.62 21.66 16.73 38.10 130.91 -172.75 -133.36 145.82 1.16 98.84 0.00 1.08 0.05 0.00 0.00 0.00 0.00 98.85 0.01 5 K E E 97.16 8.38 24.87 33.86 122.69 -158.04 -119.40 131.33 1.64 98.36 0.01 1.47 0.10 0.01 0.00 0.00 0.00 98.38 0.04 6 L E E 20.21 22.35 14.80 36.73 118.43 -165.09 -114.98 125.98 6.21 93.75 0.04 6.00 0.26 0.04 0.01 0.01 0.00 93.46 0.21 7 R E E 131.83 5.29 22.13 28.48 124.01 -168.02 -113.16 144.25 19.07 80.67 0.26 9.08 6.16 4.71 0.03 0.23 0.00 79.45 0.34 8 G E E 45.52 5.29 21.96 27.71 95.69 17.67 75.01 13.34 41.82 58.00 0.18 13.18 20.45 7.91 0.01 0.20 0.00 57.84 0.40 9 A E E 11.83 22.41 13.29 35.23 114.03 153.47 -77.04 133.98 40.76 58.87 0.37 36.92 3.01 0.55 0.10 0.27 0.00 57.64 1.52 10 A C E 68.10 6.03 25.04 31.36 105.55 -137.77 -86.47 91.50 50.06 49.70 0.24 38.78 10.76 1.06 0.07 0.21 0.00 45.67 3.44 11 I C C 16.61 21.82 14.25 35.80 132.23 149.77 -130.80 151.69 81.61 18.23 0.16 66.11 16.31 0.31 0.08 0.09 0.00 14.57 2.52 12 S C C 44.45 5.67 23.92 29.60 119.46 -108.53 -74.59 156.82 95.18 4.67 0.15 95.34 0.57 0.06 0.10 0.02 0.00 3.25 0.66 13 A H H 36.13 17.18 15.17 31.97 91.67 -113.06 -58.62 -37.82 1.66 0.00 98.34 0.24 0.18 0.99 98.17 0.41 0.00 0.00 0.00 14 Q H H 117.46 2.53 23.02 25.34 91.39 54.47 -63.54 -39.77 0.75 0.00 99.25 0.07 0.05 0.51 98.99 0.38 0.00 0.00 0.00 15 K H H 72.89 11.59 21.68 33.11 91.97 48.35 -66.59 -39.19 0.45 0.00 99.55 0.07 0.02 0.26 99.26 0.39 0.00 0.00 0.00 16 V H H 2.08 27.01 16.09 43.83 91.03 51.92 -62.93 -42.71 0.15 0.00 99.85 0.02 0.01 0.06 99.86 0.04 0.00 0.00 0.00 17 R H H 101.55 11.52 23.71 34.73 91.23 51.90 -62.46 -41.47 0.09 0.00 99.91 0.01 0.00 0.04 99.93 0.01 0.00 0.00 0.00 18 L H H 71.83 4.89 26.25 31.42 91.61 50.54 -63.60 -42.04 0.08 0.00 99.92 0.01 0.00 0.05 99.93 0.01 0.00 0.00 0.00 19 V H H 4.76 23.19 21.60 44.54 91.67 48.92 -64.03 -43.79 0.11 0.00 99.89 0.01 0.00 0.07 99.89 0.03 0.00 0.00 0.00 20 A H H 3.80 25.13 19.25 44.36 90.98 51.49 -62.54 -41.61 0.17 0.00 99.83 0.01 0.00 0.12 99.78 0.08 0.00 0.00 0.00 21 D H H 86.67 4.78 25.60 30.97 91.28 52.84 -64.69 -36.23 1.03 0.00 98.97 0.03 0.02 0.97 98.45 0.52 0.00 0.00 0.00 22 E H H 76.75 10.28 23.51 33.87 91.83 54.08 -71.09 -28.36 4.40 0.00 95.60 0.05 0.08 4.77 94.40 0.70 0.00 0.00 0.00 23 V H H 2.02 26.36 15.05 42.46 95.54 47.72 -89.82 -15.24 27.46 0.03 72.50 0.82 1.07 25.46 71.23 1.36 0.02 0.01 0.03 24 R C T 103.38 13.77 17.18 31.10 111.98 113.86 -62.18 131.77 98.42 0.06 1.52 0.23 0.54 98.05 0.99 0.12 0.00 0.01 0.05 25 G C T 55.30 2.42 21.12 23.82 94.30 17.68 84.32 -2.54 99.75 0.01 0.25 0.12 0.71 98.99 0.15 0.03 0.00 0.00 0.00 26 K C S 62.62 13.47 15.13 29.19 123.13 122.78 -85.13 151.92 99.74 0.24 0.02 43.85 55.81 0.15 0.01 0.00 0.00 0.08 0.09 27 S E B 43.54 5.78 23.79 29.95 118.14 -107.46 -70.58 155.12 10.68 89.29 0.02 8.30 0.12 0.00 0.02 0.00 0.00 3.88 87.66 28 I H H 11.85 24.15 14.00 38.41 90.99 -112.40 -58.02 -39.54 0.63 0.00 99.37 0.06 0.04 0.43 98.98 0.48 0.00 0.00 0.00 29 E H H 110.11 5.68 22.50 29.06 91.29 53.95 -63.13 -40.74 0.22 0.00 99.78 0.01 0.01 0.17 99.43 0.39 0.00 0.00 0.00 30 R H H 120.78 3.75 24.80 28.24 91.62 48.08 -66.10 -40.06 0.12 0.00 99.88 0.01 0.01 0.08 99.47 0.44 0.00 0.00 0.00 31 A H H 2.53 23.95 16.68 41.12 91.41 51.12 -63.93 -43.15 0.17 0.00 99.83 0.02 0.01 0.09 99.68 0.20 0.00 0.00 0.00 32 L H H 26.36 18.99 20.06 38.35 91.42 51.43 -62.67 -41.90 0.30 0.00 99.70 0.02 0.01 0.22 99.18 0.58 0.00 0.00 0.00 33 D H H 88.83 2.56 25.76 27.34 91.64 51.20 -63.98 -41.02 1.13 0.00 98.87 0.03 0.03 1.05 97.29 1.59 0.00 0.00 0.00 34 I H H 41.79 12.34 21.30 34.10 91.77 49.83 -65.01 -41.20 2.34 0.00 97.65 0.08 0.08 2.10 94.11 3.63 0.00 0.00 0.00 35 L H H 3.37 26.00 14.64 41.02 91.26 51.85 -67.35 -33.84 6.89 0.02 93.08 0.63 0.44 5.31 80.41 13.18 0.01 0.01 0.01 36 T H H 70.61 10.45 19.39 30.04 91.30 63.94 -68.54 -22.33 44.76 0.06 55.17 1.28 1.27 42.73 44.67 9.96 0.01 0.03 0.05 37 Y C T 155.70 3.04 20.48 23.47 94.53 52.75 -91.58 -4.34 65.61 0.10 34.29 2.36 3.40 60.24 25.05 8.79 0.01 0.04 0.10 38 S C S 23.13 18.15 9.46 26.79 119.10 98.50 -82.84 144.87 97.76 0.66 1.58 45.52 50.24 1.94 1.22 0.30 0.00 0.16 0.61 39 N C C 128.34 2.04 18.67 20.83 97.41 -135.26 -85.62 13.37 98.44 0.88 0.69 76.00 20.46 1.87 0.39 0.25 0.00 0.27 0.77 40 K C S 90.38 9.96 14.17 25.22 118.98 110.18 -83.23 147.35 79.73 0.78 19.49 25.60 49.26 3.40 20.25 0.64 0.01 0.13 0.70 41 K H H 129.63 4.08 21.08 26.01 93.49 -116.35 -62.01 -37.06 22.17 0.04 77.79 1.09 2.11 18.62 74.80 3.32 0.03 0.01 0.03 42 G H H 7.04 19.58 17.74 37.07 92.04 52.04 -65.12 -35.82 16.42 0.04 83.54 1.62 1.08 13.39 80.59 3.28 0.01 0.01 0.02 43 A H H 7.74 20.31 17.87 38.37 91.55 56.28 -63.20 -39.53 1.31 0.00 98.68 0.40 0.13 0.59 97.57 1.31 0.00 0.00 0.00 44 V H H 71.86 5.43 26.10 31.80 91.55 52.61 -63.90 -41.64 0.29 0.00 99.71 0.06 0.02 0.15 99.54 0.24 0.00 0.00 0.00 45 F H H 45.45 13.24 24.21 37.53 91.61 50.24 -64.63 -42.39 0.15 0.00 99.85 0.02 0.01 0.09 99.77 0.11 0.00 0.00 0.00 46 V H H 1.17 27.59 20.69 48.79 91.15 49.73 -63.80 -43.08 0.07 0.00 99.93 0.01 0.00 0.04 99.92 0.03 0.00 0.00 0.00 47 K H H 64.63 16.43 24.15 39.02 91.11 51.57 -62.12 -42.21 0.04 0.00 99.96 0.00 0.00 0.02 99.96 0.01 0.00 0.00 0.00 48 K H H 109.56 3.70 28.01 31.89 91.45 49.96 -64.26 -41.20 0.05 0.00 99.95 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 49 C H H 8.95 19.61 22.84 42.23 91.62 49.72 -64.05 -43.53 0.09 0.00 99.91 0.00 0.00 0.05 99.92 0.02 0.00 0.00 0.00 50 L H H 2.13 26.97 21.19 48.38 91.26 49.18 -63.70 -42.87 0.12 0.00 99.88 0.01 0.00 0.07 99.90 0.01 0.00 0.00 0.00 51 N H H 76.40 8.42 26.70 35.57 91.60 50.28 -63.87 -41.79 0.17 0.00 99.83 0.01 0.00 0.10 99.86 0.02 0.00 0.00 0.00 52 S H H 43.60 6.22 26.83 33.85 91.67 49.79 -64.56 -41.70 0.26 0.00 99.74 0.02 0.01 0.18 99.76 0.03 0.00 0.00 0.00 53 A H H 3.86 22.65 21.05 43.68 91.64 49.87 -64.14 -42.96 0.30 0.00 99.70 0.03 0.02 0.20 99.71 0.04 0.00 0.00 0.00 54 I H H 25.39 18.45 22.52 40.24 91.46 49.77 -62.86 -42.86 0.29 0.00 99.71 0.04 0.02 0.17 99.72 0.05 0.00 0.00 0.00 55 A H H 50.21 3.45 25.44 28.49 91.19 50.28 -62.64 -42.74 0.52 0.00 99.48 0.06 0.03 0.31 99.52 0.08 0.00 0.00 0.00 56 N H H 49.64 8.18 22.19 31.30 92.14 48.73 -65.51 -40.51 1.29 0.00 98.71 0.11 0.09 0.91 98.65 0.22 0.00 0.00 0.00 57 A H H 5.74 20.09 13.80 34.57 91.63 51.07 -63.95 -41.90 2.34 0.02 97.64 0.28 0.24 1.65 97.30 0.51 0.01 0.01 0.00 58 E H H 98.75 7.19 17.35 25.36 92.74 49.04 -66.70 -40.24 5.59 0.05 94.36 0.59 0.59 4.35 93.82 0.58 0.03 0.02 0.02 59 H H H 144.13 1.33 17.52 17.88 95.85 41.90 -74.89 -36.62 17.85 0.09 82.06 0.90 1.75 15.43 80.97 0.81 0.07 0.03 0.05 60 N C T 97.30 4.56 14.67 20.28 101.55 33.36 -92.28 -28.67 65.14 0.13 34.73 1.71 5.90 54.87 36.06 1.27 0.02 0.04 0.11 61 H C T 102.40 6.91 12.85 21.01 101.52 23.12 -107.62 -0.71 72.59 0.27 27.15 5.18 16.47 48.63 27.79 1.60 0.02 0.08 0.23 62 G C C 60.37 1.27 17.32 17.80 95.70 -114.71 76.18 16.42 99.47 0.11 0.42 69.89 19.69 9.85 0.10 0.34 0.00 0.05 0.09 63 L C C 39.08 16.13 9.24 25.17 119.93 149.82 -86.03 145.71 99.58 0.32 0.10 89.36 9.84 0.34 0.03 0.05 0.00 0.10 0.28 64 D C C 87.97 3.16 22.84 25.24 108.41 -118.95 -84.86 118.03 99.57 0.37 0.06 99.04 0.54 0.09 0.02 0.02 0.00 0.13 0.17 65 I H G 37.42 21.68 11.40 32.17 93.03 -157.23 -64.39 -26.77 16.27 0.24 83.49 2.13 1.81 9.58 0.59 85.72 0.00 0.15 0.02 66 D H G 106.83 3.33 20.37 24.68 90.83 65.85 -69.94 -16.43 16.20 0.21 83.59 0.60 1.33 11.81 0.50 85.60 0.00 0.15 0.01 67 G H G 33.43 6.77 19.89 27.93 94.88 56.55 -91.85 -1.62 15.91 0.43 83.66 2.01 2.25 8.86 0.51 86.04 0.00 0.31 0.02 68 L C C 7.93 25.39 11.36 36.71 119.09 102.20 -89.38 138.96 63.52 36.35 0.13 57.71 4.55 0.19 0.02 0.10 0.00 37.04 0.40 69 K E E 88.98 7.05 27.09 34.85 125.95 -168.79 -124.45 139.25 2.22 97.77 0.01 2.17 0.08 0.00 0.00 0.00 0.00 97.52 0.22 70 V E E 19.26 23.40 15.37 38.79 110.34 -124.51 -82.75 121.90 0.42 99.58 0.00 0.41 0.01 0.00 0.00 0.00 0.00 99.56 0.02 71 A E E 45.72 7.67 22.39 30.96 100.79 176.42 -93.95 -35.07 2.37 97.63 0.00 1.52 0.54 0.02 0.00 0.00 0.00 97.91 0.01 72 T E E 51.20 7.53 24.55 32.99 137.85 0.90 -151.80 148.03 1.40 98.60 0.00 0.90 0.22 0.01 0.00 0.00 0.00 98.86 0.00 73 I E E 23.50 23.72 14.98 38.16 124.08 -165.75 -127.22 129.83 0.75 99.25 0.00 0.65 0.03 0.00 0.00 0.00 0.00 99.32 0.00 74 Y E E 81.89 8.02 25.67 34.19 128.48 -174.28 -129.65 141.84 0.27 99.73 0.00 0.24 0.00 0.00 0.00 0.00 0.00 99.75 0.00 75 V E E 34.01 20.81 15.24 35.26 122.38 -158.69 -116.54 130.08 1.03 98.97 0.00 0.92 0.03 0.00 0.00 0.00 0.00 99.03 0.01 76 D E E 59.33 8.26 20.60 29.48 124.71 -170.92 -118.36 140.12 6.14 93.85 0.01 5.30 0.47 0.03 0.00 0.00 0.00 94.05 0.15 77 E E E 106.82 9.47 16.56 26.78 114.50 -127.59 -89.40 134.38 20.89 79.06 0.05 18.84 1.43 0.12 0.01 0.03 0.00 79.13 0.43 78 G E E 23.80 11.83 12.78 25.29 128.43 -159.28 -109.73 171.91 44.18 55.70 0.12 33.47 8.82 0.69 0.02 0.11 0.00 56.45 0.44 79 I E E 109.65 3.86 16.52 21.32 117.49 -75.43 -86.54 139.80 33.70 66.15 0.15 27.15 5.40 0.47 0.03 0.12 0.00 66.24 0.59 80 T E E 70.48 9.93 11.43 22.37 121.23 -147.54 -109.55 136.41 17.90 82.00 0.11 16.38 1.19 0.15 0.03 0.07 0.00 81.45 0.73 81 L E E 85.42 6.18 12.34 20.46 120.60 -158.32 -113.31 134.91 9.83 90.10 0.07 9.00 0.69 0.09 0.03 0.04 0.00 89.66 0.49 82 K E E 127.01 5.18 11.88 19.14 118.62 -147.46 -105.09 134.65 7.89 92.07 0.04 7.33 0.37 0.05 0.01 0.02 0.00 91.91 0.31 83 R E E 125.74 5.12 11.86 18.91 125.36 -172.30 -121.99 144.99 10.40 89.54 0.06 9.67 0.45 0.06 0.02 0.03 0.00 89.39 0.38 84 I E E 102.79 5.19 9.85 17.11 115.86 -128.69 -97.22 130.80 18.09 81.80 0.11 17.13 0.72 0.10 0.05 0.06 0.00 80.25 1.70 85 L E E 93.51 4.11 10.72 16.79 119.70 -166.66 -113.87 134.82 43.40 56.29 0.31 40.77 1.67 0.25 0.12 0.16 0.00 56.19 0.84 86 P E E 94.79 3.08 9.04 14.06 113.00 -114.52 -70.48 141.08 43.87 47.35 8.78 34.74 6.10 3.84 3.47 5.29 0.02 43.90 2.65 87 R C C 150.24 3.01 7.72 12.61 113.16 -163.32 -99.97 153.68 58.47 14.95 26.57 38.41 12.37 9.21 6.17 19.29 0.02 12.36 2.17 88 A C G 92.05 1.03 7.54 9.36 110.96 -60.19 -90.53 134.95 45.31 11.40 43.29 12.16 14.58 22.82 4.51 35.14 0.15 8.32 2.33 89 K C T 181.17 0.40 8.93 8.56 98.35 -8.30 31.84 33.82 61.15 1.33 37.53 5.69 12.99 41.44 2.81 35.58 0.01 0.74 0.72 90 G C T 64.91 0.74 8.84 9.76 97.52 -55.62 81.34 2.03 82.53 1.56 15.91 7.97 26.98 47.39 1.34 14.68 0.01 0.89 0.73 91 R C C 150.39 1.97 8.67 12.33 120.10 106.53 -104.87 146.41 69.39 25.10 5.51 34.43 23.17 13.11 1.12 4.40 0.04 17.92 5.80 92 A C C 71.23 4.70 8.23 14.89 117.11 -134.80 -95.55 141.05 60.97 36.49 2.54 44.39 11.57 5.22 0.60 2.20 0.01 33.09 2.93 93 D C E 83.73 4.60 11.17 17.61 121.90 -166.82 -110.58 145.76 53.91 45.21 0.89 37.06 13.35 3.00 0.15 0.75 0.00 45.00 0.69 94 R E E 145.24 4.78 11.48 18.24 115.80 -125.61 -92.74 132.90 26.20 73.61 0.19 22.63 2.59 0.37 0.05 0.11 0.00 73.83 0.42 95 I E E 79.73 7.98 11.66 21.35 121.68 -164.07 -113.97 135.29 5.29 94.68 0.02 5.02 0.25 0.03 0.01 0.01 0.00 94.42 0.27 96 S E E 58.05 7.29 13.30 22.36 120.51 -152.71 -107.32 136.11 3.44 96.54 0.01 3.23 0.13 0.01 0.00 0.00 0.00 96.42 0.19 97 K E E 99.46 8.87 14.72 24.91 125.74 -170.59 -124.22 141.75 10.05 89.93 0.02 9.01 0.55 0.03 0.00 0.01 0.00 90.23 0.17 98 R E E 102.03 10.53 16.03 27.31 121.31 -145.51 -105.33 137.08 16.81 83.17 0.02 15.72 0.63 0.04 0.01 0.01 0.00 83.32 0.27 99 T E E 46.49 11.68 18.67 31.01 129.44 -165.69 -124.03 150.69 17.62 82.36 0.02 17.19 0.48 0.04 0.00 0.01 0.00 81.59 0.68 100 C E E 13.19 19.68 16.28 36.21 126.87 -158.84 -125.52 142.85 14.55 85.43 0.02 13.74 0.57 0.04 0.00 0.01 0.00 85.06 0.58 101 H E E 66.98 9.64 24.17 34.26 118.93 -146.11 -106.76 129.64 11.60 88.39 0.01 10.03 1.01 0.04 0.00 0.01 0.00 88.74 0.17 102 I E E 7.69 24.19 17.14 41.65 122.30 -165.19 -116.06 132.83 6.27 93.72 0.00 5.93 0.18 0.01 0.00 0.00 0.00 93.80 0.08 103 T E E 31.44 10.17 26.23 37.44 121.14 -163.86 -113.91 130.99 1.41 98.59 0.00 1.28 0.05 0.00 0.00 0.00 0.00 98.64 0.02 104 I E E 5.18 25.19 18.13 43.94 121.38 -164.82 -114.27 130.22 0.49 99.51 0.00 0.45 0.01 0.00 0.00 0.00 0.00 99.53 0.01 105 K E E 68.36 9.51 26.76 36.75 124.44 -169.30 -119.39 137.32 0.32 99.68 0.00 0.30 0.00 0.00 0.00 0.00 0.00 99.69 0.01 106 V E E 13.95 22.34 15.81 38.12 120.40 -155.05 -106.80 132.45 2.12 97.88 0.00 1.98 0.06 0.00 0.00 0.00 0.00 97.87 0.09 107 G E E 22.15 8.93 19.41 29.21 134.47 169.69 -130.27 170.92 30.16 69.79 0.05 28.32 0.78 0.14 0.01 0.04 0.00 70.15 0.56 108 E C C 126.03 5.39 18.10 24.47 110.18 -86.46 -73.46 135.02 99.48 0.52 0.00 99.45 0.12 0.01 0.00 0.00 0.00 0.41 0.01