A0A5K4F2V0_SCHMA Loading...

UBX domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F2V0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 316 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.5	Low	42.1	Very low	248 Å²	248	150.3 Å²	150.3	100%	1.222	81%	0.805	S	S	*	*				0	91.8	0	-78.3	169.7	165.1	0	0	105.8
2	T	39.2	Very low	41.2	Very low	120 Å²	120	146.5 Å²	146.5	74%	0.736	80%	0.799	S	S	*	*			trans	-124.5	156.5	-167.2	37.8	0	0	0	0	109.3
3	D	42.9	Very low	40.7	Very low	130 Å²	130	147.4 Å²	147.4	70%	0.695	80%	0.8	S	S	*	*			trans	83.2	107.7	159.3	-54.1	-42.4	0	0	0	117.5
4	N	42.1	Very low	39.9	Very low	132 Å²	132	153.7 Å²	153.7	71%	0.706	81%	0.806	S	S	*	*				75.4	112.3	64.4	-70.4	-40.5	0	0	0	113.2
5	N	44.5	Very low	39.4	Very low	155 Å²	155	154.9 Å²	154.9	83%	0.829	81%	0.806	S	S	*	*				158.6	101.5	124.3	-77.6	-31.9	0	0	0	113.2
6	H	50.1	Low	38.8	Very low	169 Å²	169	153.4 Å²	153.4	78%	0.782	81%	0.806	S	S	*	*				29.6	167.5	121.8	-124.7	-19.2	0	0	0	121.8
7	P	44.8	Very low	38.5	Very low	93 Å²	93	151.5 Å²	151.5	60%	0.604	80%	0.802	S	S	*	*			cis	-128.3	172.1	-40.7	4	19.7	0	0	0	116.1
8	D	35.1	Very low	37.8	Very low	134 Å²	134	155.8 Å²	155.8	72%	0.717	81%	0.806	S	S	*	*			trans	39.8	124.5	134.3	-57.6	-31.2	0	0	0	123.4
9	H	37.9	Very low	37.4	Very low	200 Å²	200	155.5 Å²	155.5	93%	0.926	80%	0.804	S	S	*	*			trans	-141.9	111.2	133.7	-105.4	-70.9	0	0	0	109.6
10	S	38.9	Very low	37	Very low	112 Å²	112	155.2 Å²	155.2	78%	0.783	80%	0.803	S	S	*	*			trans	-81.1	137.2	179.7	50.4	0	0	0	0	112.6
11	D	33.2	Very low	36.7	Very low	160 Å²	160	156.7 Å²	156.7	86%	0.856	81%	0.807	S	S	*	*			trans	-68	155.4	169.1	-81.6	-49.8	0	0	0	114.1
12	S	30.8	Very low	35.5	Very low	105 Å²	105	147.5 Å²	147.5	73%	0.734	78%	0.776	S	S	*	*			trans	74.6	94.4	149.9	177.6	0	0	0	0	118.6
13	I	35.5	Very low	35.2	Very low	158 Å²	158	148.3 Å²	148.3	81%	0.81	78%	0.781	S	S	*	*			trans	-126	116.7	144.2	-62	179.3	0	0	0	108.8
14	R	29.3	Very low	34.9	Very low	236 Å²	236	151.1 Å²	151.1	89%	0.891	79%	0.787	S	S	*	*			trans	-70.9	126.6	160.4	-75.9	174.5	166.1	173.5	-4.4	107.8
15	E	32.7	Very low	34.8	Very low	171 Å²	171	150.5 Å²	150.5	80%	0.799	79%	0.79	S	S	*	*			trans	-130.3	117.7	166.6	-155.5	154.9	-154.3	0	0	109.8
16	T	28.7	Very low	34.8	Very low	131 Å²	131	145.9 Å²	145.9	80%	0.804	78%	0.78	S	S	*	*			trans	-104.7	112.3	177.3	-63.3	0	0	0	0	107.4
17	T	34.9	Very low	34.6	Very low	121 Å²	121	147.5 Å²	147.5	74%	0.742	79%	0.785	S	S	*	*			trans	-153.9	99.7	164.5	36.4	0	0	0	0	105.7
18	R	26	Very low	34.5	Very low	229 Å²	229	146.9 Å²	146.9	86%	0.864	78%	0.779	S	S	*	*				40.5	137.2	86.8	-96.3	-169.3	176.2	165	-0.3	114.6
19	I	29.1	Very low	34.9	Very low	151 Å²	151	142.6 Å²	142.6	77%	0.774	76%	0.759	S	S	*	*			trans	76.4	127.6	163.7	-17.3	179.2	0	0	0	113.3
20	D	29.9	Very low	35.5	Very low	148 Å²	148	138.3 Å²	138.3	79%	0.791	75%	0.749	S	S	*	*			cis	-159.9	157	29.7	-143.5	-12.2	0	0	0	112.1	G22	D20-G22 PolarHBondContact O-N 3.49Å
21	E	29.6	Very low	35.8	Very low	187 Å²	187	141.4 Å²	141.4	87%	0.874	75%	0.749	S	S	*	*			trans	-64.3	122.8	167.1	-71	-164.9	147.2	0	0	110.3
22	G	31.3	Very low	36.5	Very low	56 Å²	56	136.9 Å²	136.9	58%	0.577	73%	0.727	S	S	*	*			trans	-120.2	85.6	178.9	0	0	0	0	0	111.6	D20 F24	D20-G22 PolarHBondContact O-N 3.49Å; G22-F24 WeakPolarHBondContact O-CD2 3.21Å; G22-F24 PolarHBondContact O-N 3.44Å
23	T	31.5	Very low	37.7	Very low	136 Å²	136	137.3 Å²	137.3	83%	0.834	72%	0.72	S	S	*	*			trans	-56.9	100.8	162.2	-62.2	0	0	0	0	108.8
24	F	38.1	Very low	38.5	Very low	190 Å²	190	137.3 Å²	137.3	83%	0.833	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-76.7	122.7	173.6	-80.7	-82.5	0	0	0	109.5	G22 G26	G22-F24 WeakPolarHBondContact O-CD2 3.21Å; G22-F24 PolarHBondContact O-N 3.44Å; F24-G26 PolarHBondContact O-N 2.66Å
25	P	39	Very low	39.6	Very low	118 Å²	118	128.4 Å²	128.4	77%	0.766	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-71.8	120.2	175.4	29.2	-29.9	0	0	0	108.4
26	G	45	Very low	40.4	Very low	59 Å²	59	128.1 Å²	128.1	61%	0.608	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-56.1	146.1	171.1	0	0	0	0	0	110.7	F24 V28	F24-G26 PolarHBondContact O-N 2.66Å; G26-V28 PolarHBondContact O-N 3.36Å
27	F	44.7	Very low	41.5	Very low	203 Å²	203	133 Å²	133	89%	0.89	70%	0.696	S	S	*	*			trans	-60.8	101.6	170.5	175.9	-100.4	0	0	0	109
28	V	43.6	Very low	42.2	Very low	80 Å²	80	132.3 Å²	132.3	49%	0.485	69%	0.694	S	S	.	*			trans	-92.1	115.2	173.9	176.9	0	0	0	0	107.1	G26 S35	G26-V28 PolarHBondContact O-N 3.36Å; V28-S35 WeakPolarHBondContact CG1-OG 3.33Å
29	S	44	Very low	43.5	Very low	43 Å²	43	127.5 Å²	127.5	30%	0.301	70%	0.696	S	S	.	*			trans	-54.8	129.9	167.5	163.3	0	0	0	0	108.6	F31 T32	S29-F31 PolarHBondContact O-N 3.03Å; S29-F31 PolarHBondContact OG-N 3.26Å; S29-T32 WeakPolarHBondContact CB-OG1 3.5Å; S29-T32 PolarHBondContact O-N 3.26Å; S29-T32 VanDerWaalsContact O-N 3.16Å
30	P	48.9	Very low	44.9	Very low	111 Å²	111	125.4 Å²	125.4	72%	0.721	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-2.1	-177.3	24.8	-32.1	0	0	0	113.9
31	F	47.1	Very low	45.8	Very low	176 Å²	176	121.7 Å²	121.7	77%	0.772	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.9	7.5	-177.7	-55.4	-70.1	0	0	0	114	S29	S29-F31 PolarHBondContact O-N 3.03Å; S29-F31 PolarHBondContact OG-N 3.26Å
32	T	47.1	Very low	47	Very low	65 Å²	65	117.2 Å²	117.2	40%	0.399	67%	0.67	S	S	.	*			trans	-101.2	107.4	-176.3	-57.4	0	0	0	0	111.5	S29 F34	S29-T32 WeakPolarHBondContact CB-OG1 3.5Å; S29-T32 PolarHBondContact O-N 3.26Å; S29-T32 VanDerWaalsContact O-N 3.16Å; T32-F34 HydrophobicContact CG2-CB 3.85Å; T32-F34 HydrophobicContact CG2-CD2 3.95Å; T32-F34 HydrophobicContact CG2-CG 4.39Å; T32-F34 PolarHBondContact O-N 3.02Å
33	I	56.1	Low	48	Very low	114 Å²	114	122.2 Å²	122.2	59%	0.585	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-15.3	172.5	-77.9	169.2	0	0	0	113.2
34	F	51.7	Low	49.2	Very low	158 Å²	158	119.1 Å²	119.1	69%	0.693	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	10.2	-169.8	-56.2	-72.6	0	0	0	116.1	T32	T32-F34 HydrophobicContact CG2-CB 3.85Å; T32-F34 HydrophobicContact CG2-CD2 3.95Å; T32-F34 HydrophobicContact CG2-CG 4.39Å; T32-F34 PolarHBondContact O-N 3.02Å
35	S	51.7	Low	49.8	Very low	50 Å²	50	116.8 Å²	116.8	35%	0.35	66%	0.661	S	S	.	*	S	Bend	trans	-98	137.1	176.6	-61.5	0	0	0	0	112.3	V28 R37	V28-S35 WeakPolarHBondContact CG1-OG 3.33Å; S35-R37 PolarHBondContact O-N 3.37Å
36	D	50.6	Low	50.3	Low	165 Å²	165	117.2 Å²	117.2	88%	0.882	66%	0.655	S	S	*	*			trans	-55.4	110	174.9	-68.5	-42	0	0	0	109.9
37	R	51.3	Low	50.4	Low	232 Å²	232	117.8 Å²	117.8	88%	0.875	66%	0.661	S	S	*	*			trans	-62.6	128.1	175.5	-134.4	-179.2	-162.9	179.5	6.1	107.8	S35 S39	S35-R37 PolarHBondContact O-N 3.37Å; R37-S39 PolarHBondContact O-N 2.9Å
38	P	49.2	Very low	50.6	Low	107 Å²	107	117.2 Å²	117.2	70%	0.695	66%	0.661	S	S	*	*			trans	-57	118.7	170.9	-17.6	28.6	0	0	0	107.9	T40	P38-T40 HydrophobicContact CB-CG2 4.32Å; P38-T40 PolarHBondContact O-N 3.13Å
39	S	54.8	Low	50.7	Low	129 Å²	129	120.2 Å²	120.2	90%	0.902	67%	0.673	S	S	*	*			trans	-75	54.7	175.7	65.7	0	0	0	0	110.1	R37	R37-S39 PolarHBondContact O-N 2.9Å
40	T	56.9	Low	50.5	Low	107 Å²	107	126.9 Å²	126.9	66%	0.656	70%	0.7	S	S	*	*			trans	-98.9	115	166.8	-179.6	0	0	0	0	107.6	P38 A42	P38-T40 HydrophobicContact CB-CG2 4.32Å; P38-T40 PolarHBondContact O-N 3.13Å; T40-A42 PolarHBondContact O-N 3.27Å
41	S	49.2	Very low	50.4	Low	69 Å²	69	125.4 Å²	125.4	48%	0.483	69%	0.69	S	S	.	*			trans	-61.5	123.7	175.8	174.7	0	0	0	0	108.9	F43 A44	S41-F43 PolarHBondContact O-N 3.08Å; S41-F43 WeakPolarHBondContact OG-CB 3.46Å; S41-F43 PolarHBondContact OG-N 3.22Å; S41-A44 WeakPolarHBondContact O-CB 3.37Å; S41-A44 PolarHBondContact O-N 2.78Å
42	A	56	Low	49.9	Very low	93 Å²	93	123.6 Å²	123.6	77%	0.769	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-13.4	170.7	0	0	0	0	0	112.9	T40	T40-A42 PolarHBondContact O-N 3.27Å
43	F	52.6	Low	49.7	Very low	161 Å²	161	129.1 Å²	129.1	71%	0.706	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-6	177.4	-59.4	-84.3	0	0	0	114	S41 N45 I46	S41-F43 PolarHBondContact O-N 3.08Å; S41-F43 WeakPolarHBondContact OG-CB 3.46Å; S41-F43 PolarHBondContact OG-N 3.22Å; F43-N45 VanDerWaalsContact C-N 3.29Å; F43-N45 PolarHBondContact O-N 3.27Å; F43-I46 HydrophobicContact CB-CD1 4.16Å; F43-I46 HydrophobicContact CD1-CD1 3.58Å; F43-I46 HydrophobicContact CE1-CD1 4.44Å; F43-I46 HydrophobicContact CG-CD1 4.3Å
44	A	55.9	Low	49.2	Very low	71 Å²	71	128.7 Å²	128.7	59%	0.587	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-16.2	-174.8	0	0	0	0	0	114.3	S41	S41-A44 WeakPolarHBondContact O-CB 3.37Å; S41-A44 PolarHBondContact O-N 2.78Å
45	N	51.3	Low	48.7	Very low	142 Å²	142	127.3 Å²	127.3	76%	0.759	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	18.4	-177.6	-76.6	-17.4	0	0	0	114.8	F43 G47	F43-N45 VanDerWaalsContact C-N 3.29Å; F43-N45 PolarHBondContact O-N 3.27Å; N45-G47 PolarHBondContact O-N 2.63Å
46	I	48.5	Very low	48.3	Very low	126 Å²	126	132.3 Å²	132.3	65%	0.646	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	46.1	177.7	-52.5	172.6	0	0	0	110.7	F43	F43-I46 HydrophobicContact CB-CD1 4.16Å; F43-I46 HydrophobicContact CD1-CD1 3.58Å; F43-I46 HydrophobicContact CE1-CD1 4.44Å; F43-I46 HydrophobicContact CG-CD1 4.3Å
47	G	47.4	Very low	48	Very low	71 Å²	71	133.4 Å²	133.4	73%	0.732	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.2	-7.7	179.2	0	0	0	0	0	114.8	N45	N45-G47 PolarHBondContact O-N 2.63Å
48	Q	48	Very low	47.7	Very low	191 Å²	191	130.7 Å²	130.7	89%	0.893	74%	0.738	S	S	*	*	S	Bend	trans	-141.6	15.7	-171.1	-63.6	-169.9	1.6	0	0	115.1
49	I	46.8	Very low	47.3	Very low	144 Å²	144	132.8 Å²	132.8	74%	0.738	74%	0.744	S	S	*	*			trans	-121.2	105.1	176.9	-54.7	176.3	0	0	0	108.6	P51	I49-P51 VanDerWaalsContact O-CD 3.26Å; I49-P51 WeakPolarHBondContact O-CD 3.44Å
50	E	38.7	Very low	47.3	Very low	182 Å²	182	134.5 Å²	134.5	85%	0.85	74%	0.738	S	S	*	*			trans	-66	112.9	175.9	-155.1	-178.3	-161.7	0	0	109.4
51	P	47.3	Very low	47.6	Very low	80 Å²	80	139.8 Å²	139.8	52%	0.519	75%	0.745	S	S	.	*			trans	-92.9	109.4	-179.7	14	4.3	0	0	0	109.4	I49 Y53	I49-P51 VanDerWaalsContact O-CD 3.26Å; I49-P51 WeakPolarHBondContact O-CD 3.44Å; P51-Y53 HydrophobicContact CB-CD2 4.08Å; P51-Y53 HydrophobicContact CB-CE2 3.52Å; P51-Y53 HydrophobicContact CG-CE2 3.74Å; P51-Y53 WeakPolarHBondContact O-CD2 3.24Å; P51-Y53 PolarHBondContact O-N 3.22Å
52	T	36.2	Very low	47.7	Very low	138 Å²	138	142 Å²	142	85%	0.847	76%	0.759	S	S	*	*			trans	-73.3	103.1	166.6	-62.1	0	0	0	0	108.3
53	Y	44	Very low	48.4	Very low	181 Å²	181	145.8 Å²	145.8	71%	0.71	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-91.8	132.8	173.4	-67.7	-80.7	0	0	0	110.7	P51	P51-Y53 HydrophobicContact CB-CD2 4.08Å; P51-Y53 HydrophobicContact CB-CE2 3.52Å; P51-Y53 HydrophobicContact CG-CE2 3.74Å; P51-Y53 WeakPolarHBondContact O-CD2 3.24Å; P51-Y53 PolarHBondContact O-N 3.22Å
54	P	45.9	Very low	49.3	Very low	105 Å²	105	142.1 Å²	142.1	68%	0.682	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-73.3	160.5	159.4	31.8	-30.3	0	0	0	110.3	I56	P54-I56 PolarHBondContact O-N 2.89Å
55	P	40.3	Very low	49.9	Very low	130 Å²	130	145.1 Å²	145.1	84%	0.844	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-71	130.3	-166.1	6.1	6.3	0	0	0	111.7	E57	P55-E57 PolarHBondContact O-N 3.34Å
56	I	44	Very low	50.6	Low	154 Å²	154	138.8 Å²	138.8	79%	0.79	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-78.3	117	174.8	-62.4	171.2	0	0	0	108.4	P54	P54-I56 PolarHBondContact O-N 2.89Å
57	E	44.5	Very low	51.7	Low	189 Å²	189	138 Å²	138	88%	0.883	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-61.5	139.4	169.3	-104.4	-175.2	160.5	0	0	111.3	P55	P55-E57 PolarHBondContact O-N 3.34Å
58	Q	43.9	Very low	52.7	Low	174 Å²	174	139.2 Å²	139.2	81%	0.813	70%	0.704	S	S	*	*	S	Bend	trans	-67.4	142.1	-170	-68	169.9	-24.3	0	0	113
59	N	41	Very low	53.6	Low	151 Å²	151	135.3 Å²	135.3	81%	0.807	69%	0.689	S	S	*	*			trans	71.6	67.7	153.9	-60.1	-38.5	0	0	0	118.5
60	Q	55.1	Low	54.4	Low	166 Å²	166	132 Å²	132	78%	0.776	69%	0.691	S	S	*	*			trans	-136.4	125.4	145.5	-65.7	-168.3	26	0	0	110.3
61	R	62.3	Low	55.5	Low	217 Å²	217	127.9 Å²	127.9	82%	0.819	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-51.3	135.5	176.8	-177.2	179.7	-179.8	174.2	-1.7	109.4	R63	R61-R63 PolarHBondContact O-N 3.28Å; R61-R63 VanDerWaalsContact O-N 3.08Å
62	P	52.3	Low	56.1	Low	117 Å²	117	130.4 Å²	130.4	76%	0.76	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-58.9	119.2	177.9	23	-31.7	0	0	0	108.9
63	R	69.6	Low	57.1	Low	171 Å²	171	130.9 Å²	130.9	65%	0.645	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-72	133.3	176.1	-68.3	-173.9	-174.1	177.8	3.4	109	R61 E67	R61-R63 PolarHBondContact O-N 3.28Å; R61-R63 VanDerWaalsContact O-N 3.08Å; R63-E67 WeakPolarHBondContact CA-OE2 3.33Å; R63-E67 HydrophobicContact CB-CB 4.03Å; R63-E67 HydrophobicContact CG-CB 4.47Å
64	T	73	Confident	57.7	Low	84 Å²	84	129.6 Å²	129.6	52%	0.515	68%	0.68	S	S	.	*	P	Polyproline II helix	trans	-64.7	157.3	170.3	62.3	0	0	0	0	110	G66 E67 T68	T64-G66 PolarHBondContact O-N 3.16Å; T64-E67 PolarHBondContact N-OE2 3.1Å; T64-E67 WeakPolarHBondContact O-CB 3.27Å; T64-E67 PolarHBondContact O-N 2.97Å; T64-E67 WeakPolarHBondContact OG1-CG 3.33Å; T64-E67 PolarHBondContact OG1-N 3.16Å; T64-E67 PolarHBondContact OG1-OE2 3.12Å; T64-T68 PolarHBondContact O-N 3.07Å; T64-T68 PolarHBondContact O-OG1 3.44Å; T64-T68 VanDerWaalsContact O-OG1 3.13Å
65	L	67	Low	57.8	Low	135 Å²	135	132.5 Å²	132.5	71%	0.707	69%	0.688	S	S	*	*	H	α-helix	trans	-55.8	-35.8	176.8	-172.4	69.2	0	0	0	111.4	T68 L69	L65-T68 PolarHBondContact O-N 3.44Å; L65-L69 HydrophobicContact CD1-CD1 4.22Å; L65-L69 HydrophobicContact CG-CD1 3.97Å; L65-L69 WeakPolarHBondContact O-CB 3.47Å; L65-L69 WeakPolarHBondContact O-CG 3.47Å; L65-L69 PolarHBondContact O-N 3.29Å
66	G	67.8	Low	57.9	Low	9 Å²	9	130.7 Å²	130.7	9%	0.093	68%	0.678	C	S	.	*	H	α-helix	trans	-61.2	-44.7	172.8	0	0	0	0	0	113.2	T64 T68 L69 G70 I71	T64-G66 PolarHBondContact O-N 3.16Å; G66-T68 VanDerWaalsContact C-N 3.27Å; G66-T68 PolarHBondContact O-N 2.89Å; G66-L69 CarbonylContact O-C 3.57Å; G66-L69 PolarHBondContact O-N 3.41Å; G66-G70 PolarHBondContact O-N 3.48Å; G66-I71 CarbonylContact C-O 3.56Å; G66-I71 WeakPolarHBondContact CA-O 3.38Å; G66-I71 PolarHBondContact O-N 2.9Å
67	E	70.3	Confident	57.6	Low	109 Å²	109	129.2 Å²	129.2	51%	0.509	68%	0.681	S	S	.	*	H	α-helix	trans	-67.2	-26.6	175.8	-72.7	167.9	152.1	0	0	113	R63 T64	R63-E67 WeakPolarHBondContact CA-OE2 3.33Å; R63-E67 HydrophobicContact CB-CB 4.03Å; R63-E67 HydrophobicContact CG-CB 4.47Å; T64-E67 PolarHBondContact N-OE2 3.1Å; T64-E67 WeakPolarHBondContact O-CB 3.27Å; T64-E67 PolarHBondContact O-N 2.97Å; T64-E67 WeakPolarHBondContact OG1-CG 3.33Å; T64-E67 PolarHBondContact OG1-N 3.16Å; T64-E67 PolarHBondContact OG1-OE2 3.12Å
68	T	68.1	Low	57.5	Low	96 Å²	96	124.2 Å²	124.2	59%	0.589	67%	0.667	S	S	*	*	H	α-helix	trans	-77.1	-33.1	175.9	-51.6	0	0	0	0	111.7	T64 L65 G66	T64-T68 PolarHBondContact O-N 3.07Å; T64-T68 PolarHBondContact O-OG1 3.44Å; T64-T68 VanDerWaalsContact O-OG1 3.13Å; L65-T68 PolarHBondContact O-N 3.44Å; G66-T68 VanDerWaalsContact C-N 3.27Å; G66-T68 PolarHBondContact O-N 2.89Å
69	L	66.8	Low	57.2	Low	110 Å²	110	121.6 Å²	121.6	58%	0.576	67%	0.666	S	S	*	*	H	α-helix	trans	-97.6	-0.1	-178.6	-68	171.9	0	0	0	113.7	L65 G66 I71	L65-L69 HydrophobicContact CD1-CD1 4.22Å; L65-L69 HydrophobicContact CG-CD1 3.97Å; L65-L69 WeakPolarHBondContact O-CB 3.47Å; L65-L69 WeakPolarHBondContact O-CG 3.47Å; L65-L69 PolarHBondContact O-N 3.29Å; G66-L69 CarbonylContact O-C 3.57Å; G66-L69 PolarHBondContact O-N 3.41Å; L69-I71 HydrophobicContact CB-CD1 3.64Å; L69-I71 HydrophobicContact CB-CG1 3.41Å; L69-I71 VanDerWaalsContact CB-CG1 3.41Å; L69-I71 HydrophobicContact CD1-CD1 3.87Å; L69-I71 HydrophobicContact CG-CD1 4.42Å; L69-I71 PolarHBondContact O-N 2.89Å
70	G	64.2	Low	56.9	Low	75 Å²	75	123.5 Å²	123.5	77%	0.773	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.6	21.1	-177.7	0	0	0	0	0	114.2	G66	G66-G70 PolarHBondContact O-N 3.48Å
71	I	62.1	Low	56.2	Low	95 Å²	95	124 Å²	124	49%	0.487	67%	0.669	S	S	.	*			trans	-101.4	116.5	179.9	0.5	172.8	0	0	0	108.8	G66 L69	G66-I71 CarbonylContact C-O 3.56Å; G66-I71 WeakPolarHBondContact CA-O 3.38Å; G66-I71 PolarHBondContact O-N 2.9Å; L69-I71 HydrophobicContact CB-CD1 3.64Å; L69-I71 HydrophobicContact CB-CG1 3.41Å; L69-I71 VanDerWaalsContact CB-CG1 3.41Å; L69-I71 HydrophobicContact CD1-CD1 3.87Å; L69-I71 HydrophobicContact CG-CD1 4.42Å; L69-I71 PolarHBondContact O-N 2.89Å
72	N	58.8	Low	54.8	Low	132 Å²	132	123.1 Å²	123.1	71%	0.706	67%	0.674	S	S	*	*			trans	-85	111.8	172.6	-154.6	9.8	0	0	0	108.4	E74	N72-E74 VanDerWaalsContact C-N 3.3Å
73	L	57.9	Low	54.3	Low	149 Å²	149	124.2 Å²	124.2	78%	0.78	67%	0.673	S	S	*	*			trans	-89.3	4.7	179.5	-71.7	170.1	0	0	0	112.8	I75	L73-I75 PolarHBondContact O-N 3.19Å
74	E	57.3	Low	52.7	Low	153 Å²	153	126 Å²	126	72%	0.715	69%	0.689	S	S	*	*	S	Bend	trans	-71.6	123.4	173.5	-66.7	-166.6	166.6	0	0	110.1	N72 S76	N72-E74 VanDerWaalsContact C-N 3.3Å; E74-S76 PolarHBondContact O-N 3.38Å
75	I	46.9	Very low	51	Low	167 Å²	167	126 Å²	126	86%	0.856	70%	0.698	S	S	*	*			trans	-62.2	90	166	-84.9	154.2	0	0	0	107.2	L73 S77	L73-I75 PolarHBondContact O-N 3.19Å; I75-S77 PolarHBondContact O-N 2.96Å; I75-S77 VanDerWaalsContact O-N 3.07Å
76	S	42.4	Very low	49.5	Very low	92 Å²	92	128.5 Å²	128.5	64%	0.643	71%	0.711	S	S	*	*			trans	-72.5	101.8	175.3	62.5	0	0	0	0	108.3	E74 S78	E74-S76 PolarHBondContact O-N 3.38Å; S76-S78 PolarHBondContact O-N 2.92Å
77	S	38.7	Very low	48	Very low	122 Å²	122	132.7 Å²	132.7	85%	0.853	74%	0.738	S	S	*	*			trans	-67.2	82.9	160.3	43.1	0	0	0	0	109	I75	I75-S77 PolarHBondContact O-N 2.96Å; I75-S77 VanDerWaalsContact O-N 3.07Å
78	S	42.1	Very low	46.7	Very low	84 Å²	84	131.9 Å²	131.9	59%	0.587	75%	0.745	S	S	*	*			trans	-136.5	128.6	168.5	67.6	0	0	0	0	111.1	S76 F80	S76-S78 PolarHBondContact O-N 2.92Å; S78-F80 PolarHBondContact O-N 3.31Å
79	P	37.6	Very low	45.5	Very low	120 Å²	120	133 Å²	133	78%	0.779	75%	0.752	S	S	*	*			trans	-92.3	92.7	-174.8	33.8	-29.6	0	0	0	110
80	F	33.9	Very low	44.9	Very low	191 Å²	191	135.1 Å²	135.1	84%	0.838	76%	0.756	S	S	*	*			trans	-148.2	92.5	167.6	-97.8	-83.4	0	0	0	110.8	S78	S78-F80 PolarHBondContact O-N 3.31Å
81	H	41.6	Very low	44.6	Very low	177 Å²	177	135.1 Å²	135.1	82%	0.819	74%	0.743	S	S	*	*			trans	-172.3	102.2	131.9	-99	-64.5	0	0	0	108.4	N83	H81-N83 PolarHBondContact O-N 3Å
82	Q	33.5	Very low	44.5	Very low	197 Å²	197	139.1 Å²	139.1	92%	0.921	76%	0.757	S	S	*	*			trans	-61	100.5	159	-85.6	174.6	-38.6	0	0	107.7
83	N	40.6	Very low	44.6	Very low	140 Å²	140	140.5 Å²	140.5	75%	0.749	77%	0.765	S	S	*	*			trans	-134.4	125.7	155.6	-91.2	-33.2	0	0	0	107.7	H81 A85	H81-N83 PolarHBondContact O-N 3Å; N83-A85 PolarHBondContact O-N 3.2Å
84	Q	36.1	Very low	44.9	Very low	210 Å²	210	140.1 Å²	140.1	98%	0.981	76%	0.759	S	S	*	*			trans	-61.7	98	-175.3	-68.9	169.9	7.6	0	0	110.3
85	A	36.6	Very low	45.5	Very low	84 Å²	84	139.1 Å²	139.1	69%	0.694	75%	0.752	S	S	*	*			trans	-126.6	125	155.7	0	0	0	0	0	106.1	N83 S87	N83-A85 PolarHBondContact O-N 3.2Å; A85-S87 VanDerWaalsContact C-N 3.34Å; A85-S87 PolarHBondContact O-N 3.03Å
86	L	36.7	Very low	46.7	Very low	187 Å²	187	139 Å²	139	98%	0.979	75%	0.746	S	S	*	*			trans	-52.7	94.5	176.7	-76.7	145.4	0	0	0	109.8	S88	L86-S88 PolarHBondContact O-N 2.99Å
87	S	35.8	Very low	48.1	Very low	96 Å²	96	142.2 Å²	142.2	67%	0.671	75%	0.748	S	S	*	*			trans	-85.1	98	174.6	59.7	0	0	0	0	108.4	A85 T89	A85-S87 VanDerWaalsContact C-N 3.34Å; A85-S87 PolarHBondContact O-N 3.03Å; S87-T89 PolarHBondContact O-N 2.85Å
88	S	42.5	Very low	49.7	Very low	92 Å²	92	140.6 Å²	140.6	64%	0.643	74%	0.735	S	S	*	*			trans	-67.6	87.3	155.2	56.8	0	0	0	0	107.4	L86 F90	L86-S88 PolarHBondContact O-N 2.99Å; S88-F90 PolarHBondContact O-N 3.21Å
89	T	43.4	Very low	50.9	Low	119 Å²	119	139.9 Å²	139.9	73%	0.73	73%	0.727	S	S	*	*			trans	-73.1	84.1	172.2	-53	0	0	0	0	107.6	S87 P91	S87-T89 PolarHBondContact O-N 2.85Å; T89-P91 WeakPolarHBondContact O-CD 3.26Å
90	F	54.8	Low	52.4	Low	155 Å²	155	141 Å²	141	68%	0.68	73%	0.727	S	S	*	*			trans	-72.2	121.3	165.8	-75.3	-78	0	0	0	107.8	S88 F92	S88-F90 PolarHBondContact O-N 3.21Å; F90-F92 PolarHBondContact O-N 3.26Å
91	P	56.8	Low	53.9	Low	75 Å²	75	134.9 Å²	134.9	49%	0.487	70%	0.704	S	S	.	*			trans	-62.2	132.2	174.2	25.1	-29.8	0	0	0	108.6	T89 N93 E94	T89-P91 WeakPolarHBondContact O-CD 3.26Å; P91-N93 PolarHBondContact O-N 2.99Å; P91-E94 PolarHBondContact O-N 3.27Å
92	F	61	Low	54.7	Low	179 Å²	179	133.9 Å²	133.9	79%	0.785	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-54.2	-16.4	178	-169.3	-100.6	0	0	0	113.3	F90 E94 F95	F90-F92 PolarHBondContact O-N 3.26Å; F92-E94 PolarHBondContact O-N 3.39Å; F92-F95 PolarHBondContact O-N 3.08Å
93	N	61.5	Low	56.4	Low	162 Å²	162	128.6 Å²	128.6	87%	0.866	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-69.3	-9.7	174.3	-68.1	-5.4	0	0	0	114.5	P91	P91-N93 PolarHBondContact O-N 2.99Å
94	E	63.8	Low	57.5	Low	140 Å²	140	128.2 Å²	128.2	65%	0.654	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-105	11.2	174.2	-158.7	170.6	-171.2	0	0	112.6	P91 F92 K96	P91-E94 PolarHBondContact O-N 3.27Å; F92-E94 PolarHBondContact O-N 3.39Å; E94-K96 PolarHBondContact O-N 2.91Å
95	F	68.6	Low	59	Low	132 Å²	132	123 Å²	123	58%	0.579	67%	0.671	S	S	*	*			trans	-72.5	95.6	171	-170.9	-94.8	0	0	0	109.9	F92 F97	F92-F95 PolarHBondContact O-N 3.08Å; F95-F97 HydrophobicContact CE1-CD1 4.16Å; F95-F97 HydrophobicContact CE1-CD2 4.18Å; F95-F97 AromaticContact CE1-CE1 3.97Å; F95-F97 HydrophobicContact CE1-CE1 3.97Å; F95-F97 AromaticContact CE1-CE2 3.99Å; F95-F97 HydrophobicContact CE1-CE2 3.99Å; F95-F97 HydrophobicContact CE1-CG 4.27Å; F95-F97 AromaticContact CE1-CZ 3.89Å; F95-F97 HydrophobicContact CE1-CZ 3.89Å; F95-F97 HydrophobicContact CZ-CE1 4.38Å
96	K	73.5	Confident	60.3	Low	166 Å²	166	124.2 Å²	124.2	72%	0.722	67%	0.666	S	S	*	*			trans	-104.2	122.2	168.7	-166.3	-177.1	177.4	-159.1	0	108	E94 V99	E94-K96 PolarHBondContact O-N 2.91Å; K96-V99 HydrophobicContact CD-CG2 4.5Å
97	F	70.6	Confident	61.3	Low	158 Å²	158	119.5 Å²	119.5	69%	0.693	64%	0.641	S	S	*	*			trans	-51.3	136.8	172.6	-77.8	-83.3	0	0	0	109.7	F95 V99	F95-F97 HydrophobicContact CE1-CD1 4.16Å; F95-F97 HydrophobicContact CE1-CD2 4.18Å; F95-F97 AromaticContact CE1-CE1 3.97Å; F95-F97 HydrophobicContact CE1-CE1 3.97Å; F95-F97 AromaticContact CE1-CE2 3.99Å; F95-F97 HydrophobicContact CE1-CE2 3.99Å; F95-F97 HydrophobicContact CE1-CG 4.27Å; F95-F97 AromaticContact CE1-CZ 3.89Å; F95-F97 HydrophobicContact CE1-CZ 3.89Å; F95-F97 HydrophobicContact CZ-CE1 4.38Å; F97-V99 PolarHBondContact O-N 3.37Å
98	P	72.2	Confident	62.2	Low	88 Å²	88	117.2 Å²	117.2	57%	0.571	63%	0.625	S	S	*	*			trans	-52.8	113.7	175.6	-25.9	34.1	0	0	0	110.4	D100	P98-D100 PolarHBondContact O-N 2.99Å
99	V	69	Low	62.6	Low	69 Å²	69	119.4 Å²	119.4	42%	0.418	63%	0.63	S	S	.	*	G	3₁₀ helix	trans	-71.8	-19.6	-178.4	-138.6	0	0	0	0	111.2	K96 F97 T101 E102	K96-V99 HydrophobicContact CD-CG2 4.5Å; F97-V99 PolarHBondContact O-N 3.37Å; V99-T101 PolarHBondContact O-N 3.1Å; V99-E102 HydrophobicContact CG1-CB 4.44Å; V99-E102 WeakPolarHBondContact CG1-OE2 3.5Å; V99-E102 WeakPolarHBondContact O-CB 3.24Å; V99-E102 PolarHBondContact O-N 3.4Å
100	D	67.1	Low	63	Low	145 Å²	145	119.2 Å²	119.2	78%	0.775	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-65.5	-11.8	-178.8	-56.3	-34.6	0	0	0	113	P98	P98-D100 PolarHBondContact O-N 2.99Å
101	T	65.7	Low	62.6	Low	61 Å²	61	118.5 Å²	118.5	37%	0.374	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-112.2	-0.2	179.1	-36.1	0	0	0	0	112.4	V99 G103 Q104 L106	V99-T101 PolarHBondContact O-N 3.1Å; T101-G103 PolarHBondContact O-N 2.87Å; T101-Q104 PolarHBondContact O-N 2.84Å; T101-L106 HydrophobicContact CG2-CD1 3.41Å; T101-L106 VanDerWaalsContact CG2-CD1 3.41Å; T101-L106 HydrophobicContact CG2-CD2 3.83Å; T101-L106 HydrophobicContact CG2-CG 3.66Å
102	E	59.9	Low	61.9	Low	157 Å²	157	119.3 Å²	119.3	73%	0.734	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	116	-179.6	-167.2	175.5	-175.9	0	0	110.1	V99 Q104	V99-E102 HydrophobicContact CG1-CB 4.44Å; V99-E102 WeakPolarHBondContact CG1-OE2 3.5Å; V99-E102 WeakPolarHBondContact O-CB 3.24Å; V99-E102 PolarHBondContact O-N 3.4Å; E102-Q104 VanDerWaalsContact C-N 3.35Å; E102-Q104 PolarHBondContact O-N 3.37Å
103	G	68.3	Low	61.1	Low	86 Å²	86	115.4 Å²	115.4	89%	0.887	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	81.5	1.9	179	0	0	0	0	0	116	T101	T101-G103 PolarHBondContact O-N 2.87Å
104	Q	64.8	Low	60	Low	131 Å²	131	116 Å²	116	61%	0.612	62%	0.62	S	S	*	*			trans	-85.2	122.4	168.3	-86.9	-175.2	-11.5	0	0	110.5	T101 E102 L106	T101-Q104 PolarHBondContact O-N 2.84Å; E102-Q104 VanDerWaalsContact C-N 3.35Å; E102-Q104 PolarHBondContact O-N 3.37Å; Q104-L106 VanDerWaalsContact C-N 3.32Å; Q104-L106 PolarHBondContact O-N 2.97Å
105	D	65.8	Low	58.7	Low	102 Å²	102	112.7 Å²	112.7	55%	0.545	62%	0.624	S	S	.	*			trans	-70.6	90.9	167.1	-176.1	7.1	0	0	0	109.5	N107 S108	D105-N107 PolarHBondContact O-N 2.79Å; D105-N107 WeakPolarHBondContact OD1-CA 3.34Å; D105-N107 VanDerWaalsContact OD1-CB 3.27Å; D105-N107 WeakPolarHBondContact OD1-CB 3.47Å; D105-N107 PolarHBondContact OD1-N 3.07Å; D105-S108 VanDerWaalsContact O-CB 3.25Å; D105-S108 WeakPolarHBondContact O-CB 3.48Å; D105-S108 PolarHBondContact O-N 3.39Å; D105-S108 PolarHBondContact O-OG 2.96Å; D105-S108 PolarHBondContact OD1-N 3.41Å
106	L	64.7	Low	57.2	Low	109 Å²	109	116.7 Å²	116.7	57%	0.571	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-16.7	174.5	-68.5	-175	0	0	0	112.9	T101 Q104 S108	T101-L106 HydrophobicContact CG2-CD1 3.41Å; T101-L106 VanDerWaalsContact CG2-CD1 3.41Å; T101-L106 HydrophobicContact CG2-CD2 3.83Å; T101-L106 HydrophobicContact CG2-CG 3.66Å; Q104-L106 VanDerWaalsContact C-N 3.32Å; Q104-L106 PolarHBondContact O-N 2.97Å; L106-S108 VanDerWaalsContact C-N 3.31Å
107	N	58.1	Low	55.7	Low	87 Å²	87	117.7 Å²	117.7	47%	0.465	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.3	-9.2	175.5	-60.8	-30.7	0	0	0	112.3	D105 N109 I110 F111	D105-N107 PolarHBondContact O-N 2.79Å; D105-N107 WeakPolarHBondContact OD1-CA 3.34Å; D105-N107 VanDerWaalsContact OD1-CB 3.27Å; D105-N107 WeakPolarHBondContact OD1-CB 3.47Å; D105-N107 PolarHBondContact OD1-N 3.07Å; N107-N109 PolarHBondContact O-N 2.86Å; N107-I110 PolarHBondContact O-N 2.8Å; N107-F111 HydrophobicContact CB-CD2 4.16Å; N107-F111 HydrophobicContact CB-CE2 4.29Å; N107-F111 WeakPolarHBondContact O-CD2 3.22Å; N107-F111 PolarHBondContact O-N 3.06Å
108	S	54	Low	54.4	Low	48 Å²	48	118.6 Å²	118.6	34%	0.336	65%	0.646	S	S	.	*	H	α-helix	trans	-56.1	-38.8	177.2	59.2	0	0	0	0	111.7	D105 L106 S112	D105-S108 VanDerWaalsContact O-CB 3.25Å; D105-S108 WeakPolarHBondContact O-CB 3.48Å; D105-S108 PolarHBondContact O-N 3.39Å; D105-S108 PolarHBondContact O-OG 2.96Å; D105-S108 PolarHBondContact OD1-N 3.41Å; L106-S108 VanDerWaalsContact C-N 3.31Å; S108-S112 WeakPolarHBondContact O-CB 3.47Å; S108-S112 PolarHBondContact O-N 2.96Å; S108-S112 PolarHBondContact O-OG 2.94Å
109	N	50.6	Low	53	Low	139 Å²	139	118.7 Å²	118.7	74%	0.743	65%	0.647	S	S	*	*	H	α-helix	trans	-78.4	-16.5	176.1	-71	-31.8	0	0	0	114.4	N107	N107-N109 PolarHBondContact O-N 2.86Å
110	I	51.5	Low	51.9	Low	115 Å²	115	121.1 Å²	121.1	59%	0.59	66%	0.658	S	S	*	*	H	α-helix	trans	-82.2	-32.7	177.3	-59.9	177.6	0	0	0	110.3	N107	N107-I110 PolarHBondContact O-N 2.8Å
111	F	46.5	Very low	50.7	Low	140 Å²	140	120.1 Å²	120.1	61%	0.614	65%	0.652	S	S	*	*	H	α-helix	trans	-95.5	-20.3	176.5	-72.2	-81.9	0	0	0	114	N107 S113	N107-F111 HydrophobicContact CB-CD2 4.16Å; N107-F111 HydrophobicContact CB-CE2 4.29Å; N107-F111 WeakPolarHBondContact O-CD2 3.22Å; N107-F111 PolarHBondContact O-N 3.06Å; F111-S113 VanDerWaalsContact C-N 3.3Å; F111-S113 PolarHBondContact O-N 3.36Å
112	S	42.1	Very low	49.9	Very low	92 Å²	92	123.2 Å²	123.2	64%	0.643	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	8.2	-176.4	-59.7	0	0	0	0	115.6	S108 E114	S108-S112 WeakPolarHBondContact O-CB 3.47Å; S108-S112 PolarHBondContact O-N 2.96Å; S108-S112 PolarHBondContact O-OG 2.94Å; S112-E114 VanDerWaalsContact C-N 3.34Å
113	S	45.3	Very low	49.9	Very low	97 Å²	97	119.3 Å²	119.3	68%	0.678	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-0.8	169.6	58	0	0	0	0	114.1	F111 G115	F111-S113 VanDerWaalsContact C-N 3.3Å; F111-S113 PolarHBondContact O-N 3.36Å; S113-G115 VanDerWaalsContact C-N 3.34Å; S113-G115 PolarHBondContact O-N 2.9Å
114	E	38.7	Very low	50.3	Low	173 Å²	173	121.8 Å²	121.8	81%	0.808	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	81.3	172	-65	-169.2	177.4	0	0	110.7	S112	S112-E114 VanDerWaalsContact C-N 3.34Å
115	G	35.4	Very low	51.3	Low	72 Å²	72	118.2 Å²	118.2	74%	0.742	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	176.4	11.2	178.5	0	0	0	0	0	118	S113 E117	S113-G115 VanDerWaalsContact C-N 3.34Å; S113-G115 PolarHBondContact O-N 2.9Å; G115-E117 PolarHBondContact O-N 3.36Å
116	R	38.3	Very low	52.5	Low	216 Å²	216	116.4 Å²	116.4	82%	0.815	62%	0.624	S	S	*	*			trans	-92.2	96.8	161.4	-66.4	-164.6	-161	-176.9	7.5	107.7	F118	R116-F118 PolarHBondContact O-N 3.06Å
117	E	40.4	Very low	53.8	Low	186 Å²	186	114.5 Å²	114.5	87%	0.869	61%	0.611	S	S	*	*			trans	-54.4	97.4	157.3	-65.6	-178.4	166.9	0	0	106.5	G115 P119	G115-E117 PolarHBondContact O-N 3.36Å; E117-P119 VanDerWaalsContact O-CD 3.27Å; E117-P119 WeakPolarHBondContact O-CD 3.07Å
118	F	43.9	Very low	55.6	Low	177 Å²	177	110.6 Å²	110.6	78%	0.776	59%	0.59	S	S	*	*			trans	-65	115.6	161.4	-75.4	-84.6	0	0	0	104.6	R116 D120	R116-F118 PolarHBondContact O-N 3.06Å; F118-D120 PolarHBondContact O-N 3.18Å
119	P	43.5	Very low	57.5	Low	90 Å²	90	108.4 Å²	108.4	58%	0.584	58%	0.575	S	S	*	*			trans	-56.5	135.7	176.3	24.2	-31.1	0	0	0	107.5	E117 D121	E117-P119 VanDerWaalsContact O-CD 3.27Å; E117-P119 WeakPolarHBondContact O-CD 3.07Å; P119-D121 HydrophobicContact CB-CB 4.42Å; P119-D121 PolarHBondContact O-N 2.92Å
120	D	45.1	Very low	59.5	Low	121 Å²	121	102.6 Å²	102.6	65%	0.647	54%	0.543	S	S	*	.			trans	-65	44.6	171.8	-102.4	-24.3	0	0	0	110.6	F118 C122 K222	F118-D120 PolarHBondContact O-N 3.18Å; D120-C122 PolarHBondContact O-N 3.34Å; D120-K222 IonicContact OD2-NZ 2.58Å; D120-K222 PolarHBondContact OD2-NZ 2.98Å
121	D	42.7	Very low	61.5	Low	123 Å²	123	103.2 Å²	103.2	66%	0.658	54%	0.538	S	S	*	.			trans	-81.7	90.7	-176.6	-79.2	-17.7	0	0	0	108.8	P119 V123	P119-D121 HydrophobicContact CB-CB 4.42Å; P119-D121 PolarHBondContact O-N 2.92Å; D121-V123 PolarHBondContact O-N 3.32Å
122	C	49	Very low	63.4	Low	127 Å²	127	102.3 Å²	102.3	86%	0.858	53%	0.53	S	S	*	.			trans	31	63.8	151.8	-160.7	0	0	0	0	115.3	D120 D124	D120-C122 PolarHBondContact O-N 3.34Å; C122-D124 PolarHBondContact O-N 2.8Å
123	V	58.3	Low	65.1	Low	75 Å²	75	101.8 Å²	101.8	46%	0.455	53%	0.525	S	S	.	.			trans	-68.9	120.9	163.9	-178.8	0	0	0	0	106.6	D121 R125	D121-V123 PolarHBondContact O-N 3.32Å; V123-R125 VanDerWaalsContact O-CG 3.3Å; V123-R125 WeakPolarHBondContact O-CG 3.37Å; V123-R125 PolarHBondContact O-N 2.95Å
124	D	77.6	Confident	66.1	Low	138 Å²	138	99.8 Å²	99.8	74%	0.738	51%	0.511	S	S	*	.			trans	-60.4	108.6	171.4	-175.5	5.6	0	0	0	108.3	C122 E126	C122-D124 PolarHBondContact O-N 2.8Å; D124-E126 PolarHBondContact O-N 3.44Å; D124-E126 PolarHBondContact OD1-N 2.95Å
125	R	86.6	Confident	67.1	Low	55 Å²	55	98.3 Å²	98.3	21%	0.208	51%	0.509	C	S	.	.			trans	-76.1	-0.5	-171.9	-55.9	-179.5	-166.8	-125.4	19.6	112.6	V123 F127 A209 C210 A219 F223	V123-R125 VanDerWaalsContact O-CG 3.3Å; V123-R125 WeakPolarHBondContact O-CG 3.37Å; V123-R125 PolarHBondContact O-N 2.95Å; R125-F127 PolarHBondContact O-N 2.73Å; R125-A209 HydrophobicContact CB-CB 4.4Å; R125-C210 PolarHBondContact O-N 2.79Å; R125-A219 PolarHBondContact NH1-O 2.88Å; R125-F223 HydrophobicContact CB-CE2 4.27Å; R125-F223 VanDerWaalsContact CD-CE2 3.42Å; R125-F223 HydrophobicContact CG-CD2 4.48Å; R125-F223 HydrophobicContact CG-CE2 4.49Å; R125-F223 VanDerWaalsContact NH1-CB 3.32Å
126	E	89.5	Confident	68.1	Low	65 Å²	65	101 Å²	101	30%	0.304	51%	0.51	S	S	.	.			trans	41.5	48	179.6	-161.1	-174.7	165.6	0	0	111.7	D124 R194 I295	D124-E126 PolarHBondContact O-N 3.44Å; D124-E126 PolarHBondContact OD1-N 2.95Å; E126-R194 IonicContact OE2-CZ 3.91Å; E126-R194 IonicContact OE2-NH1 3.27Å; E126-R194 PolarHBondContact OE2-NH1 2.97Å; E126-I295 HydrophobicContact CG-CD1 4.32Å
127	F	93.3	Very high	68.7	Low	69 Å²	69	95.6 Å²	95.6	30%	0.303	51%	0.506	S	S	.	.			trans	-82.8	146.2	-170.4	79.1	-90.5	0	0	0	112.1	R125 I207 Q208 A209 F223 L227 V280	R125-F127 PolarHBondContact O-N 2.73Å; F127-I207 HydrophobicContact CD2-CG2 4.4Å; F127-Q208 CarbonylContact C-O 3.43Å; F127-Q208 WeakPolarHBondContact CA-O 3.41Å; F127-Q208 WeakPolarHBondContact CB-O 3.4Å; F127-A209 HydrophobicContact CB-CB 3.78Å; F127-F223 HydrophobicContact CB-CE2 4.24Å; F127-F223 HydrophobicContact CB-CZ 3.68Å; F127-F223 HydrophobicContact CD1-CE2 4.16Å; F127-F223 HydrophobicContact CD1-CZ 4.3Å; F127-F223 HydrophobicContact CD2-CZ 4.41Å; F127-F223 HydrophobicContact CG-CE2 4.23Å; F127-F223 AromaticContact CG-CZ 3.9Å; F127-F223 HydrophobicContact CG-CZ 3.9Å; F127-L227 HydrophobicContact CE2-CD2 4.25Å; F127-L227 HydrophobicContact CZ-CD2 4.04Å; F127-V280 HydrophobicContact CE2-CG1 4.36Å
128	V	94.1	Very high	69.1	Low	5 Å²	5	89.2 Å²	89.2	3%	0.03	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	145.9	176	-63.6	0	0	0	0	109.5	Q208 N288 K291 A292 I295	V128-Q208 HydrophobicContact CG2-CB 3.84Å; V128-Q208 HydrophobicContact CG2-CG 4.45Å; V128-Q208 PolarHBondContact N-O 3.29Å; V128-Q208 PolarHBondContact O-N 2.86Å; V128-N288 HydrophobicContact CB-CB 4.43Å; V128-K291 HydrophobicContact CG1-CD 3.74Å; V128-K291 HydrophobicContact CG1-CG 4.11Å; V128-A292 HydrophobicContact CG2-CB 3.67Å; V128-I295 HydrophobicContact CG1-CD1 4.19Å; V128-I295 HydrophobicContact CG2-CD1 4.44Å
129	I	94.8	Very high	69.3	Low	1 Å²	1	91.1 Å²	91.1	1%	0.005	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.7	-180	-178.3	172.2	0	0	0	108.7	L205 V206 I207 L276 V280 K283 A284 N288	I129-L205 HydrophobicContact CD1-CD1 3.95Å; I129-L205 HydrophobicContact CD1-CD2 3.61Å; I129-L205 HydrophobicContact CD1-CG 4.08Å; I129-L205 HydrophobicContact CG1-CD1 4.05Å; I129-L205 HydrophobicContact CG1-CD2 4.05Å; I129-L205 HydrophobicContact CG1-CG 4.07Å; I129-V206 WeakPolarHBondContact CA-O 3.34Å; I129-I207 HydrophobicContact CB-CG1 4.34Å; I129-I207 HydrophobicContact CD1-CD1 4.36Å; I129-I207 HydrophobicContact CD1-CG1 4.05Å; I129-I207 HydrophobicContact CG1-CG1 4.05Å; I129-L276 HydrophobicContact CD1-CD1 4.37Å; I129-V280 HydrophobicContact CD1-CG1 3.8Å; I129-V280 WeakPolarHBondContact CG2-O 3.31Å; I129-K283 HydrophobicContact CG2-CB 3.76Å; I129-A284 HydrophobicContact CD1-CB 4.27Å; I129-A284 HydrophobicContact CG1-CB 3.97Å; I129-A284 HydrophobicContact CG2-CB 4.32Å; I129-A284 WeakPolarHBondContact O-CA 3.03Å; I129-N288 WeakPolarHBondContact O-CB 3.49Å; I129-N288 PolarHBondContact O-ND2 3.19Å
130	F	93.6	Very high	69.7	Low	17 Å²	17	94.5 Å²	94.5	8%	0.075	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	157.3	-179.9	60.4	-84.6	0	0	0	109.9	V206 Q208 N288 A292	F130-V206 HydrophobicContact CD2-CB 4.39Å; F130-V206 HydrophobicContact CE1-CB 4.09Å; F130-V206 HydrophobicContact CE1-CG1 3.99Å; F130-V206 HydrophobicContact CE2-CB 3.92Å; F130-V206 HydrophobicContact CE2-CG1 4.33Å; F130-V206 HydrophobicContact CE2-CG2 4.21Å; F130-V206 HydrophobicContact CZ-CB 3.75Å; F130-V206 HydrophobicContact CZ-CG1 3.69Å; F130-V206 HydrophobicContact CZ-CG2 4.39Å; F130-V206 PolarHBondContact N-O 3.02Å; F130-V206 PolarHBondContact O-N 3.28Å; F130-Q208 HydrophobicContact CE1-CB 4.29Å; F130-N288 HydrophobicContact CB-CB 4.07Å; F130-A292 HydrophobicContact CD1-CB 3.91Å; F130-A292 HydrophobicContact CE1-CB 3.44Å; F130-A292 VanDerWaalsContact CE1-CB 3.44Å; F130-A292 HydrophobicContact CZ-CB 4.1Å
131	R	91.7	Very high	69.7	Low	129 Å²	129	93.6 Å²	93.6	49%	0.487	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.4	168.5	-70.5	-174.4	178.6	100.2	-2.8	108.5	N204 L205	R131-N204 WeakPolarHBondContact CA-O 3.19Å; R131-L205 HydrophobicContact CG-CD1 4.08Å
132	R	87.8	Confident	70	Confident	121 Å²	121	96.9 Å²	96.9	46%	0.457	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-67.5	134.2	172.8	-175.1	-178.1	66.6	100.4	-0.8	108.5	S134 N204	R132-S134 PolarHBondContact O-N 3.49Å; R132-S134 VanDerWaalsContact O-N 3.15Å; R132-N204 HydrophobicContact CB-CB 4.3Å; R132-N204 PolarHBondContact N-O 2.99Å; R132-N204 PolarHBondContact NH2-OD1 3.44Å
133	P	76.6	Confident	70.8	Confident	80 Å²	80	95 Å²	95	52%	0.519	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-56.4	125.2	172.3	23.2	-32.4	0	0	0	108.6	N135	P133-N135 PolarHBondContact O-N 3.02Å
134	S	66.8	Low	71.4	Confident	56 Å²	56	100.1 Å²	100.1	39%	0.392	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-65.1	135.3	169.8	52.9	0	0	0	0	107.2	R132 V136 S137	R132-S134 PolarHBondContact O-N 3.49Å; R132-S134 VanDerWaalsContact O-N 3.15Å; S134-V136 PolarHBondContact O-N 3.27Å; S134-V136 VanDerWaalsContact OG-CG2 3.27Å; S134-V136 WeakPolarHBondContact OG-CG2 3.49Å; S134-S137 PolarHBondContact O-N 3.37Å
135	N	60	Low	71.7	Confident	142 Å²	142	100.9 Å²	100.9	76%	0.759	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	21.1	-176.2	-160	5.8	0	0	0	113.4	P133	P133-N135 PolarHBondContact O-N 3.02Å
136	V	56.7	Low	71.8	Confident	129 Å²	129	102.9 Å²	102.9	78%	0.782	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-9.2	179.7	-62.4	0	0	0	0	112.7	S134	S134-V136 PolarHBondContact O-N 3.27Å; S134-V136 VanDerWaalsContact OG-CG2 3.27Å; S134-V136 WeakPolarHBondContact OG-CG2 3.49Å
137	S	51.8	Low	71.9	Confident	102 Å²	102	103.4 Å²	103.4	71%	0.713	55%	0.55	S	S	*	.	S	Bend	trans	-131	-9.1	-173	-164.5	0	0	0	0	116.9	S134 K139	S134-S137 PolarHBondContact O-N 3.37Å; S137-K139 PolarHBondContact O-N 3.38Å; S137-K139 VanDerWaalsContact O-N 3.12Å
138	S	47.2	Very low	71.8	Confident	52 Å²	52	106.3 Å²	106.3	36%	0.364	57%	0.568	S	S	.	*			trans	-81.4	97.8	176.2	51.2	0	0	0	0	110.1	E140	S138-E140 PolarHBondContact O-N 2.71Å
139	K	47.7	Very low	71.7	Confident	216 Å²	216	112.4 Å²	112.4	94%	0.939	60%	0.596	S	S	*	*			trans	-64.8	35.7	150.6	-84.4	-179.7	173.1	177.1	0	111.2	S137 S141	S137-K139 PolarHBondContact O-N 3.38Å; S137-K139 VanDerWaalsContact O-N 3.12Å; K139-S141 PolarHBondContact O-N 3.43Å; K139-S141 VanDerWaalsContact O-N 3.11Å
140	E	51.9	Low	71.6	Confident	161 Å²	161	118.7 Å²	118.7	75%	0.752	62%	0.624	S	S	*	*			trans	-69.7	111.9	162	-74	-177	179.4	0	0	103.9	S138 F142	S138-E140 PolarHBondContact O-N 2.71Å; E140-F142 PolarHBondContact O-N 3.14Å
141	S	45	Very low	71.5	Confident	103 Å²	103	124.2 Å²	124.2	72%	0.72	65%	0.648	S	S	*	*			trans	-23.5	120.4	171.9	45.8	0	0	0	0	109.4	K139 A143	K139-S141 PolarHBondContact O-N 3.43Å; K139-S141 VanDerWaalsContact O-N 3.11Å; S141-A143 VanDerWaalsContact C-N 3.32Å; S141-A143 PolarHBondContact O-N 3.46Å
142	F	50.6	Low	71.7	Confident	192 Å²	192	124.7 Å²	124.7	84%	0.842	66%	0.656	S	S	*	*			trans	-36.8	112.3	154.6	-80.5	-95.5	0	0	0	104.9	E140 E144	E140-F142 PolarHBondContact O-N 3.14Å; F142-E144 PolarHBondContact O-N 3.11Å
143	A	64.2	Low	71.9	Confident	88 Å²	88	125.3 Å²	125.3	73%	0.727	66%	0.664	S	S	*	*			trans	-46	116.3	173.9	0	0	0	0	0	103.8	S141 D145	S141-A143 VanDerWaalsContact C-N 3.32Å; S141-A143 PolarHBondContact O-N 3.46Å; A143-D145 PolarHBondContact O-N 3.01Å
144	E	72.8	Confident	72.7	Confident	182 Å²	182	124.5 Å²	124.5	85%	0.85	66%	0.657	S	S	*	*			trans	-41.9	124.3	-170.2	-84.7	172.1	149.2	0	0	107.8	F142 L146	F142-E144 PolarHBondContact O-N 3.11Å; E144-L146 PolarHBondContact O-N 3.28Å
145	D	83.2	Confident	74.1	Confident	154 Å²	154	128.1 Å²	128.1	82%	0.824	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-48.7	119.4	-176.3	-80.5	-28.3	0	0	0	107.5	A143	A143-D145 PolarHBondContact O-N 3.01Å
146	L	87.8	Confident	75.8	Confident	97 Å²	97	126 Å²	126	51%	0.508	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-60.2	136.2	-176.3	-77.1	159.3	0	0	0	108.2	E144 F150 F151	E144-L146 PolarHBondContact O-N 3.28Å; L146-F150 HydrophobicContact CB-CD1 4.39Å; L146-F150 HydrophobicContact CD1-CD1 4.1Å; L146-F150 HydrophobicContact CD1-CE1 4.03Å; L146-F150 HydrophobicContact CD2-CD2 4.47Å; L146-F150 HydrophobicContact CD2-CG 4.37Å; L146-F151 HydrophobicContact CB-CE2 4.13Å; L146-F151 HydrophobicContact CB-CZ 4.36Å
147	P	92.1	Very high	77.7	Confident	76 Å²	76	122.7 Å²	122.7	49%	0.494	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-62	149	179.6	27.5	-35	0	0	0	110.9	E149 F150	P147-E149 WeakPolarHBondContact CB-OE2 3.17Å; P147-E149 PolarHBondContact O-N 3.18Å; P147-E149 VanDerWaalsContact O-N 3.16Å; P147-F150 VanDerWaalsContact O-CB 3.24Å; P147-F150 WeakPolarHBondContact O-CB 3.46Å; P147-F150 PolarHBondContact O-N 3.5Å
148	D	90.5	Very high	79.7	Confident	129 Å²	129	122 Å²	122	69%	0.69	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-57.9	-32.5	-176.3	-75	-13.6	0	0	0	112.2	F150 F151	D148-F150 PolarHBondContact O-N 2.99Å; D148-F150 VanDerWaalsContact O-N 3.16Å; D148-F151 PolarHBondContact O-N 3.11Å
149	E	92.9	Very high	82.1	Confident	134 Å²	134	123.9 Å²	123.9	63%	0.626	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-61	-23.4	177.5	-62	84.7	174.6	0	0	113.3	P147 F151 E152	P147-E149 WeakPolarHBondContact CB-OE2 3.17Å; P147-E149 PolarHBondContact O-N 3.18Å; P147-E149 VanDerWaalsContact O-N 3.16Å; E149-F151 PolarHBondContact O-N 2.93Å; E149-E152 PolarHBondContact O-N 3.37Å
150	F	92	Very high	84.3	Confident	133 Å²	133	121.5 Å²	121.5	58%	0.583	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-63.1	-28.9	173.7	175.8	-96.6	0	0	0	112.2	L146 P147 D148	L146-F150 HydrophobicContact CB-CD1 4.39Å; L146-F150 HydrophobicContact CD1-CD1 4.1Å; L146-F150 HydrophobicContact CD1-CE1 4.03Å; L146-F150 HydrophobicContact CD2-CD2 4.47Å; L146-F150 HydrophobicContact CD2-CG 4.37Å; P147-F150 VanDerWaalsContact O-CB 3.24Å; P147-F150 WeakPolarHBondContact O-CB 3.46Å; P147-F150 PolarHBondContact O-N 3.5Å; D148-F150 PolarHBondContact O-N 2.99Å; D148-F150 VanDerWaalsContact O-N 3.16Å
151	F	92.9	Very high	86.3	Confident	133 Å²	133	117.3 Å²	117.3	58%	0.583	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-91.4	-8.9	-179.8	-58.3	-82.7	0	0	0	113	L146 D148 E149	L146-F151 HydrophobicContact CB-CE2 4.13Å; L146-F151 HydrophobicContact CB-CZ 4.36Å; D148-F151 PolarHBondContact O-N 3.11Å; E149-F151 PolarHBondContact O-N 2.93Å
152	E	94.3	Very high	88.6	Confident	139 Å²	139	118.6 Å²	118.6	65%	0.65	58%	0.582	S	S	*	*	S	Bend	trans	-79.4	136.5	172.2	-63.2	-167.4	166.4	0	0	110.6	E149	E149-E152 PolarHBondContact O-N 3.37Å
153	H	93	Very high	90.6	Very high	133 Å²	133	116.9 Å²	116.9	62%	0.616	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-79.4	129.1	-179.9	-70.3	65.2	0	0	0	110.8	D157 I158	H153-D157 HydrophobicContact CB-CB 4.49Å; H153-I158 HydrophobicContact CB-CD1 4.4Å; H153-I158 HydrophobicContact CB-CG1 4.05Å
154	T	94.4	Very high	91.8	Very high	64 Å²	64	115.4 Å²	115.4	39%	0.393	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-75.6	162.7	170	67.1	0	0	0	0	111.3	E156 D157 I158	T154-E156 PolarHBondContact O-N 3.02Å; T154-D157 WeakPolarHBondContact CB-OD2 3.4Å; T154-D157 PolarHBondContact N-OD2 2.95Å; T154-D157 VanDerWaalsContact N-OD2 3.07Å; T154-D157 PolarHBondContact O-N 3.04Å; T154-D157 VanDerWaalsContact O-N 3.1Å; T154-D157 PolarHBondContact OG1-N 3.16Å; T154-D157 PolarHBondContact OG1-OD2 3.07Å; T154-I158 PolarHBondContact O-N 2.87Å; T154-I158 VanDerWaalsContact O-N 3.12Å
155	E	95.5	Very high	92.6	Very high	132 Å²	132	111.8 Å²	111.8	62%	0.617	53%	0.533	S	S	*	.	H	α-helix	trans	-58.7	-34.8	173.7	-166.6	-170.1	155.7	0	0	111	I158 R159	E155-I158 PolarHBondContact O-N 3.02Å; E155-R159 VanDerWaalsContact O-CB 3.24Å; E155-R159 WeakPolarHBondContact O-CB 3.34Å; E155-R159 PolarHBondContact O-N 3.06Å; E155-R159 IonicContact OE1-CZ 3.7Å; E155-R159 IonicContact OE1-NH2 2.66Å; E155-R159 PolarHBondContact OE1-NH2 3.17Å; E155-R159 IonicContact OE2-NH2 3.77Å
156	E	95.6	Very high	92.8	Very high	98 Å²	98	113.8 Å²	113.8	46%	0.458	53%	0.529	S	S	.	.	H	α-helix	trans	-61.5	-41.8	174.9	-74.3	57.8	-120.2	0	0	112.5	T154 R159 R160	T154-E156 PolarHBondContact O-N 3.02Å; E156-R159 PolarHBondContact O-N 3.02Å; E156-R159 IonicContact OE1-CZ 3.79Å; E156-R159 IonicContact OE1-NH1 2.89Å; E156-R159 PolarHBondContact OE1-NH1 3.36Å; E156-R159 IonicContact OE1-NH2 3.71Å; E156-R160 WeakPolarHBondContact O-CB 3.35Å; E156-R160 PolarHBondContact O-N 2.93Å
157	D	95.5	Very high	92.7	Very high	58 Å²	58	114 Å²	114	31%	0.31	53%	0.531	S	S	.	.	H	α-helix	trans	-67.4	-45.3	179.3	-60.7	-40.5	0	0	0	110.8	H153 T154 R159 R160 L161	H153-D157 HydrophobicContact CB-CB 4.49Å; T154-D157 WeakPolarHBondContact CB-OD2 3.4Å; T154-D157 PolarHBondContact N-OD2 2.95Å; T154-D157 VanDerWaalsContact N-OD2 3.07Å; T154-D157 PolarHBondContact O-N 3.04Å; T154-D157 VanDerWaalsContact O-N 3.1Å; T154-D157 PolarHBondContact OG1-N 3.16Å; T154-D157 PolarHBondContact OG1-OD2 3.07Å; D157-R159 VanDerWaalsContact C-N 3.33Å; D157-R159 PolarHBondContact O-N 3.12Å; D157-R160 WeakPolarHBondContact O-CB 3.48Å; D157-R160 PolarHBondContact O-N 2.97Å; D157-L161 WeakPolarHBondContact O-CB 3.4Å; D157-L161 PolarHBondContact O-N 3.39Å
158	I	95.6	Very high	92.3	Very high	89 Å²	89	115 Å²	115	46%	0.456	53%	0.529	S	S	.	.	H	α-helix	trans	-61.1	-44.9	175.9	-61.8	171.3	0	0	0	110	H153 T154 E155 R160 L161 M162	H153-I158 HydrophobicContact CB-CD1 4.4Å; H153-I158 HydrophobicContact CB-CG1 4.05Å; T154-I158 PolarHBondContact O-N 2.87Å; T154-I158 VanDerWaalsContact O-N 3.12Å; E155-I158 PolarHBondContact O-N 3.02Å; I158-R160 VanDerWaalsContact C-N 3.31Å; I158-R160 PolarHBondContact O-N 2.81Å; I158-L161 PolarHBondContact O-N 3.42Å; I158-M162 HydrophobicContact CG2-CG 4.38Å; I158-M162 VanDerWaalsContact O-CG 3.27Å; I158-M162 WeakPolarHBondContact O-CG 3.45Å; I158-M162 PolarHBondContact O-N 2.86Å
159	R	95.8	Very high	91.8	Very high	90 Å²	90	119.2 Å²	119.2	34%	0.34	54%	0.535	S	S	.	.	H	α-helix	trans	-63	-38.4	178.1	-166.9	-176.4	-58.3	115.6	-9.4	111.7	E155 E156 D157 R163	E155-R159 VanDerWaalsContact O-CB 3.24Å; E155-R159 WeakPolarHBondContact O-CB 3.34Å; E155-R159 PolarHBondContact O-N 3.06Å; E155-R159 IonicContact OE1-CZ 3.7Å; E155-R159 IonicContact OE1-NH2 2.66Å; E155-R159 PolarHBondContact OE1-NH2 3.17Å; E155-R159 IonicContact OE2-NH2 3.77Å; E156-R159 PolarHBondContact O-N 3.02Å; E156-R159 IonicContact OE1-CZ 3.79Å; E156-R159 IonicContact OE1-NH1 2.89Å; E156-R159 PolarHBondContact OE1-NH1 3.36Å; E156-R159 IonicContact OE1-NH2 3.71Å; D157-R159 VanDerWaalsContact C-N 3.33Å; D157-R159 PolarHBondContact O-N 3.12Å; R159-R163 WeakPolarHBondContact O-CG 3.33Å; R159-R163 PolarHBondContact O-N 3.21Å
160	R	94.1	Very high	90.9	Very high	167 Å²	167	116.5 Å²	116.5	63%	0.63	54%	0.536	S	S	*	.	H	α-helix	trans	-67	-43.7	176	-168.3	-175.6	-50.2	-171.1	7.8	111.3	E156 D157 I158 R163 S164	E156-R160 WeakPolarHBondContact O-CB 3.35Å; E156-R160 PolarHBondContact O-N 2.93Å; D157-R160 WeakPolarHBondContact O-CB 3.48Å; D157-R160 PolarHBondContact O-N 2.97Å; I158-R160 VanDerWaalsContact C-N 3.31Å; I158-R160 PolarHBondContact O-N 2.81Å; R160-R163 PolarHBondContact O-N 3.4Å; R160-S164 PolarHBondContact O-N 3.35Å
161	L	93.8	Very high	89.9	Confident	72 Å²	72	115.9 Å²	115.9	38%	0.377	54%	0.535	S	S	.	.	H	α-helix	trans	-62.2	-43.9	176.7	-177.7	63.8	0	0	0	111.9	D157 I158 R163 S164 Y165	D157-L161 WeakPolarHBondContact O-CB 3.4Å; D157-L161 PolarHBondContact O-N 3.39Å; I158-L161 PolarHBondContact O-N 3.42Å; L161-R163 VanDerWaalsContact C-N 3.29Å; L161-R163 PolarHBondContact O-N 2.7Å; L161-S164 WeakPolarHBondContact CA-OG 3.17Å; L161-S164 PolarHBondContact O-N 2.74Å; L161-S164 PolarHBondContact O-OG 3.45Å; L161-Y165 HydrophobicContact CD1-CD2 4.03Å; L161-Y165 HydrophobicContact CD1-CE2 3.47Å; L161-Y165 VanDerWaalsContact CD1-CE2 3.47Å; L161-Y165 HydrophobicContact CD2-CE2 3.99Å; L161-Y165 HydrophobicContact CG-CD2 3.87Å; L161-Y165 HydrophobicContact CG-CE2 3.48Å; L161-Y165 VanDerWaalsContact CG-CE2 3.48Å; L161-Y165 WeakPolarHBondContact O-CD2 3.31Å; L161-Y165 PolarHBondContact O-N 2.96Å
162	M	93.9	Very high	88.7	Confident	131 Å²	131	114.8 Å²	114.8	65%	0.645	54%	0.543	S	S	*	.	H	α-helix	trans	-64.2	-34.4	176.8	-69.3	-66.3	-84.7	0	0	112.4	I158 R166	I158-M162 HydrophobicContact CG2-CG 4.38Å; I158-M162 VanDerWaalsContact O-CG 3.27Å; I158-M162 WeakPolarHBondContact O-CG 3.45Å; I158-M162 PolarHBondContact O-N 2.86Å; M162-R166 WeakPolarHBondContact O-CB 3.27Å; M162-R166 PolarHBondContact O-N 2.82Å; M162-R166 VanDerWaalsContact O-N 3.1Å
163	R	92.5	Very high	87.5	Confident	156 Å²	156	113.3 Å²	113.3	59%	0.589	54%	0.536	S	S	*	.	H	α-helix	trans	-67.2	-47.5	172.7	-70.7	173.5	-166.5	173.1	3.4	111.4	R159 R160 L161 Y165 R166 D167	R159-R163 WeakPolarHBondContact O-CG 3.33Å; R159-R163 PolarHBondContact O-N 3.21Å; R160-R163 PolarHBondContact O-N 3.4Å; L161-R163 VanDerWaalsContact C-N 3.29Å; L161-R163 PolarHBondContact O-N 2.7Å; R163-Y165 VanDerWaalsContact C-N 3.32Å; R163-Y165 PolarHBondContact O-N 3.48Å; R163-R166 WeakPolarHBondContact O-CB 3.22Å; R163-R166 PolarHBondContact O-N 3.02Å; R163-R166 VanDerWaalsContact O-N 3.08Å; R163-D167 VanDerWaalsContact O-CG 3.24Å; R163-D167 PolarHBondContact O-N 3.12Å
164	S	89.5	Confident	86.9	Confident	56 Å²	56	111.1 Å²	111.1	39%	0.392	53%	0.534	S	S	.	.	H	α-helix	trans	-61.5	-39.3	179.4	60.8	0	0	0	0	112.6	R160 L161 D167 E168	R160-S164 PolarHBondContact O-N 3.35Å; L161-S164 WeakPolarHBondContact CA-OG 3.17Å; L161-S164 PolarHBondContact O-N 2.74Å; L161-S164 PolarHBondContact O-OG 3.45Å; S164-D167 PolarHBondContact O-N 3.07Å; S164-E168 WeakPolarHBondContact O-CB 3.35Å; S164-E168 PolarHBondContact O-N 3.24Å
165	Y	89.7	Confident	86.3	Confident	107 Å²	107	116.4 Å²	116.4	42%	0.42	56%	0.559	S	S	.	*	H	α-helix	trans	-63.9	-43	172.8	-78	-54.6	0	0	0	112.1	L161 R163 D167 E168 W169	L161-Y165 HydrophobicContact CD1-CD2 4.03Å; L161-Y165 HydrophobicContact CD1-CE2 3.47Å; L161-Y165 VanDerWaalsContact CD1-CE2 3.47Å; L161-Y165 HydrophobicContact CD2-CE2 3.99Å; L161-Y165 HydrophobicContact CG-CD2 3.87Å; L161-Y165 HydrophobicContact CG-CE2 3.48Å; L161-Y165 VanDerWaalsContact CG-CE2 3.48Å; L161-Y165 WeakPolarHBondContact O-CD2 3.31Å; L161-Y165 PolarHBondContact O-N 2.96Å; R163-Y165 VanDerWaalsContact C-N 3.32Å; R163-Y165 PolarHBondContact O-N 3.48Å; Y165-D167 VanDerWaalsContact C-N 3.28Å; Y165-D167 PolarHBondContact O-N 3.29Å; Y165-E168 PolarHBondContact O-N 3.28Å; Y165-W169 WeakPolarHBondContact O-CB 3.33Å; Y165-W169 PolarHBondContact O-N 2.87Å
166	R	88.2	Confident	85.7	Confident	196 Å²	196	113.8 Å²	113.8	74%	0.74	55%	0.547	S	S	*	.	H	α-helix	trans	-60.9	-41.6	177.1	-174.5	177.8	-178	175.5	0.5	111.3	M162 R163 A170	M162-R166 WeakPolarHBondContact O-CB 3.27Å; M162-R166 PolarHBondContact O-N 2.82Å; M162-R166 VanDerWaalsContact O-N 3.1Å; R163-R166 WeakPolarHBondContact O-CB 3.22Å; R163-R166 PolarHBondContact O-N 3.02Å; R163-R166 VanDerWaalsContact O-N 3.08Å; R166-A170 WeakPolarHBondContact O-CB 3.26Å; R166-A170 PolarHBondContact O-N 3.27Å
167	D	85.1	Confident	85.5	Confident	100 Å²	100	113 Å²	113	54%	0.535	55%	0.549	S	S	.	.	H	α-helix	trans	-66.6	-46.7	179.7	-63.1	-21.4	0	0	0	110.6	R163 S164 Y165 W169 A170 E171	R163-D167 VanDerWaalsContact O-CG 3.24Å; R163-D167 PolarHBondContact O-N 3.12Å; S164-D167 PolarHBondContact O-N 3.07Å; Y165-D167 VanDerWaalsContact C-N 3.28Å; Y165-D167 PolarHBondContact O-N 3.29Å; D167-W169 VanDerWaalsContact C-N 3.32Å; D167-W169 PolarHBondContact O-N 3.28Å; D167-A170 PolarHBondContact O-N 3.45Å; D167-E171 WeakPolarHBondContact O-CB 3.39Å; D167-E171 PolarHBondContact O-N 3.21Å
168	E	83.2	Confident	85.1	Confident	99 Å²	99	114.3 Å²	114.3	46%	0.463	56%	0.563	S	S	.	*	H	α-helix	trans	-61.3	-37.7	177.4	-173.7	-179.3	-172.9	0	0	112.9	S164 Y165	S164-E168 WeakPolarHBondContact O-CB 3.35Å; S164-E168 PolarHBondContact O-N 3.24Å; Y165-E168 PolarHBondContact O-N 3.28Å
169	W	79.5	Confident	84.7	Confident	217 Å²	217	113.4 Å²	113.4	82%	0.822	57%	0.568	S	S	*	*	H	α-helix	trans	-82.6	-29.8	-179.8	-73.9	58.1	0	0	0	113.3	Y165 D167	Y165-W169 WeakPolarHBondContact O-CB 3.33Å; Y165-W169 PolarHBondContact O-N 2.87Å; D167-W169 VanDerWaalsContact C-N 3.32Å; D167-W169 PolarHBondContact O-N 3.28Å
170	A	75.3	Confident	84.4	Confident	77 Å²	77	113 Å²	113	64%	0.636	57%	0.571	S	S	*	*	H	α-helix	trans	-80.2	-30.7	177.7	0	0	0	0	0	111.9	R166 D167 S172	R166-A170 WeakPolarHBondContact O-CB 3.26Å; R166-A170 PolarHBondContact O-N 3.27Å; D167-A170 PolarHBondContact O-N 3.45Å; A170-S172 PolarHBondContact O-N 3.28Å
171	E	70.4	Confident	84.1	Confident	120 Å²	120	110.9 Å²	110.9	56%	0.561	56%	0.563	S	S	*	*	S	Bend	trans	-76.2	98.4	178.7	-155.1	160.2	-144.2	0	0	108.6	D167 Q173	D167-E171 WeakPolarHBondContact O-CB 3.39Å; D167-E171 PolarHBondContact O-N 3.21Å; E171-Q173 VanDerWaalsContact CG-NE2 3.32Å; E171-Q173 PolarHBondContact O-N 3.03Å; E171-Q173 PolarHBondContact OE2-NE2 2.91Å
172	S	67.1	Low	83.7	Confident	109 Å²	109	110.4 Å²	110.4	76%	0.762	57%	0.566	S	S	*	*			trans	-62.4	84.4	164.8	60.3	0	0	0	0	107.9	A170 P174	A170-S172 PolarHBondContact O-N 3.28Å; S172-P174 WeakPolarHBondContact O-CD 3.48Å
173	Q	70.2	Confident	83.4	Confident	108 Å²	108	110.8 Å²	110.8	51%	0.505	57%	0.566	S	S	.	*			trans	-59.1	110.2	-178.5	-72.4	-68.1	-27	0	0	108	E171	E171-Q173 VanDerWaalsContact CG-NE2 3.32Å; E171-Q173 PolarHBondContact O-N 3.03Å; E171-Q173 PolarHBondContact OE2-NE2 2.91Å
174	P	79.5	Confident	83.1	Confident	88 Å²	88	105.4 Å²	105.4	57%	0.571	56%	0.555	S	S	*	*			trans	-64.8	148.3	-178.7	27.5	-33.4	0	0	0	109.3	S172 Q176	S172-P174 WeakPolarHBondContact O-CD 3.48Å; P174-Q176 PolarHBondContact O-N 3.22Å
175	L	82.8	Confident	82.9	Confident	174 Å²	174	106.9 Å²	106.9	91%	0.911	55%	0.552	S	S	*	*			trans	-58.2	115.7	172.8	-69	174.5	0	0	0	109.2
176	Q	83.3	Confident	82.7	Confident	77 Å²	77	105.9 Å²	105.9	36%	0.36	55%	0.551	S	S	.	*			trans	-84.2	132.2	175.2	-65.2	-175.9	-39.5	0	0	109.9	P174 M180 R181	P174-Q176 PolarHBondContact O-N 3.22Å; Q176-M180 HydrophobicContact CB-CB 4.25Å; Q176-M180 HydrophobicContact CG-CE 4.16Å; Q176-R181 HydrophobicContact CB-CG 4.16Å; Q176-R181 PolarHBondContact O-NH1 3.15Å
177	T	89.5	Confident	82.7	Confident	81 Å²	81	103.6 Å²	103.6	50%	0.497	55%	0.546	S	S	.	.			trans	-73.7	162.9	172.4	68.2	0	0	0	0	110.7	A179 M180 R181	T177-A179 PolarHBondContact O-N 2.9Å; T177-M180 HydrophobicContact CG2-SD 4.47Å; T177-M180 PolarHBondContact O-N 3.13Å; T177-M180 VanDerWaalsContact O-N 3.13Å; T177-M180 WeakPolarHBondContact OG1-CG 3.4Å; T177-M180 PolarHBondContact OG1-N 3.32Å; T177-R181 PolarHBondContact O-N 3.29Å; T177-R181 VanDerWaalsContact O-N 3.09Å
178	S	88	Confident	82.6	Confident	87 Å²	87	101.7 Å²	101.7	61%	0.608	54%	0.541	S	S	*	.	H	α-helix	trans	-55.3	-39.6	174.6	-169.5	0	0	0	0	111.9	R181 S182	S178-R181 PolarHBondContact O-N 3.46Å; S178-S182 PolarHBondContact O-N 3.32Å
179	A	87.6	Confident	82.8	Confident	69 Å²	69	99.6 Å²	99.6	57%	0.57	53%	0.529	S	S	*	.	H	α-helix	trans	-62.1	-46.3	175.9	0	0	0	0	0	112	T177 R181 S182 E183	T177-A179 PolarHBondContact O-N 2.9Å; A179-R181 VanDerWaalsContact C-N 3.3Å; A179-R181 PolarHBondContact O-N 2.92Å; A179-S182 PolarHBondContact O-N 3.45Å; A179-E183 WeakPolarHBondContact O-CB 3.44Å; A179-E183 PolarHBondContact O-N 3.12Å
180	M	88.4	Confident	83	Confident	82 Å²	82	92 Å²	92	40%	0.404	51%	0.509	S	S	.	.	H	α-helix	trans	-60	-39.4	177	-72	175.1	72.4	0	0	112.2	Q176 T177 A184	Q176-M180 HydrophobicContact CB-CB 4.25Å; Q176-M180 HydrophobicContact CG-CE 4.16Å; T177-M180 HydrophobicContact CG2-SD 4.47Å; T177-M180 PolarHBondContact O-N 3.13Å; T177-M180 VanDerWaalsContact O-N 3.13Å; T177-M180 WeakPolarHBondContact OG1-CG 3.4Å; T177-M180 PolarHBondContact OG1-N 3.32Å; M180-A184 VanDerWaalsContact O-CB 3.26Å; M180-A184 WeakPolarHBondContact O-CB 3.42Å; M180-A184 PolarHBondContact O-N 3.15Å
181	R	88	Confident	83.5	Confident	123 Å²	123	93.9 Å²	93.9	46%	0.464	50%	0.503	S	S	.	.	H	α-helix	trans	-66.8	-44.9	176.8	-70.4	-166.7	-65.3	-88	3.5	112.1	Q176 T177 S178 A179 A184 R185	Q176-R181 HydrophobicContact CB-CG 4.16Å; Q176-R181 PolarHBondContact O-NH1 3.15Å; T177-R181 PolarHBondContact O-N 3.29Å; T177-R181 VanDerWaalsContact O-N 3.09Å; S178-R181 PolarHBondContact O-N 3.46Å; A179-R181 VanDerWaalsContact C-N 3.3Å; A179-R181 PolarHBondContact O-N 2.92Å; R181-A184 PolarHBondContact O-N 3.13Å; R181-R185 WeakPolarHBondContact O-CB 3.46Å; R181-R185 PolarHBondContact O-N 2.99Å
182	S	85.9	Confident	84.1	Confident	62 Å²	62	90.7 Å²	90.7	43%	0.434	49%	0.486	S	S	.	.	H	α-helix	trans	-62.8	-43.7	177.6	-172.7	0	0	0	0	111.6	S178 A179 R185 H186	S178-S182 PolarHBondContact O-N 3.32Å; A179-S182 PolarHBondContact O-N 3.45Å; S182-R185 WeakPolarHBondContact O-CB 3.44Å; S182-R185 PolarHBondContact O-N 3.45Å; S182-H186 WeakPolarHBondContact O-CB 3.29Å; S182-H186 PolarHBondContact O-N 2.76Å
183	E	88.2	Confident	85	Confident	138 Å²	138	90.2 Å²	90.2	65%	0.645	48%	0.482	S	S	*	.	H	α-helix	trans	-65	-43.7	177.3	-172.3	-176.7	-174.7	0	0	111.8	A179 R185 H186 K187	A179-E183 WeakPolarHBondContact O-CB 3.44Å; A179-E183 PolarHBondContact O-N 3.12Å; E183-R185 VanDerWaalsContact C-N 3.31Å; E183-R185 PolarHBondContact O-N 3.09Å; E183-H186 PolarHBondContact O-N 2.92Å; E183-K187 WeakPolarHBondContact O-CB 3.32Å; E183-K187 PolarHBondContact O-N 3.39Å
184	A	86.6	Confident	85.9	Confident	43 Å²	43	90.1 Å²	90.1	36%	0.355	48%	0.477	S	S	.	.	H	α-helix	trans	-61.4	-40.6	176.2	0	0	0	0	0	111.9	M180 R181 S188	M180-A184 VanDerWaalsContact O-CB 3.26Å; M180-A184 WeakPolarHBondContact O-CB 3.42Å; M180-A184 PolarHBondContact O-N 3.15Å; R181-A184 PolarHBondContact O-N 3.13Å; A184-S188 VanDerWaalsContact O-CB 3.31Å; A184-S188 WeakPolarHBondContact O-CB 3.3Å; A184-S188 PolarHBondContact O-N 2.92Å; A184-S188 PolarHBondContact O-OG 2.7Å
185	R	84.5	Confident	86.5	Confident	88 Å²	88	85.9 Å²	85.9	33%	0.332	45%	0.449	S	S	.	.	H	α-helix	trans	-61.1	-54.4	173.7	177.3	-170	-67.8	-152.2	-17.5	110.7	R181 S182 E183 K187 S188 Y189 I253 E254 D256	R181-R185 WeakPolarHBondContact O-CB 3.46Å; R181-R185 PolarHBondContact O-N 2.99Å; S182-R185 WeakPolarHBondContact O-CB 3.44Å; S182-R185 PolarHBondContact O-N 3.45Å; E183-R185 VanDerWaalsContact C-N 3.31Å; E183-R185 PolarHBondContact O-N 3.09Å; R185-K187 VanDerWaalsContact C-N 3.31Å; R185-K187 PolarHBondContact O-N 3.14Å; R185-S188 PolarHBondContact O-N 3.08Å; R185-S188 VanDerWaalsContact O-N 3.08Å; R185-Y189 HydrophobicContact CG-CD2 3.58Å; R185-Y189 HydrophobicContact CG-CE2 3.61Å; R185-Y189 WeakPolarHBondContact O-CD2 3.43Å; R185-Y189 PolarHBondContact O-N 3.15Å; R185-I253 HydrophobicContact CG-CG2 4.17Å; R185-E254 PolarHBondContact NH1-O 2.78Å; R185-D256 IonicContact CZ-OD1 3.42Å; R185-D256 VanDerWaalsContact CZ-OD1 3.31Å; R185-D256 IonicContact CZ-OD2 2.84Å; R185-D256 VanDerWaalsContact CZ-OD2 3.26Å; R185-D256 IonicContact NE-OD1 2.82Å; R185-D256 IonicContact NH1-OD1 3.31Å; R185-D256 IonicContact NH1-OD2 3.26Å; R185-D256 PolarHBondContact NH1-OD2 3.06Å; R185-D256 IonicContact NH2-OD1 3.59Å; R185-D256 PolarHBondContact NH2-OD1 2.93Å; R185-D256 IonicContact NH2-OD2 3.6Å; R185-D256 PolarHBondContact NH2-OD2 3.36Å
186	H	86.2	Confident	87.1	Confident	85 Å²	85	77.6 Å²	77.6	39%	0.394	41%	0.406	S	S	.	.	H	α-helix	trans	-57.5	-46.1	179.9	-170.3	-81.3	0	0	0	110.9	S182 E183 S188 Y189 S190 I253	S182-H186 WeakPolarHBondContact O-CB 3.29Å; S182-H186 PolarHBondContact O-N 2.76Å; E183-H186 PolarHBondContact O-N 2.92Å; H186-S188 VanDerWaalsContact C-N 3.32Å; H186-S188 PolarHBondContact O-N 2.65Å; H186-Y189 PolarHBondContact O-N 3.48Å; H186-S190 PolarHBondContact CE1-OG 3.33Å; H186-S190 PolarHBondContact ND1-OG 2.8Å; H186-S190 WeakPolarHBondContact O-CB 3.39Å; H186-S190 PolarHBondContact O-N 3.37Å; H186-S190 PolarHBondContact O-OG 3.36Å; H186-I253 HydrophobicContact CB-CG2 4.47Å
187	K	86.7	Confident	87.8	Confident	149 Å²	149	74 Å²	74	65%	0.648	39%	0.389	S	S	*	.	H	α-helix	trans	-62.6	-35.3	176.4	-174.4	176.5	-178.2	177.4	0	113.2	E183 R185	E183-K187 WeakPolarHBondContact O-CB 3.32Å; E183-K187 PolarHBondContact O-N 3.39Å; R185-K187 VanDerWaalsContact C-N 3.31Å; R185-K187 PolarHBondContact O-N 3.14Å
188	S	84.8	Confident	88.1	Confident	59 Å²	59	71 Å²	71	41%	0.413	37%	0.369	S	S	.	.	H	α-helix	trans	-71.2	-44.4	177.9	-62.1	0	0	0	0	111.2	A184 R185 H186	A184-S188 VanDerWaalsContact O-CB 3.31Å; A184-S188 WeakPolarHBondContact O-CB 3.3Å; A184-S188 PolarHBondContact O-N 2.92Å; A184-S188 PolarHBondContact O-OG 2.7Å; R185-S188 PolarHBondContact O-N 3.08Å; R185-S188 VanDerWaalsContact O-N 3.08Å; H186-S188 VanDerWaalsContact C-N 3.32Å; H186-S188 PolarHBondContact O-N 2.65Å
189	Y	87	Confident	88.5	Confident	56 Å²	56	67 Å²	67	22%	0.22	34%	0.341	C	S	.	.	H	α-helix	trans	-84.3	-21.3	-177.8	-65.7	-50.5	0	0	0	114.5	R185 H186 K191 Y192 I253 V258	R185-Y189 HydrophobicContact CG-CD2 3.58Å; R185-Y189 HydrophobicContact CG-CE2 3.61Å; R185-Y189 WeakPolarHBondContact O-CD2 3.43Å; R185-Y189 PolarHBondContact O-N 3.15Å; H186-Y189 PolarHBondContact O-N 3.48Å; Y189-K191 PolarHBondContact O-N 2.86Å; Y189-K191 VanDerWaalsContact O-N 3.14Å; Y189-Y192 HydrophobicContact CD1-CD2 4.32Å; Y189-Y192 HydrophobicContact CD1-CE2 4.08Å; Y189-Y192 WeakPolarHBondContact O-CD2 3.21Å; Y189-Y192 PolarHBondContact O-N 3.43Å; Y189-Y192 VanDerWaalsContact O-N 3.09Å; Y189-I253 HydrophobicContact CD2-CG2 4.04Å; Y189-V258 HydrophobicContact CD1-CB 3.97Å; Y189-V258 HydrophobicContact CD1-CG1 3.95Å; Y189-V258 HydrophobicContact CE1-CB 4.47Å; Y189-V258 WeakPolarHBondContact CE1-O 2.95Å; Y189-V258 HydrophobicContact CG-CB 4.13Å; Y189-V258 HydrophobicContact CG-CG1 4.22Å
190	S	82.7	Confident	88.8	Confident	58 Å²	58	65.1 Å²	65.1	41%	0.406	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-15.3	173.9	-66.2	0	0	0	0	113.3	H186 Y192	H186-S190 PolarHBondContact CE1-OG 3.33Å; H186-S190 PolarHBondContact ND1-OG 2.8Å; H186-S190 WeakPolarHBondContact O-CB 3.39Å; H186-S190 PolarHBondContact O-N 3.37Å; H186-S190 PolarHBondContact O-OG 3.36Å; S190-Y192 PolarHBondContact O-N 3.32Å
191	K	85.5	Confident	89	Confident	116 Å²	116	62 Å²	62	50%	0.504	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-24.4	174.6	-61.7	175.4	-173.4	174.7	0	112.1	Y189 L303	Y189-K191 PolarHBondContact O-N 2.86Å; Y189-K191 VanDerWaalsContact O-N 3.14Å; K191-L303 HydrophobicContact CB-CD2 4.18Å; K191-L303 VanDerWaalsContact O-CD2 3.3Å; K191-L303 WeakPolarHBondContact O-CD2 3.47Å
192	Y	84.2	Confident	89.1	Confident	53 Å²	53	59.9 Å²	59.9	21%	0.208	31%	0.305	C	S	.	.			trans	-84.7	126.5	178.9	-59.6	-95.9	0	0	0	108.8	Y189 S190 R194 P213 V258 P259 L303	Y189-Y192 HydrophobicContact CD1-CD2 4.32Å; Y189-Y192 HydrophobicContact CD1-CE2 4.08Å; Y189-Y192 WeakPolarHBondContact O-CD2 3.21Å; Y189-Y192 PolarHBondContact O-N 3.43Å; Y189-Y192 VanDerWaalsContact O-N 3.09Å; S190-Y192 PolarHBondContact O-N 3.32Å; Y192-R194 VanDerWaalsContact C-N 3.26Å; Y192-P213 VanDerWaalsContact O-CG 3.3Å; Y192-P213 WeakPolarHBondContact O-CG 3.37Å; Y192-V258 HydrophobicContact CD2-CG1 4.26Å; Y192-V258 HydrophobicContact CG-CG1 4.28Å; Y192-P259 HydrophobicContact CD1-CB 3.24Å; Y192-P259 HydrophobicContact CD1-CG 3.95Å; Y192-P259 HydrophobicContact CD2-CB 4.43Å; Y192-P259 HydrophobicContact CE1-CB 3.25Å; Y192-P259 HydrophobicContact CE1-CG 3.37Å; Y192-P259 HydrophobicContact CE2-CB 4.5Å; Y192-P259 HydrophobicContact CG-CB 3.86Å; Y192-L303 HydrophobicContact CD1-CD1 3.24Å; Y192-L303 HydrophobicContact CD1-CD2 3.56Å; Y192-L303 HydrophobicContact CD1-CG 3.86Å; Y192-L303 HydrophobicContact CD2-CD2 4.32Å; Y192-L303 HydrophobicContact CE1-CD1 2.92Å; Y192-L303 HydrophobicContact CE1-CD2 3.87Å; Y192-L303 HydrophobicContact CE1-CG 3.95Å; Y192-L303 HydrophobicContact CG-CD1 4.32Å; Y192-L303 HydrophobicContact CG-CD2 3.85Å
193	C	85.3	Confident	89.3	Confident	99 Å²	99	59.1 Å²	59.1	67%	0.669	30%	0.296	S	S	*	.	S	Bend	trans	-78.7	-15.9	174.6	-58	0	0	0	0	112.4
194	R	90	Very high	89.4	Confident	105 Å²	105	55.2 Å²	55.2	40%	0.396	28%	0.279	S	S	.	.			trans	-143.3	144.7	-174.9	-63.2	-176.8	178.8	-164.6	-3	110	E126 Y192 F211 V299	E126-R194 IonicContact OE2-CZ 3.91Å; E126-R194 IonicContact OE2-NH1 3.27Å; E126-R194 PolarHBondContact OE2-NH1 2.97Å; Y192-R194 VanDerWaalsContact C-N 3.26Å; R194-F211 CarbonylContact C-O 3.48Å; R194-F211 WeakPolarHBondContact CA-O 3.16Å; R194-V299 HydrophobicContact CB-CG2 4.11Å
195	A	92.6	Very high	89.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	134.2	166.8	0	0	0	0	0	108.4	C210 F211 P213 L252 V258 P259	A195-C210 CarbonylContact O-C 3.56Å; A195-C210 WeakPolarHBondContact O-CA 3.27Å; A195-F211 PolarHBondContact N-O 3.43Å; A195-F211 PolarHBondContact O-N 2.94Å; A195-P213 HydrophobicContact CB-CG 4.48Å; A195-L252 HydrophobicContact CB-CD1 4.13Å; A195-V258 HydrophobicContact CB-CB 4.48Å; A195-V258 HydrophobicContact CB-CG1 4.36Å; A195-V258 HydrophobicContact CB-CG2 3.89Å; A195-P259 CarbonylContact C-O 3.42Å; A195-P259 WeakPolarHBondContact CA-O 3.42Å
196	I	94.9	Very high	90.2	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	121.7	178.3	-57.7	174.4	0	0	0	107.7	Q208 P259 L260 S261 I295 I296 V299	I196-Q208 HydrophobicContact CG2-CG 3.44Å; I196-Q208 VanDerWaalsContact CG2-CG 3.44Å; I196-P259 PolarHBondContact N-O 3.43Å; I196-L260 HydrophobicContact CB-CD1 3.63Å; I196-L260 HydrophobicContact CG2-CD1 3.44Å; I196-L260 VanDerWaalsContact CG2-CD1 3.44Å; I196-L260 VanDerWaalsContact O-CA 3.3Å; I196-L260 WeakPolarHBondContact O-CA 3.28Å; I196-S261 PolarHBondContact O-N 2.79Å; I196-I295 HydrophobicContact CD1-CG2 4.12Å; I196-I296 HydrophobicContact CD1-CB 4.19Å; I196-I296 HydrophobicContact CD1-CG1 3.73Å; I196-I296 HydrophobicContact CG2-CG1 4.47Å; I196-V299 HydrophobicContact CD1-CB 4.04Å; I196-V299 HydrophobicContact CD1-CG2 3.77Å; I196-V299 HydrophobicContact CG1-CG2 4.17Å
197	I	96.6	Very high	90.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	126.2	175.8	-52.8	-60.5	0	0	0	108.6	F199 Q208 A209 F211 L220 L257 V263	I197-F199 HydrophobicContact CB-CE2 4.06Å; I197-F199 HydrophobicContact CB-CZ 4.21Å; I197-F199 HydrophobicContact CG2-CD1 4.32Å; I197-F199 HydrophobicContact CG2-CD2 4.14Å; I197-F199 HydrophobicContact CG2-CE1 3.86Å; I197-F199 HydrophobicContact CG2-CE2 3.66Å; I197-F199 HydrophobicContact CG2-CG 4.45Å; I197-F199 HydrophobicContact CG2-CZ 3.51Å; I197-Q208 WeakPolarHBondContact O-CA 3.49Å; I197-A209 PolarHBondContact N-O 2.84Å; I197-A209 PolarHBondContact O-N 3.15Å; I197-F211 HydrophobicContact CB-CD2 3.99Å; I197-F211 HydrophobicContact CB-CE2 3.85Å; I197-F211 HydrophobicContact CG1-CD2 3.6Å; I197-F211 HydrophobicContact CG1-CE2 3.91Å; I197-F211 HydrophobicContact CG1-CG 4.38Å; I197-L220 HydrophobicContact CG1-CD2 3.88Å; I197-L257 HydrophobicContact CD1-CB 3.89Å; I197-L257 WeakPolarHBondContact CD1-O 3.25Å; I197-V263 HydrophobicContact CG2-CB 4.18Å; I197-V263 HydrophobicContact CG2-CG2 3.72Å
198	Q	96.1	Very high	91	Very high	18 Å²	18	38 Å²	38	8%	0.084	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.6	171.8	-66.9	-176.8	-9.3	0	0	109	H200 V206 I207 Q208 L260 S261 V263	Q198-H200 PolarHBondContact O-CD2 3.27Å; Q198-H200 PolarHBondContact OE1-NE2 2.99Å; Q198-V206 HydrophobicContact CB-CG1 4Å; Q198-V206 HydrophobicContact CG-CG1 4.33Å; Q198-I207 CarbonylContact C-O 3.48Å; Q198-I207 WeakPolarHBondContact CA-O 3.3Å; Q198-Q208 HydrophobicContact CG-CB 4.27Å; Q198-Q208 HydrophobicContact CG-CG 4.21Å; Q198-L260 HydrophobicContact CG-CD1 4.12Å; Q198-S261 PolarHBondContact N-O 3.21Å; Q198-V263 PolarHBondContact O-N 2.84Å
199	F	96	Very high	91.6	Very high	3 Å²	3	35.2 Å²	35.2	1%	0.013	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	119.4	173.2	-58.3	-86.7	0	0	0	109.1	I197 W201 V206 I207 F211 L220 F223 I224 L236 V263	I197-F199 HydrophobicContact CB-CE2 4.06Å; I197-F199 HydrophobicContact CB-CZ 4.21Å; I197-F199 HydrophobicContact CG2-CD1 4.32Å; I197-F199 HydrophobicContact CG2-CD2 4.14Å; I197-F199 HydrophobicContact CG2-CE1 3.86Å; I197-F199 HydrophobicContact CG2-CE2 3.66Å; I197-F199 HydrophobicContact CG2-CG 4.45Å; I197-F199 HydrophobicContact CG2-CZ 3.51Å; F199-W201 HydrophobicContact CB-CE3 4.41Å; F199-W201 HydrophobicContact CB-CH2 3.82Å; F199-W201 HydrophobicContact CB-CZ3 3.5Å; F199-W201 VanDerWaalsContact CB-CZ3 3.5Å; F199-W201 VanDerWaalsContact O-CZ3 3.27Å; F199-W201 WeakPolarHBondContact O-CZ3 3.45Å; F199-V206 VanDerWaalsContact O-CA 3.31Å; F199-V206 WeakPolarHBondContact O-CA 3.38Å; F199-I207 HydrophobicContact CB-CB 4.38Å; F199-I207 WeakPolarHBondContact CD2-O 3.19Å; F199-I207 PolarHBondContact N-O 2.82Å; F199-I207 PolarHBondContact O-N 3.44Å; F199-F211 HydrophobicContact CE2-CE2 4.1Å; F199-F211 HydrophobicContact CE2-CZ 4.19Å; F199-F211 HydrophobicContact CZ-CE2 4.36Å; F199-F211 HydrophobicContact CZ-CZ 4.19Å; F199-L220 HydrophobicContact CE1-CB 4.33Å; F199-L220 HydrophobicContact CZ-CB 4.16Å; F199-L220 HydrophobicContact CZ-CD2 4.29Å; F199-F223 HydrophobicContact CD2-CD1 4.22Å; F199-F223 HydrophobicContact CD2-CE1 4.11Å; F199-F223 AromaticContact CE2-CD1 3.53Å; F199-F223 HydrophobicContact CE2-CD1 3.53Å; F199-F223 AromaticContact CE2-CE1 3.75Å; F199-F223 HydrophobicContact CE2-CE1 3.75Å; F199-F223 AromaticContact CZ-CD1 4Å; F199-F223 HydrophobicContact CZ-CD1 4Å; F199-I224 HydrophobicContact CB-CD1 4.12Å; F199-I224 HydrophobicContact CD1-CD1 3.67Å; F199-I224 HydrophobicContact CD1-CG1 3.84Å; F199-I224 HydrophobicContact CD2-CD1 3.84Å; F199-I224 HydrophobicContact CE1-CD1 3.95Å; F199-I224 HydrophobicContact CE1-CG1 3.72Å; F199-I224 HydrophobicContact CE2-CD1 4.12Å; F199-I224 HydrophobicContact CG-CD1 3.61Å; F199-I224 HydrophobicContact CG-CG1 4.29Å; F199-I224 HydrophobicContact CZ-CD1 4.15Å; F199-I224 HydrophobicContact CZ-CG1 4.07Å; F199-L236 HydrophobicContact CD1-CD2 4.29Å; F199-L236 HydrophobicContact CE1-CD1 3.98Å; F199-L236 HydrophobicContact CE1-CD2 4.45Å; F199-V263 CarbonylContact C-O 3.6Å; F199-V263 VanDerWaalsContact CA-O 3.25Å; F199-V263 WeakPolarHBondContact CA-O 3.05Å; F199-V263 HydrophobicContact CD1-CB 4.15Å; F199-V263 HydrophobicContact CD1-CG1 4.1Å; F199-V263 HydrophobicContact CE1-CB 4.42Å; F199-V263 HydrophobicContact CE1-CG1 4.25Å
200	H	94.7	Very high	91.9	Very high	30 Å²	30	33 Å²	33	14%	0.139	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.8	-176.3	-74.3	-107.5	0	0	0	110.6	Q198 V263 F264 Y265	Q198-H200 PolarHBondContact O-CD2 3.27Å; Q198-H200 PolarHBondContact OE1-NE2 2.99Å; H200-V263 PolarHBondContact N-O 2.94Å; H200-F264 HydrophobicContact CB-CD1 3.6Å; H200-F264 HydrophobicContact CB-CE1 3.68Å; H200-F264 HydrophobicContact CB-CG 4.37Å; H200-F264 HydrophobicContact CB-CZ 4.5Å; H200-Y265 PolarHBondContact O-N 3.42Å
201	W	92.7	Very high	92.5	Very high	18 Å²	18	30.4 Å²	30.4	7%	0.068	15%	0.152	C	C	.	.			trans	-107	166.5	169.4	-77.8	-101.5	0	0	0	111.3	F199 D203 N204 L205 I207 I224 Y265 A272 L276	F199-W201 HydrophobicContact CB-CE3 4.41Å; F199-W201 HydrophobicContact CB-CH2 3.82Å; F199-W201 HydrophobicContact CB-CZ3 3.5Å; F199-W201 VanDerWaalsContact CB-CZ3 3.5Å; F199-W201 VanDerWaalsContact O-CZ3 3.27Å; F199-W201 WeakPolarHBondContact O-CZ3 3.45Å; W201-D203 VanDerWaalsContact C-N 3.29Å; W201-D203 WeakPolarHBondContact CB-OD1 3.41Å; W201-D203 PolarHBondContact O-N 3.25Å; W201-N204 PolarHBondContact O-N 3.35Å; W201-L205 HydrophobicContact CB-CB 4.36Å; W201-L205 HydrophobicContact CD2-CD2 4.48Å; W201-L205 HydrophobicContact CE3-CD2 4.14Å; W201-L205 PolarHBondContact N-O 3.24Å; W201-I207 HydrophobicContact CH2-CB 4.36Å; W201-I207 HydrophobicContact CH2-CD1 3.49Å; W201-I207 VanDerWaalsContact CH2-CD1 3.49Å; W201-I207 HydrophobicContact CH2-CG1 3.92Å; W201-I207 HydrophobicContact CZ2-CD1 4.45Å; W201-I207 HydrophobicContact CZ3-CB 3.94Å; W201-I207 HydrophobicContact CZ3-CD1 3.71Å; W201-I207 HydrophobicContact CZ3-CG1 3.57Å; W201-I224 HydrophobicContact CH2-CD1 3.92Å; W201-Y265 HydrophobicContact CZ2-CD2 4.26Å; W201-Y265 AromaticContact NE1-CD1 3.92Å; W201-Y265 AromaticContact NE1-CG 3.69Å; W201-A272 HydrophobicContact CB-CB 3.95Å; W201-A272 HydrophobicContact CD2-CB 3.85Å; W201-A272 HydrophobicContact CG-CB 3.51Å; W201-L276 HydrophobicContact CH2-CD1 4.48Å; W201-L276 HydrophobicContact CH2-CD2 4.31Å; W201-L276 HydrophobicContact CZ2-CD1 4.31Å; W201-L276 HydrophobicContact CZ2-CD2 3.95Å; W201-L276 HydrophobicContact CZ2-CG 4.35Å
202	V	90.3	Very high	92.8	Very high	78 Å²	78	28.7 Å²	28.7	47%	0.473	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-22.9	-179.7	-72.4	0	0	0	0	114.6	N204 T268	V202-N204 PolarHBondContact O-N 3.32Å; V202-T268 HydrophobicContact CG1-CG2 3.38Å; V202-T268 WeakPolarHBondContact CG1-O 3.43Å; V202-T268 VanDerWaalsContact CG2-O 3.25Å; V202-T268 WeakPolarHBondContact CG2-O 3.38Å
203	D	89.7	Confident	93.1	Very high	46 Å²	46	26.5 Å²	26.5	25%	0.246	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	14.5	179.4	59.4	-0.9	0	0	0	113.2	W201 L205 P271 A272	W201-D203 VanDerWaalsContact C-N 3.29Å; W201-D203 WeakPolarHBondContact CB-OD1 3.41Å; W201-D203 PolarHBondContact O-N 3.25Å; D203-L205 PolarHBondContact O-N 3.09Å; D203-L205 WeakPolarHBondContact OD1-CB 3.4Å; D203-L205 PolarHBondContact OD1-N 3.13Å; D203-L205 VanDerWaalsContact OD1-N 3.13Å; D203-P271 HydrophobicContact CB-CB 4.41Å; D203-A272 VanDerWaalsContact OD2-CB 3.23Å; D203-A272 WeakPolarHBondContact OD2-CB 3.43Å; D203-A272 PolarHBondContact OD2-N 2.88Å
204	N	90.1	Very high	93.4	Very high	56 Å²	56	26.4 Å²	26.4	30%	0.299	13%	0.133	S	C	.	.	S	Bend	trans	65	13.6	-174.4	-55.7	-72.7	0	0	0	114.7	R131 R132 W201 V202	R131-N204 WeakPolarHBondContact CA-O 3.19Å; R132-N204 HydrophobicContact CB-CB 4.3Å; R132-N204 PolarHBondContact N-O 2.99Å; R132-N204 PolarHBondContact NH2-OD1 3.44Å; W201-N204 PolarHBondContact O-N 3.35Å; V202-N204 PolarHBondContact O-N 3.32Å
205	L	93.2	Very high	93.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	135	170.5	-165	103.3	0	0	0	110.3	I129 R131 W201 D203 I207 A272 L276 L281 A284	I129-L205 HydrophobicContact CD1-CD1 3.95Å; I129-L205 HydrophobicContact CD1-CD2 3.61Å; I129-L205 HydrophobicContact CD1-CG 4.08Å; I129-L205 HydrophobicContact CG1-CD1 4.05Å; I129-L205 HydrophobicContact CG1-CD2 4.05Å; I129-L205 HydrophobicContact CG1-CG 4.07Å; R131-L205 HydrophobicContact CG-CD1 4.08Å; W201-L205 HydrophobicContact CB-CB 4.36Å; W201-L205 HydrophobicContact CD2-CD2 4.48Å; W201-L205 HydrophobicContact CE3-CD2 4.14Å; W201-L205 PolarHBondContact N-O 3.24Å; D203-L205 PolarHBondContact O-N 3.09Å; D203-L205 WeakPolarHBondContact OD1-CB 3.4Å; D203-L205 PolarHBondContact OD1-N 3.13Å; D203-L205 VanDerWaalsContact OD1-N 3.13Å; L205-I207 HydrophobicContact CD2-CG1 4.28Å; L205-A272 HydrophobicContact CB-CB 3.97Å; L205-A272 HydrophobicContact CD2-CB 3.4Å; L205-A272 VanDerWaalsContact CD2-CB 3.4Å; L205-A272 HydrophobicContact CG-CB 4.21Å; L205-L276 HydrophobicContact CD2-CD1 3.46Å; L205-L276 VanDerWaalsContact CD2-CD1 3.46Å; L205-L281 HydrophobicContact CD1-CD1 3.76Å; L205-L281 HydrophobicContact CD2-CD1 4.42Å; L205-A284 HydrophobicContact CD1-CB 4.2Å
206	V	94.7	Very high	93.7	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.018	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.6	176.2	-175	0	0	0	0	109.4	I129 F130 Q198 F199	I129-V206 WeakPolarHBondContact CA-O 3.34Å; F130-V206 HydrophobicContact CD2-CB 4.39Å; F130-V206 HydrophobicContact CE1-CB 4.09Å; F130-V206 HydrophobicContact CE1-CG1 3.99Å; F130-V206 HydrophobicContact CE2-CB 3.92Å; F130-V206 HydrophobicContact CE2-CG1 4.33Å; F130-V206 HydrophobicContact CE2-CG2 4.21Å; F130-V206 HydrophobicContact CZ-CB 3.75Å; F130-V206 HydrophobicContact CZ-CG1 3.69Å; F130-V206 HydrophobicContact CZ-CG2 4.39Å; F130-V206 PolarHBondContact N-O 3.02Å; F130-V206 PolarHBondContact O-N 3.28Å; Q198-V206 HydrophobicContact CB-CG1 4Å; Q198-V206 HydrophobicContact CG-CG1 4.33Å; F199-V206 VanDerWaalsContact O-CA 3.31Å; F199-V206 WeakPolarHBondContact O-CA 3.38Å
207	I	95.5	Very high	93.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.7	165.9	-58.2	-178	0	0	0	107.6	F127 I129 Q198 F199 W201 L205 F223 L227 L276	F127-I207 HydrophobicContact CD2-CG2 4.4Å; I129-I207 HydrophobicContact CB-CG1 4.34Å; I129-I207 HydrophobicContact CD1-CD1 4.36Å; I129-I207 HydrophobicContact CD1-CG1 4.05Å; I129-I207 HydrophobicContact CG1-CG1 4.05Å; Q198-I207 CarbonylContact C-O 3.48Å; Q198-I207 WeakPolarHBondContact CA-O 3.3Å; F199-I207 HydrophobicContact CB-CB 4.38Å; F199-I207 WeakPolarHBondContact CD2-O 3.19Å; F199-I207 PolarHBondContact N-O 2.82Å; F199-I207 PolarHBondContact O-N 3.44Å; W201-I207 HydrophobicContact CH2-CB 4.36Å; W201-I207 HydrophobicContact CH2-CD1 3.49Å; W201-I207 VanDerWaalsContact CH2-CD1 3.49Å; W201-I207 HydrophobicContact CH2-CG1 3.92Å; W201-I207 HydrophobicContact CZ2-CD1 4.45Å; W201-I207 HydrophobicContact CZ3-CB 3.94Å; W201-I207 HydrophobicContact CZ3-CD1 3.71Å; W201-I207 HydrophobicContact CZ3-CG1 3.57Å; L205-I207 HydrophobicContact CD2-CG1 4.28Å; I207-F223 HydrophobicContact CG2-CE1 3.81Å; I207-F223 HydrophobicContact CG2-CZ 4.04Å; I207-L227 HydrophobicContact CD1-CD1 3.89Å; I207-L227 HydrophobicContact CG2-CD1 4.27Å; I207-L276 HydrophobicContact CD1-CD1 3.76Å; I207-L276 HydrophobicContact CD1-CD2 3.98Å
208	Q	95.5	Very high	93.6	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	132.3	172.1	179.5	173.2	-62.4	0	0	109.2	F127 V128 F130 I196 I197 Q198 A292	F127-Q208 CarbonylContact C-O 3.43Å; F127-Q208 WeakPolarHBondContact CA-O 3.41Å; F127-Q208 WeakPolarHBondContact CB-O 3.4Å; V128-Q208 HydrophobicContact CG2-CB 3.84Å; V128-Q208 HydrophobicContact CG2-CG 4.45Å; V128-Q208 PolarHBondContact N-O 3.29Å; V128-Q208 PolarHBondContact O-N 2.86Å; F130-Q208 HydrophobicContact CE1-CB 4.29Å; I196-Q208 HydrophobicContact CG2-CG 3.44Å; I196-Q208 VanDerWaalsContact CG2-CG 3.44Å; I197-Q208 WeakPolarHBondContact O-CA 3.49Å; Q198-Q208 HydrophobicContact CG-CB 4.27Å; Q198-Q208 HydrophobicContact CG-CG 4.21Å; Q208-A292 PolarHBondContact NE2-O 3.24Å
209	A	95.7	Very high	93.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	151.1	175.1	0	0	0	0	0	111.3	R125 F127 I197 F211 F223	R125-A209 HydrophobicContact CB-CB 4.4Å; F127-A209 HydrophobicContact CB-CB 3.78Å; I197-A209 PolarHBondContact N-O 2.84Å; I197-A209 PolarHBondContact O-N 3.15Å; A209-F211 HydrophobicContact CB-CD2 4.39Å; A209-F211 HydrophobicContact CB-CE2 3.59Å; A209-F211 HydrophobicContact CB-CZ 4.17Å; A209-F223 HydrophobicContact CB-CD1 4.32Å; A209-F223 HydrophobicContact CB-CE1 3.55Å; A209-F223 HydrophobicContact CB-CE2 4.26Å; A209-F223 HydrophobicContact CB-CZ 3.49Å; A209-F223 VanDerWaalsContact CB-CZ 3.49Å
210	C	94.7	Very high	93.5	Very high	8 Å²	8	28.9 Å²	28.9	5%	0.054	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	138.8	175.1	-69.6	0	0	0	0	110.8	R125 A195	R125-C210 PolarHBondContact O-N 2.79Å; A195-C210 CarbonylContact O-C 3.56Å; A195-C210 WeakPolarHBondContact O-CA 3.27Å
211	F	94.5	Very high	93.5	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.018	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	164	178.3	-64	-99.6	0	0	0	108.8	R194 A195 I197 F199 A209 E215 L220 F223 L252	R194-F211 CarbonylContact C-O 3.48Å; R194-F211 WeakPolarHBondContact CA-O 3.16Å; A195-F211 PolarHBondContact N-O 3.43Å; A195-F211 PolarHBondContact O-N 2.94Å; I197-F211 HydrophobicContact CB-CD2 3.99Å; I197-F211 HydrophobicContact CB-CE2 3.85Å; I197-F211 HydrophobicContact CG1-CD2 3.6Å; I197-F211 HydrophobicContact CG1-CE2 3.91Å; I197-F211 HydrophobicContact CG1-CG 4.38Å; F199-F211 HydrophobicContact CE2-CE2 4.1Å; F199-F211 HydrophobicContact CE2-CZ 4.19Å; F199-F211 HydrophobicContact CZ-CE2 4.36Å; F199-F211 HydrophobicContact CZ-CZ 4.19Å; A209-F211 HydrophobicContact CB-CD2 4.39Å; A209-F211 HydrophobicContact CB-CE2 3.59Å; A209-F211 HydrophobicContact CB-CZ 4.17Å; F211-E215 VanDerWaalsContact CD1-OE2 3.27Å; F211-E215 WeakPolarHBondContact CD1-OE2 3.26Å; F211-L220 HydrophobicContact CD1-CD2 3.61Å; F211-L220 HydrophobicContact CD2-CD2 4.02Å; F211-L220 HydrophobicContact CE1-CD2 3.4Å; F211-L220 VanDerWaalsContact CE1-CD2 3.4Å; F211-L220 HydrophobicContact CE2-CD2 3.84Å; F211-L220 HydrophobicContact CG-CD2 3.93Å; F211-L220 HydrophobicContact CZ-CD2 3.55Å; F211-F223 HydrophobicContact CE1-CB 4.28Å; F211-F223 HydrophobicContact CZ-CB 4.02Å; F211-F223 AromaticContact CZ-CD1 3.92Å; F211-F223 HydrophobicContact CZ-CD1 3.92Å; F211-F223 AromaticContact CZ-CG 3.94Å; F211-F223 HydrophobicContact CZ-CG 3.94Å; F211-L252 HydrophobicContact CB-CD1 3.54Å; F211-L252 HydrophobicContact CG-CD1 4.18Å
212	L	92.4	Very high	93.5	Very high	81 Å²	81	32.2 Å²	32.2	42%	0.424	17%	0.166	S	C	.	.			trans	-83	142.7	168	-60.6	167.9	0	0	0	110.2	N214 E215	L212-N214 PolarHBondContact O-N 3.47Å; L212-N214 VanDerWaalsContact O-N 3.11Å; L212-E215 HydrophobicContact CB-CG 4.02Å; L212-E215 WeakPolarHBondContact CB-OE1 3.37Å; L212-E215 WeakPolarHBondContact CG-OE1 3.3Å; L212-E215 PolarHBondContact N-OE1 3.25Å; L212-E215 WeakPolarHBondContact O-CB 3.48Å; L212-E215 PolarHBondContact O-N 3.01Å
213	P	90.9	Very high	93.7	Very high	7 Å²	7	28.8 Å²	28.8	5%	0.045	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-30.7	177.4	-28.4	36.7	0	0	0	114.5	Y192 A195 E215 L252 I253 V258	Y192-P213 VanDerWaalsContact O-CG 3.3Å; Y192-P213 WeakPolarHBondContact O-CG 3.37Å; A195-P213 HydrophobicContact CB-CG 4.48Å; P213-E215 VanDerWaalsContact C-N 3.33Å; P213-L252 WeakPolarHBondContact O-CB 3.47Å; P213-L252 PolarHBondContact O-N 2.97Å; P213-I253 HydrophobicContact CB-CD1 3.77Å; P213-I253 HydrophobicContact CB-CG1 3.68Å; P213-I253 WeakPolarHBondContact O-CG1 3.27Å; P213-I253 PolarHBondContact O-N 3.06Å; P213-V258 HydrophobicContact CB-CG1 4.2Å; P213-V258 HydrophobicContact CB-CG2 4Å; P213-V258 HydrophobicContact CG-CG1 4.16Å
214	N	90.9	Very high	93.8	Very high	96 Å²	96	26.6 Å²	26.6	51%	0.513	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-2.7	-179.5	-62.9	-12.1	0	0	0	113.3	L212 I253	L212-N214 PolarHBondContact O-N 3.47Å; L212-N214 VanDerWaalsContact O-N 3.11Å; N214-I253 VanDerWaalsContact OD1-CD1 3.3Å; N214-I253 WeakPolarHBondContact OD1-CD1 3.42Å
215	E	92.9	Very high	93.9	Very high	36 Å²	36	28.5 Å²	28.5	17%	0.168	14%	0.14	C	C	.	.	S	Bend	trans	-64.8	153.3	172.7	-84.4	173.3	-129.6	0	0	110.8	F211 L212 P213 A219 T251 L252	F211-E215 VanDerWaalsContact CD1-OE2 3.27Å; F211-E215 WeakPolarHBondContact CD1-OE2 3.26Å; L212-E215 HydrophobicContact CB-CG 4.02Å; L212-E215 WeakPolarHBondContact CB-OE1 3.37Å; L212-E215 WeakPolarHBondContact CG-OE1 3.3Å; L212-E215 PolarHBondContact N-OE1 3.25Å; L212-E215 WeakPolarHBondContact O-CB 3.48Å; L212-E215 PolarHBondContact O-N 3.01Å; P213-E215 VanDerWaalsContact C-N 3.33Å; E215-A219 HydrophobicContact CB-CB 4.35Å; E215-A219 WeakPolarHBondContact OE2-CB 3.39Å; E215-T251 CarbonylContact O-C 3.56Å; E215-T251 VanDerWaalsContact O-CA 3.23Å; E215-T251 WeakPolarHBondContact O-CA 3.47Å; E215-L252 HydrophobicContact CB-CD1 4.42Å; E215-L252 HydrophobicContact CB-CG 4.5Å; E215-L252 WeakPolarHBondContact O-CG 3.48Å; E215-L252 PolarHBondContact O-N 2.98Å
216	K	95	Very high	93.8	Very high	106 Å²	106	33 Å²	33	46%	0.461	17%	0.165	S	C	.	.	B	Isolated β-bridge	trans	-83	154.7	177.3	-68.6	-178	172.1	-178.5	0	110.7	S218 A219 N249 I250	K216-S218 WeakPolarHBondContact CB-OG 3.49Å; K216-S218 PolarHBondContact O-N 3.33Å; K216-S218 VanDerWaalsContact O-N 3.1Å; K216-A219 VanDerWaalsContact O-CB 3.28Å; K216-A219 WeakPolarHBondContact O-CB 3.42Å; K216-A219 PolarHBondContact O-N 2.9Å; K216-N249 WeakPolarHBondContact CD-O 3.43Å; K216-N249 WeakPolarHBondContact CE-O 3.21Å; K216-I250 CarbonylContact C-O 3.58Å; K216-I250 VanDerWaalsContact CA-O 3.31Å; K216-I250 WeakPolarHBondContact CA-O 3.3Å
217	V	95.6	Very high	93.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-55.5	-29.1	172	167.9	0	0	0	0	111.7	A219 L220 Y221 L245 D247 I250 L252 A255 L257	V217-A219 PolarHBondContact O-N 2.75Å; V217-L220 WeakPolarHBondContact O-CB 3.47Å; V217-L220 PolarHBondContact O-N 2.75Å; V217-Y221 HydrophobicContact CG1-CD2 3.95Å; V217-Y221 HydrophobicContact CG1-CE2 3.71Å; V217-Y221 WeakPolarHBondContact O-CD2 3.2Å; V217-Y221 PolarHBondContact O-N 3.34Å; V217-L245 HydrophobicContact CG1-CB 3.99Å; V217-D247 WeakPolarHBondContact CG1-O 3.32Å; V217-I250 HydrophobicContact CB-CG1 4.36Å; V217-I250 HydrophobicContact CG2-CD1 4.2Å; V217-I250 HydrophobicContact CG2-CG1 3.7Å; V217-I250 PolarHBondContact N-O 2.81Å; V217-L252 HydrophobicContact CG2-CD2 4.3Å; V217-A255 HydrophobicContact CG2-CB 3.97Å; V217-L257 HydrophobicContact CG2-CD1 4.41Å
218	S	94.9	Very high	93.3	Very high	31 Å²	31	33.9 Å²	33.9	22%	0.217	17%	0.169	C	C	.	.	H	α-helix	trans	-52.4	-34.5	171.6	63.3	0	0	0	0	113.8	K216 L220 Y221 K222 K248	K216-S218 WeakPolarHBondContact CB-OG 3.49Å; K216-S218 PolarHBondContact O-N 3.33Å; K216-S218 VanDerWaalsContact O-N 3.1Å; S218-L220 VanDerWaalsContact C-N 3.3Å; S218-L220 PolarHBondContact O-N 3.13Å; S218-Y221 PolarHBondContact O-N 2.9Å; S218-K222 WeakPolarHBondContact O-CG 3.46Å; S218-K222 PolarHBondContact O-N 2.8Å; S218-K248 WeakPolarHBondContact CB-O 3.46Å; S218-K248 PolarHBondContact N-O 3.04Å
219	A	94.3	Very high	92.8	Very high	6 Å²	6	40 Å²	40	5%	0.05	20%	0.201	C	C	.	.	H	α-helix	trans	-66.5	-31.2	178.6	0	0	0	0	0	112.5	R125 E215 K216 V217 F223	R125-A219 PolarHBondContact NH1-O 2.88Å; E215-A219 HydrophobicContact CB-CB 4.35Å; E215-A219 WeakPolarHBondContact OE2-CB 3.39Å; K216-A219 VanDerWaalsContact O-CB 3.28Å; K216-A219 WeakPolarHBondContact O-CB 3.42Å; K216-A219 PolarHBondContact O-N 2.9Å; V217-A219 PolarHBondContact O-N 2.75Å; A219-F223 WeakPolarHBondContact O-CB 3.15Å; A219-F223 PolarHBondContact O-N 2.79Å
220	L	94.8	Very high	91.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.2	-44.3	173.8	-50.9	-174	0	0	0	111	I197 F199 F211 V217 S218 F223 I224 L236 L245 L252 L257	I197-L220 HydrophobicContact CG1-CD2 3.88Å; F199-L220 HydrophobicContact CE1-CB 4.33Å; F199-L220 HydrophobicContact CZ-CB 4.16Å; F199-L220 HydrophobicContact CZ-CD2 4.29Å; F211-L220 HydrophobicContact CD1-CD2 3.61Å; F211-L220 HydrophobicContact CD2-CD2 4.02Å; F211-L220 HydrophobicContact CE1-CD2 3.4Å; F211-L220 VanDerWaalsContact CE1-CD2 3.4Å; F211-L220 HydrophobicContact CE2-CD2 3.84Å; F211-L220 HydrophobicContact CG-CD2 3.93Å; F211-L220 HydrophobicContact CZ-CD2 3.55Å; V217-L220 WeakPolarHBondContact O-CB 3.47Å; V217-L220 PolarHBondContact O-N 2.75Å; S218-L220 VanDerWaalsContact C-N 3.3Å; S218-L220 PolarHBondContact O-N 3.13Å; L220-F223 WeakPolarHBondContact O-CB 3.5Å; L220-F223 PolarHBondContact O-N 3.07Å; L220-I224 PolarHBondContact O-N 2.89Å; L220-L236 HydrophobicContact CB-CD1 4.08Å; L220-L245 HydrophobicContact CD1-CD1 4.33Å; L220-L252 HydrophobicContact CD1-CD2 3.71Å; L220-L252 HydrophobicContact CD2-CD1 4.3Å; L220-L252 HydrophobicContact CD2-CD2 3.91Å; L220-L252 HydrophobicContact CG-CD2 3.85Å; L220-L257 HydrophobicContact CD1-CD1 3.68Å
221	Y	94.5	Very high	91.1	Very high	21 Å²	21	47.3 Å²	47.3	8%	0.082	25%	0.247	C	C	.	.	H	α-helix	trans	-64.1	-44.9	176.6	-80.3	-85.5	0	0	0	111.4	V217 S218 F223 I224 H225 F234 L236 L245 K248	V217-Y221 HydrophobicContact CG1-CD2 3.95Å; V217-Y221 HydrophobicContact CG1-CE2 3.71Å; V217-Y221 WeakPolarHBondContact O-CD2 3.2Å; V217-Y221 PolarHBondContact O-N 3.34Å; S218-Y221 PolarHBondContact O-N 2.9Å; Y221-F223 VanDerWaalsContact C-N 3.32Å; Y221-F223 PolarHBondContact O-N 3.38Å; Y221-I224 PolarHBondContact O-N 3.49Å; Y221-H225 VanDerWaalsContact O-CB 3.3Å; Y221-H225 WeakPolarHBondContact O-CB 3.38Å; Y221-H225 PolarHBondContact O-N 3.37Å; Y221-F234 HydrophobicContact CD1-CD2 4.26Å; Y221-F234 AromaticContact CD1-CE2 3.57Å; Y221-F234 HydrophobicContact CD1-CE2 3.57Å; Y221-F234 AromaticContact CD1-CZ 3.92Å; Y221-F234 HydrophobicContact CD1-CZ 3.92Å; Y221-F234 HydrophobicContact CE1-CD2 4.33Å; Y221-F234 HydrophobicContact CE1-CE2 4.04Å; Y221-F234 HydrophobicContact CG-CE2 4.5Å; Y221-F234 WeakPolarHBondContact O-CZ 3.29Å; Y221-L236 HydrophobicContact CD1-CD1 4.23Å; Y221-L236 HydrophobicContact CD1-CG 4.34Å; Y221-L236 HydrophobicContact CD2-CD1 4.21Å; Y221-L236 HydrophobicContact CE1-CB 4.34Å; Y221-L236 HydrophobicContact CE1-CD1 4.2Å; Y221-L236 HydrophobicContact CE1-CG 3.92Å; Y221-L236 HydrophobicContact CE2-CB 4.47Å; Y221-L236 HydrophobicContact CE2-CD1 4.18Å; Y221-L236 HydrophobicContact CE2-CG 4.5Å; Y221-L236 HydrophobicContact CG-CD1 4.23Å; Y221-L236 PolarHBondContact OH-N 3.21Å; Y221-L245 HydrophobicContact CE2-CB 4.36Å; Y221-L245 VanDerWaalsContact CE2-O 3.3Å; Y221-L245 WeakPolarHBondContact CE2-O 3.13Å; Y221-L245 PolarHBondContact OH-O 2.84Å; Y221-K248 HydrophobicContact CD2-CD 4.46Å; Y221-K248 HydrophobicContact CD2-CG 4.16Å; Y221-K248 HydrophobicContact CE2-CG 4.24Å
222	K	93.2	Very high	90.4	Very high	96 Å²	96	52.4 Å²	52.4	42%	0.417	27%	0.267	S	S	.	.	H	α-helix	trans	-58.9	-44.5	174.9	-71.8	-176.5	-177.7	-173.3	0	111.5	D120 S218 I224 H225 D226	D120-K222 IonicContact OD2-NZ 2.58Å; D120-K222 PolarHBondContact OD2-NZ 2.98Å; S218-K222 WeakPolarHBondContact O-CG 3.46Å; S218-K222 PolarHBondContact O-N 2.8Å; K222-I224 PolarHBondContact O-N 3.43Å; K222-H225 WeakPolarHBondContact O-CB 3.39Å; K222-H225 PolarHBondContact O-N 3.19Å; K222-D226 PolarHBondContact O-N 2.85Å
223	F	94	Very high	90.2	Very high	7 Å²	7	56.3 Å²	56.3	3%	0.031	29%	0.288	C	S	.	.	H	α-helix	trans	-53.8	-51.6	177.8	-176.3	-123.7	0	0	0	113.1	R125 F127 F199 I207 A209 F211 A219 L220 Y221 H225 D226 L227	R125-F223 HydrophobicContact CB-CE2 4.27Å; R125-F223 VanDerWaalsContact CD-CE2 3.42Å; R125-F223 HydrophobicContact CG-CD2 4.48Å; R125-F223 HydrophobicContact CG-CE2 4.49Å; R125-F223 VanDerWaalsContact NH1-CB 3.32Å; F127-F223 HydrophobicContact CB-CE2 4.24Å; F127-F223 HydrophobicContact CB-CZ 3.68Å; F127-F223 HydrophobicContact CD1-CE2 4.16Å; F127-F223 HydrophobicContact CD1-CZ 4.3Å; F127-F223 HydrophobicContact CD2-CZ 4.41Å; F127-F223 HydrophobicContact CG-CE2 4.23Å; F127-F223 AromaticContact CG-CZ 3.9Å; F127-F223 HydrophobicContact CG-CZ 3.9Å; F199-F223 HydrophobicContact CD2-CD1 4.22Å; F199-F223 HydrophobicContact CD2-CE1 4.11Å; F199-F223 AromaticContact CE2-CD1 3.53Å; F199-F223 HydrophobicContact CE2-CD1 3.53Å; F199-F223 AromaticContact CE2-CE1 3.75Å; F199-F223 HydrophobicContact CE2-CE1 3.75Å; F199-F223 AromaticContact CZ-CD1 4Å; F199-F223 HydrophobicContact CZ-CD1 4Å; I207-F223 HydrophobicContact CG2-CE1 3.81Å; I207-F223 HydrophobicContact CG2-CZ 4.04Å; A209-F223 HydrophobicContact CB-CD1 4.32Å; A209-F223 HydrophobicContact CB-CE1 3.55Å; A209-F223 HydrophobicContact CB-CE2 4.26Å; A209-F223 HydrophobicContact CB-CZ 3.49Å; A209-F223 VanDerWaalsContact CB-CZ 3.49Å; F211-F223 HydrophobicContact CE1-CB 4.28Å; F211-F223 HydrophobicContact CZ-CB 4.02Å; F211-F223 AromaticContact CZ-CD1 3.92Å; F211-F223 HydrophobicContact CZ-CD1 3.92Å; F211-F223 AromaticContact CZ-CG 3.94Å; F211-F223 HydrophobicContact CZ-CG 3.94Å; A219-F223 WeakPolarHBondContact O-CB 3.15Å; A219-F223 PolarHBondContact O-N 2.79Å; L220-F223 WeakPolarHBondContact O-CB 3.5Å; L220-F223 PolarHBondContact O-N 3.07Å; Y221-F223 VanDerWaalsContact C-N 3.32Å; Y221-F223 PolarHBondContact O-N 3.38Å; F223-H225 VanDerWaalsContact C-N 3.35Å; F223-D226 PolarHBondContact O-N 3.3Å; F223-L227 HydrophobicContact CD1-CD1 4.18Å; F223-L227 HydrophobicContact CD2-CD1 4.34Å; F223-L227 HydrophobicContact CE1-CD1 3.66Å; F223-L227 HydrophobicContact CE2-CD1 3.86Å; F223-L227 HydrophobicContact CE2-CG 4.37Å; F223-L227 HydrophobicContact CZ-CD1 3.49Å; F223-L227 VanDerWaalsContact CZ-CD1 3.49Å; F223-L227 HydrophobicContact CZ-CG 4.46Å; F223-L227 WeakPolarHBondContact O-CG 3.47Å; F223-L227 PolarHBondContact O-N 3.48Å
224	I	92.6	Very high	90.3	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68.3	-40.2	-177.6	-64.7	-62.8	0	0	0	110.3	F199 W201 L220 Y221 K222 D226 L227 Q228 F234 Y265	F199-I224 HydrophobicContact CB-CD1 4.12Å; F199-I224 HydrophobicContact CD1-CD1 3.67Å; F199-I224 HydrophobicContact CD1-CG1 3.84Å; F199-I224 HydrophobicContact CD2-CD1 3.84Å; F199-I224 HydrophobicContact CE1-CD1 3.95Å; F199-I224 HydrophobicContact CE1-CG1 3.72Å; F199-I224 HydrophobicContact CE2-CD1 4.12Å; F199-I224 HydrophobicContact CG-CD1 3.61Å; F199-I224 HydrophobicContact CG-CG1 4.29Å; F199-I224 HydrophobicContact CZ-CD1 4.15Å; F199-I224 HydrophobicContact CZ-CG1 4.07Å; W201-I224 HydrophobicContact CH2-CD1 3.92Å; L220-I224 PolarHBondContact O-N 2.89Å; Y221-I224 PolarHBondContact O-N 3.49Å; K222-I224 PolarHBondContact O-N 3.43Å; I224-D226 VanDerWaalsContact C-N 3.31Å; I224-D226 PolarHBondContact O-N 2.99Å; I224-L227 PolarHBondContact O-N 3.31Å; I224-L227 VanDerWaalsContact O-N 3.16Å; I224-Q228 HydrophobicContact CG2-CG 4.48Å; I224-Q228 VanDerWaalsContact O-CG 3.27Å; I224-Q228 WeakPolarHBondContact O-CG 3.39Å; I224-Q228 PolarHBondContact O-N 3.31Å; I224-Q228 VanDerWaalsContact O-N 3.14Å; I224-F234 HydrophobicContact CB-CE2 3.85Å; I224-F234 HydrophobicContact CB-CZ 3.73Å; I224-F234 HydrophobicContact CG2-CD2 4.21Å; I224-F234 HydrophobicContact CG2-CE1 4.19Å; I224-F234 HydrophobicContact CG2-CE2 3.63Å; I224-F234 HydrophobicContact CG2-CZ 3.62Å; I224-Y265 HydrophobicContact CG2-CD2 4.34Å; I224-Y265 HydrophobicContact CG2-CE2 4.16Å
225	H	91.9	Very high	90.5	Very high	96 Å²	96	58.4 Å²	58.4	44%	0.444	29%	0.292	S	S	.	.	H	α-helix	trans	-58.6	-40.9	175	-178	-83.7	0	0	0	112.2	Y221 K222 F223 L227 Q228 F234	Y221-H225 VanDerWaalsContact O-CB 3.3Å; Y221-H225 WeakPolarHBondContact O-CB 3.38Å; Y221-H225 PolarHBondContact O-N 3.37Å; K222-H225 WeakPolarHBondContact O-CB 3.39Å; K222-H225 PolarHBondContact O-N 3.19Å; F223-H225 VanDerWaalsContact C-N 3.35Å; H225-L227 VanDerWaalsContact C-N 3.26Å; H225-L227 PolarHBondContact O-N 3.47Å; H225-Q228 WeakPolarHBondContact O-CB 3.18Å; H225-Q228 PolarHBondContact O-N 3.37Å; H225-F234 HydrophobicContact CB-CE1 4.24Å; H225-F234 HydrophobicContact CB-CZ 4.45Å
226	D	90.7	Very high	90.6	Very high	95 Å²	95	56.8 Å²	56.8	51%	0.508	29%	0.285	S	S	.	.	H	α-helix	trans	-70	-22.1	179	-61.8	-21.5	0	0	0	113.4	K222 F223 I224 R277	K222-D226 PolarHBondContact O-N 2.85Å; F223-D226 PolarHBondContact O-N 3.3Å; I224-D226 VanDerWaalsContact C-N 3.31Å; I224-D226 PolarHBondContact O-N 2.99Å; D226-R277 PolarHBondContact O-NE 3.31Å
227	L	90.5	Very high	90.6	Very high	7 Å²	7	52.8 Å²	52.8	4%	0.037	27%	0.267	C	S	.	.	H	α-helix	trans	-88.8	-13.5	175.5	-64.9	176.2	0	0	0	113.1	F127 I207 F223 I224 H225 L276 R277 V280	F127-L227 HydrophobicContact CE2-CD2 4.25Å; F127-L227 HydrophobicContact CZ-CD2 4.04Å; I207-L227 HydrophobicContact CD1-CD1 3.89Å; I207-L227 HydrophobicContact CG2-CD1 4.27Å; F223-L227 HydrophobicContact CD1-CD1 4.18Å; F223-L227 HydrophobicContact CD2-CD1 4.34Å; F223-L227 HydrophobicContact CE1-CD1 3.66Å; F223-L227 HydrophobicContact CE2-CD1 3.86Å; F223-L227 HydrophobicContact CE2-CG 4.37Å; F223-L227 HydrophobicContact CZ-CD1 3.49Å; F223-L227 VanDerWaalsContact CZ-CD1 3.49Å; F223-L227 HydrophobicContact CZ-CG 4.46Å; F223-L227 WeakPolarHBondContact O-CG 3.47Å; F223-L227 PolarHBondContact O-N 3.48Å; I224-L227 PolarHBondContact O-N 3.31Å; I224-L227 VanDerWaalsContact O-N 3.16Å; H225-L227 VanDerWaalsContact C-N 3.26Å; H225-L227 PolarHBondContact O-N 3.47Å; L227-L276 HydrophobicContact CB-CD2 4.07Å; L227-R277 WeakPolarHBondContact O-CG 3.35Å; L227-R277 PolarHBondContact O-N 3.29Å; L227-V280 HydrophobicContact CD2-CG1 4.45Å; L227-V280 HydrophobicContact CD2-CG2 3.87Å
228	Q	89.5	Confident	90.6	Very high	14 Å²	14	54.3 Å²	54.3	7%	0.065	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-78	143.2	179.5	-78	172.2	-15.6	0	0	111.8	I224 H225 F234 Y265 V275	I224-Q228 HydrophobicContact CG2-CG 4.48Å; I224-Q228 VanDerWaalsContact O-CG 3.27Å; I224-Q228 WeakPolarHBondContact O-CG 3.39Å; I224-Q228 PolarHBondContact O-N 3.31Å; I224-Q228 VanDerWaalsContact O-N 3.14Å; H225-Q228 WeakPolarHBondContact O-CB 3.18Å; H225-Q228 PolarHBondContact O-N 3.37Å; Q228-F234 VanDerWaalsContact NE2-CD1 3.31Å; Q228-F234 VanDerWaalsContact OE1-CE1 3.31Å; Q228-Y265 PolarHBondContact NE2-OH 3.18Å; Q228-Y265 VanDerWaalsContact NE2-OH 3.14Å; Q228-V275 VanDerWaalsContact CA-O 3.28Å; Q228-V275 WeakPolarHBondContact CA-O 3.31Å; Q228-V275 HydrophobicContact CG-CG1 3.57Å
229	N	85.3	Confident	90.5	Very high	130 Å²	130	56.1 Å²	56.1	70%	0.695	29%	0.286	S	S	*	.	S	Bend	trans	-86.5	-22.6	169	-169.6	46.2	0	0	0	112.1	V275 R277	N229-V275 PolarHBondContact N-O 2.98Å; N229-R277 HydrophobicContact CB-CG 3.88Å
230	S	76.7	Confident	90.1	Very high	39 Å²	39	61.7 Å²	61.7	27%	0.273	32%	0.322	S	S	.	.	S	Bend	trans	-124	142.5	-173.4	178	0	0	0	0	110.7	Y232	S230-Y232 VanDerWaalsContact CB-CD2 3.47Å; S230-Y232 PolarHBondContact O-N 3.44Å; S230-Y232 VanDerWaalsContact OG-CD2 3.25Å; S230-Y232 WeakPolarHBondContact OG-CD2 3.5Å; S230-Y232 WeakPolarHBondContact OG-CE2 3.27Å
231	T	78	Confident	89.8	Confident	121 Å²	121	67 Å²	67	74%	0.742	36%	0.356	S	S	*	.			trans	-80.3	63	177.4	57.8	0	0	0	0	110.7
232	Y	80.4	Confident	89.6	Confident	111 Å²	111	71.3 Å²	71.3	44%	0.435	38%	0.375	S	S	.	.			trans	-80.2	137.6	173.3	-72.4	-66.5	0	0	0	110.6	S230 F234	S230-Y232 VanDerWaalsContact CB-CD2 3.47Å; S230-Y232 PolarHBondContact O-N 3.44Å; S230-Y232 VanDerWaalsContact OG-CD2 3.25Å; S230-Y232 WeakPolarHBondContact OG-CD2 3.5Å; S230-Y232 WeakPolarHBondContact OG-CE2 3.27Å; Y232-F234 WeakPolarHBondContact O-CD1 3.25Å; Y232-F234 PolarHBondContact O-N 2.84Å
233	D	88.4	Confident	89.7	Confident	163 Å²	163	71.9 Å²	71.9	87%	0.872	38%	0.383	S	S	*	.			trans	-70.3	113.6	168	-74.1	-26.4	0	0	0	109.3
234	F	92.5	Very high	89.7	Confident	27 Å²	27	75 Å²	75	12%	0.118	40%	0.396	C	S	.	.			trans	-123.6	157.8	-179.5	73.5	-88.2	0	0	0	112.2	Y221 I224 H225 Q228 Y232 L236 Y265 H266	Y221-F234 HydrophobicContact CD1-CD2 4.26Å; Y221-F234 AromaticContact CD1-CE2 3.57Å; Y221-F234 HydrophobicContact CD1-CE2 3.57Å; Y221-F234 AromaticContact CD1-CZ 3.92Å; Y221-F234 HydrophobicContact CD1-CZ 3.92Å; Y221-F234 HydrophobicContact CE1-CD2 4.33Å; Y221-F234 HydrophobicContact CE1-CE2 4.04Å; Y221-F234 HydrophobicContact CG-CE2 4.5Å; Y221-F234 WeakPolarHBondContact O-CZ 3.29Å; I224-F234 HydrophobicContact CB-CE2 3.85Å; I224-F234 HydrophobicContact CB-CZ 3.73Å; I224-F234 HydrophobicContact CG2-CD2 4.21Å; I224-F234 HydrophobicContact CG2-CE1 4.19Å; I224-F234 HydrophobicContact CG2-CE2 3.63Å; I224-F234 HydrophobicContact CG2-CZ 3.62Å; H225-F234 HydrophobicContact CB-CE1 4.24Å; H225-F234 HydrophobicContact CB-CZ 4.45Å; Q228-F234 VanDerWaalsContact NE2-CD1 3.31Å; Q228-F234 VanDerWaalsContact OE1-CE1 3.31Å; Y232-F234 WeakPolarHBondContact O-CD1 3.25Å; Y232-F234 PolarHBondContact O-N 2.84Å; F234-L236 HydrophobicContact CD2-CD2 4.07Å; F234-L236 HydrophobicContact CD2-CG 4.23Å; F234-L236 HydrophobicContact CE2-CD1 4.33Å; F234-L236 HydrophobicContact CE2-CD2 4.04Å; F234-L236 HydrophobicContact CE2-CG 4.01Å; F234-Y265 HydrophobicContact CB-CD2 4.31Å; F234-Y265 HydrophobicContact CB-CE1 4.37Å; F234-Y265 HydrophobicContact CB-CE2 3.4Å; F234-Y265 VanDerWaalsContact CB-CZ 3.44Å; F234-Y265 WeakPolarHBondContact CB-OH 3.3Å; F234-Y265 HydrophobicContact CD1-CE2 4.32Å; F234-Y265 HydrophobicContact CD2-CD2 4.16Å; F234-Y265 AromaticContact CD2-CE2 3.73Å; F234-Y265 HydrophobicContact CD2-CE2 3.73Å; F234-Y265 HydrophobicContact CG-CD2 4.43Å; F234-Y265 AromaticContact CG-CE2 3.57Å; F234-Y265 HydrophobicContact CG-CE2 3.57Å; F234-H266 CarbonylContact C-O 3.58Å; F234-H266 VanDerWaalsContact CA-O 3.29Å; F234-H266 WeakPolarHBondContact CA-O 3.27Å; F234-H266 WeakPolarHBondContact CB-O 3.46Å
235	K	94.3	Very high	89.8	Confident	121 Å²	121	75.3 Å²	75.3	53%	0.526	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	150.8	172.8	-63.8	-178.4	-177.5	177.3	0	109.5	F244 H266	K235-F244 HydrophobicContact CB-CD1 4Å; K235-F244 HydrophobicContact CB-CE1 4.22Å; K235-F244 HydrophobicContact CD-CD1 4.34Å; K235-H266 HydrophobicContact CB-CB 4.32Å; K235-H266 PolarHBondContact N-O 3.18Å; K235-H266 WeakPolarHBondContact O-CB 3.41Å; K235-H266 PolarHBondContact O-N 2.94Å
236	L	95.8	Very high	89.7	Confident	1 Å²	1	75.1 Å²	75.1	1%	0.005	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	141	175.1	-61.8	177.7	0	0	0	109.2	F199 L220 Y221 F234 L245 V263	F199-L236 HydrophobicContact CD1-CD2 4.29Å; F199-L236 HydrophobicContact CE1-CD1 3.98Å; F199-L236 HydrophobicContact CE1-CD2 4.45Å; L220-L236 HydrophobicContact CB-CD1 4.08Å; Y221-L236 HydrophobicContact CD1-CD1 4.23Å; Y221-L236 HydrophobicContact CD1-CG 4.34Å; Y221-L236 HydrophobicContact CD2-CD1 4.21Å; Y221-L236 HydrophobicContact CE1-CB 4.34Å; Y221-L236 HydrophobicContact CE1-CD1 4.2Å; Y221-L236 HydrophobicContact CE1-CG 3.92Å; Y221-L236 HydrophobicContact CE2-CB 4.47Å; Y221-L236 HydrophobicContact CE2-CD1 4.18Å; Y221-L236 HydrophobicContact CE2-CG 4.5Å; Y221-L236 HydrophobicContact CG-CD1 4.23Å; Y221-L236 PolarHBondContact OH-N 3.21Å; F234-L236 HydrophobicContact CD2-CD2 4.07Å; F234-L236 HydrophobicContact CD2-CG 4.23Å; F234-L236 HydrophobicContact CE2-CD1 4.33Å; F234-L236 HydrophobicContact CE2-CD2 4.04Å; F234-L236 HydrophobicContact CE2-CG 4.01Å; L236-L245 HydrophobicContact CB-CB 4.45Å; L236-L245 HydrophobicContact CB-CD1 4.09Å; L236-L245 PolarHBondContact O-N 2.68Å; L236-V263 HydrophobicContact CB-CG1 3.71Å; L236-V263 HydrophobicContact CD1-CG1 4.36Å; L236-V263 HydrophobicContact CD2-CG1 4.12Å; L236-V263 HydrophobicContact CG-CG1 4.28Å
237	Y	95.6	Very high	89.9	Confident	22 Å²	22	74.5 Å²	74.5	9%	0.086	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	156.9	177.2	71	-87.2	0	0	0	112.4	T239 K242 L243 F244 V263 F264 H266	Y237-T239 HydrophobicContact CE2-CG2 4.12Å; Y237-K242 HydrophobicContact CD2-CD 4.26Å; Y237-K242 HydrophobicContact CD2-CG 3.71Å; Y237-K242 HydrophobicContact CE2-CD 4.31Å; Y237-K242 HydrophobicContact CE2-CG 4.16Å; Y237-K242 HydrophobicContact CG-CG 4.29Å; Y237-L243 CarbonylContact C-O 3.55Å; Y237-L243 WeakPolarHBondContact CA-O 3.43Å; Y237-L243 VanDerWaalsContact CB-O 3.28Å; Y237-L243 WeakPolarHBondContact CB-O 3.45Å; Y237-F244 HydrophobicContact CD1-CE1 4.18Å; Y237-F244 HydrophobicContact CG-CE1 4.4Å; Y237-V263 CarbonylContact O-C 3.52Å; Y237-F264 HydrophobicContact CD1-CB 3.97Å; Y237-F264 WeakPolarHBondContact CD1-O 3.43Å; Y237-F264 HydrophobicContact CD2-CB 4.03Å; Y237-F264 HydrophobicContact CD2-CD2 4.46Å; Y237-F264 HydrophobicContact CE1-CB 3.5Å; Y237-F264 VanDerWaalsContact CE1-CB 3.5Å; Y237-F264 HydrophobicContact CE2-CB 3.57Å; Y237-F264 HydrophobicContact CE2-CD2 4.15Å; Y237-F264 AromaticContact CE2-CG 3.97Å; Y237-F264 HydrophobicContact CE2-CG 3.97Å; Y237-F264 HydrophobicContact CG-CB 4.23Å; Y237-F264 PolarHBondContact N-O 3.46Å; Y237-F264 VanDerWaalsContact N-O 3.11Å; Y237-F264 PolarHBondContact O-N 3.2Å; Y237-H266 HydrophobicContact CD1-CB 3.91Å; Y237-H266 HydrophobicContact CE1-CB 3.96Å
238	T	95.2	Very high	90	Very high	33 Å²	33	79.2 Å²	79.2	20%	0.202	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	158.8	170.7	58.3	0	0	0	0	110	K242 L243 L245 L257 V263	T238-K242 VanDerWaalsContact O-CA 3.29Å; T238-K242 WeakPolarHBondContact O-CA 3.23Å; T238-L243 PolarHBondContact N-O 3Å; T238-L243 PolarHBondContact O-N 3.05Å; T238-L245 HydrophobicContact CG2-CD2 4.48Å; T238-L257 HydrophobicContact CG2-CD2 3.8Å; T238-V263 HydrophobicContact CG2-CG2 4.31Å
239	T	91.8	Very high	90.2	Very high	68 Å²	68	84 Å²	84	42%	0.417	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.6	146.9	174.5	176.8	0	0	0	0	110.2	Y237 P241 F264	Y237-T239 HydrophobicContact CE2-CG2 4.12Å; T239-P241 WeakPolarHBondContact CA-O 3.22Å; T239-F264 HydrophobicContact CG2-CD2 3.57Å; T239-F264 HydrophobicContact CG2-CE1 4.5Å; T239-F264 HydrophobicContact CG2-CE2 3.24Å; T239-F264 HydrophobicContact CG2-CG 4.34Å; T239-F264 HydrophobicContact CG2-CZ 3.76Å
240	P	86.3	Confident	90.6	Very high	123 Å²	123	80 Å²	80	80%	0.799	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	cis	-95.9	146.7	-4.8	34.6	-30.6	0	0	0	113.3
241	P	88.1	Confident	91.4	Very high	111 Å²	111	79.5 Å²	79.5	72%	0.721	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	cis	-76	164.9	-4.1	33.6	-36.3	0	0	0	112.5	T239 L243	T239-P241 WeakPolarHBondContact CA-O 3.22Å; P241-L243 PolarHBondContact O-N 2.93Å
242	K	91.5	Very high	92.2	Very high	112 Å²	112	73.7 Å²	73.7	49%	0.487	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	100.5	178.7	-172	172.1	-175	176.1	0	110.8	Y237 T238	Y237-K242 HydrophobicContact CD2-CD 4.26Å; Y237-K242 HydrophobicContact CD2-CG 3.71Å; Y237-K242 HydrophobicContact CE2-CD 4.31Å; Y237-K242 HydrophobicContact CE2-CG 4.16Å; Y237-K242 HydrophobicContact CG-CG 4.29Å; T238-K242 VanDerWaalsContact O-CA 3.29Å; T238-K242 WeakPolarHBondContact O-CA 3.23Å
243	L	94.2	Very high	92.8	Very high	109 Å²	109	68.5 Å²	68.5	57%	0.571	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	118.7	178.9	-179.1	66.6	0	0	0	110.4	Y237 T238 P241	Y237-L243 CarbonylContact C-O 3.55Å; Y237-L243 WeakPolarHBondContact CA-O 3.43Å; Y237-L243 VanDerWaalsContact CB-O 3.28Å; Y237-L243 WeakPolarHBondContact CB-O 3.45Å; T238-L243 PolarHBondContact N-O 3Å; T238-L243 PolarHBondContact O-N 3.05Å; P241-L243 PolarHBondContact O-N 2.93Å
244	F	94.9	Very high	92.9	Very high	71 Å²	71	65.2 Å²	65.2	31%	0.311	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.7	174.7	-71.9	-80.5	0	0	0	110.9	K235 Y237 S246 H266	K235-F244 HydrophobicContact CB-CD1 4Å; K235-F244 HydrophobicContact CB-CE1 4.22Å; K235-F244 HydrophobicContact CD-CD1 4.34Å; Y237-F244 HydrophobicContact CD1-CE1 4.18Å; Y237-F244 HydrophobicContact CG-CE1 4.4Å; F244-S246 PolarHBondContact O-N 2.99Å; F244-S246 PolarHBondContact O-OG 2.89Å; F244-H266 HydrophobicContact CE1-CB 4.22Å
245	L	93.5	Very high	92.9	Very high	8 Å²	8	64.9 Å²	64.9	4%	0.042	35%	0.35	C	S	.	.			trans	-75.1	68.1	174.7	-59.9	179.8	0	0	0	109.9	V217 L220 Y221 L236 T238 L257 V263	V217-L245 HydrophobicContact CG1-CB 3.99Å; L220-L245 HydrophobicContact CD1-CD1 4.33Å; Y221-L245 HydrophobicContact CE2-CB 4.36Å; Y221-L245 VanDerWaalsContact CE2-O 3.3Å; Y221-L245 WeakPolarHBondContact CE2-O 3.13Å; Y221-L245 PolarHBondContact OH-O 2.84Å; L236-L245 HydrophobicContact CB-CB 4.45Å; L236-L245 HydrophobicContact CB-CD1 4.09Å; L236-L245 PolarHBondContact O-N 2.68Å; T238-L245 HydrophobicContact CG2-CD2 4.48Å; L245-L257 HydrophobicContact CD1-CD1 3.9Å; L245-L257 HydrophobicContact CD2-CD1 4.27Å; L245-V263 HydrophobicContact CD1-CG1 4.15Å; L245-V263 HydrophobicContact CD1-CG2 4.38Å
246	S	91.6	Very high	92.7	Very high	92 Å²	92	62.5 Å²	62.5	64%	0.643	34%	0.343	S	S	*	.			trans	-79.3	-37	-171.7	-52.4	0	0	0	0	111.9	F244 K248	F244-S246 PolarHBondContact O-N 2.99Å; F244-S246 PolarHBondContact O-OG 2.89Å; S246-K248 PolarHBondContact O-N 2.85Å
247	D	93.5	Very high	92.6	Very high	82 Å²	82	62.6 Å²	62.6	44%	0.439	34%	0.343	S	S	.	.			trans	-79.8	117.2	174.8	-164.9	-18.4	0	0	0	109.9	V217 N249 I250	V217-D247 WeakPolarHBondContact CG1-O 3.32Å; D247-N249 WeakPolarHBondContact OD1-CB 3.23Å; D247-N249 PolarHBondContact OD1-N 2.83Å; D247-I250 HydrophobicContact CB-CD1 4.31Å; D247-I250 HydrophobicContact CB-CG1 4.28Å; D247-I250 HydrophobicContact CB-CG2 4.22Å; D247-I250 WeakPolarHBondContact OD2-CG2 3.1Å
248	K	93.3	Very high	92.5	Very high	105 Å²	105	61.8 Å²	61.8	46%	0.457	34%	0.34	S	S	.	.	S	Bend	trans	-90.7	-10.3	-179.2	-64.2	-178.9	-179.4	179.7	0	112.5	S218 Y221 S246	S218-K248 WeakPolarHBondContact CB-O 3.46Å; S218-K248 PolarHBondContact N-O 3.04Å; Y221-K248 HydrophobicContact CD2-CD 4.46Å; Y221-K248 HydrophobicContact CD2-CG 4.16Å; Y221-K248 HydrophobicContact CE2-CG 4.24Å; S246-K248 PolarHBondContact O-N 2.85Å
249	N	94.3	Very high	92.3	Very high	114 Å²	114	61 Å²	61	61%	0.61	34%	0.336	S	S	*	.	S	Bend	trans	-93.9	-19.7	-173.5	-66.3	-40.1	0	0	0	113.4	K216 D247	K216-N249 WeakPolarHBondContact CD-O 3.43Å; K216-N249 WeakPolarHBondContact CE-O 3.21Å; D247-N249 WeakPolarHBondContact OD1-CB 3.23Å; D247-N249 PolarHBondContact OD1-N 2.83Å
250	I	93.3	Very high	92.4	Very high	48 Å²	48	60.2 Å²	60.2	25%	0.246	33%	0.329	C	S	.	.	S	Bend	trans	-67.9	149.4	174.7	62.8	174.9	0	0	0	111.5	K216 V217 D247 E254 A255	K216-I250 CarbonylContact C-O 3.58Å; K216-I250 VanDerWaalsContact CA-O 3.31Å; K216-I250 WeakPolarHBondContact CA-O 3.3Å; V217-I250 HydrophobicContact CB-CG1 4.36Å; V217-I250 HydrophobicContact CG2-CD1 4.2Å; V217-I250 HydrophobicContact CG2-CG1 3.7Å; V217-I250 PolarHBondContact N-O 2.81Å; D247-I250 HydrophobicContact CB-CD1 4.31Å; D247-I250 HydrophobicContact CB-CG1 4.28Å; D247-I250 HydrophobicContact CB-CG2 4.22Å; D247-I250 WeakPolarHBondContact OD2-CG2 3.1Å; I250-E254 WeakPolarHBondContact CA-OE2 3.21Å; I250-E254 HydrophobicContact CB-CB 4.22Å; I250-A255 HydrophobicContact CD1-CB 3.78Å; I250-A255 HydrophobicContact CG1-CB 4.38Å
251	T	93.7	Very high	92.8	Very high	27 Å²	27	55.3 Å²	55.3	17%	0.166	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-75.7	162.6	175.9	60.9	0	0	0	0	112	E215 I253 E254 A255	E215-T251 CarbonylContact O-C 3.56Å; E215-T251 VanDerWaalsContact O-CA 3.23Å; E215-T251 WeakPolarHBondContact O-CA 3.47Å; T251-I253 PolarHBondContact O-N 3.13Å; T251-E254 PolarHBondContact N-OE2 2.99Å; T251-E254 PolarHBondContact O-N 3.32Å; T251-E254 WeakPolarHBondContact OG1-CB 3.44Å; T251-E254 VanDerWaalsContact OG1-CD 3.27Å; T251-E254 WeakPolarHBondContact OG1-CG 3.43Å; T251-E254 PolarHBondContact OG1-N 3.04Å; T251-E254 PolarHBondContact OG1-OE2 2.84Å; T251-E254 VanDerWaalsContact OG1-OE2 3.07Å; T251-A255 WeakPolarHBondContact O-CB 3.38Å; T251-A255 PolarHBondContact O-N 2.84Å
252	L	93.7	Very high	93.1	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-32.7	173.7	-58	-173	0	0	0	111.9	A195 F211 P213 E215 V217 L220 A255 D256 L257 V258	A195-L252 HydrophobicContact CB-CD1 4.13Å; F211-L252 HydrophobicContact CB-CD1 3.54Å; F211-L252 HydrophobicContact CG-CD1 4.18Å; P213-L252 WeakPolarHBondContact O-CB 3.47Å; P213-L252 PolarHBondContact O-N 2.97Å; E215-L252 HydrophobicContact CB-CD1 4.42Å; E215-L252 HydrophobicContact CB-CG 4.5Å; E215-L252 WeakPolarHBondContact O-CG 3.48Å; E215-L252 PolarHBondContact O-N 2.98Å; V217-L252 HydrophobicContact CG2-CD2 4.3Å; L220-L252 HydrophobicContact CD1-CD2 3.71Å; L220-L252 HydrophobicContact CD2-CD1 4.3Å; L220-L252 HydrophobicContact CD2-CD2 3.91Å; L220-L252 HydrophobicContact CG-CD2 3.85Å; L252-A255 PolarHBondContact O-N 3.11Å; L252-D256 PolarHBondContact O-N 2.93Å; L252-L257 HydrophobicContact CB-CB 4.16Å; L252-L257 HydrophobicContact CD2-CB 4.35Å; L252-L257 HydrophobicContact CD2-CD1 3.92Å; L252-L257 PolarHBondContact O-N 2.89Å; L252-V258 HydrophobicContact CB-CG2 3.92Å
253	I	92.6	Very high	93.4	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-49.7	171.7	-73	178.6	0	0	0	111	R185 H186 Y189 P213 N214 T251 A255 D256 V258	R185-I253 HydrophobicContact CG-CG2 4.17Å; H186-I253 HydrophobicContact CB-CG2 4.47Å; Y189-I253 HydrophobicContact CD2-CG2 4.04Å; P213-I253 HydrophobicContact CB-CD1 3.77Å; P213-I253 HydrophobicContact CB-CG1 3.68Å; P213-I253 WeakPolarHBondContact O-CG1 3.27Å; P213-I253 PolarHBondContact O-N 3.06Å; N214-I253 VanDerWaalsContact OD1-CD1 3.3Å; N214-I253 WeakPolarHBondContact OD1-CD1 3.42Å; T251-I253 PolarHBondContact O-N 3.13Å; I253-A255 VanDerWaalsContact C-N 3.29Å; I253-A255 PolarHBondContact O-N 3.41Å; I253-D256 PolarHBondContact O-N 3.07Å; I253-V258 HydrophobicContact CG1-CG2 4.12Å
254	E	91.8	Very high	93.4	Very high	93 Å²	93	47.7 Å²	47.7	44%	0.435	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-32.8	-179	-73	164	162.6	0	0	112.2	R185 I250 T251 D256	R185-E254 PolarHBondContact NH1-O 2.78Å; I250-E254 WeakPolarHBondContact CA-OE2 3.21Å; I250-E254 HydrophobicContact CB-CB 4.22Å; T251-E254 PolarHBondContact N-OE2 2.99Å; T251-E254 PolarHBondContact O-N 3.32Å; T251-E254 WeakPolarHBondContact OG1-CB 3.44Å; T251-E254 VanDerWaalsContact OG1-CD 3.27Å; T251-E254 WeakPolarHBondContact OG1-CG 3.43Å; T251-E254 PolarHBondContact OG1-N 3.04Å; T251-E254 PolarHBondContact OG1-OE2 2.84Å; T251-E254 VanDerWaalsContact OG1-OE2 3.07Å; E254-D256 PolarHBondContact O-N 3.17Å
255	A	91.9	Very high	93.4	Very high	21 Å²	21	44.7 Å²	44.7	17%	0.174	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	1.8	175.6	0	0	0	0	0	114.2	V217 I250 T251 L252 I253 L257	V217-A255 HydrophobicContact CG2-CB 3.97Å; I250-A255 HydrophobicContact CD1-CB 3.78Å; I250-A255 HydrophobicContact CG1-CB 4.38Å; T251-A255 WeakPolarHBondContact O-CB 3.38Å; T251-A255 PolarHBondContact O-N 2.84Å; L252-A255 PolarHBondContact O-N 3.11Å; I253-A255 VanDerWaalsContact C-N 3.29Å; I253-A255 PolarHBondContact O-N 3.41Å; A255-L257 HydrophobicContact CB-CB 4.49Å; A255-L257 HydrophobicContact CB-CD1 3.78Å; A255-L257 HydrophobicContact CB-CG 3.76Å; A255-L257 PolarHBondContact O-N 2.86Å
256	D	91.1	Very high	93.4	Very high	71 Å²	71	47.1 Å²	47.1	38%	0.38	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	37.9	-174.2	-67.4	-54.3	0	0	0	112.5	R185 L252 I253 E254 S261	R185-D256 IonicContact CZ-OD1 3.42Å; R185-D256 VanDerWaalsContact CZ-OD1 3.31Å; R185-D256 IonicContact CZ-OD2 2.84Å; R185-D256 VanDerWaalsContact CZ-OD2 3.26Å; R185-D256 IonicContact NE-OD1 2.82Å; R185-D256 IonicContact NH1-OD1 3.31Å; R185-D256 IonicContact NH1-OD2 3.26Å; R185-D256 PolarHBondContact NH1-OD2 3.06Å; R185-D256 IonicContact NH2-OD1 3.59Å; R185-D256 PolarHBondContact NH2-OD1 2.93Å; R185-D256 IonicContact NH2-OD2 3.6Å; R185-D256 PolarHBondContact NH2-OD2 3.36Å; L252-D256 PolarHBondContact O-N 2.93Å; I253-D256 PolarHBondContact O-N 3.07Å; E254-D256 PolarHBondContact O-N 3.17Å; D256-S261 PolarHBondContact O-OG 2.78Å
257	L	93.5	Very high	93.4	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	23%	0.228	C	C	.	.			trans	-98.6	20.4	-179.4	-64.2	179.3	0	0	0	113.6	I197 V217 L220 T238 L245 L252 A255 S261 V263	I197-L257 HydrophobicContact CD1-CB 3.89Å; I197-L257 WeakPolarHBondContact CD1-O 3.25Å; V217-L257 HydrophobicContact CG2-CD1 4.41Å; L220-L257 HydrophobicContact CD1-CD1 3.68Å; T238-L257 HydrophobicContact CG2-CD2 3.8Å; L245-L257 HydrophobicContact CD1-CD1 3.9Å; L245-L257 HydrophobicContact CD2-CD1 4.27Å; L252-L257 HydrophobicContact CB-CB 4.16Å; L252-L257 HydrophobicContact CD2-CB 4.35Å; L252-L257 HydrophobicContact CD2-CD1 3.92Å; L252-L257 PolarHBondContact O-N 2.89Å; A255-L257 HydrophobicContact CB-CB 4.49Å; A255-L257 HydrophobicContact CB-CD1 3.78Å; A255-L257 HydrophobicContact CB-CG 3.76Å; A255-L257 PolarHBondContact O-N 2.86Å; L257-S261 WeakPolarHBondContact CA-OG 3.14Å; L257-S261 PolarHBondContact O-OG 2.86Å; L257-V263 HydrophobicContact CD2-CG2 4.1Å
258	V	92.4	Very high	93.1	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.03	22%	0.22	C	C	.	.			trans	-130.2	139.8	-174.6	-174.5	0	0	0	0	108.7	Y189 Y192 A195 P213 L252 I253	Y189-V258 HydrophobicContact CD1-CB 3.97Å; Y189-V258 HydrophobicContact CD1-CG1 3.95Å; Y189-V258 HydrophobicContact CE1-CB 4.47Å; Y189-V258 WeakPolarHBondContact CE1-O 2.95Å; Y189-V258 HydrophobicContact CG-CB 4.13Å; Y189-V258 HydrophobicContact CG-CG1 4.22Å; Y192-V258 HydrophobicContact CD2-CG1 4.26Å; Y192-V258 HydrophobicContact CG-CG1 4.28Å; A195-V258 HydrophobicContact CB-CB 4.48Å; A195-V258 HydrophobicContact CB-CG1 4.36Å; A195-V258 HydrophobicContact CB-CG2 3.89Å; P213-V258 HydrophobicContact CB-CG1 4.2Å; P213-V258 HydrophobicContact CB-CG2 4Å; P213-V258 HydrophobicContact CG-CG1 4.16Å; L252-V258 HydrophobicContact CB-CG2 3.92Å; I253-V258 HydrophobicContact CG1-CG2 4.12Å
259	P	91	Very high	92.8	Very high	16 Å²	16	45 Å²	45	10%	0.104	24%	0.236	C	C	.	.	S	Bend	cis	-91.2	-19.9	1.6	37	-39	0	0	0	115.4	Y192 A195 I196 Y300	Y192-P259 HydrophobicContact CD1-CB 3.24Å; Y192-P259 HydrophobicContact CD1-CG 3.95Å; Y192-P259 HydrophobicContact CD2-CB 4.43Å; Y192-P259 HydrophobicContact CE1-CB 3.25Å; Y192-P259 HydrophobicContact CE1-CG 3.37Å; Y192-P259 HydrophobicContact CE2-CB 4.5Å; Y192-P259 HydrophobicContact CG-CB 3.86Å; A195-P259 CarbonylContact C-O 3.42Å; A195-P259 WeakPolarHBondContact CA-O 3.42Å; I196-P259 PolarHBondContact N-O 3.43Å; P259-Y300 HydrophobicContact CG-CE1 3.82Å; P259-Y300 WeakPolarHBondContact CG-OH 3.47Å
260	L	94	Very high	92.5	Very high	53 Å²	53	41.5 Å²	41.5	28%	0.277	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	117.9	178.6	173.4	67	0	0	0	108.6	I196 Q198 I296	I196-L260 HydrophobicContact CB-CD1 3.63Å; I196-L260 HydrophobicContact CG2-CD1 3.44Å; I196-L260 VanDerWaalsContact CG2-CD1 3.44Å; I196-L260 VanDerWaalsContact O-CA 3.3Å; I196-L260 WeakPolarHBondContact O-CA 3.28Å; Q198-L260 HydrophobicContact CG-CD1 4.12Å; L260-I296 HydrophobicContact CD1-CD1 4.25Å; L260-I296 HydrophobicContact CD1-CG1 4.27Å; L260-I296 HydrophobicContact CD2-CD1 4.06Å; L260-I296 HydrophobicContact CD2-CG1 4.33Å; L260-I296 HydrophobicContact CD2-CG2 4.07Å
261	S	95	Very high	92.3	Very high	20 Å²	20	40.7 Å²	40.7	14%	0.14	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	144	-177.2	-65.4	0	0	0	0	113	I196 Q198 D256 L257	I196-S261 PolarHBondContact O-N 2.79Å; Q198-S261 PolarHBondContact N-O 3.21Å; D256-S261 PolarHBondContact O-OG 2.78Å; L257-S261 WeakPolarHBondContact CA-OG 3.14Å; L257-S261 PolarHBondContact O-OG 2.86Å
262	K	94.9	Very high	92.1	Very high	124 Å²	124	39.4 Å²	39.4	54%	0.539	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.3	175.9	-63	-179.9	-176.6	174	0	109.4	F264	K262-F264 HydrophobicContact CB-CE2 4.22Å; K262-F264 HydrophobicContact CB-CZ 4.49Å
263	V	96.5	Very high	91.8	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	138.8	179.5	179.2	0	0	0	0	107.8	I197 Q198 F199 H200 L236 Y237 T238 L245 L257	I197-V263 HydrophobicContact CG2-CB 4.18Å; I197-V263 HydrophobicContact CG2-CG2 3.72Å; Q198-V263 PolarHBondContact O-N 2.84Å; F199-V263 CarbonylContact C-O 3.6Å; F199-V263 VanDerWaalsContact CA-O 3.25Å; F199-V263 WeakPolarHBondContact CA-O 3.05Å; F199-V263 HydrophobicContact CD1-CB 4.15Å; F199-V263 HydrophobicContact CD1-CG1 4.1Å; F199-V263 HydrophobicContact CE1-CB 4.42Å; F199-V263 HydrophobicContact CE1-CG1 4.25Å; H200-V263 PolarHBondContact N-O 2.94Å; L236-V263 HydrophobicContact CB-CG1 3.71Å; L236-V263 HydrophobicContact CD1-CG1 4.36Å; L236-V263 HydrophobicContact CD2-CG1 4.12Å; L236-V263 HydrophobicContact CG-CG1 4.28Å; Y237-V263 CarbonylContact O-C 3.52Å; T238-V263 HydrophobicContact CG2-CG2 4.31Å; L245-V263 HydrophobicContact CD1-CG1 4.15Å; L245-V263 HydrophobicContact CD1-CG2 4.38Å; L257-V263 HydrophobicContact CD2-CG2 4.1Å
264	F	95.6	Very high	91.5	Very high	47 Å²	47	49.8 Å²	49.8	21%	0.206	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	143	-175.1	-63.1	-93.8	0	0	0	110.4	H200 Y237 T239 K262	H200-F264 HydrophobicContact CB-CD1 3.6Å; H200-F264 HydrophobicContact CB-CE1 3.68Å; H200-F264 HydrophobicContact CB-CG 4.37Å; H200-F264 HydrophobicContact CB-CZ 4.5Å; Y237-F264 HydrophobicContact CD1-CB 3.97Å; Y237-F264 WeakPolarHBondContact CD1-O 3.43Å; Y237-F264 HydrophobicContact CD2-CB 4.03Å; Y237-F264 HydrophobicContact CD2-CD2 4.46Å; Y237-F264 HydrophobicContact CE1-CB 3.5Å; Y237-F264 VanDerWaalsContact CE1-CB 3.5Å; Y237-F264 HydrophobicContact CE2-CB 3.57Å; Y237-F264 HydrophobicContact CE2-CD2 4.15Å; Y237-F264 AromaticContact CE2-CG 3.97Å; Y237-F264 HydrophobicContact CE2-CG 3.97Å; Y237-F264 HydrophobicContact CG-CB 4.23Å; Y237-F264 PolarHBondContact N-O 3.46Å; Y237-F264 VanDerWaalsContact N-O 3.11Å; Y237-F264 PolarHBondContact O-N 3.2Å; T239-F264 HydrophobicContact CG2-CD2 3.57Å; T239-F264 HydrophobicContact CG2-CE1 4.5Å; T239-F264 HydrophobicContact CG2-CE2 3.24Å; T239-F264 HydrophobicContact CG2-CG 4.34Å; T239-F264 HydrophobicContact CG2-CZ 3.76Å; K262-F264 HydrophobicContact CB-CE2 4.22Å; K262-F264 HydrophobicContact CB-CZ 4.49Å
265	Y	94.4	Very high	91.4	Very high	9 Å²	9	45.4 Å²	45.4	4%	0.035	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	138.6	177.1	-172.5	-93.2	0	0	0	111.5	H200 W201 I224 Q228 F234 V275	H200-Y265 PolarHBondContact O-N 3.42Å; W201-Y265 HydrophobicContact CZ2-CD2 4.26Å; W201-Y265 AromaticContact NE1-CD1 3.92Å; W201-Y265 AromaticContact NE1-CG 3.69Å; I224-Y265 HydrophobicContact CG2-CD2 4.34Å; I224-Y265 HydrophobicContact CG2-CE2 4.16Å; Q228-Y265 PolarHBondContact NE2-OH 3.18Å; Q228-Y265 VanDerWaalsContact NE2-OH 3.14Å; F234-Y265 HydrophobicContact CB-CD2 4.31Å; F234-Y265 HydrophobicContact CB-CE1 4.37Å; F234-Y265 HydrophobicContact CB-CE2 3.4Å; F234-Y265 VanDerWaalsContact CB-CZ 3.44Å; F234-Y265 WeakPolarHBondContact CB-OH 3.3Å; F234-Y265 HydrophobicContact CD1-CE2 4.32Å; F234-Y265 HydrophobicContact CD2-CD2 4.16Å; F234-Y265 AromaticContact CD2-CE2 3.73Å; F234-Y265 HydrophobicContact CD2-CE2 3.73Å; F234-Y265 HydrophobicContact CG-CD2 4.43Å; F234-Y265 AromaticContact CG-CE2 3.57Å; F234-Y265 HydrophobicContact CG-CE2 3.57Å; Y265-V275 HydrophobicContact CE1-CG2 4.29Å; Y265-V275 HydrophobicContact CE2-CG1 4.23Å
266	H	93.2	Very high	91.3	Very high	58 Å²	58	44.7 Å²	44.7	27%	0.269	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	133.8	172.7	-174.8	74.8	0	0	0	109.9	F234 K235 Y237 F244	F234-H266 CarbonylContact C-O 3.58Å; F234-H266 VanDerWaalsContact CA-O 3.29Å; F234-H266 WeakPolarHBondContact CA-O 3.27Å; F234-H266 WeakPolarHBondContact CB-O 3.46Å; K235-H266 HydrophobicContact CB-CB 4.32Å; K235-H266 PolarHBondContact N-O 3.18Å; K235-H266 WeakPolarHBondContact O-CB 3.41Å; K235-H266 PolarHBondContact O-N 2.94Å; Y237-H266 HydrophobicContact CD1-CB 3.91Å; Y237-H266 HydrophobicContact CE1-CB 3.96Å; F244-H266 HydrophobicContact CE1-CB 4.22Å
267	P	91.7	Very high	91.3	Very high	41 Å²	41	45.3 Å²	45.3	27%	0.266	23%	0.229	S	C	.	.	S	Bend	cis	-65.8	139.1	10.2	-22.6	34.7	0	0	0	114.8	D269 I270	P267-D269 VanDerWaalsContact C-N 3.3Å; P267-D269 PolarHBondContact O-N 3.46Å; P267-I270 HydrophobicContact CB-CD1 3.94Å; P267-I270 HydrophobicContact CB-CG1 4.21Å; P267-I270 HydrophobicContact CG-CD1 3.98Å
268	T	87.7	Confident	91.2	Very high	42 Å²	42	49.3 Å²	49.3	26%	0.258	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-25.7	-173.7	-55.7	0	0	0	0	111.6	V202 I270	V202-T268 HydrophobicContact CG1-CG2 3.38Å; V202-T268 WeakPolarHBondContact CG1-O 3.43Å; V202-T268 VanDerWaalsContact CG2-O 3.25Å; V202-T268 WeakPolarHBondContact CG2-O 3.38Å; T268-I270 PolarHBondContact O-N 3.06Å
269	D	87.1	Confident	91.1	Very high	151 Å²	151	52.3 Å²	52.3	81%	0.807	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-5	-173.3	-49.4	-47.4	0	0	0	114.4	P267	P267-D269 VanDerWaalsContact C-N 3.3Å; P267-D269 PolarHBondContact O-N 3.46Å
270	I	87.4	Confident	91.1	Very high	42 Å²	42	51.6 Å²	51.6	22%	0.215	27%	0.268	C	S	.	.	S	Bend	trans	-98.8	120.1	-174.5	-50	174.2	0	0	0	109.2	P267 T268 N274 V275	P267-I270 HydrophobicContact CB-CD1 3.94Å; P267-I270 HydrophobicContact CB-CG1 4.21Å; P267-I270 HydrophobicContact CG-CD1 3.98Å; T268-I270 PolarHBondContact O-N 3.06Å; I270-N274 HydrophobicContact CG2-CB 4.12Å; I270-V275 HydrophobicContact CB-CG2 4.28Å; I270-V275 HydrophobicContact CG2-CG2 3.4Å; I270-V275 VanDerWaalsContact CG2-CG2 3.4Å
271	P	89.4	Confident	90.9	Very high	30 Å²	30	50.9 Å²	50.9	20%	0.195	26%	0.264	C	S	.	.			trans	-70.3	156	176.4	32.1	-36.3	0	0	0	110.8	D203 E273 N274	D203-P271 HydrophobicContact CB-CB 4.41Å; P271-E273 HydrophobicContact CB-CG 4Å; P271-E273 HydrophobicContact CG-CG 3.92Å; P271-E273 PolarHBondContact O-N 2.88Å; P271-N274 HydrophobicContact CG-CB 4.38Å; P271-N274 PolarHBondContact O-N 3.35Å
272	A	89.2	Confident	90.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-64.8	-31.2	-175.4	0	0	0	0	0	112.1	W201 D203 L205 N274 V275 L276	W201-A272 HydrophobicContact CB-CB 3.95Å; W201-A272 HydrophobicContact CD2-CB 3.85Å; W201-A272 HydrophobicContact CG-CB 3.51Å; D203-A272 VanDerWaalsContact OD2-CB 3.23Å; D203-A272 WeakPolarHBondContact OD2-CB 3.43Å; D203-A272 PolarHBondContact OD2-N 2.88Å; L205-A272 HydrophobicContact CB-CB 3.97Å; L205-A272 HydrophobicContact CD2-CB 3.4Å; L205-A272 VanDerWaalsContact CD2-CB 3.4Å; L205-A272 HydrophobicContact CG-CB 4.21Å; A272-N274 PolarHBondContact O-N 3.23Å; A272-V275 PolarHBondContact O-N 3.11Å; A272-V275 VanDerWaalsContact O-N 3.08Å; A272-L276 HydrophobicContact CB-CD1 3.81Å; A272-L276 HydrophobicContact CB-CG 4.41Å; A272-L276 WeakPolarHBondContact O-CB 3.43Å; A272-L276 WeakPolarHBondContact O-CG 3.33Å; A272-L276 PolarHBondContact O-N 2.81Å
273	E	86.8	Confident	90.3	Very high	119 Å²	119	56.7 Å²	56.7	56%	0.556	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-58.7	-27.5	177.8	69.5	-170.2	170.4	0	0	114.2	P271 L281	P271-E273 HydrophobicContact CB-CG 4Å; P271-E273 HydrophobicContact CG-CG 3.92Å; P271-E273 PolarHBondContact O-N 2.88Å; E273-L281 HydrophobicContact CB-CD2 3.87Å
274	N	87.2	Confident	89.9	Confident	102 Å²	102	57.2 Å²	57.2	55%	0.545	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-88.2	-16	179	-71.7	4.6	0	0	0	113	I270 P271 A272	I270-N274 HydrophobicContact CG2-CB 4.12Å; P271-N274 HydrophobicContact CG-CB 4.38Å; P271-N274 PolarHBondContact O-N 3.35Å; A272-N274 PolarHBondContact O-N 3.23Å
275	V	89	Confident	89.5	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-45.8	-170	174	0	0	0	0	110.4	Q228 N229 Y265 I270 A272	Q228-V275 VanDerWaalsContact CA-O 3.28Å; Q228-V275 WeakPolarHBondContact CA-O 3.31Å; Q228-V275 HydrophobicContact CG-CG1 3.57Å; N229-V275 PolarHBondContact N-O 2.98Å; Y265-V275 HydrophobicContact CE1-CG2 4.29Å; Y265-V275 HydrophobicContact CE2-CG1 4.23Å; I270-V275 HydrophobicContact CB-CG2 4.28Å; I270-V275 HydrophobicContact CG2-CG2 3.4Å; I270-V275 VanDerWaalsContact CG2-CG2 3.4Å; A272-V275 PolarHBondContact O-N 3.11Å; A272-V275 VanDerWaalsContact O-N 3.08Å
276	L	91.2	Very high	89	Confident	7 Å²	7	66.6 Å²	66.6	4%	0.037	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-83.7	154.1	-174.1	-59.7	174.6	0	0	0	111.9	I129 W201 L205 I207 L227 A272	I129-L276 HydrophobicContact CD1-CD1 4.37Å; W201-L276 HydrophobicContact CH2-CD1 4.48Å; W201-L276 HydrophobicContact CH2-CD2 4.31Å; W201-L276 HydrophobicContact CZ2-CD1 4.31Å; W201-L276 HydrophobicContact CZ2-CD2 3.95Å; W201-L276 HydrophobicContact CZ2-CG 4.35Å; L205-L276 HydrophobicContact CD2-CD1 3.46Å; L205-L276 VanDerWaalsContact CD2-CD1 3.46Å; I207-L276 HydrophobicContact CD1-CD1 3.76Å; I207-L276 HydrophobicContact CD1-CD2 3.98Å; L227-L276 HydrophobicContact CB-CD2 4.07Å; A272-L276 HydrophobicContact CB-CD1 3.81Å; A272-L276 HydrophobicContact CB-CG 4.41Å; A272-L276 WeakPolarHBondContact O-CB 3.43Å; A272-L276 WeakPolarHBondContact O-CG 3.33Å; A272-L276 PolarHBondContact O-N 2.81Å
277	R	90.9	Very high	88.9	Confident	83 Å²	83	71 Å²	71	31%	0.313	36%	0.363	S	S	.	.			trans	-66.7	144.5	172.6	-61.1	-176.4	-70.3	119	-0.3	111.1	D226 L227 N229 D279 V280 L281	D226-R277 PolarHBondContact O-NE 3.31Å; L227-R277 WeakPolarHBondContact O-CG 3.35Å; L227-R277 PolarHBondContact O-N 3.29Å; N229-R277 HydrophobicContact CB-CG 3.88Å; R277-D279 VanDerWaalsContact C-N 3.26Å; R277-D279 WeakPolarHBondContact CB-OD1 3.28Å; R277-D279 IonicContact CZ-OD1 3.64Å; R277-D279 IonicContact CZ-OD2 3.55Å; R277-D279 VanDerWaalsContact NH1-CG 3.25Å; R277-D279 IonicContact NH1-OD1 3.11Å; R277-D279 PolarHBondContact NH1-OD1 3.39Å; R277-D279 VanDerWaalsContact NH1-OD1 3.11Å; R277-D279 IonicContact NH1-OD2 2.72Å; R277-D279 PolarHBondContact NH1-OD2 3.18Å; R277-D279 IonicContact NH2-OD2 3.85Å; R277-D279 PolarHBondContact O-N 3.15Å; R277-V280 HydrophobicContact CB-CG2 4.35Å; R277-V280 WeakPolarHBondContact O-CB 3.38Å; R277-V280 PolarHBondContact O-N 2.97Å; R277-V280 VanDerWaalsContact O-N 3.09Å; R277-L281 PolarHBondContact O-N 3.05Å
278	S	90.6	Very high	88.9	Confident	86 Å²	86	70.6 Å²	70.6	60%	0.601	36%	0.358	S	S	*	.	H	α-helix	trans	-60.1	-34.3	-177.6	-50.8	0	0	0	0	113	V280 L281 E282	S278-V280 PolarHBondContact O-N 3.28Å; S278-L281 PolarHBondContact O-N 2.98Å; S278-E282 WeakPolarHBondContact O-CG 3.44Å; S278-E282 PolarHBondContact O-N 3.44Å
279	D	90.7	Very high	89.1	Confident	68 Å²	68	69.9 Å²	69.9	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-63.7	-28.2	177.5	67.5	-46.3	0	0	0	113.3	R277	R277-D279 VanDerWaalsContact C-N 3.26Å; R277-D279 WeakPolarHBondContact CB-OD1 3.28Å; R277-D279 IonicContact CZ-OD1 3.64Å; R277-D279 IonicContact CZ-OD2 3.55Å; R277-D279 VanDerWaalsContact NH1-CG 3.25Å; R277-D279 IonicContact NH1-OD1 3.11Å; R277-D279 PolarHBondContact NH1-OD1 3.39Å; R277-D279 VanDerWaalsContact NH1-OD1 3.11Å; R277-D279 IonicContact NH1-OD2 2.72Å; R277-D279 PolarHBondContact NH1-OD2 3.18Å; R277-D279 IonicContact NH2-OD2 3.85Å; R277-D279 PolarHBondContact O-N 3.15Å
280	V	90.4	Very high	89.3	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.006	35%	0.348	C	S	.	.	H	α-helix	trans	-78.2	-43.8	175.2	-178.2	0	0	0	0	109.5	F127 I129 L227 R277 S278 E282 K283	F127-V280 HydrophobicContact CE2-CG1 4.36Å; I129-V280 HydrophobicContact CD1-CG1 3.8Å; I129-V280 WeakPolarHBondContact CG2-O 3.31Å; L227-V280 HydrophobicContact CD2-CG1 4.45Å; L227-V280 HydrophobicContact CD2-CG2 3.87Å; R277-V280 HydrophobicContact CB-CG2 4.35Å; R277-V280 WeakPolarHBondContact O-CB 3.38Å; R277-V280 PolarHBondContact O-N 2.97Å; R277-V280 VanDerWaalsContact O-N 3.09Å; S278-V280 PolarHBondContact O-N 3.28Å; V280-E282 VanDerWaalsContact C-N 3.34Å; V280-E282 PolarHBondContact O-N 3.19Å; V280-K283 WeakPolarHBondContact O-CB 3.5Å; V280-K283 PolarHBondContact O-N 3.01Å; V280-K283 VanDerWaalsContact O-N 3.15Å
281	L	89.5	Confident	89.5	Confident	38 Å²	38	71.7 Å²	71.7	20%	0.199	36%	0.359	C	S	.	.	H	α-helix	trans	-66.6	-34.6	-177.7	-157.6	73.5	0	0	0	112.7	L205 E273 R277 S278 K283 A284	L205-L281 HydrophobicContact CD1-CD1 3.76Å; L205-L281 HydrophobicContact CD2-CD1 4.42Å; E273-L281 HydrophobicContact CB-CD2 3.87Å; R277-L281 PolarHBondContact O-N 3.05Å; S278-L281 PolarHBondContact O-N 2.98Å; L281-K283 PolarHBondContact O-N 3.18Å; L281-A284 WeakPolarHBondContact O-CB 3.25Å; L281-A284 PolarHBondContact O-N 3.27Å
282	E	89.1	Confident	89.7	Confident	156 Å²	156	70.3 Å²	70.3	73%	0.729	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.2	174.7	-76.1	176.6	-168.6	0	0	113.2	S278 V280 A284	S278-E282 WeakPolarHBondContact O-CG 3.44Å; S278-E282 PolarHBondContact O-N 3.44Å; V280-E282 VanDerWaalsContact C-N 3.34Å; V280-E282 PolarHBondContact O-N 3.19Å; E282-A284 PolarHBondContact O-N 3.27Å
283	K	88.9	Confident	89.9	Confident	110 Å²	110	75.4 Å²	75.4	48%	0.478	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-7.7	175.4	-65.7	174	-178.4	177.7	0	112.5	I129 V280 L281 N285 N288	I129-K283 HydrophobicContact CG2-CB 3.76Å; V280-K283 WeakPolarHBondContact O-CB 3.5Å; V280-K283 PolarHBondContact O-N 3.01Å; V280-K283 VanDerWaalsContact O-N 3.15Å; L281-K283 PolarHBondContact O-N 3.18Å; K283-N285 PolarHBondContact O-N 3.37Å; K283-N288 PolarHBondContact O-ND2 3.36Å
284	A	87.3	Confident	90.2	Very high	11 Å²	11	73.3 Å²	73.3	9%	0.091	37%	0.372	C	S	.	.			trans	-74.2	81.5	-173.7	0	0	0	0	0	112.7	I129 L205 L281 E282	I129-A284 HydrophobicContact CD1-CB 4.27Å; I129-A284 HydrophobicContact CG1-CB 3.97Å; I129-A284 HydrophobicContact CG2-CB 4.32Å; I129-A284 WeakPolarHBondContact O-CA 3.03Å; L205-A284 HydrophobicContact CD1-CB 4.2Å; L281-A284 WeakPolarHBondContact O-CB 3.25Å; L281-A284 PolarHBondContact O-N 3.27Å; E282-A284 PolarHBondContact O-N 3.27Å
285	N	87.3	Confident	90.4	Very high	88 Å²	88	69 Å²	69	47%	0.471	35%	0.348	S	S	.	.			trans	-108.1	159.7	179.4	-66.1	-18.8	0	0	0	112	K283 E287 N288	K283-N285 PolarHBondContact O-N 3.37Å; N285-E287 VanDerWaalsContact C-N 3.33Å; N285-N288 WeakPolarHBondContact O-CB 3.3Å; N285-N288 PolarHBondContact O-N 3.42Å
286	E	85.5	Confident	90.6	Very high	166 Å²	166	69.6 Å²	69.6	78%	0.776	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-35.2	175.6	-173.6	170.4	-169.2	0	0	112.2	N288 S289	E286-N288 PolarHBondContact O-N 3.03Å; E286-N288 VanDerWaalsContact O-N 3.15Å; E286-S289 WeakPolarHBondContact O-CA 3.47Å; E286-S289 WeakPolarHBondContact O-CB 3.36Å; E286-S289 PolarHBondContact O-N 2.99Å
287	E	89.9	Confident	90.6	Very high	151 Å²	151	73 Å²	73	71%	0.706	37%	0.37	S	S	*	.	H	α-helix	trans	-56.3	-32	174.4	-63.3	-179	179.1	0	0	112.5	N285 S289 I290 K291	N285-E287 VanDerWaalsContact C-N 3.33Å; E287-S289 PolarHBondContact O-N 2.89Å; E287-I290 PolarHBondContact O-N 3.28Å; E287-K291 PolarHBondContact O-N 2.94Å
288	N	92.7	Very high	90.5	Very high	32 Å²	32	71.9 Å²	71.9	17%	0.171	38%	0.375	C	S	.	.	H	α-helix	trans	-68.2	-23.2	176.4	-73.7	-9.1	0	0	0	112.7	V128 I129 F130 K283 N285 E286 K291 A292	V128-N288 HydrophobicContact CB-CB 4.43Å; I129-N288 WeakPolarHBondContact O-CB 3.49Å; I129-N288 PolarHBondContact O-ND2 3.19Å; F130-N288 HydrophobicContact CB-CB 4.07Å; K283-N288 PolarHBondContact O-ND2 3.36Å; N285-N288 WeakPolarHBondContact O-CB 3.3Å; N285-N288 PolarHBondContact O-N 3.42Å; E286-N288 PolarHBondContact O-N 3.03Å; E286-N288 VanDerWaalsContact O-N 3.15Å; N288-K291 PolarHBondContact O-N 3.07Å; N288-A292 VanDerWaalsContact O-CB 3.26Å; N288-A292 WeakPolarHBondContact O-CB 3.47Å; N288-A292 PolarHBondContact O-N 2.92Å
289	S	90.2	Very high	90.2	Very high	27 Å²	27	68.2 Å²	68.2	19%	0.189	35%	0.349	C	S	.	.	H	α-helix	trans	-67.2	-42.7	173	-166.9	0	0	0	0	110.8	E286 E287 A292 Q293	E286-S289 WeakPolarHBondContact O-CA 3.47Å; E286-S289 WeakPolarHBondContact O-CB 3.36Å; E286-S289 PolarHBondContact O-N 2.99Å; E287-S289 PolarHBondContact O-N 2.89Å; S289-A292 WeakPolarHBondContact O-CB 3.42Å; S289-A292 PolarHBondContact O-N 3.1Å; S289-Q293 WeakPolarHBondContact O-CG 3.29Å; S289-Q293 PolarHBondContact O-N 2.99Å
290	I	91.6	Very high	90	Very high	128 Å²	128	69.2 Å²	69.2	66%	0.656	35%	0.348	S	S	*	.	H	α-helix	trans	-63.9	-44.1	174.3	-59.5	171.8	0	0	0	110.1	E287 A292 Q293 S294	E287-I290 PolarHBondContact O-N 3.28Å; I290-A292 VanDerWaalsContact C-N 3.33Å; I290-A292 PolarHBondContact O-N 2.57Å; I290-Q293 PolarHBondContact O-N 3.24Å; I290-S294 PolarHBondContact O-N 3.05Å
291	K	93	Very high	89.6	Confident	103 Å²	103	74.9 Å²	74.9	45%	0.448	37%	0.373	S	S	.	.	H	α-helix	trans	-60.2	-43	175.2	-172.8	177.1	173	-173.8	0	111.7	V128 E287 N288 Q293 S294 I295	V128-K291 HydrophobicContact CG1-CD 3.74Å; V128-K291 HydrophobicContact CG1-CG 4.11Å; E287-K291 PolarHBondContact O-N 2.94Å; N288-K291 PolarHBondContact O-N 3.07Å; K291-Q293 VanDerWaalsContact C-N 3.35Å; K291-Q293 PolarHBondContact O-N 3.08Å; K291-S294 WeakPolarHBondContact O-CB 3.46Å; K291-S294 PolarHBondContact O-N 3.45Å; K291-I295 HydrophobicContact CG-CD1 4.34Å; K291-I295 WeakPolarHBondContact O-CG1 3.38Å; K291-I295 PolarHBondContact O-N 2.88Å
292	A	93.3	Very high	88.7	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.008	39%	0.387	C	S	.	.	H	α-helix	trans	-59.2	-45	177.2	0	0	0	0	0	111.8	V128 F130 Q208 N288 S289 I290 I295 I296	V128-A292 HydrophobicContact CG2-CB 3.67Å; F130-A292 HydrophobicContact CD1-CB 3.91Å; F130-A292 HydrophobicContact CE1-CB 3.44Å; F130-A292 VanDerWaalsContact CE1-CB 3.44Å; F130-A292 HydrophobicContact CZ-CB 4.1Å; Q208-A292 PolarHBondContact NE2-O 3.24Å; N288-A292 VanDerWaalsContact O-CB 3.26Å; N288-A292 WeakPolarHBondContact O-CB 3.47Å; N288-A292 PolarHBondContact O-N 2.92Å; S289-A292 WeakPolarHBondContact O-CB 3.42Å; S289-A292 PolarHBondContact O-N 3.1Å; I290-A292 VanDerWaalsContact C-N 3.33Å; I290-A292 PolarHBondContact O-N 2.57Å; A292-I295 PolarHBondContact O-N 2.65Å; A292-I296 WeakPolarHBondContact O-CG1 3.27Å; A292-I296 PolarHBondContact O-N 3.29Å; A292-I296 VanDerWaalsContact O-N 3.15Å
293	Q	92.8	Very high	87.7	Confident	107 Å²	107	71 Å²	71	50%	0.5	36%	0.357	S	S	.	.	H	α-helix	trans	-64.6	-41.4	175.2	-65.9	-66.6	9.4	0	0	112.1	S289 I290 K291 I295 I296 D297	S289-Q293 WeakPolarHBondContact O-CG 3.29Å; S289-Q293 PolarHBondContact O-N 2.99Å; I290-Q293 PolarHBondContact O-N 3.24Å; K291-Q293 VanDerWaalsContact C-N 3.35Å; K291-Q293 PolarHBondContact O-N 3.08Å; Q293-I295 VanDerWaalsContact C-N 3.28Å; Q293-I295 PolarHBondContact O-N 3.23Å; Q293-I296 WeakPolarHBondContact O-CB 3.38Å; Q293-I296 PolarHBondContact O-N 2.98Å; Q293-I296 VanDerWaalsContact O-N 3.13Å; Q293-D297 PolarHBondContact O-N 2.88Å
294	S	92.9	Very high	86.7	Confident	75 Å²	75	70.5 Å²	70.5	52%	0.524	36%	0.359	S	S	.	.	H	α-helix	trans	-60.3	-36.3	175.5	-175.9	0	0	0	0	112.8	I290 K291 S298	I290-S294 PolarHBondContact O-N 3.05Å; K291-S294 WeakPolarHBondContact O-CB 3.46Å; K291-S294 PolarHBondContact O-N 3.45Å; S294-S298 WeakPolarHBondContact O-CB 3.47Å; S294-S298 PolarHBondContact O-N 2.72Å
295	I	92	Very high	85.3	Confident	10 Å²	10	77.7 Å²	77.7	5%	0.051	39%	0.385	C	S	.	.	H	α-helix	trans	-66.1	-45	175.3	-67.9	165.7	0	0	0	110.1	E126 V128 I196 K291 A292 Q293 S298 V299	E126-I295 HydrophobicContact CG-CD1 4.32Å; V128-I295 HydrophobicContact CG1-CD1 4.19Å; V128-I295 HydrophobicContact CG2-CD1 4.44Å; I196-I295 HydrophobicContact CD1-CG2 4.12Å; K291-I295 HydrophobicContact CG-CD1 4.34Å; K291-I295 WeakPolarHBondContact O-CG1 3.38Å; K291-I295 PolarHBondContact O-N 2.88Å; A292-I295 PolarHBondContact O-N 2.65Å; Q293-I295 VanDerWaalsContact C-N 3.28Å; Q293-I295 PolarHBondContact O-N 3.23Å; I295-S298 WeakPolarHBondContact O-CB 3.28Å; I295-S298 PolarHBondContact O-N 2.99Å; I295-V299 PolarHBondContact O-N 2.91Å; I295-V299 VanDerWaalsContact O-N 3.13Å
296	I	92.4	Very high	83.9	Confident	13 Å²	13	77.6 Å²	77.6	7%	0.067	39%	0.388	C	S	.	.	H	α-helix	trans	-58.4	-51.8	177.3	-67.5	166.5	0	0	0	110.6	I196 L260 A292 Q293 S298 V299 Y300	I196-I296 HydrophobicContact CD1-CB 4.19Å; I196-I296 HydrophobicContact CD1-CG1 3.73Å; I196-I296 HydrophobicContact CG2-CG1 4.47Å; L260-I296 HydrophobicContact CD1-CD1 4.25Å; L260-I296 HydrophobicContact CD1-CG1 4.27Å; L260-I296 HydrophobicContact CD2-CD1 4.06Å; L260-I296 HydrophobicContact CD2-CG1 4.33Å; L260-I296 HydrophobicContact CD2-CG2 4.07Å; A292-I296 WeakPolarHBondContact O-CG1 3.27Å; A292-I296 PolarHBondContact O-N 3.29Å; A292-I296 VanDerWaalsContact O-N 3.15Å; Q293-I296 WeakPolarHBondContact O-CB 3.38Å; Q293-I296 PolarHBondContact O-N 2.98Å; Q293-I296 VanDerWaalsContact O-N 3.13Å; I296-S298 VanDerWaalsContact C-N 3.26Å; I296-S298 PolarHBondContact O-N 3.04Å; I296-V299 PolarHBondContact O-N 3.21Å; I296-V299 VanDerWaalsContact O-N 3.15Å; I296-Y300 HydrophobicContact CG2-CD2 3.74Å; I296-Y300 HydrophobicContact CG2-CE2 3.69Å; I296-Y300 VanDerWaalsContact O-CD2 3.32Å; I296-Y300 WeakPolarHBondContact O-CD2 2.91Å; I296-Y300 PolarHBondContact O-N 2.66Å; I296-Y300 VanDerWaalsContact O-N 3.12Å
297	D	91.3	Very high	82.4	Confident	79 Å²	79	73.8 Å²	73.8	42%	0.422	37%	0.372	S	S	.	.	H	α-helix	trans	-57	-40.7	178.4	-79.5	-2.4	0	0	0	112.3	Q293 Y300 K301	Q293-D297 PolarHBondContact O-N 2.88Å; D297-Y300 PolarHBondContact O-N 3.46Å; D297-K301 VanDerWaalsContact O-CB 3.27Å; D297-K301 WeakPolarHBondContact O-CB 3.41Å; D297-K301 WeakPolarHBondContact O-CD 3.27Å; D297-K301 WeakPolarHBondContact O-CG 3.4Å; D297-K301 PolarHBondContact O-N 3.31Å
298	S	88.1	Confident	80.3	Confident	60 Å²	60	72.3 Å²	72.3	42%	0.42	37%	0.369	S	S	.	.	H	α-helix	trans	-61	-46	178.1	-173.6	0	0	0	0	111.5	S294 I295 I296 Y300 K301 L302	S294-S298 WeakPolarHBondContact O-CB 3.47Å; S294-S298 PolarHBondContact O-N 2.72Å; I295-S298 WeakPolarHBondContact O-CB 3.28Å; I295-S298 PolarHBondContact O-N 2.99Å; I296-S298 VanDerWaalsContact C-N 3.26Å; I296-S298 PolarHBondContact O-N 3.04Å; S298-Y300 PolarHBondContact O-N 2.73Å; S298-K301 PolarHBondContact O-N 3.27Å; S298-L302 VanDerWaalsContact O-CG 3.29Å; S298-L302 WeakPolarHBondContact O-CG 3.3Å; S298-L302 PolarHBondContact O-N 2.58Å
299	V	85.9	Confident	78.5	Confident	9 Å²	9	75.7 Å²	75.7	6%	0.055	39%	0.386	C	S	.	.	H	α-helix	trans	-62.5	-42.8	178.7	173.4	0	0	0	0	111.5	R194 I196 I295 I296	R194-V299 HydrophobicContact CB-CG2 4.11Å; I196-V299 HydrophobicContact CD1-CB 4.04Å; I196-V299 HydrophobicContact CD1-CG2 3.77Å; I196-V299 HydrophobicContact CG1-CG2 4.17Å; I295-V299 PolarHBondContact O-N 2.91Å; I295-V299 VanDerWaalsContact O-N 3.13Å; I296-V299 PolarHBondContact O-N 3.21Å; I296-V299 VanDerWaalsContact O-N 3.15Å
300	Y	85.5	Confident	76.8	Confident	88 Å²	88	77.6 Å²	77.6	35%	0.345	40%	0.4	S	S	.	.	H	α-helix	trans	-72.4	-35.7	178	-75.8	-73.4	0	0	0	113.5	P259 I296 D297 S298 L303 N304	P259-Y300 HydrophobicContact CG-CE1 3.82Å; P259-Y300 WeakPolarHBondContact CG-OH 3.47Å; I296-Y300 HydrophobicContact CG2-CD2 3.74Å; I296-Y300 HydrophobicContact CG2-CE2 3.69Å; I296-Y300 VanDerWaalsContact O-CD2 3.32Å; I296-Y300 WeakPolarHBondContact O-CD2 2.91Å; I296-Y300 PolarHBondContact O-N 2.66Å; I296-Y300 VanDerWaalsContact O-N 3.12Å; D297-Y300 PolarHBondContact O-N 3.46Å; S298-Y300 PolarHBondContact O-N 2.73Å; Y300-L303 HydrophobicContact CD1-CD1 4.17Å; Y300-L303 PolarHBondContact O-N 2.86Å; Y300-N304 PolarHBondContact O-N 3.01Å
301	K	82.3	Confident	74.5	Confident	121 Å²	121	74 Å²	74	53%	0.526	39%	0.393	S	S	.	.	H	α-helix	trans	-63.6	-42.8	176.3	-78.1	168.4	-174.9	167	0	111.8	D297 S298 L303 N304 Y305	D297-K301 VanDerWaalsContact O-CB 3.27Å; D297-K301 WeakPolarHBondContact O-CB 3.41Å; D297-K301 WeakPolarHBondContact O-CD 3.27Å; D297-K301 WeakPolarHBondContact O-CG 3.4Å; D297-K301 PolarHBondContact O-N 3.31Å; S298-K301 PolarHBondContact O-N 3.27Å; K301-L303 PolarHBondContact O-N 3.31Å; K301-N304 PolarHBondContact O-N 3.09Å; K301-N304 VanDerWaalsContact O-N 3.12Å; K301-Y305 WeakPolarHBondContact O-CD2 3.07Å; K301-Y305 PolarHBondContact O-N 3.11Å
302	L	70.6	Confident	72.4	Confident	94 Å²	94	72.8 Å²	72.8	49%	0.492	40%	0.398	S	S	.	.	H	α-helix	trans	-59.3	-31.6	-179.3	-74	172.3	0	0	0	112.7	S298 T306	S298-L302 VanDerWaalsContact O-CG 3.29Å; S298-L302 WeakPolarHBondContact O-CG 3.3Å; S298-L302 PolarHBondContact O-N 2.58Å; L302-T306 WeakPolarHBondContact O-CB 3.5Å; L302-T306 PolarHBondContact O-N 3.21Å; L302-T306 PolarHBondContact O-OG1 3.3Å
303	L	69.2	Low	70.2	Confident	18 Å²	18	81.1 Å²	81.1	9%	0.094	44%	0.435	C	S	.	.	H	α-helix	trans	-69.6	-46.7	175	-61.3	156.1	0	0	0	111.9	K191 Y192 Y300 K301 Y305 T306 L307	K191-L303 HydrophobicContact CB-CD2 4.18Å; K191-L303 VanDerWaalsContact O-CD2 3.3Å; K191-L303 WeakPolarHBondContact O-CD2 3.47Å; Y192-L303 HydrophobicContact CD1-CD1 3.24Å; Y192-L303 HydrophobicContact CD1-CD2 3.56Å; Y192-L303 HydrophobicContact CD1-CG 3.86Å; Y192-L303 HydrophobicContact CD2-CD2 4.32Å; Y192-L303 HydrophobicContact CE1-CD1 2.92Å; Y192-L303 HydrophobicContact CE1-CD2 3.87Å; Y192-L303 HydrophobicContact CE1-CG 3.95Å; Y192-L303 HydrophobicContact CG-CD1 4.32Å; Y192-L303 HydrophobicContact CG-CD2 3.85Å; Y300-L303 HydrophobicContact CD1-CD1 4.17Å; Y300-L303 PolarHBondContact O-N 2.86Å; K301-L303 PolarHBondContact O-N 3.31Å; L303-Y305 VanDerWaalsContact C-N 3.27Å; L303-Y305 PolarHBondContact O-N 3.14Å; L303-T306 PolarHBondContact O-N 3.16Å; L303-L307 WeakPolarHBondContact O-CB 3.45Å; L303-L307 VanDerWaalsContact O-CG 3.22Å; L303-L307 WeakPolarHBondContact O-CG 3.43Å; L303-L307 PolarHBondContact O-N 3.49Å
304	N	65.9	Low	67.8	Low	99 Å²	99	83.4 Å²	83.4	53%	0.529	45%	0.449	S	S	.	.	H	α-helix	trans	-62.2	-39.3	180	-71.4	-23.1	0	0	0	110.6	Y300 K301 N308	Y300-N304 PolarHBondContact O-N 3.01Å; K301-N304 PolarHBondContact O-N 3.09Å; K301-N304 VanDerWaalsContact O-N 3.12Å; N304-N308 WeakPolarHBondContact O-CB 3.32Å; N304-N308 PolarHBondContact O-N 2.9Å; N304-N308 PolarHBondContact O-ND2 2.99Å; N304-N308 VanDerWaalsContact O-ND2 3.11Å
305	Y	58.2	Low	65.1	Low	163 Å²	163	85.3 Å²	85.3	64%	0.639	46%	0.461	S	S	*	.	H	α-helix	trans	-65.1	-44.7	172.6	-84	-75.9	0	0	0	112.8	K301 L303 L307 N308 I309	K301-Y305 WeakPolarHBondContact O-CD2 3.07Å; K301-Y305 PolarHBondContact O-N 3.11Å; L303-Y305 VanDerWaalsContact C-N 3.27Å; L303-Y305 PolarHBondContact O-N 3.14Å; Y305-L307 PolarHBondContact O-N 3.3Å; Y305-N308 PolarHBondContact O-N 2.91Å; Y305-I309 WeakPolarHBondContact O-CG1 3.25Å; Y305-I309 PolarHBondContact O-N 3.38Å
306	T	57.6	Low	62.4	Low	86 Å²	86	98.1 Å²	98.1	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-66.4	-37.8	-179.4	-55.5	0	0	0	0	111.8	L302 L303 I309 S310	L302-T306 WeakPolarHBondContact O-CB 3.5Å; L302-T306 PolarHBondContact O-N 3.21Å; L302-T306 PolarHBondContact O-OG1 3.3Å; L303-T306 PolarHBondContact O-N 3.16Å; T306-I309 PolarHBondContact O-N 3.39Å; T306-S310 PolarHBondContact O-N 3.35Å
307	L	54.9	Low	60.9	Low	86 Å²	86	102.4 Å²	102.4	45%	0.45	54%	0.54	S	S	.	.	H	α-helix	trans	-67.3	-39.4	174.5	-69.5	171.1	0	0	0	111.7	L303 Y305 I309 S310 G311	L303-L307 WeakPolarHBondContact O-CB 3.45Å; L303-L307 VanDerWaalsContact O-CG 3.22Å; L303-L307 WeakPolarHBondContact O-CG 3.43Å; L303-L307 PolarHBondContact O-N 3.49Å; Y305-L307 PolarHBondContact O-N 3.3Å; L307-I309 VanDerWaalsContact C-N 3.35Å; L307-I309 PolarHBondContact O-N 3.44Å; L307-S310 PolarHBondContact O-N 3.4Å; L307-G311 PolarHBondContact O-N 3.34Å
308	N	46.3	Very low	59.3	Low	119 Å²	119	103.6 Å²	103.6	64%	0.636	55%	0.546	S	S	*	.	H	α-helix	trans	-65.5	-36.6	175.8	-76.2	-26.4	0	0	0	112.4	N304 Y305 S312	N304-N308 WeakPolarHBondContact O-CB 3.32Å; N304-N308 PolarHBondContact O-N 2.9Å; N304-N308 PolarHBondContact O-ND2 2.99Å; N304-N308 VanDerWaalsContact O-ND2 3.11Å; Y305-N308 PolarHBondContact O-N 2.91Å; N308-S312 PolarHBondContact O-N 3.24Å
309	I	55.2	Low	57.7	Low	104 Å²	104	106.1 Å²	106.1	53%	0.533	55%	0.553	S	S	.	*	H	α-helix	trans	-73.1	-42.3	177.9	-63.9	165.5	0	0	0	110.9	Y305 T306 L307 G311 S312 F313	Y305-I309 WeakPolarHBondContact O-CG1 3.25Å; Y305-I309 PolarHBondContact O-N 3.38Å; T306-I309 PolarHBondContact O-N 3.39Å; L307-I309 VanDerWaalsContact C-N 3.35Å; L307-I309 PolarHBondContact O-N 3.44Å; I309-G311 VanDerWaalsContact C-N 3.32Å; I309-G311 PolarHBondContact O-N 2.93Å; I309-S312 PolarHBondContact O-N 3.14Å; I309-S312 VanDerWaalsContact O-N 3.14Å; I309-S312 PolarHBondContact O-OG 3.35Å; I309-F313 PolarHBondContact O-N 2.98Å
310	S	53.5	Low	56	Low	67 Å²	67	111.8 Å²	111.8	47%	0.469	58%	0.582	S	S	.	*	H	α-helix	trans	-68.8	-32.2	178.5	87.8	0	0	0	0	112.5	T306 L307 S312 F313	T306-S310 PolarHBondContact O-N 3.35Å; L307-S310 PolarHBondContact O-N 3.4Å; S310-S312 VanDerWaalsContact C-N 3.29Å; S310-S312 PolarHBondContact O-N 3.22Å; S310-F313 PolarHBondContact O-N 2.94Å
311	G	44.4	Very low	54.2	Low	51 Å²	51	113.3 Å²	113.3	53%	0.526	60%	0.597	S	S	.	*	H	α-helix	trans	-64	-31	170.9	0	0	0	0	0	113.5	L307 I309	L307-G311 PolarHBondContact O-N 3.34Å; I309-G311 VanDerWaalsContact C-N 3.32Å; I309-G311 PolarHBondContact O-N 2.93Å
312	S	47.9	Very low	52.3	Low	79 Å²	79	112.7 Å²	112.7	55%	0.552	60%	0.602	S	S	*	*	H	α-helix	trans	-78.9	-18.8	178.9	71.3	0	0	0	0	114.6	N308 I309 S310	N308-S312 PolarHBondContact O-N 3.24Å; I309-S312 PolarHBondContact O-N 3.14Å; I309-S312 VanDerWaalsContact O-N 3.14Å; I309-S312 PolarHBondContact O-OG 3.35Å; S310-S312 VanDerWaalsContact C-N 3.29Å; S310-S312 PolarHBondContact O-N 3.22Å
313	F	47.1	Very low	51	Low	175 Å²	175	114.1 Å²	114.1	77%	0.768	61%	0.609	S	S	*	*	H	α-helix	trans	-95.6	-4	-179.3	-101.7	-92.7	0	0	0	114.5	I309 S310	I309-F313 PolarHBondContact O-N 2.98Å; S310-F313 PolarHBondContact O-N 2.94Å
314	L	42.6	Very low	49.6	Very low	155 Å²	155	121.5 Å²	121.5	81%	0.812	65%	0.649	S	S	*	*	S	Bend	trans	-98.4	11.2	178.8	-110.6	110.5	0	0	0	115.1
315	C	36.6	Very low	48.2	Very low	115 Å²	115	123.3 Å²	123.3	78%	0.777	66%	0.659	S	S	*	*			trans	-121.1	77.5	169.8	-80.6	0	0	0	0	111.2
316	K	34.2	Very low	47.3	Very low	280 Å²	280	119.7 Å²	119.7	100%	1.217	66%	0.661	S	S	*	*			trans	-147.4	0	154.2	-87.6	-168.4	179.8	173.7	0	110.1

Retrieved 316 of 316 residues in 166.4 ms (Link to these results)

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