A0A096NJM9_PAPAN Loading...

Phosphatidylserine decarboxylase proenzyme, mitochondrial

Catalyzes the formation of phosphatidylethanolamine (PtdEtn) from phosphatidylserine (PtdSer). Plays a central role in phospholipid metabolism and in the interorganelle trafficking of phosphatidylserine. May be involved in lipid droplet biogenesis at the endoplasmic reticulum membrane.

AlphaFold DB , UniProt , Accession A0A096NJM9, Species PAPAN (Papio anubis, Olive baboon), Gene PISD, Length 409 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	32.9	Very low	29.9	Very low	250 Å²	250	156.1 Å²	156.1	100%	1.232	81%	0.808	S	S	*	*				0	145.9	0	-50.9	172.9	-165.6	0	0	106.9
2	A	29.4	Very low	29.8	Very low	89 Å²	89	154.8 Å²	154.8	74%	0.736	80%	0.802	S	S	*	*			cis	-177.1	120.6	-21.3	0	0	0	0	0	103.4
3	T	31.5	Very low	29.8	Very low	145 Å²	145	152.7 Å²	152.7	89%	0.89	79%	0.792	S	S	*	*			trans	-8.9	135.1	164.7	50	0	0	0	0	119.4
4	S	29.9	Very low	29.6	Very low	110 Å²	110	154.6 Å²	154.6	77%	0.769	80%	0.795	S	S	*	*			trans	-150.7	121.5	155.5	-164.8	0	0	0	0	114.2
5	V	32	Very low	29.3	Very low	111 Å²	111	148.8 Å²	148.8	67%	0.673	79%	0.788	S	S	*	*			trans	28.3	126.1	136.1	-170.2	0	0	0	0	118.5
6	V	30	Very low	29.1	Very low	139 Å²	139	148.7 Å²	148.7	84%	0.842	79%	0.794	S	S	*	*			cis	79	66.5	26.5	-163.2	0	0	0	0	116.3
7	H	31	Very low	29	Very low	146 Å²	146	144.9 Å²	144.9	68%	0.676	79%	0.788	S	S	*	*			trans	-155.7	150.1	164.3	-102.1	25.5	0	0	0	106.5
8	R	29	Very low	30	Very low	178 Å²	178	142.9 Å²	142.9	67%	0.672	78%	0.784	S	S	*	*			cis	-149.9	-175.5	-0.3	-114.4	173.7	-159.8	176.1	14.6	106.7
9	F	27.7	Very low	29.7	Very low	174 Å²	174	147.3 Å²	147.3	76%	0.763	79%	0.788	S	S	*	*			cis	-151.7	-174.6	9.5	-133.2	-31.2	0	0	0	109.5
10	L	26.8	Very low	29.6	Very low	151 Å²	151	150.5 Å²	150.5	79%	0.791	79%	0.788	S	S	*	*			trans	-160.4	144.4	176.6	-150.8	169.1	0	0	0	108.8
11	R	29.2	Very low	29.6	Very low	224 Å²	224	149.1 Å²	149.1	85%	0.845	79%	0.791	S	S	*	*			trans	116.8	144.3	-179.5	-72.9	172.8	-176.9	-140.9	-0.6	111.8
12	L	28.9	Very low	29.4	Very low	140 Å²	140	142.2 Å²	142.2	73%	0.733	77%	0.767	S	S	*	*			cis	-157.4	180	-6.4	-94.2	158.5	0	0	0	106.7
13	L	28.9	Very low	29.5	Very low	128 Å²	128	144 Å²	144	67%	0.67	76%	0.764	S	S	*	*			cis	-141.7	-91.8	8.5	-142.5	170.4	0	0	0	113.9
14	H	27.4	Very low	29.3	Very low	180 Å²	180	146.4 Å²	146.4	83%	0.833	77%	0.765	S	S	*	*			trans	-155.7	164.6	-161	-81	-3.5	0	0	0	115
15	G	24.5	Very low	29.3	Very low	67 Å²	67	147.1 Å²	147.1	69%	0.691	76%	0.756	S	S	*	*			trans	171.5	78.8	164.7	0	0	0	0	0	110.1
16	V	27.5	Very low	29.1	Very low	147 Å²	147	153.5 Å²	153.5	89%	0.891	77%	0.768	S	S	*	*				68.8	129.7	98.9	179.9	0	0	0	0	114.1
17	A	25.8	Very low	29.1	Very low	84 Å²	84	153.6 Å²	153.6	69%	0.694	76%	0.759	S	S	*	*			trans	-113.5	-154.6	-176.8	0	0	0	0	0	109.8
18	P	47.5	Very low	29.1	Very low	109 Å²	109	155 Å²	155	71%	0.708	77%	0.769	S	S	*	*			cis	-138.1	-152.8	-9.1	24	4.8	0	0	0	113.4
19	W	25	Very low	29.1	Very low	226 Å²	226	151.8 Å²	151.8	86%	0.856	77%	0.77	S	S	*	*			trans	85.5	159.6	166.2	-72.9	54.1	0	0	0	120.1
20	R	27.8	Very low	29.2	Very low	212 Å²	212	147.5 Å²	147.5	80%	0.8	77%	0.767	S	S	*	*			cis	-178.8	122.4	-41.2	-163.7	177.8	-159.9	-128.9	5	111.1
21	S	28.3	Very low	29.3	Very low	121 Å²	121	148.3 Å²	148.3	85%	0.846	77%	0.771	S	S	*	*			trans	167.8	161.5	158.5	47.3	0	0	0	0	111.6
22	S	29	Very low	29.2	Very low	105 Å²	105	141.8 Å²	141.8	73%	0.734	76%	0.76	S	S	*	*			cis	-156.9	141.1	-36.4	-168.3	0	0	0	0	111.3
23	L	31.8	Very low	29.2	Very low	126 Å²	126	143.6 Å²	143.6	66%	0.66	76%	0.764	S	S	*	*			trans	5.5	136	157.5	-63.9	162.7	0	0	0	121
24	H	28	Very low	29.1	Very low	196 Å²	196	141.8 Å²	141.8	91%	0.907	76%	0.762	S	S	*	*				-128.6	138.2	112.1	-129.4	65.2	0	0	0	111.8
25	H	29.1	Very low	29.1	Very low	126 Å²	126	140.9 Å²	140.9	58%	0.583	76%	0.763	S	S	*	*			trans	-114.8	147.3	-175.7	-128.5	-38.7	0	0	0	108.6
26	R	27.5	Very low	29.4	Very low	245 Å²	245	146.1 Å²	146.1	93%	0.925	77%	0.769	S	S	*	*			trans	-148.1	138.8	134	-115.8	176.1	-176.3	-170.4	-0.4	109.8
27	E	31	Very low	30.4	Very low	141 Å²	141	144.1 Å²	144.1	66%	0.659	76%	0.759	S	S	*	*			trans	-80.7	177.5	176.2	-58.7	153.1	115.6	0	0	108.6
28	I	30.7	Very low	30.5	Very low	175 Å²	175	148 Å²	148	90%	0.897	77%	0.768	S	S	*	*				-138.2	140.7	75.1	-82.7	162.1	0	0	0	111.7
29	T	29.2	Very low	29.6	Very low	110 Å²	110	154.3 Å²	154.3	68%	0.675	78%	0.778	S	S	*	*			trans	-81.5	168.5	-179.5	-52.2	0	0	0	0	112.4
30	A	28.9	Very low	29.9	Very low	85 Å²	85	153.8 Å²	153.8	70%	0.702	78%	0.781	S	S	*	*			trans	99.4	138.3	161.2	0	0	0	0	0	116.4
31	L	28.6	Very low	30.1	Very low	168 Å²	168	151.6 Å²	151.6	88%	0.88	78%	0.784	S	S	*	*			cis	-142.8	154.5	-3.5	-124.1	161.7	0	0	0	109.9
32	S	26.9	Very low	30.8	Very low	87 Å²	87	151.1 Å²	151.1	61%	0.608	78%	0.779	S	S	*	*			trans	-106.8	-177.1	-174.1	58.2	0	0	0	0	112.2
33	Q	29.1	Very low	30.8	Very low	177 Å²	177	155.4 Å²	155.4	83%	0.827	79%	0.785	S	S	*	*			trans	84.2	140.2	168.7	-58.6	177.1	25.3	0	0	116.5
34	S	26.7	Very low	30.6	Very low	90 Å²	90	160.5 Å²	160.5	63%	0.629	80%	0.795	S	S	*	*			cis	-164.6	171.4	-12.7	55.4	0	0	0	0	113.6
35	L	28.5	Very low	30.8	Very low	162 Å²	162	155.2 Å²	155.2	85%	0.848	79%	0.785	S	S	*	*			trans	67.6	115	153.4	-70.2	160	0	0	0	120.6
36	Q	30.3	Very low	30.8	Very low	176 Å²	176	158.6 Å²	158.6	82%	0.822	80%	0.798	S	S	*	*			trans	-84	-172	144.2	-53.1	-174.3	-25.6	0	0	109.1
37	P	48.7	Very low	31	Very low	105 Å²	105	157.3 Å²	157.3	68%	0.682	79%	0.794	S	S	*	*			cis	-130.7	-179.8	-11.7	40	-24.2	0	0	0	113.7
38	L	27.6	Very low	31.1	Very low	167 Å²	167	156.3 Å²	156.3	87%	0.874	80%	0.797	S	S	*	*				-179.6	149.5	128.5	-100.7	158.7	0	0	0	113.6
39	W	29.7	Very low	31.1	Very low	241 Å²	241	155.8 Å²	155.8	91%	0.913	80%	0.796	S	S	*	*			trans	-98.5	136.9	162.4	-79	1.8	0	0	0	110.1
40	K	30.5	Very low	31.5	Very low	214 Å²	214	154.5 Å²	154.5	93%	0.93	80%	0.797	S	S	*	*				-179.7	149.9	129.2	-97.3	155.7	-173.9	178.8	0	113.1
41	L	31.6	Very low	31.9	Very low	166 Å²	166	161.7 Å²	161.7	87%	0.869	81%	0.806	S	S	*	*			trans	-78.7	161.5	172.7	-80.5	163.7	0	0	0	110.3
42	P	42.9	Very low	32.5	Very low	112 Å²	112	163.6 Å²	163.6	73%	0.727	81%	0.807	S	S	*	*				-153.2	163.8	64	38.2	-15.4	0	0	0	120.8
43	F	29.1	Very low	33	Very low	195 Å²	195	165.5 Å²	165.5	86%	0.855	82%	0.815	S	S	*	*			trans	25.8	127.3	148.1	-75.4	-88	0	0	0	122
44	R	28.6	Very low	33.3	Very low	232 Å²	232	165.7 Å²	165.7	88%	0.875	82%	0.815	S	S	*	*				-144.6	129.9	126.5	-153.3	172.3	-167.7	171.6	4.5	110.8
45	A	31.6	Very low	33.9	Very low	85 Å²	85	167.9 Å²	167.9	70%	0.702	83%	0.825	S	S	*	*			trans	-95.1	147.4	173.4	0	0	0	0	0	110.5
46	F	30.1	Very low	34.4	Very low	197 Å²	197	164.2 Å²	164.2	86%	0.864	82%	0.818	S	S	*	*			trans	-131.1	149.9	159	-110.2	-89.9	0	0	0	109.5
47	R	30.2	Very low	35	Very low	219 Å²	219	161.9 Å²	161.9	83%	0.826	82%	0.818	S	S	*	*			trans	-123	133.2	-159.2	-173.1	-173.2	177.2	-174.4	0.3	110.4
48	T	33.2	Very low	34.9	Very low	119 Å²	119	162 Å²	162	73%	0.73	83%	0.828	S	S	*	*			trans	46.9	123.1	161.8	52.4	0	0	0	0	118.9
49	D	30.5	Very low	35.9	Very low	164 Å²	164	164.5 Å²	164.5	88%	0.877	83%	0.825	S	S	*	*				-131.5	151.7	118.8	-158.6	-5.7	0	0	0	109.2
50	A	38.2	Very low	36.5	Very low	83 Å²	83	158.5 Å²	158.5	69%	0.686	82%	0.816	S	S	*	*			trans	-128.8	92.2	-162.3	0	0	0	0	0	112.6
51	R	36.4	Very low	37.3	Very low	237 Å²	237	153.4 Å²	153.4	89%	0.894	80%	0.802	S	S	*	*			trans	-92.5	116.3	166.4	-77	-172.6	171.2	-173.8	-3.3	111.1	V53	R51-V53 PolarHBondContact O-N 2.85Å
52	K	41.9	Very low	38	Very low	207 Å²	207	153.7 Å²	153.7	90%	0.9	80%	0.797	S	S	*	*			trans	-60.7	122.6	169.4	-67.4	175.7	178.4	175.4	0	109.3
53	V	36.7	Very low	38.6	Very low	128 Å²	128	155.4 Å²	155.4	78%	0.776	80%	0.8	S	S	*	*			trans	-112.5	132.4	163.5	-179.1	0	0	0	0	107	R51 T55	R51-V53 PolarHBondContact O-N 2.85Å; V53-T55 PolarHBondContact O-N 2.8Å
54	H	36.9	Very low	39.9	Very low	180 Å²	180	151.9 Å²	151.9	83%	0.833	79%	0.789	S	S	*	*			trans	-68.2	124.9	-174.6	-77.7	-106.9	0	0	0	111.3	A56	H54-A56 PolarHBondContact O-N 2.78Å; H54-A56 VanDerWaalsContact O-N 3.09Å
55	T	39.4	Very low	41.4	Very low	137 Å²	137	150.3 Å²	150.3	84%	0.84	78%	0.783	S	S	*	*			trans	-75.5	94	175.6	46.6	0	0	0	0	111.1	V53	V53-T55 PolarHBondContact O-N 2.8Å
56	A	39.1	Very low	43	Very low	85 Å²	85	150.5 Å²	150.5	70%	0.702	78%	0.777	S	S	*	*			trans	-71.1	131.5	158.8	0	0	0	0	0	109.3	H54 A58	H54-A56 PolarHBondContact O-N 2.78Å; H54-A56 VanDerWaalsContact O-N 3.09Å; A56-A58 VanDerWaalsContact C-N 3.29Å; A56-A58 PolarHBondContact O-N 2.85Å
57	P	42.2	Very low	44.8	Very low	127 Å²	127	146.9 Å²	146.9	83%	0.825	77%	0.766	S	S	*	*			trans	-79.5	74.2	-175.9	32.6	-36	0	0	0	111.7	R59	P57-R59 PolarHBondContact O-N 2.93Å
58	A	46.1	Very low	46.8	Very low	106 Å²	106	140.2 Å²	140.2	88%	0.876	75%	0.751	S	S	*	*			trans	-71.5	64.9	172.4	0	0	0	0	0	111.5	A56	A56-A58 VanDerWaalsContact C-N 3.29Å; A56-A58 PolarHBondContact O-N 2.85Å
59	R	48.4	Very low	48.7	Very low	220 Å²	220	138.8 Å²	138.8	83%	0.83	74%	0.738	S	S	*	*			trans	-118.5	32.6	-175.4	-141	-179.6	-166.7	-166.9	3.8	114.6	P57 T61	P57-R59 PolarHBondContact O-N 2.93Å; R59-T61 VanDerWaalsContact C-N 3.28Å; R59-T61 PolarHBondContact O-N 2.81Å
60	T	43.9	Very low	50.6	Low	116 Å²	116	136.2 Å²	136.2	71%	0.712	72%	0.724	S	S	*	*			trans	-91.2	61.5	165.9	-41.9	0	0	0	0	109.9	F62	T60-F62 HydrophobicContact CG2-CD2 4.18Å; T60-F62 HydrophobicContact CG2-CE2 4.07Å; T60-F62 PolarHBondContact O-N 3.2Å
61	T	45.8	Very low	52.3	Low	106 Å²	106	138 Å²	138	65%	0.65	72%	0.721	S	S	*	*			trans	-63.6	107	167.5	45.5	0	0	0	0	108	R59 L63	R59-T61 VanDerWaalsContact C-N 3.28Å; R59-T61 PolarHBondContact O-N 2.81Å; T61-L63 PolarHBondContact O-N 2.99Å
62	F	47.8	Very low	54.3	Low	172 Å²	172	130 Å²	130	75%	0.754	71%	0.706	S	S	*	*			trans	-65.4	80.3	171.6	-98.3	-95.8	0	0	0	109.7	T60 L64	T60-F62 HydrophobicContact CG2-CD2 4.18Å; T60-F62 HydrophobicContact CG2-CE2 4.07Å; T60-F62 PolarHBondContact O-N 3.2Å; F62-L64 HydrophobicContact CD1-CD2 4.27Å; F62-L64 HydrophobicContact CD1-CG 4.5Å; F62-L64 PolarHBondContact O-N 3.32Å
63	L	53.9	Low	56.2	Low	149 Å²	149	124.2 Å²	124.2	78%	0.78	69%	0.688	S	S	*	*			trans	-69.2	73	162.8	-86.3	161.8	0	0	0	108.1	T61 R65	T61-L63 PolarHBondContact O-N 2.99Å; L63-R65 PolarHBondContact O-N 2.84Å
64	L	56.6	Low	58.2	Low	120 Å²	120	120 Å²	120	63%	0.628	67%	0.67	S	S	*	*			trans	-59.1	87.8	160.7	-70.2	177.1	0	0	0	107	F62 I69	F62-L64 HydrophobicContact CD1-CD2 4.27Å; F62-L64 HydrophobicContact CD1-CG 4.5Å; F62-L64 PolarHBondContact O-N 3.32Å; L64-I69 HydrophobicContact CB-CD1 4.39Å; L64-I69 HydrophobicContact CD1-CD1 4.5Å; L64-I69 HydrophobicContact CD2-CD1 4.46Å
65	R	59.6	Low	60.5	Low	199 Å²	199	113.5 Å²	113.5	75%	0.751	65%	0.652	S	S	*	*			trans	-51.5	124.6	168	-67.7	-179.9	174.5	-177.1	-2.7	105.5	L63 L67 P68	L63-R65 PolarHBondContact O-N 2.84Å; R65-L67 PolarHBondContact O-N 2.77Å; R65-L67 VanDerWaalsContact O-N 3.14Å; R65-P68 WeakPolarHBondContact O-CD 3.39Å
66	P	65.6	Low	62.6	Low	90 Å²	90	109.2 Å²	109.2	58%	0.584	64%	0.635	S	S	*	*	H	α-helix	trans	-66	-20.9	-176.4	24.2	-33.3	0	0	0	111.8	I69 L70	P66-I69 PolarHBondContact O-N 3.21Å; P66-L70 HydrophobicContact CB-CD1 4.12Å; P66-L70 WeakPolarHBondContact O-CB 3.43Å; P66-L70 VanDerWaalsContact O-CG 3.28Å; P66-L70 WeakPolarHBondContact O-CG 3.45Å; P66-L70 PolarHBondContact O-N 3.11Å
67	L	67.6	Low	64.7	Low	120 Å²	120	111.5 Å²	111.5	63%	0.628	63%	0.627	S	S	*	*	H	α-helix	trans	-59.7	-50.3	-172.6	-153.7	76.1	0	0	0	114.7	R65 I69 L70 L71	R65-L67 PolarHBondContact O-N 2.77Å; R65-L67 VanDerWaalsContact O-N 3.14Å; L67-I69 VanDerWaalsContact C-N 3.33Å; L67-I69 PolarHBondContact O-N 3.35Å; L67-L70 PolarHBondContact O-N 2.86Å; L67-L71 HydrophobicContact CG-CD1 4.17Å; L67-L71 WeakPolarHBondContact O-CB 3.35Å; L67-L71 VanDerWaalsContact O-CG 3.26Å; L67-L71 WeakPolarHBondContact O-CG 3.48Å; L67-L71 PolarHBondContact O-N 3.36Å
68	P	72.4	Confident	66.4	Low	80 Å²	80	108.2 Å²	108.2	52%	0.519	61%	0.61	S	S	.	*	H	α-helix	trans	-68.8	-31.3	179.8	-20	36.1	0	0	0	112.6	R65 L71 A72	R65-P68 WeakPolarHBondContact O-CD 3.39Å; P68-L71 PolarHBondContact O-N 3.16Å; P68-A72 VanDerWaalsContact O-CB 3.24Å; P68-A72 WeakPolarHBondContact O-CB 2.92Å; P68-A72 PolarHBondContact O-N 3.07Å
69	I	74.4	Confident	68.2	Low	88 Å²	88	105.1 Å²	105.1	45%	0.451	59%	0.589	S	S	.	*	H	α-helix	trans	-67.8	-45.2	174.3	-62.7	174.9	0	0	0	110	L64 P66 L67 L71 A72 T73	L64-I69 HydrophobicContact CB-CD1 4.39Å; L64-I69 HydrophobicContact CD1-CD1 4.5Å; L64-I69 HydrophobicContact CD2-CD1 4.46Å; P66-I69 PolarHBondContact O-N 3.21Å; L67-I69 VanDerWaalsContact C-N 3.33Å; L67-I69 PolarHBondContact O-N 3.35Å; I69-L71 VanDerWaalsContact C-N 3.33Å; I69-L71 PolarHBondContact O-N 3.17Å; I69-A72 PolarHBondContact O-N 3.16Å; I69-T73 HydrophobicContact CG2-CG2 4.31Å; I69-T73 WeakPolarHBondContact O-CB 3.42Å; I69-T73 WeakPolarHBondContact O-CG2 3.44Å; I69-T73 PolarHBondContact O-N 2.84Å; I69-T73 PolarHBondContact O-OG1 2.78Å
70	L	69.3	Low	69.9	Low	111 Å²	111	100.7 Å²	100.7	58%	0.581	57%	0.573	S	S	*	*	H	α-helix	trans	-63.9	-36.9	175.7	-73.1	168.7	0	0	0	112.2	P66 L67 T73 G74	P66-L70 HydrophobicContact CB-CD1 4.12Å; P66-L70 WeakPolarHBondContact O-CB 3.43Å; P66-L70 VanDerWaalsContact O-CG 3.28Å; P66-L70 WeakPolarHBondContact O-CG 3.45Å; P66-L70 PolarHBondContact O-N 3.11Å; L67-L70 PolarHBondContact O-N 2.86Å; L70-T73 PolarHBondContact O-OG1 2.98Å; L70-G74 WeakPolarHBondContact O-CA 3.32Å; L70-G74 PolarHBondContact O-N 3.29Å
71	L	75.3	Confident	71.6	Confident	120 Å²	120	101.3 Å²	101.3	63%	0.628	56%	0.562	S	S	*	*	H	α-helix	trans	-70.9	-43.6	175.8	-72.3	168.3	0	0	0	112	L67 P68 I69 G75	L67-L71 HydrophobicContact CG-CD1 4.17Å; L67-L71 WeakPolarHBondContact O-CB 3.35Å; L67-L71 VanDerWaalsContact O-CG 3.26Å; L67-L71 WeakPolarHBondContact O-CG 3.48Å; L67-L71 PolarHBondContact O-N 3.36Å; P68-L71 PolarHBondContact O-N 3.16Å; I69-L71 VanDerWaalsContact C-N 3.33Å; I69-L71 PolarHBondContact O-N 3.17Å; L71-G75 PolarHBondContact O-N 2.97Å
72	A	78.1	Confident	73.3	Confident	70 Å²	70	102 Å²	102	58%	0.579	56%	0.558	S	S	*	*	H	α-helix	trans	-67.3	-44.2	177.6	0	0	0	0	0	112.2	P68 I69 G76	P68-A72 VanDerWaalsContact O-CB 3.24Å; P68-A72 WeakPolarHBondContact O-CB 2.92Å; P68-A72 PolarHBondContact O-N 3.07Å; I69-A72 PolarHBondContact O-N 3.16Å; A72-G76 PolarHBondContact O-N 2.89Å
73	T	80.8	Confident	75	Confident	84 Å²	84	100.6 Å²	100.6	52%	0.515	55%	0.549	S	S	.	.	H	α-helix	trans	-69.8	-40	176.7	54.1	0	0	0	0	112	I69 L70 G76 Y77	I69-T73 HydrophobicContact CG2-CG2 4.31Å; I69-T73 WeakPolarHBondContact O-CB 3.42Å; I69-T73 WeakPolarHBondContact O-CG2 3.44Å; I69-T73 PolarHBondContact O-N 2.84Å; I69-T73 PolarHBondContact O-OG1 2.78Å; L70-T73 PolarHBondContact O-OG1 2.98Å; T73-G76 PolarHBondContact O-N 3.14Å; T73-Y77 VanDerWaalsContact O-CB 3.28Å; T73-Y77 WeakPolarHBondContact O-CB 3.31Å; T73-Y77 PolarHBondContact O-N 2.72Å
74	G	80.1	Confident	76.2	Confident	39 Å²	39	95.6 Å²	95.6	40%	0.402	52%	0.521	S	S	.	.	H	α-helix	trans	-64	-42.9	173.8	0	0	0	0	0	113	L70 Y77 A78	L70-G74 WeakPolarHBondContact O-CA 3.32Å; L70-G74 PolarHBondContact O-N 3.29Å; G74-Y77 PolarHBondContact O-N 2.86Å; G74-A78 VanDerWaalsContact O-CB 3.31Å; G74-A78 WeakPolarHBondContact O-CB 3.42Å; G74-A78 PolarHBondContact O-N 3.18Å
75	G	83.5	Confident	77.3	Confident	44 Å²	44	94.8 Å²	94.8	45%	0.454	51%	0.513	S	S	.	.	H	α-helix	trans	-64.8	-45	174	0	0	0	0	0	112.6	L71 A78 G79	L71-G75 PolarHBondContact O-N 2.97Å; G75-A78 PolarHBondContact O-N 3.19Å; G75-G79 PolarHBondContact O-N 3.16Å
76	G	84.4	Confident	78.4	Confident	47 Å²	47	91.7 Å²	91.7	49%	0.485	50%	0.502	S	S	.	.	H	α-helix	trans	-61.5	-42.9	174.5	0	0	0	0	0	112.8	A72 T73 G79 Y80	A72-G76 PolarHBondContact O-N 2.89Å; T73-G76 PolarHBondContact O-N 3.14Å; G76-G79 PolarHBondContact O-N 3.38Å; G76-Y80 WeakPolarHBondContact O-CB 3.44Å; G76-Y80 PolarHBondContact O-N 2.74Å
77	Y	82.6	Confident	79.1	Confident	134 Å²	134	92 Å²	92	53%	0.525	49%	0.491	S	S	.	.	H	α-helix	trans	-65	-41.6	174.6	-179.7	-98.6	0	0	0	112.2	T73 G74 Y80 R81	T73-Y77 VanDerWaalsContact O-CB 3.28Å; T73-Y77 WeakPolarHBondContact O-CB 3.31Å; T73-Y77 PolarHBondContact O-N 2.72Å; G74-Y77 PolarHBondContact O-N 2.86Å; Y77-Y80 PolarHBondContact O-N 2.76Å; Y77-R81 HydrophobicContact CE1-CG 4.02Å; Y77-R81 HydrophobicContact CE2-CG 4.46Å; Y77-R81 WeakPolarHBondContact O-CB 3.08Å; Y77-R81 PolarHBondContact O-N 2.88Å; Y77-R81 PolarHBondContact OH-NE 2.8Å
78	A	78.7	Confident	79.5	Confident	57 Å²	57	88.2 Å²	88.2	47%	0.471	47%	0.47	S	S	.	.	H	α-helix	trans	-63.6	-43	175.4	0	0	0	0	0	111.8	G74 G75 R81 Q82	G74-A78 VanDerWaalsContact O-CB 3.31Å; G74-A78 WeakPolarHBondContact O-CB 3.42Å; G74-A78 PolarHBondContact O-N 3.18Å; G75-A78 PolarHBondContact O-N 3.19Å; A78-R81 PolarHBondContact O-N 2.81Å; A78-Q82 WeakPolarHBondContact O-CB 3.36Å; A78-Q82 PolarHBondContact O-N 2.87Å
79	G	82.7	Confident	79.7	Confident	42 Å²	42	91.7 Å²	91.7	43%	0.433	47%	0.473	S	S	.	.	H	α-helix	trans	-61.6	-47.8	173.8	0	0	0	0	0	112.3	G75 G76 R81 Q82 Y83	G75-G79 PolarHBondContact O-N 3.16Å; G76-G79 PolarHBondContact O-N 3.38Å; G79-R81 PolarHBondContact O-N 2.93Å; G79-Q82 PolarHBondContact O-N 2.84Å; G79-Q82 VanDerWaalsContact O-N 3.11Å; G79-Y83 PolarHBondContact O-N 2.84Å
80	Y	84.3	Confident	79.9	Confident	126 Å²	126	90.1 Å²	90.1	49%	0.494	46%	0.464	S	S	.	.	H	α-helix	trans	-57.5	-46.9	174.2	180	-90.7	0	0	0	111.7	G76 Y77 Q82 Y83 E84	G76-Y80 WeakPolarHBondContact O-CB 3.44Å; G76-Y80 PolarHBondContact O-N 2.74Å; Y77-Y80 PolarHBondContact O-N 2.76Å; Y80-Q82 VanDerWaalsContact C-N 3.28Å; Y80-Q82 PolarHBondContact O-N 3.08Å; Y80-Y83 PolarHBondContact O-N 2.84Å; Y80-E84 WeakPolarHBondContact O-CB 3.27Å; Y80-E84 PolarHBondContact O-N 2.67Å
81	R	80.4	Confident	80.4	Confident	129 Å²	129	87.1 Å²	87.1	49%	0.487	45%	0.448	S	S	.	.	H	α-helix	trans	-65	-27.6	175.7	-96.5	-126.6	164.1	149.3	-4	113.9	Y77 A78 G79 K85	Y77-R81 HydrophobicContact CE1-CG 4.02Å; Y77-R81 HydrophobicContact CE2-CG 4.46Å; Y77-R81 WeakPolarHBondContact O-CB 3.08Å; Y77-R81 PolarHBondContact O-N 2.88Å; Y77-R81 PolarHBondContact OH-NE 2.8Å; A78-R81 PolarHBondContact O-N 2.81Å; G79-R81 PolarHBondContact O-N 2.93Å; R81-K85 WeakPolarHBondContact O-CD 3.29Å; R81-K85 VanDerWaalsContact O-CG 3.26Å; R81-K85 WeakPolarHBondContact O-CG 3.17Å; R81-K85 PolarHBondContact O-N 2.81Å
82	Q	81	Confident	80.2	Confident	120 Å²	120	86 Å²	86	56%	0.561	44%	0.44	S	S	*	.	H	α-helix	trans	-77.5	-40.6	175.2	-167.4	71.5	-12.3	0	0	110.9	A78 G79 Y80 K85 Y86	A78-Q82 WeakPolarHBondContact O-CB 3.36Å; A78-Q82 PolarHBondContact O-N 2.87Å; G79-Q82 PolarHBondContact O-N 2.84Å; G79-Q82 VanDerWaalsContact O-N 3.11Å; Y80-Q82 VanDerWaalsContact C-N 3.28Å; Y80-Q82 PolarHBondContact O-N 3.08Å; Q82-K85 PolarHBondContact O-N 2.82Å; Q82-Y86 PolarHBondContact O-N 3.41Å
83	Y	84.5	Confident	80.2	Confident	144 Å²	144	90 Å²	90	57%	0.565	44%	0.444	S	S	*	.	H	α-helix	trans	-63.4	-42	172.2	177.1	-104.8	0	0	0	112.3	G79 Y80 K85 Y86 R87	G79-Y83 PolarHBondContact O-N 2.84Å; Y80-Y83 PolarHBondContact O-N 2.84Å; Y83-K85 PolarHBondContact O-N 2.91Å; Y83-Y86 WeakPolarHBondContact O-CB 3.12Å; Y83-Y86 PolarHBondContact O-N 3.16Å; Y83-Y86 VanDerWaalsContact O-N 3.13Å; Y83-R87 WeakPolarHBondContact O-CB 3.21Å; Y83-R87 PolarHBondContact O-N 2.91Å
84	E	79.1	Confident	80.1	Confident	44 Å²	44	91.9 Å²	91.9	21%	0.206	45%	0.45	C	S	.	.	H	α-helix	trans	-60	-45.3	176.2	176.1	158.3	-110.1	0	0	111.9	Y80 Y86 R87 E88	Y80-E84 WeakPolarHBondContact O-CB 3.27Å; Y80-E84 PolarHBondContact O-N 2.67Å; E84-Y86 VanDerWaalsContact C-N 3.33Å; E84-Y86 PolarHBondContact O-N 3.29Å; E84-R87 PolarHBondContact O-N 3.41Å; E84-R87 IonicContact OE1-NH2 2.69Å; E84-R87 PolarHBondContact OE1-NH2 3.02Å; E84-E88 PolarHBondContact O-N 2.96Å
85	K	79.3	Confident	79.4	Confident	102 Å²	102	93 Å²	93	44%	0.443	46%	0.463	S	S	.	.	H	α-helix	trans	-64.1	-34.3	172.7	-69.9	168.3	-170.9	169.8	0	113.4	R81 Q82 Y83 R89	R81-K85 WeakPolarHBondContact O-CD 3.29Å; R81-K85 VanDerWaalsContact O-CG 3.26Å; R81-K85 WeakPolarHBondContact O-CG 3.17Å; R81-K85 PolarHBondContact O-N 2.81Å; Q82-K85 PolarHBondContact O-N 2.82Å; Y83-K85 PolarHBondContact O-N 2.91Å; K85-R89 VanDerWaalsContact O-CG 3.32Å; K85-R89 WeakPolarHBondContact O-CG 3.15Å; K85-R89 PolarHBondContact O-N 3.44Å
86	Y	81.5	Confident	78.7	Confident	135 Å²	135	95.9 Å²	95.9	53%	0.529	47%	0.467	S	S	.	.	H	α-helix	trans	-67	-49.5	175.8	177.6	-93.5	0	0	0	110	Q82 Y83 E84 E88 R89 E90	Q82-Y86 PolarHBondContact O-N 3.41Å; Y83-Y86 WeakPolarHBondContact O-CB 3.12Å; Y83-Y86 PolarHBondContact O-N 3.16Å; Y83-Y86 VanDerWaalsContact O-N 3.13Å; E84-Y86 VanDerWaalsContact C-N 3.33Å; E84-Y86 PolarHBondContact O-N 3.29Å; Y86-E88 PolarHBondContact O-N 2.74Å; Y86-R89 WeakPolarHBondContact O-CB 3.48Å; Y86-R89 PolarHBondContact O-N 3.19Å; Y86-R89 VanDerWaalsContact O-N 3.08Å; Y86-E90 HydrophobicContact CD1-CG 4.16Å; Y86-E90 HydrophobicContact CE1-CG 3.66Å; Y86-E90 HydrophobicContact CE2-CG 4.24Å; Y86-E90 PolarHBondContact O-N 2.82Å
87	R	81	Confident	77.5	Confident	95 Å²	95	102.9 Å²	102.9	36%	0.358	49%	0.487	S	S	.	.	H	α-helix	trans	-58.9	-41.8	175	-172.3	-163.3	64.3	-158.8	-10.7	112.4	Y83 E84 R89 E90 L91	Y83-R87 WeakPolarHBondContact O-CB 3.21Å; Y83-R87 PolarHBondContact O-N 2.91Å; E84-R87 PolarHBondContact O-N 3.41Å; E84-R87 IonicContact OE1-NH2 2.69Å; E84-R87 PolarHBondContact OE1-NH2 3.02Å; R87-R89 VanDerWaalsContact C-N 3.32Å; R87-R89 PolarHBondContact O-N 2.7Å; R87-E90 PolarHBondContact O-N 2.45Å; R87-L91 HydrophobicContact CG-CD1 3.94Å; R87-L91 WeakPolarHBondContact O-CB 3.5Å; R87-L91 WeakPolarHBondContact O-CG 3.49Å; R87-L91 PolarHBondContact O-N 3.24Å
88	E	76.6	Confident	76.6	Confident	41 Å²	41	100.3 Å²	100.3	19%	0.192	48%	0.481	C	S	.	.	H	α-helix	trans	-53.6	-48.6	172	-82.6	-177.4	-145.2	0	0	110.7	E84 Y86 L91 E92 I98 R293	E84-E88 PolarHBondContact O-N 2.96Å; Y86-E88 PolarHBondContact O-N 2.74Å; E88-L91 PolarHBondContact O-N 3.35Å; E88-E92 WeakPolarHBondContact O-CB 3.39Å; E88-E92 VanDerWaalsContact O-CG 3.29Å; E88-E92 WeakPolarHBondContact O-CG 3.45Å; E88-E92 PolarHBondContact O-N 2.94Å; E88-I98 HydrophobicContact CG-CD1 4.28Å; E88-R293 IonicContact OE1-NH1 3.44Å; E88-R293 IonicContact OE1-NH2 3.29Å; E88-R293 PolarHBondContact OE1-NH2 3.44Å; E88-R293 IonicContact OE2-CZ 3.2Å; E88-R293 IonicContact OE2-NH1 2.73Å; E88-R293 PolarHBondContact OE2-NH1 2.76Å; E88-R293 IonicContact OE2-NH2 3.44Å; E88-R293 PolarHBondContact OE2-NH2 2.88Å
89	R	76.8	Confident	75.9	Confident	154 Å²	154	102.6 Å²	102.6	58%	0.581	49%	0.492	S	S	*	.	H	α-helix	trans	-67.6	-39.8	-179	-68.9	165.7	178.2	-176	-2.5	114.1	K85 Y86 R87 E92 K93	K85-R89 VanDerWaalsContact O-CG 3.32Å; K85-R89 WeakPolarHBondContact O-CG 3.15Å; K85-R89 PolarHBondContact O-N 3.44Å; Y86-R89 WeakPolarHBondContact O-CB 3.48Å; Y86-R89 PolarHBondContact O-N 3.19Å; Y86-R89 VanDerWaalsContact O-N 3.08Å; R87-R89 VanDerWaalsContact C-N 3.32Å; R87-R89 PolarHBondContact O-N 2.7Å; R89-E92 PolarHBondContact O-N 2.04Å; R89-K93 WeakPolarHBondContact O-CG 3.2Å; R89-K93 PolarHBondContact O-N 3.03Å
90	E	79	Confident	75.3	Confident	55 Å²	55	102.5 Å²	102.5	26%	0.257	48%	0.483	S	S	.	.	H	α-helix	trans	-70.1	-34.5	178.9	-59.5	-45.6	114.6	0	0	111.6	Y86 R87 K93 L94	Y86-E90 HydrophobicContact CD1-CG 4.16Å; Y86-E90 HydrophobicContact CE1-CG 3.66Å; Y86-E90 HydrophobicContact CE2-CG 4.24Å; Y86-E90 PolarHBondContact O-N 2.82Å; R87-E90 PolarHBondContact O-N 2.45Å; E90-K93 PolarHBondContact O-N 2.86Å; E90-K93 IonicContact OE1-NZ 3.18Å; E90-K93 PolarHBondContact OE1-NZ 3.49Å; E90-K93 WeakPolarHBondContact OE2-CD 3.15Å; E90-K93 IonicContact OE2-NZ 2.7Å; E90-K93 PolarHBondContact OE2-NZ 3.19Å; E90-L94 WeakPolarHBondContact O-CD1 3.25Å; E90-L94 VanDerWaalsContact O-CG 3.28Å; E90-L94 WeakPolarHBondContact O-CG 3.48Å; E90-L94 PolarHBondContact O-N 3.2Å; E90-L94 VanDerWaalsContact O-N 3.15Å
91	L	77.8	Confident	74.9	Confident	48 Å²	48	104.6 Å²	104.6	25%	0.251	50%	0.495	S	S	.	.	H	α-helix	trans	-70.2	-37.4	172.1	-71.8	167.3	0	0	0	112.3	R87 E88 L94 G95 L96 I98	R87-L91 HydrophobicContact CG-CD1 3.94Å; R87-L91 WeakPolarHBondContact O-CB 3.5Å; R87-L91 WeakPolarHBondContact O-CG 3.49Å; R87-L91 PolarHBondContact O-N 3.24Å; E88-L91 PolarHBondContact O-N 3.35Å; L91-L94 CarbonylContact O-C 3.56Å; L91-L94 PolarHBondContact O-N 2.8Å; L91-L94 VanDerWaalsContact O-N 3.14Å; L91-G95 PolarHBondContact O-N 3.44Å; L91-L96 HydrophobicContact CD2-CB 4.47Å; L91-L96 HydrophobicContact CD2-CD1 3.95Å; L91-L96 PolarHBondContact O-N 2.95Å; L91-L96 VanDerWaalsContact O-N 3.13Å; L91-I98 HydrophobicContact CB-CD1 3.86Å; L91-I98 HydrophobicContact CB-CG1 4.09Å; L91-I98 HydrophobicContact CD1-CD1 3.51Å; L91-I98 HydrophobicContact CD1-CG1 3.98Å; L91-I98 HydrophobicContact CG-CD1 4.33Å
92	E	72.4	Confident	75	Confident	96 Å²	96	102.3 Å²	102.3	45%	0.449	49%	0.492	S	S	.	.	H	α-helix	trans	-61.5	-40.7	171.6	-77	174	174.3	0	0	112.2	E88 R89 L94 G95 K209	E88-E92 WeakPolarHBondContact O-CB 3.39Å; E88-E92 VanDerWaalsContact O-CG 3.29Å; E88-E92 WeakPolarHBondContact O-CG 3.45Å; E88-E92 PolarHBondContact O-N 2.94Å; R89-E92 PolarHBondContact O-N 2.04Å; E92-L94 VanDerWaalsContact C-N 3.28Å; E92-L94 PolarHBondContact O-N 3.44Å; E92-G95 PolarHBondContact O-N 2.77Å; E92-G95 VanDerWaalsContact O-N 3.17Å; E92-K209 IonicContact OE1-NZ 3.06Å; E92-K209 PolarHBondContact OE1-NZ 3.18Å
93	K	78	Confident	75	Confident	154 Å²	154	97.5 Å²	97.5	67%	0.67	47%	0.472	S	S	*	.	H	α-helix	trans	-63	-32.2	172.3	-74.8	167.5	172.7	170.7	0	113.2	R89 E90 G95	R89-K93 WeakPolarHBondContact O-CG 3.2Å; R89-K93 PolarHBondContact O-N 3.03Å; E90-K93 PolarHBondContact O-N 2.86Å; E90-K93 IonicContact OE1-NZ 3.18Å; E90-K93 PolarHBondContact OE1-NZ 3.49Å; E90-K93 WeakPolarHBondContact OE2-CD 3.15Å; E90-K93 IonicContact OE2-NZ 2.7Å; E90-K93 PolarHBondContact OE2-NZ 3.19Å; K93-G95 PolarHBondContact O-N 3.12Å
94	L	79.3	Confident	74.9	Confident	123 Å²	123	92 Å²	92	64%	0.644	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	0.4	177.4	-70.2	166.6	0	0	0	113	E90 L91 E92 L96	E90-L94 WeakPolarHBondContact O-CD1 3.25Å; E90-L94 VanDerWaalsContact O-CG 3.28Å; E90-L94 WeakPolarHBondContact O-CG 3.48Å; E90-L94 PolarHBondContact O-N 3.2Å; E90-L94 VanDerWaalsContact O-N 3.15Å; L91-L94 CarbonylContact O-C 3.56Å; L91-L94 PolarHBondContact O-N 2.8Å; L91-L94 VanDerWaalsContact O-N 3.14Å; E92-L94 VanDerWaalsContact C-N 3.28Å; E92-L94 PolarHBondContact O-N 3.44Å; L94-L96 HydrophobicContact CB-CD1 4.3Å; L94-L96 HydrophobicContact CB-CG 4.33Å; L94-L96 PolarHBondContact O-N 2.85Å
95	G	63.8	Low	75	Confident	64 Å²	64	98.5 Å²	98.5	66%	0.66	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	14.8	-179.4	0	0	0	0	0	114.4	L91 E92 K93	L91-G95 PolarHBondContact O-N 3.44Å; E92-G95 PolarHBondContact O-N 2.77Å; E92-G95 VanDerWaalsContact O-N 3.17Å; K93-G95 PolarHBondContact O-N 3.12Å
96	L	68.5	Low	75.2	Confident	103 Å²	103	102 Å²	102	54%	0.539	50%	0.5	S	S	.	.			trans	-92.2	107.2	-178.1	-67.3	174.1	0	0	0	110.3	L91 L94 I98	L91-L96 HydrophobicContact CD2-CB 4.47Å; L91-L96 HydrophobicContact CD2-CD1 3.95Å; L91-L96 PolarHBondContact O-N 2.95Å; L91-L96 VanDerWaalsContact O-N 3.13Å; L94-L96 HydrophobicContact CB-CD1 4.3Å; L94-L96 HydrophobicContact CB-CG 4.33Å; L94-L96 PolarHBondContact O-N 2.85Å; L96-I98 PolarHBondContact O-N 2.87Å; L96-I98 VanDerWaalsContact O-N 3.11Å
97	E	59.3	Low	75.4	Confident	194 Å²	194	98.2 Å²	98.2	91%	0.907	49%	0.487	S	S	*	.			trans	-65.9	108.9	173.7	-65.5	-163.9	155.5	0	0	110.8
98	I	64.6	Low	75.6	Confident	80 Å²	80	94.6 Å²	94.6	41%	0.41	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-78	121.9	173.2	-45	174.5	0	0	0	108.2	E88 L91 L96	E88-I98 HydrophobicContact CG-CD1 4.28Å; L91-I98 HydrophobicContact CB-CD1 3.86Å; L91-I98 HydrophobicContact CB-CG1 4.09Å; L91-I98 HydrophobicContact CD1-CD1 3.51Å; L91-I98 HydrophobicContact CD1-CG1 3.98Å; L91-I98 HydrophobicContact CG-CD1 4.33Å; L96-I98 PolarHBondContact O-N 2.87Å; L96-I98 VanDerWaalsContact O-N 3.11Å
99	P	64.6	Low	75.9	Confident	106 Å²	106	95.4 Å²	95.4	69%	0.688	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-61.2	135.4	173.6	25.1	-33.4	0	0	0	110.1	K101	P99-K101 PolarHBondContact O-N 2.82Å
100	P	68.9	Low	76.4	Confident	40 Å²	40	93.2 Å²	93.2	26%	0.26	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-62.4	129.6	-176.9	25.3	-34.5	0	0	0	110.6	L102 K209 V211	P100-L102 VanDerWaalsContact C-N 3.31Å; P100-L102 PolarHBondContact O-N 2.92Å; P100-K209 WeakPolarHBondContact CG-O 3.28Å; P100-V211 HydrophobicContact CB-CG2 3.68Å; P100-V211 HydrophobicContact CG-CG2 3.63Å
101	K	76.3	Confident	76.7	Confident	169 Å²	169	93.1 Å²	93.1	74%	0.735	49%	0.486	S	S	*	.			trans	-71	89.2	174.5	-173.8	-179.7	177.5	-179.1	0	109.6	P99	P99-K101 PolarHBondContact O-N 2.82Å
102	L	83.5	Confident	77	Confident	82 Å²	82	94.8 Å²	94.8	43%	0.429	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-66.8	151.4	176.5	-66.7	178.4	0	0	0	112.1	P100 V211 W294 K296	P100-L102 VanDerWaalsContact C-N 3.31Å; P100-L102 PolarHBondContact O-N 2.92Å; L102-V211 HydrophobicContact CD2-CG1 4.1Å; L102-V211 HydrophobicContact CD2-CG2 3.82Å; L102-W294 CarbonylContact C-O 3.55Å; L102-W294 WeakPolarHBondContact CA-O 3.4Å; L102-K296 HydrophobicContact CD2-CB 4.29Å
103	A	80.5	Confident	77.6	Confident	18 Å²	18	94.2 Å²	94.2	15%	0.149	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-72.4	135.7	175.9	0	0	0	0	0	111.5	E107 V108 W294	A103-E107 VanDerWaalsContact CA-OE2 3.3Å; A103-E107 WeakPolarHBondContact CA-OE2 3.38Å; A103-E107 HydrophobicContact CB-CB 4.4Å; A103-V108 HydrophobicContact CB-CG2 3.46Å; A103-V108 VanDerWaalsContact CB-CG2 3.46Å; A103-W294 HydrophobicContact CB-CD2 3.72Å; A103-W294 VanDerWaalsContact CB-CE2 3.43Å; A103-W294 HydrophobicContact CB-CE3 4.37Å; A103-W294 HydrophobicContact CB-CG 3.94Å; A103-W294 HydrophobicContact CB-CZ2 3.89Å; A103-W294 WeakPolarHBondContact CB-O 3.49Å; A103-W294 PolarHBondContact N-O 2.91Å
104	G	82.7	Confident	78	Confident	28 Å²	28	89.6 Å²	89.6	29%	0.289	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-65.1	150.9	170.4	0	0	0	0	0	111.7	W106 E107 V108	G104-W106 PolarHBondContact O-N 2.83Å; G104-W106 VanDerWaalsContact O-N 3.08Å; G104-E107 PolarHBondContact N-OE2 2.7Å; G104-E107 WeakPolarHBondContact O-CB 3.39Å; G104-E107 PolarHBondContact O-N 3Å; G104-V108 PolarHBondContact O-N 2.89Å
105	H	80.9	Confident	78.3	Confident	181 Å²	181	87.3 Å²	87.3	84%	0.838	48%	0.475	S	S	*	.	H	α-helix	trans	-53	-35.6	-179	-63.5	-74.2	0	0	0	113.3	A109	H105-A109 VanDerWaalsContact O-CB 3.29Å; H105-A109 WeakPolarHBondContact O-CB 3.32Å; H105-A109 PolarHBondContact O-N 2.83Å
106	W	83.1	Confident	79.2	Confident	176 Å²	176	84.8 Å²	84.8	67%	0.667	45%	0.447	S	S	*	.	H	α-helix	trans	-71.6	-34.4	176.4	74.2	-95.9	0	0	0	113	G104 A109 L110	G104-W106 PolarHBondContact O-N 2.83Å; G104-W106 VanDerWaalsContact O-N 3.08Å; W106-A109 PolarHBondContact O-N 3.08Å; W106-L110 HydrophobicContact CZ3-CD2 4.13Å; W106-L110 VanDerWaalsContact O-CB 3.29Å; W106-L110 WeakPolarHBondContact O-CB 3.13Å; W106-L110 PolarHBondContact O-N 3.29Å
107	E	86.5	Confident	79.9	Confident	56 Å²	56	81.6 Å²	81.6	26%	0.262	43%	0.428	S	S	.	.	H	α-helix	trans	-67.2	-43.7	175.7	-58.5	-176.6	119.9	0	0	110.2	A103 G104 L110 Y111 W294	A103-E107 VanDerWaalsContact CA-OE2 3.3Å; A103-E107 WeakPolarHBondContact CA-OE2 3.38Å; A103-E107 HydrophobicContact CB-CB 4.4Å; G104-E107 PolarHBondContact N-OE2 2.7Å; G104-E107 WeakPolarHBondContact O-CB 3.39Å; G104-E107 PolarHBondContact O-N 3Å; E107-L110 PolarHBondContact O-N 2.78Å; E107-Y111 WeakPolarHBondContact O-CB 3.44Å; E107-Y111 PolarHBondContact O-N 3Å; E107-W294 HydrophobicContact CB-CH2 4.02Å; E107-W294 HydrophobicContact CB-CZ2 3.69Å; E107-W294 HydrophobicContact CG-CZ2 4.28Å
108	V	83.8	Confident	81.2	Confident	19 Å²	19	77.3 Å²	77.3	12%	0.115	41%	0.411	C	S	.	.	H	α-helix	trans	-64.1	-40.4	174.4	-179.9	0	0	0	0	110.9	A103 G104 K112	A103-V108 HydrophobicContact CB-CG2 3.46Å; A103-V108 VanDerWaalsContact CB-CG2 3.46Å; G104-V108 PolarHBondContact O-N 2.89Å; V108-K112 HydrophobicContact CG1-CD 3.87Å; V108-K112 VanDerWaalsContact CG1-CE 3.45Å; V108-K112 HydrophobicContact CG1-CG 4.4Å; V108-K112 VanDerWaalsContact O-CB 3.27Å; V108-K112 WeakPolarHBondContact O-CB 3.45Å; V108-K112 VanDerWaalsContact O-CG 3.22Å; V108-K112 WeakPolarHBondContact O-CG 3.46Å; V108-K112 PolarHBondContact O-N 2.82Å
109	A	84	Confident	82.2	Confident	58 Å²	58	77.6 Å²	77.6	48%	0.479	41%	0.412	S	S	.	.	H	α-helix	trans	-65.7	-44.3	176	0	0	0	0	0	112.2	H105 W106 K112 S113	H105-A109 VanDerWaalsContact O-CB 3.29Å; H105-A109 WeakPolarHBondContact O-CB 3.32Å; H105-A109 PolarHBondContact O-N 2.83Å; W106-A109 PolarHBondContact O-N 3.08Å; A109-K112 CarbonylContact O-C 3.55Å; A109-K112 PolarHBondContact O-N 3.41Å; A109-S113 PolarHBondContact O-N 3.29Å
110	L	87.2	Confident	83.2	Confident	107 Å²	107	72.5 Å²	72.5	56%	0.56	38%	0.379	S	S	*	.	H	α-helix	trans	-60.2	-46.4	174.8	179.4	60.3	0	0	0	110.9	W106 E107 K112 S113	W106-L110 HydrophobicContact CZ3-CD2 4.13Å; W106-L110 VanDerWaalsContact O-CB 3.29Å; W106-L110 WeakPolarHBondContact O-CB 3.13Å; W106-L110 PolarHBondContact O-N 3.29Å; E107-L110 PolarHBondContact O-N 2.78Å; L110-K112 PolarHBondContact O-N 3.33Å; L110-S113 WeakPolarHBondContact O-CB 3.23Å; L110-S113 PolarHBondContact O-N 2.89Å; L110-S113 VanDerWaalsContact O-N 3.14Å; L110-S113 PolarHBondContact O-OG 3.04Å
111	Y	85.8	Confident	84	Confident	53 Å²	53	73.9 Å²	73.9	21%	0.208	38%	0.379	C	S	.	.	H	α-helix	trans	-66.2	-37.2	176.3	-171.9	-115.1	0	0	0	112.8	E107 S113 V114 M285 S286 M291 I295	E107-Y111 WeakPolarHBondContact O-CB 3.44Å; E107-Y111 PolarHBondContact O-N 3Å; Y111-S113 PolarHBondContact O-N 3.48Å; Y111-V114 WeakPolarHBondContact O-CB 3.04Å; Y111-V114 PolarHBondContact O-N 3.4Å; Y111-M285 HydrophobicContact CD1-CG 3.93Å; Y111-M285 HydrophobicContact CD1-SD 3.8Å; Y111-M285 HydrophobicContact CE1-CB 3.72Å; Y111-M285 HydrophobicContact CE1-CG 3.54Å; Y111-M285 HydrophobicContact CE1-SD 3.95Å; Y111-S286 PolarHBondContact OH-N 3.23Å; Y111-M291 HydrophobicContact CD1-CE 4Å; Y111-M291 HydrophobicContact CE1-CE 3.47Å; Y111-M291 VanDerWaalsContact CE1-CE 3.47Å; Y111-M291 HydrophobicContact CE2-CE 4.09Å; Y111-M291 HydrophobicContact CG-CE 4.5Å; Y111-I295 HydrophobicContact CD1-CD1 3.68Å; Y111-I295 HydrophobicContact CE1-CD1 3.97Å
112	K	84.2	Confident	84.6	Confident	84 Å²	84	68.6 Å²	68.6	37%	0.365	37%	0.367	S	S	.	.	H	α-helix	trans	-68.6	-15.8	172.4	-75.5	173.2	-178.9	171.1	0	113.9	V108 A109 L110 M285 H301	V108-K112 HydrophobicContact CG1-CD 3.87Å; V108-K112 VanDerWaalsContact CG1-CE 3.45Å; V108-K112 HydrophobicContact CG1-CG 4.4Å; V108-K112 VanDerWaalsContact O-CB 3.27Å; V108-K112 WeakPolarHBondContact O-CB 3.45Å; V108-K112 VanDerWaalsContact O-CG 3.22Å; V108-K112 WeakPolarHBondContact O-CG 3.46Å; V108-K112 PolarHBondContact O-N 2.82Å; A109-K112 CarbonylContact O-C 3.55Å; A109-K112 PolarHBondContact O-N 3.41Å; L110-K112 PolarHBondContact O-N 3.33Å; K112-M285 HydrophobicContact CG-SD 4.02Å; K112-H301 VanDerWaalsContact CE-CD2 3.49Å; K112-H301 WeakPolarHBondContact CE-CD2 3.44Å; K112-H301 PolarHBondContact NZ-CD2 3.15Å; K112-H301 PolarHBondContact NZ-NE2 3.41Å
113	S	84.6	Confident	84.7	Confident	83 Å²	83	69.2 Å²	69.2	58%	0.58	36%	0.364	S	S	*	.	H	α-helix	trans	-76.5	-23.1	173.6	80.6	0	0	0	0	113	A109 L110 Y111	A109-S113 PolarHBondContact O-N 3.29Å; L110-S113 WeakPolarHBondContact O-CB 3.23Å; L110-S113 PolarHBondContact O-N 2.89Å; L110-S113 VanDerWaalsContact O-N 3.14Å; L110-S113 PolarHBondContact O-OG 3.04Å; Y111-S113 PolarHBondContact O-N 3.48Å
114	V	86.4	Confident	84.9	Confident	58 Å²	58	68.8 Å²	68.8	35%	0.352	36%	0.361	S	S	.	.	S	Bend	trans	-62.4	128.3	173.2	-178.8	0	0	0	0	108.6	Y111 T116 L119	Y111-V114 WeakPolarHBondContact O-CB 3.04Å; Y111-V114 PolarHBondContact O-N 3.4Å; V114-T116 HydrophobicContact CB-CG2 4.36Å; V114-T116 HydrophobicContact CG1-CG2 4.16Å; V114-T116 PolarHBondContact O-N 2.9Å; V114-L119 HydrophobicContact CG1-CD1 3.93Å
115	P	84.8	Confident	85	Confident	75 Å²	75	76.4 Å²	76.4	49%	0.487	38%	0.381	S	S	.	.			trans	-77.9	58.7	-174.6	33.3	-37.7	0	0	0	112.2	R117 L118 L119	P115-R117 VanDerWaalsContact C-N 3.27Å; P115-R117 PolarHBondContact O-N 3.47Å; P115-R117 VanDerWaalsContact O-N 3.15Å; P115-L118 HydrophobicContact CB-CB 4.16Å; P115-L118 WeakPolarHBondContact O-CA 3.38Å; P115-L118 WeakPolarHBondContact O-CB 3.4Å; P115-L118 PolarHBondContact O-N 2.84Å; P115-L119 PolarHBondContact O-N 3.23Å
116	T	83.8	Confident	85.4	Confident	11 Å²	11	72.6 Å²	72.6	7%	0.067	37%	0.367	C	S	.	.	H	α-helix	trans	-52.6	-36.7	-174.5	49.1	0	0	0	0	113.9	V114 S120 L284	V114-T116 HydrophobicContact CB-CG2 4.36Å; V114-T116 HydrophobicContact CG1-CG2 4.16Å; V114-T116 PolarHBondContact O-N 2.9Å; T116-S120 VanDerWaalsContact O-CB 3.27Å; T116-S120 WeakPolarHBondContact O-CB 3.24Å; T116-S120 PolarHBondContact O-N 3.49Å; T116-S120 PolarHBondContact O-OG 3.09Å; T116-L284 VanDerWaalsContact CB-O 3.25Å; T116-L284 WeakPolarHBondContact CB-O 3.42Å; T116-L284 WeakPolarHBondContact CG2-O 3.42Å
117	R	82.8	Confident	85.5	Confident	35 Å²	35	64.6 Å²	64.6	13%	0.132	34%	0.337	C	S	.	.	H	α-helix	trans	-65.1	-41.6	173.8	-62.9	179.5	76	69.2	1.4	112.6	P115 R121 G282 L284 E303 N340 S341	P115-R117 VanDerWaalsContact C-N 3.27Å; P115-R117 PolarHBondContact O-N 3.47Å; P115-R117 VanDerWaalsContact O-N 3.15Å; R117-R121 WeakPolarHBondContact O-CB 3.43Å; R117-R121 WeakPolarHBondContact O-CG 3.09Å; R117-R121 PolarHBondContact O-N 3.36Å; R117-G282 WeakPolarHBondContact CD-O 3.47Å; R117-G282 PolarHBondContact NH1-O 3.47Å; R117-L284 HydrophobicContact CG-CD1 4.3Å; R117-L284 HydrophobicContact CG-CG 4.31Å; R117-E303 IonicContact CZ-OE2 2.55Å; R117-E303 IonicContact NH1-OE2 2.7Å; R117-E303 PolarHBondContact NH1-OE2 2.95Å; R117-E303 IonicContact NH2-OE1 3.94Å; R117-E303 IonicContact NH2-OE2 3.14Å; R117-E303 PolarHBondContact NH2-OE2 3.13Å; R117-E303 VanDerWaalsContact NH2-OE2 3.12Å; R117-N340 VanDerWaalsContact NH2-CA 3.28Å; R117-S341 PolarHBondContact NH2-O 3.33Å; R117-S341 VanDerWaalsContact NH2-O 3.07Å
118	L	85.8	Confident	85.5	Confident	105 Å²	105	67 Å²	67	55%	0.55	35%	0.348	S	S	.	.	H	α-helix	trans	-66.7	-45.5	177.1	-178.5	62.4	0	0	0	110.9	P115 R121 A122	P115-L118 HydrophobicContact CB-CB 4.16Å; P115-L118 WeakPolarHBondContact O-CA 3.38Å; P115-L118 WeakPolarHBondContact O-CB 3.4Å; P115-L118 PolarHBondContact O-N 2.84Å; L118-R121 PolarHBondContact O-N 3.05Å; L118-A122 WeakPolarHBondContact O-CB 3.41Å; L118-A122 PolarHBondContact O-N 2.87Å
119	L	86.6	Confident	85.8	Confident	85 Å²	85	70.2 Å²	70.2	45%	0.445	37%	0.368	S	S	.	.	H	α-helix	trans	-61.7	-44.4	176.8	-63.3	168.9	0	0	0	111.3	V114 P115 R121 A122 W123	V114-L119 HydrophobicContact CG1-CD1 3.93Å; P115-L119 PolarHBondContact O-N 3.23Å; L119-R121 VanDerWaalsContact C-N 3.34Å; L119-R121 PolarHBondContact O-N 3.06Å; L119-A122 PolarHBondContact O-N 3.18Å; L119-W123 VanDerWaalsContact O-CB 3.28Å; L119-W123 WeakPolarHBondContact O-CB 3.21Å; L119-W123 PolarHBondContact O-N 2.91Å
120	S	85.2	Confident	86.2	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-66.7	-32.9	178.6	-52.4	0	0	0	0	112.5	T116 G124 N325	T116-S120 VanDerWaalsContact O-CB 3.27Å; T116-S120 WeakPolarHBondContact O-CB 3.24Å; T116-S120 PolarHBondContact O-N 3.49Å; T116-S120 PolarHBondContact O-OG 3.09Å; S120-G124 PolarHBondContact O-N 3.39Å; S120-N325 PolarHBondContact OG-N 2.93Å
121	R	86.6	Confident	86.5	Confident	69 Å²	69	68.5 Å²	68.5	26%	0.26	35%	0.348	S	S	.	.	H	α-helix	trans	-71.6	-39.7	171.2	-75	-169.5	-67.2	-105.4	6.4	113.1	R117 L118 L119 G124 R125 N340 S341	R117-R121 WeakPolarHBondContact O-CB 3.43Å; R117-R121 WeakPolarHBondContact O-CG 3.09Å; R117-R121 PolarHBondContact O-N 3.36Å; L118-R121 PolarHBondContact O-N 3.05Å; L119-R121 VanDerWaalsContact C-N 3.34Å; L119-R121 PolarHBondContact O-N 3.06Å; R121-G124 PolarHBondContact O-N 2.78Å; R121-R125 WeakPolarHBondContact O-CG 3.43Å; R121-R125 PolarHBondContact O-N 2.78Å; R121-N340 WeakPolarHBondContact CG-ND2 3.29Å; R121-N340 PolarHBondContact NH1-O 2.79Å; R121-S341 PolarHBondContact NH1-O 3.01Å
122	A	86.9	Confident	86.8	Confident	58 Å²	58	68.9 Å²	68.9	48%	0.479	36%	0.357	S	S	.	.	H	α-helix	trans	-64.4	-44.2	175.2	0	0	0	0	0	111.1	L118 L119 R125 L126	L118-A122 WeakPolarHBondContact O-CB 3.41Å; L118-A122 PolarHBondContact O-N 2.87Å; L119-A122 PolarHBondContact O-N 3.18Å; A122-R125 PolarHBondContact O-N 3.2Å; A122-L126 WeakPolarHBondContact O-CB 3.21Å; A122-L126 PolarHBondContact O-N 3.25Å
123	W	86	Confident	87.1	Confident	94 Å²	94	70.6 Å²	70.6	36%	0.356	37%	0.366	S	S	.	.	H	α-helix	trans	-63.6	-44	174.3	-169	-109	0	0	0	112.2	L119 R125 L126 N127 N325	L119-W123 VanDerWaalsContact O-CB 3.28Å; L119-W123 WeakPolarHBondContact O-CB 3.21Å; L119-W123 PolarHBondContact O-N 2.91Å; W123-R125 PolarHBondContact O-N 3.38Å; W123-L126 HydrophobicContact CE3-CD2 3.96Å; W123-L126 HydrophobicContact CZ3-CD2 3.86Å; W123-L126 PolarHBondContact O-N 3.2Å; W123-N127 PolarHBondContact NE1-ND2 3.38Å; W123-N127 WeakPolarHBondContact O-CB 3.37Å; W123-N127 PolarHBondContact O-N 3.42Å; W123-N127 PolarHBondContact O-ND2 3.01Å; W123-N325 HydrophobicContact CG-CB 4.26Å
124	G	84.5	Confident	87.6	Confident	9 Å²	9	75.8 Å²	75.8	9%	0.093	37%	0.373	C	S	.	.	H	α-helix	trans	-58.5	-43.1	174.2	0	0	0	0	0	113	S120 R121 Q128	S120-G124 PolarHBondContact O-N 3.39Å; R121-G124 PolarHBondContact O-N 2.78Å; G124-Q128 VanDerWaalsContact O-CG 3.29Å; G124-Q128 WeakPolarHBondContact O-CG 3.47Å; G124-Q128 PolarHBondContact O-N 2.86Å
125	R	85.9	Confident	87.9	Confident	189 Å²	189	75.5 Å²	75.5	71%	0.713	37%	0.369	S	S	*	.	H	α-helix	trans	-64.3	-44.5	173.3	-74.1	175.4	176.3	-174	-3.3	112.1	R121 A122 W123 N127 Q128 V129	R121-R125 WeakPolarHBondContact O-CG 3.43Å; R121-R125 PolarHBondContact O-N 2.78Å; A122-R125 PolarHBondContact O-N 3.2Å; W123-R125 PolarHBondContact O-N 3.38Å; R125-N127 VanDerWaalsContact C-N 3.33Å; R125-N127 PolarHBondContact O-N 2.74Å; R125-Q128 PolarHBondContact O-N 3.4Å; R125-Q128 VanDerWaalsContact O-N 3.15Å; R125-V129 PolarHBondContact O-N 3.37Å
126	L	88.2	Confident	88.2	Confident	101 Å²	101	73.6 Å²	73.6	53%	0.529	35%	0.352	S	S	.	.	H	α-helix	trans	-59.9	-42.9	177.9	-177.8	63.6	0	0	0	111.7	A122 W123 Q128 V129	A122-L126 WeakPolarHBondContact O-CB 3.21Å; A122-L126 PolarHBondContact O-N 3.25Å; W123-L126 HydrophobicContact CE3-CD2 3.96Å; W123-L126 HydrophobicContact CZ3-CD2 3.86Å; W123-L126 PolarHBondContact O-N 3.2Å; L126-Q128 PolarHBondContact O-N 2.88Å; L126-V129 WeakPolarHBondContact O-CB 3.48Å; L126-V129 PolarHBondContact O-N 2.94Å; L126-V129 VanDerWaalsContact O-N 3.13Å
127	N	86.1	Confident	88.7	Confident	8 Å²	8	80.6 Å²	80.6	4%	0.043	38%	0.377	C	S	.	.	H	α-helix	trans	-70.9	-13.7	179.2	-62.5	-22.3	0	0	0	113.8	W123 R125 N164 L165 S166 L376	W123-N127 PolarHBondContact NE1-ND2 3.38Å; W123-N127 WeakPolarHBondContact O-CB 3.37Å; W123-N127 PolarHBondContact O-N 3.42Å; W123-N127 PolarHBondContact O-ND2 3.01Å; R125-N127 VanDerWaalsContact C-N 3.33Å; R125-N127 PolarHBondContact O-N 2.74Å; N127-N164 VanDerWaalsContact O-CB 3.25Å; N127-N164 WeakPolarHBondContact O-CB 3.25Å; N127-N164 VanDerWaalsContact O-CG 3.28Å; N127-N164 PolarHBondContact O-OD1 2.86Å; N127-L165 HydrophobicContact CB-CB 4.18Å; N127-L165 PolarHBondContact O-N 2.76Å; N127-L165 VanDerWaalsContact O-N 3.14Å; N127-S166 VanDerWaalsContact CB-OG 3.3Å; N127-S166 WeakPolarHBondContact CB-OG 3.15Å; N127-S166 WeakPolarHBondContact O-CB 3.34Å; N127-S166 PolarHBondContact O-N 2.87Å; N127-L376 VanDerWaalsContact ND2-CD1 3.34Å; N127-L376 WeakPolarHBondContact ND2-CD1 3.32Å
128	Q	87.3	Confident	89.2	Confident	107 Å²	107	82.2 Å²	82.2	50%	0.5	39%	0.392	S	S	.	.	H	α-helix	trans	-90	-15.1	173.1	-71.6	169.2	-6.5	0	0	112.8	G124 R125 L126 E130 N164	G124-Q128 VanDerWaalsContact O-CG 3.29Å; G124-Q128 WeakPolarHBondContact O-CG 3.47Å; G124-Q128 PolarHBondContact O-N 2.86Å; R125-Q128 PolarHBondContact O-N 3.4Å; R125-Q128 VanDerWaalsContact O-N 3.15Å; L126-Q128 PolarHBondContact O-N 2.88Å; Q128-E130 PolarHBondContact O-N 2.95Å; Q128-N164 PolarHBondContact O-ND2 2.86Å
129	V	90.3	Very high	89.5	Confident	86 Å²	86	79.5 Å²	79.5	52%	0.521	38%	0.38	S	S	.	.	S	Bend	trans	-63.5	129	175.1	179.9	0	0	0	0	109.6	R125 L126 L131 N164	R125-V129 PolarHBondContact O-N 3.37Å; L126-V129 WeakPolarHBondContact O-CB 3.48Å; L126-V129 PolarHBondContact O-N 2.94Å; L126-V129 VanDerWaalsContact O-N 3.13Å; V129-L131 PolarHBondContact O-N 2.99Å; V129-N164 WeakPolarHBondContact O-CB 3.46Å
130	E	92.4	Very high	89.8	Confident	95 Å²	95	75.5 Å²	75.5	44%	0.444	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-69.9	124.8	178.3	-62.8	-163.3	-127.5	0	0	111.4	Q128 R163	Q128-E130 PolarHBondContact O-N 2.95Å; E130-R163 CarbonylContact C-O 3.59Å; E130-R163 WeakPolarHBondContact CA-O 3.12Å; E130-R163 VanDerWaalsContact CD-NH2 3.26Å; E130-R163 HydrophobicContact CG-CB 4.32Å; E130-R163 IonicContact OE1-CZ 2.75Å; E130-R163 IonicContact OE1-NE 3.5Å; E130-R163 IonicContact OE1-NH2 2.65Å; E130-R163 PolarHBondContact OE1-NH2 3.3Å; E130-R163 IonicContact OE2-CZ 3.54Å; E130-R163 IonicContact OE2-NE 3.5Å; E130-R163 PolarHBondContact OE2-NE 2.82Å; E130-R163 IonicContact OE2-NH2 3.48Å; E130-R163 PolarHBondContact OE2-NH2 2.83Å; E130-R163 VanDerWaalsContact OE2-NH2 3.14Å
131	L	91.9	Very high	90.1	Very high	33 Å²	33	78 Å²	78	17%	0.173	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-78.5	133.7	177.1	-63.7	179	0	0	0	109.6	V129 L135 R136 V139 Y140 R163	V129-L131 PolarHBondContact O-N 2.99Å; L131-L135 HydrophobicContact CD2-CD2 4.17Å; L131-R136 HydrophobicContact CB-CG 3.83Å; L131-R136 PolarHBondContact O-NE 2.98Å; L131-R136 PolarHBondContact O-NH2 2.85Å; L131-V139 HydrophobicContact CD1-CB 4.09Å; L131-V139 HydrophobicContact CD1-CG1 3.89Å; L131-V139 HydrophobicContact CD1-CG2 4.48Å; L131-Y140 HydrophobicContact CD1-CE1 3.85Å; L131-R163 PolarHBondContact N-O 2.83Å
132	P	92.9	Very high	90.4	Very high	62 Å²	62	79.8 Å²	79.8	40%	0.403	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-52.4	144.6	167.7	-27.4	35.4	0	0	0	111.5	W134 L135 R136	P132-W134 HydrophobicContact CB-CG 4.47Å; P132-W134 PolarHBondContact O-N 2.85Å; P132-W134 VanDerWaalsContact O-N 3.12Å; P132-L135 HydrophobicContact CB-CB 4.4Å; P132-L135 WeakPolarHBondContact O-CA 3.47Å; P132-L135 WeakPolarHBondContact O-CB 3.45Å; P132-L135 PolarHBondContact O-N 2.79Å; P132-R136 PolarHBondContact O-N 3.36Å
133	H	91.3	Very high	90.6	Very high	119 Å²	119	78.2 Å²	78.2	55%	0.551	37%	0.372	S	S	*	.	H	α-helix	trans	-53.3	-40.2	-172	-168.4	-85.7	0	0	0	113.4	L135 H160	H133-L135 VanDerWaalsContact C-N 3.3Å; H133-L135 PolarHBondContact O-N 2.85Å; H133-H160 AromaticContact CE1-CD2 3.4Å; H133-H160 PolarHBondContact CE1-CD2 2.91Å; H133-H160 AromaticContact CE1-CG 3.74Å; H133-H160 AromaticContact ND1-CD2 3.7Å; H133-H160 AromaticContact NE2-CD2 3.94Å; H133-H160 AromaticContact NE2-CG 3.92Å
134	W	93.6	Very high	90.9	Very high	193 Å²	193	75.6 Å²	75.6	73%	0.731	37%	0.365	S	S	*	.	H	α-helix	trans	-68.2	-24.5	177.2	63.2	-98.3	0	0	0	114.1	P132 P138	P132-W134 HydrophobicContact CB-CG 4.47Å; P132-W134 PolarHBondContact O-N 2.85Å; P132-W134 VanDerWaalsContact O-N 3.12Å; W134-P138 WeakPolarHBondContact O-CD 3.39Å
135	L	92.3	Very high	91.3	Very high	51 Å²	51	85.1 Å²	85.1	27%	0.267	40%	0.398	S	S	.	.	H	α-helix	trans	-90.9	-22.7	-177.7	-172.6	60.5	0	0	0	112.6	L131 P132 H133 P138 V139	L131-L135 HydrophobicContact CD2-CD2 4.17Å; P132-L135 HydrophobicContact CB-CB 4.4Å; P132-L135 WeakPolarHBondContact O-CA 3.47Å; P132-L135 WeakPolarHBondContact O-CB 3.45Å; P132-L135 PolarHBondContact O-N 2.79Å; H133-L135 VanDerWaalsContact C-N 3.3Å; H133-L135 PolarHBondContact O-N 2.85Å; L135-P138 HydrophobicContact CD1-CG 4.38Å; L135-P138 VanDerWaalsContact O-CD 3.31Å; L135-P138 WeakPolarHBondContact O-CD 3.18Å; L135-P138 WeakPolarHBondContact O-CG 3.43Å; L135-V139 HydrophobicContact CD1-CG2 3.71Å; L135-V139 HydrophobicContact CG-CG2 3.76Å; L135-V139 WeakPolarHBondContact O-CB 3.29Å; L135-V139 WeakPolarHBondContact O-CG2 3.42Å; L135-V139 PolarHBondContact O-N 2.93Å; L135-V139 VanDerWaalsContact O-N 3.11Å
136	R	92.8	Very high	91.5	Very high	36 Å²	36	79.6 Å²	79.6	14%	0.136	39%	0.385	C	S	.	.	H	α-helix	trans	-53.1	-59.2	177.4	-71.1	175.3	-167.9	-164.5	-2.7	111.9	L131 P132 V139 Y140 H160 Y162	L131-R136 HydrophobicContact CB-CG 3.83Å; L131-R136 PolarHBondContact O-NE 2.98Å; L131-R136 PolarHBondContact O-NH2 2.85Å; P132-R136 PolarHBondContact O-N 3.36Å; R136-V139 PolarHBondContact O-N 2.93Å; R136-Y140 HydrophobicContact CB-CD2 4.04Å; R136-Y140 HydrophobicContact CB-CE2 3.67Å; R136-Y140 HydrophobicContact CG-CE2 3.94Å; R136-Y140 WeakPolarHBondContact O-CB 3.38Å; R136-Y140 WeakPolarHBondContact O-CD2 3.15Å; R136-Y140 VanDerWaalsContact O-CG 3.29Å; R136-Y140 PolarHBondContact O-N 2.68Å; R136-H160 VanDerWaalsContact CD-O 3.23Å; R136-H160 WeakPolarHBondContact CD-O 3.47Å; R136-H160 PolarHBondContact NH1-O 2.9Å; R136-Y162 WeakPolarHBondContact CD-O 3.42Å
137	R	92.4	Very high	91.5	Very high	157 Å²	157	79.1 Å²	79.1	59%	0.592	38%	0.379	S	S	*	.	H	α-helix	trans	-55.3	-53.2	-178	-172.9	177	-177.7	179.2	0.4	113.4	S141 L159	R137-S141 WeakPolarHBondContact O-CB 3.33Å; R137-S141 PolarHBondContact O-N 3.2Å; R137-S141 PolarHBondContact O-OG 3.17Å; R137-L159 HydrophobicContact CG-CD1 4.48Å
138	P	93.5	Very high	91.6	Very high	69 Å²	69	81.9 Å²	81.9	45%	0.448	41%	0.41	S	S	.	.	H	α-helix	trans	-66.1	-39.5	-179.9	23.3	-32.8	0	0	0	113.5	W134 L135 L142	W134-P138 WeakPolarHBondContact O-CD 3.39Å; L135-P138 HydrophobicContact CD1-CG 4.38Å; L135-P138 VanDerWaalsContact O-CD 3.31Å; L135-P138 WeakPolarHBondContact O-CD 3.18Å; L135-P138 WeakPolarHBondContact O-CG 3.43Å; P138-L142 WeakPolarHBondContact O-CB 3.33Å; P138-L142 PolarHBondContact O-N 2.99Å
139	V	92.6	Very high	91.8	Very high	49 Å²	49	77.2 Å²	77.2	30%	0.297	39%	0.388	S	S	.	.	H	α-helix	trans	-65.7	-47.5	179	170.4	0	0	0	0	111.4	L131 L135 R136 L142 Y143	L131-V139 HydrophobicContact CD1-CB 4.09Å; L131-V139 HydrophobicContact CD1-CG1 3.89Å; L131-V139 HydrophobicContact CD1-CG2 4.48Å; L135-V139 HydrophobicContact CD1-CG2 3.71Å; L135-V139 HydrophobicContact CG-CG2 3.76Å; L135-V139 WeakPolarHBondContact O-CB 3.29Å; L135-V139 WeakPolarHBondContact O-CG2 3.42Å; L135-V139 PolarHBondContact O-N 2.93Å; L135-V139 VanDerWaalsContact O-N 3.11Å; R136-V139 PolarHBondContact O-N 2.93Å; V139-L142 PolarHBondContact O-N 2.03Å; V139-Y143 PolarHBondContact O-N 3.15Å
140	Y	92.8	Very high	91.7	Very high	0 Å²	0	76.5 Å²	76.5	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-69.8	-37.1	178.4	-56.1	-40.1	0	0	0	111.8	L131 R136 L142 Y143 I144 L159 Y162 N164 L165 F168	L131-Y140 HydrophobicContact CD1-CE1 3.85Å; R136-Y140 HydrophobicContact CB-CD2 4.04Å; R136-Y140 HydrophobicContact CB-CE2 3.67Å; R136-Y140 HydrophobicContact CG-CE2 3.94Å; R136-Y140 WeakPolarHBondContact O-CB 3.38Å; R136-Y140 WeakPolarHBondContact O-CD2 3.15Å; R136-Y140 VanDerWaalsContact O-CG 3.29Å; R136-Y140 PolarHBondContact O-N 2.68Å; Y140-L142 PolarHBondContact O-N 3.45Å; Y140-Y143 WeakPolarHBondContact O-CB 3.49Å; Y140-Y143 PolarHBondContact O-N 2.66Å; Y140-I144 WeakPolarHBondContact O-CB 3.26Å; Y140-I144 WeakPolarHBondContact O-CD1 3.39Å; Y140-I144 WeakPolarHBondContact O-CG1 3.41Å; Y140-I144 PolarHBondContact O-N 2.91Å; Y140-L159 HydrophobicContact CD2-CB 4.13Å; Y140-L159 WeakPolarHBondContact CD2-O 3.22Å; Y140-L159 WeakPolarHBondContact CE2-O 3.24Å; Y140-Y162 WeakPolarHBondContact CE2-O 3.35Å; Y140-Y162 PolarHBondContact OH-O 2.81Å; Y140-N164 VanDerWaalsContact OH-CA 3.3Å; Y140-N164 WeakPolarHBondContact OH-CA 3.46Å; Y140-N164 PolarHBondContact OH-N 2.98Å; Y140-N164 PolarHBondContact OH-O 2.88Å; Y140-L165 HydrophobicContact CD1-CD1 3.91Å; Y140-L165 HydrophobicContact CE1-CB 4.49Å; Y140-L165 HydrophobicContact CE1-CD1 3.91Å; Y140-F168 HydrophobicContact CD1-CB 3.99Å; Y140-F168 HydrophobicContact CD1-CD1 4.21Å; Y140-F168 HydrophobicContact CD1-CD2 4.07Å; Y140-F168 AromaticContact CD1-CG 3.79Å; Y140-F168 HydrophobicContact CD1-CG 3.79Å; Y140-F168 HydrophobicContact CD2-CD2 4.42Å; Y140-F168 HydrophobicContact CE1-CB 3.77Å; Y140-F168 HydrophobicContact CE1-CG 4.12Å; Y140-F168 AromaticContact CG-CD2 3.99Å; Y140-F168 HydrophobicContact CG-CD2 3.99Å; Y140-F168 HydrophobicContact CG-CE2 4.41Å; Y140-F168 HydrophobicContact CG-CG 4.21Å
141	S	92.5	Very high	91.6	Very high	52 Å²	52	73 Å²	73	36%	0.364	37%	0.366	S	S	.	.	H	α-helix	trans	-59.9	-42.9	172.6	-70.4	0	0	0	0	112.5	R137 Y143 I144 W145	R137-S141 WeakPolarHBondContact O-CB 3.33Å; R137-S141 PolarHBondContact O-N 3.2Å; R137-S141 PolarHBondContact O-OG 3.17Å; S141-Y143 VanDerWaalsContact C-N 3.33Å; S141-Y143 PolarHBondContact O-N 2.86Å; S141-I144 PolarHBondContact O-N 3.16Å; S141-W145 WeakPolarHBondContact O-CB 3.42Å; S141-W145 PolarHBondContact O-N 2.9Å
142	L	92.5	Very high	91.5	Very high	107 Å²	107	78.9 Å²	78.9	56%	0.56	39%	0.39	S	S	*	.	H	α-helix	trans	-62.9	-40.7	175	178.7	62.4	0	0	0	111.2	P138 V139 Y140 W145 T146	P138-L142 WeakPolarHBondContact O-CB 3.33Å; P138-L142 PolarHBondContact O-N 2.99Å; V139-L142 PolarHBondContact O-N 2.03Å; Y140-L142 PolarHBondContact O-N 3.45Å; L142-W145 HydrophobicContact CD1-CE3 4.15Å; L142-T146 VanDerWaalsContact O-CB 3.29Å; L142-T146 WeakPolarHBondContact O-CB 3.2Å; L142-T146 PolarHBondContact O-N 3.49Å; L142-T146 PolarHBondContact O-OG1 2.92Å
143	Y	90.4	Very high	91.4	Very high	26 Å²	26	77.4 Å²	77.4	10%	0.102	38%	0.378	C	S	.	.	H	α-helix	trans	-63.9	-46.7	175.5	-164.2	-78.4	0	0	0	112	V139 Y140 S141 W145 T146 F147 V149 L165 F168 F169 P260	V139-Y143 PolarHBondContact O-N 3.15Å; Y140-Y143 WeakPolarHBondContact O-CB 3.49Å; Y140-Y143 PolarHBondContact O-N 2.66Å; S141-Y143 VanDerWaalsContact C-N 3.33Å; S141-Y143 PolarHBondContact O-N 2.86Å; Y143-W145 VanDerWaalsContact C-N 3.33Å; Y143-W145 PolarHBondContact O-N 2.77Å; Y143-T146 PolarHBondContact O-N 2.68Å; Y143-F147 HydrophobicContact CD1-CB 4.49Å; Y143-F147 AromaticContact CD1-CD2 3.66Å; Y143-F147 HydrophobicContact CD1-CD2 3.66Å; Y143-F147 HydrophobicContact CD1-CE2 4.44Å; Y143-F147 AromaticContact CD2-CD2 3.82Å; Y143-F147 HydrophobicContact CD2-CD2 3.82Å; Y143-F147 AromaticContact CD2-CE2 3.77Å; Y143-F147 HydrophobicContact CD2-CE2 3.77Å; Y143-F147 HydrophobicContact CE1-CB 4.22Å; Y143-F147 AromaticContact CE1-CD2 3.51Å; Y143-F147 HydrophobicContact CE1-CD2 3.51Å; Y143-F147 HydrophobicContact CE1-CE2 4.24Å; Y143-F147 HydrophobicContact CE1-CG 4.16Å; Y143-F147 AromaticContact CE2-CD2 3.68Å; Y143-F147 HydrophobicContact CE2-CD2 3.68Å; Y143-F147 AromaticContact CE2-CE2 3.54Å; Y143-F147 HydrophobicContact CE2-CE2 3.54Å; Y143-F147 AromaticContact CG-CD2 3.81Å; Y143-F147 HydrophobicContact CG-CD2 3.81Å; Y143-F147 HydrophobicContact CG-CE2 4.22Å; Y143-F147 AromaticContact CZ-CD2 3.51Å; Y143-F147 AromaticContact CZ-CE2 3.78Å; Y143-F147 WeakPolarHBondContact O-CD2 3.43Å; Y143-F147 PolarHBondContact O-N 3.26Å; Y143-V149 HydrophobicContact CD1-CG2 4.05Å; Y143-V149 HydrophobicContact CE1-CG2 4.13Å; Y143-L165 HydrophobicContact CD2-CD1 3.94Å; Y143-L165 HydrophobicContact CD2-CD2 4.29Å; Y143-L165 HydrophobicContact CE2-CD1 4.28Å; Y143-L165 HydrophobicContact CE2-CD2 4.25Å; Y143-L165 HydrophobicContact CG-CD1 4.36Å; Y143-F168 HydrophobicContact CD1-CD1 4.41Å; Y143-F168 AromaticContact CD1-CE1 3.68Å; Y143-F168 HydrophobicContact CD1-CE1 3.68Å; Y143-F168 HydrophobicContact CE1-CE1 4.21Å; Y143-F168 HydrophobicContact CG-CE1 4.28Å; Y143-F169 WeakPolarHBondContact OH-CD2 3.47Å; Y143-F169 WeakPolarHBondContact OH-CE2 3.46Å; Y143-P260 PolarHBondContact OH-O 3.19Å
144	I	92.2	Very high	91.4	Very high	38 Å²	38	71.8 Å²	71.8	20%	0.195	35%	0.351	C	S	.	.	H	α-helix	trans	-57.3	-47.2	177.5	-71.8	159	0	0	0	110.6	Y140 S141 G148 V149 M151 L159 F168	Y140-I144 WeakPolarHBondContact O-CB 3.26Å; Y140-I144 WeakPolarHBondContact O-CD1 3.39Å; Y140-I144 WeakPolarHBondContact O-CG1 3.41Å; Y140-I144 PolarHBondContact O-N 2.91Å; S141-I144 PolarHBondContact O-N 3.16Å; I144-G148 WeakPolarHBondContact O-CA 3.31Å; I144-G148 PolarHBondContact O-N 2.83Å; I144-V149 HydrophobicContact CB-CB 4.37Å; I144-V149 HydrophobicContact CG1-CB 4Å; I144-V149 HydrophobicContact CG1-CG1 4.34Å; I144-V149 HydrophobicContact CG2-CB 4.44Å; I144-V149 PolarHBondContact O-N 3.41Å; I144-M151 HydrophobicContact CD1-CG 3.57Å; I144-M151 HydrophobicContact CD1-SD 4.12Å; I144-M151 HydrophobicContact CG1-CG 4.05Å; I144-M151 HydrophobicContact CG1-SD 4.41Å; I144-L159 HydrophobicContact CD1-CD1 3.9Å; I144-L159 HydrophobicContact CD1-CD2 3.67Å; I144-L159 HydrophobicContact CD1-CG 4.46Å; I144-F168 HydrophobicContact CD1-CE2 4.21Å; I144-F168 HydrophobicContact CD1-CZ 4.04Å; I144-F168 HydrophobicContact CG1-CE2 4.38Å; I144-F168 HydrophobicContact CG1-CZ 3.71Å
145	W	92.9	Very high	91.2	Very high	209 Å²	209	65.2 Å²	65.2	79%	0.792	34%	0.338	S	S	*	.	H	α-helix	trans	-65.2	-43.9	177	177.7	82.9	0	0	0	112.6	S141 L142 Y143 F147	S141-W145 WeakPolarHBondContact O-CB 3.42Å; S141-W145 PolarHBondContact O-N 2.9Å; L142-W145 HydrophobicContact CD1-CE3 4.15Å; Y143-W145 VanDerWaalsContact C-N 3.33Å; Y143-W145 PolarHBondContact O-N 2.77Å; W145-F147 PolarHBondContact O-N 3.34Å
146	T	90.4	Very high	91.2	Very high	73 Å²	73	65.6 Å²	65.6	45%	0.448	34%	0.343	S	S	.	.	H	α-helix	trans	-67.7	-35.4	-177.7	-56.5	0	0	0	0	112.8	L142 Y143	L142-T146 VanDerWaalsContact O-CB 3.29Å; L142-T146 WeakPolarHBondContact O-CB 3.2Å; L142-T146 PolarHBondContact O-N 3.49Å; L142-T146 PolarHBondContact O-OG1 2.92Å; Y143-T146 PolarHBondContact O-N 2.68Å
147	F	88.4	Confident	91	Very high	92 Å²	92	68.5 Å²	68.5	40%	0.404	36%	0.358	S	S	.	.	H	α-helix	trans	-115.3	0.2	-171.7	-61.2	-67.9	0	0	0	115	Y143 W145 V149 P260	Y143-F147 HydrophobicContact CD1-CB 4.49Å; Y143-F147 AromaticContact CD1-CD2 3.66Å; Y143-F147 HydrophobicContact CD1-CD2 3.66Å; Y143-F147 HydrophobicContact CD1-CE2 4.44Å; Y143-F147 AromaticContact CD2-CD2 3.82Å; Y143-F147 HydrophobicContact CD2-CD2 3.82Å; Y143-F147 AromaticContact CD2-CE2 3.77Å; Y143-F147 HydrophobicContact CD2-CE2 3.77Å; Y143-F147 HydrophobicContact CE1-CB 4.22Å; Y143-F147 AromaticContact CE1-CD2 3.51Å; Y143-F147 HydrophobicContact CE1-CD2 3.51Å; Y143-F147 HydrophobicContact CE1-CE2 4.24Å; Y143-F147 HydrophobicContact CE1-CG 4.16Å; Y143-F147 AromaticContact CE2-CD2 3.68Å; Y143-F147 HydrophobicContact CE2-CD2 3.68Å; Y143-F147 AromaticContact CE2-CE2 3.54Å; Y143-F147 HydrophobicContact CE2-CE2 3.54Å; Y143-F147 AromaticContact CG-CD2 3.81Å; Y143-F147 HydrophobicContact CG-CD2 3.81Å; Y143-F147 HydrophobicContact CG-CE2 4.22Å; Y143-F147 AromaticContact CZ-CD2 3.51Å; Y143-F147 AromaticContact CZ-CE2 3.78Å; Y143-F147 WeakPolarHBondContact O-CD2 3.43Å; Y143-F147 PolarHBondContact O-N 3.26Å; W145-F147 PolarHBondContact O-N 3.34Å; F147-V149 HydrophobicContact CB-CG2 4.45Å; F147-P260 HydrophobicContact CD1-CB 3.78Å; F147-P260 HydrophobicContact CD1-CG 4.23Å; F147-P260 HydrophobicContact CE1-CB 3.96Å; F147-P260 HydrophobicContact CE1-CG 4.12Å; F147-P260 HydrophobicContact CG-CB 4.13Å; F147-P260 HydrophobicContact CZ-CB 4.46Å
148	G	89.2	Confident	91	Very high	66 Å²	66	64 Å²	64	68%	0.68	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	33.2	175.9	0	0	0	0	0	114.5	I144 N150	I144-G148 WeakPolarHBondContact O-CA 3.31Å; I144-G148 PolarHBondContact O-N 2.83Å; G148-N150 PolarHBondContact O-N 2.79Å
149	V	89.8	Confident	90.8	Very high	8 Å²	8	61.7 Å²	61.7	5%	0.048	33%	0.329	C	S	.	.			trans	-67.7	118.2	-176	175.6	0	0	0	0	111.1	Y143 I144 F147 M151 F168	Y143-V149 HydrophobicContact CD1-CG2 4.05Å; Y143-V149 HydrophobicContact CE1-CG2 4.13Å; I144-V149 HydrophobicContact CB-CB 4.37Å; I144-V149 HydrophobicContact CG1-CB 4Å; I144-V149 HydrophobicContact CG1-CG1 4.34Å; I144-V149 HydrophobicContact CG2-CB 4.44Å; I144-V149 PolarHBondContact O-N 3.41Å; F147-V149 HydrophobicContact CB-CG2 4.45Å; V149-M151 HydrophobicContact CG1-CG 4.36Å; V149-M151 HydrophobicContact CG1-SD 3.82Å; V149-M151 PolarHBondContact O-N 3.15Å; V149-M151 VanDerWaalsContact O-N 3.16Å; V149-F168 HydrophobicContact CG1-CZ 4.18Å
150	N	89.4	Confident	90.7	Very high	71 Å²	71	61.5 Å²	61.5	38%	0.38	33%	0.325	S	S	.	.			trans	-78.8	99	171.8	-170.1	5.8	0	0	0	111.5	G148 K152 E153	G148-N150 PolarHBondContact O-N 2.79Å; N150-K152 VanDerWaalsContact C-N 3.32Å; N150-K152 PolarHBondContact O-N 2.75Å; N150-K152 WeakPolarHBondContact OD1-CB 3.31Å; N150-K152 PolarHBondContact OD1-N 3.1Å; N150-K152 VanDerWaalsContact OD1-N 3.15Å; N150-E153 VanDerWaalsContact ND2-CD 3.31Å; N150-E153 WeakPolarHBondContact ND2-CG 3.37Å; N150-E153 PolarHBondContact ND2-OE1 2.86Å
151	M	89.4	Confident	90.6	Very high	23 Å²	23	67.5 Å²	67.5	11%	0.113	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-70.3	-22.6	177.3	-72.3	-55.6	-60.1	0	0	114.2	I144 V149 E153 A154 L159 Y162 F168	I144-M151 HydrophobicContact CD1-CG 3.57Å; I144-M151 HydrophobicContact CD1-SD 4.12Å; I144-M151 HydrophobicContact CG1-CG 4.05Å; I144-M151 HydrophobicContact CG1-SD 4.41Å; V149-M151 HydrophobicContact CG1-CG 4.36Å; V149-M151 HydrophobicContact CG1-SD 3.82Å; V149-M151 PolarHBondContact O-N 3.15Å; V149-M151 VanDerWaalsContact O-N 3.16Å; M151-E153 PolarHBondContact O-N 3.5Å; M151-E153 VanDerWaalsContact O-N 3.1Å; M151-A154 HydrophobicContact CE-CB 3.87Å; M151-A154 WeakPolarHBondContact O-CB 3.44Å; M151-A154 PolarHBondContact O-N 2.81Å; M151-L159 HydrophobicContact CE-CD2 3.88Å; M151-L159 HydrophobicContact CG-CD2 4.4Å; M151-L159 HydrophobicContact SD-CD2 4.35Å; M151-Y162 HydrophobicContact CE-CE2 4.08Å; M151-F168 HydrophobicContact CE-CE2 4.09Å; M151-F168 HydrophobicContact SD-CE2 3.59Å; M151-F168 VanDerWaalsContact SD-CE2 3.59Å; M151-F168 HydrophobicContact SD-CZ 3.86Å
152	K	90.4	Very high	90.5	Very high	156 Å²	156	65.6 Å²	65.6	68%	0.678	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-63.1	-21.1	179.9	-62.2	-176.1	176.5	-176.1	0	113.2	N150 K174	N150-K152 VanDerWaalsContact C-N 3.32Å; N150-K152 PolarHBondContact O-N 2.75Å; N150-K152 WeakPolarHBondContact OD1-CB 3.31Å; N150-K152 PolarHBondContact OD1-N 3.1Å; N150-K152 VanDerWaalsContact OD1-N 3.15Å; K152-K174 WeakPolarHBondContact O-CE 3.42Å; K152-K174 PolarHBondContact O-NZ 3.16Å
153	E	91.1	Very high	90.5	Very high	31 Å²	31	66.6 Å²	66.6	15%	0.145	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-89.6	-13.4	178.2	-65	173.5	-156	0	0	112.6	N150 M151 L173 K174 A177 R178 R401	N150-E153 VanDerWaalsContact ND2-CD 3.31Å; N150-E153 WeakPolarHBondContact ND2-CG 3.37Å; N150-E153 PolarHBondContact ND2-OE1 2.86Å; M151-E153 PolarHBondContact O-N 3.5Å; M151-E153 VanDerWaalsContact O-N 3.1Å; E153-L173 HydrophobicContact CB-CD2 4.36Å; E153-L173 CarbonylContact O-C 3.52Å; E153-L173 VanDerWaalsContact O-CA 3.3Å; E153-L173 WeakPolarHBondContact O-CA 3.45Å; E153-K174 PolarHBondContact O-N 3.12Å; E153-A177 HydrophobicContact CB-CB 4.11Å; E153-A177 HydrophobicContact CG-CB 4.35Å; E153-R178 IonicContact OE2-CZ 2.74Å; E153-R178 IonicContact OE2-NH1 2.75Å; E153-R178 PolarHBondContact OE2-NH1 2.88Å; E153-R178 IonicContact OE2-NH2 3.57Å; E153-R178 PolarHBondContact OE2-NH2 2.65Å; E153-R401 IonicContact OE1-NH2 2.61Å; E153-R401 PolarHBondContact OE1-NH2 2.93Å
154	A	90.6	Very high	90.5	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-74.7	144.8	178.6	0	0	0	0	0	111.8	M151 V156 K174	M151-A154 HydrophobicContact CE-CB 3.87Å; M151-A154 WeakPolarHBondContact O-CB 3.44Å; M151-A154 PolarHBondContact O-N 2.81Å; A154-V156 PolarHBondContact O-N 2.76Å; A154-K174 WeakPolarHBondContact O-CE 3.35Å; A154-K174 WeakPolarHBondContact O-CG 3Å
155	A	90.1	Very high	90.3	Very high	55 Å²	55	65.8 Å²	65.8	46%	0.455	33%	0.332	S	S	.	.	S	Bend	trans	-65.9	-26.5	177.9	0	0	0	0	0	112.9	K172	A155-K172 HydrophobicContact CB-CB 4.1Å; A155-K172 WeakPolarHBondContact CB-O 3.35Å; A155-K172 PolarHBondContact N-O 3.15Å
156	V	90.9	Very high	90	Very high	59 Å²	59	56 Å²	56	36%	0.358	30%	0.295	S	S	.	.			trans	-124.7	113.7	172.6	-178.3	0	0	0	0	107.9	A154 H161 Y162	A154-V156 PolarHBondContact O-N 2.76Å; V156-H161 HydrophobicContact CG1-CB 3.77Å; V156-Y162 PolarHBondContact O-OH 3.06Å
157	E	90.1	Very high	89.9	Confident	98 Å²	98	56.1 Å²	56.1	46%	0.458	29%	0.291	S	S	.	.			trans	-84.6	-26.5	-178.9	-62.8	-166.9	-138.2	0	0	112.8	L159 K174	E157-L159 PolarHBondContact O-N 3.35Å; E157-K174 IonicContact OE1-NZ 3.71Å; E157-K174 PolarHBondContact OE1-NZ 2.98Å
158	D	90.9	Very high	90	Very high	62 Å²	62	51.8 Å²	51.8	33%	0.332	27%	0.272	S	S	.	.			trans	-71.4	128.9	178.4	173.6	49.9	0	0	0	112.2	H160 H161 Y162	D158-H160 VanDerWaalsContact C-N 3.33Å; D158-H160 PolarHBondContact O-N 3.1Å; D158-H160 IonicContact OD1-CE1 3.34Å; D158-H160 IonicContact OD1-CG 2.66Å; D158-H160 PolarHBondContact OD1-N 2.7Å; D158-H160 IonicContact OD1-ND1 3.12Å; D158-H160 PolarHBondContact OD1-ND1 2.73Å; D158-H160 WeakPolarHBondContact OD2-CB 3.3Å; D158-H160 IonicContact OD2-CG 3.8Å; D158-H160 PolarHBondContact OD2-N 2.69Å; D158-H160 VanDerWaalsContact OD2-N 3.16Å; D158-H160 IonicContact OD2-ND1 3.47Å; D158-H161 IonicContact OD2-CE1 3.68Å; D158-H161 IonicContact OD2-CG 2.68Å; D158-H161 PolarHBondContact OD2-N 2.91Å; D158-H161 IonicContact OD2-ND1 3.49Å; D158-H161 PolarHBondContact OD2-ND1 3.29Å; D158-Y162 WeakPolarHBondContact O-CE2 3.27Å
159	L	90.5	Very high	89.8	Confident	21 Å²	21	48.7 Å²	48.7	11%	0.11	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-18	-176.8	-58	-175.2	0	0	0	113	R137 Y140 I144 M151 E157 F168	R137-L159 HydrophobicContact CG-CD1 4.48Å; Y140-L159 HydrophobicContact CD2-CB 4.13Å; Y140-L159 WeakPolarHBondContact CD2-O 3.22Å; Y140-L159 WeakPolarHBondContact CE2-O 3.24Å; I144-L159 HydrophobicContact CD1-CD1 3.9Å; I144-L159 HydrophobicContact CD1-CD2 3.67Å; I144-L159 HydrophobicContact CD1-CG 4.46Å; M151-L159 HydrophobicContact CE-CD2 3.88Å; M151-L159 HydrophobicContact CG-CD2 4.4Å; M151-L159 HydrophobicContact SD-CD2 4.35Å; E157-L159 PolarHBondContact O-N 3.35Å; L159-F168 HydrophobicContact CD2-CE2 4.02Å
160	H	89.8	Confident	89.5	Confident	45 Å²	45	51.7 Å²	51.7	21%	0.208	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-22.8	-178.5	-51.4	88.4	0	0	0	113.3	H133 R136 D158 Y162	H133-H160 AromaticContact CE1-CD2 3.4Å; H133-H160 PolarHBondContact CE1-CD2 2.91Å; H133-H160 AromaticContact CE1-CG 3.74Å; H133-H160 AromaticContact ND1-CD2 3.7Å; H133-H160 AromaticContact NE2-CD2 3.94Å; H133-H160 AromaticContact NE2-CG 3.92Å; R136-H160 VanDerWaalsContact CD-O 3.23Å; R136-H160 WeakPolarHBondContact CD-O 3.47Å; R136-H160 PolarHBondContact NH1-O 2.9Å; D158-H160 VanDerWaalsContact C-N 3.33Å; D158-H160 PolarHBondContact O-N 3.1Å; D158-H160 IonicContact OD1-CE1 3.34Å; D158-H160 IonicContact OD1-CG 2.66Å; D158-H160 PolarHBondContact OD1-N 2.7Å; D158-H160 IonicContact OD1-ND1 3.12Å; D158-H160 PolarHBondContact OD1-ND1 2.73Å; D158-H160 WeakPolarHBondContact OD2-CB 3.3Å; D158-H160 IonicContact OD2-CG 3.8Å; D158-H160 PolarHBondContact OD2-N 2.69Å; D158-H160 VanDerWaalsContact OD2-N 3.16Å; D158-H160 IonicContact OD2-ND1 3.47Å; H160-Y162 VanDerWaalsContact C-N 3.33Å; H160-Y162 PolarHBondContact O-N 2.73Å
161	H	91.2	Very high	89.5	Confident	125 Å²	125	48.9 Å²	48.9	58%	0.579	23%	0.234	S	C	*	.	S	Bend	trans	-62.4	-37.4	176.8	-79.1	64.4	0	0	0	112.7	V156 D158 R163	V156-H161 HydrophobicContact CG1-CB 3.77Å; D158-H161 IonicContact OD2-CE1 3.68Å; D158-H161 IonicContact OD2-CG 2.68Å; D158-H161 PolarHBondContact OD2-N 2.91Å; D158-H161 IonicContact OD2-ND1 3.49Å; D158-H161 PolarHBondContact OD2-ND1 3.29Å; H161-R163 PolarHBondContact O-N 3Å
162	Y	91.4	Very high	89.5	Confident	13 Å²	13	55.2 Å²	55.2	5%	0.051	26%	0.261	C	S	.	.			trans	-70.4	114.2	179.7	-58.7	-81.2	0	0	0	111.6	R136 Y140 M151 V156 D158 H160 E167 F168 R171	R136-Y162 WeakPolarHBondContact CD-O 3.42Å; Y140-Y162 WeakPolarHBondContact CE2-O 3.35Å; Y140-Y162 PolarHBondContact OH-O 2.81Å; M151-Y162 HydrophobicContact CE-CE2 4.08Å; V156-Y162 PolarHBondContact O-OH 3.06Å; D158-Y162 WeakPolarHBondContact O-CE2 3.27Å; H160-Y162 VanDerWaalsContact C-N 3.33Å; H160-Y162 PolarHBondContact O-N 2.73Å; Y162-E167 HydrophobicContact CD1-CG 4.17Å; Y162-F168 VanDerWaalsContact CD1-CA 3.44Å; Y162-F168 HydrophobicContact CD1-CB 4.09Å; Y162-F168 HydrophobicContact CD1-CD2 4.47Å; Y162-F168 AromaticContact CD2-CD2 3.91Å; Y162-F168 HydrophobicContact CD2-CD2 3.91Å; Y162-F168 HydrophobicContact CE2-CD2 4.14Å; Y162-F168 HydrophobicContact CG-CB 4.05Å; Y162-F168 HydrophobicContact CG-CD2 4.08Å; Y162-R171 HydrophobicContact CE1-CB 3.78Å; Y162-R171 WeakPolarHBondContact OH-CB 3.44Å
163	R	91.4	Very high	89.5	Confident	127 Å²	127	48.9 Å²	48.9	48%	0.479	23%	0.234	S	C	.	.			trans	-69.5	-39.3	-176.1	-61.1	171.1	69.8	165.9	-1	112.4	E130 L131 H161 E167	E130-R163 CarbonylContact C-O 3.59Å; E130-R163 WeakPolarHBondContact CA-O 3.12Å; E130-R163 VanDerWaalsContact CD-NH2 3.26Å; E130-R163 HydrophobicContact CG-CB 4.32Å; E130-R163 IonicContact OE1-CZ 2.75Å; E130-R163 IonicContact OE1-NE 3.5Å; E130-R163 IonicContact OE1-NH2 2.65Å; E130-R163 PolarHBondContact OE1-NH2 3.3Å; E130-R163 IonicContact OE2-CZ 3.54Å; E130-R163 IonicContact OE2-NE 3.5Å; E130-R163 PolarHBondContact OE2-NE 2.82Å; E130-R163 IonicContact OE2-NH2 3.48Å; E130-R163 PolarHBondContact OE2-NH2 2.83Å; E130-R163 VanDerWaalsContact OE2-NH2 3.14Å; L131-R163 PolarHBondContact N-O 2.83Å; H161-R163 PolarHBondContact O-N 3Å; R163-E167 VanDerWaalsContact CB-OE2 3.32Å; R163-E167 WeakPolarHBondContact CB-OE2 3.12Å; R163-E167 PolarHBondContact N-OE2 3.32Å
164	N	90.9	Very high	89.5	Confident	25 Å²	25	50 Å²	50	13%	0.134	24%	0.239	C	C	.	.	S	Bend	trans	-145.9	169.6	-177.8	66.7	37.1	0	0	0	112.5	N127 Q128 V129 Y140 S166 E167 F168	N127-N164 VanDerWaalsContact O-CB 3.25Å; N127-N164 WeakPolarHBondContact O-CB 3.25Å; N127-N164 VanDerWaalsContact O-CG 3.28Å; N127-N164 PolarHBondContact O-OD1 2.86Å; Q128-N164 PolarHBondContact O-ND2 2.86Å; V129-N164 WeakPolarHBondContact O-CB 3.46Å; Y140-N164 VanDerWaalsContact OH-CA 3.3Å; Y140-N164 WeakPolarHBondContact OH-CA 3.46Å; Y140-N164 PolarHBondContact OH-N 2.98Å; Y140-N164 PolarHBondContact OH-O 2.88Å; N164-S166 VanDerWaalsContact C-N 3.31Å; N164-S166 PolarHBondContact O-N 3.1Å; N164-S166 PolarHBondContact OD1-N 2.93Å; N164-E167 WeakPolarHBondContact O-CB 3.31Å; N164-E167 PolarHBondContact O-N 2.93Å; N164-E167 VanDerWaalsContact O-N 3.14Å; N164-E167 PolarHBondContact OD1-N 2.88Å; N164-F168 PolarHBondContact O-N 2.95Å; N164-F168 VanDerWaalsContact O-N 3.15Å
165	L	87.6	Confident	89.2	Confident	22 Å²	22	55.8 Å²	55.8	12%	0.115	28%	0.276	C	S	.	.	H	α-helix	trans	-67.2	-30.8	-175.7	-168.1	64.7	0	0	0	112.6	N127 Y140 Y143 E167 F168 F169	N127-L165 HydrophobicContact CB-CB 4.18Å; N127-L165 PolarHBondContact O-N 2.76Å; N127-L165 VanDerWaalsContact O-N 3.14Å; Y140-L165 HydrophobicContact CD1-CD1 3.91Å; Y140-L165 HydrophobicContact CE1-CB 4.49Å; Y140-L165 HydrophobicContact CE1-CD1 3.91Å; Y143-L165 HydrophobicContact CD2-CD1 3.94Å; Y143-L165 HydrophobicContact CD2-CD2 4.29Å; Y143-L165 HydrophobicContact CE2-CD1 4.28Å; Y143-L165 HydrophobicContact CE2-CD2 4.25Å; Y143-L165 HydrophobicContact CG-CD1 4.36Å; L165-E167 VanDerWaalsContact C-N 3.26Å; L165-E167 PolarHBondContact O-N 2.94Å; L165-F168 HydrophobicContact CD1-CB 4.47Å; L165-F168 HydrophobicContact CD1-CD1 3.99Å; L165-F168 PolarHBondContact O-N 3.01Å; L165-F169 WeakPolarHBondContact O-CB 3.4Å; L165-F169 PolarHBondContact O-N 2.95Å
166	S	86.7	Confident	89	Confident	3 Å²	3	60.3 Å²	60.3	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-67.7	-22.5	174	-79.4	0	0	0	0	113.8	N127 N164 R170	N127-S166 VanDerWaalsContact CB-OG 3.3Å; N127-S166 WeakPolarHBondContact CB-OG 3.15Å; N127-S166 WeakPolarHBondContact O-CB 3.34Å; N127-S166 PolarHBondContact O-N 2.87Å; N164-S166 VanDerWaalsContact C-N 3.31Å; N164-S166 PolarHBondContact O-N 3.1Å; N164-S166 PolarHBondContact OD1-N 2.93Å; S166-R170 PolarHBondContact O-NE 2.84Å; S166-R170 PolarHBondContact O-NH2 2.91Å
167	E	88.3	Confident	88.9	Confident	77 Å²	77	58.6 Å²	58.6	36%	0.36	28%	0.28	S	S	.	.	H	α-helix	trans	-81.9	-47.2	172	-166.6	179.1	-161	0	0	110.9	Y162 R163 N164 L165 F169 R170 R171	Y162-E167 HydrophobicContact CD1-CG 4.17Å; R163-E167 VanDerWaalsContact CB-OE2 3.32Å; R163-E167 WeakPolarHBondContact CB-OE2 3.12Å; R163-E167 PolarHBondContact N-OE2 3.32Å; N164-E167 WeakPolarHBondContact O-CB 3.31Å; N164-E167 PolarHBondContact O-N 2.93Å; N164-E167 VanDerWaalsContact O-N 3.14Å; N164-E167 PolarHBondContact OD1-N 2.88Å; L165-E167 VanDerWaalsContact C-N 3.26Å; L165-E167 PolarHBondContact O-N 2.94Å; E167-F169 VanDerWaalsContact C-N 3.26Å; E167-F169 PolarHBondContact O-N 3.2Å; E167-R170 CarbonylContact O-C 3.45Å; E167-R170 VanDerWaalsContact O-C 3.32Å; E167-R170 PolarHBondContact O-N 2.86Å; E167-R170 VanDerWaalsContact O-N 3.15Å; E167-R171 PolarHBondContact O-N 2.88Å; E167-R171 VanDerWaalsContact O-N 3.1Å
168	F	89.4	Confident	88.8	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-56.6	-40	173.9	176.8	-93	0	0	0	112.6	Y140 Y143 I144 V149 M151 L159 Y162 N164 L165 R170 R171	Y140-F168 HydrophobicContact CD1-CB 3.99Å; Y140-F168 HydrophobicContact CD1-CD1 4.21Å; Y140-F168 HydrophobicContact CD1-CD2 4.07Å; Y140-F168 AromaticContact CD1-CG 3.79Å; Y140-F168 HydrophobicContact CD1-CG 3.79Å; Y140-F168 HydrophobicContact CD2-CD2 4.42Å; Y140-F168 HydrophobicContact CE1-CB 3.77Å; Y140-F168 HydrophobicContact CE1-CG 4.12Å; Y140-F168 AromaticContact CG-CD2 3.99Å; Y140-F168 HydrophobicContact CG-CD2 3.99Å; Y140-F168 HydrophobicContact CG-CE2 4.41Å; Y140-F168 HydrophobicContact CG-CG 4.21Å; Y143-F168 HydrophobicContact CD1-CD1 4.41Å; Y143-F168 AromaticContact CD1-CE1 3.68Å; Y143-F168 HydrophobicContact CD1-CE1 3.68Å; Y143-F168 HydrophobicContact CE1-CE1 4.21Å; Y143-F168 HydrophobicContact CG-CE1 4.28Å; I144-F168 HydrophobicContact CD1-CE2 4.21Å; I144-F168 HydrophobicContact CD1-CZ 4.04Å; I144-F168 HydrophobicContact CG1-CE2 4.38Å; I144-F168 HydrophobicContact CG1-CZ 3.71Å; V149-F168 HydrophobicContact CG1-CZ 4.18Å; M151-F168 HydrophobicContact CE-CE2 4.09Å; M151-F168 HydrophobicContact SD-CE2 3.59Å; M151-F168 VanDerWaalsContact SD-CE2 3.59Å; M151-F168 HydrophobicContact SD-CZ 3.86Å; L159-F168 HydrophobicContact CD2-CE2 4.02Å; Y162-F168 VanDerWaalsContact CD1-CA 3.44Å; Y162-F168 HydrophobicContact CD1-CB 4.09Å; Y162-F168 HydrophobicContact CD1-CD2 4.47Å; Y162-F168 AromaticContact CD2-CD2 3.91Å; Y162-F168 HydrophobicContact CD2-CD2 3.91Å; Y162-F168 HydrophobicContact CE2-CD2 4.14Å; Y162-F168 HydrophobicContact CG-CB 4.05Å; Y162-F168 HydrophobicContact CG-CD2 4.08Å; N164-F168 PolarHBondContact O-N 2.95Å; N164-F168 VanDerWaalsContact O-N 3.15Å; L165-F168 HydrophobicContact CD1-CB 4.47Å; L165-F168 HydrophobicContact CD1-CD1 3.99Å; L165-F168 PolarHBondContact O-N 3.01Å; F168-R170 PolarHBondContact O-N 2.87Å; F168-R171 VanDerWaalsContact O-CB 3.32Å; F168-R171 WeakPolarHBondContact O-CB 3.47Å; F168-R171 WeakPolarHBondContact O-CD 3.45Å; F168-R171 WeakPolarHBondContact O-CG 3.02Å; F168-R171 PolarHBondContact O-N 2.85Å
169	F	85.6	Confident	88.7	Confident	2 Å²	2	57 Å²	57	1%	0.009	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-38.2	178.6	-167.4	-93.9	0	0	0	112.6	Y143 L165 E167 R171 P260 H264 L376	Y143-F169 WeakPolarHBondContact OH-CD2 3.47Å; Y143-F169 WeakPolarHBondContact OH-CE2 3.46Å; L165-F169 WeakPolarHBondContact O-CB 3.4Å; L165-F169 PolarHBondContact O-N 2.95Å; E167-F169 VanDerWaalsContact C-N 3.26Å; E167-F169 PolarHBondContact O-N 3.2Å; F169-R171 VanDerWaalsContact C-N 3.32Å; F169-P260 WeakPolarHBondContact CE2-O 3.32Å; F169-H264 HydrophobicContact CD1-CB 4.11Å; F169-H264 HydrophobicContact CE1-CB 3.38Å; F169-H264 AromaticContact CE1-CD2 3.62Å; F169-H264 AromaticContact CE1-CG 3.21Å; F169-H264 AromaticContact CE1-ND1 3.53Å; F169-H264 AromaticContact CE2-CE1 3.8Å; F169-H264 AromaticContact CE2-ND1 3.86Å; F169-H264 HydrophobicContact CZ-CB 4.01Å; F169-H264 AromaticContact CZ-CD2 3.4Å; F169-H264 WeakPolarHBondContact CZ-CD2 3.28Å; F169-H264 AromaticContact CZ-CE1 3.29Å; F169-H264 WeakPolarHBondContact CZ-CE1 3.19Å; F169-H264 AromaticContact CZ-CG 3.28Å; F169-H264 AromaticContact CZ-ND1 3.22Å; F169-H264 WeakPolarHBondContact CZ-ND1 3.16Å; F169-H264 AromaticContact CZ-NE2 3.39Å; F169-H264 WeakPolarHBondContact CZ-NE2 3.39Å; F169-L376 HydrophobicContact CD2-CG 4.46Å; F169-L376 HydrophobicContact CE1-CB 4.48Å; F169-L376 HydrophobicContact CE1-CG 4.43Å; F169-L376 HydrophobicContact CE2-CG 4.07Å; F169-L376 VanDerWaalsContact CZ-CA 3.44Å; F169-L376 HydrophobicContact CZ-CB 4.35Å; F169-L376 HydrophobicContact CZ-CG 4.04Å
170	R	83.9	Confident	88.6	Confident	71 Å²	71	58.8 Å²	58.8	27%	0.268	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	25.9	176.5	-64.5	177.3	-65.5	155.4	6	112.9	S166 E167 F168 K172 E373 N375	S166-R170 PolarHBondContact O-NE 2.84Å; S166-R170 PolarHBondContact O-NH2 2.91Å; E167-R170 CarbonylContact O-C 3.45Å; E167-R170 VanDerWaalsContact O-C 3.32Å; E167-R170 PolarHBondContact O-N 2.86Å; E167-R170 VanDerWaalsContact O-N 3.15Å; F168-R170 PolarHBondContact O-N 2.87Å; R170-K172 PolarHBondContact O-N 2.88Å; R170-E373 WeakPolarHBondContact CD-OE1 3.49Å; R170-E373 IonicContact CZ-OE1 2.71Å; R170-E373 IonicContact NE-OE1 2.75Å; R170-E373 IonicContact NH1-OE1 3.54Å; R170-E373 PolarHBondContact NH1-OE1 2.74Å; R170-N375 WeakPolarHBondContact CD-OD1 3.33Å; R170-N375 PolarHBondContact NE-OD1 3.28Å
171	R	89.5	Confident	88.3	Confident	12 Å²	12	58.1 Å²	58.1	5%	0.045	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-48.3	130.3	173.1	64.9	-167.1	-173.9	-73.8	-5.6	110.6	Y162 E167 F168 F169 G261 D262 Y263	Y162-R171 HydrophobicContact CE1-CB 3.78Å; Y162-R171 WeakPolarHBondContact OH-CB 3.44Å; E167-R171 PolarHBondContact O-N 2.88Å; E167-R171 VanDerWaalsContact O-N 3.1Å; F168-R171 VanDerWaalsContact O-CB 3.32Å; F168-R171 WeakPolarHBondContact O-CB 3.47Å; F168-R171 WeakPolarHBondContact O-CD 3.45Å; F168-R171 WeakPolarHBondContact O-CG 3.02Å; F168-R171 PolarHBondContact O-N 2.85Å; F169-R171 VanDerWaalsContact C-N 3.32Å; R171-G261 PolarHBondContact NH2-O 2.87Å; R171-D262 PolarHBondContact NH2-O 2.86Å; R171-Y263 WeakPolarHBondContact O-CE2 3.17Å
172	K	89.4	Confident	87.8	Confident	155 Å²	155	55.2 Å²	55.2	67%	0.674	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-69.1	145.6	169.4	-65.4	-172.7	177.9	-173.6	0	109	A155 R170	A155-K172 HydrophobicContact CB-CB 4.1Å; A155-K172 WeakPolarHBondContact CB-O 3.35Å; A155-K172 PolarHBondContact N-O 3.15Å; R170-K172 PolarHBondContact O-N 2.88Å
173	L	90.6	Very high	87.3	Confident	23 Å²	23	62.3 Å²	62.3	12%	0.12	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-88.5	159.9	170.1	-59.4	-176.1	0	0	0	110.5	E153 R178 Y263	E153-L173 HydrophobicContact CB-CD2 4.36Å; E153-L173 CarbonylContact O-C 3.52Å; E153-L173 VanDerWaalsContact O-CA 3.3Å; E153-L173 WeakPolarHBondContact O-CA 3.45Å; L173-R178 HydrophobicContact CD1-CG 3.73Å; L173-Y263 HydrophobicContact CD1-CD1 3.61Å; L173-Y263 HydrophobicContact CD1-CD2 4.17Å; L173-Y263 HydrophobicContact CD1-CE1 4.04Å; L173-Y263 HydrophobicContact CD1-CG 3.68Å; L173-Y263 HydrophobicContact CD2-CD2 4.35Å; L173-Y263 HydrophobicContact CD2-CG 4.5Å; L173-Y263 HydrophobicContact CG-CD1 4.16Å; L173-Y263 HydrophobicContact CG-CD2 3.88Å; L173-Y263 HydrophobicContact CG-CE1 4.32Å; L173-Y263 HydrophobicContact CG-CE2 4.08Å; L173-Y263 HydrophobicContact CG-CG 3.93Å
174	K	91.2	Very high	86.8	Confident	56 Å²	56	58.8 Å²	58.8	24%	0.243	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-64.6	139.2	168.5	-67	172.1	179	165	0	109.4	K152 E153 A154 E157 Q176 A177	K152-K174 WeakPolarHBondContact O-CE 3.42Å; K152-K174 PolarHBondContact O-NZ 3.16Å; E153-K174 PolarHBondContact O-N 3.12Å; A154-K174 WeakPolarHBondContact O-CE 3.35Å; A154-K174 WeakPolarHBondContact O-CG 3Å; E157-K174 IonicContact OE1-NZ 3.71Å; E157-K174 PolarHBondContact OE1-NZ 2.98Å; K174-Q176 VanDerWaalsContact C-N 3.26Å; K174-Q176 PolarHBondContact O-N 3.29Å; K174-A177 HydrophobicContact CB-CB 4.24Å; K174-A177 VanDerWaalsContact O-CB 3.26Å; K174-A177 WeakPolarHBondContact O-CB 3.25Å; K174-A177 PolarHBondContact O-N 3.47Å
175	P	84.2	Confident	86.5	Confident	120 Å²	120	58.8 Å²	58.8	78%	0.779	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-53.1	-42	-179.6	-28.2	35.5	0	0	0	113.5	A177	P175-A177 PolarHBondContact O-N 3.28Å
176	Q	86.5	Confident	86.7	Confident	150 Å²	150	57.8 Å²	57.8	70%	0.701	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-72.7	-5.2	178.4	70	-86.1	34.8	0	0	114.9	K174	K174-Q176 VanDerWaalsContact C-N 3.26Å; K174-Q176 PolarHBondContact O-N 3.29Å
177	A	87.2	Confident	87.1	Confident	23 Å²	23	57.6 Å²	57.6	19%	0.19	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-81.3	-17.7	179	0	0	0	0	0	113.4	E153 K174 P175	E153-A177 HydrophobicContact CB-CB 4.11Å; E153-A177 HydrophobicContact CG-CB 4.35Å; K174-A177 HydrophobicContact CB-CB 4.24Å; K174-A177 VanDerWaalsContact O-CB 3.26Å; K174-A177 WeakPolarHBondContact O-CB 3.25Å; K174-A177 PolarHBondContact O-N 3.47Å; P175-A177 PolarHBondContact O-N 3.28Å
178	R	88.7	Confident	87.5	Confident	22 Å²	22	54 Å²	54	8%	0.083	30%	0.3	C	S	.	.	S	Bend	trans	-138	74.5	-178.3	-64.9	-66.2	179.8	-82.2	-2.8	110.9	E153 L173 V180 D191 F402	E153-R178 IonicContact OE2-CZ 2.74Å; E153-R178 IonicContact OE2-NH1 2.75Å; E153-R178 PolarHBondContact OE2-NH1 2.88Å; E153-R178 IonicContact OE2-NH2 3.57Å; E153-R178 PolarHBondContact OE2-NH2 2.65Å; L173-R178 HydrophobicContact CD1-CG 3.73Å; R178-V180 PolarHBondContact O-N 2.9Å; R178-D191 IonicContact CZ-OD1 3.93Å; R178-D191 IonicContact CZ-OD2 3.84Å; R178-D191 IonicContact NE-OD1 3.39Å; R178-D191 PolarHBondContact NE-OD1 3.11Å; R178-D191 IonicContact NE-OD2 3.71Å; R178-D191 PolarHBondContact NE-OD2 3.07Å; R178-D191 IonicContact NH2-OD1 3.36Å; R178-D191 IonicContact NH2-OD2 3.65Å; R178-D191 PolarHBondContact NH2-OD2 3.47Å; R178-F402 HydrophobicContact CB-CD1 3.59Å; R178-F402 HydrophobicContact CB-CE1 4.11Å; R178-F402 VanDerWaalsContact CD-O 3.31Å; R178-F402 WeakPolarHBondContact CD-O 3.45Å; R178-F402 HydrophobicContact CG-CB 4.44Å; R178-F402 HydrophobicContact CG-CD1 3.96Å
179	P	87.8	Confident	87.8	Confident	105 Å²	105	54 Å²	54	68%	0.682	30%	0.3	S	S	*	.			trans	-64	125.5	173.1	27.6	-33.8	0	0	0	110.2
180	V	88.5	Confident	88.2	Confident	58 Å²	58	53.9 Å²	53.9	35%	0.352	30%	0.299	S	S	.	.			trans	-75.2	127.2	176	165	0	0	0	0	109.7	R178 G182 I187 K367 F402	R178-V180 PolarHBondContact O-N 2.9Å; V180-G182 PolarHBondContact O-N 2.75Å; V180-G182 VanDerWaalsContact O-N 3.16Å; V180-I187 HydrophobicContact CG1-CD1 4.08Å; V180-I187 HydrophobicContact CG2-CD1 4.26Å; V180-K367 HydrophobicContact CG1-CG 4.25Å; V180-F402 HydrophobicContact CG2-CE1 4.34Å; V180-F402 HydrophobicContact CG2-CE2 4.38Å; V180-F402 HydrophobicContact CG2-CZ 3.78Å
181	C	84.3	Confident	88.7	Confident	32 Å²	32	51 Å²	51	22%	0.216	29%	0.289	C	S	.	.			trans	-66.6	115.6	176.3	-169.6	0	0	0	0	111.4	H184 I187 K367 G403	C181-H184 PolarHBondContact SG-ND1 2.88Å; C181-I187 HydrophobicContact CB-CG2 3.92Å; C181-K367 PolarHBondContact O-NZ 2.87Å; C181-G403 WeakPolarHBondContact CB-O 3.35Å; C181-G403 PolarHBondContact N-O 2.81Å
182	G	81.2	Confident	88.9	Confident	64 Å²	64	50.4 Å²	50.4	66%	0.66	29%	0.287	S	S	*	.	S	Bend	trans	-67	-45.6	176.7	0	0	0	0	0	113	V180 K367	V180-G182 PolarHBondContact O-N 2.75Å; V180-G182 VanDerWaalsContact O-N 3.16Å; G182-K367 PolarHBondContact O-NZ 2.85Å
183	L	80.2	Confident	89.1	Confident	161 Å²	161	46.5 Å²	46.5	84%	0.843	27%	0.27	S	S	*	.	S	Bend	trans	-67.6	-40.7	-170.1	-62.9	171.9	0	0	0	113.9
184	H	81.2	Confident	89.3	Confident	53 Å²	53	45.4 Å²	45.4	25%	0.245	26%	0.264	C	S	.	.			trans	-81.5	147.3	-172.9	-67.9	78.3	0	0	0	112.9	C181 K367 Q393 A405	C181-H184 PolarHBondContact SG-ND1 2.88Å; H184-K367 PolarHBondContact O-NZ 3.46Å; H184-Q393 PolarHBondContact NE2-NE2 3.48Å; H184-Q393 PolarHBondContact NE2-OE1 2.88Å; H184-A405 HydrophobicContact CB-CB 3.74Å; H184-A405 VanDerWaalsContact CD2-CB 3.41Å; H184-A405 WeakPolarHBondContact CD2-CB 3.41Å
185	S	83.8	Confident	89.4	Confident	26 Å²	26	43.1 Å²	43.1	18%	0.182	26%	0.255	C	S	.	.	S	Bend	trans	-75.4	-28.8	-176.4	-66.6	0	0	0	0	113.5	T270 K312	S185-T270 WeakPolarHBondContact O-CB 3.47Å; S185-T270 PolarHBondContact O-OG1 3.15Å; S185-K312 WeakPolarHBondContact OG-CE 3.2Å; S185-K312 PolarHBondContact OG-NZ 2.96Å
186	V	92.6	Very high	89.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	126	178.3	-164.3	0	0	0	0	109.3	P269 W311 F384 F390 L406	V186-P269 WeakPolarHBondContact CA-O 3.49Å; V186-P269 HydrophobicContact CG1-CB 4Å; V186-W311 HydrophobicContact CG2-CH2 3.44Å; V186-W311 VanDerWaalsContact CG2-CH2 3.44Å; V186-W311 HydrophobicContact CG2-CZ2 4.42Å; V186-W311 HydrophobicContact CG2-CZ3 3.51Å; V186-F384 HydrophobicContact CG2-CE2 4.49Å; V186-F390 HydrophobicContact CG2-CE2 4.32Å; V186-F390 HydrophobicContact CG2-CZ 4.42Å; V186-L406 HydrophobicContact CG1-CD1 3.98Å; V186-L406 PolarHBondContact O-N 2.8Å
187	I	94.9	Very high	90.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	163.9	173.9	57.1	152.1	0	0	0	111.2	V180 C181 P269 K367 F402 G403 E404	V180-I187 HydrophobicContact CG1-CD1 4.08Å; V180-I187 HydrophobicContact CG2-CD1 4.26Å; C181-I187 HydrophobicContact CB-CG2 3.92Å; I187-P269 WeakPolarHBondContact CG1-O 3.49Å; I187-P269 PolarHBondContact N-O 3.31Å; I187-P269 WeakPolarHBondContact O-CB 3.4Å; I187-K367 HydrophobicContact CD1-CG 4.12Å; I187-K367 HydrophobicContact CG1-CD 4.28Å; I187-K367 HydrophobicContact CG1-CG 3.97Å; I187-K367 HydrophobicContact CG2-CD 4.33Å; I187-F402 HydrophobicContact CD1-CD2 4.41Å; I187-F402 HydrophobicContact CD1-CE2 3.86Å; I187-G403 WeakPolarHBondContact CG2-O 3.41Å; I187-E404 CarbonylContact C-O 3.55Å; I187-E404 VanDerWaalsContact CA-O 3.24Å; I187-E404 WeakPolarHBondContact CA-O 3.29Å; I187-E404 WeakPolarHBondContact CB-O 3.31Å
188	S	96.2	Very high	90.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.195	C	C	.	.			trans	-65.1	127.7	171.6	-170.4	0	0	0	0	109.9	S190 R401 F402 G403 E404	S188-S190 VanDerWaalsContact C-N 3.26Å; S188-S190 PolarHBondContact O-N 3.29Å; S188-S190 PolarHBondContact OG-O 2.76Å; S188-R401 VanDerWaalsContact CB-O 3.31Å; S188-R401 WeakPolarHBondContact CB-O 3.4Å; S188-F402 WeakPolarHBondContact O-CD2 3.37Å; S188-G403 PolarHBondContact O-N 3.14Å; S188-E404 PolarHBondContact N-O 3.01Å
189	P	95.8	Very high	90.6	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-73.5	-15.5	177.9	30.9	-36.8	0	0	0	113.1	I256 F266 H267 P269 L318 I380 L382	P189-I256 HydrophobicContact CG-CD1 4.1Å; P189-F266 CarbonylContact O-C 3.53Å; P189-F266 VanDerWaalsContact O-CA 3.27Å; P189-F266 WeakPolarHBondContact O-CA 3.22Å; P189-H267 WeakPolarHBondContact CB-O 3.4Å; P189-H267 PolarHBondContact O-N 3.4Å; P189-P269 HydrophobicContact CB-CB 4.23Å; P189-L318 HydrophobicContact CB-CD1 4.1Å; P189-I380 HydrophobicContact CB-CD1 4.43Å; P189-I380 HydrophobicContact CG-CD1 4.13Å; P189-I380 HydrophobicContact CG-CG2 4.02Å; P189-L382 HydrophobicContact CG-CD1 4.26Å; P189-L382 HydrophobicContact CG-CD2 4.26Å; P189-L382 HydrophobicContact CG-CG 4.42Å
190	S	94.3	Very high	90.7	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	-149.2	169.4	-178.5	73.1	0	0	0	0	112.2	S188 R401 F402	S188-S190 VanDerWaalsContact C-N 3.26Å; S188-S190 PolarHBondContact O-N 3.29Å; S188-S190 PolarHBondContact OG-O 2.76Å; S190-R401 CarbonylContact O-C 3.6Å; S190-F402 PolarHBondContact O-N 3.43Å
191	D	94.1	Very high	90.4	Very high	11 Å²	11	33.6 Å²	33.6	6%	0.059	19%	0.186	C	C	.	.	S	Bend	trans	-70.7	149.6	157.3	-68.9	-4.5	0	0	0	109.6	R178 D262 Y263 I400 R401 F402	R178-D191 IonicContact CZ-OD1 3.93Å; R178-D191 IonicContact CZ-OD2 3.84Å; R178-D191 IonicContact NE-OD1 3.39Å; R178-D191 PolarHBondContact NE-OD1 3.11Å; R178-D191 IonicContact NE-OD2 3.71Å; R178-D191 PolarHBondContact NE-OD2 3.07Å; R178-D191 IonicContact NH2-OD1 3.36Å; R178-D191 IonicContact NH2-OD2 3.65Å; R178-D191 PolarHBondContact NH2-OD2 3.47Å; D191-D262 HydrophobicContact CB-CB 4.13Å; D191-Y263 VanDerWaalsContact OD2-CB 3.24Å; D191-Y263 WeakPolarHBondContact OD2-CB 3.49Å; D191-I400 WeakPolarHBondContact CA-O 3.41Å; D191-R401 VanDerWaalsContact OD1-CA 3.28Å; D191-R401 WeakPolarHBondContact OD1-CA 3.23Å; D191-F402 PolarHBondContact OD1-N 3.34Å
192	G	94.3	Very high	90.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168	-161	175.3	0	0	0	0	0	114.5	Y257 K399 I400	G192-Y257 CarbonylContact C-O 3.57Å; G192-Y257 WeakPolarHBondContact CA-O 3.49Å; G192-K399 WeakPolarHBondContact O-CA 3.27Å; G192-K399 WeakPolarHBondContact O-CD 3.29Å; G192-I400 PolarHBondContact N-O 2.89Å; G192-I400 PolarHBondContact O-N 3.33Å
193	K	94.3	Very high	90.1	Very high	73 Å²	73	35.3 Å²	35.3	32%	0.317	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	128	172.9	-178.9	-174.2	173.6	78	0	108.6	L195 Y257 G397 Q398 K399	K193-L195 PolarHBondContact O-N 3.16Å; K193-Y257 PolarHBondContact N-O 2.55Å; K193-Y257 PolarHBondContact O-N 2.88Å; K193-G397 PolarHBondContact NZ-O 2.86Å; K193-Q398 CarbonylContact C-O 3.54Å; K193-Q398 VanDerWaalsContact CA-O 3.32Å; K193-Q398 WeakPolarHBondContact CA-O 3.27Å; K193-K399 HydrophobicContact CB-CD 4.43Å
194	I	95.1	Very high	90.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	117.2	171.7	-58.2	-57.1	0	0	0	108.2	F197 I256 L394 G397 Q398 I400 L406	I194-F197 HydrophobicContact CG2-CD1 3.55Å; I194-F197 HydrophobicContact CG2-CE1 4.13Å; I194-I256 HydrophobicContact CD1-CD1 4.42Å; I194-I256 HydrophobicContact CD1-CG1 4.01Å; I194-L394 HydrophobicContact CD1-CD1 4.18Å; I194-L394 HydrophobicContact CD1-CD2 4.38Å; I194-L394 HydrophobicContact CG1-CD1 4.5Å; I194-L394 HydrophobicContact CG1-CD2 4.35Å; I194-G397 WeakPolarHBondContact O-CA 3.39Å; I194-G397 PolarHBondContact O-N 2.69Å; I194-Q398 HydrophobicContact CB-CG 4.38Å; I194-Q398 HydrophobicContact CG1-CG 3.89Å; I194-Q398 PolarHBondContact N-O 3.42Å; I194-I400 HydrophobicContact CD1-CB 4.28Å; I194-I400 HydrophobicContact CD1-CD1 4Å; I194-I400 HydrophobicContact CD1-CG2 3.77Å; I194-I400 HydrophobicContact CG1-CB 4.37Å; I194-I400 HydrophobicContact CG1-CG2 4.22Å; I194-L406 HydrophobicContact CD1-CD2 4.45Å
195	L	91.7	Very high	90.3	Very high	7 Å²	7	28.7 Å²	28.7	4%	0.037	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-44.6	174.5	-67.5	-163.1	0	0	0	111.5	K193 V208 V255 Y257 P289 F299 T396	K193-L195 PolarHBondContact O-N 3.16Å; L195-V208 HydrophobicContact CB-CG2 4.24Å; L195-V208 HydrophobicContact CD1-CG2 3.99Å; L195-V255 HydrophobicContact CB-CB 4.12Å; L195-V255 HydrophobicContact CB-CG1 3.78Å; L195-V255 HydrophobicContact CD1-CG1 3.95Å; L195-V255 HydrophobicContact CG-CG1 4.19Å; L195-V255 PolarHBondContact N-O 3.24Å; L195-Y257 HydrophobicContact CD2-CG 4.35Å; L195-P289 HydrophobicContact CD2-CB 4.33Å; L195-P289 HydrophobicContact CD2-CG 3.86Å; L195-F299 HydrophobicContact CD1-CZ 4.24Å; L195-T396 WeakPolarHBondContact O-CG2 3.3Å
196	N	92.6	Very high	90.2	Very high	11 Å²	11	30.2 Å²	30.2	6%	0.059	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	161.1	175.6	-165.3	31.4	0	0	0	111.2	E206 H253 V255	N196-E206 VanDerWaalsContact ND2-CB 3.28Å; N196-E206 WeakPolarHBondContact ND2-CB 3.45Å; N196-E206 WeakPolarHBondContact ND2-CG 3.47Å; N196-E206 PolarHBondContact ND2-O 2.61Å; N196-E206 PolarHBondContact ND2-OE2 2.74Å; N196-E206 PolarHBondContact OD1-OE2 2.69Å; N196-H253 PolarHBondContact ND2-NE2 2.93Å; N196-H253 VanDerWaalsContact ND2-NE2 3.18Å; N196-V255 PolarHBondContact O-N 3.3Å
197	F	94.1	Very high	89.6	Confident	44 Å²	44	30.2 Å²	30.2	19%	0.193	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	160	172.4	61.9	-83.1	0	0	0	110	I194 H253 C254 F392 L394 T396	I194-F197 HydrophobicContact CG2-CD1 3.55Å; I194-F197 HydrophobicContact CG2-CE1 4.13Å; F197-H253 CarbonylContact C-O 3.57Å; F197-H253 WeakPolarHBondContact CA-O 3.41Å; F197-C254 HydrophobicContact CB-CB 4.35Å; F197-F392 HydrophobicContact CB-CD1 4.31Å; F197-F392 HydrophobicContact CB-CD2 4.48Å; F197-F392 HydrophobicContact CB-CE1 4.21Å; F197-F392 HydrophobicContact CB-CE2 4.36Å; F197-F392 HydrophobicContact CB-CG 4.44Å; F197-F392 HydrophobicContact CB-CZ 4.23Å; F197-F392 HydrophobicContact CD2-CB 3.45Å; F197-F392 VanDerWaalsContact CD2-CB 3.45Å; F197-F392 HydrophobicContact CD2-CD1 4.05Å; F197-F392 AromaticContact CD2-CD2 3.57Å; F197-F392 HydrophobicContact CD2-CD2 3.57Å; F197-F392 HydrophobicContact CD2-CE2 4.23Å; F197-F392 AromaticContact CD2-CG 3.45Å; F197-F392 HydrophobicContact CD2-CG 3.45Å; F197-F392 VanDerWaalsContact CD2-CG 3.45Å; F197-F392 HydrophobicContact CE2-CB 3.54Å; F197-F392 HydrophobicContact CE2-CD2 4.35Å; F197-F392 HydrophobicContact CE2-CG 4.09Å; F197-F392 HydrophobicContact CG-CB 4.47Å; F197-F392 HydrophobicContact CG-CD1 4.44Å; F197-F392 HydrophobicContact CG-CD2 4.47Å; F197-F392 HydrophobicContact CG-CG 4.25Å; F197-L394 HydrophobicContact CB-CD1 4.24Å; F197-L394 HydrophobicContact CD1-CB 3.95Å; F197-L394 HydrophobicContact CD1-CD1 4.17Å; F197-L394 HydrophobicContact CD2-CB 4.33Å; F197-L394 HydrophobicContact CD2-CD1 4.42Å; F197-L394 HydrophobicContact CE1-CB 3.65Å; F197-L394 HydrophobicContact CE2-CB 4.05Å; F197-L394 HydrophobicContact CG-CB 4.28Å; F197-L394 HydrophobicContact CG-CD1 4.01Å; F197-L394 HydrophobicContact CZ-CB 3.7Å; F197-L394 VanDerWaalsContact CZ-O 3.29Å; F197-L394 WeakPolarHBondContact CZ-O 3.26Å; F197-T396 WeakPolarHBondContact CE1-OG1 3.3Å
198	G	92.8	Very high	88.5	Confident	17 Å²	17	30.7 Å²	30.7	18%	0.175	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.9	-162.3	174.1	0	0	0	0	0	113.7	Y252 H253	G198-Y252 CarbonylContact O-C 3.44Å; G198-Y252 VanDerWaalsContact O-CA 3.24Å; G198-Y252 WeakPolarHBondContact O-CA 3.18Å; G198-Y252 WeakPolarHBondContact O-CB 3.49Å; G198-H253 PolarHBondContact N-O 3.28Å; G198-H253 PolarHBondContact O-N 2.86Å; G198-H253 PolarHBondContact O-ND1 2.75Å
199	Q	92.1	Very high	87.2	Confident	72 Å²	72	35.1 Å²	35.1	34%	0.336	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	138.3	169.5	-174	-164.1	13.3	0	0	109.6	K201 E250 Y252	Q199-K201 PolarHBondContact O-N 3.33Å; Q199-E250 HydrophobicContact CG-CB 4.43Å; Q199-E250 PolarHBondContact NE2-OE2 3.13Å; Q199-Y252 HydrophobicContact CB-CD1 4.29Å; Q199-Y252 HydrophobicContact CB-CE1 4.31Å
200	V	90	Very high	85.8	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.194	C	C	.	.			trans	-77	112.9	172.9	-176	0	0	0	0	109.4	V205 L215 K240 L251 H253	V200-V205 HydrophobicContact CG1-CG2 4.16Å; V200-V205 HydrophobicContact CG2-CG2 4.2Å; V200-L215 HydrophobicContact CG1-CD2 4.37Å; V200-K240 PolarHBondContact O-NZ 2.82Å; V200-L251 HydrophobicContact CB-CB 4.22Å; V200-L251 HydrophobicContact CB-CD2 4.13Å; V200-L251 HydrophobicContact CB-CG 4.36Å; V200-L251 HydrophobicContact CG1-CD2 4.27Å; V200-L251 HydrophobicContact CG2-CB 4.42Å; V200-L251 HydrophobicContact CG2-CD2 4.08Å; V200-L251 HydrophobicContact CG2-CG 4.13Å; V200-L251 PolarHBondContact N-O 3.17Å; V200-H253 HydrophobicContact CG2-CB 3.96Å
201	K	83.8	Confident	85.1	Confident	134 Å²	134	37.6 Å²	37.6	58%	0.583	20%	0.195	S	C	*	.	B	Isolated β-bridge	trans	-110	142.1	-179.2	-64.3	-179.7	-178.8	-179.4	0	109.5	Q199 C203 E204	Q199-K201 PolarHBondContact O-N 3.33Å; K201-C203 PolarHBondContact O-N 3.46Å; K201-E204 PolarHBondContact O-N 3.3Å
202	N	78.8	Confident	84.7	Confident	133 Å²	133	38.7 Å²	38.7	71%	0.711	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	29.2	-179.5	-50.8	-1.6	0	0	0	113.3	E204 C236	N202-E204 PolarHBondContact O-N 2.88Å; N202-C236 PolarHBondContact O-SG 3.16Å
203	C	79.7	Confident	84.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.3	28.5	-172.9	26.6	0	0	0	0	115.3	K201 L215 C236 K240	K201-C203 PolarHBondContact O-N 3.46Å; C203-L215 HydrophobicContact CB-CB 4.23Å; C203-L215 HydrophobicContact CB-CD2 4.33Å; C203-L215 WeakPolarHBondContact O-CB 3.46Å; C203-L215 PolarHBondContact O-N 3.24Å; C203-C236 HydrophobicContact CB-CB 4.5Å; C203-C236 WeakPolarHBondContact CB-SG 3.44Å; C203-C236 WeakPolarHBondContact SG-CA 3.1Å; C203-C236 WeakPolarHBondContact SG-CB 3.37Å; C203-C236 PolarHBondContact SG-O 3.45Å; C203-C236 CovalentContact SG-SG 2.03Å; C203-C236 PolarHBondContact SG-SG 2.92Å; C203-K240 HydrophobicContact CB-CB 4.3Å
204	E	83.1	Confident	84.1	Confident	75 Å²	75	36.5 Å²	36.5	35%	0.35	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	138.6	162.1	-70.1	-151.5	138.2	0	0	109.8	K201 N202 T212 Y213	K201-E204 PolarHBondContact O-N 3.3Å; N202-E204 PolarHBondContact O-N 2.88Å; E204-T212 HydrophobicContact CB-CG2 4.33Å; E204-T212 VanDerWaalsContact CD-OG1 3.3Å; E204-T212 PolarHBondContact OE1-OG1 3.27Å; E204-T212 WeakPolarHBondContact OE2-CB 3.34Å; E204-T212 WeakPolarHBondContact OE2-CG2 3.42Å; E204-T212 PolarHBondContact OE2-OG1 2.73Å; E204-Y213 CarbonylContact C-O 3.57Å; E204-Y213 WeakPolarHBondContact CA-O 3.29Å
205	V	82.3	Confident	83.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.4	170.8	-177.8	0	0	0	0	107.8	V200 Q207 T212 Y213 L215 H253	V200-V205 HydrophobicContact CG1-CG2 4.16Å; V200-V205 HydrophobicContact CG2-CG2 4.2Å; V205-Q207 PolarHBondContact O-N 3.19Å; V205-T212 CarbonylContact O-C 3.6Å; V205-T212 WeakPolarHBondContact O-CA 3.34Å; V205-Y213 HydrophobicContact CB-CD2 4.23Å; V205-Y213 HydrophobicContact CB-CE1 4.1Å; V205-Y213 HydrophobicContact CB-CE2 3.69Å; V205-Y213 HydrophobicContact CG1-CE1 4.07Å; V205-Y213 HydrophobicContact CG1-CE2 4.17Å; V205-Y213 WeakPolarHBondContact CG1-OH 3.3Å; V205-Y213 HydrophobicContact CG2-CE2 4.27Å; V205-Y213 PolarHBondContact N-O 2.83Å; V205-Y213 VanDerWaalsContact O-CD1 3.26Å; V205-Y213 WeakPolarHBondContact O-CD1 3.48Å; V205-Y213 PolarHBondContact O-N 2.88Å; V205-L215 HydrophobicContact CG2-CB 4.42Å; V205-L215 HydrophobicContact CG2-CD1 3.68Å; V205-H253 HydrophobicContact CG1-CB 3.94Å
206	E	81.6	Confident	83.7	Confident	57 Å²	57	39.7 Å²	39.7	27%	0.266	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	119.9	176.9	178.2	-154.5	176.4	0	0	110.5	N196 K209 G210 V211 T212	N196-E206 VanDerWaalsContact ND2-CB 3.28Å; N196-E206 WeakPolarHBondContact ND2-CB 3.45Å; N196-E206 WeakPolarHBondContact ND2-CG 3.47Å; N196-E206 PolarHBondContact ND2-O 2.61Å; N196-E206 PolarHBondContact ND2-OE2 2.74Å; N196-E206 PolarHBondContact OD1-OE2 2.69Å; E206-K209 WeakPolarHBondContact OE1-CA 3.24Å; E206-K209 PolarHBondContact OE1-N 2.81Å; E206-G210 PolarHBondContact OE1-N 2.89Å; E206-V211 CarbonylContact C-O 3.49Å; E206-T212 HydrophobicContact CB-CG2 4.24Å
207	Q	79.3	Confident	83.5	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	-61.7	178.9	-168.6	172	-93.6	0	0	111.7	V205 V211 Y213 A292 I295 F299	V205-Q207 PolarHBondContact O-N 3.19Å; Q207-V211 WeakPolarHBondContact CA-O 3.26Å; Q207-V211 HydrophobicContact CB-CB 4.42Å; Q207-V211 HydrophobicContact CB-CG1 4.4Å; Q207-V211 WeakPolarHBondContact CB-O 3.45Å; Q207-V211 PolarHBondContact N-O 2.81Å; Q207-Y213 HydrophobicContact CB-CD1 3.95Å; Q207-Y213 HydrophobicContact CB-CE1 3.98Å; Q207-Y213 HydrophobicContact CG-CE1 4.42Å; Q207-A292 HydrophobicContact CG-CB 4.42Å; Q207-A292 PolarHBondContact NE2-O 3.07Å; Q207-I295 PolarHBondContact NE2-O 3.23Å; Q207-F299 HydrophobicContact CB-CE2 4.4Å; Q207-F299 HydrophobicContact CG-CD2 3.99Å; Q207-F299 HydrophobicContact CG-CE1 4.16Å; Q207-F299 HydrophobicContact CG-CE2 3.58Å; Q207-F299 HydrophobicContact CG-CG 4.44Å; Q207-F299 HydrophobicContact CG-CZ 3.66Å
208	V	73.4	Confident	83.4	Confident	11 Å²	11	40 Å²	40	7%	0.067	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	127.7	175.4	-172.7	0	0	0	0	109	L195 G210 V211 A292 R293	L195-V208 HydrophobicContact CB-CG2 4.24Å; L195-V208 HydrophobicContact CD1-CG2 3.99Å; V208-G210 PolarHBondContact O-N 2.78Å; V208-V211 WeakPolarHBondContact O-CB 3.48Å; V208-V211 WeakPolarHBondContact O-CG2 3.39Å; V208-V211 PolarHBondContact O-N 3.48Å; V208-A292 HydrophobicContact CG2-CB 3.65Å; V208-R293 HydrophobicContact CB-CG 3.92Å; V208-R293 HydrophobicContact CG1-CG 3.52Å
209	K	68.9	Low	83.3	Confident	92 Å²	92	39.5 Å²	39.5	40%	0.4	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.6	67.4	168	-69	-169.3	172.5	-174.9	0	113.8	E92 P100 E206 V211	E92-K209 IonicContact OE1-NZ 3.06Å; E92-K209 PolarHBondContact OE1-NZ 3.18Å; P100-K209 WeakPolarHBondContact CG-O 3.28Å; E206-K209 WeakPolarHBondContact OE1-CA 3.24Å; E206-K209 PolarHBondContact OE1-N 2.81Å; K209-V211 PolarHBondContact O-N 2.92Å
210	G	65.9	Low	83	Confident	51 Å²	51	36.3 Å²	36.3	53%	0.526	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	-4.8	176.5	0	0	0	0	0	115.6	E206 V208 T212	E206-G210 PolarHBondContact OE1-N 2.89Å; V208-G210 PolarHBondContact O-N 2.78Å; G210-T212 PolarHBondContact O-N 2.87Å
211	V	78.4	Confident	82.7	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.012	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	113.9	171.1	-175.6	0	0	0	0	109.1	P100 L102 E206 Q207 V208 K209 K296	P100-V211 HydrophobicContact CB-CG2 3.68Å; P100-V211 HydrophobicContact CG-CG2 3.63Å; L102-V211 HydrophobicContact CD2-CG1 4.1Å; L102-V211 HydrophobicContact CD2-CG2 3.82Å; E206-V211 CarbonylContact C-O 3.49Å; Q207-V211 WeakPolarHBondContact CA-O 3.26Å; Q207-V211 HydrophobicContact CB-CB 4.42Å; Q207-V211 HydrophobicContact CB-CG1 4.4Å; Q207-V211 WeakPolarHBondContact CB-O 3.45Å; Q207-V211 PolarHBondContact N-O 2.81Å; V208-V211 WeakPolarHBondContact O-CB 3.48Å; V208-V211 WeakPolarHBondContact O-CG2 3.39Å; V208-V211 PolarHBondContact O-N 3.48Å; K209-V211 PolarHBondContact O-N 2.92Å; V211-K296 HydrophobicContact CG1-CB 4.37Å; V211-K296 HydrophobicContact CG1-CG 4.09Å
212	T	86	Confident	82	Confident	34 Å²	34	36.4 Å²	36.4	21%	0.209	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	167.1	-178	57.4	0	0	0	0	114.2	E204 V205 E206 G210 K296	E204-T212 HydrophobicContact CB-CG2 4.33Å; E204-T212 VanDerWaalsContact CD-OG1 3.3Å; E204-T212 PolarHBondContact OE1-OG1 3.27Å; E204-T212 WeakPolarHBondContact OE2-CB 3.34Å; E204-T212 WeakPolarHBondContact OE2-CG2 3.42Å; E204-T212 PolarHBondContact OE2-OG1 2.73Å; V205-T212 CarbonylContact O-C 3.6Å; V205-T212 WeakPolarHBondContact O-CA 3.34Å; E206-T212 HydrophobicContact CB-CG2 4.24Å; G210-T212 PolarHBondContact O-N 2.87Å; T212-K296 VanDerWaalsContact O-CE 3.27Å; T212-K296 WeakPolarHBondContact O-CE 3.43Å
213	Y	86.4	Confident	80.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	148.9	166.5	59.2	-91.3	0	0	0	111.5	E204 V205 Q207 L215 F218 F299 C300	E204-Y213 CarbonylContact C-O 3.57Å; E204-Y213 WeakPolarHBondContact CA-O 3.29Å; V205-Y213 HydrophobicContact CB-CD2 4.23Å; V205-Y213 HydrophobicContact CB-CE1 4.1Å; V205-Y213 HydrophobicContact CB-CE2 3.69Å; V205-Y213 HydrophobicContact CG1-CE1 4.07Å; V205-Y213 HydrophobicContact CG1-CE2 4.17Å; V205-Y213 WeakPolarHBondContact CG1-OH 3.3Å; V205-Y213 HydrophobicContact CG2-CE2 4.27Å; V205-Y213 PolarHBondContact N-O 2.83Å; V205-Y213 VanDerWaalsContact O-CD1 3.26Å; V205-Y213 WeakPolarHBondContact O-CD1 3.48Å; V205-Y213 PolarHBondContact O-N 2.88Å; Q207-Y213 HydrophobicContact CB-CD1 3.95Å; Q207-Y213 HydrophobicContact CB-CE1 3.98Å; Q207-Y213 HydrophobicContact CG-CE1 4.42Å; Y213-L215 PolarHBondContact O-N 3.45Å; Y213-F218 HydrophobicContact CD2-CB 3.82Å; Y213-F218 HydrophobicContact CD2-CD2 4.28Å; Y213-F218 HydrophobicContact CD2-CG 4.14Å; Y213-F218 HydrophobicContact CE2-CB 3.65Å; Y213-F218 AromaticContact CE2-CD1 3.98Å; Y213-F218 HydrophobicContact CE2-CD1 3.98Å; Y213-F218 AromaticContact CE2-CD2 3.71Å; Y213-F218 HydrophobicContact CE2-CD2 3.71Å; Y213-F218 HydrophobicContact CE2-CE2 4.33Å; Y213-F218 AromaticContact CE2-CG 3.51Å; Y213-F218 HydrophobicContact CE2-CG 3.51Å; Y213-F299 AromaticContact CE1-CD2 3.69Å; Y213-F299 HydrophobicContact CE1-CD2 3.69Å; Y213-F299 HydrophobicContact CE1-CE2 4.29Å; Y213-F299 AromaticContact CZ-CD2 3.97Å; Y213-C300 VanDerWaalsContact CD2-SG 3.56Å
214	S	89.9	Confident	79.6	Confident	26 Å²	26	41.1 Å²	41.1	18%	0.182	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	132.6	175.5	158.7	0	0	0	0	111.7	E216 S217 F218	S214-E216 VanDerWaalsContact C-N 3.34Å; S214-E216 PolarHBondContact OG-N 3.44Å; S214-S217 PolarHBondContact O-N 3.32Å; S214-S217 PolarHBondContact OG-N 2.87Å; S214-S217 VanDerWaalsContact OG-N 3.11Å; S214-S217 PolarHBondContact OG-OG 3.5Å; S214-F218 PolarHBondContact O-N 3.15Å; S214-F218 VanDerWaalsContact O-N 3.12Å
215	L	89.6	Confident	77.6	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-41.1	175.2	-176.7	72.2	0	0	0	111.7	V200 C203 V205 Y213 F218 L219 F239 L243 L251 I383	V200-L215 HydrophobicContact CG1-CD2 4.37Å; C203-L215 HydrophobicContact CB-CB 4.23Å; C203-L215 HydrophobicContact CB-CD2 4.33Å; C203-L215 WeakPolarHBondContact O-CB 3.46Å; C203-L215 PolarHBondContact O-N 3.24Å; V205-L215 HydrophobicContact CG2-CB 4.42Å; V205-L215 HydrophobicContact CG2-CD1 3.68Å; Y213-L215 PolarHBondContact O-N 3.45Å; L215-F218 PolarHBondContact O-N 3.15Å; L215-F218 VanDerWaalsContact O-N 3.15Å; L215-L219 HydrophobicContact CD1-CD1 3.84Å; L215-L219 HydrophobicContact CD1-CG 4.27Å; L215-L219 HydrophobicContact CG-CD1 4.04Å; L215-L219 PolarHBondContact O-N 3.2Å; L215-F239 HydrophobicContact CD2-CD1 4.13Å; L215-F239 HydrophobicContact CD2-CE1 4.16Å; L215-F239 HydrophobicContact CG-CD1 4.31Å; L215-F239 HydrophobicContact CG-CE1 4.01Å; L215-L243 HydrophobicContact CD2-CD1 3.65Å; L215-L243 HydrophobicContact CG-CD1 4.32Å; L215-L251 HydrophobicContact CD1-CD2 4.36Å; L215-L251 HydrophobicContact CD2-CD2 3.5Å; L215-L251 VanDerWaalsContact CD2-CD2 3.5Å; L215-I383 HydrophobicContact CD1-CD1 3.68Å; L215-I383 HydrophobicContact CD1-CG1 4.29Å; L215-I383 HydrophobicContact CD1-CG2 4.09Å
216	E	89.2	Confident	75.7	Confident	74 Å²	74	51.1 Å²	51.1	35%	0.346	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-43	174.6	-174.8	-174.5	-164.5	0	0	111	S214 F218 G220 F239	S214-E216 VanDerWaalsContact C-N 3.34Å; S214-E216 PolarHBondContact OG-N 3.44Å; E216-F218 PolarHBondContact O-N 2.87Å; E216-F218 VanDerWaalsContact O-N 3.16Å; E216-G220 WeakPolarHBondContact O-CA 3.39Å; E216-G220 PolarHBondContact O-N 2.74Å; E216-F239 VanDerWaalsContact CA-CE1 3.49Å; E216-F239 HydrophobicContact CB-CD1 3.81Å; E216-F239 HydrophobicContact CB-CD2 4.22Å; E216-F239 HydrophobicContact CB-CE1 3.93Å; E216-F239 HydrophobicContact CB-CE2 4.33Å; E216-F239 HydrophobicContact CB-CG 3.96Å; E216-F239 HydrophobicContact CB-CZ 4.2Å; E216-F239 HydrophobicContact CG-CD1 4.46Å; E216-F239 HydrophobicContact CG-CD2 3.98Å; E216-F239 HydrophobicContact CG-CE1 4.48Å; E216-F239 HydrophobicContact CG-CE2 4.01Å; E216-F239 HydrophobicContact CG-CG 4.22Å; E216-F239 HydrophobicContact CG-CZ 4.27Å
217	S	88	Confident	73.7	Confident	61 Å²	61	56 Å²	56	43%	0.427	30%	0.303	S	S	.	.	H	α-helix	trans	-64	-19.8	174.6	-65.8	0	0	0	0	113.5	S214 R304	S214-S217 PolarHBondContact O-N 3.32Å; S214-S217 PolarHBondContact OG-N 2.87Å; S214-S217 VanDerWaalsContact OG-N 3.11Å; S214-S217 PolarHBondContact OG-OG 3.5Å; S217-R304 PolarHBondContact O-NH2 2.95Å
218	F	92.1	Very high	72	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-92.5	-48.8	179.8	-172.6	-113.9	0	0	0	113.3	Y213 S214 L215 E216 F280 F299 R304 T319 V321 V381 I383	Y213-F218 HydrophobicContact CD2-CB 3.82Å; Y213-F218 HydrophobicContact CD2-CD2 4.28Å; Y213-F218 HydrophobicContact CD2-CG 4.14Å; Y213-F218 HydrophobicContact CE2-CB 3.65Å; Y213-F218 AromaticContact CE2-CD1 3.98Å; Y213-F218 HydrophobicContact CE2-CD1 3.98Å; Y213-F218 AromaticContact CE2-CD2 3.71Å; Y213-F218 HydrophobicContact CE2-CD2 3.71Å; Y213-F218 HydrophobicContact CE2-CE2 4.33Å; Y213-F218 AromaticContact CE2-CG 3.51Å; Y213-F218 HydrophobicContact CE2-CG 3.51Å; S214-F218 PolarHBondContact O-N 3.15Å; S214-F218 VanDerWaalsContact O-N 3.12Å; L215-F218 PolarHBondContact O-N 3.15Å; L215-F218 VanDerWaalsContact O-N 3.15Å; E216-F218 PolarHBondContact O-N 2.87Å; E216-F218 VanDerWaalsContact O-N 3.16Å; F218-F280 VanDerWaalsContact O-CE2 3.29Å; F218-F280 WeakPolarHBondContact O-CE2 3.36Å; F218-F299 HydrophobicContact CD2-CB 4.34Å; F218-F299 HydrophobicContact CE2-CB 3.83Å; F218-R304 VanDerWaalsContact O-CZ 3.29Å; F218-R304 PolarHBondContact O-NE 3.46Å; F218-R304 PolarHBondContact O-NH2 3.39Å; F218-T319 HydrophobicContact CE1-CG2 3.87Å; F218-T319 HydrophobicContact CE2-CG2 4.06Å; F218-T319 HydrophobicContact CZ-CG2 3.37Å; F218-V321 HydrophobicContact CE2-CG2 4.12Å; F218-V321 HydrophobicContact CZ-CG2 4.11Å; F218-V381 HydrophobicContact CE1-CB 3.89Å; F218-V381 HydrophobicContact CE1-CG1 3.77Å; F218-V381 HydrophobicContact CE1-CG2 4.34Å; F218-V381 HydrophobicContact CZ-CB 3.7Å; F218-V381 HydrophobicContact CZ-CG1 4.02Å; F218-V381 HydrophobicContact CZ-CG2 3.72Å; F218-I383 HydrophobicContact CD1-CD1 3.64Å; F218-I383 HydrophobicContact CE1-CD1 3.72Å
219	L	91.5	Very high	70.5	Confident	8 Å²	8	67.5 Å²	67.5	4%	0.042	37%	0.37	C	S	.	.	H	α-helix	trans	-85.4	-24.9	-179.9	-61.1	179.9	0	0	0	112.8	L215 F239 L243 R278 V306 F315 S317 I383	L215-L219 HydrophobicContact CD1-CD1 3.84Å; L215-L219 HydrophobicContact CD1-CG 4.27Å; L215-L219 HydrophobicContact CG-CD1 4.04Å; L215-L219 PolarHBondContact O-N 3.2Å; L219-F239 HydrophobicContact CB-CZ 4.31Å; L219-F239 HydrophobicContact CD1-CE1 4.46Å; L219-L243 HydrophobicContact CD1-CD1 3.8Å; L219-R278 WeakPolarHBondContact O-CD 3.36Å; L219-R278 PolarHBondContact O-NH1 3.03Å; L219-V306 HydrophobicContact CD2-CG1 3.68Å; L219-F315 HydrophobicContact CD1-CE1 4.33Å; L219-F315 HydrophobicContact CD1-CZ 4.11Å; L219-S317 WeakPolarHBondContact CD2-OG 3.23Å; L219-I383 HydrophobicContact CD1-CD1 4.46Å; L219-I383 HydrophobicContact CD2-CD1 4.02Å; L219-I383 HydrophobicContact CG-CD1 4.36Å
220	G	86.2	Confident	69.3	Low	5 Å²	5	71.6 Å²	71.6	5%	0.052	39%	0.388	C	S	.	.			trans	79.5	171.4	-171.8	0	0	0	0	0	113.1	E216 F239 R278	E216-G220 WeakPolarHBondContact O-CA 3.39Å; E216-G220 PolarHBondContact O-N 2.74Å; G220-F239 WeakPolarHBondContact O-CE2 3.35Å; G220-F239 VanDerWaalsContact O-CZ 3.27Å; G220-F239 WeakPolarHBondContact O-CZ 3.29Å; G220-R278 VanDerWaalsContact CA-NH1 3.31Å; G220-R278 PolarHBondContact O-NH1 3.19Å
221	P	82.3	Confident	68.1	Low	53 Å²	53	75 Å²	75	34%	0.344	40%	0.403	S	S	.	.			trans	-62.6	148.1	-179.6	28	-36.1	0	0	0	111.9	T223 R278 Y349	P221-T223 PolarHBondContact O-N 2.75Å; P221-R278 VanDerWaalsContact O-CZ 3.29Å; P221-R278 PolarHBondContact O-NH1 3.26Å; P221-R278 PolarHBondContact O-NH2 3.13Å; P221-Y349 HydrophobicContact CG-CE1 4.44Å
222	R	70.4	Confident	66.5	Low	82 Å²	82	79.7 Å²	79.7	31%	0.309	43%	0.434	S	S	.	.			trans	-76.2	115.8	172.3	-69.3	-156.6	75.2	153.5	3.5	109.6	Y224 F239 Q242	R222-Y224 HydrophobicContact CB-CD2 4.48Å; R222-Y224 PolarHBondContact O-N 3.35Å; R222-Y224 VanDerWaalsContact O-N 3.09Å; R222-F239 HydrophobicContact CG-CE2 4.23Å; R222-Q242 WeakPolarHBondContact CD-O 3.42Å; R222-Q242 PolarHBondContact NH1-O 3.47Å
223	T	55.5	Low	64.5	Low	86 Å²	86	83.1 Å²	83.1	53%	0.528	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	23.1	-176.4	-21.9	0	0	0	0	114	P221 R278 D351	P221-T223 PolarHBondContact O-N 2.75Å; T223-R278 PolarHBondContact OG1-NH2 3.16Å; T223-D351 PolarHBondContact OG1-OD2 2.87Å; T223-D351 VanDerWaalsContact OG1-OD2 3.1Å
224	Y	51.4	Low	62.8	Low	147 Å²	147	85.3 Å²	85.3	58%	0.576	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-5.5	-170.1	-80.3	-81.5	0	0	0	114.8	R222	R222-Y224 HydrophobicContact CB-CD2 4.48Å; R222-Y224 PolarHBondContact O-N 3.35Å; R222-Y224 VanDerWaalsContact O-N 3.09Å
225	T	42.1	Very low	61.3	Low	107 Å²	107	87.6 Å²	87.6	66%	0.656	50%	0.5	S	S	*	.			trans	-94.1	96.1	168.9	49.5	0	0	0	0	109.9
226	E	40.9	Very low	59.7	Low	178 Å²	178	90 Å²	90	83%	0.832	52%	0.516	S	S	*	.			trans	-61.9	142.6	156.4	-62.6	177.9	155.1	0	0	108.9
227	D	40.5	Very low	58.4	Low	159 Å²	159	91 Å²	91	85%	0.85	52%	0.524	S	S	*	.	S	Bend	trans	47.4	63.1	165.5	-61	-15.3	0	0	0	119.4
228	L	43.1	Very low	57.7	Low	133 Å²	133	90.2 Å²	90.2	70%	0.696	52%	0.518	S	S	*	.			trans	-121	119.3	154.8	-74.8	178	0	0	0	111.5	F230	L228-F230 PolarHBondContact O-N 2.89Å
229	P	41.4	Very low	57.1	Low	120 Å²	120	90.5 Å²	90.5	78%	0.779	52%	0.519	S	S	*	.	S	Bend	trans	-68.6	-5.7	-171	-23.8	34.5	0	0	0	117.1
230	F	44.7	Very low	56.5	Low	178 Å²	178	91.4 Å²	91.4	78%	0.781	52%	0.523	S	S	*	.			trans	-134.8	121	-178.1	-67.7	-86.5	0	0	0	109.9	L228 P232	L228-F230 PolarHBondContact O-N 2.89Å; F230-P232 WeakPolarHBondContact O-CD 3.37Å
231	S	40.8	Very low	56.2	Low	121 Å²	121	96.7 Å²	96.7	85%	0.846	55%	0.55	S	S	*	*			trans	-82.1	108	163.2	-173.6	0	0	0	0	108.3
232	P	43.6	Very low	56.1	Low	101 Å²	101	98 Å²	98	66%	0.656	55%	0.552	S	S	*	*			trans	-63.6	150.2	164.6	30	-34.2	0	0	0	108.6	F230 A234	F230-P232 WeakPolarHBondContact O-CD 3.37Å; P232-A234 PolarHBondContact O-N 2.86Å
233	A	44.3	Very low	56.8	Low	107 Å²	107	94.3 Å²	94.3	88%	0.884	54%	0.538	S	S	*	.			trans	-64.2	101.2	168.1	0	0	0	0	0	108.3	S235	A233-S235 PolarHBondContact O-N 3.26Å
234	A	52.3	Low	58.2	Low	45 Å²	45	91.7 Å²	91.7	37%	0.372	52%	0.522	S	S	.	.			trans	-60.3	125.6	-179.6	0	0	0	0	0	109.3	P232	P232-A234 PolarHBondContact O-N 2.86Å
235	S	56.7	Low	59.6	Low	75 Å²	75	88.2 Å²	88.2	52%	0.524	52%	0.516	S	S	.	.			trans	-61	144.4	164.6	56.6	0	0	0	0	108.4	A233 D237 S238	A233-S235 PolarHBondContact O-N 3.26Å; S235-D237 PolarHBondContact O-N 3.05Å; S235-D237 VanDerWaalsContact O-N 3.17Å; S235-S238 WeakPolarHBondContact O-CA 3.4Å; S235-S238 WeakPolarHBondContact O-CB 3.19Å; S235-S238 PolarHBondContact O-N 2.64Å
236	C	56.1	Low	61.7	Low	50 Å²	50	88.7 Å²	88.7	34%	0.338	51%	0.506	S	S	.	.	H	α-helix	trans	-53.4	-43.7	-176.3	-167.7	0	0	0	0	111.1	N202 C203 S238 F239 K240	N202-C236 PolarHBondContact O-SG 3.16Å; C203-C236 HydrophobicContact CB-CB 4.5Å; C203-C236 WeakPolarHBondContact CB-SG 3.44Å; C203-C236 WeakPolarHBondContact SG-CA 3.1Å; C203-C236 WeakPolarHBondContact SG-CB 3.37Å; C203-C236 PolarHBondContact SG-O 3.45Å; C203-C236 CovalentContact SG-SG 2.03Å; C203-C236 PolarHBondContact SG-SG 2.92Å; C236-S238 PolarHBondContact O-N 3.46Å; C236-S238 VanDerWaalsContact O-N 3.16Å; C236-F239 WeakPolarHBondContact O-CA 3.12Å; C236-F239 WeakPolarHBondContact O-CB 3.5Å; C236-F239 PolarHBondContact O-N 2.86Å; C236-K240 PolarHBondContact O-N 2.88Å
237	D	62.8	Low	63.7	Low	96 Å²	96	89.6 Å²	89.6	51%	0.513	51%	0.51	S	S	.	.	H	α-helix	trans	-57.4	-31.7	178.8	-53.4	-61.6	0	0	0	112.8	S235 F239 K240 N241	S235-D237 PolarHBondContact O-N 3.05Å; S235-D237 VanDerWaalsContact O-N 3.17Å; D237-F239 VanDerWaalsContact C-N 3.34Å; D237-F239 PolarHBondContact O-N 2.93Å; D237-K240 PolarHBondContact O-N 3.49Å; D237-N241 WeakPolarHBondContact O-CB 3.09Å; D237-N241 PolarHBondContact O-N 3.37Å; D237-N241 PolarHBondContact O-ND2 2.81Å; D237-N241 PolarHBondContact O-OD1 3Å
238	S	72.8	Confident	65.8	Low	44 Å²	44	84.4 Å²	84.4	31%	0.308	50%	0.495	S	S	.	.	H	α-helix	trans	-59.6	-43.7	171.4	-171.2	0	0	0	0	111.4	S235 C236 N241 Q242	S235-S238 WeakPolarHBondContact O-CA 3.4Å; S235-S238 WeakPolarHBondContact O-CB 3.19Å; S235-S238 PolarHBondContact O-N 2.64Å; C236-S238 PolarHBondContact O-N 3.46Å; C236-S238 VanDerWaalsContact O-N 3.16Å; S238-N241 PolarHBondContact O-N 2.88Å; S238-Q242 WeakPolarHBondContact O-CB 3.4Å; S238-Q242 WeakPolarHBondContact O-CG 3.29Å; S238-Q242 PolarHBondContact O-N 3.17Å; S238-Q242 PolarHBondContact O-NE2 2.71Å; S238-Q242 PolarHBondContact OG-NE2 2.92Å
239	F	79.5	Confident	68.2	Low	5 Å²	5	79 Å²	79	2%	0.022	47%	0.466	C	S	.	.	H	α-helix	trans	-68.5	-34.7	178.9	-167.9	-99.2	0	0	0	112.7	L215 E216 L219 G220 R222 C236 D237 L243	L215-F239 HydrophobicContact CD2-CD1 4.13Å; L215-F239 HydrophobicContact CD2-CE1 4.16Å; L215-F239 HydrophobicContact CG-CD1 4.31Å; L215-F239 HydrophobicContact CG-CE1 4.01Å; E216-F239 VanDerWaalsContact CA-CE1 3.49Å; E216-F239 HydrophobicContact CB-CD1 3.81Å; E216-F239 HydrophobicContact CB-CD2 4.22Å; E216-F239 HydrophobicContact CB-CE1 3.93Å; E216-F239 HydrophobicContact CB-CE2 4.33Å; E216-F239 HydrophobicContact CB-CG 3.96Å; E216-F239 HydrophobicContact CB-CZ 4.2Å; E216-F239 HydrophobicContact CG-CD1 4.46Å; E216-F239 HydrophobicContact CG-CD2 3.98Å; E216-F239 HydrophobicContact CG-CE1 4.48Å; E216-F239 HydrophobicContact CG-CE2 4.01Å; E216-F239 HydrophobicContact CG-CG 4.22Å; E216-F239 HydrophobicContact CG-CZ 4.27Å; L219-F239 HydrophobicContact CB-CZ 4.31Å; L219-F239 HydrophobicContact CD1-CE1 4.46Å; G220-F239 WeakPolarHBondContact O-CE2 3.35Å; G220-F239 VanDerWaalsContact O-CZ 3.27Å; G220-F239 WeakPolarHBondContact O-CZ 3.29Å; R222-F239 HydrophobicContact CG-CE2 4.23Å; C236-F239 WeakPolarHBondContact O-CA 3.12Å; C236-F239 WeakPolarHBondContact O-CB 3.5Å; C236-F239 PolarHBondContact O-N 2.86Å; D237-F239 VanDerWaalsContact C-N 3.34Å; D237-F239 PolarHBondContact O-N 2.93Å; F239-L243 HydrophobicContact CD1-CD1 3.96Å; F239-L243 HydrophobicContact CE1-CD1 3.53Å; F239-L243 HydrophobicContact CE1-CG 4.4Å; F239-L243 HydrophobicContact CZ-CD1 4.12Å; F239-L243 WeakPolarHBondContact O-CG 3.32Å; F239-L243 PolarHBondContact O-N 3.12Å
240	K	79.6	Confident	70.6	Confident	27 Å²	27	74.8 Å²	74.8	12%	0.117	44%	0.436	C	S	.	.	H	α-helix	trans	-65.4	-45.3	170.8	-177.2	174.7	172.8	176.4	0	111.1	V200 C203 C236 D237 Q242 L243 V244 E250	V200-K240 PolarHBondContact O-NZ 2.82Å; C203-K240 HydrophobicContact CB-CB 4.3Å; C236-K240 PolarHBondContact O-N 2.88Å; D237-K240 PolarHBondContact O-N 3.49Å; K240-Q242 VanDerWaalsContact C-N 3.28Å; K240-Q242 PolarHBondContact O-N 2.98Å; K240-L243 PolarHBondContact O-N 2.66Å; K240-V244 HydrophobicContact CG-CG2 4.39Å; K240-V244 PolarHBondContact O-N 2.82Å; K240-E250 IonicContact NZ-OE2 3.56Å; K240-E250 PolarHBondContact NZ-OE2 3.45Å
241	N	78.9	Confident	73	Confident	117 Å²	117	66.3 Å²	66.3	63%	0.626	40%	0.399	S	S	*	.	H	α-helix	trans	-69.2	-25.6	-179.6	-64.1	-10.9	0	0	0	112.5	D237 S238 L243	D237-N241 WeakPolarHBondContact O-CB 3.09Å; D237-N241 PolarHBondContact O-N 3.37Å; D237-N241 PolarHBondContact O-ND2 2.81Å; D237-N241 PolarHBondContact O-OD1 3Å; S238-N241 PolarHBondContact O-N 2.88Å; N241-L243 PolarHBondContact O-N 2.85Å
242	Q	81.4	Confident	75.5	Confident	80 Å²	80	61.3 Å²	61.3	37%	0.374	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-12.1	169.2	-75.8	169.4	45.5	0	0	113.7	R222 S238 K240	R222-Q242 WeakPolarHBondContact CD-O 3.42Å; R222-Q242 PolarHBondContact NH1-O 3.47Å; S238-Q242 WeakPolarHBondContact O-CB 3.4Å; S238-Q242 WeakPolarHBondContact O-CG 3.29Å; S238-Q242 PolarHBondContact O-N 3.17Å; S238-Q242 PolarHBondContact O-NE2 2.71Å; S238-Q242 PolarHBondContact OG-NE2 2.92Å; K240-Q242 VanDerWaalsContact C-N 3.28Å; K240-Q242 PolarHBondContact O-N 2.98Å
243	L	83.5	Confident	78	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-32.5	-179.5	-69.6	173.9	0	0	0	113.3	L215 L219 F239 K240 N241 T245 L251 F315	L215-L243 HydrophobicContact CD2-CD1 3.65Å; L215-L243 HydrophobicContact CG-CD1 4.32Å; L219-L243 HydrophobicContact CD1-CD1 3.8Å; F239-L243 HydrophobicContact CD1-CD1 3.96Å; F239-L243 HydrophobicContact CE1-CD1 3.53Å; F239-L243 HydrophobicContact CE1-CG 4.4Å; F239-L243 HydrophobicContact CZ-CD1 4.12Å; F239-L243 WeakPolarHBondContact O-CG 3.32Å; F239-L243 PolarHBondContact O-N 3.12Å; K240-L243 PolarHBondContact O-N 2.66Å; N241-L243 PolarHBondContact O-N 2.85Å; L243-T245 PolarHBondContact O-N 3.47Å; L243-L251 HydrophobicContact CD1-CD2 4.48Å; L243-F315 HydrophobicContact CB-CD1 4.39Å; L243-F315 HydrophobicContact CD2-CD1 4.31Å; L243-F315 HydrophobicContact CD2-CD2 4.1Å; L243-F315 HydrophobicContact CD2-CE1 4.03Å; L243-F315 HydrophobicContact CD2-CE2 3.79Å; L243-F315 HydrophobicContact CD2-CG 4.34Å; L243-F315 HydrophobicContact CD2-CZ 3.75Å; L243-F315 WeakPolarHBondContact O-CB 3.41Å
244	V	85.4	Confident	80.4	Confident	31 Å²	31	51.7 Å²	51.7	19%	0.188	29%	0.29	C	S	.	.			trans	-78.1	107	173	179.1	0	0	0	0	108.7	K240 R246 N249 L251 E385	K240-V244 HydrophobicContact CG-CG2 4.39Å; K240-V244 PolarHBondContact O-N 2.82Å; V244-R246 WeakPolarHBondContact CG1-O 3.41Å; V244-N249 HydrophobicContact CG1-CB 4.02Å; V244-L251 HydrophobicContact CG2-CB 4.22Å; V244-E385 HydrophobicContact CG1-CG 4.23Å
245	T	80.8	Confident	82.5	Confident	75 Å²	75	49.6 Å²	49.6	46%	0.46	27%	0.272	S	S	.	.			trans	-85.9	-18.5	-173.3	62.2	0	0	0	0	114.3	L243 G314 F315 E385	L243-T245 PolarHBondContact O-N 3.47Å; T245-G314 VanDerWaalsContact OG1-CA 3.23Å; T245-G314 WeakPolarHBondContact OG1-CA 3.08Å; T245-F315 HydrophobicContact CG2-CB 4.43Å; T245-E385 WeakPolarHBondContact CB-OE2 3.35Å; T245-E385 PolarHBondContact N-OE1 3.3Å; T245-E385 VanDerWaalsContact N-OE1 3.16Å; T245-E385 PolarHBondContact N-OE2 2.89Å; T245-E385 PolarHBondContact OG1-OE1 3.44Å; T245-E385 PolarHBondContact OG1-OE2 2.86Å
246	R	85.8	Confident	84.4	Confident	116 Å²	116	46 Å²	46	44%	0.438	25%	0.247	S	C	.	.	S	Bend	trans	-125.1	144.7	-177.4	-47.4	-172.9	-176.6	171.4	6.7	112.4	V244 K312 H313 E385	V244-R246 WeakPolarHBondContact CG1-O 3.41Å; R246-K312 VanDerWaalsContact CZ-O 3.26Å; R246-K312 PolarHBondContact NH1-O 2.82Å; R246-K312 PolarHBondContact NH2-O 2.68Å; R246-H313 WeakPolarHBondContact CD-O 3.22Å; R246-H313 PolarHBondContact NE-O 3.2Å; R246-E385 WeakPolarHBondContact CB-OE1 3.16Å; R246-E385 PolarHBondContact N-OE1 2.97Å
247	E	84.1	Confident	86.2	Confident	197 Å²	197	45.1 Å²	45.1	92%	0.921	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	146.5	173.8	-61.1	-171.5	164.1	0	0	111.6	N249	E247-N249 PolarHBondContact O-N 2.79Å
248	G	84.9	Confident	87.6	Confident	51 Å²	51	40.6 Å²	40.6	53%	0.526	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	-19.9	-179.9	0	0	0	0	0	115.5	K388	G248-K388 WeakPolarHBondContact O-CD 3.46Å; G248-K388 WeakPolarHBondContact O-CE 3.48Å; G248-K388 VanDerWaalsContact O-CG 3.29Å; G248-K388 WeakPolarHBondContact O-CG 3.5Å
249	N	92.4	Very high	88.4	Confident	18 Å²	18	39.6 Å²	39.6	10%	0.096	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	166.6	177.1	-78.7	-10.6	0	0	0	113.6	V244 E247 H313 E385 A386 P387	V244-N249 HydrophobicContact CG1-CB 4.02Å; E247-N249 PolarHBondContact O-N 2.79Å; N249-H313 PolarHBondContact ND2-O 2.89Å; N249-E385 HydrophobicContact CB-CG 3.7Å; N249-E385 WeakPolarHBondContact CB-OE1 3.36Å; N249-E385 PolarHBondContact ND2-OE1 3.3Å; N249-A386 CarbonylContact C-O 3.2Å; N249-A386 WeakPolarHBondContact CA-O 3.34Å; N249-A386 WeakPolarHBondContact CB-O 3.46Å; N249-P387 VanDerWaalsContact OD1-CA 3.27Å; N249-P387 WeakPolarHBondContact OD1-CA 3.28Å; N249-P387 WeakPolarHBondContact OD1-CD 3.25Å; N249-P387 WeakPolarHBondContact OD1-CG 3.49Å; N249-P387 VanDerWaalsContact OD1-N 3.12Å
250	E	92.7	Very high	88.8	Confident	32 Å²	32	41 Å²	41	15%	0.15	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	162.5	171.1	-76.1	-69.1	161.2	0	0	110.7	Q199 K240 Y252 E385 A386 K388	Q199-E250 HydrophobicContact CG-CB 4.43Å; Q199-E250 PolarHBondContact NE2-OE2 3.13Å; K240-E250 IonicContact NZ-OE2 3.56Å; K240-E250 PolarHBondContact NZ-OE2 3.45Å; E250-Y252 HydrophobicContact CB-CD2 4.36Å; E250-Y252 HydrophobicContact CB-CE2 3.68Å; E250-Y252 WeakPolarHBondContact O-CD2 3.49Å; E250-E385 CarbonylContact O-C 3.55Å; E250-E385 WeakPolarHBondContact O-CA 3.08Å; E250-A386 PolarHBondContact N-O 2.86Å; E250-A386 PolarHBondContact O-N 3.44Å; E250-A386 VanDerWaalsContact O-O 3.14Å; E250-K388 HydrophobicContact CB-CG 4.35Å; E250-K388 HydrophobicContact CG-CD 4.12Å; E250-K388 HydrophobicContact CG-CG 3.48Å; E250-K388 VanDerWaalsContact CG-CG 3.48Å; E250-K388 WeakPolarHBondContact OE1-CE 3.43Å; E250-K388 IonicContact OE1-NZ 3.58Å
251	L	93.6	Very high	89.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	131	174.7	-163.8	75.7	0	0	0	110	V200 L215 L243 V244 F315 I383	V200-L251 HydrophobicContact CB-CB 4.22Å; V200-L251 HydrophobicContact CB-CD2 4.13Å; V200-L251 HydrophobicContact CB-CG 4.36Å; V200-L251 HydrophobicContact CG1-CD2 4.27Å; V200-L251 HydrophobicContact CG2-CB 4.42Å; V200-L251 HydrophobicContact CG2-CD2 4.08Å; V200-L251 HydrophobicContact CG2-CG 4.13Å; V200-L251 PolarHBondContact N-O 3.17Å; L215-L251 HydrophobicContact CD1-CD2 4.36Å; L215-L251 HydrophobicContact CD2-CD2 3.5Å; L215-L251 VanDerWaalsContact CD2-CD2 3.5Å; L243-L251 HydrophobicContact CD1-CD2 4.48Å; V244-L251 HydrophobicContact CG2-CB 4.22Å; L251-F315 HydrophobicContact CD1-CD1 3.97Å; L251-F315 HydrophobicContact CD1-CE1 4.46Å; L251-I383 HydrophobicContact CD1-CG2 3.9Å; L251-I383 HydrophobicContact CD2-CG2 3.8Å; L251-I383 HydrophobicContact CG-CG2 3.88Å
252	Y	94.6	Very high	89.7	Confident	16 Å²	16	35.7 Å²	35.7	6%	0.063	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	154.6	-178.8	-65	-96.6	0	0	0	111.2	G198 Q199 E250 I383 F384 A386 P387 K388 F390 F392	G198-Y252 CarbonylContact O-C 3.44Å; G198-Y252 VanDerWaalsContact O-CA 3.24Å; G198-Y252 WeakPolarHBondContact O-CA 3.18Å; G198-Y252 WeakPolarHBondContact O-CB 3.49Å; Q199-Y252 HydrophobicContact CB-CD1 4.29Å; Q199-Y252 HydrophobicContact CB-CE1 4.31Å; E250-Y252 HydrophobicContact CB-CD2 4.36Å; E250-Y252 HydrophobicContact CB-CE2 3.68Å; E250-Y252 WeakPolarHBondContact O-CD2 3.49Å; Y252-I383 CarbonylContact O-C 3.59Å; Y252-I383 VanDerWaalsContact O-CA 3.31Å; Y252-I383 WeakPolarHBondContact O-CA 3.46Å; Y252-F384 PolarHBondContact N-O 3.11Å; Y252-F384 PolarHBondContact O-N 2.84Å; Y252-A386 HydrophobicContact CD2-CB 3.8Å; Y252-A386 HydrophobicContact CE2-CB 3.86Å; Y252-P387 PolarHBondContact OH-O 3.41Å; Y252-K388 WeakPolarHBondContact OH-CA 3.38Å; Y252-K388 PolarHBondContact OH-O 2.85Å; Y252-K388 VanDerWaalsContact OH-O 3.12Å; Y252-F390 HydrophobicContact CD1-CD1 4.14Å; Y252-F390 HydrophobicContact CE1-CB 4.42Å; Y252-F390 HydrophobicContact CE1-CD1 4.23Å; Y252-F390 HydrophobicContact CE2-CB 4.16Å; Y252-F390 HydrophobicContact CG-CD1 4.29Å; Y252-F392 AromaticContact CD1-CE2 3.84Å; Y252-F392 HydrophobicContact CD1-CE2 3.84Å; Y252-F392 HydrophobicContact CG-CE2 4.44Å
253	H	95.6	Very high	90.1	Very high	7 Å²	7	32.3 Å²	32.3	3%	0.032	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.8	177.6	68.7	-84.3	0	0	0	112.9	N196 F197 G198 V200 V205 L382 I383 F392	N196-H253 PolarHBondContact ND2-NE2 2.93Å; N196-H253 VanDerWaalsContact ND2-NE2 3.18Å; F197-H253 CarbonylContact C-O 3.57Å; F197-H253 WeakPolarHBondContact CA-O 3.41Å; G198-H253 PolarHBondContact N-O 3.28Å; G198-H253 PolarHBondContact O-N 2.86Å; G198-H253 PolarHBondContact O-ND1 2.75Å; V200-H253 HydrophobicContact CG2-CB 3.96Å; V205-H253 HydrophobicContact CG1-CB 3.94Å; H253-L382 CarbonylContact C-O 3.47Å; H253-L382 VanDerWaalsContact CA-O 3.25Å; H253-L382 WeakPolarHBondContact CA-O 3.47Å; H253-I383 HydrophobicContact CB-CG1 4.32Å; H253-F392 VanDerWaalsContact O-CZ 3.3Å; H253-F392 WeakPolarHBondContact O-CZ 3.47Å
254	C	95.7	Very high	90.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	126.7	168.5	-168.9	0	0	0	0	110.3	F197 V381 L382 F392	F197-C254 HydrophobicContact CB-CB 4.35Å; C254-V381 WeakPolarHBondContact O-CA 3.45Å; C254-L382 HydrophobicContact CB-CB 4.32Å; C254-L382 PolarHBondContact N-O 3.41Å; C254-L382 PolarHBondContact O-N 3.29Å; C254-F392 HydrophobicContact CB-CE1 4.16Å; C254-F392 HydrophobicContact CB-CZ 4.49Å
255	V	95.6	Very high	90.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	118.2	-178.1	-177.1	0	0	0	0	109.1	L195 N196 F299 T379 V381	L195-V255 HydrophobicContact CB-CB 4.12Å; L195-V255 HydrophobicContact CB-CG1 3.78Å; L195-V255 HydrophobicContact CD1-CG1 3.95Å; L195-V255 HydrophobicContact CG-CG1 4.19Å; L195-V255 PolarHBondContact N-O 3.24Å; N196-V255 PolarHBondContact O-N 3.3Å; V255-F299 HydrophobicContact CG1-CE2 3.55Å; V255-F299 HydrophobicContact CG1-CZ 3.81Å; V255-F299 HydrophobicContact CG2-CE2 4.45Å; V255-T379 HydrophobicContact CG1-CG2 3.7Å; V255-V381 HydrophobicContact CG1-CG2 4.4Å; V255-V381 HydrophobicContact CG2-CG1 4.39Å; V255-V381 HydrophobicContact CG2-CG2 4.36Å
256	I	95.7	Very high	91.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	118.4	-173.2	-49.9	179.3	0	0	0	109.1	P189 I194 T379 I380 I400 L406	P189-I256 HydrophobicContact CG-CD1 4.1Å; I194-I256 HydrophobicContact CD1-CD1 4.42Å; I194-I256 HydrophobicContact CD1-CG1 4.01Å; I256-T379 CarbonylContact O-C 3.53Å; I256-T379 WeakPolarHBondContact O-CA 3.36Å; I256-T379 WeakPolarHBondContact O-CG2 3.4Å; I256-I380 PolarHBondContact N-O 2.88Å; I256-I380 PolarHBondContact O-N 3.4Å; I256-I400 HydrophobicContact CG2-CG2 4.2Å; I256-L406 HydrophobicContact CD1-CD2 4.34Å
257	Y	94.4	Very high	91.8	Very high	32 Å²	32	21.9 Å²	21.9	13%	0.125	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.4	179.1	168	-112.3	0	0	0	111.8	G192 K193 L195 A259 V287 P289 S378	G192-Y257 CarbonylContact C-O 3.57Å; G192-Y257 WeakPolarHBondContact CA-O 3.49Å; K193-Y257 PolarHBondContact N-O 2.55Å; K193-Y257 PolarHBondContact O-N 2.88Å; L195-Y257 HydrophobicContact CD2-CG 4.35Å; Y257-A259 HydrophobicContact CD1-CB 4.43Å; Y257-A259 HydrophobicContact CE1-CB 3.74Å; Y257-V287 HydrophobicContact CD2-CG2 4Å; Y257-V287 HydrophobicContact CE2-CG2 3.96Å; Y257-P289 HydrophobicContact CD1-CG 4.12Å; Y257-P289 HydrophobicContact CE1-CG 4.3Å; Y257-S378 WeakPolarHBondContact CD2-O 3.45Å
258	L	93.1	Very high	92.4	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.081	C	C	.	.			trans	-94.3	107.1	177.4	-62.9	81.4	0	0	0	108.5	F374 S378 I380	L258-F374 HydrophobicContact CD1-CE2 4.41Å; L258-F374 HydrophobicContact CD2-CD2 4.1Å; L258-F374 HydrophobicContact CD2-CE2 4.21Å; L258-S378 PolarHBondContact N-O 2.92Å; L258-S378 PolarHBondContact O-N 3.47Å; L258-I380 HydrophobicContact CD1-CD1 4.19Å; L258-I380 HydrophobicContact CD1-CG1 3.98Å
259	A	90	Very high	93	Very high	24 Å²	24	10.1 Å²	10.1	20%	0.198	6%	0.056	C	C	.	.			trans	-80.4	151.5	176	0	0	0	0	0	110	Y257 G261 D262 H264	Y257-A259 HydrophobicContact CD1-CB 4.43Å; Y257-A259 HydrophobicContact CE1-CB 3.74Å; A259-G261 PolarHBondContact O-N 3.39Å; A259-D262 WeakPolarHBondContact CB-OD2 3.38Å; A259-D262 PolarHBondContact N-OD2 3.19Å; A259-D262 VanDerWaalsContact O-CB 3.25Å; A259-D262 WeakPolarHBondContact O-CB 3.25Å; A259-D262 PolarHBondContact O-N 3.1Å; A259-H264 PolarHBondContact O-CE1 3.4Å; A259-H264 PolarHBondContact O-NE2 2.87Å
260	P	86.9	Confident	93.1	Very high	33 Å²	33	9.4 Å²	9.4	21%	0.214	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-21.3	-168.6	-27.9	34.8	0	0	0	117.3	Y143 F147 F169	Y143-P260 PolarHBondContact OH-O 3.19Å; F147-P260 HydrophobicContact CD1-CB 3.78Å; F147-P260 HydrophobicContact CD1-CG 4.23Å; F147-P260 HydrophobicContact CE1-CB 3.96Å; F147-P260 HydrophobicContact CE1-CG 4.12Å; F147-P260 HydrophobicContact CG-CB 4.13Å; F147-P260 HydrophobicContact CZ-CB 4.46Å; F169-P260 WeakPolarHBondContact CE2-O 3.32Å
261	G	86.4	Confident	93.3	Very high	9 Å²	9	12.2 Å²	12.2	9%	0.093	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-17.7	174.3	0	0	0	0	0	115.3	R171 A259	R171-G261 PolarHBondContact NH2-O 2.87Å; A259-G261 PolarHBondContact O-N 3.39Å
262	D	90.3	Very high	93.4	Very high	25 Å²	25	12.6 Å²	12.6	13%	0.134	7%	0.07	C	C	.	.	S	Bend	trans	-70.6	179.7	-174.9	-63.3	-33.6	0	0	0	112.3	R171 D191 A259 H264 K399	R171-D262 PolarHBondContact NH2-O 2.86Å; D191-D262 HydrophobicContact CB-CB 4.13Å; A259-D262 WeakPolarHBondContact CB-OD2 3.38Å; A259-D262 PolarHBondContact N-OD2 3.19Å; A259-D262 VanDerWaalsContact O-CB 3.25Å; A259-D262 WeakPolarHBondContact O-CB 3.25Å; A259-D262 PolarHBondContact O-N 3.1Å; D262-H264 PolarHBondContact O-CE1 3.21Å; D262-H264 VanDerWaalsContact O-CE1 3.3Å; D262-H264 PolarHBondContact O-ND1 3.48Å; D262-K399 IonicContact OD1-NZ 2.82Å; D262-K399 PolarHBondContact OD1-NZ 2.79Å; D262-K399 IonicContact OD2-NZ 3.61Å; D262-K399 PolarHBondContact OD2-NZ 2.87Å
263	Y	90.1	Very high	93.4	Very high	8 Å²	8	14.3 Å²	14.3	3%	0.031	8%	0.082	C	C	.	.			trans	-89.4	127.6	171.8	175.8	-130.4	0	0	0	110.4	R171 L173 D191 C265 H267	R171-Y263 WeakPolarHBondContact O-CE2 3.17Å; L173-Y263 HydrophobicContact CD1-CD1 3.61Å; L173-Y263 HydrophobicContact CD1-CD2 4.17Å; L173-Y263 HydrophobicContact CD1-CE1 4.04Å; L173-Y263 HydrophobicContact CD1-CG 3.68Å; L173-Y263 HydrophobicContact CD2-CD2 4.35Å; L173-Y263 HydrophobicContact CD2-CG 4.5Å; L173-Y263 HydrophobicContact CG-CD1 4.16Å; L173-Y263 HydrophobicContact CG-CD2 3.88Å; L173-Y263 HydrophobicContact CG-CE1 4.32Å; L173-Y263 HydrophobicContact CG-CE2 4.08Å; L173-Y263 HydrophobicContact CG-CG 3.93Å; D191-Y263 VanDerWaalsContact OD2-CB 3.24Å; D191-Y263 WeakPolarHBondContact OD2-CB 3.49Å; Y263-C265 HydrophobicContact CE1-CB 4.07Å; Y263-C265 HydrophobicContact CE2-CB 3.78Å; Y263-C265 VanDerWaalsContact CE2-SG 3.58Å; Y263-C265 VanDerWaalsContact CZ-CB 3.48Å; Y263-C265 WeakPolarHBondContact OH-CB 3.44Å; Y263-H267 AromaticContact CE1-NE2 3.6Å
264	H	90.1	Very high	93.5	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.081	C	C	.	.			trans	-112.6	9.1	-166.3	-69.5	82.5	0	0	0	115.3	F169 A259 D262 F374 G377	F169-H264 HydrophobicContact CD1-CB 4.11Å; F169-H264 HydrophobicContact CE1-CB 3.38Å; F169-H264 AromaticContact CE1-CD2 3.62Å; F169-H264 AromaticContact CE1-CG 3.21Å; F169-H264 AromaticContact CE1-ND1 3.53Å; F169-H264 AromaticContact CE2-CE1 3.8Å; F169-H264 AromaticContact CE2-ND1 3.86Å; F169-H264 HydrophobicContact CZ-CB 4.01Å; F169-H264 AromaticContact CZ-CD2 3.4Å; F169-H264 WeakPolarHBondContact CZ-CD2 3.28Å; F169-H264 AromaticContact CZ-CE1 3.29Å; F169-H264 WeakPolarHBondContact CZ-CE1 3.19Å; F169-H264 AromaticContact CZ-CG 3.28Å; F169-H264 AromaticContact CZ-ND1 3.22Å; F169-H264 WeakPolarHBondContact CZ-ND1 3.16Å; F169-H264 AromaticContact CZ-NE2 3.39Å; F169-H264 WeakPolarHBondContact CZ-NE2 3.39Å; A259-H264 PolarHBondContact O-CE1 3.4Å; A259-H264 PolarHBondContact O-NE2 2.87Å; D262-H264 PolarHBondContact O-CE1 3.21Å; D262-H264 VanDerWaalsContact O-CE1 3.3Å; D262-H264 PolarHBondContact O-ND1 3.48Å; H264-F374 PolarHBondContact O-N 2.84Å; H264-G377 WeakPolarHBondContact NE2-CA 3.44Å
265	C	92.3	Very high	93.3	Very high	3 Å²	3	14.6 Å²	14.6	2%	0.02	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	152.7	154.9	-49.4	0	0	0	0	108.4	Y263 G372	Y263-C265 HydrophobicContact CE1-CB 4.07Å; Y263-C265 HydrophobicContact CE2-CB 3.78Å; Y263-C265 VanDerWaalsContact CE2-SG 3.58Å; Y263-C265 VanDerWaalsContact CZ-CB 3.48Å; Y263-C265 WeakPolarHBondContact OH-CB 3.44Å; C265-G372 CarbonylContact C-O 3.58Å; C265-G372 WeakPolarHBondContact CA-O 3.29Å
266	F	94.1	Very high	93.2	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	155.4	174.8	56.9	-90.3	0	0	0	111.2	P189 L318 A320 I329 I331 L371 G372 F374 I380	P189-F266 CarbonylContact O-C 3.53Å; P189-F266 VanDerWaalsContact O-CA 3.27Å; P189-F266 WeakPolarHBondContact O-CA 3.22Å; F266-L318 HydrophobicContact CD2-CD2 4.17Å; F266-L318 HydrophobicContact CE2-CD2 4.09Å; F266-A320 HydrophobicContact CE1-CB 4.46Å; F266-A320 HydrophobicContact CZ-CB 3.97Å; F266-I329 HydrophobicContact CZ-CG2 4.43Å; F266-I331 HydrophobicContact CE2-CD1 3.74Å; F266-I331 HydrophobicContact CZ-CD1 3.67Å; F266-L371 HydrophobicContact CD2-CB 4.16Å; F266-L371 HydrophobicContact CD2-CD2 4.13Å; F266-L371 HydrophobicContact CD2-CG 4.18Å; F266-L371 HydrophobicContact CE2-CB 4.42Å; F266-L371 HydrophobicContact CE2-CD2 4.2Å; F266-L371 HydrophobicContact CE2-CG 4.05Å; F266-L371 PolarHBondContact O-N 3.23Å; F266-G372 PolarHBondContact N-O 2.78Å; F266-G372 PolarHBondContact O-N 3.22Å; F266-F374 AromaticContact CD1-CD2 3.48Å; F266-F374 HydrophobicContact CD1-CD2 3.48Å; F266-F374 VanDerWaalsContact CD1-CD2 3.48Å; F266-F374 AromaticContact CD1-CE2 3.29Å; F266-F374 HydrophobicContact CD1-CE2 3.29Å; F266-F374 HydrophobicContact CD1-CG 4.47Å; F266-F374 HydrophobicContact CD1-CZ 4.17Å; F266-F374 AromaticContact CE1-CD2 3.57Å; F266-F374 HydrophobicContact CE1-CD2 3.57Å; F266-F374 HydrophobicContact CE1-CE1 4.43Å; F266-F374 AromaticContact CE1-CE2 3.41Å; F266-F374 HydrophobicContact CE1-CE2 3.41Å; F266-F374 VanDerWaalsContact CE1-CE2 3.41Å; F266-F374 HydrophobicContact CE1-CG 4.17Å; F266-F374 AromaticContact CE1-CZ 3.89Å; F266-F374 HydrophobicContact CE1-CZ 3.89Å; F266-F374 HydrophobicContact CG-CE2 4.23Å; F266-F374 HydrophobicContact CZ-CE2 4.42Å; F266-I380 HydrophobicContact CB-CD1 3.47Å; F266-I380 VanDerWaalsContact CB-CD1 3.47Å; F266-I380 HydrophobicContact CD1-CD1 4.39Å; F266-I380 HydrophobicContact CD2-CD1 4.49Å; F266-I380 HydrophobicContact CG-CD1 3.9Å
267	H	95.6	Very high	93.2	Very high	5 Å²	5	16 Å²	16	2%	0.023	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	165.5	-163.5	-65.1	-97.1	0	0	0	110.7	P189 Y263 P269 G368 E369 H370 F402	P189-H267 WeakPolarHBondContact CB-O 3.4Å; P189-H267 PolarHBondContact O-N 3.4Å; Y263-H267 AromaticContact CE1-NE2 3.6Å; H267-P269 WeakPolarHBondContact O-CD 3.37Å; H267-G368 PolarHBondContact ND1-O 3.48Å; H267-E369 CarbonylContact C-O 3.5Å; H267-E369 WeakPolarHBondContact CA-O 3.39Å; H267-E369 WeakPolarHBondContact CB-O 3.39Å; H267-H370 AromaticContact CE1-CD2 3.67Å; H267-H370 AromaticContact CE1-CE1 3.4Å; H267-H370 PolarHBondContact CE1-CE1 3.38Å; H267-H370 VanDerWaalsContact CE1-CE1 3.4Å; H267-H370 AromaticContact CE1-CG 3.54Å; H267-H370 AromaticContact CE1-ND1 3.37Å; H267-H370 PolarHBondContact CE1-ND1 2.91Å; H267-H370 AromaticContact CE1-NE2 3.61Å; H267-H370 WeakPolarHBondContact ND1-CA 3.43Å; H267-H370 AromaticContact ND1-CG 3.82Å; H267-H370 PolarHBondContact ND1-N 3.42Å; H267-H370 AromaticContact NE2-CE1 3.98Å; H267-H370 AromaticContact NE2-ND1 3.99Å; H267-F402 HydrophobicContact CB-CD2 3.76Å; H267-F402 HydrophobicContact CB-CE2 3.26Å; H267-F402 HydrophobicContact CB-CZ 3.82Å; H267-F402 AromaticContact CD2-CD1 3.92Å; H267-F402 AromaticContact CD2-CD2 3.69Å; H267-F402 AromaticContact CD2-CE1 3.94Å; H267-F402 AromaticContact CD2-CE2 3.74Å; H267-F402 AromaticContact CD2-CG 3.82Å; H267-F402 AromaticContact CD2-CZ 3.86Å; H267-F402 AromaticContact CE1-CE1 3.96Å; H267-F402 AromaticContact CG-CD2 3.83Å; H267-F402 AromaticContact CG-CE2 3.42Å; H267-F402 VanDerWaalsContact CG-CE2 3.42Å; H267-F402 AromaticContact CG-CZ 3.54Å; H267-F402 AromaticContact ND1-CZ 3.69Å; H267-F402 AromaticContact NE2-CD1 4Å; H267-F402 AromaticContact NE2-CE1 3.9Å
268	S	96.9	Very high	93.1	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.088	C	C	.	.			trans	-65.9	122.9	173.5	-163.9	0	0	0	0	110.7	T270 W272 R366 G368 E369	S268-T270 VanDerWaalsContact C-N 3.28Å; S268-T270 PolarHBondContact O-N 3.38Å; S268-T270 PolarHBondContact OG-O 2.8Å; S268-W272 PolarHBondContact OG-NE1 3.14Å; S268-R366 WeakPolarHBondContact CB-O 3.3Å; S268-G368 PolarHBondContact O-N 3.34Å; S268-E369 PolarHBondContact N-O 3.27Å
269	P	96.1	Very high	93.2	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	-77.2	-14.8	-177.7	32.3	-36.8	0	0	0	113.2	V186 I187 P189 H267 F316 L318 L382	V186-P269 WeakPolarHBondContact CA-O 3.49Å; V186-P269 HydrophobicContact CG1-CB 4Å; I187-P269 WeakPolarHBondContact CG1-O 3.49Å; I187-P269 PolarHBondContact N-O 3.31Å; I187-P269 WeakPolarHBondContact O-CB 3.4Å; P189-P269 HydrophobicContact CB-CB 4.23Å; H267-P269 WeakPolarHBondContact O-CD 3.37Å; P269-F316 HydrophobicContact CB-CZ 4.32Å; P269-F316 HydrophobicContact CG-CE1 3.56Å; P269-F316 HydrophobicContact CG-CE2 4.47Å; P269-F316 HydrophobicContact CG-CZ 3.36Å; P269-L318 HydrophobicContact CG-CD1 4.16Å; P269-L382 HydrophobicContact CB-CD1 4.06Å; P269-L382 HydrophobicContact CG-CD1 4.3Å; P269-L382 HydrophobicContact CG-CD2 4.05Å
270	T	95.9	Very high	93.3	Very high	4 Å²	4	15.9 Å²	15.9	3%	0.025	9%	0.087	C	C	.	.	S	Bend	trans	-156.8	-179.5	-178	-163.6	0	0	0	0	109.5	S185 S268 W272 W311 F316 K367	S185-T270 WeakPolarHBondContact O-CB 3.47Å; S185-T270 PolarHBondContact O-OG1 3.15Å; S268-T270 VanDerWaalsContact C-N 3.28Å; S268-T270 PolarHBondContact O-N 3.38Å; S268-T270 PolarHBondContact OG-O 2.8Å; T270-W272 HydrophobicContact CG2-CB 4.12Å; T270-W272 HydrophobicContact CG2-CG 4.37Å; T270-W311 HydrophobicContact CG2-CB 4.03Å; T270-W311 HydrophobicContact CG2-CD2 4.2Å; T270-W311 HydrophobicContact CG2-CE3 3.67Å; T270-W311 HydrophobicContact CG2-CG 4.41Å; T270-W311 HydrophobicContact CG2-CZ3 4.43Å; T270-F316 HydrophobicContact CG2-CD2 4.05Å; T270-F316 HydrophobicContact CG2-CE2 3.82Å; T270-F316 HydrophobicContact CG2-CZ 4.19Å; T270-K367 WeakPolarHBondContact O-CA 3.27Å; T270-K367 PolarHBondContact O-N 3.26Å
271	D	95.8	Very high	93.5	Very high	90 Å²	90	15.4 Å²	15.4	48%	0.481	8%	0.084	S	C	.	.	S	Bend	trans	-84.4	115.3	167.9	-57.9	-69.7	0	0	0	108.5	M365 R366 K367	D271-M365 WeakPolarHBondContact CA-O 3.11Å; D271-R366 WeakPolarHBondContact OD1-CA 3.37Å; D271-K367 PolarHBondContact OD1-N 3.18Å
272	W	96.1	Very high	93.6	Very high	8 Å²	8	15.6 Å²	15.6	3%	0.03	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	165.3	-175.9	72.1	-52.9	0	0	0	111.9	S268 T270 V274 L307 D310 W311 F316 L318 M365 L371	S268-W272 PolarHBondContact OG-NE1 3.14Å; T270-W272 HydrophobicContact CG2-CB 4.12Å; T270-W272 HydrophobicContact CG2-CG 4.37Å; W272-V274 HydrophobicContact CD2-CG2 4.14Å; W272-V274 HydrophobicContact CE3-CG2 4.16Å; W272-V274 HydrophobicContact CH2-CG2 3.77Å; W272-V274 HydrophobicContact CZ2-CG2 3.68Å; W272-V274 HydrophobicContact CZ3-CG2 3.99Å; W272-L307 HydrophobicContact CH2-CB 3.93Å; W272-D310 CarbonylContact C-O 3.58Å; W272-D310 WeakPolarHBondContact CA-O 3.18Å; W272-D310 WeakPolarHBondContact CB-O 3.42Å; W272-W311 HydrophobicContact CB-CB 3.64Å; W272-F316 HydrophobicContact CD2-CB 4.45Å; W272-F316 AromaticContact CD2-CD1 3.79Å; W272-F316 HydrophobicContact CD2-CD1 3.79Å; W272-F316 HydrophobicContact CD2-CG 4.32Å; W272-F316 HydrophobicContact CE3-CB 3.81Å; W272-F316 AromaticContact CE3-CD1 3.6Å; W272-F316 HydrophobicContact CE3-CD1 3.6Å; W272-F316 HydrophobicContact CE3-CG 4.05Å; W272-F316 HydrophobicContact CG-CD1 4.41Å; W272-F316 HydrophobicContact CH2-CD1 4.11Å; W272-F316 HydrophobicContact CZ2-CD1 4.31Å; W272-F316 HydrophobicContact CZ3-CB 4.32Å; W272-F316 AromaticContact CZ3-CD1 3.76Å; W272-F316 HydrophobicContact CZ3-CD1 3.76Å; W272-L318 HydrophobicContact CH2-CB 3.95Å; W272-L318 HydrophobicContact CZ2-CB 4.02Å; W272-M365 PolarHBondContact N-O 3.44Å; W272-M365 VanDerWaalsContact N-O 3.08Å; W272-M365 PolarHBondContact O-N 3.44Å; W272-L371 HydrophobicContact CZ2-CD2 4.38Å
273	T	95.9	Very high	93.5	Very high	52 Å²	52	15.9 Å²	15.9	32%	0.319	9%	0.09	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	114.6	-179.1	-70.7	0	0	0	0	109.7	S275 G309 D310 E361	T273-S275 PolarHBondContact O-N 3.14Å; T273-G309 CarbonylContact O-C 3.59Å; T273-G309 WeakPolarHBondContact O-CA 3.35Å; T273-D310 PolarHBondContact N-O 3.27Å; T273-D310 PolarHBondContact O-N 3.45Å; T273-E361 WeakPolarHBondContact CG2-O 3.21Å
274	V	95.7	Very high	93.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	113.4	177.9	-169.1	0	0	0	0	109.3	W272 L307 F333 F354 V363 M365	W272-V274 HydrophobicContact CD2-CG2 4.14Å; W272-V274 HydrophobicContact CE3-CG2 4.16Å; W272-V274 HydrophobicContact CH2-CG2 3.77Å; W272-V274 HydrophobicContact CZ2-CG2 3.68Å; W272-V274 HydrophobicContact CZ3-CG2 3.99Å; V274-L307 HydrophobicContact CG1-CB 4.01Å; V274-L307 HydrophobicContact CG1-CD2 4.31Å; V274-F333 HydrophobicContact CB-CZ 4.27Å; V274-F333 HydrophobicContact CG1-CZ 4.22Å; V274-F333 HydrophobicContact CG2-CZ 4.18Å; V274-F354 HydrophobicContact CG1-CD2 3.97Å; V274-F354 HydrophobicContact CG1-CE2 4.03Å; V274-V363 HydrophobicContact CB-CB 4.4Å; V274-V363 PolarHBondContact N-O 3.02Å; V274-V363 PolarHBondContact O-N 3.46Å; V274-M365 HydrophobicContact CG2-CG 3.86Å
275	S	92.9	Very high	93.4	Very high	13 Å²	13	15.7 Å²	15.7	9%	0.091	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-32.9	-179	57.5	0	0	0	0	112.7	T273 T308 F354 V355	T273-S275 PolarHBondContact O-N 3.14Å; S275-T308 PolarHBondContact N-O 2.92Å; S275-T308 PolarHBondContact OG-O 2.91Å; S275-F354 PolarHBondContact O-N 2.67Å; S275-V355 PolarHBondContact O-N 2.9Å
276	H	93.2	Very high	93.2	Very high	25 Å²	25	17.1 Å²	17.1	12%	0.116	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	142.2	-170.4	175.3	-100.9	0	0	0	113.6	T308 D351 F352	H276-T308 PolarHBondContact N-O 2.91Å; H276-T308 VanDerWaalsContact N-O 3.08Å; H276-T308 PolarHBondContact O-N 3.39Å; H276-T308 PolarHBondContact O-OG1 2.86Å; H276-D351 IonicContact CE1-OD1 3.92Å; H276-D351 IonicContact CE1-OD2 2.7Å; H276-D351 VanDerWaalsContact NE2-CB 3.33Å; H276-D351 WeakPolarHBondContact NE2-CB 2.99Å; H276-D351 IonicContact NE2-OD1 3.81Å; H276-D351 IonicContact NE2-OD2 3.52Å; H276-F352 WeakPolarHBondContact CA-O 3.13Å; H276-F352 PolarHBondContact CD2-O 3.24Å; H276-F352 PolarHBondContact NE2-N 3.4Å
277	R	94.6	Very high	92.9	Very high	6 Å²	6	17.2 Å²	17.2	2%	0.023	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	132.7	166.9	171.2	-178	58.9	71	-17.3	110.5	V305 V306 L307 D334 N350 D351 F352 F354	R277-V305 HydrophobicContact CG-CG1 3.91Å; R277-V306 WeakPolarHBondContact CA-O 3.36Å; R277-L307 HydrophobicContact CB-CD2 3.82Å; R277-L307 HydrophobicContact CG-CD2 4.08Å; R277-D334 VanDerWaalsContact CD-OD2 3.25Å; R277-D334 WeakPolarHBondContact CD-OD2 3.2Å; R277-D334 IonicContact CZ-OD2 2.76Å; R277-D334 IonicContact NE-OD2 3.53Å; R277-D334 PolarHBondContact NE-OD2 3.26Å; R277-D334 IonicContact NH2-OD2 3.97Å; R277-N350 PolarHBondContact NH1-O 2.91Å; R277-N350 VanDerWaalsContact NH1-O 3.15Å; R277-N350 PolarHBondContact NH1-OD1 3.47Å; R277-N350 PolarHBondContact NH2-OD1 2.87Å; R277-D351 CarbonylContact O-C 3.58Å; R277-D351 WeakPolarHBondContact O-CA 3.36Å; R277-F352 HydrophobicContact CB-CB 4.45Å; R277-F352 PolarHBondContact N-O 3.38Å; R277-F352 PolarHBondContact O-N 3.25Å; R277-F354 HydrophobicContact CB-CE2 3.63Å; R277-F354 HydrophobicContact CB-CZ 3.76Å
278	R	94	Very high	92.6	Very high	13 Å²	13	19.4 Å²	19.4	5%	0.049	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.6	157.7	-176.2	167.5	-71.7	154.2	-11.7	111.5	L219 G220 P221 T223 F280 V306 Y349 D351	L219-R278 WeakPolarHBondContact O-CD 3.36Å; L219-R278 PolarHBondContact O-NH1 3.03Å; G220-R278 VanDerWaalsContact CA-NH1 3.31Å; G220-R278 PolarHBondContact O-NH1 3.19Å; P221-R278 VanDerWaalsContact O-CZ 3.29Å; P221-R278 PolarHBondContact O-NH1 3.26Å; P221-R278 PolarHBondContact O-NH2 3.13Å; T223-R278 PolarHBondContact OG1-NH2 3.16Å; R278-F280 HydrophobicContact CB-CE2 4.29Å; R278-F280 HydrophobicContact CG-CD2 3.89Å; R278-F280 HydrophobicContact CG-CE2 3.51Å; R278-F280 HydrophobicContact CG-CZ 3.88Å; R278-V306 HydrophobicContact CB-CB 4.34Å; R278-V306 PolarHBondContact N-O 2.97Å; R278-V306 PolarHBondContact O-N 3.5Å; R278-Y349 HydrophobicContact CG-CD2 4.2Å; R278-Y349 HydrophobicContact CG-CG 4.28Å; R278-D351 WeakPolarHBondContact CB-OD1 3.3Å; R278-D351 WeakPolarHBondContact CD-OD1 3.19Å; R278-D351 VanDerWaalsContact CG-OD1 3.23Å; R278-D351 WeakPolarHBondContact CG-OD1 3.49Å; R278-D351 IonicContact CZ-OD1 3.7Å; R278-D351 IonicContact CZ-OD2 3.57Å; R278-D351 IonicContact NE-OD1 2.66Å; R278-D351 PolarHBondContact NE-OD1 3.14Å; R278-D351 IonicContact NE-OD2 2.78Å; R278-D351 PolarHBondContact NE-OD2 3.32Å; R278-D351 IonicContact NH2-OD1 2.76Å; R278-D351 PolarHBondContact NH2-OD1 2.83Å; R278-D351 IonicContact NH2-OD2 3.75Å; R278-D351 PolarHBondContact NH2-OD2 3.42Å
279	H	94.1	Very high	92	Very high	16 Å²	16	21.3 Å²	21.3	7%	0.074	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	119.7	169	171	-140.4	0	0	0	109.7	P281 E303 L337 Y349 N350	H279-P281 WeakPolarHBondContact O-CD 3.48Å; H279-E303 IonicContact CE1-OE1 2.76Å; H279-E303 PolarHBondContact CE1-OE1 3.24Å; H279-E303 IonicContact NE2-OE1 2.74Å; H279-E303 PolarHBondContact NE2-OE1 3.44Å; H279-L337 HydrophobicContact CB-CD1 4.17Å; H279-Y349 CarbonylContact O-C 3.54Å; H279-Y349 VanDerWaalsContact O-CA 3.29Å; H279-Y349 WeakPolarHBondContact O-CA 3.43Å; H279-N350 HydrophobicContact CB-CB 4.37Å; H279-N350 PolarHBondContact N-O 3.08Å; H279-N350 PolarHBondContact O-N 2.99Å
280	F	92.5	Very high	91.5	Very high	24 Å²	24	23.1 Å²	23.1	11%	0.105	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	106.5	166.8	-65.6	-91.8	0	0	0	108	F218 R278 E303 R304 V306 Y349	F218-F280 VanDerWaalsContact O-CE2 3.29Å; F218-F280 WeakPolarHBondContact O-CE2 3.36Å; R278-F280 HydrophobicContact CB-CE2 4.29Å; R278-F280 HydrophobicContact CG-CD2 3.89Å; R278-F280 HydrophobicContact CG-CE2 3.51Å; R278-F280 HydrophobicContact CG-CZ 3.88Å; F280-E303 CarbonylContact O-C 3.59Å; F280-E303 VanDerWaalsContact O-CA 3.24Å; F280-E303 WeakPolarHBondContact O-CA 3.32Å; F280-R304 HydrophobicContact CB-CG 3.86Å; F280-R304 HydrophobicContact CD2-CG 3.96Å; F280-R304 VanDerWaalsContact CD2-CZ 3.49Å; F280-R304 HydrophobicContact CG-CG 4.29Å; F280-R304 VanDerWaalsContact CG-CZ 3.49Å; F280-R304 PolarHBondContact N-O 2.88Å; F280-R304 PolarHBondContact O-N 3.46Å; F280-V306 HydrophobicContact CD2-CG2 4Å; F280-V306 HydrophobicContact CE2-CG2 3.78Å; F280-Y349 HydrophobicContact CE1-CD1 4.24Å; F280-Y349 HydrophobicContact CE1-CG 4.36Å
281	P	90.7	Very high	91	Very high	22 Å²	22	24.4 Å²	24.4	14%	0.143	15%	0.148	C	C	.	.			trans	-77.8	146.2	168.9	17.1	-2.1	0	0	0	109.4	H279 H344 S348	H279-P281 WeakPolarHBondContact O-CD 3.48Å; P281-H344 HydrophobicContact CB-CB 4.38Å; P281-H344 WeakPolarHBondContact CB-ND1 3.32Å; P281-H344 WeakPolarHBondContact CG-ND1 3.44Å; P281-H344 PolarHBondContact O-CE1 3.21Å; P281-H344 PolarHBondContact O-NE2 2.79Å; P281-S348 VanDerWaalsContact CD-O 3.32Å; P281-S348 WeakPolarHBondContact CD-O 3.29Å
282	G	88.6	Confident	90.5	Very high	13 Å²	13	20.1 Å²	20.1	13%	0.134	13%	0.126	C	C	.	.			trans	-169.5	-154.6	-169.2	0	0	0	0	0	113.9	R117	R117-G282 WeakPolarHBondContact CD-O 3.47Å; R117-G282 PolarHBondContact NH1-O 3.47Å
283	S	88.1	Confident	89.9	Confident	31 Å²	31	23.3 Å²	23.3	22%	0.217	14%	0.138	C	C	.	.	B	Isolated β-bridge	trans	-71.2	167.3	174.6	-62.9	0	0	0	0	112.3	H301 N302 E303	S283-H301 WeakPolarHBondContact CB-O 3.31Å; S283-H301 PolarHBondContact N-O 3.33Å; S283-N302 CarbonylContact O-C 3.57Å; S283-N302 VanDerWaalsContact O-CA 3.27Å; S283-N302 WeakPolarHBondContact O-CA 3.26Å; S283-N302 PolarHBondContact O-OD1 3.14Å; S283-E303 PolarHBondContact O-N 3.08Å
284	L	88.8	Confident	89.3	Confident	3 Å²	3	24.2 Å²	24.2	2%	0.016	14%	0.135	C	C	.	.			trans	-124.3	63.6	167.9	-71.7	179.3	0	0	0	108.6	T116 R117 E303 T324	T116-L284 VanDerWaalsContact CB-O 3.25Å; T116-L284 WeakPolarHBondContact CB-O 3.42Å; T116-L284 WeakPolarHBondContact CG2-O 3.42Å; R117-L284 HydrophobicContact CG-CD1 4.3Å; R117-L284 HydrophobicContact CG-CG 4.31Å; L284-E303 HydrophobicContact CD2-CB 4.03Å; L284-T324 WeakPolarHBondContact O-CA 3.42Å; L284-T324 WeakPolarHBondContact O-CB 3.16Å; L284-T324 PolarHBondContact O-N 2.84Å; L284-T324 VanDerWaalsContact O-N 3.08Å; L284-T324 PolarHBondContact O-OG1 3.17Å
285	M	88.8	Confident	88.8	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	14%	0.135	C	C	.	.			trans	-77.1	154.3	175.2	-69.2	-174.6	-74.8	0	0	111	Y111 K112 V287 I295 L298 H301 N302 A323 T324	Y111-M285 HydrophobicContact CD1-CG 3.93Å; Y111-M285 HydrophobicContact CD1-SD 3.8Å; Y111-M285 HydrophobicContact CE1-CB 3.72Å; Y111-M285 HydrophobicContact CE1-CG 3.54Å; Y111-M285 HydrophobicContact CE1-SD 3.95Å; K112-M285 HydrophobicContact CG-SD 4.02Å; M285-V287 PolarHBondContact O-N 3.12Å; M285-I295 HydrophobicContact SD-CD1 4Å; M285-L298 HydrophobicContact CB-CD1 3.55Å; M285-L298 HydrophobicContact CE-CD1 3.85Å; M285-L298 HydrophobicContact CG-CD1 4.44Å; M285-L298 HydrophobicContact SD-CD1 4.16Å; M285-H301 HydrophobicContact CE-CB 3.34Å; M285-N302 VanDerWaalsContact CB-OD1 3.3Å; M285-N302 WeakPolarHBondContact CB-OD1 3.24Å; M285-N302 PolarHBondContact N-OD1 3.42Å; M285-N302 PolarHBondContact O-ND2 2.92Å; M285-A323 VanDerWaalsContact O-CA 3.23Å; M285-A323 WeakPolarHBondContact O-CA 3.37Å; M285-A323 WeakPolarHBondContact O-CB 3.44Å; M285-T324 PolarHBondContact O-N 3.12Å
286	S	88.8	Confident	88.5	Confident	33 Å²	33	27.4 Å²	27.4	23%	0.231	15%	0.148	C	C	.	.			trans	-73.5	121	-177.3	-175.4	0	0	0	0	110.5	Y111 N288 M291 T324	Y111-S286 PolarHBondContact OH-N 3.23Å; S286-N288 PolarHBondContact O-N 2.9Å; S286-N288 PolarHBondContact OG-ND2 3.35Å; S286-M291 WeakPolarHBondContact O-CB 3.07Å; S286-T324 PolarHBondContact N-OG1 2.93Å
287	V	88.3	Confident	88.2	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.012	15%	0.154	C	C	.	.			trans	-84.7	15.9	-179.8	-59.2	0	0	0	0	113.8	Y257 M285 F299 N302 V321 A323 T379	Y257-V287 HydrophobicContact CD2-CG2 4Å; Y257-V287 HydrophobicContact CE2-CG2 3.96Å; M285-V287 PolarHBondContact O-N 3.12Å; V287-F299 HydrophobicContact CB-CE1 4.28Å; V287-F299 HydrophobicContact CG1-CD1 4.35Å; V287-F299 HydrophobicContact CG1-CE1 4.32Å; V287-N302 WeakPolarHBondContact CG1-ND2 3.45Å; V287-V321 HydrophobicContact CG1-CG1 4.44Å; V287-A323 HydrophobicContact CB-CB 4.22Å; V287-A323 HydrophobicContact CG1-CB 3.8Å; V287-A323 HydrophobicContact CG2-CB 3.62Å; V287-T379 VanDerWaalsContact CG2-OG1 3.3Å; V287-T379 WeakPolarHBondContact CG2-OG1 3.45Å
288	N	88.1	Confident	88	Confident	52 Å²	52	28.5 Å²	28.5	28%	0.278	15%	0.153	S	C	.	.	S	Bend	trans	-64.1	154.6	-179.2	78.8	65.6	0	0	0	111.7	S286 G290 M291 A292	S286-N288 PolarHBondContact O-N 2.9Å; S286-N288 PolarHBondContact OG-ND2 3.35Å; N288-G290 PolarHBondContact O-N 3.3Å; N288-G290 WeakPolarHBondContact OD1-CA 3.41Å; N288-G290 PolarHBondContact OD1-N 2.85Å; N288-M291 VanDerWaalsContact ND2-CG 3.26Å; N288-M291 WeakPolarHBondContact ND2-CG 3.32Å; N288-M291 PolarHBondContact O-N 3.15Å; N288-M291 PolarHBondContact OD1-N 3.15Å; N288-A292 PolarHBondContact O-N 2.84Å
289	P	85.7	Confident	87.8	Confident	40 Å²	40	27.9 Å²	27.9	26%	0.26	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.8	-173.2	-23.9	33.1	0	0	0	115.8	L195 Y257 R293	L195-P289 HydrophobicContact CD2-CB 4.33Å; L195-P289 HydrophobicContact CD2-CG 3.86Å; Y257-P289 HydrophobicContact CD1-CG 4.12Å; Y257-P289 HydrophobicContact CE1-CG 4.3Å; P289-R293 WeakPolarHBondContact O-CG 3.26Å
290	G	84.3	Confident	87.7	Confident	37 Å²	37	28.1 Å²	28.1	38%	0.381	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-49.2	171.4	0	0	0	0	0	111.4	N288 R293 W294	N288-G290 PolarHBondContact O-N 3.3Å; N288-G290 WeakPolarHBondContact OD1-CA 3.41Å; N288-G290 PolarHBondContact OD1-N 2.85Å; G290-R293 PolarHBondContact O-N 3.28Å; G290-W294 PolarHBondContact O-N 2.88Å
291	M	85.1	Confident	87.5	Confident	31 Å²	31	29.8 Å²	29.8	15%	0.153	16%	0.162	C	C	.	.	H	α-helix	trans	-66.9	-36.8	178.9	-63.1	-64.3	-63.6	0	0	112.2	Y111 S286 N288 R293 W294 I295 L298	Y111-M291 HydrophobicContact CD1-CE 4Å; Y111-M291 HydrophobicContact CE1-CE 3.47Å; Y111-M291 VanDerWaalsContact CE1-CE 3.47Å; Y111-M291 HydrophobicContact CE2-CE 4.09Å; Y111-M291 HydrophobicContact CG-CE 4.5Å; S286-M291 WeakPolarHBondContact O-CB 3.07Å; N288-M291 VanDerWaalsContact ND2-CG 3.26Å; N288-M291 WeakPolarHBondContact ND2-CG 3.32Å; N288-M291 PolarHBondContact O-N 3.15Å; N288-M291 PolarHBondContact OD1-N 3.15Å; M291-R293 PolarHBondContact O-N 2.95Å; M291-W294 HydrophobicContact CE-CE3 3.72Å; M291-W294 HydrophobicContact CE-CZ3 3.8Å; M291-W294 PolarHBondContact O-N 2.89Å; M291-W294 HydrophobicContact SD-CE3 4Å; M291-W294 HydrophobicContact SD-CZ3 4.38Å; M291-I295 HydrophobicContact CE-CD1 3.68Å; M291-I295 HydrophobicContact CE-CG1 4.45Å; M291-I295 PolarHBondContact O-N 3.13Å; M291-L298 HydrophobicContact CB-CD2 4.34Å
292	A	85.2	Confident	87.5	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-70.4	-12.4	176.8	0	0	0	0	0	114.3	Q207 V208 N288 L298	Q207-A292 HydrophobicContact CG-CB 4.42Å; Q207-A292 PolarHBondContact NE2-O 3.07Å; V208-A292 HydrophobicContact CG2-CB 3.65Å; N288-A292 PolarHBondContact O-N 2.84Å; A292-L298 HydrophobicContact CB-CD2 3.98Å
293	R	85.4	Confident	87.7	Confident	76 Å²	76	28.3 Å²	28.3	29%	0.287	15%	0.149	S	C	.	.	H	α-helix	trans	-93.4	-13.5	166.7	-68.5	-170.9	-54	164.6	9.2	113.5	E88 V208 P289 G290 M291	E88-R293 IonicContact OE1-NH1 3.44Å; E88-R293 IonicContact OE1-NH2 3.29Å; E88-R293 PolarHBondContact OE1-NH2 3.44Å; E88-R293 IonicContact OE2-CZ 3.2Å; E88-R293 IonicContact OE2-NH1 2.73Å; E88-R293 PolarHBondContact OE2-NH1 2.76Å; E88-R293 IonicContact OE2-NH2 3.44Å; E88-R293 PolarHBondContact OE2-NH2 2.88Å; V208-R293 HydrophobicContact CB-CG 3.92Å; V208-R293 HydrophobicContact CG1-CG 3.52Å; P289-R293 WeakPolarHBondContact O-CG 3.26Å; G290-R293 PolarHBondContact O-N 3.28Å; M291-R293 PolarHBondContact O-N 2.95Å
294	W	82.8	Confident	88	Confident	70 Å²	70	27.1 Å²	27.1	27%	0.265	14%	0.14	S	C	.	.	H	α-helix	trans	-101.8	-44.4	-174.9	-174.4	53.8	0	0	0	111.8	L102 A103 E107 G290 M291	L102-W294 CarbonylContact C-O 3.55Å; L102-W294 WeakPolarHBondContact CA-O 3.4Å; A103-W294 HydrophobicContact CB-CD2 3.72Å; A103-W294 VanDerWaalsContact CB-CE2 3.43Å; A103-W294 HydrophobicContact CB-CE3 4.37Å; A103-W294 HydrophobicContact CB-CG 3.94Å; A103-W294 HydrophobicContact CB-CZ2 3.89Å; A103-W294 WeakPolarHBondContact CB-O 3.49Å; A103-W294 PolarHBondContact N-O 2.91Å; E107-W294 HydrophobicContact CB-CH2 4.02Å; E107-W294 HydrophobicContact CB-CZ2 3.69Å; E107-W294 HydrophobicContact CG-CZ2 4.28Å; G290-W294 PolarHBondContact O-N 2.88Å; M291-W294 HydrophobicContact CE-CE3 3.72Å; M291-W294 HydrophobicContact CE-CZ3 3.8Å; M291-W294 PolarHBondContact O-N 2.89Å; M291-W294 HydrophobicContact SD-CE3 4Å; M291-W294 HydrophobicContact SD-CZ3 4.38Å
295	I	84.9	Confident	88.3	Confident	1 Å²	1	27 Å²	27	1%	0.005	14%	0.14	C	C	.	.	S	Bend	trans	-95.9	111.9	-178.8	-59.2	-178.3	0	0	0	109.6	Y111 Q207 M285 M291 L298	Y111-I295 HydrophobicContact CD1-CD1 3.68Å; Y111-I295 HydrophobicContact CE1-CD1 3.97Å; Q207-I295 PolarHBondContact NE2-O 3.23Å; M285-I295 HydrophobicContact SD-CD1 4Å; M291-I295 HydrophobicContact CE-CD1 3.68Å; M291-I295 HydrophobicContact CE-CG1 4.45Å; M291-I295 PolarHBondContact O-N 3.13Å; I295-L298 HydrophobicContact CB-CB 4.21Å; I295-L298 HydrophobicContact CB-CD1 4.26Å; I295-L298 HydrophobicContact CD1-CD1 4.3Å; I295-L298 HydrophobicContact CG2-CB 4.06Å; I295-L298 HydrophobicContact CG2-CD1 4.09Å
296	K	86.1	Confident	88.7	Confident	80 Å²	80	27 Å²	27	35%	0.348	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	144	168.1	-153	-149.1	175.1	-153.5	0	109.4	L102 V211 T212 L298	L102-K296 HydrophobicContact CD2-CB 4.29Å; V211-K296 HydrophobicContact CG1-CB 4.37Å; V211-K296 HydrophobicContact CG1-CG 4.09Å; T212-K296 VanDerWaalsContact O-CE 3.27Å; T212-K296 WeakPolarHBondContact O-CE 3.43Å; K296-L298 PolarHBondContact O-N 2.7Å; K296-L298 VanDerWaalsContact O-N 3.12Å
297	E	87.2	Confident	89	Confident	53 Å²	53	25.5 Å²	25.5	25%	0.248	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	27.4	174.6	-58.5	172.8	-164.8	0	0	114.4	F299 C300 H301	E297-F299 VanDerWaalsContact C-N 3.25Å; E297-F299 PolarHBondContact O-N 2.74Å; E297-C300 HydrophobicContact CB-CB 4.23Å; E297-C300 PolarHBondContact O-N 3.46Å; E297-H301 PolarHBondContact O-N 2.97Å
298	L	89.8	Confident	89.4	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-54.2	-40.9	-178.9	177.4	60	0	0	0	112.1	M285 M291 A292 I295 K296 N302	M285-L298 HydrophobicContact CB-CD1 3.55Å; M285-L298 HydrophobicContact CE-CD1 3.85Å; M285-L298 HydrophobicContact CG-CD1 4.44Å; M285-L298 HydrophobicContact SD-CD1 4.16Å; M291-L298 HydrophobicContact CB-CD2 4.34Å; A292-L298 HydrophobicContact CB-CD2 3.98Å; I295-L298 HydrophobicContact CB-CB 4.21Å; I295-L298 HydrophobicContact CB-CD1 4.26Å; I295-L298 HydrophobicContact CD1-CD1 4.3Å; I295-L298 HydrophobicContact CG2-CB 4.06Å; I295-L298 HydrophobicContact CG2-CD1 4.09Å; K296-L298 PolarHBondContact O-N 2.7Å; K296-L298 VanDerWaalsContact O-N 3.12Å; L298-N302 PolarHBondContact O-N 3.33Å; L298-N302 VanDerWaalsContact O-N 3.15Å
299	F	91.1	Very high	89.7	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-72.9	-31.1	178.3	-54.5	-21.6	0	0	0	112.9	L195 Q207 Y213 F218 V255 V287 E297 V321 T379 V381	L195-F299 HydrophobicContact CD1-CZ 4.24Å; Q207-F299 HydrophobicContact CB-CE2 4.4Å; Q207-F299 HydrophobicContact CG-CD2 3.99Å; Q207-F299 HydrophobicContact CG-CE1 4.16Å; Q207-F299 HydrophobicContact CG-CE2 3.58Å; Q207-F299 HydrophobicContact CG-CG 4.44Å; Q207-F299 HydrophobicContact CG-CZ 3.66Å; Y213-F299 AromaticContact CE1-CD2 3.69Å; Y213-F299 HydrophobicContact CE1-CD2 3.69Å; Y213-F299 HydrophobicContact CE1-CE2 4.29Å; Y213-F299 AromaticContact CZ-CD2 3.97Å; F218-F299 HydrophobicContact CD2-CB 4.34Å; F218-F299 HydrophobicContact CE2-CB 3.83Å; V255-F299 HydrophobicContact CG1-CE2 3.55Å; V255-F299 HydrophobicContact CG1-CZ 3.81Å; V255-F299 HydrophobicContact CG2-CE2 4.45Å; V287-F299 HydrophobicContact CB-CE1 4.28Å; V287-F299 HydrophobicContact CG1-CD1 4.35Å; V287-F299 HydrophobicContact CG1-CE1 4.32Å; E297-F299 VanDerWaalsContact C-N 3.25Å; E297-F299 PolarHBondContact O-N 2.74Å; F299-V321 HydrophobicContact CB-CG1 4.24Å; F299-V321 HydrophobicContact CB-CG2 4.41Å; F299-V321 HydrophobicContact CD1-CG1 4.24Å; F299-V321 HydrophobicContact CG-CG1 4.49Å; F299-T379 HydrophobicContact CE1-CG2 4.18Å; F299-T379 HydrophobicContact CE2-CG2 4.19Å; F299-T379 HydrophobicContact CZ-CG2 3.85Å; F299-V381 HydrophobicContact CD2-CG2 4Å; F299-V381 HydrophobicContact CE2-CG2 4.21Å
300	C	90.6	Very high	90.1	Very high	21 Å²	21	25.9 Å²	25.9	14%	0.142	13%	0.13	C	C	.	.	H	α-helix	trans	-74.8	-29.4	175.4	-59.1	0	0	0	0	112.3	Y213 E297 R304	Y213-C300 VanDerWaalsContact CD2-SG 3.56Å; E297-C300 HydrophobicContact CB-CB 4.23Å; E297-C300 PolarHBondContact O-N 3.46Å; C300-R304 PolarHBondContact O-NH1 3.4Å
301	H	89.2	Confident	90.6	Very high	59 Å²	59	24.6 Å²	24.6	27%	0.273	11%	0.114	S	C	.	.	H	α-helix	trans	-79.8	-24.2	175.3	-70.2	-15.1	0	0	0	114.4	K112 S283 M285 E297	K112-H301 VanDerWaalsContact CE-CD2 3.49Å; K112-H301 WeakPolarHBondContact CE-CD2 3.44Å; K112-H301 PolarHBondContact NZ-CD2 3.15Å; K112-H301 PolarHBondContact NZ-NE2 3.41Å; S283-H301 WeakPolarHBondContact CB-O 3.31Å; S283-H301 PolarHBondContact N-O 3.33Å; M285-H301 HydrophobicContact CE-CB 3.34Å; E297-H301 PolarHBondContact O-N 2.97Å
302	N	91.3	Very high	91	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-82.6	155.1	179.9	-89.8	4.7	0	0	0	112.8	S283 M285 V287 L298 R304 V321 G322	S283-N302 CarbonylContact O-C 3.57Å; S283-N302 VanDerWaalsContact O-CA 3.27Å; S283-N302 WeakPolarHBondContact O-CA 3.26Å; S283-N302 PolarHBondContact O-OD1 3.14Å; M285-N302 VanDerWaalsContact CB-OD1 3.3Å; M285-N302 WeakPolarHBondContact CB-OD1 3.24Å; M285-N302 PolarHBondContact N-OD1 3.42Å; M285-N302 PolarHBondContact O-ND2 2.92Å; V287-N302 WeakPolarHBondContact CG1-ND2 3.45Å; L298-N302 PolarHBondContact O-N 3.33Å; L298-N302 VanDerWaalsContact O-N 3.15Å; N302-R304 PolarHBondContact O-N 3.06Å; N302-V321 HydrophobicContact CB-CG1 4.04Å; N302-G322 PolarHBondContact ND2-O 3.17Å
303	E	92.5	Very high	91.4	Very high	3 Å²	3	29.1 Å²	29.1	1%	0.014	13%	0.133	C	C	.	.			trans	-60.6	125.9	167.4	175.1	160.4	-146.2	0	0	110.1	R117 H279 F280 S283 L284 G322 T339 N340	R117-E303 IonicContact CZ-OE2 2.55Å; R117-E303 IonicContact NH1-OE2 2.7Å; R117-E303 PolarHBondContact NH1-OE2 2.95Å; R117-E303 IonicContact NH2-OE1 3.94Å; R117-E303 IonicContact NH2-OE2 3.14Å; R117-E303 PolarHBondContact NH2-OE2 3.13Å; R117-E303 VanDerWaalsContact NH2-OE2 3.12Å; H279-E303 IonicContact CE1-OE1 2.76Å; H279-E303 PolarHBondContact CE1-OE1 3.24Å; H279-E303 IonicContact NE2-OE1 2.74Å; H279-E303 PolarHBondContact NE2-OE1 3.44Å; F280-E303 CarbonylContact O-C 3.59Å; F280-E303 VanDerWaalsContact O-CA 3.24Å; F280-E303 WeakPolarHBondContact O-CA 3.32Å; S283-E303 PolarHBondContact O-N 3.08Å; L284-E303 HydrophobicContact CD2-CB 4.03Å; E303-G322 WeakPolarHBondContact O-CA 3.44Å; E303-G322 PolarHBondContact O-N 3.33Å; E303-T339 VanDerWaalsContact OE1-CA 3.31Å; E303-T339 WeakPolarHBondContact OE1-CA 3.49Å; E303-T339 WeakPolarHBondContact OE1-CB 3.26Å; E303-N340 VanDerWaalsContact CD-N 3.26Å; E303-N340 PolarHBondContact OE1-N 2.97Å; E303-N340 VanDerWaalsContact OE2-CA 3.26Å; E303-N340 WeakPolarHBondContact OE2-CA 3.44Å; E303-N340 PolarHBondContact OE2-N 3.22Å
304	R	93.9	Very high	91.8	Very high	6 Å²	6	25.6 Å²	25.6	2%	0.023	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	155.3	-177.5	64.1	179.1	-175.8	-75.9	2.9	111.7	S217 F218 F280 C300 N302 T319 A320 V321	S217-R304 PolarHBondContact O-NH2 2.95Å; F218-R304 VanDerWaalsContact O-CZ 3.29Å; F218-R304 PolarHBondContact O-NE 3.46Å; F218-R304 PolarHBondContact O-NH2 3.39Å; F280-R304 HydrophobicContact CB-CG 3.86Å; F280-R304 HydrophobicContact CD2-CG 3.96Å; F280-R304 VanDerWaalsContact CD2-CZ 3.49Å; F280-R304 HydrophobicContact CG-CG 4.29Å; F280-R304 VanDerWaalsContact CG-CZ 3.49Å; F280-R304 PolarHBondContact N-O 2.88Å; F280-R304 PolarHBondContact O-N 3.46Å; C300-R304 PolarHBondContact O-NH1 3.4Å; N302-R304 PolarHBondContact O-N 3.06Å; R304-T319 HydrophobicContact CB-CG2 4.04Å; R304-T319 HydrophobicContact CG-CG2 4.33Å; R304-A320 CarbonylContact C-O 3.56Å; R304-A320 WeakPolarHBondContact CA-O 3.33Å; R304-A320 WeakPolarHBondContact CB-O 3.3Å; R304-V321 HydrophobicContact CB-CB 4.42Å; R304-V321 HydrophobicContact CB-CG1 4.49Å; R304-V321 HydrophobicContact CB-CG2 4.12Å
305	V	95.3	Very high	92.4	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.006	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	112.6	174.6	-178.8	0	0	0	0	107.1	R277 L307 T319 A320 I329 I331 L337 T339	R277-V305 HydrophobicContact CG-CG1 3.91Å; V305-L307 HydrophobicContact CG1-CD2 4.34Å; V305-T319 CarbonylContact O-C 3.59Å; V305-T319 WeakPolarHBondContact O-CA 3.33Å; V305-A320 PolarHBondContact N-O 3Å; V305-A320 PolarHBondContact O-N 3.04Å; V305-I329 HydrophobicContact CG2-CB 4.43Å; V305-I329 HydrophobicContact CG2-CD1 3.98Å; V305-I329 HydrophobicContact CG2-CG2 4.28Å; V305-I331 HydrophobicContact CG1-CG1 4.41Å; V305-L337 HydrophobicContact CG1-CD2 3.84Å; V305-L337 HydrophobicContact CG2-CD1 3.97Å; V305-L337 HydrophobicContact CG2-CD2 4.04Å; V305-T339 HydrophobicContact CG2-CG2 3.72Å
306	V	96.1	Very high	92.9	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.006	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	122.7	174.5	-175.6	0	0	0	0	107.4	L219 R277 R278 F280 T308 T319	L219-V306 HydrophobicContact CD2-CG1 3.68Å; R277-V306 WeakPolarHBondContact CA-O 3.36Å; R278-V306 HydrophobicContact CB-CB 4.34Å; R278-V306 PolarHBondContact N-O 2.97Å; R278-V306 PolarHBondContact O-N 3.5Å; F280-V306 HydrophobicContact CD2-CG2 4Å; F280-V306 HydrophobicContact CE2-CG2 3.78Å; V306-T308 HydrophobicContact CG1-CG2 3.85Å; V306-T319 HydrophobicContact CB-CG2 4.46Å; V306-T319 HydrophobicContact CG2-CG2 3.72Å
307	L	96.7	Very high	93.4	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	117.2	166.4	-62.6	-178.8	0	0	0	107.9	W272 V274 R277 V305 S317 L318 I331 F333 F354 L371	W272-L307 HydrophobicContact CH2-CB 3.93Å; V274-L307 HydrophobicContact CG1-CB 4.01Å; V274-L307 HydrophobicContact CG1-CD2 4.31Å; R277-L307 HydrophobicContact CB-CD2 3.82Å; R277-L307 HydrophobicContact CG-CD2 4.08Å; V305-L307 HydrophobicContact CG1-CD2 4.34Å; L307-S317 CarbonylContact O-C 3.59Å; L307-S317 VanDerWaalsContact O-CA 3.29Å; L307-S317 WeakPolarHBondContact O-CA 3.47Å; L307-L318 PolarHBondContact N-O 2.94Å; L307-L318 PolarHBondContact O-N 3.11Å; L307-I331 HydrophobicContact CD1-CD1 3.85Å; L307-I331 HydrophobicContact CD1-CG1 4.19Å; L307-I331 HydrophobicContact CD1-CG2 4.25Å; L307-F333 HydrophobicContact CD1-CZ 4.21Å; L307-F354 HydrophobicContact CD2-CE2 4.26Å; L307-L371 HydrophobicContact CD1-CD1 3.94Å; L307-L371 HydrophobicContact CD1-CD2 4.31Å; L307-L371 HydrophobicContact CD1-CG 4.34Å
308	T	95.8	Very high	93.9	Very high	25 Å²	25	16.2 Å²	16.2	15%	0.153	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	147.8	176.4	49.3	0	0	0	0	110.7	S275 H276 V306 F315	S275-T308 PolarHBondContact N-O 2.92Å; S275-T308 PolarHBondContact OG-O 2.91Å; H276-T308 PolarHBondContact N-O 2.91Å; H276-T308 VanDerWaalsContact N-O 3.08Å; H276-T308 PolarHBondContact O-N 3.39Å; H276-T308 PolarHBondContact O-OG1 2.86Å; V306-T308 HydrophobicContact CG1-CG2 3.85Å; T308-F315 HydrophobicContact CG2-CE2 3.83Å; T308-F315 HydrophobicContact CG2-CZ 3.95Å
309	G	94.4	Very high	94.2	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.01	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.5	-164.5	-175.5	0	0	0	0	0	111.5	T273 F316	T273-G309 CarbonylContact O-C 3.59Å; T273-G309 WeakPolarHBondContact O-CA 3.35Å; G309-F316 PolarHBondContact N-O 3.37Å; G309-F316 PolarHBondContact O-N 3.41Å
310	D	94.3	Very high	94.4	Very high	76 Å²	76	16.3 Å²	16.3	41%	0.406	8%	0.081	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	134.9	-174.9	-64.2	-85	0	0	0	110.4	W272 T273 G314	W272-D310 CarbonylContact C-O 3.58Å; W272-D310 WeakPolarHBondContact CA-O 3.18Å; W272-D310 WeakPolarHBondContact CB-O 3.42Å; T273-D310 PolarHBondContact N-O 3.27Å; T273-D310 PolarHBondContact O-N 3.45Å; D310-G314 CarbonylContact C-O 3.58Å; D310-G314 VanDerWaalsContact CA-O 3.32Å; D310-G314 WeakPolarHBondContact CA-O 3.47Å
311	W	94.8	Very high	94.6	Very high	11 Å²	11	15.3 Å²	15.3	4%	0.042	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	-178.8	175.6	83	-58.3	0	0	0	110.4	V186 T270 W272 H313 G314 F316 F384 E385 A386	V186-W311 HydrophobicContact CG2-CH2 3.44Å; V186-W311 VanDerWaalsContact CG2-CH2 3.44Å; V186-W311 HydrophobicContact CG2-CZ2 4.42Å; V186-W311 HydrophobicContact CG2-CZ3 3.51Å; T270-W311 HydrophobicContact CG2-CB 4.03Å; T270-W311 HydrophobicContact CG2-CD2 4.2Å; T270-W311 HydrophobicContact CG2-CE3 3.67Å; T270-W311 HydrophobicContact CG2-CG 4.41Å; T270-W311 HydrophobicContact CG2-CZ3 4.43Å; W272-W311 HydrophobicContact CB-CB 3.64Å; W311-H313 HydrophobicContact CD2-CB 4.47Å; W311-H313 AromaticContact CH2-CD2 3.63Å; W311-H313 HydrophobicContact CZ2-CB 3.9Å; W311-H313 AromaticContact CZ2-CD2 3.62Å; W311-H313 PolarHBondContact O-N 2.76Å; W311-G314 VanDerWaalsContact CD1-O 3.25Å; W311-G314 PolarHBondContact N-O 3.11Å; W311-G314 PolarHBondContact O-N 3.48Å; W311-F316 HydrophobicContact CB-CB 4.01Å; W311-F316 HydrophobicContact CB-CD2 4.05Å; W311-F316 HydrophobicContact CB-CG 4.28Å; W311-F316 AromaticContact CD1-CD2 3.67Å; W311-F316 AromaticContact CD2-CD2 3.86Å; W311-F316 HydrophobicContact CD2-CD2 3.86Å; W311-F316 HydrophobicContact CD2-CE2 4.4Å; W311-F316 HydrophobicContact CG-CB 4.07Å; W311-F316 AromaticContact CG-CD2 3.62Å; W311-F316 HydrophobicContact CG-CD2 3.62Å; W311-F316 HydrophobicContact CG-CG 4.24Å; W311-F316 AromaticContact NE1-CD2 3.94Å; W311-F384 HydrophobicContact CH2-CD2 4.43Å; W311-F384 AromaticContact CZ2-CD2 3.78Å; W311-F384 HydrophobicContact CZ2-CD2 3.78Å; W311-F384 HydrophobicContact CZ2-CE2 4.4Å; W311-E385 VanDerWaalsContact CE2-O 3.27Å; W311-E385 VanDerWaalsContact CZ2-O 3.25Å; W311-E385 WeakPolarHBondContact CZ2-O 3.35Å; W311-E385 PolarHBondContact NE1-O 3.44Å; W311-A386 HydrophobicContact CZ2-CB 4.17Å
312	K	92.9	Very high	94.7	Very high	99 Å²	99	12.5 Å²	12.5	43%	0.43	6%	0.062	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-20.4	-174.3	62.7	148.1	178.9	168.8	0	116	S185 R246	S185-K312 WeakPolarHBondContact OG-CE 3.2Å; S185-K312 PolarHBondContact OG-NZ 2.96Å; R246-K312 VanDerWaalsContact CZ-O 3.26Å; R246-K312 PolarHBondContact NH1-O 2.82Å; R246-K312 PolarHBondContact NH2-O 2.68Å
313	H	93.7	Very high	94.5	Very high	26 Å²	26	12.6 Å²	12.6	12%	0.12	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-0.9	179.6	-67.6	-46.4	0	0	0	115.5	R246 N249 W311 E385 L409	R246-H313 WeakPolarHBondContact CD-O 3.22Å; R246-H313 PolarHBondContact NE-O 3.2Å; N249-H313 PolarHBondContact ND2-O 2.89Å; W311-H313 HydrophobicContact CD2-CB 4.47Å; W311-H313 AromaticContact CH2-CD2 3.63Å; W311-H313 HydrophobicContact CZ2-CB 3.9Å; W311-H313 AromaticContact CZ2-CD2 3.62Å; W311-H313 PolarHBondContact O-N 2.76Å; H313-E385 WeakPolarHBondContact CB-O 3.36Å; H313-L409 WeakPolarHBondContact NE2-CD1 3.12Å
314	G	93.9	Very high	94	Very high	3 Å²	3	14 Å²	14	3%	0.031	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	127	-135.3	-177.4	0	0	0	0	0	112	T245 D310 W311 E385	T245-G314 VanDerWaalsContact OG1-CA 3.23Å; T245-G314 WeakPolarHBondContact OG1-CA 3.08Å; D310-G314 CarbonylContact C-O 3.58Å; D310-G314 VanDerWaalsContact CA-O 3.32Å; D310-G314 WeakPolarHBondContact CA-O 3.47Å; W311-G314 VanDerWaalsContact CD1-O 3.25Å; W311-G314 PolarHBondContact N-O 3.11Å; W311-G314 PolarHBondContact O-N 3.48Å; G314-E385 WeakPolarHBondContact CA-OE2 3.13Å
315	F	95	Very high	93	Very high	7 Å²	7	16.5 Å²	16.5	3%	0.031	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	138	-176.7	174.5	-103.5	0	0	0	113.6	L219 L243 T245 L251 T308 I383 E385	L219-F315 HydrophobicContact CD1-CE1 4.33Å; L219-F315 HydrophobicContact CD1-CZ 4.11Å; L243-F315 HydrophobicContact CB-CD1 4.39Å; L243-F315 HydrophobicContact CD2-CD1 4.31Å; L243-F315 HydrophobicContact CD2-CD2 4.1Å; L243-F315 HydrophobicContact CD2-CE1 4.03Å; L243-F315 HydrophobicContact CD2-CE2 3.79Å; L243-F315 HydrophobicContact CD2-CG 4.34Å; L243-F315 HydrophobicContact CD2-CZ 3.75Å; L243-F315 WeakPolarHBondContact O-CB 3.41Å; T245-F315 HydrophobicContact CG2-CB 4.43Å; L251-F315 HydrophobicContact CD1-CD1 3.97Å; L251-F315 HydrophobicContact CD1-CE1 4.46Å; T308-F315 HydrophobicContact CG2-CE2 3.83Å; T308-F315 HydrophobicContact CG2-CZ 3.95Å; F315-I383 HydrophobicContact CE1-CG2 4.18Å; F315-E385 HydrophobicContact CB-CB 4.19Å; F315-E385 PolarHBondContact N-OE2 3.49Å; F315-E385 WeakPolarHBondContact O-CB 3.44Å; F315-E385 PolarHBondContact O-N 3.44Å
316	F	95.9	Very high	91.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	140	171.3	-157.9	-83	0	0	0	111.7	P269 T270 W272 G309 W311 L318 L382 F384	P269-F316 HydrophobicContact CB-CZ 4.32Å; P269-F316 HydrophobicContact CG-CE1 3.56Å; P269-F316 HydrophobicContact CG-CE2 4.47Å; P269-F316 HydrophobicContact CG-CZ 3.36Å; T270-F316 HydrophobicContact CG2-CD2 4.05Å; T270-F316 HydrophobicContact CG2-CE2 3.82Å; T270-F316 HydrophobicContact CG2-CZ 4.19Å; W272-F316 HydrophobicContact CD2-CB 4.45Å; W272-F316 AromaticContact CD2-CD1 3.79Å; W272-F316 HydrophobicContact CD2-CD1 3.79Å; W272-F316 HydrophobicContact CD2-CG 4.32Å; W272-F316 HydrophobicContact CE3-CB 3.81Å; W272-F316 AromaticContact CE3-CD1 3.6Å; W272-F316 HydrophobicContact CE3-CD1 3.6Å; W272-F316 HydrophobicContact CE3-CG 4.05Å; W272-F316 HydrophobicContact CG-CD1 4.41Å; W272-F316 HydrophobicContact CH2-CD1 4.11Å; W272-F316 HydrophobicContact CZ2-CD1 4.31Å; W272-F316 HydrophobicContact CZ3-CB 4.32Å; W272-F316 AromaticContact CZ3-CD1 3.76Å; W272-F316 HydrophobicContact CZ3-CD1 3.76Å; G309-F316 PolarHBondContact N-O 3.37Å; G309-F316 PolarHBondContact O-N 3.41Å; W311-F316 HydrophobicContact CB-CB 4.01Å; W311-F316 HydrophobicContact CB-CD2 4.05Å; W311-F316 HydrophobicContact CB-CG 4.28Å; W311-F316 AromaticContact CD1-CD2 3.67Å; W311-F316 AromaticContact CD2-CD2 3.86Å; W311-F316 HydrophobicContact CD2-CD2 3.86Å; W311-F316 HydrophobicContact CD2-CE2 4.4Å; W311-F316 HydrophobicContact CG-CB 4.07Å; W311-F316 AromaticContact CG-CD2 3.62Å; W311-F316 HydrophobicContact CG-CD2 3.62Å; W311-F316 HydrophobicContact CG-CG 4.24Å; W311-F316 AromaticContact NE1-CD2 3.94Å; F316-L318 HydrophobicContact CE1-CB 4.45Å; F316-L382 HydrophobicContact CE1-CD2 4.21Å; F316-L382 HydrophobicContact CZ-CD2 4.27Å; F316-F384 HydrophobicContact CD2-CB 3.34Å; F316-F384 HydrophobicContact CD2-CG 4.17Å; F316-F384 HydrophobicContact CE2-CB 3.46Å; F316-F384 VanDerWaalsContact CE2-CB 3.46Å; F316-F384 HydrophobicContact CE2-CD1 4.01Å; F316-F384 AromaticContact CE2-CG 3.81Å; F316-F384 HydrophobicContact CE2-CG 3.81Å; F316-F384 HydrophobicContact CG-CB 4.12Å; F316-F384 HydrophobicContact CZ-CB 4.32Å; F316-F384 HydrophobicContact CZ-CD1 4.39Å
317	S	96.8	Very high	89.8	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	128.8	176.3	178.4	0	0	0	0	111.6	L219 L307 L382 I383	L219-S317 WeakPolarHBondContact CD2-OG 3.23Å; L307-S317 CarbonylContact O-C 3.59Å; L307-S317 VanDerWaalsContact O-CA 3.29Å; L307-S317 WeakPolarHBondContact O-CA 3.47Å; S317-L382 WeakPolarHBondContact O-CA 3.4Å; S317-I383 WeakPolarHBondContact CA-O 3.47Å; S317-I383 WeakPolarHBondContact CB-O 3.26Å; S317-I383 PolarHBondContact N-O 3.14Å; S317-I383 PolarHBondContact O-N 2.6Å
318	L	97.7	Very high	89.1	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	116.1	168.5	-173	152.4	0	0	0	109.2	P189 F266 P269 W272 L307 F316 L371 I380 L382	P189-L318 HydrophobicContact CB-CD1 4.1Å; F266-L318 HydrophobicContact CD2-CD2 4.17Å; F266-L318 HydrophobicContact CE2-CD2 4.09Å; P269-L318 HydrophobicContact CG-CD1 4.16Å; W272-L318 HydrophobicContact CH2-CB 3.95Å; W272-L318 HydrophobicContact CZ2-CB 4.02Å; L307-L318 PolarHBondContact N-O 2.94Å; L307-L318 PolarHBondContact O-N 3.11Å; F316-L318 HydrophobicContact CE1-CB 4.45Å; L318-L371 HydrophobicContact CD1-CD2 3.59Å; L318-L371 HydrophobicContact CD2-CD2 3.83Å; L318-L371 HydrophobicContact CG-CD2 4.22Å; L318-I380 HydrophobicContact CD2-CG2 4.31Å; L318-I380 HydrophobicContact CG-CG2 4.11Å; L318-L382 HydrophobicContact CB-CD2 3.97Å; L318-L382 HydrophobicContact CD1-CD2 3.71Å; L318-L382 HydrophobicContact CG-CD2 3.69Å
319	T	96.8	Very high	88.9	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	117.5	-179.8	-56.3	0	0	0	0	111.2	F218 R304 V305 V306 V321 I380 V381	F218-T319 HydrophobicContact CE1-CG2 3.87Å; F218-T319 HydrophobicContact CE2-CG2 4.06Å; F218-T319 HydrophobicContact CZ-CG2 3.37Å; R304-T319 HydrophobicContact CB-CG2 4.04Å; R304-T319 HydrophobicContact CG-CG2 4.33Å; V305-T319 CarbonylContact O-C 3.59Å; V305-T319 WeakPolarHBondContact O-CA 3.33Å; V306-T319 HydrophobicContact CB-CG2 4.46Å; V306-T319 HydrophobicContact CG2-CG2 3.72Å; T319-V321 HydrophobicContact CG2-CG2 3.98Å; T319-I380 WeakPolarHBondContact O-CA 3.41Å; T319-V381 PolarHBondContact N-O 3.19Å; T319-V381 PolarHBondContact O-N 2.81Å
320	A	95.6	Very high	88.8	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.008	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.7	170.7	0	0	0	0	0	109.8	F266 R304 V305 I329 F374	F266-A320 HydrophobicContact CE1-CB 4.46Å; F266-A320 HydrophobicContact CZ-CB 3.97Å; R304-A320 CarbonylContact C-O 3.56Å; R304-A320 WeakPolarHBondContact CA-O 3.33Å; R304-A320 WeakPolarHBondContact CB-O 3.3Å; V305-A320 PolarHBondContact N-O 3Å; V305-A320 PolarHBondContact O-N 3.04Å; A320-I329 HydrophobicContact CB-CD1 4.39Å; A320-I329 HydrophobicContact CB-CG2 3.75Å; A320-I329 WeakPolarHBondContact O-CD1 3.49Å; A320-F374 HydrophobicContact CB-CE1 3.74Å; A320-F374 HydrophobicContact CB-CZ 3.61Å
321	V	94.4	Very high	88.8	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.5	-178.5	-174.6	0	0	0	0	110.1	F218 V287 F299 N302 R304 T319 S378 T379 V381	F218-V321 HydrophobicContact CE2-CG2 4.12Å; F218-V321 HydrophobicContact CZ-CG2 4.11Å; V287-V321 HydrophobicContact CG1-CG1 4.44Å; F299-V321 HydrophobicContact CB-CG1 4.24Å; F299-V321 HydrophobicContact CB-CG2 4.41Å; F299-V321 HydrophobicContact CD1-CG1 4.24Å; F299-V321 HydrophobicContact CG-CG1 4.49Å; N302-V321 HydrophobicContact CB-CG1 4.04Å; R304-V321 HydrophobicContact CB-CB 4.42Å; R304-V321 HydrophobicContact CB-CG1 4.49Å; R304-V321 HydrophobicContact CB-CG2 4.12Å; T319-V321 HydrophobicContact CG2-CG2 3.98Å; V321-S378 WeakPolarHBondContact O-CB 3.47Å; V321-T379 WeakPolarHBondContact CB-O 3.35Å; V321-T379 PolarHBondContact N-O 2.97Å; V321-T379 PolarHBondContact O-N 3.36Å; V321-V381 HydrophobicContact CG2-CG2 4.27Å
322	G	91	Very high	88.8	Confident	1 Å²	1	23 Å²	23	1%	0.01	11%	0.112	C	C	.	.			trans	-74.1	166.3	176.1	0	0	0	0	0	112.8	N302 E303	N302-G322 PolarHBondContact ND2-O 3.17Å; E303-G322 WeakPolarHBondContact O-CA 3.44Å; E303-G322 PolarHBondContact O-N 3.33Å
323	A	87.4	Confident	88.7	Confident	3 Å²	3	21 Å²	21	3%	0.025	10%	0.104	C	C	.	.			trans	-150.9	178.7	-177.6	0	0	0	0	0	112.2	M285 V287 N325 V326 G377	M285-A323 VanDerWaalsContact O-CA 3.23Å; M285-A323 WeakPolarHBondContact O-CA 3.37Å; M285-A323 WeakPolarHBondContact O-CB 3.44Å; V287-A323 HydrophobicContact CB-CB 4.22Å; V287-A323 HydrophobicContact CG1-CB 3.8Å; V287-A323 HydrophobicContact CG2-CB 3.62Å; A323-N325 PolarHBondContact O-N 2.89Å; A323-V326 HydrophobicContact CB-CG2 3.87Å; A323-V326 VanDerWaalsContact N-CG2 3.3Å; A323-V326 VanDerWaalsContact O-CB 3.29Å; A323-V326 WeakPolarHBondContact O-CB 3.25Å; A323-V326 VanDerWaalsContact O-CG2 3.26Å; A323-V326 WeakPolarHBondContact O-CG2 3.38Å; A323-V326 PolarHBondContact O-N 3.31Å; A323-V326 VanDerWaalsContact O-N 3.13Å; A323-G377 WeakPolarHBondContact CB-O 3.47Å
324	T	80.9	Confident	88.6	Confident	33 Å²	33	20.2 Å²	20.2	20%	0.202	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	138.5	172.8	-44.7	0	0	0	0	110.9	L284 M285 S286 V326	L284-T324 WeakPolarHBondContact O-CA 3.42Å; L284-T324 WeakPolarHBondContact O-CB 3.16Å; L284-T324 PolarHBondContact O-N 2.84Å; L284-T324 VanDerWaalsContact O-N 3.08Å; L284-T324 PolarHBondContact O-OG1 3.17Å; M285-T324 PolarHBondContact O-N 3.12Å; S286-T324 PolarHBondContact N-OG1 2.93Å; T324-V326 PolarHBondContact O-N 3.01Å
325	N	73.9	Confident	88.4	Confident	57 Å²	57	28 Å²	28	31%	0.305	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	-5.8	-176.3	-60.2	-16.6	0	0	0	115.6	S120 W123 A323 G327 L376	S120-N325 PolarHBondContact OG-N 2.93Å; W123-N325 HydrophobicContact CG-CB 4.26Å; A323-N325 PolarHBondContact O-N 2.89Å; N325-G327 PolarHBondContact O-N 3.03Å; N325-G327 VanDerWaalsContact O-N 3.16Å; N325-L376 HydrophobicContact CB-CD2 3.93Å; N325-L376 WeakPolarHBondContact O-CB 3.4Å
326	V	62.5	Low	88	Confident	3 Å²	3	33.2 Å²	33.2	2%	0.018	16%	0.164	C	C	.	.			trans	-67.2	112.3	171.4	-174.7	0	0	0	0	109.2	A323 T324 L376 G377	A323-V326 HydrophobicContact CB-CG2 3.87Å; A323-V326 VanDerWaalsContact N-CG2 3.3Å; A323-V326 VanDerWaalsContact O-CB 3.29Å; A323-V326 WeakPolarHBondContact O-CB 3.25Å; A323-V326 VanDerWaalsContact O-CG2 3.26Å; A323-V326 WeakPolarHBondContact O-CG2 3.38Å; A323-V326 PolarHBondContact O-N 3.31Å; A323-V326 VanDerWaalsContact O-N 3.13Å; T324-V326 PolarHBondContact O-N 3.01Å; V326-L376 HydrophobicContact CG2-CB 4.39Å; V326-L376 WeakPolarHBondContact CG2-O 3.49Å; V326-G377 WeakPolarHBondContact CG2-O 3.29Å
327	G	61.3	Low	87.7	Confident	17 Å²	17	33.9 Å²	33.9	18%	0.175	17%	0.168	C	C	.	.			trans	-62.6	-45.1	-179.8	0	0	0	0	0	112.3	N325 N340	N325-G327 PolarHBondContact O-N 3.03Å; N325-G327 VanDerWaalsContact O-N 3.16Å; G327-N340 WeakPolarHBondContact O-CB 3.47Å; G327-N340 PolarHBondContact O-ND2 3.4Å
328	S	82.5	Confident	87.3	Confident	33 Å²	33	40.2 Å²	40.2	23%	0.231	20%	0.197	C	C	.	.			trans	-167	162.7	173.3	55.1	0	0	0	0	110.2	T339 N375	S328-T339 WeakPolarHBondContact CA-OG1 3.46Å; S328-T339 VanDerWaalsContact CB-OG1 3.32Å; S328-T339 WeakPolarHBondContact CB-OG1 3.3Å; S328-N375 PolarHBondContact O-N 2.95Å; S328-N375 PolarHBondContact OG-ND2 2.87Å
329	I	91.5	Very high	86.8	Confident	5 Å²	5	40.9 Å²	40.9	3%	0.026	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	139.2	159.2	-54.6	161.4	0	0	0	107	F266 V305 A320 T339 F374	F266-I329 HydrophobicContact CZ-CG2 4.43Å; V305-I329 HydrophobicContact CG2-CB 4.43Å; V305-I329 HydrophobicContact CG2-CD1 3.98Å; V305-I329 HydrophobicContact CG2-CG2 4.28Å; A320-I329 HydrophobicContact CB-CD1 4.39Å; A320-I329 HydrophobicContact CB-CG2 3.75Å; A320-I329 WeakPolarHBondContact O-CD1 3.49Å; I329-T339 HydrophobicContact CB-CG2 4.15Å; I329-T339 PolarHBondContact N-OG1 3.27Å; I329-T339 PolarHBondContact O-OG1 2.86Å; I329-F374 HydrophobicContact CG1-CD1 3.92Å; I329-F374 HydrophobicContact CG1-CE1 3.98Å; I329-F374 HydrophobicContact CG2-CE1 4.43Å
330	R	91.8	Very high	86.3	Confident	123 Å²	123	41.3 Å²	41.3	46%	0.464	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	133.5	172.7	-179	-176.9	-172.4	-167.8	3.2	110	G372 E373	R330-G372 CarbonylContact O-C 3.53Å; R330-G372 WeakPolarHBondContact O-CA 3.47Å; R330-E373 HydrophobicContact CB-CG 3.87Å; R330-E373 HydrophobicContact CG-CG 4.41Å; R330-E373 PolarHBondContact N-O 3.08Å; R330-E373 IonicContact NH1-OE1 3.64Å; R330-E373 PolarHBondContact O-N 2.9Å
331	I	94.5	Very high	85.6	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	143.9	165.1	-58.4	-55.5	0	0	0	106.7	F266 V305 L307 F333 D334 L337	F266-I331 HydrophobicContact CE2-CD1 3.74Å; F266-I331 HydrophobicContact CZ-CD1 3.67Å; V305-I331 HydrophobicContact CG1-CG1 4.41Å; L307-I331 HydrophobicContact CD1-CD1 3.85Å; L307-I331 HydrophobicContact CD1-CG1 4.19Å; L307-I331 HydrophobicContact CD1-CG2 4.25Å; I331-F333 HydrophobicContact CG2-CD1 4.09Å; I331-F333 HydrophobicContact CG2-CD2 4Å; I331-F333 HydrophobicContact CG2-CE1 3.89Å; I331-F333 HydrophobicContact CG2-CE2 3.77Å; I331-F333 HydrophobicContact CG2-CG 4.15Å; I331-F333 HydrophobicContact CG2-CZ 3.71Å; I331-D334 HydrophobicContact CB-CB 4.2Å; I331-D334 HydrophobicContact CG2-CB 4.21Å; I331-L337 HydrophobicContact CB-CD2 4.13Å; I331-L337 HydrophobicContact CG1-CD2 3.65Å
332	Y	93.8	Very high	84.7	Confident	70 Å²	70	48.3 Å²	48.3	28%	0.275	25%	0.25	S	C	.	.	S	Bend	trans	-81.1	-31.5	-170.3	-67.8	-50.3	0	0	0	114.4	H370 L371 E373	Y332-H370 HydrophobicContact CD2-CB 3.96Å; Y332-H370 HydrophobicContact CE2-CB 3.94Å; Y332-H370 AromaticContact CE2-ND1 3.96Å; Y332-L371 PolarHBondContact N-O 3.04Å; Y332-E373 HydrophobicContact CE1-CB 4.49Å; Y332-E373 HydrophobicContact CE1-CG 3.91Å; Y332-E373 WeakPolarHBondContact CE1-OE2 3.34Å; Y332-E373 PolarHBondContact OH-OE2 3.44Å
333	F	92	Very high	83.8	Confident	57 Å²	57	59.2 Å²	59.2	25%	0.25	29%	0.291	C	S	.	.	S	Bend	trans	-86.1	-19	176.6	56.6	-110.3	0	0	0	114	V274 L307 I331 F354 V363 M365 L371	V274-F333 HydrophobicContact CB-CZ 4.27Å; V274-F333 HydrophobicContact CG1-CZ 4.22Å; V274-F333 HydrophobicContact CG2-CZ 4.18Å; L307-F333 HydrophobicContact CD1-CZ 4.21Å; I331-F333 HydrophobicContact CG2-CD1 4.09Å; I331-F333 HydrophobicContact CG2-CD2 4Å; I331-F333 HydrophobicContact CG2-CE1 3.89Å; I331-F333 HydrophobicContact CG2-CE2 3.77Å; I331-F333 HydrophobicContact CG2-CG 4.15Å; I331-F333 HydrophobicContact CG2-CZ 3.71Å; F333-F354 HydrophobicContact CD2-CE1 4.04Å; F333-F354 HydrophobicContact CD2-CZ 4.27Å; F333-F354 HydrophobicContact CE2-CD1 4.33Å; F333-F354 HydrophobicContact CE2-CD2 4.45Å; F333-F354 AromaticContact CE2-CE1 3.82Å; F333-F354 HydrophobicContact CE2-CE1 3.82Å; F333-F354 AromaticContact CE2-CE2 3.94Å; F333-F354 HydrophobicContact CE2-CE2 3.94Å; F333-F354 AromaticContact CE2-CZ 3.62Å; F333-F354 HydrophobicContact CE2-CZ 3.62Å; F333-V363 HydrophobicContact CD1-CG1 3.78Å; F333-V363 HydrophobicContact CD2-CG1 4.36Å; F333-V363 HydrophobicContact CD2-CG2 4.11Å; F333-V363 HydrophobicContact CE1-CG1 3.94Å; F333-V363 HydrophobicContact CE2-CB 4.48Å; F333-V363 HydrophobicContact CE2-CG2 4.27Å; F333-V363 HydrophobicContact CG-CG1 4Å; F333-V363 HydrophobicContact CG-CG2 4.46Å; F333-V363 HydrophobicContact CZ-CB 4.46Å; F333-V363 HydrophobicContact CZ-CG1 4.33Å; F333-M365 HydrophobicContact CD1-SD 3.83Å; F333-M365 HydrophobicContact CE1-CG 4.22Å; F333-M365 HydrophobicContact CE1-SD 3.62Å; F333-L371 HydrophobicContact CD1-CD1 4.38Å; F333-L371 HydrophobicContact CE1-CD1 3.47Å; F333-L371 VanDerWaalsContact CE1-CD1 3.47Å; F333-L371 HydrophobicContact CZ-CD1 4.1Å
334	D	92.1	Very high	83.1	Confident	10 Å²	10	61.9 Å²	61.9	5%	0.053	30%	0.302	C	S	.	.			trans	-101	105.6	179	-174	-25.7	0	0	0	110.1	R277 I331 D336 L337 F354	R277-D334 VanDerWaalsContact CD-OD2 3.25Å; R277-D334 WeakPolarHBondContact CD-OD2 3.2Å; R277-D334 IonicContact CZ-OD2 2.76Å; R277-D334 IonicContact NE-OD2 3.53Å; R277-D334 PolarHBondContact NE-OD2 3.26Å; R277-D334 IonicContact NH2-OD2 3.97Å; I331-D334 HydrophobicContact CB-CB 4.2Å; I331-D334 HydrophobicContact CG2-CB 4.21Å; D334-D336 PolarHBondContact OD1-N 2.89Å; D334-D336 VanDerWaalsContact OD1-N 3.15Å; D334-L337 HydrophobicContact CB-CB 4.35Å; D334-L337 WeakPolarHBondContact OD1-CB 3.06Å; D334-L337 PolarHBondContact OD1-N 2.91Å; D334-F354 HydrophobicContact CB-CE1 4.2Å; D334-F354 HydrophobicContact CB-CZ 4.26Å
335	Q	87.9	Confident	82.7	Confident	166 Å²	166	64.3 Å²	64.3	78%	0.776	32%	0.321	S	S	*	.	S	Bend	trans	-89.4	-21.4	-177.4	-56	-171	31.7	0	0	112.9	H338	Q335-H338 PolarHBondContact O-CE1 3.13Å
336	D	87.9	Confident	82.6	Confident	117 Å²	117	70.8 Å²	70.8	63%	0.626	35%	0.346	S	S	*	.	S	Bend	trans	-83.5	-18	-177.2	-61.5	-46.3	0	0	0	112.4	D334 H338	D334-D336 PolarHBondContact OD1-N 2.89Å; D334-D336 VanDerWaalsContact OD1-N 3.15Å; D336-H338 PolarHBondContact O-N 3.45Å
337	L	89.9	Confident	83	Confident	14 Å²	14	74.4 Å²	74.4	7%	0.073	39%	0.385	C	S	.	.			trans	-63.1	105.3	177.3	175.6	57.2	0	0	0	112.9	H279 V305 I331 D334 T339	H279-L337 HydrophobicContact CB-CD1 4.17Å; V305-L337 HydrophobicContact CG1-CD2 3.84Å; V305-L337 HydrophobicContact CG2-CD1 3.97Å; V305-L337 HydrophobicContact CG2-CD2 4.04Å; I331-L337 HydrophobicContact CB-CD2 4.13Å; I331-L337 HydrophobicContact CG1-CD2 3.65Å; D334-L337 HydrophobicContact CB-CB 4.35Å; D334-L337 WeakPolarHBondContact OD1-CB 3.06Å; D334-L337 PolarHBondContact OD1-N 2.91Å; L337-T339 HydrophobicContact CD1-CG2 3.76Å; L337-T339 HydrophobicContact CG-CG2 4.16Å
338	H	86.8	Confident	84.1	Confident	132 Å²	132	76 Å²	76	61%	0.611	39%	0.393	S	S	*	.			trans	-114.8	88.3	179.1	-67	-11.7	0	0	0	113	Q335 D336 S341	Q335-H338 PolarHBondContact O-CE1 3.13Å; D336-H338 PolarHBondContact O-N 3.45Å; H338-S341 PolarHBondContact O-OG 3.21Å
339	T	87.9	Confident	84.3	Confident	15 Å²	15	78.9 Å²	78.9	9%	0.092	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	164.4	176.1	62.8	0	0	0	0	113.2	E303 V305 S328 I329 L337 S341	E303-T339 VanDerWaalsContact OE1-CA 3.31Å; E303-T339 WeakPolarHBondContact OE1-CA 3.49Å; E303-T339 WeakPolarHBondContact OE1-CB 3.26Å; V305-T339 HydrophobicContact CG2-CG2 3.72Å; S328-T339 WeakPolarHBondContact CA-OG1 3.46Å; S328-T339 VanDerWaalsContact CB-OG1 3.32Å; S328-T339 WeakPolarHBondContact CB-OG1 3.3Å; I329-T339 HydrophobicContact CB-CG2 4.15Å; I329-T339 PolarHBondContact N-OG1 3.27Å; I329-T339 PolarHBondContact O-OG1 2.86Å; L337-T339 HydrophobicContact CD1-CG2 3.76Å; L337-T339 HydrophobicContact CG-CG2 4.16Å; T339-S341 PolarHBondContact O-N 2.66Å; T339-S341 VanDerWaalsContact O-N 3.17Å
340	N	85.9	Confident	84.2	Confident	8 Å²	8	82.5 Å²	82.5	4%	0.043	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	18.8	-173.2	-158.3	3.8	0	0	0	114.8	R117 R121 E303 G327	R117-N340 VanDerWaalsContact NH2-CA 3.28Å; R121-N340 WeakPolarHBondContact CG-ND2 3.29Å; R121-N340 PolarHBondContact NH1-O 2.79Å; E303-N340 VanDerWaalsContact CD-N 3.26Å; E303-N340 PolarHBondContact OE1-N 2.97Å; E303-N340 VanDerWaalsContact OE2-CA 3.26Å; E303-N340 WeakPolarHBondContact OE2-CA 3.44Å; E303-N340 PolarHBondContact OE2-N 3.22Å; G327-N340 WeakPolarHBondContact O-CB 3.47Å; G327-N340 PolarHBondContact O-ND2 3.4Å
341	S	82.5	Confident	84.1	Confident	40 Å²	40	79 Å²	79	28%	0.28	41%	0.409	S	S	.	.			trans	-54	146.2	-179.5	-77.9	0	0	0	0	113.5	R117 R121 H338 T339	R117-S341 PolarHBondContact NH2-O 3.33Å; R117-S341 VanDerWaalsContact NH2-O 3.07Å; R121-S341 PolarHBondContact NH1-O 3.01Å; H338-S341 PolarHBondContact O-OG 3.21Å; T339-S341 PolarHBondContact O-N 2.66Å; T339-S341 VanDerWaalsContact O-N 3.17Å
342	P	74.4	Confident	83.9	Confident	108 Å²	108	82.6 Å²	82.6	70%	0.701	43%	0.425	S	S	*	.	S	Bend	trans	-77.9	-31.3	-175.3	30.6	-34.9	0	0	0	113.4
343	R	73	Confident	83.8	Confident	231 Å²	231	81.9 Å²	81.9	87%	0.872	43%	0.43	S	S	*	.	S	Bend	trans	-97.6	133.3	168.6	-64.7	179.9	179.6	171.9	-0.5	108.2
344	H	72.1	Confident	83.5	Confident	58 Å²	58	80.1 Å²	80.1	27%	0.269	42%	0.422	S	S	.	.			trans	-166.2	132.5	-178	147.8	52.7	0	0	0	109.4	P281 K346	P281-H344 HydrophobicContact CB-CB 4.38Å; P281-H344 WeakPolarHBondContact CB-ND1 3.32Å; P281-H344 WeakPolarHBondContact CG-ND1 3.44Å; P281-H344 PolarHBondContact O-CE1 3.21Å; P281-H344 PolarHBondContact O-NE2 2.79Å; H344-K346 VanDerWaalsContact CE1-CA 3.49Å; H344-K346 WeakPolarHBondContact CE1-CA 3.46Å
345	S	72.9	Confident	83.1	Confident	85 Å²	85	82.2 Å²	82.2	59%	0.594	44%	0.435	S	S	*	.			trans	-87.4	113.7	171	-57.2	0	0	0	0	110	G347 S348	S345-G347 PolarHBondContact O-N 2.93Å; S345-S348 PolarHBondContact O-N 3.43Å; S345-S348 VanDerWaalsContact O-N 3.13Å; S345-S348 PolarHBondContact O-OG 3.38Å
346	K	70.4	Confident	82.5	Confident	192 Å²	192	77.3 Å²	77.3	84%	0.835	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	129.2	177.4	-71.5	-177.6	-179.8	177.3	0	110	H344	H344-K346 VanDerWaalsContact CE1-CA 3.49Å; H344-K346 WeakPolarHBondContact CE1-CA 3.46Å
347	G	72.2	Confident	81.3	Confident	80 Å²	80	80.8 Å²	80.8	83%	0.825	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.7	-7.3	-178.7	0	0	0	0	0	115.5	S345	S345-G347 PolarHBondContact O-N 2.93Å
348	S	84.1	Confident	80.1	Confident	49 Å²	49	86.8 Å²	86.8	34%	0.343	47%	0.466	S	S	.	.			trans	-76.5	156.5	168.2	70.8	0	0	0	0	111.3	P281 S345	P281-S348 VanDerWaalsContact CD-O 3.32Å; P281-S348 WeakPolarHBondContact CD-O 3.29Å; S345-S348 PolarHBondContact O-N 3.43Å; S345-S348 VanDerWaalsContact O-N 3.13Å; S345-S348 PolarHBondContact O-OG 3.38Å
349	Y	87.2	Confident	79.2	Confident	95 Å²	95	83.6 Å²	83.6	37%	0.373	45%	0.454	S	S	.	.			trans	-122.9	161.1	161.1	52.4	-91.5	0	0	0	110.1	P221 R278 H279 F280 D351	P221-Y349 HydrophobicContact CG-CE1 4.44Å; R278-Y349 HydrophobicContact CG-CD2 4.2Å; R278-Y349 HydrophobicContact CG-CG 4.28Å; H279-Y349 CarbonylContact O-C 3.54Å; H279-Y349 VanDerWaalsContact O-CA 3.29Å; H279-Y349 WeakPolarHBondContact O-CA 3.43Å; F280-Y349 HydrophobicContact CE1-CD1 4.24Å; F280-Y349 HydrophobicContact CE1-CG 4.36Å; Y349-D351 VanDerWaalsContact CD2-OD1 3.3Å; Y349-D351 WeakPolarHBondContact CD2-OD1 3.23Å; Y349-D351 WeakPolarHBondContact CE2-OD2 3.43Å
350	N	89	Confident	78.2	Confident	81 Å²	81	92.9 Å²	92.9	43%	0.433	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	112.3	173.5	172.9	-98.3	0	0	0	109	R277 H279	R277-N350 PolarHBondContact NH1-O 2.91Å; R277-N350 VanDerWaalsContact NH1-O 3.15Å; R277-N350 PolarHBondContact NH1-OD1 3.47Å; R277-N350 PolarHBondContact NH2-OD1 2.87Å; H279-N350 HydrophobicContact CB-CB 4.37Å; H279-N350 PolarHBondContact N-O 3.08Å; H279-N350 PolarHBondContact O-N 2.99Å
351	D	90.3	Very high	77.7	Confident	49 Å²	49	99.8 Å²	99.8	26%	0.262	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	145.6	177.9	-78.8	1.1	0	0	0	110.8	T223 H276 R277 R278 Y349	T223-D351 PolarHBondContact OG1-OD2 2.87Å; T223-D351 VanDerWaalsContact OG1-OD2 3.1Å; H276-D351 IonicContact CE1-OD1 3.92Å; H276-D351 IonicContact CE1-OD2 2.7Å; H276-D351 VanDerWaalsContact NE2-CB 3.33Å; H276-D351 WeakPolarHBondContact NE2-CB 2.99Å; H276-D351 IonicContact NE2-OD1 3.81Å; H276-D351 IonicContact NE2-OD2 3.52Å; R277-D351 CarbonylContact O-C 3.58Å; R277-D351 WeakPolarHBondContact O-CA 3.36Å; R278-D351 WeakPolarHBondContact CB-OD1 3.3Å; R278-D351 WeakPolarHBondContact CD-OD1 3.19Å; R278-D351 VanDerWaalsContact CG-OD1 3.23Å; R278-D351 WeakPolarHBondContact CG-OD1 3.49Å; R278-D351 IonicContact CZ-OD1 3.7Å; R278-D351 IonicContact CZ-OD2 3.57Å; R278-D351 IonicContact NE-OD1 2.66Å; R278-D351 PolarHBondContact NE-OD1 3.14Å; R278-D351 IonicContact NE-OD2 2.78Å; R278-D351 PolarHBondContact NE-OD2 3.32Å; R278-D351 IonicContact NH2-OD1 2.76Å; R278-D351 PolarHBondContact NH2-OD1 2.83Å; R278-D351 IonicContact NH2-OD2 3.75Å; R278-D351 PolarHBondContact NH2-OD2 3.42Å; Y349-D351 VanDerWaalsContact CD2-OD1 3.3Å; Y349-D351 WeakPolarHBondContact CD2-OD1 3.23Å; Y349-D351 WeakPolarHBondContact CE2-OD2 3.43Å
352	F	90.4	Very high	78	Confident	78 Å²	78	98 Å²	98	34%	0.342	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	117.9	177.7	-173	-89.7	0	0	0	109.7	H276 R277 F354	H276-F352 WeakPolarHBondContact CA-O 3.13Å; H276-F352 PolarHBondContact CD2-O 3.24Å; H276-F352 PolarHBondContact NE2-N 3.4Å; R277-F352 HydrophobicContact CB-CB 4.45Å; R277-F352 PolarHBondContact N-O 3.38Å; R277-F352 PolarHBondContact O-N 3.25Å; F352-F354 AromaticContact CD1-CD1 3.86Å; F352-F354 HydrophobicContact CD1-CD1 3.86Å; F352-F354 AromaticContact CD1-CE1 3.58Å; F352-F354 HydrophobicContact CD1-CE1 3.58Å; F352-F354 HydrophobicContact CD1-CG 4.44Å; F352-F354 AromaticContact CD1-CZ 3.96Å; F352-F354 HydrophobicContact CD1-CZ 3.96Å; F352-F354 AromaticContact CE1-CD1 3.61Å; F352-F354 HydrophobicContact CE1-CD1 3.61Å; F352-F354 AromaticContact CE1-CE1 3.56Å; F352-F354 HydrophobicContact CE1-CE1 3.56Å; F352-F354 HydrophobicContact CE1-CG 4.47Å; F352-F354 HydrophobicContact CE1-CZ 4.4Å
353	S	90	Very high	78.8	Confident	55 Å²	55	94.4 Å²	94.4	39%	0.385	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	128.1	174	-175	0	0	0	0	110.2	V355	S353-V355 VanDerWaalsContact C-N 3.34Å; S353-V355 WeakPolarHBondContact CB-O 3.27Å; S353-V355 PolarHBondContact OG-N 3.31Å; S353-V355 PolarHBondContact OG-O 3.01Å
354	F	87.3	Confident	79.9	Confident	19 Å²	19	87.8 Å²	87.8	8%	0.083	47%	0.47	C	S	.	.	S	Bend	trans	-83	-18.4	166.4	-58.4	-70.6	0	0	0	111.8	V274 S275 R277 L307 F333 D334 F352 V363	V274-F354 HydrophobicContact CG1-CD2 3.97Å; V274-F354 HydrophobicContact CG1-CE2 4.03Å; S275-F354 PolarHBondContact O-N 2.67Å; R277-F354 HydrophobicContact CB-CE2 3.63Å; R277-F354 HydrophobicContact CB-CZ 3.76Å; L307-F354 HydrophobicContact CD2-CE2 4.26Å; F333-F354 HydrophobicContact CD2-CE1 4.04Å; F333-F354 HydrophobicContact CD2-CZ 4.27Å; F333-F354 HydrophobicContact CE2-CD1 4.33Å; F333-F354 HydrophobicContact CE2-CD2 4.45Å; F333-F354 AromaticContact CE2-CE1 3.82Å; F333-F354 HydrophobicContact CE2-CE1 3.82Å; F333-F354 AromaticContact CE2-CE2 3.94Å; F333-F354 HydrophobicContact CE2-CE2 3.94Å; F333-F354 AromaticContact CE2-CZ 3.62Å; F333-F354 HydrophobicContact CE2-CZ 3.62Å; D334-F354 HydrophobicContact CB-CE1 4.2Å; D334-F354 HydrophobicContact CB-CZ 4.26Å; F352-F354 AromaticContact CD1-CD1 3.86Å; F352-F354 HydrophobicContact CD1-CD1 3.86Å; F352-F354 AromaticContact CD1-CE1 3.58Å; F352-F354 HydrophobicContact CD1-CE1 3.58Å; F352-F354 HydrophobicContact CD1-CG 4.44Å; F352-F354 AromaticContact CD1-CZ 3.96Å; F352-F354 HydrophobicContact CD1-CZ 3.96Å; F352-F354 AromaticContact CE1-CD1 3.61Å; F352-F354 HydrophobicContact CE1-CD1 3.61Å; F352-F354 AromaticContact CE1-CE1 3.56Å; F352-F354 HydrophobicContact CE1-CE1 3.56Å; F352-F354 HydrophobicContact CE1-CG 4.47Å; F352-F354 HydrophobicContact CE1-CZ 4.4Å; F354-V363 HydrophobicContact CB-CG2 4.02Å; F354-V363 HydrophobicContact CD1-CG2 4.18Å; F354-V363 HydrophobicContact CG-CG2 4.1Å
355	V	83.1	Confident	81	Confident	54 Å²	54	85.5 Å²	85.5	33%	0.327	46%	0.46	S	S	.	.			trans	-76	124.5	167.6	-176.9	0	0	0	0	108.6	S275 S353 N359	S275-V355 PolarHBondContact O-N 2.9Å; S353-V355 VanDerWaalsContact C-N 3.34Å; S353-V355 WeakPolarHBondContact CB-O 3.27Å; S353-V355 PolarHBondContact OG-N 3.31Å; S353-V355 PolarHBondContact OG-O 3.01Å; V355-N359 WeakPolarHBondContact CA-O 3.29Å
356	T	75.1	Confident	82.1	Confident	64 Å²	64	90.6 Å²	90.6	39%	0.393	47%	0.466	S	S	.	.			trans	-132.9	170.4	179.1	72.6	0	0	0	0	110.3	T358 N359	T356-T358 PolarHBondContact O-N 3.02Å; T356-T358 VanDerWaalsContact O-N 3.16Å; T356-T358 PolarHBondContact OG1-N 2.91Å; T356-T358 PolarHBondContact OG1-OG1 3.15Å; T356-T358 VanDerWaalsContact OG1-OG1 3.11Å; T356-N359 PolarHBondContact N-O 2.84Å; T356-N359 CarbonylContact O-C 3.32Å; T356-N359 PolarHBondContact O-N 3.42Å; T356-N359 VanDerWaalsContact O-O 3.07Å; T356-N359 PolarHBondContact OG1-N 2.86Å
357	H	63	Low	83.2	Confident	189 Å²	189	83.5 Å²	83.5	88%	0.875	44%	0.435	S	S	*	.	S	Bend	trans	-60.5	-24.3	175.9	-58.9	-61.4	0	0	0	113.6
358	T	63.9	Low	84.2	Confident	140 Å²	140	80.6 Å²	80.6	86%	0.859	41%	0.405	S	S	*	.	S	Bend	trans	-95.5	-28.1	177.5	52.1	0	0	0	0	113.4	T356	T356-T358 PolarHBondContact O-N 3.02Å; T356-T358 VanDerWaalsContact O-N 3.16Å; T356-T358 PolarHBondContact OG1-N 2.91Å; T356-T358 PolarHBondContact OG1-OG1 3.15Å; T356-T358 VanDerWaalsContact OG1-OG1 3.11Å
359	N	67.9	Low	84.7	Confident	65 Å²	65	82.3 Å²	82.3	35%	0.348	41%	0.408	S	S	.	.			trans	-121.5	93.5	172.8	179.5	16.5	0	0	0	110.5	V355 T356 E361 G362	V355-N359 WeakPolarHBondContact CA-O 3.29Å; T356-N359 PolarHBondContact N-O 2.84Å; T356-N359 CarbonylContact O-C 3.32Å; T356-N359 PolarHBondContact O-N 3.42Å; T356-N359 VanDerWaalsContact O-O 3.07Å; T356-N359 PolarHBondContact OG1-N 2.86Å; N359-E361 PolarHBondContact O-N 3.39Å; N359-E361 PolarHBondContact OD1-N 3Å; N359-G362 PolarHBondContact ND2-O 3.13Å
360	R	68.4	Low	85	Confident	211 Å²	211	82.2 Å²	82.2	80%	0.796	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-10.7	-178.3	-62.9	-175.9	-178.7	-170.5	-0.8	114
361	E	75.3	Confident	85.3	Confident	153 Å²	153	78.4 Å²	78.4	72%	0.715	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	8.8	-168.7	-62.1	-177.2	178.7	0	0	113.4	T273 N359	T273-E361 WeakPolarHBondContact CG2-O 3.21Å; N359-E361 PolarHBondContact O-N 3.39Å; N359-E361 PolarHBondContact OD1-N 3Å
362	G	87.1	Confident	85.5	Confident	2 Å²	2	76 Å²	76	2%	0.021	38%	0.377	C	S	.	.			trans	63.3	-146.1	175.6	0	0	0	0	0	113.5	N359	N359-G362 PolarHBondContact ND2-O 3.13Å
363	V	92.8	Very high	85.5	Confident	33 Å²	33	73 Å²	73	20%	0.2	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	106.7	176	-178.3	0	0	0	0	110.2	V274 F333 F354 M365	V274-V363 HydrophobicContact CB-CB 4.4Å; V274-V363 PolarHBondContact N-O 3.02Å; V274-V363 PolarHBondContact O-N 3.46Å; F333-V363 HydrophobicContact CD1-CG1 3.78Å; F333-V363 HydrophobicContact CD2-CG1 4.36Å; F333-V363 HydrophobicContact CD2-CG2 4.11Å; F333-V363 HydrophobicContact CE1-CG1 3.94Å; F333-V363 HydrophobicContact CE2-CB 4.48Å; F333-V363 HydrophobicContact CE2-CG2 4.27Å; F333-V363 HydrophobicContact CG-CG1 4Å; F333-V363 HydrophobicContact CG-CG2 4.46Å; F333-V363 HydrophobicContact CZ-CB 4.46Å; F333-V363 HydrophobicContact CZ-CG1 4.33Å; F354-V363 HydrophobicContact CB-CG2 4.02Å; F354-V363 HydrophobicContact CD1-CG2 4.18Å; F354-V363 HydrophobicContact CG-CG2 4.1Å; V363-M365 HydrophobicContact CG1-CG 4.47Å; V363-M365 HydrophobicContact CG1-SD 4.19Å
364	P	95.1	Very high	85.5	Confident	91 Å²	91	70.3 Å²	70.3	59%	0.591	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	134.6	172.8	29.3	-33.8	0	0	0	110.7
365	M	95.8	Very high	85	Confident	11 Å²	11	70.2 Å²	70.2	5%	0.054	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	124	-179.7	-70.2	-63.5	-46.5	0	0	110.1	D271 W272 V274 F333 V363 E369 L371	D271-M365 WeakPolarHBondContact CA-O 3.11Å; W272-M365 PolarHBondContact N-O 3.44Å; W272-M365 VanDerWaalsContact N-O 3.08Å; W272-M365 PolarHBondContact O-N 3.44Å; V274-M365 HydrophobicContact CG2-CG 3.86Å; F333-M365 HydrophobicContact CD1-SD 3.83Å; F333-M365 HydrophobicContact CE1-CG 4.22Å; F333-M365 HydrophobicContact CE1-SD 3.62Å; V363-M365 HydrophobicContact CG1-CG 4.47Å; V363-M365 HydrophobicContact CG1-SD 4.19Å; M365-E369 HydrophobicContact CE-CB 3.92Å; M365-E369 HydrophobicContact CE-CG 3.74Å; M365-L371 HydrophobicContact CE-CB 4.24Å; M365-L371 HydrophobicContact CE-CD1 3.97Å; M365-L371 HydrophobicContact CG-CD1 4.36Å; M365-L371 HydrophobicContact SD-CD1 4.11Å
366	R	95.1	Very high	84.3	Confident	191 Å²	191	68.6 Å²	68.6	72%	0.721	34%	0.335	S	S	*	.			trans	-85.6	148.8	-179	-60.4	-176.8	179.7	-155.2	-2	112.3	S268 D271 G368 E369	S268-R366 WeakPolarHBondContact CB-O 3.3Å; D271-R366 WeakPolarHBondContact OD1-CA 3.37Å; R366-G368 PolarHBondContact O-N 2.88Å; R366-G368 VanDerWaalsContact O-N 3.14Å; R366-E369 HydrophobicContact CB-CB 4.3Å; R366-E369 PolarHBondContact N-OE2 3.33Å; R366-E369 WeakPolarHBondContact O-CB 3.49Å; R366-E369 PolarHBondContact O-N 2.81Å
367	K	94.8	Very high	83.8	Confident	44 Å²	44	66 Å²	66	19%	0.191	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	119.4	177.4	-177.9	170	56.4	157	0	111	V180 C181 G182 H184 I187 T270 D271	V180-K367 HydrophobicContact CG1-CG 4.25Å; C181-K367 PolarHBondContact O-NZ 2.87Å; G182-K367 PolarHBondContact O-NZ 2.85Å; H184-K367 PolarHBondContact O-NZ 3.46Å; I187-K367 HydrophobicContact CD1-CG 4.12Å; I187-K367 HydrophobicContact CG1-CD 4.28Å; I187-K367 HydrophobicContact CG1-CG 3.97Å; I187-K367 HydrophobicContact CG2-CD 4.33Å; T270-K367 WeakPolarHBondContact O-CA 3.27Å; T270-K367 PolarHBondContact O-N 3.26Å; D271-K367 PolarHBondContact OD1-N 3.18Å
368	G	93.3	Very high	84.9	Confident	19 Å²	19	57 Å²	57	20%	0.196	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	6.3	-177.4	0	0	0	0	0	115.9	H267 S268 R366	H267-G368 PolarHBondContact ND1-O 3.48Å; S268-G368 PolarHBondContact O-N 3.34Å; R366-G368 PolarHBondContact O-N 2.88Å; R366-G368 VanDerWaalsContact O-N 3.14Å
369	E	94.4	Very high	86.3	Confident	85 Å²	85	50.3 Å²	50.3	40%	0.397	24%	0.239	S	C	.	.			trans	-79.7	143.9	177.2	-175.1	167.9	-160.5	0	0	112.7	H267 S268 M365 R366 L371	H267-E369 CarbonylContact C-O 3.5Å; H267-E369 WeakPolarHBondContact CA-O 3.39Å; H267-E369 WeakPolarHBondContact CB-O 3.39Å; S268-E369 PolarHBondContact N-O 3.27Å; M365-E369 HydrophobicContact CE-CB 3.92Å; M365-E369 HydrophobicContact CE-CG 3.74Å; R366-E369 HydrophobicContact CB-CB 4.3Å; R366-E369 PolarHBondContact N-OE2 3.33Å; R366-E369 WeakPolarHBondContact O-CB 3.49Å; R366-E369 PolarHBondContact O-N 2.81Å; E369-L371 PolarHBondContact O-N 2.91Å
370	H	93.6	Very high	87.6	Confident	93 Å²	93	47.2 Å²	47.2	43%	0.431	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	114.7	179	-85.8	-88.6	0	0	0	111.9	H267 Y332	H267-H370 AromaticContact CE1-CD2 3.67Å; H267-H370 AromaticContact CE1-CE1 3.4Å; H267-H370 PolarHBondContact CE1-CE1 3.38Å; H267-H370 VanDerWaalsContact CE1-CE1 3.4Å; H267-H370 AromaticContact CE1-CG 3.54Å; H267-H370 AromaticContact CE1-ND1 3.37Å; H267-H370 PolarHBondContact CE1-ND1 2.91Å; H267-H370 AromaticContact CE1-NE2 3.61Å; H267-H370 WeakPolarHBondContact ND1-CA 3.43Å; H267-H370 AromaticContact ND1-CG 3.82Å; H267-H370 PolarHBondContact ND1-N 3.42Å; H267-H370 AromaticContact NE2-CE1 3.98Å; H267-H370 AromaticContact NE2-ND1 3.99Å; Y332-H370 HydrophobicContact CD2-CB 3.96Å; Y332-H370 HydrophobicContact CE2-CB 3.94Å; Y332-H370 AromaticContact CE2-ND1 3.96Å
371	L	95.1	Very high	88.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	-42.1	-177.4	-179.5	60.4	0	0	0	112.7	F266 W272 L307 L318 Y332 F333 M365 E369	F266-L371 HydrophobicContact CD2-CB 4.16Å; F266-L371 HydrophobicContact CD2-CD2 4.13Å; F266-L371 HydrophobicContact CD2-CG 4.18Å; F266-L371 HydrophobicContact CE2-CB 4.42Å; F266-L371 HydrophobicContact CE2-CD2 4.2Å; F266-L371 HydrophobicContact CE2-CG 4.05Å; F266-L371 PolarHBondContact O-N 3.23Å; W272-L371 HydrophobicContact CZ2-CD2 4.38Å; L307-L371 HydrophobicContact CD1-CD1 3.94Å; L307-L371 HydrophobicContact CD1-CD2 4.31Å; L307-L371 HydrophobicContact CD1-CG 4.34Å; L318-L371 HydrophobicContact CD1-CD2 3.59Å; L318-L371 HydrophobicContact CD2-CD2 3.83Å; L318-L371 HydrophobicContact CG-CD2 4.22Å; Y332-L371 PolarHBondContact N-O 3.04Å; F333-L371 HydrophobicContact CD1-CD1 4.38Å; F333-L371 HydrophobicContact CE1-CD1 3.47Å; F333-L371 VanDerWaalsContact CE1-CD1 3.47Å; F333-L371 HydrophobicContact CZ-CD1 4.1Å; M365-L371 HydrophobicContact CE-CB 4.24Å; M365-L371 HydrophobicContact CE-CD1 3.97Å; M365-L371 HydrophobicContact CG-CD1 4.36Å; M365-L371 HydrophobicContact SD-CD1 4.11Å; E369-L371 PolarHBondContact O-N 2.91Å
372	G	93.5	Very high	90	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	-172.7	-178.4	0	0	0	0	0	115.1	C265 F266 R330	C265-G372 CarbonylContact C-O 3.58Å; C265-G372 WeakPolarHBondContact CA-O 3.29Å; F266-G372 PolarHBondContact N-O 2.78Å; F266-G372 PolarHBondContact O-N 3.22Å; R330-G372 CarbonylContact O-C 3.53Å; R330-G372 WeakPolarHBondContact O-CA 3.47Å
373	E	92	Very high	90.4	Very high	13 Å²	13	29.8 Å²	29.8	6%	0.061	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	148.7	178.4	58.9	-173.3	-144.6	0	0	112.8	R170 R330 Y332	R170-E373 WeakPolarHBondContact CD-OE1 3.49Å; R170-E373 IonicContact CZ-OE1 2.71Å; R170-E373 IonicContact NE-OE1 2.75Å; R170-E373 IonicContact NH1-OE1 3.54Å; R170-E373 PolarHBondContact NH1-OE1 2.74Å; R330-E373 HydrophobicContact CB-CG 3.87Å; R330-E373 HydrophobicContact CG-CG 4.41Å; R330-E373 PolarHBondContact N-O 3.08Å; R330-E373 IonicContact NH1-OE1 3.64Å; R330-E373 PolarHBondContact O-N 2.9Å; Y332-E373 HydrophobicContact CE1-CB 4.49Å; Y332-E373 HydrophobicContact CE1-CG 3.91Å; Y332-E373 WeakPolarHBondContact CE1-OE2 3.34Å; Y332-E373 PolarHBondContact OH-OE2 3.44Å
374	F	89.5	Confident	90.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134.8	166	-59.3	-88.8	0	0	0	110.2	L258 H264 F266 A320 I329 L376 S378 I380	L258-F374 HydrophobicContact CD1-CE2 4.41Å; L258-F374 HydrophobicContact CD2-CD2 4.1Å; L258-F374 HydrophobicContact CD2-CE2 4.21Å; H264-F374 PolarHBondContact O-N 2.84Å; F266-F374 AromaticContact CD1-CD2 3.48Å; F266-F374 HydrophobicContact CD1-CD2 3.48Å; F266-F374 VanDerWaalsContact CD1-CD2 3.48Å; F266-F374 AromaticContact CD1-CE2 3.29Å; F266-F374 HydrophobicContact CD1-CE2 3.29Å; F266-F374 HydrophobicContact CD1-CG 4.47Å; F266-F374 HydrophobicContact CD1-CZ 4.17Å; F266-F374 AromaticContact CE1-CD2 3.57Å; F266-F374 HydrophobicContact CE1-CD2 3.57Å; F266-F374 HydrophobicContact CE1-CE1 4.43Å; F266-F374 AromaticContact CE1-CE2 3.41Å; F266-F374 HydrophobicContact CE1-CE2 3.41Å; F266-F374 VanDerWaalsContact CE1-CE2 3.41Å; F266-F374 HydrophobicContact CE1-CG 4.17Å; F266-F374 AromaticContact CE1-CZ 3.89Å; F266-F374 HydrophobicContact CE1-CZ 3.89Å; F266-F374 HydrophobicContact CG-CE2 4.23Å; F266-F374 HydrophobicContact CZ-CE2 4.42Å; A320-F374 HydrophobicContact CB-CE1 3.74Å; A320-F374 HydrophobicContact CB-CZ 3.61Å; I329-F374 HydrophobicContact CG1-CD1 3.92Å; I329-F374 HydrophobicContact CG1-CE1 3.98Å; I329-F374 HydrophobicContact CG2-CE1 4.43Å; F374-L376 VanDerWaalsContact C-N 3.29Å; F374-L376 VanDerWaalsContact CB-O 3.29Å; F374-L376 WeakPolarHBondContact CB-O 3.28Å; F374-L376 PolarHBondContact O-N 3.47Å; F374-S378 WeakPolarHBondContact CD1-OG 3.4Å; F374-S378 WeakPolarHBondContact CD2-OG 3.29Å; F374-S378 WeakPolarHBondContact CE1-OG 3.21Å; F374-S378 WeakPolarHBondContact CE2-OG 3.31Å; F374-S378 WeakPolarHBondContact CG-OG 3.17Å; F374-S378 WeakPolarHBondContact CZ-OG 3.37Å; F374-I380 HydrophobicContact CE2-CD1 4.13Å; F374-I380 HydrophobicContact CE2-CG1 3.8Å; F374-I380 HydrophobicContact CZ-CG1 3.93Å
375	N	75.6	Confident	90.5	Very high	16 Å²	16	23.9 Å²	23.9	9%	0.086	11%	0.111	C	C	.	.	S	Bend	trans	-76.1	-12.6	175	-89.1	-50.3	0	0	0	114	R170 S328	R170-N375 WeakPolarHBondContact CD-OD1 3.33Å; R170-N375 PolarHBondContact NE-OD1 3.28Å; S328-N375 PolarHBondContact O-N 2.95Å; S328-N375 PolarHBondContact OG-ND2 2.87Å
376	L	69.4	Low	90.5	Very high	21 Å²	21	23.4 Å²	23.4	11%	0.11	11%	0.109	C	C	.	.	S	Bend	trans	-156.4	177.8	163.5	-122.9	119.9	0	0	0	111.4	N127 F169 N325 V326 F374	N127-L376 VanDerWaalsContact ND2-CD1 3.34Å; N127-L376 WeakPolarHBondContact ND2-CD1 3.32Å; F169-L376 HydrophobicContact CD2-CG 4.46Å; F169-L376 HydrophobicContact CE1-CB 4.48Å; F169-L376 HydrophobicContact CE1-CG 4.43Å; F169-L376 HydrophobicContact CE2-CG 4.07Å; F169-L376 VanDerWaalsContact CZ-CA 3.44Å; F169-L376 HydrophobicContact CZ-CB 4.35Å; F169-L376 HydrophobicContact CZ-CG 4.04Å; N325-L376 HydrophobicContact CB-CD2 3.93Å; N325-L376 WeakPolarHBondContact O-CB 3.4Å; V326-L376 HydrophobicContact CG2-CB 4.39Å; V326-L376 WeakPolarHBondContact CG2-O 3.49Å; F374-L376 VanDerWaalsContact C-N 3.29Å; F374-L376 VanDerWaalsContact CB-O 3.29Å; F374-L376 WeakPolarHBondContact CB-O 3.28Å; F374-L376 PolarHBondContact O-N 3.47Å
377	G	64.1	Low	90.4	Very high	9 Å²	9	15.4 Å²	15.4	9%	0.093	8%	0.082	C	C	.	.			trans	-59	142.5	-169.4	0	0	0	0	0	116.5	H264 A323 V326	H264-G377 WeakPolarHBondContact NE2-CA 3.44Å; A323-G377 WeakPolarHBondContact CB-O 3.47Å; V326-G377 WeakPolarHBondContact CG2-O 3.29Å
378	S	85.3	Confident	90.2	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.			trans	-155.2	-175.2	-155.5	59.2	0	0	0	0	113.1	Y257 L258 V321 F374	Y257-S378 WeakPolarHBondContact CD2-O 3.45Å; L258-S378 PolarHBondContact N-O 2.92Å; L258-S378 PolarHBondContact O-N 3.47Å; V321-S378 WeakPolarHBondContact O-CB 3.47Å; F374-S378 WeakPolarHBondContact CD1-OG 3.4Å; F374-S378 WeakPolarHBondContact CD2-OG 3.29Å; F374-S378 WeakPolarHBondContact CE1-OG 3.21Å; F374-S378 WeakPolarHBondContact CE2-OG 3.31Å; F374-S378 WeakPolarHBondContact CG-OG 3.17Å; F374-S378 WeakPolarHBondContact CZ-OG 3.37Å
379	T	93.5	Very high	90.1	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	141.2	170.2	-62.5	0	0	0	0	110.2	V255 I256 V287 F299 V321 V381	V255-T379 HydrophobicContact CG1-CG2 3.7Å; I256-T379 CarbonylContact O-C 3.53Å; I256-T379 WeakPolarHBondContact O-CA 3.36Å; I256-T379 WeakPolarHBondContact O-CG2 3.4Å; V287-T379 VanDerWaalsContact CG2-OG1 3.3Å; V287-T379 WeakPolarHBondContact CG2-OG1 3.45Å; F299-T379 HydrophobicContact CE1-CG2 4.18Å; F299-T379 HydrophobicContact CE2-CG2 4.19Å; F299-T379 HydrophobicContact CZ-CG2 3.85Å; V321-T379 WeakPolarHBondContact CB-O 3.35Å; V321-T379 PolarHBondContact N-O 2.97Å; V321-T379 PolarHBondContact O-N 3.36Å; T379-V381 HydrophobicContact CG2-CG2 4.2Å
380	I	95.8	Very high	90	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.8	163.6	-62	170.6	0	0	0	108.3	P189 I256 L258 F266 L318 T319 F374 L382	P189-I380 HydrophobicContact CB-CD1 4.43Å; P189-I380 HydrophobicContact CG-CD1 4.13Å; P189-I380 HydrophobicContact CG-CG2 4.02Å; I256-I380 PolarHBondContact N-O 2.88Å; I256-I380 PolarHBondContact O-N 3.4Å; L258-I380 HydrophobicContact CD1-CD1 4.19Å; L258-I380 HydrophobicContact CD1-CG1 3.98Å; F266-I380 HydrophobicContact CB-CD1 3.47Å; F266-I380 VanDerWaalsContact CB-CD1 3.47Å; F266-I380 HydrophobicContact CD1-CD1 4.39Å; F266-I380 HydrophobicContact CD2-CD1 4.49Å; F266-I380 HydrophobicContact CG-CD1 3.9Å; L318-I380 HydrophobicContact CD2-CG2 4.31Å; L318-I380 HydrophobicContact CG-CG2 4.11Å; T319-I380 WeakPolarHBondContact O-CA 3.41Å; F374-I380 HydrophobicContact CE2-CD1 4.13Å; F374-I380 HydrophobicContact CE2-CG1 3.8Å; F374-I380 HydrophobicContact CZ-CG1 3.93Å; I380-L382 HydrophobicContact CG2-CD2 4.18Å
381	V	96.5	Very high	89.9	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.2	168.7	-177.8	0	0	0	0	107.9	F218 C254 V255 F299 T319 V321 T379 I383	F218-V381 HydrophobicContact CE1-CB 3.89Å; F218-V381 HydrophobicContact CE1-CG1 3.77Å; F218-V381 HydrophobicContact CE1-CG2 4.34Å; F218-V381 HydrophobicContact CZ-CB 3.7Å; F218-V381 HydrophobicContact CZ-CG1 4.02Å; F218-V381 HydrophobicContact CZ-CG2 3.72Å; C254-V381 WeakPolarHBondContact O-CA 3.45Å; V255-V381 HydrophobicContact CG1-CG2 4.4Å; V255-V381 HydrophobicContact CG2-CG1 4.39Å; V255-V381 HydrophobicContact CG2-CG2 4.36Å; F299-V381 HydrophobicContact CD2-CG2 4Å; F299-V381 HydrophobicContact CE2-CG2 4.21Å; T319-V381 PolarHBondContact N-O 3.19Å; T319-V381 PolarHBondContact O-N 2.81Å; V321-V381 HydrophobicContact CG2-CG2 4.27Å; T379-V381 HydrophobicContact CG2-CG2 4.2Å; V381-I383 HydrophobicContact CG1-CD1 4.04Å; V381-I383 HydrophobicContact CG1-CG1 4.06Å
382	L	97.1	Very high	89.8	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	136.4	164.8	-59.4	-176.1	0	0	0	109	P189 H253 C254 P269 F316 S317 L318 I380 F384 L406	P189-L382 HydrophobicContact CG-CD1 4.26Å; P189-L382 HydrophobicContact CG-CD2 4.26Å; P189-L382 HydrophobicContact CG-CG 4.42Å; H253-L382 CarbonylContact C-O 3.47Å; H253-L382 VanDerWaalsContact CA-O 3.25Å; H253-L382 WeakPolarHBondContact CA-O 3.47Å; C254-L382 HydrophobicContact CB-CB 4.32Å; C254-L382 PolarHBondContact N-O 3.41Å; C254-L382 PolarHBondContact O-N 3.29Å; P269-L382 HydrophobicContact CB-CD1 4.06Å; P269-L382 HydrophobicContact CG-CD1 4.3Å; P269-L382 HydrophobicContact CG-CD2 4.05Å; F316-L382 HydrophobicContact CE1-CD2 4.21Å; F316-L382 HydrophobicContact CZ-CD2 4.27Å; S317-L382 WeakPolarHBondContact O-CA 3.4Å; L318-L382 HydrophobicContact CB-CD2 3.97Å; L318-L382 HydrophobicContact CD1-CD2 3.71Å; L318-L382 HydrophobicContact CG-CD2 3.69Å; I380-L382 HydrophobicContact CG2-CD2 4.18Å; L382-F384 HydrophobicContact CB-CD1 4.22Å; L382-F384 HydrophobicContact CB-CE1 4.43Å; L382-L406 HydrophobicContact CD1-CD1 3.46Å; L382-L406 VanDerWaalsContact CD1-CD1 3.46Å
383	I	96.2	Very high	89.5	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	124.5	168	-68	151.5	0	0	0	106.4	L215 F218 L219 L251 Y252 H253 F315 S317 V381	L215-I383 HydrophobicContact CD1-CD1 3.68Å; L215-I383 HydrophobicContact CD1-CG1 4.29Å; L215-I383 HydrophobicContact CD1-CG2 4.09Å; F218-I383 HydrophobicContact CD1-CD1 3.64Å; F218-I383 HydrophobicContact CE1-CD1 3.72Å; L219-I383 HydrophobicContact CD1-CD1 4.46Å; L219-I383 HydrophobicContact CD2-CD1 4.02Å; L219-I383 HydrophobicContact CG-CD1 4.36Å; L251-I383 HydrophobicContact CD1-CG2 3.9Å; L251-I383 HydrophobicContact CD2-CG2 3.8Å; L251-I383 HydrophobicContact CG-CG2 3.88Å; Y252-I383 CarbonylContact O-C 3.59Å; Y252-I383 VanDerWaalsContact O-CA 3.31Å; Y252-I383 WeakPolarHBondContact O-CA 3.46Å; H253-I383 HydrophobicContact CB-CG1 4.32Å; F315-I383 HydrophobicContact CE1-CG2 4.18Å; S317-I383 WeakPolarHBondContact CA-O 3.47Å; S317-I383 WeakPolarHBondContact CB-O 3.26Å; S317-I383 PolarHBondContact N-O 3.14Å; S317-I383 PolarHBondContact O-N 2.6Å; V381-I383 HydrophobicContact CG1-CD1 4.04Å; V381-I383 HydrophobicContact CG1-CG1 4.06Å
384	F	95.6	Very high	89.5	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	150.2	-174.9	59.2	-91.3	0	0	0	112.8	V186 Y252 W311 F316 L382 A386 F390 F392	V186-F384 HydrophobicContact CG2-CE2 4.49Å; Y252-F384 PolarHBondContact N-O 3.11Å; Y252-F384 PolarHBondContact O-N 2.84Å; W311-F384 HydrophobicContact CH2-CD2 4.43Å; W311-F384 AromaticContact CZ2-CD2 3.78Å; W311-F384 HydrophobicContact CZ2-CD2 3.78Å; W311-F384 HydrophobicContact CZ2-CE2 4.4Å; F316-F384 HydrophobicContact CD2-CB 3.34Å; F316-F384 HydrophobicContact CD2-CG 4.17Å; F316-F384 HydrophobicContact CE2-CB 3.46Å; F316-F384 VanDerWaalsContact CE2-CB 3.46Å; F316-F384 HydrophobicContact CE2-CD1 4.01Å; F316-F384 AromaticContact CE2-CG 3.81Å; F316-F384 HydrophobicContact CE2-CG 3.81Å; F316-F384 HydrophobicContact CG-CB 4.12Å; F316-F384 HydrophobicContact CZ-CB 4.32Å; F316-F384 HydrophobicContact CZ-CD1 4.39Å; L382-F384 HydrophobicContact CB-CD1 4.22Å; L382-F384 HydrophobicContact CB-CE1 4.43Å; F384-A386 HydrophobicContact CD2-CB 4.16Å; F384-A386 HydrophobicContact CE2-CB 4.14Å; F384-F390 HydrophobicContact CE2-CD1 4.18Å; F384-F390 AromaticContact CE2-CE1 3.79Å; F384-F390 HydrophobicContact CE2-CE1 3.79Å; F384-F390 HydrophobicContact CE2-CE2 4.37Å; F384-F390 AromaticContact CE2-CZ 3.88Å; F384-F390 HydrophobicContact CE2-CZ 3.88Å; F384-F390 HydrophobicContact CZ-CD1 4.43Å; F384-F390 AromaticContact CZ-CE1 3.66Å; F384-F390 HydrophobicContact CZ-CE1 3.66Å; F384-F390 AromaticContact CZ-CZ 3.81Å; F384-F390 HydrophobicContact CZ-CZ 3.81Å; F384-F392 HydrophobicContact CE1-CZ 4.36Å; F384-F392 HydrophobicContact CZ-CE1 4.14Å; F384-F392 AromaticContact CZ-CZ 3.93Å; F384-F392 HydrophobicContact CZ-CZ 3.93Å
385	E	95.1	Very high	89.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	129.8	174.7	-174.5	-172.3	163.9	0	0	110.2	V244 T245 R246 N249 E250 W311 H313 G314 F315	V244-E385 HydrophobicContact CG1-CG 4.23Å; T245-E385 WeakPolarHBondContact CB-OE2 3.35Å; T245-E385 PolarHBondContact N-OE1 3.3Å; T245-E385 VanDerWaalsContact N-OE1 3.16Å; T245-E385 PolarHBondContact N-OE2 2.89Å; T245-E385 PolarHBondContact OG1-OE1 3.44Å; T245-E385 PolarHBondContact OG1-OE2 2.86Å; R246-E385 WeakPolarHBondContact CB-OE1 3.16Å; R246-E385 PolarHBondContact N-OE1 2.97Å; N249-E385 HydrophobicContact CB-CG 3.7Å; N249-E385 WeakPolarHBondContact CB-OE1 3.36Å; N249-E385 PolarHBondContact ND2-OE1 3.3Å; E250-E385 CarbonylContact O-C 3.55Å; E250-E385 WeakPolarHBondContact O-CA 3.08Å; W311-E385 VanDerWaalsContact CE2-O 3.27Å; W311-E385 VanDerWaalsContact CZ2-O 3.25Å; W311-E385 WeakPolarHBondContact CZ2-O 3.35Å; W311-E385 PolarHBondContact NE1-O 3.44Å; H313-E385 WeakPolarHBondContact CB-O 3.36Å; G314-E385 WeakPolarHBondContact CA-OE2 3.13Å; F315-E385 HydrophobicContact CB-CB 4.19Å; F315-E385 PolarHBondContact N-OE2 3.49Å; F315-E385 WeakPolarHBondContact O-CB 3.44Å; F315-E385 PolarHBondContact O-N 3.44Å
386	A	94.9	Very high	90.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	160.3	175.7	0	0	0	0	0	112	N249 E250 Y252 W311 F384 F390	N249-A386 CarbonylContact C-O 3.2Å; N249-A386 WeakPolarHBondContact CA-O 3.34Å; N249-A386 WeakPolarHBondContact CB-O 3.46Å; E250-A386 PolarHBondContact N-O 2.86Å; E250-A386 PolarHBondContact O-N 3.44Å; E250-A386 VanDerWaalsContact O-O 3.14Å; Y252-A386 HydrophobicContact CD2-CB 3.8Å; Y252-A386 HydrophobicContact CE2-CB 3.86Å; W311-A386 HydrophobicContact CZ2-CB 4.17Å; F384-A386 HydrophobicContact CD2-CB 4.16Å; F384-A386 HydrophobicContact CE2-CB 4.14Å; A386-F390 HydrophobicContact CB-CB 3.88Å; A386-F390 HydrophobicContact CB-CD2 4.28Å; A386-F390 HydrophobicContact CB-CG 4Å
387	P	93.9	Very high	91.3	Very high	23 Å²	23	37 Å²	37	15%	0.149	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	151	168.8	-29.2	37.2	0	0	0	113.6	N249 Y252 D389 F390 L409	N249-P387 VanDerWaalsContact OD1-CA 3.27Å; N249-P387 WeakPolarHBondContact OD1-CA 3.28Å; N249-P387 WeakPolarHBondContact OD1-CD 3.25Å; N249-P387 WeakPolarHBondContact OD1-CG 3.49Å; N249-P387 VanDerWaalsContact OD1-N 3.12Å; Y252-P387 PolarHBondContact OH-O 3.41Å; P387-D389 WeakPolarHBondContact CB-OD1 3.4Å; P387-D389 PolarHBondContact O-N 2.87Å; P387-F390 WeakPolarHBondContact O-CB 3.27Å; P387-F390 PolarHBondContact O-N 2.84Å; P387-L409 HydrophobicContact CB-CD2 3.85Å; P387-L409 HydrophobicContact CG-CD1 4.12Å; P387-L409 HydrophobicContact CG-CD2 4.11Å
388	K	90.9	Very high	92.7	Very high	127 Å²	127	39.5 Å²	39.5	55%	0.552	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.3	-172	-83.7	168.8	-176.8	177.9	0	115.4	G248 E250 Y252 F390	G248-K388 WeakPolarHBondContact O-CD 3.46Å; G248-K388 WeakPolarHBondContact O-CE 3.48Å; G248-K388 VanDerWaalsContact O-CG 3.29Å; G248-K388 WeakPolarHBondContact O-CG 3.5Å; E250-K388 HydrophobicContact CB-CG 4.35Å; E250-K388 HydrophobicContact CG-CD 4.12Å; E250-K388 HydrophobicContact CG-CG 3.48Å; E250-K388 VanDerWaalsContact CG-CG 3.48Å; E250-K388 WeakPolarHBondContact OE1-CE 3.43Å; E250-K388 IonicContact OE1-NZ 3.58Å; Y252-K388 WeakPolarHBondContact OH-CA 3.38Å; Y252-K388 PolarHBondContact OH-O 2.85Å; Y252-K388 VanDerWaalsContact OH-O 3.12Å; K388-F390 VanDerWaalsContact C-N 3.29Å
389	D	90.4	Very high	93.1	Very high	105 Å²	105	45 Å²	45	56%	0.561	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-6.9	175	52.9	-41.9	0	0	0	113.6	P387 N391	P387-D389 WeakPolarHBondContact CB-OD1 3.4Å; P387-D389 PolarHBondContact O-N 2.87Å; D389-N391 PolarHBondContact O-N 3.47Å; D389-N391 VanDerWaalsContact O-N 3.16Å
390	F	92.3	Very high	93.2	Very high	10 Å²	10	45.3 Å²	45.3	4%	0.044	23%	0.227	C	C	.	.			trans	-58.7	118.9	178.2	-176	-92.3	0	0	0	112.6	V186 Y252 F384 A386 P387 K388 F392 S408 L409	V186-F390 HydrophobicContact CG2-CE2 4.32Å; V186-F390 HydrophobicContact CG2-CZ 4.42Å; Y252-F390 HydrophobicContact CD1-CD1 4.14Å; Y252-F390 HydrophobicContact CE1-CB 4.42Å; Y252-F390 HydrophobicContact CE1-CD1 4.23Å; Y252-F390 HydrophobicContact CE2-CB 4.16Å; Y252-F390 HydrophobicContact CG-CD1 4.29Å; F384-F390 HydrophobicContact CE2-CD1 4.18Å; F384-F390 AromaticContact CE2-CE1 3.79Å; F384-F390 HydrophobicContact CE2-CE1 3.79Å; F384-F390 HydrophobicContact CE2-CE2 4.37Å; F384-F390 AromaticContact CE2-CZ 3.88Å; F384-F390 HydrophobicContact CE2-CZ 3.88Å; F384-F390 HydrophobicContact CZ-CD1 4.43Å; F384-F390 AromaticContact CZ-CE1 3.66Å; F384-F390 HydrophobicContact CZ-CE1 3.66Å; F384-F390 AromaticContact CZ-CZ 3.81Å; F384-F390 HydrophobicContact CZ-CZ 3.81Å; A386-F390 HydrophobicContact CB-CB 3.88Å; A386-F390 HydrophobicContact CB-CD2 4.28Å; A386-F390 HydrophobicContact CB-CG 4Å; P387-F390 WeakPolarHBondContact O-CB 3.27Å; P387-F390 PolarHBondContact O-N 2.84Å; K388-F390 VanDerWaalsContact C-N 3.29Å; F390-F392 HydrophobicContact CD1-CD2 4.49Å; F390-F392 HydrophobicContact CD1-CE2 4.4Å; F390-F392 AromaticContact CE1-CD1 4Å; F390-F392 HydrophobicContact CE1-CD1 4Å; F390-F392 HydrophobicContact CE1-CD2 4.15Å; F390-F392 AromaticContact CE1-CE1 3.86Å; F390-F392 HydrophobicContact CE1-CE1 3.86Å; F390-F392 HydrophobicContact CE1-CE2 4.04Å; F390-F392 HydrophobicContact CE1-CG 4.15Å; F390-F392 AromaticContact CE1-CZ 3.89Å; F390-F392 HydrophobicContact CE1-CZ 3.89Å; F390-S408 WeakPolarHBondContact CA-O 3.24Å; F390-S408 VanDerWaalsContact CD2-O 3.31Å; F390-S408 WeakPolarHBondContact CD2-O 3.28Å; F390-L409 HydrophobicContact CB-CD2 3.81Å; F390-L409 HydrophobicContact CD2-CD2 4.17Å
391	N	90.7	Very high	93.1	Very high	105 Å²	105	50.7 Å²	50.7	56%	0.561	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118	124	-172.4	-169.1	3.9	0	0	0	111.3	D389 G407 S408	D389-N391 PolarHBondContact O-N 3.47Å; D389-N391 VanDerWaalsContact O-N 3.16Å; N391-G407 CarbonylContact O-C 3.58Å; N391-G407 WeakPolarHBondContact O-CA 3.35Å; N391-S408 PolarHBondContact N-O 3.09Å; N391-S408 PolarHBondContact O-N 3.36Å
392	F	92.6	Very high	93	Very high	21 Å²	21	51.5 Å²	51.5	9%	0.092	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	122.8	177.4	-78.1	-77.9	0	0	0	111.3	F197 Y252 H253 C254 F384 F390 L394 L406	F197-F392 HydrophobicContact CB-CD1 4.31Å; F197-F392 HydrophobicContact CB-CD2 4.48Å; F197-F392 HydrophobicContact CB-CE1 4.21Å; F197-F392 HydrophobicContact CB-CE2 4.36Å; F197-F392 HydrophobicContact CB-CG 4.44Å; F197-F392 HydrophobicContact CB-CZ 4.23Å; F197-F392 HydrophobicContact CD2-CB 3.45Å; F197-F392 VanDerWaalsContact CD2-CB 3.45Å; F197-F392 HydrophobicContact CD2-CD1 4.05Å; F197-F392 AromaticContact CD2-CD2 3.57Å; F197-F392 HydrophobicContact CD2-CD2 3.57Å; F197-F392 HydrophobicContact CD2-CE2 4.23Å; F197-F392 AromaticContact CD2-CG 3.45Å; F197-F392 HydrophobicContact CD2-CG 3.45Å; F197-F392 VanDerWaalsContact CD2-CG 3.45Å; F197-F392 HydrophobicContact CE2-CB 3.54Å; F197-F392 HydrophobicContact CE2-CD2 4.35Å; F197-F392 HydrophobicContact CE2-CG 4.09Å; F197-F392 HydrophobicContact CG-CB 4.47Å; F197-F392 HydrophobicContact CG-CD1 4.44Å; F197-F392 HydrophobicContact CG-CD2 4.47Å; F197-F392 HydrophobicContact CG-CG 4.25Å; Y252-F392 AromaticContact CD1-CE2 3.84Å; Y252-F392 HydrophobicContact CD1-CE2 3.84Å; Y252-F392 HydrophobicContact CG-CE2 4.44Å; H253-F392 VanDerWaalsContact O-CZ 3.3Å; H253-F392 WeakPolarHBondContact O-CZ 3.47Å; C254-F392 HydrophobicContact CB-CE1 4.16Å; C254-F392 HydrophobicContact CB-CZ 4.49Å; F384-F392 HydrophobicContact CE1-CZ 4.36Å; F384-F392 HydrophobicContact CZ-CE1 4.14Å; F384-F392 AromaticContact CZ-CZ 3.93Å; F384-F392 HydrophobicContact CZ-CZ 3.93Å; F390-F392 HydrophobicContact CD1-CD2 4.49Å; F390-F392 HydrophobicContact CD1-CE2 4.4Å; F390-F392 AromaticContact CE1-CD1 4Å; F390-F392 HydrophobicContact CE1-CD1 4Å; F390-F392 HydrophobicContact CE1-CD2 4.15Å; F390-F392 AromaticContact CE1-CE1 3.86Å; F390-F392 HydrophobicContact CE1-CE1 3.86Å; F390-F392 HydrophobicContact CE1-CE2 4.04Å; F390-F392 HydrophobicContact CE1-CG 4.15Å; F390-F392 AromaticContact CE1-CZ 3.89Å; F390-F392 HydrophobicContact CE1-CZ 3.89Å; F392-L394 HydrophobicContact CB-CB 4.37Å; F392-L394 HydrophobicContact CB-CD1 4.39Å; F392-L394 HydrophobicContact CB-CG 4.31Å; F392-L394 HydrophobicContact CD1-CD1 3.62Å; F392-L394 HydrophobicContact CD1-CG 4.29Å; F392-L394 HydrophobicContact CE1-CD1 4.28Å; F392-L394 HydrophobicContact CG-CD1 4.37Å; F392-L394 PolarHBondContact O-N 3.47Å; F392-L406 CarbonylContact C-O 3.45Å; F392-L406 WeakPolarHBondContact CA-O 3.44Å; F392-L406 WeakPolarHBondContact CD1-O 3.4Å
393	Q	87.3	Confident	92.7	Very high	99 Å²	99	51.5 Å²	51.5	46%	0.463	25%	0.251	S	S	.	.			trans	-86.2	43.4	176.8	-59.1	-173.3	7.8	0	0	110.7	H184 L406 S408	H184-Q393 PolarHBondContact NE2-NE2 3.48Å; H184-Q393 PolarHBondContact NE2-OE1 2.88Å; Q393-L406 PolarHBondContact N-O 2.88Å; Q393-S408 PolarHBondContact NE2-OG 3.34Å
394	L	92.8	Very high	92.6	Very high	16 Å²	16	55.4 Å²	55.4	8%	0.084	27%	0.269	C	S	.	.			trans	-124.6	159.7	-167	-59.2	179.2	0	0	0	112.9	I194 F197 F392 Q398 I400 L406	I194-L394 HydrophobicContact CD1-CD1 4.18Å; I194-L394 HydrophobicContact CD1-CD2 4.38Å; I194-L394 HydrophobicContact CG1-CD1 4.5Å; I194-L394 HydrophobicContact CG1-CD2 4.35Å; F197-L394 HydrophobicContact CB-CD1 4.24Å; F197-L394 HydrophobicContact CD1-CB 3.95Å; F197-L394 HydrophobicContact CD1-CD1 4.17Å; F197-L394 HydrophobicContact CD2-CB 4.33Å; F197-L394 HydrophobicContact CD2-CD1 4.42Å; F197-L394 HydrophobicContact CE1-CB 3.65Å; F197-L394 HydrophobicContact CE2-CB 4.05Å; F197-L394 HydrophobicContact CG-CB 4.28Å; F197-L394 HydrophobicContact CG-CD1 4.01Å; F197-L394 HydrophobicContact CZ-CB 3.7Å; F197-L394 VanDerWaalsContact CZ-O 3.29Å; F197-L394 WeakPolarHBondContact CZ-O 3.26Å; F392-L394 HydrophobicContact CB-CB 4.37Å; F392-L394 HydrophobicContact CB-CD1 4.39Å; F392-L394 HydrophobicContact CB-CG 4.31Å; F392-L394 HydrophobicContact CD1-CD1 3.62Å; F392-L394 HydrophobicContact CD1-CG 4.29Å; F392-L394 HydrophobicContact CE1-CD1 4.28Å; F392-L394 HydrophobicContact CG-CD1 4.37Å; F392-L394 PolarHBondContact O-N 3.47Å; L394-Q398 VanDerWaalsContact CD2-NE2 3.33Å; L394-I400 HydrophobicContact CD2-CD1 3.77Å; L394-L406 HydrophobicContact CD1-CB 4.42Å; L394-L406 HydrophobicContact CD1-CD2 4.01Å; L394-L406 HydrophobicContact CD2-CD2 4.18Å; L394-L406 WeakPolarHBondContact CG-O 3.34Å
395	K	92.5	Very high	92.5	Very high	156 Å²	156	56.4 Å²	56.4	68%	0.678	28%	0.278	S	S	*	.			trans	-131.4	134.9	169.1	-60	-177.9	-179.1	179.8	0	110.2	G397 Q398	K395-G397 PolarHBondContact O-N 2.88Å; K395-Q398 WeakPolarHBondContact O-CB 3.43Å; K395-Q398 VanDerWaalsContact O-CG 3.26Å; K395-Q398 WeakPolarHBondContact O-CG 3.22Å; K395-Q398 PolarHBondContact O-N 3.39Å
396	T	90.3	Very high	92.4	Very high	82 Å²	82	56.4 Å²	56.4	50%	0.503	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	126.9	-176.2	-64	0	0	0	0	110.6	L195 F197	L195-T396 WeakPolarHBondContact O-CG2 3.3Å; F197-T396 WeakPolarHBondContact CE1-OG1 3.3Å
397	G	89.1	Confident	92	Very high	25 Å²	25	56.4 Å²	56.4	26%	0.258	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	84	0.8	-175.4	0	0	0	0	0	115.7	K193 I194 K395	K193-G397 PolarHBondContact NZ-O 2.86Å; I194-G397 WeakPolarHBondContact O-CA 3.39Å; I194-G397 PolarHBondContact O-N 2.69Å; K395-G397 PolarHBondContact O-N 2.88Å
398	Q	93.6	Very high	91.5	Very high	60 Å²	60	56.4 Å²	56.4	28%	0.28	28%	0.278	S	S	.	.			trans	-66.8	153.6	172.7	80.6	-174.8	24.2	0	0	111.9	K193 I194 L394 K395	K193-Q398 CarbonylContact C-O 3.54Å; K193-Q398 VanDerWaalsContact CA-O 3.32Å; K193-Q398 WeakPolarHBondContact CA-O 3.27Å; I194-Q398 HydrophobicContact CB-CG 4.38Å; I194-Q398 HydrophobicContact CG1-CG 3.89Å; I194-Q398 PolarHBondContact N-O 3.42Å; L394-Q398 VanDerWaalsContact CD2-NE2 3.33Å; K395-Q398 WeakPolarHBondContact O-CB 3.43Å; K395-Q398 VanDerWaalsContact O-CG 3.26Å; K395-Q398 WeakPolarHBondContact O-CG 3.22Å; K395-Q398 PolarHBondContact O-N 3.39Å
399	K	94.3	Very high	90.8	Very high	117 Å²	117	55.1 Å²	55.1	51%	0.509	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	146.7	162.2	-86.6	-66.8	-163.4	170.7	0	108.9	G192 K193 D262	G192-K399 WeakPolarHBondContact O-CA 3.27Å; G192-K399 WeakPolarHBondContact O-CD 3.29Å; K193-K399 HydrophobicContact CB-CD 4.43Å; D262-K399 IonicContact OD1-NZ 2.82Å; D262-K399 PolarHBondContact OD1-NZ 2.79Å; D262-K399 IonicContact OD2-NZ 3.61Å; D262-K399 PolarHBondContact OD2-NZ 2.87Å
400	I	94.8	Very high	90.9	Very high	5 Å²	5	52.6 Å²	52.6	3%	0.026	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	153.2	175.7	-163.5	164.9	0	0	0	109.4	D191 G192 I194 I256 L394 E404 L406	D191-I400 WeakPolarHBondContact CA-O 3.41Å; G192-I400 PolarHBondContact N-O 2.89Å; G192-I400 PolarHBondContact O-N 3.33Å; I194-I400 HydrophobicContact CD1-CB 4.28Å; I194-I400 HydrophobicContact CD1-CD1 4Å; I194-I400 HydrophobicContact CD1-CG2 3.77Å; I194-I400 HydrophobicContact CG1-CB 4.37Å; I194-I400 HydrophobicContact CG1-CG2 4.22Å; I256-I400 HydrophobicContact CG2-CG2 4.2Å; L394-I400 HydrophobicContact CD2-CD1 3.77Å; I400-E404 WeakPolarHBondContact CA-OE2 3.28Å; I400-E404 HydrophobicContact CG1-CB 4.04Å; I400-E404 WeakPolarHBondContact CG1-OE2 3.26Å; I400-L406 HydrophobicContact CD1-CD2 3.5Å; I400-L406 VanDerWaalsContact CD1-CD2 3.5Å
401	R	94.4	Very high	90.8	Very high	114 Å²	114	54.8 Å²	54.8	43%	0.43	27%	0.274	S	S	.	.			trans	-114.7	153.9	175.9	-68.1	169	159.2	157.7	-11.4	111.6	E153 S188 S190 D191 G403 E404	E153-R401 IonicContact OE1-NH2 2.61Å; E153-R401 PolarHBondContact OE1-NH2 2.93Å; S188-R401 VanDerWaalsContact CB-O 3.31Å; S188-R401 WeakPolarHBondContact CB-O 3.4Å; S190-R401 CarbonylContact O-C 3.6Å; D191-R401 VanDerWaalsContact OD1-CA 3.28Å; D191-R401 WeakPolarHBondContact OD1-CA 3.23Å; R401-G403 PolarHBondContact O-N 2.77Å; R401-E404 HydrophobicContact CB-CG 4.06Å; R401-E404 WeakPolarHBondContact CD-OE1 3.36Å; R401-E404 PolarHBondContact N-OE2 3.29Å; R401-E404 WeakPolarHBondContact O-CB 3.36Å; R401-E404 PolarHBondContact O-N 2.75Å
402	F	93.5	Very high	90.8	Very high	16 Å²	16	52.1 Å²	52.1	7%	0.07	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	133.2	167.9	164.5	-118.7	0	0	0	110.5	R178 V180 I187 S188 S190 D191 H267	R178-F402 HydrophobicContact CB-CD1 3.59Å; R178-F402 HydrophobicContact CB-CE1 4.11Å; R178-F402 VanDerWaalsContact CD-O 3.31Å; R178-F402 WeakPolarHBondContact CD-O 3.45Å; R178-F402 HydrophobicContact CG-CB 4.44Å; R178-F402 HydrophobicContact CG-CD1 3.96Å; V180-F402 HydrophobicContact CG2-CE1 4.34Å; V180-F402 HydrophobicContact CG2-CE2 4.38Å; V180-F402 HydrophobicContact CG2-CZ 3.78Å; I187-F402 HydrophobicContact CD1-CD2 4.41Å; I187-F402 HydrophobicContact CD1-CE2 3.86Å; S188-F402 WeakPolarHBondContact O-CD2 3.37Å; S190-F402 PolarHBondContact O-N 3.43Å; D191-F402 PolarHBondContact OD1-N 3.34Å; H267-F402 HydrophobicContact CB-CD2 3.76Å; H267-F402 HydrophobicContact CB-CE2 3.26Å; H267-F402 HydrophobicContact CB-CZ 3.82Å; H267-F402 AromaticContact CD2-CD1 3.92Å; H267-F402 AromaticContact CD2-CD2 3.69Å; H267-F402 AromaticContact CD2-CE1 3.94Å; H267-F402 AromaticContact CD2-CE2 3.74Å; H267-F402 AromaticContact CD2-CG 3.82Å; H267-F402 AromaticContact CD2-CZ 3.86Å; H267-F402 AromaticContact CE1-CE1 3.96Å; H267-F402 AromaticContact CG-CD2 3.83Å; H267-F402 AromaticContact CG-CE2 3.42Å; H267-F402 VanDerWaalsContact CG-CE2 3.42Å; H267-F402 AromaticContact CG-CZ 3.54Å; H267-F402 AromaticContact ND1-CZ 3.69Å; H267-F402 AromaticContact NE2-CD1 4Å; H267-F402 AromaticContact NE2-CE1 3.9Å
403	G	92.3	Very high	90.7	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.01	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	91	-19.4	-179.4	0	0	0	0	0	115.6	C181 I187 S188 R401	C181-G403 WeakPolarHBondContact CB-O 3.35Å; C181-G403 PolarHBondContact N-O 2.81Å; I187-G403 WeakPolarHBondContact CG2-O 3.41Å; S188-G403 PolarHBondContact O-N 3.14Å; R401-G403 PolarHBondContact O-N 2.77Å
404	E	93.6	Very high	90.9	Very high	81 Å²	81	51.1 Å²	51.1	38%	0.379	26%	0.255	S	S	.	.	S	Bend	trans	-69.4	149.8	172	-67.1	174.7	173	0	0	110.7	I187 S188 I400 R401	I187-E404 CarbonylContact C-O 3.55Å; I187-E404 VanDerWaalsContact CA-O 3.24Å; I187-E404 WeakPolarHBondContact CA-O 3.29Å; I187-E404 WeakPolarHBondContact CB-O 3.31Å; S188-E404 PolarHBondContact N-O 3.01Å; I400-E404 WeakPolarHBondContact CA-OE2 3.28Å; I400-E404 HydrophobicContact CG1-CB 4.04Å; I400-E404 WeakPolarHBondContact CG1-OE2 3.26Å; R401-E404 HydrophobicContact CB-CG 4.06Å; R401-E404 WeakPolarHBondContact CD-OE1 3.36Å; R401-E404 PolarHBondContact N-OE2 3.29Å; R401-E404 WeakPolarHBondContact O-CB 3.36Å; R401-E404 PolarHBondContact O-N 2.75Å
405	A	93.1	Very high	90.8	Very high	22 Å²	22	53.4 Å²	53.4	18%	0.182	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	141.3	-177.2	0	0	0	0	0	112.9	H184	H184-A405 HydrophobicContact CB-CB 3.74Å; H184-A405 VanDerWaalsContact CD2-CB 3.41Å; H184-A405 WeakPolarHBondContact CD2-CB 3.41Å
406	L	92.4	Very high	90.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-40	165.6	-62.7	-178.3	0	0	0	111.6	V186 I194 I256 L382 F392 Q393 L394 I400	V186-L406 HydrophobicContact CG1-CD1 3.98Å; V186-L406 PolarHBondContact O-N 2.8Å; I194-L406 HydrophobicContact CD1-CD2 4.45Å; I256-L406 HydrophobicContact CD1-CD2 4.34Å; L382-L406 HydrophobicContact CD1-CD1 3.46Å; L382-L406 VanDerWaalsContact CD1-CD1 3.46Å; F392-L406 CarbonylContact C-O 3.45Å; F392-L406 WeakPolarHBondContact CA-O 3.44Å; F392-L406 WeakPolarHBondContact CD1-O 3.4Å; Q393-L406 PolarHBondContact N-O 2.88Å; L394-L406 HydrophobicContact CD1-CB 4.42Å; L394-L406 HydrophobicContact CD1-CD2 4.01Å; L394-L406 HydrophobicContact CD2-CD2 4.18Å; L394-L406 WeakPolarHBondContact CG-O 3.34Å; I400-L406 HydrophobicContact CD1-CD2 3.5Å; I400-L406 VanDerWaalsContact CD1-CD2 3.5Å
407	G	87.9	Confident	90.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.5	168.6	-177.8	0	0	0	0	0	113.5	N391	N391-G407 CarbonylContact O-C 3.58Å; N391-G407 WeakPolarHBondContact O-CA 3.35Å
408	S	82.6	Confident	90.8	Very high	23 Å²	23	44.8 Å²	44.8	16%	0.161	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	160.5	174.5	61.9	0	0	0	0	110	F390 N391 Q393	F390-S408 WeakPolarHBondContact CA-O 3.24Å; F390-S408 VanDerWaalsContact CD2-O 3.31Å; F390-S408 WeakPolarHBondContact CD2-O 3.28Å; N391-S408 PolarHBondContact N-O 3.09Å; N391-S408 PolarHBondContact O-N 3.36Å; Q393-S408 PolarHBondContact NE2-OG 3.34Å
409	L	77.1	Confident	90.6	Very high	99 Å²	99	43.5 Å²	43.5	52%	0.518	21%	0.208	S	C	.	.			trans	-80	0	136.3	-58.2	175.6	0	0	0	103.8	H313 P387 F390	H313-L409 WeakPolarHBondContact NE2-CD1 3.12Å; P387-L409 HydrophobicContact CB-CD2 3.85Å; P387-L409 HydrophobicContact CG-CD1 4.12Å; P387-L409 HydrophobicContact CG-CD2 4.11Å; F390-L409 HydrophobicContact CB-CD2 3.81Å; F390-L409 HydrophobicContact CD2-CD2 4.17Å

Retrieved 409 of 409 residues in 839 ms (Link to these results)

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