A0A077ZCS7_TRITR Loading...

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AlphaFold DB , UniProt , Accession A0A077ZCS7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 564 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	28.4	Very low	27.5	Very low	252 Å²	252	150.2 Å²	150.2	100%	1.241	84%	0.843	S	S	*	*				0	121.6	0	-74.8	-178.1	-179.3	0	0	107.6
2	G	26.5	Very low	27	Very low	80 Å²	80	155 Å²	155	83%	0.825	85%	0.849	S	S	*	*			trans	130	94	175.9	0	0	0	0	0	113.2
3	N	25.1	Very low	27.1	Very low	162 Å²	162	153.5 Å²	153.5	87%	0.866	85%	0.847	S	S	*	*			trans	-68.4	146.8	-177.8	-65.2	-33.8	0	0	0	114.2
4	C	28.8	Very low	27.1	Very low	117 Å²	117	150.1 Å²	150.1	79%	0.791	84%	0.836	S	S	*	*			trans	-159	93.6	144.8	-87	0	0	0	0	108.4
5	L	27.8	Very low	26.9	Very low	159 Å²	159	147.7 Å²	147.7	83%	0.832	83%	0.833	S	S	*	*				97	119.8	99.7	-82	167.7	0	0	0	113.6
6	P	25.3	Very low	27	Very low	108 Å²	108	149 Å²	149	70%	0.701	84%	0.835	S	S	*	*			trans	-96	147.7	166.6	36.1	-28	0	0	0	111.1
7	P	32.1	Very low	27	Very low	120 Å²	120	154.2 Å²	154.2	78%	0.779	84%	0.839	S	S	*	*			trans	-91.2	101.3	171.4	31.9	-24.3	0	0	0	109.8
8	I	31.8	Very low	26.9	Very low	138 Å²	138	155.1 Å²	155.1	71%	0.708	84%	0.842	S	S	*	*				77.2	100.4	97.6	-64	157.8	0	0	0	113.3
9	G	23	Very low	26.9	Very low	72 Å²	72	159.9 Å²	159.9	74%	0.742	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-73.5	144.3	162.9	0	0	0	0	0	111.9
10	W	27.5	Very low	26.8	Very low	248 Å²	248	164.2 Å²	164.2	94%	0.939	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-90.5	129.5	-176.7	-75.2	59.6	0	0	0	111.3
11	K	25.8	Very low	26.9	Very low	196 Å²	196	168.4 Å²	168.4	85%	0.852	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-82.8	138	176.4	-78.8	178.3	173.1	177	0	111
12	F	22.1	Very low	26.8	Very low	208 Å²	208	160.6 Å²	160.6	91%	0.912	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-50.5	137.7	162.5	-98.4	-104.9	0	0	0	112.5
13	V	27.8	Very low	27	Very low	136 Å²	136	165.9 Å²	165.9	82%	0.824	83%	0.831	S	S	*	*			trans	-126.8	124.8	162	-178.4	0	0	0	0	108.8
14	P	27.1	Very low	27.2	Very low	106 Å²	106	167 Å²	167	69%	0.688	83%	0.828	S	S	*	*			trans	-91.7	136.8	-177.2	33.2	-30.9	0	0	0	114
15	S	25.1	Very low	27.1	Very low	114 Å²	114	168 Å²	168	80%	0.797	83%	0.831	S	S	*	*			trans	25.3	124.2	149.1	64.5	0	0	0	0	121.2
16	I	28.5	Very low	27.3	Very low	168 Å²	168	166.3 Å²	166.3	86%	0.862	83%	0.83	S	S	*	*			trans	-130.1	108.5	155.2	-66.7	179.8	0	0	0	112.1
17	R	27.2	Very low	27.5	Very low	237 Å²	237	170.4 Å²	170.4	89%	0.894	84%	0.836	S	S	*	*			trans	31	118.5	141.1	-71.2	179	174	171.8	-1.7	122.3
18	L	23.7	Very low	27.5	Very low	171 Å²	171	172.7 Å²	172.7	90%	0.895	84%	0.842	S	S	*	*			trans	-30.2	132.2	144.7	-74.5	140.7	0	0	0	115.4
19	R	28.5	Very low	27.3	Very low	247 Å²	247	171.4 Å²	171.4	93%	0.932	85%	0.846	S	S	*	*			trans	-128.7	114.7	151.9	-94.4	-173.6	174.6	-180	-0.1	111
20	R	24.7	Very low	27.9	Very low	245 Å²	245	173.2 Å²	173.2	93%	0.925	84%	0.844	S	S	*	*			trans	-58	136.8	162.2	-72.3	172.6	167.2	169.1	-4.7	110.5
21	R	29.4	Very low	28.1	Very low	252 Å²	252	167.9 Å²	167.9	95%	0.951	84%	0.838	S	S	*	*			trans	-139.2	110.3	148.6	-113.1	-178.5	179.9	-179.9	-0	109.7
22	A	24.6	Very low	28.1	Very low	89 Å²	89	167.3 Å²	167.3	74%	0.736	84%	0.839	S	S	*	*			trans	-90.7	165.1	164.5	0	0	0	0	0	110.1
23	K	30.5	Very low	28.4	Very low	191 Å²	191	165.9 Å²	165.9	83%	0.83	83%	0.832	S	S	*	*			trans	97.6	129.1	179.6	-63.7	177.7	177.9	176.6	0	112.2
24	K	31	Very low	28.3	Very low	185 Å²	185	165.2 Å²	165.2	80%	0.804	83%	0.834	S	S	*	*			cis	-165.5	138.2	11.3	-108.9	168.1	178.2	-171.5	0	106.9
25	T	26.5	Very low	28.3	Very low	137 Å²	137	170.9 Å²	170.9	84%	0.84	84%	0.841	S	S	*	*			trans	-68.4	153.4	158.8	41.9	0	0	0	0	110.9
26	P	31.9	Very low	28.3	Very low	125 Å²	125	171.2 Å²	171.2	81%	0.812	84%	0.839	S	S	*	*				-135.5	156.4	120.9	34.6	-21.2	0	0	0	114.3
27	K	28.9	Very low	28.3	Very low	193 Å²	193	172.8 Å²	172.8	84%	0.839	84%	0.84	S	S	*	*			trans	-61.5	143.3	179.1	-64.2	169.2	170.7	179.1	0	112.5
28	N	31.9	Very low	28.3	Very low	169 Å²	169	171.4 Å²	171.4	90%	0.904	84%	0.84	S	S	*	*				-168.6	126.2	125.3	-91.2	-12.8	0	0	0	110.5
29	S	28.4	Very low	28.5	Very low	111 Å²	111	169.9 Å²	169.9	78%	0.776	84%	0.838	S	S	*	*			trans	-93.2	-179.4	168.5	50.5	0	0	0	0	110.3
30	P	35.3	Very low	28.4	Very low	110 Å²	110	162.4 Å²	162.4	71%	0.714	82%	0.817	S	S	*	*			cis	-128.4	162.9	-46.4	33.3	-17.1	0	0	0	111.2
31	V	30.8	Very low	28.6	Very low	135 Å²	135	156.9 Å²	156.9	82%	0.818	81%	0.812	S	S	*	*			trans	-132.4	106.1	158.3	178.6	0	0	0	0	108.4
32	E	25.7	Very low	28.6	Very low	185 Å²	185	154.5 Å²	154.5	86%	0.864	80%	0.803	S	S	*	*			trans	-66.1	122.2	163.8	-72.8	178.4	141.6	0	0	109.6
33	K	29.9	Very low	28.8	Very low	178 Å²	178	156.6 Å²	156.6	77%	0.774	80%	0.802	S	S	*	*			trans	-135.4	100.1	150.2	-79.3	-169.9	178.7	178.4	0	107.9	W35	K33-W35 PolarHBondContact O-N 3.04Å
34	S	24.2	Very low	28.6	Very low	122 Å²	122	155 Å²	155	85%	0.853	80%	0.803	S	S	*	*			trans	-68	108.4	170.2	46.4	0	0	0	0	109.5
35	W	27.5	Very low	28.5	Very low	224 Å²	224	151.1 Å²	151.1	85%	0.848	79%	0.794	S	S	*	*			trans	-114.1	117.7	160.5	-82.1	81.9	0	0	0	109	K33	K33-W35 PolarHBondContact O-N 3.04Å
36	T	24.8	Very low	28.4	Very low	121 Å²	121	151.2 Å²	151.2	74%	0.742	79%	0.789	S	S	*	*			trans	-22.3	126.5	161.6	50.7	0	0	0	0	115.8
37	K	27.9	Very low	28.1	Very low	202 Å²	202	150 Å²	150	88%	0.878	78%	0.781	S	S	*	*			trans	-129.8	103.4	145.7	-91.5	-173.2	176.4	-179.2	0	109.3	T39	K37-T39 PolarHBondContact O-N 3.4Å
38	K	27.4	Very low	27.9	Very low	207 Å²	207	147 Å²	147	90%	0.9	77%	0.774	S	S	*	*			trans	-58	123.8	154.8	-78	179.3	173.8	179.1	0	106.9	D40	K38-D40 PolarHBondContact O-N 3.47Å
39	T	28.2	Very low	27.7	Very low	139 Å²	139	143.6 Å²	143.6	85%	0.853	76%	0.755	S	S	*	*			trans	-67.4	112	172.7	40.2	0	0	0	0	109.1	K37	K37-T39 PolarHBondContact O-N 3.4Å
40	D	27.9	Very low	27.5	Very low	91 Å²	91	144.1 Å²	144.1	49%	0.487	75%	0.748	S	S	.	*			trans	-71.8	125.6	168.2	-171.4	-22.4	0	0	0	108.5	K38 R42	K38-D40 PolarHBondContact O-N 3.47Å; D40-R42 PolarHBondContact O-N 3.21Å; D40-R42 VanDerWaalsContact O-N 3.11Å; D40-R42 WeakPolarHBondContact OD1-CB 3.42Å; D40-R42 PolarHBondContact OD1-N 2.93Å; D40-R42 VanDerWaalsContact OD1-N 3.08Å; D40-R42 IonicContact OD1-NE 2.61Å; D40-R42 PolarHBondContact OD1-NE 3.47Å; D40-R42 IonicContact OD1-NH2 3.12Å; D40-R42 IonicContact OD2-NE 2.79Å; D40-R42 IonicContact OD2-NH2 2.76Å
41	P	28.5	Very low	27.2	Very low	128 Å²	128	146.3 Å²	146.3	83%	0.831	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	10.9	180	31.7	-34.6	0	0	0	113.9
42	R	28.1	Very low	27.1	Very low	202 Å²	202	144.7 Å²	144.7	76%	0.762	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	11.7	178.1	-70.8	177.7	-72.1	-177.4	-0.9	115.5	D40 N44	D40-R42 PolarHBondContact O-N 3.21Å; D40-R42 VanDerWaalsContact O-N 3.11Å; D40-R42 WeakPolarHBondContact OD1-CB 3.42Å; D40-R42 PolarHBondContact OD1-N 2.93Å; D40-R42 VanDerWaalsContact OD1-N 3.08Å; D40-R42 IonicContact OD1-NE 2.61Å; D40-R42 PolarHBondContact OD1-NE 3.47Å; D40-R42 IonicContact OD1-NH2 3.12Å; D40-R42 IonicContact OD2-NE 2.79Å; D40-R42 IonicContact OD2-NH2 2.76Å; R42-N44 PolarHBondContact O-N 2.97Å
43	N	28.5	Very low	27.4	Very low	133 Å²	133	144.8 Å²	144.8	71%	0.711	74%	0.743	S	S	*	*			trans	-82.3	73.9	171.8	-136.5	20.8	0	0	0	110	T45	N43-T45 PolarHBondContact O-N 2.62Å
44	N	27.5	Very low	28	Very low	159 Å²	159	140.8 Å²	140.8	85%	0.85	74%	0.744	S	S	*	*			trans	-65.8	74.8	157.3	-99.4	-2.2	0	0	0	107.3	R42 L46	R42-N44 PolarHBondContact O-N 2.97Å; N44-L46 VanDerWaalsContact C-N 3.25Å; N44-L46 PolarHBondContact O-N 2.78Å
45	T	28.4	Very low	29	Very low	102 Å²	102	137.1 Å²	137.1	63%	0.626	72%	0.716	S	S	*	*			trans	-66.2	98.3	161.1	49.2	0	0	0	0	105.7	N43	N43-T45 PolarHBondContact O-N 2.62Å
46	L	25.5	Very low	30.2	Very low	140 Å²	140	129.3 Å²	129.3	73%	0.733	70%	0.695	S	S	*	*			trans	-34.9	134.6	154.6	-79.1	154.5	0	0	0	107.6	N44 L48	N44-L46 VanDerWaalsContact C-N 3.25Å; N44-L46 PolarHBondContact O-N 2.78Å; L46-L48 VanDerWaalsContact C-N 3.26Å; L46-L48 PolarHBondContact O-N 2.87Å
47	P	23.8	Very low	31.4	Very low	99 Å²	99	128.2 Å²	128.2	64%	0.643	68%	0.683	S	S	*	*			trans	-60.5	101.2	175	25.5	-29.8	0	0	0	106.4	L49	P47-L49 VanDerWaalsContact C-N 3.25Å; P47-L49 PolarHBondContact O-N 3.19Å
48	L	26	Very low	32.8	Very low	131 Å²	131	123.1 Å²	123.1	69%	0.686	67%	0.674	S	S	*	*			trans	-56	102.6	163.8	-104.2	128.4	0	0	0	104.1	L46 L50	L46-L48 VanDerWaalsContact C-N 3.26Å; L46-L48 PolarHBondContact O-N 2.87Å; L48-L50 PolarHBondContact O-N 3.38Å
49	L	27.1	Very low	34.5	Very low	96 Å²	96	120 Å²	120	50%	0.503	66%	0.662	S	S	.	*			trans	-64.1	71.3	157.3	-98.9	155.2	0	0	0	105.8	P47 I51	P47-L49 VanDerWaalsContact C-N 3.25Å; P47-L49 PolarHBondContact O-N 3.19Å; L49-I51 PolarHBondContact O-N 3.02Å
50	L	24.3	Very low	36.3	Very low	122 Å²	122	114.5 Å²	114.5	64%	0.639	63%	0.627	S	S	*	*			trans	-48.7	116.6	151.6	-89.7	151.6	0	0	0	103.8	L48 T52	L48-L50 PolarHBondContact O-N 3.38Å; L50-T52 HydrophobicContact CB-CG2 3.99Å; L50-T52 PolarHBondContact O-N 2.61Å
51	I	29.3	Very low	38.6	Very low	157 Å²	157	113.6 Å²	113.6	81%	0.805	63%	0.628	S	S	*	*			trans	-61.9	76.7	159.3	-56.4	174	0	0	0	104.7	L49	L49-I51 PolarHBondContact O-N 3.02Å
52	T	28.5	Very low	40.6	Very low	100 Å²	100	111.6 Å²	111.6	61%	0.613	61%	0.613	S	S	*	*			trans	-61.6	137.8	165.3	48.9	0	0	0	0	104.9	L50 A54	L50-T52 HydrophobicContact CB-CG2 3.99Å; L50-T52 PolarHBondContact O-N 2.61Å; T52-A54 PolarHBondContact O-N 2.97Å
53	E	31.6	Very low	42.6	Very low	187 Å²	187	106.2 Å²	106.2	87%	0.874	61%	0.607	S	S	*	*			trans	-39.7	120.7	175.6	-69.8	-174.8	158.4	0	0	108.9	T55	E53-T55 PolarHBondContact O-N 2.8Å
54	A	42	Very low	44.4	Very low	95 Å²	95	103.8 Å²	103.8	79%	0.785	59%	0.588	S	S	*	*			trans	-51.4	114.6	-171.7	0	0	0	0	0	108.5	T52 P56	T52-A54 PolarHBondContact O-N 2.97Å; A54-P56 VanDerWaalsContact O-CD 3.26Å; A54-P56 WeakPolarHBondContact O-CD 3.36Å
55	T	46.7	Very low	46.3	Very low	45 Å²	45	100.6 Å²	100.6	28%	0.276	56%	0.564	S	S	.	*			trans	-55.2	118.7	-179.2	-47.3	0	0	0	0	107.4	E53 L57 Q59 M60	E53-T55 PolarHBondContact O-N 2.8Å; T55-L57 PolarHBondContact O-N 3.32Å; T55-Q59 HydrophobicContact CG2-CB 3.8Å; T55-M60 HydrophobicContact CG2-CG 4.05Å
56	P	51.4	Low	48.3	Very low	60 Å²	60	100.7 Å²	100.7	39%	0.39	56%	0.56	S	S	.	*			trans	-51.6	140	179.9	-26.4	33.2	0	0	0	109.5	A54 S58 Q59 M60	A54-P56 VanDerWaalsContact O-CD 3.26Å; A54-P56 WeakPolarHBondContact O-CD 3.36Å; P56-S58 PolarHBondContact O-N 3.03Å; P56-Q59 HydrophobicContact CB-CG 4.36Å; P56-Q59 HydrophobicContact CG-CG 4.44Å; P56-Q59 WeakPolarHBondContact O-CA 3.44Å; P56-Q59 PolarHBondContact O-N 2.98Å; P56-M60 PolarHBondContact O-N 2.76Å
57	L	51	Low	50.5	Low	97 Å²	97	96 Å²	96	51%	0.508	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-50.6	-35	179.6	-78.4	163.5	0	0	0	111.6	T55 Q59 M60 R65	T55-L57 PolarHBondContact O-N 3.32Å; L57-Q59 VanDerWaalsContact C-N 3.25Å; L57-Q59 PolarHBondContact O-N 3.36Å; L57-M60 HydrophobicContact CD2-SD 4.5Å; L57-M60 PolarHBondContact O-N 3.28Å; L57-R65 HydrophobicContact CD2-CG 3.94Å; L57-R65 WeakPolarHBondContact O-CD 3.21Å; L57-R65 PolarHBondContact O-NE 3.48Å
58	S	57	Low	52.3	Low	96 Å²	96	91.9 Å²	91.9	67%	0.671	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-61.5	-27.2	176.2	54	0	0	0	0	114.6	P56	P56-S58 PolarHBondContact O-N 3.03Å
59	Q	62.8	Low	54.4	Low	142 Å²	142	88.7 Å²	88.7	66%	0.664	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-95.9	-4.6	180	-63.8	-179.7	1.9	0	0	112.8	T55 P56 L57	T55-Q59 HydrophobicContact CG2-CB 3.8Å; P56-Q59 HydrophobicContact CB-CG 4.36Å; P56-Q59 HydrophobicContact CG-CG 4.44Å; P56-Q59 WeakPolarHBondContact O-CA 3.44Å; P56-Q59 PolarHBondContact O-N 2.98Å; L57-Q59 VanDerWaalsContact C-N 3.25Å; L57-Q59 PolarHBondContact O-N 3.36Å
60	M	66.8	Low	56.7	Low	23 Å²	23	85.5 Å²	85.5	11%	0.113	48%	0.479	C	S	.	.	S	Bend	trans	-84.7	141.5	174.8	-70.3	-167.4	169.2	0	0	111.4	T55 P56 L57 R64 R65 L68	T55-M60 HydrophobicContact CG2-CG 4.05Å; P56-M60 PolarHBondContact O-N 2.76Å; L57-M60 HydrophobicContact CD2-SD 4.5Å; L57-M60 PolarHBondContact O-N 3.28Å; M60-R64 HydrophobicContact CB-CB 4.47Å; M60-R64 HydrophobicContact CB-CG 4.45Å; M60-R64 HydrophobicContact CG-CG 4.5Å; M60-R64 HydrophobicContact SD-CG 3.95Å; M60-R65 HydrophobicContact CB-CG 3.87Å; M60-R65 PolarHBondContact O-NE 3.36Å; M60-R65 PolarHBondContact O-NH2 2.88Å; M60-R65 VanDerWaalsContact O-NH2 3.12Å; M60-L68 HydrophobicContact CE-CD1 3.81Å; M60-L68 HydrophobicContact SD-CD1 3.57Å; M60-L68 VanDerWaalsContact SD-CD1 3.57Å
61	S	75	Confident	59.4	Low	71 Å²	71	87.5 Å²	87.5	50%	0.497	49%	0.489	S	S	.	.			trans	-56	147.9	171.1	70.1	0	0	0	0	111	S63 R64 R65	S61-S63 PolarHBondContact O-N 3.46Å; S61-R64 WeakPolarHBondContact O-CB 3.41Å; S61-R64 PolarHBondContact O-N 3.17Å; S61-R64 VanDerWaalsContact OG-CB 3.31Å; S61-R64 WeakPolarHBondContact OG-CB 3.32Å; S61-R64 PolarHBondContact OG-N 2.95Å; S61-R65 PolarHBondContact O-N 3.16Å
62	T	72.1	Confident	62.2	Low	87 Å²	87	81.7 Å²	81.7	53%	0.534	46%	0.459	S	S	.	.	H	α-helix	trans	-55.4	-41.1	-179.7	-50.9	0	0	0	0	111.5	R64 R65 N66	T62-R64 PolarHBondContact O-N 3.42Å; T62-R65 PolarHBondContact O-N 2.99Å; T62-N66 WeakPolarHBondContact O-CB 3.13Å; T62-N66 PolarHBondContact O-N 3.35Å
63	S	69.8	Low	65.2	Low	89 Å²	89	77.7 Å²	77.7	62%	0.622	44%	0.435	S	S	*	.	H	α-helix	trans	-59.8	-43.4	175.5	-48.9	0	0	0	0	112.4	S61 N66 Y67	S61-S63 PolarHBondContact O-N 3.46Å; S63-N66 PolarHBondContact O-N 3.17Å; S63-Y67 WeakPolarHBondContact O-CB 3.13Å; S63-Y67 PolarHBondContact O-N 3.04Å
64	R	66.9	Low	68.1	Low	82 Å²	82	69.2 Å²	69.2	31%	0.309	40%	0.395	S	S	.	.	H	α-helix	trans	-67.2	-44.1	178	-175.8	177.1	-177.2	173.7	1.9	111.2	M60 S61 T62 Y67 L68 Y477	M60-R64 HydrophobicContact CB-CB 4.47Å; M60-R64 HydrophobicContact CB-CG 4.45Å; M60-R64 HydrophobicContact CG-CG 4.5Å; M60-R64 HydrophobicContact SD-CG 3.95Å; S61-R64 WeakPolarHBondContact O-CB 3.41Å; S61-R64 PolarHBondContact O-N 3.17Å; S61-R64 VanDerWaalsContact OG-CB 3.31Å; S61-R64 WeakPolarHBondContact OG-CB 3.32Å; S61-R64 PolarHBondContact OG-N 2.95Å; T62-R64 PolarHBondContact O-N 3.42Å; R64-Y67 PolarHBondContact O-N 3.32Å; R64-L68 HydrophobicContact CG-CD1 3.91Å; R64-L68 WeakPolarHBondContact O-CB 3.2Å; R64-L68 WeakPolarHBondContact O-CG 3.27Å; R64-L68 PolarHBondContact O-N 3.43Å; R64-Y477 HydrophobicContact CG-CE1 3.84Å
65	R	67.2	Low	70.5	Confident	92 Å²	92	70.4 Å²	70.4	35%	0.347	38%	0.383	S	S	.	.	H	α-helix	trans	-58.1	-48.2	173.6	-86.7	-173.9	-90.9	164.5	-4.9	111.9	L57 M60 S61 T62 Y67 L68 C69	L57-R65 HydrophobicContact CD2-CG 3.94Å; L57-R65 WeakPolarHBondContact O-CD 3.21Å; L57-R65 PolarHBondContact O-NE 3.48Å; M60-R65 HydrophobicContact CB-CG 3.87Å; M60-R65 PolarHBondContact O-NE 3.36Å; M60-R65 PolarHBondContact O-NH2 2.88Å; M60-R65 VanDerWaalsContact O-NH2 3.12Å; S61-R65 PolarHBondContact O-N 3.16Å; T62-R65 PolarHBondContact O-N 2.99Å; R65-Y67 VanDerWaalsContact C-N 3.28Å; R65-Y67 PolarHBondContact O-N 2.81Å; R65-L68 PolarHBondContact O-N 3.28Å; R65-C69 WeakPolarHBondContact O-CA 3.15Å; R65-C69 WeakPolarHBondContact O-CB 3.42Å; R65-C69 PolarHBondContact O-N 3.19Å
66	N	70.2	Confident	72.7	Confident	103 Å²	103	69.5 Å²	69.5	55%	0.551	38%	0.378	S	S	*	.	H	α-helix	trans	-63.9	-33.7	179.8	-70.7	-9.3	0	0	0	112.1	T62 S63 S70	T62-N66 WeakPolarHBondContact O-CB 3.13Å; T62-N66 PolarHBondContact O-N 3.35Å; S63-N66 PolarHBondContact O-N 3.17Å; N66-S70 WeakPolarHBondContact O-CA 3.24Å; N66-S70 VanDerWaalsContact O-CB 3.26Å; N66-S70 WeakPolarHBondContact O-CB 3.5Å; N66-S70 PolarHBondContact O-N 3Å; N66-S70 VanDerWaalsContact O-N 3.16Å
67	Y	70.2	Confident	74.6	Confident	42 Å²	42	71.1 Å²	71.1	17%	0.165	39%	0.387	C	S	.	.	H	α-helix	trans	-70.5	-39.3	175.6	-176.8	-97.5	0	0	0	113	S63 R64 R65 K435 L437 D475 Y477 W479	S63-Y67 WeakPolarHBondContact O-CB 3.13Å; S63-Y67 PolarHBondContact O-N 3.04Å; R64-Y67 PolarHBondContact O-N 3.32Å; R65-Y67 VanDerWaalsContact C-N 3.28Å; R65-Y67 PolarHBondContact O-N 2.81Å; Y67-K435 VanDerWaalsContact CE1-NZ 3.27Å; Y67-K435 PolarHBondContact O-NZ 2.81Å; Y67-L437 HydrophobicContact CE2-CD1 4.29Å; Y67-L437 HydrophobicContact CE2-CD2 3.98Å; Y67-D475 VanDerWaalsContact CE1-OD2 3.23Å; Y67-D475 WeakPolarHBondContact CE1-OD2 3.46Å; Y67-D475 VanDerWaalsContact CZ-OD2 3.25Å; Y67-D475 PolarHBondContact OH-OD2 2.84Å; Y67-Y477 AromaticContact CD1-CD2 3.58Å; Y67-Y477 HydrophobicContact CD1-CD2 3.58Å; Y67-Y477 AromaticContact CD1-CE2 3.94Å; Y67-Y477 HydrophobicContact CD1-CE2 3.94Å; Y67-Y477 HydrophobicContact CD1-CG 4.19Å; Y67-Y477 AromaticContact CE1-CD2 3.38Å; Y67-Y477 HydrophobicContact CE1-CD2 3.38Å; Y67-Y477 HydrophobicContact CE1-CE2 4.06Å; Y67-Y477 HydrophobicContact CE1-CG 4.09Å; Y67-W479 AromaticContact CE1-CD1 3.62Å; Y67-W479 HydrophobicContact CE1-CG 4.4Å
68	L	62.1	Low	76.5	Confident	13 Å²	13	72.9 Å²	72.9	7%	0.068	39%	0.393	C	S	.	.	H	α-helix	trans	-84.1	-31.8	-176.6	-71.8	176.3	0	0	0	114	M60 R64 R65 Y477	M60-L68 HydrophobicContact CE-CD1 3.81Å; M60-L68 HydrophobicContact SD-CD1 3.57Å; M60-L68 VanDerWaalsContact SD-CD1 3.57Å; R64-L68 HydrophobicContact CG-CD1 3.91Å; R64-L68 WeakPolarHBondContact O-CB 3.2Å; R64-L68 WeakPolarHBondContact O-CG 3.27Å; R64-L68 PolarHBondContact O-N 3.43Å; R65-L68 PolarHBondContact O-N 3.28Å; L68-Y477 HydrophobicContact CD2-CD1 4.28Å; L68-Y477 HydrophobicContact CD2-CG 4.13Å
69	C	71.5	Confident	78.2	Confident	64 Å²	64	70.7 Å²	70.7	43%	0.432	37%	0.373	S	S	.	.	S	Bend	trans	-132.8	32.1	-168.8	-56.4	0	0	0	0	111.5	R65	R65-C69 WeakPolarHBondContact O-CA 3.15Å; R65-C69 WeakPolarHBondContact O-CB 3.42Å; R65-C69 PolarHBondContact O-N 3.19Å
70	S	75.3	Confident	79.6	Confident	28 Å²	28	71.8 Å²	71.8	20%	0.196	38%	0.383	C	S	.	.			trans	-55.5	144.9	169.7	-175.6	0	0	0	0	109.5	N66 N72 V73	N66-S70 WeakPolarHBondContact O-CA 3.24Å; N66-S70 VanDerWaalsContact O-CB 3.26Å; N66-S70 WeakPolarHBondContact O-CB 3.5Å; N66-S70 PolarHBondContact O-N 3Å; N66-S70 VanDerWaalsContact O-N 3.16Å; S70-N72 PolarHBondContact O-N 3.43Å; S70-N72 VanDerWaalsContact O-N 3.1Å; S70-N72 PolarHBondContact OG-N 2.65Å; S70-V73 WeakPolarHBondContact O-CB 3.13Å; S70-V73 PolarHBondContact O-N 3.11Å
71	I	80.1	Confident	80.8	Confident	164 Å²	164	72.8 Å²	72.8	84%	0.841	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-20.1	169	-167.7	165.2	0	0	0	112.3	V73	I71-V73 VanDerWaalsContact C-N 3.32Å
72	N	87.5	Confident	81.4	Confident	36 Å²	36	71.4 Å²	71.4	19%	0.193	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	11.4	176.9	-61.3	-21.5	0	0	0	113.7	S70 A444 E445 C446	S70-N72 PolarHBondContact O-N 3.43Å; S70-N72 VanDerWaalsContact O-N 3.1Å; S70-N72 PolarHBondContact OG-N 2.65Å; N72-A444 HydrophobicContact CB-CB 3.84Å; N72-A444 PolarHBondContact ND2-O 2.76Å; N72-E445 VanDerWaalsContact CB-O 3.32Å; N72-E445 WeakPolarHBondContact CB-O 3.38Å; N72-C446 PolarHBondContact ND2-N 3.41Å
73	V	92	Very high	82.1	Confident	16 Å²	16	73.2 Å²	73.2	10%	0.097	39%	0.392	C	S	.	.			trans	-85.1	113.6	167.9	177.1	0	0	0	0	108.1	S70 I71 K75 E433 K435 W479	S70-V73 WeakPolarHBondContact O-CB 3.13Å; S70-V73 PolarHBondContact O-N 3.11Å; I71-V73 VanDerWaalsContact C-N 3.32Å; V73-K75 HydrophobicContact CG1-CG 4.07Å; V73-E433 HydrophobicContact CG1-CB 4.23Å; V73-K435 HydrophobicContact CG2-CB 4.37Å; V73-K435 HydrophobicContact CG2-CD 4.21Å; V73-W479 HydrophobicContact CG1-CH2 3.7Å; V73-W479 HydrophobicContact CG1-CZ2 4.24Å; V73-W479 HydrophobicContact CG2-CH2 4.37Å; V73-W479 HydrophobicContact CG2-CZ2 4.37Å
74	I	92.6	Very high	83.1	Confident	9 Å²	9	70.9 Å²	70.9	5%	0.046	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	128.8	172.2	-59.5	178.7	0	0	0	107.8	E433 C434 Y488 E492 F494	I74-E433 CarbonylContact O-C 3.57Å; I74-E433 VanDerWaalsContact O-CA 3.25Å; I74-E433 WeakPolarHBondContact O-CA 3.46Å; I74-C434 PolarHBondContact N-O 2.79Å; I74-C434 PolarHBondContact O-N 2.67Å; I74-Y488 HydrophobicContact CD1-CD1 4.02Å; I74-Y488 HydrophobicContact CD1-CD2 3.29Å; I74-Y488 HydrophobicContact CD1-CE1 4.16Å; I74-Y488 HydrophobicContact CD1-CE2 3.43Å; I74-Y488 VanDerWaalsContact CD1-CE2 3.43Å; I74-Y488 HydrophobicContact CD1-CG 3.59Å; I74-Y488 HydrophobicContact CG1-CE2 4.22Å; I74-E492 HydrophobicContact CD1-CB 4.27Å; I74-E492 HydrophobicContact CD1-CG 4.11Å; I74-E492 WeakPolarHBondContact CG2-OE2 3.25Å; I74-F494 HydrophobicContact CB-CZ 4.35Å; I74-F494 HydrophobicContact CD1-CE1 4.27Å; I74-F494 HydrophobicContact CD1-CE2 3.83Å; I74-F494 HydrophobicContact CD1-CZ 3.35Å; I74-F494 HydrophobicContact CG1-CZ 4.33Å
75	K	92.9	Very high	84.2	Confident	119 Å²	119	67 Å²	67	52%	0.517	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122.1	177.2	-59.1	-172.4	178.4	-176.9	0	108.5	V73 E433	V73-K75 HydrophobicContact CG1-CG 4.07Å; K75-E433 WeakPolarHBondContact CE-OE1 3.25Å; K75-E433 HydrophobicContact CG-CG 4Å; K75-E433 IonicContact NZ-OE1 3.49Å
76	S	91.6	Very high	85.5	Confident	26 Å²	26	62.6 Å²	62.6	18%	0.182	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-77.1	171.2	174.5	-162.1	0	0	0	0	111	Q78 L428 L429 M432	S76-Q78 PolarHBondContact O-NE2 2.86Å; S76-L428 PolarHBondContact OG-O 3.31Å; S76-L429 WeakPolarHBondContact CB-O 3.5Å; S76-L429 PolarHBondContact OG-O 2.88Å; S76-M432 PolarHBondContact N-O 3.15Å
77	T	91.9	Very high	86.6	Confident	95 Å²	95	57.7 Å²	57.7	58%	0.583	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-55	150.9	177.6	51.9	0	0	0	0	111.2	P430 N431	T77-P430 CarbonylContact O-C 3.55Å; T77-P430 VanDerWaalsContact O-CA 3.3Å; T77-P430 WeakPolarHBondContact O-CA 3.33Å; T77-P430 WeakPolarHBondContact O-CB 3.43Å; T77-N431 PolarHBondContact O-N 2.87Å; T77-N431 PolarHBondContact O-OD1 3.19Å
78	Q	92	Very high	87.7	Confident	134 Å²	134	57 Å²	57	63%	0.626	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-102.6	132.9	177.4	-61.9	-63.1	-56.1	0	0	109.6	S76 N431	S76-Q78 PolarHBondContact O-NE2 2.86Å; Q78-N431 WeakPolarHBondContact CA-OD1 3.35Å
79	I	91.2	Very high	89.2	Confident	50 Å²	50	57.2 Å²	57.2	26%	0.256	31%	0.313	S	S	.	.			trans	-126.8	139.8	178.5	-54.1	-179.6	0	0	0	107.6	L81 L286 Q289 P430 N431	I79-L81 PolarHBondContact O-N 3.34Å; I79-L286 HydrophobicContact CD1-CD2 4.46Å; I79-Q289 HydrophobicContact CD1-CB 4.41Å; I79-Q289 HydrophobicContact CD1-CG 3.97Å; I79-P430 HydrophobicContact CD1-CB 3.48Å; I79-P430 VanDerWaalsContact CD1-CB 3.48Å; I79-P430 HydrophobicContact CD1-CG 3.6Å; I79-P430 HydrophobicContact CG1-CB 3.82Å; I79-P430 HydrophobicContact CG1-CG 4.44Å; I79-N431 PolarHBondContact N-OD1 2.92Å; I79-N431 PolarHBondContact O-ND2 3.08Å; I79-N431 PolarHBondContact O-OD1 3.47Å
80	D	92.6	Very high	90.4	Very high	164 Å²	164	54.2 Å²	54.2	88%	0.877	29%	0.293	S	S	*	.			trans	-66.8	129.8	175	-69.2	-36.1	0	0	0	110.5
81	L	91.1	Very high	91.4	Very high	45 Å²	45	53.1 Å²	53.1	24%	0.236	29%	0.285	C	S	.	.			trans	-107	139.5	178.8	-64.2	171.8	0	0	0	109.5	I79 S282 C285 L286 N431 P458	I79-L81 PolarHBondContact O-N 3.34Å; L81-S282 WeakPolarHBondContact CD1-OG 3.35Å; L81-C285 HydrophobicContact CD2-CB 3.81Å; L81-L286 HydrophobicContact CD2-CD2 4.48Å; L81-L286 HydrophobicContact CD2-CG 4.48Å; L81-N431 VanDerWaalsContact CD1-ND2 3.29Å; L81-N431 WeakPolarHBondContact CD1-ND2 3.38Å; L81-N431 WeakPolarHBondContact CG-ND2 3.31Å; L81-P458 HydrophobicContact CD1-CB 4.25Å; L81-P458 HydrophobicContact CD1-CG 4.09Å
82	P	88.9	Confident	92.1	Very high	41 Å²	41	49 Å²	49	27%	0.266	26%	0.262	S	S	.	.			trans	-68	131.3	-176.7	29.1	-34.8	0	0	0	110.4	I84 F89 T281 C285	P82-I84 HydrophobicContact CB-CD1 4.46Å; P82-I84 HydrophobicContact CB-CG1 4Å; P82-I84 PolarHBondContact O-N 3.03Å; P82-F89 HydrophobicContact CB-CD2 4.33Å; P82-F89 HydrophobicContact CB-CE2 4.5Å; P82-F89 HydrophobicContact CG-CD2 3.88Å; P82-F89 HydrophobicContact CG-CE2 3.88Å; P82-T281 HydrophobicContact CG-CG2 3.69Å; P82-C285 VanDerWaalsContact CD-SG 3.52Å
83	P	87.3	Confident	92.4	Very high	126 Å²	126	48.7 Å²	48.7	82%	0.818	26%	0.259	S	S	*	.			trans	-86	45.2	-175.1	36.7	-38	0	0	0	112.3
84	I	89	Confident	92.6	Very high	39 Å²	39	48 Å²	48	20%	0.2	26%	0.255	C	S	.	.	S	Bend	trans	-128.6	162.8	-176.2	52.8	170.2	0	0	0	111.1	P82 E88 F89	P82-I84 HydrophobicContact CB-CD1 4.46Å; P82-I84 HydrophobicContact CB-CG1 4Å; P82-I84 PolarHBondContact O-N 3.03Å; I84-E88 HydrophobicContact CB-CB 4.19Å; I84-E88 HydrophobicContact CB-CG 4Å; I84-E88 HydrophobicContact CD1-CB 4.36Å; I84-E88 HydrophobicContact CD1-CG 3.87Å; I84-E88 HydrophobicContact CG1-CG 4.47Å; I84-E88 HydrophobicContact CG2-CG 4.28Å; I84-F89 HydrophobicContact CD1-CB 3.85Å; I84-F89 HydrophobicContact CD1-CD2 4Å; I84-F89 HydrophobicContact CD1-CG 4.44Å; I84-F89 HydrophobicContact CG1-CB 4.2Å
85	S	91	Very high	92.7	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.007	28%	0.277	C	S	.	.			trans	-66.2	159.4	178	69.8	0	0	0	0	111.3	G87 E88 F89	S85-G87 VanDerWaalsContact C-N 3.28Å; S85-G87 PolarHBondContact O-N 3.08Å; S85-E88 PolarHBondContact O-N 3.49Å; S85-E88 WeakPolarHBondContact OG-CB 3.15Å; S85-E88 PolarHBondContact OG-N 2.77Å; S85-E88 VanDerWaalsContact OG-N 3.14Å; S85-F89 WeakPolarHBondContact O-CB 3.48Å; S85-F89 PolarHBondContact O-N 3.13Å
86	L	93.6	Very high	92.9	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-58.7	-43.8	174.6	176.4	66.8	0	0	0	110.6	F89 L90 H158 N277 L280 T281 I284 Y316	L86-F89 PolarHBondContact O-N 2.82Å; L86-L90 HydrophobicContact CD1-CD1 3.83Å; L86-L90 HydrophobicContact CD1-CD2 4.37Å; L86-L90 HydrophobicContact CD1-CG 3.86Å; L86-L90 HydrophobicContact CD2-CD1 4.33Å; L86-L90 HydrophobicContact CG-CD1 3.75Å; L86-L90 HydrophobicContact CG-CG 4.16Å; L86-L90 WeakPolarHBondContact O-CB 3.48Å; L86-L90 VanDerWaalsContact O-CG 3.26Å; L86-L90 WeakPolarHBondContact O-CG 3.21Å; L86-L90 PolarHBondContact O-N 3.08Å; L86-H158 HydrophobicContact CD2-CB 4.4Å; L86-N277 WeakPolarHBondContact CB-OD1 3.35Å; L86-N277 PolarHBondContact N-OD1 3.17Å; L86-L280 HydrophobicContact CD1-CB 4.11Å; L86-L280 HydrophobicContact CD2-CB 3.74Å; L86-L280 HydrophobicContact CD2-CD1 3.56Å; L86-L280 HydrophobicContact CD2-CG 4.25Å; L86-L280 HydrophobicContact CG-CB 4.38Å; L86-T281 WeakPolarHBondContact CA-OG1 3.43Å; L86-T281 PolarHBondContact N-OG1 3.48Å; L86-I284 HydrophobicContact CD1-CD1 3.56Å; L86-Y316 HydrophobicContact CD2-CE2 4.08Å
87	G	94.3	Very high	93.1	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-46.6	177.9	0	0	0	0	0	112.8	S85 W91	S85-G87 VanDerWaalsContact C-N 3.28Å; S85-G87 PolarHBondContact O-N 3.08Å; G87-W91 VanDerWaalsContact O-CB 3.31Å; G87-W91 WeakPolarHBondContact O-CB 3.42Å; G87-W91 PolarHBondContact O-N 3.37Å
88	E	93.1	Very high	93.3	Very high	27 Å²	27	52 Å²	52	13%	0.126	28%	0.275	C	S	.	.	H	α-helix	trans	-59.5	-47.7	175	-178.3	157.8	-166.8	0	0	111.3	I84 S85 W91 Q92 I246	I84-E88 HydrophobicContact CB-CB 4.19Å; I84-E88 HydrophobicContact CB-CG 4Å; I84-E88 HydrophobicContact CD1-CB 4.36Å; I84-E88 HydrophobicContact CD1-CG 3.87Å; I84-E88 HydrophobicContact CG1-CG 4.47Å; I84-E88 HydrophobicContact CG2-CG 4.28Å; S85-E88 PolarHBondContact O-N 3.49Å; S85-E88 WeakPolarHBondContact OG-CB 3.15Å; S85-E88 PolarHBondContact OG-N 2.77Å; S85-E88 VanDerWaalsContact OG-N 3.14Å; E88-W91 PolarHBondContact O-N 2.91Å; E88-Q92 WeakPolarHBondContact O-CB 3.04Å; E88-Q92 VanDerWaalsContact O-CG 3.29Å; E88-Q92 WeakPolarHBondContact O-CG 3.45Å; E88-Q92 PolarHBondContact O-N 2.78Å; E88-Q92 PolarHBondContact OE1-NE2 3.33Å; E88-I246 HydrophobicContact CB-CD1 3.98Å; E88-I246 HydrophobicContact CB-CG2 3.91Å; E88-I246 HydrophobicContact CG-CD1 3.73Å
89	F	94.4	Very high	93.5	Very high	17 Å²	17	49.1 Å²	49.1	8%	0.075	27%	0.267	C	S	.	.	H	α-helix	trans	-64.1	-49.4	-178.2	-176.6	-102.4	0	0	0	112.2	P82 I84 S85 L86 W91 Q92 Q93 T281 I284 I320	P82-F89 HydrophobicContact CB-CD2 4.33Å; P82-F89 HydrophobicContact CB-CE2 4.5Å; P82-F89 HydrophobicContact CG-CD2 3.88Å; P82-F89 HydrophobicContact CG-CE2 3.88Å; I84-F89 HydrophobicContact CD1-CB 3.85Å; I84-F89 HydrophobicContact CD1-CD2 4Å; I84-F89 HydrophobicContact CD1-CG 4.44Å; I84-F89 HydrophobicContact CG1-CB 4.2Å; S85-F89 WeakPolarHBondContact O-CB 3.48Å; S85-F89 PolarHBondContact O-N 3.13Å; L86-F89 PolarHBondContact O-N 2.82Å; F89-W91 VanDerWaalsContact C-N 3.35Å; F89-W91 PolarHBondContact O-N 3.4Å; F89-Q92 PolarHBondContact O-N 2.95Å; F89-Q93 HydrophobicContact CD1-CG 4.42Å; F89-Q93 HydrophobicContact CE1-CG 4.12Å; F89-Q93 HydrophobicContact CE2-CG 4.25Å; F89-Q93 HydrophobicContact CZ-CG 4.03Å; F89-Q93 VanDerWaalsContact O-CG 3.3Å; F89-Q93 WeakPolarHBondContact O-CG 3.4Å; F89-Q93 PolarHBondContact O-N 2.67Å; F89-T281 HydrophobicContact CB-CG2 4.33Å; F89-T281 HydrophobicContact CD1-CG2 4.43Å; F89-T281 HydrophobicContact CG-CG2 4.21Å; F89-I284 HydrophobicContact CD1-CD1 3.38Å; F89-I284 HydrophobicContact CD1-CG1 4.22Å; F89-I284 HydrophobicContact CE1-CD1 3.49Å; F89-I284 VanDerWaalsContact CE1-CD1 3.49Å; F89-I284 HydrophobicContact CE1-CG1 3.91Å; F89-I320 HydrophobicContact CE1-CD1 3.97Å; F89-I320 HydrophobicContact CE1-CG2 4.23Å; F89-I320 HydrophobicContact CZ-CD1 4.5Å
90	L	96.2	Very high	93.7	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-46.1	178.1	-70.6	175.9	0	0	0	111.1	L86 Q93 L94 I155 I284 Y316 I320	L86-L90 HydrophobicContact CD1-CD1 3.83Å; L86-L90 HydrophobicContact CD1-CD2 4.37Å; L86-L90 HydrophobicContact CD1-CG 3.86Å; L86-L90 HydrophobicContact CD2-CD1 4.33Å; L86-L90 HydrophobicContact CG-CD1 3.75Å; L86-L90 HydrophobicContact CG-CG 4.16Å; L86-L90 WeakPolarHBondContact O-CB 3.48Å; L86-L90 VanDerWaalsContact O-CG 3.26Å; L86-L90 WeakPolarHBondContact O-CG 3.21Å; L86-L90 PolarHBondContact O-N 3.08Å; L90-Q93 PolarHBondContact O-N 3.33Å; L90-L94 VanDerWaalsContact O-CG 3.29Å; L90-L94 WeakPolarHBondContact O-CG 3.44Å; L90-L94 PolarHBondContact O-N 3.29Å; L90-I155 HydrophobicContact CD1-CG1 4.25Å; L90-I284 HydrophobicContact CD2-CD1 4.2Å; L90-Y316 HydrophobicContact CD1-CD1 3.87Å; L90-Y316 HydrophobicContact CD1-CE1 3.97Å; L90-Y316 HydrophobicContact CD1-CG 4.28Å; L90-Y316 HydrophobicContact CD2-CD1 4.08Å; L90-Y316 HydrophobicContact CD2-CG 4.04Å; L90-I320 HydrophobicContact CD2-CG2 3.71Å
91	W	95.4	Very high	93.9	Very high	5 Å²	5	49 Å²	49	2%	0.019	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-47	-179.3	-172.8	-99.5	0	0	0	112.1	G87 E88 F89 Q93 L94 E95 M118 I121 R122 I159 L244	G87-W91 VanDerWaalsContact O-CB 3.31Å; G87-W91 WeakPolarHBondContact O-CB 3.42Å; G87-W91 PolarHBondContact O-N 3.37Å; E88-W91 PolarHBondContact O-N 2.91Å; F89-W91 VanDerWaalsContact C-N 3.35Å; F89-W91 PolarHBondContact O-N 3.4Å; W91-Q93 VanDerWaalsContact C-N 3.28Å; W91-Q93 PolarHBondContact O-N 2.95Å; W91-L94 HydrophobicContact CE3-CD1 4.45Å; W91-L94 PolarHBondContact O-N 3.03Å; W91-E95 HydrophobicContact CZ2-CG 4.18Å; W91-E95 PolarHBondContact NE1-OE1 2.95Å; W91-E95 PolarHBondContact NE1-OE2 3.37Å; W91-E95 PolarHBondContact O-N 2.83Å; W91-M118 HydrophobicContact CH2-CB 3.92Å; W91-M118 HydrophobicContact CH2-CG 4Å; W91-M118 HydrophobicContact CH2-SD 4.36Å; W91-M118 HydrophobicContact CZ3-CB 4.24Å; W91-M118 HydrophobicContact CZ3-CG 4.1Å; W91-I121 HydrophobicContact CE3-CG2 4.07Å; W91-I121 HydrophobicContact CZ3-CB 4.09Å; W91-I121 HydrophobicContact CZ3-CD1 4.32Å; W91-I121 HydrophobicContact CZ3-CG2 3.72Å; W91-R122 HydrophobicContact CH2-CG 4.05Å; W91-I159 HydrophobicContact CB-CD1 4.06Å; W91-I159 HydrophobicContact CB-CG1 4.28Å; W91-I159 HydrophobicContact CD2-CD1 4.12Å; W91-I159 HydrophobicContact CE3-CD1 3.59Å; W91-I159 HydrophobicContact CG-CD1 4.31Å; W91-I159 HydrophobicContact CZ3-CD1 4.44Å; W91-L244 HydrophobicContact CD2-CD1 3.6Å; W91-L244 HydrophobicContact CE3-CD1 3.8Å; W91-L244 HydrophobicContact CG-CD1 4.4Å; W91-L244 HydrophobicContact CH2-CD1 3.5Å; W91-L244 HydrophobicContact CZ2-CD1 3.34Å; W91-L244 HydrophobicContact CZ2-CG 4.38Å; W91-L244 HydrophobicContact CZ3-CD1 3.73Å
92	Q	94.6	Very high	94.2	Very high	78 Å²	78	51 Å²	51	36%	0.364	27%	0.268	S	S	.	.	H	α-helix	trans	-59	-39.1	176.6	-74.1	177.7	8.4	0	0	112.1	E88 F89 L96	E88-Q92 WeakPolarHBondContact O-CB 3.04Å; E88-Q92 VanDerWaalsContact O-CG 3.29Å; E88-Q92 WeakPolarHBondContact O-CG 3.45Å; E88-Q92 PolarHBondContact O-N 2.78Å; E88-Q92 PolarHBondContact OE1-NE2 3.33Å; F89-Q92 PolarHBondContact O-N 2.95Å; Q92-L96 WeakPolarHBondContact O-CG 3.14Å
93	Q	95.2	Very high	94.6	Very high	29 Å²	29	49.1 Å²	49.1	14%	0.136	26%	0.256	C	S	.	.	H	α-helix	trans	-72.3	-33.7	178.3	-65.9	-60.3	-72	0	0	112.9	F89 L90 W91 L96 Q97 I320	F89-Q93 HydrophobicContact CD1-CG 4.42Å; F89-Q93 HydrophobicContact CE1-CG 4.12Å; F89-Q93 HydrophobicContact CE2-CG 4.25Å; F89-Q93 HydrophobicContact CZ-CG 4.03Å; F89-Q93 VanDerWaalsContact O-CG 3.3Å; F89-Q93 WeakPolarHBondContact O-CG 3.4Å; F89-Q93 PolarHBondContact O-N 2.67Å; L90-Q93 PolarHBondContact O-N 3.33Å; W91-Q93 VanDerWaalsContact C-N 3.28Å; W91-Q93 PolarHBondContact O-N 2.95Å; Q93-L96 PolarHBondContact O-N 2.92Å; Q93-Q97 WeakPolarHBondContact O-CG 3.42Å; Q93-Q97 PolarHBondContact O-NE2 2.98Å; Q93-I320 HydrophobicContact CB-CB 3.76Å; Q93-I320 HydrophobicContact CB-CG2 3.65Å; Q93-I320 HydrophobicContact CG-CB 3.9Å; Q93-I320 HydrophobicContact CG-CG2 3.84Å
94	L	96	Very high	95	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-66.7	-38.8	174.9	-73.9	170.3	0	0	0	112	L90 W91 L96 Q97 Y114 L117 M118 I121 I155 L319	L90-L94 VanDerWaalsContact O-CG 3.29Å; L90-L94 WeakPolarHBondContact O-CG 3.44Å; L90-L94 PolarHBondContact O-N 3.29Å; W91-L94 HydrophobicContact CE3-CD1 4.45Å; W91-L94 PolarHBondContact O-N 3.03Å; L94-L96 PolarHBondContact O-N 3.48Å; L94-Q97 WeakPolarHBondContact O-CB 3.31Å; L94-Q97 PolarHBondContact O-N 3.39Å; L94-Y114 HydrophobicContact CD2-CD1 3.79Å; L94-Y114 HydrophobicContact CD2-CE1 3.76Å; L94-L117 HydrophobicContact CD2-CD2 4.36Å; L94-M118 HydrophobicContact CB-CG 4.23Å; L94-M118 HydrophobicContact CB-SD 4.22Å; L94-I121 HydrophobicContact CD1-CD1 3.73Å; L94-I155 HydrophobicContact CD1-CG2 4.46Å; L94-L319 HydrophobicContact CD2-CB 4.13Å; L94-L319 HydrophobicContact CD2-CD2 4.43Å
95	E	94.8	Very high	95.3	Very high	107 Å²	107	41.2 Å²	41.2	50%	0.5	21%	0.207	S	C	.	.	H	α-helix	trans	-64.5	-19	178.3	-74.5	-174.7	141.3	0	0	113.6	W91 Q97	W91-E95 HydrophobicContact CZ2-CG 4.18Å; W91-E95 PolarHBondContact NE1-OE1 2.95Å; W91-E95 PolarHBondContact NE1-OE2 3.37Å; W91-E95 PolarHBondContact O-N 2.83Å; E95-Q97 VanDerWaalsContact C-N 3.33Å
96	L	95.8	Very high	95.6	Very high	125 Å²	125	41.2 Å²	41.2	65%	0.654	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-13.4	175.1	-61.1	173.8	0	0	0	113	Q92 Q93 L94	Q92-L96 WeakPolarHBondContact O-CG 3.14Å; Q93-L96 PolarHBondContact O-N 2.92Å; L94-L96 PolarHBondContact O-N 3.48Å
97	Q	96.1	Very high	95.7	Very high	26 Å²	26	42.2 Å²	42.2	12%	0.121	21%	0.211	C	C	.	.	S	Bend	trans	-88.5	148	-172.6	-51	-52.5	-34.7	0	0	112.6	Q93 L94 E95 V99 Y114	Q93-Q97 WeakPolarHBondContact O-CG 3.42Å; Q93-Q97 PolarHBondContact O-NE2 2.98Å; L94-Q97 WeakPolarHBondContact O-CB 3.31Å; L94-Q97 PolarHBondContact O-N 3.39Å; E95-Q97 VanDerWaalsContact C-N 3.33Å; Q97-V99 PolarHBondContact O-N 3.1Å; Q97-Y114 HydrophobicContact CB-CD1 3.62Å; Q97-Y114 HydrophobicContact CB-CD2 3.9Å; Q97-Y114 HydrophobicContact CB-CE1 3.86Å; Q97-Y114 HydrophobicContact CB-CE2 4.13Å; Q97-Y114 HydrophobicContact CB-CG 3.65Å; Q97-Y114 HydrophobicContact CG-CD1 3.86Å; Q97-Y114 HydrophobicContact CG-CE1 3.62Å; Q97-Y114 HydrophobicContact CG-CE2 4.42Å; Q97-Y114 HydrophobicContact CG-CG 4.36Å
98	P	95.8	Very high	95.6	Very high	73 Å²	73	48.4 Å²	48.4	47%	0.474	24%	0.24	S	C	.	.			trans	-65	121.9	177.1	-18.7	32	0	0	0	111.9	E100 Q101	P98-E100 PolarHBondContact O-N 3.42Å; P98-E100 VanDerWaalsContact O-N 3.12Å; P98-Q101 HydrophobicContact CB-CB 4.17Å; P98-Q101 WeakPolarHBondContact O-CB 3.42Å; P98-Q101 PolarHBondContact O-N 3.16Å; P98-Q101 VanDerWaalsContact O-N 3.08Å
99	V	96.5	Very high	95.5	Very high	74 Å²	74	50.4 Å²	50.4	45%	0.448	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-27.6	-172.9	-62.3	0	0	0	0	114.8	Q97 T113 G115 M118	Q97-V99 PolarHBondContact O-N 3.1Å; V99-T113 VanDerWaalsContact O-CB 3.27Å; V99-T113 WeakPolarHBondContact O-CB 3.41Å; V99-T113 PolarHBondContact O-OG1 3.05Å; V99-T113 VanDerWaalsContact O-OG1 3.07Å; V99-G115 WeakPolarHBondContact O-CA 3.45Å; V99-G115 PolarHBondContact O-N 3.41Å; V99-M118 HydrophobicContact CG1-CE 3.85Å
100	E	96.9	Very high	95.4	Very high	156 Å²	156	56.5 Å²	56.5	73%	0.729	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-11.9	-178.9	-58.6	-54	149.4	0	0	113.4	P98 T113	P98-E100 PolarHBondContact O-N 3.42Å; P98-E100 VanDerWaalsContact O-N 3.12Å; E100-T113 WeakPolarHBondContact O-CG2 3.33Å
101	Q	96	Very high	95.3	Very high	57 Å²	57	57.6 Å²	57.6	27%	0.266	28%	0.281	S	S	.	.	S	Bend	trans	-75.2	139.5	-179	-178.2	176.3	-11.8	0	0	110.7	P98 A103 T113 Y114 P295 G322	P98-Q101 HydrophobicContact CB-CB 4.17Å; P98-Q101 WeakPolarHBondContact O-CB 3.42Å; P98-Q101 PolarHBondContact O-N 3.16Å; P98-Q101 VanDerWaalsContact O-N 3.08Å; Q101-A103 PolarHBondContact O-N 2.84Å; Q101-T113 CarbonylContact O-C 3.55Å; Q101-T113 WeakPolarHBondContact O-CA 3.46Å; Q101-T113 WeakPolarHBondContact O-CB 3.45Å; Q101-Y114 HydrophobicContact CB-CD2 4.22Å; Q101-Y114 HydrophobicContact CG-CD2 4.5Å; Q101-Y114 PolarHBondContact O-N 2.94Å; Q101-P295 PolarHBondContact NE2-O 2.8Å; Q101-G322 PolarHBondContact NE2-O 2.8Å
102	E	96.8	Very high	95.3	Very high	87 Å²	87	58.4 Å²	58.4	41%	0.407	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	124.2	171.6	-65.7	-168.2	149.2	0	0	110.6	M111 R324	E102-M111 HydrophobicContact CG-CB 4.34Å; E102-R324 HydrophobicContact CB-CG 4.26Å; E102-R324 WeakPolarHBondContact OE2-CD 3.49Å; E102-R324 IonicContact OE2-CZ 3.48Å; E102-R324 IonicContact OE2-NE 2.82Å; E102-R324 PolarHBondContact OE2-NE 3.24Å; E102-R324 IonicContact OE2-NH2 2.65Å
103	A	97.3	Very high	95.5	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-52.2	-179.1	0	0	0	0	0	111.1	Q101 L112 Y114 L117 L319 L325	Q101-A103 PolarHBondContact O-N 2.84Å; A103-L112 PolarHBondContact N-O 2.97Å; A103-Y114 HydrophobicContact CB-CD1 3.72Å; A103-Y114 HydrophobicContact CB-CD2 3.54Å; A103-Y114 HydrophobicContact CB-CE1 3.77Å; A103-Y114 HydrophobicContact CB-CE2 3.6Å; A103-Y114 HydrophobicContact CB-CG 3.6Å; A103-L117 HydrophobicContact CB-CD2 4.33Å; A103-L319 HydrophobicContact CB-CD2 4.19Å; A103-L325 PolarHBondContact O-N 3.15Å
104	F	96.9	Very high	95.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	140.8	-162.2	165.8	-109.3	0	0	0	113.1	M111 L112 A148 V151 L319 L325 M327	F104-M111 VanDerWaalsContact C-CE 3.5Å; F104-L112 PolarHBondContact N-O 3.01Å; F104-L112 WeakPolarHBondContact O-CB 3.38Å; F104-L112 PolarHBondContact O-N 2.85Å; F104-A148 HydrophobicContact CD1-CB 4.43Å; F104-A148 VanDerWaalsContact CE1-CA 3.42Å; F104-A148 HydrophobicContact CE1-CB 3.62Å; F104-A148 WeakPolarHBondContact CE1-O 3.48Å; F104-A148 HydrophobicContact CZ-CB 4.15Å; F104-V151 HydrophobicContact CD1-CB 4.35Å; F104-V151 HydrophobicContact CD1-CG1 4.46Å; F104-V151 HydrophobicContact CE1-CB 3.72Å; F104-V151 HydrophobicContact CE1-CG1 4.28Å; F104-V151 HydrophobicContact CE1-CG2 3.69Å; F104-V151 HydrophobicContact CE2-CG2 3.98Å; F104-V151 HydrophobicContact CZ-CB 3.97Å; F104-V151 HydrophobicContact CZ-CG2 3.36Å; F104-L319 HydrophobicContact CB-CD2 4.34Å; F104-L325 CarbonylContact C-O 3.57Å; F104-L325 VanDerWaalsContact CA-O 3.23Å; F104-L325 WeakPolarHBondContact CA-O 3.48Å; F104-L325 HydrophobicContact CD2-CB 4.19Å; F104-L325 HydrophobicContact CD2-CD2 3.72Å; F104-L325 HydrophobicContact CD2-CG 3.87Å; F104-L325 HydrophobicContact CE2-CD2 4.15Å; F104-L325 HydrophobicContact CE2-CG 4.45Å; F104-M327 HydrophobicContact CE2-CG 3.82Å; F104-M327 HydrophobicContact CE2-SD 3.7Å; F104-M327 HydrophobicContact CZ-SD 4.22Å
105	G	95.7	Very high	95.6	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	178	169.3	0	0	0	0	0	114	M111 L325 T326 M327	G105-M111 VanDerWaalsContact CA-SD 3.5Å; G105-L325 PolarHBondContact N-O 3.12Å; G105-T326 WeakPolarHBondContact O-CA 3.36Å; G105-M327 PolarHBondContact O-N 3.17Å
106	I	95.3	Very high	95.6	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	138.1	169.9	-53.7	-56.3	0	0	0	107.8	E109 A148 M327	I106-E109 HydrophobicContact CB-CB 4.09Å; I106-E109 HydrophobicContact CB-CG 4.04Å; I106-E109 WeakPolarHBondContact CB-OE2 3.41Å; I106-E109 HydrophobicContact CG2-CG 4.2Å; I106-E109 WeakPolarHBondContact O-CA 3.38Å; I106-E109 WeakPolarHBondContact O-CB 3.45Å; I106-E109 PolarHBondContact O-N 3.26Å; I106-A148 HydrophobicContact CG1-CB 4.34Å; I106-M327 CarbonylContact C-O 3.54Å; I106-M327 WeakPolarHBondContact CA-O 3.36Å; I106-M327 HydrophobicContact CD1-CB 3.83Å
107	F	95.8	Very high	95.6	Very high	20 Å²	20	47.3 Å²	47.3	9%	0.088	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	140	177.8	-175.9	-121.5	0	0	0	111.3	E109 T326 M327 L328 R338 C339 H342	F107-E109 PolarHBondContact O-N 2.82Å; F107-E109 VanDerWaalsContact O-N 3.16Å; F107-T326 HydrophobicContact CB-CG2 3.88Å; F107-M327 PolarHBondContact N-O 3.14Å; F107-L328 HydrophobicContact CB-CD2 3.58Å; F107-L328 HydrophobicContact CD1-CD2 4.09Å; F107-L328 HydrophobicContact CG-CD2 4.13Å; F107-R338 HydrophobicContact CE1-CB 3.94Å; F107-R338 HydrophobicContact CZ-CB 4.12Å; F107-C339 HydrophobicContact CB-CB 4.42Å; F107-C339 HydrophobicContact CD1-CB 3.84Å; F107-C339 HydrophobicContact CD2-CB 3.76Å; F107-C339 VanDerWaalsContact CD2-SG 3.6Å; F107-C339 HydrophobicContact CE1-CB 3.99Å; F107-C339 HydrophobicContact CE2-CB 3.94Å; F107-C339 HydrophobicContact CG-CB 3.73Å; F107-C339 HydrophobicContact CZ-CB 4.05Å; F107-H342 HydrophobicContact CE2-CB 3.9Å; F107-H342 AromaticContact CE2-CG 3.99Å; F107-H342 AromaticContact CE2-ND1 3.89Å; F107-H342 HydrophobicContact CZ-CB 4.17Å
108	E	92.2	Very high	95.6	Very high	130 Å²	130	46.6 Å²	46.6	61%	0.607	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.3	-0.9	-171.1	-50.2	-173.9	149	0	0	116.1	R338	E108-R338 IonicContact OE1-CZ 3.07Å; E108-R338 IonicContact OE1-NH1 2.78Å; E108-R338 PolarHBondContact OE1-NH1 2.94Å; E108-R338 IonicContact OE1-NH2 2.62Å; E108-R338 PolarHBondContact OE1-NH2 3.35Å
109	E	92.4	Very high	95.4	Very high	70 Å²	70	47 Å²	47	33%	0.327	23%	0.23	S	C	.	.	S	Bend	trans	-102	-179	169.5	-59.7	178.6	-160.2	0	0	110.7	I106 F107 M111	I106-E109 HydrophobicContact CB-CB 4.09Å; I106-E109 HydrophobicContact CB-CG 4.04Å; I106-E109 WeakPolarHBondContact CB-OE2 3.41Å; I106-E109 HydrophobicContact CG2-CG 4.2Å; I106-E109 WeakPolarHBondContact O-CA 3.38Å; I106-E109 WeakPolarHBondContact O-CB 3.45Å; I106-E109 PolarHBondContact O-N 3.26Å; F107-E109 PolarHBondContact O-N 2.82Å; F107-E109 VanDerWaalsContact O-N 3.16Å; E109-M111 PolarHBondContact O-N 3.23Å
110	K	90.6	Very high	95.2	Very high	145 Å²	145	45.3 Å²	45.3	63%	0.63	22%	0.219	S	C	*	.	P	Polyproline II helix	trans	-72.5	125.5	178.1	-179.2	-179.3	173.4	-172.8	0	110.5
111	M	94.9	Very high	95.1	Very high	24 Å²	24	37.9 Å²	37.9	12%	0.118	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-70.2	131.9	166.1	-66.4	-60.5	-64.8	0	0	110.9	E102 F104 G105 E109 R324	E102-M111 HydrophobicContact CG-CB 4.34Å; F104-M111 VanDerWaalsContact C-CE 3.5Å; G105-M111 VanDerWaalsContact CA-SD 3.5Å; E109-M111 PolarHBondContact O-N 3.23Å; M111-R324 HydrophobicContact CE-CG 3.85Å
112	L	96.7	Very high	95	Very high	22 Å²	22	38.2 Å²	38.2	12%	0.115	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	135.3	172.9	-59.3	177.8	0	0	0	109.8	A103 F104 Q116 A148	A103-L112 PolarHBondContact N-O 2.97Å; F104-L112 PolarHBondContact N-O 3.01Å; F104-L112 WeakPolarHBondContact O-CB 3.38Å; F104-L112 PolarHBondContact O-N 2.85Å; L112-Q116 HydrophobicContact CB-CB 4.33Å; L112-Q116 HydrophobicContact CD2-CB 4.25Å; L112-A148 HydrophobicContact CD1-CB 4.47Å
113	T	97.7	Very high	94.9	Very high	22 Å²	22	34.2 Å²	34.2	14%	0.135	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	162.9	165.3	70.7	0	0	0	0	111	V99 E100 Q101 G115 Q116 L117	V99-T113 VanDerWaalsContact O-CB 3.27Å; V99-T113 WeakPolarHBondContact O-CB 3.41Å; V99-T113 PolarHBondContact O-OG1 3.05Å; V99-T113 VanDerWaalsContact O-OG1 3.07Å; E100-T113 WeakPolarHBondContact O-CG2 3.33Å; Q101-T113 CarbonylContact O-C 3.55Å; Q101-T113 WeakPolarHBondContact O-CA 3.46Å; Q101-T113 WeakPolarHBondContact O-CB 3.45Å; T113-G115 PolarHBondContact O-N 3Å; T113-Q116 PolarHBondContact O-N 2.9Å; T113-Q116 VanDerWaalsContact O-N 3.13Å; T113-Q116 WeakPolarHBondContact OG1-CG 3.49Å; T113-Q116 PolarHBondContact OG1-N 2.81Å; T113-Q116 VanDerWaalsContact OG1-N 3.17Å; T113-L117 WeakPolarHBondContact O-CB 3.49Å; T113-L117 PolarHBondContact O-N 2.74Å
114	Y	97.7	Very high	94.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-55.3	-40	172.3	-84.8	-77.4	0	0	0	111.9	L94 Q97 Q101 A103 L117 M118 L319 G322 C323	L94-Y114 HydrophobicContact CD2-CD1 3.79Å; L94-Y114 HydrophobicContact CD2-CE1 3.76Å; Q97-Y114 HydrophobicContact CB-CD1 3.62Å; Q97-Y114 HydrophobicContact CB-CD2 3.9Å; Q97-Y114 HydrophobicContact CB-CE1 3.86Å; Q97-Y114 HydrophobicContact CB-CE2 4.13Å; Q97-Y114 HydrophobicContact CB-CG 3.65Å; Q97-Y114 HydrophobicContact CG-CD1 3.86Å; Q97-Y114 HydrophobicContact CG-CE1 3.62Å; Q97-Y114 HydrophobicContact CG-CE2 4.42Å; Q97-Y114 HydrophobicContact CG-CG 4.36Å; Q101-Y114 HydrophobicContact CB-CD2 4.22Å; Q101-Y114 HydrophobicContact CG-CD2 4.5Å; Q101-Y114 PolarHBondContact O-N 2.94Å; A103-Y114 HydrophobicContact CB-CD1 3.72Å; A103-Y114 HydrophobicContact CB-CD2 3.54Å; A103-Y114 HydrophobicContact CB-CE1 3.77Å; A103-Y114 HydrophobicContact CB-CE2 3.6Å; A103-Y114 HydrophobicContact CB-CG 3.6Å; Y114-L117 PolarHBondContact O-N 3.43Å; Y114-M118 WeakPolarHBondContact O-CB 3.38Å; Y114-M118 WeakPolarHBondContact O-CE 3.27Å; Y114-M118 VanDerWaalsContact O-CG 3.31Å; Y114-M118 WeakPolarHBondContact O-CG 3.49Å; Y114-M118 PolarHBondContact O-N 2.84Å; Y114-L319 HydrophobicContact CE1-CD2 4Å; Y114-L319 PolarHBondContact OH-O 3.48Å; Y114-G322 WeakPolarHBondContact OH-CA 3.34Å; Y114-C323 PolarHBondContact OH-N 3.16Å; Y114-C323 PolarHBondContact OH-O 3.43Å
115	G	96	Very high	94.5	Very high	21 Å²	21	34.2 Å²	34.2	22%	0.216	16%	0.164	C	C	.	.	H	α-helix	trans	-61.5	-44.6	175.2	0	0	0	0	0	112.9	V99 T113 H119	V99-G115 WeakPolarHBondContact O-CA 3.45Å; V99-G115 PolarHBondContact O-N 3.41Å; T113-G115 PolarHBondContact O-N 3Å; G115-H119 WeakPolarHBondContact O-CB 3.35Å; G115-H119 PolarHBondContact O-N 2.88Å
116	Q	95	Very high	94.2	Very high	66 Å²	66	35.3 Å²	35.3	31%	0.308	17%	0.171	S	C	.	.	H	α-helix	trans	-67.4	-41.2	176.8	-70.8	172.2	-3.7	0	0	112	L112 T113 H119 N120	L112-Q116 HydrophobicContact CB-CB 4.33Å; L112-Q116 HydrophobicContact CD2-CB 4.25Å; T113-Q116 PolarHBondContact O-N 2.9Å; T113-Q116 VanDerWaalsContact O-N 3.13Å; T113-Q116 WeakPolarHBondContact OG1-CG 3.49Å; T113-Q116 PolarHBondContact OG1-N 2.81Å; T113-Q116 VanDerWaalsContact OG1-N 3.17Å; Q116-H119 WeakPolarHBondContact O-CB 3.26Å; Q116-H119 PolarHBondContact O-N 3.07Å; Q116-N120 VanDerWaalsContact O-CG 3.26Å; Q116-N120 PolarHBondContact O-N 3.41Å; Q116-N120 PolarHBondContact O-OD1 3.3Å
117	L	96	Very high	94.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.7	-48.4	175.6	176.3	60.2	0	0	0	111.2	L94 A103 T113 Y114 H119 N120 I121 L319	L94-L117 HydrophobicContact CD2-CD2 4.36Å; A103-L117 HydrophobicContact CB-CD2 4.33Å; T113-L117 WeakPolarHBondContact O-CB 3.49Å; T113-L117 PolarHBondContact O-N 2.74Å; Y114-L117 PolarHBondContact O-N 3.43Å; L117-H119 VanDerWaalsContact C-N 3.3Å; L117-H119 PolarHBondContact O-N 3.17Å; L117-N120 PolarHBondContact O-N 3.33Å; L117-I121 HydrophobicContact CD1-CD1 4.21Å; L117-I121 HydrophobicContact CD1-CG1 4.43Å; L117-I121 HydrophobicContact CG-CD1 4Å; L117-I121 VanDerWaalsContact O-CG1 3.31Å; L117-I121 WeakPolarHBondContact O-CG1 3.41Å; L117-I121 PolarHBondContact O-N 3.13Å; L117-L319 HydrophobicContact CD2-CD1 4.05Å; L117-L319 HydrophobicContact CD2-CD2 3.51Å; L117-L319 HydrophobicContact CD2-CG 4.43Å
118	M	94.7	Very high	93.9	Very high	11 Å²	11	34.4 Å²	34.4	5%	0.054	17%	0.167	C	C	.	.	H	α-helix	trans	-61.2	-38.7	176.3	-76.5	-172.2	-74.5	0	0	112.3	W91 L94 V99 Y114 I121 R122	W91-M118 HydrophobicContact CH2-CB 3.92Å; W91-M118 HydrophobicContact CH2-CG 4Å; W91-M118 HydrophobicContact CH2-SD 4.36Å; W91-M118 HydrophobicContact CZ3-CB 4.24Å; W91-M118 HydrophobicContact CZ3-CG 4.1Å; L94-M118 HydrophobicContact CB-CG 4.23Å; L94-M118 HydrophobicContact CB-SD 4.22Å; V99-M118 HydrophobicContact CG1-CE 3.85Å; Y114-M118 WeakPolarHBondContact O-CB 3.38Å; Y114-M118 WeakPolarHBondContact O-CE 3.27Å; Y114-M118 VanDerWaalsContact O-CG 3.31Å; Y114-M118 WeakPolarHBondContact O-CG 3.49Å; Y114-M118 PolarHBondContact O-N 2.84Å; M118-I121 PolarHBondContact O-N 3.28Å; M118-R122 WeakPolarHBondContact O-CG 3.48Å; M118-R122 PolarHBondContact O-N 3.12Å
119	H	92.5	Very high	93.7	Very high	80 Å²	80	31.7 Å²	31.7	37%	0.37	16%	0.156	S	C	.	.	H	α-helix	trans	-60.9	-49.5	172.8	178.2	77.9	0	0	0	111.2	G115 Q116 L117 I121 R122 V123	G115-H119 WeakPolarHBondContact O-CB 3.35Å; G115-H119 PolarHBondContact O-N 2.88Å; Q116-H119 WeakPolarHBondContact O-CB 3.26Å; Q116-H119 PolarHBondContact O-N 3.07Å; L117-H119 VanDerWaalsContact C-N 3.3Å; L117-H119 PolarHBondContact O-N 3.17Å; H119-I121 VanDerWaalsContact C-N 3.29Å; H119-I121 PolarHBondContact O-N 3.02Å; H119-R122 WeakPolarHBondContact O-CB 3.16Å; H119-R122 PolarHBondContact O-N 2.85Å; H119-R122 VanDerWaalsContact O-N 3.11Å; H119-V123 WeakPolarHBondContact O-CG2 3.35Å; H119-V123 PolarHBondContact O-N 2.83Å
120	N	93	Very high	93.5	Very high	40 Å²	40	34.4 Å²	34.4	21%	0.214	17%	0.169	C	C	.	.	H	α-helix	trans	-60.1	-38.8	178.3	-69.1	-5.6	0	0	0	112.2	Q116 L117 V123 N124	Q116-N120 VanDerWaalsContact O-CG 3.26Å; Q116-N120 PolarHBondContact O-N 3.41Å; Q116-N120 PolarHBondContact O-OD1 3.3Å; L117-N120 PolarHBondContact O-N 3.33Å; N120-V123 PolarHBondContact O-N 3.29Å; N120-N124 WeakPolarHBondContact O-CB 3.27Å; N120-N124 VanDerWaalsContact O-CG 3.25Å; N120-N124 PolarHBondContact O-N 3.31Å; N120-N124 PolarHBondContact O-ND2 3.19Å
121	I	94.6	Very high	93.4	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.4	-48.5	174	-69	161.7	0	0	0	110.5	W91 L94 L117 M118 H119 V123 N124 I125 I155 A156 I159	W91-I121 HydrophobicContact CE3-CG2 4.07Å; W91-I121 HydrophobicContact CZ3-CB 4.09Å; W91-I121 HydrophobicContact CZ3-CD1 4.32Å; W91-I121 HydrophobicContact CZ3-CG2 3.72Å; L94-I121 HydrophobicContact CD1-CD1 3.73Å; L117-I121 HydrophobicContact CD1-CD1 4.21Å; L117-I121 HydrophobicContact CD1-CG1 4.43Å; L117-I121 HydrophobicContact CG-CD1 4Å; L117-I121 VanDerWaalsContact O-CG1 3.31Å; L117-I121 WeakPolarHBondContact O-CG1 3.41Å; L117-I121 PolarHBondContact O-N 3.13Å; M118-I121 PolarHBondContact O-N 3.28Å; H119-I121 VanDerWaalsContact C-N 3.29Å; H119-I121 PolarHBondContact O-N 3.02Å; I121-V123 VanDerWaalsContact C-N 3.33Å; I121-V123 PolarHBondContact O-N 3.17Å; I121-N124 PolarHBondContact O-N 2.93Å; I121-I125 HydrophobicContact CG2-CD1 3.99Å; I121-I125 WeakPolarHBondContact O-CG1 3.42Å; I121-I125 PolarHBondContact O-N 3.08Å; I121-I155 HydrophobicContact CD1-CB 4.08Å; I121-I155 HydrophobicContact CD1-CD1 4.03Å; I121-I155 HydrophobicContact CD1-CG2 3.74Å; I121-I155 HydrophobicContact CG1-CB 4.19Å; I121-I155 HydrophobicContact CG1-CG2 4.18Å; I121-I155 HydrophobicContact CG2-CG2 4.21Å; I121-A156 HydrophobicContact CG2-CB 4.4Å; I121-I159 HydrophobicContact CG2-CD1 3.61Å
122	R	93.6	Very high	93.1	Very high	64 Å²	64	27.4 Å²	27.4	24%	0.242	14%	0.139	C	C	.	.	H	α-helix	trans	-60	-42.3	177.8	-73.2	176.4	174.3	129.8	-3.1	112.2	W91 M118 H119 I125 V126 L240 L244	W91-R122 HydrophobicContact CH2-CG 4.05Å; M118-R122 WeakPolarHBondContact O-CG 3.48Å; M118-R122 PolarHBondContact O-N 3.12Å; H119-R122 WeakPolarHBondContact O-CB 3.16Å; H119-R122 PolarHBondContact O-N 2.85Å; H119-R122 VanDerWaalsContact O-N 3.11Å; R122-I125 WeakPolarHBondContact O-CB 3.12Å; R122-I125 PolarHBondContact O-N 3.32Å; R122-V126 PolarHBondContact O-N 3.18Å; R122-L240 HydrophobicContact CB-CD2 4.06Å; R122-L244 HydrophobicContact CG-CD1 3.97Å; R122-L244 HydrophobicContact CG-CD2 4.4Å; R122-L244 HydrophobicContact CG-CG 4.33Å
123	V	93.6	Very high	92.1	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.018	16%	0.162	C	C	.	.	H	α-helix	trans	-62.1	-45.6	176.2	175	0	0	0	0	110.9	H119 N120 I121 I125 V126 L127 Q230 L240	H119-V123 WeakPolarHBondContact O-CG2 3.35Å; H119-V123 PolarHBondContact O-N 2.83Å; N120-V123 PolarHBondContact O-N 3.29Å; I121-V123 VanDerWaalsContact C-N 3.33Å; I121-V123 PolarHBondContact O-N 3.17Å; V123-I125 VanDerWaalsContact C-N 3.28Å; V123-I125 PolarHBondContact O-N 2.94Å; V123-V126 PolarHBondContact O-N 3.12Å; V123-L127 WeakPolarHBondContact O-CB 3.47Å; V123-L127 PolarHBondContact O-N 3.37Å; V123-Q230 HydrophobicContact CG1-CB 3.78Å; V123-Q230 HydrophobicContact CG1-CG 3.86Å; V123-Q230 WeakPolarHBondContact CG1-O 3.33Å; V123-L240 HydrophobicContact CB-CD2 4.49Å; V123-L240 HydrophobicContact CG2-CD2 3.85Å
124	N	93.7	Very high	90.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.6	-33	177.9	-71.8	-26.4	0	0	0	112.5	N120 I121 L127 L128 S152 L153 A156 Q230	N120-N124 WeakPolarHBondContact O-CB 3.27Å; N120-N124 VanDerWaalsContact O-CG 3.25Å; N120-N124 PolarHBondContact O-N 3.31Å; N120-N124 PolarHBondContact O-ND2 3.19Å; I121-N124 PolarHBondContact O-N 2.93Å; N124-L127 WeakPolarHBondContact O-CB 3.4Å; N124-L127 PolarHBondContact O-N 3.23Å; N124-L128 WeakPolarHBondContact O-CB 3.34Å; N124-L128 WeakPolarHBondContact O-CG 3.35Å; N124-L128 PolarHBondContact O-N 3.46Å; N124-S152 VanDerWaalsContact ND2-C 3.25Å; N124-S152 PolarHBondContact ND2-O 3.15Å; N124-S152 PolarHBondContact ND2-OG 2.81Å; N124-L153 HydrophobicContact CB-CD1 4.41Å; N124-L153 PolarHBondContact ND2-N 3.33Å; N124-A156 HydrophobicContact CB-CB 3.56Å; N124-Q230 PolarHBondContact OD1-NE2 3.43Å
125	I	92.1	Very high	89.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-49.5	173.9	-75.8	172.4	0	0	0	110.7	I121 R122 V123 L127 L128 D129 A156 I159 R160 L244	I121-I125 HydrophobicContact CG2-CD1 3.99Å; I121-I125 WeakPolarHBondContact O-CG1 3.42Å; I121-I125 PolarHBondContact O-N 3.08Å; R122-I125 WeakPolarHBondContact O-CB 3.12Å; R122-I125 PolarHBondContact O-N 3.32Å; V123-I125 VanDerWaalsContact C-N 3.28Å; V123-I125 PolarHBondContact O-N 2.94Å; I125-L127 VanDerWaalsContact C-N 3.28Å; I125-L127 PolarHBondContact O-N 3.44Å; I125-L128 PolarHBondContact O-N 3.01Å; I125-D129 VanDerWaalsContact O-CG 3.25Å; I125-D129 PolarHBondContact O-N 2.83Å; I125-A156 HydrophobicContact CG1-CB 3.73Å; I125-I159 HydrophobicContact CD1-CB 4.03Å; I125-I159 HydrophobicContact CD1-CD1 3.94Å; I125-I159 HydrophobicContact CD1-CG2 3.64Å; I125-R160 HydrophobicContact CG1-CG 4.47Å; I125-R160 HydrophobicContact CG2-CG 4.32Å; I125-L244 HydrophobicContact CD1-CD1 3.93Å; I125-L244 HydrophobicContact CD1-CD2 3.53Å; I125-L244 HydrophobicContact CD1-CG 4.41Å; I125-L244 HydrophobicContact CG2-CD2 4.18Å
126	V	91.1	Very high	87.9	Confident	23 Å²	23	44.4 Å²	44.4	14%	0.139	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-40.7	177.3	176.1	0	0	0	0	111.1	R122 V123 D129 H130 Y233 L239 L240	R122-V126 PolarHBondContact O-N 3.18Å; V123-V126 PolarHBondContact O-N 3.12Å; V126-D129 PolarHBondContact O-N 2.81Å; V126-H130 PolarHBondContact O-N 3.48Å; V126-H130 VanDerWaalsContact O-N 3.15Å; V126-Y233 HydrophobicContact CG1-CD1 3.89Å; V126-Y233 HydrophobicContact CG1-CG 4.26Å; V126-L239 WeakPolarHBondContact CG2-O 3.24Å; V126-L240 HydrophobicContact CG2-CD2 4.17Å
127	L	91.6	Very high	87.2	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-49.5	175.2	173.2	61.4	0	0	0	111.6	V123 N124 I125 D129 H130 L131 F188 L226 L229 Y233	V123-L127 WeakPolarHBondContact O-CB 3.47Å; V123-L127 PolarHBondContact O-N 3.37Å; N124-L127 WeakPolarHBondContact O-CB 3.4Å; N124-L127 PolarHBondContact O-N 3.23Å; I125-L127 VanDerWaalsContact C-N 3.28Å; I125-L127 PolarHBondContact O-N 3.44Å; L127-D129 PolarHBondContact O-N 2.84Å; L127-H130 PolarHBondContact O-N 3.44Å; L127-H130 VanDerWaalsContact O-N 3.17Å; L127-L131 HydrophobicContact CD1-CD1 3.64Å; L127-L131 HydrophobicContact CD1-CD2 4.47Å; L127-L131 HydrophobicContact CD1-CG 3.91Å; L127-L131 HydrophobicContact CD2-CD1 4.43Å; L127-L131 HydrophobicContact CG-CD1 3.73Å; L127-L131 HydrophobicContact CG-CG 4.38Å; L127-L131 VanDerWaalsContact O-CG 3.28Å; L127-L131 WeakPolarHBondContact O-CG 3.25Å; L127-L131 PolarHBondContact O-N 3Å; L127-F188 HydrophobicContact CD2-CE1 4.29Å; L127-L226 HydrophobicContact CD2-CD1 3.6Å; L127-L229 HydrophobicContact CD1-CB 3.98Å; L127-L229 HydrophobicContact CD1-CD1 4.02Å; L127-L229 HydrophobicContact CD1-CG 4.42Å; L127-L229 HydrophobicContact CD2-CB 4.39Å; L127-Y233 HydrophobicContact CB-CD2 4.26Å; L127-Y233 HydrophobicContact CD1-CD2 3.83Å; L127-Y233 HydrophobicContact CD1-CE2 3.54Å
128	L	91.8	Very high	86.8	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-41.3	179.9	-72.5	167.7	0	0	0	111.6	N124 I125 H130 L131 L132 V140 L153 A156 I162 F188	N124-L128 WeakPolarHBondContact O-CB 3.34Å; N124-L128 WeakPolarHBondContact O-CG 3.35Å; N124-L128 PolarHBondContact O-N 3.46Å; I125-L128 PolarHBondContact O-N 3.01Å; L128-H130 PolarHBondContact O-N 3.12Å; L128-L131 PolarHBondContact O-N 3Å; L128-L132 HydrophobicContact CD2-CD1 4.11Å; L128-L132 WeakPolarHBondContact O-CB 3.39Å; L128-L132 PolarHBondContact O-N 2.79Å; L128-V140 HydrophobicContact CD2-CG2 4.34Å; L128-L153 HydrophobicContact CD1-CD1 4.26Å; L128-L153 HydrophobicContact CD2-CD1 4.28Å; L128-L153 HydrophobicContact CG-CD1 4.4Å; L128-A156 HydrophobicContact CD1-CB 3.85Å; L128-I162 HydrophobicContact CB-CD1 3.89Å; L128-I162 HydrophobicContact CD1-CD1 4.06Å; L128-I162 HydrophobicContact CD2-CD1 4.36Å; L128-I162 HydrophobicContact CG-CD1 4.33Å; L128-F188 HydrophobicContact CD2-CE2 4.25Å; L128-F188 HydrophobicContact CD2-CZ 4.16Å
129	D	88.6	Confident	86.8	Confident	73 Å²	73	47.7 Å²	47.7	39%	0.39	25%	0.246	S	C	.	.	H	α-helix	trans	-62	-28.5	176.1	-69.8	-17.5	0	0	0	112.5	I125 V126 L127 R160	I125-D129 VanDerWaalsContact O-CG 3.25Å; I125-D129 PolarHBondContact O-N 2.83Å; V126-D129 PolarHBondContact O-N 2.81Å; L127-D129 PolarHBondContact O-N 2.84Å; D129-R160 VanDerWaalsContact CG-NE 3.32Å; D129-R160 VanDerWaalsContact OD1-CD 3.29Å; D129-R160 WeakPolarHBondContact OD1-CD 3.32Å; D129-R160 IonicContact OD1-CZ 2.96Å; D129-R160 IonicContact OD1-NE 3.91Å; D129-R160 PolarHBondContact OD1-NE 2.78Å; D129-R160 IonicContact OD1-NH2 3.98Å; D129-R160 IonicContact OD2-CZ 3.7Å; D129-R160 IonicContact OD2-NE 3.14Å; D129-R160 PolarHBondContact OD2-NE 2.66Å; D129-R160 VanDerWaalsContact OD2-NE 3.09Å; D129-R160 IonicContact OD2-NH2 2.65Å; D129-R160 PolarHBondContact OD2-NH2 3Å
130	H	88.3	Confident	87	Confident	127 Å²	127	43.9 Å²	43.9	59%	0.588	23%	0.228	S	C	*	.	H	α-helix	trans	-81.9	-39	176	-173.8	78.6	0	0	0	112.9	V126 L127 L128 Y233	V126-H130 PolarHBondContact O-N 3.48Å; V126-H130 VanDerWaalsContact O-N 3.15Å; L127-H130 PolarHBondContact O-N 3.44Å; L127-H130 VanDerWaalsContact O-N 3.17Å; L128-H130 PolarHBondContact O-N 3.12Å; H130-Y233 HydrophobicContact CB-CE1 4.23Å; H130-Y233 AromaticContact CD2-CZ 3.86Å; H130-Y233 PolarHBondContact CD2-OH 3.5Å; H130-Y233 AromaticContact CG-CZ 3.95Å; H130-Y233 PolarHBondContact NE2-OH 3.08Å
131	L	88.7	Confident	87.2	Confident	10 Å²	10	42 Å²	42	5%	0.052	22%	0.218	C	C	.	.	H	α-helix	trans	-77.3	-33.4	-178	-66.9	170.6	0	0	0	112.6	L127 L128 F188 H208 I210	L127-L131 HydrophobicContact CD1-CD1 3.64Å; L127-L131 HydrophobicContact CD1-CD2 4.47Å; L127-L131 HydrophobicContact CD1-CG 3.91Å; L127-L131 HydrophobicContact CD2-CD1 4.43Å; L127-L131 HydrophobicContact CG-CD1 3.73Å; L127-L131 HydrophobicContact CG-CG 4.38Å; L127-L131 VanDerWaalsContact O-CG 3.28Å; L127-L131 WeakPolarHBondContact O-CG 3.25Å; L127-L131 PolarHBondContact O-N 3Å; L128-L131 PolarHBondContact O-N 3Å; L131-F188 HydrophobicContact CD1-CZ 4.02Å; L131-H208 HydrophobicContact CD2-CB 4.47Å; L131-H208 PolarHBondContact O-NE2 3.33Å; L131-I210 HydrophobicContact CD1-CD1 3.29Å; L131-I210 HydrophobicContact CD2-CD1 4.2Å; L131-I210 HydrophobicContact CG-CD1 4.39Å
132	L	88.3	Confident	87.3	Confident	13 Å²	13	42 Å²	42	7%	0.068	22%	0.218	C	C	.	.	S	Bend	trans	-118.2	121.1	-172.3	-57.7	173.9	0	0	0	108.7	L128 K138 V140 I162 C186	L128-L132 HydrophobicContact CD2-CD1 4.11Å; L128-L132 WeakPolarHBondContact O-CB 3.39Å; L128-L132 PolarHBondContact O-N 2.79Å; L132-K138 HydrophobicContact CD2-CB 4.48Å; L132-K138 HydrophobicContact CD2-CD 4.25Å; L132-V140 HydrophobicContact CD1-CG2 3.64Å; L132-I162 HydrophobicContact CD1-CD1 3.94Å; L132-I162 HydrophobicContact CD1-CG1 4.44Å; L132-I162 HydrophobicContact CD1-CG2 3.93Å; L132-C186 HydrophobicContact CD2-CB 4.03Å
133	E	76.7	Confident	87.4	Confident	130 Å²	130	39 Å²	39	61%	0.607	21%	0.206	S	C	*	.			trans	-57.8	139	173.5	-68.1	170.5	161.2	0	0	110.3	D135 N136	E133-D135 PolarHBondContact O-N 3.28Å; E133-N136 HydrophobicContact CB-CB 4.4Å; E133-N136 WeakPolarHBondContact O-CB 3.23Å; E133-N136 PolarHBondContact O-N 3.01Å; E133-N136 PolarHBondContact OE2-ND2 3.44Å
134	P	68.3	Low	87.4	Confident	114 Å²	114	38.9 Å²	38.9	74%	0.74	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	141.2	169.3	-21.3	30.8	0	0	0	110	N136	P134-N136 VanDerWaalsContact C-N 3.26Å; P134-N136 PolarHBondContact O-N 2.88Å
135	D	65.6	Low	87.2	Confident	133 Å²	133	41.4 Å²	41.4	71%	0.711	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.4	13.1	178	-52.2	-40.3	0	0	0	116.3	E133 R249	E133-D135 PolarHBondContact O-N 3.28Å; D135-R249 VanDerWaalsContact C-CZ 3.49Å; D135-R249 PolarHBondContact O-NH2 2.61Å
136	N	68.9	Low	87.3	Confident	45 Å²	45	41.9 Å²	41.9	24%	0.241	22%	0.222	C	C	.	.			trans	-81.4	133.5	172.3	-145.7	-40	0	0	0	111.8	E133 P134 K138 R249	E133-N136 HydrophobicContact CB-CB 4.4Å; E133-N136 WeakPolarHBondContact O-CB 3.23Å; E133-N136 PolarHBondContact O-N 3.01Å; E133-N136 PolarHBondContact OE2-ND2 3.44Å; P134-N136 VanDerWaalsContact C-N 3.26Å; P134-N136 PolarHBondContact O-N 2.88Å; N136-K138 HydrophobicContact CB-CB 4.5Å; N136-K138 HydrophobicContact CB-CD 4.02Å; N136-K138 HydrophobicContact CB-CG 4.22Å; N136-K138 VanDerWaalsContact CG-CD 3.44Å; N136-K138 VanDerWaalsContact CG-CE 3.48Å; N136-K138 WeakPolarHBondContact ND2-CE 3.4Å; N136-K138 PolarHBondContact ND2-NZ 3.09Å; N136-K138 VanDerWaalsContact ND2-NZ 3.11Å; N136-K138 PolarHBondContact O-N 3.41Å; N136-K138 WeakPolarHBondContact OD1-CG 3.49Å; N136-R249 PolarHBondContact O-NH1 3.34Å; N136-R249 PolarHBondContact O-NH2 3.43Å
137	D	79.4	Confident	87.3	Confident	119 Å²	119	42.5 Å²	42.5	64%	0.636	22%	0.222	S	C	*	.			trans	-79.2	38.1	177.5	-66.4	-28.4	0	0	0	111.7	N183 R249	D137-N183 PolarHBondContact O-ND2 3.03Å; D137-R249 IonicContact OD1-CZ 3.88Å; D137-R249 IonicContact OD1-NH2 3.94Å; D137-R249 PolarHBondContact OD1-NH2 3.44Å
138	K	88.6	Confident	87.4	Confident	18 Å²	18	43 Å²	43	8%	0.078	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-87.8	136.2	-175.5	-80.1	170.1	178.5	170.5	0	110.7	L132 N136 S185	L132-K138 HydrophobicContact CD2-CB 4.48Å; L132-K138 HydrophobicContact CD2-CD 4.25Å; N136-K138 HydrophobicContact CB-CB 4.5Å; N136-K138 HydrophobicContact CB-CD 4.02Å; N136-K138 HydrophobicContact CB-CG 4.22Å; N136-K138 VanDerWaalsContact CG-CD 3.44Å; N136-K138 VanDerWaalsContact CG-CE 3.48Å; N136-K138 WeakPolarHBondContact ND2-CE 3.4Å; N136-K138 PolarHBondContact ND2-NZ 3.09Å; N136-K138 VanDerWaalsContact ND2-NZ 3.11Å; N136-K138 PolarHBondContact O-N 3.41Å; N136-K138 WeakPolarHBondContact OD1-CG 3.49Å; K138-S185 VanDerWaalsContact CB-OG 3.3Å; K138-S185 WeakPolarHBondContact CB-OG 3.17Å; K138-S185 WeakPolarHBondContact CD-OG 3.43Å; K138-S185 WeakPolarHBondContact CG-OG 3.46Å
139	T	93.6	Very high	87.5	Confident	9 Å²	9	44.1 Å²	44.1	6%	0.055	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	135.4	171.6	-61.9	0	0	0	0	110.6	P163 A165 I182 N183 V184 S185	T139-P163 WeakPolarHBondContact CA-O 3.28Å; T139-P163 HydrophobicContact CG2-CB 4.46Å; T139-A165 HydrophobicContact CG2-CB 3.75Å; T139-I182 WeakPolarHBondContact CB-O 3.31Å; T139-I182 HydrophobicContact CG2-CD1 4.07Å; T139-I182 HydrophobicContact CG2-CG1 4.33Å; T139-I182 PolarHBondContact OG1-O 3.25Å; T139-N183 PolarHBondContact N-O 3.2Å; T139-V184 HydrophobicContact CG2-CG2 3.97Å; T139-V184 WeakPolarHBondContact O-CA 3.41Å; T139-S185 PolarHBondContact O-N 2.92Å
140	V	96.3	Very high	87.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.4	168.6	171.6	0	0	0	0	109	L128 L132 I142 I162 P163 V164 A165 C186 F188	L128-V140 HydrophobicContact CD2-CG2 4.34Å; L132-V140 HydrophobicContact CD1-CG2 3.64Å; V140-I142 HydrophobicContact CG1-CG1 4.35Å; V140-I162 HydrophobicContact CB-CG2 4.38Å; V140-I162 HydrophobicContact CG2-CG2 3.64Å; V140-P163 PolarHBondContact N-O 3.19Å; V140-V164 HydrophobicContact CB-CG2 4.43Å; V140-V164 HydrophobicContact CG1-CG2 4.38Å; V140-V164 CarbonylContact O-C 3.53Å; V140-V164 WeakPolarHBondContact O-CA 3.26Å; V140-A165 PolarHBondContact O-N 3.33Å; V140-C186 HydrophobicContact CG2-CB 4.42Å; V140-F188 HydrophobicContact CG1-CD2 3.56Å; V140-F188 HydrophobicContact CG1-CE2 3.68Å
141	L	97.5	Very high	88.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	132.6	172.4	175.8	64.2	0	0	0	110.7	L143 A165 M167 L179 V184 C186 V187 F188 L200	L141-L143 HydrophobicContact CD1-CD2 3.97Å; L141-L143 HydrophobicContact CD1-CG 4.38Å; L141-L143 HydrophobicContact CD2-CD1 4.02Å; L141-L143 HydrophobicContact CD2-CD2 4.09Å; L141-L143 HydrophobicContact CD2-CG 3.91Å; L141-L143 HydrophobicContact CG-CD2 4.09Å; L141-L143 HydrophobicContact CG-CG 3.95Å; L141-A165 CarbonylContact C-O 3.49Å; L141-A165 WeakPolarHBondContact CA-O 3.44Å; L141-A165 HydrophobicContact CD1-CB 3.97Å; L141-M167 HydrophobicContact CD1-CE 3.97Å; L141-M167 HydrophobicContact CD1-CG 4.41Å; L141-L179 HydrophobicContact CD1-CD2 3.79Å; L141-L179 HydrophobicContact CD2-CD1 3.99Å; L141-L179 HydrophobicContact CD2-CD2 4.01Å; L141-L179 HydrophobicContact CG-CD2 4.42Å; L141-V184 HydrophobicContact CB-CG1 3.59Å; L141-V184 HydrophobicContact CB-CG2 4.03Å; L141-V184 HydrophobicContact CD2-CG1 4.19Å; L141-C186 PolarHBondContact N-O 2.85Å; L141-V187 HydrophobicContact CB-CB 4.38Å; L141-V187 HydrophobicContact CB-CG2 4.15Å; L141-V187 HydrophobicContact CD2-CG2 3.93Å; L141-V187 HydrophobicContact CG-CG2 4.02Å; L141-V187 CarbonylContact O-C 3.39Å; L141-V187 WeakPolarHBondContact O-CA 3.26Å; L141-F188 PolarHBondContact O-N 3.12Å; L141-L200 HydrophobicContact CD2-CD1 3.86Å
142	I	97.4	Very high	88.5	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	117.2	171.6	-59.5	179.1	0	0	0	109.5	V140 V150 L153 L154 V164 A165 I166 F188	V140-I142 HydrophobicContact CG1-CG1 4.35Å; I142-V150 HydrophobicContact CD1-CG1 4.41Å; I142-V150 HydrophobicContact CG2-CG1 4Å; I142-V150 HydrophobicContact CG2-CG2 4.43Å; I142-L153 HydrophobicContact CD1-CD2 3.94Å; I142-L153 HydrophobicContact CD1-CG 4.34Å; I142-L153 HydrophobicContact CG1-CD2 4.29Å; I142-L154 HydrophobicContact CD1-CD2 3.73Å; I142-L154 HydrophobicContact CD1-CG 3.94Å; I142-V164 HydrophobicContact CD1-CG2 3.72Å; I142-V164 HydrophobicContact CG1-CG2 3.98Å; I142-A165 PolarHBondContact N-O 3.08Å; I142-I166 HydrophobicContact CB-CB 4.38Å; I142-I166 HydrophobicContact CB-CD1 4.31Å; I142-I166 HydrophobicContact CB-CG1 4.01Å; I142-I166 HydrophobicContact CG2-CD1 4.06Å; I142-I166 HydrophobicContact CG2-CG1 4.13Å; I142-F188 CarbonylContact C-O 3.53Å; I142-F188 WeakPolarHBondContact CA-O 3.45Å
143	L	95.8	Very high	88.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	81	174.5	-62.7	-178	0	0	0	109.8	L141 M167 A172 V187 F188 A189 S190 K196 L200	L141-L143 HydrophobicContact CD1-CD2 3.97Å; L141-L143 HydrophobicContact CD1-CG 4.38Å; L141-L143 HydrophobicContact CD2-CD1 4.02Å; L141-L143 HydrophobicContact CD2-CD2 4.09Å; L141-L143 HydrophobicContact CD2-CG 3.91Å; L141-L143 HydrophobicContact CG-CD2 4.09Å; L141-L143 HydrophobicContact CG-CG 3.95Å; L143-M167 HydrophobicContact CD2-CG 3.43Å; L143-M167 VanDerWaalsContact CD2-CG 3.43Å; L143-M167 HydrophobicContact CD2-SD 3.76Å; L143-A172 HydrophobicContact CD1-CB 4.39Å; L143-A172 HydrophobicContact CD2-CB 4.43Å; L143-V187 HydrophobicContact CD1-CG2 4.18Å; L143-V187 HydrophobicContact CG-CG2 4.24Å; L143-F188 PolarHBondContact N-O 3.1Å; L143-A189 HydrophobicContact CB-CB 4.01Å; L143-A189 CarbonylContact O-C 3.53Å; L143-A189 WeakPolarHBondContact O-CA 3.31Å; L143-S190 PolarHBondContact O-N 2.83Å; L143-K196 HydrophobicContact CD1-CB 4.4Å; L143-L200 HydrophobicContact CD1-CD1 3.8Å
144	S	93.7	Very high	89.9	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.007	15%	0.153	C	C	.	.			trans	-141.5	147.7	-172.3	-170	0	0	0	0	112	V150 S190	S144-V150 WeakPolarHBondContact OG-CG2 3.36Å; S144-S190 WeakPolarHBondContact CA-OG 3.34Å; S144-S190 WeakPolarHBondContact CB-OG 3.38Å; S144-S190 PolarHBondContact OG-OG 3.49Å
145	N	89.4	Confident	91.2	Very high	53 Å²	53	22 Å²	22	28%	0.283	12%	0.118	S	C	.	.	S	Bend	trans	-72.7	-179.1	157.2	-63.8	-47.6	0	0	0	110.1	R147 E192 H193	N145-R147 PolarHBondContact O-N 3.49Å; N145-R147 VanDerWaalsContact O-N 3.08Å; N145-E192 PolarHBondContact ND2-OE1 2.92Å; N145-H193 PolarHBondContact ND2-NE2 2.91Å
146	N	93	Very high	92.6	Very high	10 Å²	10	15.7 Å²	15.7	5%	0.053	8%	0.084	C	C	.	.	S	Bend	trans	-61	111.4	176	-68.4	-5.2	0	0	0	110.2	L303 P304 L305 M327 L328	N146-L303 PolarHBondContact ND2-O 3.39Å; N146-L303 VanDerWaalsContact ND2-O 3.12Å; N146-P304 WeakPolarHBondContact OD1-CA 3.43Å; N146-L305 WeakPolarHBondContact OD1-CG 3.38Å; N146-L305 PolarHBondContact OD1-N 3.09Å; N146-M327 HydrophobicContact CB-CE 4.32Å; N146-L328 VanDerWaalsContact CB-O 3.32Å; N146-L328 WeakPolarHBondContact CB-O 3.39Å; N146-L328 PolarHBondContact ND2-O 2.74Å; N146-L328 VanDerWaalsContact ND2-O 3.09Å
147	R	92.3	Very high	93.9	Very high	37 Å²	37	13.6 Å²	13.6	14%	0.14	7%	0.072	C	C	.	.			trans	-144.1	142.2	179.2	-69.2	-173.8	-179.3	-104.6	3.5	110.2	N145 V150 S190 E192 E214	N145-R147 PolarHBondContact O-N 3.49Å; N145-R147 VanDerWaalsContact O-N 3.08Å; R147-V150 HydrophobicContact CB-CG2 4.09Å; R147-V150 WeakPolarHBondContact O-CB 3.4Å; R147-V150 PolarHBondContact O-N 3.46Å; R147-S190 WeakPolarHBondContact CD-OG 3.38Å; R147-S190 PolarHBondContact NE-OG 2.84Å; R147-E192 IonicContact CZ-OE1 3.43Å; R147-E192 IonicContact CZ-OE2 3.57Å; R147-E192 IonicContact NE-OE1 3.1Å; R147-E192 IonicContact NH2-OE1 2.7Å; R147-E192 PolarHBondContact NH2-OE1 3.11Å; R147-E192 VanDerWaalsContact NH2-OE1 3.12Å; R147-E192 IonicContact NH2-OE2 3.03Å; R147-E192 PolarHBondContact NH2-OE2 2.89Å; R147-E214 IonicContact CZ-OE1 2.77Å; R147-E214 IonicContact NH1-OE1 3.26Å; R147-E214 PolarHBondContact NH1-OE1 2.65Å
148	A	92.9	Very high	94.6	Very high	10 Å²	10	8 Å²	8	8%	0.083	4%	0.042	C	C	.	.	H	α-helix	trans	-59.8	-42.1	-176	0	0	0	0	0	114.7	F104 I106 L112 V150 V151	F104-A148 HydrophobicContact CD1-CB 4.43Å; F104-A148 VanDerWaalsContact CE1-CA 3.42Å; F104-A148 HydrophobicContact CE1-CB 3.62Å; F104-A148 WeakPolarHBondContact CE1-O 3.48Å; F104-A148 HydrophobicContact CZ-CB 4.15Å; I106-A148 HydrophobicContact CG1-CB 4.34Å; L112-A148 HydrophobicContact CD1-CB 4.47Å; A148-V150 PolarHBondContact O-N 3.03Å; A148-V150 VanDerWaalsContact O-N 3.15Å; A148-V151 PolarHBondContact O-N 2.95Å
149	P	93.6	Very high	94.8	Very high	25 Å²	25	7.1 Å²	7.1	16%	0.162	4%	0.038	C	C	.	.	H	α-helix	trans	-59.4	-28.6	178.8	-26.7	36	0	0	0	114.2	V151 S152 L153 I212 L226	P149-V151 VanDerWaalsContact C-N 3.32Å; P149-V151 PolarHBondContact O-N 2.89Å; P149-S152 PolarHBondContact O-N 3.33Å; P149-S152 PolarHBondContact O-OG 2.96Å; P149-L153 WeakPolarHBondContact O-CB 3.38Å; P149-L153 PolarHBondContact O-N 3.23Å; P149-I212 HydrophobicContact CB-CG2 3.98Å; P149-I212 HydrophobicContact CG-CG2 4.26Å; P149-L226 HydrophobicContact CB-CD2 3.83Å
150	V	95.6	Very high	94.6	Very high	1 Å²	1	8.7 Å²	8.7	1%	0.006	4%	0.043	C	C	.	.	H	α-helix	trans	-61	-40.6	-179.9	176.5	0	0	0	0	111.4	I142 S144 R147 A148 L153 L154 I166 I212 L305	I142-V150 HydrophobicContact CD1-CG1 4.41Å; I142-V150 HydrophobicContact CG2-CG1 4Å; I142-V150 HydrophobicContact CG2-CG2 4.43Å; S144-V150 WeakPolarHBondContact OG-CG2 3.36Å; R147-V150 HydrophobicContact CB-CG2 4.09Å; R147-V150 WeakPolarHBondContact O-CB 3.4Å; R147-V150 PolarHBondContact O-N 3.46Å; A148-V150 PolarHBondContact O-N 3.03Å; A148-V150 VanDerWaalsContact O-N 3.15Å; V150-L153 PolarHBondContact O-N 3.15Å; V150-L154 HydrophobicContact CG1-CD1 3.91Å; V150-L154 HydrophobicContact CG1-CG 4.25Å; V150-L154 WeakPolarHBondContact O-CB 3.47Å; V150-L154 WeakPolarHBondContact O-CG 3.3Å; V150-L154 PolarHBondContact O-N 3.22Å; V150-I166 HydrophobicContact CG1-CD1 4.26Å; V150-I212 HydrophobicContact CG2-CD1 3.84Å; V150-L305 HydrophobicContact CB-CD1 4.02Å; V150-L305 HydrophobicContact CG1-CD1 3.98Å
151	V	96.3	Very high	94.3	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.006	4%	0.044	C	C	.	.	H	α-helix	trans	-63.9	-48.3	179.7	173.5	0	0	0	0	110.7	F104 A148 P149 L153 L154 I155 L305 V315 L319	F104-V151 HydrophobicContact CD1-CB 4.35Å; F104-V151 HydrophobicContact CD1-CG1 4.46Å; F104-V151 HydrophobicContact CE1-CB 3.72Å; F104-V151 HydrophobicContact CE1-CG1 4.28Å; F104-V151 HydrophobicContact CE1-CG2 3.69Å; F104-V151 HydrophobicContact CE2-CG2 3.98Å; F104-V151 HydrophobicContact CZ-CB 3.97Å; F104-V151 HydrophobicContact CZ-CG2 3.36Å; A148-V151 PolarHBondContact O-N 2.95Å; P149-V151 VanDerWaalsContact C-N 3.32Å; P149-V151 PolarHBondContact O-N 2.89Å; V151-L153 VanDerWaalsContact C-N 3.25Å; V151-L153 PolarHBondContact O-N 3.48Å; V151-L154 PolarHBondContact O-N 3.26Å; V151-I155 HydrophobicContact CG1-CD1 3.99Å; V151-I155 WeakPolarHBondContact O-CG1 3.22Å; V151-I155 PolarHBondContact O-N 3.22Å; V151-I155 VanDerWaalsContact O-N 3.09Å; V151-L305 HydrophobicContact CG2-CD1 4.21Å; V151-L305 HydrophobicContact CG2-CD2 4.05Å; V151-V315 HydrophobicContact CB-CG1 4.45Å; V151-V315 HydrophobicContact CG1-CG1 3.6Å; V151-V315 HydrophobicContact CG2-CG1 4Å; V151-L319 HydrophobicContact CG1-CD1 4.11Å
152	S	95.7	Very high	94.1	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-63.2	-31.9	177.4	67	0	0	0	0	112.9	N124 P149 A156	N124-S152 VanDerWaalsContact ND2-C 3.25Å; N124-S152 PolarHBondContact ND2-O 3.15Å; N124-S152 PolarHBondContact ND2-OG 2.81Å; P149-S152 PolarHBondContact O-N 3.33Å; P149-S152 PolarHBondContact O-OG 2.96Å; S152-A156 WeakPolarHBondContact O-CB 3.19Å; S152-A156 PolarHBondContact O-N 3.19Å
153	L	96.3	Very high	93.9	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-73	-44.9	177	178.9	65.1	0	0	0	111.5	N124 L128 I142 P149 V150 V151 I155 A156 C157 F188	N124-L153 HydrophobicContact CB-CD1 4.41Å; N124-L153 PolarHBondContact ND2-N 3.33Å; L128-L153 HydrophobicContact CD1-CD1 4.26Å; L128-L153 HydrophobicContact CD2-CD1 4.28Å; L128-L153 HydrophobicContact CG-CD1 4.4Å; I142-L153 HydrophobicContact CD1-CD2 3.94Å; I142-L153 HydrophobicContact CD1-CG 4.34Å; I142-L153 HydrophobicContact CG1-CD2 4.29Å; P149-L153 WeakPolarHBondContact O-CB 3.38Å; P149-L153 PolarHBondContact O-N 3.23Å; V150-L153 PolarHBondContact O-N 3.15Å; V151-L153 VanDerWaalsContact C-N 3.25Å; V151-L153 PolarHBondContact O-N 3.48Å; L153-I155 VanDerWaalsContact C-N 3.35Å; L153-I155 PolarHBondContact O-N 2.82Å; L153-A156 WeakPolarHBondContact O-CB 3.42Å; L153-A156 PolarHBondContact O-N 2.94Å; L153-C157 PolarHBondContact O-N 3.09Å; L153-C157 PolarHBondContact O-SG 2.8Å; L153-F188 HydrophobicContact CD1-CE1 4.07Å; L153-F188 HydrophobicContact CD1-CE2 4.26Å; L153-F188 HydrophobicContact CD1-CZ 3.93Å; L153-F188 HydrophobicContact CD2-CB 3.84Å; L153-F188 HydrophobicContact CD2-CD1 3.59Å; L153-F188 HydrophobicContact CD2-CD2 3.76Å; L153-F188 HydrophobicContact CD2-CE1 4Å; L153-F188 HydrophobicContact CD2-CE2 4.16Å; L153-F188 HydrophobicContact CD2-CG 3.46Å; L153-F188 VanDerWaalsContact CD2-CG 3.46Å; L153-F188 HydrophobicContact CD2-CZ 4.27Å
154	L	97.1	Very high	93.9	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-57.2	-48.1	176.3	-79.5	169.3	0	0	0	111.3	I142 V150 V151 A156 C157 H158 V164 I166 L311	I142-L154 HydrophobicContact CD1-CD2 3.73Å; I142-L154 HydrophobicContact CD1-CG 3.94Å; V150-L154 HydrophobicContact CG1-CD1 3.91Å; V150-L154 HydrophobicContact CG1-CG 4.25Å; V150-L154 WeakPolarHBondContact O-CB 3.47Å; V150-L154 WeakPolarHBondContact O-CG 3.3Å; V150-L154 PolarHBondContact O-N 3.22Å; V151-L154 PolarHBondContact O-N 3.26Å; L154-A156 VanDerWaalsContact C-N 3.31Å; L154-A156 PolarHBondContact O-N 2.85Å; L154-C157 WeakPolarHBondContact O-CB 3.32Å; L154-C157 PolarHBondContact O-N 2.84Å; L154-H158 PolarHBondContact O-CD2 2.98Å; L154-H158 PolarHBondContact O-N 3.32Å; L154-V164 HydrophobicContact CD2-CB 4.48Å; L154-V164 HydrophobicContact CD2-CG1 3.81Å; L154-V164 HydrophobicContact CD2-CG2 3.89Å; L154-I166 HydrophobicContact CD1-CD1 4.29Å; L154-L311 HydrophobicContact CD1-CD2 3.75Å
155	I	96.8	Very high	94	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-63.6	-39.6	179.2	-62.3	169.8	0	0	0	110.8	L90 L94 I121 V151 L153 H158 I159 Y316 L319	L90-I155 HydrophobicContact CD1-CG1 4.25Å; L94-I155 HydrophobicContact CD1-CG2 4.46Å; I121-I155 HydrophobicContact CD1-CB 4.08Å; I121-I155 HydrophobicContact CD1-CD1 4.03Å; I121-I155 HydrophobicContact CD1-CG2 3.74Å; I121-I155 HydrophobicContact CG1-CB 4.19Å; I121-I155 HydrophobicContact CG1-CG2 4.18Å; I121-I155 HydrophobicContact CG2-CG2 4.21Å; V151-I155 HydrophobicContact CG1-CD1 3.99Å; V151-I155 WeakPolarHBondContact O-CG1 3.22Å; V151-I155 PolarHBondContact O-N 3.22Å; V151-I155 VanDerWaalsContact O-N 3.09Å; L153-I155 VanDerWaalsContact C-N 3.35Å; L153-I155 PolarHBondContact O-N 2.82Å; I155-H158 PolarHBondContact O-N 3.04Å; I155-I159 HydrophobicContact CG2-CD1 3.84Å; I155-I159 HydrophobicContact CG2-CG1 4.4Å; I155-I159 WeakPolarHBondContact O-CG1 3.48Å; I155-I159 PolarHBondContact O-N 3.19Å; I155-Y316 HydrophobicContact CG1-CE1 4.33Å; I155-L319 HydrophobicContact CD1-CD1 3.76Å
156	A	95.2	Very high	94.3	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-61.3	-43.7	174.8	0	0	0	0	0	112.5	I121 N124 I125 L128 S152 L153 L154 H158 I159 R160	I121-A156 HydrophobicContact CG2-CB 4.4Å; N124-A156 HydrophobicContact CB-CB 3.56Å; I125-A156 HydrophobicContact CG1-CB 3.73Å; L128-A156 HydrophobicContact CD1-CB 3.85Å; S152-A156 WeakPolarHBondContact O-CB 3.19Å; S152-A156 PolarHBondContact O-N 3.19Å; L153-A156 WeakPolarHBondContact O-CB 3.42Å; L153-A156 PolarHBondContact O-N 2.94Å; L154-A156 VanDerWaalsContact C-N 3.31Å; L154-A156 PolarHBondContact O-N 2.85Å; A156-H158 VanDerWaalsContact C-N 3.34Å; A156-H158 PolarHBondContact O-N 2.92Å; A156-I159 PolarHBondContact O-N 3.09Å; A156-R160 PolarHBondContact O-N 3.04Å; A156-R160 VanDerWaalsContact O-N 3.15Å
157	C	94.9	Very high	94.4	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-57.7	-46.3	173	-68.7	0	0	0	0	111.3	L153 L154 I159 R160 D161 I162 V164	L153-C157 PolarHBondContact O-N 3.09Å; L153-C157 PolarHBondContact O-SG 2.8Å; L154-C157 WeakPolarHBondContact O-CB 3.32Å; L154-C157 PolarHBondContact O-N 2.84Å; C157-I159 PolarHBondContact O-N 3.22Å; C157-R160 CarbonylContact O-C 3.6Å; C157-R160 PolarHBondContact O-N 2.82Å; C157-R160 VanDerWaalsContact O-N 3.14Å; C157-D161 PolarHBondContact O-N 2.76Å; C157-I162 HydrophobicContact CB-CB 4.24Å; C157-I162 PolarHBondContact O-N 3.02Å; C157-V164 HydrophobicContact CB-CB 4.36Å
158	H	94.2	Very high	94.4	Very high	1 Å²	1	7.9 Å²	7.9	1%	0.005	4%	0.043	C	C	.	.	H	α-helix	trans	-63.7	-39.7	179.2	-63.8	-42.4	0	0	0	112.9	L86 L154 I155 A156 R160 D161 Y316	L86-H158 HydrophobicContact CD2-CB 4.4Å; L154-H158 PolarHBondContact O-CD2 2.98Å; L154-H158 PolarHBondContact O-N 3.32Å; I155-H158 PolarHBondContact O-N 3.04Å; A156-H158 VanDerWaalsContact C-N 3.34Å; A156-H158 PolarHBondContact O-N 2.92Å; H158-R160 PolarHBondContact O-N 2.83Å; H158-D161 PolarHBondContact O-N 3.18Å; H158-D161 VanDerWaalsContact O-N 3.15Å; H158-Y316 AromaticContact NE2-CZ 3.98Å; H158-Y316 PolarHBondContact NE2-OH 2.9Å
159	I	93.1	Very high	94.4	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-63.6	-30.6	176	-70.3	164.7	0	0	0	111.6	W91 I121 I125 I155 A156 C157 I246 S247	W91-I159 HydrophobicContact CB-CD1 4.06Å; W91-I159 HydrophobicContact CB-CG1 4.28Å; W91-I159 HydrophobicContact CD2-CD1 4.12Å; W91-I159 HydrophobicContact CE3-CD1 3.59Å; W91-I159 HydrophobicContact CG-CD1 4.31Å; W91-I159 HydrophobicContact CZ3-CD1 4.44Å; I121-I159 HydrophobicContact CG2-CD1 3.61Å; I125-I159 HydrophobicContact CD1-CB 4.03Å; I125-I159 HydrophobicContact CD1-CD1 3.94Å; I125-I159 HydrophobicContact CD1-CG2 3.64Å; I155-I159 HydrophobicContact CG2-CD1 3.84Å; I155-I159 HydrophobicContact CG2-CG1 4.4Å; I155-I159 WeakPolarHBondContact O-CG1 3.48Å; I155-I159 PolarHBondContact O-N 3.19Å; A156-I159 PolarHBondContact O-N 3.09Å; C157-I159 PolarHBondContact O-N 3.22Å; I159-I246 HydrophobicContact CG2-CG1 4.49Å; I159-S247 PolarHBondContact O-N 2.83Å
160	R	90.5	Very high	94.2	Very high	42 Å²	42	11.9 Å²	11.9	16%	0.158	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	1.1	177.4	-74.3	-71	-174.6	-106.2	9.3	114.1	I125 D129 A156 C157 H158 I162 T245 S247	I125-R160 HydrophobicContact CG1-CG 4.47Å; I125-R160 HydrophobicContact CG2-CG 4.32Å; D129-R160 VanDerWaalsContact CG-NE 3.32Å; D129-R160 VanDerWaalsContact OD1-CD 3.29Å; D129-R160 WeakPolarHBondContact OD1-CD 3.32Å; D129-R160 IonicContact OD1-CZ 2.96Å; D129-R160 IonicContact OD1-NE 3.91Å; D129-R160 PolarHBondContact OD1-NE 2.78Å; D129-R160 IonicContact OD1-NH2 3.98Å; D129-R160 IonicContact OD2-CZ 3.7Å; D129-R160 IonicContact OD2-NE 3.14Å; D129-R160 PolarHBondContact OD2-NE 2.66Å; D129-R160 VanDerWaalsContact OD2-NE 3.09Å; D129-R160 IonicContact OD2-NH2 2.65Å; D129-R160 PolarHBondContact OD2-NH2 3Å; A156-R160 PolarHBondContact O-N 3.04Å; A156-R160 VanDerWaalsContact O-N 3.15Å; C157-R160 CarbonylContact O-C 3.6Å; C157-R160 PolarHBondContact O-N 2.82Å; C157-R160 VanDerWaalsContact O-N 3.14Å; H158-R160 PolarHBondContact O-N 2.83Å; R160-I162 HydrophobicContact CB-CD1 3.54Å; R160-I162 HydrophobicContact CB-CG1 3.77Å; R160-I162 HydrophobicContact CG-CD1 4.3Å; R160-I162 PolarHBondContact O-N 3.32Å; R160-T245 PolarHBondContact NH1-O 3.19Å; R160-S247 WeakPolarHBondContact O-CB 3.38Å; R160-S247 PolarHBondContact O-OG 3.39Å
161	D	89.8	Confident	94	Very high	3 Å²	3	14.2 Å²	14.2	2%	0.016	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	32.5	-171.8	-85.7	-27.3	0	0	0	112.1	C157 H158 P163 R249 N250 N277	C157-D161 PolarHBondContact O-N 2.76Å; H158-D161 PolarHBondContact O-N 3.18Å; H158-D161 VanDerWaalsContact O-N 3.15Å; D161-P163 WeakPolarHBondContact O-CD 3.48Å; D161-R249 HydrophobicContact CB-CB 4.24Å; D161-R249 PolarHBondContact OD2-N 3.18Å; D161-N250 PolarHBondContact O-ND2 3.29Å; D161-N250 PolarHBondContact OD2-N 2.89Å; D161-N277 PolarHBondContact OD1-ND2 2.99Å
162	I	92	Very high	93.7	Very high	22 Å²	22	14.1 Å²	14.1	11%	0.113	7%	0.072	C	C	.	.			trans	-81.9	119.9	175.4	-66.4	161.8	0	0	0	108.1	L128 L132 V140 C157 R160 V164	L128-I162 HydrophobicContact CB-CD1 3.89Å; L128-I162 HydrophobicContact CD1-CD1 4.06Å; L128-I162 HydrophobicContact CD2-CD1 4.36Å; L128-I162 HydrophobicContact CG-CD1 4.33Å; L132-I162 HydrophobicContact CD1-CD1 3.94Å; L132-I162 HydrophobicContact CD1-CG1 4.44Å; L132-I162 HydrophobicContact CD1-CG2 3.93Å; V140-I162 HydrophobicContact CB-CG2 4.38Å; V140-I162 HydrophobicContact CG2-CG2 3.64Å; C157-I162 HydrophobicContact CB-CB 4.24Å; C157-I162 PolarHBondContact O-N 3.02Å; R160-I162 HydrophobicContact CB-CD1 3.54Å; R160-I162 HydrophobicContact CB-CG1 3.77Å; R160-I162 HydrophobicContact CG-CD1 4.3Å; R160-I162 PolarHBondContact O-N 3.32Å; I162-V164 PolarHBondContact O-N 3.3Å
163	P	93	Very high	93.5	Very high	28 Å²	28	16 Å²	16	18%	0.182	9%	0.091	C	C	.	.			trans	-57.8	129.1	175.2	-23.1	33.9	0	0	0	110.7	T139 V140 D161	T139-P163 WeakPolarHBondContact CA-O 3.28Å; T139-P163 HydrophobicContact CG2-CB 4.46Å; V140-P163 PolarHBondContact N-O 3.19Å; D161-P163 WeakPolarHBondContact O-CD 3.48Å
164	V	95.8	Very high	93.2	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	130.9	178.1	65.8	0	0	0	0	111.1	V140 I142 L154 C157 I162 V258 L259 T260	V140-V164 HydrophobicContact CB-CG2 4.43Å; V140-V164 HydrophobicContact CG1-CG2 4.38Å; V140-V164 CarbonylContact O-C 3.53Å; V140-V164 WeakPolarHBondContact O-CA 3.26Å; I142-V164 HydrophobicContact CD1-CG2 3.72Å; I142-V164 HydrophobicContact CG1-CG2 3.98Å; L154-V164 HydrophobicContact CD2-CB 4.48Å; L154-V164 HydrophobicContact CD2-CG1 3.81Å; L154-V164 HydrophobicContact CD2-CG2 3.89Å; C157-V164 HydrophobicContact CB-CB 4.36Å; I162-V164 PolarHBondContact O-N 3.3Å; V164-V258 WeakPolarHBondContact CG1-O 3.42Å; V164-V258 PolarHBondContact N-O 2.87Å; V164-L259 HydrophobicContact CG1-CD1 3.77Å; V164-L259 CarbonylContact O-C 3.54Å; V164-L259 VanDerWaalsContact O-CA 3.29Å; V164-L259 WeakPolarHBondContact O-CA 3.48Å; V164-T260 PolarHBondContact O-N 3.42Å
165	A	96.4	Very high	92.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	129.1	169.4	0	0	0	0	0	109.2	T139 V140 L141 I142 I182 T260 W262	T139-A165 HydrophobicContact CG2-CB 3.75Å; V140-A165 PolarHBondContact O-N 3.33Å; L141-A165 CarbonylContact C-O 3.49Å; L141-A165 WeakPolarHBondContact CA-O 3.44Å; L141-A165 HydrophobicContact CD1-CB 3.97Å; I142-A165 PolarHBondContact N-O 3.08Å; A165-I182 HydrophobicContact CB-CD1 3.7Å; A165-T260 WeakPolarHBondContact CA-O 3.49Å; A165-W262 HydrophobicContact CB-CH2 3.71Å; A165-W262 HydrophobicContact CB-CZ3 3.85Å
166	I	96.9	Very high	92.7	Very high	1 Å²	1	22 Å²	22	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	134.6	173.5	-165.3	172.3	0	0	0	109.4	I142 V150 L154 L259 T260 V261	I142-I166 HydrophobicContact CB-CB 4.38Å; I142-I166 HydrophobicContact CB-CD1 4.31Å; I142-I166 HydrophobicContact CB-CG1 4.01Å; I142-I166 HydrophobicContact CG2-CD1 4.06Å; I142-I166 HydrophobicContact CG2-CG1 4.13Å; V150-I166 HydrophobicContact CG1-CD1 4.26Å; L154-I166 HydrophobicContact CD1-CD1 4.29Å; I166-L259 HydrophobicContact CG2-CD1 3.77Å; I166-T260 PolarHBondContact N-O 2.87Å; I166-V261 HydrophobicContact CG2-CG1 3.87Å
167	M	94.4	Very high	92.5	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	15%	0.148	C	C	.	.			trans	-145.9	163.9	-174.1	67.9	173.3	60.1	0	0	112.3	L141 L143 P169 A172 L175 L179 W262 Y306	L141-M167 HydrophobicContact CD1-CE 3.97Å; L141-M167 HydrophobicContact CD1-CG 4.41Å; L143-M167 HydrophobicContact CD2-CG 3.43Å; L143-M167 VanDerWaalsContact CD2-CG 3.43Å; L143-M167 HydrophobicContact CD2-SD 3.76Å; M167-P169 VanDerWaalsContact O-CD 3.26Å; M167-P169 WeakPolarHBondContact O-CD 3.22Å; M167-A172 HydrophobicContact SD-CB 4.23Å; M167-L175 HydrophobicContact CE-CB 4.27Å; M167-L175 HydrophobicContact CE-CD1 3.82Å; M167-L175 HydrophobicContact SD-CD1 3.95Å; M167-L179 HydrophobicContact CE-CD1 3.97Å; M167-L179 HydrophobicContact CE-CD2 3.57Å; M167-L179 HydrophobicContact CE-CG 3.97Å; M167-W262 HydrophobicContact CB-CD2 4.4Å; M167-W262 HydrophobicContact CB-CE3 3.58Å; M167-W262 HydrophobicContact CB-CZ3 3.96Å; M167-W262 HydrophobicContact CE-CD2 4Å; M167-W262 HydrophobicContact CE-CE3 3.66Å; M167-W262 HydrophobicContact CE-CH2 3.43Å; M167-W262 VanDerWaalsContact CE-CH2 3.43Å; M167-W262 HydrophobicContact CE-CZ2 3.8Å; M167-W262 HydrophobicContact CE-CZ3 3.37Å; M167-Y306 VanDerWaalsContact C-CB 3.48Å
168	N	92.5	Very high	92.4	Very high	30 Å²	30	28.8 Å²	28.8	16%	0.16	16%	0.158	C	C	.	.			trans	-61.9	120.3	162.5	-173.7	-40.6	0	0	0	108.9	N170 F171 Y306	N168-N170 PolarHBondContact O-N 3.19Å; N168-N170 VanDerWaalsContact OD1-CB 3.29Å; N168-N170 WeakPolarHBondContact OD1-CB 3.33Å; N168-N170 PolarHBondContact OD1-N 2.89Å; N168-N170 PolarHBondContact OD1-ND2 3.41Å; N168-F171 HydrophobicContact CB-CD2 3.88Å; N168-F171 HydrophobicContact CB-CE2 4.05Å; N168-F171 HydrophobicContact CB-CG 4.44Å; N168-F171 PolarHBondContact O-N 2.92Å; N168-Y306 HydrophobicContact CB-CD2 4.16Å; N168-Y306 HydrophobicContact CB-CE1 4.22Å; N168-Y306 HydrophobicContact CB-CE2 3.82Å; N168-Y306 PolarHBondContact ND2-OH 2.94Å; N168-Y306 VanDerWaalsContact ND2-OH 3.15Å
169	P	92.3	Very high	92.4	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.006	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-58	-23.7	-177	-28.4	38.5	0	0	0	114.4	M167 F171 A172 H193	M167-P169 VanDerWaalsContact O-CD 3.26Å; M167-P169 WeakPolarHBondContact O-CD 3.22Å; P169-F171 PolarHBondContact O-N 3.11Å; P169-A172 WeakPolarHBondContact O-CB 3.31Å; P169-A172 PolarHBondContact O-N 3.25Å; P169-H193 HydrophobicContact CB-CB 4.34Å; P169-H193 VanDerWaalsContact CG-CD2 3.49Å; P169-H193 WeakPolarHBondContact CG-CD2 3.36Å; P169-H193 WeakPolarHBondContact CG-NE2 3.49Å
170	N	90.2	Very high	92.4	Very high	118 Å²	118	33 Å²	33	63%	0.631	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-67.9	-19.5	176.7	-65.5	-35.2	0	0	0	113.4	N168	N168-N170 PolarHBondContact O-N 3.19Å; N168-N170 VanDerWaalsContact OD1-CB 3.29Å; N168-N170 WeakPolarHBondContact OD1-CB 3.33Å; N168-N170 PolarHBondContact OD1-N 2.89Å; N168-N170 PolarHBondContact OD1-ND2 3.41Å
171	F	90.5	Very high	92.4	Very high	49 Å²	49	37.2 Å²	37.2	22%	0.215	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-90.3	-7.7	177.7	-60.1	-27.8	0	0	0	113.8	N168 P169 G173 M174 L175 M264	N168-F171 HydrophobicContact CB-CD2 3.88Å; N168-F171 HydrophobicContact CB-CE2 4.05Å; N168-F171 HydrophobicContact CB-CG 4.44Å; N168-F171 PolarHBondContact O-N 2.92Å; P169-F171 PolarHBondContact O-N 3.11Å; F171-G173 PolarHBondContact O-N 2.87Å; F171-M174 HydrophobicContact CB-CE 4.21Å; F171-M174 HydrophobicContact CD1-CE 3.68Å; F171-M174 HydrophobicContact CE1-CE 4.34Å; F171-M174 HydrophobicContact CG-CE 4.07Å; F171-M174 PolarHBondContact O-N 3.09Å; F171-L175 HydrophobicContact CB-CD1 3.62Å; F171-L175 HydrophobicContact CB-CG 4.14Å; F171-L175 WeakPolarHBondContact O-CG 3.38Å; F171-L175 PolarHBondContact O-N 2.74Å; F171-L175 VanDerWaalsContact O-N 3.13Å; F171-M264 HydrophobicContact CD1-CE 4.09Å; F171-M264 HydrophobicContact CD2-CE 4.47Å; F171-M264 HydrophobicContact CE1-CE 3.32Å; F171-M264 HydrophobicContact CE2-CE 3.78Å; F171-M264 HydrophobicContact CZ-CE 3.15Å
172	A	91.1	Very high	92.5	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-37.7	-175.3	0	0	0	0	0	113.6	L143 M167 P169 L175 K196 M199 L200	L143-A172 HydrophobicContact CD1-CB 4.39Å; L143-A172 HydrophobicContact CD2-CB 4.43Å; M167-A172 HydrophobicContact SD-CB 4.23Å; P169-A172 WeakPolarHBondContact O-CB 3.31Å; P169-A172 PolarHBondContact O-N 3.25Å; A172-L175 PolarHBondContact O-N 3.05Å; A172-K196 HydrophobicContact CB-CB 4.15Å; A172-M199 HydrophobicContact CB-CE 4.01Å; A172-L200 HydrophobicContact CB-CD1 4.38Å
173	G	89.9	Confident	92.5	Very high	40 Å²	40	40.6 Å²	40.6	41%	0.412	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-24.1	-178.7	0	0	0	0	0	114.8	F171 V176 M199	F171-G173 PolarHBondContact O-N 2.87Å; G173-V176 WeakPolarHBondContact O-CG2 3.48Å; G173-M199 WeakPolarHBondContact CA-SD 3.2Å; G173-M199 VanDerWaalsContact N-CE 3.26Å
174	M	90.2	Very high	92.6	Very high	104 Å²	104	39.5 Å²	39.5	51%	0.512	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-21.6	176.6	175.1	173.3	44.1	0	0	111.8	F171 M264 P270	F171-M174 HydrophobicContact CB-CE 4.21Å; F171-M174 HydrophobicContact CD1-CE 3.68Å; F171-M174 HydrophobicContact CE1-CE 4.34Å; F171-M174 HydrophobicContact CG-CE 4.07Å; F171-M174 PolarHBondContact O-N 3.09Å; M174-M264 HydrophobicContact CE-CE 4.25Å; M174-P270 HydrophobicContact CE-CG 3.15Å; M174-P270 HydrophobicContact CG-CG 4.33Å; M174-P270 WeakPolarHBondContact SD-CD 3.24Å; M174-P270 HydrophobicContact SD-CG 3.67Å
175	L	91.3	Very high	92.2	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	21%	0.214	C	C	.	.			trans	-104.4	18.3	-172	-61.3	177.8	0	0	0	113.4	M167 F171 A172 D177 D178 L179 W262 P270	M167-L175 HydrophobicContact CE-CB 4.27Å; M167-L175 HydrophobicContact CE-CD1 3.82Å; M167-L175 HydrophobicContact SD-CD1 3.95Å; F171-L175 HydrophobicContact CB-CD1 3.62Å; F171-L175 HydrophobicContact CB-CG 4.14Å; F171-L175 WeakPolarHBondContact O-CG 3.38Å; F171-L175 PolarHBondContact O-N 2.74Å; F171-L175 VanDerWaalsContact O-N 3.13Å; A172-L175 PolarHBondContact O-N 3.05Å; L175-D177 VanDerWaalsContact C-N 3.27Å; L175-D177 PolarHBondContact O-N 2.84Å; L175-D178 HydrophobicContact CB-CB 4.5Å; L175-D178 PolarHBondContact O-N 3.06Å; L175-L179 WeakPolarHBondContact O-CB 3.33Å; L175-L179 VanDerWaalsContact O-CG 3.22Å; L175-L179 WeakPolarHBondContact O-CG 3.48Å; L175-L179 PolarHBondContact O-N 2.84Å; L175-W262 HydrophobicContact CD1-CB 4.05Å; L175-W262 HydrophobicContact CD1-CD2 3.83Å; L175-W262 HydrophobicContact CD1-CG 3.53Å; L175-W262 HydrophobicContact CD2-CG 4.43Å; L175-P270 HydrophobicContact CD2-CB 3.73Å; L175-P270 HydrophobicContact CD2-CG 3.84Å
176	V	93.4	Very high	92.1	Very high	19 Å²	19	39.7 Å²	39.7	12%	0.115	21%	0.214	C	C	.	.	H	α-helix	trans	-59.5	-40.1	-175.6	-178.6	0	0	0	0	111.7	G173 L179 K180 L200 S203 I204	G173-V176 WeakPolarHBondContact O-CG2 3.48Å; V176-L179 PolarHBondContact O-N 3.08Å; V176-K180 WeakPolarHBondContact O-CG 3.08Å; V176-K180 PolarHBondContact O-N 3.15Å; V176-L200 HydrophobicContact CG2-CD2 3.94Å; V176-S203 VanDerWaalsContact CG1-CB 3.48Å; V176-I204 HydrophobicContact CG1-CD1 4.32Å; V176-I204 HydrophobicContact CG1-CG1 4.25Å
177	D	91.2	Very high	92.1	Very high	101 Å²	101	39.7 Å²	39.7	54%	0.54	21%	0.214	S	C	.	.	H	α-helix	trans	-73.2	-43.7	-179.1	-65.7	-33.3	0	0	0	111.5	L175 L179 K180 D181	L175-D177 VanDerWaalsContact C-N 3.27Å; L175-D177 PolarHBondContact O-N 2.84Å; D177-L179 PolarHBondContact O-N 3.32Å; D177-K180 WeakPolarHBondContact O-CB 3.44Å; D177-K180 PolarHBondContact O-N 2.49Å; D177-K180 IonicContact OD1-NZ 2.74Å; D177-K180 PolarHBondContact OD1-NZ 3.42Å; D177-D181 PolarHBondContact O-N 3.27Å
178	D	91.6	Very high	92.1	Very high	40 Å²	40	39.6 Å²	39.6	21%	0.214	21%	0.214	C	C	.	.	H	α-helix	trans	-52.8	-42	170.1	-69	16.8	0	0	0	111.8	L175 K180 D181 I182 W262 M272	L175-D178 HydrophobicContact CB-CB 4.5Å; L175-D178 PolarHBondContact O-N 3.06Å; D178-K180 VanDerWaalsContact C-N 3.32Å; D178-K180 PolarHBondContact O-N 2.76Å; D178-D181 PolarHBondContact O-N 3.28Å; D178-I182 PolarHBondContact O-N 3.02Å; D178-I182 VanDerWaalsContact O-N 3.09Å; D178-W262 HydrophobicContact CB-CZ2 4.2Å; D178-W262 PolarHBondContact OD2-NE1 3.31Å; D178-M272 HydrophobicContact CB-SD 4.25Å
179	L	94.3	Very high	92.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-68.3	-29.5	179.7	-70.5	172.6	0	0	0	113.3	L141 M167 L175 V176 D177 I182 V184 L200 I204 W262	L141-L179 HydrophobicContact CD1-CD2 3.79Å; L141-L179 HydrophobicContact CD2-CD1 3.99Å; L141-L179 HydrophobicContact CD2-CD2 4.01Å; L141-L179 HydrophobicContact CG-CD2 4.42Å; M167-L179 HydrophobicContact CE-CD1 3.97Å; M167-L179 HydrophobicContact CE-CD2 3.57Å; M167-L179 HydrophobicContact CE-CG 3.97Å; L175-L179 WeakPolarHBondContact O-CB 3.33Å; L175-L179 VanDerWaalsContact O-CG 3.22Å; L175-L179 WeakPolarHBondContact O-CG 3.48Å; L175-L179 PolarHBondContact O-N 2.84Å; V176-L179 PolarHBondContact O-N 3.08Å; D177-L179 PolarHBondContact O-N 3.32Å; L179-I182 HydrophobicContact CD2-CD1 4.16Å; L179-V184 HydrophobicContact CD2-CG2 3.83Å; L179-V184 WeakPolarHBondContact O-CB 3.33Å; L179-V184 PolarHBondContact O-N 3.04Å; L179-V184 VanDerWaalsContact O-N 3.13Å; L179-L200 HydrophobicContact CD1-CD1 4.14Å; L179-L200 HydrophobicContact CD1-CD2 3.71Å; L179-I204 HydrophobicContact CB-CD1 3.48Å; L179-I204 VanDerWaalsContact CB-CD1 3.48Å; L179-I204 HydrophobicContact CD1-CD1 4.21Å; L179-W262 HydrophobicContact CD2-CH2 3.86Å; L179-W262 HydrophobicContact CD2-CZ2 4.18Å
180	K	92.9	Very high	92.2	Very high	89 Å²	89	38.1 Å²	38.1	39%	0.387	21%	0.206	S	C	.	.	H	α-helix	trans	-70.6	-43.6	170	-67.2	169.9	-168.9	152.9	0	110.6	V176 D177 D178 I182 N183 S203 I204	V176-K180 WeakPolarHBondContact O-CG 3.08Å; V176-K180 PolarHBondContact O-N 3.15Å; D177-K180 WeakPolarHBondContact O-CB 3.44Å; D177-K180 PolarHBondContact O-N 2.49Å; D177-K180 IonicContact OD1-NZ 2.74Å; D177-K180 PolarHBondContact OD1-NZ 3.42Å; D178-K180 VanDerWaalsContact C-N 3.32Å; D178-K180 PolarHBondContact O-N 2.76Å; K180-I182 VanDerWaalsContact C-N 3.25Å; K180-I182 PolarHBondContact O-N 2.78Å; K180-N183 PolarHBondContact O-N 3.12Å; K180-S203 WeakPolarHBondContact CE-O 3.38Å; K180-I204 HydrophobicContact CG-CG1 3.93Å
181	D	90.5	Very high	92.2	Very high	132 Å²	132	35.1 Å²	35.1	71%	0.706	19%	0.192	S	C	*	.	H	α-helix	trans	-62	-34.6	-176.7	-73.4	-9.6	0	0	0	112	D177 D178 N183	D177-D181 PolarHBondContact O-N 3.27Å; D178-D181 PolarHBondContact O-N 3.28Å; D181-N183 VanDerWaalsContact C-N 3.31Å
182	I	91.5	Very high	92.2	Very high	20 Å²	20	36.9 Å²	36.9	10%	0.103	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	11.2	175.6	72.8	179.7	0	0	0	113.6	T139 A165 D178 L179 K180 V184 T260 W262 M272	T139-I182 WeakPolarHBondContact CB-O 3.31Å; T139-I182 HydrophobicContact CG2-CD1 4.07Å; T139-I182 HydrophobicContact CG2-CG1 4.33Å; T139-I182 PolarHBondContact OG1-O 3.25Å; A165-I182 HydrophobicContact CB-CD1 3.7Å; D178-I182 PolarHBondContact O-N 3.02Å; D178-I182 VanDerWaalsContact O-N 3.09Å; L179-I182 HydrophobicContact CD2-CD1 4.16Å; K180-I182 VanDerWaalsContact C-N 3.25Å; K180-I182 PolarHBondContact O-N 2.78Å; I182-V184 HydrophobicContact CD1-CG2 4Å; I182-V184 HydrophobicContact CG1-CG2 3.85Å; I182-V184 PolarHBondContact O-N 2.79Å; I182-T260 HydrophobicContact CD1-CG2 4.24Å; I182-W262 HydrophobicContact CD1-CH2 3.73Å; I182-W262 HydrophobicContact CD1-CZ2 4.06Å; I182-M272 HydrophobicContact CG2-CE 4.17Å; I182-M272 HydrophobicContact CG2-SD 3.56Å; I182-M272 VanDerWaalsContact CG2-SD 3.56Å
183	N	92.5	Very high	92.3	Very high	75 Å²	75	37.9 Å²	37.9	40%	0.401	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	49.6	175.7	-168	31.3	0	0	0	114.2	D137 T139 K180 D181 S185	D137-N183 PolarHBondContact O-ND2 3.03Å; T139-N183 PolarHBondContact N-O 3.2Å; K180-N183 PolarHBondContact O-N 3.12Å; D181-N183 VanDerWaalsContact C-N 3.31Å; N183-S185 PolarHBondContact O-N 2.91Å
184	V	94.2	Very high	92.3	Very high	5 Å²	5	38 Å²	38	3%	0.03	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	129.6	172.5	167.5	0	0	0	0	110.7	T139 L141 L179 I182 I204 L206	T139-V184 HydrophobicContact CG2-CG2 3.97Å; T139-V184 WeakPolarHBondContact O-CA 3.41Å; L141-V184 HydrophobicContact CB-CG1 3.59Å; L141-V184 HydrophobicContact CB-CG2 4.03Å; L141-V184 HydrophobicContact CD2-CG1 4.19Å; L179-V184 HydrophobicContact CD2-CG2 3.83Å; L179-V184 WeakPolarHBondContact O-CB 3.33Å; L179-V184 PolarHBondContact O-N 3.04Å; L179-V184 VanDerWaalsContact O-N 3.13Å; I182-V184 HydrophobicContact CD1-CG2 4Å; I182-V184 HydrophobicContact CG1-CG2 3.85Å; I182-V184 PolarHBondContact O-N 2.79Å; V184-I204 VanDerWaalsContact O-CG2 3.29Å; V184-I204 WeakPolarHBondContact O-CG2 3.36Å; V184-L206 HydrophobicContact CG1-CD2 3.72Å
185	S	89.3	Confident	92.4	Very high	5 Å²	5	37 Å²	37	4%	0.035	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	-19.3	-179.5	60.2	0	0	0	0	114.2	K138 T139 N183 L206 Q207 H208	K138-S185 VanDerWaalsContact CB-OG 3.3Å; K138-S185 WeakPolarHBondContact CB-OG 3.17Å; K138-S185 WeakPolarHBondContact CD-OG 3.43Å; K138-S185 WeakPolarHBondContact CG-OG 3.46Å; T139-S185 PolarHBondContact O-N 2.92Å; N183-S185 PolarHBondContact O-N 2.91Å; S185-L206 CarbonylContact O-C 3.58Å; S185-L206 WeakPolarHBondContact O-CA 3.45Å; S185-Q207 PolarHBondContact O-N 3.09Å; S185-H208 PolarHBondContact O-N 3.2Å
186	C	94.3	Very high	92.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.2	175	-179.3	0	0	0	0	108.5	L132 V140 L141 F188 H208	L132-C186 HydrophobicContact CD2-CB 4.03Å; V140-C186 HydrophobicContact CG2-CB 4.42Å; L141-C186 PolarHBondContact N-O 2.85Å; C186-F188 VanDerWaalsContact SG-CE2 3.51Å; C186-H208 WeakPolarHBondContact CA-O 3.49Å; C186-H208 HydrophobicContact CB-CB 4.22Å
187	V	95.6	Very high	92.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.7	176.2	66.4	0	0	0	0	111	L141 L143 A189 I197 L206 H208 C209 I210	L141-V187 HydrophobicContact CB-CB 4.38Å; L141-V187 HydrophobicContact CB-CG2 4.15Å; L141-V187 HydrophobicContact CD2-CG2 3.93Å; L141-V187 HydrophobicContact CG-CG2 4.02Å; L141-V187 CarbonylContact O-C 3.39Å; L141-V187 WeakPolarHBondContact O-CA 3.26Å; L143-V187 HydrophobicContact CD1-CG2 4.18Å; L143-V187 HydrophobicContact CG-CG2 4.24Å; V187-A189 HydrophobicContact CG2-CB 4.39Å; V187-I197 HydrophobicContact CG1-CG2 4.05Å; V187-L206 HydrophobicContact CB-CD2 4.48Å; V187-L206 HydrophobicContact CG1-CD1 3.91Å; V187-H208 PolarHBondContact N-O 2.86Å; V187-C209 HydrophobicContact CG1-CB 3.86Å; V187-C209 VanDerWaalsContact CG1-SG 3.6Å; V187-C209 WeakPolarHBondContact O-CA 3.23Å; V187-I210 PolarHBondContact O-N 3.34Å
188	F	95.7	Very high	92.4	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	124.4	165.2	-64.2	-101	0	0	0	108.1	L127 L128 L131 V140 L141 I142 L143 L153 C186 I210 I212 L226	L127-F188 HydrophobicContact CD2-CE1 4.29Å; L128-F188 HydrophobicContact CD2-CE2 4.25Å; L128-F188 HydrophobicContact CD2-CZ 4.16Å; L131-F188 HydrophobicContact CD1-CZ 4.02Å; V140-F188 HydrophobicContact CG1-CD2 3.56Å; V140-F188 HydrophobicContact CG1-CE2 3.68Å; L141-F188 PolarHBondContact O-N 3.12Å; I142-F188 CarbonylContact C-O 3.53Å; I142-F188 WeakPolarHBondContact CA-O 3.45Å; L143-F188 PolarHBondContact N-O 3.1Å; L153-F188 HydrophobicContact CD1-CE1 4.07Å; L153-F188 HydrophobicContact CD1-CE2 4.26Å; L153-F188 HydrophobicContact CD1-CZ 3.93Å; L153-F188 HydrophobicContact CD2-CB 3.84Å; L153-F188 HydrophobicContact CD2-CD1 3.59Å; L153-F188 HydrophobicContact CD2-CD2 3.76Å; L153-F188 HydrophobicContact CD2-CE1 4Å; L153-F188 HydrophobicContact CD2-CE2 4.16Å; L153-F188 HydrophobicContact CD2-CG 3.46Å; L153-F188 VanDerWaalsContact CD2-CG 3.46Å; L153-F188 HydrophobicContact CD2-CZ 4.27Å; C186-F188 VanDerWaalsContact SG-CE2 3.51Å; F188-I210 CarbonylContact C-O 2.86Å; F188-I210 VanDerWaalsContact CA-O 3.28Å; F188-I210 WeakPolarHBondContact CA-O 3.26Å; F188-I210 HydrophobicContact CD1-CB 3.74Å; F188-I210 HydrophobicContact CD1-CD1 4.11Å; F188-I210 HydrophobicContact CD1-CG2 3.69Å; F188-I210 HydrophobicContact CE1-CB 3.95Å; F188-I210 HydrophobicContact CE1-CD1 3.46Å; F188-I210 VanDerWaalsContact CE1-CD1 3.46Å; F188-I210 HydrophobicContact CE1-CG1 4.3Å; F188-I210 HydrophobicContact CE1-CG2 3.82Å; F188-I210 HydrophobicContact CE2-CD1 4.28Å; F188-I210 HydrophobicContact CG-CB 4.36Å; F188-I210 HydrophobicContact CZ-CD1 3.56Å; F188-I212 HydrophobicContact CB-CD1 3.97Å; F188-I212 HydrophobicContact CB-CG1 4.05Å; F188-L226 HydrophobicContact CD1-CD1 4.25Å; F188-L226 HydrophobicContact CE1-CD1 3.96Å
189	A	95	Very high	92.5	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	144.4	-174.4	0	0	0	0	0	112.4	L143 V187 I197 I210 L211 I212	L143-A189 HydrophobicContact CB-CB 4.01Å; L143-A189 CarbonylContact O-C 3.53Å; L143-A189 WeakPolarHBondContact O-CA 3.31Å; V187-A189 HydrophobicContact CG2-CB 4.39Å; A189-I197 HydrophobicContact CB-CD1 3.3Å; A189-I197 HydrophobicContact CB-CG1 3.74Å; A189-I210 PolarHBondContact N-O 2.72Å; A189-L211 CarbonylContact O-C 3.22Å; A189-L211 VanDerWaalsContact O-CA 3.3Å; A189-L211 WeakPolarHBondContact O-CA 3.1Å; A189-I212 PolarHBondContact O-N 3.24Å
190	S	92	Very high	92.5	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.			trans	-65.9	147	168.8	-58.1	0	0	0	0	110.7	L143 S144 R147 E192 H193	L143-S190 PolarHBondContact O-N 2.83Å; S144-S190 WeakPolarHBondContact CA-OG 3.34Å; S144-S190 WeakPolarHBondContact CB-OG 3.38Å; S144-S190 PolarHBondContact OG-OG 3.49Å; R147-S190 WeakPolarHBondContact CD-OG 3.38Å; R147-S190 PolarHBondContact NE-OG 2.84Å; S190-E192 WeakPolarHBondContact CB-OE1 3.34Å; S190-E192 VanDerWaalsContact CB-OE2 3.26Å; S190-E192 WeakPolarHBondContact CB-OE2 3.08Å; S190-E192 PolarHBondContact O-N 3Å; S190-E192 VanDerWaalsContact O-N 3.12Å; S190-H193 PolarHBondContact O-N 2.83Å
191	P	89.3	Confident	92.4	Very high	54 Å²	54	37.6 Å²	37.6	35%	0.351	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-53.5	-33.7	-179.4	-28.7	35.7	0	0	0	114.7	H193 L194 I212 D213	P191-H193 PolarHBondContact O-N 2.8Å; P191-H193 VanDerWaalsContact O-N 3.17Å; P191-L194 WeakPolarHBondContact O-CB 3.36Å; P191-L194 PolarHBondContact O-N 2.97Å; P191-I212 WeakPolarHBondContact CD-O 3.49Å; P191-D213 HydrophobicContact CG-CB 4.34Å
192	E	90.5	Very high	92.6	Very high	87 Å²	87	39.8 Å²	39.8	41%	0.407	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-66.9	-8.4	177	61.7	-93.6	-149.5	0	0	114.8	N145 R147 S190	N145-E192 PolarHBondContact ND2-OE1 2.92Å; R147-E192 IonicContact CZ-OE1 3.43Å; R147-E192 IonicContact CZ-OE2 3.57Å; R147-E192 IonicContact NE-OE1 3.1Å; R147-E192 IonicContact NH2-OE1 2.7Å; R147-E192 PolarHBondContact NH2-OE1 3.11Å; R147-E192 VanDerWaalsContact NH2-OE1 3.12Å; R147-E192 IonicContact NH2-OE2 3.03Å; R147-E192 PolarHBondContact NH2-OE2 2.89Å; S190-E192 WeakPolarHBondContact CB-OE1 3.34Å; S190-E192 VanDerWaalsContact CB-OE2 3.26Å; S190-E192 WeakPolarHBondContact CB-OE2 3.08Å; S190-E192 PolarHBondContact O-N 3Å; S190-E192 VanDerWaalsContact O-N 3.12Å
193	H	92.7	Very high	92.6	Very high	20 Å²	20	41.9 Å²	41.9	9%	0.093	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-113.9	17.1	179.4	-58	-42.7	0	0	0	112.9	N145 P169 S190 P191 D195 K196 I197	N145-H193 PolarHBondContact ND2-NE2 2.91Å; P169-H193 HydrophobicContact CB-CB 4.34Å; P169-H193 VanDerWaalsContact CG-CD2 3.49Å; P169-H193 WeakPolarHBondContact CG-CD2 3.36Å; P169-H193 WeakPolarHBondContact CG-NE2 3.49Å; S190-H193 PolarHBondContact O-N 2.83Å; P191-H193 PolarHBondContact O-N 2.8Å; P191-H193 VanDerWaalsContact O-N 3.17Å; H193-D195 VanDerWaalsContact C-N 3.25Å; H193-D195 PolarHBondContact O-N 3.39Å; H193-K196 HydrophobicContact CB-CG 4.36Å; H193-K196 WeakPolarHBondContact O-CB 3.4Å; H193-K196 PolarHBondContact O-N 3.28Å; H193-I197 PolarHBondContact O-N 2.78Å
194	L	89.7	Confident	92.7	Very high	42 Å²	42	38.9 Å²	38.9	22%	0.22	19%	0.192	C	C	.	.	H	α-helix	trans	-59.6	-35.3	179.6	-174.3	143.9	0	0	0	112.7	P191 K196 I197 E198 L211 L220 Y223	P191-L194 WeakPolarHBondContact O-CB 3.36Å; P191-L194 PolarHBondContact O-N 2.97Å; L194-K196 PolarHBondContact O-N 2.99Å; L194-I197 WeakPolarHBondContact O-CB 3.38Å; L194-I197 PolarHBondContact O-N 2.88Å; L194-I197 VanDerWaalsContact O-N 3.15Å; L194-E198 HydrophobicContact CD2-CG 4.2Å; L194-E198 PolarHBondContact O-N 2.58Å; L194-L211 HydrophobicContact CD1-CD1 4.22Å; L194-L211 HydrophobicContact CD1-CD2 4.31Å; L194-L220 HydrophobicContact CD1-CD1 3.33Å; L194-Y223 HydrophobicContact CD1-CD2 4.35Å; L194-Y223 HydrophobicContact CD1-CE1 4.11Å; L194-Y223 HydrophobicContact CD1-CE2 3.84Å; L194-Y223 WeakPolarHBondContact CD2-OH 3.31Å; L194-Y223 HydrophobicContact CG-CE1 4.14Å; L194-Y223 HydrophobicContact CG-CE2 4.35Å; L194-Y223 WeakPolarHBondContact CG-OH 3.33Å
195	D	92.2	Very high	92.5	Very high	84 Å²	84	44.9 Å²	44.9	45%	0.449	22%	0.224	S	C	.	.	H	α-helix	trans	-58.1	-36.7	173.8	70.4	-48.3	0	0	0	112.1	H193 M199	H193-D195 VanDerWaalsContact C-N 3.25Å; H193-D195 PolarHBondContact O-N 3.39Å; D195-M199 PolarHBondContact O-N 2.86Å; D195-M199 VanDerWaalsContact O-N 3.08Å
196	K	93.8	Very high	92.6	Very high	52 Å²	52	45.5 Å²	45.5	23%	0.226	23%	0.227	C	C	.	.	H	α-helix	trans	-69.2	-40.5	176.7	-52.3	-51.6	-179.9	-143.2	0	111.5	L143 A172 H193 L194 E198 M199 L200	L143-K196 HydrophobicContact CD1-CB 4.4Å; A172-K196 HydrophobicContact CB-CB 4.15Å; H193-K196 HydrophobicContact CB-CG 4.36Å; H193-K196 WeakPolarHBondContact O-CB 3.4Å; H193-K196 PolarHBondContact O-N 3.28Å; L194-K196 PolarHBondContact O-N 2.99Å; K196-E198 VanDerWaalsContact C-N 3.34Å; K196-E198 PolarHBondContact O-N 3.33Å; K196-M199 HydrophobicContact CB-CE 4.43Å; K196-M199 HydrophobicContact CD-CE 4.41Å; K196-M199 PolarHBondContact O-N 3.27Å; K196-L200 VanDerWaalsContact O-CG 3.31Å; K196-L200 WeakPolarHBondContact O-CG 3.5Å; K196-L200 PolarHBondContact O-N 2.8Å
197	I	91.5	Very high	92.5	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61	-46.7	175.9	-55.1	168.5	0	0	0	110.2	V187 A189 H193 L194 M199 L200 R201 L206 C209 L211 Y223	V187-I197 HydrophobicContact CG1-CG2 4.05Å; A189-I197 HydrophobicContact CB-CD1 3.3Å; A189-I197 HydrophobicContact CB-CG1 3.74Å; H193-I197 PolarHBondContact O-N 2.78Å; L194-I197 WeakPolarHBondContact O-CB 3.38Å; L194-I197 PolarHBondContact O-N 2.88Å; L194-I197 VanDerWaalsContact O-N 3.15Å; I197-M199 VanDerWaalsContact C-N 3.29Å; I197-M199 PolarHBondContact O-N 2.86Å; I197-L200 PolarHBondContact O-N 2.8Å; I197-L200 VanDerWaalsContact O-N 3.08Å; I197-R201 HydrophobicContact CG2-CG 4.34Å; I197-R201 WeakPolarHBondContact O-CG 3.41Å; I197-R201 PolarHBondContact O-N 3.34Å; I197-L206 HydrophobicContact CG2-CD1 4.33Å; I197-C209 HydrophobicContact CG2-CB 4.17Å; I197-L211 HydrophobicContact CD1-CD2 3.95Å; I197-Y223 HydrophobicContact CD1-CE1 4.26Å; I197-Y223 HydrophobicContact CG2-CE1 4.16Å
198	E	91.7	Very high	92.3	Very high	73 Å²	73	52.1 Å²	52.1	34%	0.341	26%	0.258	S	S	.	.	H	α-helix	trans	-63.2	-35.8	179.8	-73.5	-54.1	116.2	0	0	112.8	L194 K196 R201 Y223	L194-E198 HydrophobicContact CD2-CG 4.2Å; L194-E198 PolarHBondContact O-N 2.58Å; K196-E198 VanDerWaalsContact C-N 3.34Å; K196-E198 PolarHBondContact O-N 3.33Å; E198-R201 WeakPolarHBondContact OE1-CD 3.49Å; E198-R201 IonicContact OE1-CZ 3.7Å; E198-R201 IonicContact OE1-NE 2.67Å; E198-R201 IonicContact OE1-NH1 3.51Å; E198-R201 PolarHBondContact OE1-NH1 3.23Å; E198-Y223 WeakPolarHBondContact CG-OH 3.37Å; E198-Y223 VanDerWaalsContact OE1-CZ 3.29Å; E198-Y223 PolarHBondContact OE1-OH 3.26Å
199	M	93.6	Very high	92.2	Very high	61 Å²	61	52.4 Å²	52.4	30%	0.3	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-46.4	170.5	170.7	-160.9	71.3	0	0	111.4	A172 G173 D195 K196 I197 R201 K202	A172-M199 HydrophobicContact CB-CE 4.01Å; G173-M199 WeakPolarHBondContact CA-SD 3.2Å; G173-M199 VanDerWaalsContact N-CE 3.26Å; D195-M199 PolarHBondContact O-N 2.86Å; D195-M199 VanDerWaalsContact O-N 3.08Å; K196-M199 HydrophobicContact CB-CE 4.43Å; K196-M199 HydrophobicContact CD-CE 4.41Å; K196-M199 PolarHBondContact O-N 3.27Å; I197-M199 VanDerWaalsContact C-N 3.29Å; I197-M199 PolarHBondContact O-N 2.86Å; M199-R201 PolarHBondContact O-N 3.05Å; M199-K202 WeakPolarHBondContact O-CB 3.49Å; M199-K202 PolarHBondContact O-N 2.99Å
200	L	94	Very high	92.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.7	-39.5	179.8	-69.7	175.1	0	0	0	112.6	L141 L143 A172 V176 L179 K196 I197 K202 S203 I204 L206	L141-L200 HydrophobicContact CD2-CD1 3.86Å; L143-L200 HydrophobicContact CD1-CD1 3.8Å; A172-L200 HydrophobicContact CB-CD1 4.38Å; V176-L200 HydrophobicContact CG2-CD2 3.94Å; L179-L200 HydrophobicContact CD1-CD1 4.14Å; L179-L200 HydrophobicContact CD1-CD2 3.71Å; K196-L200 VanDerWaalsContact O-CG 3.31Å; K196-L200 WeakPolarHBondContact O-CG 3.5Å; K196-L200 PolarHBondContact O-N 2.8Å; I197-L200 PolarHBondContact O-N 2.8Å; I197-L200 VanDerWaalsContact O-N 3.08Å; L200-K202 PolarHBondContact O-N 3.34Å; L200-K202 VanDerWaalsContact O-N 3.09Å; L200-S203 PolarHBondContact O-N 2.79Å; L200-I204 HydrophobicContact CD2-CD1 3.96Å; L200-I204 PolarHBondContact O-N 3.44Å; L200-L206 HydrophobicContact CB-CD1 4.12Å
201	R	91.9	Very high	92.1	Very high	79 Å²	79	52.8 Å²	52.8	30%	0.298	26%	0.261	S	S	.	.	H	α-helix	trans	-56.5	-25	177.7	-79.2	179.1	165.8	176.8	-11.4	114	I197 E198 M199 S203 L206 C209 G222	I197-R201 HydrophobicContact CG2-CG 4.34Å; I197-R201 WeakPolarHBondContact O-CG 3.41Å; I197-R201 PolarHBondContact O-N 3.34Å; E198-R201 WeakPolarHBondContact OE1-CD 3.49Å; E198-R201 IonicContact OE1-CZ 3.7Å; E198-R201 IonicContact OE1-NE 2.67Å; E198-R201 IonicContact OE1-NH1 3.51Å; E198-R201 PolarHBondContact OE1-NH1 3.23Å; M199-R201 PolarHBondContact O-N 3.05Å; R201-S203 PolarHBondContact O-N 3.43Å; R201-L206 HydrophobicContact CG-CB 4.4Å; R201-L206 HydrophobicContact CG-CD1 3.89Å; R201-C209 VanDerWaalsContact CZ-SG 3.53Å; R201-C209 PolarHBondContact NE-SG 2.91Å; R201-C209 PolarHBondContact NH2-SG 3.44Å; R201-G222 PolarHBondContact NH2-O 3.38Å
202	K	92.9	Very high	92.3	Very high	178 Å²	178	50.2 Å²	50.2	77%	0.774	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-18.3	176.7	-64.1	175.5	-175.9	178.8	0	113.2	M199 L200	M199-K202 WeakPolarHBondContact O-CB 3.49Å; M199-K202 PolarHBondContact O-N 2.99Å; L200-K202 PolarHBondContact O-N 3.34Å; L200-K202 VanDerWaalsContact O-N 3.09Å
203	S	93.2	Very high	91.9	Very high	64 Å²	64	47 Å²	47	45%	0.448	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130	-18.2	-172.1	-61.6	0	0	0	0	113.8	V176 K180 L200 R201	V176-S203 VanDerWaalsContact CG1-CB 3.48Å; K180-S203 WeakPolarHBondContact CE-O 3.38Å; L200-S203 PolarHBondContact O-N 2.79Å; R201-S203 PolarHBondContact O-N 3.43Å
204	I	93.6	Very high	90.8	Very high	12 Å²	12	50.7 Å²	50.7	6%	0.062	25%	0.248	C	C	.	.	S	Bend	trans	-124.4	133.1	-178.3	-54.6	178	0	0	0	108.3	V176 L179 K180 V184 L200 L206	V176-I204 HydrophobicContact CG1-CD1 4.32Å; V176-I204 HydrophobicContact CG1-CG1 4.25Å; L179-I204 HydrophobicContact CB-CD1 3.48Å; L179-I204 VanDerWaalsContact CB-CD1 3.48Å; L179-I204 HydrophobicContact CD1-CD1 4.21Å; K180-I204 HydrophobicContact CG-CG1 3.93Å; V184-I204 VanDerWaalsContact O-CG2 3.29Å; V184-I204 WeakPolarHBondContact O-CG2 3.36Å; L200-I204 HydrophobicContact CD2-CD1 3.96Å; L200-I204 PolarHBondContact O-N 3.44Å; I204-L206 VanDerWaalsContact C-N 3.3Å; I204-L206 HydrophobicContact CB-CD2 4.5Å; I204-L206 HydrophobicContact CB-CG 4.37Å; I204-L206 HydrophobicContact CG2-CD2 3.84Å; I204-L206 HydrophobicContact CG2-CG 4.15Å; I204-L206 PolarHBondContact O-N 3.22Å
205	N	90.9	Very high	89.6	Confident	131 Å²	131	56 Å²	56	70%	0.701	27%	0.269	S	S	*	.			trans	-77.3	81	175.7	-174.3	21.5	0	0	0	110.7	Q207	N205-Q207 PolarHBondContact O-N 2.97Å
206	L	91.4	Very high	88.1	Confident	19 Å²	19	58 Å²	58	10%	0.099	28%	0.276	C	S	.	.			trans	-79.4	106.8	176.5	-62.4	175.9	0	0	0	109.9	V184 S185 V187 I197 L200 R201 I204	V184-L206 HydrophobicContact CG1-CD2 3.72Å; S185-L206 CarbonylContact O-C 3.58Å; S185-L206 WeakPolarHBondContact O-CA 3.45Å; V187-L206 HydrophobicContact CB-CD2 4.48Å; V187-L206 HydrophobicContact CG1-CD1 3.91Å; I197-L206 HydrophobicContact CG2-CD1 4.33Å; L200-L206 HydrophobicContact CB-CD1 4.12Å; R201-L206 HydrophobicContact CG-CB 4.4Å; R201-L206 HydrophobicContact CG-CD1 3.89Å; I204-L206 VanDerWaalsContact C-N 3.3Å; I204-L206 HydrophobicContact CB-CD2 4.5Å; I204-L206 HydrophobicContact CB-CG 4.37Å; I204-L206 HydrophobicContact CG2-CD2 3.84Å; I204-L206 HydrophobicContact CG2-CG 4.15Å; I204-L206 PolarHBondContact O-N 3.22Å
207	Q	90.8	Very high	86.3	Confident	95 Å²	95	62.7 Å²	62.7	44%	0.444	30%	0.296	S	S	.	.	S	Bend	trans	-71.7	-35.5	178.2	-61.9	-176	-13.8	0	0	111.7	S185 N205	S185-Q207 PolarHBondContact O-N 3.09Å; N205-Q207 PolarHBondContact O-N 2.97Å
208	H	91.7	Very high	84.6	Confident	44 Å²	44	68 Å²	68	20%	0.204	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131.7	-179.5	-59.7	-73.7	0	0	0	110.2	L131 S185 C186 V187 I210	L131-H208 HydrophobicContact CD2-CB 4.47Å; L131-H208 PolarHBondContact O-NE2 3.33Å; S185-H208 PolarHBondContact O-N 3.2Å; C186-H208 WeakPolarHBondContact CA-O 3.49Å; C186-H208 HydrophobicContact CB-CB 4.22Å; V187-H208 PolarHBondContact N-O 2.86Å; H208-I210 HydrophobicContact CB-CD1 4.49Å
209	C	93	Very high	83.2	Confident	5 Å²	5	67.6 Å²	67.6	3%	0.034	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	111.9	171.6	-55.3	0	0	0	0	109.1	V187 I197 R201 Y223 Q224	V187-C209 HydrophobicContact CG1-CB 3.86Å; V187-C209 VanDerWaalsContact CG1-SG 3.6Å; V187-C209 WeakPolarHBondContact O-CA 3.23Å; I197-C209 HydrophobicContact CG2-CB 4.17Å; R201-C209 VanDerWaalsContact CZ-SG 3.53Å; R201-C209 PolarHBondContact NE-SG 2.91Å; R201-C209 PolarHBondContact NH2-SG 3.44Å; C209-Y223 HydrophobicContact CB-CD1 4Å; C209-Y223 HydrophobicContact CB-CE1 4.46Å; C209-Q224 PolarHBondContact O-N 3.39Å; C209-Q224 VanDerWaalsContact O-N 3.1Å
210	I	93.4	Very high	82.2	Confident	0 Å²	0	69 Å²	69	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.9	-170.3	-60.2	162.2	0	0	0	108.2	L131 V187 F188 A189 H208 Q224 L226 L229	L131-I210 HydrophobicContact CD1-CD1 3.29Å; L131-I210 HydrophobicContact CD2-CD1 4.2Å; L131-I210 HydrophobicContact CG-CD1 4.39Å; V187-I210 PolarHBondContact O-N 3.34Å; F188-I210 CarbonylContact C-O 2.86Å; F188-I210 VanDerWaalsContact CA-O 3.28Å; F188-I210 WeakPolarHBondContact CA-O 3.26Å; F188-I210 HydrophobicContact CD1-CB 3.74Å; F188-I210 HydrophobicContact CD1-CD1 4.11Å; F188-I210 HydrophobicContact CD1-CG2 3.69Å; F188-I210 HydrophobicContact CE1-CB 3.95Å; F188-I210 HydrophobicContact CE1-CD1 3.46Å; F188-I210 VanDerWaalsContact CE1-CD1 3.46Å; F188-I210 HydrophobicContact CE1-CG1 4.3Å; F188-I210 HydrophobicContact CE1-CG2 3.82Å; F188-I210 HydrophobicContact CE2-CD1 4.28Å; F188-I210 HydrophobicContact CG-CB 4.36Å; F188-I210 HydrophobicContact CZ-CD1 3.56Å; A189-I210 PolarHBondContact N-O 2.72Å; H208-I210 HydrophobicContact CB-CD1 4.49Å; I210-Q224 CarbonylContact C-O 3.19Å; I210-Q224 WeakPolarHBondContact CA-O 3.28Å; I210-Q224 HydrophobicContact CG1-CB 4.27Å; I210-L226 HydrophobicContact CG2-CB 3.87Å; I210-L226 HydrophobicContact CG2-CD1 4.3Å; I210-L229 HydrophobicContact CD1-CD1 4.24Å; I210-L229 HydrophobicContact CG1-CD1 4.18Å; I210-L229 HydrophobicContact CG2-CD1 4.1Å
211	L	93.1	Very high	81.3	Confident	8 Å²	8	74.9 Å²	74.9	4%	0.042	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128	177.8	-61.3	177.7	0	0	0	109.8	A189 L194 I197 D213 L220 Y223 Q224 L226	A189-L211 CarbonylContact O-C 3.22Å; A189-L211 VanDerWaalsContact O-CA 3.3Å; A189-L211 WeakPolarHBondContact O-CA 3.1Å; L194-L211 HydrophobicContact CD1-CD1 4.22Å; L194-L211 HydrophobicContact CD1-CD2 4.31Å; I197-L211 HydrophobicContact CD1-CD2 3.95Å; L211-D213 PolarHBondContact O-N 3.22Å; L211-L220 HydrophobicContact CD1-CD1 4.08Å; L211-Y223 HydrophobicContact CD1-CD1 4.48Å; L211-Y223 HydrophobicContact CD1-CG 4.12Å; L211-Y223 HydrophobicContact CD2-CD1 4.19Å; L211-Y223 HydrophobicContact CG-CD1 4.28Å; L211-Y223 HydrophobicContact CG-CG 4.31Å; L211-Q224 PolarHBondContact N-O 3.08Å; L211-L226 VanDerWaalsContact O-CB 3.28Å; L211-L226 WeakPolarHBondContact O-CB 3.29Å; L211-L226 PolarHBondContact O-N 3.12Å
212	I	92.1	Very high	80.7	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.005	40%	0.398	C	S	.	.			trans	-82	75	175.7	-51.5	175.1	0	0	0	107.8	P149 V150 F188 A189 P191 L226	P149-I212 HydrophobicContact CB-CG2 3.98Å; P149-I212 HydrophobicContact CG-CG2 4.26Å; V150-I212 HydrophobicContact CG2-CD1 3.84Å; F188-I212 HydrophobicContact CB-CD1 3.97Å; F188-I212 HydrophobicContact CB-CG1 4.05Å; A189-I212 PolarHBondContact O-N 3.24Å; P191-I212 WeakPolarHBondContact CD-O 3.49Å; I212-L226 HydrophobicContact CB-CD2 4.48Å; I212-L226 HydrophobicContact CG1-CD2 4.3Å; I212-L226 HydrophobicContact CG2-CD2 4.07Å
213	D	83.5	Confident	80.4	Confident	20 Å²	20	66.6 Å²	66.6	11%	0.107	37%	0.366	C	S	.	.			trans	-99.8	144.7	179.1	56.8	8.3	0	0	0	112.3	P191 L211 S225 L226 S227	P191-D213 HydrophobicContact CG-CB 4.34Å; L211-D213 PolarHBondContact O-N 3.22Å; D213-S225 WeakPolarHBondContact OD1-CB 3.42Å; D213-S225 PolarHBondContact OD1-OG 2.92Å; D213-S225 WeakPolarHBondContact OD2-CB 3.28Å; D213-S225 PolarHBondContact OD2-OG 3.41Å; D213-L226 PolarHBondContact OD1-N 3.46Å; D213-S227 WeakPolarHBondContact O-CB 3.42Å; D213-S227 PolarHBondContact O-OG 3.02Å; D213-S227 PolarHBondContact OD1-N 3.47Å; D213-S227 PolarHBondContact OD1-OG 3.42Å
214	E	68.5	Low	80.1	Confident	96 Å²	96	67.1 Å²	67.1	45%	0.449	36%	0.361	S	S	.	.	S	Bend	trans	-94.2	-13.1	-179.9	-77.8	157.1	-139.6	0	0	113.5	R147	R147-E214 IonicContact CZ-OE1 2.77Å; R147-E214 IonicContact NH1-OE1 3.26Å; R147-E214 PolarHBondContact NH1-OE1 2.65Å
215	K	64.8	Low	80	Confident	154 Å²	154	66.6 Å²	66.6	67%	0.67	36%	0.359	S	S	*	.	S	Bend	trans	-122.9	136.1	-178.5	-64.9	-174.5	-179.9	-179	0	108.3	K217	K215-K217 HydrophobicContact CB-CG 4.48Å; K215-K217 PolarHBondContact O-N 2.96Å
216	E	59.8	Low	80	Confident	127 Å²	127	60.5 Å²	60.5	59%	0.593	33%	0.326	S	S	*	.			trans	-57.6	81.2	169.2	-71.4	-178	-171.4	0	0	109.3	K231	E216-K231 WeakPolarHBondContact OE1-CD 3.48Å; E216-K231 WeakPolarHBondContact OE1-CE 3.43Å; E216-K231 IonicContact OE1-NZ 3.63Å; E216-K231 PolarHBondContact OE1-NZ 3.33Å; E216-K231 IonicContact OE2-NZ 2.74Å; E216-K231 PolarHBondContact OE2-NZ 3.39Å
217	K	56.9	Low	79.8	Confident	150 Å²	150	60.7 Å²	60.7	65%	0.652	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-97.2	142.4	167.3	-72	-174.3	177	-178.6	0	106.2	K215 P219	K215-K217 HydrophobicContact CB-CG 4.48Å; K215-K217 PolarHBondContact O-N 2.96Å; K217-P219 VanDerWaalsContact O-N 3.14Å
218	S	55.3	Low	79.7	Confident	112 Å²	112	60.4 Å²	60.4	78%	0.783	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-50.9	126	170.5	-56.3	0	0	0	0	107.9	L220	S218-L220 PolarHBondContact O-N 2.91Å
219	P	62.2	Low	79.5	Confident	64 Å²	64	59 Å²	59	42%	0.416	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-54.7	135.7	-178.2	16	-26.7	0	0	0	109.1	K217 Y223	K217-P219 VanDerWaalsContact O-N 3.14Å; P219-Y223 WeakPolarHBondContact CB-O 3.21Å
220	L	72.2	Confident	79.3	Confident	91 Å²	91	60.4 Å²	60.4	48%	0.476	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-56.4	140.8	169.6	-72.4	169.1	0	0	0	108.2	L194 L211 S218 G222 Y223	L194-L220 HydrophobicContact CD1-CD1 3.33Å; L211-L220 HydrophobicContact CD1-CD1 4.08Å; S218-L220 PolarHBondContact O-N 2.91Å; L220-G222 PolarHBondContact O-N 2.96Å; L220-Y223 HydrophobicContact CB-CD2 3.6Å; L220-Y223 HydrophobicContact CB-CE2 4.17Å; L220-Y223 HydrophobicContact CB-CG 4.44Å; L220-Y223 PolarHBondContact O-N 3.4Å
221	P	75.2	Confident	78.9	Confident	122 Å²	122	65.9 Å²	65.9	79%	0.792	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	126.7	-179.9	-26.9	34	0	0	0	111.4	Y223	P221-Y223 WeakPolarHBondContact O-CD2 3.48Å
222	G	79.2	Confident	78.6	Confident	59 Å²	59	68.7 Å²	68.7	61%	0.608	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	7.7	-178.1	0	0	0	0	0	115.5	R201 L220	R201-G222 PolarHBondContact NH2-O 3.38Å; L220-G222 PolarHBondContact O-N 2.96Å
223	Y	86.6	Confident	78.1	Confident	25 Å²	25	70.8 Å²	70.8	10%	0.098	38%	0.379	C	S	.	.			trans	-126.5	158.1	173.3	-54	-91.5	0	0	0	110.7	L194 I197 E198 C209 L211 P219 L220 P221	L194-Y223 HydrophobicContact CD1-CD2 4.35Å; L194-Y223 HydrophobicContact CD1-CE1 4.11Å; L194-Y223 HydrophobicContact CD1-CE2 3.84Å; L194-Y223 WeakPolarHBondContact CD2-OH 3.31Å; L194-Y223 HydrophobicContact CG-CE1 4.14Å; L194-Y223 HydrophobicContact CG-CE2 4.35Å; L194-Y223 WeakPolarHBondContact CG-OH 3.33Å; I197-Y223 HydrophobicContact CD1-CE1 4.26Å; I197-Y223 HydrophobicContact CG2-CE1 4.16Å; E198-Y223 WeakPolarHBondContact CG-OH 3.37Å; E198-Y223 VanDerWaalsContact OE1-CZ 3.29Å; E198-Y223 PolarHBondContact OE1-OH 3.26Å; C209-Y223 HydrophobicContact CB-CD1 4Å; C209-Y223 HydrophobicContact CB-CE1 4.46Å; L211-Y223 HydrophobicContact CD1-CD1 4.48Å; L211-Y223 HydrophobicContact CD1-CG 4.12Å; L211-Y223 HydrophobicContact CD2-CD1 4.19Å; L211-Y223 HydrophobicContact CG-CD1 4.28Å; L211-Y223 HydrophobicContact CG-CG 4.31Å; P219-Y223 WeakPolarHBondContact CB-O 3.21Å; L220-Y223 HydrophobicContact CB-CD2 3.6Å; L220-Y223 HydrophobicContact CB-CE2 4.17Å; L220-Y223 HydrophobicContact CB-CG 4.44Å; L220-Y223 PolarHBondContact O-N 3.4Å; P221-Y223 WeakPolarHBondContact O-CD2 3.48Å
224	Q	88.8	Confident	77.9	Confident	75 Å²	75	70.6 Å²	70.6	35%	0.35	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	149.6	170.4	-61.9	173	-39.7	0	0	109.5	C209 I210 L211 L229	C209-Q224 PolarHBondContact O-N 3.39Å; C209-Q224 VanDerWaalsContact O-N 3.1Å; I210-Q224 CarbonylContact C-O 3.19Å; I210-Q224 WeakPolarHBondContact CA-O 3.28Å; I210-Q224 HydrophobicContact CG1-CB 4.27Å; L211-Q224 PolarHBondContact N-O 3.08Å; Q224-L229 HydrophobicContact CB-CD1 3.73Å; Q224-L229 HydrophobicContact CB-CG 4.33Å
225	S	90.1	Very high	77.9	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.007	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	128.8	175.7	155.6	0	0	0	0	109.6	D213 S227 H228 L229	D213-S225 WeakPolarHBondContact OD1-CB 3.42Å; D213-S225 PolarHBondContact OD1-OG 2.92Å; D213-S225 WeakPolarHBondContact OD2-CB 3.28Å; D213-S225 PolarHBondContact OD2-OG 3.41Å; S225-S227 PolarHBondContact OG-N 2.67Å; S225-S227 PolarHBondContact OG-OG 3.38Å; S225-H228 PolarHBondContact O-N 3.04Å; S225-H228 WeakPolarHBondContact OG-CB 3.24Å; S225-H228 PolarHBondContact OG-N 3.32Å; S225-H228 VanDerWaalsContact OG-N 3.1Å; S225-L229 WeakPolarHBondContact O-CB 3.19Å; S225-L229 VanDerWaalsContact O-CG 3.26Å; S225-L229 WeakPolarHBondContact O-CG 3.49Å; S225-L229 PolarHBondContact O-N 3.12Å
226	L	91.4	Very high	78	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.01	38%	0.376	C	S	.	.	H	α-helix	trans	-62	-45.9	177.4	180	61.5	0	0	0	110.5	L127 P149 F188 I210 L211 I212 D213 H228 L229 Q230	L127-L226 HydrophobicContact CD2-CD1 3.6Å; P149-L226 HydrophobicContact CB-CD2 3.83Å; F188-L226 HydrophobicContact CD1-CD1 4.25Å; F188-L226 HydrophobicContact CE1-CD1 3.96Å; I210-L226 HydrophobicContact CG2-CB 3.87Å; I210-L226 HydrophobicContact CG2-CD1 4.3Å; L211-L226 VanDerWaalsContact O-CB 3.28Å; L211-L226 WeakPolarHBondContact O-CB 3.29Å; L211-L226 PolarHBondContact O-N 3.12Å; I212-L226 HydrophobicContact CB-CD2 4.48Å; I212-L226 HydrophobicContact CG1-CD2 4.3Å; I212-L226 HydrophobicContact CG2-CD2 4.07Å; D213-L226 PolarHBondContact OD1-N 3.46Å; L226-H228 VanDerWaalsContact C-N 3.32Å; L226-H228 PolarHBondContact O-N 3.45Å; L226-L229 PolarHBondContact O-N 3.03Å; L226-Q230 HydrophobicContact CD1-CG 4.01Å; L226-Q230 HydrophobicContact CG-CG 4.19Å; L226-Q230 WeakPolarHBondContact O-CB 3.5Å; L226-Q230 VanDerWaalsContact O-CG 3.24Å; L226-Q230 WeakPolarHBondContact O-CG 3.38Å; L226-Q230 PolarHBondContact O-N 2.94Å
227	S	88.2	Confident	78.1	Confident	23 Å²	23	63.6 Å²	63.6	16%	0.161	38%	0.382	C	S	.	.	H	α-helix	trans	-61.5	-41	179.7	57.1	0	0	0	0	112.1	D213 S225 K231	D213-S227 WeakPolarHBondContact O-CB 3.42Å; D213-S227 PolarHBondContact O-OG 3.02Å; D213-S227 PolarHBondContact OD1-N 3.47Å; D213-S227 PolarHBondContact OD1-OG 3.42Å; S225-S227 PolarHBondContact OG-N 2.67Å; S225-S227 PolarHBondContact OG-OG 3.38Å; S227-K231 WeakPolarHBondContact O-CB 3.5Å; S227-K231 PolarHBondContact O-N 3.19Å
228	H	87.5	Confident	78.5	Confident	90 Å²	90	61.2 Å²	61.2	42%	0.417	38%	0.384	S	S	.	.	H	α-helix	trans	-63.9	-48.1	174.4	-179.4	72.6	0	0	0	112.2	S225 L226 Q230 K231 C232	S225-H228 PolarHBondContact O-N 3.04Å; S225-H228 WeakPolarHBondContact OG-CB 3.24Å; S225-H228 PolarHBondContact OG-N 3.32Å; S225-H228 VanDerWaalsContact OG-N 3.1Å; L226-H228 VanDerWaalsContact C-N 3.32Å; L226-H228 PolarHBondContact O-N 3.45Å; H228-Q230 PolarHBondContact O-N 3.42Å; H228-K231 WeakPolarHBondContact O-CB 3.33Å; H228-K231 PolarHBondContact O-N 3.23Å; H228-C232 PolarHBondContact O-N 3.06Å; H228-C232 PolarHBondContact O-SG 3.03Å; H228-C232 VanDerWaalsContact O-SG 3.32Å
229	L	87.9	Confident	79.1	Confident	15 Å²	15	60.1 Å²	60.1	8%	0.079	37%	0.369	C	S	.	.	H	α-helix	trans	-61.3	-45.8	178.5	-69.9	170	0	0	0	110.8	L127 I210 Q224 S225 L226 K231 C232 Y233	L127-L229 HydrophobicContact CD1-CB 3.98Å; L127-L229 HydrophobicContact CD1-CD1 4.02Å; L127-L229 HydrophobicContact CD1-CG 4.42Å; L127-L229 HydrophobicContact CD2-CB 4.39Å; I210-L229 HydrophobicContact CD1-CD1 4.24Å; I210-L229 HydrophobicContact CG1-CD1 4.18Å; I210-L229 HydrophobicContact CG2-CD1 4.1Å; Q224-L229 HydrophobicContact CB-CD1 3.73Å; Q224-L229 HydrophobicContact CB-CG 4.33Å; S225-L229 WeakPolarHBondContact O-CB 3.19Å; S225-L229 VanDerWaalsContact O-CG 3.26Å; S225-L229 WeakPolarHBondContact O-CG 3.49Å; S225-L229 PolarHBondContact O-N 3.12Å; L226-L229 PolarHBondContact O-N 3.03Å; L229-K231 VanDerWaalsContact C-N 3.28Å; L229-K231 PolarHBondContact O-N 3.26Å; L229-C232 WeakPolarHBondContact O-CB 3.49Å; L229-C232 PolarHBondContact O-N 3.19Å; L229-C232 VanDerWaalsContact O-N 3.09Å; L229-Y233 HydrophobicContact CB-CD2 4.4Å; L229-Y233 HydrophobicContact CB-CE2 4.33Å; L229-Y233 HydrophobicContact CD2-CE2 4.09Å; L229-Y233 WeakPolarHBondContact O-CD2 3.16Å; L229-Y233 PolarHBondContact O-N 3.18Å
230	Q	88.3	Confident	79.7	Confident	33 Å²	33	58.3 Å²	58.3	15%	0.154	36%	0.356	C	S	.	.	H	α-helix	trans	-57.9	-40	176.5	-75.6	176	-29.3	0	0	112	V123 N124 L226 H228 G234	V123-Q230 HydrophobicContact CG1-CB 3.78Å; V123-Q230 HydrophobicContact CG1-CG 3.86Å; V123-Q230 WeakPolarHBondContact CG1-O 3.33Å; N124-Q230 PolarHBondContact OD1-NE2 3.43Å; L226-Q230 HydrophobicContact CD1-CG 4.01Å; L226-Q230 HydrophobicContact CG-CG 4.19Å; L226-Q230 WeakPolarHBondContact O-CB 3.5Å; L226-Q230 VanDerWaalsContact O-CG 3.24Å; L226-Q230 WeakPolarHBondContact O-CG 3.38Å; L226-Q230 PolarHBondContact O-N 2.94Å; H228-Q230 PolarHBondContact O-N 3.42Å; Q230-G234 VanDerWaalsContact O-CA 3.31Å; Q230-G234 WeakPolarHBondContact O-CA 3.31Å; Q230-G234 PolarHBondContact O-N 3.38Å
231	K	86.4	Confident	79.5	Confident	115 Å²	115	55.6 Å²	55.6	50%	0.5	34%	0.344	S	S	.	.	H	α-helix	trans	-64.5	-44.8	174.1	-173.3	177	-176.6	178.8	0	111.9	E216 S227 H228 L229 G234 A235	E216-K231 WeakPolarHBondContact OE1-CD 3.48Å; E216-K231 WeakPolarHBondContact OE1-CE 3.43Å; E216-K231 IonicContact OE1-NZ 3.63Å; E216-K231 PolarHBondContact OE1-NZ 3.33Å; E216-K231 IonicContact OE2-NZ 2.74Å; E216-K231 PolarHBondContact OE2-NZ 3.39Å; S227-K231 WeakPolarHBondContact O-CB 3.5Å; S227-K231 PolarHBondContact O-N 3.19Å; H228-K231 WeakPolarHBondContact O-CB 3.33Å; H228-K231 PolarHBondContact O-N 3.23Å; L229-K231 VanDerWaalsContact C-N 3.28Å; L229-K231 PolarHBondContact O-N 3.26Å; K231-G234 PolarHBondContact O-N 3.27Å; K231-A235 WeakPolarHBondContact O-CB 3.38Å; K231-A235 PolarHBondContact O-N 2.93Å
232	C	85	Confident	79.1	Confident	68 Å²	68	55.8 Å²	55.8	46%	0.459	35%	0.345	S	S	.	.	H	α-helix	trans	-61.3	-44.5	179.1	-70.2	0	0	0	0	112.4	H228 L229	H228-C232 PolarHBondContact O-N 3.06Å; H228-C232 PolarHBondContact O-SG 3.03Å; H228-C232 VanDerWaalsContact O-SG 3.32Å; L229-C232 WeakPolarHBondContact O-CB 3.49Å; L229-C232 PolarHBondContact O-N 3.19Å; L229-C232 VanDerWaalsContact O-N 3.09Å
233	Y	82.9	Confident	78.9	Confident	44 Å²	44	58.6 Å²	58.6	17%	0.173	35%	0.35	C	S	.	.	H	α-helix	trans	-82.2	-28.2	179.2	-65	-70.3	0	0	0	113.4	V126 L127 H130 L229	V126-Y233 HydrophobicContact CG1-CD1 3.89Å; V126-Y233 HydrophobicContact CG1-CG 4.26Å; L127-Y233 HydrophobicContact CB-CD2 4.26Å; L127-Y233 HydrophobicContact CD1-CD2 3.83Å; L127-Y233 HydrophobicContact CD1-CE2 3.54Å; H130-Y233 HydrophobicContact CB-CE1 4.23Å; H130-Y233 AromaticContact CD2-CZ 3.86Å; H130-Y233 PolarHBondContact CD2-OH 3.5Å; H130-Y233 AromaticContact CG-CZ 3.95Å; H130-Y233 PolarHBondContact NE2-OH 3.08Å; L229-Y233 HydrophobicContact CB-CD2 4.4Å; L229-Y233 HydrophobicContact CB-CE2 4.33Å; L229-Y233 HydrophobicContact CD2-CE2 4.09Å; L229-Y233 WeakPolarHBondContact O-CD2 3.16Å; L229-Y233 PolarHBondContact O-N 3.18Å
234	G	78.3	Confident	78.5	Confident	17 Å²	17	58 Å²	58	18%	0.175	35%	0.349	C	S	.	.	H	α-helix	trans	-84.5	-22.9	-178.7	0	0	0	0	0	114.9	Q230 K231 S236	Q230-G234 VanDerWaalsContact O-CA 3.31Å; Q230-G234 WeakPolarHBondContact O-CA 3.31Å; Q230-G234 PolarHBondContact O-N 3.38Å; K231-G234 PolarHBondContact O-N 3.27Å; G234-S236 PolarHBondContact O-N 2.87Å
235	A	69.4	Low	78.1	Confident	85 Å²	85	59.5 Å²	59.5	70%	0.702	36%	0.363	S	S	*	.	S	Bend	trans	-66.4	-20.7	-179.4	0	0	0	0	0	113.8	K231	K231-A235 WeakPolarHBondContact O-CB 3.38Å; K231-A235 PolarHBondContact O-N 2.93Å
236	S	67	Low	77.6	Confident	42 Å²	42	61 Å²	61	29%	0.294	37%	0.37	S	S	.	.			trans	-105.5	101.9	179.5	-160.9	0	0	0	0	109.7	G234 S238 L239	G234-S236 PolarHBondContact O-N 2.87Å; S236-S238 PolarHBondContact O-N 3.3Å; S236-S238 VanDerWaalsContact O-N 3.09Å; S236-S238 PolarHBondContact OG-OG 2.95Å; S236-L239 WeakPolarHBondContact O-CB 3.41Å; S236-L239 PolarHBondContact O-N 2.95Å
237	S	62.2	Low	77	Confident	103 Å²	103	62.3 Å²	62.3	72%	0.72	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-25.6	175.2	56.1	0	0	0	0	112.8	L239 L240	S237-L239 VanDerWaalsContact C-N 3.29Å; S237-L239 PolarHBondContact O-N 3.15Å; S237-L240 PolarHBondContact O-N 3.29Å
238	S	63.8	Low	76.2	Confident	99 Å²	99	67.1 Å²	67.1	69%	0.692	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-21	173	58.5	0	0	0	0	114.5	S236	S236-S238 PolarHBondContact O-N 3.3Å; S236-S238 VanDerWaalsContact O-N 3.09Å; S236-S238 PolarHBondContact OG-OG 2.95Å
239	L	68.1	Low	75.2	Confident	89 Å²	89	66.7 Å²	66.7	47%	0.466	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-21.1	175.4	-66	175.8	0	0	0	111.9	V126 S236 S237	V126-L239 WeakPolarHBondContact CG2-O 3.24Å; S236-L239 WeakPolarHBondContact O-CB 3.41Å; S236-L239 PolarHBondContact O-N 2.95Å; S237-L239 VanDerWaalsContact C-N 3.29Å; S237-L239 PolarHBondContact O-N 3.15Å
240	L	75.4	Confident	74.2	Confident	26 Å²	26	67 Å²	67	14%	0.136	39%	0.394	C	S	.	.	S	Bend	trans	-83.8	121.3	-179.7	-64.9	173.5	0	0	0	109.7	R122 V123 V126 S237	R122-L240 HydrophobicContact CB-CD2 4.06Å; V123-L240 HydrophobicContact CB-CD2 4.49Å; V123-L240 HydrophobicContact CG2-CD2 3.85Å; V126-L240 HydrophobicContact CG2-CD2 4.17Å; S237-L240 PolarHBondContact O-N 3.29Å
241	P	68.1	Low	73	Confident	34 Å²	34	68.9 Å²	68.9	22%	0.221	41%	0.405	C	S	.	.			trans	-65.9	127.4	-178.6	26.2	-33.9	0	0	0	110.1	V243 L244	P241-V243 VanDerWaalsContact C-N 3.26Å; P241-V243 PolarHBondContact O-N 3.03Å; P241-L244 HydrophobicContact CG-CD2 3.61Å; P241-L244 HydrophobicContact CG-CG 4.46Å
242	P	65.8	Low	72.2	Confident	126 Å²	126	70.9 Å²	70.9	82%	0.818	42%	0.421	S	S	*	.	S	Bend	trans	-67.7	-31.8	179.3	26	-33.1	0	0	0	111.7
243	V	74.9	Confident	71.9	Confident	118 Å²	118	71.2 Å²	71.2	72%	0.715	42%	0.419	S	S	*	.	S	Bend	trans	-120.5	123.9	171.7	179.5	0	0	0	0	107.1	P241 T245	P241-V243 VanDerWaalsContact C-N 3.26Å; P241-V243 PolarHBondContact O-N 3.03Å; V243-T245 PolarHBondContact O-N 3.14Å
244	L	79.5	Confident	71.7	Confident	14 Å²	14	72.9 Å²	72.9	7%	0.073	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-75.8	117.9	176.9	-82.4	172.8	0	0	0	110.3	W91 R122 I125 P241 I246	W91-L244 HydrophobicContact CD2-CD1 3.6Å; W91-L244 HydrophobicContact CE3-CD1 3.8Å; W91-L244 HydrophobicContact CG-CD1 4.4Å; W91-L244 HydrophobicContact CH2-CD1 3.5Å; W91-L244 HydrophobicContact CZ2-CD1 3.34Å; W91-L244 HydrophobicContact CZ2-CG 4.38Å; W91-L244 HydrophobicContact CZ3-CD1 3.73Å; R122-L244 HydrophobicContact CG-CD1 3.97Å; R122-L244 HydrophobicContact CG-CD2 4.4Å; R122-L244 HydrophobicContact CG-CG 4.33Å; I125-L244 HydrophobicContact CD1-CD1 3.93Å; I125-L244 HydrophobicContact CD1-CD2 3.53Å; I125-L244 HydrophobicContact CD1-CG 4.41Å; I125-L244 HydrophobicContact CG2-CD2 4.18Å; P241-L244 HydrophobicContact CG-CD2 3.61Å; P241-L244 HydrophobicContact CG-CG 4.46Å; L244-I246 PolarHBondContact O-N 2.79Å
245	T	80.2	Confident	72.1	Confident	105 Å²	105	75 Å²	75	64%	0.644	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-69.9	118	164.3	-53.4	0	0	0	0	107.8	R160 V243	R160-T245 PolarHBondContact NH1-O 3.19Å; V243-T245 PolarHBondContact O-N 3.14Å
246	I	79.8	Confident	72.9	Confident	33 Å²	33	71.4 Å²	71.4	17%	0.169	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-85.9	132.6	174.9	-60.7	159.1	0	0	0	108.6	E88 I159 L244	E88-I246 HydrophobicContact CB-CD1 3.98Å; E88-I246 HydrophobicContact CB-CG2 3.91Å; E88-I246 HydrophobicContact CG-CD1 3.73Å; I159-I246 HydrophobicContact CG2-CG1 4.49Å; L244-I246 PolarHBondContact O-N 2.79Å
247	S	77.3	Confident	74.1	Confident	30 Å²	30	71.5 Å²	71.5	21%	0.21	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-66.4	141.7	175	-171.5	0	0	0	0	109.9	I159 R160 R249	I159-S247 PolarHBondContact O-N 2.83Å; R160-S247 WeakPolarHBondContact O-CB 3.38Å; R160-S247 PolarHBondContact O-OG 3.39Å; S247-R249 PolarHBondContact OG-N 2.96Å
248	K	72.3	Confident	75.5	Confident	124 Å²	124	66.7 Å²	66.7	54%	0.539	38%	0.378	S	S	.	.			trans	-119.7	16.7	176.8	-70.5	-165.8	175	-167.1	0	111.3	N250 L251	K248-N250 VanDerWaalsContact C-N 3.26Å; K248-N250 PolarHBondContact O-N 3.27Å; K248-L251 HydrophobicContact CB-CD1 3.7Å; K248-L251 HydrophobicContact CB-CG 4.31Å; K248-L251 HydrophobicContact CD-CD1 3.63Å; K248-L251 HydrophobicContact CG-CD1 3.52Å; K248-L251 HydrophobicContact CG-CG 4.49Å; K248-L251 PolarHBondContact O-N 2.81Å
249	R	67	Low	77.1	Confident	80 Å²	80	62 Å²	62	30%	0.302	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-55.2	-44.1	-171.8	-175	-179.8	177.6	161.8	5.6	111.2	D135 N136 D137 D161 S247	D135-R249 VanDerWaalsContact C-CZ 3.49Å; D135-R249 PolarHBondContact O-NH2 2.61Å; N136-R249 PolarHBondContact O-NH1 3.34Å; N136-R249 PolarHBondContact O-NH2 3.43Å; D137-R249 IonicContact OD1-CZ 3.88Å; D137-R249 IonicContact OD1-NH2 3.94Å; D137-R249 PolarHBondContact OD1-NH2 3.44Å; D161-R249 HydrophobicContact CB-CB 4.24Å; D161-R249 PolarHBondContact OD2-N 3.18Å; S247-R249 PolarHBondContact OG-N 2.96Å
250	N	66.6	Low	78.4	Confident	21 Å²	21	57.9 Å²	57.9	11%	0.112	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-96.1	2.3	-174.1	-64.7	-19.1	0	0	0	113.5	D161 K248 N252 D253 A256	D161-N250 PolarHBondContact O-ND2 3.29Å; D161-N250 PolarHBondContact OD2-N 2.89Å; K248-N250 VanDerWaalsContact C-N 3.26Å; K248-N250 PolarHBondContact O-N 3.27Å; N250-N252 PolarHBondContact O-N 3.04Å; N250-D253 CarbonylContact O-C 3.54Å; N250-D253 VanDerWaalsContact O-C 3.24Å; N250-D253 PolarHBondContact O-N 3.03Å; N250-D253 VanDerWaalsContact O-N 3.08Å; N250-A256 HydrophobicContact CB-CB 4.12Å
251	L	63.7	Low	79.3	Confident	74 Å²	74	56.6 Å²	56.6	39%	0.387	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-63.7	-24.8	175.6	-75.2	177.8	0	0	0	112.5	K248	K248-L251 HydrophobicContact CB-CD1 3.7Å; K248-L251 HydrophobicContact CB-CG 4.31Å; K248-L251 HydrophobicContact CD-CD1 3.63Å; K248-L251 HydrophobicContact CG-CD1 3.52Å; K248-L251 HydrophobicContact CG-CG 4.49Å; K248-L251 PolarHBondContact O-N 2.81Å
252	N	67.9	Low	80.4	Confident	156 Å²	156	55.8 Å²	55.8	83%	0.834	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-87	-13.9	176.5	-64.4	-31	0	0	0	113.3	N250	N250-N252 PolarHBondContact O-N 3.04Å
253	D	79.6	Confident	81.3	Confident	76 Å²	76	50.9 Å²	50.9	41%	0.406	28%	0.277	S	S	.	.			trans	-123	85.8	174.6	-173.4	-0.8	0	0	0	110	N250 I255 A256	N250-D253 CarbonylContact O-C 3.54Å; N250-D253 VanDerWaalsContact O-C 3.24Å; N250-D253 PolarHBondContact O-N 3.03Å; N250-D253 VanDerWaalsContact O-N 3.08Å; D253-I255 PolarHBondContact O-N 3.18Å; D253-I255 WeakPolarHBondContact OD1-CG1 3.36Å; D253-I255 PolarHBondContact OD1-N 3.48Å; D253-A256 HydrophobicContact CB-CB 4.07Å; D253-A256 WeakPolarHBondContact O-CB 3.46Å; D253-A256 PolarHBondContact O-N 3.04Å; D253-A256 VanDerWaalsContact O-N 3.08Å; D253-A256 PolarHBondContact OD1-N 2.84Å
254	P	79.6	Confident	81.6	Confident	78 Å²	78	49.4 Å²	49.4	51%	0.506	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-11	-175	28.7	-35.8	0	0	0	113.6
255	I	84.9	Confident	81.4	Confident	61 Å²	61	49 Å²	49	31%	0.313	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-0.7	178.4	64.7	167.8	0	0	0	113.1	D253 Q462	D253-I255 PolarHBondContact O-N 3.18Å; D253-I255 WeakPolarHBondContact OD1-CG1 3.36Å; D253-I255 PolarHBondContact OD1-N 3.48Å; I255-Q462 HydrophobicContact CG2-CB 4.3Å; I255-Q462 HydrophobicContact CG2-CG 4.27Å
256	A	88.2	Confident	80.9	Confident	11 Å²	11	48 Å²	48	9%	0.091	25%	0.247	C	C	.	.			trans	-58.1	129.2	176	0	0	0	0	0	111.2	N250 D253 V258	N250-A256 HydrophobicContact CB-CB 4.12Å; D253-A256 HydrophobicContact CB-CB 4.07Å; D253-A256 WeakPolarHBondContact O-CB 3.46Å; D253-A256 PolarHBondContact O-N 3.04Å; D253-A256 VanDerWaalsContact O-N 3.08Å; D253-A256 PolarHBondContact OD1-N 2.84Å; A256-V258 PolarHBondContact O-N 2.99Å
257	P	90.8	Very high	80.5	Confident	43 Å²	43	50.3 Å²	50.3	28%	0.279	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	128.3	172.9	-23.8	34.6	0	0	0	111.4	H274	P257-H274 HydrophobicContact CB-CB 3.88Å; P257-H274 HydrophobicContact CG-CB 3.86Å
258	V	93.1	Very high	80.3	Confident	2 Å²	2	51 Å²	51	1%	0.012	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-29.1	168.9	-57.4	0	0	0	0	111.9	V164 A256 L275 N277 L280	V164-V258 WeakPolarHBondContact CG1-O 3.42Å; V164-V258 PolarHBondContact N-O 2.87Å; A256-V258 PolarHBondContact O-N 2.99Å; V258-L275 WeakPolarHBondContact CG2-O 3.46Å; V258-L275 PolarHBondContact N-O 3.28Å; V258-N277 HydrophobicContact CG1-CB 4.44Å; V258-N277 WeakPolarHBondContact CG1-ND2 3.38Å; V258-L280 HydrophobicContact CG2-CD1 3.69Å
259	L	95.5	Very high	80.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	125.5	175.9	177.7	66.7	0	0	0	109.6	V164 I166 V261 L275 L280 L311	V164-L259 HydrophobicContact CG1-CD1 3.77Å; V164-L259 CarbonylContact O-C 3.54Å; V164-L259 VanDerWaalsContact O-CA 3.29Å; V164-L259 WeakPolarHBondContact O-CA 3.48Å; I166-L259 HydrophobicContact CG2-CD1 3.77Å; L259-V261 HydrophobicContact CD1-CG1 4.26Å; L259-V261 HydrophobicContact CD2-CG1 4.24Å; L259-V261 HydrophobicContact CG-CG1 4.02Å; L259-L275 HydrophobicContact CB-CB 4.28Å; L259-L275 HydrophobicContact CD2-CD1 4.03Å; L259-L275 PolarHBondContact N-O 3.24Å; L259-L275 VanDerWaalsContact N-O 3.11Å; L259-L275 PolarHBondContact O-N 3.46Å; L259-L280 HydrophobicContact CB-CD1 3.85Å; L259-L280 HydrophobicContact CD2-CD1 4.12Å; L259-L280 HydrophobicContact CD2-CD2 4.16Å; L259-L311 HydrophobicContact CD1-CD1 4.4Å; L259-L311 HydrophobicContact CD2-CD1 3.62Å
260	T	95.4	Very high	81.2	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.9	173.4	-57.5	0	0	0	0	109.2	V164 A165 I166 I182 W262 M272 V273 H274	V164-T260 PolarHBondContact O-N 3.42Å; A165-T260 WeakPolarHBondContact CA-O 3.49Å; I166-T260 PolarHBondContact N-O 2.87Å; I182-T260 HydrophobicContact CD1-CG2 4.24Å; T260-W262 HydrophobicContact CG2-CH2 3.8Å; T260-W262 HydrophobicContact CG2-CZ2 4.04Å; T260-W262 HydrophobicContact CG2-CZ3 4.08Å; T260-M272 HydrophobicContact CG2-CG 3.49Å; T260-M272 VanDerWaalsContact CG2-CG 3.49Å; T260-M272 HydrophobicContact CG2-SD 3.85Å; T260-V273 WeakPolarHBondContact CA-O 3.28Å; T260-H274 PolarHBondContact OG1-CE1 3.42Å; T260-H274 PolarHBondContact OG1-ND1 3.42Å
261	V	94.7	Very high	82	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	164.3	177.5	-62	0	0	0	0	110.3	I166 L259 M272 V273 P308 C406	I166-V261 HydrophobicContact CG2-CG1 3.87Å; L259-V261 HydrophobicContact CD1-CG1 4.26Å; L259-V261 HydrophobicContact CD2-CG1 4.24Å; L259-V261 HydrophobicContact CG-CG1 4.02Å; V261-M272 CarbonylContact O-C 3.57Å; V261-V273 HydrophobicContact CG2-CB 3.99Å; V261-V273 PolarHBondContact N-O 2.88Å; V261-V273 PolarHBondContact O-N 3.26Å; V261-P308 HydrophobicContact CG2-CG 4.23Å; V261-C406 HydrophobicContact CG2-CB 4.46Å
262	W	92	Very high	83.3	Confident	17 Å²	17	43 Å²	43	6%	0.064	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.7	175.4	-69.1	-101.1	0	0	0	111.2	A165 M167 L175 D178 L179 I182 T260 K271 M272	A165-W262 HydrophobicContact CB-CH2 3.71Å; A165-W262 HydrophobicContact CB-CZ3 3.85Å; M167-W262 HydrophobicContact CB-CD2 4.4Å; M167-W262 HydrophobicContact CB-CE3 3.58Å; M167-W262 HydrophobicContact CB-CZ3 3.96Å; M167-W262 HydrophobicContact CE-CD2 4Å; M167-W262 HydrophobicContact CE-CE3 3.66Å; M167-W262 HydrophobicContact CE-CH2 3.43Å; M167-W262 VanDerWaalsContact CE-CH2 3.43Å; M167-W262 HydrophobicContact CE-CZ2 3.8Å; M167-W262 HydrophobicContact CE-CZ3 3.37Å; L175-W262 HydrophobicContact CD1-CB 4.05Å; L175-W262 HydrophobicContact CD1-CD2 3.83Å; L175-W262 HydrophobicContact CD1-CG 3.53Å; L175-W262 HydrophobicContact CD2-CG 4.43Å; D178-W262 HydrophobicContact CB-CZ2 4.2Å; D178-W262 PolarHBondContact OD2-NE1 3.31Å; L179-W262 HydrophobicContact CD2-CH2 3.86Å; L179-W262 HydrophobicContact CD2-CZ2 4.18Å; I182-W262 HydrophobicContact CD1-CH2 3.73Å; I182-W262 HydrophobicContact CD1-CZ2 4.06Å; T260-W262 HydrophobicContact CG2-CH2 3.8Å; T260-W262 HydrophobicContact CG2-CZ2 4.04Å; T260-W262 HydrophobicContact CG2-CZ3 4.08Å; W262-K271 VanDerWaalsContact CA-O 3.24Å; W262-K271 WeakPolarHBondContact CA-O 3.49Å; W262-M272 HydrophobicContact CZ2-CG 4.26Å; W262-M272 HydrophobicContact CZ2-SD 4.05Å
263	T	85	Confident	84.4	Confident	22 Å²	22	35.5 Å²	35.5	14%	0.135	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	149.4	170.8	64	0	0	0	0	110.5	G265 P270 K271 C406	T263-G265 PolarHBondContact O-N 2.86Å; T263-P270 CarbonylContact O-C 3.55Å; T263-P270 WeakPolarHBondContact O-CA 3.29Å; T263-K271 PolarHBondContact N-O 3.16Å; T263-K271 PolarHBondContact O-N 2.86Å; T263-C406 HydrophobicContact CG2-CB 3.35Å; T263-C406 WeakPolarHBondContact CG2-SG 3.21Å
264	M	81.5	Confident	85.1	Confident	88 Å²	88	33 Å²	33	43%	0.433	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	112.6	170.3	-170.9	57	63	0	0	109.2	F171 M174 P270	F171-M264 HydrophobicContact CD1-CE 4.09Å; F171-M264 HydrophobicContact CD2-CE 4.47Å; F171-M264 HydrophobicContact CE1-CE 3.32Å; F171-M264 HydrophobicContact CE2-CE 3.78Å; F171-M264 HydrophobicContact CZ-CE 3.15Å; M174-M264 HydrophobicContact CE-CE 4.25Å; M264-P270 HydrophobicContact CE-CG 4.18Å; M264-P270 HydrophobicContact SD-CG 4.48Å
265	G	73.8	Confident	85.8	Confident	6 Å²	6	29.3 Å²	29.3	6%	0.062	17%	0.168	C	C	.	.			trans	-63.1	154.7	174.8	0	0	0	0	0	111.6	T263 N267 G268 C269	T263-G265 PolarHBondContact O-N 2.86Å; G265-N267 PolarHBondContact O-N 3.42Å; G265-N267 VanDerWaalsContact O-N 3.12Å; G265-G268 PolarHBondContact O-N 2.93Å; G265-C269 WeakPolarHBondContact CA-O 3.4Å; G265-C269 PolarHBondContact N-O 3.45Å
266	R	70.8	Confident	86.2	Confident	84 Å²	84	26.5 Å²	26.5	32%	0.317	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-14.5	179.5	-57.6	179.4	-162.9	172.9	-2.5	113.4	G268 L471 T482 G483 D484	R266-G268 VanDerWaalsContact C-N 3.33Å; R266-L471 HydrophobicContact CB-CD1 4.07Å; R266-T482 PolarHBondContact NH2-O 3Å; R266-G483 VanDerWaalsContact NH1-C 3.31Å; R266-G483 PolarHBondContact NH1-O 2.7Å; R266-D484 IonicContact CZ-OD1 3.97Å; R266-D484 IonicContact NH1-OD1 3.85Å; R266-D484 IonicContact NH2-OD1 3.62Å; R266-D484 PolarHBondContact NH2-OD1 2.89Å; R266-D484 IonicContact NH2-OD2 3.02Å; R266-D484 PolarHBondContact NH2-OD2 3.48Å; R266-D484 VanDerWaalsContact NH2-OD2 3.1Å
267	N	71.2	Confident	86.4	Confident	80 Å²	80	26.9 Å²	26.9	43%	0.428	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-3.8	171.2	59.6	-7.9	0	0	0	112.9	G265 C269	G265-N267 PolarHBondContact O-N 3.42Å; G265-N267 VanDerWaalsContact O-N 3.12Å; N267-C269 VanDerWaalsContact C-N 3.34Å; N267-C269 PolarHBondContact OD1-N 3.21Å; N267-C269 PolarHBondContact OD1-O 3.33Å
268	G	73.9	Confident	86.5	Confident	46 Å²	46	31.3 Å²	31.3	47%	0.474	17%	0.169	S	C	.	.	S	Bend	trans	85.7	1.5	-177.4	0	0	0	0	0	114.5	G265 R266	G265-G268 PolarHBondContact O-N 2.93Å; R266-G268 VanDerWaalsContact C-N 3.33Å
269	C	75	Confident	86.6	Confident	72 Å²	72	31.3 Å²	31.3	49%	0.486	17%	0.169	S	C	.	.	S	Bend	trans	-98.3	133.8	173	-62.2	0	0	0	0	109.4	G265 N267	G265-C269 WeakPolarHBondContact CA-O 3.4Å; G265-C269 PolarHBondContact N-O 3.45Å; N267-C269 VanDerWaalsContact C-N 3.34Å; N267-C269 PolarHBondContact OD1-N 3.21Å; N267-C269 PolarHBondContact OD1-O 3.33Å
270	P	81.9	Confident	86.6	Confident	20 Å²	20	31.3 Å²	31.3	13%	0.13	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	149.5	172.1	-19.9	29.2	0	0	0	111.8	M174 L175 T263 M264	M174-P270 HydrophobicContact CE-CG 3.15Å; M174-P270 HydrophobicContact CG-CG 4.33Å; M174-P270 WeakPolarHBondContact SD-CD 3.24Å; M174-P270 HydrophobicContact SD-CG 3.67Å; L175-P270 HydrophobicContact CD2-CB 3.73Å; L175-P270 HydrophobicContact CD2-CG 3.84Å; T263-P270 CarbonylContact O-C 3.55Å; T263-P270 WeakPolarHBondContact O-CA 3.29Å; M264-P270 HydrophobicContact CE-CG 4.18Å; M264-P270 HydrophobicContact SD-CG 4.48Å
271	K	84.6	Confident	86.6	Confident	13 Å²	13	31.4 Å²	31.4	6%	0.057	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.1	169.3	-55.5	-179.3	-165.7	168.9	0	108.6	W262 T263 E407 T472	W262-K271 VanDerWaalsContact CA-O 3.24Å; W262-K271 WeakPolarHBondContact CA-O 3.49Å; T263-K271 PolarHBondContact N-O 3.16Å; T263-K271 PolarHBondContact O-N 2.86Å; K271-E407 IonicContact NZ-OE1 2.64Å; K271-E407 PolarHBondContact NZ-OE1 2.78Å; K271-T472 VanDerWaalsContact NZ-CB 3.32Å; K271-T472 PolarHBondContact NZ-OG1 3.49Å; K271-T472 VanDerWaalsContact NZ-OG1 3.12Å
272	M	89.4	Confident	86.6	Confident	24 Å²	24	31.6 Å²	31.6	12%	0.118	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	140.6	168.1	-172	166.2	56.9	0	0	109.5	D178 I182 T260 V261 W262 H274 P465	D178-M272 HydrophobicContact CB-SD 4.25Å; I182-M272 HydrophobicContact CG2-CE 4.17Å; I182-M272 HydrophobicContact CG2-SD 3.56Å; I182-M272 VanDerWaalsContact CG2-SD 3.56Å; T260-M272 HydrophobicContact CG2-CG 3.49Å; T260-M272 VanDerWaalsContact CG2-CG 3.49Å; T260-M272 HydrophobicContact CG2-SD 3.85Å; V261-M272 CarbonylContact O-C 3.57Å; W262-M272 HydrophobicContact CZ2-CG 4.26Å; W262-M272 HydrophobicContact CZ2-SD 4.05Å; M272-H274 WeakPolarHBondContact CE-NE2 3.2Å; M272-P465 HydrophobicContact CB-CG 4.08Å; M272-P465 WeakPolarHBondContact O-CD 3.15Å; M272-P465 WeakPolarHBondContact O-CG 3.46Å
273	V	91.9	Very high	86.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	121.8	176.6	-177.4	0	0	0	0	108.4	T260 V261 L275 C406 E407 A461	T260-V273 WeakPolarHBondContact CA-O 3.28Å; V261-V273 HydrophobicContact CG2-CB 3.99Å; V261-V273 PolarHBondContact N-O 2.88Å; V261-V273 PolarHBondContact O-N 3.26Å; V273-L275 HydrophobicContact CG1-CD2 3.95Å; V273-L275 HydrophobicContact CG1-CG 4.46Å; V273-C406 HydrophobicContact CG2-CB 4.35Å; V273-E407 HydrophobicContact CG2-CG 4.05Å; V273-A461 HydrophobicContact CG1-CB 3.86Å
274	H	93.1	Very high	87.3	Confident	24 Å²	24	29.8 Å²	29.8	11%	0.111	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	128.1	174.5	-59.5	-65	0	0	0	111.2	P257 T260 M272 C463	P257-H274 HydrophobicContact CB-CB 3.88Å; P257-H274 HydrophobicContact CG-CB 3.86Å; T260-H274 PolarHBondContact OG1-CE1 3.42Å; T260-H274 PolarHBondContact OG1-ND1 3.42Å; M272-H274 WeakPolarHBondContact CE-NE2 3.2Å; H274-C463 HydrophobicContact CB-CB 3.87Å
275	L	94.6	Very high	88	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	135.2	177.5	-54.7	177	0	0	0	108.8	V258 L259 V273 N279 L280 P308 T409 A461	V258-L275 WeakPolarHBondContact CG2-O 3.46Å; V258-L275 PolarHBondContact N-O 3.28Å; L259-L275 HydrophobicContact CB-CB 4.28Å; L259-L275 HydrophobicContact CD2-CD1 4.03Å; L259-L275 PolarHBondContact N-O 3.24Å; L259-L275 VanDerWaalsContact N-O 3.11Å; L259-L275 PolarHBondContact O-N 3.46Å; V273-L275 HydrophobicContact CG1-CD2 3.95Å; V273-L275 HydrophobicContact CG1-CG 4.46Å; L275-N279 HydrophobicContact CB-CB 4.47Å; L275-L280 HydrophobicContact CB-CD1 4.37Å; L275-L280 HydrophobicContact CB-CD2 4.45Å; L275-L280 HydrophobicContact CB-CG 4.22Å; L275-L280 HydrophobicContact CD1-CD2 4.04Å; L275-P308 HydrophobicContact CD1-CB 3.93Å; L275-T409 HydrophobicContact CD1-CG2 4.32Å; L275-T409 HydrophobicContact CD2-CG2 4.39Å; L275-A461 HydrophobicContact CD2-CB 3.9Å
276	T	93.3	Very high	89	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.012	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	167.8	-179.2	65.3	0	0	0	0	111.2	K278 N279 L280 Q462	T276-K278 PolarHBondContact O-N 3.15Å; T276-K278 PolarHBondContact OG1-N 2.99Å; T276-N279 PolarHBondContact N-OD1 2.84Å; T276-N279 WeakPolarHBondContact O-CB 3.31Å; T276-N279 PolarHBondContact O-N 3.43Å; T276-N279 VanDerWaalsContact O-N 3.14Å; T276-N279 PolarHBondContact OG1-N 2.93Å; T276-N279 VanDerWaalsContact OG1-N 3.12Å; T276-N279 PolarHBondContact OG1-OD1 3.01Å; T276-L280 PolarHBondContact O-N 3.03Å; T276-L280 VanDerWaalsContact O-N 3.16Å; T276-Q462 HydrophobicContact CG2-CB 4.43Å; T276-Q462 HydrophobicContact CG2-CG 4.41Å
277	N	92.7	Very high	90.1	Very high	19 Å²	19	22.3 Å²	22.3	10%	0.102	13%	0.13	C	C	.	.	H	α-helix	trans	-51.4	-46.5	169.4	-91.2	-49.9	0	0	0	111.2	L86 D161 V258 N279 L280 T281	L86-N277 WeakPolarHBondContact CB-OD1 3.35Å; L86-N277 PolarHBondContact N-OD1 3.17Å; D161-N277 PolarHBondContact OD1-ND2 2.99Å; V258-N277 HydrophobicContact CG1-CB 4.44Å; V258-N277 WeakPolarHBondContact CG1-ND2 3.38Å; N277-N279 VanDerWaalsContact C-N 3.34Å; N277-N279 PolarHBondContact O-N 3.24Å; N277-L280 PolarHBondContact O-N 3.15Å; N277-T281 WeakPolarHBondContact O-CB 3.12Å; N277-T281 PolarHBondContact O-N 3.09Å; N277-T281 PolarHBondContact O-OG1 3.49Å
278	K	92.3	Very high	91.2	Very high	136 Å²	136	22.8 Å²	22.8	59%	0.591	13%	0.125	S	C	*	.	H	α-helix	trans	-60.8	-43.2	179.1	-176	174.1	-178.8	177.4	0	111.6	T276 S282	T276-K278 PolarHBondContact O-N 3.15Å; T276-K278 PolarHBondContact OG1-N 2.99Å; K278-S282 WeakPolarHBondContact O-CB 3.36Å; K278-S282 PolarHBondContact O-N 2.8Å; K278-S282 PolarHBondContact O-OG 3.24Å
279	N	95.1	Very high	91.9	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.011	13%	0.126	C	C	.	.	H	α-helix	trans	-58.1	-54.3	179.2	-69.4	136	0	0	0	111.6	L275 T276 N277 S283 T409 P458 V460	L275-N279 HydrophobicContact CB-CB 4.47Å; T276-N279 PolarHBondContact N-OD1 2.84Å; T276-N279 WeakPolarHBondContact O-CB 3.31Å; T276-N279 PolarHBondContact O-N 3.43Å; T276-N279 VanDerWaalsContact O-N 3.14Å; T276-N279 PolarHBondContact OG1-N 2.93Å; T276-N279 VanDerWaalsContact OG1-N 3.12Å; T276-N279 PolarHBondContact OG1-OD1 3.01Å; N277-N279 VanDerWaalsContact C-N 3.34Å; N277-N279 PolarHBondContact O-N 3.24Å; N279-S283 WeakPolarHBondContact O-CB 3.4Å; N279-S283 PolarHBondContact O-N 2.93Å; N279-T409 HydrophobicContact CB-CG2 4.22Å; N279-T409 WeakPolarHBondContact CB-OG1 3.24Å; N279-P458 WeakPolarHBondContact CA-O 3.4Å; N279-P458 PolarHBondContact ND2-O 3.14Å; N279-V460 PolarHBondContact ND2-O 3.18Å
280	L	96	Very high	92.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-70.7	-45.2	-174.1	-67.1	167.8	0	0	0	112.3	L86 V258 L259 L275 T276 N277 S282 S283 I284 T312 T409	L86-L280 HydrophobicContact CD1-CB 4.11Å; L86-L280 HydrophobicContact CD2-CB 3.74Å; L86-L280 HydrophobicContact CD2-CD1 3.56Å; L86-L280 HydrophobicContact CD2-CG 4.25Å; L86-L280 HydrophobicContact CG-CB 4.38Å; V258-L280 HydrophobicContact CG2-CD1 3.69Å; L259-L280 HydrophobicContact CB-CD1 3.85Å; L259-L280 HydrophobicContact CD2-CD1 4.12Å; L259-L280 HydrophobicContact CD2-CD2 4.16Å; L275-L280 HydrophobicContact CB-CD1 4.37Å; L275-L280 HydrophobicContact CB-CD2 4.45Å; L275-L280 HydrophobicContact CB-CG 4.22Å; L275-L280 HydrophobicContact CD1-CD2 4.04Å; T276-L280 PolarHBondContact O-N 3.03Å; T276-L280 VanDerWaalsContact O-N 3.16Å; N277-L280 PolarHBondContact O-N 3.15Å; L280-S282 VanDerWaalsContact C-N 3.31Å; L280-S282 PolarHBondContact O-N 3.35Å; L280-S283 WeakPolarHBondContact O-CB 3.38Å; L280-S283 PolarHBondContact O-N 3.46Å; L280-S283 VanDerWaalsContact O-N 3.17Å; L280-I284 WeakPolarHBondContact O-CG1 3.45Å; L280-I284 PolarHBondContact O-N 3.3Å; L280-T312 HydrophobicContact CD2-CG2 3.78Å; L280-T409 HydrophobicContact CD2-CG2 3.9Å
281	T	94.8	Very high	93	Very high	4 Å²	4	24.1 Å²	24.1	3%	0.025	12%	0.115	C	C	.	.	H	α-helix	trans	-62.3	-40.5	177.3	-55.9	0	0	0	0	111.2	P82 L86 F89 N277 S283 I284 C285	P82-T281 HydrophobicContact CG-CG2 3.69Å; L86-T281 WeakPolarHBondContact CA-OG1 3.43Å; L86-T281 PolarHBondContact N-OG1 3.48Å; F89-T281 HydrophobicContact CB-CG2 4.33Å; F89-T281 HydrophobicContact CD1-CG2 4.43Å; F89-T281 HydrophobicContact CG-CG2 4.21Å; N277-T281 WeakPolarHBondContact O-CB 3.12Å; N277-T281 PolarHBondContact O-N 3.09Å; N277-T281 PolarHBondContact O-OG1 3.49Å; T281-S283 PolarHBondContact O-N 3.18Å; T281-I284 VanDerWaalsContact O-CG1 3.25Å; T281-I284 WeakPolarHBondContact O-CG1 3.33Å; T281-C285 WeakPolarHBondContact O-CB 3.29Å; T281-C285 PolarHBondContact O-N 3.38Å; T281-C285 VanDerWaalsContact O-N 3.13Å; T281-C285 PolarHBondContact O-SG 2.74Å
282	S	95.4	Very high	93.3	Very high	4 Å²	4	30.6 Å²	30.6	3%	0.028	15%	0.145	C	C	.	.	H	α-helix	trans	-63.1	-44	174.7	-54.4	0	0	0	0	111.2	L81 K278 L280 I284 C285 L286 P458	L81-S282 WeakPolarHBondContact CD1-OG 3.35Å; K278-S282 WeakPolarHBondContact O-CB 3.36Å; K278-S282 PolarHBondContact O-N 2.8Å; K278-S282 PolarHBondContact O-OG 3.24Å; L280-S282 VanDerWaalsContact C-N 3.31Å; L280-S282 PolarHBondContact O-N 3.35Å; S282-I284 PolarHBondContact O-N 2.84Å; S282-C285 PolarHBondContact O-N 3.42Å; S282-L286 WeakPolarHBondContact O-CB 3.34Å; S282-L286 WeakPolarHBondContact O-CG 3.44Å; S282-L286 PolarHBondContact O-N 2.76Å; S282-P458 WeakPolarHBondContact OG-CB 3.3Å
283	S	96.7	Very high	93.5	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.007	14%	0.142	C	C	.	.	H	α-helix	trans	-56.6	-52.4	179.3	-168.4	0	0	0	0	111.9	N279 L280 T281 C285 L286 I287 S410 L459	N279-S283 WeakPolarHBondContact O-CB 3.4Å; N279-S283 PolarHBondContact O-N 2.93Å; L280-S283 WeakPolarHBondContact O-CB 3.38Å; L280-S283 PolarHBondContact O-N 3.46Å; L280-S283 VanDerWaalsContact O-N 3.17Å; T281-S283 PolarHBondContact O-N 3.18Å; S283-C285 PolarHBondContact O-N 3.12Å; S283-L286 PolarHBondContact O-N 3.45Å; S283-I287 WeakPolarHBondContact O-CB 3.43Å; S283-I287 VanDerWaalsContact O-CD1 3.3Å; S283-I287 WeakPolarHBondContact O-CD1 3.31Å; S283-I287 WeakPolarHBondContact O-CG1 3.29Å; S283-I287 PolarHBondContact O-N 3.33Å; S283-I287 WeakPolarHBondContact OG-CD1 3.33Å; S283-S410 WeakPolarHBondContact OG-CB 3.43Å; S283-L459 VanDerWaalsContact CA-CD2 3.42Å
284	I	96.3	Very high	93.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-68	-35.9	-176.6	62.5	-175.7	0	0	0	111.9	L86 F89 L90 L280 T281 S282 R288 T312 Y316 I320	L86-I284 HydrophobicContact CD1-CD1 3.56Å; F89-I284 HydrophobicContact CD1-CD1 3.38Å; F89-I284 HydrophobicContact CD1-CG1 4.22Å; F89-I284 HydrophobicContact CE1-CD1 3.49Å; F89-I284 VanDerWaalsContact CE1-CD1 3.49Å; F89-I284 HydrophobicContact CE1-CG1 3.91Å; L90-I284 HydrophobicContact CD2-CD1 4.2Å; L280-I284 WeakPolarHBondContact O-CG1 3.45Å; L280-I284 PolarHBondContact O-N 3.3Å; T281-I284 VanDerWaalsContact O-CG1 3.25Å; T281-I284 WeakPolarHBondContact O-CG1 3.33Å; S282-I284 PolarHBondContact O-N 2.84Å; I284-R288 VanDerWaalsContact O-CB 3.25Å; I284-R288 WeakPolarHBondContact O-CB 3.19Å; I284-R288 PolarHBondContact O-N 3.45Å; I284-T312 HydrophobicContact CG2-CG2 4.41Å; I284-Y316 HydrophobicContact CG2-CD2 4.07Å; I284-Y316 HydrophobicContact CG2-CG 4.37Å; I284-I320 HydrophobicContact CB-CD1 4.21Å; I284-I320 HydrophobicContact CG1-CD1 4.48Å
285	C	95.2	Very high	93.6	Very high	20 Å²	20	35.2 Å²	35.2	14%	0.135	17%	0.174	C	C	.	.	H	α-helix	trans	-63.8	-46	174.1	-71.4	0	0	0	0	111.7	L81 P82 T281 S282 S283 R288 Q289	L81-C285 HydrophobicContact CD2-CB 3.81Å; P82-C285 VanDerWaalsContact CD-SG 3.52Å; T281-C285 WeakPolarHBondContact O-CB 3.29Å; T281-C285 PolarHBondContact O-N 3.38Å; T281-C285 VanDerWaalsContact O-N 3.13Å; T281-C285 PolarHBondContact O-SG 2.74Å; S282-C285 PolarHBondContact O-N 3.42Å; S283-C285 PolarHBondContact O-N 3.12Å; C285-R288 PolarHBondContact O-N 3.01Å; C285-Q289 WeakPolarHBondContact O-CG 3.45Å; C285-Q289 PolarHBondContact O-N 3.07Å
286	L	95.2	Very high	93.6	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-69.1	-40.7	-179	-66.4	176	0	0	0	112.1	I79 L81 S282 S283 Q289 V290 L429 P430 N431 L459	I79-L286 HydrophobicContact CD1-CD2 4.46Å; L81-L286 HydrophobicContact CD2-CD2 4.48Å; L81-L286 HydrophobicContact CD2-CG 4.48Å; S282-L286 WeakPolarHBondContact O-CB 3.34Å; S282-L286 WeakPolarHBondContact O-CG 3.44Å; S282-L286 PolarHBondContact O-N 2.76Å; S283-L286 PolarHBondContact O-N 3.45Å; L286-Q289 WeakPolarHBondContact O-CB 3.46Å; L286-Q289 PolarHBondContact O-N 2.98Å; L286-V290 PolarHBondContact O-N 2.85Å; L286-L429 HydrophobicContact CB-CD1 4.35Å; L286-P430 WeakPolarHBondContact CD1-O 3.46Å; L286-P430 HydrophobicContact CD2-CB 3.74Å; L286-P430 HydrophobicContact CD2-CG 4.26Å; L286-P430 WeakPolarHBondContact CD2-O 3.3Å; L286-N431 HydrophobicContact CD1-CB 4.42Å; L286-N431 HydrophobicContact CD2-CB 4.46Å; L286-L459 HydrophobicContact CD1-CD1 4.08Å; L286-L459 HydrophobicContact CD1-CD2 4.06Å; L286-L459 HydrophobicContact CD1-CG 4.09Å
287	I	94.5	Very high	93.8	Very high	1 Å²	1	42 Å²	42	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-62.9	-43.4	175.3	-69.6	160.1	0	0	0	110.4	S283 Q289 V290 T291 L313 N317 I411	S283-I287 WeakPolarHBondContact O-CB 3.43Å; S283-I287 VanDerWaalsContact O-CD1 3.3Å; S283-I287 WeakPolarHBondContact O-CD1 3.31Å; S283-I287 WeakPolarHBondContact O-CG1 3.29Å; S283-I287 PolarHBondContact O-N 3.33Å; S283-I287 WeakPolarHBondContact OG-CD1 3.33Å; I287-Q289 VanDerWaalsContact C-N 3.27Å; I287-Q289 PolarHBondContact O-N 3.46Å; I287-V290 PolarHBondContact O-N 3.1Å; I287-V290 VanDerWaalsContact O-N 3.12Å; I287-T291 HydrophobicContact CG2-CG2 3.88Å; I287-T291 WeakPolarHBondContact O-CB 3.42Å; I287-T291 WeakPolarHBondContact O-CG2 3.32Å; I287-T291 PolarHBondContact O-N 3.32Å; I287-T291 PolarHBondContact O-OG1 3.05Å; I287-L313 HydrophobicContact CD1-CD2 3.6Å; I287-L313 HydrophobicContact CD1-CG 4.3Å; I287-L313 HydrophobicContact CG1-CD2 3.91Å; I287-L313 HydrophobicContact CG2-CD2 4.17Å; I287-N317 HydrophobicContact CG2-CB 4.27Å; I287-N317 WeakPolarHBondContact CG2-ND2 3.44Å; I287-I411 HydrophobicContact CG1-CD1 4.44Å; I287-I411 HydrophobicContact CG1-CG1 4.31Å
288	R	92.9	Very high	94.1	Very high	89 Å²	89	46.1 Å²	46.1	34%	0.336	22%	0.224	S	C	.	.	H	α-helix	trans	-59.9	-36.7	177.6	-174	177.1	177.5	-179.5	3.9	112.6	I284 C285 V290 T291 Q292 I320	I284-R288 VanDerWaalsContact O-CB 3.25Å; I284-R288 WeakPolarHBondContact O-CB 3.19Å; I284-R288 PolarHBondContact O-N 3.45Å; C285-R288 PolarHBondContact O-N 3.01Å; R288-V290 VanDerWaalsContact C-N 3.29Å; R288-V290 PolarHBondContact O-N 2.92Å; R288-T291 WeakPolarHBondContact CA-OG1 3.5Å; R288-Q292 WeakPolarHBondContact O-CA 3.5Å; R288-Q292 PolarHBondContact O-N 3.43Å; R288-I320 HydrophobicContact CB-CD1 4.46Å
289	Q	89.4	Confident	94.3	Very high	104 Å²	104	39.6 Å²	39.6	49%	0.486	20%	0.196	S	C	.	.	H	α-helix	trans	-64.6	-33.2	176.8	-71	-68.1	-36.2	0	0	113	I79 C285 L286 I287 Q292	I79-Q289 HydrophobicContact CD1-CB 4.41Å; I79-Q289 HydrophobicContact CD1-CG 3.97Å; C285-Q289 WeakPolarHBondContact O-CG 3.45Å; C285-Q289 PolarHBondContact O-N 3.07Å; L286-Q289 WeakPolarHBondContact O-CB 3.46Å; L286-Q289 PolarHBondContact O-N 2.98Å; I287-Q289 VanDerWaalsContact C-N 3.27Å; I287-Q289 PolarHBondContact O-N 3.46Å; Q289-Q292 VanDerWaalsContact O-CG 3.24Å; Q289-Q292 WeakPolarHBondContact O-CG 3.37Å; Q289-Q292 PolarHBondContact O-NE2 3Å; Q289-Q292 VanDerWaalsContact O-NE2 3.1Å
290	V	87.4	Confident	94.5	Very high	49 Å²	49	39.5 Å²	39.5	30%	0.297	20%	0.196	S	C	.	.	H	α-helix	trans	-85.2	-43.3	179.7	175.2	0	0	0	0	111.8	L286 I287 R288 I414 L429	L286-V290 PolarHBondContact O-N 2.85Å; I287-V290 PolarHBondContact O-N 3.1Å; I287-V290 VanDerWaalsContact O-N 3.12Å; R288-V290 VanDerWaalsContact C-N 3.29Å; R288-V290 PolarHBondContact O-N 2.92Å; V290-I414 HydrophobicContact CG1-CD1 3.98Å; V290-I414 HydrophobicContact CG1-CG2 3.93Å; V290-L429 HydrophobicContact CG2-CD2 3.61Å
291	T	91.6	Very high	94.5	Very high	13 Å²	13	39.5 Å²	39.5	8%	0.08	20%	0.196	C	C	.	.	H	α-helix	trans	-76.6	-35	-175.9	51.4	0	0	0	0	112.7	I287 R288 F293 N317 F376	I287-T291 HydrophobicContact CG2-CG2 3.88Å; I287-T291 WeakPolarHBondContact O-CB 3.42Å; I287-T291 WeakPolarHBondContact O-CG2 3.32Å; I287-T291 PolarHBondContact O-N 3.32Å; I287-T291 PolarHBondContact O-OG1 3.05Å; R288-T291 WeakPolarHBondContact CA-OG1 3.5Å; T291-F293 HydrophobicContact CG2-CE1 4.09Å; T291-F293 HydrophobicContact CG2-CE2 4.01Å; T291-F293 HydrophobicContact CG2-CZ 3.68Å; T291-F293 WeakPolarHBondContact O-CD1 3.38Å; T291-F293 PolarHBondContact O-N 3.27Å; T291-F293 VanDerWaalsContact O-N 3.08Å; T291-N317 PolarHBondContact OG1-ND2 3.24Å; T291-N317 VanDerWaalsContact OG1-ND2 3.07Å; T291-F376 HydrophobicContact CG2-CE1 4.24Å; T291-F376 HydrophobicContact CG2-CZ 4.06Å
292	Q	90.5	Very high	94.5	Very high	149 Å²	149	39.5 Å²	39.5	70%	0.696	20%	0.195	S	C	*	.			trans	49.9	34.5	178.1	-56.2	-174.8	8.3	0	0	113.7	R288 Q289	R288-Q292 WeakPolarHBondContact O-CA 3.5Å; R288-Q292 PolarHBondContact O-N 3.43Å; Q289-Q292 VanDerWaalsContact O-CG 3.24Å; Q289-Q292 WeakPolarHBondContact O-CG 3.37Å; Q289-Q292 PolarHBondContact O-NE2 3Å; Q289-Q292 VanDerWaalsContact O-NE2 3.1Å
293	F	94.4	Very high	94.4	Very high	14 Å²	14	39.5 Å²	39.5	6%	0.061	20%	0.195	C	C	.	.			trans	-62.3	146.1	179.8	-60.1	-27.4	0	0	0	111.6	T291 V297 I299 N317 C323 V347 F349 M374 F376	T291-F293 HydrophobicContact CG2-CE1 4.09Å; T291-F293 HydrophobicContact CG2-CE2 4.01Å; T291-F293 HydrophobicContact CG2-CZ 3.68Å; T291-F293 WeakPolarHBondContact O-CD1 3.38Å; T291-F293 PolarHBondContact O-N 3.27Å; T291-F293 VanDerWaalsContact O-N 3.08Å; F293-V297 HydrophobicContact CB-CB 4.49Å; F293-V297 HydrophobicContact CB-CG2 4.26Å; F293-V297 HydrophobicContact CD1-CG1 4.32Å; F293-V297 HydrophobicContact CG-CG1 4.41Å; F293-I299 HydrophobicContact CD2-CD1 3.61Å; F293-I299 HydrophobicContact CE2-CD1 3.62Å; F293-I299 HydrophobicContact CG-CD1 4.48Å; F293-I299 HydrophobicContact CZ-CD1 4.49Å; F293-N317 WeakPolarHBondContact CD2-ND2 3.01Å; F293-N317 VanDerWaalsContact CE2-ND2 3.3Å; F293-N317 WeakPolarHBondContact CE2-ND2 3.32Å; F293-C323 VanDerWaalsContact CB-SG 3.59Å; F293-V347 HydrophobicContact CE1-CG1 4.17Å; F293-V347 HydrophobicContact CE1-CG2 4.03Å; F293-V347 HydrophobicContact CZ-CG1 3.82Å; F293-V347 HydrophobicContact CZ-CG2 4.42Å; F293-F349 HydrophobicContact CE2-CE2 4.3Å; F293-F349 HydrophobicContact CE2-CZ 4.02Å; F293-F349 HydrophobicContact CZ-CE2 4.44Å; F293-F349 AromaticContact CZ-CZ 3.96Å; F293-F349 HydrophobicContact CZ-CZ 3.96Å; F293-M374 HydrophobicContact CD1-CE 4.37Å; F293-M374 HydrophobicContact CE1-CE 4.15Å; F293-F376 HydrophobicContact CE1-CE2 4.36Å; F293-F376 HydrophobicContact CZ-CE2 4.14Å; F293-F376 HydrophobicContact CZ-CZ 4.4Å
294	D	92.6	Very high	94.3	Very high	71 Å²	71	41.3 Å²	41.3	38%	0.38	21%	0.207	S	C	.	.			trans	-115.8	168	172.5	77	79.9	0	0	0	111.1	N296 V297 C323	D294-N296 PolarHBondContact O-N 3.44Å; D294-N296 VanDerWaalsContact OD1-CB 3.24Å; D294-N296 WeakPolarHBondContact OD1-CB 3.41Å; D294-N296 PolarHBondContact OD1-N 2.84Å; D294-N296 PolarHBondContact OD1-ND2 3.33Å; D294-V297 WeakPolarHBondContact O-CB 3.47Å; D294-V297 WeakPolarHBondContact O-CG2 3.28Å; D294-V297 PolarHBondContact O-N 3.28Å; D294-C323 PolarHBondContact O-SG 3.05Å
295	P	95.1	Very high	94.2	Very high	60 Å²	60	41.3 Å²	41.3	39%	0.39	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.1	-175.3	-26.8	36.3	0	0	0	116.2	Q101 V297 G322	Q101-P295 PolarHBondContact NE2-O 2.8Å; P295-V297 VanDerWaalsContact C-N 3.32Å; P295-G322 WeakPolarHBondContact CA-O 3.48Å
296	N	95.1	Very high	94.1	Very high	136 Å²	136	43 Å²	43	73%	0.727	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-14.9	177.4	-55.7	-66.9	0	0	0	112.8	D294 R298	D294-N296 PolarHBondContact O-N 3.44Å; D294-N296 VanDerWaalsContact OD1-CB 3.24Å; D294-N296 WeakPolarHBondContact OD1-CB 3.41Å; D294-N296 PolarHBondContact OD1-N 2.84Å; D294-N296 PolarHBondContact OD1-ND2 3.33Å; N296-R298 PolarHBondContact O-N 3.48Å
297	V	96.8	Very high	94	Very high	8 Å²	8	45.1 Å²	45.1	5%	0.048	22%	0.221	C	C	.	.			trans	-67	129.7	-178.5	179.8	0	0	0	0	110.2	F293 D294 P295 I299 C323 R324 V347	F293-V297 HydrophobicContact CB-CB 4.49Å; F293-V297 HydrophobicContact CB-CG2 4.26Å; F293-V297 HydrophobicContact CD1-CG1 4.32Å; F293-V297 HydrophobicContact CG-CG1 4.41Å; D294-V297 WeakPolarHBondContact O-CB 3.47Å; D294-V297 WeakPolarHBondContact O-CG2 3.28Å; D294-V297 PolarHBondContact O-N 3.28Å; P295-V297 VanDerWaalsContact C-N 3.32Å; V297-I299 HydrophobicContact CG1-CD1 4.3Å; V297-I299 HydrophobicContact CG1-CG1 3.76Å; V297-C323 HydrophobicContact CB-CB 4.48Å; V297-C323 WeakPolarHBondContact O-CB 3.26Å; V297-R324 PolarHBondContact O-N 2.9Å; V297-V347 HydrophobicContact CG1-CB 4.21Å; V297-V347 HydrophobicContact CG1-CG2 3.53Å
298	R	98.1	Very high	94	Very high	106 Å²	106	45.1 Å²	45.1	40%	0.4	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	118.4	172.7	-59.8	-171.9	178.7	141.2	-4.7	109.8	N296 R324 D343 Q344 I345 S346 V347	N296-R298 PolarHBondContact O-N 3.48Å; R298-R324 WeakPolarHBondContact CA-O 3.24Å; R298-R324 HydrophobicContact CG-CB 4.34Å; R298-D343 WeakPolarHBondContact CD-O 3.42Å; R298-Q344 WeakPolarHBondContact CD-O 3.46Å; R298-Q344 VanDerWaalsContact NH1-CB 3.31Å; R298-I345 HydrophobicContact CB-CD1 4.42Å; R298-S346 PolarHBondContact N-OG 3.37Å; R298-S346 PolarHBondContact O-N 2.86Å; R298-V347 PolarHBondContact O-N 3.13Å
299	I	98.1	Very high	94.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	135.1	-171.2	-57.8	174.7	0	0	0	109.5	F293 V297 C323 R324 L325 T326 V347 F349	F293-I299 HydrophobicContact CD2-CD1 3.61Å; F293-I299 HydrophobicContact CE2-CD1 3.62Å; F293-I299 HydrophobicContact CG-CD1 4.48Å; F293-I299 HydrophobicContact CZ-CD1 4.49Å; V297-I299 HydrophobicContact CG1-CD1 4.3Å; V297-I299 HydrophobicContact CG1-CG1 3.76Å; I299-C323 HydrophobicContact CD1-CB 3.83Å; I299-C323 HydrophobicContact CG1-CB 4.36Å; I299-R324 PolarHBondContact N-O 2.95Å; I299-L325 HydrophobicContact CB-CD1 4.04Å; I299-L325 HydrophobicContact CG2-CD1 3.79Å; I299-T326 PolarHBondContact O-N 3.01Å; I299-V347 CarbonylContact C-O 3.44Å; I299-V347 WeakPolarHBondContact CA-O 3.39Å; I299-V347 HydrophobicContact CG1-CB 4.28Å; I299-F349 HydrophobicContact CG2-CD2 3.96Å; I299-F349 HydrophobicContact CG2-CE2 3.83Å
300	L	97.8	Very high	94.5	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116.8	166.8	-179.6	53.6	0	0	0	110.3	L302 T326 L328 F336 C339 I345 V347 C348 F349	L300-L302 HydrophobicContact CD1-CD2 4.09Å; L300-L302 HydrophobicContact CD2-CD2 3.95Å; L300-L302 HydrophobicContact CG-CD2 3.73Å; L300-L302 HydrophobicContact CG-CG 4.22Å; L300-T326 WeakPolarHBondContact CA-O 3.28Å; L300-T326 WeakPolarHBondContact CD1-O 3.4Å; L300-L328 HydrophobicContact CD1-CD2 4.13Å; L300-L328 HydrophobicContact CD1-CG 4.11Å; L300-F336 HydrophobicContact CD2-CD2 3.51Å; L300-F336 HydrophobicContact CD2-CE2 3.95Å; L300-F336 HydrophobicContact CD2-CG 4.43Å; L300-C339 HydrophobicContact CD2-CB 4.17Å; L300-I345 HydrophobicContact CB-CB 4.46Å; L300-I345 HydrophobicContact CB-CD1 3.95Å; L300-I345 HydrophobicContact CB-CG1 4.01Å; L300-I345 HydrophobicContact CB-CG2 3.63Å; L300-I345 HydrophobicContact CD2-CG1 4.34Å; L300-V347 PolarHBondContact N-O 2.97Å; L300-C348 HydrophobicContact CB-CB 4.24Å; L300-C348 WeakPolarHBondContact O-CA 3.47Å; L300-F349 PolarHBondContact O-N 3.17Å; L300-F349 VanDerWaalsContact O-N 3.15Å
301	D	96.2	Very high	95	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	118.2	171.9	-164.9	1.7	0	0	0	111.2	L303 S310 S314 L325 T326 M327	D301-L303 WeakPolarHBondContact OD1-CB 3.18Å; D301-L303 VanDerWaalsContact OD1-CG 3.29Å; D301-L303 WeakPolarHBondContact OD1-CG 3.48Å; D301-L303 PolarHBondContact OD1-N 2.83Å; D301-S310 WeakPolarHBondContact OD2-CB 3.46Å; D301-S310 PolarHBondContact OD2-OG 3.37Å; D301-S314 VanDerWaalsContact CB-OG 3.31Å; D301-S314 WeakPolarHBondContact CB-OG 3.35Å; D301-S314 WeakPolarHBondContact OD2-CB 3.36Å; D301-L325 HydrophobicContact CB-CD1 4.04Å; D301-T326 PolarHBondContact N-O 3.46Å; D301-M327 HydrophobicContact CB-CE 4.08Å; D301-M327 HydrophobicContact CB-CG 4.02Å; D301-M327 WeakPolarHBondContact OD2-CE 3.46Å
302	L	95.2	Very high	95.2	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.021	16%	0.164	C	C	.	.			trans	-103.1	14.4	175	-52.6	176.2	0	0	0	111.9	L300 L328 V331 F336 F349 A350 I354	L300-L302 HydrophobicContact CD1-CD2 4.09Å; L300-L302 HydrophobicContact CD2-CD2 3.95Å; L300-L302 HydrophobicContact CG-CD2 3.73Å; L300-L302 HydrophobicContact CG-CG 4.22Å; L302-L328 HydrophobicContact CD2-CD1 3.51Å; L302-L328 HydrophobicContact CD2-CG 4.04Å; L302-V331 HydrophobicContact CB-CG1 3.95Å; L302-V331 HydrophobicContact CD2-CG1 4.36Å; L302-V331 WeakPolarHBondContact O-CG2 3.08Å; L302-F336 HydrophobicContact CD1-CD2 3.64Å; L302-F336 HydrophobicContact CD1-CE2 4.25Å; L302-F336 HydrophobicContact CD1-CG 4.42Å; L302-F336 HydrophobicContact CD2-CB 4.48Å; L302-F336 HydrophobicContact CD2-CD2 4.23Å; L302-F336 HydrophobicContact CG-CD2 4.44Å; L302-F349 VanDerWaalsContact CB-O 3.32Å; L302-F349 WeakPolarHBondContact CB-O 3.46Å; L302-F349 PolarHBondContact N-O 3.04Å; L302-A350 HydrophobicContact CD1-CB 3.96Å; L302-I354 HydrophobicContact CD1-CB 4.46Å; L302-I354 HydrophobicContact CD1-CG1 4.35Å; L302-I354 HydrophobicContact CD1-CG2 3.84Å
303	L	93.8	Very high	95.5	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.016	13%	0.131	C	C	.	.	S	Bend	trans	-99.7	152.1	179.7	-51.7	178	0	0	0	110.9	N146 D301 F309 F349 I351 V378	N146-L303 PolarHBondContact ND2-O 3.39Å; N146-L303 VanDerWaalsContact ND2-O 3.12Å; D301-L303 WeakPolarHBondContact OD1-CB 3.18Å; D301-L303 VanDerWaalsContact OD1-CG 3.29Å; D301-L303 WeakPolarHBondContact OD1-CG 3.48Å; D301-L303 PolarHBondContact OD1-N 2.83Å; L303-F309 HydrophobicContact CD1-CB 3.84Å; L303-F349 HydrophobicContact CD1-CB 4.2Å; L303-F349 HydrophobicContact CG-CB 4.42Å; L303-I351 HydrophobicContact CD2-CG2 3.87Å; L303-V378 HydrophobicContact CD1-CG2 3.84Å; L303-V378 HydrophobicContact CD2-CG2 3.92Å; L303-V378 HydrophobicContact CG-CG2 4.45Å
304	P	93.4	Very high	95.6	Very high	39 Å²	39	25.4 Å²	25.4	25%	0.253	13%	0.128	S	C	.	.			trans	-73.1	135.9	172.8	26.9	-31.1	0	0	0	111.5	N146 Y306 H307 S310	N146-P304 WeakPolarHBondContact OD1-CA 3.43Å; P304-Y306 HydrophobicContact CB-CD1 3.95Å; P304-Y306 HydrophobicContact CB-CD2 3.98Å; P304-Y306 HydrophobicContact CB-CE1 3.52Å; P304-Y306 HydrophobicContact CB-CE2 3.55Å; P304-Y306 HydrophobicContact CB-CG 4.16Å; P304-Y306 HydrophobicContact CG-CD2 4.18Å; P304-Y306 HydrophobicContact CG-CE1 4.44Å; P304-Y306 HydrophobicContact CG-CE2 3.59Å; P304-Y306 PolarHBondContact O-N 2.94Å; P304-Y306 VanDerWaalsContact O-N 3.11Å; P304-H307 HydrophobicContact CG-CB 4.04Å; P304-H307 WeakPolarHBondContact O-CB 3.45Å; P304-H307 PolarHBondContact O-N 3.39Å; P304-S310 VanDerWaalsContact O-CB 3.24Å; P304-S310 WeakPolarHBondContact O-CB 3.2Å
305	L	94.4	Very high	95.8	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.7	178.3	-81.9	179.6	0	0	0	113.7	N146 V150 V151 H307 L311 V315 M327	N146-L305 WeakPolarHBondContact OD1-CG 3.38Å; N146-L305 PolarHBondContact OD1-N 3.09Å; V150-L305 HydrophobicContact CB-CD1 4.02Å; V150-L305 HydrophobicContact CG1-CD1 3.98Å; V151-L305 HydrophobicContact CG2-CD1 4.21Å; V151-L305 HydrophobicContact CG2-CD2 4.05Å; L305-H307 PolarHBondContact O-N 3.3Å; L305-L311 HydrophobicContact CD2-CD2 4.06Å; L305-V315 HydrophobicContact CD2-CG2 3.67Å; L305-M327 HydrophobicContact CD1-CE 4.48Å; L305-M327 HydrophobicContact CD1-SD 4.31Å; L305-M327 HydrophobicContact CD2-CE 3.6Å; L305-M327 HydrophobicContact CD2-SD 3.68Å; L305-M327 HydrophobicContact CG-CE 3.61Å; L305-M327 HydrophobicContact CG-SD 3.96Å
306	Y	93.7	Very high	95.9	Very high	54 Å²	54	19.3 Å²	19.3	21%	0.212	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-4.3	176.9	56.9	-110.9	0	0	0	113.9	M167 N168 P304	M167-Y306 VanDerWaalsContact C-CB 3.48Å; N168-Y306 HydrophobicContact CB-CD2 4.16Å; N168-Y306 HydrophobicContact CB-CE1 4.22Å; N168-Y306 HydrophobicContact CB-CE2 3.82Å; N168-Y306 PolarHBondContact ND2-OH 2.94Å; N168-Y306 VanDerWaalsContact ND2-OH 3.15Å; P304-Y306 HydrophobicContact CB-CD1 3.95Å; P304-Y306 HydrophobicContact CB-CD2 3.98Å; P304-Y306 HydrophobicContact CB-CE1 3.52Å; P304-Y306 HydrophobicContact CB-CE2 3.55Å; P304-Y306 HydrophobicContact CB-CG 4.16Å; P304-Y306 HydrophobicContact CG-CD2 4.18Å; P304-Y306 HydrophobicContact CG-CE1 4.44Å; P304-Y306 HydrophobicContact CG-CE2 3.59Å; P304-Y306 PolarHBondContact O-N 2.94Å; P304-Y306 VanDerWaalsContact O-N 3.11Å
307	H	93.4	Very high	96	Very high	47 Å²	47	12.8 Å²	12.8	22%	0.218	6%	0.057	C	C	.	.	S	Bend	trans	-101.3	132.5	174.4	-165.4	-86.5	0	0	0	110.1	P304 L305 F309 S310 C406	P304-H307 HydrophobicContact CG-CB 4.04Å; P304-H307 WeakPolarHBondContact O-CB 3.45Å; P304-H307 PolarHBondContact O-N 3.39Å; L305-H307 PolarHBondContact O-N 3.3Å; H307-F309 AromaticContact CE1-CD1 3.5Å; H307-F309 AromaticContact CE1-CD2 3.62Å; H307-F309 AromaticContact CE1-CE1 3.86Å; H307-F309 AromaticContact CE1-CE2 3.99Å; H307-F309 AromaticContact CE1-CG 3.35Å; H307-F309 WeakPolarHBondContact CE1-CG 3.5Å; H307-F309 VanDerWaalsContact ND1-CB 3.32Å; H307-F309 WeakPolarHBondContact ND1-CB 3.49Å; H307-F309 AromaticContact ND1-CD1 3.77Å; H307-F309 AromaticContact ND1-CD2 3.97Å; H307-F309 AromaticContact ND1-CG 3.41Å; H307-F309 WeakPolarHBondContact ND1-CG 3.36Å; H307-F309 PolarHBondContact ND1-N 2.95Å; H307-F309 PolarHBondContact O-N 3.48Å; H307-S310 WeakPolarHBondContact O-CB 3.4Å; H307-S310 PolarHBondContact O-N 2.79Å; H307-C406 PolarHBondContact NE2-SG 2.82Å; H307-C406 VanDerWaalsContact NE2-SG 3.36Å
308	P	94.9	Very high	96	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-65	-17.2	-174.1	28.1	-37	0	0	0	113.5	V261 L275 L311 T312 C406 T409	V261-P308 HydrophobicContact CG2-CG 4.23Å; L275-P308 HydrophobicContact CD1-CB 3.93Å; P308-L311 PolarHBondContact O-N 3.33Å; P308-T312 WeakPolarHBondContact O-CB 3.19Å; P308-T312 WeakPolarHBondContact O-CG2 3.24Å; P308-T312 PolarHBondContact O-N 3.36Å; P308-T312 PolarHBondContact O-OG1 3.21Å; P308-C406 VanDerWaalsContact CD-SG 3.53Å; P308-C406 HydrophobicContact CG-CB 4Å; P308-C406 WeakPolarHBondContact CG-SG 3.48Å; P308-T409 WeakPolarHBondContact CB-O 3.41Å
309	F	95.5	Very high	96	Very high	3 Å²	3	7.4 Å²	7.4	1%	0.013	4%	0.036	C	C	.	.	H	α-helix	trans	-65.9	-43.4	172.6	-69.9	11.9	0	0	0	112	L303 H307 L311 T312 L313 V378 A379	L303-F309 HydrophobicContact CD1-CB 3.84Å; H307-F309 AromaticContact CE1-CD1 3.5Å; H307-F309 AromaticContact CE1-CD2 3.62Å; H307-F309 AromaticContact CE1-CE1 3.86Å; H307-F309 AromaticContact CE1-CE2 3.99Å; H307-F309 AromaticContact CE1-CG 3.35Å; H307-F309 WeakPolarHBondContact CE1-CG 3.5Å; H307-F309 VanDerWaalsContact ND1-CB 3.32Å; H307-F309 WeakPolarHBondContact ND1-CB 3.49Å; H307-F309 AromaticContact ND1-CD1 3.77Å; H307-F309 AromaticContact ND1-CD2 3.97Å; H307-F309 AromaticContact ND1-CG 3.41Å; H307-F309 WeakPolarHBondContact ND1-CG 3.36Å; H307-F309 PolarHBondContact ND1-N 2.95Å; H307-F309 PolarHBondContact O-N 3.48Å; F309-L311 VanDerWaalsContact C-N 3.28Å; F309-L311 PolarHBondContact O-N 2.81Å; F309-T312 PolarHBondContact O-N 2.98Å; F309-L313 HydrophobicContact CB-CD1 3.84Å; F309-L313 HydrophobicContact CB-CG 4.49Å; F309-L313 HydrophobicContact CD2-CD1 4.32Å; F309-L313 HydrophobicContact CG-CD1 4.16Å; F309-L313 WeakPolarHBondContact O-CB 3.34Å; F309-L313 WeakPolarHBondContact O-CG 3.36Å; F309-L313 PolarHBondContact O-N 2.98Å; F309-V378 HydrophobicContact CD2-CB 4.31Å; F309-V378 HydrophobicContact CD2-CG2 4.46Å; F309-A379 HydrophobicContact CD2-CB 4.15Å; F309-A379 HydrophobicContact CE2-CB 4.22Å
310	S	96.1	Very high	95.9	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.037	C	C	.	.	I	π-helix	trans	-56.8	-48.6	174	174.3	0	0	0	0	109.7	D301 P304 H307 S314 V315	D301-S310 WeakPolarHBondContact OD2-CB 3.46Å; D301-S310 PolarHBondContact OD2-OG 3.37Å; P304-S310 VanDerWaalsContact O-CB 3.24Å; P304-S310 WeakPolarHBondContact O-CB 3.2Å; H307-S310 WeakPolarHBondContact O-CB 3.4Å; H307-S310 PolarHBondContact O-N 2.79Å; S310-S314 CarbonylContact O-C 3.54Å; S310-S314 WeakPolarHBondContact O-CA 3.46Å; S310-S314 VanDerWaalsContact O-CB 3.31Å; S310-S314 WeakPolarHBondContact O-CB 3.26Å; S310-S314 PolarHBondContact O-N 2.86Å; S310-S314 VanDerWaalsContact O-N 3.16Å; S310-V315 PolarHBondContact O-N 3.44Å
311	L	97.3	Very high	95.8	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.039	C	C	.	.	I	π-helix	trans	-62.6	-48.7	-178.5	-58.9	179.7	0	0	0	112.7	L154 L259 L305 P308 F309 Y316	L154-L311 HydrophobicContact CD1-CD2 3.75Å; L259-L311 HydrophobicContact CD1-CD1 4.4Å; L259-L311 HydrophobicContact CD2-CD1 3.62Å; L305-L311 HydrophobicContact CD2-CD2 4.06Å; P308-L311 PolarHBondContact O-N 3.33Å; F309-L311 VanDerWaalsContact C-N 3.28Å; F309-L311 PolarHBondContact O-N 2.81Å; L311-Y316 HydrophobicContact CB-CD2 4.28Å; L311-Y316 HydrophobicContact CB-CE2 3.79Å; L311-Y316 VanDerWaalsContact O-CB 3.24Å; L311-Y316 WeakPolarHBondContact O-CB 3.45Å; L311-Y316 WeakPolarHBondContact O-CD2 3.46Å; L311-Y316 PolarHBondContact O-N 3.06Å
312	T	97.2	Very high	95.8	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.039	C	C	.	.	I	π-helix	trans	-87.1	-40.2	-171.9	54.6	0	0	0	0	114.2	L280 I284 P308 F309 N317 T409 S410	L280-T312 HydrophobicContact CD2-CG2 3.78Å; I284-T312 HydrophobicContact CG2-CG2 4.41Å; P308-T312 WeakPolarHBondContact O-CB 3.19Å; P308-T312 WeakPolarHBondContact O-CG2 3.24Å; P308-T312 PolarHBondContact O-N 3.36Å; P308-T312 PolarHBondContact O-OG1 3.21Å; F309-T312 PolarHBondContact O-N 2.98Å; T312-N317 WeakPolarHBondContact O-CB 3.46Å; T312-T409 HydrophobicContact CG2-CG2 4.37Å; T312-S410 VanDerWaalsContact OG1-CB 3.23Å; T312-S410 WeakPolarHBondContact OG1-CB 3.48Å; T312-S410 PolarHBondContact OG1-OG 3.17Å
313	L	96.1	Very high	95.9	Very high	2 Å²	2	7.6 Å²	7.6	1%	0.01	4%	0.038	C	C	.	.	I	π-helix	trans	-79	-37.6	-178.8	-61.6	170	0	0	0	112.1	I287 F309 N317 F349 V378 I411	I287-L313 HydrophobicContact CD1-CD2 3.6Å; I287-L313 HydrophobicContact CD1-CG 4.3Å; I287-L313 HydrophobicContact CG1-CD2 3.91Å; I287-L313 HydrophobicContact CG2-CD2 4.17Å; F309-L313 HydrophobicContact CB-CD1 3.84Å; F309-L313 HydrophobicContact CB-CG 4.49Å; F309-L313 HydrophobicContact CD2-CD1 4.32Å; F309-L313 HydrophobicContact CG-CD1 4.16Å; F309-L313 WeakPolarHBondContact O-CB 3.34Å; F309-L313 WeakPolarHBondContact O-CG 3.36Å; F309-L313 PolarHBondContact O-N 2.98Å; L313-N317 VanDerWaalsContact O-CB 3.28Å; L313-N317 WeakPolarHBondContact O-CB 3.45Å; L313-N317 PolarHBondContact O-ND2 2.97Å; L313-F349 HydrophobicContact CB-CD1 3.98Å; L313-F349 HydrophobicContact CB-CE1 3.78Å; L313-F349 HydrophobicContact CB-CZ 4.12Å; L313-F349 HydrophobicContact CD1-CD1 4.29Å; L313-F349 WeakPolarHBondContact O-CE2 3.3Å; L313-F349 WeakPolarHBondContact O-CZ 3.35Å; L313-V378 HydrophobicContact CD1-CB 4.43Å; L313-V378 HydrophobicContact CD1-CG1 4.01Å; L313-V378 HydrophobicContact CD1-CG2 4.46Å; L313-I411 HydrophobicContact CD1-CG2 3.94Å; L313-I411 HydrophobicContact CD2-CB 4.41Å; L313-I411 HydrophobicContact CD2-CD1 3.63Å; L313-I411 HydrophobicContact CD2-CG1 3.78Å; L313-I411 HydrophobicContact CD2-CG2 3.86Å; L313-I411 HydrophobicContact CG-CG2 4.44Å
314	S	96.2	Very high	96.1	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.042	C	C	.	.	I	π-helix	trans	-108.1	-74.9	-172.5	-164.7	0	0	0	0	111.4	D301 S310 Y316 N317 S318 L325	D301-S314 VanDerWaalsContact CB-OG 3.31Å; D301-S314 WeakPolarHBondContact CB-OG 3.35Å; D301-S314 WeakPolarHBondContact OD2-CB 3.36Å; S310-S314 CarbonylContact O-C 3.54Å; S310-S314 WeakPolarHBondContact O-CA 3.46Å; S310-S314 VanDerWaalsContact O-CB 3.31Å; S310-S314 WeakPolarHBondContact O-CB 3.26Å; S310-S314 PolarHBondContact O-N 2.86Å; S310-S314 VanDerWaalsContact O-N 3.16Å; S314-Y316 PolarHBondContact O-N 2.81Å; S314-N317 PolarHBondContact O-N 2.77Å; S314-S318 WeakPolarHBondContact O-CB 3.38Å; S314-S318 PolarHBondContact O-N 2.93Å; S314-S318 PolarHBondContact O-OG 2.74Å; S314-S318 VanDerWaalsContact O-OG 3.05Å; S314-L325 WeakPolarHBondContact OG-CD1 3.38Å
315	V	97.7	Very high	96.4	Very high	1 Å²	1	6.8 Å²	6.8	1%	0.006	3%	0.029	C	C	.	.	I	π-helix	trans	-55.8	-58.3	-168.6	-178.9	0	0	0	0	113.2	V151 L305 S310 S318 L319 L325 M327	V151-V315 HydrophobicContact CB-CG1 4.45Å; V151-V315 HydrophobicContact CG1-CG1 3.6Å; V151-V315 HydrophobicContact CG2-CG1 4Å; L305-V315 HydrophobicContact CD2-CG2 3.67Å; S310-V315 PolarHBondContact O-N 3.44Å; V315-S318 PolarHBondContact O-OG 2.73Å; V315-L319 HydrophobicContact CG1-CD1 4.09Å; V315-L319 WeakPolarHBondContact O-CB 3.24Å; V315-L319 WeakPolarHBondContact O-CD1 3.34Å; V315-L319 WeakPolarHBondContact O-CG 3.3Å; V315-L319 PolarHBondContact O-N 3.16Å; V315-L325 HydrophobicContact CB-CD2 4.23Å; V315-L325 HydrophobicContact CG2-CD2 3.99Å; V315-M327 HydrophobicContact CG2-SD 4.33Å
316	Y	97.8	Very high	96.5	Very high	1 Å²	1	6.8 Å²	6.8	0%	0.004	3%	0.029	C	C	.	.	H	α-helix	trans	-71.7	-41.1	-177.2	-60.3	-25.6	0	0	0	111.2	L86 L90 I155 H158 I284 L311 S314 S318 L319 I320	L86-Y316 HydrophobicContact CD2-CE2 4.08Å; L90-Y316 HydrophobicContact CD1-CD1 3.87Å; L90-Y316 HydrophobicContact CD1-CE1 3.97Å; L90-Y316 HydrophobicContact CD1-CG 4.28Å; L90-Y316 HydrophobicContact CD2-CD1 4.08Å; L90-Y316 HydrophobicContact CD2-CG 4.04Å; I155-Y316 HydrophobicContact CG1-CE1 4.33Å; H158-Y316 AromaticContact NE2-CZ 3.98Å; H158-Y316 PolarHBondContact NE2-OH 2.9Å; I284-Y316 HydrophobicContact CG2-CD2 4.07Å; I284-Y316 HydrophobicContact CG2-CG 4.37Å; L311-Y316 HydrophobicContact CB-CD2 4.28Å; L311-Y316 HydrophobicContact CB-CE2 3.79Å; L311-Y316 VanDerWaalsContact O-CB 3.24Å; L311-Y316 WeakPolarHBondContact O-CB 3.45Å; L311-Y316 WeakPolarHBondContact O-CD2 3.46Å; L311-Y316 PolarHBondContact O-N 3.06Å; S314-Y316 PolarHBondContact O-N 2.81Å; Y316-S318 PolarHBondContact O-N 2.92Å; Y316-L319 PolarHBondContact O-N 3.01Å; Y316-I320 WeakPolarHBondContact O-CG1 3.22Å; Y316-I320 WeakPolarHBondContact O-CG2 3.29Å; Y316-I320 PolarHBondContact O-N 3.18Å
317	N	96.8	Very high	96.7	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-63.8	-41.3	-179	-170.2	40.1	0	0	0	112	I287 T291 F293 T312 L313 S314 I320 S321	I287-N317 HydrophobicContact CG2-CB 4.27Å; I287-N317 WeakPolarHBondContact CG2-ND2 3.44Å; T291-N317 PolarHBondContact OG1-ND2 3.24Å; T291-N317 VanDerWaalsContact OG1-ND2 3.07Å; F293-N317 WeakPolarHBondContact CD2-ND2 3.01Å; F293-N317 VanDerWaalsContact CE2-ND2 3.3Å; F293-N317 WeakPolarHBondContact CE2-ND2 3.32Å; T312-N317 WeakPolarHBondContact O-CB 3.46Å; L313-N317 VanDerWaalsContact O-CB 3.28Å; L313-N317 WeakPolarHBondContact O-CB 3.45Å; L313-N317 PolarHBondContact O-ND2 2.97Å; S314-N317 PolarHBondContact O-N 2.77Å; N317-I320 WeakPolarHBondContact O-CG1 3.44Å; N317-S321 WeakPolarHBondContact O-CB 3.44Å; N317-S321 PolarHBondContact O-N 2.76Å; N317-S321 PolarHBondContact O-OG 2.84Å
318	S	97.1	Very high	96.7	Very high	0 Å²	0	2.1 Å²	2.1	0%	0	1%	0.01	C	C	.	.	H	α-helix	trans	-64	-47.8	176.8	70.4	0	0	0	0	111	S314 V315 Y316 I320 S321 G322 C323 L325	S314-S318 WeakPolarHBondContact O-CB 3.38Å; S314-S318 PolarHBondContact O-N 2.93Å; S314-S318 PolarHBondContact O-OG 2.74Å; S314-S318 VanDerWaalsContact O-OG 3.05Å; V315-S318 PolarHBondContact O-OG 2.73Å; Y316-S318 PolarHBondContact O-N 2.92Å; S318-I320 PolarHBondContact O-N 3.09Å; S318-S321 PolarHBondContact O-N 3.41Å; S318-S321 VanDerWaalsContact O-N 3.12Å; S318-G322 PolarHBondContact O-N 2.77Å; S318-G322 VanDerWaalsContact O-N 3.12Å; S318-C323 PolarHBondContact O-N 3.17Å; S318-L325 WeakPolarHBondContact OG-CB 3.43Å; S318-L325 WeakPolarHBondContact OG-CD2 3.35Å
319	L	97.3	Very high	96.4	Very high	1 Å²	1	5 Å²	5	1%	0.005	3%	0.03	C	C	.	.	H	α-helix	trans	-64.6	-42.3	-175.7	-70.9	177.3	0	0	0	112	L94 A103 F104 Y114 L117 V151 I155 V315 Y316 S321	L94-L319 HydrophobicContact CD2-CB 4.13Å; L94-L319 HydrophobicContact CD2-CD2 4.43Å; A103-L319 HydrophobicContact CB-CD2 4.19Å; F104-L319 HydrophobicContact CB-CD2 4.34Å; Y114-L319 HydrophobicContact CE1-CD2 4Å; Y114-L319 PolarHBondContact OH-O 3.48Å; L117-L319 HydrophobicContact CD2-CD1 4.05Å; L117-L319 HydrophobicContact CD2-CD2 3.51Å; L117-L319 HydrophobicContact CD2-CG 4.43Å; V151-L319 HydrophobicContact CG1-CD1 4.11Å; I155-L319 HydrophobicContact CD1-CD1 3.76Å; V315-L319 HydrophobicContact CG1-CD1 4.09Å; V315-L319 WeakPolarHBondContact O-CB 3.24Å; V315-L319 WeakPolarHBondContact O-CD1 3.34Å; V315-L319 WeakPolarHBondContact O-CG 3.3Å; V315-L319 PolarHBondContact O-N 3.16Å; Y316-L319 PolarHBondContact O-N 3.01Å; L319-S321 VanDerWaalsContact C-N 3.25Å; L319-S321 PolarHBondContact O-N 3.29Å
320	I	95.9	Very high	96	Very high	1 Å²	1	12.9 Å²	12.9	1%	0.005	6%	0.064	C	C	.	.	H	α-helix	trans	-73	-18.2	176.8	71	179.5	0	0	0	113.5	F89 L90 Q93 I284 R288 Y316 N317 S318	F89-I320 HydrophobicContact CE1-CD1 3.97Å; F89-I320 HydrophobicContact CE1-CG2 4.23Å; F89-I320 HydrophobicContact CZ-CD1 4.5Å; L90-I320 HydrophobicContact CD2-CG2 3.71Å; Q93-I320 HydrophobicContact CB-CB 3.76Å; Q93-I320 HydrophobicContact CB-CG2 3.65Å; Q93-I320 HydrophobicContact CG-CB 3.9Å; Q93-I320 HydrophobicContact CG-CG2 3.84Å; I284-I320 HydrophobicContact CB-CD1 4.21Å; I284-I320 HydrophobicContact CG1-CD1 4.48Å; R288-I320 HydrophobicContact CB-CD1 4.46Å; Y316-I320 WeakPolarHBondContact O-CG1 3.22Å; Y316-I320 WeakPolarHBondContact O-CG2 3.29Å; Y316-I320 PolarHBondContact O-N 3.18Å; N317-I320 WeakPolarHBondContact O-CG1 3.44Å; S318-I320 PolarHBondContact O-N 3.09Å
321	S	95.8	Very high	95.5	Very high	6 Å²	6	15.8 Å²	15.8	4%	0.042	8%	0.082	C	C	.	.	H	α-helix	trans	-96.4	-3.5	-178.7	-54.5	0	0	0	0	113	N317 S318 L319 C323	N317-S321 WeakPolarHBondContact O-CB 3.44Å; N317-S321 PolarHBondContact O-N 2.76Å; N317-S321 PolarHBondContact O-OG 2.84Å; S318-S321 PolarHBondContact O-N 3.41Å; S318-S321 VanDerWaalsContact O-N 3.12Å; L319-S321 VanDerWaalsContact C-N 3.25Å; L319-S321 PolarHBondContact O-N 3.29Å; S321-C323 VanDerWaalsContact C-N 3.29Å; S321-C323 VanDerWaalsContact CB-SG 3.55Å
322	G	96.8	Very high	95.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	11	-179	0	0	0	0	0	114.1	Q101 Y114 P295 S318	Q101-G322 PolarHBondContact NE2-O 2.8Å; Y114-G322 WeakPolarHBondContact OH-CA 3.34Å; P295-G322 WeakPolarHBondContact CA-O 3.48Å; S318-G322 PolarHBondContact O-N 2.77Å; S318-G322 VanDerWaalsContact O-N 3.12Å
323	C	97.5	Very high	94.7	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.102	C	C	.	.			trans	-79.1	156.9	-174.2	-52.7	0	0	0	0	112	Y114 F293 D294 V297 I299 S318 S321	Y114-C323 PolarHBondContact OH-N 3.16Å; Y114-C323 PolarHBondContact OH-O 3.43Å; F293-C323 VanDerWaalsContact CB-SG 3.59Å; D294-C323 PolarHBondContact O-SG 3.05Å; V297-C323 HydrophobicContact CB-CB 4.48Å; V297-C323 WeakPolarHBondContact O-CB 3.26Å; I299-C323 HydrophobicContact CD1-CB 3.83Å; I299-C323 HydrophobicContact CG1-CB 4.36Å; S318-C323 PolarHBondContact O-N 3.17Å; S321-C323 VanDerWaalsContact C-N 3.29Å; S321-C323 VanDerWaalsContact CB-SG 3.55Å
324	R	97.7	Very high	94.4	Very high	26 Å²	26	22.2 Å²	22.2	10%	0.098	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	118	168.7	-178.1	-176.9	178.9	-79.4	0.4	109.8	E102 M111 V297 R298 I299 T326 D343	E102-R324 HydrophobicContact CB-CG 4.26Å; E102-R324 WeakPolarHBondContact OE2-CD 3.49Å; E102-R324 IonicContact OE2-CZ 3.48Å; E102-R324 IonicContact OE2-NE 2.82Å; E102-R324 PolarHBondContact OE2-NE 3.24Å; E102-R324 IonicContact OE2-NH2 2.65Å; M111-R324 HydrophobicContact CE-CG 3.85Å; V297-R324 PolarHBondContact O-N 2.9Å; R298-R324 WeakPolarHBondContact CA-O 3.24Å; R298-R324 HydrophobicContact CG-CB 4.34Å; I299-R324 PolarHBondContact N-O 2.95Å; R324-T326 PolarHBondContact NH1-OG1 3.33Å; R324-D343 IonicContact CZ-OD2 3.73Å; R324-D343 VanDerWaalsContact CZ-OD2 3.26Å; R324-D343 IonicContact NH1-OD2 3.9Å; R324-D343 PolarHBondContact NH1-OD2 2.74Å; R324-D343 IonicContact NH2-OD1 2.8Å; R324-D343 PolarHBondContact NH2-OD1 2.8Å; R324-D343 IonicContact NH2-OD2 2.74Å; R324-D343 PolarHBondContact NH2-OD2 2.85Å
325	L	98.1	Very high	94.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129.5	177.1	174.6	63	0	0	0	112.3	A103 F104 G105 I299 D301 S314 V315 S318 M327	A103-L325 PolarHBondContact O-N 3.15Å; F104-L325 CarbonylContact C-O 3.57Å; F104-L325 VanDerWaalsContact CA-O 3.23Å; F104-L325 WeakPolarHBondContact CA-O 3.48Å; F104-L325 HydrophobicContact CD2-CB 4.19Å; F104-L325 HydrophobicContact CD2-CD2 3.72Å; F104-L325 HydrophobicContact CD2-CG 3.87Å; F104-L325 HydrophobicContact CE2-CD2 4.15Å; F104-L325 HydrophobicContact CE2-CG 4.45Å; G105-L325 PolarHBondContact N-O 3.12Å; I299-L325 HydrophobicContact CB-CD1 4.04Å; I299-L325 HydrophobicContact CG2-CD1 3.79Å; D301-L325 HydrophobicContact CB-CD1 4.04Å; S314-L325 WeakPolarHBondContact OG-CD1 3.38Å; V315-L325 HydrophobicContact CB-CD2 4.23Å; V315-L325 HydrophobicContact CG2-CD2 3.99Å; S318-L325 WeakPolarHBondContact OG-CB 3.43Å; S318-L325 WeakPolarHBondContact OG-CD2 3.35Å; L325-M327 HydrophobicContact CG-CG 4.42Å
326	T	97.8	Very high	94	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	137.9	170.5	-44.3	0	0	0	0	109.5	G105 F107 I299 L300 D301 R324 D343	G105-T326 WeakPolarHBondContact O-CA 3.36Å; F107-T326 HydrophobicContact CB-CG2 3.88Å; I299-T326 PolarHBondContact O-N 3.01Å; L300-T326 WeakPolarHBondContact CA-O 3.28Å; L300-T326 WeakPolarHBondContact CD1-O 3.4Å; D301-T326 PolarHBondContact N-O 3.46Å; R324-T326 PolarHBondContact NH1-OG1 3.33Å; T326-D343 WeakPolarHBondContact CG2-OD2 3.29Å; T326-D343 PolarHBondContact OG1-OD2 2.78Å; T326-D343 VanDerWaalsContact OG1-OD2 3.08Å
327	M	96.7	Very high	94	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	161.6	169.8	-50.8	-172.5	68.6	0	0	110.3	F104 G105 I106 F107 N146 D301 L305 V315 L325	F104-M327 HydrophobicContact CE2-CG 3.82Å; F104-M327 HydrophobicContact CE2-SD 3.7Å; F104-M327 HydrophobicContact CZ-SD 4.22Å; G105-M327 PolarHBondContact O-N 3.17Å; I106-M327 CarbonylContact C-O 3.54Å; I106-M327 WeakPolarHBondContact CA-O 3.36Å; I106-M327 HydrophobicContact CD1-CB 3.83Å; F107-M327 PolarHBondContact N-O 3.14Å; N146-M327 HydrophobicContact CB-CE 4.32Å; D301-M327 HydrophobicContact CB-CE 4.08Å; D301-M327 HydrophobicContact CB-CG 4.02Å; D301-M327 WeakPolarHBondContact OD2-CE 3.46Å; L305-M327 HydrophobicContact CD1-CE 4.48Å; L305-M327 HydrophobicContact CD1-SD 4.31Å; L305-M327 HydrophobicContact CD2-CE 3.6Å; L305-M327 HydrophobicContact CD2-SD 3.68Å; L305-M327 HydrophobicContact CG-CE 3.61Å; L305-M327 HydrophobicContact CG-SD 3.96Å; V315-M327 HydrophobicContact CG2-SD 4.33Å; L325-M327 HydrophobicContact CG-CG 4.42Å
328	L	94.3	Very high	93.9	Very high	4 Å²	4	29 Å²	29	2%	0.021	15%	0.151	C	C	.	.			trans	-99.8	137.2	169.2	-53.4	-178.2	0	0	0	109.9	F107 N146 L300 L302 K330 V331 D335 C339	F107-L328 HydrophobicContact CB-CD2 3.58Å; F107-L328 HydrophobicContact CD1-CD2 4.09Å; F107-L328 HydrophobicContact CG-CD2 4.13Å; N146-L328 VanDerWaalsContact CB-O 3.32Å; N146-L328 WeakPolarHBondContact CB-O 3.39Å; N146-L328 PolarHBondContact ND2-O 2.74Å; N146-L328 VanDerWaalsContact ND2-O 3.09Å; L300-L328 HydrophobicContact CD1-CD2 4.13Å; L300-L328 HydrophobicContact CD1-CG 4.11Å; L302-L328 HydrophobicContact CD2-CD1 3.51Å; L302-L328 HydrophobicContact CD2-CG 4.04Å; L328-K330 VanDerWaalsContact C-N 3.27Å; L328-K330 WeakPolarHBondContact CB-O 3.14Å; L328-V331 HydrophobicContact CB-CG2 4.44Å; L328-D335 HydrophobicContact CD1-CB 3.85Å; L328-D335 HydrophobicContact CD2-CB 4.38Å; L328-C339 HydrophobicContact CD2-CB 4.09Å
329	S	89	Confident	93.9	Very high	61 Å²	61	29 Å²	29	43%	0.427	15%	0.151	S	C	.	.	S	Bend	trans	-63.6	-38	171.6	57.9	0	0	0	0	111
330	K	85.7	Confident	93.9	Very high	168 Å²	168	29 Å²	29	73%	0.73	15%	0.151	S	C	*	.	S	Bend	trans	-131.6	125.6	170	-67.6	179.9	-177.6	174.3	0	108.9	L328 G332	L328-K330 VanDerWaalsContact C-N 3.27Å; L328-K330 WeakPolarHBondContact CB-O 3.14Å; K330-G332 PolarHBondContact O-N 2.88Å
331	V	87	Confident	93.9	Very high	61 Å²	61	32.5 Å²	32.5	37%	0.37	17%	0.167	S	C	.	.			trans	-79.9	116	-178.3	179	0	0	0	0	109	L302 L328 I354	L302-V331 HydrophobicContact CB-CG1 3.95Å; L302-V331 HydrophobicContact CD2-CG1 4.36Å; L302-V331 WeakPolarHBondContact O-CG2 3.08Å; L328-V331 HydrophobicContact CB-CG2 4.44Å; V331-I354 HydrophobicContact CG1-CD1 4.21Å; V331-I354 HydrophobicContact CG1-CG1 4.47Å
332	G	88	Confident	94	Very high	14 Å²	14	38.8 Å²	38.8	14%	0.144	20%	0.196	C	C	.	.			trans	-140.6	148.3	176.8	0	0	0	0	0	110.8	K330 L334 D335 F336	K330-G332 PolarHBondContact O-N 2.88Å; G332-L334 VanDerWaalsContact C-N 3.29Å; G332-L334 PolarHBondContact O-N 3.33Å; G332-D335 PolarHBondContact O-N 3.47Å; G332-F336 PolarHBondContact O-N 3.31Å
333	P	88.3	Confident	93.9	Very high	44 Å²	44	39.4 Å²	39.4	29%	0.286	20%	0.199	S	C	.	.	H	α-helix	trans	-63.1	-33.6	179.9	-18.9	28.9	0	0	0	113.8	F336 L337 I354 F357	P333-F336 WeakPolarHBondContact O-CB 3.3Å; P333-F336 PolarHBondContact O-N 2.95Å; P333-L337 WeakPolarHBondContact O-CG 3.31Å; P333-L337 PolarHBondContact O-N 3.47Å; P333-L337 VanDerWaalsContact O-N 3.17Å; P333-I354 HydrophobicContact CG-CD1 4.04Å; P333-F357 HydrophobicContact CB-CB 4.09Å; P333-F357 HydrophobicContact CB-CD1 3.36Å; P333-F357 HydrophobicContact CB-CD2 3.55Å; P333-F357 HydrophobicContact CB-CE1 3.49Å; P333-F357 VanDerWaalsContact CB-CE1 3.49Å; P333-F357 HydrophobicContact CB-CE2 3.69Å; P333-F357 HydrophobicContact CB-CG 3.38Å; P333-F357 HydrophobicContact CB-CZ 3.67Å; P333-F357 HydrophobicContact CG-CB 4.31Å; P333-F357 HydrophobicContact CG-CD1 4.41Å; P333-F357 HydrophobicContact CG-CD2 3.95Å; P333-F357 HydrophobicContact CG-CE2 4.35Å; P333-F357 HydrophobicContact CG-CG 3.98Å
334	L	90.9	Very high	93.9	Very high	78 Å²	78	42.4 Å²	42.4	41%	0.408	21%	0.213	S	C	.	.	H	α-helix	trans	-67.6	-44.8	175.4	-178.6	62.9	0	0	0	111.6	G332 F336 L337 R338 M363 Y367	G332-L334 VanDerWaalsContact C-N 3.29Å; G332-L334 PolarHBondContact O-N 3.33Å; L334-F336 VanDerWaalsContact C-N 3.27Å; L334-F336 PolarHBondContact O-N 3.2Å; L334-L337 PolarHBondContact O-N 3.27Å; L334-R338 HydrophobicContact CD1-CG 4.47Å; L334-R338 WeakPolarHBondContact O-CG 3.22Å; L334-R338 PolarHBondContact O-N 3.44Å; L334-M363 HydrophobicContact CD1-SD 3.91Å; L334-Y367 HydrophobicContact CD1-CE2 4.33Å; L334-Y367 VanDerWaalsContact CD1-OH 3.24Å; L334-Y367 WeakPolarHBondContact CD1-OH 3.43Å
335	D	92.1	Very high	93.9	Very high	52 Å²	52	41.1 Å²	41.1	28%	0.278	21%	0.208	S	C	.	.	H	α-helix	trans	-66	-32.7	177.8	-61.2	-58.1	0	0	0	111.6	L328 G332 R338 C339	L328-D335 HydrophobicContact CD1-CB 3.85Å; L328-D335 HydrophobicContact CD2-CB 4.38Å; G332-D335 PolarHBondContact O-N 3.47Å; D335-R338 IonicContact OD1-NH1 3.09Å; D335-C339 WeakPolarHBondContact O-CB 3.15Å; D335-C339 PolarHBondContact O-N 3.13Å
336	F	94.3	Very high	93.9	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.009	21%	0.213	C	C	.	.	H	α-helix	trans	-56.8	-54.2	168.1	166.1	-90.2	0	0	0	111.2	L300 L302 G332 P333 L334 R338 C339 S340 C348 L358 L372	L300-F336 HydrophobicContact CD2-CD2 3.51Å; L300-F336 HydrophobicContact CD2-CE2 3.95Å; L300-F336 HydrophobicContact CD2-CG 4.43Å; L302-F336 HydrophobicContact CD1-CD2 3.64Å; L302-F336 HydrophobicContact CD1-CE2 4.25Å; L302-F336 HydrophobicContact CD1-CG 4.42Å; L302-F336 HydrophobicContact CD2-CB 4.48Å; L302-F336 HydrophobicContact CD2-CD2 4.23Å; L302-F336 HydrophobicContact CG-CD2 4.44Å; G332-F336 PolarHBondContact O-N 3.31Å; P333-F336 WeakPolarHBondContact O-CB 3.3Å; P333-F336 PolarHBondContact O-N 2.95Å; L334-F336 VanDerWaalsContact C-N 3.27Å; L334-F336 PolarHBondContact O-N 3.2Å; F336-R338 PolarHBondContact O-N 3.32Å; F336-C339 PolarHBondContact O-N 3.14Å; F336-S340 WeakPolarHBondContact CE2-OG 3.44Å; F336-S340 WeakPolarHBondContact CZ-OG 3.38Å; F336-S340 WeakPolarHBondContact O-CB 3.36Å; F336-S340 PolarHBondContact O-N 3.34Å; F336-S340 PolarHBondContact O-OG 3.38Å; F336-C348 HydrophobicContact CE2-CB 4.1Å; F336-L358 HydrophobicContact CD1-CD1 4.31Å; F336-L358 HydrophobicContact CD1-CD2 3.66Å; F336-L358 HydrophobicContact CD1-CG 4.42Å; F336-L358 HydrophobicContact CE1-CD1 3.6Å; F336-L358 HydrophobicContact CE1-CD2 3.26Å; F336-L358 HydrophobicContact CE1-CG 3.99Å; F336-L358 HydrophobicContact CE2-CD1 4.46Å; F336-L358 HydrophobicContact CZ-CD1 3.66Å; F336-L358 HydrophobicContact CZ-CD2 4.19Å; F336-L372 HydrophobicContact CZ-CD2 4.14Å
337	L	95.8	Very high	93.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-45.9	-177.2	-68.4	176.8	0	0	0	112	P333 L334 C339 S340 E341 F357 L358 M363 V364 Y367 V369	P333-L337 WeakPolarHBondContact O-CG 3.31Å; P333-L337 PolarHBondContact O-N 3.47Å; P333-L337 VanDerWaalsContact O-N 3.17Å; L334-L337 PolarHBondContact O-N 3.27Å; L337-C339 VanDerWaalsContact C-N 3.33Å; L337-C339 PolarHBondContact O-N 3.02Å; L337-S340 PolarHBondContact O-N 3.25Å; L337-E341 PolarHBondContact O-N 2.86Å; L337-F357 HydrophobicContact CD1-CE1 3.76Å; L337-F357 HydrophobicContact CD1-CZ 4.17Å; L337-F357 HydrophobicContact CG-CE1 4.27Å; L337-L358 HydrophobicContact CD2-CD2 3.91Å; L337-M363 HydrophobicContact CD1-CG 4.4Å; L337-V364 HydrophobicContact CD1-CG2 4.16Å; L337-V364 HydrophobicContact CD2-CB 4.29Å; L337-V364 HydrophobicContact CD2-CG1 3.88Å; L337-V364 HydrophobicContact CD2-CG2 4.16Å; L337-Y367 HydrophobicContact CB-CD1 3.98Å; L337-Y367 HydrophobicContact CB-CD2 3.84Å; L337-Y367 HydrophobicContact CB-CE1 4.31Å; L337-Y367 HydrophobicContact CB-CE2 4.16Å; L337-Y367 HydrophobicContact CB-CG 3.73Å; L337-Y367 HydrophobicContact CD1-CD2 3.63Å; L337-Y367 HydrophobicContact CD1-CE2 3.9Å; L337-Y367 HydrophobicContact CD1-CG 4.32Å; L337-Y367 HydrophobicContact CG-CD2 4.27Å; L337-Y367 HydrophobicContact CG-CG 4.49Å; L337-V369 HydrophobicContact CD2-CG1 4Å
338	R	96.3	Very high	93.9	Very high	91 Å²	91	41.9 Å²	41.9	34%	0.343	21%	0.213	S	C	.	.	H	α-helix	trans	-60.2	-42.7	177.5	-67.4	175.4	71.6	-138.6	-5.4	111.9	F107 E108 L334 D335 F336 H342 Y367	F107-R338 HydrophobicContact CE1-CB 3.94Å; F107-R338 HydrophobicContact CZ-CB 4.12Å; E108-R338 IonicContact OE1-CZ 3.07Å; E108-R338 IonicContact OE1-NH1 2.78Å; E108-R338 PolarHBondContact OE1-NH1 2.94Å; E108-R338 IonicContact OE1-NH2 2.62Å; E108-R338 PolarHBondContact OE1-NH2 3.35Å; L334-R338 HydrophobicContact CD1-CG 4.47Å; L334-R338 WeakPolarHBondContact O-CG 3.22Å; L334-R338 PolarHBondContact O-N 3.44Å; D335-R338 IonicContact OD1-NH1 3.09Å; F336-R338 PolarHBondContact O-N 3.32Å; R338-H342 WeakPolarHBondContact O-CB 3.23Å; R338-H342 PolarHBondContact O-N 3.18Å; R338-Y367 HydrophobicContact CG-CE1 3.78Å
339	C	96.6	Very high	93.9	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-69.1	-45	177.6	-177.1	0	0	0	0	111.5	F107 L300 L328 D335 F336 L337 E341 H342 D343	F107-C339 HydrophobicContact CB-CB 4.42Å; F107-C339 HydrophobicContact CD1-CB 3.84Å; F107-C339 HydrophobicContact CD2-CB 3.76Å; F107-C339 VanDerWaalsContact CD2-SG 3.6Å; F107-C339 HydrophobicContact CE1-CB 3.99Å; F107-C339 HydrophobicContact CE2-CB 3.94Å; F107-C339 HydrophobicContact CG-CB 3.73Å; F107-C339 HydrophobicContact CZ-CB 4.05Å; L300-C339 HydrophobicContact CD2-CB 4.17Å; L328-C339 HydrophobicContact CD2-CB 4.09Å; D335-C339 WeakPolarHBondContact O-CB 3.15Å; D335-C339 PolarHBondContact O-N 3.13Å; F336-C339 PolarHBondContact O-N 3.14Å; L337-C339 VanDerWaalsContact C-N 3.33Å; L337-C339 PolarHBondContact O-N 3.02Å; C339-E341 VanDerWaalsContact C-N 3.31Å; C339-E341 PolarHBondContact O-N 3.12Å; C339-H342 PolarHBondContact O-N 3.45Å; C339-D343 VanDerWaalsContact O-CB 3.31Å; C339-D343 WeakPolarHBondContact O-CB 3.17Å; C339-D343 PolarHBondContact O-N 2.63Å
340	S	96.5	Very high	94.1	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.007	19%	0.192	C	C	.	.	H	α-helix	trans	-55.6	-44.9	177.9	-75.9	0	0	0	0	112.7	F336 L337 Q344 I345	F336-S340 WeakPolarHBondContact CE2-OG 3.44Å; F336-S340 WeakPolarHBondContact CZ-OG 3.38Å; F336-S340 WeakPolarHBondContact O-CB 3.36Å; F336-S340 PolarHBondContact O-N 3.34Å; F336-S340 PolarHBondContact O-OG 3.38Å; L337-S340 PolarHBondContact O-N 3.25Å; S340-Q344 WeakPolarHBondContact O-CA 3.42Å; S340-Q344 PolarHBondContact O-N 2.84Å; S340-I345 PolarHBondContact O-N 3.11Å; S340-I345 VanDerWaalsContact O-N 3.13Å
341	E	97.2	Very high	94.4	Very high	75 Å²	75	33.6 Å²	33.6	35%	0.35	17%	0.172	S	C	.	.	H	α-helix	trans	-70.1	-51.6	176.9	178.4	175.8	-108.4	0	0	112.2	L337 C339 Q344 D368	L337-E341 PolarHBondContact O-N 2.86Å; C339-E341 VanDerWaalsContact C-N 3.31Å; C339-E341 PolarHBondContact O-N 3.12Å; E341-Q344 PolarHBondContact O-NE2 3.26Å; E341-D368 VanDerWaalsContact CA-O 3.25Å; E341-D368 WeakPolarHBondContact CA-O 3.12Å; E341-D368 WeakPolarHBondContact CB-O 3.1Å; E341-D368 HydrophobicContact CG-CB 4.19Å; E341-D368 PolarHBondContact OE1-N 3.13Å
342	H	96.8	Very high	94.6	Very high	138 Å²	138	31.4 Å²	31.4	64%	0.639	16%	0.159	S	C	*	.	H	α-helix	trans	-65.6	-46.6	-175.2	178.2	-82.8	0	0	0	112.6	F107 R338 C339	F107-H342 HydrophobicContact CE2-CB 3.9Å; F107-H342 AromaticContact CE2-CG 3.99Å; F107-H342 AromaticContact CE2-ND1 3.89Å; F107-H342 HydrophobicContact CZ-CB 4.17Å; R338-H342 WeakPolarHBondContact O-CB 3.23Å; R338-H342 PolarHBondContact O-N 3.18Å; C339-H342 PolarHBondContact O-N 3.45Å
343	D	96	Very high	94.7	Very high	12 Å²	12	34 Å²	34	6%	0.064	18%	0.175	C	C	.	.	H	α-helix	trans	-91.2	-3.3	-176.2	-78.1	9.2	0	0	0	112.9	R298 R324 T326 C339 I345	R298-D343 WeakPolarHBondContact CD-O 3.42Å; R324-D343 IonicContact CZ-OD2 3.73Å; R324-D343 VanDerWaalsContact CZ-OD2 3.26Å; R324-D343 IonicContact NH1-OD2 3.9Å; R324-D343 PolarHBondContact NH1-OD2 2.74Å; R324-D343 IonicContact NH2-OD1 2.8Å; R324-D343 PolarHBondContact NH2-OD1 2.8Å; R324-D343 IonicContact NH2-OD2 2.74Å; R324-D343 PolarHBondContact NH2-OD2 2.85Å; T326-D343 WeakPolarHBondContact CG2-OD2 3.29Å; T326-D343 PolarHBondContact OG1-OD2 2.78Å; T326-D343 VanDerWaalsContact OG1-OD2 3.08Å; C339-D343 VanDerWaalsContact O-CB 3.31Å; C339-D343 WeakPolarHBondContact O-CB 3.17Å; C339-D343 PolarHBondContact O-N 2.63Å; D343-I345 HydrophobicContact CB-CD1 3.74Å; D343-I345 HydrophobicContact CB-CG1 4.16Å; D343-I345 PolarHBondContact O-N 3.32Å
344	Q	97	Very high	95	Very high	63 Å²	63	32.3 Å²	32.3	29%	0.294	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	56.7	177.4	-63.6	-78	-67.3	0	0	110.3	R298 S340 E341 T371	R298-Q344 WeakPolarHBondContact CD-O 3.46Å; R298-Q344 VanDerWaalsContact NH1-CB 3.31Å; S340-Q344 WeakPolarHBondContact O-CA 3.42Å; S340-Q344 PolarHBondContact O-N 2.84Å; E341-Q344 PolarHBondContact O-NE2 3.26Å; Q344-T371 WeakPolarHBondContact CA-OG1 3.39Å; Q344-T371 HydrophobicContact CB-CG2 4.02Å; Q344-T371 HydrophobicContact CG-CG2 4.49Å
345	I	97.9	Very high	95.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.144	C	C	.	.			trans	-66.8	133.8	-172.6	-63.1	-61.1	0	0	0	110.6	R298 L300 S340 D343 V347 T371 L372	R298-I345 HydrophobicContact CB-CD1 4.42Å; L300-I345 HydrophobicContact CB-CB 4.46Å; L300-I345 HydrophobicContact CB-CD1 3.95Å; L300-I345 HydrophobicContact CB-CG1 4.01Å; L300-I345 HydrophobicContact CB-CG2 3.63Å; L300-I345 HydrophobicContact CD2-CG1 4.34Å; S340-I345 PolarHBondContact O-N 3.11Å; S340-I345 VanDerWaalsContact O-N 3.13Å; D343-I345 HydrophobicContact CB-CD1 3.74Å; D343-I345 HydrophobicContact CB-CG1 4.16Å; D343-I345 PolarHBondContact O-N 3.32Å; I345-V347 VanDerWaalsContact CG2-O 3.26Å; I345-V347 WeakPolarHBondContact CG2-O 3.39Å; I345-T371 PolarHBondContact N-OG1 3.11Å; I345-T371 CarbonylContact O-C 3.41Å; I345-T371 PolarHBondContact O-OG1 3.26Å; I345-L372 HydrophobicContact CG2-CD1 4.27Å; I345-L372 WeakPolarHBondContact O-CA 3.44Å; I345-L372 PolarHBondContact O-N 2.68Å
346	S	97.6	Very high	95.2	Very high	15 Å²	15	31 Å²	31	11%	0.105	15%	0.153	C	C	.	.	S	Bend	trans	-97.4	-35.7	177.6	-42	0	0	0	0	112.6	R298 T371 E373 M374	R298-S346 PolarHBondContact N-OG 3.37Å; R298-S346 PolarHBondContact O-N 2.86Å; S346-T371 WeakPolarHBondContact CA-O 3.25Å; S346-E373 PolarHBondContact O-N 2.88Å; S346-M374 PolarHBondContact O-N 2.97Å
347	V	97.4	Very high	95.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	137.6	-174.9	-179.5	0	0	0	0	110.4	F293 V297 R298 I299 L300 I345 F349 M374 F376	F293-V347 HydrophobicContact CE1-CG1 4.17Å; F293-V347 HydrophobicContact CE1-CG2 4.03Å; F293-V347 HydrophobicContact CZ-CG1 3.82Å; F293-V347 HydrophobicContact CZ-CG2 4.42Å; V297-V347 HydrophobicContact CG1-CB 4.21Å; V297-V347 HydrophobicContact CG1-CG2 3.53Å; R298-V347 PolarHBondContact O-N 3.13Å; I299-V347 CarbonylContact C-O 3.44Å; I299-V347 WeakPolarHBondContact CA-O 3.39Å; I299-V347 HydrophobicContact CG1-CB 4.28Å; L300-V347 PolarHBondContact N-O 2.97Å; I345-V347 VanDerWaalsContact CG2-O 3.26Å; I345-V347 WeakPolarHBondContact CG2-O 3.39Å; V347-F349 HydrophobicContact CG1-CE2 4.43Å; V347-M374 VanDerWaalsContact CA-O 3.31Å; V347-M374 WeakPolarHBondContact CA-O 3.46Å; V347-M374 HydrophobicContact CG1-CB 4.36Å; V347-M374 HydrophobicContact CG2-CB 4.09Å; V347-M374 HydrophobicContact CG2-CE 3.82Å; V347-M374 HydrophobicContact CG2-CG 4.43Å; V347-F376 HydrophobicContact CG1-CD2 3.82Å; V347-F376 HydrophobicContact CG1-CE2 3.71Å
348	C	96.4	Very high	95.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	144.7	168.8	76.4	0	0	0	0	113.5	L300 F336 L372 M374 F376	L300-C348 HydrophobicContact CB-CB 4.24Å; L300-C348 WeakPolarHBondContact O-CA 3.47Å; F336-C348 HydrophobicContact CE2-CB 4.1Å; C348-L372 HydrophobicContact CB-CD1 4.42Å; C348-M374 PolarHBondContact N-O 2.63Å; C348-M374 VanDerWaalsContact N-O 3.09Å; C348-F376 PolarHBondContact O-N 2.99Å
349	F	95.1	Very high	95	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	114.1	168.4	-65	-80.8	0	0	0	108.4	F293 I299 L300 L302 L303 L313 V347 F376	F293-F349 HydrophobicContact CE2-CE2 4.3Å; F293-F349 HydrophobicContact CE2-CZ 4.02Å; F293-F349 HydrophobicContact CZ-CE2 4.44Å; F293-F349 AromaticContact CZ-CZ 3.96Å; F293-F349 HydrophobicContact CZ-CZ 3.96Å; I299-F349 HydrophobicContact CG2-CD2 3.96Å; I299-F349 HydrophobicContact CG2-CE2 3.83Å; L300-F349 PolarHBondContact O-N 3.17Å; L300-F349 VanDerWaalsContact O-N 3.15Å; L302-F349 VanDerWaalsContact CB-O 3.32Å; L302-F349 WeakPolarHBondContact CB-O 3.46Å; L302-F349 PolarHBondContact N-O 3.04Å; L303-F349 HydrophobicContact CD1-CB 4.2Å; L303-F349 HydrophobicContact CG-CB 4.42Å; L313-F349 HydrophobicContact CB-CD1 3.98Å; L313-F349 HydrophobicContact CB-CE1 3.78Å; L313-F349 HydrophobicContact CB-CZ 4.12Å; L313-F349 HydrophobicContact CD1-CD1 4.29Å; L313-F349 WeakPolarHBondContact O-CE2 3.3Å; L313-F349 WeakPolarHBondContact O-CZ 3.35Å; V347-F349 HydrophobicContact CG1-CE2 4.43Å; F349-F376 HydrophobicContact CD1-CB 3.47Å; F349-F376 VanDerWaalsContact CD1-CB 3.47Å; F349-F376 HydrophobicContact CD1-CD2 4.19Å; F349-F376 AromaticContact CD1-CG 3.84Å; F349-F376 HydrophobicContact CD1-CG 3.84Å; F349-F376 HydrophobicContact CE1-CB 3.77Å; F349-F376 HydrophobicContact CE1-CD1 4.01Å; F349-F376 AromaticContact CE1-CD2 3.78Å; F349-F376 HydrophobicContact CE1-CD2 3.78Å; F349-F376 HydrophobicContact CE1-CE2 4.4Å; F349-F376 AromaticContact CE1-CG 3.58Å; F349-F376 HydrophobicContact CE1-CG 3.58Å; F349-F376 HydrophobicContact CG-CB 4.39Å; F349-F376 HydrophobicContact CZ-CD2 4.25Å; F349-F376 HydrophobicContact CZ-CG 4.46Å
350	A	93.5	Very high	95	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.9	-168.9	0	0	0	0	0	112.3	L302 I354 L355 F376 S377 V378	L302-A350 HydrophobicContact CD1-CB 3.96Å; A350-I354 HydrophobicContact CB-CB 4.41Å; A350-L355 HydrophobicContact CB-CD2 3.71Å; A350-L355 HydrophobicContact CB-CG 4.08Å; A350-F376 PolarHBondContact N-O 3.11Å; A350-S377 WeakPolarHBondContact O-CA 3.17Å; A350-V378 PolarHBondContact O-N 3.01Å
351	I	91.8	Very high	95	Very high	60 Å²	60	36.2 Å²	36.2	31%	0.308	18%	0.184	S	C	.	.			trans	-86.3	153.9	167.3	60	173	0	0	0	110.2	L303 S353 I354 L355 A379	L303-I351 HydrophobicContact CD2-CG2 3.87Å; I351-S353 VanDerWaalsContact CD1-OG 3.28Å; I351-S353 WeakPolarHBondContact CD1-OG 3.29Å; I351-S353 WeakPolarHBondContact CG1-OG 3.4Å; I351-S353 PolarHBondContact O-N 3.44Å; I351-I354 HydrophobicContact CG1-CG1 4.08Å; I351-I354 PolarHBondContact O-N 3.22Å; I351-L355 PolarHBondContact O-N 3.03Å; I351-A379 HydrophobicContact CG2-CB 4.16Å
352	P	90.8	Very high	94.8	Very high	15 Å²	15	38.4 Å²	38.4	10%	0.097	20%	0.198	C	C	.	.	H	α-helix	trans	-53.5	-30	-176	-30.7	36.4	0	0	0	115.7	I354 L355 E356 A380 P381	P352-I354 VanDerWaalsContact C-N 3.34Å; P352-I354 PolarHBondContact O-N 2.87Å; P352-L355 WeakPolarHBondContact O-CB 3.44Å; P352-L355 PolarHBondContact O-N 3.45Å; P352-E356 WeakPolarHBondContact O-CB 3.5Å; P352-E356 PolarHBondContact O-N 3.49Å; P352-A380 HydrophobicContact CG-CB 3.88Å; P352-A380 WeakPolarHBondContact CG-O 3.38Å; P352-P381 WeakPolarHBondContact CG-O 3.47Å
353	S	91.4	Very high	94.7	Very high	69 Å²	69	35.4 Å²	35.4	48%	0.483	19%	0.185	S	C	.	.	H	α-helix	trans	-68.2	-30.7	178.8	58.2	0	0	0	0	113.6	I351 F357	I351-S353 VanDerWaalsContact CD1-OG 3.28Å; I351-S353 WeakPolarHBondContact CD1-OG 3.29Å; I351-S353 WeakPolarHBondContact CG1-OG 3.4Å; I351-S353 PolarHBondContact O-N 3.44Å; S353-F357 PolarHBondContact O-N 3.12Å
354	I	92.7	Very high	94.7	Very high	8 Å²	8	35 Å²	35	4%	0.041	18%	0.183	C	C	.	.	H	α-helix	trans	-71.9	-40.3	171.7	-61.1	-61	0	0	0	109.6	L302 V331 P333 A350 I351 P352 E356 F357 L358	L302-I354 HydrophobicContact CD1-CB 4.46Å; L302-I354 HydrophobicContact CD1-CG1 4.35Å; L302-I354 HydrophobicContact CD1-CG2 3.84Å; V331-I354 HydrophobicContact CG1-CD1 4.21Å; V331-I354 HydrophobicContact CG1-CG1 4.47Å; P333-I354 HydrophobicContact CG-CD1 4.04Å; A350-I354 HydrophobicContact CB-CB 4.41Å; I351-I354 HydrophobicContact CG1-CG1 4.08Å; I351-I354 PolarHBondContact O-N 3.22Å; P352-I354 VanDerWaalsContact C-N 3.34Å; P352-I354 PolarHBondContact O-N 2.87Å; I354-E356 VanDerWaalsContact C-N 3.32Å; I354-E356 PolarHBondContact O-N 3.3Å; I354-F357 WeakPolarHBondContact O-CB 3.39Å; I354-F357 PolarHBondContact O-N 2.84Å; I354-L358 HydrophobicContact CG2-CD1 4.41Å; I354-L358 WeakPolarHBondContact O-CG 3.35Å; I354-L358 PolarHBondContact O-N 2.98Å
355	L	93.8	Very high	94.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.6	-37.6	178.3	-63	-169.1	0	0	0	112.6	A350 I351 P352 L358 A359 V375 S377 I382 I386 L390 L399	A350-L355 HydrophobicContact CB-CD2 3.71Å; A350-L355 HydrophobicContact CB-CG 4.08Å; I351-L355 PolarHBondContact O-N 3.03Å; P352-L355 WeakPolarHBondContact O-CB 3.44Å; P352-L355 PolarHBondContact O-N 3.45Å; L355-L358 HydrophobicContact CD2-CD1 4.32Å; L355-L358 PolarHBondContact O-N 2.7Å; L355-A359 WeakPolarHBondContact O-CB 3.47Å; L355-A359 PolarHBondContact O-N 3.43Å; L355-V375 HydrophobicContact CD1-CG1 4.28Å; L355-V375 HydrophobicContact CD2-CG1 3.4Å; L355-V375 VanDerWaalsContact CD2-CG1 3.4Å; L355-V375 HydrophobicContact CG-CG1 4.5Å; L355-S377 VanDerWaalsContact CD1-CB 3.46Å; L355-I382 HydrophobicContact CD1-CD1 3.81Å; L355-I386 HydrophobicContact CB-CG2 3.95Å; L355-L390 HydrophobicContact CB-CD1 3.72Å; L355-L390 HydrophobicContact CD1-CD1 4.37Å; L355-L390 HydrophobicContact CD2-CD1 4.11Å; L355-L390 HydrophobicContact CG-CD1 4.27Å; L355-L399 HydrophobicContact CD1-CD1 4.39Å
356	E	94.7	Very high	94.5	Very high	101 Å²	101	45 Å²	45	47%	0.472	23%	0.234	S	C	.	.	H	α-helix	trans	-59.6	-46.1	172	-174.1	178.2	-176.2	0	0	111.6	P352 I354 L358 A359 F360 I386	P352-E356 WeakPolarHBondContact O-CB 3.5Å; P352-E356 PolarHBondContact O-N 3.49Å; I354-E356 VanDerWaalsContact C-N 3.32Å; I354-E356 PolarHBondContact O-N 3.3Å; E356-L358 VanDerWaalsContact C-N 3.33Å; E356-L358 PolarHBondContact O-N 3.07Å; E356-A359 PolarHBondContact O-N 2.74Å; E356-F360 HydrophobicContact CG-CD2 3.77Å; E356-F360 HydrophobicContact CG-CE2 4.04Å; E356-F360 VanDerWaalsContact O-CD2 3.23Å; E356-F360 WeakPolarHBondContact O-CD2 3.25Å; E356-F360 PolarHBondContact O-N 2.74Å; E356-F360 VanDerWaalsContact O-N 3.08Å; E356-I386 HydrophobicContact CB-CD1 3.94Å; E356-I386 HydrophobicContact CB-CG1 4.24Å; E356-I386 HydrophobicContact CG-CD1 4.27Å; E356-I386 HydrophobicContact CG-CG1 4.34Å
357	F	94.5	Very high	94.4	Very high	39 Å²	39	47 Å²	47	17%	0.171	24%	0.239	C	C	.	.	H	α-helix	trans	-58.9	-45.5	175.3	175.4	-86.2	0	0	0	111.4	P333 L337 S353 I354 A359 F360 N361 M363 V364	P333-F357 HydrophobicContact CB-CB 4.09Å; P333-F357 HydrophobicContact CB-CD1 3.36Å; P333-F357 HydrophobicContact CB-CD2 3.55Å; P333-F357 HydrophobicContact CB-CE1 3.49Å; P333-F357 VanDerWaalsContact CB-CE1 3.49Å; P333-F357 HydrophobicContact CB-CE2 3.69Å; P333-F357 HydrophobicContact CB-CG 3.38Å; P333-F357 HydrophobicContact CB-CZ 3.67Å; P333-F357 HydrophobicContact CG-CB 4.31Å; P333-F357 HydrophobicContact CG-CD1 4.41Å; P333-F357 HydrophobicContact CG-CD2 3.95Å; P333-F357 HydrophobicContact CG-CE2 4.35Å; P333-F357 HydrophobicContact CG-CG 3.98Å; L337-F357 HydrophobicContact CD1-CE1 3.76Å; L337-F357 HydrophobicContact CD1-CZ 4.17Å; L337-F357 HydrophobicContact CG-CE1 4.27Å; S353-F357 PolarHBondContact O-N 3.12Å; I354-F357 WeakPolarHBondContact O-CB 3.39Å; I354-F357 PolarHBondContact O-N 2.84Å; F357-A359 VanDerWaalsContact C-N 3.31Å; F357-A359 PolarHBondContact O-N 3.1Å; F357-F360 PolarHBondContact O-N 3.03Å; F357-N361 HydrophobicContact CD1-CB 4.33Å; F357-N361 HydrophobicContact CD2-CB 3.76Å; F357-N361 HydrophobicContact CE1-CB 4.29Å; F357-N361 HydrophobicContact CE2-CB 3.7Å; F357-N361 VanDerWaalsContact CE2-CG 3.43Å; F357-N361 WeakPolarHBondContact CE2-ND2 3.31Å; F357-N361 HydrophobicContact CG-CB 4.08Å; F357-N361 HydrophobicContact CZ-CB 3.98Å; F357-N361 WeakPolarHBondContact O-CB 3.35Å; F357-N361 PolarHBondContact O-N 2.79Å; F357-M363 HydrophobicContact CZ-SD 4.37Å; F357-V364 HydrophobicContact CD1-CG2 4.22Å; F357-V364 HydrophobicContact CE1-CG2 3.86Å
358	L	93.8	Very high	94.3	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-63.8	-35.1	177.9	-65.7	178.6	0	0	0	113.1	F336 L337 I354 L355 E356 V364 L390 R393	F336-L358 HydrophobicContact CD1-CD1 4.31Å; F336-L358 HydrophobicContact CD1-CD2 3.66Å; F336-L358 HydrophobicContact CD1-CG 4.42Å; F336-L358 HydrophobicContact CE1-CD1 3.6Å; F336-L358 HydrophobicContact CE1-CD2 3.26Å; F336-L358 HydrophobicContact CE1-CG 3.99Å; F336-L358 HydrophobicContact CE2-CD1 4.46Å; F336-L358 HydrophobicContact CZ-CD1 3.66Å; F336-L358 HydrophobicContact CZ-CD2 4.19Å; L337-L358 HydrophobicContact CD2-CD2 3.91Å; I354-L358 HydrophobicContact CG2-CD1 4.41Å; I354-L358 WeakPolarHBondContact O-CG 3.35Å; I354-L358 PolarHBondContact O-N 2.98Å; L355-L358 HydrophobicContact CD2-CD1 4.32Å; L355-L358 PolarHBondContact O-N 2.7Å; E356-L358 VanDerWaalsContact C-N 3.33Å; E356-L358 PolarHBondContact O-N 3.07Å; L358-V364 HydrophobicContact CD2-CG1 4.32Å; L358-V364 HydrophobicContact CD2-CG2 4.07Å; L358-L390 HydrophobicContact CB-CD2 3.68Å; L358-R393 VanDerWaalsContact O-CD 3.31Å; L358-R393 WeakPolarHBondContact O-CD 3.24Å; L358-R393 PolarHBondContact O-NH1 3.14Å
359	A	94.1	Very high	94.3	Very high	11 Å²	11	51.2 Å²	51.2	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-69.3	-39.3	177.8	0	0	0	0	0	113.1	L355 E356 F357 I386 L390	L355-A359 WeakPolarHBondContact O-CB 3.47Å; L355-A359 PolarHBondContact O-N 3.43Å; E356-A359 PolarHBondContact O-N 2.74Å; F357-A359 VanDerWaalsContact C-N 3.31Å; F357-A359 PolarHBondContact O-N 3.1Å; A359-I386 HydrophobicContact CB-CG2 4.48Å; A359-L390 HydrophobicContact CB-CD2 4.28Å; A359-L390 HydrophobicContact CB-CG 3.9Å
360	F	95.6	Very high	94.3	Very high	92 Å²	92	55.8 Å²	55.8	40%	0.404	29%	0.294	S	S	.	.	H	α-helix	trans	-121.3	-11.6	-163.3	-57.7	-60.1	0	0	0	116.1	E356 F357 L385 I386 S389	E356-F360 HydrophobicContact CG-CD2 3.77Å; E356-F360 HydrophobicContact CG-CE2 4.04Å; E356-F360 VanDerWaalsContact O-CD2 3.23Å; E356-F360 WeakPolarHBondContact O-CD2 3.25Å; E356-F360 PolarHBondContact O-N 2.74Å; E356-F360 VanDerWaalsContact O-N 3.08Å; F357-F360 PolarHBondContact O-N 3.03Å; F360-L385 HydrophobicContact CZ-CD2 4.36Å; F360-L385 HydrophobicContact CZ-CG 4.01Å; F360-I386 HydrophobicContact CE2-CG1 4.06Å; F360-S389 VanDerWaalsContact CE1-OG 3.25Å; F360-S389 WeakPolarHBondContact CE1-OG 3.25Å
361	N	95.9	Very high	94.4	Very high	59 Å²	59	57.3 Å²	57.3	32%	0.316	30%	0.304	S	S	.	.			trans	-91.1	124.2	-177.7	-161.6	-58.5	0	0	0	111.5	F357 M363 V364 R393	F357-N361 HydrophobicContact CD1-CB 4.33Å; F357-N361 HydrophobicContact CD2-CB 3.76Å; F357-N361 HydrophobicContact CE1-CB 4.29Å; F357-N361 HydrophobicContact CE2-CB 3.7Å; F357-N361 VanDerWaalsContact CE2-CG 3.43Å; F357-N361 WeakPolarHBondContact CE2-ND2 3.31Å; F357-N361 HydrophobicContact CG-CB 4.08Å; F357-N361 HydrophobicContact CZ-CB 3.98Å; F357-N361 WeakPolarHBondContact O-CB 3.35Å; F357-N361 PolarHBondContact O-N 2.79Å; N361-M363 VanDerWaalsContact C-N 3.25Å; N361-M363 PolarHBondContact O-N 3.04Å; N361-M363 WeakPolarHBondContact OD1-CB 3.29Å; N361-M363 PolarHBondContact OD1-N 2.96Å; N361-V364 HydrophobicContact CB-CG2 4.44Å; N361-V364 VanDerWaalsContact O-CG2 3.27Å; N361-V364 WeakPolarHBondContact O-CG2 3.4Å; N361-V364 PolarHBondContact O-N 2.64Å; N361-R393 PolarHBondContact O-NH1 3.44Å; N361-R393 PolarHBondContact O-NH2 3.13Å
362	D	94.4	Very high	94.6	Very high	121 Å²	121	55 Å²	55	65%	0.647	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-65.7	-26.4	-178.3	-61.7	-23.5	0	0	0	112.9	V364 E365	D362-V364 PolarHBondContact O-N 3.09Å; D362-E365 WeakPolarHBondContact O-CB 3.33Å; D362-E365 WeakPolarHBondContact O-CG 3.06Å; D362-E365 PolarHBondContact O-N 3.29Å
363	M	94.3	Very high	94.8	Very high	74 Å²	74	59.6 Å²	59.6	37%	0.365	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-55.4	-23.8	177.7	-176.7	-173.7	-65.8	0	0	113.3	L334 L337 F357 N361 E365 D366 Y367	L334-M363 HydrophobicContact CD1-SD 3.91Å; L337-M363 HydrophobicContact CD1-CG 4.4Å; F357-M363 HydrophobicContact CZ-SD 4.37Å; N361-M363 VanDerWaalsContact C-N 3.25Å; N361-M363 PolarHBondContact O-N 3.04Å; N361-M363 WeakPolarHBondContact OD1-CB 3.29Å; N361-M363 PolarHBondContact OD1-N 2.96Å; M363-E365 PolarHBondContact O-N 3.13Å; M363-D366 WeakPolarHBondContact O-CB 3.2Å; M363-D366 PolarHBondContact O-N 3.02Å; M363-Y367 HydrophobicContact CG-CE2 4.06Å; M363-Y367 WeakPolarHBondContact O-CD2 3.11Å
364	V	95.1	Very high	95	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.024	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-61.9	-24.4	177.2	-177.4	0	0	0	0	111.8	L337 F357 L358 N361 D362 D366 Y367 F394	L337-V364 HydrophobicContact CD1-CG2 4.16Å; L337-V364 HydrophobicContact CD2-CB 4.29Å; L337-V364 HydrophobicContact CD2-CG1 3.88Å; L337-V364 HydrophobicContact CD2-CG2 4.16Å; F357-V364 HydrophobicContact CD1-CG2 4.22Å; F357-V364 HydrophobicContact CE1-CG2 3.86Å; L358-V364 HydrophobicContact CD2-CG1 4.32Å; L358-V364 HydrophobicContact CD2-CG2 4.07Å; N361-V364 HydrophobicContact CB-CG2 4.44Å; N361-V364 VanDerWaalsContact O-CG2 3.27Å; N361-V364 WeakPolarHBondContact O-CG2 3.4Å; N361-V364 PolarHBondContact O-N 2.64Å; D362-V364 PolarHBondContact O-N 3.09Å; V364-D366 PolarHBondContact O-N 3.46Å; V364-Y367 PolarHBondContact O-N 3.33Å; V364-F394 HydrophobicContact CG1-CZ 3.7Å
365	E	94.3	Very high	95.2	Very high	145 Å²	145	57.5 Å²	57.5	68%	0.678	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-72	-16.3	175.9	-54.7	-173.4	171.9	0	0	113.1	D362 M363 Y367 R393	D362-E365 WeakPolarHBondContact O-CB 3.33Å; D362-E365 WeakPolarHBondContact O-CG 3.06Å; D362-E365 PolarHBondContact O-N 3.29Å; M363-E365 PolarHBondContact O-N 3.13Å; E365-Y367 VanDerWaalsContact C-N 3.27Å; E365-Y367 PolarHBondContact O-N 3.25Å; E365-R393 VanDerWaalsContact CG-NH2 3.27Å; E365-R393 IonicContact OE1-NH2 3.78Å
366	D	96.4	Very high	95.2	Very high	128 Å²	128	57.7 Å²	57.7	68%	0.684	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-82.1	-3.5	179.2	-59.9	-38.5	0	0	0	113	M363 V364	M363-D366 WeakPolarHBondContact O-CB 3.2Å; M363-D366 PolarHBondContact O-N 3.02Å; V364-D366 PolarHBondContact O-N 3.46Å
367	Y	96.9	Very high	95.3	Very high	58 Å²	58	52.9 Å²	52.9	23%	0.227	27%	0.273	C	S	.	.	S	Bend	trans	-126.8	140.7	-175.1	-67.8	-92.7	0	0	0	111.9	L334 L337 R338 M363 V364 E365 V369	L334-Y367 HydrophobicContact CD1-CE2 4.33Å; L334-Y367 VanDerWaalsContact CD1-OH 3.24Å; L334-Y367 WeakPolarHBondContact CD1-OH 3.43Å; L337-Y367 HydrophobicContact CB-CD1 3.98Å; L337-Y367 HydrophobicContact CB-CD2 3.84Å; L337-Y367 HydrophobicContact CB-CE1 4.31Å; L337-Y367 HydrophobicContact CB-CE2 4.16Å; L337-Y367 HydrophobicContact CB-CG 3.73Å; L337-Y367 HydrophobicContact CD1-CD2 3.63Å; L337-Y367 HydrophobicContact CD1-CE2 3.9Å; L337-Y367 HydrophobicContact CD1-CG 4.32Å; L337-Y367 HydrophobicContact CG-CD2 4.27Å; L337-Y367 HydrophobicContact CG-CG 4.49Å; R338-Y367 HydrophobicContact CG-CE1 3.78Å; M363-Y367 HydrophobicContact CG-CE2 4.06Å; M363-Y367 WeakPolarHBondContact O-CD2 3.11Å; V364-Y367 PolarHBondContact O-N 3.33Å; E365-Y367 VanDerWaalsContact C-N 3.27Å; E365-Y367 PolarHBondContact O-N 3.25Å; Y367-V369 PolarHBondContact O-N 2.85Å
368	D	95.6	Very high	95.2	Very high	72 Å²	72	51 Å²	51	39%	0.385	27%	0.265	S	S	.	.			trans	-78.9	100.5	171.6	-176.9	11.5	0	0	0	111.3	E341 S370	E341-D368 VanDerWaalsContact CA-O 3.25Å; E341-D368 WeakPolarHBondContact CA-O 3.12Å; E341-D368 WeakPolarHBondContact CB-O 3.1Å; E341-D368 HydrophobicContact CG-CB 4.19Å; E341-D368 PolarHBondContact OE1-N 3.13Å; D368-S370 WeakPolarHBondContact OD1-CB 3.47Å; D368-S370 PolarHBondContact OD1-N 3.45Å; D368-S370 PolarHBondContact OD1-OG 2.86Å
369	V	95	Very high	94.7	Very high	16 Å²	16	53.5 Å²	53.5	10%	0.097	29%	0.286	C	S	.	.			trans	-108.7	21.2	173.2	-61.1	0	0	0	0	112.3	L337 Y367 T371 L372 F394	L337-V369 HydrophobicContact CD2-CG1 4Å; Y367-V369 PolarHBondContact O-N 2.85Å; V369-T371 PolarHBondContact O-N 2.79Å; V369-L372 WeakPolarHBondContact O-CB 3.45Å; V369-L372 PolarHBondContact O-N 2.97Å; V369-L372 VanDerWaalsContact O-N 3.11Å; V369-F394 HydrophobicContact CG2-CE1 3.67Å; V369-F394 HydrophobicContact CG2-CZ 4.13Å
370	S	94.8	Very high	94.3	Very high	96 Å²	96	55.2 Å²	55.2	67%	0.671	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-19	-173.5	63.4	0	0	0	0	114.5	D368 L372	D368-S370 WeakPolarHBondContact OD1-CB 3.47Å; D368-S370 PolarHBondContact OD1-N 3.45Å; D368-S370 PolarHBondContact OD1-OG 2.86Å; S370-L372 VanDerWaalsContact C-N 3.31Å
371	T	96.7	Very high	93.8	Very high	32 Å²	32	55.2 Å²	55.2	20%	0.196	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-11.7	175.9	59.7	0	0	0	0	114	Q344 I345 S346 V369 E373	Q344-T371 WeakPolarHBondContact CA-OG1 3.39Å; Q344-T371 HydrophobicContact CB-CG2 4.02Å; Q344-T371 HydrophobicContact CG-CG2 4.49Å; I345-T371 PolarHBondContact N-OG1 3.11Å; I345-T371 CarbonylContact O-C 3.41Å; I345-T371 PolarHBondContact O-OG1 3.26Å; S346-T371 WeakPolarHBondContact CA-O 3.25Å; V369-T371 PolarHBondContact O-N 2.79Å; T371-E373 PolarHBondContact O-N 3.01Å
372	L	96.2	Very high	93.5	Very high	12 Å²	12	53.4 Å²	53.4	6%	0.063	30%	0.3	C	S	.	.			trans	-70	118.7	-179.5	-171	62.8	0	0	0	109.1	F336 I345 C348 V369 S370 V375 I397	F336-L372 HydrophobicContact CZ-CD2 4.14Å; I345-L372 HydrophobicContact CG2-CD1 4.27Å; I345-L372 WeakPolarHBondContact O-CA 3.44Å; I345-L372 PolarHBondContact O-N 2.68Å; C348-L372 HydrophobicContact CB-CD1 4.42Å; V369-L372 WeakPolarHBondContact O-CB 3.45Å; V369-L372 PolarHBondContact O-N 2.97Å; V369-L372 VanDerWaalsContact O-N 3.11Å; S370-L372 VanDerWaalsContact C-N 3.31Å; L372-V375 HydrophobicContact CD1-CG2 4.27Å; L372-V375 HydrophobicContact CD2-CG2 3.78Å; L372-V375 HydrophobicContact CG-CG2 4.04Å; L372-I397 HydrophobicContact CB-CD1 4Å; L372-I397 HydrophobicContact CD2-CD1 3.61Å; L372-I397 HydrophobicContact CG-CD1 3.71Å; L372-I397 HydrophobicContact CG-CG1 4.47Å; L372-I397 VanDerWaalsContact O-CG1 3.27Å; L372-I397 WeakPolarHBondContact O-CG1 3.47Å
373	E	95.6	Very high	93.2	Very high	111 Å²	111	52.2 Å²	52.2	52%	0.519	29%	0.293	S	S	.	.			trans	-110.3	-38	-176.1	-69.4	174.3	-178.9	0	0	111.6	S346 T371 I397 L398	S346-E373 PolarHBondContact O-N 2.88Å; T371-E373 PolarHBondContact O-N 3.01Å; E373-I397 WeakPolarHBondContact O-CA 3.18Å; E373-L398 PolarHBondContact O-N 3.02Å
374	M	95.5	Very high	92.8	Very high	27 Å²	27	50.9 Å²	50.9	13%	0.133	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.3	-177.8	-51.2	-176.3	-111.4	0	0	112.5	F293 S346 V347 C348 F376 L398 Y400	F293-M374 HydrophobicContact CD1-CE 4.37Å; F293-M374 HydrophobicContact CE1-CE 4.15Å; S346-M374 PolarHBondContact O-N 2.97Å; V347-M374 VanDerWaalsContact CA-O 3.31Å; V347-M374 WeakPolarHBondContact CA-O 3.46Å; V347-M374 HydrophobicContact CG1-CB 4.36Å; V347-M374 HydrophobicContact CG2-CB 4.09Å; V347-M374 HydrophobicContact CG2-CE 3.82Å; V347-M374 HydrophobicContact CG2-CG 4.43Å; C348-M374 PolarHBondContact N-O 2.63Å; C348-M374 VanDerWaalsContact N-O 3.09Å; M374-F376 HydrophobicContact CB-CE2 3.99Å; M374-F376 HydrophobicContact SD-CE2 4.43Å; M374-L398 WeakPolarHBondContact CA-O 3.17Å; M374-L398 HydrophobicContact CG-CB 4.18Å; M374-L398 HydrophobicContact CG-CD1 4.27Å; M374-Y400 HydrophobicContact CB-CE2 4.41Å; M374-Y400 HydrophobicContact CG-CE2 4.35Å; M374-Y400 HydrophobicContact SD-CE2 4.09Å
375	V	95.6	Very high	92.6	Very high	5 Å²	5	56 Å²	56	3%	0.03	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	122.2	176.5	174.8	0	0	0	0	108.8	L355 L372 I397 L398 L399 Y400	L355-V375 HydrophobicContact CD1-CG1 4.28Å; L355-V375 HydrophobicContact CD2-CG1 3.4Å; L355-V375 VanDerWaalsContact CD2-CG1 3.4Å; L355-V375 HydrophobicContact CG-CG1 4.5Å; L372-V375 HydrophobicContact CD1-CG2 4.27Å; L372-V375 HydrophobicContact CD2-CG2 3.78Å; L372-V375 HydrophobicContact CG-CG2 4.04Å; V375-I397 HydrophobicContact CB-CG2 4.04Å; V375-I397 HydrophobicContact CG2-CD1 4.38Å; V375-I397 HydrophobicContact CG2-CG2 3.6Å; V375-L398 PolarHBondContact N-O 3.22Å; V375-L399 HydrophobicContact CB-CD1 4.06Å; V375-L399 HydrophobicContact CG1-CD1 3.82Å; V375-L399 CarbonylContact O-C 3.54Å; V375-Y400 PolarHBondContact O-N 3.3Å
376	F	95.4	Very high	92.5	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	109.4	175.9	-68.6	-100.6	0	0	0	109.6	T291 F293 V347 C348 F349 A350 M374 V378 Y400 I414	T291-F376 HydrophobicContact CG2-CE1 4.24Å; T291-F376 HydrophobicContact CG2-CZ 4.06Å; F293-F376 HydrophobicContact CE1-CE2 4.36Å; F293-F376 HydrophobicContact CZ-CE2 4.14Å; F293-F376 HydrophobicContact CZ-CZ 4.4Å; V347-F376 HydrophobicContact CG1-CD2 3.82Å; V347-F376 HydrophobicContact CG1-CE2 3.71Å; C348-F376 PolarHBondContact O-N 2.99Å; F349-F376 HydrophobicContact CD1-CB 3.47Å; F349-F376 VanDerWaalsContact CD1-CB 3.47Å; F349-F376 HydrophobicContact CD1-CD2 4.19Å; F349-F376 AromaticContact CD1-CG 3.84Å; F349-F376 HydrophobicContact CD1-CG 3.84Å; F349-F376 HydrophobicContact CE1-CB 3.77Å; F349-F376 HydrophobicContact CE1-CD1 4.01Å; F349-F376 AromaticContact CE1-CD2 3.78Å; F349-F376 HydrophobicContact CE1-CD2 3.78Å; F349-F376 HydrophobicContact CE1-CE2 4.4Å; F349-F376 AromaticContact CE1-CG 3.58Å; F349-F376 HydrophobicContact CE1-CG 3.58Å; F349-F376 HydrophobicContact CG-CB 4.39Å; F349-F376 HydrophobicContact CZ-CD2 4.25Å; F349-F376 HydrophobicContact CZ-CG 4.46Å; A350-F376 PolarHBondContact N-O 3.11Å; M374-F376 HydrophobicContact CB-CE2 3.99Å; M374-F376 HydrophobicContact SD-CE2 4.43Å; F376-V378 HydrophobicContact CB-CG1 4.21Å; F376-Y400 HydrophobicContact CD1-CD2 4.28Å; F376-Y400 AromaticContact CD1-CG 3.98Å; F376-Y400 HydrophobicContact CD1-CG 3.98Å; F376-Y400 HydrophobicContact CE1-CD1 4.23Å; F376-Y400 AromaticContact CE1-CD2 3.84Å; F376-Y400 HydrophobicContact CE1-CD2 3.84Å; F376-Y400 HydrophobicContact CE1-CE2 4.5Å; F376-Y400 AromaticContact CE1-CG 3.68Å; F376-Y400 HydrophobicContact CE1-CG 3.68Å; F376-Y400 HydrophobicContact CE2-CD2 4.1Å; F376-Y400 AromaticContact CZ-CD2 3.73Å; F376-Y400 HydrophobicContact CZ-CD2 3.73Å; F376-Y400 HydrophobicContact CZ-CE2 4.1Å; F376-Y400 HydrophobicContact CZ-CG 4.08Å; F376-I414 HydrophobicContact CD1-CD1 4.02Å; F376-I414 HydrophobicContact CE1-CD1 3.76Å
377	S	94.8	Very high	92.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	117.2	168.3	-176.8	0	0	0	0	110	A350 L355 Y400 A402	A350-S377 WeakPolarHBondContact O-CA 3.17Å; L355-S377 VanDerWaalsContact CD1-CB 3.46Å; S377-Y400 PolarHBondContact N-O 3.07Å; S377-A402 PolarHBondContact O-N 3.24Å
378	V	93.1	Very high	92.1	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	27%	0.272	C	S	.	.			trans	-137.7	172.3	-175.6	-56	0	0	0	0	112.3	L303 F309 L313 A350 F376 A380 A402	L303-V378 HydrophobicContact CD1-CG2 3.84Å; L303-V378 HydrophobicContact CD2-CG2 3.92Å; L303-V378 HydrophobicContact CG-CG2 4.45Å; F309-V378 HydrophobicContact CD2-CB 4.31Å; F309-V378 HydrophobicContact CD2-CG2 4.46Å; L313-V378 HydrophobicContact CD1-CB 4.43Å; L313-V378 HydrophobicContact CD1-CG1 4.01Å; L313-V378 HydrophobicContact CD1-CG2 4.46Å; A350-V378 PolarHBondContact O-N 3.01Å; F376-V378 HydrophobicContact CB-CG1 4.21Å; V378-A380 PolarHBondContact O-N 2.86Å; V378-A402 HydrophobicContact CG1-CB 4.09Å
379	A	84.1	Confident	92	Very high	56 Å²	56	43.1 Å²	43.1	46%	0.463	26%	0.264	S	S	.	.	S	Bend	trans	65.2	-16.6	175.3	0	0	0	0	0	117.1	F309 I351	F309-A379 HydrophobicContact CD2-CB 4.15Å; F309-A379 HydrophobicContact CE2-CB 4.22Å; I351-A379 HydrophobicContact CG2-CB 4.16Å
380	A	85.8	Confident	91.9	Very high	46 Å²	46	43 Å²	43	38%	0.38	26%	0.262	S	S	.	.	S	Bend	trans	-151	158.2	171.1	0	0	0	0	0	111.8	P352 V378 I382	P352-A380 HydrophobicContact CG-CB 3.88Å; P352-A380 WeakPolarHBondContact CG-O 3.38Å; V378-A380 PolarHBondContact O-N 2.86Å; A380-I382 PolarHBondContact O-N 3.39Å
381	P	85	Confident	91.7	Very high	92 Å²	92	40.4 Å²	40.4	60%	0.597	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-60.6	133.3	175.5	-20.7	32.5	0	0	0	111.6	P352 M514	P352-P381 WeakPolarHBondContact CG-O 3.47Å; P381-M514 HydrophobicContact CG-CE 4.27Å
382	I	89.6	Confident	91.5	Very high	22 Å²	22	47.8 Å²	47.8	11%	0.113	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-86.2	138.4	170.1	-169.1	169.1	0	0	0	110.6	L355 A380 I386 A387 L399 N401 L417	L355-I382 HydrophobicContact CD1-CD1 3.81Å; A380-I382 PolarHBondContact O-N 3.39Å; I382-I386 HydrophobicContact CD1-CG2 4.35Å; I382-I386 HydrophobicContact CG1-CB 4.33Å; I382-I386 HydrophobicContact CG1-CG2 4.29Å; I382-A387 HydrophobicContact CD1-CB 3.98Å; I382-A387 HydrophobicContact CG1-CB 4.33Å; I382-L399 HydrophobicContact CD1-CD1 4.45Å; I382-L399 HydrophobicContact CD1-CD2 4.14Å; I382-N401 HydrophobicContact CG2-CB 4.31Å; I382-L417 HydrophobicContact CG2-CD1 4.13Å
383	D	87.6	Confident	91.4	Very high	95 Å²	95	50 Å²	50	51%	0.508	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-81.2	143.2	174.1	-169.3	-85.8	0	0	0	111	L385 I386 A387	D383-L385 PolarHBondContact O-N 3.42Å; D383-L385 WeakPolarHBondContact OD1-CA 3.41Å; D383-L385 WeakPolarHBondContact OD1-CB 3.41Å; D383-L385 PolarHBondContact OD1-N 3.28Å; D383-I386 HydrophobicContact CB-CB 4.5Å; D383-I386 HydrophobicContact CB-CD1 3.94Å; D383-I386 HydrophobicContact CB-CG1 4.13Å; D383-I386 PolarHBondContact O-N 3.27Å; D383-I386 VanDerWaalsContact O-N 3.12Å; D383-A387 PolarHBondContact O-N 3.48Å
384	D	86.4	Confident	91.3	Very high	47 Å²	47	46.5 Å²	46.5	25%	0.251	26%	0.26	S	S	.	.	H	α-helix	trans	-57.8	-35.4	178.2	-75	-14	0	0	0	112.9	I386 A387 S388 R423	D384-I386 VanDerWaalsContact C-N 3.35Å; D384-A387 PolarHBondContact O-N 2.88Å; D384-S388 WeakPolarHBondContact O-CB 3.12Å; D384-S388 PolarHBondContact O-N 3.36Å; D384-S388 PolarHBondContact O-OG 3.5Å; D384-R423 WeakPolarHBondContact OD1-CG 2.92Å; D384-R423 IonicContact OD1-NE 2.78Å; D384-R423 WeakPolarHBondContact OD2-CG 3.47Å; D384-R423 IonicContact OD2-CZ 3.33Å; D384-R423 IonicContact OD2-NE 3.79Å; D384-R423 PolarHBondContact OD2-NE 3.12Å; D384-R423 IonicContact OD2-NH2 3.68Å; D384-R423 PolarHBondContact OD2-NH2 2.86Å
385	L	90.8	Very high	91.1	Very high	110 Å²	110	49.4 Å²	49.4	58%	0.576	28%	0.28	S	S	*	.	H	α-helix	trans	-65.8	-42.5	179.4	-175	65.8	0	0	0	110.1	F360 D383 S389	F360-L385 HydrophobicContact CZ-CD2 4.36Å; F360-L385 HydrophobicContact CZ-CG 4.01Å; D383-L385 PolarHBondContact O-N 3.42Å; D383-L385 WeakPolarHBondContact OD1-CA 3.41Å; D383-L385 WeakPolarHBondContact OD1-CB 3.41Å; D383-L385 PolarHBondContact OD1-N 3.28Å; L385-S389 WeakPolarHBondContact O-CB 3.48Å; L385-S389 PolarHBondContact O-N 2.96Å; L385-S389 PolarHBondContact O-OG 2.98Å
386	I	92.6	Very high	90.9	Very high	17 Å²	17	56.3 Å²	56.3	9%	0.087	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-52.6	175.4	-62.6	168.2	0	0	0	109.2	L355 E356 A359 F360 I382 D383 D384 S388 S389 L390	L355-I386 HydrophobicContact CB-CG2 3.95Å; E356-I386 HydrophobicContact CB-CD1 3.94Å; E356-I386 HydrophobicContact CB-CG1 4.24Å; E356-I386 HydrophobicContact CG-CD1 4.27Å; E356-I386 HydrophobicContact CG-CG1 4.34Å; A359-I386 HydrophobicContact CB-CG2 4.48Å; F360-I386 HydrophobicContact CE2-CG1 4.06Å; I382-I386 HydrophobicContact CD1-CG2 4.35Å; I382-I386 HydrophobicContact CG1-CB 4.33Å; I382-I386 HydrophobicContact CG1-CG2 4.29Å; D383-I386 HydrophobicContact CB-CB 4.5Å; D383-I386 HydrophobicContact CB-CD1 3.94Å; D383-I386 HydrophobicContact CB-CG1 4.13Å; D383-I386 PolarHBondContact O-N 3.27Å; D383-I386 VanDerWaalsContact O-N 3.12Å; D384-I386 VanDerWaalsContact C-N 3.35Å; I386-S388 PolarHBondContact O-N 3.47Å; I386-S389 PolarHBondContact O-N 3.24Å; I386-L390 HydrophobicContact CG2-CD1 4.18Å; I386-L390 WeakPolarHBondContact O-CB 3.4Å; I386-L390 PolarHBondContact O-N 3.49Å
387	A	91.8	Very high	90.8	Very high	11 Å²	11	56.9 Å²	56.9	9%	0.091	32%	0.32	C	S	.	.	H	α-helix	trans	-59.8	-46.4	-178.3	0	0	0	0	0	112.5	I382 D383 D384 S389 L390 Q391 L399 L417	I382-A387 HydrophobicContact CD1-CB 3.98Å; I382-A387 HydrophobicContact CG1-CB 4.33Å; D383-A387 PolarHBondContact O-N 3.48Å; D384-A387 PolarHBondContact O-N 2.88Å; A387-S389 PolarHBondContact O-N 3.24Å; A387-L390 PolarHBondContact O-N 2.96Å; A387-Q391 PolarHBondContact O-N 3.42Å; A387-L399 HydrophobicContact CB-CD2 3.77Å; A387-L417 HydrophobicContact CB-CD1 3.96Å
388	S	91.4	Very high	90.7	Very high	76 Å²	76	60.4 Å²	60.4	53%	0.531	34%	0.339	S	S	.	.	H	α-helix	trans	-66.9	-37.1	179.9	-55.4	0	0	0	0	112	D384 I386 K392	D384-S388 WeakPolarHBondContact O-CB 3.12Å; D384-S388 PolarHBondContact O-N 3.36Å; D384-S388 PolarHBondContact O-OG 3.5Å; I386-S388 PolarHBondContact O-N 3.47Å; S388-K392 WeakPolarHBondContact O-CB 3.34Å; S388-K392 PolarHBondContact O-N 3.02Å
389	S	93.7	Very high	90.7	Very high	29 Å²	29	60.6 Å²	60.6	20%	0.203	34%	0.34	C	S	.	.	H	α-helix	trans	-71.4	-39.7	178.4	-56.8	0	0	0	0	111.4	F360 L385 I386 A387 K392 R393	F360-S389 VanDerWaalsContact CE1-OG 3.25Å; F360-S389 WeakPolarHBondContact CE1-OG 3.25Å; L385-S389 WeakPolarHBondContact O-CB 3.48Å; L385-S389 PolarHBondContact O-N 2.96Å; L385-S389 PolarHBondContact O-OG 2.98Å; I386-S389 PolarHBondContact O-N 3.24Å; A387-S389 PolarHBondContact O-N 3.24Å; S389-K392 PolarHBondContact O-N 3.42Å; S389-R393 WeakPolarHBondContact O-CB 3.34Å; S389-R393 PolarHBondContact O-N 2.81Å
390	L	92.9	Very high	91.2	Very high	13 Å²	13	60 Å²	60	7%	0.068	33%	0.326	C	S	.	.	H	α-helix	trans	-58.7	-50.3	171.1	-88.5	176.2	0	0	0	111.7	L355 L358 A359 I386 A387 K392 R393 F394 L399	L355-L390 HydrophobicContact CB-CD1 3.72Å; L355-L390 HydrophobicContact CD1-CD1 4.37Å; L355-L390 HydrophobicContact CD2-CD1 4.11Å; L355-L390 HydrophobicContact CG-CD1 4.27Å; L358-L390 HydrophobicContact CB-CD2 3.68Å; A359-L390 HydrophobicContact CB-CD2 4.28Å; A359-L390 HydrophobicContact CB-CG 3.9Å; I386-L390 HydrophobicContact CG2-CD1 4.18Å; I386-L390 WeakPolarHBondContact O-CB 3.4Å; I386-L390 PolarHBondContact O-N 3.49Å; A387-L390 PolarHBondContact O-N 2.96Å; L390-K392 VanDerWaalsContact C-N 3.26Å; L390-K392 PolarHBondContact O-N 3.16Å; L390-R393 PolarHBondContact O-N 3.4Å; L390-R393 VanDerWaalsContact O-N 3.16Å; L390-F394 HydrophobicContact CD2-CD2 3.99Å; L390-F394 HydrophobicContact CD2-CE2 4.16Å; L390-F394 PolarHBondContact O-N 3.12Å; L390-L399 HydrophobicContact CD1-CD1 4.49Å; L390-L399 HydrophobicContact CD1-CD2 4.41Å
391	Q	91.3	Very high	91.6	Very high	43 Å²	43	58.3 Å²	58.3	20%	0.201	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-35.3	179.6	-162.5	69.4	54.2	0	0	112	A387 F394 P395 I397 P418	A387-Q391 PolarHBondContact O-N 3.42Å; Q391-F394 CarbonylContact O-C 3.57Å; Q391-P395 PolarHBondContact NE2-O 3.01Å; Q391-P395 WeakPolarHBondContact O-CA 3.15Å; Q391-I397 PolarHBondContact NE2-O 3.48Å; Q391-P418 HydrophobicContact CG-CG 4.45Å
392	K	93	Very high	92	Very high	187 Å²	187	54.1 Å²	54.1	81%	0.813	28%	0.284	S	S	*	.	H	α-helix	trans	-67.1	-40.5	175.9	-174.1	-177.6	176.9	-170.3	0	111.7	S388 S389 L390	S388-K392 WeakPolarHBondContact O-CB 3.34Å; S388-K392 PolarHBondContact O-N 3.02Å; S389-K392 PolarHBondContact O-N 3.42Å; L390-K392 VanDerWaalsContact C-N 3.26Å; L390-K392 PolarHBondContact O-N 3.16Å
393	R	93.6	Very high	92.3	Very high	58 Å²	58	54.1 Å²	54.1	22%	0.219	28%	0.282	C	S	.	.	H	α-helix	trans	-74.2	-39.9	-179.7	-169.2	173.7	-164.1	165.3	10.4	112.1	L358 N361 E365 S389 L390 P395	L358-R393 VanDerWaalsContact O-CD 3.31Å; L358-R393 WeakPolarHBondContact O-CD 3.24Å; L358-R393 PolarHBondContact O-NH1 3.14Å; N361-R393 PolarHBondContact O-NH1 3.44Å; N361-R393 PolarHBondContact O-NH2 3.13Å; E365-R393 VanDerWaalsContact CG-NH2 3.27Å; E365-R393 IonicContact OE1-NH2 3.78Å; S389-R393 WeakPolarHBondContact O-CB 3.34Å; S389-R393 PolarHBondContact O-N 2.81Å; L390-R393 PolarHBondContact O-N 3.4Å; L390-R393 VanDerWaalsContact O-N 3.16Å; R393-P395 WeakPolarHBondContact O-CD 3.37Å
394	F	93.5	Very high	92.6	Very high	38 Å²	38	50.4 Å²	50.4	17%	0.167	27%	0.266	C	S	.	.			trans	-123.5	75.7	-178.2	-55.7	-72.5	0	0	0	110.5	V364 V369 L390 Q391 N396 I397	V364-F394 HydrophobicContact CG1-CZ 3.7Å; V369-F394 HydrophobicContact CG2-CE1 3.67Å; V369-F394 HydrophobicContact CG2-CZ 4.13Å; L390-F394 HydrophobicContact CD2-CD2 3.99Å; L390-F394 HydrophobicContact CD2-CE2 4.16Å; L390-F394 PolarHBondContact O-N 3.12Å; Q391-F394 CarbonylContact O-C 3.57Å; F394-N396 PolarHBondContact O-N 3.33Å; F394-N396 VanDerWaalsContact O-N 3.12Å; F394-I397 HydrophobicContact CB-CB 4.07Å; F394-I397 HydrophobicContact CB-CD1 3.45Å; F394-I397 VanDerWaalsContact CB-CD1 3.45Å; F394-I397 HydrophobicContact CB-CG1 3.77Å; F394-I397 HydrophobicContact CD1-CD1 4.14Å; F394-I397 HydrophobicContact CD2-CD1 4.29Å; F394-I397 HydrophobicContact CG-CD1 3.71Å; F394-I397 PolarHBondContact O-N 2.57Å; F394-I397 VanDerWaalsContact O-N 3.17Å
395	P	91.6	Very high	93	Very high	87 Å²	87	49 Å²	49	57%	0.565	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.7	-172.7	24.8	-34.8	0	0	0	114	Q391 R393	Q391-P395 PolarHBondContact NE2-O 3.01Å; Q391-P395 WeakPolarHBondContact O-CA 3.15Å; R393-P395 WeakPolarHBondContact O-CD 3.37Å
396	N	91.7	Very high	93.1	Very high	151 Å²	151	44 Å²	44	81%	0.807	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-7.8	-177.4	-59	-27.7	0	0	0	113.6	F394	F394-N396 PolarHBondContact O-N 3.33Å; F394-N396 VanDerWaalsContact O-N 3.12Å
397	I	93	Very high	93.2	Very high	16 Å²	16	43.6 Å²	43.6	8%	0.082	23%	0.23	C	C	.	.			trans	-79.8	134.8	178.6	-70.1	-179.2	0	0	0	109.8	L372 E373 V375 Q391 F394	L372-I397 HydrophobicContact CB-CD1 4Å; L372-I397 HydrophobicContact CD2-CD1 3.61Å; L372-I397 HydrophobicContact CG-CD1 3.71Å; L372-I397 HydrophobicContact CG-CG1 4.47Å; L372-I397 VanDerWaalsContact O-CG1 3.27Å; L372-I397 WeakPolarHBondContact O-CG1 3.47Å; E373-I397 WeakPolarHBondContact O-CA 3.18Å; V375-I397 HydrophobicContact CB-CG2 4.04Å; V375-I397 HydrophobicContact CG2-CD1 4.38Å; V375-I397 HydrophobicContact CG2-CG2 3.6Å; Q391-I397 PolarHBondContact NE2-O 3.48Å; F394-I397 HydrophobicContact CB-CB 4.07Å; F394-I397 HydrophobicContact CB-CD1 3.45Å; F394-I397 VanDerWaalsContact CB-CD1 3.45Å; F394-I397 HydrophobicContact CB-CG1 3.77Å; F394-I397 HydrophobicContact CD1-CD1 4.14Å; F394-I397 HydrophobicContact CD2-CD1 4.29Å; F394-I397 HydrophobicContact CG-CD1 3.71Å; F394-I397 PolarHBondContact O-N 2.57Å; F394-I397 VanDerWaalsContact O-N 3.17Å
398	L	93.2	Very high	93.3	Very high	74 Å²	74	43 Å²	43	39%	0.387	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	109.2	166.9	-59.4	179.9	0	0	0	109.5	E373 M374 V375 Y400 L416	E373-L398 PolarHBondContact O-N 3.02Å; M374-L398 WeakPolarHBondContact CA-O 3.17Å; M374-L398 HydrophobicContact CG-CB 4.18Å; M374-L398 HydrophobicContact CG-CD1 4.27Å; V375-L398 PolarHBondContact N-O 3.22Å; L398-Y400 HydrophobicContact CB-CD2 4.39Å; L398-Y400 HydrophobicContact CB-CE2 3.77Å; L398-Y400 HydrophobicContact CD1-CE2 4.46Å; L398-L416 HydrophobicContact CB-CD1 3.73Å; L398-L416 HydrophobicContact CD2-CD1 4.06Å; L398-L416 HydrophobicContact CD2-CD2 4.12Å; L398-L416 HydrophobicContact CG-CD1 4.45Å
399	L	93.3	Very high	93.5	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.021	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	107.4	178.2	179.1	61.2	0	0	0	110.9	L355 V375 I382 A387 L390 L417	L355-L399 HydrophobicContact CD1-CD1 4.39Å; V375-L399 HydrophobicContact CB-CD1 4.06Å; V375-L399 HydrophobicContact CG1-CD1 3.82Å; V375-L399 CarbonylContact O-C 3.54Å; I382-L399 HydrophobicContact CD1-CD1 4.45Å; I382-L399 HydrophobicContact CD1-CD2 4.14Å; A387-L399 HydrophobicContact CB-CD2 3.77Å; L390-L399 HydrophobicContact CD1-CD1 4.49Å; L390-L399 HydrophobicContact CD1-CD2 4.41Å; L399-L417 HydrophobicContact CD2-CB 4.43Å; L399-L417 HydrophobicContact CD2-CD1 4.18Å; L399-L417 HydrophobicContact CG-CB 4.41Å; L399-L417 HydrophobicContact CG-CD1 4.36Å; L399-L417 WeakPolarHBondContact O-CB 3.3Å; L399-L417 PolarHBondContact O-N 2.83Å
400	Y	93.6	Very high	93.6	Very high	44 Å²	44	38 Å²	38	17%	0.173	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133	174.8	-69.1	-89.2	0	0	0	111.3	M374 V375 F376 S377 L398 I414 T415 L416	M374-Y400 HydrophobicContact CB-CE2 4.41Å; M374-Y400 HydrophobicContact CG-CE2 4.35Å; M374-Y400 HydrophobicContact SD-CE2 4.09Å; V375-Y400 PolarHBondContact O-N 3.3Å; F376-Y400 HydrophobicContact CD1-CD2 4.28Å; F376-Y400 AromaticContact CD1-CG 3.98Å; F376-Y400 HydrophobicContact CD1-CG 3.98Å; F376-Y400 HydrophobicContact CE1-CD1 4.23Å; F376-Y400 AromaticContact CE1-CD2 3.84Å; F376-Y400 HydrophobicContact CE1-CD2 3.84Å; F376-Y400 HydrophobicContact CE1-CE2 4.5Å; F376-Y400 AromaticContact CE1-CG 3.68Å; F376-Y400 HydrophobicContact CE1-CG 3.68Å; F376-Y400 HydrophobicContact CE2-CD2 4.1Å; F376-Y400 AromaticContact CZ-CD2 3.73Å; F376-Y400 HydrophobicContact CZ-CD2 3.73Å; F376-Y400 HydrophobicContact CZ-CE2 4.1Å; F376-Y400 HydrophobicContact CZ-CG 4.08Å; S377-Y400 PolarHBondContact N-O 3.07Å; L398-Y400 HydrophobicContact CB-CD2 4.39Å; L398-Y400 HydrophobicContact CB-CE2 3.77Å; L398-Y400 HydrophobicContact CD1-CE2 4.46Å; Y400-I414 HydrophobicContact CD1-CD1 3.92Å; Y400-I414 HydrophobicContact CD1-CG1 4.07Å; Y400-I414 HydrophobicContact CG-CD1 4.37Å; Y400-T415 CarbonylContact C-O 3.59Å; Y400-T415 VanDerWaalsContact CA-O 3.29Å; Y400-T415 WeakPolarHBondContact CA-O 3.36Å; Y400-L416 HydrophobicContact CD1-CB 4.36Å; Y400-L416 HydrophobicContact CD1-CD1 4.45Å; Y400-L416 HydrophobicContact CD2-CD1 4.37Å; Y400-L416 HydrophobicContact CE1-CB 4.11Å; Y400-L416 HydrophobicContact CE1-CD1 4.22Å; Y400-L416 HydrophobicContact CE2-CD1 4.13Å
401	N	93.5	Very high	93.8	Very high	10 Å²	10	37.6 Å²	37.6	5%	0.053	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119.6	167.1	-175.5	33.8	0	0	0	108.7	I382 I414 T415 L417 S424	I382-N401 HydrophobicContact CG2-CB 4.31Å; N401-I414 WeakPolarHBondContact O-CA 3.34Å; N401-T415 HydrophobicContact CB-CG2 4.16Å; N401-T415 PolarHBondContact N-O 3.47Å; N401-T415 PolarHBondContact O-N 3.24Å; N401-L417 HydrophobicContact CB-CD1 3.83Å; N401-L417 HydrophobicContact CB-CD2 4.45Å; N401-L417 HydrophobicContact CB-CG 4.03Å; N401-S424 PolarHBondContact ND2-O 2.9Å
402	A	94.1	Very high	94	Very high	5 Å²	5	35.6 Å²	35.6	4%	0.041	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136.6	-179.9	0	0	0	0	0	111.8	S377 V378 I411 H413 I414	S377-A402 PolarHBondContact O-N 3.24Å; V378-A402 HydrophobicContact CG1-CB 4.09Å; A402-I411 HydrophobicContact CB-CB 4.14Å; A402-I411 HydrophobicContact CB-CD1 4.05Å; A402-I411 HydrophobicContact CB-CG2 3.7Å; A402-H413 WeakPolarHBondContact CA-O 3.19Å; A402-I414 HydrophobicContact CB-CB 4.23Å; A402-I414 HydrophobicContact CB-CD1 4.15Å; A402-I414 HydrophobicContact CB-CG1 3.94Å
403	Y	95.3	Very high	94.1	Very high	22 Å²	22	26.7 Å²	26.7	9%	0.086	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.6	178.9	163.1	-102.1	0	0	0	111	L405 I411 T412 H413 I425 D484 I496	Y403-L405 HydrophobicContact CE1-CD1 4.23Å; Y403-L405 HydrophobicContact CE2-CD1 4.34Å; Y403-L405 WeakPolarHBondContact OH-CD1 3.38Å; Y403-I411 CarbonylContact O-C 3.56Å; Y403-I411 WeakPolarHBondContact O-CA 3.4Å; Y403-T412 PolarHBondContact O-N 3.37Å; Y403-T412 PolarHBondContact O-OG1 3.03Å; Y403-H413 HydrophobicContact CD1-CB 4.32Å; Y403-H413 AromaticContact CD1-ND1 3.62Å; Y403-H413 PolarHBondContact N-O 2.96Å; Y403-H413 PolarHBondContact O-N 3.4Å; Y403-H413 VanDerWaalsContact O-N 3.09Å; Y403-I425 HydrophobicContact CD1-CD1 3.42Å; Y403-I425 VanDerWaalsContact CD1-CD1 3.42Å; Y403-I425 HydrophobicContact CE1-CD1 4Å; Y403-I425 HydrophobicContact CG-CB 4.35Å; Y403-I425 HydrophobicContact CG-CD1 3.68Å; Y403-I425 HydrophobicContact CG-CG2 4.4Å; Y403-D484 PolarHBondContact OH-OD2 3.43Å; Y403-I496 HydrophobicContact CD2-CD1 3.38Å; Y403-I496 HydrophobicContact CE2-CD1 3.34Å; Y403-I496 HydrophobicContact CG-CD1 4Å
404	G	95.1	Very high	94.2	Very high	16 Å²	16	24.5 Å²	24.5	17%	0.165	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	174.8	178.8	0	0	0	0	0	112.1	S410	G404-S410 WeakPolarHBondContact CA-O 3.35Å
405	L	94	Very high	94.1	Very high	18 Å²	18	23.8 Å²	23.8	9%	0.094	13%	0.132	C	C	.	.			trans	-137	157	172.8	-53.6	95.3	0	0	0	108.9	Y403 E407 A408 T409 S410 L455 T472 T482	Y403-L405 HydrophobicContact CE1-CD1 4.23Å; Y403-L405 HydrophobicContact CE2-CD1 4.34Å; Y403-L405 WeakPolarHBondContact OH-CD1 3.38Å; L405-E407 VanDerWaalsContact C-N 3.27Å; L405-E407 PolarHBondContact O-N 3.45Å; L405-A408 HydrophobicContact CB-CB 4.34Å; L405-A408 HydrophobicContact CD1-CB 4.36Å; L405-A408 CarbonylContact O-C 3.59Å; L405-A408 VanDerWaalsContact O-C 3.22Å; L405-A408 WeakPolarHBondContact O-CA 3.43Å; L405-A408 PolarHBondContact O-N 3.43Å; L405-T409 PolarHBondContact O-N 3.03Å; L405-S410 PolarHBondContact N-O 3.32Å; L405-L455 HydrophobicContact CD1-CD1 4.2Å; L405-T472 HydrophobicContact CD2-CG2 4.49Å; L405-T482 HydrophobicContact CD1-CG2 3.92Å
406	C	93.4	Very high	94	Very high	4 Å²	4	21.3 Å²	21.3	3%	0.027	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-65.1	-36	171.2	-66.8	0	0	0	0	111.2	V261 T263 V273 H307 P308 A408 T409	V261-C406 HydrophobicContact CG2-CB 4.46Å; T263-C406 HydrophobicContact CG2-CB 3.35Å; T263-C406 WeakPolarHBondContact CG2-SG 3.21Å; V273-C406 HydrophobicContact CG2-CB 4.35Å; H307-C406 PolarHBondContact NE2-SG 2.82Å; H307-C406 VanDerWaalsContact NE2-SG 3.36Å; P308-C406 VanDerWaalsContact CD-SG 3.53Å; P308-C406 HydrophobicContact CG-CB 4Å; P308-C406 WeakPolarHBondContact CG-SG 3.48Å; C406-A408 PolarHBondContact O-N 3.3Å; C406-A408 VanDerWaalsContact O-N 3.13Å; C406-T409 WeakPolarHBondContact O-CA 3.43Å; C406-T409 PolarHBondContact O-N 3.22Å
407	E	93.3	Very high	93.7	Very high	9 Å²	9	14.8 Å²	14.8	4%	0.042	8%	0.079	C	C	.	.	G	3₁₀ helix	trans	-63.1	-14.8	172.9	-60.5	92.8	145.9	0	0	112.6	K271 V273 L405 A461 V464 T472 L480	K271-E407 IonicContact NZ-OE1 2.64Å; K271-E407 PolarHBondContact NZ-OE1 2.78Å; V273-E407 HydrophobicContact CG2-CG 4.05Å; L405-E407 VanDerWaalsContact C-N 3.27Å; L405-E407 PolarHBondContact O-N 3.45Å; E407-A461 VanDerWaalsContact O-CB 3.27Å; E407-A461 WeakPolarHBondContact O-CB 3.41Å; E407-A461 PolarHBondContact O-N 2.76Å; E407-V464 HydrophobicContact CB-CG2 3.99Å; E407-V464 HydrophobicContact CG-CG1 4.01Å; E407-V464 HydrophobicContact CG-CG2 4.08Å; E407-T472 HydrophobicContact CB-CG2 4.08Å; E407-T472 HydrophobicContact CG-CG2 3.87Å; E407-L480 HydrophobicContact CB-CD1 3.94Å; E407-L480 HydrophobicContact CB-CD2 4.01Å
408	A	95.1	Very high	92.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-112.2	27.2	170.4	0	0	0	0	0	112.1	L405 C406 S410 T412 L455 L459 L480	L405-A408 HydrophobicContact CB-CB 4.34Å; L405-A408 HydrophobicContact CD1-CB 4.36Å; L405-A408 CarbonylContact O-C 3.59Å; L405-A408 VanDerWaalsContact O-C 3.22Å; L405-A408 WeakPolarHBondContact O-CA 3.43Å; L405-A408 PolarHBondContact O-N 3.43Å; C406-A408 PolarHBondContact O-N 3.3Å; C406-A408 VanDerWaalsContact O-N 3.13Å; A408-S410 PolarHBondContact O-N 2.74Å; A408-T412 HydrophobicContact CB-CG2 3.65Å; A408-L455 HydrophobicContact CB-CD1 4.45Å; A408-L459 CarbonylContact C-O 3.51Å; A408-L459 WeakPolarHBondContact CA-O 3.42Å; A408-L459 WeakPolarHBondContact O-CB 3.5Å; A408-L459 VanDerWaalsContact O-O 3.09Å; A408-L480 HydrophobicContact CB-CD2 3.91Å
409	T	95.9	Very high	91	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	64	-49.2	179.4	-51.6	0	0	0	0	115.2	L275 N279 L280 P308 T312 L405 C406 L459	L275-T409 HydrophobicContact CD1-CG2 4.32Å; L275-T409 HydrophobicContact CD2-CG2 4.39Å; N279-T409 HydrophobicContact CB-CG2 4.22Å; N279-T409 WeakPolarHBondContact CB-OG1 3.24Å; L280-T409 HydrophobicContact CD2-CG2 3.9Å; P308-T409 WeakPolarHBondContact CB-O 3.41Å; T312-T409 HydrophobicContact CG2-CG2 4.37Å; L405-T409 PolarHBondContact O-N 3.03Å; C406-T409 WeakPolarHBondContact O-CA 3.43Å; C406-T409 PolarHBondContact O-N 3.22Å; T409-L459 WeakPolarHBondContact CB-O 3.29Å; T409-L459 PolarHBondContact N-O 2.96Å; T409-L459 PolarHBondContact OG1-O 3.02Å
410	S	95.4	Very high	89.6	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	-157.5	-150.5	-174.5	-161.9	0	0	0	0	110.7	S283 T312 G404 L405 A408	S283-S410 WeakPolarHBondContact OG-CB 3.43Å; T312-S410 VanDerWaalsContact OG1-CB 3.23Å; T312-S410 WeakPolarHBondContact OG1-CB 3.48Å; T312-S410 PolarHBondContact OG1-OG 3.17Å; G404-S410 WeakPolarHBondContact CA-O 3.35Å; L405-S410 PolarHBondContact N-O 3.32Å; A408-S410 PolarHBondContact O-N 2.74Å
411	I	96.4	Very high	88.6	Confident	4 Å²	4	27.2 Å²	27.2	2%	0.021	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	145.6	170.7	71.2	174.3	0	0	0	110.8	I287 L313 A402 Y403 I414 L429 L459	I287-I411 HydrophobicContact CG1-CD1 4.44Å; I287-I411 HydrophobicContact CG1-CG1 4.31Å; L313-I411 HydrophobicContact CD1-CG2 3.94Å; L313-I411 HydrophobicContact CD2-CB 4.41Å; L313-I411 HydrophobicContact CD2-CD1 3.63Å; L313-I411 HydrophobicContact CD2-CG1 3.78Å; L313-I411 HydrophobicContact CD2-CG2 3.86Å; L313-I411 HydrophobicContact CG-CG2 4.44Å; A402-I411 HydrophobicContact CB-CB 4.14Å; A402-I411 HydrophobicContact CB-CD1 4.05Å; A402-I411 HydrophobicContact CB-CG2 3.7Å; Y403-I411 CarbonylContact O-C 3.56Å; Y403-I411 WeakPolarHBondContact O-CA 3.4Å; I411-I414 HydrophobicContact CD1-CD1 4.22Å; I411-L429 HydrophobicContact CD1-CD1 4.47Å; I411-L429 HydrophobicContact CG1-CD1 3.97Å; I411-L429 WeakPolarHBondContact O-CD1 3.4Å; I411-L459 WeakPolarHBondContact O-CD1 3.15Å
412	T	96.6	Very high	87.8	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	-21.5	176.5	58.6	0	0	0	0	111.9	Y403 A408 L429 M432 L455 L459	Y403-T412 PolarHBondContact O-N 3.37Å; Y403-T412 PolarHBondContact O-OG1 3.03Å; A408-T412 HydrophobicContact CB-CG2 3.65Å; T412-L429 PolarHBondContact O-N 3.33Å; T412-M432 HydrophobicContact CG2-CE 4.09Å; T412-L455 HydrophobicContact CG2-CD1 4.06Å; T412-L459 HydrophobicContact CG2-CD1 4.33Å
413	H	95.4	Very high	87.3	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.3	175.2	-58.2	66	0	0	0	109.7	A402 Y403 I425 S427 L428 F494	A402-H413 WeakPolarHBondContact CA-O 3.19Å; Y403-H413 HydrophobicContact CD1-CB 4.32Å; Y403-H413 AromaticContact CD1-ND1 3.62Å; Y403-H413 PolarHBondContact N-O 2.96Å; Y403-H413 PolarHBondContact O-N 3.4Å; Y403-H413 VanDerWaalsContact O-N 3.09Å; H413-I425 CarbonylContact C-O 3.57Å; H413-I425 HydrophobicContact CB-CD1 4.16Å; H413-I425 HydrophobicContact CB-CG1 4.41Å; H413-I425 VanDerWaalsContact CB-O 3.22Å; H413-I425 WeakPolarHBondContact CB-O 3.47Å; H413-S427 VanDerWaalsContact CA-O 3.25Å; H413-S427 WeakPolarHBondContact CA-O 3.35Å; H413-L428 WeakPolarHBondContact CE1-CD1 3.48Å; H413-L428 WeakPolarHBondContact NE2-CD1 3.22Å; H413-F494 AromaticContact CD2-CD2 3.52Å; H413-F494 AromaticContact CD2-CG 3.69Å; H413-F494 AromaticContact NE2-CD1 3.96Å; H413-F494 AromaticContact NE2-CD2 3.63Å; H413-F494 AromaticContact NE2-CE2 3.89Å; H413-F494 AromaticContact NE2-CG 3.66Å
414	I	93.9	Very high	87	Confident	13 Å²	13	36.1 Å²	36.1	7%	0.067	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	146	176.7	-168.7	168.1	0	0	0	111.3	V290 F376 Y400 N401 A402 I411 I425 G426 S427 L429	V290-I414 HydrophobicContact CG1-CD1 3.98Å; V290-I414 HydrophobicContact CG1-CG2 3.93Å; F376-I414 HydrophobicContact CD1-CD1 4.02Å; F376-I414 HydrophobicContact CE1-CD1 3.76Å; Y400-I414 HydrophobicContact CD1-CD1 3.92Å; Y400-I414 HydrophobicContact CD1-CG1 4.07Å; Y400-I414 HydrophobicContact CG-CD1 4.37Å; N401-I414 WeakPolarHBondContact O-CA 3.34Å; A402-I414 HydrophobicContact CB-CB 4.23Å; A402-I414 HydrophobicContact CB-CD1 4.15Å; A402-I414 HydrophobicContact CB-CG1 3.94Å; I411-I414 HydrophobicContact CD1-CD1 4.22Å; I414-I425 PolarHBondContact N-O 2.82Å; I414-G426 WeakPolarHBondContact O-CA 3.38Å; I414-S427 PolarHBondContact N-O 3.22Å; I414-S427 VanDerWaalsContact N-O 3.16Å; I414-S427 PolarHBondContact O-N 2.6Å; I414-L429 HydrophobicContact CG2-CD2 3.87Å
415	T	91.7	Very high	86.9	Confident	22 Å²	22	36 Å²	36	14%	0.135	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	156.6	170.5	-173.5	0	0	0	0	111.4	Y400 N401 L417 S424 G426	Y400-T415 CarbonylContact C-O 3.59Å; Y400-T415 VanDerWaalsContact CA-O 3.29Å; Y400-T415 WeakPolarHBondContact CA-O 3.36Å; N401-T415 HydrophobicContact CB-CG2 4.16Å; N401-T415 PolarHBondContact N-O 3.47Å; N401-T415 PolarHBondContact O-N 3.24Å; T415-L417 HydrophobicContact CG2-CD2 4.12Å; T415-S424 VanDerWaalsContact CG2-O 3.28Å; T415-S424 WeakPolarHBondContact CG2-O 3.39Å; T415-G426 VanDerWaalsContact CB-CA 3.43Å
416	L	89.8	Confident	86.8	Confident	36 Å²	36	35.1 Å²	35.1	19%	0.188	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	125.6	166.5	-179.9	65	0	0	0	109.2	L398 Y400 E419	L398-L416 HydrophobicContact CB-CD1 3.73Å; L398-L416 HydrophobicContact CD2-CD1 4.06Å; L398-L416 HydrophobicContact CD2-CD2 4.12Å; L398-L416 HydrophobicContact CG-CD1 4.45Å; Y400-L416 HydrophobicContact CD1-CB 4.36Å; Y400-L416 HydrophobicContact CD1-CD1 4.45Å; Y400-L416 HydrophobicContact CD2-CD1 4.37Å; Y400-L416 HydrophobicContact CE1-CB 4.11Å; Y400-L416 HydrophobicContact CE1-CD1 4.22Å; Y400-L416 HydrophobicContact CE2-CD1 4.13Å; L416-E419 HydrophobicContact CD2-CG 4.36Å
417	L	84.8	Confident	86.7	Confident	13 Å²	13	38 Å²	38	7%	0.068	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	148.6	172.9	-60.8	-179.7	0	0	0	110	I382 A387 L399 N401 T415	I382-L417 HydrophobicContact CG2-CD1 4.13Å; A387-L417 HydrophobicContact CB-CD1 3.96Å; L399-L417 HydrophobicContact CD2-CB 4.43Å; L399-L417 HydrophobicContact CD2-CD1 4.18Å; L399-L417 HydrophobicContact CG-CB 4.41Å; L399-L417 HydrophobicContact CG-CD1 4.36Å; L399-L417 WeakPolarHBondContact O-CB 3.3Å; L399-L417 PolarHBondContact O-N 2.83Å; N401-L417 HydrophobicContact CB-CD1 3.83Å; N401-L417 HydrophobicContact CB-CD2 4.45Å; N401-L417 HydrophobicContact CB-CG 4.03Å; T415-L417 HydrophobicContact CG2-CD2 4.12Å
418	P	67.3	Low	86.8	Confident	79 Å²	79	38.1 Å²	38.1	51%	0.513	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	cis	-95.4	11.1	-5	36.4	-33.7	0	0	0	114.3	Q391 K420	Q391-P418 HydrophobicContact CG-CG 4.45Å; P418-K420 VanDerWaalsContact C-N 3.35Å; P418-K420 PolarHBondContact O-N 2.83Å
419	E	63.6	Low	86.8	Confident	140 Å²	140	38.3 Å²	38.3	65%	0.654	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-36	-152.3	-75.4	-161.9	143.5	0	0	117.3	L416	L416-E419 HydrophobicContact CD2-CG 4.36Å
420	K	63.6	Low	86.8	Confident	179 Å²	179	39 Å²	39	78%	0.778	20%	0.201	S	C	*	.	S	Bend	trans	-138.3	-33.7	-169.2	-63.7	-178.6	-174.3	170.8	0	115.9	P418	P418-K420 VanDerWaalsContact C-N 3.35Å; P418-K420 PolarHBondContact O-N 2.83Å
421	A	72.2	Confident	86.8	Confident	2 Å²	2	39.9 Å²	39.9	2%	0.017	21%	0.205	C	C	.	.			trans	-139.7	81.9	-168.2	0	0	0	0	0	111.4	R423 S424 N493 Y495	A421-R423 PolarHBondContact O-N 2.97Å; A421-S424 WeakPolarHBondContact O-CB 3.04Å; A421-S424 PolarHBondContact O-N 2.97Å; A421-N493 HydrophobicContact CB-CB 4.01Å; A421-Y495 WeakPolarHBondContact CB-OH 3.39Å
422	P	76.6	Confident	86.8	Confident	85 Å²	85	39.7 Å²	39.7	55%	0.552	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	139.5	178.1	-23	32.7	0	0	0	111.3	S424 Y495	P422-S424 PolarHBondContact O-N 2.92Å; P422-S424 VanDerWaalsContact O-N 3.16Å; P422-Y495 WeakPolarHBondContact O-CE1 3.27Å
423	R	83.5	Confident	86.8	Confident	139 Å²	139	41 Å²	41	53%	0.525	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	-1.7	-174.2	-56.3	175.6	174.9	165.2	7.8	116.5	D384 A421	D384-R423 WeakPolarHBondContact OD1-CG 2.92Å; D384-R423 IonicContact OD1-NE 2.78Å; D384-R423 WeakPolarHBondContact OD2-CG 3.47Å; D384-R423 IonicContact OD2-CZ 3.33Å; D384-R423 IonicContact OD2-NE 3.79Å; D384-R423 PolarHBondContact OD2-NE 3.12Å; D384-R423 IonicContact OD2-NH2 3.68Å; D384-R423 PolarHBondContact OD2-NH2 2.86Å; A421-R423 PolarHBondContact O-N 2.97Å
424	S	89.3	Confident	86.8	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.21	C	C	.	.			trans	-68.3	143.4	179.7	-175.1	0	0	0	0	110.7	N401 T415 A421 P422 G426 N493 F494	N401-S424 PolarHBondContact ND2-O 2.9Å; T415-S424 VanDerWaalsContact CG2-O 3.28Å; T415-S424 WeakPolarHBondContact CG2-O 3.39Å; A421-S424 WeakPolarHBondContact O-CB 3.04Å; A421-S424 PolarHBondContact O-N 2.97Å; P422-S424 PolarHBondContact O-N 2.92Å; P422-S424 VanDerWaalsContact O-N 3.16Å; S424-G426 WeakPolarHBondContact OG-CA 3.21Å; S424-G426 PolarHBondContact OG-N 3.28Å; S424-N493 WeakPolarHBondContact OG-CB 3.17Å; S424-F494 CarbonylContact C-O 3.56Å; S424-F494 VanDerWaalsContact CA-O 3.31Å; S424-F494 WeakPolarHBondContact CA-O 3.44Å; S424-F494 PolarHBondContact OG-O 3.32Å
425	I	92.6	Very high	86.9	Confident	13 Å²	13	40.4 Å²	40.4	7%	0.067	21%	0.207	C	C	.	.			trans	-84	-2.5	164.2	57.4	156.2	0	0	0	112.1	Y403 H413 I414 F494 I496	Y403-I425 HydrophobicContact CD1-CD1 3.42Å; Y403-I425 VanDerWaalsContact CD1-CD1 3.42Å; Y403-I425 HydrophobicContact CE1-CD1 4Å; Y403-I425 HydrophobicContact CG-CB 4.35Å; Y403-I425 HydrophobicContact CG-CD1 3.68Å; Y403-I425 HydrophobicContact CG-CG2 4.4Å; H413-I425 CarbonylContact C-O 3.57Å; H413-I425 HydrophobicContact CB-CD1 4.16Å; H413-I425 HydrophobicContact CB-CG1 4.41Å; H413-I425 VanDerWaalsContact CB-O 3.22Å; H413-I425 WeakPolarHBondContact CB-O 3.47Å; I414-I425 PolarHBondContact N-O 2.82Å; I425-F494 HydrophobicContact CD1-CB 3.78Å; I425-F494 HydrophobicContact CG1-CB 3.64Å; I425-F494 VanDerWaalsContact CG1-O 3.24Å; I425-F494 WeakPolarHBondContact CG1-O 3.34Å; I425-F494 PolarHBondContact N-O 2.91Å; I425-I496 HydrophobicContact CD1-CD1 4.08Å; I425-I496 HydrophobicContact CD1-CG1 3.91Å; I425-I496 HydrophobicContact CG1-CG1 4.4Å; I425-I496 HydrophobicContact CG2-CD1 3.93Å; I425-I496 HydrophobicContact CG2-CG1 4.02Å
426	G	91.9	Very high	87.1	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	92.3	-163.8	171.8	0	0	0	0	0	115.9	I414 T415 S424 F494	I414-G426 WeakPolarHBondContact O-CA 3.38Å; T415-G426 VanDerWaalsContact CB-CA 3.43Å; S424-G426 WeakPolarHBondContact OG-CA 3.21Å; S424-G426 PolarHBondContact OG-N 3.28Å; G426-F494 PolarHBondContact O-N 3.1Å
427	S	92.4	Very high	87.3	Confident	63 Å²	63	38 Å²	38	44%	0.441	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	155	-179.5	55.2	0	0	0	0	111	H413 I414	H413-S427 VanDerWaalsContact CA-O 3.25Å; H413-S427 WeakPolarHBondContact CA-O 3.35Å; I414-S427 PolarHBondContact N-O 3.22Å; I414-S427 VanDerWaalsContact N-O 3.16Å; I414-S427 PolarHBondContact O-N 2.6Å
428	L	95.2	Very high	87.6	Confident	12 Å²	12	39.1 Å²	39.1	6%	0.063	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	133.9	-178.3	-170.7	68.4	0	0	0	112.2	S76 H413 M432 C434 L455	S76-L428 PolarHBondContact OG-O 3.31Å; H413-L428 WeakPolarHBondContact CE1-CD1 3.48Å; H413-L428 WeakPolarHBondContact NE2-CD1 3.22Å; L428-M432 HydrophobicContact CD1-CB 3.72Å; L428-M432 VanDerWaalsContact CD2-C 3.46Å; L428-M432 HydrophobicContact CD2-CB 3.94Å; L428-M432 WeakPolarHBondContact CD2-O 3.37Å; L428-M432 HydrophobicContact CG-CB 3.69Å; L428-C434 HydrophobicContact CD1-CB 3.96Å; L428-C434 HydrophobicContact CD2-CB 3.72Å; L428-C434 HydrophobicContact CG-CB 4.44Å; L428-L455 HydrophobicContact CD1-CD2 4.39Å
429	L	95.4	Very high	88.6	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.021	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-59.1	154.2	174.1	-74.6	-162.1	0	0	0	112.3	S76 L286 V290 I411 T412 I414 M432 L459	S76-L429 WeakPolarHBondContact CB-O 3.5Å; S76-L429 PolarHBondContact OG-O 2.88Å; L286-L429 HydrophobicContact CB-CD1 4.35Å; V290-L429 HydrophobicContact CG2-CD2 3.61Å; I411-L429 HydrophobicContact CD1-CD1 4.47Å; I411-L429 HydrophobicContact CG1-CD1 3.97Å; I411-L429 WeakPolarHBondContact O-CD1 3.4Å; T412-L429 PolarHBondContact O-N 3.33Å; I414-L429 HydrophobicContact CG2-CD2 3.87Å; L429-M432 HydrophobicContact CB-CG 4.42Å; L429-M432 WeakPolarHBondContact O-CB 3.37Å; L429-M432 PolarHBondContact O-N 2.76Å; L429-L459 HydrophobicContact CD1-CD1 4.31Å
430	P	94.6	Very high	89.5	Confident	16 Å²	16	34.1 Å²	34.1	10%	0.104	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	155.9	175.3	-18.7	29.1	0	0	0	112.4	T77 I79 L286 M432	T77-P430 CarbonylContact O-C 3.55Å; T77-P430 VanDerWaalsContact O-CA 3.3Å; T77-P430 WeakPolarHBondContact O-CA 3.33Å; T77-P430 WeakPolarHBondContact O-CB 3.43Å; I79-P430 HydrophobicContact CD1-CB 3.48Å; I79-P430 VanDerWaalsContact CD1-CB 3.48Å; I79-P430 HydrophobicContact CD1-CG 3.6Å; I79-P430 HydrophobicContact CG1-CB 3.82Å; I79-P430 HydrophobicContact CG1-CG 4.44Å; L286-P430 WeakPolarHBondContact CD1-O 3.46Å; L286-P430 HydrophobicContact CD2-CB 3.74Å; L286-P430 HydrophobicContact CD2-CG 4.26Å; L286-P430 WeakPolarHBondContact CD2-O 3.3Å; P430-M432 PolarHBondContact O-N 3.19Å
431	N	95.6	Very high	90.6	Very high	18 Å²	18	29.1 Å²	29.1	10%	0.096	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	-1.4	-176.9	-60.8	28.3	0	0	0	115.5	T77 Q78 I79 L81 L286 P458	T77-N431 PolarHBondContact O-N 2.87Å; T77-N431 PolarHBondContact O-OD1 3.19Å; Q78-N431 WeakPolarHBondContact CA-OD1 3.35Å; I79-N431 PolarHBondContact N-OD1 2.92Å; I79-N431 PolarHBondContact O-ND2 3.08Å; I79-N431 PolarHBondContact O-OD1 3.47Å; L81-N431 VanDerWaalsContact CD1-ND2 3.29Å; L81-N431 WeakPolarHBondContact CD1-ND2 3.38Å; L81-N431 WeakPolarHBondContact CG-ND2 3.31Å; L286-N431 HydrophobicContact CD1-CB 4.42Å; L286-N431 HydrophobicContact CD2-CB 4.46Å; N431-P458 HydrophobicContact CB-CG 3.83Å; N431-P458 WeakPolarHBondContact O-CD 3.15Å
432	M	96.2	Very high	91.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.172	C	C	.	.			trans	-95.8	154.2	176.5	-61.1	-62.9	-67.3	0	0	111.3	S76 T412 L428 L429 P430 L455 L459 V460	S76-M432 PolarHBondContact N-O 3.15Å; T412-M432 HydrophobicContact CG2-CE 4.09Å; L428-M432 HydrophobicContact CD1-CB 3.72Å; L428-M432 VanDerWaalsContact CD2-C 3.46Å; L428-M432 HydrophobicContact CD2-CB 3.94Å; L428-M432 WeakPolarHBondContact CD2-O 3.37Å; L428-M432 HydrophobicContact CG-CB 3.69Å; L429-M432 HydrophobicContact CB-CG 4.42Å; L429-M432 WeakPolarHBondContact O-CB 3.37Å; L429-M432 PolarHBondContact O-N 2.76Å; P430-M432 PolarHBondContact O-N 3.19Å; M432-L455 HydrophobicContact CE-CB 4.44Å; M432-L459 HydrophobicContact CE-CB 3.96Å; M432-L459 HydrophobicContact CE-CG 4.46Å; M432-L459 HydrophobicContact CG-CD1 4.01Å; M432-L459 HydrophobicContact CG-CG 4.34Å; M432-L459 HydrophobicContact SD-CB 3.61Å; M432-L459 HydrophobicContact SD-CD1 3.83Å; M432-L459 HydrophobicContact SD-CG 3.56Å; M432-L459 VanDerWaalsContact SD-CG 3.56Å; M432-V460 HydrophobicContact CE-CG2 4.25Å
433	E	96.7	Very high	91.7	Very high	28 Å²	28	33.2 Å²	33.2	13%	0.131	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	144.8	170	-52.1	-175	163.6	0	0	109.5	V73 I74 K75 L455 R456 W479	V73-E433 HydrophobicContact CG1-CB 4.23Å; I74-E433 CarbonylContact O-C 3.57Å; I74-E433 VanDerWaalsContact O-CA 3.25Å; I74-E433 WeakPolarHBondContact O-CA 3.46Å; K75-E433 WeakPolarHBondContact CE-OE1 3.25Å; K75-E433 HydrophobicContact CG-CG 4Å; K75-E433 IonicContact NZ-OE1 3.49Å; E433-L455 CarbonylContact O-C 3.6Å; E433-L455 WeakPolarHBondContact O-CA 3.22Å; E433-R456 HydrophobicContact CB-CB 4.36Å; E433-R456 PolarHBondContact N-O 2.76Å; E433-R456 PolarHBondContact O-N 3.02Å; E433-R456 IonicContact OE1-NH2 3.33Å; E433-R456 PolarHBondContact OE1-NH2 3.05Å; E433-R456 IonicContact OE2-CZ 3.32Å; E433-R456 IonicContact OE2-NE 3.88Å; E433-R456 PolarHBondContact OE2-NE 3.08Å; E433-R456 IonicContact OE2-NH2 3.96Å; E433-R456 PolarHBondContact OE2-NH2 3.41Å; E433-W479 HydrophobicContact CB-CH2 3.83Å; E433-W479 HydrophobicContact CB-CZ3 4.21Å
434	C	96.7	Very high	92.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	144.7	179.8	-172.9	0	0	0	0	110.2	I74 L428 V454 L455 F494	I74-C434 PolarHBondContact N-O 2.79Å; I74-C434 PolarHBondContact O-N 2.67Å; L428-C434 HydrophobicContact CD1-CB 3.96Å; L428-C434 HydrophobicContact CD2-CB 3.72Å; L428-C434 HydrophobicContact CG-CB 4.44Å; C434-V454 WeakPolarHBondContact CA-O 3.4Å; C434-L455 HydrophobicContact CB-CD2 3.94Å; C434-F494 HydrophobicContact CB-CE1 4.12Å; C434-F494 HydrophobicContact CB-CZ 3.84Å; C434-F494 WeakPolarHBondContact SG-CE1 3.32Å
435	K	95.6	Very high	92.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	156	165	64.8	-179.3	172	-178	0	109.8	Y67 V73 L437 A444 V454 W479	Y67-K435 VanDerWaalsContact CE1-NZ 3.27Å; Y67-K435 PolarHBondContact O-NZ 2.81Å; V73-K435 HydrophobicContact CG2-CB 4.37Å; V73-K435 HydrophobicContact CG2-CD 4.21Å; K435-L437 HydrophobicContact CD-CD2 3.98Å; K435-L437 HydrophobicContact CD-CG 4.42Å; K435-L437 HydrophobicContact CG-CD2 4.46Å; K435-L437 HydrophobicContact CG-CG 4.44Å; K435-A444 HydrophobicContact CB-CB 4.24Å; K435-A444 HydrophobicContact CD-CB 4.03Å; K435-V454 HydrophobicContact CD-CG2 3.99Å; K435-V454 VanDerWaalsContact CE-CG2 3.44Å; K435-V454 HydrophobicContact CG-CG2 3.25Å; K435-V454 PolarHBondContact N-O 3.21Å; K435-V454 WeakPolarHBondContact O-CG2 3.15Å; K435-V454 PolarHBondContact O-N 2.89Å; K435-W479 HydrophobicContact CD-CH2 4.39Å; K435-W479 HydrophobicContact CD-CZ2 4.41Å; K435-W479 HydrophobicContact CD-CZ3 4.44Å; K435-W479 HydrophobicContact CG-CE3 4.31Å; K435-W479 HydrophobicContact CG-CH2 4.37Å; K435-W479 HydrophobicContact CG-CZ3 4.07Å
436	I	96	Very high	92.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	117.3	170.6	-56	-56.6	0	0	0	107.9	A444 E445 G451 E452 I453 Y488 F494	I436-A444 CarbonylContact O-C 3.46Å; I436-A444 WeakPolarHBondContact O-CA 2.83Å; I436-E445 HydrophobicContact CB-CB 4.17Å; I436-E445 HydrophobicContact CG2-CB 4.13Å; I436-E445 WeakPolarHBondContact O-CB 3.28Å; I436-E445 PolarHBondContact O-N 2.89Å; I436-G451 VanDerWaalsContact CG2-N 3.27Å; I436-E452 CarbonylContact C-O 3.44Å; I436-E452 WeakPolarHBondContact CA-O 3.35Å; I436-I453 HydrophobicContact CD1-CB 4.35Å; I436-I453 HydrophobicContact CD1-CG1 3.7Å; I436-Y488 HydrophobicContact CG1-CD1 3.58Å; I436-Y488 HydrophobicContact CG1-CE1 4.05Å; I436-F494 HydrophobicContact CD1-CD1 4.17Å; I436-F494 HydrophobicContact CD1-CE1 4.06Å
437	L	94.1	Very high	92.1	Very high	8 Å²	8	33.2 Å²	33.2	4%	0.042	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	123.2	177.3	-76.3	-178.5	0	0	0	111	Y67 K435 L439 G442 G451 E452 V454 H481	Y67-L437 HydrophobicContact CE2-CD1 4.29Å; Y67-L437 HydrophobicContact CE2-CD2 3.98Å; K435-L437 HydrophobicContact CD-CD2 3.98Å; K435-L437 HydrophobicContact CD-CG 4.42Å; K435-L437 HydrophobicContact CG-CD2 4.46Å; K435-L437 HydrophobicContact CG-CG 4.44Å; L437-L439 PolarHBondContact O-N 3.04Å; L437-G442 WeakPolarHBondContact CD2-O 3.45Å; L437-G451 CarbonylContact O-C 3.51Å; L437-G451 WeakPolarHBondContact O-CA 3.27Å; L437-E452 HydrophobicContact CB-CB 4.45Å; L437-E452 PolarHBondContact N-O 3.29Å; L437-E452 PolarHBondContact O-N 2.92Å; L437-V454 HydrophobicContact CD1-CB 4.36Å; L437-V454 HydrophobicContact CD1-CG1 3.62Å; L437-V454 HydrophobicContact CD1-CG2 3.84Å; L437-V454 HydrophobicContact CG-CG1 4.07Å; L437-V454 HydrophobicContact CG-CG2 3.81Å; L437-H481 WeakPolarHBondContact CD1-CE1 3.43Å
438	N	91.4	Very high	92.1	Very high	35 Å²	35	31.8 Å²	31.8	19%	0.187	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-59.1	122.3	168	-175.7	-64.2	0	0	0	109.5	H440 T441 G442 K443 E445	N438-H440 PolarHBondContact O-N 3.08Å; N438-H440 VanDerWaalsContact OD1-CA 3.32Å; N438-H440 WeakPolarHBondContact OD1-CA 3.22Å; N438-H440 WeakPolarHBondContact OD1-CB 3.35Å; N438-H440 PolarHBondContact OD1-N 3.21Å; N438-T441 VanDerWaalsContact CB-OG1 3.29Å; N438-T441 WeakPolarHBondContact CB-OG1 3.19Å; N438-T441 PolarHBondContact O-N 2.75Å; N438-T441 PolarHBondContact OD1-N 2.8Å; N438-G442 WeakPolarHBondContact O-CA 3.46Å; N438-G442 PolarHBondContact O-N 3.2Å; N438-K443 PolarHBondContact N-O 3.02Å; N438-E445 HydrophobicContact CB-CG 3.79Å; N438-E445 VanDerWaalsContact CB-OE1 3.27Å; N438-E445 WeakPolarHBondContact CB-OE1 3.39Å; N438-E445 PolarHBondContact ND2-OE1 3.46Å
439	L	87.3	Confident	92	Very high	22 Å²	22	38.6 Å²	38.6	12%	0.115	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.6	-177.6	-63.9	-179.1	0	0	0	113.5	L437 E452 I485 V509 A511 V541	L437-L439 PolarHBondContact O-N 3.04Å; L439-E452 HydrophobicContact CD2-CB 3.74Å; L439-I485 HydrophobicContact CD1-CD1 3.82Å; L439-I485 HydrophobicContact CD2-CD1 3.96Å; L439-I485 HydrophobicContact CG-CD1 4.31Å; L439-V509 HydrophobicContact CD1-CG1 4.27Å; L439-V509 HydrophobicContact CD2-CB 4.31Å; L439-V509 HydrophobicContact CD2-CG1 4.01Å; L439-V509 HydrophobicContact CD2-CG2 4.4Å; L439-A511 HydrophobicContact CD1-CB 4.39Å; L439-V541 WeakPolarHBondContact O-CG2 3.49Å
440	H	82.6	Confident	91.9	Very high	93 Å²	93	42.5 Å²	42.5	43%	0.431	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-38	-178.9	-174.6	77.3	0	0	0	113.3	N438 R540	N438-H440 PolarHBondContact O-N 3.08Å; N438-H440 VanDerWaalsContact OD1-CA 3.32Å; N438-H440 WeakPolarHBondContact OD1-CA 3.22Å; N438-H440 WeakPolarHBondContact OD1-CB 3.35Å; N438-H440 PolarHBondContact OD1-N 3.21Å; H440-R540 PolarHBondContact CE1-O 3.12Å; H440-R540 PolarHBondContact ND1-O 3.26Å
441	T	86	Confident	91.9	Very high	74 Å²	74	41.9 Å²	41.9	45%	0.454	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-16.4	-173	72.1	0	0	0	0	114.1	N438 K443	N438-T441 VanDerWaalsContact CB-OG1 3.29Å; N438-T441 WeakPolarHBondContact CB-OG1 3.19Å; N438-T441 PolarHBondContact O-N 2.75Å; N438-T441 PolarHBondContact OD1-N 2.8Å; T441-K443 PolarHBondContact O-N 3.27Å; T441-K443 PolarHBondContact OG1-N 3.24Å
442	G	85.2	Confident	91.9	Very high	38 Å²	38	41.2 Å²	41.2	39%	0.392	22%	0.224	S	C	.	.			trans	67	12.1	-174.5	0	0	0	0	0	114.4	L437 N438	L437-G442 WeakPolarHBondContact CD2-O 3.45Å; N438-G442 WeakPolarHBondContact O-CA 3.46Å; N438-G442 PolarHBondContact O-N 3.2Å
443	K	88.4	Confident	92	Very high	134 Å²	134	41.2 Å²	41.2	58%	0.583	22%	0.224	S	C	*	.	S	Bend	trans	-96.1	153.9	178.3	-63.7	-177.7	-178	178	0	111.3	N438 T441 E445	N438-K443 PolarHBondContact N-O 3.02Å; T441-K443 PolarHBondContact O-N 3.27Å; T441-K443 PolarHBondContact OG1-N 3.24Å; K443-E445 PolarHBondContact O-N 3.35Å
444	A	91.9	Very high	91.9	Very high	16 Å²	16	39.9 Å²	39.9	13%	0.132	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-68.2	126.4	173.4	0	0	0	0	0	110.9	N72 K435 I436	N72-A444 HydrophobicContact CB-CB 3.84Å; N72-A444 PolarHBondContact ND2-O 2.76Å; K435-A444 HydrophobicContact CB-CB 4.24Å; K435-A444 HydrophobicContact CD-CB 4.03Å; I436-A444 CarbonylContact O-C 3.46Å; I436-A444 WeakPolarHBondContact O-CA 2.83Å
445	E	92.9	Very high	92	Very high	38 Å²	38	39.9 Å²	39.9	18%	0.178	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-85.7	151.3	180	-81.1	-63	170.2	0	0	112.7	N72 I436 N438 K443 R449 Y488	N72-E445 VanDerWaalsContact CB-O 3.32Å; N72-E445 WeakPolarHBondContact CB-O 3.38Å; I436-E445 HydrophobicContact CB-CB 4.17Å; I436-E445 HydrophobicContact CG2-CB 4.13Å; I436-E445 WeakPolarHBondContact O-CB 3.28Å; I436-E445 PolarHBondContact O-N 2.89Å; N438-E445 HydrophobicContact CB-CG 3.79Å; N438-E445 VanDerWaalsContact CB-OE1 3.27Å; N438-E445 WeakPolarHBondContact CB-OE1 3.39Å; N438-E445 PolarHBondContact ND2-OE1 3.46Å; K443-E445 PolarHBondContact O-N 3.35Å; E445-R449 HydrophobicContact CB-CB 3.86Å; E445-R449 HydrophobicContact CG-CB 4.04Å; E445-R449 WeakPolarHBondContact OE2-CB 3.45Å; E445-R449 WeakPolarHBondContact OE2-CG 3.44Å; E445-Y488 PolarHBondContact O-OH 3.19Å
446	C	91	Very high	91.9	Very high	57 Å²	57	42.7 Å²	42.7	39%	0.385	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-81.2	171.4	172.6	61.6	0	0	0	0	111.9	N72 R449	N72-C446 PolarHBondContact ND2-N 3.41Å; C446-R449 WeakPolarHBondContact O-CB 3.26Å; C446-R449 PolarHBondContact O-N 2.84Å
447	S	89.9	Confident	91.9	Very high	41 Å²	41	43.7 Å²	43.7	29%	0.287	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	139.6	176.7	-179.3	0	0	0	0	112.8	R449 Y488 D489 Q490	S447-R449 PolarHBondContact O-N 3.27Å; S447-Y488 CarbonylContact C-O 3.33Å; S447-Y488 WeakPolarHBondContact CA-O 3.09Å; S447-Y488 VanDerWaalsContact N-CZ 3.32Å; S447-Y488 PolarHBondContact N-OH 2.74Å; S447-Y488 PolarHBondContact OG-O 2.66Å; S447-D489 WeakPolarHBondContact OG-CA 3.39Å; S447-D489 PolarHBondContact OG-O 3.47Å; S447-Q490 PolarHBondContact OG-N 2.88Å
448	G	91.3	Very high	91.9	Very high	33 Å²	33	44.1 Å²	44.1	34%	0.34	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	-2	-180	0	0	0	0	0	115.2	Y488	G448-Y488 PolarHBondContact N-O 2.87Å
449	R	93.3	Very high	92.2	Very high	155 Å²	155	42.5 Å²	42.5	59%	0.585	23%	0.233	S	C	*	.			trans	-97.6	134.9	178.6	-61	-63.9	-174.1	176.1	0.5	111.2	E445 C446 S447 F487	E445-R449 HydrophobicContact CB-CB 3.86Å; E445-R449 HydrophobicContact CG-CB 4.04Å; E445-R449 WeakPolarHBondContact OE2-CB 3.45Å; E445-R449 WeakPolarHBondContact OE2-CG 3.44Å; C446-R449 WeakPolarHBondContact O-CB 3.26Å; C446-R449 PolarHBondContact O-N 2.84Å; S447-R449 PolarHBondContact O-N 3.27Å; R449-F487 WeakPolarHBondContact O-CB 3.42Å
450	M	93.4	Very high	92.5	Very high	87 Å²	87	41.5 Å²	41.5	43%	0.429	23%	0.229	S	C	.	.			trans	-78.6	143	-179.6	-66.2	-169.4	-61.7	0	0	112	G486 Y513	M450-G486 CarbonylContact C-O 3.59Å; M450-G486 WeakPolarHBondContact CA-O 3.39Å; M450-Y513 HydrophobicContact CE-CE1 4.24Å; M450-Y513 HydrophobicContact SD-CD1 4.47Å; M450-Y513 HydrophobicContact SD-CE1 3.99Å
451	G	95	Very high	93	Very high	2 Å²	2	37.1 Å²	37.1	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.4	-170.4	173.1	0	0	0	0	0	111.6	I436 L437 I485 G486	I436-G451 VanDerWaalsContact CG2-N 3.27Å; L437-G451 CarbonylContact O-C 3.51Å; L437-G451 WeakPolarHBondContact O-CA 3.27Å; G451-I485 CarbonylContact O-C 3.44Å; G451-I485 VanDerWaalsContact O-CA 3.3Å; G451-I485 WeakPolarHBondContact O-CA 3.38Å; G451-G486 PolarHBondContact N-O 2.93Å; G451-G486 PolarHBondContact O-N 3.31Å; G451-G486 VanDerWaalsContact O-O 3.1Å
452	E	95.8	Very high	92.5	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.019	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	132.2	173.4	178.5	175.8	-165.8	0	0	111	I436 L437 L439 V454 H481 T482 G483 D484 I485 R503	I436-E452 CarbonylContact C-O 3.44Å; I436-E452 WeakPolarHBondContact CA-O 3.35Å; L437-E452 HydrophobicContact CB-CB 4.45Å; L437-E452 PolarHBondContact N-O 3.29Å; L437-E452 PolarHBondContact O-N 2.92Å; L439-E452 HydrophobicContact CD2-CB 3.74Å; E452-V454 HydrophobicContact CG-CG1 3.89Å; E452-V454 PolarHBondContact O-N 3.12Å; E452-H481 WeakPolarHBondContact OE1-CA 3.41Å; E452-H481 VanDerWaalsContact OE1-CB 3.28Å; E452-H481 WeakPolarHBondContact OE1-CB 3.25Å; E452-H481 IonicContact OE1-CG 3.98Å; E452-H481 IonicContact OE1-ND1 3.69Å; E452-H481 IonicContact OE2-CE1 3.13Å; E452-H481 IonicContact OE2-CG 3.81Å; E452-H481 IonicContact OE2-ND1 2.85Å; E452-H481 PolarHBondContact OE2-ND1 3.32Å; E452-T482 PolarHBondContact OE1-N 3.08Å; E452-G483 WeakPolarHBondContact OE1-CA 3.33Å; E452-G483 PolarHBondContact OE1-N 3.24Å; E452-D484 CarbonylContact C-O 3.54Å; E452-D484 WeakPolarHBondContact CA-O 3.46Å; E452-I485 HydrophobicContact CB-CD1 4.15Å; E452-R503 IonicContact OE1-CZ 3.91Å; E452-R503 IonicContact OE1-NH1 3.81Å; E452-R503 IonicContact OE1-NH2 3.91Å; E452-R503 PolarHBondContact OE1-NH2 2.84Å; E452-R503 IonicContact OE2-CZ 3.12Å; E452-R503 IonicContact OE2-NH1 3.62Å; E452-R503 PolarHBondContact OE2-NH1 3.08Å; E452-R503 IonicContact OE2-NH2 2.79Å; E452-R503 PolarHBondContact OE2-NH2 3.37Å; E452-R503 VanDerWaalsContact OE2-NH2 3.14Å
453	I	96.5	Very high	91.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	123.2	169.8	-58.3	174.7	0	0	0	108.2	I436 L455 T482 D484 I496	I436-I453 HydrophobicContact CD1-CB 4.35Å; I436-I453 HydrophobicContact CD1-CG1 3.7Å; I453-L455 HydrophobicContact CG2-CD2 4.04Å; I453-L455 HydrophobicContact CG2-CG 4.44Å; I453-T482 HydrophobicContact CG2-CG2 4.36Å; I453-T482 WeakPolarHBondContact O-CB 3.22Å; I453-T482 VanDerWaalsContact O-CG2 3.28Å; I453-T482 WeakPolarHBondContact O-CG2 3.32Å; I453-T482 PolarHBondContact O-N 3.16Å; I453-T482 PolarHBondContact O-OG1 2.74Å; I453-D484 HydrophobicContact CD1-CB 4.4Å; I453-D484 PolarHBondContact N-O 2.88Å; I453-I496 HydrophobicContact CD1-CG1 3.93Å
454	V	96.4	Very high	90.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	141.1	173.2	-52.7	0	0	0	0	111.4	C434 K435 L437 E452 W479 L480 H481	C434-V454 WeakPolarHBondContact CA-O 3.4Å; K435-V454 HydrophobicContact CD-CG2 3.99Å; K435-V454 VanDerWaalsContact CE-CG2 3.44Å; K435-V454 HydrophobicContact CG-CG2 3.25Å; K435-V454 PolarHBondContact N-O 3.21Å; K435-V454 WeakPolarHBondContact O-CG2 3.15Å; K435-V454 PolarHBondContact O-N 2.89Å; L437-V454 HydrophobicContact CD1-CB 4.36Å; L437-V454 HydrophobicContact CD1-CG1 3.62Å; L437-V454 HydrophobicContact CD1-CG2 3.84Å; L437-V454 HydrophobicContact CG-CG1 4.07Å; L437-V454 HydrophobicContact CG-CG2 3.81Å; E452-V454 HydrophobicContact CG-CG1 3.89Å; E452-V454 PolarHBondContact O-N 3.12Å; V454-W479 HydrophobicContact CB-CE3 4.4Å; V454-W479 HydrophobicContact CG2-CD2 4.38Å; V454-W479 HydrophobicContact CG2-CE3 3.8Å; V454-W479 HydrophobicContact CG2-CZ3 4.46Å; V454-L480 CarbonylContact C-O 3.5Å; V454-L480 VanDerWaalsContact CA-O 3.22Å; V454-L480 WeakPolarHBondContact CA-O 3.49Å; V454-L480 WeakPolarHBondContact CB-O 3.34Å; V454-H481 HydrophobicContact CG1-CB 4.41Å
455	L	96.9	Very high	89.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	147	-167.2	-55.7	174.9	0	0	0	110.9	L405 A408 T412 L428 M432 E433 C434 I453 V460 W479 L480 T482	L405-L455 HydrophobicContact CD1-CD1 4.2Å; A408-L455 HydrophobicContact CB-CD1 4.45Å; T412-L455 HydrophobicContact CG2-CD1 4.06Å; L428-L455 HydrophobicContact CD1-CD2 4.39Å; M432-L455 HydrophobicContact CE-CB 4.44Å; E433-L455 CarbonylContact O-C 3.6Å; E433-L455 WeakPolarHBondContact O-CA 3.22Å; C434-L455 HydrophobicContact CB-CD2 3.94Å; I453-L455 HydrophobicContact CG2-CD2 4.04Å; I453-L455 HydrophobicContact CG2-CG 4.44Å; L455-V460 HydrophobicContact CB-CG2 4.47Å; L455-W479 CarbonylContact O-C 3.51Å; L455-W479 WeakPolarHBondContact O-CA 3.16Å; L455-L480 HydrophobicContact CB-CB 4.42Å; L455-L480 PolarHBondContact N-O 2.88Å; L455-L480 PolarHBondContact O-N 3.12Å; L455-T482 HydrophobicContact CD1-CG2 3.69Å; L455-T482 HydrophobicContact CG-CG2 3.82Å
456	R	95.4	Very high	87.6	Confident	60 Å²	60	36.1 Å²	36.1	23%	0.226	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	145	170.5	-177.6	168.9	75.2	158.8	4.4	109.2	E433 G478 W479	E433-R456 HydrophobicContact CB-CB 4.36Å; E433-R456 PolarHBondContact N-O 2.76Å; E433-R456 PolarHBondContact O-N 3.02Å; E433-R456 IonicContact OE1-NH2 3.33Å; E433-R456 PolarHBondContact OE1-NH2 3.05Å; E433-R456 IonicContact OE2-CZ 3.32Å; E433-R456 IonicContact OE2-NE 3.88Å; E433-R456 PolarHBondContact OE2-NE 3.08Å; E433-R456 IonicContact OE2-NH2 3.96Å; E433-R456 PolarHBondContact OE2-NH2 3.41Å; R456-G478 WeakPolarHBondContact CG-O 3.33Å; R456-W479 HydrophobicContact CB-CD2 3.82Å; R456-W479 HydrophobicContact CB-CE3 3.56Å; R456-W479 HydrophobicContact CB-CG 4.49Å; R456-W479 HydrophobicContact CB-CH2 3.96Å; R456-W479 HydrophobicContact CB-CZ2 4.23Å; R456-W479 HydrophobicContact CB-CZ3 3.64Å
457	G	95.3	Very high	86.2	Confident	21 Å²	21	38.7 Å²	38.7	22%	0.216	20%	0.2	C	C	.	.	S	Bend	trans	148.3	-176	178	0	0	0	0	0	112.1	L459 V460	G457-L459 PolarHBondContact O-N 2.65Å; G457-V460 PolarHBondContact O-N 3.2Å; G457-V460 VanDerWaalsContact O-N 3.15Å
458	P	94.6	Very high	84.7	Confident	17 Å²	17	41.6 Å²	41.6	11%	0.11	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-16.4	-173.4	29.6	-36.4	0	0	0	113.5	L81 N279 S282 N431	L81-P458 HydrophobicContact CD1-CB 4.25Å; L81-P458 HydrophobicContact CD1-CG 4.09Å; N279-P458 WeakPolarHBondContact CA-O 3.4Å; N279-P458 PolarHBondContact ND2-O 3.14Å; S282-P458 WeakPolarHBondContact OG-CB 3.3Å; N431-P458 HydrophobicContact CB-CG 3.83Å; N431-P458 WeakPolarHBondContact O-CD 3.15Å
459	L	96	Very high	83.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-14.9	176.5	-54.9	-176.8	0	0	0	113	S283 L286 A408 T409 I411 T412 L429 M432 G457 A461	S283-L459 VanDerWaalsContact CA-CD2 3.42Å; L286-L459 HydrophobicContact CD1-CD1 4.08Å; L286-L459 HydrophobicContact CD1-CD2 4.06Å; L286-L459 HydrophobicContact CD1-CG 4.09Å; A408-L459 CarbonylContact C-O 3.51Å; A408-L459 WeakPolarHBondContact CA-O 3.42Å; A408-L459 WeakPolarHBondContact O-CB 3.5Å; A408-L459 VanDerWaalsContact O-O 3.09Å; T409-L459 WeakPolarHBondContact CB-O 3.29Å; T409-L459 PolarHBondContact N-O 2.96Å; T409-L459 PolarHBondContact OG1-O 3.02Å; I411-L459 WeakPolarHBondContact O-CD1 3.15Å; T412-L459 HydrophobicContact CG2-CD1 4.33Å; L429-L459 HydrophobicContact CD1-CD1 4.31Å; M432-L459 HydrophobicContact CE-CB 3.96Å; M432-L459 HydrophobicContact CE-CG 4.46Å; M432-L459 HydrophobicContact CG-CD1 4.01Å; M432-L459 HydrophobicContact CG-CG 4.34Å; M432-L459 HydrophobicContact SD-CB 3.61Å; M432-L459 HydrophobicContact SD-CD1 3.83Å; M432-L459 HydrophobicContact SD-CG 3.56Å; M432-L459 VanDerWaalsContact SD-CG 3.56Å; G457-L459 PolarHBondContact O-N 2.65Å; L459-A461 PolarHBondContact O-N 3.38Å
460	V	95.5	Very high	82.3	Confident	2 Å²	2	39 Å²	39	1%	0.012	22%	0.217	C	C	.	.	S	Bend	trans	-71.4	121.6	178.8	176	0	0	0	0	110.2	N279 M432 L455 G457 Q462 L474 L480	N279-V460 PolarHBondContact ND2-O 3.18Å; M432-V460 HydrophobicContact CE-CG2 4.25Å; L455-V460 HydrophobicContact CB-CG2 4.47Å; G457-V460 PolarHBondContact O-N 3.2Å; G457-V460 VanDerWaalsContact O-N 3.15Å; V460-Q462 PolarHBondContact O-N 3.34Å; V460-Q462 PolarHBondContact O-NE2 3.21Å; V460-Q462 VanDerWaalsContact O-NE2 3.08Å; V460-L474 HydrophobicContact CG1-CD1 3.54Å; V460-L480 HydrophobicContact CG1-CB 3.81Å; V460-L480 HydrophobicContact CG2-CB 4.01Å; V460-L480 HydrophobicContact CG2-CD2 4.49Å
461	A	91.9	Very high	81.7	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.201	C	C	.	.			trans	-60	132.2	176.1	0	0	0	0	0	110	V273 L275 E407 L459 V464	V273-A461 HydrophobicContact CG1-CB 3.86Å; L275-A461 HydrophobicContact CD2-CB 3.9Å; E407-A461 VanDerWaalsContact O-CB 3.27Å; E407-A461 WeakPolarHBondContact O-CB 3.41Å; E407-A461 PolarHBondContact O-N 2.76Å; L459-A461 PolarHBondContact O-N 3.38Å; A461-V464 HydrophobicContact CB-CG2 3.89Å
462	Q	74.7	Confident	81.3	Confident	74 Å²	74	35.6 Å²	35.6	35%	0.346	20%	0.2	S	C	.	.	S	Bend	trans	-82.4	-20.3	-174.8	-63.3	-60.3	-54.5	0	0	113	I255 T276 V460	I255-Q462 HydrophobicContact CG2-CB 4.3Å; I255-Q462 HydrophobicContact CG2-CG 4.27Å; T276-Q462 HydrophobicContact CG2-CB 4.43Å; T276-Q462 HydrophobicContact CG2-CG 4.41Å; V460-Q462 PolarHBondContact O-N 3.34Å; V460-Q462 PolarHBondContact O-NE2 3.21Å; V460-Q462 VanDerWaalsContact O-NE2 3.08Å
463	C	68.3	Low	80.9	Confident	37 Å²	37	38.4 Å²	38.4	25%	0.25	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-125.4	68.4	179.3	-36	0	0	0	0	110	H274 P465	H274-C463 HydrophobicContact CB-CB 3.87Å; C463-P465 WeakPolarHBondContact O-CD 3.44Å
464	V	65.9	Low	80.5	Confident	14 Å²	14	39.1 Å²	39.1	9%	0.085	22%	0.215	C	C	.	.			trans	-80.9	117.3	164.8	-178	0	0	0	0	107	E407 A461 E466 L480	E407-V464 HydrophobicContact CB-CG2 3.99Å; E407-V464 HydrophobicContact CG-CG1 4.01Å; E407-V464 HydrophobicContact CG-CG2 4.08Å; A461-V464 HydrophobicContact CB-CG2 3.89Å; V464-E466 PolarHBondContact O-N 3.47Å; V464-L480 HydrophobicContact CG2-CD1 4.37Å
465	P	63.4	Low	80.1	Confident	23 Å²	23	40 Å²	40	15%	0.149	22%	0.22	C	C	.	.			trans	-58.3	121.5	179.8	-22.1	31.7	0	0	0	111.2	M272 C463 H467	M272-P465 HydrophobicContact CB-CG 4.08Å; M272-P465 WeakPolarHBondContact O-CD 3.15Å; M272-P465 WeakPolarHBondContact O-CG 3.46Å; C463-P465 WeakPolarHBondContact O-CD 3.44Å; P465-H467 VanDerWaalsContact C-N 3.34Å; P465-H467 PolarHBondContact O-N 2.81Å
466	E	58.5	Low	79.6	Confident	131 Å²	131	47.7 Å²	47.7	61%	0.612	25%	0.253	S	S	*	.			trans	-77.9	84.9	171.8	-69.8	-174.6	-179	0	0	109.2	V464	V464-E466 PolarHBondContact O-N 3.47Å
467	H	62.8	Low	79.2	Confident	112 Å²	112	47.7 Å²	47.7	52%	0.519	25%	0.254	S	S	.	.			trans	-89.3	140.5	160.8	-57.6	-61.3	0	0	0	108.9	P465 D469 C470	P465-H467 VanDerWaalsContact C-N 3.34Å; P465-H467 PolarHBondContact O-N 2.81Å; H467-D469 PolarHBondContact O-N 2.92Å; H467-C470 HydrophobicContact CB-CB 4.42Å; H467-C470 VanDerWaalsContact O-CB 3.29Å; H467-C470 WeakPolarHBondContact O-CB 3.49Å; H467-C470 PolarHBondContact O-N 2.95Å
468	A	57	Low	78.9	Confident	102 Å²	102	47.7 Å²	47.7	84%	0.843	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-28.4	-178.8	0	0	0	0	0	113.1
469	D	62.4	Low	78.8	Confident	122 Å²	122	46.9 Å²	46.9	65%	0.652	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-1.8	-179.9	-59	-33.4	0	0	0	113.8	H467 L471	H467-D469 PolarHBondContact O-N 2.92Å; D469-L471 PolarHBondContact O-N 2.81Å
470	C	72.1	Confident	78.7	Confident	10 Å²	10	46.9 Å²	46.9	7%	0.068	25%	0.248	C	C	.	.			trans	-69.5	114.2	178.1	-87.4	0	0	0	0	110.4	H467 T472	H467-C470 HydrophobicContact CB-CB 4.42Å; H467-C470 VanDerWaalsContact O-CB 3.29Å; H467-C470 WeakPolarHBondContact O-CB 3.49Å; H467-C470 PolarHBondContact O-N 2.95Å; C470-T472 WeakPolarHBondContact CB-O 3.38Å; C470-T472 PolarHBondContact O-N 3.33Å
471	L	80.7	Confident	78.6	Confident	17 Å²	17	47.4 Å²	47.4	9%	0.089	25%	0.25	C	S	.	.	S	Bend	trans	-69.5	-20.4	175.5	-54.8	-177.8	0	0	0	112.9	R266 D469 V500 R503	R266-L471 HydrophobicContact CB-CD1 4.07Å; D469-L471 PolarHBondContact O-N 2.81Å; L471-V500 WeakPolarHBondContact CD1-O 3.22Å; L471-V500 HydrophobicContact CD2-CG1 4.22Å; L471-R503 PolarHBondContact O-NE 2.87Å; L471-R503 PolarHBondContact O-NH2 3.2Å
472	T	87.3	Confident	78.6	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.012	25%	0.25	C	S	.	.	S	Bend	trans	-112.4	124.2	178.1	-46.9	0	0	0	0	108	K271 L405 E407 C470 L480 H481 T482	K271-T472 VanDerWaalsContact NZ-CB 3.32Å; K271-T472 PolarHBondContact NZ-OG1 3.49Å; K271-T472 VanDerWaalsContact NZ-OG1 3.12Å; L405-T472 HydrophobicContact CD2-CG2 4.49Å; E407-T472 HydrophobicContact CB-CG2 4.08Å; E407-T472 HydrophobicContact CG-CG2 3.87Å; C470-T472 WeakPolarHBondContact CB-O 3.38Å; C470-T472 PolarHBondContact O-N 3.33Å; T472-L480 HydrophobicContact CG2-CD1 3.87Å; T472-L480 HydrophobicContact CG2-CG 4.41Å; T472-H481 WeakPolarHBondContact CA-O 3.29Å; T472-H481 VanDerWaalsContact CG2-O 3.25Å; T472-H481 WeakPolarHBondContact CG2-O 3.48Å; T472-T482 PolarHBondContact OG1-O 2.97Å
473	Y	86.9	Confident	79.4	Confident	63 Å²	63	43.9 Å²	43.9	25%	0.247	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	162.2	-177.4	66.8	-89.7	0	0	0	111	D475 H481	Y473-D475 HydrophobicContact CE2-CB 4.29Å; Y473-H481 HydrophobicContact CD1-CB 3.9Å; Y473-H481 HydrophobicContact CD2-CB 4.41Å; Y473-H481 HydrophobicContact CE1-CB 3.64Å; Y473-H481 AromaticContact CE1-CG 3.8Å; Y473-H481 HydrophobicContact CE2-CB 4.16Å; Y473-H481 AromaticContact CE2-CD2 3.39Å; Y473-H481 WeakPolarHBondContact CE2-CD2 3.28Å; Y473-H481 AromaticContact CE2-CG 3.77Å; Y473-H481 AromaticContact CE2-NE2 3.91Å; Y473-H481 HydrophobicContact CG-CB 4.27Å; Y473-H481 AromaticContact CZ-CD2 3.48Å; Y473-H481 VanDerWaalsContact CZ-CD2 3.48Å; Y473-H481 AromaticContact CZ-CG 3.4Å; Y473-H481 AromaticContact CZ-ND1 3.78Å; Y473-H481 AromaticContact CZ-NE2 3.88Å; Y473-H481 PolarHBondContact N-O 3.49Å; Y473-H481 PolarHBondContact O-N 2.79Å; Y473-H481 PolarHBondContact OH-CE1 3.05Å; Y473-H481 VanDerWaalsContact OH-CE1 3.3Å; Y473-H481 PolarHBondContact OH-ND1 2.76Å; Y473-H481 PolarHBondContact OH-NE2 2.73Å
474	L	88.5	Confident	80.6	Confident	14 Å²	14	42.8 Å²	42.8	7%	0.073	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126.8	173.7	-167.6	67.2	0	0	0	109.1	V460 L480	V460-L474 HydrophobicContact CG1-CD1 3.54Å; L474-L480 HydrophobicContact CD1-CB 4.44Å
475	D	88	Confident	82	Confident	20 Å²	20	42.1 Å²	42.1	11%	0.107	22%	0.222	C	C	.	.			trans	-77.5	167	172.4	80.1	6.3	0	0	0	111.7	Y67 Y473 Y477 G478 W479 H481	Y67-D475 VanDerWaalsContact CE1-OD2 3.23Å; Y67-D475 WeakPolarHBondContact CE1-OD2 3.46Å; Y67-D475 VanDerWaalsContact CZ-OD2 3.25Å; Y67-D475 PolarHBondContact OH-OD2 2.84Å; Y473-D475 HydrophobicContact CE2-CB 4.29Å; D475-Y477 PolarHBondContact O-N 2.82Å; D475-Y477 VanDerWaalsContact OD1-C 3.23Å; D475-Y477 VanDerWaalsContact OD1-CA 3.22Å; D475-Y477 WeakPolarHBondContact OD1-CA 3.44Å; D475-Y477 VanDerWaalsContact OD1-CB 3.27Å; D475-Y477 WeakPolarHBondContact OD1-CB 3.34Å; D475-Y477 PolarHBondContact OD1-N 2.83Å; D475-G478 PolarHBondContact O-N 2.88Å; D475-G478 PolarHBondContact OD1-N 2.64Å; D475-W479 PolarHBondContact N-O 3.22Å; D475-W479 PolarHBondContact OD1-N 2.85Å; D475-H481 IonicContact OD2-NE2 3.77Å
476	K	86.1	Confident	83.5	Confident	160 Å²	160	41 Å²	41	70%	0.696	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-4.5	177.3	70.9	-173.6	-177.7	-173.9	0	115.2
477	Y	86.9	Confident	85.2	Confident	61 Å²	61	36.4 Å²	36.4	24%	0.239	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	4.4	-179.4	-58.3	-59.4	0	0	0	112.4	R64 Y67 L68 D475	R64-Y477 HydrophobicContact CG-CE1 3.84Å; Y67-Y477 AromaticContact CD1-CD2 3.58Å; Y67-Y477 HydrophobicContact CD1-CD2 3.58Å; Y67-Y477 AromaticContact CD1-CE2 3.94Å; Y67-Y477 HydrophobicContact CD1-CE2 3.94Å; Y67-Y477 HydrophobicContact CD1-CG 4.19Å; Y67-Y477 AromaticContact CE1-CD2 3.38Å; Y67-Y477 HydrophobicContact CE1-CD2 3.38Å; Y67-Y477 HydrophobicContact CE1-CE2 4.06Å; Y67-Y477 HydrophobicContact CE1-CG 4.09Å; L68-Y477 HydrophobicContact CD2-CD1 4.28Å; L68-Y477 HydrophobicContact CD2-CG 4.13Å; D475-Y477 PolarHBondContact O-N 2.82Å; D475-Y477 VanDerWaalsContact OD1-C 3.23Å; D475-Y477 VanDerWaalsContact OD1-CA 3.22Å; D475-Y477 WeakPolarHBondContact OD1-CA 3.44Å; D475-Y477 VanDerWaalsContact OD1-CB 3.27Å; D475-Y477 WeakPolarHBondContact OD1-CB 3.34Å; D475-Y477 PolarHBondContact OD1-N 2.83Å
478	G	89.2	Confident	86.7	Confident	21 Å²	21	32 Å²	32	22%	0.216	17%	0.171	C	C	.	.	S	Bend	trans	79.3	17.4	179.8	0	0	0	0	0	114.2	R456 D475	R456-G478 WeakPolarHBondContact CG-O 3.33Å; D475-G478 PolarHBondContact O-N 2.88Å; D475-G478 PolarHBondContact OD1-N 2.64Å
479	W	92.8	Very high	88.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.139	C	C	.	.			trans	-88.2	120.8	170.8	-66.9	88.9	0	0	0	110.3	Y67 V73 E433 K435 V454 L455 R456 D475 H481	Y67-W479 AromaticContact CE1-CD1 3.62Å; Y67-W479 HydrophobicContact CE1-CG 4.4Å; V73-W479 HydrophobicContact CG1-CH2 3.7Å; V73-W479 HydrophobicContact CG1-CZ2 4.24Å; V73-W479 HydrophobicContact CG2-CH2 4.37Å; V73-W479 HydrophobicContact CG2-CZ2 4.37Å; E433-W479 HydrophobicContact CB-CH2 3.83Å; E433-W479 HydrophobicContact CB-CZ3 4.21Å; K435-W479 HydrophobicContact CD-CH2 4.39Å; K435-W479 HydrophobicContact CD-CZ2 4.41Å; K435-W479 HydrophobicContact CD-CZ3 4.44Å; K435-W479 HydrophobicContact CG-CE3 4.31Å; K435-W479 HydrophobicContact CG-CH2 4.37Å; K435-W479 HydrophobicContact CG-CZ3 4.07Å; V454-W479 HydrophobicContact CB-CE3 4.4Å; V454-W479 HydrophobicContact CG2-CD2 4.38Å; V454-W479 HydrophobicContact CG2-CE3 3.8Å; V454-W479 HydrophobicContact CG2-CZ3 4.46Å; L455-W479 CarbonylContact O-C 3.51Å; L455-W479 WeakPolarHBondContact O-CA 3.16Å; R456-W479 HydrophobicContact CB-CD2 3.82Å; R456-W479 HydrophobicContact CB-CE3 3.56Å; R456-W479 HydrophobicContact CB-CG 4.49Å; R456-W479 HydrophobicContact CB-CH2 3.96Å; R456-W479 HydrophobicContact CB-CZ2 4.23Å; R456-W479 HydrophobicContact CB-CZ3 3.64Å; D475-W479 PolarHBondContact N-O 3.22Å; D475-W479 PolarHBondContact OD1-N 2.85Å; W479-H481 PolarHBondContact O-N 3.32Å
480	L	93.9	Very high	89.4	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	110.4	168.6	-178.3	69.1	0	0	0	109	E407 A408 V454 L455 V460 V464 T472 L474 T482	E407-L480 HydrophobicContact CB-CD1 3.94Å; E407-L480 HydrophobicContact CB-CD2 4.01Å; A408-L480 HydrophobicContact CB-CD2 3.91Å; V454-L480 CarbonylContact C-O 3.5Å; V454-L480 VanDerWaalsContact CA-O 3.22Å; V454-L480 WeakPolarHBondContact CA-O 3.49Å; V454-L480 WeakPolarHBondContact CB-O 3.34Å; L455-L480 HydrophobicContact CB-CB 4.42Å; L455-L480 PolarHBondContact N-O 2.88Å; L455-L480 PolarHBondContact O-N 3.12Å; V460-L480 HydrophobicContact CG1-CB 3.81Å; V460-L480 HydrophobicContact CG2-CB 4.01Å; V460-L480 HydrophobicContact CG2-CD2 4.49Å; V464-L480 HydrophobicContact CG2-CD1 4.37Å; T472-L480 HydrophobicContact CG2-CD1 3.87Å; T472-L480 HydrophobicContact CG2-CG 4.41Å; L474-L480 HydrophobicContact CD1-CB 4.44Å; L480-T482 PolarHBondContact O-N 3.11Å
481	H	93.4	Very high	90	Very high	12 Å²	12	37.1 Å²	37.1	6%	0.056	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	110	165.2	-77	-99.9	0	0	0	108.5	L437 E452 V454 T472 Y473 D475 W479 G483	L437-H481 WeakPolarHBondContact CD1-CE1 3.43Å; E452-H481 WeakPolarHBondContact OE1-CA 3.41Å; E452-H481 VanDerWaalsContact OE1-CB 3.28Å; E452-H481 WeakPolarHBondContact OE1-CB 3.25Å; E452-H481 IonicContact OE1-CG 3.98Å; E452-H481 IonicContact OE1-ND1 3.69Å; E452-H481 IonicContact OE2-CE1 3.13Å; E452-H481 IonicContact OE2-CG 3.81Å; E452-H481 IonicContact OE2-ND1 2.85Å; E452-H481 PolarHBondContact OE2-ND1 3.32Å; V454-H481 HydrophobicContact CG1-CB 4.41Å; T472-H481 WeakPolarHBondContact CA-O 3.29Å; T472-H481 VanDerWaalsContact CG2-O 3.25Å; T472-H481 WeakPolarHBondContact CG2-O 3.48Å; Y473-H481 HydrophobicContact CD1-CB 3.9Å; Y473-H481 HydrophobicContact CD2-CB 4.41Å; Y473-H481 HydrophobicContact CE1-CB 3.64Å; Y473-H481 AromaticContact CE1-CG 3.8Å; Y473-H481 HydrophobicContact CE2-CB 4.16Å; Y473-H481 AromaticContact CE2-CD2 3.39Å; Y473-H481 WeakPolarHBondContact CE2-CD2 3.28Å; Y473-H481 AromaticContact CE2-CG 3.77Å; Y473-H481 AromaticContact CE2-NE2 3.91Å; Y473-H481 HydrophobicContact CG-CB 4.27Å; Y473-H481 AromaticContact CZ-CD2 3.48Å; Y473-H481 VanDerWaalsContact CZ-CD2 3.48Å; Y473-H481 AromaticContact CZ-CG 3.4Å; Y473-H481 AromaticContact CZ-ND1 3.78Å; Y473-H481 AromaticContact CZ-NE2 3.88Å; Y473-H481 PolarHBondContact N-O 3.49Å; Y473-H481 PolarHBondContact O-N 2.79Å; Y473-H481 PolarHBondContact OH-CE1 3.05Å; Y473-H481 VanDerWaalsContact OH-CE1 3.3Å; Y473-H481 PolarHBondContact OH-ND1 2.76Å; Y473-H481 PolarHBondContact OH-NE2 2.73Å; D475-H481 IonicContact OD2-NE2 3.77Å; W479-H481 PolarHBondContact O-N 3.32Å; H481-G483 VanDerWaalsContact C-N 3.31Å
482	T	92.8	Very high	90.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-27.5	-174.2	63.7	0	0	0	0	112.2	R266 L405 E452 I453 L455 T472 L480 D484	R266-T482 PolarHBondContact NH2-O 3Å; L405-T482 HydrophobicContact CD1-CG2 3.92Å; E452-T482 PolarHBondContact OE1-N 3.08Å; I453-T482 HydrophobicContact CG2-CG2 4.36Å; I453-T482 WeakPolarHBondContact O-CB 3.22Å; I453-T482 VanDerWaalsContact O-CG2 3.28Å; I453-T482 WeakPolarHBondContact O-CG2 3.32Å; I453-T482 PolarHBondContact O-N 3.16Å; I453-T482 PolarHBondContact O-OG1 2.74Å; L455-T482 HydrophobicContact CD1-CG2 3.69Å; L455-T482 HydrophobicContact CG-CG2 3.82Å; T472-T482 PolarHBondContact OG1-O 2.97Å; L480-T482 PolarHBondContact O-N 3.11Å; T482-D484 PolarHBondContact OG1-N 3.2Å
483	G	91.3	Very high	90.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76	3.9	-165.1	0	0	0	0	0	113.5	R266 E452 H481 V500	R266-G483 VanDerWaalsContact NH1-C 3.31Å; R266-G483 PolarHBondContact NH1-O 2.7Å; E452-G483 WeakPolarHBondContact OE1-CA 3.33Å; E452-G483 PolarHBondContact OE1-N 3.24Å; H481-G483 VanDerWaalsContact C-N 3.31Å; G483-V500 WeakPolarHBondContact O-CB 3.27Å; G483-V500 WeakPolarHBondContact O-CG2 3.48Å; G483-V500 PolarHBondContact O-N 3.3Å
484	D	93.5	Very high	91	Very high	14 Å²	14	38.9 Å²	38.9	8%	0.075	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	137.2	175.5	-65.5	-50.8	0	0	0	110.9	R266 Y403 E452 I453 T482 I496 I499	R266-D484 IonicContact CZ-OD1 3.97Å; R266-D484 IonicContact NH1-OD1 3.85Å; R266-D484 IonicContact NH2-OD1 3.62Å; R266-D484 PolarHBondContact NH2-OD1 2.89Å; R266-D484 IonicContact NH2-OD2 3.02Å; R266-D484 PolarHBondContact NH2-OD2 3.48Å; R266-D484 VanDerWaalsContact NH2-OD2 3.1Å; Y403-D484 PolarHBondContact OH-OD2 3.43Å; E452-D484 CarbonylContact C-O 3.54Å; E452-D484 WeakPolarHBondContact CA-O 3.46Å; I453-D484 HydrophobicContact CD1-CB 4.4Å; I453-D484 PolarHBondContact N-O 2.88Å; T482-D484 PolarHBondContact OG1-N 3.2Å; D484-I496 HydrophobicContact CB-CG2 4.44Å; D484-I499 WeakPolarHBondContact OD1-CG2 3.23Å
485	I	94.4	Very high	91.2	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.1	-179.2	-56.5	-54.8	0	0	0	108.7	L439 G451 E452 T497 G498 V500 A511 Y513	L439-I485 HydrophobicContact CD1-CD1 3.82Å; L439-I485 HydrophobicContact CD2-CD1 3.96Å; L439-I485 HydrophobicContact CG-CD1 4.31Å; G451-I485 CarbonylContact O-C 3.44Å; G451-I485 VanDerWaalsContact O-CA 3.3Å; G451-I485 WeakPolarHBondContact O-CA 3.38Å; E452-I485 HydrophobicContact CB-CD1 4.15Å; I485-T497 PolarHBondContact O-N 3.03Å; I485-T497 PolarHBondContact O-OG1 3.3Å; I485-T497 VanDerWaalsContact O-OG1 3.12Å; I485-G498 PolarHBondContact N-O 2.87Å; I485-G498 PolarHBondContact O-N 3.35Å; I485-G498 VanDerWaalsContact O-N 3.07Å; I485-V500 HydrophobicContact CD1-CG2 3.6Å; I485-V500 HydrophobicContact CG1-CG2 4.22Å; I485-A511 HydrophobicContact CG1-CB 4.08Å; I485-Y513 HydrophobicContact CG2-CD1 4.47Å; I485-Y513 HydrophobicContact CG2-CE1 3.75Å
486	G	95.1	Very high	91.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	-172.6	-174.1	0	0	0	0	0	113.5	M450 G451 Y495	M450-G486 CarbonylContact C-O 3.59Å; M450-G486 WeakPolarHBondContact CA-O 3.39Å; G451-G486 PolarHBondContact N-O 2.93Å; G451-G486 PolarHBondContact O-N 3.31Å; G451-G486 VanDerWaalsContact O-O 3.1Å; G486-Y495 CarbonylContact C-O 3.55Å; G486-Y495 WeakPolarHBondContact CA-O 3.41Å
487	F	94.1	Very high	91.7	Very high	35 Å²	35	33.3 Å²	33.3	15%	0.154	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	172.6	171.6	68	-84	0	0	0	108.7	R449 Y495 T497	R449-F487 WeakPolarHBondContact O-CB 3.42Å; F487-Y495 AromaticContact CD2-CD2 3.99Å; F487-Y495 HydrophobicContact CD2-CD2 3.99Å; F487-Y495 HydrophobicContact CE1-CD2 4.29Å; F487-Y495 HydrophobicContact CE1-CG 4.1Å; F487-Y495 AromaticContact CE2-CD2 3.44Å; F487-Y495 HydrophobicContact CE2-CD2 3.44Å; F487-Y495 VanDerWaalsContact CE2-CD2 3.44Å; F487-Y495 AromaticContact CE2-CE2 3.93Å; F487-Y495 HydrophobicContact CE2-CE2 3.93Å; F487-Y495 HydrophobicContact CE2-CG 4.04Å; F487-Y495 HydrophobicContact CZ-CD1 4.42Å; F487-Y495 AromaticContact CZ-CD2 3.61Å; F487-Y495 HydrophobicContact CZ-CD2 3.61Å; F487-Y495 HydrophobicContact CZ-CE2 4.29Å; F487-Y495 AromaticContact CZ-CG 3.69Å; F487-Y495 HydrophobicContact CZ-CG 3.69Å; F487-Y495 PolarHBondContact N-O 3.16Å; F487-Y495 VanDerWaalsContact N-O 3.13Å; F487-Y495 PolarHBondContact O-N 3Å; F487-T497 HydrophobicContact CD1-CG2 3.92Å; F487-T497 HydrophobicContact CE1-CG2 3.79Å
488	Y	93.6	Very high	91.9	Very high	18 Å²	18	30.4 Å²	30.4	7%	0.071	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	151	168.3	67.6	-78.5	0	0	0	110	I74 I436 E445 S447 G448 N493 F494	I74-Y488 HydrophobicContact CD1-CD1 4.02Å; I74-Y488 HydrophobicContact CD1-CD2 3.29Å; I74-Y488 HydrophobicContact CD1-CE1 4.16Å; I74-Y488 HydrophobicContact CD1-CE2 3.43Å; I74-Y488 VanDerWaalsContact CD1-CE2 3.43Å; I74-Y488 HydrophobicContact CD1-CG 3.59Å; I74-Y488 HydrophobicContact CG1-CE2 4.22Å; I436-Y488 HydrophobicContact CG1-CD1 3.58Å; I436-Y488 HydrophobicContact CG1-CE1 4.05Å; E445-Y488 PolarHBondContact O-OH 3.19Å; S447-Y488 CarbonylContact C-O 3.33Å; S447-Y488 WeakPolarHBondContact CA-O 3.09Å; S447-Y488 VanDerWaalsContact N-CZ 3.32Å; S447-Y488 PolarHBondContact N-OH 2.74Å; S447-Y488 PolarHBondContact OG-O 2.66Å; G448-Y488 PolarHBondContact N-O 2.87Å; Y488-N493 CarbonylContact C-O 3.52Å; Y488-N493 WeakPolarHBondContact CA-O 3.35Å; Y488-F494 HydrophobicContact CD1-CE1 4.37Å; Y488-F494 HydrophobicContact CG-CE1 4.31Å; Y488-F494 HydrophobicContact CG-CZ 4.4Å
489	D	88.8	Confident	92	Very high	32 Å²	32	31 Å²	31	17%	0.171	15%	0.151	C	C	.	.			trans	-89.7	-169.4	176.7	65.3	23.8	0	0	0	112.7	S447 D491 E492 N493 Y495	S447-D489 WeakPolarHBondContact OG-CA 3.39Å; S447-D489 PolarHBondContact OG-O 3.47Å; D489-D491 PolarHBondContact O-N 2.82Å; D489-D491 PolarHBondContact OD1-N 2.71Å; D489-E492 PolarHBondContact O-N 2.97Å; D489-E492 PolarHBondContact OD1-N 2.57Å; D489-N493 PolarHBondContact N-O 2.99Å; D489-N493 WeakPolarHBondContact OD1-CB 3.38Å; D489-N493 PolarHBondContact OD1-N 2.98Å; D489-N493 PolarHBondContact OD1-ND2 2.82Å; D489-N493 WeakPolarHBondContact OD2-CB 3.17Å; D489-N493 PolarHBondContact OD2-ND2 3.19Å; D489-Y495 HydrophobicContact CB-CE2 3.99Å; D489-Y495 WeakPolarHBondContact OD2-CE2 3.29Å; D489-Y495 PolarHBondContact OD2-OH 3.49Å
490	Q	87.7	Confident	91.8	Very high	179 Å²	179	31 Å²	31	84%	0.836	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-20.3	-176.1	-68	-177.4	-12.8	0	0	112.4	S447 E492	S447-Q490 PolarHBondContact OG-N 2.88Å; Q490-E492 VanDerWaalsContact C-N 3.3Å
491	D	85.9	Confident	91.3	Very high	131 Å²	131	35.6 Å²	35.6	70%	0.701	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.8	14.7	178.3	-59.4	-48.3	0	0	0	111.3	D489 N493	D489-D491 PolarHBondContact O-N 2.82Å; D489-D491 PolarHBondContact OD1-N 2.71Å; D491-N493 WeakPolarHBondContact CB-ND2 3.45Å; D491-N493 PolarHBondContact O-N 2.87Å
492	E	90.5	Very high	90.6	Very high	94 Å²	94	37.3 Å²	37.3	44%	0.439	18%	0.182	S	C	.	.			trans	59.2	27.3	-180	-53.5	-172.4	159.4	0	0	114.6	I74 D489 Q490 F494	I74-E492 HydrophobicContact CD1-CB 4.27Å; I74-E492 HydrophobicContact CD1-CG 4.11Å; I74-E492 WeakPolarHBondContact CG2-OE2 3.25Å; D489-E492 PolarHBondContact O-N 2.97Å; D489-E492 PolarHBondContact OD1-N 2.57Å; Q490-E492 VanDerWaalsContact C-N 3.3Å; E492-F494 VanDerWaalsContact O-CD2 3.24Å; E492-F494 WeakPolarHBondContact O-CD2 2.98Å; E492-F494 WeakPolarHBondContact O-CE2 3.34Å
493	N	91	Very high	89.8	Confident	24 Å²	24	40 Å²	40	13%	0.128	19%	0.192	C	C	.	.			trans	-81.4	131.6	167.8	-59.4	-71.6	0	0	0	109.6	A421 S424 Y488 D489 D491 Y495	A421-N493 HydrophobicContact CB-CB 4.01Å; S424-N493 WeakPolarHBondContact OG-CB 3.17Å; Y488-N493 CarbonylContact C-O 3.52Å; Y488-N493 WeakPolarHBondContact CA-O 3.35Å; D489-N493 PolarHBondContact N-O 2.99Å; D489-N493 WeakPolarHBondContact OD1-CB 3.38Å; D489-N493 PolarHBondContact OD1-N 2.98Å; D489-N493 PolarHBondContact OD1-ND2 2.82Å; D489-N493 WeakPolarHBondContact OD2-CB 3.17Å; D489-N493 PolarHBondContact OD2-ND2 3.19Å; D491-N493 WeakPolarHBondContact CB-ND2 3.45Å; D491-N493 PolarHBondContact O-N 2.87Å; N493-Y495 HydrophobicContact CB-CE2 4.08Å; N493-Y495 WeakPolarHBondContact O-CD2 3.39Å; N493-Y495 WeakPolarHBondContact O-CE2 3.46Å
494	F	93.7	Very high	88.6	Confident	1 Å²	1	41.7 Å²	41.7	0%	0.004	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	150.3	-177.9	-73	-102.5	0	0	0	112.1	I74 H413 S424 I425 G426 C434 I436 Y488 E492	I74-F494 HydrophobicContact CB-CZ 4.35Å; I74-F494 HydrophobicContact CD1-CE1 4.27Å; I74-F494 HydrophobicContact CD1-CE2 3.83Å; I74-F494 HydrophobicContact CD1-CZ 3.35Å; I74-F494 HydrophobicContact CG1-CZ 4.33Å; H413-F494 AromaticContact CD2-CD2 3.52Å; H413-F494 AromaticContact CD2-CG 3.69Å; H413-F494 AromaticContact NE2-CD1 3.96Å; H413-F494 AromaticContact NE2-CD2 3.63Å; H413-F494 AromaticContact NE2-CE2 3.89Å; H413-F494 AromaticContact NE2-CG 3.66Å; S424-F494 CarbonylContact C-O 3.56Å; S424-F494 VanDerWaalsContact CA-O 3.31Å; S424-F494 WeakPolarHBondContact CA-O 3.44Å; S424-F494 PolarHBondContact OG-O 3.32Å; I425-F494 HydrophobicContact CD1-CB 3.78Å; I425-F494 HydrophobicContact CG1-CB 3.64Å; I425-F494 VanDerWaalsContact CG1-O 3.24Å; I425-F494 WeakPolarHBondContact CG1-O 3.34Å; I425-F494 PolarHBondContact N-O 2.91Å; G426-F494 PolarHBondContact O-N 3.1Å; C434-F494 HydrophobicContact CB-CE1 4.12Å; C434-F494 HydrophobicContact CB-CZ 3.84Å; C434-F494 WeakPolarHBondContact SG-CE1 3.32Å; I436-F494 HydrophobicContact CD1-CD1 4.17Å; I436-F494 HydrophobicContact CD1-CE1 4.06Å; Y488-F494 HydrophobicContact CD1-CE1 4.37Å; Y488-F494 HydrophobicContact CG-CE1 4.31Å; Y488-F494 HydrophobicContact CG-CZ 4.4Å; E492-F494 VanDerWaalsContact O-CD2 3.24Å; E492-F494 WeakPolarHBondContact O-CD2 2.98Å; E492-F494 WeakPolarHBondContact O-CE2 3.34Å
495	Y	93.3	Very high	86.9	Confident	34 Å²	34	46.2 Å²	46.2	13%	0.133	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	128.7	-178.7	-57.4	-94.1	0	0	0	110.3	A421 P422 G486 F487 D489 N493	A421-Y495 WeakPolarHBondContact CB-OH 3.39Å; P422-Y495 WeakPolarHBondContact O-CE1 3.27Å; G486-Y495 CarbonylContact C-O 3.55Å; G486-Y495 WeakPolarHBondContact CA-O 3.41Å; F487-Y495 AromaticContact CD2-CD2 3.99Å; F487-Y495 HydrophobicContact CD2-CD2 3.99Å; F487-Y495 HydrophobicContact CE1-CD2 4.29Å; F487-Y495 HydrophobicContact CE1-CG 4.1Å; F487-Y495 AromaticContact CE2-CD2 3.44Å; F487-Y495 HydrophobicContact CE2-CD2 3.44Å; F487-Y495 VanDerWaalsContact CE2-CD2 3.44Å; F487-Y495 AromaticContact CE2-CE2 3.93Å; F487-Y495 HydrophobicContact CE2-CE2 3.93Å; F487-Y495 HydrophobicContact CE2-CG 4.04Å; F487-Y495 HydrophobicContact CZ-CD1 4.42Å; F487-Y495 AromaticContact CZ-CD2 3.61Å; F487-Y495 HydrophobicContact CZ-CD2 3.61Å; F487-Y495 HydrophobicContact CZ-CE2 4.29Å; F487-Y495 AromaticContact CZ-CG 3.69Å; F487-Y495 HydrophobicContact CZ-CG 3.69Å; F487-Y495 PolarHBondContact N-O 3.16Å; F487-Y495 VanDerWaalsContact N-O 3.13Å; F487-Y495 PolarHBondContact O-N 3Å; D489-Y495 HydrophobicContact CB-CE2 3.99Å; D489-Y495 WeakPolarHBondContact OD2-CE2 3.29Å; D489-Y495 PolarHBondContact OD2-OH 3.49Å; N493-Y495 HydrophobicContact CB-CE2 4.08Å; N493-Y495 WeakPolarHBondContact O-CD2 3.39Å; N493-Y495 WeakPolarHBondContact O-CE2 3.46Å
496	I	93.2	Very high	85.1	Confident	36 Å²	36	50.7 Å²	50.7	19%	0.185	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	127.6	172.2	-56.6	178.8	0	0	0	108.7	Y403 I425 I453 D484 M514	Y403-I496 HydrophobicContact CD2-CD1 3.38Å; Y403-I496 HydrophobicContact CE2-CD1 3.34Å; Y403-I496 HydrophobicContact CG-CD1 4Å; I425-I496 HydrophobicContact CD1-CD1 4.08Å; I425-I496 HydrophobicContact CD1-CG1 3.91Å; I425-I496 HydrophobicContact CG1-CG1 4.4Å; I425-I496 HydrophobicContact CG2-CD1 3.93Å; I425-I496 HydrophobicContact CG2-CG1 4.02Å; I453-I496 HydrophobicContact CD1-CG1 3.93Å; D484-I496 HydrophobicContact CB-CG2 4.44Å; I496-M514 HydrophobicContact CG2-CE 3.9Å
497	T	91.7	Very high	83.3	Confident	8 Å²	8	57.1 Å²	57.1	5%	0.049	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	-7.8	-176.4	61.1	0	0	0	0	112.8	I485 F487 Y513 M514	I485-T497 PolarHBondContact O-N 3.03Å; I485-T497 PolarHBondContact O-OG1 3.3Å; I485-T497 VanDerWaalsContact O-OG1 3.12Å; F487-T497 HydrophobicContact CD1-CG2 3.92Å; F487-T497 HydrophobicContact CE1-CG2 3.79Å; T497-Y513 CarbonylContact O-C 3.59Å; T497-Y513 WeakPolarHBondContact O-CA 3.46Å; T497-M514 PolarHBondContact O-N 3.01Å
498	G	91.3	Very high	81.6	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.8	-175.2	-177.8	0	0	0	0	0	113.1	I485 R512	I485-G498 PolarHBondContact N-O 2.87Å; I485-G498 PolarHBondContact O-N 3.35Å; I485-G498 VanDerWaalsContact O-N 3.07Å; G498-R512 CarbonylContact C-O 3.56Å; G498-R512 WeakPolarHBondContact CA-O 3.31Å
499	I	90.5	Very high	80.4	Confident	34 Å²	34	56.7 Å²	56.7	17%	0.174	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	139.8	179.6	54	168.3	0	0	0	110.2	D484 A511 R512	D484-I499 WeakPolarHBondContact OD1-CG2 3.23Å; I499-A511 CarbonylContact O-C 3.24Å; I499-A511 WeakPolarHBondContact O-CA 3.41Å; I499-R512 HydrophobicContact CG1-CB 4.3Å; I499-R512 PolarHBondContact N-O 2.64Å; I499-R512 PolarHBondContact O-N 3.03Å
500	V	88.1	Confident	79.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	142	162.5	177.9	0	0	0	0	108.6	L471 G483 I485 R503 V509 H510	L471-V500 WeakPolarHBondContact CD1-O 3.22Å; L471-V500 HydrophobicContact CD2-CG1 4.22Å; G483-V500 WeakPolarHBondContact O-CB 3.27Å; G483-V500 WeakPolarHBondContact O-CG2 3.48Å; G483-V500 PolarHBondContact O-N 3.3Å; I485-V500 HydrophobicContact CD1-CG2 3.6Å; I485-V500 HydrophobicContact CG1-CG2 4.22Å; V500-R503 HydrophobicContact CG1-CG 4.17Å; V500-V509 HydrophobicContact CB-CG1 4.17Å; V500-V509 HydrophobicContact CG1-CG1 3.53Å; V500-V509 HydrophobicContact CG2-CG1 3.64Å; V500-H510 CarbonylContact C-O 3.48Å
501	R	82.8	Confident	79	Confident	96 Å²	96	49.2 Å²	49.2	36%	0.362	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	-36.4	-177.9	-77.6	-75.3	170.6	-178	-10.1	112.9	H510 R512	R501-H510 HydrophobicContact CB-CB 4.44Å; R501-H510 PolarHBondContact N-O 3.11Å; R501-R512 HydrophobicContact CG-CB 3.9Å; R501-R512 VanDerWaalsContact NE-CZ 3.3Å
502	S	79.1	Confident	78.7	Confident	48 Å²	48	46.7 Å²	46.7	34%	0.336	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	153.8	175.5	56.2	0	0	0	0	109.6	H510	S502-H510 PolarHBondContact O-N 2.77Å; S502-H510 VanDerWaalsContact O-N 3.08Å; S502-H510 WeakPolarHBondContact OG-CB 3.39Å; S502-H510 PolarHBondContact OG-CD2 3.23Å
503	R	77.2	Confident	78.1	Confident	56 Å²	56	44.8 Å²	44.8	21%	0.211	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	115.1	168.3	-60.3	-174.2	-171.8	-99.4	2.4	106.8	E452 L471 V500 Q508	E452-R503 IonicContact OE1-CZ 3.91Å; E452-R503 IonicContact OE1-NH1 3.81Å; E452-R503 IonicContact OE1-NH2 3.91Å; E452-R503 PolarHBondContact OE1-NH2 2.84Å; E452-R503 IonicContact OE2-CZ 3.12Å; E452-R503 IonicContact OE2-NH1 3.62Å; E452-R503 PolarHBondContact OE2-NH1 3.08Å; E452-R503 IonicContact OE2-NH2 2.79Å; E452-R503 PolarHBondContact OE2-NH2 3.37Å; E452-R503 VanDerWaalsContact OE2-NH2 3.14Å; L471-R503 PolarHBondContact O-NE 2.87Å; L471-R503 PolarHBondContact O-NH2 3.2Å; V500-R503 HydrophobicContact CG1-CG 4.17Å; R503-Q508 CarbonylContact C-O 3.54Å; R503-Q508 WeakPolarHBondContact CA-O 3.26Å
504	G	66.1	Low	76.9	Confident	35 Å²	35	47.4 Å²	47.4	36%	0.361	25%	0.249	S	C	.	.			trans	-74.8	163.1	174.8	0	0	0	0	0	111.5	D506 Q507 Q508	G504-D506 PolarHBondContact O-N 3.01Å; G504-D506 VanDerWaalsContact O-N 3.12Å; G504-Q507 WeakPolarHBondContact O-CA 3.45Å; G504-Q507 PolarHBondContact O-N 3.35Å; G504-Q508 PolarHBondContact N-O 3.24Å
505	A	57.9	Low	74.6	Confident	110 Å²	110	50.7 Å²	50.7	91%	0.909	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-30.4	177.5	0	0	0	0	0	113.2	Q507	A505-Q507 PolarHBondContact O-N 3.29Å
506	D	56.6	Low	72.1	Confident	93 Å²	93	51.8 Å²	51.8	50%	0.497	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	21.5	176.1	-55.3	-25.6	0	0	0	113.2	G504 Q508 P543	G504-D506 PolarHBondContact O-N 3.01Å; G504-D506 VanDerWaalsContact O-N 3.12Å; D506-Q508 HydrophobicContact CB-CG 4.44Å; D506-Q508 PolarHBondContact O-N 2.72Å; D506-Q508 VanDerWaalsContact O-N 3.11Å; D506-P543 HydrophobicContact CB-CG 4.2Å
507	Q	56.9	Low	69.1	Low	135 Å²	135	59 Å²	59	63%	0.631	33%	0.326	S	S	*	.			trans	57.7	17.4	-169.7	-57.3	-175.5	-19.3	0	0	114.4	G504 A505 V509 V541	G504-Q507 WeakPolarHBondContact O-CA 3.45Å; G504-Q507 PolarHBondContact O-N 3.35Å; A505-Q507 PolarHBondContact O-N 3.29Å; Q507-V509 WeakPolarHBondContact O-CG2 3.43Å; Q507-V509 PolarHBondContact O-N 2.86Å; Q507-V509 VanDerWaalsContact O-N 3.16Å; Q507-V541 HydrophobicContact CB-CG1 4.3Å; Q507-V541 WeakPolarHBondContact O-CB 3.49Å; Q507-V541 WeakPolarHBondContact O-CG2 3.26Å
508	Q	57.5	Low	66.2	Low	36 Å²	36	62.1 Å²	62.1	17%	0.168	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-61.3	119.7	173.3	-75.4	-175.1	25.3	0	0	110.2	R503 G504 D506 R540	R503-Q508 CarbonylContact C-O 3.54Å; R503-Q508 WeakPolarHBondContact CA-O 3.26Å; G504-Q508 PolarHBondContact N-O 3.24Å; D506-Q508 HydrophobicContact CB-CG 4.44Å; D506-Q508 PolarHBondContact O-N 2.72Å; D506-Q508 VanDerWaalsContact O-N 3.11Å; Q508-R540 VanDerWaalsContact CD-CG 3.41Å; Q508-R540 HydrophobicContact CG-CG 4.02Å
509	V	69.3	Low	63.3	Low	8 Å²	8	67.3 Å²	67.3	5%	0.048	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	118.9	-179	-172.3	0	0	0	0	109.4	L439 V500 Q507 V541	L439-V509 HydrophobicContact CD1-CG1 4.27Å; L439-V509 HydrophobicContact CD2-CB 4.31Å; L439-V509 HydrophobicContact CD2-CG1 4.01Å; L439-V509 HydrophobicContact CD2-CG2 4.4Å; V500-V509 HydrophobicContact CB-CG1 4.17Å; V500-V509 HydrophobicContact CG1-CG1 3.53Å; V500-V509 HydrophobicContact CG2-CG1 3.64Å; Q507-V509 WeakPolarHBondContact O-CG2 3.43Å; Q507-V509 PolarHBondContact O-N 2.86Å; Q507-V509 VanDerWaalsContact O-N 3.16Å; V509-V541 HydrophobicContact CG2-CG2 4.48Å
510	H	73.2	Confident	60.5	Low	52 Å²	52	72.8 Å²	72.8	24%	0.241	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	129.9	168.9	-63.9	-97.7	0	0	0	109.2	V500 R501 S502 T538	V500-H510 CarbonylContact C-O 3.48Å; R501-H510 HydrophobicContact CB-CB 4.44Å; R501-H510 PolarHBondContact N-O 3.11Å; S502-H510 PolarHBondContact O-N 2.77Å; S502-H510 VanDerWaalsContact O-N 3.08Å; S502-H510 WeakPolarHBondContact OG-CB 3.39Å; S502-H510 PolarHBondContact OG-CD2 3.23Å; H510-T538 WeakPolarHBondContact CE1-CG2 3.44Å; H510-T538 PolarHBondContact CE1-OG1 3.44Å; H510-T538 VanDerWaalsContact CE1-OG1 3.27Å; H510-T538 WeakPolarHBondContact ND1-CB 3.06Å; H510-T538 WeakPolarHBondContact ND1-CG2 3.35Å; H510-T538 PolarHBondContact ND1-OG1 2.92Å
511	A	74	Confident	57.5	Low	2 Å²	2	76.9 Å²	76.9	2%	0.017	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146	-179.7	0	0	0	0	0	111.4	L439 I485 I499 Y513 V537	L439-A511 HydrophobicContact CD1-CB 4.39Å; I485-A511 HydrophobicContact CG1-CB 4.08Å; I499-A511 CarbonylContact O-C 3.24Å; I499-A511 WeakPolarHBondContact O-CA 3.41Å; A511-Y513 HydrophobicContact CB-CE2 4.09Å; A511-V537 PolarHBondContact N-O 2.8Å; A511-V537 PolarHBondContact O-N 3.38Å
512	R	77.9	Confident	54.9	Low	79 Å²	79	84.1 Å²	84.1	30%	0.298	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.2	168.2	-177.9	-179.5	-62.5	172.9	7.1	108.4	G498 I499 R501 N536	G498-R512 CarbonylContact C-O 3.56Å; G498-R512 WeakPolarHBondContact CA-O 3.31Å; I499-R512 HydrophobicContact CG1-CB 4.3Å; I499-R512 PolarHBondContact N-O 2.64Å; I499-R512 PolarHBondContact O-N 3.03Å; R501-R512 HydrophobicContact CG-CB 3.9Å; R501-R512 VanDerWaalsContact NE-CZ 3.3Å; R512-N536 PolarHBondContact NE-OD1 3.3Å; R512-N536 VanDerWaalsContact NE-OD1 3.11Å
513	Y	78	Confident	52.3	Low	53 Å²	53	91.3 Å²	91.3	21%	0.208	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	136.7	176.3	-63.1	-90.2	0	0	0	110.2	M450 I485 T497 A511 V537	M450-Y513 HydrophobicContact CE-CE1 4.24Å; M450-Y513 HydrophobicContact SD-CD1 4.47Å; M450-Y513 HydrophobicContact SD-CE1 3.99Å; I485-Y513 HydrophobicContact CG2-CD1 4.47Å; I485-Y513 HydrophobicContact CG2-CE1 3.75Å; T497-Y513 CarbonylContact O-C 3.59Å; T497-Y513 WeakPolarHBondContact O-CA 3.46Å; A511-Y513 HydrophobicContact CB-CE2 4.09Å; Y513-V537 HydrophobicContact CD2-CB 4.44Å; Y513-V537 HydrophobicContact CD2-CG2 4.09Å; Y513-V537 HydrophobicContact CE2-CB 4.03Å; Y513-V537 HydrophobicContact CE2-CG2 4.07Å
514	M	67.3	Low	50	Low	80 Å²	80	100.3 Å²	100.3	39%	0.394	52%	0.523	S	S	.	.			trans	-66.2	140.3	162.8	-54.4	-147.5	-135.7	0	0	107.2	P381 I496 T497 T516	P381-M514 HydrophobicContact CG-CE 4.27Å; I496-M514 HydrophobicContact CG2-CE 3.9Å; T497-M514 PolarHBondContact O-N 3.01Å; M514-T516 VanDerWaalsContact C-N 3.34Å; M514-T516 PolarHBondContact O-N 2.86Å
515	G	45.3	Very low	48.1	Very low	69 Å²	69	108.6 Å²	108.6	71%	0.711	55%	0.549	S	S	*	.	S	Bend	trans	-65	92.5	-174.7	0	0	0	0	0	110.9
516	T	40.5	Very low	46.7	Very low	57 Å²	57	106.8 Å²	106.8	35%	0.35	54%	0.541	S	S	.	.			trans	-127	114.7	170.7	53.4	0	0	0	0	108.4	M514 T518	M514-T516 VanDerWaalsContact C-N 3.34Å; M514-T516 PolarHBondContact O-N 2.86Å; T516-T518 PolarHBondContact O-N 3.37Å
517	E	29.4	Very low	45.2	Very low	188 Å²	188	110.4 Å²	110.4	88%	0.879	56%	0.56	S	S	*	*			trans	-60.2	121.7	155.1	-68.6	-173.6	160.6	0	0	106.5
518	T	30.6	Very low	43.9	Very low	74 Å²	74	111 Å²	111	45%	0.454	57%	0.568	S	S	.	*			trans	-57.7	129.2	179.1	28.2	0	0	0	0	110.2	T516 L520 S521	T516-T518 PolarHBondContact O-N 3.37Å; T518-L520 PolarHBondContact O-N 3.28Å; T518-S521 PolarHBondContact O-N 3.41Å
519	P	30.5	Very low	42.4	Very low	109 Å²	109	116.9 Å²	116.9	71%	0.708	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-63.1	-14.6	179.1	-21	31.5	0	0	0	114.1	S521	P519-S521 VanDerWaalsContact C-N 3.28Å; P519-S521 PolarHBondContact O-N 3.25Å
520	L	31.7	Very low	40.6	Very low	149 Å²	149	123.9 Å²	123.9	78%	0.78	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-81.5	5.5	-174.6	-73.6	160.4	0	0	0	114.8	T518	T518-L520 PolarHBondContact O-N 3.28Å
521	S	26.8	Very low	38.5	Very low	86 Å²	86	128.8 Å²	128.8	60%	0.601	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-134.5	47.9	-179.8	70.5	0	0	0	0	115	T518 P519 K523	T518-S521 PolarHBondContact O-N 3.41Å; P519-S521 VanDerWaalsContact C-N 3.28Å; P519-S521 PolarHBondContact O-N 3.25Å; S521-K523 PolarHBondContact O-N 3.32Å
522	R	26.4	Very low	36.5	Very low	248 Å²	248	132.2 Å²	132.2	94%	0.936	70%	0.701	S	S	*	*			trans	-74.4	73.8	161.5	-88.6	-175.9	174.5	155.5	-0.7	111.1
523	K	26	Very low	34.2	Very low	199 Å²	199	137.4 Å²	137.4	87%	0.865	73%	0.726	S	S	*	*			trans	-80	113.4	145.5	-90.1	-174.8	176.1	177.5	0	106.8	S521 K525	S521-K523 PolarHBondContact O-N 3.32Å; K523-K525 PolarHBondContact O-N 3Å
524	R	27.2	Very low	32.2	Very low	244 Å²	244	142.7 Å²	142.7	92%	0.921	75%	0.75	S	S	*	*			trans	-41.3	120.7	171.8	-81.1	176.4	163.7	170.1	-5	110.7
525	K	28	Very low	30.7	Very low	209 Å²	209	148.4 Å²	148.4	91%	0.909	77%	0.767	S	S	*	*			trans	-171.6	127	145.2	-107.7	170.9	-173.6	-172.1	0	112.6	K523	K523-K525 PolarHBondContact O-N 3Å
526	G	27.3	Very low	30.2	Very low	73 Å²	73	150.6 Å²	150.6	75%	0.753	76%	0.762	S	S	*	*			trans	81	106.8	134.3	0	0	0	0	0	117.8	N528	G526-N528 PolarHBondContact O-N 3.44Å
527	N	25.8	Very low	30.2	Very low	168 Å²	168	150.9 Å²	150.9	90%	0.898	76%	0.764	S	S	*	*			trans	-40.3	114	163.8	-151.4	16	0	0	0	111.9
528	N	29.4	Very low	30.3	Very low	147 Å²	147	146.6 Å²	146.6	79%	0.786	75%	0.751	S	S	*	*			trans	-157.5	121.1	157.6	-117.7	-6.7	0	0	0	112	G526 N530	G526-N528 PolarHBondContact O-N 3.44Å; N528-N530 PolarHBondContact O-N 3.46Å
529	N	26.3	Very low	30.6	Very low	161 Å²	161	144.9 Å²	144.9	86%	0.861	74%	0.74	S	S	*	*			trans	-48.5	118.8	164.7	-87.2	-19.8	0	0	0	110.1
530	N	31.4	Very low	30.4	Very low	154 Å²	154	148.4 Å²	148.4	82%	0.824	74%	0.739	S	S	*	*			trans	-137	109.8	165.9	-109	-20.5	0	0	0	110.9	N528 G532	N528-N530 PolarHBondContact O-N 3.46Å; N530-G532 PolarHBondContact O-N 3.34Å
531	N	28.4	Very low	30.5	Very low	156 Å²	156	141.9 Å²	141.9	83%	0.834	71%	0.706	S	S	*	*			trans	-48	122.4	161.8	-83	-22.3	0	0	0	109.6	K533	N531-K533 PolarHBondContact O-N 2.9Å
532	G	32	Very low	30.3	Very low	73 Å²	73	142.8 Å²	142.8	75%	0.753	71%	0.707	S	S	*	*			trans	-59.6	89.7	-179.3	0	0	0	0	0	112.7	N530 K534	N530-G532 PolarHBondContact O-N 3.34Å; G532-K534 PolarHBondContact O-N 3.01Å
533	K	29.5	Very low	30.3	Very low	189 Å²	189	133.7 Å²	133.7	82%	0.822	68%	0.68	S	S	*	*			trans	-73.7	109.5	169.7	-83.3	-177.1	175.8	176.9	0	109.3	N531 R535	N531-K533 PolarHBondContact O-N 2.9Å; K533-R535 PolarHBondContact O-N 3.01Å
534	K	36.4	Very low	30.5	Very low	164 Å²	164	133.2 Å²	133.2	71%	0.713	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-55.3	118.7	168.3	-63.9	176.5	-178.7	175.8	0	109	G532	G532-K534 PolarHBondContact O-N 3.01Å
535	R	35.5	Very low	30.5	Very low	200 Å²	200	128.7 Å²	128.7	76%	0.755	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-96.5	127.3	177.4	-73.9	-178.8	175.4	166.9	-0.8	110	K533	K533-R535 PolarHBondContact O-N 3.01Å
536	N	35.7	Very low	30.5	Very low	114 Å²	114	126.1 Å²	126.1	61%	0.61	66%	0.662	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-88	129.2	166.8	-67	-34.1	0	0	0	107.9	R512	R512-N536 PolarHBondContact NE-OD1 3.3Å; R512-N536 VanDerWaalsContact NE-OD1 3.11Å
537	V	39.1	Very low	30.6	Very low	63 Å²	63	127.8 Å²	127.8	38%	0.382	65%	0.653	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.1	125.4	177.4	-177.4	0	0	0	0	108.5	A511 Y513 V539	A511-V537 PolarHBondContact N-O 2.8Å; A511-V537 PolarHBondContact O-N 3.38Å; Y513-V537 HydrophobicContact CD2-CB 4.44Å; Y513-V537 HydrophobicContact CD2-CG2 4.09Å; Y513-V537 HydrophobicContact CE2-CB 4.03Å; Y513-V537 HydrophobicContact CE2-CG2 4.07Å; V537-V539 HydrophobicContact CG1-CG2 4.07Å
538	T	32.2	Very low	30.7	Very low	98 Å²	98	128.7 Å²	128.7	60%	0.601	65%	0.652	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.6	121	173.2	-67.7	0	0	0	0	108.6	H510	H510-T538 WeakPolarHBondContact CE1-CG2 3.44Å; H510-T538 PolarHBondContact CE1-OG1 3.44Å; H510-T538 VanDerWaalsContact CE1-OG1 3.27Å; H510-T538 WeakPolarHBondContact ND1-CB 3.06Å; H510-T538 WeakPolarHBondContact ND1-CG2 3.35Å; H510-T538 PolarHBondContact ND1-OG1 2.92Å
539	V	37.3	Very low	30.5	Very low	39 Å²	39	126.2 Å²	126.2	24%	0.236	65%	0.646	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.9	120.5	176.3	-175.8	0	0	0	0	108.9	V537	V537-V539 HydrophobicContact CG1-CG2 4.07Å
540	R	26.4	Very low	30.7	Very low	183 Å²	183	127.5 Å²	127.5	69%	0.691	65%	0.647	S	S	*	*			trans	-82.2	117.5	176.9	-133.6	178.2	-174	179.5	1.2	108.9	H440 Q508	H440-R540 PolarHBondContact CE1-O 3.12Å; H440-R540 PolarHBondContact ND1-O 3.26Å; Q508-R540 VanDerWaalsContact CD-CG 3.41Å; Q508-R540 HydrophobicContact CG-CG 4.02Å
541	V	32.6	Very low	30.6	Very low	12 Å²	12	127.4 Å²	127.4	7%	0.073	65%	0.646	C	S	.	*			trans	-93.1	126.9	171.8	-174.7	0	0	0	0	106.8	L439 Q507 V509	L439-V541 WeakPolarHBondContact O-CG2 3.49Å; Q507-V541 HydrophobicContact CB-CG1 4.3Å; Q507-V541 WeakPolarHBondContact O-CB 3.49Å; Q507-V541 WeakPolarHBondContact O-CG2 3.26Å; V509-V541 HydrophobicContact CG2-CG2 4.48Å
542	V	24	Very low	30.5	Very low	105 Å²	105	129 Å²	129	64%	0.636	65%	0.649	S	S	*	*			trans	-100.5	113.7	177.6	-175.5	0	0	0	0	107	R544	V542-R544 PolarHBondContact O-N 3.01Å
543	P	26.8	Very low	30.4	Very low	56 Å²	56	134.1 Å²	134.1	36%	0.364	65%	0.653	S	S	.	*			trans	-61.7	132.1	176.6	-19.7	31	0	0	0	110.1	D506 L545	D506-P543 HydrophobicContact CB-CG 4.2Å; P543-L545 PolarHBondContact O-N 3.37Å
544	R	30	Very low	30.3	Very low	190 Å²	190	134 Å²	134	72%	0.717	66%	0.655	S	S	*	*			trans	-76.7	70	173.4	-150.8	177.8	-166.5	-166.7	1.2	109.4	V542 L546 L547	V542-R544 PolarHBondContact O-N 3.01Å; R544-L546 PolarHBondContact O-N 3.2Å; R544-L547 HydrophobicContact CG-CD1 4.41Å
545	L	26.3	Very low	29.9	Very low	148 Å²	148	133.5 Å²	133.5	78%	0.775	66%	0.66	S	S	*	*			trans	-86.9	22.1	172.2	-107	158.5	0	0	0	112.5	P543	P543-L545 PolarHBondContact O-N 3.37Å
546	L	28	Very low	29.5	Very low	156 Å²	156	130.6 Å²	130.6	82%	0.817	66%	0.659	S	S	*	*			trans	-127.8	47.4	179.3	-74	170.4	0	0	0	112.6	R544	R544-L546 PolarHBondContact O-N 3.2Å
547	L	30.6	Very low	29.1	Very low	107 Å²	107	134.9 Å²	134.9	56%	0.56	67%	0.673	S	S	*	*			trans	-128	26.8	164	-77.5	175.5	0	0	0	112.3	R544	R544-L547 HydrophobicContact CG-CD1 4.41Å
548	Q	26.2	Very low	28.6	Very low	187 Å²	187	136.6 Å²	136.6	87%	0.874	69%	0.688	S	S	*	*	S	Bend	trans	-106.9	67.6	162.4	-74.4	-173.1	-20	0	0	108.8
549	S	26.8	Very low	28.4	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	70%	0.701	S	S	*	*			trans	179.3	71.9	160.1	59.8	0	0	0	0	109.5
550	E	29	Very low	28.1	Very low	187 Å²	187	143.4 Å²	143.4	87%	0.874	73%	0.728	S	S	*	*			trans	-135.2	76.1	150.6	-77.7	-169.8	172.6	0	0	105.9
551	D	29.4	Very low	28.4	Very low	153 Å²	153	140.8 Å²	140.8	82%	0.818	73%	0.732	S	S	*	*			trans	-63.2	133.7	150.8	-76.9	-39.2	0	0	0	107.9	Q553	D551-Q553 PolarHBondContact O-N 3.27Å
552	E	27.2	Very low	28.2	Very low	188 Å²	188	145.4 Å²	145.4	88%	0.879	77%	0.765	S	S	*	*			trans	9.6	95.2	151.8	-63	179.9	156.8	0	0	116.9
553	Q	29.7	Very low	28.5	Very low	182 Å²	182	145.5 Å²	145.5	85%	0.85	77%	0.771	S	S	*	*			trans	-135	110.1	140.7	-75.3	-165.2	-19.5	0	0	109.8	D551 L555	D551-Q553 PolarHBondContact O-N 3.27Å; Q553-L555 PolarHBondContact O-N 3.14Å; Q553-L555 VanDerWaalsContact O-N 3.14Å
554	Q	26.3	Very low	28.9	Very low	185 Å²	185	152.1 Å²	152.1	86%	0.864	82%	0.818	S	S	*	*			trans	-49.1	112.8	160.2	-72.7	172.8	-36	0	0	108.9
555	L	28.4	Very low	28.8	Very low	155 Å²	155	150.2 Å²	150.2	81%	0.812	82%	0.823	S	S	*	*			trans	-91.7	95.5	157.2	-88	157.3	0	0	0	106.7	Q553 F557	Q553-L555 PolarHBondContact O-N 3.14Å; Q553-L555 VanDerWaalsContact O-N 3.14Å; L555-F557 PolarHBondContact O-N 3.36Å
556	D	26.9	Very low	29	Very low	138 Å²	138	150.3 Å²	150.3	74%	0.738	83%	0.826	S	S	*	*			trans	-53	111.5	161.7	-91.7	-30.7	0	0	0	109.2	S558	D556-S558 VanDerWaalsContact C-N 3.26Å; D556-S558 PolarHBondContact O-N 3.14Å; D556-S558 VanDerWaalsContact O-N 3.14Å
557	F	27.1	Very low	29	Very low	205 Å²	205	150 Å²	150	90%	0.899	83%	0.826	S	S	*	*			trans	-77.2	86.5	156.5	-81.4	-89.9	0	0	0	107.2	L555	L555-F557 PolarHBondContact O-N 3.36Å
558	S	30.2	Very low	28.9	Very low	99 Å²	99	152.5 Å²	152.5	69%	0.692	84%	0.842	S	S	*	*			trans	-84.7	110.9	163.1	45.3	0	0	0	0	108.9	D556 S560	D556-S558 VanDerWaalsContact C-N 3.26Å; D556-S558 PolarHBondContact O-N 3.14Å; D556-S558 VanDerWaalsContact O-N 3.14Å; S558-S560 PolarHBondContact O-N 3.18Å
559	D	28.2	Very low	29.1	Very low	164 Å²	164	150.4 Å²	150.4	88%	0.877	84%	0.84	S	S	*	*			trans	-52.3	123.8	161.2	-78.6	-39	0	0	0	109.6
560	S	30.6	Very low	29.2	Very low	115 Å²	115	154 Å²	154	80%	0.804	85%	0.851	S	S	*	*			trans	-134.3	91.1	162.8	52	0	0	0	0	109.9	S558	S558-S560 PolarHBondContact O-N 3.18Å
561	T	32.5	Very low	29.3	Very low	128 Å²	128	151.6 Å²	151.6	79%	0.785	85%	0.85	S	S	*	*			trans	-108.9	116.8	153.4	44.8	0	0	0	0	108.9
562	S	28.5	Very low	29.3	Very low	109 Å²	109	151.5 Å²	151.5	76%	0.762	85%	0.852	S	S	*	*			trans	55.4	116.4	150.6	65.1	0	0	0	0	120.1
563	S	30.7	Very low	29.4	Very low	107 Å²	107	148.5 Å²	148.5	75%	0.748	85%	0.85	S	S	*	*				160.1	144.4	95.4	62.4	0	0	0	0	112
564	S	34.2	Very low	29.4	Very low	195 Å²	195	145.5 Å²	145.5	100%	1.364	85%	0.85	S	S	*	*			trans	66.6	0	167	69.7	0	0	0	0	119.3

Retrieved 564 of 564 residues in 106 ms (Link to these results)

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